USER MOD reduce.3.24.130724 H: found=0, std=0, add=1738, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1732 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 74 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 79 HIS : no HD1:sc= -3.2! C(o=-3.2!,f=-3.7!) USER MOD Set 2.1: B 57 THR OG1 : rot 153:sc= -5.27! USER MOD Set 2.2: B 58 HIS : no HD1:sc= -9.9! C(o=-15!,f=-16!) USER MOD Set 3.1: B 33 GLN : amide:sc= -2.36! C(o=-5.6!,f=-5.7!) USER MOD Set 3.2: B 76 HIS : no HE2:sc= -3.23! C(o=-5.6!,f=-8.3!) USER MOD Set 4.1: A 33 GLN : amide:sc= -2.37! C(o=-5.6!,f=-5.7!) USER MOD Set 4.2: A 76 HIS : no HD1:sc= -3.25! C(o=-5.6!,f=-8.6!) USER MOD Set 5.1: A 74 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 79 HIS : no HD1:sc= -3.22! C(o=-3.2!,f=-3.8!) USER MOD Set 6.1: A 57 THR OG1 : rot 149:sc= -5.62! USER MOD Set 6.2: A 58 HIS : no HD1:sc= -9.59! C(o=-15!,f=-16!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -122:sc= 0.414 (180deg=-0.811) USER MOD Single : A 8 HIS : no HD1:sc= -0.0877 K(o=-0.088,f=-1.5) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot -96:sc= -2.59! USER MOD Single : A 19 LYS NZ :NH3+ 178:sc= 0.243 (180deg=0.242) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc= -0.305 F(o=-2.1,f=-0.31) USER MOD Single : A 32 SER OG : rot -160:sc= -1.36 USER MOD Single : A 36 THR OG1 : rot 180:sc= -1.59! USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 49:sc= -0.0171! USER MOD Single : A 46 LYS NZ :NH3+ -162:sc= -3.19! (180deg=-3.77!) USER MOD Single : A 48 SER OG : rot -133:sc= -0.0575! USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 51 MET CE :methyl 157:sc= 0 (180deg=-0.00594) USER MOD Single : A 54 GLN :FLIP amide:sc= -13.9! C(o=-17!,f=-14!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl -173:sc= 0 (180deg=-0.0319) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -1.97 K(o=-2,f=-6.9!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot -59:sc= -0.675! USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -107:sc= -3.68! (180deg=-8.05!) USER MOD Single : A 104 LYS NZ :NH3+ -132:sc= -0.931! (180deg=-4.57!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= -0.477 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 THR OG1 : rot 180:sc= 0 USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ -118:sc= 0.361 (180deg=-0.786) USER MOD Single : B 8 HIS : no HD1:sc= -0.0922 K(o=-0.092,f=-1.5) USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 THR OG1 : rot -94:sc= -2.52! USER MOD Single : B 19 LYS NZ :NH3+ 178:sc= 0.229 (180deg=0.227) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 ASN :FLIP amide:sc= -0.309 F(o=-2.1,f=-0.31) USER MOD Single : B 32 SER OG : rot -169:sc= -1.47 USER MOD Single : B 36 THR OG1 : rot 180:sc= -1.52! USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 SER OG : rot 47:sc= -0.029! USER MOD Single : B 46 LYS NZ :NH3+ -173:sc= -2.94! (180deg=-3.72!) USER MOD Single : B 48 SER OG : rot -133:sc= 0.218! USER MOD Single : B 49 HIS : no HD1:sc= 0 X(o=0,f=-0.081) USER MOD Single : B 51 MET CE :methyl 161:sc= 0 (180deg=-0.0105) USER MOD Single : B 54 GLN :FLIP amide:sc= -13.3! C(o=-17!,f=-13!) USER MOD Single : B 61 SER OG : rot 180:sc= 0 USER MOD Single : B 62 MET CE :methyl -173:sc= 0 (180deg=-0.0389) USER MOD Single : B 63 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -1.93 K(o=-1.9,f=-6.8!) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 TYR OH : rot 180:sc= 0 USER MOD Single : B 75 SER OG : rot -57:sc= -0.607! USER MOD Single : B 83 SER OG : rot 180:sc= 0 USER MOD Single : B 87 THR OG1 : rot 180:sc= 0 USER MOD Single : B 92 LYS NZ :NH3+ -100:sc= -3.77! (180deg=-8.04!) USER MOD Single : B 104 LYS NZ :NH3+ -137:sc= -1.01! (180deg=-4.82!) USER MOD Single : B 105 SER OG : rot 180:sc= 0 USER MOD Single : B 106 SER OG : rot 180:sc= 0 USER MOD Single : B 110 THR OG1 : rot 180:sc= -0.48 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.130 5.187 -20.664 1.00 0.00 N ATOM 2 CA MET A 1 -3.632 6.354 -21.442 1.00 0.00 C ATOM 3 C MET A 1 -2.534 6.849 -22.386 1.00 0.00 C ATOM 4 O MET A 1 -2.761 7.066 -23.559 1.00 0.00 O ATOM 5 CB MET A 1 -4.023 7.479 -20.480 1.00 0.00 C ATOM 6 CG MET A 1 -4.714 8.600 -21.258 1.00 0.00 C ATOM 7 SD MET A 1 -5.110 9.960 -20.133 1.00 0.00 S ATOM 8 CE MET A 1 -5.950 11.016 -21.339 1.00 0.00 C ATOM 0 H1 MET A 1 -3.876 4.851 -20.022 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.864 4.423 -21.317 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.298 5.472 -20.108 1.00 0.00 H new ATOM 0 HA MET A 1 -4.503 6.054 -22.024 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.688 7.095 -19.707 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.137 7.865 -19.976 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.066 8.954 -22.059 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.624 8.225 -21.726 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.285 11.931 -20.850 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.261 11.267 -22.145 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.811 10.487 -21.749 1.00 0.00 H new ATOM 17 N ALA A 2 -1.344 7.029 -21.883 1.00 0.00 N ATOM 18 CA ALA A 2 -0.233 7.514 -22.750 1.00 0.00 C ATOM 19 C ALA A 2 -0.736 8.666 -23.622 1.00 0.00 C ATOM 20 O ALA A 2 -0.783 8.569 -24.833 1.00 0.00 O ATOM 21 CB ALA A 2 0.250 6.372 -23.644 1.00 0.00 C ATOM 0 H ALA A 2 -1.093 6.861 -20.909 1.00 0.00 H new ATOM 0 HA ALA A 2 0.591 7.861 -22.127 1.00 0.00 H new ATOM 0 HB1 ALA A 2 1.063 6.726 -24.279 1.00 0.00 H new ATOM 0 HB2 ALA A 2 0.606 5.550 -23.023 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -0.574 6.025 -24.268 1.00 0.00 H new ATOM 27 N THR A 3 -1.113 9.759 -23.014 1.00 0.00 N ATOM 28 CA THR A 3 -1.617 10.917 -23.805 1.00 0.00 C ATOM 29 C THR A 3 -0.480 11.474 -24.659 1.00 0.00 C ATOM 30 O THR A 3 -0.638 11.742 -25.834 1.00 0.00 O ATOM 31 CB THR A 3 -2.107 12.005 -22.848 1.00 0.00 C ATOM 32 OG1 THR A 3 -2.675 13.070 -23.595 1.00 0.00 O ATOM 33 CG2 THR A 3 -0.932 12.529 -22.019 1.00 0.00 C ATOM 0 H THR A 3 -1.093 9.899 -22.004 1.00 0.00 H new ATOM 0 HA THR A 3 -2.437 10.596 -24.447 1.00 0.00 H new ATOM 0 HB THR A 3 -2.860 11.587 -22.180 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.991 13.767 -22.983 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.284 13.304 -21.338 1.00 0.00 H new ATOM 0 HG22 THR A 3 -0.499 11.711 -21.444 1.00 0.00 H new ATOM 0 HG23 THR A 3 -0.175 12.946 -22.683 1.00 0.00 H new ATOM 41 N SER A 4 0.669 11.637 -24.069 1.00 0.00 N ATOM 42 CA SER A 4 1.839 12.159 -24.825 1.00 0.00 C ATOM 43 C SER A 4 3.067 11.336 -24.460 1.00 0.00 C ATOM 44 O SER A 4 3.288 10.267 -24.992 1.00 0.00 O ATOM 45 CB SER A 4 2.093 13.615 -24.453 1.00 0.00 C ATOM 46 OG SER A 4 0.904 14.370 -24.637 1.00 0.00 O ATOM 0 H SER A 4 0.849 11.429 -23.087 1.00 0.00 H new ATOM 0 HA SER A 4 1.638 12.090 -25.894 1.00 0.00 H new ATOM 0 HB2 SER A 4 2.422 13.683 -23.416 1.00 0.00 H new ATOM 0 HB3 SER A 4 2.894 14.024 -25.069 1.00 0.00 H new ATOM 0 HG SER A 4 1.070 15.305 -24.396 1.00 0.00 H new ATOM 52 N GLY A 5 3.864 11.806 -23.549 1.00 0.00 N ATOM 53 CA GLY A 5 5.068 11.023 -23.158 1.00 0.00 C ATOM 54 C GLY A 5 4.698 10.018 -22.060 1.00 0.00 C ATOM 55 O GLY A 5 3.624 10.064 -21.494 1.00 0.00 O ATOM 0 H GLY A 5 3.738 12.692 -23.059 1.00 0.00 H new ATOM 0 HA2 GLY A 5 5.469 10.498 -24.025 1.00 0.00 H new ATOM 0 HA3 GLY A 5 5.850 11.694 -22.802 1.00 0.00 H new ATOM 59 N PHE A 6 5.590 9.121 -21.747 1.00 0.00 N ATOM 60 CA PHE A 6 5.306 8.129 -20.677 1.00 0.00 C ATOM 61 C PHE A 6 6.504 8.103 -19.726 1.00 0.00 C ATOM 62 O PHE A 6 7.640 8.053 -20.152 1.00 0.00 O ATOM 63 CB PHE A 6 5.090 6.751 -21.305 1.00 0.00 C ATOM 64 CG PHE A 6 4.063 5.990 -20.495 1.00 0.00 C ATOM 65 CD1 PHE A 6 4.296 5.719 -19.139 1.00 0.00 C ATOM 66 CD2 PHE A 6 2.878 5.551 -21.099 1.00 0.00 C ATOM 67 CE1 PHE A 6 3.346 5.011 -18.391 1.00 0.00 C ATOM 68 CE2 PHE A 6 1.929 4.843 -20.349 1.00 0.00 C ATOM 69 CZ PHE A 6 2.163 4.574 -18.996 1.00 0.00 C ATOM 0 H PHE A 6 6.506 9.033 -22.188 1.00 0.00 H new ATOM 0 HA PHE A 6 4.405 8.400 -20.127 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.752 6.857 -22.336 1.00 0.00 H new ATOM 0 HB3 PHE A 6 6.030 6.200 -21.333 1.00 0.00 H new ATOM 0 HD1 PHE A 6 5.209 6.056 -18.671 1.00 0.00 H new ATOM 0 HD2 PHE A 6 2.695 5.758 -22.143 1.00 0.00 H new ATOM 0 HE1 PHE A 6 3.527 4.803 -17.347 1.00 0.00 H new ATOM 0 HE2 PHE A 6 1.016 4.505 -20.816 1.00 0.00 H new ATOM 0 HZ PHE A 6 1.430 4.029 -18.419 1.00 0.00 H new ATOM 79 N LYS A 7 6.271 8.185 -18.443 1.00 0.00 N ATOM 80 CA LYS A 7 7.419 8.207 -17.488 1.00 0.00 C ATOM 81 C LYS A 7 7.679 6.849 -16.844 1.00 0.00 C ATOM 82 O LYS A 7 6.828 6.259 -16.208 1.00 0.00 O ATOM 83 CB LYS A 7 7.139 9.215 -16.367 1.00 0.00 C ATOM 84 CG LYS A 7 8.445 9.522 -15.624 1.00 0.00 C ATOM 85 CD LYS A 7 8.152 10.373 -14.383 1.00 0.00 C ATOM 86 CE LYS A 7 7.802 9.460 -13.204 1.00 0.00 C ATOM 87 NZ LYS A 7 7.578 10.285 -11.986 1.00 0.00 N ATOM 0 H LYS A 7 5.346 8.237 -18.017 1.00 0.00 H new ATOM 0 HA LYS A 7 8.299 8.486 -18.067 1.00 0.00 H new ATOM 0 HB2 LYS A 7 6.719 10.131 -16.783 1.00 0.00 H new ATOM 0 HB3 LYS A 7 6.400 8.811 -15.675 1.00 0.00 H new ATOM 0 HG2 LYS A 7 8.934 8.593 -15.331 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.133 10.050 -16.284 1.00 0.00 H new ATOM 0 HD2 LYS A 7 9.019 10.985 -14.137 1.00 0.00 H new ATOM 0 HD3 LYS A 7 7.327 11.056 -14.585 1.00 0.00 H new ATOM 0 HE2 LYS A 7 6.908 8.880 -13.433 1.00 0.00 H new ATOM 0 HE3 LYS A 7 8.608 8.748 -13.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 8.234 9.984 -11.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 7.744 11.287 -12.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 6.599 10.161 -11.658 1.00 0.00 H new ATOM 101 N HIS A 8 8.896 6.398 -16.966 1.00 0.00 N ATOM 102 CA HIS A 8 9.331 5.136 -16.317 1.00 0.00 C ATOM 103 C HIS A 8 10.472 5.520 -15.381 1.00 0.00 C ATOM 104 O HIS A 8 11.462 6.078 -15.808 1.00 0.00 O ATOM 105 CB HIS A 8 9.846 4.135 -17.354 1.00 0.00 C ATOM 106 CG HIS A 8 8.684 3.594 -18.149 1.00 0.00 C ATOM 107 ND1 HIS A 8 8.182 4.251 -19.265 1.00 0.00 N ATOM 108 CD2 HIS A 8 7.912 2.465 -18.001 1.00 0.00 C ATOM 109 CE1 HIS A 8 7.155 3.519 -19.740 1.00 0.00 C ATOM 110 NE2 HIS A 8 6.952 2.424 -19.006 1.00 0.00 N ATOM 0 H HIS A 8 9.625 6.867 -17.504 1.00 0.00 H new ATOM 0 HA HIS A 8 8.500 4.666 -15.791 1.00 0.00 H new ATOM 0 HB2 HIS A 8 10.562 4.619 -18.019 1.00 0.00 H new ATOM 0 HB3 HIS A 8 10.373 3.320 -16.858 1.00 0.00 H new ATOM 0 HD2 HIS A 8 8.033 1.725 -17.224 1.00 0.00 H new ATOM 0 HE1 HIS A 8 6.569 3.786 -20.607 1.00 0.00 H new ATOM 0 HE2 HIS A 8 6.241 1.707 -19.151 1.00 0.00 H new ATOM 119 N LEU A 9 10.353 5.258 -14.115 1.00 0.00 N ATOM 120 CA LEU A 9 11.456 5.636 -13.193 1.00 0.00 C ATOM 121 C LEU A 9 11.717 4.498 -12.222 1.00 0.00 C ATOM 122 O LEU A 9 10.812 3.815 -11.787 1.00 0.00 O ATOM 123 CB LEU A 9 11.082 6.904 -12.420 1.00 0.00 C ATOM 124 CG LEU A 9 12.296 7.393 -11.625 1.00 0.00 C ATOM 125 CD1 LEU A 9 12.364 8.920 -11.674 1.00 0.00 C ATOM 126 CD2 LEU A 9 12.169 6.938 -10.170 1.00 0.00 C ATOM 0 H LEU A 9 9.550 4.804 -13.680 1.00 0.00 H new ATOM 0 HA LEU A 9 12.358 5.831 -13.773 1.00 0.00 H new ATOM 0 HB2 LEU A 9 10.750 7.679 -13.111 1.00 0.00 H new ATOM 0 HB3 LEU A 9 10.250 6.700 -11.746 1.00 0.00 H new ATOM 0 HG LEU A 9 13.204 6.976 -12.062 1.00 0.00 H new ATOM 0 HD11 LEU A 9 13.229 9.264 -11.107 1.00 0.00 H new ATOM 0 HD12 LEU A 9 12.455 9.247 -12.710 1.00 0.00 H new ATOM 0 HD13 LEU A 9 11.456 9.339 -11.240 1.00 0.00 H new ATOM 0 HD21 LEU A 9 13.033 7.286 -9.603 1.00 0.00 H new ATOM 0 HD22 LEU A 9 11.259 7.354 -9.737 1.00 0.00 H new ATOM 0 HD23 LEU A 9 12.124 5.850 -10.132 1.00 0.00 H new ATOM 138 N VAL A 10 12.952 4.284 -11.888 1.00 0.00 N ATOM 139 CA VAL A 10 13.289 3.181 -10.959 1.00 0.00 C ATOM 140 C VAL A 10 14.164 3.719 -9.823 1.00 0.00 C ATOM 141 O VAL A 10 15.102 4.455 -10.049 1.00 0.00 O ATOM 142 CB VAL A 10 14.053 2.100 -11.731 1.00 0.00 C ATOM 143 CG1 VAL A 10 15.375 2.680 -12.239 1.00 0.00 C ATOM 144 CG2 VAL A 10 14.341 0.906 -10.817 1.00 0.00 C ATOM 0 H VAL A 10 13.747 4.829 -12.221 1.00 0.00 H new ATOM 0 HA VAL A 10 12.377 2.758 -10.538 1.00 0.00 H new ATOM 0 HB VAL A 10 13.447 1.766 -12.573 1.00 0.00 H new ATOM 0 HG11 VAL