USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 30 HIS HE2 : A 30 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD Set 1.1: B 160 ASN : amide:sc= -0.101 K(o=-1.2,f=-1.8) USER MOD Set 1.2: B 162 GLN :FLIP amide:sc= -1.06 F(o=-2.5,f=-1.2) USER MOD Set 2.1: B 127 LYS NZ :NH3+ -143:sc= -1.38 (180deg=-2.26) USER MOD Set 2.2: B 141 GLN : amide:sc= -2.23 K(o=-3.6,f=-11!) USER MOD Set 3.1: A 29 SER OG : rot 83:sc= 1.24 USER MOD Set 3.2: B 106 LYS NZ :NH3+ -167:sc= 0 (180deg=0) USER MOD Set 3.3: B 168 HIS :FLIP no HE2:sc= -1.48 F(o=-0.91,f=-0.24) USER MOD Single : A 1 SER N :NH3+ 172:sc= 0 (180deg=-0.0538) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= -1.28 USER MOD Single : A 13 MET CE :methyl 154:sc= -1.41 (180deg=-2.1) USER MOD Single : A 15 GLN : amide:sc= -0.483 X(o=-0.48,f=-0.27) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= -1.19 USER MOD Single : A 24 GLN : amide:sc= -0.886 K(o=-0.89,f=-2.2!) USER MOD Single : A 33 GLN :FLIP amide:sc= -0.575 F(o=-2.8!,f=-0.57) USER MOD Single : A 38 SER OG : rot -118:sc= 0.0953 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 99 SER OG : rot 180:sc= -0.022 USER MOD Single : B 100 HIS : no HD1:sc= -0.755 X(o=-0.76,f=-0.34) USER MOD Single : B 101 MET CE :methyl -166:sc= -2.97! (180deg=-3.35) USER MOD Single : B 102 GLN : amide:sc= -0.364 K(o=-0.36,f=-2.3!) USER MOD Single : B 107 THR OG1 : rot -2:sc= -2.38 USER MOD Single : B 109 THR OG1 : rot -1:sc= 0.529! USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 THR OG1 : rot 180:sc= 0 USER MOD Single : B 114 THR OG1 : rot -105:sc= 1.86 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 122 THR OG1 : rot -170:sc= -0.437 USER MOD Single : B 125 ASN : amide:sc= -0.113 X(o=-0.11,f=0) USER MOD Single : B 129 LYS NZ :NH3+ 176:sc= 0.0105 (180deg=0.00973) USER MOD Single : B 131 GLN : amide:sc= -0.743 X(o=-0.74,f=-0.67) USER MOD Single : B 133 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0249) USER MOD Single : B 140 GLN :FLIP amide:sc= -0.811 F(o=-1.8,f=-0.81) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 149 GLN : amide:sc= -0.0425 X(o=-0.042,f=0) USER MOD Single : B 155 THR OG1 : rot 180:sc= 0 USER MOD Single : B 157 SER OG : rot 180:sc= 0 USER MOD Single : B 159 TYR OH : rot 165:sc= -0.0218 USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot 80:sc= 0.964 USER MOD Single : B 166 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -25.289 -6.007 -1.729 1.00 0.00 N ATOM 2 CA SER A 1 -24.366 -5.980 -0.600 1.00 0.00 C ATOM 3 C SER A 1 -24.486 -7.254 0.232 1.00 0.00 C ATOM 4 O SER A 1 -24.514 -7.206 1.462 1.00 0.00 O ATOM 5 CB SER A 1 -24.637 -4.758 0.278 1.00 0.00 C ATOM 6 OG SER A 1 -24.136 -3.576 -0.324 1.00 0.00 O ATOM 0 H1 SER A 1 -25.288 -5.080 -2.200 1.00 0.00 H new ATOM 0 H2 SER A 1 -24.990 -6.739 -2.404 1.00 0.00 H new ATOM 0 H3 SER A 1 -26.248 -6.221 -1.388 1.00 0.00 H new ATOM 0 HA SER A 1 -23.352 -5.918 -0.994 1.00 0.00 H new ATOM 0 HB2 SER A 1 -25.709 -4.658 0.446 1.00 0.00 H new ATOM 0 HB3 SER A 1 -24.173 -4.898 1.254 1.00 0.00 H new ATOM 0 HG SER A 1 -24.323 -2.809 0.256 1.00 0.00 H new ATOM 12 N HIS A 2 -24.558 -8.393 -0.450 1.00 0.00 N ATOM 13 CA HIS A 2 -24.674 -9.681 0.224 1.00 0.00 C ATOM 14 C HIS A 2 -23.304 -10.193 0.661 1.00 0.00 C ATOM 15 O HIS A 2 -23.161 -10.772 1.736 1.00 0.00 O ATOM 16 CB HIS A 2 -25.344 -10.703 -0.694 1.00 0.00 C ATOM 17 CG HIS A 2 -26.840 -10.684 -0.621 1.00 0.00 C ATOM 18 ND1 HIS A 2 -27.641 -10.333 -1.686 1.00 0.00 N ATOM 19 CD2 HIS A 2 -27.681 -10.978 0.399 1.00 0.00 C ATOM 20 CE1 HIS A 2 -28.909 -10.410 -1.326 1.00 0.00 C ATOM 21 NE2 HIS A 2 -28.960 -10.798 -0.065 1.00 0.00 N ATOM 0 H HIS A 2 -24.538 -8.450 -1.468 1.00 0.00 H new ATOM 0 HA HIS A 2 -25.290 -9.543 1.112 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -25.036 -10.512 -1.722 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -24.988 -11.700 -0.435 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -27.398 -11.295 1.392 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -29.759 -10.193 -1.955 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -29.812 -10.941 0.477 1.00 0.00 H new ATOM 29 N MET A 3 -22.300 -9.974 -0.183 1.00 0.00 N ATOM 30 CA MET A 3 -20.942 -10.413 0.115 1.00 0.00 C ATOM 31 C MET A 3 -20.040 -9.220 0.416 1.00 0.00 C ATOM 32 O MET A 3 -20.472 -8.070 0.350 1.00 0.00 O ATOM 33 CB MET A 3 -20.374 -11.216 -1.055 1.00 0.00 C ATOM 34 CG MET A 3 -20.997 -12.594 -1.206 1.00 0.00 C ATOM 35 SD MET A 3 -20.452 -13.748 0.067 1.00 0.00 S ATOM 36 CE MET A 3 -21.138 -15.282 -0.551 1.00 0.00 C ATOM 0 H MET A 3 -22.402 -9.495 -1.078 1.00 0.00 H new ATOM 0 HA MET A 3 -20.978 -11.051 0.998 1.00 0.00 H new ATOM 0 HB2 MET A 3 -20.525 -10.655 -1.977 1.00 0.00 H new ATOM 0 HB3 MET A 3 -19.298 -11.326 -0.921 1.00 0.00 H new ATOM 0 HG2 MET A 3 -22.083 -12.503 -1.168 1.00 0.00 H new ATOM 0 HG3 MET A 3 -20.745 -12.996 -2.187 1.00 0.00 H new ATOM 0 HE1 MET A 3 -20.885 -16.094 0.131 1.00 0.00 H new ATOM 0 HE2 MET A 3 -22.222 -15.193 -0.623 1.00 0.00 H new ATOM 0 HE3 MET A 3 -20.725 -15.494 -1.537 1.00 0.00 H new ATOM 46 N GLY A 4 -18.783 -9.503 0.745 1.00 0.00 N ATOM 47 CA GLY A 4 -17.840 -8.443 1.051 1.00 0.00 C ATOM 48 C GLY A 4 -16.569 -8.965 1.692 1.00 0.00 C ATOM 49 O GLY A 4 -16.479 -9.064 2.916 1.00 0.00 O ATOM 0 H GLY A 4 -18.401 -10.447 0.805 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -17.588 -7.909 0.135 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -18.312 -7.723 1.720 1.00 0.00 H new ATOM 53 N ALA A 5 -15.585 -9.301 0.865 1.00 0.00 N ATOM 54 CA ALA A 5 -14.314 -9.815 1.358 1.00 0.00 C ATOM 55 C ALA A 5 -13.265 -8.710 1.431 1.00 0.00 C ATOM 56 O ALA A 5 -12.338 -8.668 0.624 1.00 0.00 O ATOM 57 CB ALA A 5 -13.825 -10.951 0.473 1.00 0.00 C ATOM 0 H ALA A 5 -15.644 -9.226 -0.151 1.00 0.00 H new ATOM 0 HA ALA A 5 -14.472 -10.197 2.367 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -12.875 -11.325 0.853 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -14.559 -11.756 0.476 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -13.690 -10.587 -0.545 1.00 0.00 H new ATOM 63 N ALA A 6 -13.421 -7.815 2.402 1.00 0.00 N ATOM 64 CA ALA A 6 -12.487 -6.711 2.580 1.00 0.00 C ATOM 65 C ALA A 6 -12.753 -5.974 3.888 1.00 0.00 C ATOM 66 O ALA A 6 -13.868 -5.993 4.408 1.00 0.00 O ATOM 67 CB ALA A 6 -12.575 -5.750 1.403 1.00 0.00 C ATOM 0 H ALA A 6 -14.186 -7.834 3.077 1.00 0.00 H new ATOM 0 HA ALA A 6 -11.479 -7.123 2.623 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -11.872 -4.930 1.549 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -12.329 -6.279 0.482 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -13.587 -5.352 1.333 1.00 0.00 H new ATOM 73 N ALA A 7 -11.719 -5.323 4.415 1.00 0.00 N ATOM 74 CA ALA A 7 -11.842 -4.578 5.662 1.00 0.00 C ATOM 75 C ALA A 7 -12.980 -3.565 5.587 1.00 0.00 C ATOM 76 O ALA A 7 -13.657 -3.302 6.581 1.00 0.00 O ATOM 77 CB ALA A 7 -10.531 -3.879 5.991 1.00 0.00 C ATOM 0 H ALA A 7 -10.789 -5.297 3.998 1.00 0.00 H new ATOM 0 HA ALA A 7 -12.073 -5.286 6.458 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -10.638 -3.327 6.925 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.740 -4.621 6.097 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.276 -3.188 5.188 1.00 0.00 H new ATOM 83 N LEU A 8 -13.184 -2.998 4.403 1.00 0.00 N ATOM 84 CA LEU A 8 -14.239 -2.013 4.199 1.00 0.00 C ATOM 85 C LEU A 8 -15.038 -2.324 2.937 1.00 0.00 C ATOM 86 O LEU A 8 -14.467 -2.602 1.882 1.00 0.00 O ATOM 87 CB LEU A 8 -13.642 -0.608 4.103 1.00 0.00 C ATOM 88 CG LEU A 8 -12.173 -0.531 3.683 1.00 0.00 C ATOM 89 CD1 LEU A 8 -11.885 0.792 2.990 1.00 0.00 C ATOM 90 CD2 LEU A 8 -11.263 -0.711 4.889 1.00 0.00 C ATOM 0 H LEU A 8 -12.632 -3.204 3.570 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.913 -2.057 5.055 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -14.233 -0.031 3.392 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -13.748 -0.123 5.073 1.00 0.00 H new ATOM 0 HG LEU A 8 -11.974 -1.339 2.979 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -10.835 0.829 2.698 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -12.512 0.882 2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -12.101 1.615 3.672 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -10.222 -0.653 4.571 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -11.464 0.075 5.617 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.450 -1.684 5.344 1.00 0.00 H new ATOM 102 N ARG A 9 -16.361 -2.275 3.052 1.00 0.00 N ATOM 103 CA ARG A 9 -17.238 -2.550 1.921 1.00 0.00 C ATOM 104 C ARG A 9 -17.697 -1.254 1.260 1.00 0.00 C ATOM 105 O ARG A 9 -18.477 -1.273 0.308 1.00 0.00 O ATOM 106 CB ARG A 9 -18.453 -3.362 2.375 1.00 0.00 C ATOM 107 CG ARG A 9 -19.609 -2.505 2.862 1.00 0.00 C ATOM 108 CD ARG A 9 -19.208 -1.653 4.056 1.00 0.00 C ATOM 109 NE ARG A 9 -20.366 -1.062 4.721 1.00 0.00 N ATOM 110 CZ ARG A 9 -20.304 -0.446 5.896 1.00 0.00 C ATOM 111 NH1 ARG A 9 -19.145 -0.340 6.532 1.00 0.00 N ATOM 112 NH2 ARG A 9 -21.401 0.066 6.438 1.00 0.00 N ATOM 0 H ARG A 9 -16.849 -2.047 3.918 1.00 0.00 H new ATOM 0 HA ARG A 9 -16.674 -3.130 1.190 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -18.795 -3.982 1.547 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -18.150 -4.037 3.175 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -19.951 -1.860 2.053 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -20.448 -3.145 3.136 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -18.654 -2.265 4.768 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -18.536 -0.861 3.726 1.00 0.00 H new ATOM 0 HE ARG A 9 -21.272 -1.126 4.258 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -18.299 -0.732 6.119 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -19.100 0.134 7.434 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -22.294 -0.013 5.952 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -21.351 0.539 7.341 1.00 0.00 H new ATOM 126 N SER A 10 -17.209 -0.129 1.773 1.00 0.00 N ATOM 127 CA SER A 10 -17.573 1.177 1.236 1.00 0.00 C ATOM 128 C SER A 10 -16.479 2.203 1.517 1.00 0.00 C ATOM 129 O SER A 10 -16.072 2.398 2.663 1.00 0.00 O ATOM 130 CB SER A 10 -18.898 1.649 1.838 1.00 0.00 C ATOM 131 OG SER A 10 -19.689 0.550 2.253 1.00 0.00 O ATOM 0 H SER A 10 -16.561 -0.096 2.560 1.00 0.00 H new ATOM 0 HA SER A 10 -17.688 1.080 0.156 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.703 2.302 2.688 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.446 2.238 1.103 1.00 0.00 H new ATOM 0 HG SER A 10 -20.530 0.878 2.635 1.00 0.00 H new ATOM 137 N CYS A 11 -16.006 2.857 0.461 1.00 0.00 N ATOM 138 CA CYS A 11 -14.960 3.864 0.591 1.00 0.00 C ATOM 139 C CYS A 11 -15.329 4.900 1.648 1.00 0.00 C ATOM 140 O CYS A 11 -16.211 5.737 1.453 1.00 0.00 O ATOM 141 CB CYS A 11 -14.717 4.555 -0.752 1.00 0.00 C ATOM 142 SG CYS A 11 -13.158 5.495 -0.836 1.00 0.00 S ATOM 0 H CYS A 11 -16.331 2.707 -0.494 1.00 0.00 H new ATOM 0 HA CYS A 11 -14.045 3.361 0.904 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -14.718 3.803 -1.541 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -15.547 5.231 -0.956 1.00 0.00 H new ATOM 147 N PRO A 12 -14.638 4.844 2.798 1.00 0.00 N ATOM 148 CA PRO A 12 -14.876 5.770 3.909 1.00 0.00 C ATOM 149 C PRO A 12 -14.418 7.190 3.589 1.00 0.00 C ATOM 150 O PRO A 12 -14.590 8.104 4.395 1.00 0.00 O ATOM 151 CB PRO A 12 -14.037 5.182 5.046 1.00 0.00 C ATOM 152 CG PRO A 12 -12.960 4.412 4.363 1.00 0.00 C ATOM 153 CD PRO A 12 -13.573 3.874 3.100 1.00 0.00 C ATOM 0 HA PRO A 12 -15.936 5.860 4.145 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.622 5.967 5.679 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -14.637 4.538 5.689 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -12.105 5.050 4.141 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -12.597 3.602 4.996 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -12.843 3.814 2.293 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -13.973 2.870 3.243 1.00 0.00 H new ATOM 161 N MET A 13 -13.836 7.367 2.407 1.00 0.00 N ATOM 162 CA MET A 13 -13.356 8.675 1.981 1.00 0.00 C ATOM 163 C MET A 13 -14.422 9.409 1.172 1.00 0.00 C ATOM 164 O MET A 13 -14.791 10.539 1.493 1.00 0.00 O ATOM 165 CB MET A 13 -12.081 8.529 1.149 1.00 0.00 C ATOM 166 CG MET A 13 -10.805 8.731 1.952 1.00 0.00 C ATOM 167 SD MET A 13 -9.327 8.731 0.919 1.00 0.00 S ATOM 168 CE MET A 13 -8.968 6.978 0.841 1.00 0.00 C ATOM 0 H MET A 13 -13.686 6.621 1.728 1.00 0.00 H new ATOM 0 HA MET A 13 -13.134 9.260 2.874 1.00 0.00 H new ATOM 0 HB2 MET A 13 -12.063 7.537 0.697 1.00 0.00 H new ATOM 0 HB3 MET A 13 -12.105 9.251 0.333 1.00 0.00 H new ATOM 0 HG2 MET A 13 -10.866 9.676 2.492 1.00 0.00 H new ATOM 0 HG3 MET A 13 -10.722 7.942 2.699 1.00 0.00 H new ATOM 0 HE1 MET A 13 -8.417 6.760 -0.074 1.00 0.00 H new ATOM 0 HE2 MET A 13 -8.367 6.691 1.704 1.00 0.00 H new ATOM 0 HE3 MET A 13 -9.901 6.415 0.846 1.00 0.00 H new ATOM 178 N CYS A 14 -14.912 8.759 0.122 1.00 0.00 N ATOM 179 CA CYS A 14 -15.936 9.349 -0.733 1.00 0.00 C ATOM 180 C CYS A 14 -17.256 8.594 -0.602 1.00 0.00 C ATOM 181 O CYS A 14 -18.112 8.666 -1.483 1.00 0.00 O ATOM 182 CB CYS A 14 -15.475 9.344 -2.192 1.00 0.00 C ATOM 183 SG CYS A 14 -15.431 7.689 -2.953 1.00 0.00 S ATOM 0 H CYS A 14 -14.617 7.824 -0.158 1.00 0.00 H new ATOM 0 HA CYS A 14 -16.094 10.379 -0.412 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -16.140 9.982 -2.774 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -14.480 9.785 -2.249 1.00 0.00 H new ATOM 188 N GLN A 15 -17.411 7.873 0.503 1.00 0.00 N ATOM 189 CA GLN A 15 -18.626 7.106 0.749 1.00 0.00 C ATOM 190 C GLN A 15 -19.088 6.397 -0.520 1.00 0.00 C ATOM 191 O GLN A 15 -20.169 6.673 -1.041 1.00 0.00 O ATOM 192 CB GLN A 15 -19.737 8.021 1.268 1.00 0.00 C ATOM 193 CG GLN A 15 -19.618 8.339 2.750 1.00 0.00 C ATOM 194 CD GLN A 15 -19.677 7.100 3.620 1.00 0.00 C ATOM 195 OE1 GLN A 15 -18.844 6.910 4.508 1.00 0.00 O ATOM 196 NE2 GLN A 15 -20.663 6.247 3.370 1.00 0.00 N ATOM 0 H GLN A 15 -16.711 7.804 1.242 1.00 0.00 H new ATOM 0 HA GLN A 15 -18.403 6.353 1.505 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -19.723 8.953 0.702 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -20.702 7.549 1.082 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -18.678 8.861 2.931 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -20.420 9.018 3.037 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -21.331 6.444 2.625 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -20.753 5.395 3.923 1.00 0.00 H new ATOM 205 N LYS A 16 -18.262 5.481 -1.014 1.00 0.00 N ATOM 206 CA LYS A 16 -18.584 4.730 -2.222 1.00 0.00 C ATOM 207 C LYS A 16 -18.588 3.230 -1.945 1.00 0.00 C ATOM 208 O LYS A 16 -17.533 2.615 -1.795 1.00 0.00 O ATOM 209 CB LYS A 16 -17.580 5.052 -3.331 1.00 0.00 C ATOM 210 CG LYS A 16 -17.787 4.235 -4.595 1.00 0.00 C ATOM 211 CD LYS A 16 -17.993 5.126 -5.808 1.00 0.00 C ATOM 212 CE LYS A 16 -16.710 5.847 -6.195 1.00 0.00 C ATOM 213 NZ LYS A 16 -16.958 6.920 -7.197 1.00 0.00 N ATOM 0 H LYS A 16 -17.363 5.240 -0.596 1.00 0.00 H new ATOM 0 HA LYS A 16 -19.582 5.024 -2.547 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -17.651 6.111 -3.577 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -16.571 4.879 -2.958 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -16.923 3.591 -4.758 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -18.652 3.583 -4.470 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -18.341 4.524 -6.648 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -18.773 5.857 -5.595 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -16.254 6.280 -5.305 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -15.998 5.129 -6.