USER MOD reduce.3.24.130724 H: found=0, std=0, add=1424, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1422 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 NoAdj-H: A 15 HIS HE2 : A 15 HIS NE2 : A 94 ZNZN :(H bumps) USER MOD NoAdj-H: A 85 HIS HE2 : A 85 HIS NE2 : B 94 ZNZN :(H bumps) USER MOD NoAdj-H: B 15 HIS HE2 : B 15 HIS NE2 : B 94 ZNZN :(H bumps) USER MOD NoAdj-H: B 85 HIS HE2 : B 85 HIS NE2 : A 94 ZNZN :(H bumps) USER MOD Set 1.1: A 74 MET CE :methyl -173:sc= -0.43 (180deg=-0.47) USER MOD Set 1.2: B 78 SER OG : rot -44:sc= -4.65! USER MOD Set 2.1: B 57 MET CE :methyl -178:sc= -1.49 (180deg=-1.53) USER MOD Set 2.2: B 68 CYS SG : rot -52:sc= 0.545 USER MOD Set 3.1: B 17 TYR OH : rot 88:sc= -1.12! USER MOD Set 3.2: B 38 ASN : amide:sc= -0.646 K(o=-1.8,f=-4.7!) USER MOD Set 4.1: A 78 SER OG : rot -48:sc= -4.5! USER MOD Set 4.2: B 74 MET CE :methyl -173:sc= -0.369 (180deg=-0.383) USER MOD Set 5.1: A 57 MET CE :methyl -179:sc= -1.6 (180deg=-1.66) USER MOD Set 5.2: A 68 CYS SG : rot -50:sc= 0.542 USER MOD Set 6.1: A 17 TYR OH : rot 88:sc= -1.08 USER MOD Set 6.2: A 38 ASN : amide:sc= -0.619 K(o=-1.7,f=-4.4!) USER MOD Single : A 0 MET CE :methyl 171:sc= 0 (180deg=-0.0443) USER MOD Single : A 0 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -161:sc= 0.671 (180deg=0.389) USER MOD Single : A 7 MET CE :methyl -166:sc= -0.0695 (180deg=-0.138) USER MOD Single : A 16 GLN :FLIP amide:sc= -1.58 F(o=-2.8!,f=-1.6) USER MOD Single : A 18 SER OG : rot -57:sc= 0.51 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -2.47 X(o=-2.5,f=-2.7) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -158:sc= -0.294 (180deg=-1.17) USER MOD Single : A 29 LYS NZ :NH3+ -149:sc= -0.518 (180deg=-1.1) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 156:sc= -0.0345 (180deg=-0.303) USER MOD Single : A 37 ASN : amide:sc= -0.953 K(o=-0.95,f=-7!) USER MOD Single : A 41 SER OG : rot 139:sc= 0.88 USER MOD Single : A 42 HIS : no HD1:sc= -0.346 X(o=-0.35,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -147:sc= -0.0125 (180deg=-0.337) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -6.87! C(o=-6.9!,f=-9.8!) USER MOD Single : A 79 MET CE :methyl -165:sc= -0.836 (180deg=-0.994) USER MOD Single : A 81 THR OG1 : rot -34:sc= -1.58! USER MOD Single : A 82 THR OG1 : rot -79:sc= -0.762 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 0 MET CE :methyl 170:sc= 0 (180deg=-0.0374) USER MOD Single : B 0 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ -161:sc= 0.72 (180deg=0.328) USER MOD Single : B 7 MET CE :methyl -172:sc= -0.0188 (180deg=-0.0372) USER MOD Single : B 16 GLN :FLIP amide:sc= -1.48 F(o=-2.8!,f=-1.5) USER MOD Single : B 18 SER OG : rot -59:sc= 0.477 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -2.44 X(o=-2.4,f=-2.7) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -154:sc= -0.329 (180deg=-1.23) USER MOD Single : B 29 LYS NZ :NH3+ -156:sc= -0.565 (180deg=-1.23) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 156:sc= -0.0265 (180deg=-0.251) USER MOD Single : B 37 ASN : amide:sc= -0.915 K(o=-0.91,f=-7.2!) USER MOD Single : B 41 SER OG : rot 139:sc= 0.9 USER MOD Single : B 42 HIS : no HD1:sc= -0.274 X(o=-0.27,f=0) USER MOD Single : B 48 LYS NZ :NH3+ -150:sc= -0.0256 (180deg=-0.336) USER MOD Single : B 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 GLN : amide:sc= -6.91! C(o=-6.9!,f=-9.9!) USER MOD Single : B 79 MET CE :methyl -167:sc= -0.8 (180deg=-0.909) USER MOD Single : B 81 THR OG1 : rot -54:sc= -1.85! USER MOD Single : B 82 THR OG1 : rot -84:sc= -0.765 USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 90 HIS : no HD1:sc=-0.00402 X(o=-0.004,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 -11.270 3.739 16.450 1.00 0.00 N ATOM 2 CA MET A 0 -11.103 2.365 15.896 1.00 0.00 C ATOM 3 C MET A 0 -10.660 2.465 14.431 1.00 0.00 C ATOM 4 O MET A 0 -11.292 1.925 13.545 1.00 0.00 O ATOM 5 CB MET A 0 -12.446 1.615 15.995 1.00 0.00 C ATOM 6 CG MET A 0 -12.207 0.103 16.107 1.00 0.00 C ATOM 7 SD MET A 0 -10.989 -0.421 14.874 1.00 0.00 S ATOM 8 CE MET A 0 -10.619 -2.040 15.594 1.00 0.00 C ATOM 0 H1 MET A 0 -11.571 3.678 17.444 1.00 0.00 H new ATOM 0 H2 MET A 0 -10.365 4.249 16.392 1.00 0.00 H new ATOM 0 H3 MET A 0 -11.991 4.249 15.901 1.00 0.00 H new ATOM 0 HA MET A 0 -10.347 1.820 16.461 1.00 0.00 H new ATOM 0 HB2 MET A 0 -13.003 1.967 16.863 1.00 0.00 H new ATOM 0 HB3 MET A 0 -13.055 1.829 15.117 1.00 0.00 H new ATOM 0 HG2 MET A 0 -11.854 -0.145 17.108 1.00 0.00 H new ATOM 0 HG3 MET A 0 -13.144 -0.434 15.957 1.00 0.00 H new ATOM 0 HE1 MET A 0 -10.000 -2.613 14.903 1.00 0.00 H new ATOM 0 HE2 MET A 0 -10.085 -1.906 16.535 1.00 0.00 H new ATOM 0 HE3 MET A 0 -11.549 -2.577 15.778 1.00 0.00 H new ATOM 20 N SER A 1 -9.578 3.161 14.173 1.00 0.00 N ATOM 21 CA SER A 1 -9.082 3.313 12.766 1.00 0.00 C ATOM 22 C SER A 1 -7.818 2.470 12.565 1.00 0.00 C ATOM 23 O SER A 1 -6.718 2.981 12.509 1.00 0.00 O ATOM 24 CB SER A 1 -8.759 4.784 12.507 1.00 0.00 C ATOM 25 OG SER A 1 -9.874 5.581 12.887 1.00 0.00 O ATOM 0 H SER A 1 -9.014 3.633 14.880 1.00 0.00 H new ATOM 0 HA SER A 1 -9.850 2.974 12.071 1.00 0.00 H new ATOM 0 HB2 SER A 1 -7.876 5.080 13.073 1.00 0.00 H new ATOM 0 HB3 SER A 1 -8.529 4.938 11.453 1.00 0.00 H new ATOM 0 HG SER A 1 -9.671 6.526 12.724 1.00 0.00 H new ATOM 31 N GLU A 2 -7.973 1.181 12.448 1.00 0.00 N ATOM 32 CA GLU A 2 -6.782 0.304 12.241 1.00 0.00 C ATOM 33 C GLU A 2 -5.935 0.878 11.101 1.00 0.00 C ATOM 34 O GLU A 2 -4.726 0.745 11.078 1.00 0.00 O ATOM 35 CB GLU A 2 -7.236 -1.116 11.884 1.00 0.00 C ATOM 36 CG GLU A 2 -7.725 -1.827 13.149 1.00 0.00 C ATOM 37 CD GLU A 2 -8.023 -3.294 12.834 1.00 0.00 C ATOM 38 OE1 GLU A 2 -8.624 -3.547 11.803 1.00 0.00 O ATOM 39 OE2 GLU A 2 -7.644 -4.138 13.629 1.00 0.00 O ATOM 0 H GLU A 2 -8.869 0.696 12.486 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.192 0.265 13.156 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.034 -1.079 11.143 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.412 -1.672 11.437 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -6.969 -1.759 13.931 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -8.622 -1.337 13.529 1.00 0.00 H new ATOM 46 N LEU A 3 -6.567 1.516 10.155 1.00 0.00 N ATOM 47 CA LEU A 3 -5.814 2.104 9.007 1.00 0.00 C ATOM 48 C LEU A 3 -4.989 3.311 9.490 1.00 0.00 C ATOM 49 O LEU A 3 -4.055 3.730 8.837 1.00 0.00 O ATOM 50 CB LEU A 3 -6.821 2.559 7.923 1.00 0.00 C ATOM 51 CG LEU A 3 -6.925 1.542 6.766 1.00 0.00 C ATOM 52 CD1 LEU A 3 -5.733 1.707 5.813 1.00 0.00 C ATOM 53 CD2 LEU A 3 -6.979 0.097 7.298 1.00 0.00 C ATOM 0 H LEU A 3 -7.577 1.657 10.126 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.138 1.357 8.590 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -7.803 2.695 8.375 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -6.515 3.528 7.528 1.00 0.00 H new ATOM 0 HG LEU A 3 -7.850 1.738 6.224 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -5.815 0.986 5.000 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -5.732 2.717 5.403 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -4.805 1.536 6.358 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -7.052 -0.597 6.460 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.074 -0.115 7.867 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -7.849 -0.021 7.944 1.00 0.00 H new ATOM 65 N GLU A 4 -5.315 3.863 10.628 1.00 0.00 N ATOM 66 CA GLU A 4 -4.534 5.026 11.135 1.00 0.00 C ATOM 67 C GLU A 4 -3.194 4.513 11.645 1.00 0.00 C ATOM 68 O GLU A 4 -2.193 5.203 11.629 1.00 0.00 O ATOM 69 CB GLU A 4 -5.301 5.703 12.277 1.00 0.00 C ATOM 70 CG GLU A 4 -4.429 6.791 12.928 1.00 0.00 C ATOM 71 CD GLU A 4 -3.498 6.163 13.972 1.00 0.00 C ATOM 72 OE1 GLU A 4 -3.960 5.305 14.706 1.00 0.00 O ATOM 73 OE2 GLU A 4 -2.344 6.552 14.017 1.00 0.00 O ATOM 0 H GLU A 4 -6.084 3.560 11.225 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.378 5.754 10.339 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.222 6.144 11.896 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.588 4.961 13.023 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -3.841 7.302 12.165 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.062 7.543 13.399 1.00 0.00 H new ATOM 80 N LYS A 5 -3.176 3.291 12.085 1.00 0.00 N ATOM 81 CA LYS A 5 -1.914 2.691 12.589 1.00 0.00 C ATOM 82 C LYS A 5 -0.977 2.493 11.400 1.00 0.00 C ATOM 83 O LYS A 5 0.198 2.794 11.454 1.00 0.00 O ATOM 84 CB LYS A 5 -2.192 1.319 13.251 1.00 0.00 C ATOM 85 CG LYS A 5 -3.533 1.313 14.007 1.00 0.00 C ATOM 86 CD LYS A 5 -3.475 2.231 15.243 1.00 0.00 C ATOM 87 CE LYS A 5 -4.879 2.742 15.569 1.00 0.00 C ATOM 88 NZ LYS A 5 -4.815 3.660 16.741 1.00 0.00 N ATOM 0 H LYS A 5 -3.989 2.676 12.118 1.00 0.00 H new ATOM 0 HA LYS A 5 -1.467 3.350 13.333 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -2.201 0.542 12.487 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -1.384 1.078 13.941 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -4.331 1.643 13.342 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.776 0.296 14.316 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -3.069 1.686 16.095 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -2.806 3.071 15.054 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.297 3.263 14.708 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -5.541 1.904 15.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -5.762 3.752 17.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -4.158 3.274 17.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -4.481 4.595 16.432 1.00 0.00 H new ATOM 102 N ALA A 6 -1.499 1.962 10.333 1.00 0.00 N ATOM 103 CA ALA A 6 -0.660 1.707 9.131 1.00 0.00 C ATOM 104 C ALA A 6 -0.148 3.013 8.532 1.00 0.00 C ATOM 105 O ALA A 6 1.037 3.193 8.334 1.00 0.00 O ATOM 106 CB ALA A 6 -1.502 0.973 8.088 1.00 0.00 C ATOM 0 H ALA A 6 -2.478 1.691 10.241 1.00 0.00 H new ATOM 0 HA ALA A 6 0.199 1.104 9.426 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.897 0.781 7.202 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.850 0.027 8.502 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -2.360 1.587 7.815 1.00 0.00 H new ATOM 112 N MET A 7 -1.026 3.914 8.216 1.00 0.00 N ATOM 113 CA MET A 7 -0.580 5.192 7.599 1.00 0.00 C ATOM 114 C MET A 7 0.512 5.842 8.445 1.00 0.00 C ATOM 115 O MET A 7 1.447 6.410 7.923 1.00 0.00 O ATOM 116 CB MET A 7 -1.765 6.164 7.488 1.00 0.00 C ATOM 117 CG MET A 7 -2.790 5.667 6.453 1.00 0.00 C ATOM 118 SD MET A 7 -3.640 7.097 5.726 1.00 0.00 S ATOM 119 CE MET A 7 -5.340 6.482 5.846 1.00 0.00 C ATOM 0 H MET A 7 -2.032 3.824 8.357 1.00 0.00 H new ATOM 0 HA MET A 7 -0.186 4.972 6.607 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.246 6.269 8.460 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.404 7.152 7.202 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.290 5.091 5.675 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.511 5.002 6.928 1.00 0.00 H new ATOM 0 HE1 MET A 7 -5.995 7.100 5.231 1.00 0.00 H new ATOM 0 HE2 MET A 7 -5.379 5.451 5.495 1.00 0.00 H new ATOM 0 HE3 MET A 7 -5.670 6.525 6.884 1.00 0.00 H new ATOM 129 N VAL A 8 0.410 5.780 9.739 1.00 0.00 N ATOM 130 CA VAL A 8 1.460 6.423 10.583 1.00 0.00 C ATOM 131 C VAL A 8 2.707 5.540 10.605 1.00 0.00 C ATOM 132 O VAL A 8 3.823 6.017 10.526 1.00 0.00 O ATOM 133 CB VAL A 8 0.923 6.623 12.005 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.062 7.027 12.945 1.00 0.00 C ATOM 135 CG2 VAL A 8 -0.136 7.729 11.991 1.00 0.00 C ATOM 0 H VAL A 8 -0.344 5.319 10.249 1.00 0.00 H new ATOM 0 HA VAL A 8 1.723 7.395 10.166 1.00 0.00 H new ATOM 0 HB VAL A 8 0.484 5.690 12.357 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.670 7.167 13.952 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.820 6.244 12.956 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.508 7.959 12.597 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.522 7.876 13.000 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.312 8.657 11.635 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.953 7.442 11.328 1.00 0.00 H new ATOM 145 N ALA A 9 2.525 4.259 10.714 1.00 0.00 N ATOM 146 CA ALA A 9 3.693 3.344 10.744 1.00 0.00 C ATOM 147 C ALA A 9 4.489 3.470 9.439 1.00 0.00 C ATOM 148 O ALA A 9 5.701 3.371 9.430 1.00 0.00 O ATOM 149 CB ALA A 9 3.202 1.904 10.910 1.00 0.00 C ATOM 0 H ALA A 9 1.615 3.804 10.784 1.00 0.00 H new ATOM 0 HA ALA A 9 4.339 3.610 11.581 1.00 0.00 H new ATOM 0 HB1 ALA A 9 4.057 1.228 10.933 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.644 1.815 11.842 1.00 0.00 H new ATOM 0 HB3 ALA A 9 2.554 1.642 10.073 1.00 0.00 H new ATOM 155 N LEU A 10 3.822 3.672 8.330 1.00 0.00 N ATOM 156 CA LEU A 10 4.561 3.778 7.036 1.00 0.00 C ATOM 157 C LEU A 10 5.169 5.179 6.869 1.00 0.00 C ATOM 158 O LEU A 10 6.310 5.307 6.513 1.00 0.00 O ATOM 159 CB LEU A 10 3.602 3.463 5.869 1.00 0.00 C ATOM 160 CG LEU A 10 3.635 1.961 5.555 1.00 0.00 C ATOM 161 CD1 LEU A 10 3.150 1.170 6.772 1.00 0.00 C ATOM 162 CD2 LEU A 10 2.722 1.668 4.365 1.00 0.00 C ATOM 0 H LEU A 10 2.809 3.767 8.265 1.00 0.00 H new ATOM 0 HA LEU A 10 5.378 3.056 7.035 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.588 3.767 6.128 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.890 4.034 4.986 1.00 0.00 H new ATOM 0 HG LEU A 10 4.656 1.666 5.314 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.174 0.104 6.546 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.800 1.376 7.622 1.00 0.00 H new ATOM 0 HD13 LEU A 10 2.130 1.466 7.015 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.746 0.601 4.142 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.702 1.966 4.607 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.067 2.228 3.496 1.00 0.00 H new ATOM 174 N ILE A 11 4.422 6.222 7.100 1.00 0.00 N ATOM 175 CA ILE A 11 4.975 7.602 6.917 1.00 0.00 C ATOM 176 C ILE A 11 6.369 7.696 7.549 1.00 0.00 C ATOM 177 O ILE A 11 7.226 8.412 7.071 1.00 0.00 O ATOM 178 CB ILE A 11 4.025 8.618 7.578 1.00 0.00 C ATOM 179 CG1 ILE A 11 2.781 8.788 6.699 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.717 9.980 7.732 1.00 0.00 C ATOM 181 CD1 ILE A 11 1.665 9.470 7.498 1.00 0.00 C ATOM 0 H ILE A 11 3.450 6.183 7.408 1.00 0.00 H new ATOM 0 HA ILE A 11 5.060 7.823 5.853 1.00 0.00 H new ATOM 0 HB ILE A 11 3.745 8.248 8.564 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.026 9.383 5.819 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.442 7.816 6.342 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.031 10.686 8.201 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.605 9.869 8.355 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.007 10.354 6.750 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.785 9.587 6.866 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.412 8.858 8.364 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.004 10.450 7.833 1.00 0.00 H new ATOM 193 N ASP A 12 6.607 6.983 8.612 1.00 0.00 N ATOM 194 CA ASP A 12 7.955 7.049 9.250 1.00 0.00 C ATOM 195 C ASP A 12 8.949 6.204 8.446 1.00 0.00 C ATOM 196 O ASP A 12 10.002 6.665 8.062 1.00 0.00 O ATOM 197 CB ASP A 12 7.879 6.513 10.684 1.00 0.00 C ATOM 198 CG ASP A 12 6.648 7.089 11.384 1.00 0.00 C ATOM 199 OD1 ASP A 12 6.086 8.040 10.867 1.00 0.00 O ATOM 200 OD2 ASP A 12 6.287 6.570 12.428 1.00 0.00 O ATOM 0 H ASP A 12 5.936 6.362 9.065 1.00 0.00 H new ATOM 0 HA ASP A 12 8.289 8.087 9.268 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.827 5.424 10.673 1.00 0.00 H new ATOM 0 HB3 ASP A 12 8.781 6.784 11.232 1.00 0.00 H new ATOM 205 N VAL A 13 8.617 4.972 8.186 1.00 0.00 N ATOM 206 CA VAL A 13 9.537 4.094 7.405 1.00 0.00 C ATOM 207 C VAL A 13 9.512 4.508 5.930 1.00 0.00 C ATOM 208 O VAL A 13 10.448 4.278 5.190 1.00 0.00 O ATOM 209 CB VAL A 13 9.089 2.633 7.558 1.00 0.00 C ATOM 210 CG1 VAL A 13 9.986 1.714 6.725 1.00 0.00 C ATOM 211 CG2 VAL A 13 9.185 2.230 9.033 1.00 0.00 C ATOM 0 H VAL A 13 7.746 4.531 8.481 1.00 0.00 H new ATOM 0 HA VAL A 13 10.556 4.196 7.779 1.00 0.00 H new ATOM 0 HB VAL A 13 8.061 2.537 7.209 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.658 0.681 6.842 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.922 1.998 5.675 1.00 0.00 H new ATOM 0 HG13 VAL A 13 11.018 1.808 7.064 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.868 1.193 9.148 1.00 0.00 H new ATOM 0 HG22 VAL A 13 10.216 2.334 9.372 1.00 0.00 H new ATOM 0 HG23 VAL A 13 8.540 2.875 9.629 1.00 0.00 H new ATOM 221 N PHE A 14 8.434 5.100 5.499 1.00 0.00 N ATOM 222 CA PHE A 14 8.331 5.510 4.067 1.00 0.00 C ATOM 223 C PHE A 14 9.381 6.586 3.735 1.00 0.00 C ATOM 224 O PHE A 14 10.191 6.414 2.847 1.00 0.00 O ATOM 225 CB PHE A 14 6.913 6.045 3.804 1.00 0.00 C ATOM 226 CG PHE A 14 6.858 6.907 2.553 1.00 0.00 C ATOM 227 CD1 PHE A 14 7.645 6.599 1.434 1.00 0.00 C ATOM 228 CD2 PHE A 14 6.009 8.019 2.524 1.00 0.00 C ATOM 229 CE1 PHE A 14 7.579 7.406 0.291 1.00 0.00 C ATOM 230 CE2 PHE A 14 5.945 8.825 1.382 1.00 0.00 C ATOM 231 CZ PHE A 14 6.730 8.518 0.266 1.00 0.00 C ATOM 0 H PHE A 14 7.620 5.318 6.073 1.00 0.00 H new ATOM 0 HA PHE A 14 8.522 4.648 3.428 1.00 0.00 H new ATOM 0 HB2 PHE A 14 6.222 5.208 3.700 1.00 0.00 H new ATOM 0 HB3 PHE A 14 6.580 6.628 4.662 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.301 5.741 1.453 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.402 8.256 3.385 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.184 7.170 -0.572 1.00 0.00 H new ATOM 0 HE2 PHE A 14 5.290 9.683 1.362 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.681 9.140 -0.616 1.00 0.00 H new ATOM 241 N HIS A 15 9.363 7.703 4.417 1.00 0.00 N ATOM 242 CA HIS A 15 10.350 8.785 4.105 1.00 0.00 C ATOM 243 C HIS A 15 11.716 8.499 4.755 1.00 0.00 C ATOM 244 O HIS A 15 12.734 8.955 4.274 1.00 0.00 O ATOM 245 CB HIS A 15 9.787 10.146 4.587 1.00 0.00 C ATOM 246 CG HIS A 15 9.194 10.903 3.418 1.00 0.00 C ATOM 247 ND1 HIS A 15 8.057 10.470 2.757 1.00 0.00 N ATOM 248 CD2 HIS A 15 9.588 12.049 2.771 1.00 0.00 C ATOM 249 CE1 HIS A 15 7.809 11.341 1.761 1.00 0.00 C ATOM 250 NE2 HIS A 15 8.711 12.324 1.725 1.00 0.00 N ATOM 0 H HIS A 15 8.712 7.914 5.173 1.00 0.00 H new ATOM 0 HA HIS A 15 10.505 8.819 3.027 1.00 0.00 H new ATOM 0 HB2 HIS A 15 9.026 9.984 5.350 1.00 0.00 H new ATOM 0 HB3 HIS A 15 10.580 10.735 5.048 1.00 0.00 H new ATOM 0 HD1 HIS A 15 7.507 9.641 2.984 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.448 12.647 3.034 1.00 0.00 H new ATOM 0 HE1 HIS A 15 6.980 11.255 1.074 1.00 0.00 H new ATOM 258 N GLN A 16 11.765 7.766 5.835 1.00 0.00 N ATOM 259 CA GLN A 16 13.092 7.497 6.467 1.00 0.00 C ATOM 260 C GLN A 16 13.990 6.782 5.457 1.00 0.00 C ATOM 261 O GLN A 16 15.162 7.081 5.315 1.00 0.00 O ATOM 262 CB GLN A 16 12.903 6.613 7.708 1.00 0.00 C ATOM 263 CG GLN A 16 12.463 7.477 8.895 1.00 0.00 C ATOM 264 CD GLN A 16 11.886 6.584 9.996 1.00 0.00 C ATOM 265 OE1 GLN A 16 11.948 5.287 9.869 1.00 0.00 O flip ATOM 266 NE2 GLN A 16 11.374 7.072 10.984 1.00 0.00 N flip ATOM 0 H GLN A 16 10.960 7.348 6.301 1.00 0.00 H new ATOM 0 HA GLN A 16 13.554 8.438 6.767 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.156 5.844 7.509 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.834 6.099 7.945 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.311 8.043 9.280 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.716 8.202 8.572 1.00 0.00 H new ATOM 0 HE21 GLN A 16 11.325 8.086 11.085 1.00 0.00 H new ATOM 0 HE22 GLN A 16 10.994 6.468 11.712 1.00 0.00 H new ATOM 275 N TYR A 17 13.440 5.851 4.736 1.00 0.00 N ATOM 276 CA TYR A 17 14.248 5.123 3.722 1.00 0.00 C ATOM 277 C TYR A 17 14.405 6.009 2.487 1.00 0.00 C ATOM 278 O TYR A 17 15.479 6.120 1.928 1.00 0.00 O ATOM 279 CB TYR A 17 13.549 3.799 3.366 1.00 0.00 C ATOM 280 CG TYR A 17 14.029 2.702 4.296 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.492 2.592 5.585 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.017 1.807 3.872 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.942 1.585 6.447 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.469 0.801 4.734 1.00 0.00 C ATOM 285 CZ TYR A 17 14.932 0.689 6.022 1.00 0.00 C ATOM 286 OH TYR A 17 15.378 -0.302 6.872 1.00 0.00 O ATOM 0 H TYR A 17 12.464 5.561 4.804 1.00 0.00 H new ATOM 0 HA TYR A 17 15.237 4.892 4.117 1.00 0.00 H new ATOM 0 HB2 TYR A 17 12.468 3.913 3.450 1.00 0.00 H new ATOM 0 HB3 TYR A 17 13.762 3.531 2.331 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.731 3.284 5.914 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.432 1.892 2.878 1.00 0.00 H new ATOM 0 HE1 TYR A 17 13.526 1.499 7.440 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.232 0.111 4.405 1.00 0.00 H new ATOM 0 HH TYR A 17 14.805 -1.092 6.782 1.00 0.00 H new ATOM 296 N SER A 18 13.361 6.661 2.069 1.00 0.00 N ATOM 297 CA SER A 18 13.488 7.554 0.891 1.00 0.00 C ATOM 298 C SER A 18 14.543 8.615 1.219 1.00 0.00 C ATOM 299 O SER A 18 15.355 8.981 0.394 1.00 0.00 O ATOM 300 CB SER A 18 12.139 8.229 0.610 1.00 0.00 C ATOM 301 OG SER A 18 12.098 9.498 1.252 1.00 0.00 O ATOM 0 H SER A 18 12.432 6.615 2.488 1.00 0.00 H new ATOM 0 HA SER A 18 13.783 6.986 0.009 1.00 0.00 H new ATOM 0 HB2 SER A 18 11.997 8.349 -0.464 1.00 0.00 H new ATOM 0 HB3 SER A 18 11.324 7.601 0.971 1.00 0.00 H new ATOM 0 HG SER A 18 12.258 9.384 2.212 1.00 0.00 H new ATOM 307 N GLY A 19 14.532 9.104 2.433 1.00 0.00 N ATOM 308 CA GLY A 19 15.519 10.143 2.841 1.00 0.00 C ATOM 309 C GLY A 19 16.845 9.491 3.247 1.00 0.00 C ATOM 310 O GLY A 19 17.754 10.157 3.701 1.00 0.00 O ATOM 0 H GLY A 19 13.876 8.825 3.162 1.00 0.00 H new ATOM 0 HA2 GLY A 19 15.685 10.838 2.018 1.00 0.00 H new ATOM 0 HA3 GLY A 19 15.122 10.724 3.674 1.00 0.00 H new ATOM 314 N ARG A 20 16.982 8.203 3.073 1.00 0.00 N ATOM 315 CA ARG A 20 18.269 7.543 3.435 1.00 0.00 C ATOM 316 C ARG A 20 19.350 8.027 2.475 1.00 0.00 C ATOM 317 O ARG A 20 20.415 8.447 2.879 1.00 0.00 O ATOM 318 CB ARG A 20 18.122 6.021 3.303 1.00 0.00 C ATOM 319 CG ARG A 20 19.455 5.319 3.606 1.00 