USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1229 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 84 SER OG : rot -160:sc= -1 USER MOD Set 1.2: A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 35 THR OG1 : rot -121:sc= 0.108 USER MOD Set 2.2: B 1 MET CE :methyl -107:sc= -5.05! (180deg=-8.22!) USER MOD Set 3.1: A 1 MET CE :methyl 169:sc= -1.56 (180deg=-1.63) USER MOD Set 3.2: B 35 THR OG1 : rot 67:sc= 0.623 USER MOD Single : A 1 MET N :NH3+ 155:sc= 0.0154 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -2.11 K(o=-2.1,f=-17!) USER MOD Single : A 3 LYS NZ :NH3+ -138:sc= -1.85 (180deg=-5.73!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.266 K(o=-0.27,f=-1.7!) USER MOD Single : A 14 THR OG1 : rot -80:sc= -5.6! USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 20 SER OG : rot -41:sc= -10.1! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -171:sc= -6.75! (180deg=-7.78!) USER MOD Single : A 27 SER OG : rot 88:sc= 0.196 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 95:sc= -1.7! USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= -0.112 K(o=-0.11,f=-0.75) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.521 USER MOD Single : A 49 ASN : amide:sc= -0.993 K(o=-0.99,f=-2.4) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.115 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 143:sc= 0.123 (180deg=-1.18) USER MOD Single : B 2 ASN : amide:sc= -2.98! C(o=-3!,f=-6.7!) USER MOD Single : B 3 LYS NZ :NH3+ -145:sc= -5.11! (180deg=-12.3!) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 GLN : amide:sc= -0.245 X(o=-0.25,f=-0.013) USER MOD Single : B 14 THR OG1 : rot -110:sc= -7.65! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : B 20 SER OG : rot -71:sc= -11.3! USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl -142:sc= -10.1! (180deg=-12.7!) USER MOD Single : B 27 SER OG : rot -65:sc= -0.811! USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 THR OG1 : rot 23:sc= -3.95! USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc=-0.00139 K(o=-0.0014,f=-0.76) USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.723! USER MOD Single : B 49 ASN : amide:sc= -0.456 X(o=-0.46,f=-0.075) USER MOD Single : B 51 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.07) USER MOD Single : B 78 SER OG : rot 180:sc= -0.64 USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 84 SER OG : rot 180:sc= 0 USER MOD Single : B 86 LYS NZ :NH3+ -124:sc= 1.08 (180deg=-0.942) USER MOD Single : B 87 LYS NZ :NH3+ 157:sc= -0.106 (180deg=-0.77) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.693 4.009 11.426 1.00 0.00 N ATOM 2 CA MET A 1 5.005 5.066 10.631 1.00 0.00 C ATOM 3 C MET A 1 3.585 4.620 10.277 1.00 0.00 C ATOM 4 O MET A 1 3.228 3.474 10.459 1.00 0.00 O ATOM 5 CB MET A 1 5.848 5.219 9.363 1.00 0.00 C ATOM 6 CG MET A 1 6.549 6.579 9.372 1.00 0.00 C ATOM 7 SD MET A 1 7.845 6.598 8.113 1.00 0.00 S ATOM 8 CE MET A 1 6.765 6.933 6.703 1.00 0.00 C ATOM 0 H1 MET A 1 6.722 4.099 11.306 1.00 0.00 H new ATOM 0 H2 MET A 1 5.451 4.118 12.431 1.00 0.00 H new ATOM 0 H3 MET A 1 5.387 3.072 11.096 1.00 0.00 H new ATOM 0 HA MET A 1 4.917 6.004 11.180 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.586 4.419 9.306 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.214 5.131 8.480 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.828 7.373 9.179 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.979 6.772 10.355 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.371 7.182 5.832 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.164 6.050 6.487 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.108 7.770 6.939 1.00 0.00 H new ATOM 20 N ASN A 2 2.772 5.511 9.760 1.00 0.00 N ATOM 21 CA ASN A 2 1.379 5.122 9.384 1.00 0.00 C ATOM 22 C ASN A 2 0.608 6.311 8.814 1.00 0.00 C ATOM 23 O ASN A 2 1.173 7.342 8.504 1.00 0.00 O ATOM 24 CB ASN A 2 0.713 4.623 10.674 1.00 0.00 C ATOM 25 CG ASN A 2 0.784 5.706 11.754 1.00 0.00 C ATOM 26 OD1 ASN A 2 1.403 6.732 11.563 1.00 0.00 O ATOM 27 ND2 ASN A 2 0.173 5.516 12.890 1.00 0.00 N ATOM 0 H ASN A 2 3.013 6.486 9.583 1.00 0.00 H new ATOM 0 HA ASN A 2 1.386 4.354 8.611 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -0.327 4.361 10.478 1.00 0.00 H new ATOM 0 HB3 ASN A 2 1.210 3.717 11.022 1.00 0.00 H new ATOM 0 HD21 ASN A 2 0.215 6.230 13.618 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -0.348 4.654 13.051 1.00 0.00 H new ATOM 34 N LYS A 3 -0.688 6.172 8.680 1.00 0.00 N ATOM 35 CA LYS A 3 -1.517 7.290 8.134 1.00 0.00 C ATOM 36 C LYS A 3 -1.301 8.566 8.959 1.00 0.00 C ATOM 37 O LYS A 3 -1.704 9.638 8.562 1.00 0.00 O ATOM 38 CB LYS A 3 -2.968 6.809 8.241 1.00 0.00 C ATOM 39 CG LYS A 3 -3.920 7.918 7.771 1.00 0.00 C ATOM 40 CD LYS A 3 -4.893 7.365 6.713 1.00 0.00 C ATOM 41 CE LYS A 3 -6.364 7.620 7.117 1.00 0.00 C ATOM 42 NZ LYS A 3 -6.450 7.383 8.590 1.00 0.00 N ATOM 0 H LYS A 3 -1.208 5.330 8.926 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.251 7.534 7.105 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -3.110 5.914 7.635 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -3.195 6.535 9.271 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -4.479 8.313 8.620 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.348 8.746 7.353 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.691 7.834 5.750 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.728 6.295 6.588 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.662 8.639 6.871 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -7.035 6.952 6.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -7.320 6.856 8.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -5.625 6.832 8.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -6.465 8.296 9.088 1.00 0.00 H new ATOM 56 N THR A 4 -0.662 8.458 10.096 1.00 0.00 N ATOM 57 CA THR A 4 -0.405 9.666 10.933 1.00 0.00 C ATOM 58 C THR A 4 1.062 10.078 10.789 1.00 0.00 C ATOM 59 O THR A 4 1.389 11.196 10.427 1.00 0.00 O ATOM 60 CB THR A 4 -0.709 9.228 12.369 1.00 0.00 C ATOM 61 OG1 THR A 4 -2.093 8.933 12.488 1.00 0.00 O ATOM 62 CG2 THR A 4 -0.339 10.352 13.342 1.00 0.00 C ATOM 0 H THR A 4 -0.307 7.583 10.481 1.00 0.00 H new ATOM 0 HA THR A 4 -1.014 10.522 10.641 1.00 0.00 H new ATOM 0 HB THR A 4 -0.124 8.340 12.608 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.290 8.651 13.406 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.557 10.036 14.362 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.724 10.577 13.251 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.920 11.243 13.106 1.00 0.00 H new ATOM 70 N GLU A 5 1.955 9.171 11.056 1.00 0.00 N ATOM 71 CA GLU A 5 3.395 9.504 10.923 1.00 0.00 C ATOM 72 C GLU A 5 3.669 9.979 9.500 1.00 0.00 C ATOM 73 O GLU A 5 4.263 11.018 9.292 1.00 0.00 O ATOM 74 CB GLU A 5 4.148 8.215 11.245 1.00 0.00 C ATOM 75 CG GLU A 5 4.621 8.249 12.703 1.00 0.00 C ATOM 76 CD GLU A 5 4.314 6.909 13.374 1.00 0.00 C ATOM 77 OE1 GLU A 5 3.161 6.509 13.353 1.00 0.00 O ATOM 78 OE2 GLU A 5 5.235 6.307 13.899 1.00 0.00 O ATOM 0 H GLU A 5 1.751 8.219 11.359 1.00 0.00 H new ATOM 0 HA GLU A 5 3.710 10.305 11.592 1.00 0.00 H new ATOM 0 HB2 GLU A 5 3.501 7.353 11.082 1.00 0.00 H new ATOM 0 HB3 GLU A 5 5.002 8.104 10.577 1.00 0.00 H new ATOM 0 HG2 GLU A 5 5.691 8.451 12.744 1.00 0.00 H new ATOM 0 HG3 GLU A 5 4.123 9.058 13.238 1.00 0.00 H new ATOM 85 N LEU A 6 3.224 9.242 8.512 1.00 0.00 N ATOM 86 CA LEU A 6 3.451 9.691 7.103 1.00 0.00 C ATOM 87 C LEU A 6 3.017 11.154 6.931 1.00 0.00 C ATOM 88 O LEU A 6 3.700 11.936 6.291 1.00 0.00 O ATOM 89 CB LEU A 6 2.595 8.766 6.238 1.00 0.00 C ATOM 90 CG LEU A 6 3.322 7.437 6.033 1.00 0.00 C ATOM 91 CD1 LEU A 6 2.307 6.350 5.678 1.00 0.00 C ATOM 92 CD2 LEU A 6 4.335 7.580 4.895 1.00 0.00 C ATOM 0 H LEU A 6 2.720 8.361 8.617 1.00 0.00 H new ATOM 0 HA LEU A 6 4.503 9.641 6.824 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.630 8.594 6.716 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.395 9.235 5.275 1.00 0.00 H new ATOM 0 HG LEU A 6 3.842 7.162 6.951 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.825 5.402 5.532 1.00 0.00 H new ATOM 0 HD12 LEU A 6 1.585 6.248 6.488 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.786 6.624 4.761 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.854 6.633 4.748 1.00 0.00 H new ATOM 0 HD22 LEU A 6 3.815 7.855 3.977 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.059 8.355 5.148 1.00 0.00 H new ATOM 104 N ILE A 7 1.910 11.555 7.518 1.00 0.00 N ATOM 105 CA ILE A 7 1.513 12.992 7.380 1.00 0.00 C ATOM 106 C ILE A 7 2.664 13.824 7.915 1.00 0.00 C ATOM 107 O ILE A 7 3.104 14.764 7.290 1.00 0.00 O ATOM 108 CB ILE A 7 0.212 13.222 8.166 1.00 0.00 C ATOM 109 CG1 ILE A 7 0.500 13.755 9.570 1.00 0.00 C ATOM 110 CG2 ILE A 7 -0.593 11.931 8.260 1.00 0.00 C ATOM 111 CD1 ILE A 7 -0.812 14.187 10.194 1.00 0.00 C ATOM 0 H ILE A 7 1.283 10.969 8.069 1.00 0.00 H new ATOM 0 HA ILE A 7 1.321 13.276 6.345 1.00 0.00 H new ATOM 0 HB ILE A 7 -0.371 13.968 7.626 1.00 0.00 H new ATOM 0 HG12 ILE A 7 0.974 12.985 10.178 1.00 0.00 H new ATOM 0 HG13 ILE A 7 1.193 14.595 9.522 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.510 12.114 8.820 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -0.843 11.584 7.257 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -0.002 11.170 8.770 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -0.629 14.571 11.198 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -1.265 14.968 9.584 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.487 13.333 10.250 1.00 0.00 H new ATOM 123 N LYS A 8 3.193 13.441 9.050 1.00 0.00 N ATOM 124 CA LYS A 8 4.367 14.180 9.594 1.00 0.00 C ATOM 125 C LYS A 8 5.460 14.162 8.532 1.00 0.00 C ATOM 126 O LYS A 8 6.169 15.129 8.337 1.00 0.00 O ATOM 127 CB LYS A 8 4.846 13.414 10.830 1.00 0.00 C ATOM 128 CG LYS A 8 3.681 13.101 11.773 1.00 0.00 C ATOM 129 CD LYS A 8 4.232 12.684 13.143 1.00 0.00 C ATOM 130 CE LYS A 8 5.351 11.644 12.970 1.00 0.00 C ATOM 131 NZ LYS A 8 5.921 11.461 14.333 1.00 0.00 N ATOM 0 H LYS A 8 2.866 12.658 9.616 1.00 0.00 H new ATOM 0 HA LYS A 8 4.120 15.209 9.854 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.327 12.486 10.522 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.596 14.003 11.358 1.00 0.00 H new ATOM 0 HG2 LYS A 8 3.039 13.975 11.878 1.00 0.00 H new ATOM 0 HG3 LYS A 8 3.067 12.302 11.357 1.00 0.00 H new ATOM 0 HD2 LYS A 8 4.616 13.558 13.670 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.431 12.269 13.755 1.00 0.00 H new ATOM 0 HE2 LYS A 8 4.960 10.706 12.576 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.109 11.993 12.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.692 10.764 14.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 6.291 12.369 14.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 5.178 11.122 14.977 1.00 0.00 H new ATOM 145 N ALA A 9 5.583 13.063 7.822 1.00 0.00 N ATOM 146 CA ALA A 9 6.610 12.988 6.750 1.00 0.00 C ATOM 147 C ALA A 9 6.401 14.154 5.795 1.00 0.00 C ATOM 148 O ALA A 9 7.338 14.758 5.321 1.00 0.00 O ATOM 149 CB ALA A 9 6.351 11.666 6.041 1.00 0.00 C ATOM 0 H ALA A 9 5.017 12.223 7.943 1.00 0.00 H new ATOM 0 HA ALA A 9 7.630 13.041 7.130 1.00 0.00 H new ATOM 0 HB1 ALA A 9 7.072 11.539 5.234 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.453 10.846 6.752 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.342 11.666 5.629 1.00 0.00 H new ATOM 155 N ILE A 10 5.165 14.493 5.542 1.00 0.00 N ATOM 156 CA ILE A 10 4.876 15.640 4.653 1.00 0.00 C ATOM 157 C ILE A 10 4.841 16.883 5.520 1.00 0.00 C ATOM 158 O ILE A 10 5.243 17.954 5.131 1.00 0.00 O ATOM 159 CB ILE A 10 3.489 15.331 4.060 1.00 0.00 C ATOM 160 CG1 ILE A 10 3.634 14.567 2.743 1.00 0.00 C ATOM 161 CG2 ILE A 10 2.714 16.627 3.801 1.00 0.00 C ATOM 162 CD1 ILE A 10 4.464 13.298 2.962 1.00 0.00 C ATOM 0 H ILE A 10 4.344 14.019 5.918 1.00 0.00 H new ATOM 0 HA ILE A 10 5.608 15.797 3.861 1.00 0.00 H new ATOM 0 HB ILE A 10 2.943 14.721 4.779 1.00 0.00 H new ATOM 0 HG12 ILE A 10 2.650 14.305 2.355 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.113 15.200 1.996 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.736 16.389 3.382 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.585 17.167 4.739 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.269 17.248 3.098 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.562 12.760 2.019 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.454 13.569 3.330 1.00 0.00 H new ATOM 0 HD13 ILE A 10 3.968 12.660 3.693 1.00 0.00 H new ATOM 174 N ALA A 11 4.387 16.736 6.720 1.00 0.00 N ATOM 175 CA ALA A 11 4.351 17.900 7.621 1.00 0.00 C ATOM 176 C ALA A 11 5.788 18.338 7.920 1.00 0.00 C ATOM 177 O ALA A 11 6.028 19.419 8.422 1.00 0.00 O ATOM 178 CB ALA A 11 3.638 17.386 8.869 1.00 0.00 C ATOM 0 H ALA A 11 4.040 15.862 7.115 1.00 0.00 H new ATOM 0 HA ALA A 11 3.839 18.769 7.207 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.564 18.189 9.602 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.638 17.045 8.602 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.203 16.557 9.295 1.00 0.00 H new ATOM 184 N GLN A 12 6.750 17.509 7.586 1.00 0.00 N ATOM 185 CA GLN A 12 8.169 17.877 7.820 1.00 0.00 C ATOM 186 C GLN A 12 8.905 17.963 6.483 1.00 0.00 C ATOM 187 O GLN A 12 9.683 18.871 6.262 1.00 0.00 O ATOM 188 CB GLN A 12 8.747 16.768 8.700 1.00 0.00 C ATOM 189 CG GLN A 12 7.957 16.681 10.010 1.00 0.00 C ATOM 190 CD GLN A 12 8.836 17.144 11.175 1.00 0.00 C ATOM 191 OE1 GLN A 12 10.041 16.988 11.141 1.00 0.00 O ATOM 192 NE2 GLN A 12 8.280 17.709 12.212 1.00 0.00 N ATOM 0 H GLN A 12 6.605 16.593 7.161 1.00 0.00 H new ATOM 0 HA GLN A 12 8.271 18.848 8.304 1.00 0.00 H new ATOM 0 HB2 GLN A 12 8.704 15.814 8.174 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.798 16.968 8.911 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.062 17.301 9.948 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.624 15.657 10.178 1.00 0.00 H new ATOM 0 HE21 GLN A 12 7.269 17.840 12.240 1.00 0.00 H new ATOM 0 HE22 GLN A 12 8.857 18.020 12.994 1.00 0.00 H new ATOM 201 N ASP A 13 8.634 17.069 5.560 1.00 0.00 N ATOM 202 CA ASP A 13 9.299 17.187 4.229 1.00 0.00 C ATOM 203 C ASP A 13 8.747 18.447 3.593 1.00 0.00 C ATOM 204 O ASP A 13 9.394 19.139 2.832 1.00 0.00 O ATOM 205 CB ASP A 13 8.867 15.966 3.422 1.00 0.00 C ATOM 206 CG ASP A 13 9.638 14.733 3.901 1.00 0.00 C ATOM 207 OD1 ASP A 13 9.807 14.595 5.101 1.00 0.00 O ATOM 208 OD2 ASP A 13 10.044 13.948 3.060 1.00 0.00 O ATOM 0 H ASP A 13 7.996 16.281 5.669 1.00 0.00 H new ATOM 0 HA ASP A 13 10.386 17.235 4.285 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.795 15.804 3.535 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.053 16.134 2.361 1.00 0.00 H new ATOM 213 N THR A 14 7.532 18.737 3.947 1.00 0.00 N ATOM 214 CA THR A 14 6.844 19.934 3.447 1.00 0.00 C ATOM 215 C THR A 14 6.816 20.972 4.569 1.00 0.00 C ATOM 216 O THR A 14 7.571 21.924 4.563 1.00 0.00 O ATOM 217 CB THR A 14 5.445 19.428 3.108 1.00 0.00 C ATOM 218 OG1 THR A 14 5.440 18.005 3.095 1.00 0.00 O ATOM 219 CG2 THR A 14 5.071 19.912 1.737 1.00 0.00 C ATOM 0 H THR A 14 6.975 18.168 4.585 1.00 0.00 H new ATOM 0 HA THR A 14 7.316 20.407 2.586 1.00 0.00 H new ATOM 0 HB THR A 14 4.739 19.796 3.852 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.805 17.684 2.244 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.072 19.555 1.485 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.082 21.002 1.720 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.787 19.531 1.009 1.00 0.00 H new ATOM 227 N GLY A 15 5.967 20.782 5.549 1.00 0.00 N ATOM 228 CA GLY A 15 5.908 21.742 6.692 1.00 0.00 C ATOM 229 C GLY A 15 5.776 23.182 6.189 1.00 0.00 C ATOM 230 O GLY A 15 5.974 24.124 6.932 1.00 0.00 O ATOM 0 H GLY A 15 5.312 20.002 5.606 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.062 21.498 7.334 1.00 0.00 H new ATOM 0 HA3 GLY A 15 6.808 21.646 7.300 1.00 0.00 H new ATOM 234 N LEU A 16 5.421 23.367 4.946 1.00 0.00 N ATOM 235 CA LEU A 16 5.258 24.776 4.435 1.00 0.00 C ATOM 236 C LEU A 16 3.982 25.347 5.033 1.00 0.00 C ATOM 237 O LEU A 16 3.832 26.539 5.215 1.00 0.00 O ATOM 238 CB LEU A 16 5.159 24.782 2.890 1.00 0.00 C ATOM 239 CG LEU A 16 5.171 23.376 2.329 1.00 0.00 C ATOM 240 CD1 LEU A 16 3.811 22.730 2.585 1.00 0.00 C ATOM 241 CD2 LEU A 16 5.428 23.411 0.818 1.00 0.00 C ATOM 0 H LEU A 16 5.238 22.627 4.268 1.00 0.00 H new ATOM 0 HA LEU A 16 6.120 25.378 4.723 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.244 25.289 2.585 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.992 25.349 2.473 1.00 0.00 H new ATOM 0 HG LEU A 16 5.962 22.804 2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.809 21.716 2.185 1.00 0.00 H new ATOM 0 HD12 LEU A 16 3.620 22.697 3.658 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.032 23.315 2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.434 22.394 0.426 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.640 23.984 0.328 1.00 0.00 H new ATOM 0 HD23 LEU A 16 6.392 23.881 0.624 1.00 0.00 H new ATOM 253 N THR A 17 3.063 24.480 5.331 1.00 0.00 N ATOM 254 CA THR A 17 1.773 24.901 5.916 1.00 0.00 C ATOM 255 C THR A 17 1.115 23.708 6.620 1.00 0.00 C ATOM 256 O THR A 17 0.136 23.864 7.324 1.00 0.00 O ATOM 257 CB THR A 17 0.943 25.358 4.704 1.00 0.00 C ATOM 258 OG1 THR A 17 0.406 26.648 4.959 1.00 0.00 O ATOM 259 CG2 THR A 17 -0.199 24.376 4.430 1.00 0.00 C ATOM 0 H THR A 17 3.157 23.474 5.189 1.00 0.00 H new ATOM 0 HA THR A 17 1.871 25.689 6.662 1.00 0.00 H new ATOM 0 HB THR A 17 1.592 25.392 3.829 1.00 0.00 H new ATOM 0 HG1 THR A 17 -0.122 26.941 4.187 1.00 0.00 H new ATOM 0 HG21 THR A 17 -0.774 24.717 3.569 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.212 23.388 4.223 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.850 24.322 5.303 1.00 0.00 H new