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -16.060 7.387 -7.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -17.370 6.504 -8.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -17.618 7.619 -6.801 1.00 0.00 H new ATOM 227 N GLU A 17 -19.782 2.647 -1.882 1.00 0.00 N ATOM 228 CA GLU A 17 -19.921 1.219 -1.624 1.00 0.00 C ATOM 229 C GLU A 17 -19.158 0.402 -2.663 1.00 0.00 C ATOM 230 O GLU A 17 -19.517 0.383 -3.840 1.00 0.00 O ATOM 231 CB GLU A 17 -21.397 0.819 -1.628 1.00 0.00 C ATOM 232 CG GLU A 17 -22.181 1.371 -0.449 1.00 0.00 C ATOM 233 CD GLU A 17 -23.672 1.430 -0.717 1.00 0.00 C ATOM 234 OE1 GLU A 17 -24.211 0.463 -1.294 1.00 0.00 O ATOM 235 OE2 GLU A 17 -24.301 2.444 -0.348 1.00 0.00 O ATOM 0 H GLU A 17 -20.665 3.142 -2.006 1.00 0.00 H new ATOM 0 HA GLU A 17 -19.498 1.010 -0.641 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -21.856 1.166 -2.553 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -21.470 -0.269 -1.625 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -21.997 0.750 0.428 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -21.818 2.371 -0.212 1.00 0.00 H new ATOM 242 N PHE A 18 -18.102 -0.272 -2.218 1.00 0.00 N ATOM 243 CA PHE A 18 -17.286 -1.090 -3.108 1.00 0.00 C ATOM 244 C PHE A 18 -18.082 -2.282 -3.633 1.00 0.00 C ATOM 245 O PHE A 18 -19.024 -2.744 -2.990 1.00 0.00 O ATOM 246 CB PHE A 18 -16.033 -1.580 -2.380 1.00 0.00 C ATOM 247 CG PHE A 18 -15.132 -0.468 -1.924 1.00 0.00 C ATOM 248 CD1 PHE A 18 -14.678 0.486 -2.820 1.00 0.00 C ATOM 249 CD2 PHE A 18 -14.739 -0.376 -0.599 1.00 0.00 C ATOM 250 CE1 PHE A 18 -13.849 1.510 -2.404 1.00 0.00 C ATOM 251 CE2 PHE A 18 -13.910 0.645 -0.177 1.00 0.00 C ATOM 252 CZ PHE A 18 -13.463 1.589 -1.081 1.00 0.00 C ATOM 0 H PHE A 18 -17.791 -0.268 -1.246 1.00 0.00 H new ATOM 0 HA PHE A 18 -16.987 -0.473 -3.955 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -16.333 -2.172 -1.515 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -15.474 -2.242 -3.041 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -14.976 0.429 -3.857 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -15.085 -1.111 0.113 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -13.503 2.248 -3.113 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -13.611 0.705 0.859 1.00 0.00 H new ATOM 0 HZ PHE A 18 -12.813 2.387 -0.753 1.00 0.00 H new ATOM 262 N ALA A 19 -17.697 -2.772 -4.806 1.00 0.00 N ATOM 263 CA ALA A 19 -18.372 -3.910 -5.417 1.00 0.00 C ATOM 264 C ALA A 19 -18.321 -5.132 -4.508 1.00 0.00 C ATOM 265 O ALA A 19 -17.411 -5.292 -3.693 1.00 0.00 O ATOM 266 CB ALA A 19 -17.750 -4.229 -6.769 1.00 0.00 C ATOM 0 H ALA A 19 -16.921 -2.399 -5.353 1.00 0.00 H new ATOM 0 HA ALA A 19 -19.419 -3.643 -5.564 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -18.264 -5.081 -7.214 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -17.845 -3.365 -7.426 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -16.695 -4.470 -6.636 1.00 0.00 H new ATOM 272 N PRO A 20 -19.320 -6.016 -4.647 1.00 0.00 N ATOM 273 CA PRO A 20 -19.412 -7.240 -3.844 1.00 0.00 C ATOM 274 C PRO A 20 -18.333 -8.254 -4.208 1.00 0.00 C ATOM 275 O PRO A 20 -17.650 -8.110 -5.222 1.00 0.00 O ATOM 276 CB PRO A 20 -20.799 -7.787 -4.189 1.00 0.00 C ATOM 277 CG PRO A 20 -21.096 -7.240 -5.542 1.00 0.00 C ATOM 278 CD PRO A 20 -20.438 -5.889 -5.596 1.00 0.00 C ATOM 0 HA PRO A 20 -19.269 -7.043 -2.782 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -20.805 -8.877 -4.193 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -21.543 -7.467 -3.460 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -20.707 -7.895 -6.322 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -22.171 -7.157 -5.702 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -20.087 -5.653 -6.601 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -21.125 -5.095 -5.303 1.00 0.00 H new ATOM 286 N ARG A 21 -18.185 -9.280 -3.376 1.00 0.00 N ATOM 287 CA ARG A 21 -17.189 -10.318 -3.611 1.00 0.00 C ATOM 288 C ARG A 21 -15.890 -9.714 -4.138 1.00 0.00 C ATOM 289 O ARG A 21 -15.255 -10.269 -5.035 1.00 0.00 O ATOM 290 CB ARG A 21 -17.722 -11.351 -4.604 1.00 0.00 C ATOM 291 CG ARG A 21 -17.983 -10.786 -5.990 1.00 0.00 C ATOM 292 CD ARG A 21 -18.053 -11.887 -7.037 1.00 0.00 C ATOM 293 NE ARG A 21 -19.425 -12.152 -7.463 1.00 0.00 N ATOM 294 CZ ARG A 21 -20.252 -12.964 -6.814 1.00 0.00 C ATOM 295 NH1 ARG A 21 -19.849 -13.586 -5.716 1.00 0.00 N ATOM 296 NH2 ARG A 21 -21.486 -13.153 -7.265 1.00 0.00 N ATOM 0 H ARG A 21 -18.743 -9.414 -2.533 1.00 0.00 H new ATOM 0 HA ARG A 21 -16.983 -10.811 -2.661 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -17.006 -12.169 -4.683 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -18.647 -11.774 -4.213 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -18.919 -10.227 -5.986 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -17.192 -10.083 -6.252 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -17.453 -11.603 -7.902 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -17.616 -12.800 -6.632 1.00 0.00 H new ATOM 0 HE ARG A 21 -19.767 -11.688 -8.305 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -18.902 -13.442 -5.367 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -20.486 -14.209 -5.220 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -21.799 -12.675 -8.110 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -22.121 -13.776 -6.767 1.00 0.00 H new ATOM 310 N LEU A 22 -15.502 -8.575 -3.574 1.00 0.00 N ATOM 311 CA LEU A 22 -14.278 -7.897 -3.986 1.00 0.00 C ATOM 312 C LEU A 22 -13.059 -8.505 -3.300 1.00 0.00 C ATOM 313 O LEU A 22 -13.173 -9.480 -2.556 1.00 0.00 O ATOM 314 CB LEU A 22 -14.366 -6.404 -3.664 1.00 0.00 C ATOM 315 CG LEU A 22 -14.954 -6.046 -2.299 1.00 0.00 C ATOM 316 CD1 LEU A 22 -14.189 -6.748 -1.188 1.00 0.00 C ATOM 317 CD2 LEU A 22 -14.939 -4.538 -2.090 1.00 0.00 C ATOM 0 H LEU A 22 -16.017 -8.102 -2.831 1.00 0.00 H new ATOM 0 HA LEU A 22 -14.167 -8.025 -5.063 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -13.364 -5.979 -3.729 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -14.967 -5.921 -4.434 1.00 0.00 H new ATOM 0 HG LEU A 22 -15.989 -6.386 -2.270 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -14.622 -6.481 -0.224 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -14.252 -7.827 -1.328 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -13.144 -6.439 -1.215 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -15.361 -4.302 -1.113 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -13.913 -4.174 -2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -15.532 -4.057 -2.868 1.00 0.00 H new ATOM 329 N THR A 23 -11.891 -7.922 -3.553 1.00 0.00 N ATOM 330 CA THR A 23 -10.651 -8.405 -2.959 1.00 0.00 C ATOM 331 C THR A 23 -9.875 -7.268 -2.304 1.00 0.00 C ATOM 332 O THR A 23 -10.121 -6.096 -2.584 1.00 0.00 O ATOM 333 CB THR A 23 -9.753 -9.086 -4.009 1.00 0.00 C ATOM 334 OG1 THR A 23 -9.597 -8.232 -5.148 1.00 0.00 O ATOM 335 CG2 THR A 23 -10.345 -10.418 -4.444 1.00 0.00 C ATOM 0 H THR A 23 -11.778 -7.114 -4.166 1.00 0.00 H new ATOM 0 HA THR A 23 -10.929 -9.136 -2.200 1.00 0.00 H new ATOM 0 HB THR A 23 -8.778 -9.270 -3.558 1.00 0.00 H new ATOM 0 HG1 THR A 23 -9.024 -8.672 -5.810 1.00 0.00 H new ATOM 0 HG21 THR A 23 -9.694 -10.881 -5.186 1.00 0.00 H new ATOM 0 HG22 THR A 23 -10.435 -11.076 -3.580 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.331 -10.253 -4.879 1.00 0.00 H new ATOM 343 N GLN A 24 -8.938 -7.624 -1.431 1.00 0.00 N ATOM 344 CA GLN A 24 -8.127 -6.631 -0.736 1.00 0.00 C ATOM 345 C GLN A 24 -7.512 -5.644 -1.723 1.00 0.00 C ATOM 346 O GLN A 24 -7.383 -4.454 -1.427 1.00 0.00 O ATOM 347 CB GLN A 24 -7.023 -7.318 0.070 1.00 0.00 C ATOM 348 CG GLN A 24 -7.530 -8.436 0.967 1.00 0.00 C ATOM 349 CD GLN A 24 -8.654 -7.988 1.880 1.00 0.00 C ATOM 350 OE1 GLN A 24 -9.664 -8.676 2.025 1.00 0.00 O ATOM 351 NE2 GLN A 24 -8.484 -6.827 2.502 1.00 0.00 N ATOM 0 H GLN A 24 -8.722 -8.591 -1.188 1.00 0.00 H new ATOM 0 HA GLN A 24 -8.776 -6.080 -0.055 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -6.281 -7.724 -0.618 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -6.515 -6.573 0.683 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -7.878 -9.263 0.348 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.705 -8.814 1.571 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -7.631 -6.289 2.353 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -9.207 -6.474 3.129 1.00 0.00 H new ATOM 360 N LEU A 25 -7.135 -6.142 -2.894 1.00 0.00 N ATOM 361 CA LEU A 25 -6.534 -5.303 -3.925 1.00 0.00 C ATOM 362 C LEU A 25 -7.574 -4.378 -4.549 1.00 0.00 C ATOM 363 O LEU A 25 -7.267 -3.245 -4.920 1.00 0.00 O ATOM 364 CB LEU A 25 -5.893 -6.172 -5.008 1.00 0.00 C ATOM 365 CG LEU A 25 -5.588 -5.476 -6.335 1.00 0.00 C ATOM 366 CD1 LEU A 25 -4.556 -4.378 -6.136 1.00 0.00 C ATOM 367 CD2 LEU A 25 -5.106 -6.485 -7.368 1.00 0.00 C ATOM 0 H LEU A 25 -7.235 -7.123 -3.154 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.764 -4.690 -3.456 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.963 -6.582 -4.614 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -6.554 -7.016 -5.207 1.00 0.00 H new ATOM 0 HG LEU A 25 -6.506 -5.020 -6.704 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.351 -3.894 -7.091 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.940 -3.641 -5.430 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.636 -4.811 -5.744 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.894 -5.972 -8.306 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.200 -6.971 -7.007 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.879 -7.236 -7.532 1.00 0.00 H new ATOM 379 N ASP A 26 -8.804 -4.868 -4.659 1.00 0.00 N ATOM 380 CA ASP A 26 -9.890 -4.083 -5.235 1.00 0.00 C ATOM 381 C ASP A 26 -10.123 -2.807 -4.432 1.00 0.00 C ATOM 382 O ASP A 26 -10.181 -1.711 -4.991 1.00 0.00 O ATOM 383 CB ASP A 26 -11.175 -4.911 -5.283 1.00 0.00 C ATOM 384 CG ASP A 26 -11.062 -6.101 -6.216 1.00 0.00 C ATOM 385 OD1 ASP A 26 -9.996 -6.261 -6.847 1.00 0.00 O ATOM 386 OD2 ASP A 26 -12.039 -6.872 -6.315 1.00 0.00 O ATOM 0 H ASP A 26 -9.074 -5.804 -4.357 1.00 0.00 H new ATOM 0 HA ASP A 26 -9.607 -3.806 -6.250 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -11.416 -5.261 -4.279 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -12.001 -4.277 -5.606 1.00 0.00 H new ATOM 391 N VAL A 27 -10.258 -2.956 -3.118 1.00 0.00 N ATOM 392 CA VAL A 27 -10.485 -1.815 -2.238 1.00 0.00 C ATOM 393 C VAL A 27 -9.231 -0.956 -2.117 1.00 0.00 C ATOM 394 O VAL A 27 -9.313 0.257 -1.924 1.00 0.00 O ATOM 395 CB VAL A 27 -10.920 -2.268 -0.832 1.00 0.00 C ATOM 396 CG1 VAL A 27 -11.180 -1.065 0.061 1.00 0.00 C ATOM 397 CG2 VAL A 27 -12.153 -3.156 -0.917 1.00 0.00 C ATOM 0 H VAL A 27 -10.214 -3.856 -2.639 1.00 0.00 H new ATOM 0 HA VAL A 27 -11.285 -1.225 -2.685 1.00 0.00 H new ATOM 0 HB VAL A 27 -10.111 -2.849 -0.390 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.486 -1.406 1.050 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.269 -0.472 0.147 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -11.971 -0.454 -0.373 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.447 -3.467 0.085 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.970 -2.601 -1.379 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -11.927 -4.036 -1.518 1.00 0.00 H new ATOM 407 N ASP A 28 -8.071 -1.593 -2.234 1.00 0.00 N ATOM 408 CA ASP A 28 -6.798 -0.887 -2.139 1.00 0.00 C ATOM 409 C ASP A 28 -6.567 -0.017 -3.371 1.00 0.00 C ATOM 410 O ASP A 28 -6.127 1.127 -3.260 1.00 0.00 O ATOM 411 CB ASP A 28 -5.649 -1.884 -1.979 1.00 0.00 C ATOM 412 CG ASP A 28 -5.573 -2.460 -0.580 1.00 0.00 C ATOM 413 OD1 ASP A 28 -6.001 -1.772 0.371 1.00 0.00 O ATOM 414 OD2 ASP A 28 -5.086 -3.602 -0.434 1.00 0.00 O ATOM 0 H ASP A 28 -7.986 -2.597 -2.395 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.832 -0.241 -1.262 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.773 -2.695 -2.696 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.707 -1.390 -2.217 1.00 0.00 H new ATOM 419 N SER A 29 -6.866 -0.568 -4.543 1.00 0.00 N ATOM 420 CA SER A 29 -6.685 0.156 -5.795 1.00 0.00 C ATOM 421 C SER A 29 -7.359 1.524 -5.735 1.00 0.00 C ATOM 422 O SER A 29 -6.728 2.550 -5.987 1.00 0.00 O ATOM 423 CB SER A 29 -7.253 -0.654 -6.963 1.00 0.00 C ATOM 424 OG SER A 29 -6.631 -1.924 -7.053 1.00 0.00 O ATOM 0 H SER A 29 -7.234 -1.513 -4.651 1.00 0.00 H