0.00 C ATOM 320 CD ARG A 20 19.306 3.815 3.361 1.00 0.00 C ATOM 321 NE ARG A 20 20.468 3.102 3.964 1.00 0.00 N ATOM 322 CZ ARG A 20 20.828 1.930 3.511 1.00 0.00 C ATOM 323 NH1 ARG A 20 20.168 1.373 2.533 1.00 0.00 N ATOM 324 NH2 ARG A 20 21.850 1.314 4.040 1.00 0.00 N ATOM 0 H ARG A 20 16.263 7.584 2.698 1.00 0.00 H new ATOM 0 HA ARG A 20 18.537 7.791 4.462 1.00 0.00 H new ATOM 0 HB2 ARG A 20 17.353 5.664 3.988 1.00 0.00 H new ATOM 0 HB3 ARG A 20 17.793 5.768 2.295 1.00 0.00 H new ATOM 0 HG2 ARG A 20 20.244 5.725 2.973 1.00 0.00 H new ATOM 0 HG3 ARG A 20 19.749 5.503 4.640 1.00 0.00 H new ATOM 0 HD2 ARG A 20 18.375 3.454 3.799 1.00 0.00 H new ATOM 0 HD3 ARG A 20 19.255 3.612 2.291 1.00 0.00 H new ATOM 0 HE ARG A 20 20.984 3.530 4.733 1.00 0.00 H new ATOM 0 HH11 ARG A 20 19.368 1.852 2.119 1.00 0.00 H new ATOM 0 HH12 ARG A 20 20.452 0.458 2.182 1.00 0.00 H new ATOM 0 HH21 ARG A 20 22.366 1.747 4.806 1.00 0.00 H new ATOM 0 HH22 ARG A 20 22.132 0.399 3.688 1.00 0.00 H new ATOM 338 N GLU A 21 19.083 7.952 1.203 1.00 0.00 N ATOM 339 CA GLU A 21 20.101 8.392 0.205 1.00 0.00 C ATOM 340 C GLU A 21 19.423 8.779 -1.110 1.00 0.00 C ATOM 341 O GLU A 21 18.305 8.394 -1.385 1.00 0.00 O ATOM 342 CB GLU A 21 21.070 7.237 -0.054 1.00 0.00 C ATOM 343 CG GLU A 21 20.280 5.995 -0.474 1.00 0.00 C ATOM 344 CD GLU A 21 21.242 4.834 -0.733 1.00 0.00 C ATOM 345 OE1 GLU A 21 21.827 4.350 0.223 1.00 0.00 O ATOM 346 OE2 GLU A 21 21.377 4.449 -1.883 1.00 0.00 O ATOM 0 H GLU A 21 18.208 7.607 0.810 1.00 0.00 H new ATOM 0 HA GLU A 21 20.636 9.258 0.596 1.00 0.00 H new ATOM 0 HB2 GLU A 21 21.780 7.511 -0.835 1.00 0.00 H new ATOM 0 HB3 GLU A 21 21.650 7.026 0.844 1.00 0.00 H new ATOM 0 HG2 GLU A 21 19.569 5.723 0.306 1.00 0.00 H new ATOM 0 HG3 GLU A 21 19.701 6.207 -1.373 1.00 0.00 H new ATOM 353 N GLY A 22 20.110 9.525 -1.932 1.00 0.00 N ATOM 354 CA GLY A 22 19.532 9.930 -3.243 1.00 0.00 C ATOM 355 C GLY A 22 18.327 10.852 -3.037 1.00 0.00 C ATOM 356 O GLY A 22 18.084 11.348 -1.956 1.00 0.00 O ATOM 0 H GLY A 22 21.052 9.873 -1.750 1.00 0.00 H new ATOM 0 HA2 GLY A 22 20.289 10.439 -3.839 1.00 0.00 H new ATOM 0 HA3 GLY A 22 19.229 9.045 -3.802 1.00 0.00 H new ATOM 360 N ASP A 23 17.577 11.089 -4.081 1.00 0.00 N ATOM 361 CA ASP A 23 16.388 11.984 -3.972 1.00 0.00 C ATOM 362 C ASP A 23 15.374 11.399 -2.985 1.00 0.00 C ATOM 363 O ASP A 23 14.979 10.256 -3.088 1.00 0.00 O ATOM 364 CB ASP A 23 15.737 12.127 -5.349 1.00 0.00 C ATOM 365 CG ASP A 23 16.819 12.373 -6.402 1.00 0.00 C ATOM 366 OD1 ASP A 23 17.152 13.526 -6.621 1.00 0.00 O ATOM 367 OD2 ASP A 23 17.294 11.405 -6.972 1.00 0.00 O ATOM 0 H ASP A 23 17.738 10.699 -5.009 1.00 0.00 H new ATOM 0 HA ASP A 23 16.708 12.961 -3.611 1.00 0.00 H new ATOM 0 HB2 ASP A 23 15.176 11.225 -5.593 1.00 0.00 H new ATOM 0 HB3 ASP A 23 15.026 12.953 -5.343 1.00 0.00 H new ATOM 372 N LYS A 24 14.951 12.184 -2.031 1.00 0.00 N ATOM 373 CA LYS A 24 13.961 11.689 -1.032 1.00 0.00 C ATOM 374 C LYS A 24 12.573 11.612 -1.670 1.00 0.00 C ATOM 375 O LYS A 24 12.361 12.090 -2.766 1.00 0.00 O ATOM 376 CB LYS A 24 13.919 12.649 0.160 1.00 0.00 C ATOM 377 CG LYS A 24 13.506 14.045 -0.317 1.00 0.00 C ATOM 378 CD LYS A 24 13.807 15.070 0.778 1.00 0.00 C ATOM 379 CE LYS A 24 13.103 16.390 0.456 1.00 0.00 C ATOM 380 NZ LYS A 24 13.432 17.397 1.504 1.00 0.00 N ATOM 0 H LYS A 24 15.250 13.150 -1.900 1.00 0.00 H new ATOM 0 HA LYS A 24 14.257 10.696 -0.695 1.00 0.00 H new ATOM 0 HB2 LYS A 24 13.214 12.286 0.907 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.897 12.692 0.639 1.00 0.00 H new ATOM 0 HG2 LYS A 24 14.044 14.303 -1.229 1.00 0.00 H new ATOM 0 HG3 LYS A 24 12.443 14.058 -0.560 1.00 0.00 H new ATOM 0 HD2 LYS A 24 13.471 14.694 1.744 1.00 0.00 H new ATOM 0 HD3 LYS A 24 14.883 15.230 0.855 1.00 0.00 H new ATOM 0 HE2 LYS A 24 13.417 16.752 -0.523 1.00 0.00 H new ATOM 0 HE3 LYS A 24 12.025 16.237 0.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 12.954 18.294 1.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 13.112 17.051 2.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 14.460 17.550 1.528 1.00 0.00 H new ATOM 394 N HIS A 25 11.629 11.018 -0.976 1.00 0.00 N ATOM 395 CA HIS A 25 10.229 10.902 -1.501 1.00 0.00 C ATOM 396 C HIS A 25 10.112 9.710 -2.442 1.00 0.00 C ATOM 397 O HIS A 25 9.030 9.358 -2.868 1.00 0.00 O ATOM 398 CB HIS A 25 9.828 12.204 -2.228 1.00 0.00 C ATOM 399 CG HIS A 25 8.343 12.439 -2.123 1.00 0.00 C ATOM 400 ND1 HIS A 25 7.808 13.432 -1.313 1.00 0.00 N ATOM 401 CD2 HIS A 25 7.272 11.840 -2.740 1.00 0.00 C ATOM 402 CE1 HIS A 25 6.471 13.405 -1.466 1.00 0.00 C ATOM 403 NE2 HIS A 25 6.096 12.454 -2.324 1.00 0.00 N ATOM 0 H HIS A 25 11.772 10.603 -0.055 1.00 0.00 H new ATOM 0 HA HIS A 25 9.551 10.745 -0.662 1.00 0.00 H new ATOM 0 HB2 HIS A 25 10.366 13.048 -1.796 1.00 0.00 H new ATOM 0 HB3 HIS A 25 10.118 12.145 -3.277 1.00 0.00 H new ATOM 0 HD2 HIS A 25 7.334 11.020 -3.440 1.00 0.00 H new ATOM 0 HE1 HIS A 25 5.788 14.069 -0.958 1.00 0.00 H new ATOM 0 HE2 HIS A 25 5.145 12.225 -2.614 1.00 0.00 H new ATOM 411 N LYS A 26 11.205 9.076 -2.764 1.00 0.00 N ATOM 412 CA LYS A 26 11.152 7.896 -3.669 1.00 0.00 C ATOM 413 C LYS A 26 12.027 6.801 -3.089 1.00 0.00 C ATOM 414 O LYS A 26 13.048 7.057 -2.483 1.00 0.00 O ATOM 415 CB LYS A 26 11.676 8.288 -5.052 1.00 0.00 C ATOM 416 CG LYS A 26 10.980 9.579 -5.528 1.00 0.00 C ATOM 417 CD LYS A 26 10.932 9.627 -7.069 1.00 0.00 C ATOM 418 CE LYS A 26 9.686 8.892 -7.574 1.00 0.00 C ATOM 419 NZ LYS A 26 9.805 8.655 -9.041 1.00 0.00 N ATOM 0 H LYS A 26 12.138 9.327 -2.437 1.00 0.00 H new ATOM 0 HA LYS A 26 10.125 7.544 -3.762 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.755 8.439 -5.013 1.00 0.00 H new ATOM 0 HB3 LYS A 26 11.492 7.482 -5.762 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.968 9.624 -5.125 1.00 0.00 H new ATOM 0 HG3 LYS A 26 11.514 10.449 -5.147 1.00 0.00 H new ATOM 0 HD2 LYS A 26 10.917 10.662 -7.409 1.00 0.00 H new ATOM 0 HD3 LYS A 26 11.829 9.168 -7.484 1.00 0.00 H new ATOM 0 HE2 LYS A 26 9.574 7.943 -7.050 1.00 0.00 H new ATOM 0 HE3 LYS A 26 8.793 9.480 -7.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 8.959 8.156 -9.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 9.892 9.567 -9.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 10.648 8.077 -9.232 1.00 0.00 H new ATOM 433 N LEU A 27 11.644 5.576 -3.287 1.00 0.00 N ATOM 434 CA LEU A 27 12.466 4.440 -2.765 1.00 0.00 C ATOM 435 C LEU A 27 13.418 3.971 -3.872 1.00 0.00 C ATOM 436 O LEU A 27 13.039 3.787 -5.011 1.00 0.00 O ATOM 437 CB LEU A 27 11.556 3.263 -2.336 1.00 0.00 C ATOM 438 CG LEU A 27 11.142 3.377 -0.838 1.00 0.00 C ATOM 439 CD1 LEU A 27 9.815 4.132 -0.702 1.00 0.00 C ATOM 440 CD2 LEU A 27 10.994 1.973 -0.241 1.00 0.00 C ATOM 0 H LEU A 27 10.798 5.305 -3.787 1.00 0.00 H new ATOM 0 HA LEU A 27 13.031 4.776 -1.896 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.663 3.246 -2.961 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.078 2.320 -2.500 1.00 0.00 H new ATOM 0 HG LEU A 27 11.915 3.928 -0.302 1.00 0.00 H new ATOM 0 HD11 LEU A 27 9.542 4.202 0.351 1.00 0.00 H new ATOM 0 HD12 LEU A 27 9.923 5.135 -1.116 1.00 0.00 H new ATOM 0 HD13 LEU A 27 9.035 3.597 -1.244 1.00 0.00 H new ATOM 0 HD21 LEU A 27 10.704 2.052 0.807 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.228 1.424 -0.789 1.00 0.00 H new ATOM 0 HD23 LEU A 27 11.944 1.444 -0.316 1.00 0.00 H new ATOM 452 N LYS A 28 14.648 3.758 -3.507 1.00 0.00 N ATOM 453 CA LYS A 28 15.674 3.271 -4.479 1.00 0.00 C ATOM 454 C LYS A 28 16.030 1.826 -4.136 1.00 0.00 C ATOM 455 O LYS A 28 15.807 1.381 -3.033 1.00 0.00 O ATOM 456 CB LYS A 28 16.910 4.162 -4.385 1.00 0.00 C ATOM 457 CG LYS A 28 16.467 5.634 -4.441 1.00 0.00 C ATOM 458 CD LYS A 28 17.638 6.516 -4.877 1.00 0.00 C ATOM 459 CE LYS A 28 17.160 7.962 -5.069 1.00 0.00 C ATOM 460 NZ LYS A 28 15.888 7.979 -5.847 1.00 0.00 N ATOM 0 H LYS A 28 14.997 3.902 -2.559 1.00 0.00 H new ATOM 0 HA LYS A 28 15.287 3.311 -5.497 1.00 0.00 H new ATOM 0 HB2 LYS A 28 17.447 3.965 -3.457 1.00 0.00 H new ATOM 0 HB3 LYS A 28 17.596 3.943 -5.203 1.00 0.00 H new ATOM 0 HG2 LYS A 28 15.637 5.746 -5.138 1.00 0.00 H new ATOM 0 HG3 LYS A 28 16.106 5.951 -3.463 1.00 0.00 H new ATOM 0 HD2 LYS A 28 18.429 6.482 -4.128 1.00 0.00 H new ATOM 0 HD3 LYS A 28 18.063 6.138 -5.807 1.00 0.00 H new ATOM 0 HE2 LYS A 28 17.009 8.436 -4.099 1.00 0.00 H new ATOM 0 HE3 LYS A 28 17.923 8.540 -5.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 15.764 8.912 -6.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 15.923 7.248 -6.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 15.089 7.789 -5.209 1.00 0.00 H new ATOM 474 N LYS A 29 16.567 1.081 -5.067 1.00 0.00 N ATOM 475 CA LYS A 29 16.918 -0.341 -4.765 1.00 0.00 C ATOM 476 C LYS A 29 17.642 -0.410 -3.419 1.00 0.00 C ATOM 477 O LYS A 29 17.317 -1.216 -2.570 1.00 0.00 O ATOM 478 CB LYS A 29 17.825 -0.900 -5.866 1.00 0.00 C ATOM 479 CG LYS A 29 17.029 -1.053 -7.171 1.00 0.00 C ATOM 480 CD LYS A 29 17.751 -2.030 -8.104 1.00 0.00 C ATOM 481 CE LYS A 29 19.165 -1.519 -8.391 1.00 0.00 C ATOM 482 NZ LYS A 29 19.116 -0.060 -8.689 1.00 0.00 N ATOM 0 H LYS A 29 16.777 1.391 -6.016 1.00 0.00 H new ATOM 0 HA LYS A 29 16.005 -0.935 -4.720 1.00 0.00 H new ATOM 0 HB2 LYS A 29 18.674 -0.234 -6.023 1.00 0.00 H new ATOM 0 HB3 LYS A 29 18.229 -1.865 -5.561 1.00 0.00 H new ATOM 0 HG2 LYS A 29 16.024 -1.416 -6.955 1.00 0.00 H new ATOM 0 HG3 LYS A 29 16.920 -0.084 -7.658 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.797 -3.018 -7.647 1.00 0.00 H new ATOM 0 HD3 LYS A 29 17.196 -2.136 -9.036 1.00 0.00 H new ATOM 0 HE2 LYS A 29 19.811 -1.704 -7.533 1.00 0.00 H new ATOM 0 HE3 LYS A 29 19.594 -2.059 -9.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 19.875 0.184 -9.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 18.195 0.178 -9.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 19.243 0.479 -7.808 1.00 0.00 H new ATOM 496 N SER A 30 18.613 0.438 -3.210 1.00 0.00 N ATOM 497 CA SER A 30 19.336 0.420 -1.910 1.00 0.00 C ATOM 498 C SER A 30 18.309 0.478 -0.778 1.00 0.00 C ATOM 499 O SER A 30 18.600 0.166 0.352 1.00 0.00 O ATOM 500 CB SER A 30 20.276 1.627 -1.820 1.00 0.00 C ATOM 501 OG SER A 30 21.451 1.362 -2.575 1.00 0.00 O ATOM 0 H SER A 30 18.934 1.137 -3.880 1.00 0.00 H new ATOM 0 HA SER A 30 19.928 -0.492 -1.828 1.00 0.00 H new ATOM 0 HB2 SER A 30 19.779 2.519 -2.200 1.00 0.00 H new ATOM 0 HB3 SER A 30 20.535 1.825 -0.780 1.00 0.00 H new ATOM 0 HG SER A 30 22.055 2.132 -2.522 1.00 0.00 H new ATOM 507 N GLU A 31 17.101 0.858 -1.089 1.00 0.00 N ATOM 508 CA GLU A 31 16.031 0.921 -0.049 1.00 0.00 C ATOM 509 C GLU A 31 15.171 -0.329 -0.159 1.00 0.00 C ATOM 510 O GLU A 31 14.840 -0.952 0.823 1.00 0.00 O ATOM 511 CB GLU A 31 15.161 2.159 -0.275 1.00 0.00 C ATOM 512 CG GLU A 31 16.054 3.395 -0.401 1.00 0.00 C ATOM 513 CD GLU A 31 15.197 4.659 -0.321 1.00 0.00 C ATOM 514 OE1 GLU A 31 14.129 4.592 0.265 1.00 0.00 O ATOM 515 OE2 GLU A 31 15.625 5.674 -0.847 1.00 0.00 O ATOM 0 H GLU A 31 16.805 1.130 -2.026 1.00 0.00 H new ATOM 0 HA GLU A 31 16.482 0.980 0.941 1.00 0.00 H new ATOM 0 HB2 GLU A 31 14.563 2.036 -1.178 1.00 0.00 H new ATOM 0 HB3 GLU A 31 14.465 2.283 0.554 1.00 0.00 H new ATOM 0 HG2 GLU A 31 16.800 3.399 0.393 1.00 0.00 H new ATOM 0 HG3 GLU A 31 16.595 3.370 -1.347 1.00 0.00 H new ATOM 522 N LEU A 32 14.809 -0.705 -1.345 1.00 0.00 N ATOM 523 CA LEU A 32 13.967 -1.917 -1.495 1.00 0.00 C ATOM 524 C LEU A 32 14.733 -3.132 -0.964 1.00 0.00 C ATOM 525 O LEU A 32 14.254 -3.845 -0.110 1.00 0.00 O ATOM 526 CB LEU A 32 13.583 -2.098 -2.989 1.00 0.00 C ATOM 527 CG LEU A 32 12.099 -2.486 -3.130 1.00 0.00 C ATOM 528 CD1 LEU A 32 11.672 -2.409 -4.602 1.00 0.00 C ATOM 529 CD2 LEU A 32 11.899 -3.913 -2.620 1.00 0.00 C ATOM 0 H LEU A 32 15.057 -0.231 -2.213 1.00 0.00 H new ATOM 0 HA LEU A 32 13.047 -1.813 -0.919 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.775 -1.173 -3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.209 -2.868 -3.439 1.00 0.00 H new ATOM 0 HG LEU A 32 11.492 -1.795 -2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.621 -2.685 -4.691 1.00 0.00 H new ATOM 0 HD12 LEU A 32 11.812 -1.392 -4.969 1.00 0.00 H new ATOM 0 HD13 LEU A 32 12.279 -3.095 -5.193 1.00 0.00 H new ATOM 0 HD21 LEU A 32 10.850 -4.191 -2.718 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.512 -4.598 -3.206 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.192 -3.969 -1.572 1.00 0.00 H new ATOM 541 N LYS A 33 15.919 -3.369 -1.439 1.00 0.00 N ATOM 542 CA LYS A 33 16.689 -4.530 -0.937 1.00 0.00 C ATOM 543 C LYS A 33 17.041 -4.311 0.541 1.00 0.00 C ATOM 544 O LYS A 33 17.078 -5.242 1.320 1.00 0.00 O ATOM 545 CB LYS A 33 17.947 -4.645 -1.792 1.00 0.00 C ATOM 546 CG LYS A 33 18.815 -5.833 -1.361 1.00 0.00 C ATOM 547 CD LYS A 33 20.218 -5.683 -1.986 1.00 0.00 C ATOM 548 CE LYS A 33 21.150 -4.931 -1.029 1.00 0.00 C ATOM 549 NZ LYS A 33 21.502 -5.815 0.118 1.00 0.00 N ATOM 0 H LYS A 33 16.387 -2.809 -2.152 1.00 0.00 H new ATOM 0 HA LYS A 33 16.111 -5.452 -1.006 1.00 0.00 H new ATOM 0 HB2 LYS A 33 17.667 -4.759 -2.839 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.525 -3.724 -1.715 1.00 0.00 H new ATOM 0 HG2 LYS A 33 18.889 -5.870 -0.274 1.00 0.00 H new ATOM 0 HG3 LYS A 33 18.358 -6.769 -1.682 1.00 0.00 H new ATOM 0 HD2 LYS A 33 20.631 -6.667 -2.209 1.00 0.00 H new ATOM 0 HD3 LYS A 33 20.147 -5.146 -2.932 1.00 0.00 H new ATOM 0 HE2 LYS A 33 22.054 -4.620 -1.553 1.00 0.00 H new ATOM 0 HE3 LYS A 33 20.664 -4.025 -0.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 22.403 -5.503 0.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 20.753 -5.764 0.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 21.596 -6.796 -0.216 1.00 0.00 H new ATOM 563 N GLU A 34 17.315 -3.094 0.933 1.00 0.00 N ATOM 564 CA GLU A 34 17.680 -2.850 2.366 1.00 0.00 C ATOM 565 C GLU A 34 16.420 -2.831 3.227 1.00 0.00 C ATOM 566 O GLU A 34 16.438 -3.238 4.371 1.00 0.00 O ATOM 567 CB GLU A 34 18.421 -1.522 2.510 1.00 0.00 C ATOM 568 CG GLU A 34 18.984 -1.398 3.930 1.00 0.00 C ATOM 569 CD GLU A 34 20.132 -2.391 4.109 1.00 0.00 C ATOM 570 OE1 GLU A 34 19.865 -3.511 4.513 1.00 0.00 O ATOM 571 OE2 GLU A 34 21.262 -2.016 3.840 1.00 0.00 O ATOM 0 H GLU A 34 17.303 -2.268 0.335 1.00 0.00 H new ATOM 0 HA GLU A 34 18.334 -3.655 2.700 1.00 0.00 H new ATOM 0 HB2 GLU A 34 19.229 -1.464 1.781 1.00 0.00 H new ATOM 0 HB3 GLU A 34 17.745 -0.693 2.302 1.00 0.00 H new ATOM 0 HG2 GLU A 34 19.337 -0.382 4.106 1.00 0.00 H new ATOM 0 HG3 GLU A 34 18.201 -1.595 4.662 1.00 0.00 H new ATOM 578 N LEU A 35 15.324 -2.385 2.691 1.00 0.00 N ATOM 579 CA LEU A 35 14.067 -2.370 3.488 1.00 0.00 C ATOM 580 C LEU A 35 13.600 -3.816 3.654 1.00 0.00 C ATOM 581 O LEU A 35 13.072 -4.201 4.678 1.00 0.00 O ATOM 582 CB LEU A 35 13.006 -1.538 2.751 1.00 0.00 C ATOM 583 CG LEU A 35 11.716 -1.438 3.593 1.00 0.00 C ATOM 584 CD1 LEU A 35 11.853 -0.332 4.646 1.00 0.00 C ATOM 585 CD2 LEU A 35 10.533 -1.107 2.678 1.00 0.00 C ATOM 0 H LEU A 35 15.241 -2.030 1.738 1.00 0.00 H new ATOM 0 HA LEU A 35 14.231 -1.922 4.468 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.394 -0.540 2.549 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.783 -1.994 1.786 1.00 0.00 H new ATOM 0 HG LEU A 35 11.549 -2.393 4.092 1.00 0.00 H new ATOM 0 HD11 LEU A 35 10.936 -0.272 5.233 1.00 0.00 H new ATOM 0 HD12 LEU A 35 12.691 -0.559 5.305 1.00 0.00 H new ATOM 0 HD13 LEU A 35 12.029 0.623 4.150 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.622 -1.036 3.272 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.715 -0.156 2.178 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.419 -1.893 1.932 1.00 0.00 H new ATOM 597 N ILE A 36 13.817 -4.622 2.652 1.00 0.00 N ATOM 598 CA ILE A 36 13.420 -6.055 2.729 1.00 0.00 C ATOM 599 C ILE A 36 14.293 -6.755 3.777 1.00 0.00 C ATOM 600 O ILE A 36 13.836 -7.589 4.533 1.00 0.00 O ATOM 601 CB ILE A 36 13.625 -6.689 1.350 1.00 0.00 C ATOM 602 CG1 ILE A 36 12.541 -6.171 0.394 1.00 0.00 C ATOM 603 CG2 ILE A 36 13.524 -8.215 1.450 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.953 -6.459 -1.051 1.00 0.00 C ATOM 0 H ILE A 36 14.257 -4.346 1.774 1.00 0.00 H new ATOM 0 HA ILE A 36 12.374 -6.154 3.019 1.00 0.00 H new ATOM 0 HB ILE A 36 14.613 -6.422 0.976 1.00 0.00 H new ATOM 0 HG12 ILE A 36 11.588 -6.652 0.614 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.398 -5.100 0.536 1.00 0.00 H new ATOM 0 HG21 ILE A 36 13.671 -8.655 0.464 1.00 0.00 H new ATOM 0 HG22 ILE A 36 14.290 -8.586 2.131 1.00 0.00 H new ATOM 0 HG23 ILE A 36 12.539 -8.491 1.827 1.00 0.00 H new ATOM 0 HD11 ILE A 36 12.183 -6.091 -1.729 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.897 -5.958 -1.267 1.00 0.00 H new ATOM 0 HD13 ILE A 36 13.073 -7.534 -1.188 1.00 0.00 H new ATOM 616 N ASN A 37 15.554 -6.422 3.810 1.00 0.00 N ATOM 617 CA ASN A 37 16.490 -7.056 4.786 1.00 0.00 C ATOM 618 C ASN A 37 16.386 -6.397 6.170 1.00 0.00 C ATOM 619 O ASN A 37 16.783 -6.975 7.163 1.00 0.00 O ATOM 620 CB ASN A 37 17.924 -6.908 4.277 1.00 0.00 C ATOM 621 CG ASN A 37 18.047 -7.548 2.894 1.00 0.00 C ATOM 622 OD1 ASN A 37 17.074 -7.661 2.174 1.00 0.00 O ATOM 623 ND2 ASN A 37 19.212 -7.973 2.489 1.00 0.00 N ATOM 0 H ASN A 37 15.982 -5.730 3.196 1.00 0.00 H new ATOM 0 HA ASN A 37 16.220 -8.108 4.881 1.00 0.00 H new ATOM 0 HB2 ASN A 37 18.195 -5.854 4.226 1.00 0.00 H new ATOM 0 HB3 ASN A 37 18.618 -7.382 4.971 1.00 0.00 H new ATOM 0 HD21 ASN A 37 19.307 -8.400 1.568 1.00 0.00 H new ATOM 0 HD22 ASN A 37 20.028 -7.878 3.094 1.00 0.00 H new ATOM 630 N ASN A 38 15.918 -5.175 6.245 1.00 0.00 N ATOM 631 CA ASN A 38 15.857 -4.475 7.574 1.00 0.00 C ATOM 632 C ASN A 38 14.468 -4.579 8.224 1.00 0.00 C ATOM 633 O ASN A 38 14.364 -4.819 9.410 1.00 0.00 O ATOM 634 CB ASN A 38 16.201 -2.994 7.366 1.00 0.00 C ATOM 635 CG ASN A 38 17.706 -2.841 7.144 1.00 0.00 C ATOM 636 OD1 ASN A 38 18.341 -3.708 6.577 1.00 0.00 O ATOM 637 ND2 ASN A 38 18.307 -1.764 7.569 1.00 0.00 N ATOM 0 H ASN A 38 15.577 -4.632 5.452 1.00 0.00 H new ATOM 0 HA ASN A 38 16.571 -4.958 8.241 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.655 -2.601 6.508 1.00 0.00 H new ATOM 0 HB3 ASN A 38 15.891 -2.413 8.235 1.00 0.00 H new ATOM 0 HD21 ASN A 38 19.310 -1.649 7.425 1.00 0.00 H new ATOM 0 HD22 ASN A 38 17.774 -1.036 8.045 1.00 0.00 H new ATOM 644 N GLU A 39 13.406 -4.387 7.482 1.00 0.00 N ATOM 645 CA GLU A 39 12.033 -4.460 8.092 1.00 0.00 C ATOM 646 C GLU A 39 11.348 -5.764 7.684 1.00 0.00 C ATOM 647 O GLU A 39 11.044 -6.603 8.507 1.00 0.00 O ATOM 648 CB GLU A 39 11.196 -3.269 7.597 1.00 0.00 C ATOM 649 CG GLU A 39 11.557 -2.014 8.399 1.00 0.00 C ATOM 650 CD GLU A 39 13.030 -1.674 8.177 1.00 0.00 C ATOM 651 OE1 GLU A 39 13.520 -1.943 7.094 1.00 0.00 O ATOM 652 OE2 GLU A 39 13.640 -1.148 9.093 1.00 0.00 O ATOM 0 H GLU A 39 13.425 -4.183 6.483 1.00 0.00 H new ATOM 0 HA GLU A 39 12.120 -4.427 9.178 1.00 0.00 H new ATOM 0 HB2 GLU A 39 11.379 -3.099 6.536 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.134 -3.489 7.706 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.929 -1.178 8.089 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.367 -2.180 9.459 1.00 0.00 H new ATOM 659 N LEU A 40 11.095 -5.932 6.422 1.00 0.00 N ATOM 660 CA LEU A 40 10.420 -7.175 5.960 1.00 0.00 C ATOM 661 C LEU A 40 11.426 -8.334 6.018 1.00 0.00 C ATOM 662 O LEU A 40 11.403 -9.228 5.201 1.00 0.00 O ATOM 663 CB LEU A 40 9.887 -6.987 4.512 1.00 0.00 C ATOM 664 CG LEU A 40 9.703 -5.494 4.167 1.00 0.00 C ATOM 665 CD1 LEU A 40 9.192 -5.380 2.731 1.00 0.00 C ATOM 666 CD2 LEU A 40 8.681 -4.831 5.110 1.00 0.00 C ATOM 0 H LEU A 40 11.326 -5.263 5.687 1.00 0.00 H new ATOM 0 HA LEU A 40 9.571 -7.398 6.606 1.00 0.00 H new ATOM 0 HB2 LEU A 40 10.581 -7.442 3.806 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.935 -7.507 4.403 1.00 0.00 H new ATOM 0 HG LEU A 40 10.662 -4.989 4.280 1.00 0.00 H new ATOM 0 HD11 LEU A 40 9.058 -4.329 2.475 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.915 -5.830 2.051 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.238 -5.900 2.642 1.00 0.00 H new ATOM 0 HD21 LEU A 40 8.570 -3.779 4.845 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.718 -5.333 5.014 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.030 -4.911 6.139 1.00 0.00 H new ATOM 678 N SER A 41 12.320 -8.320 6.973 1.00 0.00 N ATOM 679 CA SER A 41 13.331 -9.414 7.071 1.00 0.00 C ATOM 680 C SER A 41 12.794 -10.575 7.920 1.00 0.00 C ATOM 681 O SER A 41 13.285 -11.683 7.845 1.00 0.00 O ATOM 682 CB SER A 41 14.604 -8.847 7.708 1.00 0.00 C ATOM 683 OG SER A 41 15.739 -9.481 7.131 1.00 0.00 O ATOM 0 H SER A 41 12.393 -7.598 7.689 1.00 0.00 H new ATOM 0 HA SER A 41 13.548 -9.797 6.074 1.00 0.00 H new ATOM 0 HB2 SER A 41 14.655 -7.770 7.550 1.00 0.00 H new ATOM 0 HB3 SER A 41 14.590 -9.011 8.786 1.00 0.00 H new ATOM 0 HG SER A 41 16.444 -8.817 6.981 1.00 0.00 H new ATOM 689 N HIS A 42 11.795 -10.336 8.729 1.00 0.00 N ATOM 690 CA HIS A 42 11.242 -11.434 9.579 1.00 0.00 C ATOM 691 C HIS A 42 10.093 -12.118 8.837 1.00 0.00 C ATOM 692 O HIS A 42 9.793 -13.273 9.066 1.00 0.00 O ATOM 693 CB HIS A 42 10.718 -10.851 10.896 1.00 0.00 C ATOM 694 CG HIS A 42 11.676 -9.810 11.408 1.00 0.00 C ATOM 695 ND1 HIS A 42 12.673 -10.109 12.327 1.00 0.00 N ATOM 696 CD2 HIS A 42 11.793 -8.467 11.149 1.00 0.00 C ATOM 697 CE1 HIS A 42 13.338 -8.968 12.587 1.00 0.00 C ATOM 698 NE2 HIS A 42 12.841 -7.941 11.896 1.00 0.00 N ATOM 0 H HIS A 42 11.338 -9.430 8.838 1.00 0.00 H new ATOM 0 HA HIS A 42 12.028 -12.159 9.790 1.00 0.00 H new ATOM 0 HB2 HIS A 42 9.734 -10.409 10.743 1.00 0.00 H new ATOM 0 HB3 HIS A 42 10.600 -11.644 11.634 1.00 0.00 H new ATOM 0 HD2 HIS A 42 11.168 -7.906 10.470 1.00 0.00 H new ATOM 0 HE1 HIS A 42 14.171 -8.893 13.270 1.00 0.00 H new ATOM 0 HE2 HIS A 42 13.162 -6.973 11.912 1.00 0.00 H new ATOM 707 N PHE A 43 9.442 -11.406 7.952 1.00 0.00 N ATOM 708 CA PHE A 43 8.300 -11.996 7.189 1.00 0.00 C ATOM 709 C PHE A 43 