A 10 15.921 1.914 -12.789 1.00 0.00 H new ATOM 0 HG12 VAL A 10 15.173 3.524 -12.898 1.00 0.00 H new ATOM 0 HG13 VAL A 10 15.974 3.016 -11.393 1.00 0.00 H new ATOM 0 HG21 VAL A 10 14.884 0.143 -11.375 1.00 0.00 H new ATOM 0 HG22 VAL A 10 14.943 1.233 -9.970 1.00 0.00 H new ATOM 0 HG23 VAL A 10 13.401 0.490 -10.455 1.00 0.00 H new ATOM 154 N VAL A 11 13.884 3.330 -8.612 1.00 0.00 N ATOM 155 CA VAL A 11 14.718 3.792 -7.469 1.00 0.00 C ATOM 156 C VAL A 11 15.411 2.559 -6.924 1.00 0.00 C ATOM 157 O VAL A 11 14.775 1.558 -6.661 1.00 0.00 O ATOM 158 CB VAL A 11 13.853 4.433 -6.381 1.00 0.00 C ATOM 159 CG1 VAL A 11 14.614 5.613 -5.775 1.00 0.00 C ATOM 160 CG2 VAL A 11 12.540 4.934 -6.991 1.00 0.00 C ATOM 0 H VAL A 11 13.112 2.711 -8.364 1.00 0.00 H new ATOM 0 HA VAL A 11 15.434 4.547 -7.793 1.00 0.00 H new ATOM 0 HB VAL A 11 13.630 3.697 -5.609 1.00 0.00 H new ATOM 0 HG11 VAL A 11 14.007 6.077 -4.998 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.549 5.259 -5.341 1.00 0.00 H new ATOM 0 HG13 VAL A 11 14.830 6.345 -6.553 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.928 5.389 -6.213 1.00 0.00 H new ATOM 0 HG22 VAL A 11 12.756 5.674 -7.762 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.001 4.096 -7.433 1.00 0.00 H new ATOM 170 N VAL A 12 16.702 2.573 -6.797 1.00 0.00 N ATOM 171 CA VAL A 12 17.365 1.331 -6.330 1.00 0.00 C ATOM 172 C VAL A 12 18.473 1.591 -5.309 1.00 0.00 C ATOM 173 O VAL A 12 19.107 2.629 -5.286 1.00 0.00 O ATOM 174 CB VAL A 12 17.959 0.641 -7.547 1.00 0.00 C ATOM 175 CG1 VAL A 12 16.972 0.755 -8.711 1.00 0.00 C ATOM 176 CG2 VAL A 12 19.270 1.335 -7.928 1.00 0.00 C ATOM 0 H VAL A 12 17.314 3.366 -6.990 1.00 0.00 H new ATOM 0 HA VAL A 12 16.619 0.713 -5.830 1.00 0.00 H new ATOM 0 HB VAL A 12 18.151 -0.408 -7.324 1.00 0.00 H new ATOM 0 HG11 VAL A 12 17.388 0.263 -9.590 1.00 0.00 H new ATOM 0 HG12 VAL A 12 16.031 0.277 -8.439 1.00 0.00 H new ATOM 0 HG13 VAL A 12 16.793 1.807 -8.934 1.00 0.00 H new ATOM 0 HG21 VAL A 12 19.701 0.844 -8.801 1.00 0.00 H new ATOM 0 HG22 VAL A 12 19.073 2.382 -8.160 1.00 0.00 H new ATOM 0 HG23 VAL A 12 19.970 1.274 -7.095 1.00 0.00 H new ATOM 186 N LYS A 13 18.721 0.603 -4.491 1.00 0.00 N ATOM 187 CA LYS A 13 19.794 0.694 -3.470 1.00 0.00 C ATOM 188 C LYS A 13 20.694 -0.530 -3.660 1.00 0.00 C ATOM 189 O LYS A 13 20.269 -1.534 -4.198 1.00 0.00 O ATOM 190 CB LYS A 13 19.176 0.697 -2.067 1.00 0.00 C ATOM 191 CG LYS A 13 18.661 2.104 -1.744 1.00 0.00 C ATOM 192 CD LYS A 13 18.068 2.121 -0.333 1.00 0.00 C ATOM 193 CE LYS A 13 19.190 2.290 0.691 1.00 0.00 C ATOM 194 NZ LYS A 13 18.602 2.470 2.049 1.00 0.00 N ATOM 0 H LYS A 13 18.211 -0.280 -4.491 1.00 0.00 H new ATOM 0 HA LYS A 13 20.370 1.613 -3.580 1.00 0.00 H new ATOM 0 HB2 LYS A 13 18.359 -0.023 -2.015 1.00 0.00 H new ATOM 0 HB3 LYS A 13 19.918 0.390 -1.330 1.00 0.00 H new ATOM 0 HG2 LYS A 13 19.475 2.826 -1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 13 17.905 2.402 -2.471 1.00 0.00 H new ATOM 0 HD2 LYS A 13 17.350 2.936 -0.239 1.00 0.00 H new ATOM 0 HD3 LYS A 13 17.526 1.195 -0.144 1.00 0.00 H new ATOM 0 HE2 LYS A 13 19.842 1.417 0.679 1.00 0.00 H new ATOM 0 HE3 LYS A 13 19.806 3.152 0.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 19.366 2.585 2.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 17.997 3.316 2.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 18.033 1.635 2.294 1.00 0.00 H new ATOM 208 N PHE A 14 21.934 -0.458 -3.265 1.00 0.00 N ATOM 209 CA PHE A 14 22.848 -1.622 -3.477 1.00 0.00 C ATOM 210 C PHE A 14 23.232 -2.291 -2.147 1.00 0.00 C ATOM 211 O PHE A 14 23.281 -1.659 -1.111 1.00 0.00 O ATOM 212 CB PHE A 14 24.111 -1.120 -4.171 1.00 0.00 C ATOM 213 CG PHE A 14 24.956 -0.350 -3.185 1.00 0.00 C ATOM 214 CD1 PHE A 14 25.770 -1.034 -2.272 1.00 0.00 C ATOM 215 CD2 PHE A 14 24.924 1.049 -3.182 1.00 0.00 C ATOM 216 CE1 PHE A 14 26.552 -0.318 -1.357 1.00 0.00 C ATOM 217 CE2 PHE A 14 25.707 1.764 -2.268 1.00 0.00 C ATOM 218 CZ PHE A 14 26.521 1.081 -1.357 1.00 0.00 C ATOM 0 H PHE A 14 22.355 0.350 -2.807 1.00 0.00 H new ATOM 0 HA PHE A 14 22.333 -2.365 -4.087 1.00 0.00 H new ATOM 0 HB2 PHE A 14 24.677 -1.961 -4.572 1.00 0.00 H new ATOM 0 HB3 PHE A 14 23.846 -0.483 -5.015 1.00 0.00 H new ATOM 0 HD1 PHE A 14 25.794 -2.114 -2.274 1.00 0.00 H new ATOM 0 HD2 PHE A 14 24.296 1.577 -3.884 1.00 0.00 H new ATOM 0 HE1 PHE A 14 27.178 -0.845 -0.652 1.00 0.00 H new ATOM 0 HE2 PHE A 14 25.683 2.844 -2.266 1.00 0.00 H new ATOM 0 HZ PHE A 14 27.126 1.634 -0.654 1.00 0.00 H new ATOM 228 N LYS A 15 23.534 -3.568 -2.188 1.00 0.00 N ATOM 229 CA LYS A 15 23.963 -4.286 -0.949 1.00 0.00 C ATOM 230 C LYS A 15 25.277 -5.015 -1.241 1.00 0.00 C ATOM 231 O LYS A 15 26.019 -5.364 -0.343 1.00 0.00 O ATOM 232 CB LYS A 15 22.892 -5.293 -0.518 1.00 0.00 C ATOM 233 CG LYS A 15 22.730 -6.369 -1.591 1.00 0.00 C ATOM 234 CD LYS A 15 21.571 -7.295 -1.215 1.00 0.00 C ATOM 235 CE LYS A 15 21.585 -8.520 -2.130 1.00 0.00 C ATOM 236 NZ LYS A 15 20.287 -9.244 -2.018 1.00 0.00 N ATOM 0 H LYS A 15 23.501 -4.143 -3.030 1.00 0.00 H new ATOM 0 HA LYS A 15 24.103 -3.570 -0.139 1.00 0.00 H new ATOM 0 HB2 LYS A 15 23.172 -5.752 0.430 1.00 0.00 H new ATOM 0 HB3 LYS A 15 21.943 -4.782 -0.357 1.00 0.00 H new ATOM 0 HG2 LYS A 15 22.540 -5.906 -2.559 1.00 0.00 H new ATOM 0 HG3 LYS A 15 23.652 -6.943 -1.687 1.00 0.00 H new ATOM 0 HD2 LYS A 15 21.660 -7.604 -0.173 1.00 0.00 H new ATOM 0 HD3 LYS A 15 20.623 -6.766 -1.310 1.00 0.00 H new ATOM 0 HE2 LYS A 15 21.754 -8.213 -3.162 1.00 0.00 H new ATOM 0 HE3 LYS A 15 22.407 -9.182 -1.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 20.299 -10.077 -2.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 20.144 -9.550 -1.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 19.511 -8.611 -2.300 1.00 0.00 H new ATOM 250 N GLU A 16 25.585 -5.215 -2.494 1.00 0.00 N ATOM 251 CA GLU A 16 26.872 -5.871 -2.855 1.00 0.00 C ATOM 252 C GLU A 16 27.911 -4.759 -3.024 1.00 0.00 C ATOM 253 O GLU A 16 28.936 -4.730 -2.374 1.00 0.00 O ATOM 254 CB GLU A 16 26.715 -6.633 -4.183 1.00 0.00 C ATOM 255 CG GLU A 16 25.689 -7.760 -4.026 1.00 0.00 C ATOM 256 CD GLU A 16 25.588 -8.552 -5.333 1.00 0.00 C ATOM 257 OE1 GLU A 16 26.186 -8.127 -6.309 1.00 0.00 O ATOM 258 OE2 GLU A 16 24.915 -9.570 -5.339 1.00 0.00 O ATOM 0 H GLU A 16 24.998 -4.951 -3.285 1.00 0.00 H new ATOM 0 HA GLU A 16 27.176 -6.579 -2.084 1.00 0.00 H new ATOM 0 HB2 GLU A 16 26.397 -5.948 -4.969 1.00 0.00 H new ATOM 0 HB3 GLU A 16 27.676 -7.046 -4.490 1.00 0.00 H new ATOM 0 HG2 GLU A 16 25.983 -8.421 -3.211 1.00 0.00 H new ATOM 0 HG3 GLU A 16 24.716 -7.345 -3.765 1.00 0.00 H new ATOM 265 N ASP A 17 27.615 -3.838 -3.899 1.00 0.00 N ATOM 266 CA ASP A 17 28.503 -2.671 -4.157 1.00 0.00 C ATOM 267 C ASP A 17 28.238 -2.231 -5.593 1.00 0.00 C ATOM 268 O ASP A 17 29.110 -2.251 -6.438 1.00 0.00 O ATOM 269 CB ASP A 17 29.973 -3.060 -3.992 1.00 0.00 C ATOM 270 CG ASP A 17 30.214 -4.434 -4.624 1.00 0.00 C ATOM 271 OD1 ASP A 17 29.338 -4.900 -5.334 1.00 0.00 O ATOM 272 OD2 ASP A 17 31.273 -4.994 -4.389 1.00 0.00 O ATOM 0 H ASP A 17 26.766 -3.848 -4.464 1.00 0.00 H new ATOM 0 HA ASP A 17 28.298 -1.868 -3.449 1.00 0.00 H new ATOM 0 HB2 ASP A 17 30.612 -2.314 -4.464 1.00 0.00 H new ATOM 0 HB3 ASP A 17 30.237 -3.083 -2.935 1.00 0.00 H new ATOM 277 N THR A 18 27.013 -1.890 -5.884 1.00 0.00 N ATOM 278 CA THR A 18 26.645 -1.515 -7.278 1.00 0.00 C ATOM 279 C THR A 18 27.628 -0.532 -7.905 1.00 0.00 C ATOM 280 O THR A 18 27.642 0.647 -7.605 1.00 0.00 O ATOM 281 CB THR A 18 25.253 -0.889 -7.311 1.00 0.00 C ATOM 282 OG1 THR A 18 24.315 -1.795 -6.754 1.00 0.00 O ATOM 283 CG2 THR A 18 24.884 -0.593 -8.764 1.00 0.00 C ATOM 0 H THR A 18 26.247 -1.855 -5.212 1.00 0.00 H new ATOM 0 HA THR A 18 26.668 -2.439 -7.857 1.00 0.00 H new ATOM 0 HB THR A 18 25.243 0.034 -6.732 1.00 0.00 H new ATOM 0 HG1 THR A 18 23.880 -2.298 -7.473 1.00 0.00 H new ATOM 0 HG21 THR A 18 23.891 -0.145 -8.803 1.00 0.00 H new ATOM 0 HG22 THR A 18 25.611 0.098 -9.190 1.00 0.00 H new ATOM 0 HG23 THR A 18 24.886 -1.521 -9.336 1.00 0.00 H new ATOM 291 N LYS A 19 28.406 -1.013 -8.829 1.00 0.00 N ATOM 292 CA LYS A 19 29.334 -0.129 -9.566 1.00 0.00 C ATOM 293 C LYS A 19 28.469 0.644 -10.554 1.00 0.00 C ATOM 294 O LYS A 19 28.255 0.222 -11.670 1.00 0.00 O ATOM 295 CB LYS A 19 30.364 -0.976 -10.319 1.00 0.00 C ATOM 296 CG LYS A 19 29.756 -2.345 -10.641 1.00 0.00 C ATOM 297 CD LYS A 19 29.995 -3.302 -9.468 1.00 0.00 C ATOM 298 CE LYS A 19 28.945 -4.419 -9.492 1.00 0.00 C ATOM 299 NZ LYS A 19 29.176 -5.350 -8.350 1.00 0.00 N ATOM 0 H LYS A 19 28.436 -1.994 -9.106 1.00 0.00 H new ATOM 0 HA LYS A 19 29.877 0.540 -8.899 1.00 0.00 H new ATOM 0 HB2 LYS A 19 30.663 -0.473 -11.238 1.00 0.00 H new ATOM 0 HB3 LYS A 19 31.263 -1.098 -9.715 1.00 0.00 H new ATOM 0 HG2 LYS A 19 28.687 -2.244 -10.829 1.00 0.00 H new ATOM 0 HG3 LYS A 19 30.203 -2.748 -11.550 1.00 0.00 H new ATOM 0 HD2 LYS A 19 30.996 -3.729 -9.532 1.00 0.00 H new ATOM 0 HD3 LYS A 19 29.940 -2.758 -8.525 1.00 0.00 H new ATOM 0 HE2 LYS A 19 27.944 -3.992 -9.429 1.00 0.00 H new ATOM 0 HE3 LYS A 19 29.001 -4.963 -10.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 28.442 -6.087 -8.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 30.112 -5.793 -8.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 29.135 -4.820 -7.456 1.00 0.00 H new ATOM 313 N VAL A 20 27.932 1.753 -10.130 1.00 0.00 N ATOM 314 CA VAL A 20 27.016 2.534 -11.011 1.00 0.00 C ATOM 315 C VAL A 20 27.724 2.923 -12.311 1.00 0.00 C ATOM 316 O VAL A 20 27.122 2.987 -13.364 1.00 0.00 O ATOM 317 CB VAL A 20 26.592 3.802 -10.281 1.00 0.00 C ATOM 318 CG1 VAL A 20 25.692 3.435 -9.098 1.00 0.00 C ATOM 319 CG2 VAL A 20 27.838 4.527 -9.765 1.00 0.00 C ATOM 0 H VAL A 20 28.088 2.156 -9.206 1.00 0.00 H new ATOM 0 HA VAL A 20 26.147 1.921 -11.251 1.00 0.00 H new ATOM 0 HB VAL A 20 26.045 4.451 -10.965 1.00 0.00 H new ATOM 0 HG11 VAL A 20 25.389 4.343 -8.576 1.00 0.00 H new ATOM 0 HG12 VAL A 20 24.807 2.913 -9.462 1.00 0.00 H new ATOM 0 HG13 VAL A 20 26.238 2.787 -8.412 1.00 0.00 H new ATOM 0 HG21 VAL A 20 27.540 5.435 -9.242 1.00 0.00 H new ATOM 0 HG22 VAL A 20 28.381 3.875 -9.080 1.00 0.00 H new ATOM 0 HG23 VAL A 20 28.482 4.787 -10.605 1.00 0.00 H new ATOM 329 N ASP A 21 28.993 3.195 -12.238 1.00 0.00 N ATOM 330 CA ASP A 21 29.752 3.577 -13.462 1.00 0.00 C ATOM 331 C ASP A 21 29.833 2.396 -14.437 1.00 0.00 C ATOM 332 O ASP A 21 29.694 2.567 -15.632 1.00 0.00 O ATOM 333 CB ASP A 21 31.154 4.012 -13.057 1.00 0.00 C ATOM 334 CG ASP A 21 31.889 2.816 -12.447 1.00 0.00 C ATOM 335 OD1 ASP A 21 31.219 1.912 -11.971 1.00 0.00 O ATOM 336 OD2 ASP A 21 33.109 2.816 -12.473 1.00 0.00 O ATOM 0 H ASP A 21 29.543 3.170 -11.379 1.00 0.00 H new ATOM 0 HA ASP A 21 29.238 4.398 -13.962 1.00 0.00 H new ATOM 0 HB2 ASP A 21 31.698 4.386 -13.925 1.00 0.00 H new ATOM 0 HB3 ASP A 21 31.102 4.829 -12.337 1.00 0.00 H new ATOM 341 N GLU A 22 30.037 1.200 -13.952 1.00 0.00 N ATOM 342 CA GLU A 22 30.073 0.035 -14.880 1.00 0.00 C ATOM 343 C GLU A 22 28.661 -0.150 -15.421 1.00 0.00 C ATOM 344 O GLU A 22 28.450 -0.510 -16.563 1.00 0.00 O ATOM 345 CB GLU A 22 30.511 -1.222 -14.131 1.00 0.00 C ATOM 346 CG GLU A 22 31.992 -1.108 -13.779 1.00 0.00 C ATOM 347 CD GLU A 22 32.486 -2.438 -13.207 1.00 0.00 C ATOM 348 OE1 GLU A 22 31.709 -3.379 -13.197 1.00 0.00 O ATOM 349 OE2 GLU A 22 33.631 -2.493 -12.791 1.00 0.00 O ATOM 0 H GLU A 22 30.179 0.982 -12.966 1.00 0.00 H new ATOM 0 HA GLU A 22 30.782 0.208 -15.689 1.00 0.00 H new ATOM 0 HB2 GLU A 22 29.918 -1.344 -13.225 1.00 0.00 H new ATOM 0 HB3 GLU A 22 30.338 -2.105 -14.746 1.00 0.00 H new ATOM 0 HG2 GLU A 22 32.568 -0.846 -14.666 1.00 0.00 H new ATOM 0 HG3 GLU A 22 32.143 -0.309 -13.053 1.00 0.00 H new ATOM 356 N ILE A 23 27.696 0.149 -14.606 1.00 0.00 N ATOM 357 CA ILE A 23 26.288 0.084 -15.051 1.00 0.00 C ATOM 358 C ILE A 23 26.132 1.130 -16.150 1.00 0.00 C ATOM 359 O ILE A 23 25.558 0.889 -17.194 1.00 0.00 O ATOM 360 CB ILE A 23 25.396 0.425 -13.853 1.00 0.00 C ATOM 361 CG1 ILE A 23 24.948 -0.871 -13.175 1.00 0.00 C ATOM 362 CG2 ILE A 23 24.174 1.223 -14.308 1.00 0.00 C ATOM 363 CD1 ILE A 23 26.152 -1.793 -12.983 1.00 0.00 C ATOM 0 H ILE A 23 27.827 0.440 -13.637 1.00 0.00 H new ATOM 0 HA ILE A 23 26.011 -0.901 -15.426 