new ATOM 0 HA SER A 29 -5.616 0.304 -5.949 1.00 0.00 H new ATOM 0 HB2 SER A 29 -8.328 -0.780 -6.833 1.00 0.00 H new ATOM 0 HB3 SER A 29 -7.106 -0.107 -7.894 1.00 0.00 H new ATOM 0 HG SER A 29 -7.063 -2.545 -6.430 1.00 0.00 H new ATOM 430 N HIS A 30 -8.644 1.528 -5.398 1.00 0.00 N ATOM 431 CA HIS A 30 -9.406 2.769 -5.303 1.00 0.00 C ATOM 432 C HIS A 30 -8.924 3.613 -4.127 1.00 0.00 C ATOM 433 O HIS A 30 -8.738 4.824 -4.254 1.00 0.00 O ATOM 434 CB HIS A 30 -10.897 2.467 -5.152 1.00 0.00 C ATOM 435 CG HIS A 30 -11.752 3.694 -5.087 1.00 0.00 C ATOM 436 ND1 HIS A 30 -12.725 3.984 -6.021 1.00 0.00 N ATOM 437 CD2 HIS A 30 -11.779 4.709 -4.191 1.00 0.00 C ATOM 438 CE1 HIS A 30 -13.312 5.124 -5.703 1.00 0.00 C ATOM 439 NE2 HIS A 30 -12.756 5.585 -4.596 1.00 0.00 N ATOM 0 H HIS A 30 -9.180 0.687 -5.186 1.00 0.00 H new ATOM 0 HA HIS A 30 -9.249 3.334 -6.222 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -11.222 1.852 -5.991 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -11.050 1.879 -4.247 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -12.955 3.408 -6.831 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -11.149 4.811 -3.320 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -14.110 5.599 -6.254 1.00 0.00 H new ATOM 447 N LEU A 31 -8.723 2.966 -2.984 1.00 0.00 N ATOM 448 CA LEU A 31 -8.263 3.658 -1.784 1.00 0.00 C ATOM 449 C LEU A 31 -7.005 4.471 -2.073 1.00 0.00 C ATOM 450 O LEU A 31 -6.824 5.563 -1.536 1.00 0.00 O ATOM 451 CB LEU A 31 -7.988 2.651 -0.666 1.00 0.00 C ATOM 452 CG LEU A 31 -9.156 2.361 0.278 1.00 0.00 C ATOM 453 CD1 LEU A 31 -8.803 1.230 1.231 1.00 0.00 C ATOM 454 CD2 LEU A 31 -9.539 3.614 1.053 1.00 0.00 C ATOM 0 H LEU A 31 -8.871 1.964 -2.863 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.049 4.342 -1.464 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.672 1.712 -1.120 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.150 3.017 -0.073 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.013 2.051 -0.320 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.646 1.037 1.895 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -8.578 0.329 0.660 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -7.932 1.511 1.823 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -10.372 3.389 1.720 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.686 3.954 1.640 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -9.834 4.397 0.355 1.00 0.00 H new ATOM 466 N ALA A 32 -6.141 3.931 -2.927 1.00 0.00 N ATOM 467 CA ALA A 32 -4.903 4.608 -3.290 1.00 0.00 C ATOM 468 C ALA A 32 -5.186 5.912 -4.031 1.00 0.00 C ATOM 469 O ALA A 32 -4.536 6.927 -3.787 1.00 0.00 O ATOM 470 CB ALA A 32 -4.032 3.695 -4.140 1.00 0.00 C ATOM 0 H ALA A 32 -6.276 3.027 -3.380 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.369 4.851 -2.372 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.110 4.214 -4.404 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -3.792 2.793 -3.577 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.568 3.423 -5.049 1.00 0.00 H new ATOM 476 N GLN A 33 -6.159 5.873 -4.935 1.00 0.00 N ATOM 477 CA GLN A 33 -6.527 7.051 -5.712 1.00 0.00 C ATOM 478 C GLN A 33 -7.297 8.049 -4.855 1.00 0.00 C ATOM 479 O GLN A 33 -6.949 9.229 -4.845 1.00 0.00 O ATOM 480 CB GLN A 33 -7.367 6.646 -6.924 1.00 0.00 C ATOM 481 CG GLN A 33 -6.562 5.974 -8.026 1.00 0.00 C ATOM 482 CD GLN A 33 -6.213 6.923 -9.155 1.00 0.00 C ATOM 483 OE1 GLN A 33 -5.371 7.906 -8.863 1.00 0.00 O flip ATOM 484 NE2 GLN A 33 -6.695 6.773 -10.279 1.00 0.00 N flip ATOM 0 H GLN A 33 -6.707 5.039 -5.148 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.610 7.529 -6.058 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -8.157 5.969 -6.598 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -7.854 7.532 -7.330 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -5.644 5.566 -7.603 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -7.130 5.134 -8.425 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -7.339 6.003 -10.459 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -6.450 7.419 -11.029 1.00 0.00 H new ATOM 493 N CYS A 34 -8.316 7.562 -4.163 1.00 0.00 N ATOM 494 CA CYS A 34 -9.123 8.421 -3.312 1.00 0.00 C ATOM 495 C CYS A 34 -8.189 9.149 -2.343 1.00 0.00 C ATOM 496 O CYS A 34 -8.329 10.343 -2.074 1.00 0.00 O ATOM 497 CB CYS A 34 -10.208 7.632 -2.576 1.00 0.00 C ATOM 498 SG CYS A 34 -11.764 8.594 -2.536 1.00 0.00 S ATOM 0 H CYS A 34 -8.602 6.583 -4.174 1.00 0.00 H new ATOM 0 HA CYS A 34 -9.652 9.151 -3.924 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -10.374 6.676 -3.073 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -9.882 7.410 -1.560 1.00 0.00 H new ATOM 503 N LEU A 35 -7.228 8.397 -1.819 1.00 0.00 N ATOM 504 CA LEU A 35 -6.257 8.944 -0.877 1.00 0.00 C ATOM 505 C LEU A 35 -5.386 10.004 -1.545 1.00 0.00 C ATOM 506 O LEU A 35 -5.220 11.105 -1.022 1.00 0.00 O ATOM 507 CB LEU A 35 -5.377 7.826 -0.314 1.00 0.00 C ATOM 508 CG LEU A 35 -4.460 8.214 0.846 1.00 0.00 C ATOM 509 CD1 LEU A 35 -5.272 8.453 2.111 1.00 0.00 C ATOM 510 CD2 LEU A 35 -3.411 7.136 1.080 1.00 0.00 C ATOM 0 H LEU A 35 -7.100 7.407 -2.030 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.806 9.413 -0.060 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -6.024 7.013 0.017 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.760 7.434 -1.123 1.00 0.00 H new ATOM 0 HG LEU A 35 -3.949 9.141 0.586 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -4.603 8.728 2.926 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -5.985 9.259 1.939 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.810 7.543 2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.767 7.429 1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -3.904 6.194 1.319 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -2.809 7.012 0.180 1.00 0.00 H new ATOM 522 N ALA A 36 -4.836 9.663 -2.706 1.00 0.00 N ATOM 523 CA ALA A 36 -3.986 10.586 -3.448 1.00 0.00 C ATOM 524 C ALA A 36 -4.752 11.848 -3.833 1.00 0.00 C ATOM 525 O ALA A 36 -4.156 12.898 -4.073 1.00 0.00 O ATOM 526 CB ALA A 36 -3.428 9.907 -4.690 1.00 0.00 C ATOM 0 H ALA A 36 -4.964 8.755 -3.153 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.157 10.877 -2.802 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.795 10.608 -5.235 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.838 9.039 -4.396 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.250 9.588 -5.330 1.00 0.00 H new ATOM 532 N GLU A 37 -6.075 11.738 -3.891 1.00 0.00 N ATOM 533 CA GLU A 37 -6.922 12.871 -4.248 1.00 0.00 C ATOM 534 C GLU A 37 -7.403 13.605 -3.000 1.00 0.00 C ATOM 535 O GLU A 37 -7.785 14.773 -3.063 1.00 0.00 O ATOM 536 CB GLU A 37 -8.122 12.399 -5.072 1.00 0.00 C ATOM 537 CG GLU A 37 -7.776 12.056 -6.511 1.00 0.00 C ATOM 538 CD GLU A 37 -8.996 12.015 -7.410 1.00 0.00 C ATOM 539 OE1 GLU A 37 -10.119 11.881 -6.882 1.00 0.00 O ATOM 540 OE2 GLU A 37 -8.826 12.118 -8.643 1.00 0.00 O ATOM 0 H GLU A 37 -6.584 10.876 -3.695 1.00 0.00 H new ATOM 0 HA GLU A 37 -6.329 13.562 -4.847 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.558 11.522 -4.593 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -8.885 13.178 -5.066 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.070 12.792 -6.896 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.275 11.088 -6.540 1.00 0.00 H new ATOM 547 N SER A 38 -7.383 12.910 -1.867 1.00 0.00 N ATOM 548 CA SER A 38 -7.821 13.493 -0.605 1.00 0.00 C ATOM 549 C SER A 38 -6.829 14.545 -0.119 1.00 0.00 C ATOM 550 O SER A 38 -5.643 14.496 -0.445 1.00 0.00 O ATOM 551 CB SER A 38 -7.986 12.403 0.455 1.00 0.00 C ATOM 552 OG SER A 38 -8.626 12.911 1.614 1.00 0.00 O ATOM 0 H SER A 38 -7.068 11.942 -1.798 1.00 0.00 H new ATOM 0 HA SER A 38 -8.784 13.976 -0.772 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.569 11.578 0.045 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.009 12.000 0.722 1.00 0.00 H new ATOM 0 HG SER A 38 -8.024 12.829 2.383 1.00 0.00 H new ATOM 558 N THR A 39 -7.324 15.499 0.665 1.00 0.00 N ATOM 559 CA THR A 39 -6.483 16.564 1.196 1.00 0.00 C ATOM 560 C THR A 39 -6.200 16.355 2.679 1.00 0.00 C ATOM 561 O THR A 39 -5.269 16.940 3.231 1.00 0.00 O ATOM 562 CB THR A 39 -7.135 17.946 1.000 1.00 0.00 C ATOM 563 OG1 THR A 39 -7.871 17.970 -0.228 1.00 0.00 O ATOM 564 CG2 THR A 39 -6.083 19.045 0.987 1.00 0.00 C ATOM 0 H THR A 39 -8.303 15.555 0.946 1.00 0.00 H new ATOM 0 HA THR A 39 -5.545 16.531 0.642 1.00 0.00 H new ATOM 0 HB THR A 39 -7.813 18.124 1.834 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.284 18.851 -0.345 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.568 20.011 0.847 1.00 0.00 H new ATOM 0 HG22 THR A 39 -5.543 19.043 1.934 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.383 18.869 0.170 1.00 0.00 H new ATOM 572 N GLU A 40 -7.009 15.515 3.317 1.00 0.00 N ATOM 573 CA GLU A 40 -6.844 15.228 4.738 1.00 0.00 C ATOM 574 C GLU A 40 -6.445 13.772 4.956 1.00 0.00 C ATOM 575 O GLU A 40 -7.043 12.860 4.385 1.00 0.00 O ATOM 576 CB GLU A 40 -8.139 15.533 5.495 1.00 0.00 C ATOM 577 CG GLU A 40 -8.267 16.985 5.924 1.00 0.00 C ATOM 578 CD GLU A 40 -8.918 17.851 4.862 1.00 0.00 C ATOM 579 OE1 GLU A 40 -9.908 17.395 4.251 1.00 0.00 O ATOM 580 OE2 GLU A 40 -8.439 18.982 4.643 1.00 0.00 O ATOM 0 H GLU A 40 -7.784 15.022 2.874 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.048 15.866 5.122 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -8.989 15.274 4.863 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.192 14.896 6.378 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.853 17.039 6.841 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.278 17.381 6.154 1.00 0.00 H new ATOM 587 N ASP A 41 -5.429 13.563 5.787 1.00 0.00 N ATOM 588 CA ASP A 41 -4.949 12.218 6.082 1.00 0.00 C ATOM 589 C ASP A 41 -5.699 11.621 7.269 1.00 0.00 C ATOM 590 O ASP A 41 -5.138 11.455 8.352 1.00 0.00 O ATOM 591 CB ASP A 41 -3.447 12.242 6.373 1.00 0.00 C ATOM 592 CG ASP A 41 -2.709 13.257 5.524 1.00 0.00 C ATOM 593 OD1 ASP A 41 -2.696 14.448 5.901 1.00 0.00 O ATOM 594 OD2 ASP A 41 -2.147 12.864 4.480 1.00 0.00 O ATOM 0 H ASP A 41 -4.923 14.307 6.267 1.00 0.00 H new ATOM 0 HA ASP A 41 -5.133 11.594 5.208 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -3.288 12.470 7.427 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -3.029 11.251 6.194 1.00 0.00 H new ATOM 599 N VAL A 42 -6.972 11.300 7.058 1.00 0.00 N ATOM 600 CA VAL A 42 -7.799 10.722 8.109 1.00 0.00 C ATOM 601 C VAL A 42 -7.563 9.221 8.232 1.00 0.00 C ATOM 602 O VAL A 42 -7.650 8.484 7.249 1.00 0.00 O ATOM 603 CB VAL A 42 -9.296 10.974 7.849 1.00 0.00 C ATOM 604 CG1 VAL A 42 -9.604 12.463 7.900 1.00 0.00 C ATOM 605 CG2 VAL A 42 -9.710 10.382 6.508 1.00 0.00 C ATOM 0 H VAL A 42 -7.452 11.431 6.168 1.00 0.00 H new ATOM 0 HA VAL A 42 -7.512 11.210 9.040 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.871 10.481 8.633 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.666 12.621 7.714 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -9.346 12.855 8.884 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.021 12.981 7.139 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.771 10.569 6.340 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.129 10.845 5.711 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.527 9.307 6.513 1.00 0.00 H new ATOM 615 N THR A 43 -7.261 8.772 9.447 1.00 0.00 N ATOM 616 CA THR A 43 -7.011 7.360 9.699 1.00 0.00 C ATOM 617 C THR A 43 -8.297 6.631 10.073 1.00 0.00 C ATOM 618 O THR A 43 -8.929 6.945 11.081 1.00 0.00 O ATOM 619 CB THR A 43 -5.979 7.164 10.826 1.00 0.00 C ATOM 620 OG1 THR A 43 -4.855 8.026 10.616 1.00 0.00 O ATOM 621 CG2 THR A 43 -5.510 5.718 10.887 1.00 0.00 C ATOM 0 H THR A 43 -7.184 9.368 10.272 1.00 0.00 H new ATOM 0 HA THR A 43 -6.614 6.941 8.775 1.00 0.00 H new ATOM 0 HB THR A 43 -6.457 7.414 11.773 1.00 0.00 H new ATOM 0 HG1 THR A 43 -4.204 7.897 11.337 1.00 0.00 H new ATOM 0 HG21 THR A 43 -4.782 5.605 11.690 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.363 5.066 11.076 1.00 0.00 H new ATOM 0 HG23 THR A 43 -5.048 5.445 9.938 1.00 0.00 H new ATOM 629 N TRP A 44 -8.678 5.657 9.255 1.00 0.00 N ATOM 630 CA TRP A 44 -9.890 4.883 9.500 1.00 0.00 C ATOM 631 C TRP A 44 -9.549 3.474 9.972 1.00 0.00 C ATOM 632 O TRP A 44 -8.445 3.002 9.709 1.00 0.00 O ATOM 633 CB TRP A 44 -10.742 4.817 8.232 1.00 0.00 C ATOM 634 CG TRP A 44 -10.116 4.009 7.136 1.00 0.00 C ATOM 635 CD1 TRP A 44 -10.357 2.697 6.844 1.00 0.00 C ATOM 636 CD2 TRP A 44 -9.144 4.461 6.187 1.00 0.00 C ATOM 637 NE1 TRP A 44 -9.593 2.305 5.772 1.00 0.00 N ATOM 638 CE2 TRP A 44 -8.841 3.370 5.349 1.00 0.00 C ATOM 639 CE3 TRP A 44 -8.501 5.681 5.961 1.00 0.00 C ATOM 640 CZ2 TRP A 44 -7.923 3.465 4.307 1.00 0.00 C ATOM 641 CZ3 TRP A 44 -7.591 5.773 4.927 1.00 0.00 C ATOM 642 CH2 TRP A 44 -7.309 4.671 4.109 1.00 0.00 C ATOM 0 H TRP A 44 -8.166 5.384 8.416 1.00 0.00 H new ATOM 0 HA TRP A 44 -10.458 5.382 10.285 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -11.714 4.390 8.478 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -10.921 5.830 7.870 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -11.047 2.061 7.378 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -9.586 1.373 5.358 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -8.712 6.537 6.585 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -7.703 2.616 3.677 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -7.088 6.711 4.745 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -6.593 4.776 3.307 1.00 0.00 H new TER 653 TRP A 44 ATOM 654 N SER B 99 14.119 -16.604 5.425 1.00 0.00 N ATOM 655 CA SER B 99 13.996 -15.550 6.425 1.00 0.00 C ATOM 656 C SER B 99 13.872 -14.182 5.760 1.00 0.00 C ATOM 657 O SER B 99 14.386 -13.184 6.267 1.00 0.00 O ATOM 658 CB SER B 99 15.204 -15.565 7.365 1.00 0.00 C ATOM 659 OG SER B 99 16.347 -15.014 6.735 1.00 0.00 O ATOM 0 HA SER B 99 13.092 -15.737 7.004 1.00 0.00 H new ATOM 0 HB2 SER B 99 14.974 -14.999 8.267 1.00 0.00 H new ATOM 0 HB3 SER B 99 15.414 -16.588 7.676 1.00 0.00 H new