8.753 -12.346 5.774 1.00 0.00 C ATOM 710 O PHE A 43 8.546 -13.448 5.306 1.00 0.00 O ATOM 711 CB PHE A 43 7.162 -10.978 7.127 1.00 0.00 C ATOM 712 CG PHE A 43 6.535 -10.850 8.494 1.00 0.00 C ATOM 713 CD1 PHE A 43 5.609 -11.806 8.931 1.00 0.00 C ATOM 714 CD2 PHE A 43 6.880 -9.779 9.328 1.00 0.00 C ATOM 715 CE1 PHE A 43 5.029 -11.691 10.200 1.00 0.00 C ATOM 716 CE2 PHE A 43 6.301 -9.665 10.598 1.00 0.00 C ATOM 717 CZ PHE A 43 5.376 -10.621 11.034 1.00 0.00 C ATOM 0 H PHE A 43 9.654 -10.435 7.724 1.00 0.00 H new ATOM 0 HA PHE A 43 7.956 -12.902 7.687 1.00 0.00 H new ATOM 0 HB2 PHE A 43 7.541 -10.011 6.796 1.00 0.00 H new ATOM 0 HB3 PHE A 43 6.415 -11.294 6.399 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.342 -12.632 8.289 1.00 0.00 H new ATOM 0 HD2 PHE A 43 7.593 -9.041 8.992 1.00 0.00 H new ATOM 0 HE1 PHE A 43 4.314 -12.428 10.536 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.568 -8.839 11.241 1.00 0.00 H new ATOM 0 HZ PHE A 43 4.930 -10.533 12.014 1.00 0.00 H new ATOM 727 N LEU A 44 9.378 -11.428 5.083 1.00 0.00 N ATOM 728 CA LEU A 44 9.845 -11.735 3.698 1.00 0.00 C ATOM 729 C LEU A 44 11.253 -12.327 3.780 1.00 0.00 C ATOM 730 O LEU A 44 12.088 -11.863 4.531 1.00 0.00 O ATOM 731 CB LEU A 44 9.856 -10.451 2.852 1.00 0.00 C ATOM 732 CG LEU A 44 9.907 -10.784 1.347 1.00 0.00 C ATOM 733 CD1 LEU A 44 8.661 -11.587 0.918 1.00 0.00 C ATOM 734 CD2 LEU A 44 9.977 -9.470 0.553 1.00 0.00 C ATOM 0 H LEU A 44 9.584 -10.486 5.415 1.00 0.00 H new ATOM 0 HA LEU A 44 9.172 -12.451 3.226 1.00 0.00 H new ATOM 0 HB2 LEU A 44 8.965 -9.861 3.068 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.717 -9.840 3.123 1.00 0.00 H new ATOM 0 HG LEU A 44 10.788 -11.394 1.146 1.00 0.00 H new ATOM 0 HD11 LEU A 44 8.721 -11.810 -0.147 1.00 0.00 H new ATOM 0 HD12 LEU A 44 8.617 -12.519 1.481 1.00 0.00 H new ATOM 0 HD13 LEU A 44 7.764 -11.000 1.116 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.014 -9.691 -0.514 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.095 -8.867 0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 44 10.872 -8.919 0.840 1.00 0.00 H new ATOM 746 N GLU A 45 11.519 -13.359 3.028 1.00 0.00 N ATOM 747 CA GLU A 45 12.869 -13.988 3.083 1.00 0.00 C ATOM 748 C GLU A 45 13.946 -12.912 2.951 1.00 0.00 C ATOM 749 O GLU A 45 13.866 -12.032 2.117 1.00 0.00 O ATOM 750 CB GLU A 45 13.019 -14.998 1.943 1.00 0.00 C ATOM 751 CG GLU A 45 14.258 -15.867 2.193 1.00 0.00 C ATOM 752 CD GLU A 45 14.661 -16.573 0.897 1.00 0.00 C ATOM 753 OE1 GLU A 45 14.582 -15.945 -0.146 1.00 0.00 O ATOM 754 OE2 GLU A 45 15.042 -17.730 0.970 1.00 0.00 O ATOM 0 H GLU A 45 10.862 -13.793 2.379 1.00 0.00 H new ATOM 0 HA GLU A 45 12.982 -14.501 4.038 1.00 0.00 H new ATOM 0 HB2 GLU A 45 12.129 -15.624 1.877 1.00 0.00 H new ATOM 0 HB3 GLU A 45 13.113 -14.477 0.990 1.00 0.00 H new ATOM 0 HG2 GLU A 45 15.081 -15.250 2.553 1.00 0.00 H new ATOM 0 HG3 GLU A 45 14.048 -16.603 2.969 1.00 0.00 H new ATOM 761 N GLU A 46 14.953 -12.982 3.776 1.00 0.00 N ATOM 762 CA GLU A 46 16.050 -11.974 3.720 1.00 0.00 C ATOM 763 C GLU A 46 16.651 -11.937 2.310 1.00 0.00 C ATOM 764 O GLU A 46 17.671 -12.541 2.043 1.00 0.00 O ATOM 765 CB GLU A 46 17.140 -12.356 4.732 1.00 0.00 C ATOM 766 CG GLU A 46 17.424 -13.869 4.662 1.00 0.00 C ATOM 767 CD GLU A 46 16.421 -14.634 5.533 1.00 0.00 C ATOM 768 OE1 GLU A 46 16.585 -14.621 6.742 1.00 0.00 O ATOM 769 OE2 GLU A 46 15.508 -15.219 4.974 1.00 0.00 O ATOM 0 H GLU A 46 15.064 -13.700 4.492 1.00 0.00 H new ATOM 0 HA GLU A 46 15.650 -10.990 3.964 1.00 0.00 H new ATOM 0 HB2 GLU A 46 18.052 -11.797 4.523 1.00 0.00 H new ATOM 0 HB3 GLU A 46 16.823 -12.084 5.739 1.00 0.00 H new ATOM 0 HG2 GLU A 46 17.357 -14.212 3.630 1.00 0.00 H new ATOM 0 HG3 GLU A 46 18.440 -14.072 5.000 1.00 0.00 H new ATOM 776 N ILE A 47 16.032 -11.230 1.406 1.00 0.00 N ATOM 777 CA ILE A 47 16.575 -11.158 0.021 1.00 0.00 C ATOM 778 C ILE A 47 18.025 -10.659 0.069 1.00 0.00 C ATOM 779 O ILE A 47 18.316 -9.608 0.603 1.00 0.00 O ATOM 780 CB ILE A 47 15.691 -10.205 -0.821 1.00 0.00 C ATOM 781 CG1 ILE A 47 14.479 -10.990 -1.367 1.00 0.00 C ATOM 782 CG2 ILE A 47 16.492 -9.604 -1.985 1.00 0.00 C ATOM 783 CD1 ILE A 47 13.504 -10.067 -2.123 1.00 0.00 C ATOM 0 H ILE A 47 15.175 -10.700 1.566 1.00 0.00 H new ATOM 0 HA ILE A 47 16.564 -12.145 -0.441 1.00 0.00 H new ATOM 0 HB ILE A 47 15.348 -9.387 -0.187 1.00 0.00 H new ATOM 0 HG12 ILE A 47 14.826 -11.779 -2.034 1.00 0.00 H new ATOM 0 HG13 ILE A 47 13.957 -11.476 -0.542 1.00 0.00 H new ATOM 0 HG21 ILE A 47 15.851 -8.938 -2.562 1.00 0.00 H new ATOM 0 HG22 ILE A 47 17.339 -9.042 -1.592 1.00 0.00 H new ATOM 0 HG23 ILE A 47 16.856 -10.405 -2.628 1.00 0.00 H new ATOM 0 HD11 ILE A 47 12.663 -10.652 -2.494 1.00 0.00 H new ATOM 0 HD12 ILE A 47 13.138 -9.293 -1.448 1.00 0.00 H new ATOM 0 HD13 ILE A 47 14.020 -9.602 -2.963 1.00 0.00 H new ATOM 795 N LYS A 48 18.928 -11.413 -0.507 1.00 0.00 N ATOM 796 CA LYS A 48 20.369 -11.014 -0.535 1.00 0.00 C ATOM 797 C LYS A 48 20.762 -10.726 -1.985 1.00 0.00 C ATOM 798 O LYS A 48 21.750 -10.071 -2.257 1.00 0.00 O ATOM 799 CB LYS A 48 21.223 -12.162 0.006 1.00 0.00 C ATOM 800 CG LYS A 48 21.085 -13.376 -0.915 1.00 0.00 C ATOM 801 CD LYS A 48 21.639 -14.616 -0.216 1.00 0.00 C ATOM 802 CE LYS A 48 21.650 -15.791 -1.197 1.00 0.00 C ATOM 803 NZ LYS A 48 20.254 -16.098 -1.619 1.00 0.00 N ATOM 0 H LYS A 48 18.724 -12.301 -0.966 1.00 0.00 H new ATOM 0 HA LYS A 48 20.528 -10.128 0.080 1.00 0.00 H new ATOM 0 HB2 LYS A 48 22.267 -11.855 0.068 1.00 0.00 H new ATOM 0 HB3 LYS A 48 20.906 -12.420 1.016 1.00 0.00 H new ATOM 0 HG2 LYS A 48 20.038 -13.530 -1.175 1.00 0.00 H new ATOM 0 HG3 LYS A 48 21.623 -13.201 -1.847 1.00 0.00 H new ATOM 0 HD2 LYS A 48 22.648 -14.422 0.147 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.029 -14.860 0.654 1.00 0.00 H new ATOM 0 HE2 LYS A 48 22.259 -15.546 -2.067 1.00 0.00 H new ATOM 0 HE3 LYS A 48 22.100 -16.666 -0.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 20.159 -17.120 -1.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.593 -15.806 -0.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 20.035 -15.582 -2.495 1.00 0.00 H new ATOM 817 N GLU A 49 19.982 -11.208 -2.922 1.00 0.00 N ATOM 818 CA GLU A 49 20.283 -10.967 -4.366 1.00 0.00 C ATOM 819 C GLU A 49 19.396 -9.829 -4.875 1.00 0.00 C ATOM 820 O GLU A 49 18.322 -9.590 -4.360 1.00 0.00 O ATOM 821 CB GLU A 49 19.988 -12.237 -5.170 1.00 0.00 C ATOM 822 CG GLU A 49 20.623 -13.444 -4.476 1.00 0.00 C ATOM 823 CD GLU A 49 20.648 -14.633 -5.439 1.00 0.00 C ATOM 824 OE1 GLU A 49 19.584 -15.155 -5.730 1.00 0.00 O ATOM 825 OE2 GLU A 49 21.729 -15.001 -5.869 1.00 0.00 O ATOM 0 H GLU A 49 19.144 -11.762 -2.746 1.00 0.00 H new ATOM 0 HA GLU A 49 21.334 -10.701 -4.483 1.00 0.00 H new ATOM 0 HB2 GLU A 49 18.911 -12.381 -5.259 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.381 -12.138 -6.182 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.636 -13.201 -4.155 1.00 0.00 H new ATOM 0 HG3 GLU A 49 20.058 -13.700 -3.580 1.00 0.00 H new ATOM 832 N GLN A 50 19.841 -9.118 -5.876 1.00 0.00 N ATOM 833 CA GLN A 50 19.031 -7.983 -6.419 1.00 0.00 C ATOM 834 C GLN A 50 18.165 -8.462 -7.587 1.00 0.00 C ATOM 835 O GLN A 50 17.140 -7.885 -7.889 1.00 0.00 O ATOM 836 CB GLN A 50 19.976 -6.890 -6.924 1.00 0.00 C ATOM 837 CG GLN A 50 20.771 -6.310 -5.754 1.00 0.00 C ATOM 838 CD GLN A 50 21.960 -5.511 -6.292 1.00 0.00 C ATOM 839 OE1 GLN A 50 23.098 -5.826 -6.009 1.00 0.00 O ATOM 840 NE2 GLN A 50 21.741 -4.482 -7.066 1.00 0.00 N ATOM 0 H GLN A 50 20.734 -9.273 -6.344 1.00 0.00 H new ATOM 0 HA GLN A 50 18.389 -7.596 -5.628 1.00 0.00 H new ATOM 0 HB2 GLN A 50 20.657 -7.301 -7.669 1.00 0.00 H new ATOM 0 HB3 GLN A 50 19.405 -6.101 -7.414 1.00 0.00 H new ATOM 0 HG2 GLN A 50 20.131 -5.668 -5.149 1.00 0.00 H new ATOM 0 HG3 GLN A 50 21.122 -7.113 -5.105 1.00 0.00 H new ATOM 0 HE21 GLN A 50 20.785 -4.217 -7.304 1.00 0.00 H new ATOM 0 HE22 GLN A 50 22.526 -3.943 -7.433 1.00 0.00 H new ATOM 849 N GLU A 51 18.586 -9.492 -8.267 1.00 0.00 N ATOM 850 CA GLU A 51 17.809 -9.985 -9.438 1.00 0.00 C ATOM 851 C GLU A 51 16.326 -10.087 -9.108 1.00 0.00 C ATOM 852 O GLU A 51 15.485 -9.834 -9.946 1.00 0.00 O ATOM 853 CB GLU A 51 18.336 -11.354 -9.873 1.00 0.00 C ATOM 854 CG GLU A 51 18.031 -12.390 -8.792 1.00 0.00 C ATOM 855 CD GLU A 51 18.805 -13.677 -9.085 1.00 0.00 C ATOM 856 OE1 GLU A 51 19.982 -13.578 -9.390 1.00 0.00 O ATOM 857 OE2 GLU A 51 18.209 -14.738 -9.000 1.00 0.00 O ATOM 0 H GLU A 51 19.437 -10.015 -8.061 1.00 0.00 H new ATOM 0 HA GLU A 51 17.931 -9.271 -10.252 1.00 0.00 H new ATOM 0 HB2 GLU A 51 17.874 -11.650 -10.815 1.00 0.00 H new ATOM 0 HB3 GLU A 51 19.411 -11.302 -10.048 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.309 -12.001 -7.812 1.00 0.00 H new ATOM 0 HG3 GLU A 51 16.961 -12.595 -8.762 1.00 0.00 H new ATOM 864 N VAL A 52 15.981 -10.434 -7.905 1.00 0.00 N ATOM 865 CA VAL A 52 14.536 -10.518 -7.570 1.00 0.00 C ATOM 866 C VAL A 52 14.005 -9.105 -7.436 1.00 0.00 C ATOM 867 O VAL A 52 12.910 -8.794 -7.861 1.00 0.00 O ATOM 868 CB VAL A 52 14.346 -11.276 -6.258 1.00 0.00 C ATOM 869 CG1 VAL A 52 14.947 -12.677 -6.388 1.00 0.00 C ATOM 870 CG2 VAL A 52 15.054 -10.519 -5.133 1.00 0.00 C ATOM 0 H VAL A 52 16.625 -10.661 -7.148 1.00 0.00 H new ATOM 0 HA VAL A 52 13.997 -11.052 -8.352 1.00 0.00 H new ATOM 0 HB VAL A 52 13.283 -11.358 -6.032 1.00 0.00 H new ATOM 0 HG11 VAL A 52 14.812 -13.219 -5.452 1.00 0.00 H new ATOM 0 HG12 VAL A 52 14.447 -13.214 -7.194 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.011 -12.597 -6.611 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.922 -11.056 -4.194 1.00 0.00 H new ATOM 0 HG22 VAL A 52 16.117 -10.441 -5.360 1.00 0.00 H new ATOM 0 HG23 VAL A 52 14.628 -9.520 -5.043 1.00 0.00 H new ATOM 880 N VAL A 53 14.787 -8.239 -6.875 1.00 0.00 N ATOM 881 CA VAL A 53 14.348 -6.832 -6.743 1.00 0.00 C ATOM 882 C VAL A 53 14.261 -6.277 -8.163 1.00 0.00 C ATOM 883 O VAL A 53 13.545 -5.336 -8.441 1.00 0.00 O ATOM 884 CB VAL A 53 15.351 -6.059 -5.833 1.00 0.00 C ATOM 885 CG1 VAL A 53 16.141 -5.004 -6.620 1.00 0.00 C ATOM 886 CG2 VAL A 53 14.600 -5.358 -4.696 1.00 0.00 C ATOM 0 H VAL A 53 15.714 -8.444 -6.501 1.00 0.00 H new ATOM 0 HA VAL A 53 13.375 -6.731 -6.263 1.00 0.00 H new ATOM 0 HB VAL A 53 16.050 -6.793 -5.432 1.00 0.00 H new ATOM 0 HG11 VAL A 53 16.828 -4.489 -5.949 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.706 -5.491 -7.415 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.450 -4.282 -7.056 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.310 -4.822 -4.067 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.882 -4.653 -5.115 1.00 0.00 H new ATOM 0 HG23 VAL A 53 14.073 -6.100 -4.096 1.00 0.00 H new ATOM 896 N ASP A 54 14.978 -6.884 -9.068 1.00 0.00 N ATOM 897 CA ASP A 54 14.927 -6.429 -10.481 1.00 0.00 C ATOM 898 C ASP A 54 13.672 -7.021 -11.119 1.00 0.00 C ATOM 899 O ASP A 54 13.044 -6.415 -11.963 1.00 0.00 O ATOM 900 CB ASP A 54 16.169 -6.912 -11.232 1.00 0.00 C ATOM 901 CG ASP A 54 16.275 -6.174 -12.568 1.00 0.00 C ATOM 902 OD1 ASP A 54 16.014 -4.982 -12.585 1.00 0.00 O ATOM 903 OD2 ASP A 54 16.615 -6.811 -13.550 1.00 0.00 O ATOM 0 H ASP A 54 15.596 -7.675 -8.888 1.00 0.00 H new ATOM 0 HA ASP A 54 14.901 -5.340 -10.527 1.00 0.00 H new ATOM 0 HB2 ASP A 54 17.062 -6.733 -10.633 1.00 0.00 H new ATOM 0 HB3 ASP A 54 16.110 -7.987 -11.402 1.00 0.00 H new ATOM 908 N LYS A 55 13.298 -8.210 -10.709 1.00 0.00 N ATOM 909 CA LYS A 55 12.074 -8.847 -11.281 1.00 0.00 C ATOM 910 C LYS A 55 10.841 -8.341 -10.513 1.00 0.00 C ATOM 911 O LYS A 55 9.781 -8.162 -11.079 1.00 0.00 O ATOM 912 CB LYS A 55 12.225 -10.397 -11.227 1.00 0.00 C ATOM 913 CG LYS A 55 11.481 -11.045 -10.031 1.00 0.00 C ATOM 914 CD LYS A 55 10.027 -11.364 -10.416 1.00 0.00 C ATOM 915 CE LYS A 55 9.197 -11.606 -9.151 1.00 0.00 C ATOM 916 NZ LYS A 55 7.936 -12.312 -9.514 1.00 0.00 N ATOM 0 H LYS A 55 13.787 -8.763 -10.005 1.00 0.00 H new ATOM 0 HA LYS A 55 11.943 -8.574 -12.328 1.00 0.00 H new ATOM 0 HB2 LYS A 55 11.847 -10.824 -12.156 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.284 -10.650 -11.167 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.993 -11.958 -9.727 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.498 -10.371 -9.175 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.603 -10.539 -10.988 1.00 0.00 H new ATOM 0 HD3 LYS A 55 9.996 -12.245 -11.057 1.00 0.00 H new ATOM 0 HE2 LYS A 55 9.767 -12.200 -8.437 1.00 0.00 H new ATOM 0 HE3 LYS A 55 8.969 -10.657 -8.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.371 -12.477 -8.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 7.391 -11.729 -10.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 8.164 -13.224 -9.959 1.00 0.00 H new ATOM 930 N VAL A 56 10.975 -8.088 -9.233 1.00 0.00 N ATOM 931 CA VAL A 56 9.804 -7.576 -8.466 1.00 0.00 C ATOM 932 C VAL A 56 9.425 -6.227 -9.073 1.00 0.00 C ATOM 933 O VAL A 56 8.268 -5.934 -9.300 1.00 0.00 O ATOM 934 CB VAL A 56 10.158 -7.451 -6.962 1.00 0.00 C ATOM 935 CG1 VAL A 56 10.785 -6.087 -6.643 1.00 0.00 C ATOM 936 CG2 VAL A 56 8.889 -7.613 -6.118 1.00 0.00 C ATOM 0 H VAL A 56 11.833 -8.213 -8.696 1.00 0.00 H new ATOM 0 HA VAL A 56 8.959 -8.261 -8.530 1.00 0.00 H new ATOM 0 HB VAL A 56 10.879 -8.233 -6.726 1.00 0.00 H new ATOM 0 HG11 VAL A 56 11.020 -6.034 -5.580 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.699 -5.962 -7.224 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.082 -5.295 -6.898 1.00 0.00 H new ATOM 0 HG21 VAL A 56 9.141 -7.525 -5.061 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.172 -6.837 -6.386 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.450 -8.593 -6.306 1.00 0.00 H new ATOM 946 N MET A 57 10.404 -5.418 -9.365 1.00 0.00 N ATOM 947 CA MET A 57 10.114 -4.101 -9.990 1.00 0.00 C ATOM 948 C MET A 57 9.401 -4.349 -11.320 1.00 0.00 C ATOM 949 O MET A 57 8.530 -3.611 -11.721 1.00 0.00 O ATOM 950 CB MET A 57 11.423 -3.352 -10.246 1.00 0.00 C ATOM 951 CG MET A 57 11.948 -2.775 -8.931 1.00 0.00 C ATOM 952 SD MET A 57 13.623 -2.132 -9.189 1.00 0.00 S ATOM 953 CE MET A 57 13.470 -0.649 -8.163 1.00 0.00 C ATOM 0 H MET A 57 11.391 -5.613 -9.198 1.00 0.00 H new ATOM 0 HA MET A 57 9.487 -3.502 -9.329 1.00 0.00 H new ATOM 0 HB2 MET A 57 12.161 -4.027 -10.679 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.261 -2.551 -10.967 1.00 0.00 H new ATOM 0 HG2 MET A 57 11.290 -1.980 -8.581 1.00 0.00 H new ATOM 0 HG3 MET A 57 11.956 -3.545 -8.160 1.00 0.00 H new ATOM 0 HE1 MET A 57 14.403 -0.086 -8.196 1.00 0.00 H new ATOM 0 HE2 MET A 57 12.658 -0.028 -8.540 1.00 0.00 H new ATOM 0 HE3 MET A 57 13.257 -0.939 -7.134 1.00 0.00 H new ATOM 963 N GLU A 58 9.761 -5.396 -12.004 1.00 0.00 N ATOM 964 CA GLU A 58 9.096 -5.700 -13.301 1.00 0.00 C ATOM 965 C GLU A 58 7.612 -5.952 -13.044 1.00 0.00 C ATOM 966 O GLU A 58 6.770 -5.693 -13.880 1.00 0.00 O ATOM 967 CB GLU A 58 9.737 -6.951 -13.915 1.00 0.00 C ATOM 968 CG GLU A 58 9.438 -7.014 -15.415 1.00 0.00 C ATOM 969 CD GLU A 58 10.238 -8.158 -16.039 1.00 0.00 C ATOM 970 OE1 GLU A 58 11.238 -8.542 -15.455 1.00 0.00 O ATOM 971 OE2 GLU A 58 9.838 -8.632 -17.090 1.00 0.00 O ATOM 0 H GLU A 58 10.487 -6.055 -11.722 1.00 0.00 H new ATOM 0 HA GLU A 58 9.212 -4.863 -13.990 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.815 -6.934 -13.752 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.354 -7.844 -13.422 1.00 0.00 H new ATOM 0 HG2 GLU A 58 8.372 -7.168 -15.579 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.701 -6.069 -15.890 1.00 0.00 H new ATOM 978 N THR A 59 7.294 -6.459 -11.887 1.00 0.00 N ATOM 979 CA THR A 59 5.871 -6.741 -11.551 1.00 0.00 C ATOM 980 C THR A 59 5.232 -5.503 -10.924 1.00 0.00 C ATOM 981 O THR A 59 4.040 -5.292 -11.033 1.00 0.00 O ATOM 982 CB THR A 59 5.812 -7.899 -10.558 1.00 0.00 C ATOM 983 OG1 THR A 59 6.506 -9.017 -11.096 1.00 0.00 O ATOM 984 CG2 THR A 59 4.354 -8.276 -10.303 1.00 0.00 C ATOM 0 H THR A 59 7.964 -6.692 -11.154 1.00 0.00 H new ATOM 0 HA THR A 59 5.329 -7.003 -12.459 1.00 0.00 H new ATOM 0 HB THR A 59 6.278 -7.600 -9.619 1.00 0.00 H new ATOM 0 HG1 THR A 59 6.471 -9.761 -10.459 1.00 0.00 H new ATOM 0 HG21 THR A 59 4.311 -9.103 -9.594 1.00 0.00 H new ATOM 0 HG22 THR A 59 3.823 -7.417 -9.892 1.00 0.00 H new ATOM 0 HG23 THR A 59 3.887 -8.577 -11.241 1.00 0.00 H new ATOM 992 N LEU A 60 6.009 -4.687 -10.252 1.00 0.00 N ATOM 993 CA LEU A 60 5.432 -3.465 -9.597 1.00 0.00 C ATOM 994 C LEU A 60 5.711 -2.218 -10.440 1.00 0.00 C ATOM 995 O LEU A 60 4.844 -1.381 -10.604 1.00 0.00 O ATOM 996 CB LEU A 60 6.060 -3.283 -8.206 1.00 0.00 C ATOM 997 CG LEU A 60 5.315 -4.125 -7.161 1.00 0.00 C ATOM 998 CD1 LEU A 60 3.861 -3.619 -6.970 1.00 0.00 C ATOM 999 CD2 LEU A 60 5.310 -5.594 -7.601 1.00 0.00 C ATOM 0 H LEU A 60 7.014 -4.812 -10.128 1.00 0.00 H new ATOM 0 HA LEU A 60 4.354 -3.597 -9.507 1.00 0.00 H new ATOM 0 HB2 LEU A 60 7.110 -3.575 -8.234 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.029 -2.231 -7.922 1.00 0.00 H new ATOM 0 HG LEU A 60 5.830 -4.031 -6.205 1.00 0.00 H new ATOM 0 HD11 LEU A 60 3.357 -4.234 -6.224 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.878 -2.582 -6.634 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.325 -3.685 -7.917 1.00 0.00 H new ATOM 0 HD21 LEU A 60 4.781 -6.194 -6.860 1.00 0.00 H new ATOM 0 HD22 LEU A 60 4.809 -5.683 -8.565 1.00 0.00 H new ATOM 0 HD23 LEU A 60 6.336 -5.950 -7.691 1.00 0.00 H new ATOM 1011 N ASP A 61 6.889 -2.061 -10.979 1.00 0.00 N ATOM 1012 CA ASP A 61 7.181 -0.851 -11.802 1.00 0.00 C ATOM 1013 C ASP A 61 6.172 -0.731 -12.932 1.00 0.00 C ATOM 1014 O ASP A 61 6.222 -1.441 -13.918 1.00 0.00 O ATOM 1015 CB ASP A 61 8.598 -0.978 -12.370 1.00 0.00 C ATOM 1016 CG ASP A 61 9.121 0.394 -12.797 1.00 0.00 C ATOM 1017 OD1 ASP A 61 8.394 1.361 -12.647 1.00 0.00 O ATOM 1018 OD2 ASP A 61 10.242 0.451 -13.272 1.00 0.00 O ATOM 0 H ASP A 61 7.663 -2.718 -10.885 1.00 0.00 H new ATOM 0 HA ASP A 61 7.109 0.044 -11.184 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.261 -1.411 -11.620 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.596 -1.656 -13.223 1.00 0.00 H new ATOM 1023 N GLU A 62 5.258 0.180 -12.784 1.00 0.00 N ATOM 1024 CA GLU A 62 4.223 0.399 -13.828 1.00 0.00 C ATOM 1025 C GLU A 62 4.734 1.448 -14.800 1.00 0.00 C ATOM 1026 O GLU A 62 4.644 1.302 -16.003 1.00 0.00 O ATOM 1027 CB GLU A 62 2.933 0.884 -13.161 1.00 0.00 C ATOM 1028 CG GLU A 62 1.822 1.027 -14.204 1.00 0.00 C ATOM 1029 CD GLU A 62 0.576 1.608 -13.535 1.00 0.00 C ATOM 1030 OE1 GLU A 62 0.367 1.319 -12.368 1.00 0.00 O ATOM 1031 OE2 GLU A 62 -0.147 2.332 -14.198 1.00 0.00 O ATOM 0 H GLU A 62 5.182 0.792 -11.972 1.00 0.00 H new ATOM 0 HA GLU A 62 4.018 -0.527 -14.364 1.00 0.00 H new ATOM 0 HB2 GLU A 62 2.627 0.179 -12.387 1.00 0.00 H new ATOM 0 HB3 GLU A 62 3.106 1.841 -12.670 1.00 0.00 H new ATOM 0 HG2 GLU A 62 2.150 1.677 -15.015 1.00 0.00 H new ATOM 0 HG3 GLU A 62 1.594 0.057 -14.645 1.00 0.00 H new ATOM 1038 N ASP A 63 5.286 2.503 -14.283 1.00 0.00 N ATOM 1039 CA ASP A 63 5.823 3.561 -15.166 1.00 0.00 C ATOM 1040 C ASP A 63 7.170 3.093 -15.711 1.00 0.00 C ATOM 1041 O ASP A 63 7.796 3.768 -16.505 1.00 0.00 O ATOM 1042 CB ASP A 63 6.014 4.848 -14.361 1.00 0.00 C ATOM 1043 CG ASP A 63 6.648 4.514 -13.009 1.00 0.00 C ATOM 1044 OD1 ASP A 63 7.054 3.376 -12.832 1.00 0.00 O ATOM 1045 OD2 ASP A 63 6.719 5.400 -12.174 1.00 0.00 O ATOM 0 H ASP A 63 5.388 2.677 -13.283 1.00 0.00 H new ATOM 0 HA ASP A 63 5.133 3.755 -15.987 1.00 0.00 H new ATOM 0 HB2 ASP A 63 6.649 5.543 -14.911 1.00 0.00 H new ATOM 0 HB3 ASP A 63 5.054 5.343 -14.212 1.00 0.00 H new ATOM 1050 N GLY A 64 7.631 1.941 -15.290 1.00 0.00 N ATOM 1051 CA GLY A 64 8.942 1.457 -15.798 1.00 0.00 C ATOM 1052 C GLY A 64 10.008 2.475 -15.411 1.00 0.00 C ATOM 1053 O GLY A 64 10.850 2.842 -16.207 1.00 0.00 O ATOM 0 H GLY A 64 7.161 1.326 -14.626 1.00 0.00 H new ATOM 0 HA2 GLY A 64 9.177 0.481 -15.374 1.00 0.00 H new ATOM 0 HA3 GLY A 64 8.908 1.335 -16.881 1.00 0.00 H new ATOM 1057 N ASP A 65 9.966 2.951 -14.193 1.00 0.00 N ATOM 1058 CA ASP A 65 10.970 3.969 -13.750 1.00 0.00 C ATOM 1059 C ASP A 65 12.118 3.280 -13.019 1.00 0.00 C ATOM 1060 O ASP A 65 13.087 3.906 -12.640 1.00 0.00 O ATOM 1061 CB ASP A 65 10.299 4.972 -12.809 1.00 0.00 C ATOM 1062 CG ASP A 65 9.619 4.226 -11.660 1.00 0.00 C ATOM 1063 OD1 ASP A 65 9.849 3.035 -11.535 1.00 0.00 O ATOM 1064 OD2 ASP A 65 8.881 4.860 -10.923 1.00 0.00 O ATOM 0 H ASP A 65 9.282 2.680 -13.486 1.00 0.00 H new ATOM 0 HA ASP A 65 11.360 4.490 -14.624 1.00 0.00 H new ATOM 0 HB2 ASP A 65 11.040 5.668 -12.415 1.00 0.00 H new ATOM 0 HB3 ASP A 65 9.565 5.564 -13.356 1.00 0.00 H new ATOM 1069 N GLY A 66 12.018 1.999 -12.809 1.00 0.00 N ATOM 1070 CA GLY A 66 13.112 1.288 -12.091 1.00 0.00 C ATOM 1071 C GLY A 66 13.127 1.767 -10.646 1.00 0.00 C ATOM 1072 O GLY A 66 14.009 1.438 -9.876 1.00 0.00 O ATOM 0 H GLY A 66 11.233 1.416 -13.100 1.00 0.00 H new ATOM 0 HA2 GLY A 66 12.955 0.210 -12.132 1.00 0.00 H new ATOM 0 HA3 GLY A 66 14.072 1.489 -12.567 1.00 0.00 H new ATOM 1076 N GLU A 67 12.141 2.539 -10.277 1.00 0.00 N ATOM 1077 CA GLU A 67 12.043 3.057 -8.882 1.00 0.00 C ATOM 1078 C GLU A 67 10.640 2.750 -8.370 1.00 0.00 C ATOM 1079 O GLU A 67 9.801 2.272 -9.108 1.00 0.00 O ATOM 1080 CB GLU A 67 12.280 4.567 -8.875 1.00 0.00 C ATOM 1081 CG GLU A 67 13.739 4.854 -9.237 1.00 0.00 C ATOM 1082 CD GLU A 67 13.939 6.360 -9.405 1.00 0.00 C ATOM 1083 OE1 GLU A 67 14.156 7.025 -8.406 1.00 0.00 O ATOM 1084 OE2 GLU A 67 13.875 6.824 -10.532 1.00 0.00 O ATOM 0 H GLU A 67 11.386 2.838 -10.894 1.00 0.00 H new ATOM 0 HA GLU A 67 12.792 2.587 -8.245 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.614 5.054 -9.588 1.00 0.00 H new ATOM 0 HB3 GLU A 67 12.050 4.978 -7.892 1.00 0.00 H new ATOM 0 HG2 GLU A 67 14.399 4.474 -8.457 1.00 0.00 H new ATOM 0 HG3 GLU A 67 14.004 4.337 -10.159 1.00 0.00 H new ATOM 1091 N CYS A 68 10.380 2.997 -7.113 1.00 0.00 N ATOM 1092 CA CYS A 68 9.026 2.695 -6.545 1.00 0.00 C ATOM 