1.00 0.00 H new ATOM 0 HB ILE A 23 25.962 1.033 -13.147 1.00 0.00 H new ATOM 0 HG12 ILE A 23 24.490 -0.649 -12.211 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.190 -1.367 -13.781 1.00 0.00 H new ATOM 0 HG21 ILE A 23 23.551 1.457 -13.445 1.00 0.00 H new ATOM 0 HG22 ILE A 23 24.500 2.149 -14.782 1.00 0.00 H new ATOM 0 HG23 ILE A 23 23.599 0.633 -15.021 1.00 0.00 H new ATOM 0 HD11 ILE A 23 25.830 -2.716 -12.500 1.00 0.00 H new ATOM 0 HD12 ILE A 23 26.591 -2.025 -13.953 1.00 0.00 H new ATOM 0 HD13 ILE A 23 26.895 -1.296 -12.359 1.00 0.00 H new ATOM 375 N LEU A 24 26.684 2.288 -15.913 1.00 0.00 N ATOM 376 CA LEU A 24 26.639 3.379 -16.919 1.00 0.00 C ATOM 377 C LEU A 24 27.204 2.858 -18.242 1.00 0.00 C ATOM 378 O LEU A 24 26.745 3.224 -19.306 1.00 0.00 O ATOM 379 CB LEU A 24 27.492 4.537 -16.404 1.00 0.00 C ATOM 380 CG LEU A 24 27.107 5.831 -17.115 1.00 0.00 C ATOM 381 CD1 LEU A 24 25.921 6.476 -16.395 1.00 0.00 C ATOM 382 CD2 LEU A 24 28.302 6.786 -17.087 1.00 0.00 C ATOM 0 H LEU A 24 27.172 2.525 -15.049 1.00 0.00 H new ATOM 0 HA LEU A 24 25.616 3.718 -17.079 1.00 0.00 H new ATOM 0 HB2 LEU A 24 27.355 4.649 -15.329 1.00 0.00 H new ATOM 0 HB3 LEU A 24 28.548 4.323 -16.570 1.00 0.00 H new ATOM 0 HG LEU A 24 26.828 5.617 -18.147 1.00 0.00 H new ATOM 0 HD11 LEU A 24 25.646 7.400 -16.903 1.00 0.00 H new ATOM 0 HD12 LEU A 24 25.073 5.791 -16.404 1.00 0.00 H new ATOM 0 HD13 LEU A 24 26.198 6.697 -15.364 1.00 0.00 H new ATOM 0 HD21 LEU A 24 28.038 7.715 -17.593 1.00 0.00 H new ATOM 0 HD22 LEU A 24 28.572 7.000 -16.053 1.00 0.00 H new ATOM 0 HD23 LEU A 24 29.149 6.324 -17.595 1.00 0.00 H new ATOM 394 N LYS A 25 28.185 1.989 -18.194 1.00 0.00 N ATOM 395 CA LYS A 25 28.736 1.441 -19.466 1.00 0.00 C ATOM 396 C LYS A 25 27.602 0.703 -20.169 1.00 0.00 C ATOM 397 O LYS A 25 27.495 0.707 -21.379 1.00 0.00 O ATOM 398 CB LYS A 25 29.885 0.468 -19.181 1.00 0.00 C ATOM 399 CG LYS A 25 30.451 -0.050 -20.509 1.00 0.00 C ATOM 400 CD LYS A 25 30.564 -1.576 -20.464 1.00 0.00 C ATOM 401 CE LYS A 25 29.166 -2.195 -20.499 1.00 0.00 C ATOM 402 NZ LYS A 25 29.234 -3.547 -21.124 1.00 0.00 N ATOM 0 H LYS A 25 28.621 1.641 -17.340 1.00 0.00 H new ATOM 0 HA LYS A 25 29.126 2.248 -20.087 1.00 0.00 H new ATOM 0 HB2 LYS A 25 30.667 0.968 -18.609 1.00 0.00 H new ATOM 0 HB3 LYS A 25 29.530 -0.365 -18.574 1.00 0.00 H new ATOM 0 HG2 LYS A 25 29.804 0.252 -21.333 1.00 0.00 H new ATOM 0 HG3 LYS A 25 31.430 0.391 -20.694 1.00 0.00 H new ATOM 0 HD2 LYS A 25 31.152 -1.932 -21.310 1.00 0.00 H new ATOM 0 HD3 LYS A 25 31.087 -1.886 -19.559 1.00 0.00 H new ATOM 0 HE2 LYS A 25 28.765 -2.270 -19.488 1.00 0.00 H new ATOM 0 HE3 LYS A 25 28.488 -1.555 -21.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 28.283 -3.967 -21.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 29.599 -3.463 -22.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 29.867 -4.155 -20.567 1.00 0.00 H new ATOM 416 N GLY A 26 26.739 0.091 -19.404 1.00 0.00 N ATOM 417 CA GLY A 26 25.586 -0.620 -20.012 1.00 0.00 C ATOM 418 C GLY A 26 24.518 0.417 -20.347 1.00 0.00 C ATOM 419 O GLY A 26 23.947 0.415 -21.420 1.00 0.00 O ATOM 0 H GLY A 26 26.785 0.054 -18.386 1.00 0.00 H new ATOM 0 HA2 GLY A 26 25.897 -1.151 -20.911 1.00 0.00 H new ATOM 0 HA3 GLY A 26 25.191 -1.365 -19.322 1.00 0.00 H new ATOM 423 N LEU A 27 24.257 1.317 -19.435 1.00 0.00 N ATOM 424 CA LEU A 27 23.234 2.367 -19.688 1.00 0.00 C ATOM 425 C LEU A 27 23.612 3.128 -20.963 1.00 0.00 C ATOM 426 O LEU A 27 22.858 3.165 -21.917 1.00 0.00 O ATOM 427 CB LEU A 27 23.186 3.328 -18.494 1.00 0.00 C ATOM 428 CG LEU A 27 21.796 3.962 -18.390 1.00 0.00 C ATOM 429 CD1 LEU A 27 21.422 4.593 -19.736 1.00 0.00 C ATOM 430 CD2 LEU A 27 20.770 2.883 -18.037 1.00 0.00 C ATOM 0 H LEU A 27 24.712 1.368 -18.523 1.00 0.00 H new ATOM 0 HA LEU A 27 22.251 1.913 -19.815 1.00 0.00 H new ATOM 0 HB2 LEU A 27 23.420 2.791 -17.575 1.00 0.00 H new ATOM 0 HB3 LEU A 27 23.942 4.105 -18.611 1.00 0.00 H new ATOM 0 HG LEU A 27 21.803 4.728 -17.615 1.00 0.00 H new ATOM 0 HD11 LEU A 27 20.433 5.045 -19.664 1.00 0.00 H new ATOM 0 HD12 LEU A 27 22.153 5.359 -19.994 1.00 0.00 H new ATOM 0 HD13 LEU A 27 21.414 3.824 -20.509 1.00 0.00 H new ATOM 0 HD21 LEU A 27 19.780 3.333 -17.963 1.00 0.00 H new ATOM 0 HD22 LEU A 27 20.764 2.119 -18.814 1.00 0.00 H new ATOM 0 HD23 LEU A 27 21.034 2.428 -17.083 1.00 0.00 H new ATOM 442 N GLU A 28 24.780 3.718 -21.004 1.00 0.00 N ATOM 443 CA GLU A 28 25.177 4.472 -22.227 1.00 0.00 C ATOM 444 C GLU A 28 25.071 3.512 -23.407 1.00 0.00 C ATOM 445 O GLU A 28 24.588 3.856 -24.468 1.00 0.00 O ATOM 446 CB GLU A 28 26.618 4.976 -22.096 1.00 0.00 C ATOM 447 CG GLU A 28 27.568 3.785 -21.924 1.00 0.00 C ATOM 448 CD GLU A 28 28.120 3.373 -23.291 1.00 0.00 C ATOM 449 OE1 GLU A 28 27.511 3.729 -24.287 1.00 0.00 O ATOM 450 OE2 GLU A 28 29.141 2.707 -23.319 1.00 0.00 O ATOM 0 H GLU A 28 25.468 3.710 -20.251 1.00 0.00 H new ATOM 0 HA GLU A 28 24.529 5.337 -22.369 1.00 0.00 H new ATOM 0 HB2 GLU A 28 26.895 5.550 -22.981 1.00 0.00 H new ATOM 0 HB3 GLU A 28 26.702 5.647 -21.241 1.00 0.00 H new ATOM 0 HG2 GLU A 28 28.386 4.052 -21.255 1.00 0.00 H new ATOM 0 HG3 GLU A 28 27.041 2.948 -21.465 1.00 0.00 H new ATOM 457 N ASN A 29 25.490 2.292 -23.209 1.00 0.00 N ATOM 458 CA ASN A 29 25.371 1.276 -24.285 1.00 0.00 C ATOM 459 C ASN A 29 23.882 1.110 -24.607 1.00 0.00 C ATOM 460 O ASN A 29 23.475 1.102 -25.752 1.00 0.00 O ATOM 461 CB ASN A 29 25.973 -0.042 -23.777 1.00 0.00 C ATOM 462 CG ASN A 29 25.800 -1.145 -24.820 1.00 0.00 C ATOM 463 OD1 ASN A 29 25.172 -2.240 -24.487 1.00 0.00 O flip ATOM 464 ND2 ASN A 29 26.247 -1.017 -25.942 1.00 0.00 N flip ATOM 0 H ASN A 29 25.911 1.957 -22.343 1.00 0.00 H new ATOM 0 HA ASN A 29 25.904 1.577 -25.187 1.00 0.00 H new ATOM 0 HB2 ASN A 29 27.032 0.096 -23.557 1.00 0.00 H new ATOM 0 HB3 ASN A 29 25.489 -0.335 -22.845 1.00 0.00 H new ATOM 0 HD21 ASN A 29 26.737 -0.161 -26.201 1.00 0.00 H new ATOM 0 HD22 ASN A 29 26.132 -1.766 -26.625 1.00 0.00 H new ATOM 471 N LEU A 30 23.066 1.008 -23.587 1.00 0.00 N ATOM 472 CA LEU A 30 21.593 0.869 -23.796 1.00 0.00 C ATOM 473 C LEU A 30 21.117 2.020 -24.684 1.00 0.00 C ATOM 474 O LEU A 30 20.379 1.827 -25.631 1.00 0.00 O ATOM 475 CB LEU A 30 20.897 0.944 -22.432 1.00 0.00 C ATOM 476 CG LEU A 30 19.422 0.527 -22.537 1.00 0.00 C ATOM 477 CD1 LEU A 30 18.634 1.576 -23.323 1.00 0.00 C ATOM 478 CD2 LEU A 30 19.310 -0.828 -23.238 1.00 0.00 C ATOM 0 H LEU A 30 23.361 1.015 -22.611 1.00 0.00 H new ATOM 0 HA LEU A 30 21.358 -0.082 -24.274 1.00 0.00 H new ATOM 0 HB2 LEU A 30 21.411 0.296 -21.722 1.00 0.00 H new ATOM 0 HB3 LEU A 30 20.964 1.960 -22.042 1.00 0.00 H new ATOM 0 HG LEU A 30 19.009 0.447 -21.532 1.00 0.00 H new ATOM 0 HD11 LEU A 30 17.590 1.271 -23.392 1.00 0.00 H new ATOM 0 HD12 LEU A 30 18.698 2.537 -22.813 1.00 0.00 H new ATOM 0 HD13 LEU A 30 19.051 1.669 -24.326 1.00 0.00 H new ATOM 0 HD21 LEU A 30 18.261 -1.116 -23.308 1.00 0.00 H new ATOM 0 HD22 LEU A 30 19.734 -0.756 -24.239 1.00 0.00 H new ATOM 0 HD23 LEU A 30 19.855 -1.579 -22.667 1.00 0.00 H new ATOM 490 N VAL A 31 21.545 3.224 -24.389 1.00 0.00 N ATOM 491 CA VAL A 31 21.133 4.393 -25.224 1.00 0.00 C ATOM 492 C VAL A 31 21.515 4.120 -26.676 1.00 0.00 C ATOM 493 O VAL A 31 20.828 4.512 -27.598 1.00 0.00 O ATOM 494 CB VAL A 31 21.848 5.655 -24.737 1.00 0.00 C ATOM 495 CG1 VAL A 31 21.407 6.856 -25.578 1.00 0.00 C ATOM 496 CG2 VAL A 31 21.486 5.899 -23.272 1.00 0.00 C ATOM 0 H VAL A 31 22.161 3.446 -23.607 1.00 0.00 H new ATOM 0 HA VAL A 31 20.056 4.541 -25.143 1.00 0.00 H new ATOM 0 HB VAL A 31 22.926 5.525 -24.836 1.00 0.00 H new ATOM 0 HG11 VAL A 31 21.918 7.753 -25.228 1.00 0.00 H new ATOM 0 HG12 VAL A 31 21.658 6.680 -26.624 1.00 0.00 H new ATOM 0 HG13 VAL A 31 20.330 6.992 -25.482 1.00 0.00 H new ATOM 0 HG21 VAL A 31 21.992 6.797 -22.917 1.00 0.00 H new ATOM 0 HG22 VAL A 31 20.408 6.030 -23.181 1.00 0.00 H new ATOM 0 HG23 VAL A 31 21.800 5.045 -22.672 1.00 0.00 H new ATOM 506 N SER A 32 22.603 3.432 -26.883 1.00 0.00 N ATOM 507 CA SER A 32 23.015 3.105 -28.270 1.00 0.00 C ATOM 508 C SER A 32 21.790 2.611 -29.040 1.00 0.00 C ATOM 509 O SER A 32 21.608 2.917 -30.201 1.00 0.00 O ATOM 510 CB SER A 32 24.075 2.001 -28.232 1.00 0.00 C ATOM 511 OG SER A 32 25.032 2.298 -27.224 1.00 0.00 O ATOM 0 H SER A 32 23.222 3.084 -26.151 1.00 0.00 H new ATOM 0 HA SER A 32 23.429 3.987 -28.759 1.00 0.00 H new ATOM 0 HB2 SER A 32 23.606 1.038 -28.031 1.00 0.00 H new ATOM 0 HB3 SER A 32 24.566 1.920 -29.202 1.00 0.00 H new ATOM 0 HG SER A 32 25.856 1.796 -27.397 1.00 0.00 H new ATOM 517 N GLN A 33 20.959 1.831 -28.403 1.00 0.00 N ATOM 518 CA GLN A 33 19.722 1.343 -29.074 1.00 0.00 C ATOM 519 C GLN A 33 18.715 2.486 -29.300 1.00 0.00 C ATOM 520 O GLN A 33 18.257 2.686 -30.405 1.00 0.00 O ATOM 521 CB GLN A 33 19.074 0.266 -28.198 1.00 0.00 C ATOM 522 CG GLN A 33 17.599 0.107 -28.583 1.00 0.00 C ATOM 523 CD GLN A 33 17.471 0.011 -30.104 1.00 0.00 C ATOM 524 OE1 GLN A 33 18.292 -0.606 -30.755 1.00 0.00 O ATOM 525 NE2 GLN A 33 16.472 0.599 -30.702 1.00 0.00 N ATOM 0 H GLN A 33 21.085 1.510 -27.443 1.00 0.00 H new ATOM 0 HA GLN A 33 19.996 0.935 -30.047 1.00 0.00 H new ATOM 0 HB2 GLN A 33 19.597 -0.682 -28.324 1.00 0.00 H new ATOM 0 HB3 GLN A 33 19.158 0.540 -27.146 1.00 0.00 H new ATOM 0 HG2 GLN A 33 17.186 -0.787 -28.116 1.00 0.00 H new ATOM 0 HG3 GLN A 33 17.023 0.955 -28.213 1.00 0.00 H new ATOM 0 HE21 GLN A 33 15.784 1.116 -30.155 1.00 0.00 H new ATOM 0 HE22 GLN A 33 16.379 0.541 -31.716 1.00 0.00 H new ATOM 534 N ILE A 34 18.336 3.230 -28.287 1.00 0.00 N ATOM 535 CA ILE A 34 17.383 4.357 -28.550 1.00 0.00 C ATOM 536 C ILE A 34 17.996 5.364 -29.514 1.00 0.00 C ATOM 537 O ILE A 34 17.825 6.557 -29.360 1.00 0.00 O ATOM 538 CB ILE A 34 16.985 5.078 -27.265 1.00 0.00 C ATOM 539 CG1 ILE A 34 16.659 4.059 -26.176 1.00 0.00 C ATOM 540 CG2 ILE A 34 15.738 5.925 -27.546 1.00 0.00 C ATOM 541 CD1 ILE A 34 16.414 4.794 -24.856 1.00 0.00 C ATOM 0 H ILE A 34 18.634 3.113 -27.318 1.00 0.00 H new ATOM 0 HA ILE A 34 16.489 3.918 -28.992 1.00 0.00 H new ATOM 0 HB ILE A 34 17.808 5.709 -26.930 1.00 0.00 H new ATOM 0 HG12 ILE A 34 15.777 3.482 -26.454 1.00 0.00 H new ATOM 0 HG13 ILE A 34 17.481 3.352 -26.065 1.00 0.00 H new ATOM 0 HG21 ILE A 34 15.440 6.447 -26.637 1.00 0.00 H new ATOM 0 HG22 ILE A 34 15.961 6.653 -28.326 1.00 0.00 H new ATOM 0 HG23 ILE A 34 14.925 5.278 -27.875 1.00 0.00 H new ATOM 0 HD11 ILE A 34 16.181 4.071 -24.075 1.00 0.00 H new ATOM 0 HD12 ILE A 34 17.308 5.352 -24.579 1.00 0.00 H new ATOM 0 HD13 ILE A 34 15.578 5.484 -24.973 1.00 0.00 H new ATOM 553 N ASP A 35 18.673 4.917 -30.532 1.00 0.00 N ATOM 554 CA ASP A 35 19.205 5.898 -31.505 1.00 0.00 C ATOM 555 C ASP A 35 17.984 6.617 -32.060 1.00 0.00 C ATOM 556 O ASP A 35 18.073 7.549 -32.833 1.00 0.00 O ATOM 557 CB ASP A 35 19.939 5.165 -32.629 1.00 0.00 C ATOM 558 CG ASP A 35 20.649 6.179 -33.527 1.00 0.00 C ATOM 559 OD1 ASP A 35 20.627 7.352 -33.195 1.00 0.00 O ATOM 560 OD2 ASP A 35 21.209 5.765 -34.530 1.00 0.00 O ATOM 0 H ASP A 35 18.876 3.937 -30.728 1.00 0.00 H new ATOM 0 HA ASP A 35 19.911 6.591 -31.047 1.00 0.00 H new ATOM 0 HB2 ASP A 35 20.663 4.467 -32.209 1.00 0.00 H new ATOM 0 HB3 ASP A 35 19.233 4.577 -33.215 1.00 0.00 H new ATOM 565 N THR A 36 16.835 6.167 -31.633 1.00 0.00 N ATOM 566 CA THR A 36 15.560 6.780 -32.068 1.00 0.00 C ATOM 567 C THR A 36 15.355 8.089 -31.309 1.00 0.00 C ATOM 568 O THR A 36 14.387 8.791 -31.510 1.00 0.00 O ATOM 569 CB THR A 36 14.411 5.817 -31.745 1.00 0.00 C ATOM 570 OG1 THR A 36 14.443 5.484 -30.361 1.00 0.00 O ATOM 571 CG2 THR A 36 14.569 4.545 -32.579 1.00 0.00 C ATOM 0 H THR A 36 16.731 5.384 -30.988 1.00 0.00 H new ATOM 0 HA THR A 36 15.584 6.978 -33.140 1.00 0.00 H new ATOM 0 HB THR A 36 13.459 6.293 -31.980 1.00 0.00 H new ATOM 0 HG1 THR A 36 13.707 4.870 -30.155 1.00 0.00 H new ATOM 0 HG21 THR A 36 13.754 3.858 -32.352 1.00 0.00 H new ATOM 0 HG22 THR A 36 14.545 4.799 -33.639 1.00 0.00 H new ATOM 0 HG23 THR A 36 15.521 4.070 -32.341 1.00 0.00 H new ATOM 579 N VAL A 37 16.264 8.429 -30.440 1.00 0.00 N ATOM 580 CA VAL A 37 16.137 9.721 -29.715 1.00 0.00 C ATOM 581 C VAL A 37 14.657 10.052 -29.536 1.00 0.00 C ATOM 582 O VAL A 37 14.219 11.158 -29.784 1.00 0.00 O ATOM 583 CB VAL A 37 16.796 10.831 -30.527 1.00 0.00 C ATOM 584 CG1 VAL A 37 18.310 10.618 -30.572 1.00 0.00 C ATOM 585 CG2 VAL A 37 16.235 10.813 -31.949 1.00 0.00 C ATOM 0 H VAL A 37 17.084 7.872 -30.202 1.00 0.00 H new ATOM 0 HA VAL A 37 16.623 9.639 -28.743 1.00 0.00 H new ATOM 0 HB VAL A 37 16.587 11.793 -30.059 1.00 0.00 H new ATOM 0 HG11 VAL A 37 18.772 11.415 -31.154 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.709 10.630 -29.558 1.00 0.00 H new ATOM 0 HG13 VAL A 37 18.528 9.656 -31.036 1.00 0.00 H new ATOM 0 HG21 VAL A 37 16.702 11.605 -32.535 1.00 0.00 H new ATOM 0 HG22 VAL A 37 16.445 9.848 -32.411 1.00 0.00 H new ATOM 0 HG23 VAL A 37 15.157 10.973 -31.917 1.00 0.00 H new ATOM 595 N LYS A 38 13.888 9.101 -29.096 1.00 0.00 N ATOM 596 CA LYS A 38 12.457 9.363 -28.809 1.00 0.00 C ATOM 597 C LYS A 38 12.193 8.957 -27.366 1.00 0.00 C ATOM 598 O LYS A 38 11.202 8.335 -27.047 1.00 0.00 O ATOM 599 CB LYS A 38 11.567 8.542 -29.746 1.00 0.00 C ATOM 600 CG LYS A 38 11.857 7.055 -29.553 1.00 0.00 C ATOM 601 CD LYS A 38 10.735 6.229 -30.184 1.00 0.00 C ATOM 602 CE LYS A 38 10.426 6.772 -31.579 1.00 0.00 C ATOM 603 NZ LYS A 38 9.649 5.759 -32.345 1.00 0.00 N ATOM 0 H LYS A 38 14.194 8.144 -28.921 1.00 0.00 H new ATOM 0 HA LYS A 38 12.231 10.418 -28.962 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.517 8.748 -29.540 1.00 0.00 H new ATOM 0 HB3 LYS A 38 11.751 8.828 -30.782 1.00 0.00 H new ATOM 0 HG2 LYS A 38 12.813 6.798 -30.010 1.00 0.00 H new ATOM 0 HG3 LYS A 38 11.939 6.825 -28.491 1.00 0.00 H new ATOM 0 HD2 LYS A 38 11.031 5.182 -30.247 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.843 6.271 -29.560 1.00 0.00 H new ATOM 0 HE2 LYS A 38 9.859 7.699 -31.502 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.352 7.008 -32.