ATOM 0 HG SER B 99 17.104 -15.034 7.356 1.00 0.00 H new ATOM 665 N HIS B 100 13.188 -14.144 4.621 1.00 0.00 N ATOM 666 CA HIS B 100 12.996 -12.900 3.886 1.00 0.00 C ATOM 667 C HIS B 100 11.892 -13.050 2.843 1.00 0.00 C ATOM 668 O HIS B 100 11.929 -13.958 2.013 1.00 0.00 O ATOM 669 CB HIS B 100 14.299 -12.476 3.209 1.00 0.00 C ATOM 670 CG HIS B 100 14.496 -10.991 3.166 1.00 0.00 C ATOM 671 ND1 HIS B 100 15.480 -10.342 3.879 1.00 0.00 N ATOM 672 CD2 HIS B 100 13.829 -10.029 2.486 1.00 0.00 C ATOM 673 CE1 HIS B 100 15.410 -9.043 3.642 1.00 0.00 C ATOM 674 NE2 HIS B 100 14.416 -8.828 2.799 1.00 0.00 N ATOM 0 H HIS B 100 12.758 -14.961 4.187 1.00 0.00 H new ATOM 0 HA HIS B 100 12.698 -12.129 4.597 1.00 0.00 H new ATOM 0 HB2 HIS B 100 15.138 -12.930 3.737 1.00 0.00 H new ATOM 0 HB3 HIS B 100 14.314 -12.866 2.191 1.00 0.00 H new ATOM 0 HD2 HIS B 100 12.991 -10.178 1.821 1.00 0.00 H new ATOM 0 HE1 HIS B 100 16.055 -8.287 4.065 1.00 0.00 H new ATOM 0 HE2 HIS B 100 14.131 -7.917 2.439 1.00 0.00 H new ATOM 682 N MET B 101 10.912 -12.154 2.893 1.00 0.00 N ATOM 683 CA MET B 101 9.799 -12.187 1.951 1.00 0.00 C ATOM 684 C MET B 101 9.919 -11.064 0.926 1.00 0.00 C ATOM 685 O MET B 101 10.786 -10.198 1.041 1.00 0.00 O ATOM 686 CB MET B 101 8.468 -12.070 2.697 1.00 0.00 C ATOM 687 CG MET B 101 8.237 -10.702 3.319 1.00 0.00 C ATOM 688 SD MET B 101 6.574 -10.515 3.987 1.00 0.00 S ATOM 689 CE MET B 101 6.371 -8.737 3.895 1.00 0.00 C ATOM 0 H MET B 101 10.866 -11.397 3.575 1.00 0.00 H new ATOM 0 HA MET B 101 9.831 -13.141 1.424 1.00 0.00 H new ATOM 0 HB2 MET B 101 7.654 -12.288 2.006 1.00 0.00 H new ATOM 0 HB3 MET B 101 8.433 -12.827 3.481 1.00 0.00 H new ATOM 0 HG2 MET B 101 8.964 -10.542 4.115 1.00 0.00 H new ATOM 0 HG3 MET B 101 8.411 -9.932 2.568 1.00 0.00 H new ATOM 0 HE1 MET B 101 5.509 -8.438 4.491 1.00 0.00 H new ATOM 0 HE2 MET B 101 7.266 -8.248 4.280 1.00 0.00 H new ATOM 0 HE3 MET B 101 6.214 -8.442 2.857 1.00 0.00 H new ATOM 699 N GLN B 102 9.046 -11.087 -0.077 1.00 0.00 N ATOM 700 CA GLN B 102 9.058 -10.072 -1.122 1.00 0.00 C ATOM 701 C GLN B 102 7.675 -9.453 -1.296 1.00 0.00 C ATOM 702 O GLN B 102 6.667 -10.038 -0.896 1.00 0.00 O ATOM 703 CB GLN B 102 9.528 -10.677 -2.446 1.00 0.00 C ATOM 704 CG GLN B 102 9.924 -9.640 -3.484 1.00 0.00 C ATOM 705 CD GLN B 102 10.576 -10.255 -4.706 1.00 0.00 C ATOM 706 OE1 GLN B 102 11.787 -10.479 -4.732 1.00 0.00 O ATOM 707 NE2 GLN B 102 9.774 -10.533 -5.727 1.00 0.00 N ATOM 0 H GLN B 102 8.322 -11.797 -0.187 1.00 0.00 H new ATOM 0 HA GLN B 102 9.753 -9.287 -0.822 1.00 0.00 H new ATOM 0 HB2 GLN B 102 10.379 -11.331 -2.255 1.00 0.00 H new ATOM 0 HB3 GLN B 102 8.732 -11.301 -2.853 1.00 0.00 H new ATOM 0 HG2 GLN B 102 9.039 -9.083 -3.791 1.00 0.00 H new ATOM 0 HG3 GLN B 102 10.611 -8.924 -3.033 1.00 0.00 H new ATOM 0 HE21 GLN B 102 8.776 -10.331 -5.662 1.00 0.00 H new ATOM 0 HE22 GLN B 102 10.155 -10.949 -6.577 1.00 0.00 H new ATOM 716 N ILE B 103 7.633 -8.266 -1.891 1.00 0.00 N ATOM 717 CA ILE B 103 6.373 -7.568 -2.117 1.00 0.00 C ATOM 718 C ILE B 103 6.384 -6.834 -3.453 1.00 0.00 C ATOM 719 O ILE B 103 7.441 -6.602 -4.039 1.00 0.00 O ATOM 720 CB ILE B 103 6.080 -6.559 -0.991 1.00 0.00 C ATOM 721 CG1 ILE B 103 7.207 -5.530 -0.891 1.00 0.00 C ATOM 722 CG2 ILE B 103 5.896 -7.283 0.334 1.00 0.00 C ATOM 723 CD1 ILE B 103 6.866 -4.344 -0.018 1.00 0.00 C ATOM 0 H ILE B 103 8.457 -7.767 -2.226 1.00 0.00 H new ATOM 0 HA ILE B 103 5.589 -8.325 -2.128 1.00 0.00 H new ATOM 0 HB ILE B 103 5.155 -6.033 -1.227 1.00 0.00 H new ATOM 0 HG12 ILE B 103 8.099 -6.017 -0.496 1.00 0.00 H new ATOM 0 HG13 ILE B 103 7.454 -5.175 -1.892 1.00 0.00 H new ATOM 0 HG21 ILE B 103 5.690 -6.557 1.120 1.00 0.00 H new ATOM 0 HG22 ILE B 103 5.061 -7.979 0.255 1.00 0.00 H new ATOM 0 HG23 ILE B 103 6.805 -7.833 0.578 1.00 0.00 H new ATOM 0 HD11 ILE B 103 7.711 -3.656 0.007 1.00 0.00 H new ATOM 0 HD12 ILE B 103 5.993 -3.833 -0.424 1.00 0.00 H new ATOM 0 HD13 ILE B 103 6.648 -4.687 0.993 1.00 0.00 H new ATOM 735 N PHE B 104 5.198 -6.468 -3.930 1.00 0.00 N ATOM 736 CA PHE B 104 5.071 -5.758 -5.197 1.00 0.00 C ATOM 737 C PHE B 104 4.259 -4.477 -5.023 1.00 0.00 C ATOM 738 O PHE B 104 3.092 -4.516 -4.632 1.00 0.00 O ATOM 739 CB PHE B 104 4.408 -6.656 -6.244 1.00 0.00 C ATOM 740 CG PHE B 104 5.183 -7.909 -6.534 1.00 0.00 C ATOM 741 CD1 PHE B 104 5.168 -8.971 -5.644 1.00 0.00 C ATOM 742 CD2 PHE B 104 5.929 -8.027 -7.696 1.00 0.00 C ATOM 743 CE1 PHE B 104 5.879 -10.126 -5.907 1.00 0.00 C ATOM 744 CE2 PHE B 104 6.642 -9.180 -7.965 1.00 0.00 C ATOM 745 CZ PHE B 104 6.618 -10.230 -7.069 1.00 0.00 C ATOM 0 H PHE B 104 4.312 -6.651 -3.458 1.00 0.00 H new ATOM 0 HA PHE B 104 6.071 -5.491 -5.538 1.00 0.00 H new ATOM 0 HB2 PHE B 104 3.410 -6.927 -5.900 1.00 0.00 H new ATOM 0 HB3 PHE B 104 4.284 -6.092 -7.169 1.00 0.00 H new ATOM 0 HD1 PHE B 104 4.593 -8.895 -4.733 1.00 0.00 H new ATOM 0 HD2 PHE B 104 5.953 -7.208 -8.400 1.00 0.00 H new ATOM 0 HE1 PHE B 104 5.857 -10.946 -5.205 1.00 0.00 H new ATOM 0 HE2 PHE B 104 7.217 -9.260 -8.875 1.00 0.00 H new ATOM 0 HZ PHE B 104 7.176 -11.131 -7.276 1.00 0.00 H new ATOM 755 N VAL B 105 4.885 -3.342 -5.316 1.00 0.00 N ATOM 756 CA VAL B 105 4.222 -2.049 -5.194 1.00 0.00 C ATOM 757 C VAL B 105 3.921 -1.454 -6.565 1.00 0.00 C ATOM 758 O VAL B 105 4.829 -1.185 -7.351 1.00 0.00 O ATOM 759 CB VAL B 105 5.080 -1.053 -4.391 1.00 0.00 C ATOM 760 CG1 VAL B 105 4.298 0.222 -4.112 1.00 0.00 C ATOM 761 CG2 VAL B 105 5.560 -1.687 -3.094 1.00 0.00 C ATOM 0 H VAL B 105 5.851 -3.291 -5.640 1.00 0.00 H new ATOM 0 HA VAL B 105 3.286 -2.222 -4.663 1.00 0.00 H new ATOM 0 HB VAL B 105 5.955 -0.792 -4.987 1.00 0.00 H new ATOM 0 HG11 VAL B 105 4.920 0.914 -3.544 1.00 0.00 H new ATOM 0 HG12 VAL B 105 4.009 0.685 -5.055 1.00 0.00 H new ATOM 0 HG13 VAL B 105 3.404 -0.018 -3.537 1.00 0.00 H new ATOM 0 HG21 VAL B 105 6.165 -0.969 -2.540 1.00 0.00 H new ATOM 0 HG22 VAL B 105 4.700 -1.979 -2.491 1.00 0.00 H new ATOM 0 HG23 VAL B 105 6.160 -2.568 -3.320 1.00 0.00 H new ATOM 771 N LYS B 106 2.638 -1.248 -6.845 1.00 0.00 N ATOM 772 CA LYS B 106 2.215 -0.683 -8.120 1.00 0.00 C ATOM 773 C LYS B 106 1.955 0.815 -7.992 1.00 0.00 C ATOM 774 O LYS B 106 1.191 1.252 -7.130 1.00 0.00 O ATOM 775 CB LYS B 106 0.953 -1.389 -8.620 1.00 0.00 C ATOM 776 CG LYS B 106 0.394 -0.800 -9.904 1.00 0.00 C ATOM 777 CD LYS B 106 -1.089 -0.493 -9.778 1.00 0.00 C ATOM 778 CE LYS B 106 -1.893 -1.162 -10.882 1.00 0.00 C ATOM 779 NZ LYS B 106 -3.097 -1.856 -10.349 1.00 0.00 N ATOM 0 H LYS B 106 1.873 -1.464 -6.205 1.00 0.00 H new ATOM 0 HA LYS B 106 3.019 -0.834 -8.841 1.00 0.00 H new ATOM 0 HB2 LYS B 106 1.177 -2.444 -8.781 1.00 0.00 H new ATOM 0 HB3 LYS B 106 0.188 -1.340 -7.845 1.00 0.00 H new ATOM 0 HG2 LYS B 106 0.935 0.113 -10.152 1.00 0.00 H new ATOM 0 HG3 LYS B 106 0.553 -1.499 -10.725 1.00 0.00 H new ATOM 0 HD2 LYS B 106 -1.450 -0.832 -8.807 1.00 0.00 H new ATOM 0 HD3 LYS B 106 -1.243 0.585 -9.817 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -2.199 -0.413 -11.613 1.00 0.00 H new ATOM 0 HE3 LYS B 106 -1.262 -1.880 -11.406 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 -3.494 -2.476 -11.083 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 -2.831 -2.426 -9.521 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 -3.809 -1.151 -10.070 1.00 0.00 H new ATOM 793 N THR B 107 2.594 1.598 -8.854 1.00 0.00 N ATOM 794 CA THR B 107 2.432 3.046 -8.838 1.00 0.00 C ATOM 795 C THR B 107 1.000 3.443 -9.179 1.00 0.00 C ATOM 796 O THR B 107 0.180 2.597 -9.538 1.00 0.00 O ATOM 797 CB THR B 107 3.392 3.731 -9.827 1.00 0.00 C ATOM 798 OG1 THR B 107 3.133 3.272 -11.159 1.00 0.00 O ATOM 799 CG2 THR B 107 4.841 3.447 -9.461 1.00 0.00 C ATOM 0 H THR B 107 3.230 1.253 -9.573 1.00 0.00 H new ATOM 0 HA THR B 107 2.668 3.378 -7.827 1.00 0.00 H new ATOM 0 HB THR B 107 3.225 4.807 -9.774 1.00 0.00 H new ATOM 0 HG1 THR B 107 2.423 2.597 -11.140 1.00 0.00 H new ATOM 0 HG21 THR B 107 5.500 3.942 -10.174 1.00 0.00 H new ATOM 0 HG22 THR B 107 5.044 3.824 -8.458 1.00 0.00 H new ATOM 0 HG23 THR B 107 5.019 2.372 -9.488 1.00 0.00 H new ATOM 807 N LEU B 108 0.705 4.734 -9.067 1.00 0.00 N ATOM 808 CA LEU B 108 -0.628 5.243 -9.365 1.00 0.00 C ATOM 809 C LEU B 108 -0.826 5.405 -10.869 1.00 0.00 C ATOM 810 O LEU B 108 -1.898 5.802 -11.327 1.00 0.00 O ATOM 811 CB LEU B 108 -0.852 6.583 -8.663 1.00 0.00 C ATOM 812 CG LEU B 108 -2.274 6.853 -8.169 1.00 0.00 C ATOM 813 CD1 LEU B 108 -2.545 6.091 -6.881 1.00 0.00 C ATOM 814 CD2 LEU B 108 -2.495 8.345 -7.965 1.00 0.00 C ATOM 0 H LEU B 108 1.372 5.447 -8.772 1.00 0.00 H new ATOM 0 HA LEU B 108 -1.356 4.520 -8.997 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -0.176 6.641 -7.810 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -0.569 7.381 -9.349 1.00 0.00 H new ATOM 0 HG LEU B 108 -2.974 6.504 -8.928 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -3.561 6.295 -6.544 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -2.430 5.022 -7.060 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -1.838 6.409 -6.115 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -3.512 8.517 -7.613 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -1.787 8.720 -7.226 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -2.344 8.868 -8.910 1.00 0.00 H new ATOM 826 N THR B 109 0.216 5.092 -11.634 1.00 0.00 N ATOM 827 CA THR B 109 0.157 5.201 -13.087 1.00 0.00 C ATOM 828 C THR B 109 0.058 3.826 -13.738 1.00 0.00 C ATOM 829 O THR B 109 -0.238 3.712 -14.926 1.00 0.00 O ATOM 830 CB THR B 109 1.391 5.934 -13.645 1.00 0.00 C ATOM 831 OG1 THR B 109 1.443 5.791 -15.069 1.00 0.00 O ATOM 832 CG2 THR B 109 2.669 5.387 -13.029 1.00 0.00 C ATOM 0 H THR B 109 1.110 4.761 -11.272 1.00 0.00 H new ATOM 0 HA THR B 109 -0.737 5.777 -13.325 1.00 0.00 H new ATOM 0 HB THR B 109 1.306 6.990 -13.389 1.00 0.00 H new ATOM 0 HG1 THR B 109 0.691 5.240 -15.370 1.00 0.00 H new ATOM 0 HG21 THR B 109 3.527 5.920 -13.438 1.00 0.00 H new ATOM 0 HG22 THR B 109 2.639 5.523 -11.948 1.00 0.00 H new ATOM 0 HG23 THR B 109 2.758 4.325 -13.259 1.00 0.00 H new ATOM 840 N GLY B 110 0.307 2.784 -12.950 1.00 0.00 N ATOM 841 CA GLY B 110 0.240 1.430 -13.469 1.00 0.00 C ATOM 842 C GLY B 110 1.556 0.691 -13.330 1.00 0.00 C ATOM 843 O GLY B 110 1.583 -0.538 -13.272 1.00 0.00 O ATOM 0 H GLY B 110 0.554 2.853 -11.963 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -0.540 0.880 -12.942 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -0.047 1.461 -14.520 1.00 0.00 H new ATOM 847 N LYS B 111 2.651 1.441 -13.280 1.00 0.00 N ATOM 848 CA LYS B 111 3.978 0.851 -13.148 1.00 0.00 C ATOM 849 C LYS B 111 4.007 -0.178 -12.022 1.00 0.00 C ATOM 850 O LYS B 111 3.429 0.037 -10.956 1.00 0.00 O ATOM 851 CB LYS B 111 5.020 1.940 -12.885 1.00 0.00 C ATOM 852 CG LYS B 111 6.435 1.531 -13.258 1.00 0.00 C ATOM 853 CD LYS B 111 7.446 2.590 -12.849 1.00 0.00 C ATOM 854 CE LYS B 111 8.601 2.667 -13.836 1.00 0.00 C ATOM 855 NZ LYS B 111 8.291 3.563 -14.984 1.00 0.00 N ATOM 0 H LYS B 111 2.646 2.460 -13.329 1.00 0.00 H new ATOM 0 HA LYS B 111 4.218 0.346 -14.084 1.00 0.00 H new ATOM 0 HB2 LYS B 111 4.749 2.834 -13.447 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.995 2.208 -11.829 1.00 0.00 H new ATOM 0 HG2 LYS B 111 6.681 0.585 -12.775 1.00 0.00 H new ATOM 0 HG3 LYS B 111 6.495 1.365 -14.334 1.00 0.00 H new ATOM 0 HD2 LYS B 111 6.953 3.560 -12.787 1.00 0.00 H new ATOM 0 HD3 LYS B 111 7.830 2.363 -11.854 1.00 0.00 H new ATOM 0 HE2 LYS B 111 9.493 3.028 -13.324 1.00 0.00 H new ATOM 0 HE3 LYS B 111 8.829 1.668 -14.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 9.103 3.588 -15.634 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 7.455 3.204 -15.488 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 8.098 4.523 -14.633 1.00 0.00 H new ATOM 869 N THR B 112 4.683 -1.296 -12.266 1.00 0.00 N ATOM 870 CA THR B 112 4.788 -2.358 -11.273 1.00 0.00 C ATOM 871 C THR B 112 6.197 -2.438 -10.698 1.00 0.00 C ATOM 872 O THR B 112 7.162 -2.668 -11.429 1.00 0.00 O ATOM 873 CB THR B 112 4.410 -3.726 -11.870 1.00 0.00 C ATOM 874 OG1 THR B 112 3.081 -3.679 -12.399 1.00 0.00 O ATOM 875 CG2 THR B 112 4.505 -4.821 -10.819 1.00 0.00 C ATOM 0 H THR B 112 5.166 -1.490 -13.143 1.00 0.00 H new ATOM 0 HA THR B 112 4.087 -2.113 -10.475 1.00 0.00 H new ATOM 0 HB THR B 112 5.112 -3.954 -12.672 1.00 0.00 H new ATOM 0 HG1 THR B 112 2.849 -4.552 -12.778 1.00 0.00 H new ATOM 0 HG21 THR B 112 4.233 -5.778 -11.265 1.00 0.00 H new ATOM 0 HG22 THR B 112 5.526 -4.874 -10.440 1.00 0.00 H new ATOM 0 HG23 THR B 112 3.824 -4.597 -9.998 1.00 0.00 H new ATOM 883 N ILE B 113 6.310 -2.248 -9.389 1.00 0.00 N ATOM 884 CA ILE B 113 7.603 -2.300 -8.718 1.00 0.00 C ATOM 885 C ILE B 113 7.723 -3.551 -7.852 1.00 0.00 C ATOM 886 O ILE B 113 6.755 -3.977 -7.221 1.00 0.00 O ATOM 887 CB ILE B 113 7.833 -1.057 -7.839 1.00 0.00 C ATOM 888 CG1 ILE B 113 7.657 0.219 -8.665 1.00 0.00 C ATOM 889 CG2 ILE B 113 9.217 -1.101 -7.210 1.00 0.00 C ATOM 890 CD1 ILE B 113 7.674 1.483 -7.837 1.00 0.00 C ATOM 0 H ILE B 113 5.522 -2.056 -8.771 1.00 0.00 H new ATOM 0 HA ILE B 113 8.363 -2.327 -9.499 1.00 0.00 H new ATOM 0 HB ILE B 113 7.092 -1.054 -7.039 1.00 0.00 H new ATOM 0 HG12 ILE B 113 8.451 0.272 -9.410 1.00 0.00 H new ATOM 0 HG13 ILE B 113 6.714 0.163 -9.208 1.00 0.00 H new ATOM 0 HG21 ILE B 113 9.364 -0.215 -6.592 1.00 0.00 H new ATOM 0 HG22 ILE B 113 9.307 -1.994 -6.592 1.00 0.00 H new ATOM 0 HG23 ILE B 113 9.973 -1.125 -7.995 1.00 0.00 H new ATOM 0 HD11 ILE B 113 7.544 2.347 -8.489 1.00 0.00 H new ATOM 0 HD12 ILE B 113 6.863 1.452 -7.109 1.00 0.00 H new ATOM 0 HD13 ILE B 113 8.627 1.563 -7.315 1.00 0.00 H new ATOM 902 N THR B 114 8.918 -4.133 -7.825 1.00 0.00 N ATOM 903 CA THR B 114 9.165 -5.333 -7.037 1.00 0.00 C ATOM 904 C THR B 114 10.380 -5.157 -6.134 1.00 0.00 C ATOM 905 O THR B 114 11.469 -4.816 -6.599 1.00 0.00 O ATOM 906 CB THR B 114 9.385 -6.563 -7.939 1.00 0.00 C ATOM 907 OG1 THR B 114 8.339 -6.647 -8.914 1.00 0.00 O ATOM 908 CG2 THR B 114 9.419 -7.840 -7.113 1.00 0.00 C ATOM 0 H THR B 114 9.730 -3.792 -8.340 1.00 0.00 H new ATOM 0 HA THR B 114 8.279 -5.495 -6.423 1.00 0.00 H new ATOM 0 HB THR B 114 10.344 -6.450 -8.444 1.00 0.00 H new ATOM 0 HG1 THR B 114 7.721 -7.367 -8.670 1.00 0.00 H new ATOM 0 HG21 THR B 114 9.575 -8.695 -7.771 1.00 0.00 H new ATOM 0 HG22 THR B 114 10.233 -7.784 -6.391 1.00 0.00 H new ATOM 0 HG23 THR B 114 8.473 -7.957 -6.585 1.00 0.00 H new ATOM 916 N LEU B 115 10.189 -5.392 -4.840 1.00 0.00 N ATOM 917 CA LEU B 115 11.271 -5.259 -3.870 1.00 0.00 C ATOM 918 C LEU B 115 11.115 -6.270 -2.739 1.00 0.00 C ATOM 919 O LEU B 115 10.023 -6.788 -2.503 1.00 0.00 O ATOM 920 CB LEU B 115 11.302 -3.840 -3.301 1.00 0.00 C ATOM 921 CG LEU B 115 12.123 -2.819 -4.088 1.00 0.00 C ATOM 922 CD1 LEU B 115 11.801 -1.406 -3.628 1.00 0.00 C ATOM 923 CD2 LEU B 115 13.611 -3.103 -3.941 1.00 0.00 C ATOM 0 H LEU B 115 9.295 -5.675 -4.438 1.00 0.00 H new ATOM 0 HA LEU B 115 12.212 -5.458 -4.383 1.00 0.00 H new ATOM 0 HB2 LEU B 115 10.277 -3.476 -3.231 1.00 0.00 H new ATOM 0 HB3 LEU B 115 11.694 -3.886 -2.285 1.00 0.00 H new ATOM 0 HG LEU B 115 11.859 -2.905 -5.142 1.00 0.00 H new ATOM 0 HD11 LEU B 115 12.395 -0.693 -4.200 1.00 0.00 H new ATOM 0 HD12 LEU B 115 10.741 -1.205 -3.786 1.00 0.00 H new ATOM 0 HD13 LEU B 115 12.035 -1.306 -2.568 1.00 0.00 H new ATOM 0 HD21 LEU B 115 14.180 -2.366 -4.508 1.00 0.00 H new ATOM 0 HD22 LEU B 115 13.890 -3.046 -2.889 1.00 0.00 H new ATOM 0 HD23 LEU B 115 13.830 -4.101 -4.321 1.00 0.00 H new ATOM 935 N GLU B 116 12.212 -6.544 -2.041 1.00 0.00 N ATOM 936 CA GLU B 116 12.195 -7.492 -0.933 1.00 0.00 C ATOM 937 C GLU B 116 12.046 -6.766 0.402 1.00 0.00 C ATOM 938 O GLU B 116 12.630 -5.703 0.611 1.00 0.00 O ATOM 939 CB GLU B 116 13.476 -8.330 -0.930 1.00 0.00 C ATOM 940 CG GLU B 116 13.864 -8.851 -2.303 1.00 0.00 C ATOM 941 CD GLU B 116 15.136 -9.676 -2.275 1.00 0.00 C ATOM 942 OE1 GLU B 116 15.220 -10.608 -1.447 1.00 0.00 O ATOM 943 OE2 GLU B 116 16.048 -9.391 -3.080 1.00 0.00 O ATOM 0 H GLU B 116 13.123 -6.123 -2.223 1.00 0.00 H new ATOM 0 HA GLU B 116 11.338 -8.152 -1.066 1.00 0.00 H new ATOM 0 HB2 GLU B 116 14.294 -7.727 -0.535 1.00 0.00 H new ATOM 0 HB3 GLU B 116 13.346 -9.175 -0.253 1.00 0.00 H new ATOM 0 HG2 GLU B 116 13.050 -9.458 -2.701 1.00 0.00 H new ATOM 0 HG3 GLU B 116 13.996 -8.009 -2.983 1.00 0.00 H new ATOM 950 N VAL B 117 11.260 -7.349 1.300 1.00 0.00 N ATOM 951 CA VAL B 117 11.033 -6.760 2.615 1.00 0.00 C ATOM 952 C VAL B 117 10.904 -7.838 3.685 1.00 0.00 C ATOM 953 O VAL B 117 10.566 -8.982 3.389 1.00 0.00 O ATOM 954 CB VAL B 117 9.765 -5.885 2.626 1.00 0.00 C ATOM 955 CG1 VAL B 117 9.897 -4.740 1.635 1.00 0.00 C ATOM 956 CG2 VAL B 117 8.535 -6.727 2.322 1.00 0.00 C ATOM 0 H VAL B 117 10.769 -8.229 1.142 1.00 0.00 H new ATOM 0 HA VAL B 117 11.898 -6.135 2.836 1.00 0.00 H new ATOM 0 HB VAL B 117 9.647 -5.458 3.622 1.00 0.00 H new ATOM 0 HG11 VAL B 117 8.992 -4.133 1.657 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.754 -4.123 1.904 1.00 0.00 H new ATOM 0 HG13 VAL B 117 10.040 -5.142 0.632 1.00 0.00 H new ATOM 0 HG21 VAL B 117 7.648 -6.093 2.334 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.641 -7.184 1.338 1.00 0.00 H new ATOM 0 HG23 VAL B 117 8.433 -7.508 3.076 1.00 0.00 H new ATOM 966 N GLU B 118 11.176 -7.462 4.931 1.00 0.00 N ATOM 967 CA GLU B 118 11.091 -8.397 6.046 1.00 0.00 C ATOM 968 C GLU B 118 9.827 -8.154 6.865 1.00 0.00 C ATOM 969 O GLU B 118 9.204 -7.094 6.792 1.00 0.00 O ATOM 970 CB GLU B 118 12.325 -8.271 6.943 1.00 0.00 C ATOM 971 CG GLU B 118 13.438 -9.241 6.587 1.00 0.00 C ATOM 972 CD GLU B 118 14.731 -8.940 7.319 1.00 0.00 C ATOM 973 OE1 GLU B 118 15.268 -7.826 7.143 1.00 0.00 O ATOM 974 OE2 GLU B 118 15.206 -9.818 8.069 1.00 0.00 O ATOM 0 H GLU B 118 11.457 -6.517 5.193 1.00 0.00 H new ATOM 0 HA GLU B 118 11.050 -9.406 5.637 1.00 0.00 H new ATOM 0 HB2 GLU B 118 12.708 -7.252 6.879 1.00 0.00 H new ATOM 0 HB3 GLU B 118 12.029 -8.435 7.979 1.00 0.00 H new ATOM 0 HG2 GLU B 118 13.119 -10.256 6.823 1.00 0.00 H new ATOM 0 HG3 GLU B 118 13.616 -9.205 5.512 1.00 0.00 H new ATOM 981 N PRO B 119 9.437 -9.158 7.664 1.00 0.00 N ATOM 982 CA PRO B 119 8.244 -9.078 8.512 1.00 0.00 C ATOM 983 C PRO B 119 8.418 -8.097 9.667 1.00 0.00 C ATOM 984 O PRO B 119 7.442 -7.566 10.195 1.00 0.00 O ATOM 985 CB PRO B 119 8.089 -10.506 9.042 1.00 0.00 C ATOM 986 CG PRO B 119 9.463 -11.079 8.992 1.00 0.00 C ATOM 987 CD PRO B 119 10.131 -10.450 7.801 1.00 0.00 C ATOM 0 HA PRO B 119 7.376 -8.717 7.961 1.00 0.00 H new ATOM 0 HB2 PRO B 119 7.695 -10.511 10.058 1.00 0.00 H new ATOM 0 HB3 PRO B 119 7.397 -11.083 8.429 1.00 0.00 H new ATOM 0 HG2 PRO B 119 10.011 -10.859 9.908 1.00 0.00 H new ATOM 0 HG3 PRO B 119 9.430 -12.164 8.893 1.00 0.00 H new ATOM 0 HD2 PRO B 119 11.200 -10.316 7.964 1.00 0.00 H new ATOM 0 HD3 PRO B 119 10.019 -11.063 6.907 1.00 0.00 H new ATOM 995 N SER B 120 9.668 -7.861 10.052 1.00 0.00 N ATOM 996 CA SER B 120 9.970 -6.946 11.148 1.00 0.00 C ATOM 997 C SER B 120 10.170 -5.525 10.629 1.00 0.00 C ATOM 998 O SER B 120 10.210 -4.570 11.404 1.00 0.00 O ATOM 999 CB SER B 120 11.221 -7.409 11.896 1.00 0.00 C ATOM 1000 OG SER B 120 12.391 -7.171 11.133 1.00 0.00 O ATOM 0 H SER B 120 10.488 -8.290 9.622 1.00 0.00 H new ATOM 0 HA SER B 120 9.124 -6.948 11.835 1.00 0.00 H new ATOM 0 HB2 SER B 120 11.293 -6.886 12.849 1.00 0.00 H new ATOM 0 HB3 SER B 120 11.141 -8.472 12.121 1.00 0.00 H new ATOM 0 HG SER B 120 13.176 -7.474 11.635 1.00 0.00 H new ATOM 1006 N ASP B 121 10.296 -5.395 9.312 1.00 0.00 N ATOM 1007 CA ASP B 121 10.490 -4.092 8.688 1.00 0.00 C ATOM 1008 C ASP B 121 9.301 -3.176 8.960 1.00 0.00 C ATOM 1009 O ASP B 121 8.396 -3.523 9.720 1.00 0.00 O ATOM 1010 CB ASP B 121 10.693 -4.250 7.181 1.00 0.00 C ATOM 1011 CG ASP B 121 12.039 -4.860 6.839 1.00 0.00 C ATOM 1012 OD1 ASP B 121 12.813 -5.152 7.773 1.00 0.00 O ATOM 1013 OD2 ASP B 121 12.316 -5.047 5.636 1.00 0.00 O ATOM 0 H ASP B 121 10.267 -6.176 8.657 1.00 0.00 H new ATOM 0 HA ASP B 121 11.381 -3.639 9.122 1.00 0.00 H new ATOM 0 HB2 ASP B 121 9.899 -4.877 6.774 1.00 0.00 H new ATOM 0 HB3 ASP B 121 10.607 -3.275 6.701 1.00 0.00 H new ATOM 1018 N THR B 122 9.311 -2.002 8.337 1.00 0.00 N ATOM 1019 CA THR B 122 8.235 -1.035 8.513 1.00 0.00 C ATOM 1020 C THR B 122 7.838 -0.404 7.184 1.00 0.00 C ATOM 1021 O THR B 122 8.589 -0.465 6.209 1.00 0.00 O ATOM 1022 CB THR B 122 8.639 0.080 9.496 1.00 0.00 C ATOM 1023 OG1 THR B 122 9.891 0.652 9.102 1.00 0.00 O ATOM 1024 CG2 THR B 122 8.746 -0.459 10.914 1.00 0.00 C ATOM 0 H THR B 122 10.052 -1.698 7.706 1.00 0.00 H new ATOM 0 HA THR B 122 7.384 -1.580 8.921 1.00 0.00 H new ATOM 0 HB THR B 122 7.866 0.848 9.474 1.00 0.00 H new ATOM 0 HG1 THR B 122 10.217 1.245 9.811 1.00 0.00 H new ATOM 0 HG21 THR B 122 9.032 0.347 11.589 1.00 0.00 H new ATOM 0 HG22 THR B 122 7.783 -0.865 11.222 1.00 0.00 H new ATOM 0 HG23 THR B 122 9.500 -1.246 10.948 1.00 0.00 H new ATOM 1032 N ILE B 123 6.655 0.200 7.150 1.00 0.00 N ATOM 1033 CA ILE B 123 6.161 0.843 5.938 1.00 0.00 C ATOM 1034 C ILE B 123 7.157 1.872 5.416 1.00 0.00 C ATOM 1035 O ILE B 123 7.299 2.055 4.208 1.00 0.00 O ATOM 1036 CB ILE B 123 4.806 1.533 6.181 1.00 0.00 C ATOM 1037 CG1 ILE B 123 3.799 0.539 6.764 1.00 0.00 C ATOM 1038 CG2 ILE B 123 4.278 2.132 4.886 1.00 0.00 C ATOM 1039 CD1 ILE B 123 3.616 -0.702 5.917 1.00 0.00 C ATOM 0 H ILE B 123 6.021 0.258 7.947 1.00 0.00 H new ATOM 0 HA ILE B 123 6.032 0.057 5.194 1.00 0.00 H new ATOM 0 HB ILE B 123 4.949 2.339 6.900 1.00 0.00 H new ATOM 0 HG12 ILE B 123 4.127 0.244 7.761 1.00 0.00 H new ATOM 0 HG13 ILE B 123 2.836 1.036 6.880 1.00 0.00 H new ATOM 0 HG21 ILE B 123 3.320 2.616 5.073 1.00 0.00 H new ATOM 0 HG22 ILE B 123 4.989 2.867 4.509 1.00 0.00 H new ATOM 0 HG23 ILE B 123 4.147 1.342 4.147 1.00 0.00 H new ATOM 0 HD11 ILE B 123 2.889 -1.362 6.390 1.00 0.00 H new ATOM 0 HD12 ILE B 123 3.258 -0.418 4.928 1.00 0.00 H new ATOM 0 HD13 ILE B 123 4.569 -1.222 5.822 1.00 0.00 H new ATOM 1051 N GLU B 124 7.846 2.541 6.336 1.00 0.00 N ATOM 1052 CA GLU B 124 8.830 3.552 5.967 1.00 0.00 C ATOM 1053 C GLU B 124 10.081 2.905 5.381 1.00 0.00 C ATOM 1054 O GLU B 124 10.855 3.552 4.677 1.00 0.00 O ATOM 1055 CB GLU B 124 9.204 4.399 7.185 1.00 0.00 C ATOM 1056 CG GLU B 124 9.967 3.631 8.250 1.00 0.00 C ATOM 1057 CD GLU B 124 10.531 4.534 9.330 1.00 0.00 C ATOM 1058 OE1 GLU B 124 9.785 5.407 9.821 1.00 0.00 O ATOM 1059 OE2 GLU B 124 11.716 4.367 9.684 1.00 0.00 O ATOM 0 H GLU B 124 7.741 2.401 7.341 1.00 0.00 H new ATOM 0 HA GLU B 124 8.385 4.196 5.208 1.00 0.00 H new ATOM 0 HB2 GLU B 124 9.808 5.245 6.857 1.00 0.00 H new ATOM 0 HB3 GLU B 124 8.295 4.808 7.625 1.00 0.00 H new ATOM 0 HG2 GLU B 124 9.305 2.895 8.706 1.00 0.00 H new ATOM 0 HG3 GLU B 124 10.782 3.079 7.781 1.00 0.00 H new ATOM 1066 N ASN B 125 10.272 1.624 5.676 1.00 0.00 N ATOM 1067 CA ASN B 125 11.428 0.888 5.179 1.00 0.00 C ATOM 1068 C ASN B 125 11.255 0.532 3.706 1.00 0.00 C ATOM 1069 O ASN B 125 12.122 0.821 2.881 1.00 0.00 O ATOM 1070 CB ASN B 125 11.642 -0.385 6.001 1.00 0.00 C ATOM 1071 CG ASN B 125 13.092 -0.825 6.020 1.00 0.00 C ATOM 1072 OD1 ASN B 125 13.772 -0.720 7.041 1.00 0.00 O ATOM 1073 ND2 ASN B 125 13.574 -1.322 4.886 1.00 0.00 N ATOM 0 H ASN B 125 9.640 1.073 6.258 1.00 0.00 H new ATOM 0 HA ASN B 125 12.304 1.529 5.279 1.00 0.00 H new ATOM 0 HB2 ASN B 125 11.304 -0.215 7.023 1.00 0.00 H new ATOM 0 HB3 ASN B 125 11.028 -1.186 5.591 1.00 0.00 H new ATOM 0 HD21 ASN B 125 14.544 -1.635 4.838 1.00 0.00 H new ATOM 0 HD22 ASN B 125 12.974 -1.391 4.064 1.00 0.00 H new ATOM 1080 N VAL B 126 10.130 -0.097 3.384 1.00 0.00 N ATOM 1081 CA VAL B 126 9.842 -0.491 2.010 1.00 0.00 C ATOM 1082 C VAL B 126 9.881 0.711 1.073 1.00 0.00 C ATOM 1083 O VAL B 126 10.179 0.578 -0.114 1.00 0.00 O ATOM 1084 CB VAL B 126 8.463 -1.170 1.898 1.00 0.00 C ATOM 1085 CG1 VAL B 126 8.293 -2.216 2.989 1.00 0.00 C ATOM 1086 CG2 VAL B 126 7.352 -0.134 1.965 1.00 0.00 C ATOM 0 H VAL B 126 9.403 -0.345 4.055 1.00 0.00 H new ATOM 0 HA VAL B 126 10.614 -1.202 1.717 1.00 0.00 H new ATOM 0 HB VAL B 126 8.402 -1.673 0.933 1.00 0.00 H new ATOM 0 HG11 VAL B 126 7.314 -2.685 2.894 1.00 0.00 H new ATOM 0 HG12 VAL B 126 9.070 -2.974 2.890 1.00 0.00 H new ATOM 0 HG13 VAL B 126 8.374 -1.739 3.966 1.00 0.00 H new ATOM 0 HG21 VAL B 126 6.385 -0.631 1.884 1.00 0.00 H new ATOM 0 HG22 VAL B 126 7.408 0.399 2.914 1.00 0.00 H new ATOM 0 HG23 VAL B 126 7.465 0.574 1.144 1.00 0.00 H new ATOM 1096 N LYS B 127 9.579 1.886 1.615 1.00 0.00 N ATOM 1097 CA LYS B 127 9.582 3.114 0.829 1.00 0.00 C ATOM 1098 C LYS B 127 11.004 3.626 0.624 1.00 0.00 C ATOM 1099 O LYS B 127 11.304 4.267 -0.383 1.00 0.00 O ATOM 1100 CB LYS B 127 8.737 4.188 1.520 1.00 0.00 C ATOM 1101 CG LYS B 127 7.336 3.722 1.878 1.00 0.00 C ATOM 1102 CD LYS B 127 6.332 4.095 0.799 1.00 0.00 C ATOM 1103 CE LYS B 127 5.165 3.121 0.764 1.00 0.00 C ATOM 1104 NZ LYS B 127 4.669 2.900 -0.623 1.00 0.00 N ATOM 0 H LYS B 127 9.329 2.014 2.596 1.00 0.00 H new ATOM 0 HA LYS B 127 9.150 2.892 -0.147 1.00 0.00 H new ATOM 0 HB2 LYS B 127 9.247 4.511 2.428 1.00 0.00 H new ATOM 0 HB3 LYS B 127 8.666 5.058 0.867 1.00 0.00 H new ATOM 0 HG2 LYS B 127 7.336 2.641 2.019 1.00 0.00 H new ATOM 0 HG3 LYS B 127 7.035 4.167 2.826 1.00 0.00 H new ATOM 0 HD2 LYS B 127 5.960 5.104 0.979 1.00 0.00 H new ATOM 0 HD3 LYS B 127 6.827 4.107 -0.172 1.00 0.00 H new ATOM 0 HE2 LYS B 127 5.474 2.169 1.196 1.00 0.00 H new ATOM 0 HE3 LYS B 127 4.354 3.504 1.383 1.00 0.00 H new ATOM 0 HZ1 LYS B 127 3.633 2.804 -0.610 1.00 0.00 H new ATOM 0 HZ2 LYS B 127 4.935 3.709 -1.220 1.00 0.00 H new ATOM 0 HZ3 LYS B 127 5.092 2.032 -1.009 1.00 0.00 H new ATOM 1118 N ALA B 128 11.876 3.339 1.584 1.00 0.00 N ATOM 1119 CA ALA B 128 13.267 3.767 1.507 1.00 0.00 C ATOM 1120 C ALA B 128 13.940 3.219 0.253 1.00 0.00 C ATOM 1121 O ALA B 128 14.547 3.965 -0.515 1.00 0.00 O ATOM 1122 CB ALA B 128 14.025 3.327 2.751 1.00 0.00 C ATOM 0 H ALA B 128 11.644 2.811 2.425 1.00 0.00 H new ATOM 0 HA ALA B 128 13.284 4.855 1.451 1.00 0.00 H new ATOM 0 HB1 ALA B 128 15.062 3.654 2.679 1.00 0.00 H new ATOM 0 HB2 ALA B 128 13.565 3.771 3.634 1.00 0.00 H new ATOM 0 HB3 ALA B 128 13.991 2.241 2.832 1.00 0.00 H new ATOM 1128 N LYS B 129 13.832 1.910 0.052 1.00 0.00 N ATOM 1129 CA LYS B 129 14.429 1.261 -1.108 1.00 0.00 C ATOM 1130 C LYS B 129 13.682 1.633 -2.385 1.00 0.00 C ATOM 1131 O LYS B 129 14.293 1.851 -3.431 1.00 0.00 O ATOM 1132 CB LYS B 129 14.426 -0.259 -0.927 1.00 0.00 C ATOM 1133 CG LYS B 129 13.124 -0.801 -0.362 1.00 0.00 C ATOM 1134 CD LYS B 129 13.323 -1.403 1.019 1.00 0.00 C ATOM 1135 CE LYS B 129 13.303 -2.922 0.973 1.00 0.00 C ATOM 1136 NZ LYS B 129 14.350 -3.518 1.848 1.00 0.00 N ATOM 0 H LYS B 129 13.335 1.277 0.679 1.00 0.00 H new ATOM 0 HA LYS B 129 15.459 1.608 -1.196 1.00 0.00 H new ATOM 0 HB2 LYS B 129 14.619 -0.732 -1.890 1.00 0.00 H new ATOM 0 HB3 LYS B 129 15.245 -0.539 -0.264 1.00 0.00 H new ATOM 0 HG2 LYS B 129 12.388 0.001 -0.308 1.00 0.00 H new ATOM 0 HG3 LYS B 129 12.721 -1.558 -1.035 1.00 0.00 H new ATOM 0 HD2 LYS B 129 14.273 -1.063 1.432 1.00 0.00 H new ATOM 0 HD3 LYS B 129 12.539 -1.048 1.688 1.00 0.00 H new ATOM 0 HE2 LYS B 129 12.322 -3.282 1.284 1.00 0.00 H new ATOM 0 HE3 LYS B 129 13.454 -3.256 -0.053 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 14.260 -4.554 1.841 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 15.291 -3.250 1.495 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 14.232 -3.167 2.820 1.00 0.00 H new ATOM 1150 N ILE B 130 12.358 1.703 -2.291 1.00 0.00 N ATOM 1151 CA ILE B 130 11.529 2.052 -3.437 1.00 0.00 C ATOM 1152 C ILE B 130 11.966 3.379 -4.049 1.00 0.00 C ATOM 1153 O ILE B 130 11.841 3.587 -5.256 1.00 0.00 O ATOM 1154 CB ILE B 130 10.041 2.143 -3.050 1.00 0.00 C ATOM 1155 CG1 ILE B 130 9.446 0.742 -2.890 1.00 0.00 C ATOM 1156 CG2 ILE B 130 9.270 2.936 -4.093 1.00 0.00 C ATOM 1157 CD1 ILE B 130 8.130 0.726 -2.147 1.00 0.00 C ATOM 0 H ILE B 130 11.837 1.523 -1.433 1.00 0.00 H new ATOM 0 HA ILE B 130 11.657 1.257 -4.171 1.00 0.00 H new ATOM 0 HB ILE B 130 9.961 2.662 -2.095 1.00 0.00 H new ATOM 0 HG12 ILE B 130 9.302 0.302 -3.877 1.00 0.00 H new ATOM 0 HG13 ILE B 130 10.160 