ATOM 267 N GLN A 18 1.611 22.508 6.401 1.00 0.00 N ATOM 268 CA GLN A 18 0.954 21.321 7.018 1.00 0.00 C ATOM 269 C GLN A 18 -0.474 21.317 6.528 1.00 0.00 C ATOM 270 O GLN A 18 -1.387 20.949 7.236 1.00 0.00 O ATOM 271 CB GLN A 18 1.024 21.531 8.536 1.00 0.00 C ATOM 272 CG GLN A 18 2.403 22.073 8.912 1.00 0.00 C ATOM 273 CD GLN A 18 2.663 21.830 10.400 1.00 0.00 C ATOM 274 OE1 GLN A 18 1.752 21.877 11.203 1.00 0.00 O ATOM 275 NE2 GLN A 18 3.876 21.571 10.804 1.00 0.00 N ATOM 0 H GLN A 18 2.431 22.308 5.829 1.00 0.00 H new ATOM 0 HA GLN A 18 1.423 20.371 6.762 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.248 22.228 8.854 1.00 0.00 H new ATOM 0 HB3 GLN A 18 0.838 20.590 9.053 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.172 21.584 8.314 1.00 0.00 H new ATOM 0 HG3 GLN A 18 2.458 23.139 8.692 1.00 0.00 H new ATOM 0 HE21 GLN A 18 4.641 21.532 10.130 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.060 21.408 11.794 1.00 0.00 H new ATOM 284 N VAL A 19 -0.649 21.757 5.297 1.00 0.00 N ATOM 285 CA VAL A 19 -2.006 21.837 4.680 1.00 0.00 C ATOM 286 C VAL A 19 -3.027 21.359 5.708 1.00 0.00 C ATOM 287 O VAL A 19 -3.429 22.104 6.582 1.00 0.00 O ATOM 288 CB VAL A 19 -1.916 20.967 3.387 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.978 19.774 3.586 1.00 0.00 C ATOM 290 CG2 VAL A 19 -3.285 20.446 2.950 1.00 0.00 C ATOM 0 H VAL A 19 0.109 22.068 4.690 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.329 22.840 4.399 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.522 21.619 2.608 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.936 19.187 2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.021 20.134 3.833 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.350 19.150 4.399 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.175 19.846 2.047 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.711 19.832 3.744 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.947 21.288 2.748 1.00 0.00 H new ATOM 300 N SER A 20 -3.381 20.128 5.671 1.00 0.00 N ATOM 301 CA SER A 20 -4.286 19.584 6.687 1.00 0.00 C ATOM 302 C SER A 20 -3.715 18.254 7.125 1.00 0.00 C ATOM 303 O SER A 20 -4.435 17.425 7.602 1.00 0.00 O ATOM 304 CB SER A 20 -5.639 19.415 6.018 1.00 0.00 C ATOM 305 OG SER A 20 -5.644 18.216 5.271 1.00 0.00 O ATOM 0 H SER A 20 -3.075 19.459 4.964 1.00 0.00 H new ATOM 0 HA SER A 20 -4.394 20.226 7.561 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.429 19.392 6.769 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.844 20.264 5.366 1.00 0.00 H new ATOM 0 HG SER A 20 -4.786 18.116 4.808 1.00 0.00 H new ATOM 311 N VAL A 21 -2.426 18.037 6.923 1.00 0.00 N ATOM 312 CA VAL A 21 -1.754 16.745 7.284 1.00 0.00 C ATOM 313 C VAL A 21 -2.718 15.807 7.991 1.00 0.00 C ATOM 314 O VAL A 21 -2.763 14.613 7.751 1.00 0.00 O ATOM 315 CB VAL A 21 -0.613 17.156 8.211 1.00 0.00 C ATOM 316 CG1 VAL A 21 0.371 18.050 7.451 1.00 0.00 C ATOM 317 CG2 VAL A 21 -1.170 17.919 9.418 1.00 0.00 C ATOM 0 H VAL A 21 -1.799 18.727 6.510 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.401 16.204 6.406 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.097 16.261 8.559 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.185 18.342 8.115 1.00 0.00 H new ATOM 0 HG12 VAL A 21 0.776 17.503 6.599 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.146 18.942 7.097 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.350 18.209 10.075 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.693 18.812 9.074 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.864 17.280 9.964 1.00 0.00 H new ATOM 327 N SER A 22 -3.526 16.377 8.815 1.00 0.00 N ATOM 328 CA SER A 22 -4.563 15.582 9.540 1.00 0.00 C ATOM 329 C SER A 22 -5.690 15.243 8.563 1.00 0.00 C ATOM 330 O SER A 22 -6.199 14.139 8.531 1.00 0.00 O ATOM 331 CB SER A 22 -5.065 16.498 10.652 1.00 0.00 C ATOM 332 OG SER A 22 -4.387 16.184 11.862 1.00 0.00 O ATOM 0 H SER A 22 -3.523 17.374 9.029 1.00 0.00 H new ATOM 0 HA SER A 22 -4.181 14.646 9.946 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.893 17.541 10.385 1.00 0.00 H new ATOM 0 HB3 SER A 22 -6.140 16.376 10.782 1.00 0.00 H new ATOM 0 HG SER A 22 -4.706 16.772 12.578 1.00 0.00 H new ATOM 338 N LYS A 23 -6.065 16.191 7.750 1.00 0.00 N ATOM 339 CA LYS A 23 -7.126 15.959 6.750 1.00 0.00 C ATOM 340 C LYS A 23 -6.498 15.469 5.443 1.00 0.00 C ATOM 341 O LYS A 23 -7.096 14.698 4.722 1.00 0.00 O ATOM 342 CB LYS A 23 -7.791 17.319 6.567 1.00 0.00 C ATOM 343 CG LYS A 23 -9.259 17.229 6.968 1.00 0.00 C ATOM 344 CD LYS A 23 -9.965 18.558 6.666 1.00 0.00 C ATOM 345 CE LYS A 23 -9.653 19.002 5.232 1.00 0.00 C ATOM 346 NZ LYS A 23 -10.893 19.677 4.758 1.00 0.00 N ATOM 0 H LYS A 23 -5.669 17.131 7.742 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.846 15.201 7.058 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -7.283 18.068 7.174 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.706 17.640 5.529 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.744 16.418 6.425 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -9.341 16.996 8.030 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -11.041 18.445 6.795 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -9.638 19.322 7.372 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -8.800 19.680 5.206 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.402 18.150 4.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.756 20.009 3.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.687 19.006 4.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.103 20.489 5.373 1.00 0.00 H new ATOM 360 N MET A 24 -5.283 15.881 5.132 1.00 0.00 N ATOM 361 CA MET A 24 -4.644 15.403 3.907 1.00 0.00 C ATOM 362 C MET A 24 -4.502 13.886 4.020 1.00 0.00 C ATOM 363 O MET A 24 -4.566 13.170 3.040 1.00 0.00 O ATOM 364 CB MET A 24 -3.310 16.142 3.919 1.00 0.00 C ATOM 365 CG MET A 24 -2.482 15.746 2.720 1.00 0.00 C ATOM 366 SD MET A 24 -1.587 14.204 3.044 1.00 0.00 S ATOM 367 CE MET A 24 -1.272 14.500 4.799 1.00 0.00 C ATOM 0 H MET A 24 -4.726 16.528 5.690 1.00 0.00 H new ATOM 0 HA MET A 24 -5.181 15.587 2.976 1.00 0.00 H new ATOM 0 HB2 MET A 24 -3.482 17.218 3.911 1.00 0.00 H new ATOM 0 HB3 MET A 24 -2.767 15.913 4.836 1.00 0.00 H new ATOM 0 HG2 MET A 24 -3.127 15.622 1.850 1.00 0.00 H new ATOM 0 HG3 MET A 24 -1.775 16.540 2.481 1.00 0.00 H new ATOM 0 HE1 MET A 24 -0.587 13.742 5.178 1.00 0.00 H new ATOM 0 HE2 MET A 24 -0.829 15.487 4.928 1.00 0.00 H new ATOM 0 HE3 MET A 24 -2.211 14.449 5.351 1.00 0.00 H new ATOM 377 N LEU A 25 -4.361 13.386 5.228 1.00 0.00 N ATOM 378 CA LEU A 25 -4.278 11.913 5.411 1.00 0.00 C ATOM 379 C LEU A 25 -5.697 11.337 5.412 1.00 0.00 C ATOM 380 O LEU A 25 -5.975 10.346 4.765 1.00 0.00 O ATOM 381 CB LEU A 25 -3.565 11.694 6.753 1.00 0.00 C ATOM 382 CG LEU A 25 -4.536 11.820 7.942 1.00 0.00 C ATOM 383 CD1 LEU A 25 -5.347 10.531 8.103 1.00 0.00 C ATOM 384 CD2 LEU A 25 -3.749 12.071 9.229 1.00 0.00 C ATOM 0 H LEU A 25 -4.301 13.936 6.085 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.729 11.412 4.614 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.104 10.706 6.763 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.761 12.422 6.861 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.212 12.654 7.750 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -6.029 10.633 8.947 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -5.919 10.345 7.194 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.670 9.696 8.283 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.440 12.159 10.067 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.068 11.239 9.407 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.177 12.994 9.132 1.00 0.00 H new ATOM 396 N ALA A 26 -6.608 11.973 6.113 1.00 0.00 N ATOM 397 CA ALA A 26 -8.010 11.478 6.123 1.00 0.00 C ATOM 398 C ALA A 26 -8.549 11.588 4.703 1.00 0.00 C ATOM 399 O ALA A 26 -9.446 10.873 4.299 1.00 0.00 O ATOM 400 CB ALA A 26 -8.768 12.411 7.069 1.00 0.00 C ATOM 0 H ALA A 26 -6.436 12.808 6.673 1.00 0.00 H new ATOM 0 HA ALA A 26 -8.105 10.443 6.450 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -9.812 12.103 7.124 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -8.322 12.362 8.063 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.710 13.433 6.695 1.00 0.00 H new ATOM 406 N SER A 27 -7.964 12.466 3.934 1.00 0.00 N ATOM 407 CA SER A 27 -8.384 12.624 2.522 1.00 0.00 C ATOM 408 C SER A 27 -7.634 11.593 1.695 1.00 0.00 C ATOM 409 O SER A 27 -8.185 10.958 0.823 1.00 0.00 O ATOM 410 CB SER A 27 -7.969 14.042 2.132 1.00 0.00 C ATOM 411 OG SER A 27 -8.917 14.968 2.645 1.00 0.00 O ATOM 0 H SER A 27 -7.208 13.083 4.231 1.00 0.00 H new ATOM 0 HA SER A 27 -9.453 12.478 2.365 1.00 0.00 H new ATOM 0 HB2 SER A 27 -6.977 14.264 2.526 1.00 0.00 H new ATOM 0 HB3 SER A 27 -7.908 14.130 1.047 1.00 0.00 H new ATOM 0 HG SER A 27 -8.659 15.230 3.553 1.00 0.00 H new ATOM 417 N PHE A 28 -6.374 11.410 1.996 1.00 0.00 N ATOM 418 CA PHE A 28 -5.555 10.404 1.263 1.00 0.00 C ATOM 419 C PHE A 28 -6.191 9.031 1.425 1.00 0.00 C ATOM 420 O PHE A 28 -6.363 8.312 0.472 1.00 0.00 O ATOM 421 CB PHE A 28 -4.163 10.485 1.908 1.00 0.00 C ATOM 422 CG PHE A 28 -3.555 9.110 2.117 1.00 0.00 C ATOM 423 CD1 PHE A 28 -3.945 8.326 3.212 1.00 0.00 C ATOM 424 CD2 PHE A 28 -2.573 8.636 1.239 1.00 0.00 C ATOM 425 CE1 PHE A 28 -3.356 7.085 3.425 1.00 0.00 C ATOM 426 CE2 PHE A 28 -1.989 7.390 1.453 1.00 0.00 C ATOM 427 CZ PHE A 28 -2.377 6.615 2.545 1.00 0.00 C ATOM 0 H PHE A 28 -5.875 11.920 2.725 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.490 10.588 0.191 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.504 11.081 1.276 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -4.236 10.999 2.866 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -4.704 8.687 3.891 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -2.268 9.237 0.395 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -3.655 6.484 4.271 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -1.235 7.024 0.772 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.921 5.650 2.711 1.00 0.00 H new ATOM 437 N GLU A 29 -6.585 8.670 2.607 1.00 0.00 N ATOM 438 CA GLU A 29 -7.242 7.360 2.768 1.00 0.00 C ATOM 439 C GLU A 29 -8.587 7.443 2.088 1.00 0.00 C ATOM 440 O GLU A 29 -9.041 6.521 1.441 1.00 0.00 O ATOM 441 CB GLU A 29 -7.411 7.170 4.259 1.00 0.00 C ATOM 442 CG GLU A 29 -7.680 5.699 4.520 1.00 0.00 C ATOM 443 CD GLU A 29 -9.046 5.530 5.190 1.00 0.00 C ATOM 444 OE1 GLU A 29 -9.942 6.290 4.864 1.00 0.00 O ATOM 445 OE2 GLU A 29 -9.172 4.643 6.020 1.00 0.00 O ATOM 0 H GLU A 29 -6.481 9.221 3.459 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.678 6.533 2.337 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -6.514 7.492 4.788 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.236 7.779 4.629 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.654 5.144 3.582 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.899 5.285 5.158 1.00 0.00 H new ATOM 452 N LYS A 30 -9.209 8.577 2.203 1.00 0.00 N ATOM 453 CA LYS A 30 -10.508 8.769 1.538 1.00 0.00 C ATOM 454 C LYS A 30 -10.296 8.641 0.037 1.00 0.00 C ATOM 455 O LYS A 30 -11.191 8.327 -0.687 1.00 0.00 O ATOM 456 CB LYS A 30 -10.971 10.179 1.904 1.00 0.00 C ATOM 457 CG LYS A 30 -12.292 10.470 1.194 1.00 0.00 C ATOM 458 CD LYS A 30 -12.759 11.886 1.538 1.00 0.00 C ATOM 459 CE LYS A 30 -14.285 11.913 1.631 1.00 0.00 C ATOM 460 NZ LYS A 30 -14.591 13.007 2.595 1.00 0.00 N ATOM 0 H LYS A 30 -8.867 9.379 2.732 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.253 8.035 1.844 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -11.097 10.265 2.983 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.218 10.910 1.611 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.167 10.369 0.116 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -13.047 9.744 1.496 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.321 12.205 2.484 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -12.418 12.588 0.776 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -14.737 12.106 0.658 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -14.677 10.958 1.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -15.621 13.088 2.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.154 12.792 3.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.212 13.905 2.233 1.00 0.00 H new ATOM 474 N ILE A 31 -9.105 8.834 -0.444 1.00 0.00 N ATOM 475 CA ILE A 31 -8.894 8.664 -1.904 1.00 0.00 C ATOM 476 C ILE A 31 -8.130 7.381 -2.158 1.00 0.00 C ATOM 477 O ILE A 31 -8.291 6.742 -3.169 1.00 0.00 O ATOM 478 CB ILE A 31 -8.153 9.887 -2.416 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.090 10.372 -1.444 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.172 10.994 -2.670 1.00 0.00 C ATOM 481 CD1 ILE A 31 -5.736 10.258 -2.135 1.00 0.00 C ATOM 0 H ILE A 31 -8.282 9.097 0.098 1.00 0.00 H new ATOM 0 HA ILE A 31 -9.841 8.583 -2.437 1.00 0.00 H new ATOM 0 HB ILE A 31 -7.635 9.615 -3.336 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.283 11.404 -1.151 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.105 9.774 -0.533 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -8.660 11.883 -3.039 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -9.896 10.658 -3.412 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -9.689 11.233 -1.741 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.953 10.600 -1.459 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -5.552 9.218 -2.407 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.734 10.874 -3.034 1.00 0.00 H new ATOM 493 N ILE A 32 -7.343 6.970 -1.218 1.00 0.00 N ATOM 494 CA ILE A 32 -6.616 5.686 -1.378 1.00 0.00 C ATOM 495 C ILE A 32 -7.618 4.571 -1.192 1.00 0.00 C ATOM 496 O ILE A 32 -7.854 3.760 -2.074 1.00 0.00 O ATOM 497 CB ILE A 32 -5.575 5.624 -0.262 1.00 0.00 C ATOM 498 CG1 ILE A 32 -4.603 6.807 -0.392 1.00 0.00 C ATOM 499 CG2 ILE A 32 -4.811 4.302 -0.375 1.00 0.00 C ATOM 500 CD1 ILE A 32 -3.262 6.337 -0.953 1.00 0.00 C ATOM 0 H ILE A 32 -7.169 7.465 -0.343 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.138 5.598 -2.353 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.067 5.682 0.709 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.031 7.567 -1.045 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.454 7.272 0.583 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.064 4.245 0.417 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.508 3.470 -0.277 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.317 4.249 -1.345 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.585 7.187 -1.039 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.828 5.594 -0.284 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.414 5.894 -1.937 1.00 0.00 H new ATOM 512 N THR A 33 -8.226 4.543 -0.043 1.00 0.00 N ATOM 513 CA THR A 33 -9.223 3.509 0.226 1.00 0.00 C ATOM 514 C THR A 33 -10.468 3.788 -0.622 1.00 0.00 C ATOM 515 O THR A 33 -11.148 2.875 -1.044 1.00 0.00 O ATOM 516 CB THR A 33 -9.496 3.609 1.736 1.00 0.00 C ATOM 517 OG1 THR A 33 -8.879 2.516 2.399 1.00 0.00 O ATOM 518 CG2 THR A 33 -10.994 3.581 2.010 1.00 0.00 C ATOM 0 H THR A 33 -8.065 5.202 0.719 1.00 0.00 H new ATOM 0 HA THR A 33 -8.898 2.501 -0.032 1.00 0.00 H new ATOM 0 HB THR A 33 -9.087 4.549 2.105 1.00 0.00 H new ATOM 0 HG1 THR A 33 -7.994 2.787 2.722 1.00 0.00 H new ATOM 0 HG21 THR A 33 -11.169 3.653 3.083 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.472 4.422 1.508 1.00 0.00 H new ATOM 0 HG23 THR A 33 -11.415 2.648 1.635 1.00 0.00 H new ATOM 526 N GLU A 34 -10.777 5.044 -0.880 1.00 0.00 N ATOM 527 CA GLU A 34 -11.975 5.350 -1.697 1.00 0.00 C ATOM 528 C GLU A 34 -11.686 5.220 -3.196 1.00 0.00 C ATOM 529 O GLU A 34 -12.584 4.930 -3.959 1.00 0.00 O ATOM 530 CB GLU A 34 -12.321 6.775 -1.326 1.00 0.00 C ATOM 531 CG GLU A 34 -12.791 6.806 0.141 1.00 0.00 C ATOM 532 CD GLU A 34 -14.146 6.106 0.257 1.00 0.00 C ATOM 533 OE1 GLU A 34 -15.032 6.442 -0.513 1.00 0.00 O ATOM 534 OE2 GLU A 34 -14.277 5.248 1.114 1.00 0.00 O ATOM 0 H GLU A 34 -10.249 5.855 -0.558 1.00 0.00 H new ATOM 0 HA GLU A 34 -12.793 4.657 -1.503 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.453 7.421 -1.458 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -13.104 7.156 -1.981 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -12.059 6.312 0.779 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -12.871 7.837 0.487 1.00 0.00 H new ATOM 541 N THR A 35 -10.461 5.409 -3.652 1.00 0.00 N ATOM 542 CA THR A 35 -10.238 5.244 -5.123 1.00 0.00 C ATOM 543 C THR A 35 -10.356 3.779 -5.462 1.00 0.00 C ATOM 544 O THR A 35 -11.144 3.391 -6.298 1.00 0.00 O ATOM 545 CB THR A 35 -8.832 5.715 -5.472 1.00 0.00 C ATOM 546 OG1 THR A 35 -8.802 7.135 -5.503 1.00 0.00 O ATOM 547 CG2 THR A 35 -8.476 5.148 -6.855 1.00 0.00 C ATOM 0 H THR A 35 -9.644 5.659 -3.095 1.00 0.00 H new ATOM 0 HA THR A 35 -10.972 5.826 -5.681 1.00 0.00 H new ATOM 0 HB THR A 35 -8.113 5.370 -4.729 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.511 7.437 -6.389 1.00 0.00 H new ATOM 0 HG21 THR A 35 -7.472 5.469 -7.133 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.512 4.059 -6.822 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.191 5.513 -7.593 1.00 0.00 H new ATOM 555 N VAL A 36 -9.590 2.951 -4.811 1.00 0.00 N ATOM 556 CA VAL A 36 -9.708 1.503 -5.100 1.00 0.00 C ATOM 557 C VAL A 36 -11.160 1.127 -4.898 1.00 0.00 C ATOM 558 O VAL A 36 -11.761 0.407 -5.669 1.00 0.00 O ATOM 559 CB VAL A 36 -8.835 0.811 -4.073 1.00 0.00 C ATOM 560 CG1 VAL A 36 -8.955 -0.699 -4.261 1.00 0.00 C ATOM 561 CG2 VAL A 36 -7.391 1.257 -4.273 1.00 0.00 C ATOM 0 H VAL A 36 -8.901 3.210 -4.105 1.00 0.00 H new ATOM 0 HA VAL A 36 -9.403 1.230 -6.110 1.00 0.00 H new ATOM 0 HB VAL A 36 -9.152 1.071 -3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -8.330 -1.208 -3.527 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -9.994 -1.001 -4.126 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -8.627 -0.968 -5.265 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -6.753 0.765 -3.539 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -7.063 0.988 -5.277 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -7.323 2.337 -4.146 1.00 0.00 H new ATOM 571 N ALA A 37 -11.737 1.665 -3.872 1.00 0.00 N ATOM 572 CA ALA A 37 -13.160 1.400 -3.620 1.00 0.00 C ATOM 573 C ALA A 37 -13.978 2.082 -4.707 1.00 0.00 C ATOM 574 O ALA A 37 -15.084 1.686 -5.003 1.00 0.00 O ATOM 575 CB ALA A 37 -13.443 2.021 -2.267 1.00 0.00 C ATOM 0 H ALA A 37 -11.280 2.278 -3.197 1.00 0.00 H new ATOM 0 HA ALA A 37 -13.410 0.339 -3.627 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -14.490 1.865 -2.007 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -12.808 1.555 -1.513 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -13.235 3.090 -2.307 1.00 0.00 H new ATOM 581 N LYS A 38 -13.411 3.080 -5.337 1.00 0.00 N ATOM 582 CA LYS A 38 -14.131 3.766 -6.444 1.00 0.00 C ATOM 583 C LYS A 38 -13.922 2.933 -7.680 1.00 0.00 C ATOM 584 O LYS A 38 -14.723 2.918 -8.595 1.00 0.00 O ATOM 585 CB LYS A 38 -13.474 5.141 -6.595 1.00 0.00 C ATOM 586 CG LYS A 38 -14.297 6.198 -5.856 1.00 0.00 C ATOM 587 CD LYS A 38 -13.577 7.548 -5.923 1.00 0.00 C ATOM 588 CE LYS A 38 -12.955 7.861 -4.560 1.00 0.00 C ATOM 589 NZ LYS A 38 -12.695 9.327 -4.584 1.00 0.00 N ATOM 0 H LYS A 38 -12.482 3.446 -5.130 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.200 3.884 -6.265 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -12.460 5.114 -6.197 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -13.395 5.402 -7.650 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -15.288 6.280 -6.303 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -14.440 5.902 -4.817 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -12.804 7.522 -6.691 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -14.279 8.333 -6.204 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -13.630 7.593 -3.747 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -12.034 7.299 -4.