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.439 6.128 -33.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.206 4.885 -32.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 8.759 5.555 -31.847 1.00 0.00 H new ATOM 617 N SER A 39 13.098 9.298 -26.493 1.00 0.00 N ATOM 618 CA SER A 39 12.957 8.893 -25.073 1.00 0.00 C ATOM 619 C SER A 39 14.097 9.518 -24.259 1.00 0.00 C ATOM 620 O SER A 39 14.916 10.237 -24.796 1.00 0.00 O ATOM 621 CB SER A 39 13.018 7.374 -24.999 1.00 0.00 C ATOM 622 OG SER A 39 13.078 6.965 -23.643 1.00 0.00 O ATOM 0 H SER A 39 13.933 9.843 -26.706 1.00 0.00 H new ATOM 0 HA SER A 39 12.007 9.236 -24.664 1.00 0.00 H new ATOM 0 HB2 SER A 39 12.142 6.941 -25.481 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.892 7.009 -25.538 1.00 0.00 H new ATOM 0 HG SER A 39 12.384 7.430 -23.130 1.00 0.00 H new ATOM 628 N PHE A 40 14.152 9.293 -22.973 1.00 0.00 N ATOM 629 CA PHE A 40 15.257 9.914 -22.185 1.00 0.00 C ATOM 630 C PHE A 40 15.718 9.013 -21.038 1.00 0.00 C ATOM 631 O PHE A 40 14.980 8.191 -20.531 1.00 0.00 O ATOM 632 CB PHE A 40 14.748 11.238 -21.610 1.00 0.00 C ATOM 633 CG PHE A 40 14.335 12.140 -22.738 1.00 0.00 C ATOM 634 CD1 PHE A 40 15.291 12.926 -23.385 1.00 0.00 C ATOM 635 CD2 PHE A 40 12.996 12.189 -23.136 1.00 0.00 C ATOM 636 CE1 PHE A 40 14.911 13.764 -24.436 1.00 0.00 C ATOM 637 CE2 PHE A 40 12.613 13.028 -24.188 1.00 0.00 C ATOM 638 CZ PHE A 40 13.570 13.816 -24.838 1.00 0.00 C ATOM 0 H PHE A 40 13.496 8.719 -22.443 1.00 0.00 H new ATOM 0 HA PHE A 40 16.110 10.069 -22.846 1.00 0.00 H new ATOM 0 HB2 PHE A 40 13.904 11.059 -20.944 1.00 0.00 H new ATOM 0 HB3 PHE A 40 15.528 11.714 -21.015 1.00 0.00 H new ATOM 0 HD1 PHE A 40 16.324 12.886 -23.073 1.00 0.00 H new ATOM 0 HD2 PHE A 40 12.259 11.581 -22.633 1.00 0.00 H new ATOM 0 HE1 PHE A 40 15.650 14.371 -24.938 1.00 0.00 H new ATOM 0 HE2 PHE A 40 11.579 13.068 -24.498 1.00 0.00 H new ATOM 0 HZ PHE A 40 13.274 14.464 -25.650 1.00 0.00 H new ATOM 648 N GLU A 41 16.949 9.195 -20.615 1.00 0.00 N ATOM 649 CA GLU A 41 17.512 8.370 -19.503 1.00 0.00 C ATOM 650 C GLU A 41 18.682 9.112 -18.828 1.00 0.00 C ATOM 651 O GLU A 41 19.627 9.520 -19.472 1.00 0.00 O ATOM 652 CB GLU A 41 18.027 7.053 -20.059 1.00 0.00 C ATOM 653 CG GLU A 41 16.927 6.368 -20.869 1.00 0.00 C ATOM 654 CD GLU A 41 17.361 4.945 -21.221 1.00 0.00 C ATOM 655 OE1 GLU A 41 18.515 4.625 -20.992 1.00 0.00 O ATOM 656 OE2 GLU A 41 16.531 4.197 -21.714 1.00 0.00 O ATOM 0 H GLU A 41 17.591 9.888 -20.999 1.00 0.00 H new ATOM 0 HA GLU A 41 16.726 8.188 -18.771 1.00 0.00 H new ATOM 0 HB2 GLU A 41 18.899 7.230 -20.689 1.00 0.00 H new ATOM 0 HB3 GLU A 41 18.349 6.405 -19.244 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.000 6.345 -20.296 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.726 6.933 -21.779 1.00 0.00 H new ATOM 663 N TRP A 42 18.629 9.272 -17.530 1.00 0.00 N ATOM 664 CA TRP A 42 19.741 9.957 -16.808 1.00 0.00 C ATOM 665 C TRP A 42 19.941 9.247 -15.476 1.00 0.00 C ATOM 666 O TRP A 42 19.226 8.318 -15.161 1.00 0.00 O ATOM 667 CB TRP A 42 19.366 11.425 -16.570 1.00 0.00 C ATOM 668 CG TRP A 42 20.581 12.294 -16.681 1.00 0.00 C ATOM 669 CD1 TRP A 42 21.197 12.618 -17.841 1.00 0.00 C ATOM 670 CD2 TRP A 42 21.340 12.948 -15.620 1.00 0.00 C ATOM 671 NE1 TRP A 42 22.287 13.421 -17.562 1.00 0.00 N ATOM 672 CE2 TRP A 42 22.418 13.653 -16.207 1.00 0.00 C ATOM 673 CE3 TRP A 42 21.199 12.999 -14.221 1.00 0.00 C ATOM 674 CZ2 TRP A 42 23.329 14.374 -15.433 1.00 0.00 C ATOM 675 CZ3 TRP A 42 22.116 13.721 -13.439 1.00 0.00 C ATOM 676 CH2 TRP A 42 23.179 14.406 -14.044 1.00 0.00 C ATOM 0 H TRP A 42 17.860 8.956 -16.938 1.00 0.00 H new ATOM 0 HA TRP A 42 20.660 9.923 -17.393 1.00 0.00 H new ATOM 0 HB2 TRP A 42 18.618 11.739 -17.297 1.00 0.00 H new ATOM 0 HB3 TRP A 42 18.918 11.538 -15.583 1.00 0.00 H new ATOM 0 HD1 TRP A 42 20.887 12.301 -18.826 1.00 0.00 H new ATOM 0 HE1 TRP A 42 22.918 13.796 -18.270 1.00 0.00 H new ATOM 0 HE3 TRP A 42 20.380 12.480 -13.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 24.144 14.903 -15.904 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 22.001 13.748 -12.365 1.00 0.00 H new ATOM 0 HH2 TRP A 42 23.881 14.958 -13.437 1.00 0.00 H new ATOM 687 N GLY A 43 20.896 9.651 -14.682 1.00 0.00 N ATOM 688 CA GLY A 43 21.089 8.951 -13.371 1.00 0.00 C ATOM 689 C GLY A 43 21.482 9.944 -12.278 1.00 0.00 C ATOM 690 O GLY A 43 21.804 11.085 -12.545 1.00 0.00 O ATOM 0 H GLY A 43 21.540 10.418 -14.874 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.170 8.438 -13.089 1.00 0.00 H new ATOM 0 HA3 GLY A 43 21.862 8.189 -13.471 1.00 0.00 H new ATOM 694 N GLU A 44 21.470 9.514 -11.045 1.00 0.00 N ATOM 695 CA GLU A 44 21.824 10.436 -9.933 1.00 0.00 C ATOM 696 C GLU A 44 22.463 9.640 -8.800 1.00 0.00 C ATOM 697 O GLU A 44 22.098 8.514 -8.533 1.00 0.00 O ATOM 698 CB GLU A 44 20.567 11.129 -9.396 1.00 0.00 C ATOM 699 CG GLU A 44 19.863 11.889 -10.522 1.00 0.00 C ATOM 700 CD GLU A 44 18.703 12.691 -9.936 1.00 0.00 C ATOM 701 OE1 GLU A 44 18.371 12.460 -8.785 1.00 0.00 O ATOM 702 OE2 GLU A 44 18.163 13.522 -10.649 1.00 0.00 O ATOM 0 H GLU A 44 21.230 8.564 -10.762 1.00 0.00 H new ATOM 0 HA GLU A 44 22.519 11.186 -10.309 1.00 0.00 H new ATOM 0 HB2 GLU A 44 19.890 10.390 -8.967 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.836 11.818 -8.595 1.00 0.00 H new ATOM 0 HG2 GLU A 44 20.566 12.555 -11.022 1.00 0.00 H new ATOM 0 HG3 GLU A 44 19.495 11.191 -11.274 1.00 0.00 H new ATOM 709 N ASP A 45 23.393 10.241 -8.123 1.00 0.00 N ATOM 710 CA ASP A 45 24.017 9.605 -6.933 1.00 0.00 C ATOM 711 C ASP A 45 23.839 10.584 -5.771 1.00 0.00 C ATOM 712 O ASP A 45 23.832 11.781 -5.975 1.00 0.00 O ATOM 713 CB ASP A 45 25.502 9.336 -7.193 1.00 0.00 C ATOM 714 CG ASP A 45 25.651 8.292 -8.300 1.00 0.00 C ATOM 715 OD1 ASP A 45 24.653 7.671 -8.637 1.00 0.00 O ATOM 716 OD2 ASP A 45 26.754 8.128 -8.792 1.00 0.00 O ATOM 0 H ASP A 45 23.756 11.167 -8.348 1.00 0.00 H new ATOM 0 HA ASP A 45 23.551 8.646 -6.707 1.00 0.00 H new ATOM 0 HB2 ASP A 45 26.004 10.260 -7.481 1.00 0.00 H new ATOM 0 HB3 ASP A 45 25.983 8.984 -6.280 1.00 0.00 H new ATOM 721 N LYS A 46 23.675 10.119 -4.565 1.00 0.00 N ATOM 722 CA LYS A 46 23.385 11.078 -3.462 1.00 0.00 C ATOM 723 C LYS A 46 24.024 10.584 -2.165 1.00 0.00 C ATOM 724 O LYS A 46 23.958 9.416 -1.836 1.00 0.00 O ATOM 725 CB LYS A 46 21.878 11.233 -3.273 1.00 0.00 C ATOM 726 CG LYS A 46 21.395 10.229 -2.220 1.00 0.00 C ATOM 727 CD LYS A 46 21.650 8.808 -2.721 1.00 0.00 C ATOM 728 CE LYS A 46 21.838 7.871 -1.526 1.00 0.00 C ATOM 729 NZ LYS A 46 23.229 7.332 -1.531 1.00 0.00 N ATOM 0 H LYS A 46 23.728 9.136 -4.297 1.00 0.00 H new ATOM 0 HA LYS A 46 23.805 12.049 -3.723 1.00 0.00 H new ATOM 0 HB2 LYS A 46 21.642 12.250 -2.959 1.00 0.00 H new ATOM 0 HB3 LYS A 46 21.362 11.063 -4.218 1.00 0.00 H new ATOM 0 HG2 LYS A 46 21.917 10.394 -1.278 1.00 0.00 H new ATOM 0 HG3 LYS A 46 20.332 10.373 -2.025 1.00 0.00 H new ATOM 0 HD2 LYS A 46 20.813 8.471 -3.333 1.00 0.00 H new ATOM 0 HD3 LYS A 46 22.536 8.788 -3.355 1.00 0.00 H new ATOM 0 HE2 LYS A 46 21.648 8.407 -0.596 1.00 0.00 H new ATOM 0 HE3 LYS A 46 21.119 7.053 -1.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 23.276 6.486 -0.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 23.500 7.080 -2.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 23.882 8.054 -1.166 1.00 0.00 H new ATOM 743 N GLU A 47 24.642 11.470 -1.431 1.00 0.00 N ATOM 744 CA GLU A 47 25.173 11.104 -0.085 1.00 0.00 C ATOM 745 C GLU A 47 24.728 12.154 0.939 1.00 0.00 C ATOM 746 O GLU A 47 25.035 12.062 2.109 1.00 0.00 O ATOM 747 CB GLU A 47 26.708 11.037 -0.120 1.00 0.00 C ATOM 748 CG GLU A 47 27.158 9.947 -1.095 1.00 0.00 C ATOM 749 CD GLU A 47 28.684 9.836 -1.069 1.00 0.00 C ATOM 750 OE1 GLU A 47 29.313 10.703 -0.484 1.00 0.00 O ATOM 751 OE2 GLU A 47 29.199 8.884 -1.634 1.00 0.00 O ATOM 0 H GLU A 47 24.803 12.438 -1.708 1.00 0.00 H new ATOM 0 HA GLU A 47 24.784 10.126 0.198 1.00 0.00 H new ATOM 0 HB2 GLU A 47 27.116 12.001 -0.424 1.00 0.00 H new ATOM 0 HB3 GLU A 47 27.095 10.828 0.877 1.00 0.00 H new ATOM 0 HG2 GLU A 47 26.709 8.992 -0.822 1.00 0.00 H new ATOM 0 HG3 GLU A 47 26.817 10.183 -2.103 1.00 0.00 H new ATOM 758 N SER A 48 24.008 13.157 0.503 1.00 0.00 N ATOM 759 CA SER A 48 23.551 14.215 1.452 1.00 0.00 C ATOM 760 C SER A 48 22.915 13.575 2.692 1.00 0.00 C ATOM 761 O SER A 48 23.253 12.471 3.071 1.00 0.00 O ATOM 762 CB SER A 48 22.516 15.103 0.758 1.00 0.00 C ATOM 763 OG SER A 48 21.982 16.023 1.700 1.00 0.00 O ATOM 0 H SER A 48 23.718 13.288 -0.466 1.00 0.00 H new ATOM 0 HA SER A 48 24.410 14.812 1.759 1.00 0.00 H new ATOM 0 HB2 SER A 48 22.977 15.640 -0.071 1.00 0.00 H new ATOM 0 HB3 SER A 48 21.718 14.491 0.337 1.00 0.00 H new ATOM 0 HG SER A 48 21.005 16.038 1.625 1.00 0.00 H new ATOM 769 N HIS A 49 21.993 14.253 3.321 1.00 0.00 N ATOM 770 CA HIS A 49 21.375 13.706 4.565 1.00 0.00 C ATOM 771 C HIS A 49 20.477 12.517 4.216 1.00 0.00 C ATOM 772 O HIS A 49 19.955 12.418 3.126 1.00 0.00 O ATOM 773 CB HIS A 49 20.547 14.798 5.251 1.00 0.00 C ATOM 774 CG HIS A 49 21.453 15.922 5.675 1.00 0.00 C ATOM 775 ND1 HIS A 49 21.678 17.034 4.875 1.00 0.00 N ATOM 776 CD2 HIS A 49 22.198 16.122 6.813 1.00 0.00 C ATOM 777 CE1 HIS A 49 22.524 17.845 5.534 1.00 0.00 C ATOM 778 NE2 HIS A 49 22.870 17.335 6.717 1.00 0.00 N ATOM 0 H HIS A 49 21.640 15.164 3.027 1.00 0.00 H new ATOM 0 HA HIS A 49 22.162 13.373 5.242 1.00 0.00 H new ATOM 0 HB2 HIS A 49 19.782 15.171 4.570 1.00 0.00 H new ATOM 0 HB3 HIS A 49 20.030 14.387 6.118 1.00 0.00 H new ATOM 0 HD2 HIS A 49 22.253 15.443 7.651 1.00 0.00 H new ATOM 0 HE1 HIS A 49 22.879 18.791 5.153 1.00 0.00 H new ATOM 0 HE2 HIS A 49 23.497 17.749 7.407 1.00 0.00 H new ATOM 787 N ASP A 50 20.305 11.608 5.136 1.00 0.00 N ATOM 788 CA ASP A 50 19.444 10.418 4.868 1.00 0.00 C ATOM 789 C ASP A 50 17.977 10.833 4.707 1.00 0.00 C ATOM 790 O ASP A 50 17.271 10.326 3.859 1.00 0.00 O ATOM 791 CB ASP A 50 19.564 9.435 6.032 1.00 0.00 C ATOM 792 CG ASP A 50 20.983 8.862 6.078 1.00 0.00 C ATOM 793 OD1 ASP A 50 21.714 9.066 5.122 1.00 0.00 O ATOM 794 OD2 ASP A 50 21.316 8.233 7.068 1.00 0.00 O ATOM 0 H ASP A 50 20.724 11.637 6.065 1.00 0.00 H new ATOM 0 HA ASP A 50 19.778 9.948 3.943 1.00 0.00 H new ATOM 0 HB2 ASP A 50 19.334 9.938 6.971 1.00 0.00 H new ATOM 0 HB3 ASP A 50 18.839 8.629 5.916 1.00 0.00 H new ATOM 799 N MET A 51 17.503 11.731 5.528 1.00 0.00 N ATOM 800 CA MET A 51 16.079 12.163 5.420 