0.111 -2.361 1.00 0.00 H new ATOM 0 HG21 ILE B 130 8.220 2.991 -3.805 1.00 0.00 H new ATOM 0 HG22 ILE B 130 9.681 3.943 -4.161 1.00 0.00 H new ATOM 0 HG23 ILE B 130 9.355 2.443 -5.061 1.00 0.00 H new ATOM 0 HD11 ILE B 130 7.767 -0.299 -2.071 1.00 0.00 H new ATOM 0 HD12 ILE B 130 8.272 1.136 -1.147 1.00 0.00 H new ATOM 0 HD13 ILE B 130 7.400 1.330 -2.686 1.00 0.00 H new ATOM 1169 N GLN B 131 12.478 4.272 -3.208 1.00 0.00 N ATOM 1170 CA GLN B 131 12.934 5.578 -3.667 1.00 0.00 C ATOM 1171 C GLN B 131 14.002 5.433 -4.746 1.00 0.00 C ATOM 1172 O GLN B 131 13.982 6.143 -5.752 1.00 0.00 O ATOM 1173 CB GLN B 131 13.486 6.390 -2.493 1.00 0.00 C ATOM 1174 CG GLN B 131 14.351 7.565 -2.919 1.00 0.00 C ATOM 1175 CD GLN B 131 14.263 8.733 -1.958 1.00 0.00 C ATOM 1176 OE1 GLN B 131 14.507 8.585 -0.760 1.00 0.00 O ATOM 1177 NE2 GLN B 131 13.915 9.904 -2.479 1.00 0.00 N ATOM 0 H GLN B 131 12.587 4.115 -2.206 1.00 0.00 H new ATOM 0 HA GLN B 131 12.080 6.104 -4.094 1.00 0.00 H new ATOM 0 HB2 GLN B 131 12.653 6.761 -1.895 1.00 0.00 H new ATOM 0 HB3 GLN B 131 14.072 5.732 -1.851 1.00 0.00 H new ATOM 0 HG2 GLN B 131 15.388 7.239 -2.994 1.00 0.00 H new ATOM 0 HG3 GLN B 131 14.047 7.894 -3.913 1.00 0.00 H new ATOM 0 HE21 GLN B 131 13.722 9.981 -3.478 1.00 0.00 H new ATOM 0 HE22 GLN B 131 13.841 10.727 -1.881 1.00 0.00 H new ATOM 1186 N ASP B 132 14.934 4.512 -4.530 1.00 0.00 N ATOM 1187 CA ASP B 132 16.010 4.274 -5.486 1.00 0.00 C ATOM 1188 C ASP B 132 15.485 3.562 -6.729 1.00 0.00 C ATOM 1189 O ASP B 132 16.176 3.472 -7.744 1.00 0.00 O ATOM 1190 CB ASP B 132 17.120 3.445 -4.839 1.00 0.00 C ATOM 1191 CG ASP B 132 18.005 4.272 -3.927 1.00 0.00 C ATOM 1192 OD1 ASP B 132 18.962 4.893 -4.434 1.00 0.00 O ATOM 1193 OD2 ASP B 132 17.739 4.298 -2.707 1.00 0.00 O ATOM 0 H ASP B 132 14.967 3.918 -3.702 1.00 0.00 H new ATOM 0 HA ASP B 132 16.416 5.240 -5.787 1.00 0.00 H new ATOM 0 HB2 ASP B 132 16.675 2.631 -4.267 1.00 0.00 H new ATOM 0 HB3 ASP B 132 17.731 2.990 -5.619 1.00 0.00 H new ATOM 1198 N LYS B 133 14.259 3.058 -6.643 1.00 0.00 N ATOM 1199 CA LYS B 133 13.640 2.355 -7.760 1.00 0.00 C ATOM 1200 C LYS B 133 12.908 3.328 -8.678 1.00 0.00 C ATOM 1201 O LYS B 133 13.278 3.498 -9.839 1.00 0.00 O ATOM 1202 CB LYS B 133 12.666 1.292 -7.245 1.00 0.00 C ATOM 1203 CG LYS B 133 13.266 -0.101 -7.175 1.00 0.00 C ATOM 1204 CD LYS B 133 14.334 -0.194 -6.098 1.00 0.00 C ATOM 1205 CE LYS B 133 15.187 -1.442 -6.266 1.00 0.00 C ATOM 1206 NZ LYS B 133 16.165 -1.300 -7.382 1.00 0.00 N ATOM 0 H LYS B 133 13.674 3.123 -5.810 1.00 0.00 H new ATOM 0 HA LYS B 133 14.430 1.868 -8.332 1.00 0.00 H new ATOM 0 HB2 LYS B 133 12.320 1.579 -6.252 1.00 0.00 H new ATOM 0 HB3 LYS B 133 11.790 1.269 -7.894 1.00 0.00 H new ATOM 0 HG2 LYS B 133 12.479 -0.827 -6.972 1.00 0.00 H new ATOM 0 HG3 LYS B 133 13.698 -0.361 -8.141 1.00 0.00 H new ATOM 0 HD2 LYS B 133 14.970 0.691 -6.137 1.00 0.00 H new ATOM 0 HD3 LYS B 133 13.862 -0.204 -5.116 1.00 0.00 H new ATOM 0 HE2 LYS B 133 15.722 -1.644 -5.338 1.00 0.00 H new ATOM 0 HE3 LYS B 133 14.542 -2.300 -6.455 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 16.826 -2.103 -7.368 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 15.657 -1.285 -8.289 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 16.695 -0.413 -7.268 1.00 0.00 H new ATOM 1220 N GLU B 134 11.868 3.966 -8.149 1.00 0.00 N ATOM 1221 CA GLU B 134 11.086 4.923 -8.921 1.00 0.00 C ATOM 1222 C GLU B 134 11.766 6.289 -8.944 1.00 0.00 C ATOM 1223 O GLU B 134 11.857 6.931 -9.989 1.00 0.00 O ATOM 1224 CB GLU B 134 9.676 5.051 -8.339 1.00 0.00 C ATOM 1225 CG GLU B 134 8.617 4.311 -9.139 1.00 0.00 C ATOM 1226 CD GLU B 134 8.329 4.967 -10.475 1.00 0.00 C ATOM 1227 OE1 GLU B 134 9.232 4.979 -11.338 1.00 0.00 O ATOM 1228 OE2 GLU B 134 7.201 5.470 -10.658 1.00 0.00 O ATOM 0 H GLU B 134 11.548 3.837 -7.189 1.00 0.00 H new ATOM 0 HA GLU B 134 11.016 4.555 -9.945 1.00 0.00 H new ATOM 0 HB2 GLU B 134 9.678 4.672 -7.317 1.00 0.00 H new ATOM 0 HB3 GLU B 134 9.408 6.106 -8.287 1.00 0.00 H new ATOM 0 HG2 GLU B 134 8.944 3.285 -9.306 1.00 0.00 H new ATOM 0 HG3 GLU B 134 7.697 4.261 -8.557 1.00 0.00 H new ATOM 1235 N GLY B 135 12.239 6.727 -7.781 1.00 0.00 N ATOM 1236 CA GLY B 135 12.904 8.014 -7.689 1.00 0.00 C ATOM 1237 C GLY B 135 12.085 9.036 -6.924 1.00 0.00 C ATOM 1238 O GLY B 135 12.034 10.207 -7.300 1.00 0.00 O ATOM 0 H GLY B 135 12.174 6.214 -6.902 1.00 0.00 H new ATOM 0 HA2 GLY B 135 13.870 7.887 -7.200 1.00 0.00 H new ATOM 0 HA3 GLY B 135 13.103 8.390 -8.693 1.00 0.00 H new ATOM 1242 N ILE B 136 11.440 8.591 -5.851 1.00 0.00 N ATOM 1243 CA ILE B 136 10.619 9.475 -5.033 1.00 0.00 C ATOM 1244 C ILE B 136 10.879 9.249 -3.547 1.00 0.00 C ATOM 1245 O ILE B 136 11.179 8.140 -3.106 1.00 0.00 O ATOM 1246 CB ILE B 136 9.119 9.272 -5.316 1.00 0.00 C ATOM 1247 CG1 ILE B 136 8.554 10.475 -6.074 1.00 0.00 C ATOM 1248 CG2 ILE B 136 8.360 9.055 -4.016 1.00 0.00 C ATOM 1249 CD1 ILE B 136 7.490 10.107 -7.085 1.00 0.00 C ATOM 0 H ILE B 136 11.470 7.624 -5.528 1.00 0.00 H new ATOM 0 HA ILE B 136 10.896 10.496 -5.297 1.00 0.00 H new ATOM 0 HB ILE B 136 8.998 8.385 -5.937 1.00 0.00 H new ATOM 0 HG12 ILE B 136 8.134 11.181 -5.358 1.00 0.00 H new ATOM 0 HG13 ILE B 136 9.369 10.987 -6.586 1.00 0.00 H new ATOM 0 HG21 ILE B 136 7.301 8.913 -4.232 1.00 0.00 H new ATOM 0 HG22 ILE B 136 8.749 8.171 -3.511 1.00 0.00 H new ATOM 0 HG23 ILE B 136 8.485 9.925 -3.372 1.00 0.00 H new ATOM 0 HD11 ILE B 136 7.135 11.009 -7.584 1.00 0.00 H new ATOM 0 HD12 ILE B 136 7.911 9.425 -7.824 1.00 0.00 H new ATOM 0 HD13 ILE B 136 6.657 9.622 -6.576 1.00 0.00 H new ATOM 1261 N PRO B 137 10.762 10.326 -2.755 1.00 0.00 N ATOM 1262 CA PRO B 137 10.978 10.270 -1.307 1.00 0.00 C ATOM 1263 C PRO B 137 9.879 9.498 -0.586 1.00 0.00 C ATOM 1264 O PRO B 137 8.703 9.565 -0.944 1.00 0.00 O ATOM 1265 CB PRO B 137 10.961 11.742 -0.889 1.00 0.00 C ATOM 1266 CG PRO B 137 10.145 12.423 -1.934 1.00 0.00 C ATOM 1267 CD PRO B 137 10.408 11.680 -3.214 1.00 0.00 C ATOM 0 HA PRO B 137 11.902 9.751 -1.052 1.00 0.00 H new ATOM 0 HB2 PRO B 137 10.522 11.868 0.101 1.00 0.00 H new ATOM 0 HB3 PRO B 137 11.970 12.153 -0.844 1.00 0.00 H new ATOM 0 HG2 PRO B 137 9.085 12.399 -1.679 1.00 0.00 H new ATOM 0 HG3 PRO B 137 10.426 13.472 -2.027 1.00 0.00 H new ATOM 0 HD2 PRO B 137 9.530 11.669 -3.860 1.00 0.00 H new ATOM 0 HD3 PRO B 137 11.218 12.136 -3.784 1.00 0.00 H new ATOM 1275 N PRO B 138 10.267 8.746 0.455 1.00 0.00 N ATOM 1276 CA PRO B 138 9.329 7.948 1.249 1.00 0.00 C ATOM 1277 C PRO B 138 8.401 8.814 2.094 1.00 0.00 C ATOM 1278 O PRO B 138 7.437 8.319 2.679 1.00 0.00 O ATOM 1279 CB PRO B 138 10.245 7.112 2.146 1.00 0.00 C ATOM 1280 CG PRO B 138 11.499 7.908 2.253 1.00 0.00 C ATOM 1281 CD PRO B 138 11.653 8.619 0.938 1.00 0.00 C ATOM 0 HA PRO B 138 8.667 7.353 0.620 1.00 0.00 H new ATOM 0 HB2 PRO B 138 9.796 6.947 3.125 1.00 0.00 H new ATOM 0 HB3 PRO B 138 10.435 6.130 1.712 1.00 0.00 H new ATOM 0 HG2 PRO B 138 11.440 8.620 3.077 1.00 0.00 H new ATOM 0 HG3 PRO B 138 12.355 7.263 2.450 1.00 0.00 H new ATOM 0 HD2 PRO B 138 12.127 9.593 1.061 1.00 0.00 H new ATOM 0 HD3 PRO B 138 12.270 8.050 0.243 1.00 0.00 H new ATOM 1289 N ASP B 139 8.699 10.107 2.154 1.00 0.00 N ATOM 1290 CA ASP B 139 7.890 11.043 2.927 1.00 0.00 C ATOM 1291 C ASP B 139 6.683 11.512 2.121 1.00 0.00 C ATOM 1292 O ASP B 139 5.874 12.304 2.603 1.00 0.00 O ATOM 1293 CB ASP B 139 8.732 12.246 3.355 1.00 0.00 C ATOM 1294 CG ASP B 139 8.172 12.939 4.580 1.00 0.00 C ATOM 1295 OD1 ASP B 139 8.300 12.379 5.689 1.00 0.00 O ATOM 1296 OD2 ASP B 139 7.604 14.041 4.431 1.00 0.00 O ATOM 0 H ASP B 139 9.495 10.531 1.677 1.00 0.00 H new ATOM 0 HA ASP B 139 7.531 10.526 3.817 1.00 0.00 H new ATOM 0 HB2 ASP B 139 9.751 11.918 3.561 1.00 0.00 H new ATOM 0 HB3 ASP B 139 8.787 12.958 2.532 1.00 0.00 H new ATOM 1301 N GLN B 140 6.568 11.017 0.893 1.00 0.00 N ATOM 1302 CA GLN B 140 5.461 11.388 0.021 1.00 0.00 C ATOM 1303 C GLN B 140 4.657 10.158 -0.390 1.00 0.00 C ATOM 1304 O GLN B 140 3.430 10.205 -0.467 1.00 0.00 O ATOM 1305 CB GLN B 140 5.983 12.110 -1.222 1.00 0.00 C ATOM 1306 CG GLN B 140 6.036 13.622 -1.070 1.00 0.00 C ATOM 1307 CD GLN B 140 7.251 14.233 -1.738 1.00 0.00 C ATOM 1308 OE1 GLN B 140 7.393 14.001 -3.038 1.00 0.00 O flip ATOM 1309 NE2 GLN B 140 8.056 14.907 -1.093 1.00 0.00 N flip ATOM 0 H GLN B 140 7.228 10.358 0.480 1.00 0.00 H new ATOM 0 HA GLN B 140 4.805 12.061 0.574 1.00 0.00 H new ATOM 0 HB2 GLN B 140 6.982 11.741 -1.453 1.00 0.00 H new ATOM 0 HB3 GLN B 140 5.347 11.861 -2.071 1.00 0.00 H new ATOM 0 HG2 GLN B 140 5.133 14.058 -1.498 1.00 0.00 H new ATOM 0 HG3 GLN B 140 6.042 13.877 -0.010 1.00 0.00 H new ATOM 0 HE21 GLN B 140 7.909 15.061 -0.095 1.00 0.00 H new ATOM 0 HE22 GLN B 140 8.870 15.311 -1.557 1.00 0.00 H new ATOM 1318 N GLN B 141 5.358 9.061 -0.655 1.00 0.00 N ATOM 1319 CA GLN B 141 4.709 7.819 -1.060 1.00 0.00 C ATOM 1320 C GLN B 141 4.228 7.035 0.156 1.00 0.00 C ATOM 1321 O GLN B 141 4.841 7.086 1.223 1.00 0.00 O ATOM 1322 CB GLN B 141 5.670 6.963 -1.885 1.00 0.00 C ATOM 1323 CG GLN B 141 7.015 6.736 -1.214 1.00 0.00 C ATOM 1324 CD GLN B 141 7.858 5.701 -1.932 1.00 0.00 C ATOM 1325 OE1 GLN B 141 7.366 4.643 -2.322 1.00 0.00 O ATOM 1326 NE2 GLN B 141 9.139 6.004 -2.112 1.00 0.00 N ATOM 0 H GLN B 141 6.375 9.006 -0.597 1.00 0.00 H new ATOM 0 HA GLN B 141 3.843 8.073 -1.672 1.00 0.00 H new ATOM 0 HB2 GLN B 141 5.205 5.997 -2.082 1.00 0.00 H new ATOM 0 HB3 GLN B 141 5.832 7.442 -2.851 1.00 0.00 H new ATOM 0 HG2 GLN B 141 7.560 7.679 -1.174 1.00 0.00 H new ATOM 0 HG3 GLN B 141 6.854 6.417 -0.184 1.00 0.00 H new ATOM 0 HE21 GLN B 141 9.505 6.893 -1.772 1.00 0.00 H new ATOM 0 HE22 GLN B 141 9.756 5.347 -2.590 1.00 0.00 H new ATOM 1335 N ARG B 142 3.126 6.310 -0.011 1.00 0.00 N ATOM 1336 CA ARG B 142 2.562 5.516 1.074 1.00 0.00 C ATOM 1337 C ARG B 142 2.086 4.160 0.564 1.00 0.00 C ATOM 1338 O ARG B 142 2.068 3.909 -0.642 1.00 0.00 O ATOM 1339 CB ARG B 142 1.398 6.263 1.729 1.00 0.00 C ATOM 1340 CG ARG B 142 1.839 7.396 2.642 1.00 0.00 C ATOM 1341 CD ARG B 142 0.754 8.453 2.781 1.00 0.00 C ATOM 1342 NE ARG B 142 1.162 9.543 3.663 1.00 0.00 N ATOM 1343 CZ ARG B 142 0.439 10.640 3.860 1.00 0.00 C ATOM 1344 NH1 ARG B 142 -0.723 10.791 3.240 1.00 0.00 N ATOM 1345 NH2 ARG B 142 0.877 11.588 4.678 1.00 0.00 N ATOM 0 H ARG B 142 2.606 6.256 -0.887 1.00 0.00 H new ATOM 0 HA ARG B 142 3.344 5.352 1.816 1.00 0.00 H new ATOM 0 HB2 ARG B 142 0.751 6.666 0.950 1.00 0.00 H new ATOM 0 HB3 ARG B 142 0.801 5.555 2.304 1.00 0.00 H new ATOM 0 HG2 ARG B 142 2.088 6.997 3.625 1.00 0.00 H new ATOM 0 HG3 ARG B 142 2.745 7.853 2.245 1.00 0.00 H new ATOM 0 HD2 ARG B 142 0.511 8.854 1.797 1.00 0.00 H new ATOM 0 HD3 ARG B 142 -0.154 7.992 3.170 1.00 0.00 H new ATOM 0 HE ARG B 142 2.051 9.457 4.155 1.00 0.00 H new ATOM 0 HH11 ARG B 142 -1.063 10.064 2.610 1.00 0.00 H new ATOM 0 HH12 ARG B 142 -1.277 11.634 3.393 1.00 0.00 H new ATOM 0 HH21 ARG B 142 1.770 11.475 5.157 1.00 0.00 H new ATOM 0 HH22 ARG B 142 0.320 12.429 4.828 1.00 0.00 H new ATOM 1359 N LEU B 143 1.702 3.287 1.489 1.00 0.00 N ATOM 1360 CA LEU B 143 1.226 1.954 1.134 1.00 0.00 C ATOM 1361 C LEU B 143 -0.248 1.791 1.488 1.00 0.00 C ATOM 1362 O LEU B 143 -0.756 2.452 2.394 1.00 0.00 O ATOM 1363 CB LEU B 143 2.056 0.888 1.851 1.00 0.00 C ATOM 1364 CG LEU B 143 3.124 0.189 1.008 1.00 0.00 C ATOM 1365 CD1 LEU B 143 3.845 -0.868 1.828 1.00 0.00 C ATOM 1366 CD2 LEU B 143 2.501 -0.430 -0.235 1.00 0.00 C ATOM 0 H LEU B 143 1.711 3.478 2.491 1.00 0.00 H new ATOM 0 HA LEU B 143 1.338 1.829 0.057 1.00 0.00 H new ATOM 0 HB2 LEU B 143 2.544 1.352 2.708 1.00 0.00 H new ATOM 0 HB3 LEU B 143 1.377 0.130 2.243 1.00 0.00 H new ATOM 0 HG LEU B 143 3.855 0.934 0.692 1.00 0.00 H new ATOM 0 HD11 LEU B 143 4.601 -1.354 1.211 1.00 0.00 H new ATOM 0 HD12 LEU B 143 4.325 -0.398 2.686 1.00 0.00 H new ATOM 0 HD13 LEU B 143 3.127 -1.611 2.175 1.00 0.00 H new ATOM 0 HD21 LEU B 143 3.275 -0.923 -0.823 1.00 0.00 H new ATOM 0 HD22 LEU B 143 1.749 -1.161 0.061 1.00 0.00 H new ATOM 0 HD23 LEU B 143 2.032 0.351 -0.834 1.00 0.00 H new ATOM 1378 N ILE B 144 -0.928 0.904 0.769 1.00 0.00 N ATOM 1379 CA ILE B 144 -2.343 0.650 1.010 1.00 0.00 C ATOM 1380 C ILE B 144 -2.651 -0.842 0.960 1.00 0.00 C ATOM 1381 O ILE B 144 -2.732 -1.435 -0.116 1.00 0.00 O ATOM 1382 CB ILE B 144 -3.229 1.380 -0.019 1.00 0.00 C ATOM 1383 CG1 ILE B 144 -2.820 2.851 -0.123 1.00 0.00 C ATOM 1384 CG2 ILE B 144 -4.695 1.257 0.364 1.00 0.00 C ATOM 1385 CD1 ILE B 144 -3.081 3.641 1.141 1.00 0.00 C ATOM 0 H ILE B 144 -0.522 0.350 0.015 1.00 0.00 H new ATOM 0 HA ILE B 144 -2.566 1.031 2.006 1.00 0.00 H new ATOM 0 HB ILE B 144 -3.089 0.914 -0.994 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -1.759 2.909 -0.365 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -3.361 3.313 -0.949 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -5.308 1.777 -0.372 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -4.977 0.204 0.392 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -4.853 1.701 1.347 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -2.767 4.675 0.995 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -4.146 3.614 1.373 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -2.518 3.204 1.966 1.00 0.00 H new ATOM 1397 N PHE B 145 -2.824 -1.444 2.132 1.00 0.00 N ATOM 1398 CA PHE B 145 -3.124 -2.868 2.223 1.00 0.00 C ATOM 1399 C PHE B 145 -4.189 -3.133 3.284 1.00 0.00 C ATOM 1400 O PHE B 145 -4.265 -2.431 4.291 1.00 0.00 O ATOM 1401 CB PHE B 145 -1.855 -3.659 2.549 1.00 0.00 C ATOM 1402 CG PHE B 145 -1.911 -5.093 2.106 1.00 0.00 C ATOM 1403 CD1 PHE B 145 -1.808 -5.420 0.763 1.00 0.00 C ATOM 1404 CD2 PHE B 145 -2.066 -6.113 3.030 1.00 0.00 C ATOM 1405 CE1 PHE B 145 -1.859 -6.738 0.351 1.00 0.00 C ATOM 1406 CE2 PHE B 145 -2.117 -7.432 2.623 1.00 0.00 C ATOM 1407 CZ PHE B 145 -2.014 -7.746 1.283 1.00 0.00 C ATOM 0 H PHE B 145 -2.762 -0.968 3.032 1.00 0.00 H new ATOM 0 HA PHE B 145 -3.509 -3.195 1.257 1.00 0.00 H new ATOM 0 HB2 PHE B 145 -1.002 -3.174 2.074 1.00 0.00 H new ATOM 0 HB3 PHE B 145 -1.682 -3.626 3.625 