1093 C CYS A 68 8.445 3.923 -5.840 1.00 0.00 C ATOM 1094 O CYS A 68 8.681 4.138 -4.666 1.00 0.00 O ATOM 1095 CB CYS A 68 9.161 1.554 -5.535 1.00 0.00 C ATOM 1096 SG CYS A 68 9.539 0.016 -6.412 1.00 0.00 S ATOM 0 H CYS A 68 11.046 3.396 -6.451 1.00 0.00 H new ATOM 0 HA CYS A 68 8.356 2.413 -7.357 1.00 0.00 H new ATOM 0 HB2 CYS A 68 9.950 1.780 -4.818 1.00 0.00 H new ATOM 0 HB3 CYS A 68 8.237 1.444 -4.968 1.00 0.00 H new ATOM 0 HG CYS A 68 8.691 -0.149 -7.383 1.00 0.00 H new ATOM 1102 N ASP A 69 7.694 4.736 -6.546 1.00 0.00 N ATOM 1103 CA ASP A 69 7.093 5.943 -5.909 1.00 0.00 C ATOM 1104 C ASP A 69 6.308 5.505 -4.670 1.00 0.00 C ATOM 1105 O ASP A 69 6.437 4.389 -4.216 1.00 0.00 O ATOM 1106 CB ASP A 69 6.152 6.635 -6.900 1.00 0.00 C ATOM 1107 CG ASP A 69 5.830 8.046 -6.403 1.00 0.00 C ATOM 1108 OD1 ASP A 69 6.228 8.366 -5.295 1.00 0.00 O ATOM 1109 OD2 ASP A 69 5.193 8.782 -7.138 1.00 0.00 O ATOM 0 H ASP A 69 7.474 4.613 -7.534 1.00 0.00 H new ATOM 0 HA ASP A 69 7.879 6.642 -5.622 1.00 0.00 H new ATOM 0 HB2 ASP A 69 6.616 6.683 -7.885 1.00 0.00 H new ATOM 0 HB3 ASP A 69 5.233 6.058 -7.008 1.00 0.00 H new ATOM 1114 N PHE A 70 5.499 6.359 -4.106 1.00 0.00 N ATOM 1115 CA PHE A 70 4.735 5.962 -2.886 1.00 0.00 C ATOM 1116 C PHE A 70 3.526 5.078 -3.245 1.00 0.00 C ATOM 1117 O PHE A 70 3.103 4.253 -2.459 1.00 0.00 O ATOM 1118 CB PHE A 70 4.256 7.231 -2.160 1.00 0.00 C ATOM 1119 CG PHE A 70 3.940 8.320 -3.170 1.00 0.00 C ATOM 1120 CD1 PHE A 70 2.783 8.241 -3.955 1.00 0.00 C ATOM 1121 CD2 PHE A 70 4.806 9.410 -3.317 1.00 0.00 C ATOM 1122 CE1 PHE A 70 2.495 9.248 -4.884 1.00 0.00 C ATOM 1123 CE2 PHE A 70 4.519 10.417 -4.247 1.00 0.00 C ATOM 1124 CZ PHE A 70 3.364 10.336 -5.031 1.00 0.00 C ATOM 0 H PHE A 70 5.333 7.311 -4.434 1.00 0.00 H new ATOM 0 HA PHE A 70 5.391 5.382 -2.237 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.370 7.007 -1.565 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.025 7.577 -1.469 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.112 7.402 -3.844 1.00 0.00 H new ATOM 0 HD2 PHE A 70 5.698 9.475 -2.712 1.00 0.00 H new ATOM 0 HE1 PHE A 70 1.602 9.186 -5.488 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.190 11.256 -4.359 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.142 11.112 -5.749 1.00 0.00 H new ATOM 1134 N GLN A 71 2.948 5.259 -4.399 1.00 0.00 N ATOM 1135 CA GLN A 71 1.749 4.446 -4.766 1.00 0.00 C ATOM 1136 C GLN A 71 2.161 3.027 -5.147 1.00 0.00 C ATOM 1137 O GLN A 71 1.452 2.073 -4.886 1.00 0.00 O ATOM 1138 CB GLN A 71 0.981 5.107 -5.922 1.00 0.00 C ATOM 1139 CG GLN A 71 1.921 5.460 -7.083 1.00 0.00 C ATOM 1140 CD GLN A 71 2.286 4.196 -7.862 1.00 0.00 C ATOM 1141 OE1 GLN A 71 1.657 3.168 -7.708 1.00 0.00 O ATOM 1142 NE2 GLN A 71 3.282 4.233 -8.704 1.00 0.00 N ATOM 0 H GLN A 71 3.250 5.932 -5.104 1.00 0.00 H new ATOM 0 HA GLN A 71 1.092 4.395 -3.898 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.200 4.434 -6.275 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.486 6.010 -5.564 1.00 0.00 H new ATOM 0 HG2 GLN A 71 1.440 6.179 -7.746 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.824 5.934 -6.699 1.00 0.00 H new ATOM 0 HE21 GLN A 71 3.809 5.097 -8.833 1.00 0.00 H new ATOM 0 HE22 GLN A 71 3.533 3.398 -9.234 1.00 0.00 H new ATOM 1151 N GLU A 72 3.304 2.864 -5.736 1.00 0.00 N ATOM 1152 CA GLU A 72 3.755 1.499 -6.109 1.00 0.00 C ATOM 1153 C GLU A 72 4.486 0.894 -4.912 1.00 0.00 C ATOM 1154 O GLU A 72 4.368 -0.279 -4.622 1.00 0.00 O ATOM 1155 CB GLU A 72 4.684 1.626 -7.317 1.00 0.00 C ATOM 1156 CG GLU A 72 5.278 0.267 -7.702 1.00 0.00 C ATOM 1157 CD GLU A 72 6.347 0.480 -8.769 1.00 0.00 C ATOM 1158 OE1 GLU A 72 6.202 1.413 -9.542 1.00 0.00 O ATOM 1159 OE2 GLU A 72 7.293 -0.290 -8.796 1.00 0.00 O ATOM 0 H GLU A 72 3.949 3.617 -5.977 1.00 0.00 H new ATOM 0 HA GLU A 72 2.918 0.851 -6.371 1.00 0.00 H new ATOM 0 HB2 GLU A 72 4.132 2.038 -8.162 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.488 2.326 -7.089 1.00 0.00 H new ATOM 0 HG2 GLU A 72 5.710 -0.217 -6.826 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.496 -0.393 -8.078 1.00 0.00 H new ATOM 1166 N PHE A 73 5.238 1.691 -4.210 1.00 0.00 N ATOM 1167 CA PHE A 73 5.973 1.174 -3.026 1.00 0.00 C ATOM 1168 C PHE A 73 4.970 0.580 -2.036 1.00 0.00 C ATOM 1169 O PHE A 73 5.222 -0.426 -1.408 1.00 0.00 O ATOM 1170 CB PHE A 73 6.727 2.330 -2.369 1.00 0.00 C ATOM 1171 CG PHE A 73 7.226 1.943 -0.991 1.00 0.00 C ATOM 1172 CD1 PHE A 73 7.940 0.752 -0.800 1.00 0.00 C ATOM 1173 CD2 PHE A 73 6.990 2.795 0.097 1.00 0.00 C ATOM 1174 CE1 PHE A 73 8.422 0.423 0.471 1.00 0.00 C ATOM 1175 CE2 PHE A 73 7.466 2.460 1.366 1.00 0.00 C ATOM 1176 CZ PHE A 73 8.184 1.276 1.553 1.00 0.00 C ATOM 0 H PHE A 73 5.376 2.682 -4.406 1.00 0.00 H new ATOM 0 HA PHE A 73 6.681 0.403 -3.328 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.570 2.621 -2.996 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.072 3.198 -2.292 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.118 0.089 -1.634 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.439 3.713 -0.047 1.00 0.00 H new ATOM 0 HE1 PHE A 73 8.979 -0.491 0.617 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.279 3.116 2.203 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.555 1.019 2.534 1.00 0.00 H new ATOM 1186 N MET A 74 3.831 1.192 -1.893 1.00 0.00 N ATOM 1187 CA MET A 74 2.818 0.652 -0.949 1.00 0.00 C ATOM 1188 C MET A 74 2.146 -0.547 -1.617 1.00 0.00 C ATOM 1189 O MET A 74 1.567 -1.389 -0.966 1.00 0.00 O ATOM 1190 CB MET A 74 1.782 1.749 -0.612 1.00 0.00 C ATOM 1191 CG MET A 74 1.947 2.225 0.838 1.00 0.00 C ATOM 1192 SD MET A 74 1.174 1.018 1.951 1.00 0.00 S ATOM 1193 CE MET A 74 -0.141 2.076 2.608 1.00 0.00 C ATOM 0 H MET A 74 3.558 2.041 -2.388 1.00 0.00 H new ATOM 0 HA MET A 74 3.286 0.337 -0.016 1.00 0.00 H new ATOM 0 HB2 MET A 74 1.903 2.592 -1.293 1.00 0.00 H new ATOM 0 HB3 MET A 74 0.774 1.362 -0.760 1.00 0.00 H new ATOM 0 HG2 MET A 74 3.004 2.336 1.079 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.486 3.204 0.967 1.00 0.00 H new ATOM 0 HE1 MET A 74 -0.661 1.554 3.411 1.00 0.00 H new ATOM 0 HE2 MET A 74 0.293 2.998 2.996 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.848 2.314 1.813 1.00 0.00 H new ATOM 1203 N ALA A 75 2.290 -0.659 -2.904 1.00 0.00 N ATOM 1204 CA ALA A 75 1.725 -1.850 -3.605 1.00 0.00 C ATOM 1205 C ALA A 75 2.695 -3.006 -3.389 1.00 0.00 C ATOM 1206 O ALA A 75 2.354 -4.163 -3.535 1.00 0.00 O ATOM 1207 CB ALA A 75 1.562 -1.564 -5.099 1.00 0.00 C ATOM 0 H ALA A 75 2.770 0.014 -3.501 1.00 0.00 H new ATOM 0 HA ALA A 75 0.740 -2.096 -3.209 1.00 0.00 H new ATOM 0 HB1 ALA A 75 1.149 -2.443 -5.595 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.887 -0.719 -5.236 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.534 -1.326 -5.532 1.00 0.00 H new ATOM 1213 N PHE A 76 3.907 -2.687 -3.031 1.00 0.00 N ATOM 1214 CA PHE A 76 4.913 -3.758 -2.794 1.00 0.00 C ATOM 1215 C PHE A 76 4.608 -4.440 -1.460 1.00 0.00 C ATOM 1216 O PHE A 76 4.432 -5.639 -1.403 1.00 0.00 O ATOM 1217 CB PHE A 76 6.330 -3.164 -2.782 1.00 0.00 C ATOM 1218 CG PHE A 76 7.322 -4.190 -2.262 1.00 0.00 C ATOM 1219 CD1 PHE A 76 7.424 -5.447 -2.876 1.00 0.00 C ATOM 1220 CD2 PHE A 76 8.136 -3.884 -1.161 1.00 0.00 C ATOM 1221 CE1 PHE A 76 8.336 -6.392 -2.390 1.00 0.00 C ATOM 1222 CE2 PHE A 76 9.048 -4.830 -0.680 1.00 0.00 C ATOM 1223 CZ PHE A 76 9.147 -6.083 -1.295 1.00 0.00 C ATOM 0 H PHE A 76 4.243 -1.734 -2.893 1.00 0.00 H new ATOM 0 HA PHE A 76 4.861 -4.493 -3.597 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.611 -2.853 -3.788 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.354 -2.273 -2.154 1.00 0.00 H new ATOM 0 HD1 PHE A 76 6.799 -5.686 -3.724 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.059 -2.918 -0.685 1.00 0.00 H new ATOM 0 HE1 PHE A 76 8.413 -7.360 -2.862 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.676 -4.593 0.166 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.851 -6.812 -0.923 1.00 0.00 H new ATOM 1233 N VAL A 77 4.509 -3.692 -0.394 1.00 0.00 N ATOM 1234 CA VAL A 77 4.188 -4.318 0.921 1.00 0.00 C ATOM 1235 C VAL A 77 2.928 -5.170 0.759 1.00 0.00 C ATOM 1236 O VAL A 77 2.767 -6.201 1.378 1.00 0.00 O ATOM 1237 CB VAL A 77 3.933 -3.226 1.962 1.00 0.00 C ATOM 1238 CG1 VAL A 77 3.400 -3.859 3.249 1.00 0.00 C ATOM 1239 CG2 VAL A 77 5.240 -2.496 2.268 1.00 0.00 C ATOM 0 H VAL A 77 4.636 -2.680 -0.376 1.00 0.00 H new ATOM 0 HA VAL A 77 5.022 -4.938 1.251 1.00 0.00 H new ATOM 0 HB VAL A 77 3.201 -2.520 1.570 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.219 -3.080 3.990 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.468 -4.383 3.038 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.133 -4.566 3.638 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.057 -1.718 3.010 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.970 -3.205 2.658 1.00 0.00 H new ATOM 0 HG23 VAL A 77 5.626 -2.043 1.355 1.00 0.00 H new ATOM 1249 N SER A 78 2.038 -4.739 -0.077 1.00 0.00 N ATOM 1250 CA SER A 78 0.790 -5.502 -0.303 1.00 0.00 C ATOM 1251 C SER A 78 1.142 -6.820 -0.983 1.00 0.00 C ATOM 1252 O SER A 78 0.538 -7.842 -0.746 1.00 0.00 O ATOM 1253 CB SER A 78 -0.133 -4.682 -1.211 1.00 0.00 C ATOM 1254 OG SER A 78 0.282 -3.330 -1.177 1.00 0.00 O ATOM 0 H SER A 78 2.122 -3.880 -0.621 1.00 0.00 H new ATOM 0 HA SER A 78 0.286 -5.700 0.643 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.095 -5.063 -2.231 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.167 -4.769 -0.876 1.00 0.00 H new ATOM 0 HG SER A 78 0.411 -3.051 -0.247 1.00 0.00 H new ATOM 1260 N MET A 79 2.126 -6.792 -1.831 1.00 0.00 N ATOM 1261 CA MET A 79 2.528 -8.036 -2.540 1.00 0.00 C ATOM 1262 C MET A 79 3.235 -8.980 -1.569 1.00 0.00 C ATOM 1263 O MET A 79 3.159 -10.186 -1.702 1.00 0.00 O ATOM 1264 CB MET A 79 3.454 -7.694 -3.714 1.00 0.00 C ATOM 1265 CG MET A 79 3.878 -8.981 -4.454 1.00 0.00 C ATOM 1266 SD MET A 79 4.008 -8.644 -6.234 1.00 0.00 S ATOM 1267 CE MET A 79 5.810 -8.738 -6.385 1.00 0.00 C ATOM 0 H MET A 79 2.671 -5.962 -2.065 1.00 0.00 H new ATOM 0 HA MET A 79 1.637 -8.530 -2.928 1.00 0.00 H new ATOM 0 HB2 MET A 79 2.945 -7.021 -4.404 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.337 -7.169 -3.349 1.00 0.00 H new ATOM 0 HG2 MET A 79 4.834 -9.335 -4.070 1.00 0.00 H new ATOM 0 HG3 MET A 79 3.150 -9.772 -4.275 1.00 0.00 H new ATOM 0 HE1 MET A 79 6.119 -8.303 -7.335 1.00 0.00 H new ATOM 0 HE2 MET A 79 6.273 -8.187 -5.566 1.00 0.00 H new ATOM 0 HE3 MET A 79 6.125 -9.781 -6.344 1.00 0.00 H new ATOM 1277 N VAL A 80 3.894 -8.453 -0.570 1.00 0.00 N ATOM 1278 CA VAL A 80 4.564 -9.340 0.423 1.00 0.00 C ATOM 1279 C VAL A 80 3.535 -9.642 1.496 1.00 0.00 C ATOM 1280 O VAL A 80 3.521 -10.704 2.087 1.00 0.00 O ATOM 1281 CB VAL A 80 5.828 -8.663 1.026 1.00 0.00 C ATOM 1282 CG1 VAL A 80 6.414 -7.670 0.025 1.00 0.00 C ATOM 1283 CG2 VAL A 80 5.502 -7.916 2.332 1.00 0.00 C ATOM 0 H VAL A 80 3.996 -7.452 -0.400 1.00 0.00 H new ATOM 0 HA VAL A 80 4.912 -10.258 -0.051 1.00 0.00 H new ATOM 0 HB VAL A 80 6.549 -9.451 1.245 1.00 0.00 H new ATOM 0 HG11 VAL A 80 7.299 -7.200 0.454 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.690 -8.195 -0.890 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.672 -6.905 -0.205 1.00 0.00 H new ATOM 0 HG21 VAL A 80 6.409 -7.456 2.724 1.00 0.00 H new ATOM 0 HG22 VAL A 80 4.760 -7.143 2.133 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.106 -8.620 3.064 1.00 0.00 H new ATOM 1293 N THR A 81 2.658 -8.709 1.741 1.00 0.00 N ATOM 1294 CA THR A 81 1.615 -8.942 2.762 1.00 0.00 C ATOM 1295 C THR A 81 0.588 -9.893 2.176 1.00 0.00 C ATOM 1296 O THR A 81 0.033 -10.724 2.869 1.00 0.00 O ATOM 1297 CB THR A 81 0.936 -7.622 3.125 1.00 0.00 C ATOM 1298 OG1 THR A 81 1.917 -6.680 3.532 1.00 0.00 O ATOM 1299 CG2 THR A 81 -0.064 -7.843 4.260 1.00 0.00 C ATOM 0 H THR A 81 2.623 -7.801 1.278 1.00 0.00 H new ATOM 0 HA THR A 81 2.061 -9.365 3.662 1.00 0.00 H new ATOM 0 HB THR A 81 0.405 -7.242 2.252 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.645 -7.145 3.995 1.00 0.00 H new ATOM 0 HG21 THR A 81 -0.543 -6.897 4.512 1.00 0.00 H new ATOM 0 HG22 THR A 81 -0.821 -8.560 3.943 1.00 0.00 H new ATOM 0 HG23 THR A 81 0.458 -8.230 5.135 1.00 0.00 H new ATOM 1307 N THR A 82 0.308 -9.781 0.902 1.00 0.00 N ATOM 1308 CA THR A 82 -0.707 -10.682 0.290 1.00 0.00 C ATOM 1309 C THR A 82 -0.207 -12.124 0.301 1.00 0.00 C ATOM 1310 O THR A 82 -0.968 -13.047 0.512 1.00 0.00 O ATOM 1311 CB THR A 82 -0.961 -10.233 -1.147 1.00 0.00 C ATOM 1312 OG1 THR A 82 0.283 -10.007 -1.789 1.00 0.00 O ATOM 1313 CG2 THR A 82 -1.792 -8.935 -1.147 1.00 0.00 C ATOM 0 H THR A 82 0.736 -9.109 0.266 1.00 0.00 H new ATOM 0 HA THR A 82 -1.632 -10.632 0.864 1.00 0.00 H new ATOM 0 HB THR A 82 -1.513 -11.007 -1.681 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.635 -9.132 -1.522 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.971 -8.618 -2.174 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.746 -9.114 -0.651 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.247 -8.154 -0.616 1.00 0.00 H new ATOM 1321 N ALA A 83 1.064 -12.341 0.086 1.00 0.00 N ATOM 1322 CA ALA A 83 1.583 -13.735 0.101 1.00 0.00 C ATOM 1323 C ALA A 83 1.479 -14.277 1.525 1.00 0.00 C ATOM 1324 O ALA A 83 1.235 -15.447 1.742 1.00 0.00 O ATOM 1325 CB ALA A 83 3.046 -13.739 -0.346 1.00 0.00 C ATOM 0 H ALA A 83 1.759 -11.617 -0.098 1.00 0.00 H new ATOM 0 HA ALA A 83 1.002 -14.359 -0.578 1.00 0.00 H new ATOM 0 HB1 ALA A 83 3.427 -14.760 -0.335 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.119 -13.335 -1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 83 3.636 -13.125 0.334 1.00 0.00 H new ATOM 1331 N CYS A 84 1.657 -13.426 2.499 1.00 0.00 N ATOM 1332 CA CYS A 84 1.561 -13.881 3.913 1.00 0.00 C ATOM 1333 C CYS A 84 0.120 -14.290 4.205 1.00 0.00 C ATOM 1334 O CYS A 84 -0.136 -15.321 4.796 1.00 0.00 O ATOM 1335 CB CYS A 84 1.970 -12.740 4.846 1.00 0.00 C ATOM 1336 SG CYS A 84 1.723 -13.245 6.565 1.00 0.00 S ATOM 0 H CYS A 84 1.865 -12.435 2.375 1.00 0.00 H new ATOM 0 HA CYS A 84 2.225 -14.730 4.074 1.00 0.00 H new ATOM 0 HB2 CYS A 84 3.015 -12.478 4.680 1.00 0.00 H new ATOM 0 HB3 CYS A 84 1.379 -11.850 4.629 1.00 0.00 H new ATOM 0 HG CYS A 84 2.073 -12.275 7.357 1.00 0.00 H new ATOM 1342 N HIS A 85 -0.828 -13.499 3.786 1.00 0.00 N ATOM 1343 CA HIS A 85 -2.250 -13.857 4.031 1.00 0.00 C ATOM 1344 C HIS A 85 -2.613 -15.038 3.119 1.00 0.00 C ATOM 1345 O HIS A 85 -3.465 -15.842 3.433 1.00 0.00 O ATOM 1346 CB HIS A 85 -3.150 -12.619 3.763 1.00 0.00 C ATOM 1347 CG HIS A 85 -3.881 -12.734 2.445 1.00 0.00 C ATOM 1348 ND1 HIS A 85 -3.250 -12.538 1.227 1.00 0.00 N ATOM 1349 CD2 HIS A 85 -5.187 -13.036 2.147 1.00 0.00 C ATOM 1350 CE1 HIS A 85 -4.168 -12.724 0.261 1.00 0.00 C ATOM 1351 NE2 HIS A 85 -5.365 -13.029 0.768 1.00 0.00 N ATOM 0 H HIS A 85 -0.679 -12.623 3.286 1.00 0.00 H new ATOM 0 HA HIS A 85 -2.407 -14.156 5.067 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -3.873 -12.513 4.572 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -2.538 -11.717 3.762 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -2.269 -12.297 1.088 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -5.958 -13.247 2.873 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -3.962 -12.637 -0.796 1.00 0.00 H new ATOM 1359 N GLU A 86 -1.956 -15.148 1.995 1.00 0.00 N ATOM 1360 CA GLU A 86 -2.247 -16.274 1.065 1.00 0.00 C ATOM 1361 C GLU A 86 -1.788 -17.581 1.708 1.00 0.00 C ATOM 1362 O GLU A 86 -2.525 -18.543 1.780 1.00 0.00 O ATOM 1363 CB GLU A 86 -1.492 -16.053 -0.249 1.00 0.00 C ATOM 1364 CG GLU A 86 -1.908 -17.113 -1.271 1.00 0.00 C ATOM 1365 CD GLU A 86 -3.370 -16.901 -1.668 1.00 0.00 C ATOM 1366 OE1 GLU A 86 -3.749 -15.758 -1.869 1.00 0.00 O ATOM 1367 OE2 GLU A 86 -4.085 -17.884 -1.764 1.00 0.00 O ATOM 0 H GLU A 86 -1.229 -14.505 1.682 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.317 -16.322 0.862 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.704 -15.057 -0.638 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.417 -16.105 -0.075 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -1.269 -17.053 -2.152 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -1.776 -18.110 -0.850 1.00 0.00 H new ATOM 1374 N PHE A 87 -0.576 -17.617 2.182 1.00 0.00 N ATOM 1375 CA PHE A 87 -0.069 -18.856 2.831 1.00 0.00 C ATOM 1376 C PHE A 87 -1.020 -19.246 3.963 1.00 0.00 C ATOM 1377 O PHE A 87 -1.398 -20.392 4.105 1.00 0.00 O ATOM 1378 CB PHE A 87 1.331 -18.602 3.401 1.00 0.00 C ATOM 1379 CG PHE A 87 1.781 -19.807 4.195 1.00 0.00 C ATOM 1380 CD1 PHE A 87 2.360 -20.902 3.543 1.00 0.00 C ATOM 1381 CD2 PHE A 87 1.618 -19.827 5.586 1.00 0.00 C ATOM 1382 CE1 PHE A 87 2.774 -22.018 4.281 1.00 0.00 C ATOM 1383 CE2 PHE A 87 2.032 -20.942 6.323 1.00 0.00 C ATOM 1384 CZ PHE A 87 2.611 -22.038 5.671 1.00 0.00 C ATOM 0 H PHE A 87 0.086 -16.842 2.148 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.016 -19.662 2.099 1.00 0.00 H new ATOM 0 HB2 PHE A 87 2.034 -18.404 2.592 1.00 0.00 H new ATOM 0 HB3 PHE A 87 1.321 -17.717 4.038 1.00 0.00 H new ATOM 0 HD1 PHE A 87 2.488 -20.886 2.471 1.00 0.00 H new ATOM 0 HD2 PHE A 87 1.173 -18.982 6.090 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.219 -22.863 3.777 1.00 0.00 H new ATOM 0 HE2 PHE A 87 1.905 -20.957 7.395 1.00 0.00 H new ATOM 0 HZ PHE A 87 2.931 -22.898 6.240 1.00 0.00 H new ATOM 1394 N PHE A 88 -1.409 -18.297 4.771 1.00 0.00 N ATOM 1395 CA PHE A 88 -2.337 -18.610 5.894 1.00 0.00 C ATOM 1396 C PHE A 88 -3.752 -18.831 5.349 1.00 0.00 C ATOM 1397 O PHE A 88 -4.514 -19.616 5.876 1.00 0.00 O ATOM 1398 CB PHE A 88 -2.350 -17.446 6.885 1.00 0.00 C ATOM 1399 CG PHE A 88 -3.325 -17.748 7.995 1.00 0.00 C ATOM 1400 CD1 PHE A 88 -2.905 -18.472 9.117 1.00 0.00 C ATOM 1401 CD2 PHE A 88 -4.650 -17.306 7.901 1.00 0.00 C ATOM 1402 CE1 PHE A 88 -3.811 -18.755 10.145 1.00 0.00 C ATOM 1403 CE2 PHE A 88 -5.557 -17.588 8.931 1.00 0.00 C ATOM 1404 CZ PHE A 88 -5.137 -18.314 10.052 1.00 0.00 C ATOM 0 H PHE A 88 -1.124 -17.320 4.702 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.999 -19.515 6.398 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -1.352 -17.291 7.294 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -2.633 -16.524 6.377 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.882 -18.812 9.189 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -4.973 -16.748 7.035 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -3.488 -19.314 11.011 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.579 -17.246 8.860 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.836 -18.534 10.845 1.00 0.00 H new ATOM 1414 N GLU A 89 -4.108 -18.142 4.298 1.00 0.00 N ATOM 1415 CA GLU A 89 -5.473 -18.309 3.717 1.00 0.00 C ATOM 1416 C GLU A 89 -5.466 -19.494 2.747 1.00 0.00 C ATOM 1417 O GLU A 89 -6.474 -19.844 2.167 1.00 0.00 O ATOM 1418 CB GLU A 89 -5.860 -17.025 2.972 1.00 0.00 C ATOM 1419 CG GLU A 89 -7.307 -17.111 2.477 1.00 0.00 C ATOM 1420 CD GLU A 89 -7.792 -15.715 2.075 1.00 0.00 C ATOM 1421 OE1 GLU A 89 -7.228 -15.157 1.147 1.00 0.00 O ATOM 1422 OE2 GLU A 89 -8.719 -15.229 2.701 1.00 0.00 O ATOM 0 H GLU A 89 -3.512 -17.469 3.816 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.197 -18.499 4.509 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -5.745 -16.165 3.632 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -5.188 -16.870 2.127 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.372 -17.789 1.626 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.947 -17.519 3.260 1.00 0.00 H new ATOM 1429 N HIS A 90 -4.336 -20.122 2.570 1.00 0.00 N ATOM 1430 CA HIS A 90 -4.271 -21.285 1.642 1.00 0.00 C ATOM 1431 C HIS A 90 -5.092 -22.442 2.215 1.00 0.00 C ATOM 1432 O HIS A 90 -4.649 -23.150 3.098 1.00 0.00 O ATOM 1433 CB HIS A 90 -2.817 -21.730 1.477 1.00 0.00 C ATOM 1434 CG HIS A 90 -2.744 -22.835 0.458 1.00 0.00 C ATOM 1435 ND1 HIS A 90 -2.116 -24.044 0.720 1.00 0.00 N ATOM 1436 CD2 HIS A 90 -3.221 -22.928 -0.827 1.00 0.00 C ATOM 1437 CE1 HIS A 90 -2.231 -24.808 -0.383 1.00 0.00 C ATOM 1438 NE2 HIS A 90 -2.894 -24.173 -1.351 1.00 0.00 N ATOM 0 H HIS A 90 -3.457 -19.880 3.027 1.00 0.00 H new ATOM 0 HA HIS A 90 -4.675 -20.995 0.672 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -2.201 -20.888 1.161 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -2.420 -22.074 2.432 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -3.765 -22.154 -1.349 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -1.836 -25.809 -0.473 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -3.115 -24.527 -2.282 1.00 0.00 H new ATOM 1447 N GLU A 91 -6.284 -22.642 1.720 1.00 0.00 N ATOM 1448 CA GLU A 91 -7.134 -23.756 2.236 1.00 0.00 C ATOM 1449 C GLU A 91 -6.817 -25.039 1.464 1.00 0.00 C ATOM 1450 O GLU A 91 -6.780 -24.980 0.246 1.00 0.00 O ATOM 1451 CB GLU A 91 -8.611 -23.403 2.045 1.00 0.00 C ATOM 1452 CG GLU A 91 -9.480 -24.528 2.609 1.00 0.00 C ATOM 1453 CD GLU A 91 -10.944 -24.085 2.627 1.00 0.00 C ATOM 1454 OE1 GLU A 91 -11.181 -22.889 2.609 1.00 0.00 O ATOM 1455 OE2 GLU A 91 -11.804 -24.950 2.660 1.00 0.00 O ATOM 1456 OXT GLU A 91 -6.619 -26.058 2.104 1.00 0.00 O ATOM 0 H GLU A 91 -6.707 -22.082 0.980 1.00 0.00 H new ATOM 0 HA GLU A 91 -6.929 -23.906 3.296 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -8.840 -22.464 2.549 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -8.827 -23.257 0.987 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -9.369 -25.426 2.002 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -9.154 -24.782 3.618 1.00 0.00 H new TER 1463 GLU A 91 ATOM 1464 N MET B 0 11.169 -4.180 16.436 1.00 0.00 N ATOM 1465 CA MET B 0 11.011 -2.792 15.916 1.00 0.00 C ATOM 1466 C MET B 0 10.579 -2.853 14.445 1.00 0.00 C ATOM 1467 O MET B 0 11.221 -2.292 13.579 1.00 0.00 O ATOM 1468 CB MET B 0 12.354 -2.049 16.046 1.00 0.00 C ATOM 1469 CG MET B 0 12.122 -0.539 16.187 1.00 0.00 C ATOM 1470 SD MET B 0 10.903 0.015 14.968 1.00 0.00 S ATOM 1471 CE