1.00 0.00 C ATOM 801 C MET A 51 15.851 12.971 4.136 1.00 0.00 C ATOM 802 O MET A 51 14.797 12.901 3.536 1.00 0.00 O ATOM 803 CB MET A 51 15.704 13.012 6.635 1.00 0.00 C ATOM 804 CG MET A 51 14.184 13.166 6.697 1.00 0.00 C ATOM 805 SD MET A 51 13.652 14.400 5.486 1.00 0.00 S ATOM 806 CE MET A 51 12.036 13.677 5.116 1.00 0.00 C ATOM 0 H MET A 51 18.039 12.184 6.268 1.00 0.00 H new ATOM 0 HA MET A 51 15.450 11.274 5.386 1.00 0.00 H new ATOM 0 HB2 MET A 51 16.071 12.542 7.548 1.00 0.00 H new ATOM 0 HB3 MET A 51 16.177 13.992 6.568 1.00 0.00 H new ATOM 0 HG2 MET A 51 13.702 12.210 6.493 1.00 0.00 H new ATOM 0 HG3 MET A 51 13.879 13.469 7.699 1.00 0.00 H new ATOM 0 HE1 MET A 51 11.374 14.448 4.722 1.00 0.00 H new ATOM 0 HE2 MET A 51 12.152 12.886 4.375 1.00 0.00 H new ATOM 0 HE3 MET A 51 11.606 13.261 6.027 1.00 0.00 H new ATOM 816 N LEU A 52 16.817 13.735 3.701 1.00 0.00 N ATOM 817 CA LEU A 52 16.622 14.518 2.443 1.00 0.00 C ATOM 818 C LEU A 52 17.019 13.654 1.241 1.00 0.00 C ATOM 819 O LEU A 52 16.245 13.449 0.327 1.00 0.00 O ATOM 820 CB LEU A 52 17.503 15.773 2.466 1.00 0.00 C ATOM 821 CG LEU A 52 17.202 16.604 3.719 1.00 0.00 C ATOM 822 CD1 LEU A 52 18.063 17.868 3.708 1.00 0.00 C ATOM 823 CD2 LEU A 52 15.724 17.002 3.730 1.00 0.00 C ATOM 0 H LEU A 52 17.723 13.851 4.155 1.00 0.00 H new ATOM 0 HA LEU A 52 15.575 14.810 2.364 1.00 0.00 H new ATOM 0 HB2 LEU A 52 18.555 15.489 2.453 1.00 0.00 H new ATOM 0 HB3 LEU A 52 17.323 16.370 1.572 1.00 0.00 H new ATOM 0 HG LEU A 52 17.426 16.012 4.607 1.00 0.00 H new ATOM 0 HD11 LEU A 52 17.851 18.461 4.598 1.00 0.00 H new ATOM 0 HD12 LEU A 52 19.117 17.590 3.700 1.00 0.00 H new ATOM 0 HD13 LEU A 52 17.836 18.455 2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.513 17.592 4.622 1.00 0.00 H new ATOM 0 HD22 LEU A 52 15.500 17.593 2.842 1.00 0.00 H new ATOM 0 HD23 LEU A 52 15.106 16.104 3.734 1.00 0.00 H new ATOM 835 N ARG A 53 18.228 13.159 1.230 1.00 0.00 N ATOM 836 CA ARG A 53 18.700 12.324 0.084 1.00 0.00 C ATOM 837 C ARG A 53 17.817 11.080 -0.096 1.00 0.00 C ATOM 838 O ARG A 53 18.096 10.228 -0.914 1.00 0.00 O ATOM 839 CB ARG A 53 20.139 11.886 0.356 1.00 0.00 C ATOM 840 CG ARG A 53 20.143 10.502 1.014 1.00 0.00 C ATOM 841 CD ARG A 53 21.491 10.275 1.692 1.00 0.00 C ATOM 842 NE ARG A 53 21.493 8.933 2.352 1.00 0.00 N ATOM 843 CZ ARG A 53 22.608 8.384 2.736 1.00 0.00 C ATOM 844 NH1 ARG A 53 23.736 9.003 2.539 1.00 0.00 N ATOM 845 NH2 ARG A 53 22.593 7.219 3.331 1.00 0.00 N ATOM 0 H ARG A 53 18.915 13.298 1.971 1.00 0.00 H new ATOM 0 HA ARG A 53 18.644 12.917 -0.829 1.00 0.00 H new ATOM 0 HB2 ARG A 53 20.703 11.857 -0.576 1.00 0.00 H new ATOM 0 HB3 ARG A 53 20.633 12.609 1.005 1.00 0.00 H new ATOM 0 HG2 ARG A 53 19.338 10.431 1.745 1.00 0.00 H new ATOM 0 HG3 ARG A 53 19.963 9.730 0.266 1.00 0.00 H new ATOM 0 HD2 ARG A 53 22.295 10.333 0.958 1.00 0.00 H new ATOM 0 HD3 ARG A 53 21.676 11.056 2.430 1.00 0.00 H new ATOM 0 HE ARG A 53 20.611 8.443 2.503 1.00 0.00 H new ATOM 0 HH11 ARG A 53 23.744 9.916 2.085 1.00 0.00 H new ATOM 0 HH12 ARG A 53 24.612 8.575 2.839 1.00 0.00 H new ATOM 0 HH21 ARG A 53 21.707 6.741 3.494 1.00 0.00 H new ATOM 0 HH22 ARG A 53 23.467 6.789 3.632 1.00 0.00 H new ATOM 859 N GLN A 54 16.766 10.959 0.662 1.00 0.00 N ATOM 860 CA GLN A 54 15.871 9.770 0.511 1.00 0.00 C ATOM 861 C GLN A 54 16.660 8.476 0.767 1.00 0.00 C ATOM 862 O GLN A 54 16.098 7.436 1.051 1.00 0.00 O ATOM 863 CB GLN A 54 15.268 9.747 -0.897 1.00 0.00 C ATOM 864 CG GLN A 54 13.791 10.151 -0.823 1.00 0.00 C ATOM 865 CD GLN A 54 13.104 9.830 -2.151 1.00 0.00 C ATOM 866 OE1 GLN A 54 12.287 10.701 -2.673 1.00 0.00 O flip ATOM 867 NE2 GLN A 54 13.314 8.777 -2.720 1.00 0.00 N flip ATOM 0 H GLN A 54 16.484 11.627 1.379 1.00 0.00 H new ATOM 0 HA GLN A 54 15.065 9.840 1.242 1.00 0.00 H new ATOM 0 HB2 GLN A 54 15.812 10.431 -1.549 1.00 0.00 H new ATOM 0 HB3 GLN A 54 15.363 8.751 -1.329 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.298 9.619 -0.009 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.705 11.216 -0.606 1.00 0.00 H new ATOM 0 HE21 GLN A 54 13.953 8.095 -2.312 1.00 0.00 H new ATOM 0 HE22 GLN A 54 12.851 8.575 -3.606 1.00 0.00 H new ATOM 876 N GLY A 55 17.962 8.551 0.703 1.00 0.00 N ATOM 877 CA GLY A 55 18.822 7.349 0.955 1.00 0.00 C ATOM 878 C GLY A 55 18.978 6.453 -0.286 1.00 0.00 C ATOM 879 O GLY A 55 19.859 5.619 -0.330 1.00 0.00 O ATOM 0 H GLY A 55 18.477 9.404 0.484 1.00 0.00 H new ATOM 0 HA2 GLY A 55 19.807 7.677 1.286 1.00 0.00 H new ATOM 0 HA3 GLY A 55 18.391 6.764 1.767 1.00 0.00 H new ATOM 883 N PHE A 56 18.141 6.580 -1.281 1.00 0.00 N ATOM 884 CA PHE A 56 18.298 5.697 -2.481 1.00 0.00 C ATOM 885 C PHE A 56 19.672 5.929 -3.124 1.00 0.00 C ATOM 886 O PHE A 56 19.979 7.011 -3.582 1.00 0.00 O ATOM 887 CB PHE A 56 17.185 5.984 -3.495 1.00 0.00 C ATOM 888 CG PHE A 56 17.497 7.250 -4.244 1.00 0.00 C ATOM 889 CD1 PHE A 56 17.483 8.476 -3.571 1.00 0.00 C ATOM 890 CD2 PHE A 56 17.798 7.202 -5.609 1.00 0.00 C ATOM 891 CE1 PHE A 56 17.772 9.655 -4.264 1.00 0.00 C ATOM 892 CE2 PHE A 56 18.087 8.380 -6.303 1.00 0.00 C ATOM 893 CZ PHE A 56 18.074 9.608 -5.630 1.00 0.00 C ATOM 0 H PHE A 56 17.367 7.244 -1.319 1.00 0.00 H new ATOM 0 HA PHE A 56 18.226 4.656 -2.167 1.00 0.00 H new ATOM 0 HB2 PHE A 56 17.091 5.151 -4.192 1.00 0.00 H new ATOM 0 HB3 PHE A 56 16.228 6.080 -2.982 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.249 8.512 -2.517 1.00 0.00 H new ATOM 0 HD2 PHE A 56 17.807 6.254 -6.127 1.00 0.00 H new ATOM 0 HE1 PHE A 56 17.762 10.602 -3.745 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.320 8.343 -7.357 1.00 0.00 H new ATOM 0 HZ PHE A 56 18.297 10.519 -6.165 1.00 0.00 H new ATOM 903 N THR A 57 20.506 4.918 -3.148 1.00 0.00 N ATOM 904 CA THR A 57 21.896 5.094 -3.670 1.00 0.00 C ATOM 905 C THR A 57 21.883 5.747 -5.057 1.00 0.00 C ATOM 906 O THR A 57 22.779 6.490 -5.406 1.00 0.00 O ATOM 907 CB THR A 57 22.586 3.730 -3.774 1.00 0.00 C ATOM 908 OG1 THR A 57 21.909 2.927 -4.731 1.00 0.00 O ATOM 909 CG2 THR A 57 22.559 3.034 -2.413 1.00 0.00 C ATOM 0 H THR A 57 20.282 3.976 -2.827 1.00 0.00 H new ATOM 0 HA THR A 57 22.437 5.740 -2.978 1.00 0.00 H new ATOM 0 HB THR A 57 23.621 3.873 -4.086 1.00 0.00 H new ATOM 0 HG1 THR A 57 22.549 2.324 -5.164 1.00 0.00 H new ATOM 0 HG21 THR A 57 23.051 2.064 -2.490 1.00 0.00 H new ATOM 0 HG22 THR A 57 23.082 3.648 -1.680 1.00 0.00 H new ATOM 0 HG23 THR A 57 21.525 2.893 -2.097 1.00 0.00 H new ATOM 917 N HIS A 58 20.892 5.468 -5.862 1.00 0.00 N ATOM 918 CA HIS A 58 20.855 6.090 -7.217 1.00 0.00 C ATOM 919 C HIS A 58 19.558 5.712 -7.934 1.00 0.00 C ATOM 920 O HIS A 58 18.912 4.739 -7.604 1.00 0.00 O ATOM 921 CB HIS A 58 22.040 5.580 -8.041 1.00 0.00 C ATOM 922 CG HIS A 58 22.529 4.274 -7.467 1.00 0.00 C ATOM 923 ND1 HIS A 58 21.916 3.062 -7.760 1.00 0.00 N ATOM 924 CD2 HIS A 58 23.564 3.973 -6.614 1.00 0.00 C ATOM 925 CE1 HIS A 58 22.579 2.100 -7.092 1.00 0.00 C ATOM 926 NE2 HIS A 58 23.590 2.602 -6.381 1.00 0.00 N ATOM 0 H HIS A 58 20.115 4.844 -5.643 1.00 0.00 H new ATOM 0 HA HIS A 58 20.908 7.173 -7.110 1.00 0.00 H new ATOM 0 HB2 HIS A 58 21.741 5.443 -9.080 1.00 0.00 H new ATOM 0 HB3 HIS A 58 22.844 6.316 -8.035 1.00 0.00 H new ATOM 0 HD2 HIS A 58 24.251 4.690 -6.190 1.00 0.00 H new ATOM 0 HE1 HIS A 58 22.324 1.051 -7.127 1.00 0.00 H new ATOM 0 HE2 HIS A 58 24.244 2.088 -5.791 1.00 0.00 H new ATOM 935 N ALA A 59 19.184 6.470 -8.929 1.00 0.00 N ATOM 936 CA ALA A 59 17.927 6.172 -9.666 1.00 0.00 C ATOM 937 C ALA A 59 18.125 6.487 -11.147 1.00 0.00 C ATOM 938 O ALA A 59 19.104 7.091 -11.541 1.00 0.00 O ATOM 939 CB ALA A 59 16.778 7.017 -9.114 1.00 0.00 C ATOM 0 H ALA A 59 19.698 7.285 -9.263 1.00 0.00 H new ATOM 0 HA ALA A 59 17.681 5.117 -9.541 1.00 0.00 H new ATOM 0 HB1 ALA A 59 15.863 6.790 -9.662 1.00 0.00 H new ATOM 0 HB2 ALA A 59 16.634 6.790 -8.058 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.016 8.074 -9.229 1.00 0.00 H new ATOM 945 N PHE A 60 17.199 6.084 -11.968 1.00 0.00 N ATOM 946 CA PHE A 60 17.311 6.375 -13.419 1.00 0.00 C ATOM 947 C PHE A 60 15.988 6.954 -13.916 1.00 0.00 C ATOM 948 O PHE A 60 14.938 6.376 -13.722 1.00 0.00 O ATOM 949 CB PHE A 60 17.602 5.076 -14.178 1.00 0.00 C ATOM 950 CG PHE A 60 18.961 4.548 -13.791 1.00 0.00 C ATOM 951 CD1 PHE A 60 20.098 4.966 -14.492 1.00 0.00 C ATOM 952 CD2 PHE A 60 19.086 3.645 -12.729 1.00 0.00 C ATOM 953 CE1 PHE A 60 21.361 4.482 -14.130 1.00 0.00 C ATOM 954 CE2 PHE A 60 20.348 3.160 -12.368 1.00 0.00 C ATOM 955 CZ PHE A 60 21.485 3.579 -13.069 1.00 0.00 C ATOM 0 H PHE A 60 16.366 5.563 -11.694 1.00 0.00 H new ATOM 0 HA PHE A 60 18.118 7.088 -13.587 1.00 0.00 H new ATOM 0 HB2 PHE A 60 16.836 4.334 -13.953 1.00 0.00 H new ATOM 0 HB3 PHE A 60 17.565 5.256 -15.252 1.00 0.00 H new ATOM 0 HD1 PHE A 60 20.001 5.662 -15.312 1.00 0.00 H new ATOM 0 HD2 PHE A 60 18.209 3.323 -12.188 1.00 0.00 H new ATOM 0 HE1 PHE A 60 22.239 4.806 -14.670 1.00 0.00 H new ATOM 0 HE2 PHE A 60 20.445 2.463 -11.549 1.00 0.00 H new ATOM 0 HZ PHE A 60 22.459 3.205 -12.790 1.00 0.00 H new ATOM 965 N SER A 61 16.027 8.079 -14.567 1.00 0.00 N ATOM 966 CA SER A 61 14.761 8.698 -15.051 1.00 0.00 C ATOM 967 C SER A 61 14.521 8.228 -16.488 1.00 0.00 C ATOM 968 O SER A 61 15.107 8.731 -17.425 1.00 0.00 O ATOM 969 CB SER A 61 14.875 10.220 -15.009 1.00 0.00 C ATOM 970 OG SER A 61 13.716 10.791 -15.604 1.00 0.00 O ATOM 0 H SER A 61 16.878 8.598 -14.786 1.00 0.00 H new ATOM 0 HA SER A 61 13.928 8.400 -14.414 1.00 0.00 H new ATOM 0 HB2 SER A 61 14.975 10.561 -13.979 1.00 0.00 H new ATOM 0 HB3 SER A 61 15.769 10.545 -15.541 1.00 0.00 H new ATOM 0 HG SER A 61 13.783 11.768 -15.578 1.00 0.00 H new ATOM 976 N MET A 62 13.692 7.235 -16.664 1.00 0.00 N ATOM 977 CA MET A 62 13.406 6.749 -18.037 1.00 0.00 C ATOM 978 C MET A 62 12.068 7.277 -18.528 1.00 0.00 C ATOM 979 O MET A 62 11.018 6.913 -18.035 1.00 0.00 O ATOM 980 CB MET A 62 13.378 5.217 -18.038 1.00 0.00 C ATOM 981 CG MET A 62 14.783 4.682 -17.764 1.00 0.00 C ATOM 982 SD MET A 62 14.744 2.874 -17.742 1.00 0.00 S ATOM 983 CE MET A 62 14.231 2.679 -16.018 1.00 0.00 C ATOM 0 H MET A 62 13.203 6.743 -15.916 1.00 0.00 H new ATOM 0 HA MET A 62 14.189 7.110 -18.704 1.00 0.00 H new ATOM 0 HB2 MET A 62 12.685 4.855 -17.279 1.00 0.00 H new ATOM 0 HB3 MET A 62 13.018 4.850 -18.999 1.00 0.00 H new ATOM 0 HG2 MET A 62 15.473 5.032 -18.531 1.00 0.00 H new ATOM 0 HG3 MET A 62 15.148 5.060 -16.809 1.00 0.00 H new ATOM 0 HE1 MET A 62 14.262 1.624 -15.746 1.00 0.00 H new ATOM 0 HE2 MET A 62 14.906 3.240 -15.372 1.00 0.00 H new ATOM 0 HE3 MET A 62 13.215 3.055 -15.896 1.00 0.00 H new ATOM 993 N THR A 63 12.110 8.111 -19.525 1.00 0.00 N ATOM 994 CA THR A 63 10.863 8.697 -20.082 1.00 0.00 C ATOM 995 C THR A 63 10.816 8.350 -21.580 1.00 0.00 C ATOM 996 O THR A 63 11.835 8.309 -22.243 1.00 0.00 O ATOM 997 CB THR A 63 10.882 10.213 -19.867 1.00 0.00 C ATOM 998 OG1 THR A 63 10.789 10.479 -18.473 1.00 0.00 O ATOM 999 CG2 THR A 63 9.697 10.864 -20.585 1.00 0.00 C ATOM 0 H THR A 63 12.968 8.416 -19.984 1.00 0.00 H new ATOM 0 HA THR A 63 9.978 8.298 -19.587 1.00 0.00 H new ATOM 0 HB THR A 63 11.808 10.624 -20.270 1.00 0.00 H new ATOM 0 HG1 THR A 63 10.802 11.447 -18.323 1.00 0.00 H new ATOM 0 HG21 THR A 63 9.722 11.942 -20.424 1.00 0.00 H new ATOM 0 HG22 THR A 63 9.759 10.655 -21.653 1.00 0.00 H new ATOM 0 HG23 THR A 63 8.765 10.460 -20.190 1.00 0.00 H new ATOM 1007 N PHE A 64 9.665 8.052 -22.111 1.00 0.00 N ATOM 1008 CA PHE A 64 9.595 7.685 -23.557 1.00 0.00 C ATOM 1009 C PHE A 64 8.710 8.678 -24.309 1.00 0.00 C ATOM 1010 O PHE A 64 7.907 9.374 -23.720 1.00 0.00 O ATOM 1011 CB PHE A 64 8.980 6.280 -23.671 1.00 0.00 C ATOM 1012 CG PHE A 64 9.947 5.253 -23.133 1.00 0.00 C ATOM 1013 CD1 PHE A 64 10.060 5.051 -21.751 1.00 0.00 C ATOM 1014 CD2 PHE A 64 10.731 4.503 -24.015 1.00 0.00 C ATOM 1015 CE1 PHE A 64 10.956 4.100 -21.254 1.00 0.00 C ATOM 1016 CE2 PHE A 64 11.628 3.551 -23.518 1.00 0.00 C ATOM 1017 CZ PHE A 64 11.741 3.350 -22.137 1.00 0.00 C ATOM 0 H PHE A 64 8.774 8.046 -21.614 1.00 0.00 H new ATOM 0 HA PHE A 64 10.596 7.704 -23.988 1.00 0.00 H new ATOM 0 HB2 PHE A 64 8.043 6.237 -23.115 1.00 0.00 H new ATOM 0 HB3 PHE A 64 8.744 6.060 -24.712 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.455 