1.00 0.00 H new ATOM 0 HD1 PHE B 145 -1.687 -4.636 0.030 1.00 0.00 H new ATOM 0 HD2 PHE B 145 -2.148 -5.875 4.080 1.00 0.00 H new ATOM 0 HE1 PHE B 145 -1.778 -6.980 -0.698 1.00 0.00 H new ATOM 0 HE2 PHE B 145 -2.238 -8.218 3.354 1.00 0.00 H new ATOM 0 HZ PHE B 145 -2.054 -8.777 0.964 1.00 0.00 H new ATOM 1417 N ALA B 146 -5.009 -4.152 3.048 1.00 0.00 N ATOM 1418 CA ALA B 146 -6.068 -4.511 3.983 1.00 0.00 C ATOM 1419 C ALA B 146 -7.142 -3.430 4.037 1.00 0.00 C ATOM 1420 O ALA B 146 -7.861 -3.306 5.028 1.00 0.00 O ATOM 1421 CB ALA B 146 -5.489 -4.754 5.369 1.00 0.00 C ATOM 0 H ALA B 146 -4.960 -4.743 2.218 1.00 0.00 H new ATOM 0 HA ALA B 146 -6.534 -5.431 3.630 1.00 0.00 H new ATOM 0 HB1 ALA B 146 -6.291 -5.021 6.057 1.00 0.00 H new ATOM 0 HB2 ALA B 146 -4.764 -5.567 5.323 1.00 0.00 H new ATOM 0 HB3 ALA B 146 -4.996 -3.848 5.721 1.00 0.00 H new ATOM 1427 N GLY B 147 -7.244 -2.651 2.966 1.00 0.00 N ATOM 1428 CA GLY B 147 -8.234 -1.589 2.913 1.00 0.00 C ATOM 1429 C GLY B 147 -7.902 -0.441 3.845 1.00 0.00 C ATOM 1430 O GLY B 147 -8.712 0.466 4.036 1.00 0.00 O ATOM 0 H GLY B 147 -6.660 -2.735 2.134 1.00 0.00 H new ATOM 0 HA2 GLY B 147 -8.307 -1.215 1.892 1.00 0.00 H new ATOM 0 HA3 GLY B 147 -9.212 -1.994 3.174 1.00 0.00 H new ATOM 1434 N LYS B 148 -6.708 -0.479 4.427 1.00 0.00 N ATOM 1435 CA LYS B 148 -6.270 0.565 5.344 1.00 0.00 C ATOM 1436 C LYS B 148 -5.010 1.250 4.827 1.00 0.00 C ATOM 1437 O LYS B 148 -4.329 0.731 3.944 1.00 0.00 O ATOM 1438 CB LYS B 148 -6.011 -0.023 6.733 1.00 0.00 C ATOM 1439 CG LYS B 148 -6.793 -1.295 7.011 1.00 0.00 C ATOM 1440 CD LYS B 148 -6.609 -1.760 8.446 1.00 0.00 C ATOM 1441 CE LYS B 148 -5.589 -2.884 8.542 1.00 0.00 C ATOM 1442 NZ LYS B 148 -5.005 -2.987 9.908 1.00 0.00 N ATOM 0 H LYS B 148 -6.026 -1.223 4.279 1.00 0.00 H new ATOM 0 HA LYS B 148 -7.064 1.309 5.414 1.00 0.00 H new ATOM 0 HB2 LYS B 148 -4.946 -0.231 6.837 1.00 0.00 H new ATOM 0 HB3 LYS B 148 -6.266 0.722 7.487 1.00 0.00 H new ATOM 0 HG2 LYS B 148 -7.851 -1.122 6.816 1.00 0.00 H new ATOM 0 HG3 LYS B 148 -6.467 -2.080 6.329 1.00 0.00 H new ATOM 0 HD2 LYS B 148 -6.286 -0.921 9.063 1.00 0.00 H new ATOM 0 HD3 LYS B 148 -7.565 -2.100 8.845 1.00 0.00 H new ATOM 0 HE2 LYS B 148 -6.064 -3.829 8.278 1.00 0.00 H new ATOM 0 HE3 LYS B 148 -4.792 -2.714 7.818 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 -4.315 -3.764 9.933 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 -4.530 -2.094 10.151 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 -5.762 -3.174 10.596 1.00 0.00 H new ATOM 1456 N GLN B 149 -4.705 2.418 5.384 1.00 0.00 N ATOM 1457 CA GLN B 149 -3.525 3.173 4.978 1.00 0.00 C ATOM 1458 C GLN B 149 -2.308 2.765 5.802 1.00 0.00 C ATOM 1459 O GLN B 149 -2.223 3.062 6.993 1.00 0.00 O ATOM 1460 CB GLN B 149 -3.777 4.674 5.129 1.00 0.00 C ATOM 1461 CG GLN B 149 -2.663 5.538 4.562 1.00 0.00 C ATOM 1462 CD GLN B 149 -2.577 6.895 5.233 1.00 0.00 C ATOM 1463 OE1 GLN B 149 -1.491 7.362 5.577 1.00 0.00 O ATOM 1464 NE2 GLN B 149 -3.724 7.535 5.423 1.00 0.00 N ATOM 0 H GLN B 149 -5.258 2.862 6.117 1.00 0.00 H new ATOM 0 HA GLN B 149 -3.324 2.949 3.930 1.00 0.00 H new ATOM 0 HB2 GLN B 149 -4.712 4.929 4.631 1.00 0.00 H new ATOM 0 HB3 GLN B 149 -3.905 4.908 6.186 1.00 0.00 H new ATOM 0 HG2 GLN B 149 -1.711 5.019 4.677 1.00 0.00 H new ATOM 0 HG3 GLN B 149 -2.823 5.675 3.493 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -4.601 7.110 5.122 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -3.728 8.452 5.870 1.00 0.00 H new ATOM 1473 N LEU B 150 -1.367 2.082 5.158 1.00 0.00 N ATOM 1474 CA LEU B 150 -0.154 1.631 5.830 1.00 0.00 C ATOM 1475 C LEU B 150 0.833 2.782 6.000 1.00 0.00 C ATOM 1476 O LEU B 150 1.141 3.494 5.045 1.00 0.00 O ATOM 1477 CB LEU B 150 0.499 0.496 5.041 1.00 0.00 C ATOM 1478 CG LEU B 150 -0.455 -0.473 4.343 1.00 0.00 C ATOM 1479 CD1 LEU B 150 0.309 -1.657 3.772 1.00 0.00 C ATOM 1480 CD2 LEU B 150 -1.533 -0.947 5.308 1.00 0.00 C ATOM 0 H LEU B 150 -1.421 1.829 4.171 1.00 0.00 H new ATOM 0 HA LEU B 150 -0.431 1.264 6.818 1.00 0.00 H new ATOM 0 HB2 LEU B 150 1.154 0.934 4.288 1.00 0.00 H new ATOM 0 HB3 LEU B 150 1.131 -0.075 5.721 1.00 0.00 H new ATOM 0 HG LEU B 150 -0.937 0.053 3.519 1.00 0.00 H new ATOM 0 HD11 LEU B 150 -0.387 -2.336 3.279 1.00 0.00 H new ATOM 0 HD12 LEU B 150 1.043 -1.302 3.049 1.00 0.00 H new ATOM 0 HD13 LEU B 150 0.820 -2.184 4.578 1.00 0.00 H new ATOM 0 HD21 LEU B 150 -2.204 -1.636 4.795 1.00 0.00 H new ATOM 0 HD22 LEU B 150 -1.067 -1.455 6.152 1.00 0.00 H new ATOM 0 HD23 LEU B 150 -2.101 -0.089 5.669 1.00 0.00 H new ATOM 1492 N GLU B 151 1.327 2.956 7.222 1.00 0.00 N ATOM 1493 CA GLU B 151 2.280 4.019 7.516 1.00 0.00 C ATOM 1494 C GLU B 151 3.393 3.515 8.431 1.00 0.00 C ATOM 1495 O GLU B 151 3.339 2.391 8.931 1.00 0.00 O ATOM 1496 CB GLU B 151 1.569 5.207 8.167 1.00 0.00 C ATOM 1497 CG GLU B 151 0.607 4.809 9.274 1.00 0.00 C ATOM 1498 CD GLU B 151 0.316 5.948 10.231 1.00 0.00 C ATOM 1499 OE1 GLU B 151 1.185 6.833 10.382 1.00 0.00 O ATOM 1500 OE2 GLU B 151 -0.780 5.955 10.830 1.00 0.00 O ATOM 0 H GLU B 151 1.083 2.375 8.024 1.00 0.00 H new ATOM 0 HA GLU B 151 2.725 4.342 6.575 1.00 0.00 H new ATOM 0 HB2 GLU B 151 2.316 5.888 8.574 1.00 0.00 H new ATOM 0 HB3 GLU B 151 1.021 5.756 7.401 1.00 0.00 H new ATOM 0 HG2 GLU B 151 -0.327 4.463 8.832 1.00 0.00 H new ATOM 0 HG3 GLU B 151 1.026 3.970 9.830 1.00 0.00 H new ATOM 1507 N ASP B 152 4.400 4.355 8.646 1.00 0.00 N ATOM 1508 CA ASP B 152 5.526 3.995 9.501 1.00 0.00 C ATOM 1509 C ASP B 152 5.055 3.687 10.919 1.00 0.00 C ATOM 1510 O ASP B 152 5.759 3.038 11.690 1.00 0.00 O ATOM 1511 CB ASP B 152 6.555 5.126 9.527 1.00 0.00 C ATOM 1512 CG ASP B 152 6.159 6.248 10.468 1.00 0.00 C ATOM 1513 OD1 ASP B 152 5.243 7.021 10.117 1.00 0.00 O ATOM 1514 OD2 ASP B 152 6.765 6.352 11.554 1.00 0.00 O ATOM 0 H ASP B 152 4.460 5.289 8.241 1.00 0.00 H new ATOM 0 HA ASP B 152 5.991 3.099 9.089 1.00 0.00 H new ATOM 0 HB2 ASP B 152 7.523 4.726 9.830 1.00 0.00 H new ATOM 0 HB3 ASP B 152 6.677 5.526 8.520 1.00 0.00 H new ATOM 1519 N GLY B 153 3.857 4.157 11.254 1.00 0.00 N ATOM 1520 CA GLY B 153 3.313 3.923 12.579 1.00 0.00 C ATOM 1521 C GLY B 153 3.223 2.447 12.916 1.00 0.00 C ATOM 1522 O GLY B 153 3.164 2.074 14.088 1.00 0.00 O ATOM 0 H GLY B 153 3.254 4.695 10.632 1.00 0.00 H new ATOM 0 HA2 GLY B 153 3.937 4.424 13.319 1.00 0.00 H new ATOM 0 HA3 GLY B 153 2.321 4.369 12.645 1.00 0.00 H new ATOM 1526 N ARG B 154 3.210 1.607 11.887 1.00 0.00 N ATOM 1527 CA ARG B 154 3.124 0.164 12.080 1.00 0.00 C ATOM 1528 C ARG B 154 4.182 -0.559 11.252 1.00 0.00 C ATOM 1529 O ARG B 154 4.815 0.033 10.379 1.00 0.00 O ATOM 1530 CB ARG B 154 1.730 -0.340 11.700 1.00 0.00 C ATOM 1531 CG ARG B 154 0.604 0.546 12.205 1.00 0.00 C ATOM 1532 CD ARG B 154 -0.666 -0.254 12.452 1.00 0.00 C ATOM 1533 NE ARG B 154 -0.600 -1.017 13.695 1.00 0.00 N ATOM 1534 CZ ARG B 154 -1.669 -1.490 14.326 1.00 0.00 C ATOM 1535 NH1 ARG B 154 -2.882 -1.279 13.832 1.00 0.00 N ATOM 1536 NH2 ARG B 154 -1.527 -2.174 15.454 1.00 0.00 N ATOM 0 H ARG B 154 3.258 1.900 10.911 1.00 0.00 H new ATOM 0 HA ARG B 154 3.305 -0.048 13.134 1.00 0.00 H new ATOM 0 HB2 ARG B 154 1.663 -0.415 10.615 1.00 0.00 H new ATOM 0 HB3 ARG B 154 1.596 -1.346 12.098 1.00 0.00 H new ATOM 0 HG2 ARG B 154 0.912 1.037 13.128 1.00 0.00 H new ATOM 0 HG3 ARG B 154 0.404 1.333 11.477 1.00 0.00 H new ATOM 0 HD2 ARG B 154 -1.520 0.423 12.487 1.00 0.00 H new ATOM 0 HD3 ARG B 154 -0.833 -0.935 11.617 1.00 0.00 H new ATOM 0 HE ARG B 154 0.318 -1.197 14.102 1.00 0.00 H new ATOM 0 HH11 ARG B 154 -2.995 -0.753 12.966 1.00 0.00 H new ATOM 0 HH12 ARG B 154 -3.701 -1.643 14.318 1.00 0.00 H new ATOM 0 HH21 ARG B 154 -0.596 -2.337 15.838 1.00 0.00 H new ATOM 0 HH22 ARG B 154 -2.349 -2.537 15.937 1.00 0.00 H new ATOM 1550 N THR B 155 4.369 -1.845 11.534 1.00 0.00 N ATOM 1551 CA THR B 155 5.350 -2.649 10.817 1.00 0.00 C ATOM 1552 C THR B 155 4.680 -3.528 9.767 1.00 0.00 C ATOM 1553 O THR B 155 3.459 -3.503 9.609 1.00 0.00 O ATOM 1554 CB THR B 155 6.155 -3.543 11.780 1.00 0.00 C ATOM 1555 OG1 THR B 155 5.263 -4.322 12.586 1.00 0.00 O ATOM 1556 CG2 THR B 155 7.053 -2.704 12.675 1.00 0.00 C ATOM 0 H THR B 155 3.854 -2.351 12.254 1.00 0.00 H new ATOM 0 HA THR B 155 6.029 -1.953 10.324 1.00 0.00 H new ATOM 0 HB THR B 155 6.781 -4.208 11.185 1.00 0.00 H new ATOM 0 HG1 THR B 155 5.782 -4.889 13.194 1.00 0.00 H new ATOM 0 HG21 THR B 155 7.611 -3.357 13.346 1.00 0.00 H new ATOM 0 HG22 THR B 155 7.750 -2.135 12.060 1.00 0.00 H new ATOM 0 HG23 THR B 155 6.443 -2.017 13.262 1.00 0.00 H new ATOM 1564 N LEU B 156 5.485 -4.304 9.051 1.00 0.00 N ATOM 1565 CA LEU B 156 4.970 -5.192 8.014 1.00 0.00 C ATOM 1566 C LEU B 156 4.103 -6.291 8.620 1.00 0.00 C ATOM 1567 O LEU B 156 2.996 -6.553 8.151 1.00 0.00 O ATOM 1568 CB LEU B 156 6.125 -5.814 7.226 1.00 0.00 C ATOM 1569 CG LEU B 156 6.663 -4.985 6.058 1.00 0.00 C ATOM 1570 CD1 LEU B 156 5.645 -4.930 4.930 1.00 0.00 C ATOM 1571 CD2 LEU B 156 7.025 -3.582 6.523 1.00 0.00 C ATOM 0 H LEU B 156 6.498 -4.337 9.169 1.00 0.00 H new ATOM 0 HA LEU B 156 4.354 -4.600 7.337 1.00 0.00 H new ATOM 0 HB2 LEU B 156 6.946 -6.009 7.916 1.00 0.00 H new ATOM 0 HB3 LEU B 156 5.797 -6.779 6.840 1.00 0.00 H new ATOM 0 HG LEU B 156 7.566 -5.465 5.681 1.00 0.00 H new ATOM 0 HD11 LEU B 156 6.045 -4.336 4.108 1.00 0.00 H new ATOM 0 HD12 LEU B 156 5.435 -5.941 4.579 1.00 0.00 H new ATOM 0 HD13 LEU B 156 4.724 -4.474 5.293 1.00 0.00 H new ATOM 0 HD21 LEU B 156 7.406 -3.006 5.680 1.00 0.00 H new ATOM 0 HD22 LEU B 156 6.139 -3.092 6.926 1.00 0.00 H new ATOM 0 HD23 LEU B 156 7.790 -3.641 7.297 1.00 0.00 H new ATOM 1583 N SER B 157 4.615 -6.931 9.668 1.00 0.00 N ATOM 1584 CA SER B 157 3.889 -8.003 10.338 1.00 0.00 C ATOM 1585 C SER B 157 2.616 -7.472 10.990 1.00 0.00 C ATOM 1586 O SER B 157 1.687 -8.230 11.273 1.00 0.00 O ATOM 1587 CB SER B 157 4.776 -8.668 11.391 1.00 0.00 C ATOM 1588 OG SER B 157 4.071 -9.683 12.085 1.00 0.00 O ATOM 0 H SER B 157 5.529 -6.725 10.070 1.00 0.00 H new ATOM 0 HA SER B 157 3.611 -8.744 9.588 1.00 0.00 H new ATOM 0 HB2 SER B 157 5.657 -9.095 10.912 1.00 0.00 H new ATOM 0 HB3 SER B 157 5.130 -7.918 12.098 1.00 0.00 H new ATOM 0 HG SER B 157 4.661 -10.094 12.751 1.00 0.00 H new ATOM 1594 N ASP B 158 2.580 -6.166 11.226 1.00 0.00 N ATOM 1595 CA ASP B 158 1.422 -5.531 11.844 1.00 0.00 C ATOM 1596 C ASP B 158 0.235 -5.519 10.886 1.00 0.00 C ATOM 1597 O ASP B 158 -0.919 -5.581 11.313 1.00 0.00 O ATOM 1598 CB ASP B 158 1.764 -4.103 12.272 1.00 0.00 C ATOM 1599 CG ASP B 158 2.033 -3.993 13.759 1.00 0.00 C ATOM 1600 OD1 ASP B 158 1.372 -4.712 14.538 1.00 0.00 O ATOM 1601 OD2 ASP B 158 2.905 -3.187 14.146 1.00 0.00 O ATOM 0 H ASP B 158 3.340 -5.525 10.999 1.00 0.00 H new ATOM 0 HA ASP B 158 1.148 -6.109 12.726 1.00 0.00 H new ATOM 0 HB2 ASP B 158 2.640 -3.762 11.721 1.00 0.00 H new ATOM 0 HB3 ASP B 158 0.941 -3.440 12.005 1.00 0.00 H new ATOM 1606 N TYR B 159 0.524 -5.438 9.593 1.00 0.00 N ATOM 1607 CA TYR B 159 -0.520 -5.413 8.576 1.00 0.00 C ATOM 1608 C TYR B 159 -0.681 -6.785 7.928 1.00 0.00 C ATOM 1609 O TYR B 159 -1.326 -6.921 6.890 1.00 0.00 O ATOM 1610 CB TYR B 159 -0.195 -4.368 7.508 1.00 0.00 C ATOM 1611 CG TYR B 159 -0.438 -2.945 7.959 1.00 0.00 C ATOM 1612 CD1 TYR B 159 -1.703 -2.528 8.355 1.00 0.00 C ATOM 1613 CD2 TYR B 159 0.597 -2.018 7.988 1.00 0.00 C ATOM 1614 CE1 TYR B 159 -1.929 -1.229 8.768 1.00 0.00 C ATOM 1615 CE2 TYR B 159 0.380 -0.718 8.400 1.00 0.00 C ATOM 1616 CZ TYR B 159 -0.885 -0.328 8.788 1.00 0.00 C ATOM 1617 OH TYR B 159 -1.106 0.967 9.199 1.00 0.00 O ATOM 0 H TYR B 159 1.473 -5.388 9.224 1.00 0.00 H new ATOM 0 HA TYR B 159 -1.459 -5.147 9.061 1.00 0.00 H new ATOM 0 HB2 TYR B 159 0.849 -4.474 7.214 1.00 0.00 H new ATOM 0 HB3 TYR B 159 -0.797 -4.567 6.622 1.00 0.00 H new ATOM 0 HD1 TYR B 159 -2.523 -3.231 8.340 1.00 0.00 H new ATOM 0 HD2 TYR B 159 1.588 -2.320 7.683 1.00 0.00 H new ATOM 0 HE1 TYR B 159 -2.918 -0.921 9.074 1.00 0.00 H new ATOM 0 HE2 TYR B 159 1.196 -0.011 8.418 1.00 0.00 H new ATOM 0 HH TYR B 159 -0.248 1.402 9.385 1.00 0.00 H new ATOM 1627 N ASN B 160 -0.090 -7.799 8.551 1.00 0.00 N ATOM 1628 CA ASN B 160 -0.168 -9.162 8.037 1.00 0.00 C ATOM 1629 C ASN B 160 0.220 -9.210 6.562 1.00 0.00 C ATOM 1630 O ASN B 160 -0.446 -9.860 5.756 1.00 0.00 O ATOM 1631 CB ASN B 160 -1.580 -9.720 8.223 1.00 0.00 C ATOM 1632 CG ASN B 160 -1.580 -11.206 8.523 1.00 0.00 C ATOM 1633 OD1 ASN B 160 -0.743 -11.698 9.279 1.00 0.00 O ATOM 1634 ND2 ASN B 160 -2.523 -11.929 7.929 1.00 0.00 N ATOM 0 H ASN B 160 0.448 -7.703 9.412 1.00 0.00 H new ATOM 0 HA ASN B 160 0.535 -9.777 8.600 1.00 0.00 H new ATOM 0 HB2 ASN B 160 -2.074 -9.188 9.036 1.00 0.00 H new ATOM 0 HB3 ASN B 160 -2.163 -9.534 7.321 1.00 0.00 H new ATOM 0 HD21 ASN B 160 -2.573 -12.935 8.092 1.00 0.00 H new ATOM 0 HD22 ASN B 160 -3.197 -11.479 7.310 1.00 0.00 H new ATOM 1641 N ILE B 161 1.299 -8.516 6.217 1.00 0.00 N ATOM 1642 CA ILE B 161 1.776 -8.482 4.840 1.00 0.00 C ATOM 1643 C ILE B 161 2.634 -9.703 4.524 1.00 0.00 C ATOM 1644 O ILE B 161 3.742 -9.844 5.039 1.00 0.00 O ATOM 1645 CB ILE B 161 2.595 -7.207 4.560 1.00 0.00 C ATOM 1646 CG1 ILE B 161 1.718 -5.964 4.727 1.00 0.00 C ATOM 1647 CG2 ILE B 161 3.190 -7.258 3.162 1.00 0.00 C ATOM 1648 CD1 ILE B 161 2.482 -4.665 4.606 1.00 0.00 C ATOM 0 H ILE B 161 1.859 -7.970 6.872 1.00 0.00 H new ATOM 0 HA ILE B 161 0.893 -8.486 4.200 1.00 0.00 H new ATOM 0 HB ILE B 161 3.412 -7.151 5.280 1.00 0.00 H new ATOM 0 HG12 ILE B 161 0.928 -5.983 3.976 1.00 0.00 H new ATOM 0 HG13 ILE B 161 1.232 -6.001 5.702 1.00 0.00 H new ATOM 0 HG21 ILE B 161 3.766 -6.351 2.978 1.00 0.00 H new ATOM 0 HG22 ILE B 161 3.843 -8.126 3.076 1.00 0.00 H new ATOM 0 HG23 ILE B 161 2.388 -7.334 2.428 1.00 0.00 H new ATOM 0 HD11 ILE B 161 1.797 -3.827 4.735 1.00 0.00 H new ATOM 0 HD12 ILE B 161 3.254 -4.624 5.374 1.00 0.00 H new ATOM 0 HD13 ILE B 161 2.946 -4.606 3.621 1.00 0.00 H new ATOM 1660 N GLN B 162 2.112 -10.580 3.673 1.00 0.00 N ATOM 1661 CA GLN B 162 2.830 -11.789 3.288 1.00 0.00 C ATOM 1662 C GLN B 162 3.621 -11.565 2.003 1.00 0.00 C ATOM 1663 O GLN B 