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -12.268 9.619 -3.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -12.044 9.551 -5.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -13.591 9.836 -4.723 1.00 0.00 H new ATOM 603 N GLY A 39 -12.851 2.205 -7.682 1.00 0.00 N ATOM 604 CA GLY A 39 -12.567 1.323 -8.809 1.00 0.00 C ATOM 605 C GLY A 39 -11.475 1.917 -9.696 1.00 0.00 C ATOM 606 O GLY A 39 -11.448 1.695 -10.891 1.00 0.00 O ATOM 0 H GLY A 39 -12.157 2.191 -6.935 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -12.253 0.346 -8.442 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.474 1.168 -9.394 1.00 0.00 H new ATOM 610 N ASP A 40 -10.567 2.663 -9.125 1.00 0.00 N ATOM 611 CA ASP A 40 -9.475 3.255 -9.956 1.00 0.00 C ATOM 612 C ASP A 40 -8.117 2.711 -9.502 1.00 0.00 C ATOM 613 O ASP A 40 -7.854 2.575 -8.323 1.00 0.00 O ATOM 614 CB ASP A 40 -9.565 4.766 -9.736 1.00 0.00 C ATOM 615 CG ASP A 40 -9.803 5.468 -11.075 1.00 0.00 C ATOM 616 OD1 ASP A 40 -8.954 5.347 -11.944 1.00 0.00 O ATOM 617 OD2 ASP A 40 -10.829 6.113 -11.209 1.00 0.00 O ATOM 0 H ASP A 40 -10.532 2.887 -8.131 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.578 3.004 -11.012 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.376 4.995 -9.045 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.645 5.133 -9.280 1.00 0.00 H new ATOM 622 N LYS A 41 -7.258 2.391 -10.434 1.00 0.00 N ATOM 623 CA LYS A 41 -5.919 1.844 -10.069 1.00 0.00 C ATOM 624 C LYS A 41 -5.031 2.941 -9.479 1.00 0.00 C ATOM 625 O LYS A 41 -4.209 3.523 -10.161 1.00 0.00 O ATOM 626 CB LYS A 41 -5.331 1.327 -11.384 1.00 0.00 C ATOM 627 CG LYS A 41 -5.693 -0.149 -11.559 1.00 0.00 C ATOM 628 CD LYS A 41 -5.910 -0.451 -13.044 1.00 0.00 C ATOM 629 CE LYS A 41 -7.056 -1.454 -13.200 1.00 0.00 C ATOM 630 NZ LYS A 41 -6.702 -2.258 -14.404 1.00 0.00 N ATOM 0 H LYS A 41 -7.427 2.485 -11.435 1.00 0.00 H new ATOM 0 HA LYS A 41 -5.989 1.060 -9.315 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -5.717 1.909 -12.221 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -4.248 1.449 -11.383 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -4.897 -0.779 -11.162 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -6.596 -0.382 -10.994 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -6.141 0.468 -13.583 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -4.997 -0.855 -13.481 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -7.151 -2.086 -12.317 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -8.011 -0.945 -13.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -7.441 -2.969 -14.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -6.625 -1.631 -15.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -5.792 -2.736 -14.247 1.00 0.00 H new ATOM 644 N VAL A 42 -5.185 3.218 -8.214 1.00 0.00 N ATOM 645 CA VAL A 42 -4.342 4.273 -7.570 1.00 0.00 C ATOM 646 C VAL A 42 -2.913 3.749 -7.384 1.00 0.00 C ATOM 647 O VAL A 42 -2.711 2.594 -7.061 1.00 0.00 O ATOM 648 CB VAL A 42 -5.006 4.546 -6.216 1.00 0.00 C ATOM 649 CG1 VAL A 42 -4.957 3.289 -5.344 1.00 0.00 C ATOM 650 CG2 VAL A 42 -4.263 5.682 -5.508 1.00 0.00 C ATOM 0 H VAL A 42 -5.856 2.762 -7.596 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.274 5.181 -8.170 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.046 4.828 -6.379 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -5.431 3.493 -4.384 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.486 2.478 -5.845 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.919 2.999 -5.181 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -4.733 5.879 -4.544 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.223 5.395 -5.353 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -4.304 6.582 -6.122 1.00 0.00 H new ATOM 660 N GLN A 43 -1.918 4.575 -7.594 1.00 0.00 N ATOM 661 CA GLN A 43 -0.515 4.090 -7.432 1.00 0.00 C ATOM 662 C GLN A 43 0.414 5.211 -6.967 1.00 0.00 C ATOM 663 O GLN A 43 0.106 6.381 -7.080 1.00 0.00 O ATOM 664 CB GLN A 43 -0.096 3.621 -8.828 1.00 0.00 C ATOM 665 CG GLN A 43 -0.187 4.785 -9.816 1.00 0.00 C ATOM 666 CD GLN A 43 -0.696 4.277 -11.165 1.00 0.00 C ATOM 667 OE1 GLN A 43 0.078 4.041 -12.071 1.00 0.00 O ATOM 668 NE2 GLN A 43 -1.977 4.095 -11.339 1.00 0.00 N ATOM 0 H GLN A 43 -2.015 5.553 -7.867 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.454 3.302 -6.682 1.00 0.00 H new ATOM 0 HB2 GLN A 43 0.923 3.234 -8.801 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -0.739 2.804 -9.155 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -0.858 5.552 -9.429 1.00 0.00 H new ATOM 0 HG3 GLN A 43 0.792 5.249 -9.937 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -2.628 4.293 -10.579 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -2.327 3.755 -12.235 1.00 0.00 H new ATOM 677 N LEU A 44 1.565 4.849 -6.471 1.00 0.00 N ATOM 678 CA LEU A 44 2.549 5.874 -6.025 1.00 0.00 C ATOM 679 C LEU A 44 3.691 5.920 -7.041 1.00 0.00 C ATOM 680 O LEU A 44 4.470 4.995 -7.141 1.00 0.00 O ATOM 681 CB LEU A 44 3.064 5.398 -4.659 1.00 0.00 C ATOM 682 CG LEU A 44 1.895 4.955 -3.772 1.00 0.00 C ATOM 683 CD1 LEU A 44 2.420 4.449 -2.424 1.00 0.00 C ATOM 684 CD2 LEU A 44 0.974 6.147 -3.532 1.00 0.00 C ATOM 0 H LEU A 44 1.867 3.882 -6.355 1.00 0.00 H new ATOM 0 HA LEU A 44 2.115 6.871 -5.949 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.760 4.570 -4.794 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.615 6.202 -4.171 1.00 0.00 H new ATOM 0 HG LEU A 44 1.351 4.152 -4.269 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.582 4.137 -1.801 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.086 3.602 -2.588 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.966 5.248 -1.923 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.139 5.841 -2.902 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.530 6.943 -3.036 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.593 6.511 -4.486 1.00 0.00 H new ATOM 696 N THR A 45 3.776 6.981 -7.810 1.00 0.00 N ATOM 697 CA THR A 45 4.850 7.106 -8.857 1.00 0.00 C ATOM 698 C THR A 45 5.164 5.745 -9.504 1.00 0.00 C ATOM 699 O THR A 45 4.505 5.340 -10.442 1.00 0.00 O ATOM 700 CB THR A 45 6.090 7.701 -8.164 1.00 0.00 C ATOM 701 OG1 THR A 45 7.255 7.346 -8.897 1.00 0.00 O ATOM 702 CG2 THR A 45 6.227 7.190 -6.727 1.00 0.00 C ATOM 0 H THR A 45 3.140 7.777 -7.758 1.00 0.00 H new ATOM 0 HA THR A 45 4.520 7.755 -9.668 1.00 0.00 H new ATOM 0 HB THR A 45 5.974 8.784 -8.134 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.045 7.725 -8.459 1.00 0.00 H new ATOM 0 HG21 THR A 45 7.112 7.630 -6.267 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.343 7.472 -6.155 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.323 6.104 -6.735 1.00 0.00 H new ATOM 710 N GLY A 46 6.162 5.041 -9.030 1.00 0.00 N ATOM 711 CA GLY A 46 6.491 3.728 -9.647 1.00 0.00 C ATOM 712 C GLY A 46 6.849 2.692 -8.577 1.00 0.00 C ATOM 713 O GLY A 46 7.317 1.618 -8.898 1.00 0.00 O ATOM 0 H GLY A 46 6.756 5.319 -8.249 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.642 3.374 -10.231 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.326 3.846 -10.338 1.00 0.00 H new ATOM 717 N PHE A 47 6.632 2.976 -7.313 1.00 0.00 N ATOM 718 CA PHE A 47 6.974 1.954 -6.278 1.00 0.00 C ATOM 719 C PHE A 47 5.710 1.290 -5.737 1.00 0.00 C ATOM 720 O PHE A 47 5.777 0.206 -5.206 1.00 0.00 O ATOM 721 CB PHE A 47 7.780 2.674 -5.187 1.00 0.00 C ATOM 722 CG PHE A 47 6.886 3.513 -4.313 1.00 0.00 C ATOM 723 CD1 PHE A 47 6.255 2.950 -3.199 1.00 0.00 C ATOM 724 CD2 PHE A 47 6.702 4.859 -4.612 1.00 0.00 C ATOM 725 CE1 PHE A 47 5.441 3.739 -2.391 1.00 0.00 C ATOM 726 CE2 PHE A 47 5.887 5.648 -3.804 1.00 0.00 C ATOM 727 CZ PHE A 47 5.257 5.089 -2.694 1.00 0.00 C ATOM 0 H PHE A 47 6.242 3.851 -6.962 1.00 0.00 H new ATOM 0 HA PHE A 47 7.573 1.145 -6.697 1.00 0.00 H new ATOM 0 HB2 PHE A 47 8.306 1.940 -4.576 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.538 3.306 -5.649 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.399 1.905 -2.966 1.00 0.00 H new ATOM 0 HD2 PHE A 47 7.192 5.293 -5.471 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.952 3.307 -1.530 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.743 6.693 -4.038 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.625 5.701 -2.067 1.00 0.00 H new ATOM 737 N LEU A 48 4.562 1.903 -5.882 1.00 0.00 N ATOM 738 CA LEU A 48 3.315 1.246 -5.386 1.00 0.00 C ATOM 739 C LEU A 48 2.195 1.296 -6.431 1.00 0.00 C ATOM 740 O LEU A 48 2.081 2.230 -7.201 1.00 0.00 O ATOM 741 CB LEU A 48 2.909 2.020 -4.143 1.00 0.00 C ATOM 742 CG LEU A 48 3.250 1.246 -2.856 1.00 0.00 C ATOM 743 CD1 LEU A 48 2.059 1.320 -1.907 1.00 0.00 C ATOM 744 CD2 LEU A 48 3.556 -0.236 -3.140 1.00 0.00 C ATOM 0 H LEU A 48 4.435 2.817 -6.316 1.00 0.00 H new ATOM 0 HA LEU A 48 3.491 0.191 -5.176 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.416 2.985 -4.133 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.838 2.223 -4.173 1.00 0.00 H new ATOM 0 HG LEU A 48 4.138 1.700 -2.417 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.289 0.775 -0.991 1.00 0.00 H new ATOM 0 HD12 LEU A 48 1.850 2.362 -1.666 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.185 0.876 -2.384 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.791 -0.745 -2.205 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.686 -0.706 -3.600 1.00 0.00 H new ATOM 0 HD23 LEU A 48 4.407 -0.309 -3.817 1.00 0.00 H new ATOM 756 N ASN A 49 1.361 0.287 -6.443 1.00 0.00 N ATOM 757 CA ASN A 49 0.226 0.242 -7.413 1.00 0.00 C ATOM 758 C ASN A 49 -0.911 -0.619 -6.841 1.00 0.00 C ATOM 759 O ASN A 49 -0.751 -1.804 -6.623 1.00 0.00 O ATOM 760 CB ASN A 49 0.808 -0.402 -8.674 1.00 0.00 C ATOM 761 CG ASN A 49 0.465 0.457 -9.894 1.00 0.00 C ATOM 762 OD1 ASN A 49 1.169 1.397 -10.206 1.00 0.00 O ATOM 763 ND2 ASN A 49 -0.594 0.172 -10.600 1.00 0.00 N ATOM 0 H ASN A 49 1.419 -0.515 -5.816 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.189 1.229 -7.618 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.889 -0.501 -8.578 1.00 0.00 H new ATOM 0 HB3 ASN A 49 0.406 -1.407 -8.800 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -0.832 0.738 -11.414 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -1.185 -0.617 -10.338 1.00 0.00 H new ATOM 770 N ILE A 50 -2.055 -0.031 -6.591 1.00 0.00 N ATOM 771 CA ILE A 50 -3.200 -0.816 -6.025 1.00 0.00 C ATOM 772 C ILE A 50 -4.302 -0.989 -7.073 1.00 0.00 C ATOM 773 O ILE A 50 -4.429 -0.190 -7.980 1.00 0.00 O ATOM 774 CB ILE A 50 -3.718 0.029 -4.859 1.00 0.00 C ATOM 775 CG1 ILE A 50 -2.586 0.244 -3.837 1.00 0.00 C ATOM 776 CG2 ILE A 50 -4.915 -0.678 -4.207 1.00 0.00 C ATOM 777 CD1 ILE A 50 -3.033 -0.183 -2.434 1.00 0.00 C ATOM 0 H ILE A 50 -2.247 0.957 -6.754 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.894 -1.815 -5.713 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.046 1.003 -5.223 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.708 -0.329 -4.134 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -2.293 1.294 -3.827 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.284 -0.077 -3.376 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.708 -0.805 -4.944 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -4.603 -1.655 -3.837 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.218 -0.023 -1.728 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.897 0.409 -2.132 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.302 -1.239 -2.444 1.00 0.00 H new ATOM 789 N LYS A 51 -5.113 -2.016 -6.956 1.00 0.00 N ATOM 790 CA LYS A 51 -6.206 -2.191 -7.965 1.00 0.00 C ATOM 791 C LYS A 51 -7.290 -3.145 -7.441 1.00 0.00 C ATOM 792 O LYS A 51 -6.992 -4.247 -7.029 1.00 0.00 O ATOM 793 CB LYS A 51 -5.522 -2.779 -9.205 1.00 0.00 C ATOM 794 CG LYS A 51 -4.730 -4.033 -8.827 1.00 0.00 C ATOM 795 CD LYS A 51 -4.177 -4.687 -10.095 1.00 0.00 C ATOM 796 CE LYS A 51 -5.282 -5.502 -10.771 1.00 0.00 C ATOM 797 NZ LYS A 51 -4.882 -5.576 -12.204 1.00 0.00 N ATOM 0 H LYS A 51 -5.068 -2.725 -6.224 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.706 -1.247 -8.184 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.269 -3.026 -9.959 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.855 -2.039 -9.647 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.914 -3.772 -8.154 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.371 -4.734 -8.293 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.804 -3.924 -10.778 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.334 -5.332 -9.847 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.364 -6.496 -10.332 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.254 -5.022 -10.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.591 -6.121 -12.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.818 -4.615 -12.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -3.957 -6.044 -12.282 1.00 0.00 H new ATOM 811 N PRO A 52 -8.525 -2.692 -7.470 1.00 0.00 N ATOM 812 CA PRO A 52 -9.643 -3.525 -6.991 1.00 0.00 C ATOM 813 C PRO A 52 -10.172 -4.417 -8.106 1.00 0.00 C ATOM 814 O PRO A 52 -10.224 -4.033 -9.258 1.00 0.00 O ATOM 815 CB PRO A 52 -10.699 -2.510 -6.587 1.00 0.00 C ATOM 816 CG PRO A 52 -10.414 -1.287 -7.405 1.00 0.00 C ATOM 817 CD PRO A 52 -8.996 -1.384 -7.932 1.00 0.00 C ATOM 0 HA PRO A 52 -9.351 -4.190 -6.178 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.702 -2.888 -6.783 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.644 -2.290 -5.521 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -11.121 -1.210 -8.231 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.533 -0.389 -6.799 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.970 -1.314 -9.019 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -8.372 -0.578 -7.546 1.00 0.00 H new ATOM 825 N VAL A 53 -10.575 -5.600 -7.758 1.00 0.00 N ATOM 826 CA VAL A 53 -11.119 -6.533 -8.780 1.00 0.00 C ATOM 827 C VAL A 53 -12.259 -7.359 -8.189 1.00 0.00 C ATOM 828 O VAL A 53 -12.079 -8.117 -7.260 1.00 0.00 O ATOM 829 CB VAL A 53 -9.945 -7.411 -9.193 1.00 0.00 C ATOM 830 CG1 VAL A 53 -8.816 -6.524 -9.725 1.00 0.00 C ATOM 831 CG2 VAL A 53 -9.439 -8.194 -7.983 1.00 0.00 C ATOM 0 H VAL A 53 -10.552 -5.965 -6.806 1.00 0.00 H new ATOM 0 HA VAL A 53 -11.536 -6.009 -9.640 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.267 -8.107 -9.968 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.973 -7.147 -10.022 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.172 -5.960 -10.587 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.498 -5.832 -8.945 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.599 -8.821 -8.281 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.115 -7.498 -7.209 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.241 -8.822 -7.595 1.00 0.00 H new ATOM 841 N ALA A 54 -13.433 -7.186 -8.726 1.00 0.00 N ATOM 842 CA ALA A 54 -14.643 -7.914 -8.221 1.00 0.00 C ATOM 843 C ALA A 54 -14.296 -9.293 -7.649 1.00 0.00 C ATOM 844 O ALA A 54 -13.707 -10.127 -8.309 1.00 0.00 O ATOM 845 CB ALA A 54 -15.558 -8.052 -9.435 1.00 0.00 C ATOM 0 H ALA A 54 -13.614 -6.559 -9.510 1.00 0.00 H new ATOM 0 HA ALA A 54 -15.111 -7.369 -7.401 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.469 -8.576 -9.146 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -15.813 -7.062 -9.813 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -15.046 -8.616 -10.214 1.00 0.00 H new ATOM 1164 N VAL A 75 -14.877 -6.661 -3.222 1.00 0.00 N ATOM 1165 CA VAL A 75 -14.038 -6.562 -4.455 1.00 0.00 C ATOM 1166 C VAL A 75 -12.657 -7.165 -4.170 1.00 0.00 C ATOM 1167 O VAL A 75 -12.401 -7.650 -3.086 1.00 0.00 O ATOM 1168 CB VAL A 75 -13.955 -5.055 -4.764 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -12.668 -4.446 -4.187 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -13.974 -4.842 -6.280 1.00 0.00 C ATOM 0 HA VAL A 75 -14.450 -7.106 -5.305 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.812 -4.563 -4.304 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.633 -3.381 -4.419 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.654 -4.583 -3.106 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -11.802 -4.941 -4.627 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -13.915 -3.776 -6.498 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -13.122 -5.352 -6.730 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -14.898 -5.246 -6.693 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.766 -7.143 -5.122 1.00 0.00 N ATOM 1181 CA GLY A 76 -10.415 -7.719 -4.872 1.00 0.00 C ATOM 1182 C GLY A 76 -9.387 -6.592 -4.831 1.00 0.00 C ATOM 1183 O GLY A 76 -8.505 -6.516 -5.660 1.00 0.00 O ATOM 0 H GLY A 76 -11.912 -6.755 -6.054 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.409 -8.267 -3.930 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.160 -8.431 -5.656 1.00 0.00 H new ATOM 1187 N VAL A 77 -9.501 -5.712 -3.872 1.00 0.00 N ATOM 1188 CA VAL A 77 -8.535 -4.575 -3.770 1.00 0.00 C ATOM 1189 C VAL A 77 -7.103 -5.087 -3.721 1.00 0.00 C ATOM 1190 O VAL A 77 -6.459 -5.081 -2.691 1.00 0.00 O ATOM 1191 CB VAL A 77 -8.896 -3.854 -2.466 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -8.823 -4.835 -1.291 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -7.913 -2.703 -2.224 1.00 0.00 C ATOM 0 H VAL A 77 -10.223 -5.730 -3.152 1.00 0.00 H new ATOM 0 HA VAL A 77 -8.598 -3.912 -4.633 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.909 -3.460 -2.547 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -9.081 -4.316 -0.368 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.524 -5.653 -1.456 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.812 -5.235 -1.213 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -8.172 -2.192 -1.297 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.900 -3.099 -2.150 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.967 -1.998 -3.054 1.00 0.00 H new ATOM 1203 N SER A 78 -6.596 -5.513 -4.838 1.00 0.00 N ATOM 1204 CA SER A 78 -5.201 -6.008 -4.867 1.00 0.00 C ATOM 1205 C SER A 78 -4.244 -4.818 -4.918 1.00 0.00 C ATOM 1206 O SER A 78 -4.651 -3.675 -4.963 1.00 0.00 O ATOM 1207 CB SER A 78 -5.097 -6.841 -6.143 1.00 0.00 C ATOM 1208 OG SER A 78 -3.817 -7.456 -6.200 1.00 0.00 O ATOM 0 H SER A 78 -7.088 -5.539 -5.731 1.00 0.00 H new ATOM 0 HA SER A 78 -4.944 -6.597 -3.986 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.879 -7.600 -6.160 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.248 -6.208 -7.017 1.00 0.00 H new ATOM 0 HG SER A 78 -3.748 -7.993 -7.017 1.00 0.00 H new ATOM 1214 N VAL A 79 -2.976 -5.091 -4.922 1.00 0.00 N ATOM 1215 CA VAL A 79 -1.954 -4.007 -4.982 1.00 0.00 C ATOM 1216 C VAL A 79 -0.558 -4.630 -4.954 1.00 0.00 C ATOM 1217 O VAL A 79 -0.395 -5.812 -4.724 1.00 0.00 O ATOM 1218 CB VAL A 79 -2.193 -3.142 -3.712 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -2.705 -4.016 -2.562 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -0.899 -2.456 -3.255 1.00 0.00 C ATOM 0 H VAL A 79 -2.593 -6.036 -4.886 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.031 -3.408 -5.889 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.933 -2.384 -3.970 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.868 -3.397 -1.679 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.644 -4.487 -2.853 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.968 -4.786 -2.334 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -1.098 -1.859 -2.365 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.149 -3.212 -3.024 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.529 -1.809 -4.051 1.00 0.00 H new ATOM 1230 N LYS A 80 0.443 -3.824 -5.142 1.00 0.00 N ATOM 1231 CA LYS A 80 1.841 -4.304 -5.089 1.00 0.00 C ATOM 1232 C LYS A 80 2.750 -3.124 -5.418 1.00 0.00 C ATOM 1233 O LYS A 80 2.277 -2.075 -5.809 1.00 0.00 O ATOM 1234 CB LYS A 80 1.953 -5.388 -6.170 1.00 0.00 C ATOM 1235 CG LYS A 80 1.512 -4.821 -7.524 1.00 0.00 C ATOM 1236 CD LYS A 80 2.538 -5.193 -8.597 1.00 0.00 C ATOM 1237 CE LYS A 80 2.350 -6.657 -9.000 1.00 0.00 C ATOM 1238 NZ LYS A 80 1.603 -6.608 -10.288 1.00 0.00 N ATOM 0 H LYS A 80 0.345 -2.827 -5.335 1.00 0.00 H new ATOM 0 HA LYS A 80 2.123 -4.703 -4.115 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.980 -5.746 -6.233 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.333 -6.244 -5.905 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.532 -5.215 -7.792 1.00 0.00 H new ATOM 0 HG3 LYS A 80 1.414 -3.737 -7.461 1.00 0.00 H new ATOM 0 HD2 LYS A 80 2.420 -4.547 -9.467 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.548 -5.036 -8.219 1.00 0.00 H new ATOM 0 HE2 LYS A 80 3.310 -7.160 -9.119 1.00 0.00 H new ATOM 0 HE3 LYS A 80 1.793 -7.207 -8.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 1.435 -7.576 -10.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.691 -6.129 -10.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 2.160 -6.084 -10.993 1.00 0.00 H new ATOM 1252 N PRO A 81 4.021 -3.336 -5.295 1.00 0.00 N ATOM 1253 CA PRO A 81 4.980 -2.285 -5.634 1.00 0.00 C ATOM 1254 C PRO A 81 5.297 -2.325 -7.130 1.00 0.00 C ATOM 1255 O PRO A 81 4.894 -3.224 -7.842 1.00 0.00 O ATOM 1256 CB PRO A 81 6.212 -2.652 -4.817 1.00 0.00 C ATOM 1257 CG PRO A 81 6.114 -4.132 -4.593 1.00 0.00 C ATOM 1258 CD PRO A 81 4.675 -4.542 -4.802 1.00 0.00 C ATOM 0 HA PRO A 81 4.613 -1.281 -5.420 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.128 -2.395 -5.350 1.00 0.00 H new ATOM 0 HB3 PRO A 81 6.231 -2.112 -3.871 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.766 -4.666 -5.284 1.00 0.00 H new ATOM 0 HG3 PRO A 81 6.440 -4.387 -3.585 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.595 -5.359 -5.519 1.00 0.00 H new ATOM 0 HD3 PRO A 81 4.222 -4.888 -3.873 1.00 0.00 H new ATOM 1266 N GLY A 82 6.054 -1.377 -7.593 1.00 0.00 N ATOM 1267 CA GLY A 82 6.456 -1.358 -9.030 1.00 0.00 C ATOM 1268 C GLY A 82 7.957 -1.528 -9.026 1.00 0.00 C ATOM 1269 O GLY A 82 8.486 -2.571 -9.354 1.00 0.00 O ATOM 0 H GLY A 82 6.418 -0.604 -7.035 1.00 0.00 H new ATOM 0 HA2 GLY A 82 5.971 -2.161 -9.585 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.167 -0.421 -9.507 1.00 0.00 H new ATOM 1273 N GLU A 83 8.636 -0.531 -8.550 1.00 0.00 N ATOM 1274 CA GLU A 83 10.098 -0.637 -8.393 1.00 0.00 C ATOM 1275 C GLU A 83 10.321 -1.246 -7.033 1.00 0.00 C ATOM 1276 O GLU A 83 11.050 -0.721 -6.222 1.00 0.00 O ATOM 1277 CB GLU A 83 10.636 0.784 -8.436 1.00 0.00 C ATOM 1278 CG GLU A 83 12.158 0.725 -8.413 1.00 0.00 C ATOM 1279 CD GLU A 83 12.734 2.069 -8.860 1.00 0.00 C ATOM 1280 OE1 GLU A 83 12.131 3.083 -8.549 1.00 0.00 O ATOM 1281 OE2 GLU A 83 13.771 2.063 -9.504 1.00 0.00 O ATOM 0 H GLU A 83 8.233 0.360 -8.261 1.00 0.00 H new ATOM 0 HA GLU A 83 10.587 -1.238 -9.159 1.00 0.00 H new ATOM 0 HB2 GLU A 83 10.290 1.293 -9.336 1.00 0.00 H new ATOM 0 HB3 GLU A 83 10.266 1.355 -7.584 1.00 0.00 H new ATOM 0 HG2 GLU A 83 12.507 0.485 -7.409 1.00 0.00 H new ATOM 0 HG3 GLU A 83 12.511 -0.069 -9.071 1.00 0.00 H new ATOM 1288 N SER A 84 9.678 -2.369 -6.809 1.00 0.00 N ATOM 1289 CA SER A 84 9.764 -3.117 -5.521 1.00 0.00 C ATOM 1290 C SER A 84 10.471 -2.307 -4.481 1.00 0.00 C ATOM 1291 O SER A 84 11.415 -2.745 -3.840 1.00 0.00 O ATOM 1292 CB SER A 84 10.510 -4.412 -5.832 1.00 0.00 C ATOM 1293 OG SER A 84 10.078 -4.912 -7.091 1.00 0.00 O ATOM 0 H SER A 84 9.072 -2.812 -7.500 1.00 0.00 H new ATOM 0 HA SER A 84 8.775 -3.330 -5.114 1.00 0.00 H new ATOM 0 HB2 SER A 84 11.585 -4.231 -5.849 1.00 0.00 H new ATOM 0 HB3 SER A 84 10.323 -5.149 -5.051 1.00 0.00 H new ATOM 0 HG SER A 84 10.294 -5.866 -7.156 1.00 0.00 H new ATOM 1299 N LEU A 85 10.149 -1.057 -4.378 1.00 0.00 N ATOM 1300 CA LEU A 85 10.984 -0.255 -3.468 1.00 0.00 C ATOM 1301 C LEU A 85 12.280 -1.053 -3.370 1.00 0.00 C ATOM 1302 O LEU A 85 13.009 -1.020 -2.424 1.00 0.00 O ATOM 1303 CB LEU A 85 10.213 -0.240 -2.148 1.00 0.00 C ATOM 1304 CG LEU A 85 9.079 0.782 -2.237 1.00 0.00 C ATOM 1305 CD1 LEU A 85 7.788 0.076 -2.663 1.00 0.00 C ATOM 1306 CD2 LEU A 85 8.877 1.441 -0.872 1.00 0.00 C ATOM 0 H LEU A 85 9.386 -0.578 -4.856 1.00 0.00 H new ATOM 0 HA LEU A 85 11.199 0.771 -3.768 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.810 -1.231 -1.938 1.00 0.00 H new ATOM 0 HB3 LEU A 85 10.882 0.013 -1.326 1.00 0.00 H new ATOM 0 HG LEU A 85 9.334 1.545 -2.972 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.979 0.804 -2.727 1.00 0.00 H new ATOM 0 HD12 LEU A 85 7.933 -0.391 -3.637 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.532 -0.688 -1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 85 8.069 2.169 -0.936 1.00 0.00 H new ATOM 0 HD22 LEU A 85 8.622 0.680 -0.135 1.00 0.00 H new ATOM 0 HD23 LEU A 85 9.796 1.944 -0.571 1.00 0.00 H new ATOM 1318 N LYS A 86 12.528 -1.748 -4.479 1.00 0.00 N ATOM 1319 CA LYS A 86 13.742 -2.564 -4.715 1.00 0.00 C ATOM 1320 C LYS A 86 14.874 -1.609 -4.507 1.00 0.00 C ATOM 1321 O LYS A 86 15.907 -1.890 -3.932 1.00 0.00 O ATOM 1322 CB LYS A 86 13.588 -2.907 -6.210 1.00 0.00 C ATOM 1323 CG LYS A 86 13.919 -4.365 -6.495 1.00 0.00 C ATOM 1324 CD LYS A 86 13.243 -4.753 -7.814 1.00 0.00 C ATOM 1325 CE LYS A 86 13.628 -6.185 -8.191 1.00 0.00 C ATOM 1326 NZ LYS A 86 12.530 -6.656 -9.081 1.00 0.00 N ATOM 0 H LYS A 86 11.879 -1.767 -5.266 1.00 0.00 H new ATOM 0 HA LYS A 86 13.891 -3.451 -4.099 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.566 -2.698 -6.527 1.00 0.00 H new ATOM 0 HB3 LYS A 86 14.242 -2.264 -6.799 1.00 0.00 H new ATOM 0 HG2 LYS A 86 14.998 -4.505 -6.564 1.00 0.00 H new ATOM 0 HG3 LYS A 86 13.566 -5.002 -5.684 1.00 0.00 H new ATOM 0 HD2 LYS A 86 12.160 -4.671 -7.716 1.00 0.00 H new ATOM 0 HD3 LYS A 86 13.545 -4.065 -8.604 1.00 0.00 H new ATOM 0 HE2 LYS A 86 14.590 -6.214 -8.702 1.00 0.00 H new ATOM 0 HE3 LYS A 86 13.718 -6.816 -7.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 12.722 -7.633 -9.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.627 -6.624 -8.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 12.473 -6.041 -9.917 1.00 0.00 H new ATOM 1340 N LYS A 87 14.588 -0.433 -4.942 1.00 0.00 N ATOM 1341 CA LYS A 87 15.488 0.691 -4.791 1.00 0.00 C ATOM 1342 C LYS A 87 15.389 1.131 -3.341 1.00 0.00 C ATOM 1343 O LYS A 87 16.348 1.588 -2.737 1.00 0.00 O ATOM 1344 CB LYS A 87 14.865 1.720 -5.727 1.00 0.00 C ATOM 1345 CG LYS A 87 15.846 2.869 -5.973 1.00 0.00 C ATOM 1346 CD LYS A 87 15.727 3.340 -7.424 1.00 0.00 C ATOM 1347 CE LYS A 87 16.929 4.219 -7.776 1.00 0.00 C ATOM 1348 NZ LYS A 87 16.398 5.230 -8.732 1.00 0.00 N ATOM 0 H LYS A 87 13.716 -0.206 -5.420 1.00 0.00 H new ATOM 0 HA LYS A 87 16.539 0.510 -5.018 1.00 0.00 H new ATOM 0 HB2 LYS A 87 14.600 1.249 -6.673 1.00 0.00 H new ATOM 0 HB3 LYS A 87 13.942 2.106 -5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 87 15.634 3.694 -5.293 1.00 0.00 H new ATOM 0 HG3 LYS A 87 16.865 2.541 -5.768 1.00 0.00 H new ATOM 0 HD2 LYS A 87 15.683 2.481 -8.094 1.00 0.00 H new ATOM 0 HD3 LYS A 87 14.802 3.899 -7.561 1.00 0.00 H new ATOM 0 HE2 LYS A 87 17.344 4.695 -6.888 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.729 3.632 -8.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 17.164 5.871 -9.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 16.016 4.748 -9.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 15.642 5.778 -8.273 1.00 0.00 H new ATOM 1362 N ALA A 88 14.223 0.960 -2.758 1.00 0.00 N ATOM 1363 CA ALA A 88 14.077 1.356 -1.332 1.00 0.00 C ATOM 1364 C ALA A 88 14.611 0.231 -0.454 1.00 0.00 C ATOM 1365 O ALA A 88 14.963 0.419 0.687 1.00 0.00 O ATOM 1366 CB ALA A 88 12.583 1.575 -1.120 1.00 0.00 C ATOM 0 H ALA A 88 13.390 0.573 -3.200 1.00 0.00 H new ATOM 0 HA ALA A 88 14.633 2.258 -1.077 1.00 0.00 H new ATOM 0 HB1 ALA A 88 12.402 1.870 -0.087 1.00 0.00 H new ATOM 0 HB2 ALA A 88 12.232 2.361 -1.789 1.00 0.00 H new ATOM 0 HB3 ALA A 88 12.046 0.651 -1.333 1.00 0.00 H new ATOM 1372 N ALA A 89 14.690 -0.943 -0.989 1.00 0.00 N ATOM 1373 CA ALA A 89 15.214 -2.069 -0.196 1.00 0.00 C ATOM 1374 C ALA A 89 16.730 -2.007 -0.211 1.00 0.00 C ATOM 1375 O ALA A 89 17.374 -2.132 0.813 1.00 0.00 O ATOM 1376 CB ALA A 89 14.675 -3.323 -0.882 1.00 0.00 C ATOM 0 H ALA A 89 14.413 -1.171 -1.944 1.00 0.00 H new ATOM 0 HA ALA A 89 14.909 -2.052 0.850 1.00 0.00 H new ATOM 0 HB1 ALA A 89 15.023 -4.208 -0.348 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.585 -3.301 -0.876 1.00 0.00 H new ATOM 0 HB3 ALA A 89 15.032 -3.357 -1.911 1.00 0.00 H new ATOM 1382 N GLU A 90 17.307 -1.758 -1.351 1.00 0.00 N ATOM 1383 CA GLU A 90 18.785 -1.626 -1.404 1.00 0.00 C ATOM 1384 C GLU A 90 19.184 -0.491 -0.460 1.00 0.00 C ATOM 1385 O GLU A 90 20.250 -0.492 0.123 1.00 0.00 O ATOM 1386 CB GLU A 90 19.113 -1.271 -2.856 1.00 0.00 C ATOM 1387 CG GLU A 90 19.599 -2.523 -3.593 1.00 0.00 C ATOM 1388 CD GLU A 90 19.030 -2.534 -5.013 1.00 0.00 C ATOM 1389 OE1 GLU A 90 19.342 -1.625 -5.762 1.00 0.00 O ATOM 1390 OE2 GLU A 90 18.290 -3.452 -5.326 1.00 0.00 O ATOM 0 H GLU A 90 16.823 -1.641 -2.241 1.00 0.00 H new ATOM 0 HA GLU A 90 19.316 -2.529 -1.102 1.00 0.00 H new ATOM 0 HB2 GLU A 90 18.230 -0.865 -3.350 1.00 0.00 H new ATOM 0 HB3 GLU A 90 19.880 -0.497 -2.888 1.00 0.00 H new ATOM 0 HG2 GLU A 90 20.688 -2.538 -3.626 1.00 0.00 H new ATOM 0 HG3 GLU A 90 19.284 -3.418 -3.057 1.00 0.00 H new ATOM 1397 N GLY A 91 18.313 0.479 -0.308 1.00 0.00 N ATOM 1398 CA GLY A 91 18.612 1.621 0.599 1.00 0.00 C ATOM 1399 C GLY A 91 18.552 1.180 2.073 1.00 0.00 C ATOM 1400 O GLY A 91 19.295 1.685 2.892 1.00 0.00 O ATOM 0 H GLY A 91 17.408 0.524 -0.776 1.00 0.00 H new ATOM 0 HA2 GLY A 91 19.601 2.020 0.374 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.897 2.425 0.426 1.00 0.00 H new ATOM 1404 N LEU A 92 17.684 0.253 2.440 1.00 0.00 N ATOM 1405 CA LEU A 92 17.631 -0.167 3.883 1.00 0.00 C ATOM 1406 C LEU A 92 18.734 -1.175 4.194 1.00 0.00 C ATOM 1407 O LEU A 92 18.644 -1.928 5.143 1.00 0.00 O ATOM 1408 CB LEU A 92 16.234 -0.787 4.091 1.00 0.00 C ATOM 1409 CG LEU A 92 16.234 -2.297 3.802 1.00 0.00 C ATOM 1410 CD1 LEU A 92 16.329 -3.077 5.119 1.00 0.00 C ATOM 1411 CD2 LEU A 92 14.929 -2.674 3.092 1.00 0.00 C ATOM 0 H LEU A 92 17.027 -0.219 1.818 1.00 0.00 H new ATOM 0 HA LEU A 92 17.790 0.678 4.553 1.00 0.00 H new ATOM 0 HB2 LEU A 92 15.907 -0.613 5.116 1.00 0.00 H new ATOM 0 HB3 LEU A 92 15.515 -0.291 3.439 1.00 0.00 H new ATOM 0 HG LEU A 92 17.088 -2.543 3.171 1.00 0.00 H new ATOM 0 HD11 LEU A 92 16.329 -4.147 4.909 1.00 0.00 H new ATOM 0 HD12 LEU A 92 17.251 -2.809 5.635 1.00 0.00 H new ATOM 0 HD13 LEU A 92 15.475 -2.831 5.750 1.00 0.00 H new ATOM 0 HD21 LEU A 92 14.924 -3.744 2.885 1.00 0.00 H new ATOM 0 HD22 LEU A 92 14.082 -2.424 3.731 1.00 0.00 H new ATOM 0 HD23 LEU A 92 14.852 -2.122 2.155 1.00 0.00 H new ATOM 1423 N LYS A 93 19.766 -1.222 3.397 1.00 0.00 N ATOM 1424 CA LYS A 93 20.844 -2.220 3.652 1.00 0.00 C ATOM 1425 C LYS A 93 20.192 -3.597 3.651 1.00 0.00 C ATOM 1426 O LYS A 93 20.524 -4.472 4.428 1.00 0.00 O ATOM 1427 CB LYS A 93 21.424 -1.881 5.030 1.00 0.00 C ATOM 1428 CG LYS A 93 22.773 -1.180 4.858 1.00 0.00 C ATOM 1429 CD LYS A 93 22.548 0.239 4.332 1.00 0.00 C ATOM 1430 CE LYS A 93 22.262 1.178 5.505 1.00 0.00 C ATOM 1431 NZ LYS A 93 23.585 1.764 5.860 1.00 0.00 N ATOM 0 H LYS A 93 19.909 -0.619 2.587 1.00 0.00 H new ATOM 0 HA LYS A 93 21.638 -2.206 2.905 1.00 0.00 H new ATOM 0 HB2 LYS A 93 20.735 -1.238 5.578 1.00 0.00 H new ATOM 0 HB3 LYS A 93 21.547 -2.790 5.618 1.00 0.00 H new ATOM 0 HG2 LYS A 93 23.301 -1.146 5.811 1.00 0.00 H new ATOM 0 HG3 LYS A 93 23.400 -1.741 4.165 1.00 0.00 H new ATOM 0 HD2 LYS A 93 23.428 0.580 3.786 1.00 0.00 H new ATOM 0 HD3 LYS A 93 21.713 0.250 3.631 1.00 0.00 H new ATOM 0 HE2 LYS A 93 21.549 1.953 5.225 1.00 0.00 H new ATOM 0 HE3 LYS A 93 21.831 0.637 6.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 23.471 2.420 6.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 24.241 1.003 6.