MET B 0 10.537 1.617 15.724 1.00 0.00 C ATOM 0 H1 MET B 0 11.462 -4.146 17.433 1.00 0.00 H new ATOM 0 H2 MET B 0 10.263 -4.685 16.358 1.00 0.00 H new ATOM 0 H3 MET B 0 11.892 -4.679 15.880 1.00 0.00 H new ATOM 0 HA MET B 0 10.252 -2.259 16.489 1.00 0.00 H new ATOM 0 HB2 MET B 0 12.900 -2.421 16.913 1.00 0.00 H new ATOM 0 HB3 MET B 0 12.972 -2.248 15.171 1.00 0.00 H new ATOM 0 HG2 MET B 0 11.773 -0.309 17.194 1.00 0.00 H new ATOM 0 HG3 MET B 0 13.061 -0.003 16.045 1.00 0.00 H new ATOM 0 HE1 MET B 0 9.933 2.213 15.040 1.00 0.00 H new ATOM 0 HE2 MET B 0 9.988 1.464 16.653 1.00 0.00 H new ATOM 0 HE3 MET B 0 11.469 2.141 15.935 1.00 0.00 H new ATOM 1483 N SER B 1 9.497 -3.536 14.160 1.00 0.00 N ATOM 1484 CA SER B 1 9.011 -3.650 12.748 1.00 0.00 C ATOM 1485 C SER B 1 7.749 -2.799 12.561 1.00 0.00 C ATOM 1486 O SER B 1 6.649 -3.306 12.486 1.00 0.00 O ATOM 1487 CB SER B 1 8.688 -5.113 12.444 1.00 0.00 C ATOM 1488 OG SER B 1 9.796 -5.922 12.821 1.00 0.00 O ATOM 0 H SER B 1 8.925 -4.023 14.850 1.00 0.00 H new ATOM 0 HA SER B 1 9.786 -3.294 12.069 1.00 0.00 H new ATOM 0 HB2 SER B 1 7.795 -5.422 12.987 1.00 0.00 H new ATOM 0 HB3 SER B 1 8.475 -5.238 11.382 1.00 0.00 H new ATOM 0 HG SER B 1 9.595 -6.862 12.630 1.00 0.00 H new ATOM 1494 N GLU B 2 7.907 -1.506 12.479 1.00 0.00 N ATOM 1495 CA GLU B 2 6.718 -0.622 12.289 1.00 0.00 C ATOM 1496 C GLU B 2 5.878 -1.163 11.128 1.00 0.00 C ATOM 1497 O GLU B 2 4.670 -1.024 11.099 1.00 0.00 O ATOM 1498 CB GLU B 2 7.166 0.810 11.973 1.00 0.00 C ATOM 1499 CG GLU B 2 7.679 1.474 13.253 1.00 0.00 C ATOM 1500 CD GLU B 2 7.970 2.953 12.982 1.00 0.00 C ATOM 1501 OE1 GLU B 2 8.575 3.240 11.962 1.00 0.00 O ATOM 1502 OE2 GLU B 2 7.582 3.772 13.799 1.00 0.00 O ATOM 0 H GLU B 2 8.804 -1.023 12.535 1.00 0.00 H new ATOM 0 HA GLU B 2 6.127 -0.610 13.205 1.00 0.00 H new ATOM 0 HB2 GLU B 2 7.950 0.799 11.216 1.00 0.00 H new ATOM 0 HB3 GLU B 2 6.334 1.381 11.562 1.00 0.00 H new ATOM 0 HG2 GLU B 2 6.938 1.378 14.047 1.00 0.00 H new ATOM 0 HG3 GLU B 2 8.583 0.972 13.598 1.00 0.00 H new ATOM 1509 N LEU B 3 6.515 -1.780 10.171 1.00 0.00 N ATOM 1510 CA LEU B 3 5.770 -2.334 9.003 1.00 0.00 C ATOM 1511 C LEU B 3 4.937 -3.550 9.448 1.00 0.00 C ATOM 1512 O LEU B 3 4.006 -3.948 8.779 1.00 0.00 O ATOM 1513 CB LEU B 3 6.784 -2.763 7.916 1.00 0.00 C ATOM 1514 CG LEU B 3 6.899 -1.717 6.785 1.00 0.00 C ATOM 1515 CD1 LEU B 3 5.714 -1.857 5.820 1.00 0.00 C ATOM 1516 CD2 LEU B 3 6.951 -0.285 7.356 1.00 0.00 C ATOM 0 H LEU B 3 7.524 -1.925 10.147 1.00 0.00 H new ATOM 0 HA LEU B 3 5.100 -1.575 8.600 1.00 0.00 H new ATOM 0 HB2 LEU B 3 7.763 -2.912 8.372 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.479 -3.721 7.494 1.00 0.00 H new ATOM 0 HG LEU B 3 7.828 -1.900 6.244 1.00 0.00 H new ATOM 0 HD11 LEU B 3 5.802 -1.116 5.025 1.00 0.00 H new ATOM 0 HD12 LEU B 3 5.715 -2.857 5.386 1.00 0.00 H new ATOM 0 HD13 LEU B 3 4.782 -1.698 6.363 1.00 0.00 H new ATOM 0 HD21 LEU B 3 7.032 0.430 6.538 1.00 0.00 H new ATOM 0 HD22 LEU B 3 6.042 -0.086 7.923 1.00 0.00 H new ATOM 0 HD23 LEU B 3 7.816 -0.186 8.011 1.00 0.00 H new ATOM 1528 N GLU B 4 5.254 -4.136 10.571 1.00 0.00 N ATOM 1529 CA GLU B 4 4.465 -5.310 11.042 1.00 0.00 C ATOM 1530 C GLU B 4 3.124 -4.805 11.559 1.00 0.00 C ATOM 1531 O GLU B 4 2.122 -5.489 11.517 1.00 0.00 O ATOM 1532 CB GLU B 4 5.224 -6.021 12.168 1.00 0.00 C ATOM 1533 CG GLU B 4 4.347 -7.120 12.789 1.00 0.00 C ATOM 1534 CD GLU B 4 3.415 -6.514 13.844 1.00 0.00 C ATOM 1535 OE1 GLU B 4 3.875 -5.673 14.599 1.00 0.00 O ATOM 1536 OE2 GLU B 4 2.260 -6.899 13.879 1.00 0.00 O ATOM 0 H GLU B 4 6.022 -3.854 11.180 1.00 0.00 H new ATOM 0 HA GLU B 4 4.310 -6.015 10.226 1.00 0.00 H new ATOM 0 HB2 GLU B 4 6.144 -6.457 11.778 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.513 -5.300 12.933 1.00 0.00 H new ATOM 0 HG2 GLU B 4 3.760 -7.611 12.012 1.00 0.00 H new ATOM 0 HG3 GLU B 4 4.976 -7.885 13.244 1.00 0.00 H new ATOM 1543 N LYS B 5 3.109 -3.595 12.032 1.00 0.00 N ATOM 1544 CA LYS B 5 1.845 -3.005 12.544 1.00 0.00 C ATOM 1545 C LYS B 5 0.916 -2.772 11.355 1.00 0.00 C ATOM 1546 O LYS B 5 -0.261 -3.072 11.395 1.00 0.00 O ATOM 1547 CB LYS B 5 2.123 -1.652 13.245 1.00 0.00 C ATOM 1548 CG LYS B 5 3.460 -1.668 14.008 1.00 0.00 C ATOM 1549 CD LYS B 5 3.391 -2.616 15.222 1.00 0.00 C ATOM 1550 CE LYS B 5 4.790 -3.144 15.543 1.00 0.00 C ATOM 1551 NZ LYS B 5 4.711 -4.105 16.680 1.00 0.00 N ATOM 0 H LYS B 5 3.924 -2.984 12.087 1.00 0.00 H new ATOM 0 HA LYS B 5 1.391 -3.683 13.267 1.00 0.00 H new ATOM 0 HB2 LYS B 5 2.138 -0.854 12.503 1.00 0.00 H new ATOM 0 HB3 LYS B 5 1.312 -1.428 13.938 1.00 0.00 H new ATOM 0 HG2 LYS B 5 4.261 -1.985 13.340 1.00 0.00 H new ATOM 0 HG3 LYS B 5 3.704 -0.660 14.343 1.00 0.00 H new ATOM 0 HD2 LYS B 5 2.984 -2.089 16.085 1.00 0.00 H new ATOM 0 HD3 LYS B 5 2.718 -3.447 15.009 1.00 0.00 H new ATOM 0 HE2 LYS B 5 5.215 -3.635 14.667 1.00 0.00 H new ATOM 0 HE3 LYS B 5 5.453 -2.317 15.798 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 5.653 -4.216 17.106 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 4.048 -3.743 17.395 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 4.377 -5.027 16.333 1.00 0.00 H new ATOM 1565 N ALA B 6 1.447 -2.216 10.305 1.00 0.00 N ATOM 1566 CA ALA B 6 0.618 -1.926 9.105 1.00 0.00 C ATOM 1567 C ALA B 6 0.106 -3.215 8.467 1.00 0.00 C ATOM 1568 O ALA B 6 -1.078 -3.385 8.254 1.00 0.00 O ATOM 1569 CB ALA B 6 1.471 -1.168 8.087 1.00 0.00 C ATOM 0 H ALA B 6 2.428 -1.948 10.226 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.241 -1.328 9.410 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.873 -0.950 7.202 1.00 0.00 H new ATOM 0 HB2 ALA B 6 1.820 -0.235 8.528 1.00 0.00 H new ATOM 0 HB3 ALA B 6 2.328 -1.779 7.804 1.00 0.00 H new ATOM 1575 N MET B 7 0.983 -4.109 8.134 1.00 0.00 N ATOM 1576 CA MET B 7 0.539 -5.370 7.481 1.00 0.00 C ATOM 1577 C MET B 7 -0.562 -6.041 8.302 1.00 0.00 C ATOM 1578 O MET B 7 -1.493 -6.595 7.758 1.00 0.00 O ATOM 1579 CB MET B 7 1.721 -6.342 7.353 1.00 0.00 C ATOM 1580 CG MET B 7 2.761 -5.818 6.345 1.00 0.00 C ATOM 1581 SD MET B 7 3.605 -7.229 5.573 1.00 0.00 S ATOM 1582 CE MET B 7 5.310 -6.635 5.716 1.00 0.00 C ATOM 0 H MET B 7 1.988 -4.025 8.284 1.00 0.00 H new ATOM 0 HA MET B 7 0.154 -5.121 6.492 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.191 -6.479 8.327 1.00 0.00 H new ATOM 0 HB3 MET B 7 1.360 -7.319 7.033 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.273 -5.209 5.584 1.00 0.00 H new ATOM 0 HG3 MET B 7 3.484 -5.178 6.850 1.00 0.00 H new ATOM 0 HE1 MET B 7 5.975 -7.302 5.167 1.00 0.00 H new ATOM 0 HE2 MET B 7 5.381 -5.630 5.301 1.00 0.00 H new ATOM 0 HE3 MET B 7 5.602 -6.615 6.766 1.00 0.00 H new ATOM 1592 N VAL B 8 -0.470 -6.013 9.599 1.00 0.00 N ATOM 1593 CA VAL B 8 -1.529 -6.677 10.417 1.00 0.00 C ATOM 1594 C VAL B 8 -2.772 -5.791 10.454 1.00 0.00 C ATOM 1595 O VAL B 8 -3.889 -6.262 10.356 1.00 0.00 O ATOM 1596 CB VAL B 8 -1.004 -6.922 11.839 1.00 0.00 C ATOM 1597 CG1 VAL B 8 -2.160 -7.332 12.761 1.00 0.00 C ATOM 1598 CG2 VAL B 8 0.034 -8.047 11.803 1.00 0.00 C ATOM 0 H VAL B 8 0.280 -5.567 10.127 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.791 -7.636 9.971 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.550 -6.006 12.218 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.779 -7.504 13.768 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.905 -6.537 12.786 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -2.618 -8.247 12.385 1.00 0.00 H new ATOM 0 HG21 VAL B 8 0.411 -8.226 12.810 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -0.429 -8.957 11.421 1.00 0.00 H new ATOM 0 HG23 VAL B 8 0.860 -7.760 11.152 1.00 0.00 H new ATOM 1608 N ALA B 9 -2.587 -4.515 10.597 1.00 0.00 N ATOM 1609 CA ALA B 9 -3.753 -3.599 10.644 1.00 0.00 C ATOM 1610 C ALA B 9 -4.539 -3.686 9.331 1.00 0.00 C ATOM 1611 O ALA B 9 -5.751 -3.583 9.317 1.00 0.00 O ATOM 1612 CB ALA B 9 -3.262 -2.166 10.852 1.00 0.00 C ATOM 0 H ALA B 9 -1.676 -4.064 10.684 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.405 -3.887 11.469 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.116 -1.490 10.887 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -2.711 -2.103 11.790 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -2.608 -1.882 10.027 1.00 0.00 H new ATOM 1618 N LEU B 10 -3.866 -3.859 8.221 1.00 0.00 N ATOM 1619 CA LEU B 10 -4.599 -3.930 6.921 1.00 0.00 C ATOM 1620 C LEU B 10 -5.206 -5.324 6.712 1.00 0.00 C ATOM 1621 O LEU B 10 -6.346 -5.441 6.346 1.00 0.00 O ATOM 1622 CB LEU B 10 -3.634 -3.582 5.768 1.00 0.00 C ATOM 1623 CG LEU B 10 -3.665 -2.070 5.497 1.00 0.00 C ATOM 1624 CD1 LEU B 10 -3.186 -1.314 6.736 1.00 0.00 C ATOM 1625 CD2 LEU B 10 -2.751 -1.741 4.318 1.00 0.00 C ATOM 0 H LEU B 10 -2.852 -3.953 8.159 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.416 -3.209 6.936 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.621 -3.894 6.024 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -3.918 -4.127 4.868 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.686 -1.770 5.261 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -3.209 -0.242 6.540 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -3.840 -1.543 7.577 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.167 -1.617 6.976 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -2.775 -0.668 4.128 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -1.731 -2.046 4.552 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -3.094 -2.274 3.432 1.00 0.00 H new ATOM 1637 N ILE B 11 -4.464 -6.375 6.919 1.00 0.00 N ATOM 1638 CA ILE B 11 -5.019 -7.748 6.696 1.00 0.00 C ATOM 1639 C ILE B 11 -6.418 -7.855 7.317 1.00 0.00 C ATOM 1640 O ILE B 11 -7.275 -8.556 6.815 1.00 0.00 O ATOM 1641 CB ILE B 11 -4.079 -8.785 7.336 1.00 0.00 C ATOM 1642 CG1 ILE B 11 -2.828 -8.930 6.463 1.00 0.00 C ATOM 1643 CG2 ILE B 11 -4.777 -10.148 7.441 1.00 0.00 C ATOM 1644 CD1 ILE B 11 -1.722 -9.627 7.258 1.00 0.00 C ATOM 0 H ILE B 11 -3.494 -6.347 7.234 1.00 0.00 H new ATOM 0 HA ILE B 11 -5.096 -7.939 5.626 1.00 0.00 H new ATOM 0 HB ILE B 11 -3.807 -8.448 8.336 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.063 -9.505 5.567 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -2.488 -7.949 6.132 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -4.099 -10.870 7.896 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -5.671 -10.052 8.057 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -5.057 -10.491 6.445 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -0.834 -9.728 6.634 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -1.480 -9.035 8.140 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -2.063 -10.615 7.567 1.00 0.00 H new ATOM 1656 N ASP B 12 -6.660 -7.167 8.397 1.00 0.00 N ATOM 1657 CA ASP B 12 -8.012 -7.244 9.027 1.00 0.00 C ATOM 1658 C ASP B 12 -9.000 -6.380 8.238 1.00 0.00 C ATOM 1659 O ASP B 12 -10.050 -6.831 7.833 1.00 0.00 O ATOM 1660 CB ASP B 12 -7.936 -6.733 10.468 1.00 0.00 C ATOM 1661 CG ASP B 12 -6.720 -7.342 11.166 1.00 0.00 C ATOM 1662 OD1 ASP B 12 -6.161 -8.284 10.628 1.00 0.00 O ATOM 1663 OD2 ASP B 12 -6.369 -6.857 12.229 1.00 0.00 O ATOM 0 H ASP B 12 -5.990 -6.560 8.869 1.00 0.00 H new ATOM 0 HA ASP B 12 -8.350 -8.280 9.022 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.865 -5.645 10.475 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -8.846 -6.997 11.006 1.00 0.00 H new ATOM 1668 N VAL B 13 -8.666 -5.142 8.012 1.00 0.00 N ATOM 1669 CA VAL B 13 -9.580 -4.244 7.249 1.00 0.00 C ATOM 1670 C VAL B 13 -9.545 -4.618 5.764 1.00 0.00 C ATOM 1671 O VAL B 13 -10.474 -4.364 5.023 1.00 0.00 O ATOM 1672 CB VAL B 13 -9.133 -2.789 7.444 1.00 0.00 C ATOM 1673 CG1 VAL B 13 -10.025 -1.850 6.633 1.00 0.00 C ATOM 1674 CG2 VAL B 13 -9.239 -2.425 8.926 1.00 0.00 C ATOM 0 H VAL B 13 -7.796 -4.710 8.323 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.601 -4.356 7.613 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.102 -2.685 7.105 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -9.698 -0.821 6.780 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -9.956 -2.106 5.576 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.058 -1.953 6.965 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.923 -1.392 9.070 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.272 -2.538 9.255 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.598 -3.086 9.510 1.00 0.00 H new ATOM 1684 N PHE B 14 -8.464 -5.201 5.326 1.00 0.00 N ATOM 1685 CA PHE B 14 -8.353 -5.573 3.884 1.00 0.00 C ATOM 1686 C PHE B 14 -9.403 -6.636 3.516 1.00 0.00 C ATOM 1687 O PHE B 14 -10.208 -6.437 2.627 1.00 0.00 O ATOM 1688 CB PHE B 14 -6.934 -6.106 3.616 1.00 0.00 C ATOM 1689 CG PHE B 14 -6.873 -6.932 2.344 1.00 0.00 C ATOM 1690 CD1 PHE B 14 -7.653 -6.594 1.228 1.00 0.00 C ATOM 1691 CD2 PHE B 14 -6.024 -8.046 2.287 1.00 0.00 C ATOM 1692 CE1 PHE B 14 -7.582 -7.368 0.064 1.00 0.00 C ATOM 1693 CE2 PHE B 14 -5.955 -8.819 1.123 1.00 0.00 C ATOM 1694 CZ PHE B 14 -6.734 -8.480 0.012 1.00 0.00 C ATOM 0 H PHE B 14 -7.654 -5.436 5.900 1.00 0.00 H new ATOM 0 HA PHE B 14 -8.537 -4.693 3.267 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -6.240 -5.269 3.540 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -6.609 -6.714 4.460 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -8.308 -5.736 1.267 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -5.421 -8.308 3.144 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -8.182 -7.107 -0.795 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -5.300 -9.677 1.082 1.00 0.00 H new ATOM 0 HZ PHE B 14 -6.681 -9.077 -0.887 1.00 0.00 H new ATOM 1704 N HIS B 15 -9.392 -7.769 4.168 1.00 0.00 N ATOM 1705 CA HIS B 15 -10.380 -8.841 3.819 1.00 0.00 C ATOM 1706 C HIS B 15 -11.750 -8.568 4.469 1.00 0.00 C ATOM 1707 O HIS B 15 -12.768 -9.003 3.966 1.00 0.00 O ATOM 1708 CB HIS B 15 -9.825 -10.216 4.267 1.00 0.00 C ATOM 1709 CG HIS B 15 -9.224 -10.943 3.084 1.00 0.00 C ATOM 1710 ND1 HIS B 15 -8.075 -10.499 2.446 1.00 0.00 N ATOM 1711 CD2 HIS B 15 -9.616 -12.071 2.403 1.00 0.00 C ATOM 1712 CE1 HIS B 15 -7.820 -11.348 1.432 1.00 0.00 C ATOM 1713 NE2 HIS B 15 -8.728 -12.324 1.361 1.00 0.00 N ATOM 0 H HIS B 15 -8.747 -8.001 4.923 1.00 0.00 H new ATOM 0 HA HIS B 15 -10.527 -8.846 2.739 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.070 -10.078 5.041 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.624 -10.815 4.704 1.00 0.00 H new ATOM 0 HD1 HIS B 15 -7.524 -9.679 2.699 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -10.482 -12.671 2.641 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -6.982 -11.251 0.758 1.00 0.00 H new ATOM 1721 N GLN B 16 -11.804 -7.867 5.570 1.00 0.00 N ATOM 1722 CA GLN B 16 -13.135 -7.610 6.199 1.00 0.00 C ATOM 1723 C GLN B 16 -14.023 -6.863 5.200 1.00 0.00 C ATOM 1724 O GLN B 16 -15.195 -7.154 5.044 1.00 0.00 O ATOM 1725 CB GLN B 16 -12.955 -6.761 7.466 1.00 0.00 C ATOM 1726 CG GLN B 16 -12.517 -7.657 8.629 1.00 0.00 C ATOM 1727 CD GLN B 16 -11.947 -6.794 9.757 1.00 0.00 C ATOM 1728 OE1 GLN B 16 -12.011 -5.492 9.663 1.00 0.00 O flip ATOM 1729 NE2 GLN B 16 -11.442 -7.307 10.736 1.00 0.00 N flip ATOM 0 H GLN B 16 -11.001 -7.467 6.055 1.00 0.00 H new ATOM 0 HA GLN B 16 -13.602 -8.557 6.470 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.210 -5.984 7.292 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.889 -6.257 7.714 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -13.365 -8.236 8.994 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -11.766 -8.370 8.289 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -11.391 -8.323 10.811 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -11.069 -6.722 11.483 1.00 0.00 H new ATOM 1738 N TYR B 17 -13.465 -5.915 4.509 1.00 0.00 N ATOM 1739 CA TYR B 17 -14.265 -5.157 3.508 1.00 0.00 C ATOM 1740 C TYR B 17 -14.416 -6.009 2.249 1.00 0.00 C ATOM 1741 O TYR B 17 -15.485 -6.101 1.680 1.00 0.00 O ATOM 1742 CB TYR B 17 -13.560 -3.826 3.192 1.00 0.00 C ATOM 1743 CG TYR B 17 -14.043 -2.754 4.148 1.00 0.00 C ATOM 1744 CD1 TYR B 17 -13.515 -2.678 5.442 1.00 0.00 C ATOM 1745 CD2 TYR B 17 -15.028 -1.844 3.739 1.00 0.00 C ATOM 1746 CE1 TYR B 17 -13.970 -1.692 6.327 1.00 0.00 C ATOM 1747 CE2 TYR B 17 -15.483 -0.860 4.625 1.00 0.00 C ATOM 1748 CZ TYR B 17 -14.955 -0.784 5.919 1.00 0.00 C ATOM 1749 OH TYR B 17 -15.405 0.185 6.793 1.00 0.00 O ATOM 0 H TYR B 17 -12.489 -5.630 4.592 1.00 0.00 H new ATOM 0 HA TYR B 17 -15.256 -4.934 3.903 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -12.480 -3.945 3.279 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -13.766 -3.529 2.163 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -12.757 -3.379 5.758 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -15.436 -1.902 2.741 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.561 -1.632 7.325 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -16.242 -0.159 4.310 1.00 0.00 H new ATOM 0 HH TYR B 17 -14.840 0.982 6.717 1.00 0.00 H new ATOM 1759 N SER B 18 -13.371 -6.656 1.821 1.00 0.00 N ATOM 1760 CA SER B 18 -13.495 -7.515 0.618 1.00 0.00 C ATOM 1761 C SER B 18 -14.554 -8.580 0.911 1.00 0.00 C ATOM 1762 O SER B 18 -15.361 -8.923 0.071 1.00 0.00 O ATOM 1763 CB SER B 18 -12.147 -8.188 0.324 1.00 0.00 C ATOM 1764 OG SER B 18 -12.110 -9.468 0.945 1.00 0.00 O ATOM 0 H SER B 18 -12.445 -6.627 2.248 1.00 0.00 H new ATOM 0 HA SER B 18 -13.783 -6.921 -0.249 1.00 0.00 H new ATOM 0 HB2 SER B 18 -12.006 -8.290 -0.752 1.00 0.00 H new ATOM 0 HB3 SER B 18 -11.331 -7.568 0.695 1.00 0.00 H new ATOM 0 HG SER B 18 -12.230 -9.366 1.912 1.00 0.00 H new ATOM 1770 N GLY B 19 -14.551 -9.102 2.111 1.00 0.00 N ATOM 1771 CA GLY B 19 -15.544 -10.149 2.486 1.00 0.00 C ATOM 1772 C GLY B 19 -16.871 -9.505 2.901 1.00 0.00 C ATOM 1773 O GLY B 19 -17.783 -10.183 3.330 1.00 0.00 O ATOM 0 H GLY B 19 -13.898 -8.845 2.851 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.707 -10.822 1.644 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.154 -10.752 3.306 1.00 0.00 H new ATOM 1777 N ARG B 20 -17.003 -8.213 2.761 1.00 0.00 N ATOM 1778 CA ARG B 20 -18.292 -7.561 3.133 1.00 0.00 C ATOM 1779 C ARG B 20 -19.368 -8.014 2.152 1.00 0.00 C ATOM 1780 O ARG B 20 -20.437 -8.444 2.536 1.00 0.00 O ATOM 1781 CB ARG B 20 -18.138 -6.035 3.053 1.00 0.00 C ATOM 1782 CG ARG B 20 -19.473 -5.338 3.358 1.00 0.00 C ATOM 1783 CD ARG B 20 -19.323 -3.830 3.144 1.00 0.00 C ATOM 1784 NE ARG B 20 -20.479 -3.127 3.768 1.00 0.00 N ATOM 1785 CZ ARG B 20 -20.840 -1.945 3.343 1.00 0.00 C ATOM 1786 NH1 ARG B 20 -20.178 -1.365 2.379 1.00 0.00 N ATOM 1787 NH2 ARG B 20 -21.862 -1.343 3.886 1.00 0.00 N ATOM 0 H ARG B 20 -16.281 -7.585 2.408 1.00 0.00 H new ATOM 0 HA ARG B 20 -18.570 -7.840 4.149 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -17.379 -5.703 3.761 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -17.792 -5.751 2.059 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -20.257 -5.732 2.711 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -19.775 -5.542 4.385 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -18.389 -3.480 3.584 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -19.278 -3.605 2.078 1.00 0.00 H new ATOM 0 HE ARG B 20 -20.991 -3.570 4.531 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -19.377 -1.834 1.956 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -20.461 -0.442 2.049 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -22.378 -1.795 4.641 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -22.145 -0.420 3.556 1.00 0.00 H new ATOM 1801 N GLU B 21 -19.094 -7.907 0.885 1.00 0.00 N ATOM 1802 CA GLU B 21 -20.106 -8.316 -0.132 1.00 0.00 C ATOM 1803 C GLU B 21 -19.421 -8.671 -1.451 1.00 0.00 C ATOM 1804 O GLU B 21 -18.298 -8.284 -1.709 1.00 0.00 O ATOM 1805 CB GLU B 21 -21.071 -7.153 -0.370 1.00 0.00 C ATOM 1806 CG GLU B 21 -20.271 -5.896 -0.727 1.00 0.00 C ATOM 1807 CD GLU B 21 -21.230 -4.732 -0.980 1.00 0.00 C ATOM 1808 OE1 GLU B 21 -21.827 -4.265 -0.023 1.00 0.00 O ATOM 1809 OE2 GLU B 21 -21.351 -4.325 -2.124 1.00 0.00 O ATOM 0 H GLU B 21 -18.215 -7.555 0.507 1.00 0.00 H new ATOM 0 HA GLU B 21 -20.646 -9.189 0.235 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -21.763 -7.399 -1.176 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -21.671 -6.975 0.522 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -19.586 -5.646 0.083 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -19.663 -6.079 -1.613 1.00 0.00 H new ATOM 1816 N GLY B 22 -20.104 -9.395 -2.296 1.00 0.00 N ATOM 1817 CA GLY B 22 -19.517 -9.767 -3.614 1.00 0.00 C ATOM 1818 C GLY B 22 -18.317 -10.696 -3.424 1.00 0.00 C ATOM 1819 O GLY B 22 -18.083 -11.222 -2.355 1.00 0.00 O ATOM 0 H GLY B 22 -21.047 -9.746 -2.129 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -20.271 -10.259 -4.229 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -19.208 -8.868 -4.147 1.00 0.00 H new ATOM 1823 N ASP B 23 -17.559 -10.907 -4.469 1.00 0.00 N ATOM 1824 CA ASP B 23 -16.374 -11.808 -4.377 1.00 0.00 C ATOM 1825 C ASP B 23 -15.365 -11.252 -3.368 1.00 0.00 C ATOM 1826 O ASP B 23 -14.963 -10.108 -3.437 1.00 0.00 O ATOM 1827 CB ASP B 23 -15.714 -11.909 -5.754 1.00 0.00 C ATOM 1828 CG ASP B 23 -16.790 -12.129 -6.819 1.00 0.00 C ATOM 1829 OD1 ASP B 23 -17.126 -13.277 -7.065 1.00 0.00 O ATOM 1830 OD2 ASP B 23 -17.260 -11.148 -7.370 1.00 0.00 O ATOM 0 H ASP B 23 -17.712 -10.491 -5.387 1.00 0.00 H new ATOM 0 HA ASP B 23 -16.698 -12.795 -4.046 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -15.155 -10.998 -5.969 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -15.000 -12.732 -5.768 1.00 0.00 H new ATOM 1835 N LYS B 24 -14.950 -12.062 -2.432 1.00 0.00 N ATOM 1836 CA LYS B 24 -13.965 -11.597 -1.415 1.00 0.00 C ATOM 1837 C LYS B 24 -12.572 -11.506 -2.041 1.00 0.00 C ATOM 1838 O LYS B 24 -12.354 -11.955 -3.147 1.00 0.00 O ATOM 1839 CB LYS B 24 -13.932 -12.587 -0.249 1.00 0.00 C ATOM 1840 CG LYS B 24 -13.539 -13.975 -0.765 1.00 0.00 C ATOM 1841 CD LYS B 24 -13.810 -15.017 0.323 1.00 0.00 C ATOM 1842 