162 3.656 -10.458 1.467 1.00 0.00 O ATOM 1664 CB GLN B 162 1.854 -12.952 3.103 1.00 0.00 C ATOM 1665 CG GLN B 162 1.286 -13.482 4.409 1.00 0.00 C ATOM 1666 CD GLN B 162 -0.037 -12.838 4.775 1.00 0.00 C ATOM 1667 OE1 GLN B 162 -0.237 -12.585 6.064 1.00 0.00 O flip ATOM 1668 NE2 GLN B 162 -0.871 -12.571 3.909 1.00 0.00 N flip ATOM 0 H GLN B 162 1.196 -10.476 3.237 1.00 0.00 H new ATOM 0 HA GLN B 162 3.529 -12.035 4.087 1.00 0.00 H new ATOM 0 HB2 GLN B 162 1.033 -12.628 2.464 1.00 0.00 H new ATOM 0 HB3 GLN B 162 2.363 -13.763 2.582 1.00 0.00 H new ATOM 0 HG2 GLN B 162 1.151 -14.561 4.331 1.00 0.00 H new ATOM 0 HG3 GLN B 162 2.004 -13.308 5.210 1.00 0.00 H new ATOM 0 HE21 GLN B 162 -0.676 -12.783 2.930 1.00 0.00 H new ATOM 0 HE22 GLN B 162 -1.757 -12.138 4.170 1.00 0.00 H new ATOM 1677 N LYS B 163 4.255 -12.625 1.512 1.00 0.00 N ATOM 1678 CA LYS B 163 5.045 -12.546 0.289 1.00 0.00 C ATOM 1679 C LYS B 163 4.147 -12.344 -0.927 1.00 0.00 C ATOM 1680 O LYS B 163 3.033 -12.866 -0.980 1.00 0.00 O ATOM 1681 CB LYS B 163 5.881 -13.817 0.114 1.00 0.00 C ATOM 1682 CG LYS B 163 6.842 -13.756 -1.060 1.00 0.00 C ATOM 1683 CD LYS B 163 8.112 -14.540 -0.782 1.00 0.00 C ATOM 1684 CE LYS B 163 9.233 -14.141 -1.729 1.00 0.00 C ATOM 1685 NZ LYS B 163 10.439 -14.998 -1.556 1.00 0.00 N ATOM 0 H LYS B 163 4.237 -13.549 1.943 1.00 0.00 H new ATOM 0 HA LYS B 163 5.712 -11.688 0.372 1.00 0.00 H new ATOM 0 HB2 LYS B 163 6.448 -13.998 1.027 1.00 0.00 H new ATOM 0 HB3 LYS B 163 5.211 -14.667 -0.019 1.00 0.00 H new ATOM 0 HG2 LYS B 163 6.355 -14.154 -1.951 1.00 0.00 H new ATOM 0 HG3 LYS B 163 7.094 -12.717 -1.272 1.00 0.00 H new ATOM 0 HD2 LYS B 163 8.427 -14.371 0.248 1.00 0.00 H new ATOM 0 HD3 LYS B 163 7.912 -15.607 -0.883 1.00 0.00 H new ATOM 0 HE2 LYS B 163 8.881 -14.213 -2.758 1.00 0.00 H new ATOM 0 HE3 LYS B 163 9.501 -13.099 -1.556 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 11.179 -14.693 -2.220 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 10.790 -14.910 -0.581 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 10.190 -15.990 -1.746 1.00 0.00 H new ATOM 1699 N GLU B 164 4.641 -11.587 -1.902 1.00 0.00 N ATOM 1700 CA GLU B 164 3.881 -11.318 -3.117 1.00 0.00 C ATOM 1701 C GLU B 164 2.602 -10.548 -2.801 1.00 0.00 C ATOM 1702 O GLU B 164 1.560 -10.774 -3.417 1.00 0.00 O ATOM 1703 CB GLU B 164 3.538 -12.628 -3.831 1.00 0.00 C ATOM 1704 CG GLU B 164 4.705 -13.596 -3.921 1.00 0.00 C ATOM 1705 CD GLU B 164 4.638 -14.478 -5.153 1.00 0.00 C ATOM 1706 OE1 GLU B 164 3.688 -15.281 -5.258 1.00 0.00 O ATOM 1707 OE2 GLU B 164 5.536 -14.362 -6.013 1.00 0.00 O ATOM 0 H GLU B 164 5.562 -11.150 -1.874 1.00 0.00 H new ATOM 0 HA GLU B 164 4.500 -10.706 -3.773 1.00 0.00 H new ATOM 0 HB2 GLU B 164 2.714 -13.113 -3.307 1.00 0.00 H new ATOM 0 HB3 GLU B 164 3.186 -12.402 -4.838 1.00 0.00 H new ATOM 0 HG2 GLU B 164 5.639 -13.034 -3.932 1.00 0.00 H new ATOM 0 HG3 GLU B 164 4.721 -14.224 -3.030 1.00 0.00 H new ATOM 1714 N SER B 165 2.689 -9.638 -1.837 1.00 0.00 N ATOM 1715 CA SER B 165 1.539 -8.837 -1.435 1.00 0.00 C ATOM 1716 C SER B 165 1.209 -7.790 -2.494 1.00 0.00 C ATOM 1717 O SER B 165 2.102 -7.170 -3.072 1.00 0.00 O ATOM 1718 CB SER B 165 1.811 -8.153 -0.093 1.00 0.00 C ATOM 1719 OG SER B 165 1.426 -8.983 0.989 1.00 0.00 O ATOM 0 H SER B 165 3.545 -9.437 -1.319 1.00 0.00 H new ATOM 0 HA SER B 165 0.683 -9.503 -1.329 1.00 0.00 H new ATOM 0 HB2 SER B 165 2.871 -7.913 -0.012 1.00 0.00 H new ATOM 0 HB3 SER B 165 1.266 -7.210 -0.044 1.00 0.00 H new ATOM 0 HG SER B 165 2.125 -9.649 1.156 1.00 0.00 H new ATOM 1725 N THR B 166 -0.083 -7.598 -2.745 1.00 0.00 N ATOM 1726 CA THR B 166 -0.532 -6.628 -3.735 1.00 0.00 C ATOM 1727 C THR B 166 -0.914 -5.307 -3.077 1.00 0.00 C ATOM 1728 O THR B 166 -1.949 -5.208 -2.417 1.00 0.00 O ATOM 1729 CB THR B 166 -1.738 -7.158 -4.534 1.00 0.00 C ATOM 1730 OG1 THR B 166 -1.726 -8.590 -4.546 1.00 0.00 O ATOM 1731 CG2 THR B 166 -1.715 -6.634 -5.962 1.00 0.00 C ATOM 0 H THR B 166 -0.836 -8.102 -2.276 1.00 0.00 H new ATOM 0 HA THR B 166 0.302 -6.463 -4.417 1.00 0.00 H new ATOM 0 HB THR B 166 -2.649 -6.806 -4.050 1.00 0.00 H new ATOM 0 HG1 THR B 166 -2.496 -8.919 -5.054 1.00 0.00 H new ATOM 0 HG21 THR B 166 -2.576 -7.022 -6.506 1.00 0.00 H new ATOM 0 HG22 THR B 166 -1.754 -5.545 -5.951 1.00 0.00 H new ATOM 0 HG23 THR B 166 -0.798 -6.959 -6.454 1.00 0.00 H new ATOM 1739 N LEU B 167 -0.074 -4.295 -3.262 1.00 0.00 N ATOM 1740 CA LEU B 167 -0.324 -2.978 -2.686 1.00 0.00 C ATOM 1741 C LEU B 167 -0.272 -1.896 -3.759 1.00 0.00 C ATOM 1742 O LEU B 167 0.085 -2.162 -4.907 1.00 0.00 O ATOM 1743 CB LEU B 167 0.700 -2.676 -1.590 1.00 0.00 C ATOM 1744 CG LEU B 167 1.044 -3.836 -0.655 1.00 0.00 C ATOM 1745 CD1 LEU B 167 2.243 -4.609 -1.182 1.00 0.00 C ATOM 1746 CD2 LEU B 167 1.315 -3.323 0.752 1.00 0.00 C ATOM 0 H LEU B 167 0.786 -4.361 -3.806 1.00 0.00 H new ATOM 0 HA LEU B 167 -1.323 -2.983 -2.250 1.00 0.00 H new ATOM 0 HB2 LEU B 167 1.620 -2.333 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU B 167 0.324 -1.849 -0.987 1.00 0.00 H new ATOM 0 HG LEU B 167 0.190 -4.512 -0.616 1.00 0.00 H new ATOM 0 HD11 LEU B 167 2.473 -5.431 -0.504 1.00 0.00 H new ATOM 0 HD12 LEU B 167 2.013 -5.008 -2.170 1.00 0.00 H new ATOM 0 HD13 LEU B 167 3.103 -3.943 -1.251 1.00 0.00 H new ATOM 0 HD21 LEU B 167 1.558 -4.162 1.404 1.00 0.00 H new ATOM 0 HD22 LEU B 167 2.152 -2.626 0.730 1.00 0.00 H new ATOM 0 HD23 LEU B 167 0.429 -2.814 1.131 1.00 0.00 H new ATOM 1758 N HIS B 168 -0.630 -0.673 -3.378 1.00 0.00 N ATOM 1759 CA HIS B 168 -0.622 0.450 -4.307 1.00 0.00 C ATOM 1760 C HIS B 168 0.293 1.563 -3.806 1.00 0.00 C ATOM 1761 O HIS B 168 0.757 1.534 -2.664 1.00 0.00 O ATOM 1762 CB HIS B 168 -2.039 0.989 -4.503 1.00 0.00 C ATOM 1763 CG HIS B 168 -2.744 0.405 -5.689 1.00 0.00 C ATOM 1764 ND1 HIS B 168 -3.156 0.978 -6.844 1.00 0.00 N flip ATOM 1765 CD2 HIS B 168 -3.102 -0.924 -5.772 1.00 0.00 C flip ATOM 1766 CE1 HIS B 168 -3.750 -0.005 -7.596 1.00 0.00 C flip ATOM 1767 NE2 HIS B 168 -3.704 -1.144 -6.927 1.00 0.00 N flip ATOM 0 H HIS B 168 -0.929 -0.436 -2.432 1.00 0.00 H new ATOM 0 HA HIS B 168 -0.242 0.094 -5.264 1.00 0.00 H new ATOM 0 HB2 HIS B 168 -2.624 0.785 -3.606 1.00 0.00 H new ATOM 0 HB3 HIS B 168 -1.995 2.072 -4.614 1.00 0.00 H new ATOM 0 HD1 HIS B 168 -3.046 1.957 -7.107 1.00 0.00 H new ATOM 0 HD2 HIS B 168 -2.919 -1.669 -5.012 1.00 0.00 H new ATOM 0 HE1 HIS B 168 -4.184 0.130 -8.575 1.00 0.00 H new ATOM 1775 N LEU B 169 0.550 2.544 -4.664 1.00 0.00 N ATOM 1776 CA LEU B 169 1.410 3.668 -4.308 1.00 0.00 C ATOM 1777 C LEU B 169 0.626 4.976 -4.314 1.00 0.00 C ATOM 1778 O LEU B 169 -0.044 5.307 -5.292 1.00 0.00 O ATOM 1779 CB LEU B 169 2.588 3.761 -5.279 1.00 0.00 C ATOM 1780 CG LEU B 169 3.881 4.345 -4.711 1.00 0.00 C ATOM 1781 CD1 LEU B 169 3.628 5.719 -4.109 1.00 0.00 C ATOM 1782 CD2 LEU B 169 4.480 3.407 -3.673 1.00 0.00 C ATOM 0 H LEU B 169 0.175 2.584 -5.612 1.00 0.00 H new ATOM 0 HA LEU B 169 1.790 3.499 -3.301 1.00 0.00 H new ATOM 0 HB2 LEU B 169 2.800 2.761 -5.658 1.00 0.00 H new ATOM 0 HB3 LEU B 169 2.283 4.367 -6.132 1.00 0.00 H new ATOM 0 HG LEU B 169 4.596 4.455 -5.527 1.00 0.00 H new ATOM 0 HD11 LEU B 169 4.560 6.119 -3.710 1.00 0.00 H new ATOM 0 HD12 LEU B 169 3.246 6.389 -4.879 1.00 0.00 H new ATOM 0 HD13 LEU B 169 2.896 5.635 -3.306 1.00 0.00 H new ATOM 0 HD21 LEU B 169 5.400 3.839 -3.280 1.00 0.00 H new ATOM 0 HD22 LEU B 169 3.769 3.264 -2.859 1.00 0.00 H new ATOM 0 HD23 LEU B 169 4.700 2.445 -4.136 1.00 0.00 H new ATOM 1794 N VAL B 170 0.718 5.718 -3.214 1.00 0.00 N ATOM 1795 CA VAL B 170 0.020 6.993 -3.093 1.00 0.00 C ATOM 1796 C VAL B 170 0.987 8.116 -2.732 1.00 0.00 C ATOM 1797 O VAL B 170 1.564 8.127 -1.644 1.00 0.00 O ATOM 1798 CB VAL B 170 -1.092 6.925 -2.030 1.00 0.00 C ATOM 1799 CG1 VAL B 170 -1.966 8.170 -2.091 1.00 0.00 C ATOM 1800 CG2 VAL B 170 -1.927 5.668 -2.213 1.00 0.00 C ATOM 0 H VAL B 170 1.268 5.458 -2.395 1.00 0.00 H new ATOM 0 HA VAL B 170 -0.429 7.202 -4.064 1.00 0.00 H new ATOM 0 HB VAL B 170 -0.627 6.884 -1.045 1.00 0.00 H new ATOM 0 HG11 VAL B 170 -2.746 8.104 -1.333 1.00 0.00 H new ATOM 0 HG12 VAL B 170 -1.354 9.053 -1.907 1.00 0.00 H new ATOM 0 HG13 VAL B 170 -2.424 8.245 -3.077 1.00 0.00 H new ATOM 0 HG21 VAL B 170 -2.708 5.636 -1.453 1.00 0.00 H new ATOM 0 HG22 VAL B 170 -2.384 5.675 -3.203 1.00 0.00 H new ATOM 0 HG23 VAL B 170 -1.289 4.790 -2.114 1.00 0.00 H new ATOM 1810 N LEU B 171 1.158 9.060 -3.651 1.00 0.00 N ATOM 1811 CA LEU B 171 2.054 10.190 -3.430 1.00 0.00 C ATOM 1812 C LEU B 171 1.269 11.441 -3.052 1.00 0.00 C ATOM 1813 O LEU B 171 0.435 11.919 -3.821 1.00 0.00 O ATOM 1814 CB LEU B 171 2.889 10.457 -4.683 1.00 0.00 C ATOM 1815 CG LEU B 171 4.375 10.111 -4.586 1.00 0.00 C ATOM 1816 CD1 LEU B 171 4.673 8.820 -5.332 1.00 0.00 C ATOM 1817 CD2 LEU B 171 5.225 11.251 -5.129 1.00 0.00 C ATOM 0 H LEU B 171 0.688 9.065 -4.556 1.00 0.00 H new ATOM 0 HA LEU B 171 2.720 9.938 -2.605 1.00 0.00 H new ATOM 0 HB2 LEU B 171 2.458 9.892 -5.509 1.00 0.00 H new ATOM 0 HB3 LEU B 171 2.798 11.513 -4.937 1.00 0.00 H new ATOM 0 HG LEU B 171 4.626 9.965 -3.535 1.00 0.00 H new ATOM 0 HD11 LEU B 171 5.735 8.590 -5.252 1.00 0.00 H new ATOM 0 HD12 LEU B 171 4.092 8.006 -4.898 1.00 0.00 H new ATOM 0 HD13 LEU B 171 4.405 8.937 -6.382 1.00 0.00 H new ATOM 0 HD21 LEU B 171 6.280 10.987 -5.052 1.00 0.00 H new ATOM 0 HD22 LEU B 171 4.971 11.429 -6.174 1.00 0.00 H new ATOM 0 HD23 LEU B 171 5.034 12.155 -4.550 1.00 0.00 H new ATOM 1829 N ARG B 172 1.543 11.970 -1.863 1.00 0.00 N ATOM 1830 CA ARG B 172 0.864 13.167 -1.384 1.00 0.00 C ATOM 1831 C ARG B 172 1.825 14.351 -1.325 1.00 0.00 C ATOM 1832 O ARG B 172 2.563 14.518 -0.352 1.00 0.00 O ATOM 1833 CB ARG B 172 0.260 12.918 -0.001 1.00 0.00 C ATOM 1834 CG ARG B 172 -1.191 12.467 -0.042 1.00 0.00 C ATOM 1835 CD ARG B 172 -2.063 13.315 0.870 1.00 0.00 C ATOM 1836 NE ARG B 172 -1.961 14.737 0.559 1.00 0.00 N ATOM 1837 CZ ARG B 172 -2.452 15.697 1.336 1.00 0.00 C ATOM 1838 NH1 ARG B 172 -3.075 15.388 2.464 1.00 0.00 N ATOM 1839 NH2 ARG B 172 -2.320 16.970 0.984 1.00 0.00 N ATOM 0 H ARG B 172 2.231 11.588 -1.214 1.00 0.00 H new ATOM 0 HA ARG B 172 0.064 13.405 -2.085 1.00 0.00 H new ATOM 0 HB2 ARG B 172 0.852 12.162 0.514 1.00 0.00 H new ATOM 0 HB3 ARG B 172 0.331 13.833 0.587 1.00 0.00 H new ATOM 0 HG2 ARG B 172 -1.564 12.529 -1.064 1.00 0.00 H new ATOM 0 HG3 ARG B 172 -1.257 11.421 0.259 1.00 0.00 H new ATOM 0 HD2 ARG B 172 -3.101 12.997 0.776 1.00 0.00 H new ATOM 0 HD3 ARG B 172 -1.771 13.149 1.907 1.00 0.00 H new ATOM 0 HE ARG B 172 -1.487 15.009 -0.302 1.00 0.00 H new ATOM 0 HH11 ARG B 172 -3.179 14.411 2.738 1.00 0.00 H new ATOM 0 HH12 ARG B 172 -3.451 16.127 3.058 1.00 0.00 H new ATOM 0 HH21 ARG B 172 -1.841 17.212 0.116 1.00 0.00 H new ATOM 0 HH22 ARG B 172 -2.697 17.706 1.581 1.00 0.00 H new ATOM 1853 N LEU B 173 1.812 15.169 -2.371 1.00 0.00 N ATOM 1854 CA LEU B 173 2.683 16.338 -2.439 1.00 0.00 C ATOM 1855 C LEU B 173 2.054 17.528 -1.721 1.00 0.00 C ATOM 1856 O LEU B 173 0.834 17.700 -1.734 1.00 0.00 O ATOM 1857 CB LEU B 173 2.970 16.701 -3.897 1.00 0.00 C ATOM 1858 CG LEU B 173 3.597 15.599 -4.752 1.00 0.00 C ATOM 1859 CD1 LEU B 173 4.645 14.836 -3.956 1.00 0.00 C ATOM 1860 CD2 LEU B 173 2.524 14.651 -5.269 1.00 0.00 C ATOM 0 H LEU B 173 1.208 15.045 -3.184 1.00 0.00 H new ATOM 0 HA LEU B 173 3.621 16.091 -1.941 1.00 0.00 H new ATOM 0 HB2 LEU B 173 2.035 17.008 -4.365 1.00 0.00 H new ATOM 0 HB3 LEU B 173 3.633 17.566 -3.911 1.00 0.00 H new ATOM 0 HG LEU B 173 4.087 16.064 -5.607 1.00 0.00 H new ATOM 0 HD11 LEU B 173 5.080 14.056 -4.581 1.00 0.00 H new ATOM 0 HD12 LEU B 173 5.428 15.522 -3.634 1.00 0.00 H new ATOM 0 HD13 LEU B 173 4.179 14.382 -3.082 1.00 0.00 H new ATOM 0 HD21 LEU B 173 2.987 13.873 -5.876 1.00 0.00 H new ATOM 0 HD22 LEU B 173 2.006 14.194 -4.426 1.00 0.00 H new ATOM 0 HD23 LEU B 173 1.809 15.207 -5.876 1.00 0.00 H new ATOM 1872 N ARG B 174 2.893 18.349 -1.099 1.00 0.00 N ATOM 1873 CA ARG B 174 2.420 19.524 -0.377 1.00 0.00 C ATOM 1874 C ARG B 174 2.029 20.636 -1.346 1.00 0.00 C ATOM 1875 O ARG B 174 2.888 21.326 -1.894 1.00 0.00 O ATOM 1876 CB ARG B 174 3.497 20.026 0.586 1.00 0.00 C ATOM 1877 CG ARG B 174 2.938 20.696 1.830 1.00 0.00 C ATOM 1878 CD ARG B 174 2.330 22.052 1.506 1.00 0.00 C ATOM 1879 NE ARG B 174 3.312 22.972 0.940 1.00 0.00 N ATOM 1880 CZ ARG B 174 3.021 24.205 0.542 1.00 0.00 C ATOM 1881 NH1 ARG B 174 1.782 24.664 0.648 1.00 0.00 N ATOM 1882 NH2 ARG B 174 3.971 24.982 0.036 1.00 0.00 N ATOM 0 H ARG B 174 3.905 18.222 -1.080 1.00 0.00 H new ATOM 0 HA ARG B 174 1.538 19.237 0.195 1.00 0.00 H new ATOM 0 HB2 ARG B 174 4.124 19.186 0.887 1.00 0.00 H new ATOM 0 HB3 ARG B 174 4.141 20.732 0.062 1.00 0.00 H new ATOM 0 HG2 ARG B 174 2.181 20.055 2.281 1.00 0.00 H new ATOM 0 HG3 ARG B 174 3.732 20.818 2.567 1.00 0.00 H new ATOM 0 HD2 ARG B 174 1.508 21.922 0.802 1.00 0.00 H new ATOM 0 HD3 ARG B 174 1.908 22.486 2.413 1.00 0.00 H new ATOM 0 HE ARG B 174 4.275 22.650 0.845 1.00 0.00 H new ATOM 0 HH11 ARG B 174 1.049 24.070 1.036 1.00 0.00 H new ATOM 0 HH12 ARG B 174 1.561 25.611 0.342 1.00 0.00 H new ATOM 0 HH21 ARG B 174 4.925 24.632 -0.047 1.00 0.00 H new ATOM 0 HH22 ARG B 174 3.746 25.929 -0.269 1.00 0.00 H new ATOM 1896 N GLY B 175 0.727 20.804 -1.553 1.00 0.00 N ATOM 1897 CA GLY B 175 0.245 21.833 -2.455 1.00 0.00 C ATOM 1898 C GLY B 175 -1.087 21.477 -3.084 1.00 0.00 C ATOM 1899 O GLY B 175 -2.008 22.291 -3.107 1.00 0.00 O ATOM 0 H GLY B 175 -0.003 20.245 -1.112 1.00 0.00 H new ATOM 0 HA2 GLY B 175 0.146 22.772 -1.910 1.00 0.00 H new ATOM 0 HA3 GLY B 175 0.982 21.997 -3.241 1.00 0.00 H new ATOM 1903 N GLY B 176 -1.189 20.254 -3.598 1.00 0.00 N ATOM 1904 CA GLY B 176 -2.422 19.813 -4.224 1.00 0.00 C ATOM 1905 C GLY B 176 -3.484 19.435 -3.211 1.00 0.00 C ATOM 1906 O GLY B 176 -3.582 18.276 -2.808 1.00 0.00 O ATOM 0 H GLY B 176 -0.440 19.562 -3.592 1.00 0.00 H new ATOM 0 HA2 GLY B 176 -2.803 20.606 -4.867 1.00 0.00 H new ATOM 0 HA3 GLY B 176 -2.214 18.956 -4.865 1.00 0.00 H new TER 1910 GLY B 176 HETATM 1911 ZN ZN A 101 -13.164 6.802 -2.907 1.00 0.00 ZN