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 23.968 2.278 5.041 1.00 0.00 H new ATOM 1445 N TYR A 94 19.235 -3.762 2.775 1.00 0.00 N ATOM 1446 CA TYR A 94 18.492 -5.047 2.666 1.00 0.00 C ATOM 1447 C TYR A 94 19.444 -6.239 2.846 1.00 0.00 C ATOM 1448 O TYR A 94 19.079 -7.260 3.396 1.00 0.00 O ATOM 1449 CB TYR A 94 17.886 -5.007 1.256 1.00 0.00 C ATOM 1450 CG TYR A 94 18.327 -6.211 0.481 1.00 0.00 C ATOM 1451 CD1 TYR A 94 17.734 -7.445 0.736 1.00 0.00 C ATOM 1452 CD2 TYR A 94 19.344 -6.094 -0.467 1.00 0.00 C ATOM 1453 CE1 TYR A 94 18.156 -8.581 0.040 1.00 0.00 C ATOM 1454 CE2 TYR A 94 19.768 -7.226 -1.170 1.00 0.00 C ATOM 1455 CZ TYR A 94 19.176 -8.471 -0.917 1.00 0.00 C ATOM 1456 OH TYR A 94 19.600 -9.587 -1.607 1.00 0.00 O ATOM 0 H TYR A 94 18.933 -3.043 2.118 1.00 0.00 H new ATOM 0 HA TYR A 94 17.728 -5.167 3.434 1.00 0.00 H new ATOM 0 HB2 TYR A 94 16.798 -4.981 1.318 1.00 0.00 H new ATOM 0 HB3 TYR A 94 18.197 -4.098 0.742 1.00 0.00 H new ATOM 0 HD1 TYR A 94 16.948 -7.524 1.472 1.00 0.00 H new ATOM 0 HD2 TYR A 94 19.801 -5.134 -0.657 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.699 -9.539 0.238 1.00 0.00 H new ATOM 0 HE2 TYR A 94 20.552 -7.141 -1.908 1.00 0.00 H new ATOM 0 HH TYR A 94 20.311 -9.335 -2.232 1.00 0.00 H new ATOM 1466 N GLU A 95 20.664 -6.106 2.395 1.00 0.00 N ATOM 1467 CA GLU A 95 21.641 -7.224 2.552 1.00 0.00 C ATOM 1468 C GLU A 95 21.886 -7.475 4.037 1.00 0.00 C ATOM 1469 O GLU A 95 21.860 -8.599 4.500 1.00 0.00 O ATOM 1470 CB GLU A 95 22.923 -6.756 1.866 1.00 0.00 C ATOM 1471 CG GLU A 95 22.625 -6.388 0.410 1.00 0.00 C ATOM 1472 CD GLU A 95 23.937 -6.306 -0.375 1.00 0.00 C ATOM 1473 OE1 GLU A 95 24.909 -5.827 0.184 1.00 0.00 O ATOM 1474 OE2 GLU A 95 23.945 -6.721 -1.522 1.00 0.00 O ATOM 0 H GLU A 95 21.025 -5.275 1.927 1.00 0.00 H new ATOM 0 HA GLU A 95 21.280 -8.155 2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 95 23.335 -5.895 2.392 1.00 0.00 H new ATOM 0 HB3 GLU A 95 23.676 -7.543 1.905 1.00 0.00 H new ATOM 0 HG2 GLU A 95 21.967 -7.133 -0.037 1.00 0.00 H new ATOM 0 HG3 GLU A 95 22.102 -5.433 0.365 1.00 0.00 H new ATOM 1547 N MET B 1 -5.009 6.536 -10.427 1.00 0.00 N ATOM 1548 CA MET B 1 -4.340 7.804 -10.011 1.00 0.00 C ATOM 1549 C MET B 1 -2.818 7.622 -10.016 1.00 0.00 C ATOM 1550 O MET B 1 -2.307 6.679 -10.584 1.00 0.00 O ATOM 1551 CB MET B 1 -4.858 8.084 -8.601 1.00 0.00 C ATOM 1552 CG MET B 1 -6.080 9.003 -8.687 1.00 0.00 C ATOM 1553 SD MET B 1 -7.242 8.591 -7.367 1.00 0.00 S ATOM 1554 CE MET B 1 -6.209 9.145 -5.991 1.00 0.00 C ATOM 0 H1 MET B 1 -5.883 6.408 -9.878 1.00 0.00 H new ATOM 0 H2 MET B 1 -5.240 6.581 -11.440 1.00 0.00 H new ATOM 0 H3 MET B 1 -4.371 5.734 -10.253 1.00 0.00 H new ATOM 0 HA MET B 1 -4.557 8.631 -10.687 1.00 0.00 H new ATOM 0 HB2 MET B 1 -5.125 7.150 -8.106 1.00 0.00 H new ATOM 0 HB3 MET B 1 -4.078 8.552 -8.000 1.00 0.00 H new ATOM 0 HG2 MET B 1 -5.771 10.045 -8.601 1.00 0.00 H new ATOM 0 HG3 MET B 1 -6.563 8.893 -9.658 1.00 0.00 H new ATOM 0 HE1 MET B 1 -5.823 8.279 -5.454 1.00 0.00 H new ATOM 0 HE2 MET B 1 -5.377 9.735 -6.375 1.00 0.00 H new ATOM 0 HE3 MET B 1 -6.804 9.756 -5.313 1.00 0.00 H new ATOM 1566 N ASN B 2 -2.087 8.521 -9.396 1.00 0.00 N ATOM 1567 CA ASN B 2 -0.596 8.395 -9.383 1.00 0.00 C ATOM 1568 C ASN B 2 0.037 9.511 -8.548 1.00 0.00 C ATOM 1569 O ASN B 2 -0.646 10.375 -8.033 1.00 0.00 O ATOM 1570 CB ASN B 2 -0.175 8.531 -10.853 1.00 0.00 C ATOM 1571 CG ASN B 2 1.274 8.075 -11.032 1.00 0.00 C ATOM 1572 OD1 ASN B 2 1.549 6.894 -11.091 1.00 0.00 O ATOM 1573 ND2 ASN B 2 2.220 8.969 -11.125 1.00 0.00 N ATOM 0 H ASN B 2 -2.458 9.332 -8.901 1.00 0.00 H new ATOM 0 HA ASN B 2 -0.273 7.452 -8.943 1.00 0.00 H new ATOM 0 HB2 ASN B 2 -0.833 7.933 -11.484 1.00 0.00 H new ATOM 0 HB3 ASN B 2 -0.280 9.567 -11.175 1.00 0.00 H new ATOM 0 HD21 ASN B 2 3.189 8.675 -11.247 1.00 0.00 H new ATOM 0 HD22 ASN B 2 1.990 9.962 -11.076 1.00 0.00 H new ATOM 1580 N LYS B 3 1.346 9.500 -8.416 1.00 0.00 N ATOM 1581 CA LYS B 3 2.047 10.566 -7.622 1.00 0.00 C ATOM 1582 C LYS B 3 1.485 11.954 -7.967 1.00 0.00 C ATOM 1583 O LYS B 3 1.570 12.877 -7.184 1.00 0.00 O ATOM 1584 CB LYS B 3 3.528 10.474 -8.026 1.00 0.00 C ATOM 1585 CG LYS B 3 4.378 10.097 -6.804 1.00 0.00 C ATOM 1586 CD LYS B 3 5.746 10.801 -6.865 1.00 0.00 C ATOM 1587 CE LYS B 3 6.588 10.408 -5.635 1.00 0.00 C ATOM 1588 NZ LYS B 3 5.704 10.688 -4.471 1.00 0.00 N ATOM 0 H LYS B 3 1.961 8.796 -8.825 1.00 0.00 H new ATOM 0 HA LYS B 3 1.909 10.425 -6.550 1.00 0.00 H new ATOM 0 HB2 LYS B 3 3.654 9.730 -8.812 1.00 0.00 H new ATOM 0 HB3 LYS B 3 3.863 11.428 -8.433 1.00 0.00 H new ATOM 0 HG2 LYS B 3 3.857 10.379 -5.889 1.00 0.00 H new ATOM 0 HG3 LYS B 3 4.519 9.017 -6.770 1.00 0.00 H new ATOM 0 HD2 LYS B 3 6.269 10.522 -7.780 1.00 0.00 H new ATOM 0 HD3 LYS B 3 5.609 11.882 -6.893 1.00 0.00 H new ATOM 0 HE2 LYS B 3 6.876 9.357 -5.671 1.00 0.00 H new ATOM 0 HE3 LYS B 3 7.509 10.989 -5.583 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 6.278 11.026 -3.672 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 5.009 11.417 -4.730 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 5.207 9.817 -4.195 1.00 0.00 H new ATOM 1602 N THR B 4 0.897 12.102 -9.128 1.00 0.00 N ATOM 1603 CA THR B 4 0.314 13.425 -9.513 1.00 0.00 C ATOM 1604 C THR B 4 -1.205 13.374 -9.352 1.00 0.00 C ATOM 1605 O THR B 4 -1.822 14.283 -8.824 1.00 0.00 O ATOM 1606 CB THR B 4 0.701 13.621 -10.984 1.00 0.00 C ATOM 1607 OG1 THR B 4 2.088 13.914 -11.069 1.00 0.00 O ATOM 1608 CG2 THR B 4 -0.104 14.778 -11.585 1.00 0.00 C ATOM 0 H THR B 4 0.795 11.365 -9.826 1.00 0.00 H new ATOM 0 HA THR B 4 0.679 14.245 -8.894 1.00 0.00 H new ATOM 0 HB THR B 4 0.483 12.709 -11.539 1.00 0.00 H new ATOM 0 HG1 THR B 4 2.339 14.038 -12.008 1.00 0.00 H new ATOM 0 HG21 THR B 4 0.176 14.912 -12.630 1.00 0.00 H new ATOM 0 HG22 THR B 4 -1.169 14.553 -11.520 1.00 0.00 H new ATOM 0 HG23 THR B 4 0.107 15.694 -11.033 1.00 0.00 H new ATOM 1616 N GLU B 5 -1.812 12.308 -9.791 1.00 0.00 N ATOM 1617 CA GLU B 5 -3.289 12.188 -9.647 1.00 0.00 C ATOM 1618 C GLU B 5 -3.637 12.198 -8.158 1.00 0.00 C ATOM 1619 O GLU B 5 -4.516 12.912 -7.719 1.00 0.00 O ATOM 1620 CB GLU B 5 -3.654 10.857 -10.307 1.00 0.00 C ATOM 1621 CG GLU B 5 -4.529 11.116 -11.537 1.00 0.00 C ATOM 1622 CD GLU B 5 -4.226 10.068 -12.610 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -3.068 9.718 -12.759 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -5.160 9.633 -13.265 1.00 0.00 O ATOM 0 H GLU B 5 -1.352 11.517 -10.242 1.00 0.00 H new ATOM 0 HA GLU B 5 -3.839 13.006 -10.113 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -2.749 10.324 -10.598 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -4.185 10.221 -9.598 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -5.583 11.075 -11.262 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -4.340 12.116 -11.927 1.00 0.00 H new ATOM 1631 N LEU B 6 -2.934 11.437 -7.367 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.213 11.449 -5.902 1.00 0.00 C ATOM 1633 C LEU B 6 -2.854 12.820 -5.335 1.00 0.00 C ATOM 1634 O LEU B 6 -3.451 13.288 -4.380 1.00 0.00 O ATOM 1635 CB LEU B 6 -2.313 10.366 -5.305 1.00 0.00 C ATOM 1636 CG LEU B 6 -3.001 9.006 -5.417 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -1.965 7.932 -5.756 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -3.672 8.664 -4.084 1.00 0.00 C ATOM 0 H LEU B 6 -2.185 10.812 -7.666 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.262 11.260 -5.673 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -1.357 10.345 -5.828 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -2.100 10.592 -4.260 1.00 0.00 H new ATOM 0 HG LEU B 6 -3.753 9.045 -6.205 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.458 6.963 -5.835 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -1.487 8.175 -6.705 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.211 7.892 -4.970 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.163 7.694 -4.162 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -2.919 8.627 -3.297 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.412 9.427 -3.843 1.00 0.00 H new ATOM 1650 N ILE B 7 -1.901 13.487 -5.933 1.00 0.00 N ATOM 1651 CA ILE B 7 -1.532 14.840 -5.441 1.00 0.00 C ATOM 1652 C ILE B 7 -2.786 15.703 -5.469 1.00 0.00 C ATOM 1653 O ILE B 7 -3.245 16.190 -4.454 1.00 0.00 O ATOM 1654 CB ILE B 7 -0.462 15.350 -6.419 1.00 0.00 C ATOM 1655 CG1 ILE B 7 0.911 15.227 -5.762 1.00 0.00 C ATOM 1656 CG2 ILE B 7 -0.724 16.816 -6.774 1.00 0.00 C ATOM 1657 CD1 ILE B 7 1.978 15.868 -6.654 1.00 0.00 C ATOM 0 H ILE B 7 -1.367 13.153 -6.736 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.144 14.852 -4.422 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.497 14.754 -7.331 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.901 15.713 -4.786 1.00 0.00 H new ATOM 0 HG13 ILE B 7 1.150 14.177 -5.593 1.00 0.00 H new ATOM 0 HG21 ILE B 7 0.041 17.165 -7.467 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -1.705 16.908 -7.240 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -0.695 17.421 -5.868 1.00 0.00 H new ATOM 0 HD11 ILE B 7 2.954 15.776 -6.178 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.996 15.363 -7.620 1.00 0.00 H new ATOM 0 HD13 ILE B 7 1.744 16.922 -6.801 1.00 0.00 H new ATOM 1669 N LYS B 8 -3.359 15.864 -6.626 1.00 0.00 N ATOM 1670 CA LYS B 8 -4.604 16.665 -6.725 1.00 0.00 C ATOM 1671 C LYS B 8 -5.685 16.002 -5.875 1.00 0.00 C ATOM 1672 O LYS B 8 -6.584 16.657 -5.391 1.00 0.00 O ATOM 1673 CB LYS B 8 -4.988 16.675 -8.209 1.00 0.00 C ATOM 1674 CG LYS B 8 -5.178 15.243 -8.702 1.00 0.00 C ATOM 1675 CD LYS B 8 -5.934 15.248 -10.029 1.00 0.00 C ATOM 1676 CE LYS B 8 -6.186 13.805 -10.466 1.00 0.00 C ATOM 1677 NZ LYS B 8 -7.511 13.833 -11.146 1.00 0.00 N ATOM 0 H LYS B 8 -3.019 15.476 -7.506 1.00 0.00 H new ATOM 0 HA LYS B 8 -4.478 17.685 -6.362 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -5.906 17.244 -8.353 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -4.212 17.170 -8.792 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -4.209 14.760 -8.827 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -5.729 14.664 -7.961 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -6.880 15.779 -9.921 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -5.357 15.776 -10.789 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -5.404 13.455 -11.140 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -6.196 13.130 -9.610 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -7.753 12.876 -11.474 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -8.237 14.164 -10.479 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -7.470 14.478 -11.960 1.00 0.00 H new ATOM 1691 N ALA B 9 -5.596 14.706 -5.657 1.00 0.00 N ATOM 1692 CA ALA B 9 -6.617 14.038 -4.804 1.00 0.00 C ATOM 1693 C ALA B 9 -6.610 14.693 -3.428 1.00 0.00 C ATOM 1694 O ALA B 9 -7.643 14.920 -2.833 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.171 12.587 -4.707 1.00 0.00 C ATOM 0 H ALA B 9 -4.868 14.096 -6.030 1.00 0.00 H new ATOM 0 HA ALA B 9 -7.626 14.115 -5.208 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -6.877 12.030 -4.091 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.136 12.150 -5.705 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.180 12.540 -4.255 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.448 15.044 -2.935 1.00 0.00 N ATOM 1702 CA ILE B 10 -5.378 15.725 -1.628 1.00 0.00 C ATOM 1703 C ILE B 10 -5.449 17.212 -1.917 1.00 0.00 C ATOM 1704 O ILE B 10 -6.068 17.975 -1.210 1.00 0.00 O ATOM 1705 CB ILE B 10 -4.018 15.308 -1.035 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -4.238 14.339 0.128 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -3.246 16.534 -0.527 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -4.953 13.081 -0.374 1.00 0.00 C ATOM 0 H ILE B 10 -4.549 14.883 -3.390 1.00 0.00 H new ATOM 0 HA ILE B 10 -6.175 15.474 -0.928 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.437 14.824 -1.820 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -3.281 14.071 0.576 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.831 14.819 0.907 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -2.289 16.216 -0.113 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -3.072 17.223 -1.354 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.828 17.035 0.247 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -5.107 12.394 0.458 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -5.917 13.356 -0.801 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -4.344 12.596 -1.137 1.00 0.00 H new ATOM 1720 N ALA B 11 -4.859 17.626 -2.991 1.00 0.00 N ATOM 1721 CA ALA B 11 -4.940 19.061 -3.340 1.00 0.00 C ATOM 1722 C ALA B 11 -6.411 19.426 -3.582 1.00 0.00 C ATOM 1723 O ALA B 11 -6.776 20.584 -3.637 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.109 19.199 -4.612 1.00 0.00 C ATOM 0 H ALA B 11 -4.329 17.041 -3.637 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.569 19.725 -2.559 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.116 20.238 -4.940 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.083 18.889 -4.412 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -4.533 18.568 -5.394 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.260 18.433 -3.704 1.00 0.00 N ATOM 1731 CA GLN B 12 -8.707 18.696 -3.917 1.00 0.00 C ATOM 1732 C GLN B 12 -9.494 18.215 -2.694 1.00 0.00 C ATOM 1733 O GLN B 12 -10.351 18.916 -2.189 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.077 17.900 -5.175 1.00 0.00 C ATOM 1735 CG GLN B 12 -10.598 17.806 -5.319 1.00 0.00 C ATOM 1736 CD GLN B 12 -11.189 19.209 -5.472 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -12.151 19.551 -4.813 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -10.650 20.042 -6.319 1.00 0.00 N ATOM 0 H GLN B 12 -7.004 17.446 -3.664 1.00 0.00 H new ATOM 0 HA GLN B 12 -8.936 19.754 -4.044 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -8.651 18.381 -6.056 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -8.648 16.899 -5.119 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -10.854 17.197 -6.186 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -11.026 17.314 -4.446 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -9.842 19.755 -6.872 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -11.036 20.980 -6.428 1.00 0.00 H new ATOM 1747 N ASP B 13 -9.188 17.047 -2.183 1.00 0.00 N ATOM 1748 CA ASP B 13 -9.905 16.579 -0.958 1.00 0.00 C ATOM 1749 C ASP B 13 -9.542 17.541 0.161 1.00 0.00 C ATOM 1750 O ASP B 13 -10.328 17.855 1.033 1.00 0.00 O ATOM 1751 CB ASP B 13 -9.357 15.184 -0.661 1.00 0.00 C ATOM 1752 CG ASP B 13 -9.966 14.173 -1.634 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -10.105 14.510 -2.799 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -10.285 13.080 -1.199 1.00 0.00 O ATOM 0 H ASP B 13 -8.485 16.408 -2.554 1.00 0.00 H new ATOM 0 HA ASP B 13 -10.989 16.546 -1.070 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -8.271 15.182 -0.752 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -9.591 14.902 0.366 1.00 0.00 H new ATOM 1759 N THR B 14 -8.340 18.027 0.093 1.00 0.00 N ATOM 1760 CA THR B 14 -7.839 19.004 1.081 1.00 0.00 C ATOM 1761 C THR B 14 -7.974 20.400 0.451 1.00 0.00 C ATOM 1762 O THR B 14 -8.821 21.185 0.832 1.00 0.00 O ATOM 1763 CB THR B 14 -6.375 18.584 1.283 1.00 0.00 C ATOM 1764 OG1 THR B 14 -6.138 17.357 0.603 1.00 0.00 O ATOM 1765 CG2 THR B 14 -6.095 18.358 2.755 1.00 0.00 C ATOM 0 H THR B 14 -7.666 17.777 -0.631 1.00 0.00 H new ATOM 0 HA THR B 14 -8.368 19.031 2.034 1.00 0.00 H new ATOM 0 HB THR B 14 -5.731 19.374 0.896 1.00 0.00 H new ATOM 0 HG1 THR B 14 -6.006 16.640 1.258 1.00 0.00 H new ATOM 0 HG21 THR B 14 -5.055 18.061 2.886 1.00 0.00 H new ATOM 0 HG22 THR B 14 -6.281 19.280 3.306 1.00 0.00 H new ATOM 0 HG23 THR B 14 -6.748 17.571 3.133 1.00 0.00 H new ATOM 1773 N GLY B 15 -7.180 20.686 -0.549 1.00 0.00 N ATOM 1774 CA GLY B 15 -7.288 22.001 -1.264 1.00 0.00 C ATOM 1775 C GLY B 15 -7.103 23.177 -0.308 1.00 0.00 C ATOM 1776 O GLY B 15 -7.518 24.285 -0.586 1.00 0.00 O ATOM 0 H GLY B 15 -6.456 20.063 -0.906 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -6.537 22.050 -2.052 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -8.262 22.074 -1.747 1.00 0.00 H new ATOM 1780 N LEU B 16 -6.470 22.953 0.799 1.00 0.00 N ATOM 1781 CA LEU B 16 -6.237 24.071 1.768 1.00 0.00 C ATOM 1782 C LEU B 16 -5.312 25.096 1.149 1.00 0.00 C ATOM 1783 O LEU B 16 -5.677 26.225 0.887 1.00 0.00 O ATOM 1784 CB LEU B 16 -5.540 23.439 2.968 1.00 0.00 C ATOM 1785 CG LEU B 16 -6.477 22.451 3.633 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -6.193 21.053 3.102 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -6.250 22.482 5.149 1.00 0.00 C ATOM 0 H LEU B 16 -6.099 22.047 1.085 1.00 0.00 H new ATOM 0 HA LEU B 16 -7.169 24.565 2.043 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -4.629 22.934 2.648 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -5.244 24.211 3.678 1.00 0.00 H new ATOM 0 HG LEU B 16 -7.511 22.718 3.415 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -6.865 20.339 3.578 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -6.349 21.035 2.023 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -5.161 20.782 3.324 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -6.922 21.773 5.632 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -5.217 22.210 5.368 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -6.449 23.485 5.526 1.00 0.00 H new ATOM 1799 N THR B 17 -4.105 24.692 0.927 1.00 0.00 N ATOM 1800 CA THR B 17 -3.101 25.592 0.337 1.00 0.00 C ATOM 1801 C THR B 17 -2.339 24.834 -0.742 1.00 0.00 C ATOM 1802 O THR B 17 -1.335 25.295 -1.248 1.00 0.00 O ATOM 1803 CB THR B 17 -2.185 25.938 1.524 1.00 0.00 C ATOM 1804 OG1 THR B 17 -1.890 27.327 1.508 1.00 0.00 O ATOM 1805 CG2 THR B 17 -0.882 25.137 1.453 1.00 0.00 C ATOM 0 H THR B 17 -3.766 23.753 1.135 1.00 0.00 H new ATOM 0 HA THR B 17 -3.518 26.484 -0.131 1.00 0.00 H new ATOM 0 HB THR B 17 -2.702 25.681 2.449 1.00 0.00 H new ATOM 0 HG1 THR B 17 -1.308 27.547 2.265 1.00 0.00 H new ATOM 0 HG21 THR B 17 -0.249 25.397 2.301 1.00 0.00 H new ATOM 0 HG22 THR B 17 -1.108 24.071 1.482 1.00 0.00 H new ATOM 0 HG23 THR B 17 -0.360 25.372 0.525 1.00 0.00 H new ATOM 1813 N GLN B 18 -2.767 23.633 -1.049 1.00 0.00 N ATOM 1814 CA GLN B 18 -2.007 22.815 -2.023 1.00 0.00 C ATOM 1815 C GLN B 18 -0.607 22.664 -1.446 1.00 0.00 C ATOM 1816 O GLN B 18 0.357 22.466 -2.156 1.00 0.00 O ATOM 1817 CB GLN B 18 -1.990 23.598 -3.342 1.00 0.00 C ATOM 1818 CG GLN B 18 -3.387 24.147 -3.632 1.00 0.00 C ATOM 1819 CD GLN B 18 -3.508 24.483 -5.120 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -2.516 24.675 -5.795 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -4.692 24.563 -5.664 1.00 0.00 N ATOM 0 H GLN B 18 -3.604 23.193 -0.666 1.00 0.00 H new ATOM 0 HA GLN B 18 -2.435 21.829 -2.204 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -1.272 24.416 -3.281 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -1.667 22.950 -4.157 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -4.143 23.413 -3.352 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -3.570 25.038 -3.032 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -5.525 24.402 -5.098 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -4.784 24.787 -6.655 1.00 0.00 H new ATOM 1830 N VAL B 19 -0.524 22.780 -0.130 1.00 0.00 N ATOM 1831 CA VAL B 19 0.775 22.677 0.599 1.00 0.00 C ATOM 1832 C VAL B 19 1.909 22.623 -0.416 1.00 0.00 C ATOM 1833 O VAL B 19 2.346 23.635 -0.928 1.00 0.00 O ATOM 