CE LYS B 24 -13.128 -16.336 -0.046 1.00 0.00 C ATOM 1843 NZ LYS B 24 -13.477 -17.372 0.966 1.00 0.00 N ATOM 0 H LYS B 24 -15.253 -13.030 -2.328 1.00 0.00 H new ATOM 0 HA LYS B 24 -14.262 -10.612 -1.054 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -13.219 -12.253 0.505 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.909 -12.630 0.233 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -14.107 -14.215 -1.664 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -12.485 -13.987 -1.041 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -13.438 -14.660 1.283 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -14.883 -15.170 0.434 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -13.446 -16.658 -1.037 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -12.047 -16.201 -0.087 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -13.015 -18.270 0.717 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -13.152 -17.064 1.905 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -14.508 -17.507 0.983 1.00 0.00 H new ATOM 1857 N HIS B 25 -11.632 -10.933 -1.326 1.00 0.00 N ATOM 1858 CA HIS B 25 -10.229 -10.806 -1.837 1.00 0.00 C ATOM 1859 C HIS B 25 -10.101 -9.591 -2.746 1.00 0.00 C ATOM 1860 O HIS B 25 -9.015 -9.233 -3.156 1.00 0.00 O ATOM 1861 CB HIS B 25 -9.824 -12.089 -2.595 1.00 0.00 C ATOM 1862 CG HIS B 25 -8.341 -12.331 -2.488 1.00 0.00 C ATOM 1863 ND1 HIS B 25 -7.812 -13.349 -1.705 1.00 0.00 N ATOM 1864 CD2 HIS B 25 -7.265 -11.718 -3.082 1.00 0.00 C ATOM 1865 CE1 HIS B 25 -6.475 -13.321 -1.852 1.00 0.00 C ATOM 1866 NE2 HIS B 25 -6.093 -12.346 -2.679 1.00 0.00 N ATOM 0 H HIS B 25 -11.780 -10.542 -0.396 1.00 0.00 H new ATOM 0 HA HIS B 25 -9.558 -10.672 -0.988 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -10.366 -12.943 -2.189 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -10.108 -12.001 -3.644 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -7.321 -10.878 -3.758 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -5.796 -14.003 -1.362 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -5.140 -12.111 -2.957 1.00 0.00 H new ATOM 1874 N LYS B 26 -11.189 -8.946 -3.057 1.00 0.00 N ATOM 1875 CA LYS B 26 -11.126 -7.743 -3.930 1.00 0.00 C ATOM 1876 C LYS B 26 -12.003 -6.661 -3.328 1.00 0.00 C ATOM 1877 O LYS B 26 -13.029 -6.931 -2.737 1.00 0.00 O ATOM 1878 CB LYS B 26 -11.644 -8.100 -5.326 1.00 0.00 C ATOM 1879 CG LYS B 26 -10.942 -9.378 -5.830 1.00 0.00 C ATOM 1880 CD LYS B 26 -10.888 -9.389 -7.371 1.00 0.00 C ATOM 1881 CE LYS B 26 -9.649 -8.629 -7.856 1.00 0.00 C ATOM 1882 NZ LYS B 26 -9.759 -8.379 -9.320 1.00 0.00 N ATOM 0 H LYS B 26 -12.125 -9.202 -2.742 1.00 0.00 H new ATOM 0 HA LYS B 26 -10.097 -7.390 -4.007 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -12.723 -8.254 -5.296 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -11.459 -7.276 -6.015 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -9.932 -9.430 -5.424 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.475 -10.259 -5.472 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -10.861 -10.416 -7.735 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -11.789 -8.930 -7.778 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -9.557 -7.684 -7.321 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -8.749 -9.205 -7.642 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -8.918 -7.863 -9.648 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -9.827 -9.287 -9.823 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -10.610 -7.812 -9.512 1.00 0.00 H new ATOM 1896 N LEU B 27 -11.615 -5.432 -3.489 1.00 0.00 N ATOM 1897 CA LEU B 27 -12.438 -4.309 -2.945 1.00 0.00 C ATOM 1898 C LEU B 27 -13.383 -3.808 -4.044 1.00 0.00 C ATOM 1899 O LEU B 27 -12.997 -3.594 -5.176 1.00 0.00 O ATOM 1900 CB LEU B 27 -11.532 -3.144 -2.477 1.00 0.00 C ATOM 1901 CG LEU B 27 -11.127 -3.299 -0.982 1.00 0.00 C ATOM 1902 CD1 LEU B 27 -9.806 -4.065 -0.862 1.00 0.00 C ATOM 1903 CD2 LEU B 27 -10.971 -1.914 -0.348 1.00 0.00 C ATOM 0 H LEU B 27 -10.763 -5.150 -3.974 1.00 0.00 H new ATOM 0 HA LEU B 27 -13.009 -4.669 -2.089 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -10.635 -3.108 -3.096 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -12.054 -2.197 -2.617 1.00 0.00 H new ATOM 0 HG LEU B 27 -11.907 -3.857 -0.464 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -9.537 -4.165 0.190 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -9.918 -5.055 -1.303 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -9.021 -3.521 -1.387 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -10.687 -2.023 0.699 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -10.198 -1.357 -0.877 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -11.916 -1.375 -0.414 1.00 0.00 H new ATOM 1915 N LYS B 28 -14.615 -3.601 -3.682 1.00 0.00 N ATOM 1916 CA LYS B 28 -15.634 -3.086 -4.648 1.00 0.00 C ATOM 1917 C LYS B 28 -15.989 -1.650 -4.269 1.00 0.00 C ATOM 1918 O LYS B 28 -15.774 -1.233 -3.154 1.00 0.00 O ATOM 1919 CB LYS B 28 -16.872 -3.980 -4.581 1.00 0.00 C ATOM 1920 CG LYS B 28 -16.429 -5.446 -4.694 1.00 0.00 C ATOM 1921 CD LYS B 28 -17.606 -6.315 -5.141 1.00 0.00 C ATOM 1922 CE LYS B 28 -17.130 -7.755 -5.373 1.00 0.00 C ATOM 1923 NZ LYS B 28 -15.858 -7.753 -6.150 1.00 0.00 N ATOM 0 H LYS B 28 -14.970 -3.769 -2.741 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.242 -3.098 -5.665 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -17.405 -3.818 -3.644 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -17.562 -3.731 -5.387 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -15.610 -5.533 -5.408 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -16.052 -5.796 -3.733 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -18.390 -6.299 -4.384 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -18.039 -5.913 -6.057 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -16.981 -8.256 -4.416 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -17.893 -8.317 -5.911 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -15.769 -8.648 -6.672 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -15.863 -6.959 -6.822 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -15.054 -7.650 -5.499 1.00 0.00 H new ATOM 1937 N LYS B 29 -16.515 -0.879 -5.186 1.00 0.00 N ATOM 1938 CA LYS B 29 -16.864 0.535 -4.849 1.00 0.00 C ATOM 1939 C LYS B 29 -17.598 0.571 -3.507 1.00 0.00 C ATOM 1940 O LYS B 29 -17.279 1.354 -2.634 1.00 0.00 O ATOM 1941 CB LYS B 29 -17.762 1.125 -5.943 1.00 0.00 C ATOM 1942 CG LYS B 29 -16.955 1.322 -7.235 1.00 0.00 C ATOM 1943 CD LYS B 29 -17.678 2.316 -8.147 1.00 0.00 C ATOM 1944 CE LYS B 29 -19.089 1.808 -8.447 1.00 0.00 C ATOM 1945 NZ LYS B 29 -19.034 0.356 -8.778 1.00 0.00 N ATOM 0 H LYS B 29 -16.717 -1.163 -6.145 1.00 0.00 H new ATOM 0 HA LYS B 29 -15.950 1.125 -4.781 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -18.606 0.461 -6.129 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -18.173 2.079 -5.612 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -15.956 1.690 -6.999 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -16.831 0.368 -7.747 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -17.727 3.294 -7.668 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -17.122 2.443 -9.076 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -19.737 1.971 -7.586 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -19.519 2.366 -9.279 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -19.860 0.100 -9.357 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -18.163 0.154 -9.309 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -19.041 -0.201 -7.900 1.00 0.00 H new ATOM 1959 N SER B 30 -18.570 -0.281 -3.327 1.00 0.00 N ATOM 1960 CA SER B 30 -19.304 -0.297 -2.032 1.00 0.00 C ATOM 1961 C SER B 30 -18.286 -0.385 -0.894 1.00 0.00 C ATOM 1962 O SER B 30 -18.584 -0.101 0.242 1.00 0.00 O ATOM 1963 CB SER B 30 -20.245 -1.506 -1.983 1.00 0.00 C ATOM 1964 OG SER B 30 -21.422 -1.212 -2.724 1.00 0.00 O ATOM 0 H SER B 30 -18.886 -0.963 -4.017 1.00 0.00 H new ATOM 0 HA SER B 30 -19.897 0.612 -1.930 1.00 0.00 H new ATOM 0 HB2 SER B 30 -19.750 -2.384 -2.397 1.00 0.00 H new ATOM 0 HB3 SER B 30 -20.501 -1.742 -0.950 1.00 0.00 H new ATOM 0 HG SER B 30 -22.027 -1.983 -2.697 1.00 0.00 H new ATOM 1970 N GLU B 31 -17.077 -0.760 -1.206 1.00 0.00 N ATOM 1971 CA GLU B 31 -16.013 -0.852 -0.161 1.00 0.00 C ATOM 1972 C GLU B 31 -15.150 0.396 -0.232 1.00 0.00 C ATOM 1973 O GLU B 31 -14.823 0.993 0.767 1.00 0.00 O ATOM 1974 CB GLU B 31 -15.146 -2.087 -0.413 1.00 0.00 C ATOM 1975 CG GLU B 31 -16.042 -3.317 -0.571 1.00 0.00 C ATOM 1976 CD GLU B 31 -15.188 -4.585 -0.525 1.00 0.00 C ATOM 1977 OE1 GLU B 31 -14.124 -4.537 0.069 1.00 0.00 O ATOM 1978 OE2 GLU B 31 -15.614 -5.584 -1.081 1.00 0.00 O ATOM 0 H GLU B 31 -16.776 -1.009 -2.148 1.00 0.00 H new ATOM 0 HA GLU B 31 -16.471 -0.934 0.825 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -14.544 -1.945 -1.311 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -14.453 -2.233 0.416 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -16.788 -3.340 0.223 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -16.584 -3.266 -1.515 1.00 0.00 H new ATOM 1985 N LEU B 32 -14.779 0.802 -1.406 1.00 0.00 N ATOM 1986 CA LEU B 32 -13.933 2.016 -1.518 1.00 0.00 C ATOM 1987 C LEU B 32 -14.700 3.217 -0.958 1.00 0.00 C ATOM 1988 O LEU B 32 -14.222 3.908 -0.084 1.00 0.00 O ATOM 1989 CB LEU B 32 -13.541 2.237 -3.003 1.00 0.00 C ATOM 1990 CG LEU B 32 -12.056 2.624 -3.125 1.00 0.00 C ATOM 1991 CD1 LEU B 32 -11.630 2.582 -4.598 1.00 0.00 C ATOM 1992 CD2 LEU B 32 -11.853 4.038 -2.576 1.00 0.00 C ATOM 0 H LEU B 32 -15.022 0.351 -2.288 1.00 0.00 H new ATOM 0 HA LEU B 32 -13.017 1.894 -0.940 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -13.733 1.328 -3.573 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -14.162 3.021 -3.435 1.00 0.00 H new ATOM 0 HG LEU B 32 -11.451 1.919 -2.555 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.578 2.856 -4.681 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -11.774 1.575 -4.990 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -12.234 3.285 -5.172 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.802 4.314 -2.661 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -12.460 4.741 -3.147 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -12.152 4.068 -1.528 1.00 0.00 H new ATOM 2004 N LYS B 33 -15.882 3.469 -1.433 1.00 0.00 N ATOM 2005 CA LYS B 33 -16.651 4.619 -0.907 1.00 0.00 C ATOM 2006 C LYS B 33 -17.013 4.362 0.561 1.00 0.00 C ATOM 2007 O LYS B 33 -17.053 5.273 1.364 1.00 0.00 O ATOM 2008 CB LYS B 33 -17.903 4.761 -1.768 1.00 0.00 C ATOM 2009 CG LYS B 33 -18.773 5.937 -1.307 1.00 0.00 C ATOM 2010 CD LYS B 33 -20.169 5.810 -1.951 1.00 0.00 C ATOM 2011 CE LYS B 33 -21.114 5.039 -1.022 1.00 0.00 C ATOM 2012 NZ LYS B 33 -21.481 5.901 0.138 1.00 0.00 N ATOM 0 H LYS B 33 -16.347 2.928 -2.162 1.00 0.00 H new ATOM 0 HA LYS B 33 -16.070 5.540 -0.948 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -17.615 4.907 -2.809 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -18.483 3.839 -1.724 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -18.858 5.939 -0.220 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -18.311 6.882 -1.592 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -20.575 6.801 -2.154 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -20.090 5.296 -2.909 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -22.011 4.739 -1.565 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -20.633 4.126 -0.672 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -22.388 5.581 0.535 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -20.742 5.836 0.867 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -21.570 6.888 -0.177 1.00 0.00 H new ATOM 2026 N GLU B 34 -17.294 3.136 0.918 1.00 0.00 N ATOM 2027 CA GLU B 34 -17.669 2.856 2.342 1.00 0.00 C ATOM 2028 C GLU B 34 -16.415 2.811 3.211 1.00 0.00 C ATOM 2029 O GLU B 34 -16.438 3.188 4.365 1.00 0.00 O ATOM 2030 CB GLU B 34 -18.413 1.527 2.446 1.00 0.00 C ATOM 2031 CG GLU B 34 -18.984 1.366 3.859 1.00 0.00 C ATOM 2032 CD GLU B 34 -20.133 2.356 4.057 1.00 0.00 C ATOM 2033 OE1 GLU B 34 -19.865 3.465 4.493 1.00 0.00 O ATOM 2034 OE2 GLU B 34 -21.260 1.990 3.771 1.00 0.00 O ATOM 0 H GLU B 34 -17.282 2.326 0.299 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.323 3.654 2.692 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.218 1.491 1.712 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -17.738 0.702 2.220 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -19.339 0.346 4.006 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -18.205 1.543 4.601 1.00 0.00 H new ATOM 2041 N LEU B 35 -15.317 2.376 2.670 1.00 0.00 N ATOM 2042 CA LEU B 35 -14.067 2.335 3.474 1.00 0.00 C ATOM 2043 C LEU B 35 -13.598 3.776 3.682 1.00 0.00 C ATOM 2044 O LEU B 35 -13.075 4.133 4.719 1.00 0.00 O ATOM 2045 CB LEU B 35 -13.003 1.524 2.721 1.00 0.00 C ATOM 2046 CG LEU B 35 -11.719 1.399 3.569 1.00 0.00 C ATOM 2047 CD1 LEU B 35 -11.860 0.260 4.586 1.00 0.00 C ATOM 2048 CD2 LEU B 35 -10.529 1.098 2.653 1.00 0.00 C ATOM 0 H LEU B 35 -15.229 2.047 1.708 1.00 0.00 H new ATOM 0 HA LEU B 35 -14.238 1.859 4.439 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -13.390 0.532 2.488 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -12.773 2.007 1.771 1.00 0.00 H new ATOM 0 HG LEU B 35 -11.559 2.338 4.099 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -10.947 0.184 5.176 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -12.703 0.464 5.246 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -12.030 -0.679 4.059 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -9.622 1.010 3.252 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -10.706 0.163 2.122 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -10.411 1.907 1.932 1.00 0.00 H new ATOM 2060 N ILE B 36 -13.806 4.608 2.700 1.00 0.00 N ATOM 2061 CA ILE B 36 -13.405 6.036 2.818 1.00 0.00 C ATOM 2062 C ILE B 36 -14.285 6.712 3.879 1.00 0.00 C ATOM 2063 O ILE B 36 -13.829 7.523 4.659 1.00 0.00 O ATOM 2064 CB ILE B 36 -13.599 6.708 1.454 1.00 0.00 C ATOM 2065 CG1 ILE B 36 -12.507 6.215 0.493 1.00 0.00 C ATOM 2066 CG2 ILE B 36 -13.498 8.230 1.597 1.00 0.00 C ATOM 2067 CD1 ILE B 36 -12.907 6.539 -0.949 1.00 0.00 C ATOM 0 H ILE B 36 -14.241 4.356 1.812 1.00 0.00 H new ATOM 0 HA ILE B 36 -12.361 6.123 3.118 1.00 0.00 H new ATOM 0 HB ILE B 36 -14.584 6.453 1.064 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -11.556 6.690 0.733 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.365 5.141 0.609 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -13.637 8.697 0.622 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -14.269 8.583 2.282 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -12.516 8.494 1.989 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -12.131 6.188 -1.629 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -13.848 6.043 -1.186 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -13.027 7.617 -1.060 1.00 0.00 H new ATOM 2079 N ASN B 37 -15.547 6.382 3.894 1.00 0.00 N ATOM 2080 CA ASN B 37 -16.487 6.995 4.882 1.00 0.00 C ATOM 2081 C ASN B 37 -16.394 6.298 6.249 1.00 0.00 C ATOM 2082 O ASN B 37 -16.793 6.851 7.255 1.00 0.00 O ATOM 2083 CB ASN B 37 -17.919 6.869 4.361 1.00 0.00 C ATOM 2084 CG ASN B 37 -18.029 7.542 2.993 1.00 0.00 C ATOM 2085 OD1 ASN B 37 -17.051 7.665 2.283 1.00 0.00 O ATOM 2086 ND2 ASN B 37 -19.189 7.986 2.591 1.00 0.00 N ATOM 0 H ASN B 37 -15.974 5.708 3.259 1.00 0.00 H new ATOM 0 HA ASN B 37 -16.213 8.043 5.006 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -18.197 5.818 4.284 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -18.614 7.332 5.062 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -19.275 8.437 1.680 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -20.010 7.882 3.188 1.00 0.00 H new ATOM 2093 N ASN B 38 -15.928 5.072 6.294 1.00 0.00 N ATOM 2094 CA ASN B 38 -15.878 4.338 7.605 1.00 0.00 C ATOM 2095 C ASN B 38 -14.492 4.423 8.266 1.00 0.00 C ATOM 2096 O ASN B 38 -14.395 4.630 9.461 1.00 0.00 O ATOM 2097 CB ASN B 38 -16.222 2.865 7.355 1.00 0.00 C ATOM 2098 CG ASN B 38 -17.725 2.719 7.116 1.00 0.00 C ATOM 2099 OD1 ASN B 38 -18.355 3.604 6.570 1.00 0.00 O ATOM 2100 ND2 ASN B 38 -18.331 1.629 7.502 1.00 0.00 N ATOM 0 H ASN B 38 -15.582 4.549 5.489 1.00 0.00 H new ATOM 0 HA ASN B 38 -16.596 4.803 8.280 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -15.669 2.494 6.492 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -15.920 2.261 8.211 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -19.333 1.520 7.346 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -17.802 0.887 7.960 1.00 0.00 H new ATOM 2107 N GLU B 39 -13.426 4.249 7.526 1.00 0.00 N ATOM 2108 CA GLU B 39 -12.056 4.302 8.147 1.00 0.00 C ATOM 2109 C GLU B 39 -11.364 5.613 7.777 1.00 0.00 C ATOM 2110 O GLU B 39 -11.063 6.431 8.623 1.00 0.00 O ATOM 2111 CB GLU B 39 -11.220 3.123 7.627 1.00 0.00 C ATOM 2112 CG GLU B 39 -11.588 1.849 8.392 1.00 0.00 C ATOM 2113 CD GLU B 39 -13.060 1.515 8.149 1.00 0.00 C ATOM 2114 OE1 GLU B 39 -13.541 1.815 7.071 1.00 0.00 O ATOM 2115 OE2 GLU B 39 -13.680 0.964 9.045 1.00 0.00 O ATOM 0 H GLU B 39 -13.439 4.073 6.521 1.00 0.00 H new ATOM 0 HA GLU B 39 -12.151 4.242 9.231 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.397 2.982 6.561 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -10.158 3.337 7.748 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -10.958 1.022 8.066 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -11.407 1.987 9.458 1.00 0.00 H new ATOM 2122 N LEU B 40 -11.103 5.815 6.521 1.00 0.00 N ATOM 2123 CA LEU B 40 -10.420 7.069 6.097 1.00 0.00 C ATOM 2124 C LEU B 40 -11.425 8.225 6.176 1.00 0.00 C ATOM 2125 O LEU B 40 -11.394 9.140 5.385 1.00 0.00 O ATOM 2126 CB LEU B 40 -9.869 6.918 4.652 1.00 0.00 C ATOM 2127 CG LEU B 40 -9.698 5.434 4.264 1.00 0.00 C ATOM 2128 CD1 LEU B 40 -9.173 5.355 2.829 1.00 0.00 C ATOM 2129 CD2 LEU B 40 -8.693 4.731 5.198 1.00 0.00 C ATOM 0 H LEU B 40 -11.332 5.168 5.767 1.00 0.00 H new ATOM 0 HA LEU B 40 -9.577 7.275 6.756 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.548 7.403 3.950 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -8.909 7.429 4.572 1.00 0.00 H new ATOM 0 HG LEU B 40 -10.665 4.938 4.352 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -9.048 4.310 2.544 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.884 5.833 2.155 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -8.212 5.866 2.764 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -8.591 3.687 4.903 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -7.724 5.224 5.127 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -9.053 4.784 6.226 1.00 0.00 H new ATOM 2141 N SER B 41 -12.325 8.189 7.126 1.00 0.00 N ATOM 2142 CA SER B 41 -13.335 9.282 7.246 1.00 0.00 C ATOM 2143 C SER B 41 -12.799 10.417 8.130 1.00 0.00 C ATOM 2144 O SER B 41 -13.285 11.529 8.081 1.00 0.00 O ATOM 2145 CB SER B 41 -14.613 8.701 7.861 1.00 0.00 C ATOM 2146 OG SER B 41 -15.744 9.348 7.291 1.00 0.00 O ATOM 0 H SER B 41 -12.403 7.449 7.824 1.00 0.00 H new ATOM 0 HA SER B 41 -13.546 9.692 6.258 1.00 0.00 H new ATOM 0 HB2 SER B 41 -14.663 7.628 7.678 1.00 0.00 H new ATOM 0 HB3 SER B 41 -14.606 8.840 8.942 1.00 0.00 H new ATOM 0 HG SER B 41 -16.448 8.687 7.121 1.00 0.00 H new ATOM 2152 N HIS B 42 -11.807 10.153 8.941 1.00 0.00 N ATOM 2153 CA HIS B 42 -11.257 11.229 9.821 1.00 0.00 C ATOM 2154 C HIS B 42 -10.100 11.927 9.106 1.00 0.00 C ATOM 2155 O HIS B 42 -9.797 13.076 9.369 1.00 0.00 O ATOM 2156 CB HIS B 42 -10.747 10.614 11.132 1.00 0.00 C ATOM 2157 CG HIS B 42 -11.708 9.559 11.607 1.00 0.00 C ATOM 2158 ND1 HIS B 42 -12.718 9.834 12.518 1.00 0.00 N ATOM 2159 CD2 HIS B 42 -11.816 8.221 11.320 1.00 0.00 C ATOM 2160 CE1 HIS B 42 -13.383 8.685 12.746 1.00 0.00 C ATOM 2161 NE2 HIS B 42 -12.872 7.676 12.041 1.00 0.00 N ATOM 0 H HIS B 42 -11.355 9.243 9.032 1.00 0.00 H new ATOM 0 HA HIS B 42 -12.042 11.952 10.042 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -9.760 10.178 10.980 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -10.640 11.389 11.891 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -11.179 7.676 10.639 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -14.225 8.593 13.416 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -13.189 6.707 12.032 1.00 0.00 H new ATOM 2170 N PHE B 43 -9.446 11.238 8.206 1.00 0.00 N ATOM 2171 CA PHE B 43 -8.296 11.845 7.467 1.00 0.00 C ATOM 2172 C PHE B 43 -8.740 12.235 6.060 1.00 0.00 C ATOM 2173 O PHE B 43 -8.530 13.349 5.624 1.00 0.00 O ATOM 2174 CB PHE B 43 -7.158 10.827 7.384 1.00 0.00 C ATOM 2175 CG PHE B 43 -6.541 10.660 8.753 1.00 0.00 C ATOM 2176 CD1 PHE B 43 -5.622 11.605 9.224 1.00 0.00 C ATOM 2177 CD2 PHE B 43 -6.892 9.566 9.554 1.00 0.00 C ATOM 2178 CE1 PHE B 43 -5.052 11.455 10.494 1.00 0.00 C ATOM 2179 CE2 PHE B 43 -6.323 9.416 10.823 1.00 0.00 C ATOM 2180 CZ PHE B 43 -5.402 10.360 11.294 1.00 0.00 C ATOM 0 H PHE B 43 -9.660 10.274 7.949 1.00 0.00 H new ATOM 0 HA PHE B 43 -7.952 12.735 7.993 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -7.535 9.870 7.023 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -6.405 11.163 6.671 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -5.353 12.450 8.608 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -7.602 8.838 9.192 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -4.342 12.184 10.857 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -6.594 8.572 11.440 1.00 0.00 H new ATOM 0 HZ PHE B 43 -4.962 10.244 12.273 1.00 0.00 H new ATOM 2190 N LEU B 44 -9.362 11.336 5.339 1.00 0.00 N ATOM 2191 CA LEU B 44 -9.820 11.685 3.961 1.00 0.00 C ATOM 2192 C LEU B 44 -11.228 12.275 4.050 1.00 0.00 C ATOM 2193 O LEU B 44 -12.069 11.792 4.782 1.00 0.00 O ATOM 2194 CB LEU B 44 -9.827 10.426 3.078 1.00 0.00 C ATOM 2195 CG