5.630 -21.070 1.00 0.00 H new ATOM 0 HD2 PHE A 64 10.644 4.659 -25.080 1.00 0.00 H new ATOM 0 HE1 PHE A 64 11.042 3.944 -20.189 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.233 2.971 -24.199 1.00 0.00 H new ATOM 0 HZ PHE A 64 12.434 2.616 -21.753 1.00 0.00 H new ATOM 1027 N GLU A 65 8.819 8.730 -25.614 1.00 0.00 N ATOM 1028 CA GLU A 65 7.970 9.684 -26.382 1.00 0.00 C ATOM 1029 C GLU A 65 6.603 9.035 -26.572 1.00 0.00 C ATOM 1030 O GLU A 65 5.584 9.693 -26.631 1.00 0.00 O ATOM 1031 CB GLU A 65 8.583 9.961 -27.756 1.00 0.00 C ATOM 1032 CG GLU A 65 7.795 11.082 -28.440 1.00 0.00 C ATOM 1033 CD GLU A 65 8.329 11.301 -29.856 1.00 0.00 C ATOM 1034 OE1 GLU A 65 9.238 10.581 -30.242 1.00 0.00 O ATOM 1035 OE2 GLU A 65 7.826 12.183 -30.530 1.00 0.00 O ATOM 0 H GLU A 65 9.453 8.159 -26.173 1.00 0.00 H new ATOM 0 HA GLU A 65 7.891 10.627 -25.841 1.00 0.00 H new ATOM 0 HB2 GLU A 65 9.629 10.248 -27.650 1.00 0.00 H new ATOM 0 HB3 GLU A 65 8.560 9.059 -28.367 1.00 0.00 H new ATOM 0 HG2 GLU A 65 6.736 10.825 -28.476 1.00 0.00 H new ATOM 0 HG3 GLU A 65 7.880 12.003 -27.863 1.00 0.00 H new ATOM 1042 N ASN A 66 6.590 7.734 -26.645 1.00 0.00 N ATOM 1043 CA ASN A 66 5.318 6.993 -26.828 1.00 0.00 C ATOM 1044 C ASN A 66 5.584 5.506 -26.579 1.00 0.00 C ATOM 1045 O ASN A 66 6.704 5.099 -26.343 1.00 0.00 O ATOM 1046 CB ASN A 66 4.809 7.201 -28.252 1.00 0.00 C ATOM 1047 CG ASN A 66 5.778 6.554 -29.241 1.00 0.00 C ATOM 1048 OD1 ASN A 66 6.880 6.193 -28.881 1.00 0.00 O ATOM 1049 ND2 ASN A 66 5.413 6.393 -30.483 1.00 0.00 N ATOM 0 H ASN A 66 7.422 7.146 -26.584 1.00 0.00 H new ATOM 0 HA ASN A 66 4.564 7.355 -26.129 1.00 0.00 H new ATOM 0 HB2 ASN A 66 3.816 6.765 -28.362 1.00 0.00 H new ATOM 0 HB3 ASN A 66 4.714 8.266 -28.464 1.00 0.00 H new ATOM 0 HD21 ASN A 66 6.053 5.964 -31.151 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.487 6.696 -30.786 1.00 0.00 H new ATOM 1056 N LYS A 67 4.563 4.696 -26.602 1.00 0.00 N ATOM 1057 CA LYS A 67 4.752 3.238 -26.355 1.00 0.00 C ATOM 1058 C LYS A 67 5.595 2.587 -27.460 1.00 0.00 C ATOM 1059 O LYS A 67 6.213 1.561 -27.250 1.00 0.00 O ATOM 1060 CB LYS A 67 3.381 2.558 -26.303 1.00 0.00 C ATOM 1061 CG LYS A 67 2.563 3.152 -25.153 1.00 0.00 C ATOM 1062 CD LYS A 67 1.313 2.296 -24.918 1.00 0.00 C ATOM 1063 CE LYS A 67 0.419 2.346 -26.158 1.00 0.00 C ATOM 1064 NZ LYS A 67 -0.967 1.936 -25.791 1.00 0.00 N ATOM 0 H LYS A 67 3.601 4.982 -26.782 1.00 0.00 H new ATOM 0 HA LYS A 67 5.278 3.116 -25.408 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.857 2.699 -27.248 1.00 0.00 H new ATOM 0 HB3 LYS A 67 3.501 1.484 -26.162 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.166 3.190 -24.246 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.276 4.177 -25.388 1.00 0.00 H new ATOM 0 HD2 LYS A 67 1.599 1.266 -24.705 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.767 2.662 -24.048 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.413 3.353 -26.574 1.00 0.00 H new ATOM 0 HE3 LYS A 67 0.813 1.684 -26.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -1.574 1.970 -26.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.954 0.967 -25.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.341 2.584 -25.069 1.00 0.00 H new ATOM 1078 N ASP A 68 5.617 3.151 -28.637 1.00 0.00 N ATOM 1079 CA ASP A 68 6.405 2.525 -29.746 1.00 0.00 C ATOM 1080 C ASP A 68 7.892 2.464 -29.382 1.00 0.00 C ATOM 1081 O ASP A 68 8.544 1.460 -29.582 1.00 0.00 O ATOM 1082 CB ASP A 68 6.224 3.331 -31.034 1.00 0.00 C ATOM 1083 CG ASP A 68 6.870 2.575 -32.197 1.00 0.00 C ATOM 1084 OD1 ASP A 68 7.330 1.467 -31.977 1.00 0.00 O ATOM 1085 OD2 ASP A 68 6.894 3.119 -33.290 1.00 0.00 O ATOM 0 H ASP A 68 5.128 4.012 -28.881 1.00 0.00 H new ATOM 0 HA ASP A 68 6.039 1.510 -29.899 1.00 0.00 H new ATOM 0 HB2 ASP A 68 5.164 3.489 -31.232 1.00 0.00 H new ATOM 0 HB3 ASP A 68 6.679 4.316 -30.928 1.00 0.00 H new ATOM 1090 N GLY A 69 8.441 3.522 -28.852 1.00 0.00 N ATOM 1091 CA GLY A 69 9.880 3.485 -28.472 1.00 0.00 C ATOM 1092 C GLY A 69 10.055 2.547 -27.279 1.00 0.00 C ATOM 1093 O GLY A 69 11.052 1.866 -27.145 1.00 0.00 O ATOM 0 H GLY A 69 7.960 4.403 -28.667 1.00 0.00 H new ATOM 0 HA2 GLY A 69 10.483 3.141 -29.313 1.00 0.00 H new ATOM 0 HA3 GLY A 69 10.228 4.486 -28.218 1.00 0.00 H new ATOM 1097 N TYR A 70 9.082 2.510 -26.409 1.00 0.00 N ATOM 1098 CA TYR A 70 9.169 1.622 -25.216 1.00 0.00 C ATOM 1099 C TYR A 70 9.156 0.147 -25.642 1.00 0.00 C ATOM 1100 O TYR A 70 9.959 -0.636 -25.176 1.00 0.00 O ATOM 1101 CB TYR A 70 7.990 1.911 -24.286 1.00 0.00 C ATOM 1102 CG TYR A 70 8.024 0.973 -23.103 1.00 0.00 C ATOM 1103 CD1 TYR A 70 8.763 1.315 -21.965 1.00 0.00 C ATOM 1104 CD2 TYR A 70 7.323 -0.239 -23.144 1.00 0.00 C ATOM 1105 CE1 TYR A 70 8.805 0.445 -20.869 1.00 0.00 C ATOM 1106 CE2 TYR A 70 7.363 -1.110 -22.047 1.00 0.00 C ATOM 1107 CZ TYR A 70 8.104 -0.765 -20.909 1.00 0.00 C ATOM 1108 OH TYR A 70 8.147 -1.623 -19.828 1.00 0.00 O ATOM 0 H TYR A 70 8.226 3.060 -26.475 1.00 0.00 H new ATOM 0 HA TYR A 70 10.104 1.818 -24.691 1.00 0.00 H new ATOM 0 HB2 TYR A 70 8.032 2.945 -23.942 1.00 0.00 H new ATOM 0 HB3 TYR A 70 7.051 1.793 -24.828 1.00 0.00 H new ATOM 0 HD1 TYR A 70 9.301 2.251 -21.932 1.00 0.00 H new ATOM 0 HD2 TYR A 70 6.751 -0.502 -24.022 1.00 0.00 H new ATOM 0 HE1 TYR A 70 9.379 0.708 -19.993 1.00 0.00 H new ATOM 0 HE2 TYR A 70 6.824 -2.045 -22.079 1.00 0.00 H new ATOM 0 HH TYR A 70 7.605 -2.417 -20.019 1.00 0.00 H new ATOM 1118 N VAL A 71 8.275 -0.255 -26.524 1.00 0.00 N ATOM 1119 CA VAL A 71 8.271 -1.695 -26.928 1.00 0.00 C ATOM 1120 C VAL A 71 9.516 -1.970 -27.772 1.00 0.00 C ATOM 1121 O VAL A 71 10.044 -3.064 -27.780 1.00 0.00 O ATOM 1122 CB VAL A 71 7.008 -2.042 -27.728 1.00 0.00 C ATOM 1123 CG1 VAL A 71 5.750 -1.704 -26.924 1.00 0.00 C ATOM 1124 CG2 VAL A 71 7.002 -1.232 -29.029 1.00 0.00 C ATOM 0 H VAL A 71 7.574 0.335 -26.973 1.00 0.00 H new ATOM 0 HA VAL A 71 8.278 -2.316 -26.032 1.00 0.00 H new ATOM 0 HB VAL A 71 7.011 -3.110 -27.944 1.00 0.00 H new ATOM 0 HG11 VAL A 71 4.866 -1.957 -27.509 1.00 0.00 H new ATOM 0 HG12 VAL A 71 5.747 -2.275 -25.996 1.00 0.00 H new ATOM 0 HG13 VAL A 71 5.740 -0.638 -26.695 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.108 -1.473 -29.603 1.00 0.00 H new ATOM 0 HG22 VAL A 71 7.007 -0.167 -28.795 1.00 0.00 H new ATOM 0 HG23 VAL A 71 7.887 -1.479 -29.615 1.00 0.00 H new ATOM 1134 N ALA A 72 9.999 -0.978 -28.466 1.00 0.00 N ATOM 1135 CA ALA A 72 11.206 -1.180 -29.314 1.00 0.00 C ATOM 1136 C ALA A 72 12.408 -1.497 -28.418 1.00 0.00 C ATOM 1137 O ALA A 72 13.020 -2.540 -28.532 1.00 0.00 O ATOM 1138 CB ALA A 72 11.493 0.105 -30.094 1.00 0.00 C ATOM 0 H ALA A 72 9.610 -0.035 -28.483 1.00 0.00 H new ATOM 0 HA ALA A 72 11.033 -2.005 -30.006 1.00 0.00 H new ATOM 0 HB1 ALA A 72 12.376 -0.037 -30.717 1.00 0.00 H new ATOM 0 HB2 ALA A 72 10.638 0.346 -30.726 1.00 0.00 H new ATOM 0 HB3 ALA A 72 11.669 0.923 -29.395 1.00 0.00 H new ATOM 1144 N PHE A 73 12.763 -0.594 -27.544 1.00 0.00 N ATOM 1145 CA PHE A 73 13.955 -0.815 -26.674 1.00 0.00 C ATOM 1146 C PHE A 73 13.775 -2.064 -25.790 1.00 0.00 C ATOM 1147 O PHE A 73 14.597 -2.958 -25.800 1.00 0.00 O ATOM 1148 CB PHE A 73 14.157 0.415 -25.785 1.00 0.00 C ATOM 1149 CG PHE A 73 14.167 -0.007 -24.331 1.00 0.00 C ATOM 1150 CD1 PHE A 73 15.360 -0.429 -23.731 1.00 0.00 C ATOM 1151 CD2 PHE A 73 12.982 0.024 -23.585 1.00 0.00 C ATOM 1152 CE1 PHE A 73 15.368 -0.819 -22.385 1.00 0.00 C ATOM 1153 CE2 PHE A 73 12.991 -0.367 -22.239 1.00 0.00 C ATOM 1154 CZ PHE A 73 14.183 -0.788 -21.640 1.00 0.00 C ATOM 0 H PHE A 73 12.277 0.290 -27.394 1.00 0.00 H new ATOM 0 HA PHE A 73 14.827 -0.972 -27.309 1.00 0.00 H new ATOM 0 HB2 PHE A 73 15.095 0.909 -26.038 1.00 0.00 H new ATOM 0 HB3 PHE A 73 13.360 1.137 -25.959 1.00 0.00 H new ATOM 0 HD1 PHE A 73 16.274 -0.454 -24.306 1.00 0.00 H new ATOM 0 HD2 PHE A 73 12.061 0.349 -24.047 1.00 0.00 H new ATOM 0 HE1 PHE A 73 16.288 -1.144 -21.922 1.00 0.00 H new ATOM 0 HE2 PHE A 73 12.077 -0.343 -21.664 1.00 0.00 H new ATOM 0 HZ PHE A 73 14.189 -1.089 -20.603 1.00 0.00 H new ATOM 1164 N THR A 74 12.725 -2.131 -25.015 1.00 0.00 N ATOM 1165 CA THR A 74 12.534 -3.318 -24.126 1.00 0.00 C ATOM 1166 C THR A 74 12.520 -4.607 -24.956 1.00 0.00 C ATOM 1167 O THR A 74 12.968 -5.645 -24.509 1.00 0.00 O ATOM 1168 CB THR A 74 11.202 -3.197 -23.377 1.00 0.00 C ATOM 1169 OG1 THR A 74 11.090 -4.255 -22.436 1.00 0.00 O ATOM 1170 CG2 THR A 74 10.040 -3.265 -24.367 1.00 0.00 C ATOM 0 H THR A 74 11.995 -1.421 -24.958 1.00 0.00 H new ATOM 0 HA THR A 74 13.359 -3.353 -23.414 1.00 0.00 H new ATOM 0 HB THR A 74 11.169 -2.241 -22.855 1.00 0.00 H new ATOM 0 HG1 THR A 74 10.239 -4.177 -21.956 1.00 0.00 H new ATOM 0 HG21 THR A 74 9.097 -3.178 -23.828 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.124 -2.448 -25.084 1.00 0.00 H new ATOM 0 HG23 THR A 74 10.069 -4.217 -24.897 1.00 0.00 H new ATOM 1178 N SER A 75 11.989 -4.558 -26.147 1.00 0.00 N ATOM 1179 CA SER A 75 11.920 -5.790 -26.986 1.00 0.00 C ATOM 1180 C SER A 75 13.320 -6.218 -27.450 1.00 0.00 C ATOM 1181 O SER A 75 13.561 -7.378 -27.715 1.00 0.00 O ATOM 1182 CB SER A 75 11.043 -5.515 -28.207 1.00 0.00 C ATOM 1183 OG SER A 75 11.577 -4.412 -28.929 1.00 0.00 O ATOM 0 H SER A 75 11.600 -3.719 -26.576 1.00 0.00 H new ATOM 0 HA SER A 75 11.494 -6.596 -26.389 1.00 0.00 H new ATOM 0 HB2 SER A 75 11.002 -6.397 -28.846 1.00 0.00 H new ATOM 0 HB3 SER A 75 10.021 -5.300 -27.894 1.00 0.00 H new ATOM 0 HG SER A 75 11.604 -3.623 -28.348 1.00 0.00 H new ATOM 1189 N HIS A 76 14.244 -5.301 -27.556 1.00 0.00 N ATOM 1190 CA HIS A 76 15.615 -5.682 -28.014 1.00 0.00 C ATOM 1191 C HIS A 76 16.267 -6.609 -26.977 1.00 0.00 C ATOM 1192 O HIS A 76 15.972 -6.533 -25.804 1.00 0.00 O ATOM 1193 CB HIS A 76 16.469 -4.419 -28.168 1.00 0.00 C ATOM 1194 CG HIS A 76 16.093 -3.700 -29.435 1.00 0.00 C ATOM 1195 ND1 HIS A 76 15.267 -2.584 -29.434 1.00 0.00 N ATOM 1196 CD2 HIS A 76 16.420 -3.923 -30.750 1.00 0.00 C ATOM 1197 CE1 HIS A 76 15.126 -2.181 -30.709 1.00 0.00 C ATOM 1198 NE2 HIS A 76 15.810 -2.962 -31.548 1.00 0.00 N ATOM 0 H HIS A 76 14.112 -4.311 -27.347 1.00 0.00 H new ATOM 0 HA HIS A 76 15.545 -6.199 -28.971 1.00 0.00 H new ATOM 0 HB2 HIS A 76 16.322 -3.763 -27.310 1.00 0.00 H new ATOM 0 HB3 HIS A 76 17.526 -4.684 -28.190 1.00 0.00 H new ATOM 0 HD2 HIS A 76 17.053 -4.721 -31.109 1.00 0.00 H new ATOM 0 HE1 HIS A 76 14.534 -1.332 -31.016 1.00 0.00 H new ATOM 0 HE2 HIS A 76 15.872 -2.872 -32.562 1.00 0.00 H new ATOM 1207 N PRO A 77 17.152 -7.472 -27.405 1.00 0.00 N ATOM 1208 CA PRO A 77 17.871 -8.413 -26.489 1.00 0.00 C ATOM 1209 C PRO A 77 18.927 -7.700 -25.625 1.00 0.00 C ATOM 1210 O PRO A 77 19.446 -8.259 -24.680 1.00 0.00 O ATOM 1211 CB PRO A 77 18.534 -9.389 -27.464 1.00 0.00 C ATOM 1212 CG PRO A 77 18.761 -8.587 -28.703 1.00 0.00 C ATOM 1213 CD PRO A 77 17.567 -7.629 -28.819 1.00 0.00 C ATOM 0 HA PRO A 77 17.203 -8.888 -25.770 1.00 0.00 H new ATOM 0 HB2 PRO A 77 19.472 -9.774 -27.063 1.00 0.00 H new ATOM 0 HB3 PRO A 77 17.894 -10.249 -27.660 1.00 0.00 H new ATOM 0 HG2 PRO A 77 19.699 -8.035 -28.643 1.00 0.00 H new ATOM 0 HG3 PRO A 77 18.828 -9.233 -29.578 1.00 0.00 H new ATOM 0 HD2 PRO A 77 17.851 -6.677 -29.268 1.00 0.00 H new ATOM 0 HD3 PRO A 77 16.769 -8.046 -29.434 1.00 0.00 H new ATOM 1221 N LEU A 78 19.250 -6.475 -25.953 1.00 0.00 N ATOM 1222 CA LEU A 78 20.266 -5.709 -25.161 1.00 0.00 C ATOM 1223 C LEU A 78 19.704 -5.289 -23.795 1.00 0.00 C ATOM 1224 O LEU A 78 20.439 -5.115 -22.842 1.00 0.00 O ATOM 1225 CB LEU A 78 20.643 -4.450 -25.943 1.00 0.00 C ATOM 1226 CG LEU A 78 22.013 -3.938 -25.496 1.00 0.00 C ATOM 1227 CD1 LEU A 78 22.765 -3.394 -26.710 1.00 0.00 C ATOM 1228 CD2 LEU A 78 21.831 -2.813 -24.472 1.00 0.00 C ATOM 0 H LEU A 78 18.851 -5.966 -26.742 1.00 0.00 H new ATOM 0 HA LEU A 78 21.135 -6.347 -24.997 1.00 0.00 H new ATOM 0 HB2 LEU A 78 20.659 -4.668 -27.011 1.00 0.00 H new ATOM 0 HB3 LEU A 78 19.890 -3.678 -25.787 1.00 0.00 H new ATOM 0 HG LEU A 78 22.577 -4.754 -25.044 1.00 0.00 H new ATOM 0 HD11 LEU A 78 23.743 -3.027 -26.398 1.00 0.00 H new ATOM 0 HD12 LEU A 78 22.893 -4.189 -27.445 1.00 0.00 H new ATOM 0 HD13 LEU A 78 22.196 -2.577 -27.154 1.00 0.00 H new ATOM 0 HD21 LEU A 78 22.808 -2.449 -24.154 1.00 0.00 H new ATOM 0 