1834 CB VAL B 19 0.618 21.404 1.494 1.00 0.00 C ATOM 1835 CG1 VAL B 19 -0.231 20.346 0.794 1.00 0.00 C ATOM 1836 CG2 VAL B 19 1.955 20.755 1.893 1.00 0.00 C ATOM 0 H VAL B 19 -1.329 22.946 0.474 1.00 0.00 H new ATOM 0 HA VAL B 19 1.021 23.528 1.234 1.00 0.00 H new ATOM 0 HB VAL B 19 0.131 21.758 2.403 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -0.325 19.471 1.437 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -1.221 20.752 0.587 1.00 0.00 H new ATOM 0 HG13 VAL B 19 0.246 20.058 -0.143 1.00 0.00 H new ATOM 0 HG21 VAL B 19 1.764 19.879 2.512 1.00 0.00 H new ATOM 0 HG22 VAL B 19 2.495 20.454 0.996 1.00 0.00 H new ATOM 0 HG23 VAL B 19 2.554 21.472 2.454 1.00 0.00 H new ATOM 1846 N SER B 20 2.340 21.471 -0.745 1.00 0.00 N ATOM 1847 CA SER B 20 3.379 21.312 -1.752 1.00 0.00 C ATOM 1848 C SER B 20 2.962 20.149 -2.624 1.00 0.00 C ATOM 1849 O SER B 20 3.790 19.504 -3.205 1.00 0.00 O ATOM 1850 CB SER B 20 4.643 21.026 -0.968 1.00 0.00 C ATOM 1851 OG SER B 20 4.852 19.629 -0.913 1.00 0.00 O ATOM 0 H SER B 20 2.002 20.597 -0.342 1.00 0.00 H new ATOM 0 HA SER B 20 3.537 22.177 -2.397 1.00 0.00 H new ATOM 0 HB2 SER B 20 5.496 21.515 -1.440 1.00 0.00 H new ATOM 0 HB3 SER B 20 4.560 21.433 0.040 1.00 0.00 H new ATOM 0 HG SER B 20 4.185 19.221 -0.322 1.00 0.00 H new ATOM 1857 N VAL B 21 1.675 19.851 -2.665 1.00 0.00 N ATOM 1858 CA VAL B 21 1.140 18.693 -3.442 1.00 0.00 C ATOM 1859 C VAL B 21 2.239 18.009 -4.220 1.00 0.00 C ATOM 1860 O VAL B 21 2.377 16.802 -4.229 1.00 0.00 O ATOM 1861 CB VAL B 21 0.107 19.299 -4.393 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -1.138 19.705 -3.602 1.00 0.00 C ATOM 1863 CG2 VAL B 21 0.679 20.533 -5.103 1.00 0.00 C ATOM 0 H VAL B 21 0.959 20.385 -2.173 1.00 0.00 H new ATOM 0 HA VAL B 21 0.707 17.934 -2.791 1.00 0.00 H new ATOM 0 HB VAL B 21 -0.153 18.552 -5.143 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -1.875 20.137 -4.279 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.563 18.827 -3.116 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -0.865 20.441 -2.846 1.00 0.00 H new ATOM 0 HG21 VAL B 21 -0.073 20.948 -5.774 1.00 0.00 H new ATOM 0 HG22 VAL B 21 0.957 21.283 -4.362 1.00 0.00 H new ATOM 0 HG23 VAL B 21 1.560 20.247 -5.677 1.00 0.00 H new ATOM 1873 N SER B 22 3.047 18.798 -4.819 1.00 0.00 N ATOM 1874 CA SER B 22 4.187 18.243 -5.599 1.00 0.00 C ATOM 1875 C SER B 22 5.286 17.753 -4.665 1.00 0.00 C ATOM 1876 O SER B 22 5.908 16.743 -4.914 1.00 0.00 O ATOM 1877 CB SER B 22 4.682 19.396 -6.470 1.00 0.00 C ATOM 1878 OG SER B 22 3.834 19.525 -7.605 1.00 0.00 O ATOM 0 H SER B 22 2.980 19.816 -4.812 1.00 0.00 H new ATOM 0 HA SER B 22 3.889 17.385 -6.202 1.00 0.00 H new ATOM 0 HB2 SER B 22 4.686 20.324 -5.898 1.00 0.00 H new ATOM 0 HB3 SER B 22 5.708 19.213 -6.787 1.00 0.00 H new ATOM 0 HG SER B 22 4.148 20.265 -8.165 1.00 0.00 H new ATOM 1884 N LYS B 23 5.529 18.451 -3.595 1.00 0.00 N ATOM 1885 CA LYS B 23 6.588 18.012 -2.659 1.00 0.00 C ATOM 1886 C LYS B 23 6.012 17.134 -1.546 1.00 0.00 C ATOM 1887 O LYS B 23 6.714 16.301 -1.020 1.00 0.00 O ATOM 1888 CB LYS B 23 7.193 19.294 -2.093 1.00 0.00 C ATOM 1889 CG LYS B 23 8.322 19.778 -3.002 1.00 0.00 C ATOM 1890 CD LYS B 23 8.757 21.186 -2.576 1.00 0.00 C ATOM 1891 CE LYS B 23 7.546 22.127 -2.572 1.00 0.00 C ATOM 1892 NZ LYS B 23 8.019 23.369 -3.245 1.00 0.00 N ATOM 0 H LYS B 23 5.039 19.306 -3.331 1.00 0.00 H new ATOM 0 HA LYS B 23 7.340 17.404 -3.162 1.00 0.00 H new ATOM 0 HB2 LYS B 23 6.425 20.063 -2.010 1.00 0.00 H new ATOM 0 HB3 LYS B 23 7.575 19.114 -1.088 1.00 0.00 H new ATOM 0 HG2 LYS B 23 9.167 19.092 -2.945 1.00 0.00 H new ATOM 0 HG3 LYS B 23 7.988 19.788 -4.040 1.00 0.00 H new ATOM 0 HD2 LYS B 23 9.206 21.153 -1.583 1.00 0.00 H new ATOM 0 HD3 LYS B 23 9.519 21.563 -3.258 1.00 0.00 H new ATOM 0 HE2 LYS B 23 6.703 21.687 -3.104 1.00 0.00 H new ATOM 0 HE3 LYS B 23 7.210 22.333 -1.556 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 7.244 24.062 -3.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 8.818 23.770 -2.713 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 8.326 23.144 -4.213 1.00 0.00 H new ATOM 1906 N MET B 24 4.751 17.268 -1.172 1.00 0.00 N ATOM 1907 CA MET B 24 4.262 16.364 -0.096 1.00 0.00 C ATOM 1908 C MET B 24 4.156 14.956 -0.667 1.00 0.00 C ATOM 1909 O MET B 24 4.487 13.995 0.000 1.00 0.00 O ATOM 1910 CB MET B 24 2.902 16.854 0.457 1.00 0.00 C ATOM 1911 CG MET B 24 2.244 17.937 -0.404 1.00 0.00 C ATOM 1912 SD MET B 24 0.487 17.566 -0.519 1.00 0.00 S ATOM 1913 CE MET B 24 0.731 16.030 -1.428 1.00 0.00 C ATOM 0 H MET B 24 4.077 17.933 -1.550 1.00 0.00 H new ATOM 0 HA MET B 24 4.961 16.364 0.740 1.00 0.00 H new ATOM 0 HB2 MET B 24 2.224 16.004 0.537 1.00 0.00 H new ATOM 0 HB3 MET B 24 3.048 17.242 1.465 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.397 18.921 0.039 1.00 0.00 H new ATOM 0 HG3 MET B 24 2.694 17.960 -1.396 1.00 0.00 H new ATOM 0 HE1 MET B 24 -0.052 15.923 -2.178 1.00 0.00 H new ATOM 0 HE2 MET B 24 1.704 16.048 -1.919 1.00 0.00 H new ATOM 0 HE3 MET B 24 0.689 15.188 -0.737 1.00 0.00 H new ATOM 1923 N LEU B 25 3.744 14.802 -1.910 1.00 0.00 N ATOM 1924 CA LEU B 25 3.702 13.427 -2.463 1.00 0.00 C ATOM 1925 C LEU B 25 5.113 13.043 -2.895 1.00 0.00 C ATOM 1926 O LEU B 25 5.628 12.019 -2.494 1.00 0.00 O ATOM 1927 CB LEU B 25 2.746 13.463 -3.655 1.00 0.00 C ATOM 1928 CG LEU B 25 1.279 13.503 -3.184 1.00 0.00 C ATOM 1929 CD1 LEU B 25 0.448 12.536 -4.030 1.00 0.00 C ATOM 1930 CD2 LEU B 25 1.148 13.090 -1.710 1.00 0.00 C ATOM 0 H LEU B 25 3.447 15.549 -2.538 1.00 0.00 H new ATOM 0 HA LEU B 25 3.357 12.691 -1.737 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.958 14.337 -4.270 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.907 12.586 -4.282 1.00 0.00 H new ATOM 0 HG LEU B 25 0.922 14.527 -3.295 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.590 12.563 -3.699 1.00 0.00 H new ATOM 0 HD12 LEU B 25 0.502 12.831 -5.078 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.839 11.525 -3.917 1.00 0.00 H new ATOM 0 HD21 LEU B 25 0.100 13.130 -1.413 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.523 12.075 -1.582 1.00 0.00 H new ATOM 0 HD23 LEU B 25 1.728 13.772 -1.088 1.00 0.00 H new ATOM 1942 N ALA B 26 5.761 13.872 -3.679 1.00 0.00 N ATOM 1943 CA ALA B 26 7.157 13.553 -4.098 1.00 0.00 C ATOM 1944 C ALA B 26 7.973 13.194 -2.861 1.00 0.00 C ATOM 1945 O ALA B 26 8.835 12.340 -2.899 1.00 0.00 O ATOM 1946 CB ALA B 26 7.700 14.825 -4.748 1.00 0.00 C ATOM 0 H ALA B 26 5.385 14.748 -4.043 1.00 0.00 H new ATOM 0 HA ALA B 26 7.204 12.712 -4.790 1.00 0.00 H new ATOM 0 HB1 ALA B 26 8.725 14.656 -5.078 1.00 0.00 H new ATOM 0 HB2 ALA B 26 7.081 15.088 -5.606 1.00 0.00 H new ATOM 0 HB3 ALA B 26 7.682 15.640 -4.024 1.00 0.00 H new ATOM 1952 N SER B 27 7.678 13.824 -1.750 1.00 0.00 N ATOM 1953 CA SER B 27 8.406 13.498 -0.496 1.00 0.00 C ATOM 1954 C SER B 27 7.779 12.255 0.122 1.00 0.00 C ATOM 1955 O SER B 27 8.455 11.438 0.704 1.00 0.00 O ATOM 1956 CB SER B 27 8.230 14.700 0.426 1.00 0.00 C ATOM 1957 OG SER B 27 6.874 14.777 0.847 1.00 0.00 O ATOM 0 H SER B 27 6.965 14.548 -1.663 1.00 0.00 H new ATOM 0 HA SER B 27 9.464 13.299 -0.669 1.00 0.00 H new ATOM 0 HB2 SER B 27 8.886 14.608 1.291 1.00 0.00 H new ATOM 0 HB3 SER B 27 8.514 15.615 -0.093 1.00 0.00 H new ATOM 0 HG SER B 27 6.301 14.957 0.073 1.00 0.00 H new ATOM 1963 N PHE B 28 6.487 12.098 -0.028 1.00 0.00 N ATOM 1964 CA PHE B 28 5.805 10.889 0.528 1.00 0.00 C ATOM 1965 C PHE B 28 6.483 9.661 -0.041 1.00 0.00 C ATOM 1966 O PHE B 28 6.951 8.819 0.686 1.00 0.00 O ATOM 1967 CB PHE B 28 4.350 11.034 0.076 1.00 0.00 C ATOM 1968 CG PHE B 28 3.680 9.700 -0.175 1.00 0.00 C ATOM 1969 CD1 PHE B 28 3.826 9.055 -1.410 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.848 9.145 0.805 1.00 0.00 C ATOM 1971 CE1 PHE B 28 3.142 7.867 -1.661 1.00 0.00 C ATOM 1972 CE2 PHE B 28 2.174 7.952 0.557 1.00 0.00 C ATOM 1973 CZ PHE B 28 2.314 7.312 -0.678 1.00 0.00 C ATOM 0 H PHE B 28 5.875 12.755 -0.512 1.00 0.00 H new ATOM 0 HA PHE B 28 5.854 10.793 1.613 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.791 11.580 0.836 1.00 0.00 H new ATOM 0 HB3 PHE B 28 4.315 11.631 -0.835 1.00 0.00 H new ATOM 0 HD1 PHE B 28 4.469 9.478 -2.168 1.00 0.00 H new ATOM 0 HD2 PHE B 28 2.729 9.643 1.756 1.00 0.00 H new ATOM 0 HE1 PHE B 28 3.251 7.374 -2.616 1.00 0.00 H new ATOM 0 HE2 PHE B 28 1.542 7.521 1.320 1.00 0.00 H new ATOM 0 HZ PHE B 28 1.784 6.391 -0.873 1.00 0.00 H new ATOM 1983 N GLU B 29 6.617 9.575 -1.322 1.00 0.00 N ATOM 1984 CA GLU B 29 7.345 8.424 -1.868 1.00 0.00 C ATOM 1985 C GLU B 29 8.772 8.523 -1.358 1.00 0.00 C ATOM 1986 O GLU B 29 9.383 7.548 -0.984 1.00 0.00 O ATOM 1987 CB GLU B 29 7.322 8.591 -3.376 1.00 0.00 C ATOM 1988 CG GLU B 29 8.214 7.522 -3.987 1.00 0.00 C ATOM 1989 CD GLU B 29 9.406 8.176 -4.689 1.00 0.00 C ATOM 1990 OE1 GLU B 29 10.010 9.053 -4.095 1.00 0.00 O ATOM 1991 OE2 GLU B 29 9.695 7.788 -5.810 1.00 0.00 O ATOM 0 H GLU B 29 6.259 10.243 -2.004 1.00 0.00 H new ATOM 0 HA GLU B 29 6.916 7.464 -1.582 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.304 8.497 -3.753 1.00 0.00 H new ATOM 0 HB3 GLU B 29 7.675 9.584 -3.654 1.00 0.00 H new ATOM 0 HG2 GLU B 29 8.566 6.843 -3.211 1.00 0.00 H new ATOM 0 HG3 GLU B 29 7.645 6.925 -4.699 1.00 0.00 H new ATOM 1998 N LYS B 30 9.287 9.722 -1.310 1.00 0.00 N ATOM 1999 CA LYS B 30 10.664 9.916 -0.802 1.00 0.00 C ATOM 2000 C LYS B 30 10.730 9.418 0.626 1.00 0.00 C ATOM 2001 O LYS B 30 11.756 9.038 1.091 1.00 0.00 O ATOM 2002 CB LYS B 30 10.934 11.418 -0.861 1.00 0.00 C ATOM 2003 CG LYS B 30 12.444 11.663 -0.846 1.00 0.00 C ATOM 2004 CD LYS B 30 12.719 13.165 -0.938 1.00 0.00 C ATOM 2005 CE LYS B 30 12.407 13.826 0.408 1.00 0.00 C ATOM 2006 NZ LYS B 30 12.050 15.232 0.072 1.00 0.00 N ATOM 0 H LYS B 30 8.808 10.574 -1.603 1.00 0.00 H new ATOM 0 HA LYS B 30 11.404 9.370 -1.387 1.00 0.00 H new ATOM 0 HB2 LYS B 30 10.494 11.843 -1.763 1.00 0.00 H new ATOM 0 HB3 LYS B 30 10.465 11.917 -0.013 1.00 0.00 H new ATOM 0 HG2 LYS B 30 12.880 11.258 0.068 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.915 11.145 -1.681 1.00 0.00 H new ATOM 0 HD2 LYS B 30 13.761 13.339 -1.207 1.00 0.00 H new ATOM 0 HD3 LYS B 30 12.108 13.610 -1.724 1.00 0.00 H new ATOM 0 HE2 LYS B 30 11.585 13.320 0.915 1.00 0.00 H new ATOM 0 HE3 LYS B 30 13.267 13.786 1.076 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 11.823 15.750 0.944 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 12.853 15.690 -0.404 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 11.224 15.239 -0.560 1.00 0.00 H new ATOM 2020 N ILE B 31 9.634 9.372 1.318 1.00 0.00 N ATOM 2021 CA ILE B 31 9.688 8.844 2.701 1.00 0.00 C ATOM 2022 C ILE B 31 9.141 7.430 2.700 1.00 0.00 C ATOM 2023 O ILE B 31 9.528 6.603 3.488 1.00 0.00 O ATOM 2024 CB ILE B 31 8.876 9.768 3.602 1.00 0.00 C ATOM 2025 CG1 ILE B 31 7.616 10.278 2.927 1.00 0.00 C ATOM 2026 CG2 ILE B 31 9.746 10.948 4.028 1.00 0.00 C ATOM 2027 CD1 ILE B 31 6.414 9.783 3.725 1.00 0.00 C ATOM 0 H ILE B 31 8.715 9.672 0.993 1.00 0.00 H new ATOM 0 HA ILE B 31 10.710 8.811 3.078 1.00 0.00 H new ATOM 0 HB ILE B 31 8.563 9.190 4.472 1.00 0.00 H new ATOM 0 HG12 ILE B 31 7.622 11.367 2.885 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.564 9.919 1.899 1.00 0.00 H new ATOM 0 HG21 ILE B 31 9.169 11.611 4.672 1.00 0.00 H new ATOM 0 HG22 ILE B 31 10.617 10.581 4.571 1.00 0.00 H new ATOM 0 HG23 ILE B 31 10.074 11.496 3.145 1.00 0.00 H new ATOM 0 HD11 ILE B 31 5.496 10.138 3.257 1.00 0.00 H new ATOM 0 HD12 ILE B 31 6.414 8.693 3.744 1.00 0.00 H new ATOM 0 HD13 ILE B 31 6.473 10.164 4.745 1.00 0.00 H new ATOM 2039 N ILE B 32 8.282 7.137 1.778 1.00 0.00 N ATOM 2040 CA ILE B 32 7.752 5.753 1.683 1.00 0.00 C ATOM 2041 C ILE B 32 8.883 4.858 1.229 1.00 0.00 C ATOM 2042 O ILE B 32 9.217 3.883 1.872 1.00 0.00 O ATOM 2043 CB ILE B 32 6.643 5.767 0.635 1.00 0.00 C ATOM 2044 CG1 ILE B 32 5.551 6.774 1.052 1.00 0.00 C ATOM 2045 CG2 ILE B 32 6.052 4.354 0.524 1.00 0.00 C ATOM 2046 CD1 ILE B 32 4.289 6.049 1.526 1.00 0.00 C ATOM 0 H ILE B 32 7.921 7.792 1.084 1.00 0.00 H new ATOM 0 HA ILE B 32 7.362 5.393 2.635 1.00 0.00 H new ATOM 0 HB ILE B 32 7.043 6.070 -0.333 1.00 0.00 H new ATOM 0 HG12 ILE B 32 5.928 7.415 1.849 1.00 0.00 H new ATOM 0 HG13 ILE B 32 5.308 7.422 0.210 1.00 0.00 H new ATOM 0 HG21 ILE B 32 5.257 4.350 -0.222 1.00 0.00 H new ATOM 0 HG22 ILE B 32 6.834 3.655 0.226 1.00 0.00 H new ATOM 0 HG23 ILE B 32 5.645 4.053 1.489 1.00 0.00 H new ATOM 0 HD11 ILE B 32 3.535 6.782 1.814 1.00 0.00 H new ATOM 0 HD12 ILE B 32 3.901 5.428 0.719 1.00 0.00 H new ATOM 0 HD13 ILE B 32 4.531 5.421 2.383 1.00 0.00 H new ATOM 2058 N THR B 33 9.499 5.199 0.132 1.00 0.00 N ATOM 2059 CA THR B 33 10.631 4.379 -0.340 1.00 0.00 C ATOM 2060 C THR B 33 11.799 4.587 0.591 1.00 0.00 C ATOM 2061 O THR B 33 12.427 3.655 1.054 1.00 0.00 O ATOM 2062 CB THR B 33 11.006 4.887 -1.727 1.00 0.00 C ATOM 2063 OG1 THR B 33 10.586 6.228 -1.896 1.00 0.00 O ATOM 2064 CG2 THR B 33 10.346 4.012 -2.761 1.00 0.00 C ATOM 0 H THR B 33 9.265 6.004 -0.449 1.00 0.00 H new ATOM 0 HA THR B 33 10.370 3.321 -0.368 1.00 0.00 H new ATOM 0 HB THR B 33 12.089 4.850 -1.842 1.00 0.00 H new ATOM 0 HG1 THR B 33 10.494 6.655 -1.019 1.00 0.00 H new ATOM 0 HG21 THR B 33 10.607 4.366 -3.758 1.00 0.00 H new ATOM 0 HG22 THR B 33 10.688 2.984 -2.640 1.00 0.00 H new ATOM 0 HG23 THR B 33 9.264 4.051 -2.634 1.00 0.00 H new ATOM 2072 N GLU B 34 12.099 5.821 0.861 1.00 0.00 N ATOM 2073 CA GLU B 34 13.233 6.114 1.752 1.00 0.00 C ATOM 2074 C GLU B 34 13.016 5.445 3.110 1.00 0.00 C ATOM 2075 O GLU B 34 13.953 4.953 3.704 1.00 0.00 O ATOM 2076 CB GLU B 34 13.256 7.630 1.840 1.00 0.00 C ATOM 2077 CG GLU B 34 13.656 8.193 0.457 1.00 0.00 C ATOM 2078 CD GLU B 34 15.092 7.777 0.131 1.00 0.00 C ATOM 2079 OE1 GLU B 34 16.000 8.485 0.532 1.00 0.00 O ATOM 2080 OE2 GLU B 34 15.259 6.756 -0.516 1.00 0.00 O ATOM 0 H GLU B 34 11.604 6.636 0.500 1.00 0.00 H new ATOM 0 HA GLU B 34 14.187 5.730 1.390 1.00 0.00 H new ATOM 0 HB2 GLU B 34 12.277 8.008 2.134 1.00 0.00 H new ATOM 0 HB3 GLU B 34 13.965 7.955 2.601 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.976 7.821 -0.309 1.00 0.00 H new ATOM 0 HG3 GLU B 34 13.572 9.280 0.457 1.00 0.00 H new ATOM 2087 N THR B 35 11.792 5.369 3.598 1.00 0.00 N ATOM 2088 CA THR B 35 11.591 4.664 4.899 1.00 0.00 C ATOM 2089 C THR B 35 11.828 3.189 4.664 1.00 0.00 C ATOM 2090 O THR B 35 12.498 2.539 5.440 1.00 0.00 O ATOM 2091 CB THR B 35 10.157 4.943 5.356 1.00 0.00 C ATOM 2092 OG1 THR B 35 10.030 6.320 5.686 1.00 0.00 O ATOM 2093 CG2 THR B 35 9.844 4.103 6.596 1.00 0.00 C ATOM 0 H THR B 35 10.953 5.753 3.163 1.00 0.00 H new ATOM 0 HA THR B 35 12.278 5.005 5.674 1.00 0.00 H new ATOM 0 HB THR B 35 9.464 4.687 4.554 1.00 0.00 H new ATOM 0 HG1 THR B 35 10.126 6.861 4.874 1.00 0.00 H new ATOM 0 HG21 THR B 35 8.823 4.301 6.922 1.00 0.00 H new ATOM 0 HG22 THR B 35 9.949 3.045 6.355 1.00 0.00 H new ATOM 0 HG23 THR B 35 10.537 4.363 7.396 1.00 0.00 H new ATOM 2101 N VAL B 36 11.335 2.648 3.578 1.00 0.00 N ATOM 2102 CA VAL B 36 11.622 1.213 3.312 1.00 0.00 C ATOM 2103 C VAL B 36 13.133 1.064 3.291 1.00 0.00 C ATOM 2104 O VAL B 36 13.683 0.161 3.884 1.00 0.00 O ATOM 2105 CB VAL B 36 11.009 0.887 1.957 1.00 0.00 C ATOM 2106 CG1 VAL B 36 11.494 -0.493 1.508 1.00 0.00 C ATOM 2107 CG2 VAL B 36 9.484 0.883 2.088 1.00 0.00 C ATOM 0 H VAL B 36 10.761 3.126 2.883 1.00 0.00 H new ATOM 0 HA VAL B 36 11.209 0.538 4.062 1.00 0.00 H new ATOM 0 HB VAL B 36 11.308 1.633 1.220 1.00 0.00 H new ATOM 0 HG11 VAL B 36 11.059 -0.734 0.538 1.00 0.00 H new ATOM 0 HG12 VAL B 36 12.581 -0.488 1.427 1.00 0.00 H new ATOM 0 HG13 VAL B 36 11.188 -1.242 2.239 1.00 0.00 H new ATOM 0 HG21 VAL B 36 9.036 0.650 1.122 1.00 0.00 H new ATOM 0 HG22 VAL B 36 9.183 0.131 2.818 1.00 0.00 H new ATOM 0 HG23 VAL B 36 9.145 1.865 2.418 1.00 0.00 H new ATOM 2117 N ALA B 37 13.809 1.989 2.654 1.00 0.00 N ATOM 2118 CA ALA B 37 15.295 1.934 2.649 1.00 0.00 C ATOM 2119 C ALA B 37 15.835 2.424 3.999 1.00 0.00 C ATOM 2120 O ALA B 37 17.029 2.489 4.212 1.00 0.00 O ATOM 2121 CB ALA B 37 15.753 2.827 1.502 1.00 0.00 C ATOM 0 H ALA B 37 13.397 2.770 2.144 1.00 0.00 H new ATOM 0 HA ALA B 37 15.668 0.920 2.508 1.00 0.00 H new ATOM 0 HB1 ALA B 37 16.842 2.824 1.451 1.00 0.00 H new ATOM 0 HB2 ALA B 37 15.345 2.452 0.563 1.00 0.00 H new ATOM 0 HB3 ALA B 37 15.400 3.845 1.670 1.00 0.00 H new ATOM 2127 N LYS B 38 14.962 2.742 4.927 1.00 0.00 N ATOM 2128 CA LYS B 38 15.429 3.182 6.274 1.00 0.00 C ATOM 2129 C LYS B 38 14.889 2.222 7.335 1.00 0.00 C ATOM 2130 O LYS B 38 15.078 2.418 8.520 1.00 0.00 O ATOM 2131 CB LYS B 38 14.867 4.591 6.480 1.00 0.00 C ATOM 2132 CG LYS B 38 16.010 5.611 6.444 1.00 0.00 C ATOM 2133 CD LYS B 38 15.543 6.882 5.728 1.00 0.00 C ATOM 2134 CE LYS B 38 16.107 6.909 4.304 1.00 0.00 C ATOM 2135 NZ LYS B 38 16.620 8.295 4.120 1.00 0.00 N ATOM 0 H LYS B 38 13.949 2.715 4.807 1.00 0.00 H new ATOM 0 HA LYS B 38 16.516 3.184 6.352 1.00 0.00 H new ATOM 0 HB2 LYS B 38 14.138 4.820 5.703 1.00 0.00 H new ATOM 0 HB3 LYS B 38 14.344 4.649 7.435 1.00 0.00 H new ATOM 0 HG2 LYS B 38 16.330 5.850 7.458 1.00 0.00 H new ATOM 0 HG3 LYS B 38 16.872 5.188 5.929 1.00 0.00 H new ATOM 0 HD2 LYS B 38 14.454 6.915 5.699 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.874 7.763 6.277 1.00 0.00 H new ATOM 0 HE2 LYS B 38 16.902 6.174 4.180 1.00 0.00 H new ATOM 0 HE3 LYS B 38 15.337 6.672 3.570 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 17.023 8.392 3.166 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 15.840 8.972 4.237 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 17.356 8.490 4.828 1.00 0.00 H new ATOM 2149 N GLY B 39 14.226 1.176 6.913 1.00 0.00 N ATOM 2150 CA GLY B 39 13.685 0.193 7.887 1.00 0.00 C ATOM 2151 C GLY B 39 12.179 0.407 8.061 1.00 0.00 C ATOM 2152 O GLY B 39 11.639 0.243 9.138 