LEU B 44 -9.874 10.806 1.585 1.00 0.00 C ATOM 2196 CD1 LEU B 44 -8.620 11.612 1.183 1.00 0.00 C ATOM 2197 CD2 LEU B 44 -9.945 9.518 0.755 1.00 0.00 C ATOM 0 H LEU B 44 -9.571 10.385 5.642 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.143 12.414 3.516 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.936 9.830 3.279 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -10.688 9.806 3.328 1.00 0.00 H new ATOM 0 HG LEU B 44 -10.751 11.427 1.401 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.676 11.869 0.125 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.569 12.525 1.776 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.728 11.012 1.364 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -9.979 9.770 -0.305 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -9.065 8.907 0.955 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -10.842 8.961 1.024 1.00 0.00 H new ATOM 2209 N GLU B 45 -11.487 13.328 3.326 1.00 0.00 N ATOM 2210 CA GLU B 45 -12.836 13.958 3.389 1.00 0.00 C ATOM 2211 C GLU B 45 -13.915 12.888 3.218 1.00 0.00 C ATOM 2212 O GLU B 45 -13.831 12.032 2.361 1.00 0.00 O ATOM 2213 CB GLU B 45 -12.974 15.002 2.279 1.00 0.00 C ATOM 2214 CG GLU B 45 -14.223 15.856 2.533 1.00 0.00 C ATOM 2215 CD GLU B 45 -14.608 16.602 1.254 1.00 0.00 C ATOM 2216 OE1 GLU B 45 -14.521 16.003 0.195 1.00 0.00 O ATOM 2217 OE2 GLU B 45 -14.983 17.758 1.355 1.00 0.00 O ATOM 0 H GLU B 45 -10.825 13.779 2.695 1.00 0.00 H new ATOM 0 HA GLU B 45 -12.957 14.443 4.358 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -12.087 15.635 2.248 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -13.048 14.510 1.309 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -15.048 15.222 2.858 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -14.032 16.567 3.336 1.00 0.00 H new ATOM 2224 N GLU B 46 -14.927 12.939 4.039 1.00 0.00 N ATOM 2225 CA GLU B 46 -16.025 11.936 3.949 1.00 0.00 C ATOM 2226 C GLU B 46 -16.618 11.938 2.535 1.00 0.00 C ATOM 2227 O GLU B 46 -17.636 12.550 2.278 1.00 0.00 O ATOM 2228 CB GLU B 46 -17.120 12.290 4.966 1.00 0.00 C ATOM 2229 CG GLU B 46 -17.402 13.806 4.936 1.00 0.00 C ATOM 2230 CD GLU B 46 -16.402 14.548 5.830 1.00 0.00 C ATOM 2231 OE1 GLU B 46 -16.571 14.504 7.037 1.00 0.00 O ATOM 2232 OE2 GLU B 46 -15.485 15.145 5.291 1.00 0.00 O ATOM 0 H GLU B 46 -15.041 13.637 4.774 1.00 0.00 H new ATOM 0 HA GLU B 46 -15.628 10.945 4.168 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -18.032 11.738 4.737 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -16.808 11.990 5.967 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -17.331 14.176 3.913 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -18.419 14.001 5.276 1.00 0.00 H new ATOM 2239 N ILE B 47 -15.993 11.255 1.616 1.00 0.00 N ATOM 2240 CA ILE B 47 -16.527 11.221 0.225 1.00 0.00 C ATOM 2241 C ILE B 47 -17.979 10.724 0.252 1.00 0.00 C ATOM 2242 O ILE B 47 -18.277 9.661 0.758 1.00 0.00 O ATOM 2243 CB ILE B 47 -15.642 10.290 -0.639 1.00 0.00 C ATOM 2244 CG1 ILE B 47 -14.425 11.087 -1.156 1.00 0.00 C ATOM 2245 CG2 ILE B 47 -16.446 9.719 -1.822 1.00 0.00 C ATOM 2246 CD1 ILE B 47 -13.446 10.179 -1.925 1.00 0.00 C ATOM 0 H ILE B 47 -15.138 10.720 1.767 1.00 0.00 H new ATOM 0 HA ILE B 47 -16.509 12.220 -0.210 1.00 0.00 H new ATOM 0 HB ILE B 47 -15.300 9.454 -0.029 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -14.765 11.892 -1.807 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -13.909 11.552 -0.316 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -15.806 9.067 -2.416 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -17.294 9.148 -1.444 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -16.809 10.537 -2.444 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -12.600 10.770 -2.276 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -13.088 9.389 -1.265 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -13.957 9.734 -2.779 1.00 0.00 H new ATOM 2258 N LYS B 48 -18.877 11.493 -0.312 1.00 0.00 N ATOM 2259 CA LYS B 48 -20.319 11.098 -0.358 1.00 0.00 C ATOM 2260 C LYS B 48 -20.704 10.852 -1.817 1.00 0.00 C ATOM 2261 O LYS B 48 -21.692 10.209 -2.114 1.00 0.00 O ATOM 2262 CB LYS B 48 -21.173 12.235 0.211 1.00 0.00 C ATOM 2263 CG LYS B 48 -21.030 13.471 -0.678 1.00 0.00 C ATOM 2264 CD LYS B 48 -21.563 14.701 0.057 1.00 0.00 C ATOM 2265 CE LYS B 48 -21.584 15.892 -0.903 1.00 0.00 C ATOM 2266 NZ LYS B 48 -20.188 16.228 -1.306 1.00 0.00 N ATOM 0 H LYS B 48 -18.669 12.391 -0.749 1.00 0.00 H new ATOM 0 HA LYS B 48 -20.484 10.196 0.231 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -22.218 11.929 0.262 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -20.858 12.467 1.229 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -19.984 13.620 -0.944 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -21.578 13.326 -1.609 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -22.566 14.506 0.436 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -20.935 14.925 0.919 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -22.181 15.653 -1.783 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -22.053 16.751 -0.424 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -20.119 17.247 -1.503 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -19.535 15.980 -0.536 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -19.935 15.692 -2.160 1.00 0.00 H new ATOM 2280 N GLU B 49 -19.915 11.355 -2.734 1.00 0.00 N ATOM 2281 CA GLU B 49 -20.203 11.158 -4.188 1.00 0.00 C ATOM 2282 C GLU B 49 -19.318 10.028 -4.721 1.00 0.00 C ATOM 2283 O GLU B 49 -18.248 9.771 -4.208 1.00 0.00 O ATOM 2284 CB GLU B 49 -19.892 12.449 -4.951 1.00 0.00 C ATOM 2285 CG GLU B 49 -20.543 13.636 -4.236 1.00 0.00 C ATOM 2286 CD GLU B 49 -20.558 14.850 -5.169 1.00 0.00 C ATOM 2287 OE1 GLU B 49 -19.492 15.377 -5.440 1.00 0.00 O ATOM 2288 OE2 GLU B 49 -21.636 15.230 -5.596 1.00 0.00 O ATOM 0 H GLU B 49 -19.075 11.899 -2.535 1.00 0.00 H new ATOM 0 HA GLU B 49 -21.254 10.903 -4.324 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -18.814 12.596 -5.014 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -20.264 12.378 -5.973 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -21.560 13.381 -3.938 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -19.993 13.871 -3.325 1.00 0.00 H new ATOM 2295 N GLN B 50 -19.759 9.346 -5.745 1.00 0.00 N ATOM 2296 CA GLN B 50 -18.948 8.223 -6.311 1.00 0.00 C ATOM 2297 C GLN B 50 -18.074 8.730 -7.461 1.00 0.00 C ATOM 2298 O GLN B 50 -17.047 8.160 -7.770 1.00 0.00 O ATOM 2299 CB GLN B 50 -19.892 7.147 -6.851 1.00 0.00 C ATOM 2300 CG GLN B 50 -20.700 6.545 -5.704 1.00 0.00 C ATOM 2301 CD GLN B 50 -21.884 5.758 -6.269 1.00 0.00 C ATOM 2302 OE1 GLN B 50 -23.025 6.067 -5.987 1.00 0.00 O ATOM 2303 NE2 GLN B 50 -21.660 4.747 -7.062 1.00 0.00 N ATOM 0 H GLN B 50 -20.647 9.517 -6.216 1.00 0.00 H new ATOM 0 HA GLN B 50 -18.312 7.814 -5.526 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -20.563 7.578 -7.594 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -19.320 6.367 -7.353 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -20.068 5.890 -5.105 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -21.057 7.335 -5.043 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -20.703 4.487 -7.299 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -22.442 4.216 -7.445 1.00 0.00 H new ATOM 2312 N GLU B 51 -18.488 9.778 -8.116 1.00 0.00 N ATOM 2313 CA GLU B 51 -17.705 10.301 -9.268 1.00 0.00 C ATOM 2314 C GLU B 51 -16.223 10.391 -8.926 1.00 0.00 C ATOM 2315 O GLU B 51 -15.377 10.157 -9.766 1.00 0.00 O ATOM 2316 CB GLU B 51 -18.235 11.679 -9.669 1.00 0.00 C ATOM 2317 CG GLU B 51 -17.896 12.700 -8.581 1.00 0.00 C ATOM 2318 CD GLU B 51 -18.687 13.987 -8.825 1.00 0.00 C ATOM 2319 OE1 GLU B 51 -19.863 13.888 -9.134 1.00 0.00 O ATOM 2320 OE2 GLU B 51 -18.100 15.051 -8.700 1.00 0.00 O ATOM 0 H GLU B 51 -19.339 10.297 -7.901 1.00 0.00 H new ATOM 0 HA GLU B 51 -17.818 9.611 -10.104 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -17.796 11.986 -10.618 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -19.314 11.635 -9.816 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -18.136 12.294 -7.598 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -16.827 12.911 -8.586 1.00 0.00 H new ATOM 2327 N VAL B 52 -15.884 10.707 -7.714 1.00 0.00 N ATOM 2328 CA VAL B 52 -14.441 10.777 -7.367 1.00 0.00 C ATOM 2329 C VAL B 52 -13.914 9.360 -7.265 1.00 0.00 C ATOM 2330 O VAL B 52 -12.818 9.057 -7.692 1.00 0.00 O ATOM 2331 CB VAL B 52 -14.256 11.506 -6.036 1.00 0.00 C ATOM 2332 CG1 VAL B 52 -14.863 12.908 -6.134 1.00 0.00 C ATOM 2333 CG2 VAL B 52 -14.960 10.721 -4.924 1.00 0.00 C ATOM 0 H VAL B 52 -16.532 10.918 -6.955 1.00 0.00 H new ATOM 0 HA VAL B 52 -13.894 11.327 -8.133 1.00 0.00 H new ATOM 0 HB VAL B 52 -13.193 11.586 -5.809 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -14.732 13.429 -5.185 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -14.364 13.466 -6.926 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -15.926 12.829 -6.360 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -14.829 11.239 -3.974 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -16.023 10.642 -5.151 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -14.529 9.722 -4.855 1.00 0.00 H new ATOM 2343 N VAL B 53 -14.702 8.481 -6.732 1.00 0.00 N ATOM 2344 CA VAL B 53 -14.267 7.070 -6.635 1.00 0.00 C ATOM 2345 C VAL B 53 -14.172 6.554 -8.068 1.00 0.00 C ATOM 2346 O VAL B 53 -13.457 5.620 -8.368 1.00 0.00 O ATOM 2347 CB VAL B 53 -15.277 6.273 -5.752 1.00 0.00 C ATOM 2348 CG1 VAL B 53 -16.062 5.237 -6.568 1.00 0.00 C ATOM 2349 CG2 VAL B 53 -14.530 5.547 -4.626 1.00 0.00 C ATOM 0 H VAL B 53 -15.630 8.678 -6.358 1.00 0.00 H new ATOM 0 HA VAL B 53 -13.297 6.955 -6.151 1.00 0.00 H new ATOM 0 HB VAL B 53 -15.982 6.995 -5.340 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -16.753 4.706 -5.913 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -16.623 5.742 -7.354 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -15.368 4.526 -7.017 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -15.243 4.993 -4.015 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -13.806 4.855 -5.057 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -14.009 6.276 -4.005 1.00 0.00 H new ATOM 2359 N ASP B 54 -14.882 7.185 -8.962 1.00 0.00 N ATOM 2360 CA ASP B 54 -14.822 6.767 -10.385 1.00 0.00 C ATOM 2361 C ASP B 54 -13.563 7.373 -10.999 1.00 0.00 C ATOM 2362 O ASP B 54 -12.930 6.787 -11.856 1.00 0.00 O ATOM 2363 CB ASP B 54 -16.058 7.273 -11.130 1.00 0.00 C ATOM 2364 CG ASP B 54 -16.159 6.571 -12.487 1.00 0.00 C ATOM 2365 OD1 ASP B 54 -15.901 5.380 -12.534 1.00 0.00 O ATOM 2366 OD2 ASP B 54 -16.491 7.237 -13.453 1.00 0.00 O ATOM 0 H ASP B 54 -15.500 7.972 -8.766 1.00 0.00 H new ATOM 0 HA ASP B 54 -14.796 5.680 -10.460 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -16.955 7.080 -10.541 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -15.995 8.352 -11.271 1.00 0.00 H new ATOM 2371 N LYS B 55 -13.186 8.550 -10.556 1.00 0.00 N ATOM 2372 CA LYS B 55 -11.958 9.197 -11.104 1.00 0.00 C ATOM 2373 C LYS B 55 -10.732 8.668 -10.341 1.00 0.00 C ATOM 2374 O LYS B 55 -9.668 8.502 -10.903 1.00 0.00 O ATOM 2375 CB LYS B 55 -12.104 10.746 -11.013 1.00 0.00 C ATOM 2376 CG LYS B 55 -11.372 11.361 -9.793 1.00 0.00 C ATOM 2377 CD LYS B 55 -9.915 11.690 -10.158 1.00 0.00 C ATOM 2378 CE LYS B 55 -9.087 11.870 -8.883 1.00 0.00 C ATOM 2379 NZ LYS B 55 -7.819 12.583 -9.212 1.00 0.00 N ATOM 0 H LYS B 55 -13.676 9.087 -9.840 1.00 0.00 H new ATOM 0 HA LYS B 55 -11.822 8.950 -12.157 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -11.713 11.195 -11.926 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -13.162 11.002 -10.960 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -11.887 12.266 -9.469 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -11.396 10.664 -8.956 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -9.493 10.889 -10.766 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -9.878 12.599 -10.758 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -9.655 12.436 -8.145 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -8.867 10.899 -8.439 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -7.255 12.706 -8.347 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -7.276 12.026 -9.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -8.040 13.515 -9.617 1.00 0.00 H new ATOM 2393 N VAL B 56 -10.875 8.382 -9.070 1.00 0.00 N ATOM 2394 CA VAL B 56 -9.712 7.845 -8.310 1.00 0.00 C ATOM 2395 C VAL B 56 -9.332 6.512 -8.950 1.00 0.00 C ATOM 2396 O VAL B 56 -8.174 6.225 -9.180 1.00 0.00 O ATOM 2397 CB VAL B 56 -10.077 7.684 -6.810 1.00 0.00 C ATOM 2398 CG1 VAL B 56 -10.705 6.313 -6.528 1.00 0.00 C ATOM 2399 CG2 VAL B 56 -8.814 7.829 -5.951 1.00 0.00 C ATOM 0 H VAL B 56 -11.736 8.496 -8.535 1.00 0.00 H new ATOM 0 HA VAL B 56 -8.863 8.527 -8.351 1.00 0.00 H new ATOM 0 HB VAL B 56 -10.801 8.460 -6.562 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -10.948 6.235 -5.468 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -11.615 6.201 -7.118 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -9.999 5.527 -6.797 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -9.075 7.715 -4.899 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -8.093 7.061 -6.231 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -8.376 8.814 -6.112 1.00 0.00 H new ATOM 2409 N MET B 57 -10.311 5.711 -9.266 1.00 0.00 N ATOM 2410 CA MET B 57 -10.017 4.411 -9.927 1.00 0.00 C ATOM 2411 C MET B 57 -9.297 4.694 -11.244 1.00 0.00 C ATOM 2412 O MET B 57 -8.425 3.966 -11.660 1.00 0.00 O ATOM 2413 CB MET B 57 -11.324 3.669 -10.212 1.00 0.00 C ATOM 2414 CG MET B 57 -11.868 3.080 -8.913 1.00 0.00 C ATOM 2415 SD MET B 57 -13.537 2.435 -9.201 1.00 0.00 S ATOM 2416 CE MET B 57 -13.385 0.929 -8.210 1.00 0.00 C ATOM 0 H MET B 57 -11.299 5.900 -9.095 1.00 0.00 H new ATOM 0 HA MET B 57 -9.394 3.795 -9.279 1.00 0.00 H new ATOM 0 HB2 MET B 57 -12.054 4.351 -10.649 1.00 0.00 H new ATOM 0 HB3 MET B 57 -11.153 2.876 -10.940 1.00 0.00 H new ATOM 0 HG2 MET B 57 -11.214 2.283 -8.559 1.00 0.00 H new ATOM 0 HG3 MET B 57 -11.890 3.843 -8.135 1.00 0.00 H new ATOM 0 HE1 MET B 57 -14.308 0.353 -8.279 1.00 0.00 H new ATOM 0 HE2 MET B 57 -12.555 0.330 -8.584 1.00 0.00 H new ATOM 0 HE3 MET B 57 -13.201 1.195 -7.169 1.00 0.00 H new ATOM 2426 N GLU B 58 -9.650 5.760 -11.901 1.00 0.00 N ATOM 2427 CA GLU B 58 -8.978 6.097 -13.185 1.00 0.00 C ATOM 2428 C GLU B 58 -7.496 6.339 -12.912 1.00 0.00 C ATOM 2429 O GLU B 58 -6.648 6.100 -13.750 1.00 0.00 O ATOM 2430 CB GLU B 58 -9.612 7.366 -13.769 1.00 0.00 C ATOM 2431 CG GLU B 58 -9.292 7.475 -15.262 1.00 0.00 C ATOM 2432 CD GLU B 58 -10.089 8.634 -15.865 1.00 0.00 C ATOM 2433 OE1 GLU B 58 -11.094 9.001 -15.278 1.00 0.00 O ATOM 2434 OE2 GLU B 58 -9.681 9.133 -16.900 1.00 0.00 O ATOM 0 H GLU B 58 -10.375 6.413 -11.605 1.00 0.00 H new ATOM 0 HA GLU B 58 -9.092 5.279 -13.897 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -10.692 7.343 -13.621 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -9.237 8.244 -13.244 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -8.224 7.639 -15.406 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -9.543 6.543 -15.769 1.00 0.00 H new ATOM 2441 N THR B 59 -7.182 6.814 -11.740 1.00 0.00 N ATOM 2442 CA THR B 59 -5.761 7.081 -11.390 1.00 0.00 C ATOM 2443 C THR B 59 -5.127 5.826 -10.790 1.00 0.00 C ATOM 2444 O THR B 59 -3.935 5.615 -10.898 1.00 0.00 O ATOM 2445 CB THR B 59 -5.702 8.218 -10.368 1.00 0.00 C ATOM 2446 OG1 THR B 59 -6.398 9.345 -10.879 1.00 0.00 O ATOM 2447 CG2 THR B 59 -4.247 8.595 -10.096 1.00 0.00 C ATOM 0 H THR B 59 -7.855 7.030 -11.004 1.00 0.00 H new ATOM 0 HA THR B 59 -5.214 7.362 -12.290 1.00 0.00 H new ATOM 0 HB THR B 59 -6.166 7.892 -9.437 1.00 0.00 H new ATOM 0 HG1 THR B 59 -6.363 10.075 -10.226 1.00 0.00 H new ATOM 0 HG21 THR B 59 -4.211 9.405 -9.368 1.00 0.00 H new ATOM 0 HG22 THR B 59 -3.714 7.729 -9.702 1.00 0.00 H new ATOM 0 HG23 THR B 59 -3.776 8.920 -11.024 1.00 0.00 H new ATOM 2455 N LEU B 60 -5.911 4.994 -10.144 1.00 0.00 N ATOM 2456 CA LEU B 60 -5.341 3.755 -9.520 1.00 0.00 C ATOM 2457 C LEU B 60 -5.618 2.530 -10.398 1.00 0.00 C ATOM 2458 O LEU B 60 -4.753 1.696 -10.579 1.00 0.00 O ATOM 2459 CB LEU B 60 -5.979 3.535 -8.138 1.00 0.00 C ATOM 2460 CG LEU B 60 -5.241 4.352 -7.067 1.00 0.00 C ATOM 2461 CD1 LEU B 60 -3.790 3.836 -6.878 1.00 0.00 C ATOM 2462 CD2 LEU B 60 -5.227 5.829 -7.475 1.00 0.00 C ATOM 0 H LEU B 60 -6.916 5.118 -10.022 1.00 0.00 H new ATOM 0 HA LEU B 60 -4.263 3.884 -9.420 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -7.029 3.826 -8.166 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -5.948 2.476 -7.881 1.00 0.00 H new ATOM 0 HG LEU B 60 -5.764 4.240 -6.117 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -3.289 4.431 -6.114 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -3.813 2.792 -6.567 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -3.248 3.923 -7.819 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -4.704 6.411 -6.716 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -4.716 5.937 -8.432 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -6.251 6.191 -7.567 1.00 0.00 H new ATOM 2474 N ASP B 61 -6.794 2.393 -10.949 1.00 0.00 N ATOM 2475 CA ASP B 61 -7.083 1.206 -11.805 1.00 0.00 C ATOM 2476 C ASP B 61 -6.067 1.113 -12.931 1.00 0.00 C ATOM 2477 O ASP B 61 -6.107 1.848 -13.898 1.00 0.00 O ATOM 2478 CB ASP B 61 -8.496 1.352 -12.378 1.00 0.00 C ATOM 2479 CG ASP B 61 -9.019 -0.008 -12.843 1.00 0.00 C ATOM 2480 OD1 ASP B 61 -8.296 -0.981 -12.711 1.00 0.00 O ATOM 2481 OD2 ASP B 61 -10.137 -0.051 -13.327 1.00 0.00 O ATOM 0 H ASP B 61 -7.566 3.051 -10.844 1.00 0.00 H new ATOM 0 HA ASP B 61 -7.017 0.295 -11.211 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -9.162 1.767 -11.622 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -8.487 2.052 -13.214 1.00 0.00 H new ATOM 2486 N GLU B 62 -5.156 0.195 -12.802 1.00 0.00 N ATOM 2487 CA GLU B 62 -4.115 0.003 -13.844 1.00 0.00 C ATOM 2488 C GLU B 62 -4.621 -1.020 -14.846 1.00 0.00 C ATOM 2489 O GLU B 62 -4.522 -0.842 -16.044 1.00 0.00 O ATOM 2490 CB GLU B 62 -2.831 -0.501 -13.182 1.00 0.00 C ATOM 2491 CG GLU B 62 -1.717 -0.632 -14.224 1.00 0.00 C ATOM 2492 CD GLU B 62 -0.473 -1.226 -13.560 1.00 0.00 C ATOM 2493 OE1 GLU B 62 -0.273 -0.966 -12.384 1.00 0.00 O ATOM 2494 OE2 GLU B 62 0.257 -1.930 -14.236 1.00 0.00 O ATOM 0 H GLU B 62 -5.087 -0.440 -12.007 1.00 0.00 H new ATOM 0 HA GLU B 62 -3.905 0.943 -14.354 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -2.524 0.188 -12.395 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -3.012 -1.466 -12.708 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -2.044 -1.269 -15.046 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -1.485 0.344 -14.650 1.00 0.00 H new ATOM 2501 N ASP B 63 -5.181 -2.086 -14.360 1.00 0.00 N ATOM 2502 CA ASP B 63 -5.715 -3.119 -15.275 1.00 0.00 C ATOM 2503 C ASP B 63 -7.057 -2.635 -15.816 1.00 0.00 C ATOM 2504 O ASP B 63 -7.680 -3.288 -16.629 1.00 0.00 O ATOM 2505 CB ASP B 63 -5.910 -4.427 -14.506 1.00 0.00 C ATOM 2506 CG ASP B 63 -6.554 -4.127 -13.150 1.00 0.00 C ATOM 2507 OD1 ASP B 63 -6.957 -2.993 -12.946 1.00 0.00 O ATOM 2508 OD2 ASP B 63 -6.635 -5.035 -12.340 1.00 0.00 O ATOM 0 H ASP B 63 -5.291 -2.286 -13.366 1.00 0.00 H new ATOM 0 HA ASP B 63 -5.021 -3.291 -16.098 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -6.540 -5.108 -15.078 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.951 -4.925 -14.364 1.00 0.00 H new ATOM 2513 N GLY B 64 -7.515 -1.492 -15.368 1.00 0.00 N ATOM 2514 CA GLY B 64 -8.824 -0.991 -15.870 1.00 0.00 C ATOM 2515 C GLY B 64 -9.895 -2.017 -15.519 1.00 0.00 C ATOM 2516 O GLY B 64 -10.733 -2.360 -16.327 1.00 0.00 O ATOM 0 H GLY B 64 -7.045 -0.895 -14.687 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -9.060 -0.027 -15.420 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -8.784 -0.838 -16.948 1.00 0.00 H new ATOM 2520 N ASP B 65 -9.863 -2.526 -14.314 1.00 0.00 N ATOM 2521 CA ASP B 65 -10.871 -3.553 -13.904 1.00 0.00 C ATOM 2522 C ASP B 65 -12.022 -2.880 -13.163 1.00 0.00 C ATOM 2523 O ASP B 65 -12.995 -3.513 -12.804 1.00 0.00 O ATOM 2524 CB ASP B 65 -10.209 -4.583 -12.986 1.00 0.00 C ATOM 2525 CG ASP B 65 -9.534 -3.869 -11.813 1.00 0.00 C ATOM 2526 OD1 ASP B 65 -9.763 -2.680 -11.658 1.00 0.00 O ATOM 2527 OD2 ASP B 65 -8.802 -4.523 -11.089 1.00 0.00 O ATOM 0 H ASP B 65 -9.183 -2.276 -13.596 1.00 0.00 H new ATOM 0 HA ASP B 65 -11.256 -4.051 -14.794 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -10.954 -5.287 -12.616 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -9.473 -5.162 -13.544 1.00 0.00 H new ATOM 2532 N GLY B 66 -11.920 -1.606 -12.918 1.00 0.00 N ATOM 2533 CA GLY B 66 -13.015 -0.910 -12.187 1.00 0.00 C ATOM 2534 C GLY B 66 -13.044 -1.427 -10.755 1.00 0.00 C ATOM 2535 O GLY B 66 -13.930 -1.120 -9.985 1.00 0.00 O ATOM 0 H GLY B 66 -11.132 -1.018 -13.190 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -12.852 0.168 -12.197 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -13.972 -1.093 -12.675 1.00 0.00 H new ATOM 2539 N GLU B 67 -12.060 -2.208 -10.400 1.00 0.00 N ATOM 2540 CA GLU B 67 -11.973 -2.764 -9.019 1.00 0.00 C ATOM 2541 C GLU B 67 -10.571 -2.477 -8.491 1.00 0.00 C ATOM 2542 O GLU B 67 -9.727 -1.984 -9.212 1.00 0.00 O ATOM 2543 CB GLU B 67 -12.216 -4.275 -9.054 1.00 0.00 C ATOM 2544 CG GLU B 67 -13.672 -4.545 -9.442 1.00 0.00 C ATOM 2545 CD GLU B 67 -13.877 -6.047 -9.644 1.00 0.00 C ATOM 2546 OE1 GLU B 67 -14.102 -6.733 -8.661 1.00 0.00 O ATOM 2547 OE2 GLU B 67 -13.807 -6.486 -10.780 1.00 0.00 O ATOM 0 H GLU B 67 -11.300 -2.489 -11.019 1.00 0.00 H new ATOM 0 HA GLU B 67 -12.724 -2.308 -8.374 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.543 -4.746 -9.771 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -12.000 -4.712 -8.079 