HD22 LEU A 78 21.269 -1.996 -24.925 1.00 0.00 H new ATOM 0 HD23 LEU A 78 21.286 -3.193 -23.607 1.00 0.00 H new ATOM 1240 N HIS A 79 18.418 -5.092 -23.697 1.00 0.00 N ATOM 1241 CA HIS A 79 17.830 -4.656 -22.394 1.00 0.00 C ATOM 1242 C HIS A 79 17.596 -5.865 -21.489 1.00 0.00 C ATOM 1243 O HIS A 79 17.688 -5.777 -20.280 1.00 0.00 O ATOM 1244 CB HIS A 79 16.493 -3.958 -22.650 1.00 0.00 C ATOM 1245 CG HIS A 79 15.841 -3.627 -21.334 1.00 0.00 C ATOM 1246 ND1 HIS A 79 16.507 -2.932 -20.332 1.00 0.00 N ATOM 1247 CD2 HIS A 79 14.587 -3.883 -20.843 1.00 0.00 C ATOM 1248 CE1 HIS A 79 15.655 -2.797 -19.300 1.00 0.00 C ATOM 1249 NE2 HIS A 79 14.474 -3.359 -19.561 1.00 0.00 N ATOM 0 H HIS A 79 17.750 -5.213 -24.458 1.00 0.00 H new ATOM 0 HA HIS A 79 18.523 -3.971 -21.905 1.00 0.00 H new ATOM 0 HB2 HIS A 79 16.650 -3.048 -23.229 1.00 0.00 H new ATOM 0 HB3 HIS A 79 15.841 -4.602 -23.239 1.00 0.00 H new ATOM 0 HD2 HIS A 79 13.807 -4.411 -21.371 1.00 0.00 H new ATOM 0 HE1 HIS A 79 15.897 -2.296 -18.375 1.00 0.00 H new ATOM 0 HE2 HIS A 79 13.659 -3.396 -18.948 1.00 0.00 H new ATOM 1258 N VAL A 80 17.282 -6.988 -22.062 1.00 0.00 N ATOM 1259 CA VAL A 80 17.033 -8.202 -21.240 1.00 0.00 C ATOM 1260 C VAL A 80 18.303 -8.592 -20.483 1.00 0.00 C ATOM 1261 O VAL A 80 18.326 -8.634 -19.269 1.00 0.00 O ATOM 1262 CB VAL A 80 16.617 -9.344 -22.161 1.00 0.00 C ATOM 1263 CG1 VAL A 80 16.559 -10.648 -21.367 1.00 0.00 C ATOM 1264 CG2 VAL A 80 15.238 -9.037 -22.749 1.00 0.00 C ATOM 0 H VAL A 80 17.186 -7.120 -23.069 1.00 0.00 H new ATOM 0 HA VAL A 80 16.242 -7.997 -20.518 1.00 0.00 H new ATOM 0 HB VAL A 80 17.343 -9.449 -22.967 1.00 0.00 H new ATOM 0 HG11 VAL A 80 16.262 -11.463 -22.027 1.00 0.00 H new ATOM 0 HG12 VAL A 80 17.542 -10.862 -20.946 1.00 0.00 H new ATOM 0 HG13 VAL A 80 15.832 -10.551 -20.560 1.00 0.00 H new ATOM 0 HG21 VAL A 80 14.935 -9.850 -23.409 1.00 0.00 H new ATOM 0 HG22 VAL A 80 14.513 -8.935 -21.942 1.00 0.00 H new ATOM 0 HG23 VAL A 80 15.283 -8.107 -23.316 1.00 0.00 H new ATOM 1274 N GLU A 81 19.359 -8.883 -21.190 1.00 0.00 N ATOM 1275 CA GLU A 81 20.633 -9.245 -20.510 1.00 0.00 C ATOM 1276 C GLU A 81 21.001 -8.161 -19.498 1.00 0.00 C ATOM 1277 O GLU A 81 21.504 -8.440 -18.428 1.00 0.00 O ATOM 1278 CB GLU A 81 21.747 -9.369 -21.550 1.00 0.00 C ATOM 1279 CG GLU A 81 23.013 -9.901 -20.880 1.00 0.00 C ATOM 1280 CD GLU A 81 24.152 -9.940 -21.899 1.00 0.00 C ATOM 1281 OE1 GLU A 81 23.930 -9.518 -23.022 1.00 0.00 O ATOM 1282 OE2 GLU A 81 25.226 -10.392 -21.538 1.00 0.00 O ATOM 0 H GLU A 81 19.395 -8.886 -22.209 1.00 0.00 H new ATOM 0 HA GLU A 81 20.509 -10.196 -19.992 1.00 0.00 H new ATOM 0 HB2 GLU A 81 21.438 -10.040 -22.352 1.00 0.00 H new ATOM 0 HB3 GLU A 81 21.944 -8.398 -22.005 1.00 0.00 H new ATOM 0 HG2 GLU A 81 23.286 -9.265 -20.038 1.00 0.00 H new ATOM 0 HG3 GLU A 81 22.834 -10.899 -20.481 1.00 0.00 H new ATOM 1289 N PHE A 82 20.755 -6.923 -19.827 1.00 0.00 N ATOM 1290 CA PHE A 82 21.080 -5.823 -18.877 1.00 0.00 C ATOM 1291 C PHE A 82 20.125 -5.868 -17.682 1.00 0.00 C ATOM 1292 O PHE A 82 20.521 -5.657 -16.553 1.00 0.00 O ATOM 1293 CB PHE A 82 20.937 -4.476 -19.590 1.00 0.00 C ATOM 1294 CG PHE A 82 21.250 -3.359 -18.623 1.00 0.00 C ATOM 1295 CD1 PHE A 82 22.579 -2.973 -18.406 1.00 0.00 C ATOM 1296 CD2 PHE A 82 20.213 -2.708 -17.946 1.00 0.00 C ATOM 1297 CE1 PHE A 82 22.870 -1.938 -17.510 1.00 0.00 C ATOM 1298 CE2 PHE A 82 20.504 -1.672 -17.050 1.00 0.00 C ATOM 1299 CZ PHE A 82 21.832 -1.287 -16.833 1.00 0.00 C ATOM 0 H PHE A 82 20.343 -6.626 -20.712 1.00 0.00 H new ATOM 0 HA PHE A 82 22.104 -5.946 -18.524 1.00 0.00 H new ATOM 0 HB2 PHE A 82 21.612 -4.431 -20.445 1.00 0.00 H new ATOM 0 HB3 PHE A 82 19.924 -4.363 -19.977 1.00 0.00 H new ATOM 0 HD1 PHE A 82 23.379 -3.474 -18.930 1.00 0.00 H new ATOM 0 HD2 PHE A 82 19.188 -3.004 -18.114 1.00 0.00 H new ATOM 0 HE1 PHE A 82 23.895 -1.642 -17.341 1.00 0.00 H new ATOM 0 HE2 PHE A 82 19.704 -1.170 -16.526 1.00 0.00 H new ATOM 0 HZ PHE A 82 22.056 -0.487 -16.143 1.00 0.00 H new ATOM 1309 N SER A 83 18.868 -6.137 -17.920 1.00 0.00 N ATOM 1310 CA SER A 83 17.886 -6.168 -16.796 1.00 0.00 C ATOM 1311 C SER A 83 18.257 -7.273 -15.803 1.00 0.00 C ATOM 1312 O SER A 83 18.181 -7.088 -14.604 1.00 0.00 O ATOM 1313 CB SER A 83 16.485 -6.427 -17.345 1.00 0.00 C ATOM 1314 OG SER A 83 15.537 -6.286 -16.298 1.00 0.00 O ATOM 0 H SER A 83 18.480 -6.336 -18.842 1.00 0.00 H new ATOM 0 HA SER A 83 17.905 -5.206 -16.283 1.00 0.00 H new ATOM 0 HB2 SER A 83 16.262 -5.726 -18.150 1.00 0.00 H new ATOM 0 HB3 SER A 83 16.428 -7.429 -17.770 1.00 0.00 H new ATOM 0 HG SER A 83 14.636 -6.450 -16.648 1.00 0.00 H new ATOM 1320 N ALA A 84 18.664 -8.418 -16.282 1.00 0.00 N ATOM 1321 CA ALA A 84 19.033 -9.515 -15.344 1.00 0.00 C ATOM 1322 C ALA A 84 20.153 -9.023 -14.432 1.00 0.00 C ATOM 1323 O ALA A 84 20.080 -9.127 -13.224 1.00 0.00 O ATOM 1324 CB ALA A 84 19.521 -10.732 -16.128 1.00 0.00 C ATOM 0 H ALA A 84 18.756 -8.639 -17.273 1.00 0.00 H new ATOM 0 HA ALA A 84 18.161 -9.799 -14.754 1.00 0.00 H new ATOM 0 HB1 ALA A 84 19.788 -11.529 -15.434 1.00 0.00 H new ATOM 0 HB2 ALA A 84 18.729 -11.079 -16.791 1.00 0.00 H new ATOM 0 HB3 ALA A 84 20.395 -10.458 -16.719 1.00 0.00 H new ATOM 1330 N ALA A 85 21.182 -8.470 -15.007 1.00 0.00 N ATOM 1331 CA ALA A 85 22.297 -7.943 -14.183 1.00 0.00 C ATOM 1332 C ALA A 85 21.802 -6.721 -13.414 1.00 0.00 C ATOM 1333 O ALA A 85 22.096 -6.550 -12.248 1.00 0.00 O ATOM 1334 CB ALA A 85 23.459 -7.540 -15.088 1.00 0.00 C ATOM 0 H ALA A 85 21.297 -8.361 -16.015 1.00 0.00 H new ATOM 0 HA ALA A 85 22.637 -8.709 -13.487 1.00 0.00 H new ATOM 0 HB1 ALA A 85 24.277 -7.153 -14.480 1.00 0.00 H new ATOM 0 HB2 ALA A 85 23.803 -8.410 -15.648 1.00 0.00 H new ATOM 0 HB3 ALA A 85 23.128 -6.769 -15.784 1.00 0.00 H new ATOM 1340 N PHE A 86 21.033 -5.876 -14.050 1.00 0.00 N ATOM 1341 CA PHE A 86 20.516 -4.681 -13.333 1.00 0.00 C ATOM 1342 C PHE A 86 20.025 -5.125 -11.960 1.00 0.00 C ATOM 1343 O PHE A 86 20.105 -4.392 -10.994 1.00 0.00 O ATOM 1344 CB PHE A 86 19.356 -4.057 -14.113 1.00 0.00 C ATOM 1345 CG PHE A 86 19.123 -2.645 -13.629 1.00 0.00 C ATOM 1346 CD1 PHE A 86 20.107 -1.668 -13.817 1.00 0.00 C ATOM 1347 CD2 PHE A 86 17.920 -2.314 -12.992 1.00 0.00 C ATOM 1348 CE1 PHE A 86 19.890 -0.360 -13.369 1.00 0.00 C ATOM 1349 CE2 PHE A 86 17.702 -1.004 -12.547 1.00 0.00 C ATOM 1350 CZ PHE A 86 18.687 -0.029 -12.735 1.00 0.00 C ATOM 0 H PHE A 86 20.745 -5.963 -15.025 1.00 0.00 H new ATOM 0 HA PHE A 86 21.307 -3.938 -13.234 1.00 0.00 H new ATOM 0 HB2 PHE A 86 19.581 -4.054 -15.180 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.453 -4.652 -13.979 1.00 0.00 H new ATOM 0 HD1 PHE A 86 21.034 -1.923 -14.308 1.00 0.00 H new ATOM 0 HD2 PHE A 86 17.161 -3.068 -12.844 1.00 0.00 H new ATOM 0 HE1 PHE A 86 20.650 0.393 -13.512 1.00 0.00 H new ATOM 0 HE2 PHE A 86 16.774 -0.747 -12.059 1.00 0.00 H new ATOM 0 HZ PHE A 86 18.519 0.981 -12.390 1.00 0.00 H new ATOM 1360 N THR A 87 19.541 -6.334 -11.854 1.00 0.00 N ATOM 1361 CA THR A 87 19.071 -6.817 -10.532 1.00 0.00 C ATOM 1362 C THR A 87 20.285 -7.306 -9.753 1.00 0.00 C ATOM 1363 O THR A 87 20.627 -6.783 -8.714 1.00 0.00 O ATOM 1364 CB THR A 87 18.095 -7.980 -10.718 1.00 0.00 C ATOM 1365 OG1 THR A 87 17.182 -7.666 -11.760 1.00 0.00 O ATOM 1366 CG2 THR A 87 17.321 -8.224 -9.423 1.00 0.00 C ATOM 0 H THR A 87 19.453 -7.000 -12.621 1.00 0.00 H new ATOM 0 HA THR A 87 18.565 -6.012 -9.999 1.00 0.00 H new ATOM 0 HB THR A 87 18.654 -8.879 -10.976 1.00 0.00 H new ATOM 0 HG1 THR A 87 16.557 -8.410 -11.882 1.00 0.00 H new ATOM 0 HG21 THR A 87 16.628 -9.054 -9.564 1.00 0.00 H new ATOM 0 HG22 THR A 87 18.019 -8.466 -8.622 1.00 0.00 H new ATOM 0 HG23 THR A 87 16.763 -7.326 -9.158 1.00 0.00 H new ATOM 1374 N ALA A 88 20.949 -8.303 -10.270 1.00 0.00 N ATOM 1375 CA ALA A 88 22.163 -8.830 -9.591 1.00 0.00 C ATOM 1376 C ALA A 88 22.955 -7.682 -8.966 1.00 0.00 C ATOM 1377 O ALA A 88 23.648 -7.859 -7.985 1.00 0.00 O ATOM 1378 CB ALA A 88 23.052 -9.524 -10.622 1.00 0.00 C ATOM 0 H ALA A 88 20.700 -8.777 -11.138 1.00 0.00 H new ATOM 0 HA ALA A 88 21.858 -9.531 -8.814 1.00 0.00 H new ATOM 0 HB1 ALA A 88 23.944 -9.913 -10.131 1.00 0.00 H new ATOM 0 HB2 ALA A 88 22.503 -10.346 -11.081 1.00 0.00 H new ATOM 0 HB3 ALA A 88 23.344 -8.809 -11.391 1.00 0.00 H new ATOM 1384 N VAL A 89 22.877 -6.513 -9.535 1.00 0.00 N ATOM 1385 CA VAL A 89 23.641 -5.361 -8.982 1.00 0.00 C ATOM 1386 C VAL A 89 22.730 -4.454 -8.141 1.00 0.00 C ATOM 1387 O VAL A 89 23.080 -3.324 -7.850 1.00 0.00 O ATOM 1388 CB VAL A 89 24.241 -4.564 -10.142 1.00 0.00 C ATOM 1389 CG1 VAL A 89 24.974 -5.520 -11.083 1.00 0.00 C ATOM 1390 CG2 VAL A 89 23.121 -3.858 -10.916 1.00 0.00 C ATOM 0 H VAL A 89 22.316 -6.305 -10.361 1.00 0.00 H new ATOM 0 HA VAL A 89 24.434 -5.736 -8.335 1.00 0.00 H new ATOM 0 HB VAL A 89 24.937 -3.822 -9.750 1.00 0.00 H new ATOM 0 HG11 VAL A 89 25.403 -4.957 -11.912 1.00 0.00 H new ATOM 0 HG12 VAL A 89 25.770 -6.028 -10.538 1.00 0.00 H new ATOM 0 HG13 VAL A 89 24.272 -6.258 -11.471 1.00 0.00 H new ATOM 0 HG21 VAL A 89 23.551 -3.291 -11.742 1.00 0.00 H new ATOM 0 HG22 VAL A 89 22.426 -4.600 -11.309 1.00 0.00 H new ATOM 0 HG23 VAL A 89 22.589 -3.180 -10.249 1.00 0.00 H new ATOM 1400 N ILE A 90 21.575 -4.918 -7.741 1.00 0.00 N ATOM 1401 CA ILE A 90 20.692 -4.054 -6.906 1.00 0.00 C ATOM 1402 C ILE A 90 20.289 -4.784 -5.625 1.00 0.00 C ATOM 1403 O ILE A 90 20.322 -5.995 -5.540 1.00 0.00 O ATOM 1404 CB ILE A 90 19.431 -3.684 -7.695 1.00 0.00 C ATOM 1405 CG1 ILE A 90 19.778 -2.604 -8.724 1.00 0.00 C ATOM 1406 CG2 ILE A 90 18.373 -3.147 -6.727 1.00 0.00 C ATOM 1407 CD1 ILE A 90 18.569 -2.345 -9.622 1.00 0.00 C ATOM 0 H ILE A 90 21.209 -5.846 -7.953 1.00 0.00 H new ATOM 0 HA ILE A 90 21.240 -3.149 -6.643 1.00 0.00 H new ATOM 0 HB ILE A 90 19.044 -4.564 -8.208 1.00 0.00 H new ATOM 0 HG12 ILE A 90 20.071 -1.685 -8.217 1.00 0.00 H new ATOM 0 HG13 ILE A 90 20.630 -2.921 -9.326 1.00 0.00 H new ATOM 0 HG21 ILE A 90 17.473 -2.882 -7.282 1.00 0.00 H new ATOM 0 HG22 ILE A 90 18.132 -3.913 -5.990 1.00 0.00 H new ATOM 0 HG23 ILE A 90 18.760 -2.263 -6.219 1.00 0.00 H new ATOM 0 HD11 ILE A 90 18.817 -1.576 -10.354 1.00 0.00 H new ATOM 0 HD12 ILE A 90 18.297 -3.265 -10.140 1.00 0.00 H new ATOM 0 HD13 ILE A 90 17.729 -2.009 -9.014 1.00 0.00 H new ATOM 1419 N ASP A 91 19.886 -4.030 -4.635 1.00 0.00 N ATOM 1420 CA ASP A 91 19.462 -4.619 -3.333 1.00 0.00 C ATOM 1421 C ASP A 91 17.932 -4.618 -3.271 1.00 0.00 C ATOM 1422 O ASP A 91 17.312 -5.487 -2.690 1.00 0.00 O ATOM 1423 CB ASP A 91 19.997 -3.729 -2.212 1.00 0.00 C ATOM 1424 CG ASP A 91 19.518 -4.234 -0.852 1.00 0.00 C ATOM 1425 OD1 ASP A 91 18.872 -5.266 -0.810 1.00 0.00 O ATOM 1426 OD2 ASP A 91 19.809 -3.572 0.135 1.00 0.00 O ATOM 0 H ASP A 91 19.833 -3.012 -4.677 1.00 0.00 H new ATOM 0 HA ASP A 91 19.841 -5.636 -3.230 1.00 0.00 H new ATOM 0 HB2 ASP A 91 21.087 -3.716 -2.239 1.00 0.00 H new ATOM 0 HB3 ASP A 91 19.663 -2.703 -2.364 1.00 0.00 H new ATOM 1431 N LYS A 92 17.332 -3.638 -3.894 1.00 0.00 N ATOM 1432 CA LYS A 92 15.846 -3.525 -3.914 1.00 0.00 C ATOM 1433 C LYS A 92 15.423 -2.795 -5.201 1.00 0.00 C ATOM 1434 O LYS A 92 16.153 -1.973 -5.714 1.00 0.00 O ATOM 1435 CB LYS A 92 15.406 -2.702 -2.700 1.00 0.00 C ATOM 1436 CG LYS A 92 15.676 -1.214 -2.964 1.00 0.00 C ATOM 1437 CD LYS A 92 15.382 -0.393 -1.699 1.00 0.00 C ATOM 1438 CE LYS A 92 15.128 1.072 -2.083 1.00 0.00 C ATOM 1439 NZ LYS A 92 15.266 1.942 -0.878 1.00 0.00 N ATOM 0 H LYS A 92 17.820 -2.898 -4.399 1.00 0.00 H new ATOM 0 HA LYS A 92 15.387 -4.513 -3.882 1.00 0.00 H new ATOM 0 HB2 LYS A 92 14.345 -2.861 -2.505 1.00 0.00 H new ATOM 0 HB3 LYS A 92 15.946 -3.028 -1.811 1.00 0.00 H new ATOM 0 HG2 LYS A 92 16.714 -1.072 -3.266 1.00 0.00 H new ATOM 0 HG3 LYS A 92 15.054 -0.864 -3.787 1.00 0.00 H new ATOM 0 HD2 LYS A 92 14.513 -0.800 -1.183 1.00 0.00 H new ATOM 0 HD3 LYS A 92 16.222 -0.458 -1.008 1.00 0.00 H new ATOM 0 HE2 LYS A 92 15.836 1.384 -2.851 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.130 1.178 -2.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.325 2.265 -0.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.713 1.402 -0.