1.00 0.00 O ATOM 0 H GLY B 39 14.038 0.964 5.933 1.00 0.00 H new ATOM 0 HA2 GLY B 39 13.879 -0.822 7.539 1.00 0.00 H new ATOM 0 HA3 GLY B 39 14.190 0.303 8.847 1.00 0.00 H new ATOM 2156 N ASP B 40 11.502 0.791 7.012 1.00 0.00 N ATOM 2157 CA ASP B 40 10.032 1.042 7.108 1.00 0.00 C ATOM 2158 C ASP B 40 9.274 -0.098 7.789 1.00 0.00 C ATOM 2159 O ASP B 40 9.729 -1.219 7.909 1.00 0.00 O ATOM 2160 CB ASP B 40 9.545 1.180 5.662 1.00 0.00 C ATOM 2161 CG ASP B 40 8.019 1.316 5.620 1.00 0.00 C ATOM 2162 OD1 ASP B 40 7.477 1.998 6.474 1.00 0.00 O ATOM 2163 OD2 ASP B 40 7.418 0.732 4.734 1.00 0.00 O ATOM 0 H ASP B 40 11.905 0.943 6.087 1.00 0.00 H new ATOM 0 HA ASP B 40 9.849 1.929 7.714 1.00 0.00 H new ATOM 0 HB2 ASP B 40 10.007 2.052 5.198 1.00 0.00 H new ATOM 0 HB3 ASP B 40 9.854 0.310 5.083 1.00 0.00 H new ATOM 2168 N LYS B 41 8.090 0.232 8.195 1.00 0.00 N ATOM 2169 CA LYS B 41 7.151 -0.709 8.851 1.00 0.00 C ATOM 2170 C LYS B 41 5.912 0.129 9.134 1.00 0.00 C ATOM 2171 O LYS B 41 5.494 0.311 10.260 1.00 0.00 O ATOM 2172 CB LYS B 41 7.832 -1.154 10.148 1.00 0.00 C ATOM 2173 CG LYS B 41 8.206 -2.636 10.050 1.00 0.00 C ATOM 2174 CD LYS B 41 9.084 -3.022 11.243 1.00 0.00 C ATOM 2175 CE LYS B 41 10.155 -4.017 10.790 1.00 0.00 C ATOM 2176 NZ LYS B 41 10.957 -4.300 12.013 1.00 0.00 N ATOM 0 H LYS B 41 7.713 1.174 8.092 1.00 0.00 H new ATOM 0 HA LYS B 41 6.890 -1.592 8.268 1.00 0.00 H new ATOM 0 HB2 LYS B 41 8.725 -0.554 10.326 1.00 0.00 H new ATOM 0 HB3 LYS B 41 7.165 -0.992 10.995 1.00 0.00 H new ATOM 0 HG2 LYS B 41 7.305 -3.249 10.035 1.00 0.00 H new ATOM 0 HG3 LYS B 41 8.737 -2.827 9.117 1.00 0.00 H new ATOM 0 HD2 LYS B 41 9.554 -2.133 11.665 1.00 0.00 H new ATOM 0 HD3 LYS B 41 8.473 -3.463 12.030 1.00 0.00 H new ATOM 0 HE2 LYS B 41 9.706 -4.927 10.393 1.00 0.00 H new ATOM 0 HE3 LYS B 41 10.776 -3.596 9.999 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 11.713 -4.976 11.783 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 11.377 -3.416 12.365 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 10.341 -4.706 12.746 1.00 0.00 H new ATOM 2190 N VAL B 42 5.376 0.700 8.089 1.00 0.00 N ATOM 2191 CA VAL B 42 4.209 1.612 8.230 1.00 0.00 C ATOM 2192 C VAL B 42 2.884 0.864 8.117 1.00 0.00 C ATOM 2193 O VAL B 42 2.761 -0.123 7.419 1.00 0.00 O ATOM 2194 CB VAL B 42 4.376 2.624 7.085 1.00 0.00 C ATOM 2195 CG1 VAL B 42 4.397 1.896 5.739 1.00 0.00 C ATOM 2196 CG2 VAL B 42 3.221 3.628 7.093 1.00 0.00 C ATOM 0 H VAL B 42 5.703 0.570 7.132 1.00 0.00 H new ATOM 0 HA VAL B 42 4.183 2.089 9.210 1.00 0.00 H new ATOM 0 HB VAL B 42 5.318 3.154 7.228 1.00 0.00 H new ATOM 0 HG11 VAL B 42 4.516 2.622 4.935 1.00 0.00 H new ATOM 0 HG12 VAL B 42 5.229 1.193 5.719 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.461 1.354 5.604 1.00 0.00 H new ATOM 0 HG21 VAL B 42 3.351 4.339 6.277 1.00 0.00 H new ATOM 0 HG22 VAL B 42 2.277 3.098 6.965 1.00 0.00 H new ATOM 0 HG23 VAL B 42 3.211 4.163 8.043 1.00 0.00 H new ATOM 2206 N GLN B 43 1.891 1.350 8.807 1.00 0.00 N ATOM 2207 CA GLN B 43 0.549 0.710 8.768 1.00 0.00 C ATOM 2208 C GLN B 43 -0.503 1.792 8.542 1.00 0.00 C ATOM 2209 O GLN B 43 -0.942 2.444 9.470 1.00 0.00 O ATOM 2210 CB GLN B 43 0.361 0.067 10.147 1.00 0.00 C ATOM 2211 CG GLN B 43 1.685 -0.530 10.631 1.00 0.00 C ATOM 2212 CD GLN B 43 1.405 -1.715 11.557 1.00 0.00 C ATOM 2213 OE1 GLN B 43 0.367 -1.779 12.185 1.00 0.00 O ATOM 2214 NE2 GLN B 43 2.294 -2.664 11.670 1.00 0.00 N ATOM 0 H GLN B 43 1.954 2.175 9.404 1.00 0.00 H new ATOM 0 HA GLN B 43 0.456 -0.028 7.971 1.00 0.00 H new ATOM 0 HB2 GLN B 43 0.006 0.812 10.859 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -0.400 -0.711 10.094 1.00 0.00 H new ATOM 0 HG2 GLN B 43 2.282 -0.854 9.779 1.00 0.00 H new ATOM 0 HG3 GLN B 43 2.266 0.227 11.158 1.00 0.00 H new ATOM 0 HE21 GLN B 43 3.166 -2.611 11.143 1.00 0.00 H new ATOM 0 HE22 GLN B 43 2.117 -3.458 12.285 1.00 0.00 H new ATOM 2223 N LEU B 44 -0.906 1.999 7.320 1.00 0.00 N ATOM 2224 CA LEU B 44 -1.919 3.052 7.044 1.00 0.00 C ATOM 2225 C LEU B 44 -3.203 2.749 7.814 1.00 0.00 C ATOM 2226 O LEU B 44 -3.984 1.907 7.420 1.00 0.00 O ATOM 2227 CB LEU B 44 -2.153 2.995 5.535 1.00 0.00 C ATOM 2228 CG LEU B 44 -1.068 3.814 4.835 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -1.073 3.521 3.332 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -1.347 5.295 5.066 1.00 0.00 C ATOM 0 H LEU B 44 -0.578 1.485 6.502 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.591 4.043 7.357 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.128 1.962 5.188 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -3.139 3.389 5.291 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.092 3.548 5.241 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.296 4.110 2.844 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.882 2.461 3.167 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.044 3.784 2.913 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -0.580 5.891 4.572 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.324 5.549 4.656 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.336 5.505 6.136 1.00 0.00 H new ATOM 2242 N THR B 45 -3.412 3.435 8.917 1.00 0.00 N ATOM 2243 CA THR B 45 -4.638 3.214 9.758 1.00 0.00 C ATOM 2244 C THR B 45 -5.044 1.733 9.755 1.00 0.00 C ATOM 2245 O THR B 45 -4.551 0.948 10.543 1.00 0.00 O ATOM 2246 CB THR B 45 -5.745 4.112 9.163 1.00 0.00 C ATOM 2247 OG1 THR B 45 -7.018 3.544 9.442 1.00 0.00 O ATOM 2248 CG2 THR B 45 -5.579 4.264 7.645 1.00 0.00 C ATOM 0 H THR B 45 -2.777 4.148 9.275 1.00 0.00 H new ATOM 0 HA THR B 45 -4.456 3.474 10.801 1.00 0.00 H new ATOM 0 HB THR B 45 -5.666 5.099 9.619 1.00 0.00 H new ATOM 0 HG1 THR B 45 -7.720 4.115 9.066 1.00 0.00 H new ATOM 0 HG21 THR B 45 -6.372 4.901 7.254 1.00 0.00 H new ATOM 0 HG22 THR B 45 -4.611 4.716 7.428 1.00 0.00 H new ATOM 0 HG23 THR B 45 -5.636 3.283 7.173 1.00 0.00 H new ATOM 2256 N GLY B 46 -5.926 1.340 8.876 1.00 0.00 N ATOM 2257 CA GLY B 46 -6.342 -0.085 8.828 1.00 0.00 C ATOM 2258 C GLY B 46 -6.658 -0.469 7.384 1.00 0.00 C ATOM 2259 O GLY B 46 -7.554 -1.246 7.130 1.00 0.00 O ATOM 0 H GLY B 46 -6.375 1.947 8.190 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -5.549 -0.721 9.220 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -7.217 -0.242 9.458 1.00 0.00 H new ATOM 2263 N PHE B 47 -5.935 0.069 6.433 1.00 0.00 N ATOM 2264 CA PHE B 47 -6.219 -0.286 5.013 1.00 0.00 C ATOM 2265 C PHE B 47 -4.928 -0.562 4.225 1.00 0.00 C ATOM 2266 O PHE B 47 -4.948 -1.303 3.266 1.00 0.00 O ATOM 2267 CB PHE B 47 -7.041 0.886 4.449 1.00 0.00 C ATOM 2268 CG PHE B 47 -6.154 1.976 3.911 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -5.522 1.819 2.680 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -5.971 3.146 4.647 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -4.701 2.829 2.187 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -5.152 4.160 4.153 1.00 0.00 C ATOM 2273 CZ PHE B 47 -4.514 4.000 2.924 1.00 0.00 C ATOM 0 H PHE B 47 -5.171 0.729 6.577 1.00 0.00 H new ATOM 0 HA PHE B 47 -6.781 -1.216 4.930 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -7.695 0.524 3.656 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -7.683 1.291 5.232 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -5.669 0.914 2.108 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -6.464 3.267 5.600 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.208 2.707 1.234 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -5.012 5.068 4.721 1.00 0.00 H new ATOM 0 HZ PHE B 47 -3.875 4.782 2.542 1.00 0.00 H new ATOM 2283 N LEU B 48 -3.805 -0.016 4.611 1.00 0.00 N ATOM 2284 CA LEU B 48 -2.561 -0.329 3.844 1.00 0.00 C ATOM 2285 C LEU B 48 -1.383 -0.607 4.781 1.00 0.00 C ATOM 2286 O LEU B 48 -0.908 0.263 5.481 1.00 0.00 O ATOM 2287 CB LEU B 48 -2.284 0.890 2.969 1.00 0.00 C ATOM 2288 CG LEU B 48 -2.759 0.644 1.526 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -2.122 1.681 0.608 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -2.356 -0.758 1.051 1.00 0.00 C ATOM 0 H LEU B 48 -3.694 0.617 5.403 1.00 0.00 H new ATOM 0 HA LEU B 48 -2.690 -1.229 3.243 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -2.792 1.762 3.381 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -1.217 1.112 2.973 1.00 0.00 H new ATOM 0 HG LEU B 48 -3.846 0.725 1.498 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -2.454 1.513 -0.416 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -2.419 2.680 0.926 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -1.037 1.592 0.657 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -2.702 -0.909 0.029 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -1.271 -0.856 1.085 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -2.808 -1.507 1.702 1.00 0.00 H new ATOM 2302 N ASN B 49 -0.905 -1.822 4.787 1.00 0.00 N ATOM 2303 CA ASN B 49 0.249 -2.171 5.669 1.00 0.00 C ATOM 2304 C ASN B 49 1.481 -2.515 4.822 1.00 0.00 C ATOM 2305 O ASN B 49 1.643 -3.631 4.369 1.00 0.00 O ATOM 2306 CB ASN B 49 -0.215 -3.394 6.461 1.00 0.00 C ATOM 2307 CG ASN B 49 -1.210 -2.957 7.538 1.00 0.00 C ATOM 2308 OD1 ASN B 49 -2.376 -2.760 7.261 1.00 0.00 O ATOM 2309 ND2 ASN B 49 -0.795 -2.793 8.764 1.00 0.00 N ATOM 0 H ASN B 49 -1.263 -2.590 4.219 1.00 0.00 H new ATOM 0 HA ASN B 49 0.534 -1.346 6.321 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -0.681 -4.118 5.793 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.641 -3.889 6.921 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -1.450 -2.500 9.489 1.00 0.00 H new ATOM 0 HD22 ASN B 49 0.184 -2.958 8.997 1.00 0.00 H new ATOM 2316 N ILE B 50 2.349 -1.561 4.608 1.00 0.00 N ATOM 2317 CA ILE B 50 3.575 -1.824 3.792 1.00 0.00 C ATOM 2318 C ILE B 50 4.685 -2.354 4.704 1.00 0.00 C ATOM 2319 O ILE B 50 4.854 -1.878 5.811 1.00 0.00 O ATOM 2320 CB ILE B 50 3.977 -0.455 3.206 1.00 0.00 C ATOM 2321 CG1 ILE B 50 2.982 0.038 2.128 1.00 0.00 C ATOM 2322 CG2 ILE B 50 5.370 -0.560 2.570 1.00 0.00 C ATOM 2323 CD1 ILE B 50 1.615 -0.643 2.255 1.00 0.00 C ATOM 0 H ILE B 50 2.263 -0.609 4.963 1.00 0.00 H new ATOM 0 HA ILE B 50 3.404 -2.562 3.009 1.00 0.00 H new ATOM 0 HB ILE B 50 3.973 0.261 4.028 1.00 0.00 H new ATOM 0 HG12 ILE B 50 2.859 1.118 2.215 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.394 -0.157 1.138 1.00 0.00 H new ATOM 0 HG21 ILE B 50 5.655 0.407 2.156 1.00 0.00 H new ATOM 0 HG22 ILE B 50 6.095 -0.857 3.328 1.00 0.00 H new ATOM 0 HG23 ILE B 50 5.351 -1.304 1.774 1.00 0.00 H new ATOM 0 HD11 ILE B 50 0.948 -0.267 1.479 1.00 0.00 H new ATOM 0 HD12 ILE B 50 1.733 -1.721 2.141 1.00 0.00 H new ATOM 0 HD13 ILE B 50 1.190 -0.426 3.235 1.00 0.00 H new ATOM 2335 N LYS B 51 5.447 -3.330 4.269 1.00 0.00 N ATOM 2336 CA LYS B 51 6.533 -3.847 5.165 1.00 0.00 C ATOM 2337 C LYS B 51 7.622 -4.574 4.358 1.00 0.00 C ATOM 2338 O LYS B 51 7.382 -5.636 3.821 1.00 0.00 O ATOM 2339 CB LYS B 51 5.836 -4.822 6.123 1.00 0.00 C ATOM 2340 CG LYS B 51 4.889 -5.741 5.346 1.00 0.00 C ATOM 2341 CD LYS B 51 4.850 -7.118 6.013 1.00 0.00 C ATOM 2342 CE LYS B 51 6.126 -7.890 5.669 1.00 0.00 C ATOM 2343 NZ LYS B 51 6.213 -8.964 6.697 1.00 0.00 N ATOM 0 H LYS B 51 5.369 -3.781 3.358 1.00 0.00 H new ATOM 0 HA LYS B 51 7.033 -3.036 5.694 1.00 0.00 H new ATOM 0 HB2 LYS B 51 6.580 -5.418 6.652 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.278 -4.266 6.877 1.00 0.00 H new ATOM 0 HG2 LYS B 51 3.888 -5.310 5.319 1.00 0.00 H new ATOM 0 HG3 LYS B 51 5.223 -5.835 4.313 1.00 0.00 H new ATOM 0 HD2 LYS B 51 4.760 -7.008 7.094 1.00 0.00 H new ATOM 0 HD3 LYS B 51 3.975 -7.673 5.675 1.00 0.00 H new ATOM 0 HE2 LYS B 51 6.076 -8.308 4.664 1.00 0.00 H new ATOM 0 HE3 LYS B 51 7.001 -7.241 5.701 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 6.724 -9.780 6.304 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 6.722 -8.606 7.531 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 5.255 -9.257 6.975 1.00 0.00 H new ATOM 2357 N PRO B 52 8.794 -3.982 4.302 1.00 0.00 N ATOM 2358 CA PRO B 52 9.923 -4.599 3.555 1.00 0.00 C ATOM 2359 C PRO B 52 10.435 -5.860 4.247 1.00 0.00 C ATOM 2360 O PRO B 52 10.463 -5.958 5.459 1.00 0.00 O ATOM 2361 CB PRO B 52 10.993 -3.515 3.556 1.00 0.00 C ATOM 2362 CG PRO B 52 10.679 -2.675 4.748 1.00 0.00 C ATOM 2363 CD PRO B 52 9.183 -2.700 4.909 1.00 0.00 C ATOM 0 HA PRO B 52 9.631 -4.914 2.553 1.00 0.00 H new ATOM 0 HB2 PRO B 52 11.992 -3.945 3.626 1.00 0.00 H new ATOM 0 HB3 PRO B 52 10.963 -2.928 2.638 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.171 -3.066 5.638 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.037 -1.655 4.608 1.00 0.00 H new ATOM 0 HD2 PRO B 52 8.891 -2.648 5.958 1.00 0.00 H new ATOM 0 HD3 PRO B 52 8.711 -1.857 4.404 1.00 0.00 H new ATOM 2371 N VAL B 53 10.842 -6.823 3.468 1.00 0.00 N ATOM 2372 CA VAL B 53 11.363 -8.096 4.046 1.00 0.00 C ATOM 2373 C VAL B 53 12.528 -8.638 3.210 1.00 0.00 C ATOM 2374 O VAL B 53 12.379 -8.962 2.050 1.00 0.00 O ATOM 2375 CB VAL B 53 10.178 -9.052 4.019 1.00 0.00 C ATOM 2376 CG1 VAL B 53 9.031 -8.454 4.839 1.00 0.00 C ATOM 2377 CG2 VAL B 53 9.713 -9.255 2.573 1.00 0.00 C ATOM 0 H VAL B 53 10.837 -6.784 2.449 1.00 0.00 H new ATOM 0 HA VAL B 53 11.753 -7.960 5.055 1.00 0.00 H new ATOM 0 HB VAL B 53 10.475 -10.012 4.442 1.00 0.00 H new ATOM 0 HG11 VAL B 53 8.179 -9.134 4.823 1.00 0.00 H new ATOM 0 HG12 VAL B 53 9.358 -8.306 5.868 1.00 0.00 H new ATOM 0 HG13 VAL B 53 8.738 -7.496 4.410 1.00 0.00 H new ATOM 0 HG21 VAL B 53 8.865 -9.940 2.556 1.00 0.00 H new ATOM 0 HG22 VAL B 53 9.414 -8.296 2.149 1.00 0.00 H new ATOM 0 HG23 VAL B 53 10.529 -9.674 1.984 1.00 0.00 H new ATOM 2387 N ALA B 54 13.688 -8.718 3.795 1.00 0.00 N ATOM 2388 CA ALA B 54 14.895 -9.207 3.050 1.00 0.00 C ATOM 2389 C ALA B 54 14.599 -10.474 2.241 1.00 0.00 C ATOM 2390 O ALA B 54 13.827 -11.324 2.641 1.00 0.00 O ATOM 2391 CB ALA B 54 15.952 -9.491 4.116 1.00 0.00 C ATOM 0 H ALA B 54 13.860 -8.464 4.768 1.00 0.00 H new ATOM 0 HA ALA B 54 15.227 -8.462 2.327 1.00 0.00 H new ATOM 0 HB1 ALA B 54 16.862 -9.853 3.638 1.00 0.00 H new ATOM 0 HB2 ALA B 54 16.170 -8.575 4.665 1.00 0.00 H new ATOM 0 HB3 ALA B 54 15.579 -10.248 4.806 1.00 0.00 H new ATOM 2710 N VAL B 75 15.400 -6.632 -0.505 1.00 0.00 N ATOM 2711 CA VAL B 75 14.301 -6.816 0.489 1.00 0.00 C ATOM 2712 C VAL B 75 12.967 -6.963 -0.250 1.00 0.00 C ATOM 2713 O VAL B 75 12.885 -6.757 -1.446 1.00 0.00 O ATOM 2714 CB VAL B 75 14.347 -5.564 1.392 1.00 0.00 C ATOM 2715 CG1 VAL B 75 12.965 -4.909 1.512 1.00 0.00 C ATOM 2716 CG2 VAL B 75 14.823 -5.970 2.790 1.00 0.00 C ATOM 0 HA VAL B 75 14.414 -7.716 1.094 1.00 0.00 H new ATOM 0 HB VAL B 75 15.033 -4.846 0.942 1.00 0.00 H new ATOM 0 HG11 VAL B 75 13.033 -4.031 2.154 1.00 0.00 H new ATOM 0 HG12 VAL B 75 12.617 -4.609 0.523 1.00 0.00 H new ATOM 0 HG13 VAL B 75 12.261 -5.621 1.944 1.00 0.00 H new ATOM 0 HG21 VAL B 75 14.858 -5.090 3.432 1.00 0.00 H new ATOM 0 HG22 VAL B 75 14.132 -6.700 3.212 1.00 0.00 H new ATOM 0 HG23 VAL B 75 15.818 -6.409 2.722 1.00 0.00 H new ATOM 2726 N GLY B 76 11.934 -7.332 0.446 1.00 0.00 N ATOM 2727 CA GLY B 76 10.616 -7.511 -0.217 1.00 0.00 C ATOM 2728 C GLY B 76 9.633 -6.488 0.329 1.00 0.00 C ATOM 2729 O GLY B 76 8.905 -6.750 1.264 1.00 0.00 O ATOM 0 H GLY B 76 11.944 -7.518 1.449 1.00 0.00 H new ATOM 0 HA2 GLY B 76 10.720 -7.392 -1.296 1.00 0.00 H new ATOM 0 HA3 GLY B 76 10.243 -8.520 -0.042 1.00 0.00 H new ATOM 2733 N VAL B 77 9.612 -5.323 -0.250 1.00 0.00 N ATOM 2734 CA VAL B 77 8.674 -4.262 0.220 1.00 0.00 C ATOM 2735 C VAL B 77 7.234 -4.745 0.079 1.00 0.00 C ATOM 2736 O VAL B 77 6.534 -4.383 -0.848 1.00 0.00 O ATOM 2737 CB VAL B 77 8.946 -3.065 -0.698 1.00 0.00 C ATOM 2738 CG1 VAL B 77 8.857 -3.505 -2.166 1.00 0.00 C ATOM 2739 CG2 VAL B 77 7.917 -1.960 -0.435 1.00 0.00 C ATOM 0 H VAL B 77 10.207 -5.056 -1.034 1.00 0.00 H new ATOM 0 HA VAL B 77 8.818 -4.005 1.269 1.00 0.00 H new ATOM 0 HB VAL B 77 9.946 -2.683 -0.493 1.00 0.00 H new ATOM 0 HG11 VAL B 77 9.051 -2.651 -2.814 1.00 0.00 H new ATOM 0 HG12 VAL B 77 9.597 -4.282 -2.358 1.00 0.00 H new ATOM 0 HG13 VAL B 77 7.860 -3.895 -2.369 1.00 0.00 H new ATOM 0 HG21 VAL B 77 8.117 -1.113 -1.091 1.00 0.00 H new ATOM 0 HG22 VAL B 77 6.915 -2.342 -0.631 1.00 0.00 H new ATOM 0 HG23 VAL B 77 7.986 -1.638 0.604 1.00 0.00 H new ATOM 2749 N SER B 78 6.791 -5.569 0.986 1.00 0.00 N ATOM 2750 CA SER B 78 5.399 -6.082 0.892 1.00 0.00 C ATOM 2751 C SER B 78 4.392 -4.953 1.136 1.00 0.00 C ATOM 2752 O SER B 78 4.753 -3.832 1.424 1.00 0.00 O ATOM 2753 CB SER B 78 5.296 -7.154 1.980 1.00 0.00 C ATOM 2754 OG SER B 78 3.938 -7.303 2.375 1.00 0.00 O ATOM 0 H SER B 78 7.330 -5.907 1.783 1.00 0.00 H new ATOM 0 HA SER B 78 5.175 -6.486 -0.095 1.00 0.00 H new ATOM 0 HB2 SER B 78 5.683 -8.103 1.608 1.00 0.00 H new ATOM 0 HB3 SER B 78 5.907 -6.875 2.839 1.00 0.00 H new ATOM 0 HG SER B 78 3.873 -7.991 3.070 1.00 0.00 H new ATOM 2760 N VAL B 79 3.135 -5.278 1.031 1.00 0.00 N ATOM 2761 CA VAL B 79 2.022 -4.298 1.240 1.00 0.00 C ATOM 2762 C VAL B 79 0.702 -5.083 1.225 1.00 0.00 C ATOM 2763 O VAL B 79 0.690 -6.261 0.924 1.00 0.00 O ATOM 2764 CB VAL B 79 2.087 -3.360 0.006 1.00 0.00 C ATOM 2765 CG1 VAL B 79 0.769 -2.600 -0.173 1.00 0.00 C ATOM 2766 CG2 VAL B 79 3.218 -2.345 0.159 1.00 0.00 C ATOM 0 H VAL B 79 2.817 -6.219 0.800 1.00 0.00 H new ATOM 0 HA VAL B 79 2.096 -3.743 2.175 1.00 0.00 H new ATOM 0 HB VAL B 79 2.269 -3.985 -0.869 1.00 0.00 H new ATOM 0 HG11 VAL B 79 0.840 -1.949 -1.045 1.00 0.00 H new ATOM 0 HG12 VAL B 79 -0.045 -3.311 -0.316 1.00 0.00 H new ATOM 0 HG13 VAL B 79 0.573 -1.998 0.714 1.00 0.00 H new ATOM 0 HG21 VAL B 79 3.246 -1.697 -0.717 1.00 0.00 H new ATOM 0 HG22 VAL B 79 3.048 -1.742 1.051 1.00 0.00 H new ATOM 0 HG23 VAL B 79 4.168 -2.871 0.252 1.00 0.00 H new ATOM 2776 N LYS B 80 -0.412 -4.444 1.484 1.00 0.00 N ATOM 2777 CA LYS B 80 -1.718 -5.159 1.417 1.00 0.00 C ATOM 2778 C LYS B 80 -2.862 -4.205 1.777 1.00 0.00 