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -14.341 -4.178 -8.664 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.921 -4.007 -10.357 1.00 0.00 H new ATOM 2554 N CYS B 68 -10.320 -2.758 -7.240 1.00 0.00 N ATOM 2555 CA CYS B 68 -8.969 -2.475 -6.657 1.00 0.00 C ATOM 2556 C CYS B 68 -8.398 -3.722 -5.980 1.00 0.00 C ATOM 2557 O CYS B 68 -8.643 -3.967 -4.813 1.00 0.00 O ATOM 2558 CB CYS B 68 -9.103 -1.358 -5.621 1.00 0.00 C ATOM 2559 SG CYS B 68 -9.484 0.198 -6.462 1.00 0.00 S ATOM 0 H CYS B 68 -10.991 -3.172 -6.593 1.00 0.00 H new ATOM 0 HA CYS B 68 -8.294 -2.175 -7.458 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -9.890 -1.601 -4.908 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -8.178 -1.260 -5.053 1.00 0.00 H new ATOM 0 HG CYS B 68 -8.618 0.403 -7.409 1.00 0.00 H new ATOM 2565 N ASP B 69 -7.645 -4.518 -6.702 1.00 0.00 N ATOM 2566 CA ASP B 69 -7.051 -5.744 -6.093 1.00 0.00 C ATOM 2567 C ASP B 69 -6.272 -5.339 -4.837 1.00 0.00 C ATOM 2568 O ASP B 69 -6.400 -4.235 -4.356 1.00 0.00 O ATOM 2569 CB ASP B 69 -6.107 -6.410 -7.098 1.00 0.00 C ATOM 2570 CG ASP B 69 -5.791 -7.833 -6.636 1.00 0.00 C ATOM 2571 OD1 ASP B 69 -6.196 -8.185 -5.540 1.00 0.00 O ATOM 2572 OD2 ASP B 69 -5.150 -8.551 -7.388 1.00 0.00 O ATOM 0 H ASP B 69 -7.418 -4.369 -7.685 1.00 0.00 H new ATOM 0 HA ASP B 69 -7.839 -6.449 -5.828 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -6.567 -6.431 -8.086 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -5.187 -5.832 -7.187 1.00 0.00 H new ATOM 2577 N PHE B 70 -5.468 -6.211 -4.291 1.00 0.00 N ATOM 2578 CA PHE B 70 -4.710 -5.849 -3.056 1.00 0.00 C ATOM 2579 C PHE B 70 -3.498 -4.959 -3.384 1.00 0.00 C ATOM 2580 O PHE B 70 -3.079 -4.155 -2.577 1.00 0.00 O ATOM 2581 CB PHE B 70 -4.237 -7.140 -2.360 1.00 0.00 C ATOM 2582 CG PHE B 70 -3.920 -8.201 -3.397 1.00 0.00 C ATOM 2583 CD1 PHE B 70 -2.757 -8.106 -4.169 1.00 0.00 C ATOM 2584 CD2 PHE B 70 -4.792 -9.282 -3.581 1.00 0.00 C ATOM 2585 CE1 PHE B 70 -2.466 -9.088 -5.123 1.00 0.00 C ATOM 2586 CE2 PHE B 70 -4.503 -10.263 -4.537 1.00 0.00 C ATOM 2587 CZ PHE B 70 -3.339 -10.166 -5.308 1.00 0.00 C ATOM 0 H PHE B 70 -5.303 -7.154 -4.643 1.00 0.00 H new ATOM 0 HA PHE B 70 -5.369 -5.286 -2.395 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.353 -6.935 -1.756 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.010 -7.502 -1.682 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -2.083 -7.274 -4.029 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -5.689 -9.359 -2.984 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -1.567 -9.014 -5.717 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -5.178 -11.094 -4.679 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.115 -10.923 -6.045 1.00 0.00 H new ATOM 2597 N GLN B 71 -2.911 -5.112 -4.540 1.00 0.00 N ATOM 2598 CA GLN B 71 -1.710 -4.289 -4.877 1.00 0.00 C ATOM 2599 C GLN B 71 -2.116 -2.862 -5.223 1.00 0.00 C ATOM 2600 O GLN B 71 -1.407 -1.916 -4.932 1.00 0.00 O ATOM 2601 CB GLN B 71 -0.930 -4.919 -6.045 1.00 0.00 C ATOM 2602 CG GLN B 71 -1.859 -5.245 -7.221 1.00 0.00 C ATOM 2603 CD GLN B 71 -2.227 -3.960 -7.965 1.00 0.00 C ATOM 2604 OE1 GLN B 71 -1.597 -2.936 -7.787 1.00 0.00 O ATOM 2605 NE2 GLN B 71 -3.227 -3.974 -8.804 1.00 0.00 N ATOM 0 H GLN B 71 -3.208 -5.767 -5.263 1.00 0.00 H new ATOM 0 HA GLN B 71 -1.061 -4.262 -4.001 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.148 -4.235 -6.375 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -0.435 -5.829 -5.706 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.369 -5.942 -7.901 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -2.762 -5.736 -6.858 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -3.756 -4.834 -8.953 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -3.480 -3.125 -9.310 1.00 0.00 H new ATOM 2614 N GLU B 72 -3.254 -2.680 -5.817 1.00 0.00 N ATOM 2615 CA GLU B 72 -3.698 -1.304 -6.155 1.00 0.00 C ATOM 2616 C GLU B 72 -4.434 -0.726 -4.947 1.00 0.00 C ATOM 2617 O GLU B 72 -4.311 0.439 -4.628 1.00 0.00 O ATOM 2618 CB GLU B 72 -4.619 -1.394 -7.373 1.00 0.00 C ATOM 2619 CG GLU B 72 -5.215 -0.024 -7.718 1.00 0.00 C ATOM 2620 CD GLU B 72 -6.273 -0.207 -8.802 1.00 0.00 C ATOM 2621 OE1 GLU B 72 -6.121 -1.119 -9.599 1.00 0.00 O ATOM 2622 OE2 GLU B 72 -7.219 0.564 -8.817 1.00 0.00 O ATOM 0 H GLU B 72 -3.898 -3.424 -6.084 1.00 0.00 H new ATOM 0 HA GLU B 72 -2.857 -0.653 -6.393 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -4.061 -1.776 -8.227 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.422 -2.103 -7.174 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.658 0.429 -6.831 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -4.433 0.652 -8.064 1.00 0.00 H new ATOM 2629 N PHE B 73 -5.193 -1.539 -4.273 1.00 0.00 N ATOM 2630 CA PHE B 73 -5.936 -1.051 -3.079 1.00 0.00 C ATOM 2631 C PHE B 73 -4.939 -0.488 -2.066 1.00 0.00 C ATOM 2632 O PHE B 73 -5.194 0.499 -1.409 1.00 0.00 O ATOM 2633 CB PHE B 73 -6.699 -2.222 -2.459 1.00 0.00 C ATOM 2634 CG PHE B 73 -7.204 -1.872 -1.073 1.00 0.00 C ATOM 2635 CD1 PHE B 73 -7.912 -0.682 -0.852 1.00 0.00 C ATOM 2636 CD2 PHE B 73 -6.983 -2.759 -0.010 1.00 0.00 C ATOM 2637 CE1 PHE B 73 -8.399 -0.387 0.424 1.00 0.00 C ATOM 2638 CE2 PHE B 73 -7.465 -2.458 1.265 1.00 0.00 C ATOM 2639 CZ PHE B 73 -8.175 -1.275 1.481 1.00 0.00 C ATOM 0 H PHE B 73 -5.332 -2.524 -4.497 1.00 0.00 H new ATOM 0 HA PHE B 73 -6.639 -0.269 -3.366 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -7.540 -2.492 -3.098 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -6.049 -3.095 -2.403 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -8.081 0.006 -1.667 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.439 -3.677 -0.178 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -8.949 0.527 0.594 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -7.289 -3.140 2.084 1.00 0.00 H new ATOM 0 HZ PHE B 73 -8.552 -1.045 2.467 1.00 0.00 H new ATOM 2649 N MET B 74 -3.803 -1.106 -1.931 1.00 0.00 N ATOM 2650 CA MET B 74 -2.794 -0.595 -0.965 1.00 0.00 C ATOM 2651 C MET B 74 -2.116 0.620 -1.594 1.00 0.00 C ATOM 2652 O MET B 74 -1.540 1.442 -0.917 1.00 0.00 O ATOM 2653 CB MET B 74 -1.763 -1.704 -0.653 1.00 0.00 C ATOM 2654 CG MET B 74 -1.939 -2.222 0.781 1.00 0.00 C ATOM 2655 SD MET B 74 -1.175 -1.047 1.934 1.00 0.00 S ATOM 2656 CE MET B 74 0.148 -2.119 2.554 1.00 0.00 C ATOM 0 H MET B 74 -3.528 -1.942 -2.447 1.00 0.00 H new ATOM 0 HA MET B 74 -3.266 -0.305 -0.026 1.00 0.00 H new ATOM 0 HB2 MET B 74 -1.881 -2.526 -1.359 1.00 0.00 H new ATOM 0 HB3 MET B 74 -0.753 -1.315 -0.783 1.00 0.00 H new ATOM 0 HG2 MET B 74 -2.998 -2.340 1.011 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.479 -3.205 0.885 1.00 0.00 H new ATOM 0 HE1 MET B 74 0.665 -1.621 3.374 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.280 -3.056 2.910 1.00 0.00 H new ATOM 0 HE3 MET B 74 0.856 -2.325 1.751 1.00 0.00 H new ATOM 2666 N ALA B 75 -2.250 0.766 -2.879 1.00 0.00 N ATOM 2667 CA ALA B 75 -1.678 1.970 -3.545 1.00 0.00 C ATOM 2668 C ALA B 75 -2.644 3.124 -3.307 1.00 0.00 C ATOM 2669 O ALA B 75 -2.299 4.282 -3.423 1.00 0.00 O ATOM 2670 CB ALA B 75 -1.515 1.716 -5.044 1.00 0.00 C ATOM 0 H ALA B 75 -2.728 0.109 -3.496 1.00 0.00 H new ATOM 0 HA ALA B 75 -0.694 2.204 -3.138 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -1.096 2.603 -5.520 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -0.845 0.870 -5.199 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -2.487 1.494 -5.483 1.00 0.00 H new ATOM 2676 N PHE B 76 -3.861 2.799 -2.966 1.00 0.00 N ATOM 2677 CA PHE B 76 -4.864 3.866 -2.708 1.00 0.00 C ATOM 2678 C PHE B 76 -4.566 4.512 -1.356 1.00 0.00 C ATOM 2679 O PHE B 76 -4.380 5.706 -1.271 1.00 0.00 O ATOM 2680 CB PHE B 76 -6.283 3.278 -2.723 1.00 0.00 C ATOM 2681 CG PHE B 76 -7.275 4.291 -2.182 1.00 0.00 C ATOM 2682 CD1 PHE B 76 -7.369 5.564 -2.764 1.00 0.00 C ATOM 2683 CD2 PHE B 76 -8.099 3.958 -1.097 1.00 0.00 C ATOM 2684 CE1 PHE B 76 -8.283 6.498 -2.260 1.00 0.00 C ATOM 2685 CE2 PHE B 76 -9.011 4.894 -0.598 1.00 0.00 C ATOM 2686 CZ PHE B 76 -9.103 6.163 -1.179 1.00 0.00 C ATOM 0 H PHE B 76 -4.202 1.844 -2.856 1.00 0.00 H new ATOM 0 HA PHE B 76 -4.804 4.622 -3.491 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -6.557 2.997 -3.740 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.315 2.370 -2.121 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.737 5.824 -3.600 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.029 2.979 -0.647 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -8.354 7.478 -2.707 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -9.645 4.636 0.237 1.00 0.00 H new ATOM 0 HZ PHE B 76 -9.808 6.884 -0.792 1.00 0.00 H new ATOM 2696 N VAL B 77 -4.480 3.737 -0.307 1.00 0.00 N ATOM 2697 CA VAL B 77 -4.163 4.330 1.024 1.00 0.00 C ATOM 2698 C VAL B 77 -2.902 5.181 0.892 1.00 0.00 C ATOM 2699 O VAL B 77 -2.740 6.193 1.540 1.00 0.00 O ATOM 2700 CB VAL B 77 -3.911 3.211 2.039 1.00 0.00 C ATOM 2701 CG1 VAL B 77 -3.418 3.813 3.355 1.00 0.00 C ATOM 2702 CG2 VAL B 77 -5.208 2.447 2.296 1.00 0.00 C ATOM 0 H VAL B 77 -4.615 2.726 -0.314 1.00 0.00 H new ATOM 0 HA VAL B 77 -4.998 4.943 1.364 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.158 2.531 1.640 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -3.239 3.015 4.076 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -2.491 4.359 3.181 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -4.172 4.495 3.748 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -5.025 1.652 3.019 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -5.960 3.130 2.691 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -5.566 2.013 1.362 1.00 0.00 H new ATOM 2712 N SER B 78 -2.008 4.769 0.050 1.00 0.00 N ATOM 2713 CA SER B 78 -0.757 5.535 -0.148 1.00 0.00 C ATOM 2714 C SER B 78 -1.103 6.872 -0.795 1.00 0.00 C ATOM 2715 O SER B 78 -0.499 7.886 -0.524 1.00 0.00 O ATOM 2716 CB SER B 78 0.170 4.738 -1.071 1.00 0.00 C ATOM 2717 OG SER B 78 -0.252 3.388 -1.077 1.00 0.00 O ATOM 0 H SER B 78 -2.091 3.925 -0.516 1.00 0.00 H new ATOM 0 HA SER B 78 -0.258 5.707 0.806 1.00 0.00 H new ATOM 0 HB2 SER B 78 0.142 5.148 -2.081 1.00 0.00 H new ATOM 0 HB3 SER B 78 1.201 4.811 -0.726 1.00 0.00 H new ATOM 0 HG SER B 78 -0.451 3.103 -0.161 1.00 0.00 H new ATOM 2723 N MET B 79 -2.082 6.869 -1.650 1.00 0.00 N ATOM 2724 CA MET B 79 -2.478 8.133 -2.324 1.00 0.00 C ATOM 2725 C MET B 79 -3.185 9.052 -1.331 1.00 0.00 C ATOM 2726 O MET B 79 -3.102 10.259 -1.429 1.00 0.00 O ATOM 2727 CB MET B 79 -3.404 7.831 -3.508 1.00 0.00 C ATOM 2728 CG MET B 79 -3.782 9.141 -4.232 1.00 0.00 C ATOM 2729 SD MET B 79 -3.923 8.833 -6.017 1.00 0.00 S ATOM 2730 CE MET B 79 -5.725 8.924 -6.155 1.00 0.00 C ATOM 0 H MET B 79 -2.626 6.047 -1.912 1.00 0.00 H new ATOM 0 HA MET B 79 -1.582 8.631 -2.695 1.00 0.00 H new ATOM 0 HB2 MET B 79 -2.910 7.152 -4.203 1.00 0.00 H new ATOM 0 HB3 MET B 79 -4.305 7.327 -3.156 1.00 0.00 H new ATOM 0 HG2 MET B 79 -4.726 9.524 -3.843 1.00 0.00 H new ATOM 0 HG3 MET B 79 -3.027 9.904 -4.043 1.00 0.00 H new ATOM 0 HE1 MET B 79 -6.036 8.536 -7.125 1.00 0.00 H new ATOM 0 HE2 MET B 79 -6.181 8.329 -5.364 1.00 0.00 H new ATOM 0 HE3 MET B 79 -6.045 9.961 -6.059 1.00 0.00 H new ATOM 2740 N VAL B 80 -3.853 8.500 -0.352 1.00 0.00 N ATOM 2741 CA VAL B 80 -4.527 9.361 0.661 1.00 0.00 C ATOM 2742 C VAL B 80 -3.503 9.631 1.749 1.00 0.00 C ATOM 2743 O VAL B 80 -3.488 10.676 2.367 1.00 0.00 O ATOM 2744 CB VAL B 80 -5.795 8.671 1.240 1.00 0.00 C ATOM 2745 CG1 VAL B 80 -6.379 7.711 0.206 1.00 0.00 C ATOM 2746 CG2 VAL B 80 -5.473 7.881 2.520 1.00 0.00 C ATOM 0 H VAL B 80 -3.960 7.495 -0.211 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.871 10.292 0.209 1.00 0.00 H new ATOM 0 HB VAL B 80 -6.514 9.453 1.483 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -7.267 7.230 0.617 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.649 8.265 -0.693 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.638 6.952 -0.045 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -6.382 7.412 2.897 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -4.734 7.112 2.296 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -5.074 8.559 3.275 1.00 0.00 H new ATOM 2756 N THR B 81 -2.629 8.689 1.973 1.00 0.00 N ATOM 2757 CA THR B 81 -1.591 8.892 3.005 1.00 0.00 C ATOM 2758 C THR B 81 -0.557 9.855 2.450 1.00 0.00 C ATOM 2759 O THR B 81 -0.005 10.666 3.168 1.00 0.00 O ATOM 2760 CB THR B 81 -0.919 7.560 3.339 1.00 0.00 C ATOM 2761 OG1 THR B 81 -1.906 6.609 3.711 1.00 0.00 O ATOM 2762 CG2 THR B 81 0.072 7.745 4.487 1.00 0.00 C ATOM 0 H THR B 81 -2.594 7.794 1.485 1.00 0.00 H new ATOM 0 HA THR B 81 -2.040 9.294 3.913 1.00 0.00 H new ATOM 0 HB THR B 81 -0.382 7.203 2.460 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.456 6.975 4.435 1.00 0.00 H new ATOM 0 HG21 THR B 81 0.545 6.790 4.717 1.00 0.00 H new ATOM 0 HG22 THR B 81 0.835 8.467 4.196 1.00 0.00 H new ATOM 0 HG23 THR B 81 -0.456 8.110 5.368 1.00 0.00 H new ATOM 2770 N THR B 82 -0.270 9.775 1.175 1.00 0.00 N ATOM 2771 CA THR B 82 0.750 10.691 0.592 1.00 0.00 C ATOM 2772 C THR B 82 0.255 12.134 0.641 1.00 0.00 C ATOM 2773 O THR B 82 1.019 13.047 0.882 1.00 0.00 O ATOM 2774 CB THR B 82 1.006 10.284 -0.856 1.00 0.00 C ATOM 2775 OG1 THR B 82 -0.237 10.080 -1.506 1.00 0.00 O ATOM 2776 CG2 THR B 82 1.831 8.985 -0.895 1.00 0.00 C ATOM 0 H THR B 82 -0.695 9.120 0.519 1.00 0.00 H new ATOM 0 HA THR B 82 1.672 10.621 1.168 1.00 0.00 H new ATOM 0 HB THR B 82 1.562 11.072 -1.364 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.553 9.169 -1.329 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.011 8.699 -1.931 1.00 0.00 H new ATOM 0 HG22 THR B 82 2.785 9.144 -0.392 1.00 0.00 H new ATOM 0 HG23 THR B 82 1.282 8.190 -0.389 1.00 0.00 H new ATOM 2784 N ALA B 83 -1.014 12.360 0.422 1.00 0.00 N ATOM 2785 CA ALA B 83 -1.526 13.754 0.472 1.00 0.00 C ATOM 2786 C ALA B 83 -1.434 14.258 1.910 1.00 0.00 C ATOM 2787 O ALA B 83 -1.186 15.420 2.160 1.00 0.00 O ATOM 2788 CB ALA B 83 -2.986 13.779 0.013 1.00 0.00 C ATOM 0 H ALA B 83 -1.710 11.644 0.213 1.00 0.00 H new ATOM 0 HA ALA B 83 -0.934 14.392 -0.184 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -3.361 14.802 0.050 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -3.053 13.404 -1.008 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -3.585 13.149 0.670 1.00 0.00 H new ATOM 2794 N CYS B 84 -1.620 13.381 2.859 1.00 0.00 N ATOM 2795 CA CYS B 84 -1.533 13.799 4.285 1.00 0.00 C ATOM 2796 C CYS B 84 -0.092 14.196 4.598 1.00 0.00 C ATOM 2797 O CYS B 84 0.163 15.211 5.218 1.00 0.00 O ATOM 2798 CB CYS B 84 -1.953 12.634 5.184 1.00 0.00 C ATOM 2799 SG CYS B 84 -1.717 13.093 6.919 1.00 0.00 S ATOM 0 H CYS B 84 -1.828 12.394 2.707 1.00 0.00 H new ATOM 0 HA CYS B 84 -2.195 14.646 4.464 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -2.997 12.380 5.003 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -1.364 11.748 4.948 1.00 0.00 H new ATOM 0 HG CYS B 84 -2.076 12.104 7.682 1.00 0.00 H new ATOM 2805 N HIS B 85 0.857 13.414 4.164 1.00 0.00 N ATOM 2806 CA HIS B 85 2.278 13.761 4.427 1.00 0.00 C ATOM 2807 C HIS B 85 2.650 14.965 3.550 1.00 0.00 C ATOM 2808 O HIS B 85 3.504 15.757 3.891 1.00 0.00 O ATOM 2809 CB HIS B 85 3.175 12.527 4.130 1.00 0.00 C ATOM 2810 CG HIS B 85 3.913 12.677 2.820 1.00 0.00 C ATOM 2811 ND1 HIS B 85 3.287 12.514 1.594 1.00 0.00 N ATOM 2812 CD2 HIS B 85 5.218 12.989 2.536 1.00 0.00 C ATOM 2813 CE1 HIS B 85 4.209 12.727 0.638 1.00 0.00 C ATOM 2814 NE2 HIS B 85 5.403 13.021 1.158 1.00 0.00 N ATOM 0 H HIS B 85 0.709 12.552 3.640 1.00 0.00 H new ATOM 0 HA HIS B 85 2.430 14.032 5.472 1.00 0.00 H new ATOM 0 HB2 HIS B 85 3.893 12.395 4.940 1.00 0.00 H new ATOM 0 HB3 HIS B 85 2.559 11.628 4.100 1.00 0.00 H new ATOM 0 HD1 HIS B 85 2.307 12.276 1.444 1.00 0.00 H new ATOM 0 HD2 HIS B 85 5.986 13.181 3.271 1.00 0.00 H new ATOM 0 HE1 HIS B 85 4.008 12.667 -0.421 1.00 0.00 H new ATOM 2822 N GLU B 86 2.000 15.107 2.426 1.00 0.00 N ATOM 2823 CA GLU B 86 2.300 16.257 1.528 1.00 0.00 C ATOM 2824 C GLU B 86 1.840 17.547 2.202 1.00 0.00 C ATOM 2825 O GLU B 86 2.579 18.506 2.306 1.00 0.00 O ATOM 2826 CB GLU B 86 1.553 16.073 0.204 1.00 0.00 C ATOM 2827 CG GLU B 86 1.979 17.157 -0.790 1.00 0.00 C ATOM 2828 CD GLU B 86 3.444 16.951 -1.181 1.00 0.00 C ATOM 2829 OE1 GLU B 86 3.821 15.813 -1.408 1.00 0.00 O ATOM 2830 OE2 GLU B 86 4.163 17.933 -1.248 1.00 0.00 O ATOM 0 H GLU B 86 1.273 14.474 2.091 1.00 0.00 H new ATOM 0 HA GLU B 86 3.371 16.308 1.334 1.00 0.00 H new ATOM 0 HB2 GLU B 86 1.764 15.086 -0.208 1.00 0.00 H new ATOM 0 HB3 GLU B 86 0.477 16.125 0.373 1.00 0.00 H new ATOM 0 HG2 GLU B 86 1.347 17.119 -1.677 1.00 0.00 H new ATOM 0 HG3 GLU B 86 1.846 18.144 -0.346 1.00 0.00 H new ATOM 2837 N PHE B 87 0.626 17.573 2.670 1.00 0.00 N ATOM 2838 CA PHE B 87 0.116 18.796 3.349 1.00 0.00 C ATOM 2839 C PHE B 87 1.060 19.153 4.497 1.00 0.00 C ATOM 2840 O PHE B 87 1.441 20.294 4.671 1.00 0.00 O ATOM 2841 CB PHE B 87 -1.287 18.530 3.904 1.00 0.00 C ATOM 2842 CG PHE B 87 -1.740 19.714 4.726 1.00 0.00 C ATOM 2843 CD1 PHE B 87 -2.307 20.830 4.096 1.00 0.00 C ATOM 2844 CD2 PHE B 87 -1.590 19.698 6.118 1.00 0.00 C ATOM 2845 CE1 PHE B 87 -2.724 21.927 4.859 1.00 0.00 C ATOM 2846 CE2 PHE B 87 -2.007 20.796 6.880 1.00 0.00 C ATOM 2847 CZ PHE B 87 -2.573 21.910 6.251 1.00 0.00 C ATOM 0 H PHE B 87 -0.037 16.800 2.612 1.00 0.00 H new ATOM 0 HA PHE B 87 0.068 19.620 2.637 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -1.985 18.354 3.086 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -1.282 17.629 4.518 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -2.422 20.844 3.022 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -1.153 18.838 6.604 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -3.162 22.787 4.374 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -1.892 20.783 7.954 1.00 0.00 H new ATOM 0 HZ PHE B 87 -2.894 22.757 6.839 1.00 0.00 H new ATOM 2857 N PHE B 88 1.443 18.182 5.281 1.00 0.00 N ATOM 2858 CA PHE B 88 2.365 18.463 6.418 1.00 0.00 C ATOM 2859 C PHE B 88 3.784 18.694 5.888 1.00 0.00 C ATOM 2860 O PHE B 88 4.545 19.464 6.440 1.00 0.00 O ATOM 2861 CB PHE B 88 2.372 17.271 7.376 1.00 0.00 C ATOM 2862 CG PHE B 88 3.338 17.541 8.501 1.00 0.00 C ATOM 2863 CD1 PHE B 88 2.911 18.239 9.637 1.00 0.00 C ATOM 2864 CD2 PHE B 88 4.663 17.098 8.407 1.00 0.00 C ATOM 2865 CE1 PHE B 88 3.809 18.494 10.680 1.00 0.00 C ATOM 2866 CE2 PHE B 88 5.561 17.353 9.450 1.00 0.00 C ATOM 2867 CZ PHE B 88 5.134 18.051 10.586 1.00 0.00 C ATOM 0 H PHE B 88 1.158 17.208 5.183 1.00 0.00 H new ATOM 0 HA PHE B 88 2.024 19.355 6.944 1.00 0.00 H new ATOM 0 HB2 PHE B 88 1.371 17.103 7.773 1.00 0.00 H new ATOM 0 HB3 PHE B 88 2.660 16.364 6.844 1.00 0.00 H new ATOM 0 HD1 PHE B 88 1.889 18.581 9.709 1.00 0.00 H new ATOM 0 HD2 PHE B 88 4.992 16.560 7.530 1.00 0.00 H new ATOM 0 HE1 PHE B 88 3.480 19.032 11.557 1.00 0.00 H new ATOM 0 HE2 PHE B 88 6.583 17.011 9.378 1.00 0.00 H new ATOM 0 HZ PHE B 88 5.827 18.248 11.390 1.00 0.00 H new ATOM 2877 N GLU B 89 4.146 18.033 4.822 1.00 0.00 N ATOM 2878 CA GLU B 89 5.515 18.211 4.255 1.00 0.00 C ATOM 2879 C GLU B 89 5.518 19.420 3.316 1.00 0.00 C ATOM 2880 O GLU B 89 6.531 19.782 2.753 1.00 0.00 O ATOM 2881 CB GLU B 89 5.901 16.944 3.481 1.00 0.00 C ATOM 2882 CG GLU B 89 7.346 17.045 2.983 1.00 0.00 C ATOM 2883 CD GLU B 89 7.835 15.657 2.555 1.00 0.00 C ATOM 2884 OE1 GLU B 89 7.280 15.121 1.610 1.00 0.00 O ATOM 2885 OE2 GLU B 89 8.753 15.154 3.181 1.00 0.00 O ATOM 0 H GLU B 89 3.551 17.375 4.317 1.00 0.00 H new ATOM 0 HA GLU B 89 6.235 18.380 5.056 1.00 0.00 H new ATOM 0 HB2 GLU B 89 5.791 16.070 4.123 1.00 0.00 H new ATOM 0 HB3 GLU B 89 5.227 16.806 2.636 1.00 0.00 H new ATOM 0 HG2 GLU B 89 7.406 17.738 2.144 1.00 0.00 H new ATOM 0 HG3 GLU B 89 7.987 17.442 3.770 1.00 0.00 H new ATOM 2892 N HIS B 90 4.390 20.056 3.148 1.00 0.00 N ATOM 2893 CA HIS B 90 4.335 21.244 2.249 1.00 0.00 C ATOM 2894 C HIS B 90 5.153 22.383 2.860 1.00 0.00 C ATOM 2895 O HIS B 90 4.706 23.068 3.758 1.00 0.00 O ATOM 2896 CB HIS B 90 2.881 21.695 2.083 1.00 0.00 C ATOM 2897 CG HIS B 90 2.820 22.828 1.097 1.00 0.00 C ATOM 2898 ND1 HIS B 90 2.189 24.029 1.389 1.00 0.00 N ATOM 2899 CD2 HIS B 90 3.306 22.959 -0.181 1.00 0.00 C ATOM 2900 CE1 HIS B 90 2.312 24.824 0.308 1.00 0.00 C ATOM 2901 NE2 HIS B 90 2.984 24.218 -0.672 1.00 0.00 N ATOM 0 H HIS B 90 3.507 19.805 3.593 1.00 0.00 H new ATOM 0 HA HIS B 90 4.747 20.980 1.275 1.00 0.00 H new ATOM 0 HB2 HIS B 90 2.268 20.863 1.736 1.00 0.00 H new ATOM 0 HB3 HIS B 90 2.475 22.012 3.044 1.00 0.00 H new ATOM 0 HD2 HIS B 90 3.854 22.201 -0.721 1.00 0.00 H new ATOM 0 HE1 HIS B 90 1.916 25.827 0.243 1.00 0.00 H new ATOM 0 HE2 HIS B 90 3.213 24.599 -1.590 1.00 0.00 H new ATOM 2910 N GLU B 91 6.349 22.595 2.380 1.00 0.00 N ATOM 2911 CA GLU B 91 7.198 23.692 2.931 1.00 0.00 C ATOM 2912 C GLU B 91 6.892 24.995 2.189 1.00 0.00 C ATOM 2913 O GLU B 91 6.862 24.966 0.969 1.00 0.00 O ATOM 2914 CB GLU B 91 8.674 23.336 2.748 1.00 0.00 C ATOM 2915 CG GLU B 91 9.545 24.450 3.332 1.00 0.00 C ATOM 2916 CD GLU B 91 11.006 24.000 3.353 1.00 0.00 C ATOM 2917 OE1 GLU B 91 11.239 22.803 3.305 1.00 0.00 O ATOM 2918 OE2 GLU B 91 11.869 24.860 3.418 1.00 0.00 O ATOM 2919 OXT GLU B 91 6.694 25.999 2.852 1.00 0.00 O ATOM 0 H GLU B 91 6.776 22.054 1.628 1.00 0.00 H new ATOM 0 HA GLU B 91 6.984 23.819 3.992 1.00 0.00 H new ATOM 0 HB2 GLU B 91 8.895 22.390 3.243 1.00 0.00 H new ATOM 0 HB3 GLU B 91 8.898 23.202 1.690 1.00 0.00 H new ATOM 0 HG2 GLU B 91 9.442 25.357 2.736 1.00 0.00 H new ATOM 0 HG3 GLU B 91 9.214 24.693 4.342 1.00 0.00 H new TER 2926 GLU B 91 HETATM 2927 CA CA A 92 14.953 8.069 -1.709 1.00 0.00 CA HETATM 2928 CA CA A 93 7.887 1.634 -10.731 1.00 0.00 CA HETATM 2929 ZN ZN A 94 7.325 13.302 0.640 1.00 0.00 ZN HETATM 2930 CA CA B 92 -15.432 -7.982 -2.433 1.00 0.00 CA HETATM 2931 CA CA B 93 -7.762 -1.306 -10.802 1.00 0.00 CA HETATM 2932 ZN ZN B 94 -7.314 -13.281 0.263 1.00 0.00 ZN