C ATOM 2779 O LYS B 80 -2.634 -3.104 2.227 1.00 0.00 O ATOM 2780 CB LYS B 80 -1.625 -6.289 2.453 1.00 0.00 C ATOM 2781 CG LYS B 80 -1.329 -5.703 3.837 1.00 0.00 C ATOM 2782 CD LYS B 80 -0.603 -6.748 4.691 1.00 0.00 C ATOM 2783 CE LYS B 80 -1.145 -6.710 6.122 1.00 0.00 C ATOM 2784 NZ LYS B 80 -1.537 -8.116 6.423 1.00 0.00 N ATOM 0 H LYS B 80 -0.471 -3.458 1.739 1.00 0.00 H new ATOM 0 HA LYS B 80 -1.917 -5.543 0.417 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -2.560 -6.849 2.478 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -0.840 -6.990 2.170 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -0.716 -4.807 3.741 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -2.258 -5.403 4.323 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -0.743 -7.741 4.265 1.00 0.00 H new ATOM 0 HD3 LYS B 80 0.469 -6.550 4.692 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -0.389 -6.353 6.821 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -1.998 -6.036 6.203 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -1.919 -8.171 7.389 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -2.263 -8.427 5.746 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -0.704 -8.733 6.345 1.00 0.00 H new ATOM 2798 N PRO B 81 -4.058 -4.688 1.594 1.00 0.00 N ATOM 2799 CA PRO B 81 -5.273 -3.923 1.913 1.00 0.00 C ATOM 2800 C PRO B 81 -5.781 -4.272 3.314 1.00 0.00 C ATOM 2801 O PRO B 81 -5.719 -5.408 3.744 1.00 0.00 O ATOM 2802 CB PRO B 81 -6.261 -4.420 0.866 1.00 0.00 C ATOM 2803 CG PRO B 81 -5.786 -5.796 0.484 1.00 0.00 C ATOM 2804 CD PRO B 81 -4.392 -5.983 1.038 1.00 0.00 C ATOM 0 HA PRO B 81 -5.118 -2.844 1.902 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -7.274 -4.452 1.267 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -6.281 -3.758 0.000 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -6.459 -6.555 0.883 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -5.783 -5.910 -0.600 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -4.367 -6.763 1.799 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -3.689 -6.276 0.258 1.00 0.00 H new ATOM 2812 N GLY B 82 -6.295 -3.307 4.017 1.00 0.00 N ATOM 2813 CA GLY B 82 -6.828 -3.573 5.386 1.00 0.00 C ATOM 2814 C GLY B 82 -8.358 -3.513 5.358 1.00 0.00 C ATOM 2815 O GLY B 82 -8.980 -2.956 6.240 1.00 0.00 O ATOM 0 H GLY B 82 -6.371 -2.339 3.704 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -6.498 -4.552 5.733 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -6.437 -2.838 6.089 1.00 0.00 H new ATOM 2819 N GLU B 83 -8.967 -4.082 4.346 1.00 0.00 N ATOM 2820 CA GLU B 83 -10.468 -4.078 4.226 1.00 0.00 C ATOM 2821 C GLU B 83 -11.015 -2.677 3.941 1.00 0.00 C ATOM 2822 O GLU B 83 -11.935 -2.519 3.168 1.00 0.00 O ATOM 2823 CB GLU B 83 -11.018 -4.589 5.562 1.00 0.00 C ATOM 2824 CG GLU B 83 -12.542 -4.699 5.474 1.00 0.00 C ATOM 2825 CD GLU B 83 -12.943 -6.165 5.296 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -13.089 -6.845 6.300 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -13.099 -6.583 4.161 1.00 0.00 O ATOM 0 H GLU B 83 -8.484 -4.558 3.584 1.00 0.00 H new ATOM 0 HA GLU B 83 -10.774 -4.709 3.392 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -10.585 -5.561 5.799 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -10.737 -3.910 6.367 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -12.998 -4.294 6.377 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -12.911 -4.107 4.637 1.00 0.00 H new ATOM 2834 N SER B 84 -10.479 -1.663 4.562 1.00 0.00 N ATOM 2835 CA SER B 84 -10.997 -0.281 4.325 1.00 0.00 C ATOM 2836 C SER B 84 -11.114 -0.012 2.824 1.00 0.00 C ATOM 2837 O SER B 84 -12.007 0.681 2.376 1.00 0.00 O ATOM 2838 CB SER B 84 -9.972 0.648 4.964 1.00 0.00 C ATOM 2839 OG SER B 84 -10.636 1.547 5.844 1.00 0.00 O ATOM 0 H SER B 84 -9.705 -1.729 5.223 1.00 0.00 H new ATOM 0 HA SER B 84 -11.990 -0.135 4.750 1.00 0.00 H new ATOM 0 HB2 SER B 84 -9.229 0.067 5.511 1.00 0.00 H new ATOM 0 HB3 SER B 84 -9.438 1.204 4.193 1.00 0.00 H new ATOM 0 HG SER B 84 -9.979 2.145 6.258 1.00 0.00 H new ATOM 2845 N LEU B 85 -10.233 -0.575 2.043 1.00 0.00 N ATOM 2846 CA LEU B 85 -10.315 -0.372 0.568 1.00 0.00 C ATOM 2847 C LEU B 85 -11.331 -1.354 -0.010 1.00 0.00 C ATOM 2848 O LEU B 85 -11.979 -1.083 -1.001 1.00 0.00 O ATOM 2849 CB LEU B 85 -8.921 -0.675 0.009 1.00 0.00 C ATOM 2850 CG LEU B 85 -7.841 -0.002 0.863 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -6.975 -1.074 1.529 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -6.963 0.884 -0.029 1.00 0.00 C ATOM 0 H LEU B 85 -9.463 -1.164 2.360 1.00 0.00 H new ATOM 0 HA LEU B 85 -10.625 0.641 0.313 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -8.757 -1.752 -0.011 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -8.851 -0.322 -1.020 1.00 0.00 H new ATOM 0 HG LEU B 85 -8.314 0.611 1.631 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -6.207 -0.596 2.136 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -7.599 -1.704 2.163 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -6.502 -1.687 0.762 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -6.195 1.363 0.578 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -6.490 0.272 -0.797 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -7.580 1.648 -0.503 1.00 0.00 H new ATOM 2864 N LYS B 86 -11.473 -2.495 0.613 1.00 0.00 N ATOM 2865 CA LYS B 86 -12.448 -3.502 0.111 1.00 0.00 C ATOM 2866 C LYS B 86 -13.840 -3.160 0.616 1.00 0.00 C ATOM 2867 O LYS B 86 -14.818 -3.260 -0.099 1.00 0.00 O ATOM 2868 CB LYS B 86 -11.982 -4.843 0.683 1.00 0.00 C ATOM 2869 CG LYS B 86 -11.689 -5.822 -0.455 1.00 0.00 C ATOM 2870 CD LYS B 86 -10.718 -6.898 0.039 1.00 0.00 C ATOM 2871 CE LYS B 86 -10.435 -7.892 -1.091 1.00 0.00 C ATOM 2872 NZ LYS B 86 -11.531 -8.896 -1.002 1.00 0.00 N ATOM 0 H LYS B 86 -10.955 -2.771 1.447 1.00 0.00 H new ATOM 0 HA LYS B 86 -12.493 -3.528 -0.978 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.088 -4.698 1.289 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -12.749 -5.254 1.339 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -12.614 -6.282 -0.801 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.260 -5.291 -1.305 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -9.788 -6.437 0.373 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -11.142 -7.419 0.897 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -10.431 -7.396 -2.062 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -9.459 -8.361 -0.969 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -11.123 -9.847 -0.902 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -12.128 -8.686 -0.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -12.109 -8.856 -1.866 1.00 0.00 H new ATOM 2886 N LYS B 87 -13.925 -2.728 1.834 1.00 0.00 N ATOM 2887 CA LYS B 87 -15.239 -2.342 2.392 1.00 0.00 C ATOM 2888 C LYS B 87 -15.684 -1.080 1.667 1.00 0.00 C ATOM 2889 O LYS B 87 -16.842 -0.902 1.319 1.00 0.00 O ATOM 2890 CB LYS B 87 -14.983 -2.086 3.882 1.00 0.00 C ATOM 2891 CG LYS B 87 -16.252 -1.539 4.540 1.00 0.00 C ATOM 2892 CD LYS B 87 -15.909 -0.952 5.912 1.00 0.00 C ATOM 2893 CE LYS B 87 -16.396 -1.898 7.013 1.00 0.00 C ATOM 2894 NZ LYS B 87 -15.603 -3.146 6.824 1.00 0.00 N ATOM 0 H LYS B 87 -13.135 -2.625 2.471 1.00 0.00 H new ATOM 0 HA LYS B 87 -16.019 -3.094 2.271 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -14.678 -3.011 4.372 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -14.165 -1.376 4.003 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -16.700 -0.773 3.907 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -16.989 -2.334 4.648 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -14.832 -0.804 5.996 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -16.376 0.026 6.027 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -16.231 -1.471 8.002 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -17.465 -2.092 6.923 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -15.573 -3.677 7.718 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -16.047 -3.731 6.088 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -14.635 -2.901 6.534 1.00 0.00 H new ATOM 2908 N ALA B 88 -14.748 -0.224 1.373 1.00 0.00 N ATOM 2909 CA ALA B 88 -15.099 0.992 0.618 1.00 0.00 C ATOM 2910 C ALA B 88 -15.409 0.566 -0.817 1.00 0.00 C ATOM 2911 O ALA B 88 -16.220 1.160 -1.501 1.00 0.00 O ATOM 2912 CB ALA B 88 -13.853 1.878 0.688 1.00 0.00 C ATOM 0 H ALA B 88 -13.764 -0.319 1.624 1.00 0.00 H new ATOM 0 HA ALA B 88 -15.965 1.527 1.006 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -14.036 2.806 0.147 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -13.625 2.104 1.730 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -13.009 1.355 0.237 1.00 0.00 H new ATOM 2918 N ALA B 89 -14.764 -0.485 -1.270 1.00 0.00 N ATOM 2919 CA ALA B 89 -15.002 -0.974 -2.660 1.00 0.00 C ATOM 2920 C ALA B 89 -16.385 -1.580 -2.776 1.00 0.00 C ATOM 2921 O ALA B 89 -17.168 -1.181 -3.617 1.00 0.00 O ATOM 2922 CB ALA B 89 -13.917 -2.015 -2.918 1.00 0.00 C ATOM 0 H ALA B 89 -14.083 -1.023 -0.734 1.00 0.00 H new ATOM 0 HA ALA B 89 -14.957 -0.168 -3.392 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -14.031 -2.418 -3.924 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -12.936 -1.549 -2.823 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -14.007 -2.823 -2.191 1.00 0.00 H new ATOM 2928 N GLU B 90 -16.722 -2.505 -1.921 1.00 0.00 N ATOM 2929 CA GLU B 90 -18.096 -3.074 -1.980 1.00 0.00 C ATOM 2930 C GLU B 90 -19.077 -1.901 -1.955 1.00 0.00 C ATOM 2931 O GLU B 90 -20.204 -1.998 -2.397 1.00 0.00 O ATOM 2932 CB GLU B 90 -18.248 -3.958 -0.737 1.00 0.00 C ATOM 2933 CG GLU B 90 -17.979 -3.137 0.521 1.00 0.00 C ATOM 2934 CD GLU B 90 -18.490 -3.898 1.746 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -18.178 -5.072 1.863 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -19.184 -3.294 2.548 1.00 0.00 O ATOM 0 H GLU B 90 -16.116 -2.887 -1.195 1.00 0.00 H new ATOM 0 HA GLU B 90 -18.285 -3.666 -2.876 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -19.253 -4.378 -0.700 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -17.554 -4.797 -0.790 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -16.911 -2.943 0.620 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -18.474 -2.169 0.449 1.00 0.00 H new ATOM 2943 N GLY B 91 -18.629 -0.783 -1.430 1.00 0.00 N ATOM 2944 CA GLY B 91 -19.493 0.414 -1.357 1.00 0.00 C ATOM 2945 C GLY B 91 -19.545 1.198 -2.689 1.00 0.00 C ATOM 2946 O GLY B 91 -20.539 1.853 -2.941 1.00 0.00 O ATOM 0 H GLY B 91 -17.691 -0.659 -1.049 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -20.503 0.111 -1.079 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -19.129 1.072 -0.568 1.00 0.00 H new ATOM 2950 N LEU B 92 -18.519 1.210 -3.546 1.00 0.00 N ATOM 2951 CA LEU B 92 -18.676 2.056 -4.783 1.00 0.00 C ATOM 2952 C LEU B 92 -18.783 1.237 -6.076 1.00 0.00 C ATOM 2953 O LEU B 92 -19.838 1.167 -6.677 1.00 0.00 O ATOM 2954 CB LEU B 92 -17.461 2.997 -4.851 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.792 3.160 -3.476 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -15.716 4.243 -3.565 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -17.834 3.574 -2.428 1.00 0.00 C ATOM 0 H LEU B 92 -17.640 0.703 -3.446 1.00 0.00 H new ATOM 0 HA LEU B 92 -19.614 2.606 -4.708 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.736 2.605 -5.564 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -17.776 3.973 -5.221 1.00 0.00 H new ATOM 0 HG LEU B 92 -16.345 2.210 -3.182 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -15.239 4.362 -2.592 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -14.968 3.953 -4.303 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -16.173 5.187 -3.863 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -17.350 3.687 -1.458 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -18.287 4.522 -2.720 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -18.607 2.808 -2.361 1.00 0.00 H new ATOM 2969 N LYS B 93 -17.707 0.665 -6.546 1.00 0.00 N ATOM 2970 CA LYS B 93 -17.785 -0.084 -7.843 1.00 0.00 C ATOM 2971 C LYS B 93 -17.401 -1.556 -7.696 1.00 0.00 C ATOM 2972 O LYS B 93 -16.718 -2.114 -8.537 1.00 0.00 O ATOM 2973 CB LYS B 93 -16.801 0.635 -8.767 1.00 0.00 C ATOM 2974 CG LYS B 93 -17.571 1.523 -9.748 1.00 0.00 C ATOM 2975 CD LYS B 93 -17.743 2.920 -9.148 1.00 0.00 C ATOM 2976 CE LYS B 93 -17.677 3.967 -10.261 1.00 0.00 C ATOM 2977 NZ LYS B 93 -19.074 4.079 -10.767 1.00 0.00 N ATOM 0 H LYS B 93 -16.790 0.680 -6.100 1.00 0.00 H new ATOM 0 HA LYS B 93 -18.805 -0.091 -8.227 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -16.110 1.239 -8.179 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -16.202 -0.093 -9.314 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -17.035 1.586 -10.695 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -18.546 1.085 -9.962 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -18.698 2.988 -8.627 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -16.963 3.109 -8.410 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -17.316 4.923 -9.883 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -16.994 3.659 -11.053 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -19.110 4.780 -11.534 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -19.388 3.155 -11.127 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -19.700 4.380 -9.993 1.00 0.00 H new ATOM 2991 N TYR B 94 -17.856 -2.201 -6.665 1.00 0.00 N ATOM 2992 CA TYR B 94 -17.534 -3.646 -6.500 1.00 0.00 C ATOM 2993 C TYR B 94 -18.418 -4.463 -7.443 1.00 0.00 C ATOM 2994 O TYR B 94 -17.963 -5.371 -8.110 1.00 0.00 O ATOM 2995 CB TYR B 94 -17.841 -3.949 -5.032 1.00 0.00 C ATOM 2996 CG TYR B 94 -18.120 -5.424 -4.834 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -17.337 -6.389 -5.481 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -19.169 -5.822 -3.998 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -17.606 -7.750 -5.292 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -19.438 -7.183 -3.809 1.00 0.00 C ATOM 3001 CZ TYR B 94 -18.657 -8.147 -4.456 1.00 0.00 C ATOM 3002 OH TYR B 94 -18.922 -9.488 -4.269 1.00 0.00 O ATOM 0 H TYR B 94 -18.435 -1.795 -5.930 1.00 0.00 H new ATOM 0 HA TYR B 94 -16.500 -3.893 -6.741 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -16.998 -3.647 -4.410 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -18.702 -3.365 -4.708 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -16.526 -6.083 -6.125 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -19.772 -5.079 -3.498 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -17.003 -8.494 -5.791 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -20.248 -7.489 -3.164 1.00 0.00 H new ATOM 0 HH TYR B 94 -19.682 -9.589 -3.659 1.00 0.00 H new ATOM 3012 N GLU B 95 -19.677 -4.129 -7.514 1.00 0.00 N ATOM 3013 CA GLU B 95 -20.593 -4.867 -8.427 1.00 0.00 C ATOM 3014 C GLU B 95 -20.317 -4.429 -9.862 1.00 0.00 C ATOM 3015 O GLU B 95 -20.367 -5.217 -10.785 1.00 0.00 O ATOM 3016 CB GLU B 95 -22.007 -4.470 -8.002 1.00 0.00 C ATOM 3017 CG GLU B 95 -22.222 -4.827 -6.527 1.00 0.00 C ATOM 3018 CD GLU B 95 -22.204 -3.552 -5.682 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -23.249 -2.938 -5.548 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -21.144 -3.211 -5.182 1.00 0.00 O ATOM 0 H GLU B 95 -20.111 -3.377 -6.979 1.00 0.00 H new ATOM 0 HA GLU B 95 -20.460 -5.948 -8.376 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -22.156 -3.401 -8.153 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -22.741 -4.985 -8.622 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -23.173 -5.344 -6.403 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -21.442 -5.509 -6.190 1.00 0.00 H new ATOM 3027 N ASP B 96 -19.998 -3.174 -10.049 1.00 0.00 N ATOM 3028 CA ASP B 96 -19.685 -2.681 -11.421 1.00 0.00 C ATOM 3029 C ASP B 96 -18.537 -3.511 -11.985 1.00 0.00 C ATOM 3030 O ASP B 96 -18.533 -3.891 -13.140 1.00 0.00 O ATOM 3031 CB ASP B 96 -19.265 -1.221 -11.241 1.00 0.00 C ATOM 3032 CG ASP B 96 -19.808 -0.386 -12.402 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -19.229 -0.451 -13.474 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -20.793 0.305 -12.199 1.00 0.00 O ATOM 0 H ASP B 96 -19.941 -2.472 -9.312 1.00 0.00 H new ATOM 0 HA ASP B 96 -20.527 -2.763 -12.109 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -19.644 -0.837 -10.294 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -18.178 -1.146 -11.203 1.00 0.00 H new ATOM 3039 N PHE B 97 -17.574 -3.816 -11.159 1.00 0.00 N ATOM 3040 CA PHE B 97 -16.430 -4.653 -11.620 1.00 0.00 C ATOM 3041 C PHE B 97 -16.889 -6.109 -11.730 1.00 0.00 C ATOM 3042 O PHE B 97 -16.357 -6.885 -12.501 1.00 0.00 O ATOM 3043 CB PHE B 97 -15.362 -4.506 -10.532 1.00 0.00 C ATOM 3044 CG PHE B 97 -14.192 -3.717 -11.068 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -13.549 -4.126 -12.242 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -13.750 -2.575 -10.389 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -12.465 -3.393 -12.738 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -12.666 -1.842 -10.885 1.00 0.00 C ATOM 3049 CZ PHE B 97 -12.023 -2.251 -12.059 1.00 0.00 C ATOM 0 H PHE B 97 -17.530 -3.521 -10.183 1.00 0.00 H new ATOM 0 HA PHE B 97 -16.049 -4.351 -12.595 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -15.783 -4.003 -9.661 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -15.028 -5.490 -10.202 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -13.889 -5.007 -12.765 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -14.246 -2.260 -9.483 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -11.969 -3.708 -13.644 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -12.326 -0.961 -10.362 1.00 0.00 H new ATOM 0 HZ PHE B 97 -11.186 -1.686 -12.441 1.00 0.00 H new