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.856 2.766 -1.111 1.00 0.00 H new ATOM 1453 N ILE A 93 14.264 -3.089 -5.740 1.00 0.00 N ATOM 1454 CA ILE A 93 13.851 -2.407 -7.008 1.00 0.00 C ATOM 1455 C ILE A 93 12.485 -1.736 -6.814 1.00 0.00 C ATOM 1456 O ILE A 93 11.513 -2.367 -6.443 1.00 0.00 O ATOM 1457 CB ILE A 93 13.793 -3.418 -8.169 1.00 0.00 C ATOM 1458 CG1 ILE A 93 13.700 -2.663 -9.502 1.00 0.00 C ATOM 1459 CG2 ILE A 93 12.570 -4.324 -8.023 1.00 0.00 C ATOM 1460 CD1 ILE A 93 15.102 -2.277 -9.982 1.00 0.00 C ATOM 0 H ILE A 93 13.595 -3.761 -5.364 1.00 0.00 H new ATOM 0 HA ILE A 93 14.589 -1.644 -7.256 1.00 0.00 H new ATOM 0 HB ILE A 93 14.696 -4.028 -8.148 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.209 -3.286 -10.249 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.089 -1.769 -9.381 1.00 0.00 H new ATOM 0 HG21 ILE A 93 12.542 -5.033 -8.850 1.00 0.00 H new ATOM 0 HG22 ILE A 93 12.631 -4.868 -7.080 1.00 0.00 H new ATOM 0 HG23 ILE A 93 11.664 -3.717 -8.034 1.00 0.00 H new ATOM 0 HD11 ILE A 93 15.028 -1.742 -10.929 1.00 0.00 H new ATOM 0 HD12 ILE A 93 15.577 -1.637 -9.239 1.00 0.00 H new ATOM 0 HD13 ILE A 93 15.700 -3.178 -10.121 1.00 0.00 H new ATOM 1472 N VAL A 94 12.416 -0.454 -7.068 1.00 0.00 N ATOM 1473 CA VAL A 94 11.125 0.298 -6.931 1.00 0.00 C ATOM 1474 C VAL A 94 10.853 1.047 -8.247 1.00 0.00 C ATOM 1475 O VAL A 94 11.724 1.716 -8.763 1.00 0.00 O ATOM 1476 CB VAL A 94 11.265 1.320 -5.793 1.00 0.00 C ATOM 1477 CG1 VAL A 94 9.940 2.045 -5.570 1.00 0.00 C ATOM 1478 CG2 VAL A 94 11.678 0.610 -4.501 1.00 0.00 C ATOM 0 H VAL A 94 13.208 0.114 -7.369 1.00 0.00 H new ATOM 0 HA VAL A 94 10.307 -0.389 -6.714 1.00 0.00 H new ATOM 0 HB VAL A 94 12.030 2.046 -6.069 1.00 0.00 H new ATOM 0 HG11 VAL A 94 10.052 2.767 -4.761 1.00 0.00 H new ATOM 0 HG12 VAL A 94 9.652 2.565 -6.483 1.00 0.00 H new ATOM 0 HG13 VAL A 94 9.169 1.321 -5.306 1.00 0.00 H new ATOM 0 HG21 VAL A 94 11.775 1.342 -3.699 1.00 0.00 H new ATOM 0 HG22 VAL A 94 10.920 -0.125 -4.232 1.00 0.00 H new ATOM 0 HG23 VAL A 94 12.633 0.107 -4.651 1.00 0.00 H new ATOM 1488 N LEU A 95 9.668 0.954 -8.807 1.00 0.00 N ATOM 1489 CA LEU A 95 9.425 1.669 -10.105 1.00 0.00 C ATOM 1490 C LEU A 95 8.013 2.272 -10.167 1.00 0.00 C ATOM 1491 O LEU A 95 7.037 1.651 -9.795 1.00 0.00 O ATOM 1492 CB LEU A 95 9.586 0.706 -11.279 1.00 0.00 C ATOM 1493 CG LEU A 95 10.701 -0.299 -10.991 1.00 0.00 C ATOM 1494 CD1 LEU A 95 10.186 -1.370 -10.027 1.00 0.00 C ATOM 1495 CD2 LEU A 95 11.129 -0.961 -12.305 1.00 0.00 C ATOM 0 H LEU A 95 8.877 0.429 -8.434 1.00 0.00 H new ATOM 0 HA LEU A 95 10.158 2.473 -10.167 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.649 0.179 -11.457 1.00 0.00 H new ATOM 0 HB3 LEU A 95 9.815 1.264 -12.187 1.00 0.00 H new ATOM 0 HG LEU A 95 11.551 0.214 -10.541 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.981 -2.087 -9.821 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.871 -0.900 -9.095 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.338 -1.887 -10.477 1.00 0.00 H new ATOM 0 HD21 LEU A 95 11.925 -1.680 -12.108 1.00 0.00 H new ATOM 0 HD22 LEU A 95 10.276 -1.476 -12.748 1.00 0.00 H new ATOM 0 HD23 LEU A 95 11.491 -0.199 -12.995 1.00 0.00 H new ATOM 1507 N LEU A 96 7.912 3.477 -10.675 1.00 0.00 N ATOM 1508 CA LEU A 96 6.581 4.136 -10.829 1.00 0.00 C ATOM 1509 C LEU A 96 6.329 4.432 -12.312 1.00 0.00 C ATOM 1510 O LEU A 96 7.121 5.082 -12.962 1.00 0.00 O ATOM 1511 CB LEU A 96 6.561 5.471 -10.072 1.00 0.00 C ATOM 1512 CG LEU A 96 7.467 5.411 -8.844 1.00 0.00 C ATOM 1513 CD1 LEU A 96 8.933 5.386 -9.282 1.00 0.00 C ATOM 1514 CD2 LEU A 96 7.217 6.654 -7.987 1.00 0.00 C ATOM 0 H LEU A 96 8.704 4.036 -10.992 1.00 0.00 H new ATOM 0 HA LEU A 96 5.816 3.470 -10.431 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.889 6.274 -10.732 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.541 5.706 -9.766 1.00 0.00 H new ATOM 0 HG LEU A 96 7.250 4.509 -8.271 1.00 0.00 H new ATOM 0 HD11 LEU A 96 9.575 5.343 -8.402 1.00 0.00 H new ATOM 0 HD12 LEU A 96 9.112 4.509 -9.905 1.00 0.00 H new ATOM 0 HD13 LEU A 96 9.158 6.288 -9.852 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.858 6.624 -7.106 1.00 0.00 H new ATOM 0 HD22 LEU A 96 7.442 7.548 -8.569 1.00 0.00 H new ATOM 0 HD23 LEU A 96 6.173 6.677 -7.675 1.00 0.00 H new ATOM 1526 N ASP A 97 5.225 3.980 -12.850 1.00 0.00 N ATOM 1527 CA ASP A 97 4.923 4.265 -14.286 1.00 0.00 C ATOM 1528 C ASP A 97 3.600 5.038 -14.372 1.00 0.00 C ATOM 1529 O ASP A 97 2.584 4.603 -13.869 1.00 0.00 O ATOM 1530 CB ASP A 97 4.796 2.954 -15.067 1.00 0.00 C ATOM 1531 CG ASP A 97 3.610 2.150 -14.525 1.00 0.00 C ATOM 1532 OD1 ASP A 97 3.235 2.376 -13.386 1.00 0.00 O ATOM 1533 OD2 ASP A 97 3.095 1.322 -15.260 1.00 0.00 O ATOM 0 H ASP A 97 4.522 3.428 -12.359 1.00 0.00 H new ATOM 0 HA ASP A 97 5.732 4.856 -14.716 1.00 0.00 H new ATOM 0 HB2 ASP A 97 4.654 3.162 -16.127 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.714 2.374 -14.976 1.00 0.00 H new ATOM 1538 N PHE A 98 3.606 6.186 -14.997 1.00 0.00 N ATOM 1539 CA PHE A 98 2.346 6.986 -15.101 1.00 0.00 C ATOM 1540 C PHE A 98 2.385 7.893 -16.338 1.00 0.00 C ATOM 1541 O PHE A 98 3.287 8.688 -16.493 1.00 0.00 O ATOM 1542 CB PHE A 98 2.208 7.869 -13.855 1.00 0.00 C ATOM 1543 CG PHE A 98 0.924 8.662 -13.922 1.00 0.00 C ATOM 1544 CD1 PHE A 98 -0.303 8.027 -13.690 1.00 0.00 C ATOM 1545 CD2 PHE A 98 0.961 10.031 -14.215 1.00 0.00 C ATOM 1546 CE1 PHE A 98 -1.492 8.762 -13.753 1.00 0.00 C ATOM 1547 CE2 PHE A 98 -0.229 10.765 -14.275 1.00 0.00 C ATOM 1548 CZ PHE A 98 -1.456 10.131 -14.043 1.00 0.00 C ATOM 0 H PHE A 98 4.424 6.605 -15.439 1.00 0.00 H new ATOM 0 HA PHE A 98 1.503 6.300 -15.183 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.216 7.250 -12.958 1.00 0.00 H new ATOM 0 HB3 PHE A 98 3.059 8.546 -13.783 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.331 6.972 -13.463 1.00 0.00 H new ATOM 0 HD2 PHE A 98 1.907 10.520 -14.395 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -2.439 8.273 -13.578 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -0.201 11.821 -14.500 1.00 0.00 H new ATOM 0 HZ PHE A 98 -2.374 10.698 -14.088 1.00 0.00 H new ATOM 1558 N PRO A 99 1.416 7.782 -17.213 1.00 0.00 N ATOM 1559 CA PRO A 99 1.344 8.633 -18.437 1.00 0.00 C ATOM 1560 C PRO A 99 1.604 10.111 -18.130 1.00 0.00 C ATOM 1561 O PRO A 99 1.103 10.647 -17.161 1.00 0.00 O ATOM 1562 CB PRO A 99 -0.083 8.425 -18.939 1.00 0.00 C ATOM 1563 CG PRO A 99 -0.452 7.050 -18.493 1.00 0.00 C ATOM 1564 CD PRO A 99 0.282 6.820 -17.167 1.00 0.00 C ATOM 0 HA PRO A 99 2.103 8.359 -19.170 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -0.761 9.170 -18.522 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -0.137 8.516 -20.024 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -1.530 6.959 -18.362 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -0.158 6.308 -19.235 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -0.368 7.009 -16.313 1.00 0.00 H new ATOM 0 HD3 PRO A 99 0.634 5.792 -17.078 1.00 0.00 H new ATOM 1572 N VAL A 100 2.388 10.774 -18.938 1.00 0.00 N ATOM 1573 CA VAL A 100 2.674 12.214 -18.687 1.00 0.00 C ATOM 1574 C VAL A 100 2.227 13.054 -19.886 1.00 0.00 C ATOM 1575 O VAL A 100 2.404 12.670 -21.024 1.00 0.00 O ATOM 1576 CB VAL A 100 4.179 12.399 -18.465 1.00 0.00 C ATOM 1577 CG1 VAL A 100 4.517 13.891 -18.450 1.00 0.00 C ATOM 1578 CG2 VAL A 100 4.573 11.774 -17.123 1.00 0.00 C ATOM 0 H VAL A 100 2.842 10.379 -19.761 1.00 0.00 H new ATOM 0 HA VAL A 100 2.128 12.540 -17.802 1.00 0.00 H new ATOM 0 HB VAL A 100 4.728 11.913 -19.272 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.588 14.020 -18.292 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.235 14.338 -19.403 1.00 0.00 H new ATOM 0 HG13 VAL A 100 3.970 14.380 -17.644 1.00 0.00 H new ATOM 0 HG21 VAL A 100 5.643 11.904 -16.961 1.00 0.00 H new ATOM 0 HG22 VAL A 100 4.023 12.262 -16.319 1.00 0.00 H new ATOM 0 HG23 VAL A 100 4.334 10.711 -17.133 1.00 0.00 H new ATOM 1588 N ALA A 101 1.656 14.199 -19.634 1.00 0.00 N ATOM 1589 CA ALA A 101 1.206 15.076 -20.756 1.00 0.00 C ATOM 1590 C ALA A 101 2.045 16.360 -20.775 1.00 0.00 C ATOM 1591 O ALA A 101 1.773 17.303 -20.057 1.00 0.00 O ATOM 1592 CB ALA A 101 -0.266 15.436 -20.555 1.00 0.00 C ATOM 0 H ALA A 101 1.480 14.567 -18.699 1.00 0.00 H new ATOM 0 HA ALA A 101 1.331 14.549 -21.702 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -0.599 16.076 -21.372 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.865 14.525 -20.541 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -0.386 15.964 -19.609 1.00 0.00 H new ATOM 1598 N ALA A 102 3.062 16.407 -21.593 1.00 0.00 N ATOM 1599 CA ALA A 102 3.905 17.632 -21.657 1.00 0.00 C ATOM 1600 C ALA A 102 3.046 18.824 -22.077 1.00 0.00 C ATOM 1601 O ALA A 102 3.088 19.265 -23.210 1.00 0.00 O ATOM 1602 CB ALA A 102 5.030 17.429 -22.673 1.00 0.00 C ATOM 0 H ALA A 102 3.344 15.651 -22.218 1.00 0.00 H new ATOM 0 HA ALA A 102 4.336 17.825 -20.674 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.646 18.327 -22.718 1.00 0.00 H new ATOM 0 HB2 ALA A 102 5.645 16.582 -22.370 1.00 0.00 H new ATOM 0 HB3 ALA A 102 4.602 17.233 -23.656 1.00 0.00 H new ATOM 1608 N VAL A 103 2.264 19.349 -21.173 1.00 0.00 N ATOM 1609 CA VAL A 103 1.393 20.507 -21.517 1.00 0.00 C ATOM 1610 C VAL A 103 1.218 21.388 -20.281 1.00 0.00 C ATOM 1611 O VAL A 103 0.698 20.962 -19.269 1.00 0.00 O ATOM 1612 CB VAL A 103 0.030 19.997 -21.984 1.00 0.00 C ATOM 1613 CG1 VAL A 103 0.223 18.980 -23.109 1.00 0.00 C ATOM 1614 CG2 VAL A 103 -0.691 19.328 -20.811 1.00 0.00 C ATOM 0 H VAL A 103 2.191 19.024 -20.209 1.00 0.00 H new ATOM 0 HA VAL A 103 1.852 21.089 -22.316 1.00 0.00 H new ATOM 0 HB VAL A 103 -0.565 20.834 -22.350 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.749 18.617 -23.442 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.738 19.455 -23.944 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.818 18.143 -22.744 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.664 18.963 -21.142 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -0.095 18.491 -20.447 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.829 20.052 -20.008 1.00 0.00 H new ATOM 1624 N LYS A 104 1.645 22.620 -20.357 1.00 0.00 N ATOM 1625 CA LYS A 104 1.507 23.532 -19.188 1.00 0.00 C ATOM 1626 C LYS A 104 1.221 24.951 -19.682 1.00 0.00 C ATOM 1627 O LYS A 104 0.862 25.823 -18.915 1.00 0.00 O ATOM 1628 CB LYS A 104 2.811 23.530 -18.384 1.00 0.00 C ATOM 1629 CG LYS A 104 2.840 22.318 -17.453 1.00 0.00 C ATOM 1630 CD LYS A 104 2.007 22.616 -16.203 1.00 0.00 C ATOM 1631 CE LYS A 104 1.881 21.346 -15.360 1.00 0.00 C ATOM 1632 NZ LYS A 104 1.336 20.240 -16.199 1.00 0.00 N ATOM 0 H LYS A 104 2.084 23.033 -21.180 1.00 0.00 H new ATOM 0 HA LYS A 104 0.687 23.192 -18.556 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.666 23.502 -19.059 1.00 0.00 H new ATOM 0 HB3 LYS A 104 2.893 24.449 -17.803 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.444 21.442 -17.967 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.867 22.086 -17.172 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.477 23.407 -15.620 1.00 0.00 H new ATOM 0 HD3 LYS A 104 1.018 22.975 -16.489 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.855 21.066 -14.959 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.225 21.527 -14.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.560 19.769 -15.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 0.979 20.628 -17.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.089 19.550 -16.396 1.00 0.00 H new ATOM 1646 N SER A 105 1.378 25.194 -20.954 1.00 0.00 N ATOM 1647 CA SER A 105 1.112 26.559 -21.483 1.00 0.00 C ATOM 1648 C SER A 105 -0.160 27.103 -20.834 1.00 0.00 C ATOM 1649 O SER A 105 -0.360 28.298 -20.738 1.00 0.00 O ATOM 1650 CB SER A 105 0.926 26.488 -22.998 1.00 0.00 C ATOM 1651 OG SER A 105 -0.195 25.665 -23.292 1.00 0.00 O ATOM 0 H SER A 105 1.678 24.508 -21.647 1.00 0.00 H new ATOM 0 HA SER A 105 1.951 27.217 -21.254 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.775 27.488 -23.405 1.00 0.00 H new ATOM 0 HB3 SER A 105 1.823 26.084 -23.468 1.00 0.00 H new ATOM 0 HG SER A 105 -0.320 25.617 -24.263 1.00 0.00 H new ATOM 1657 N SER A 106 -1.021 26.233 -20.386 1.00 0.00 N ATOM 1658 CA SER A 106 -2.270 26.694 -19.726 1.00 0.00 C ATOM 1659 C SER A 106 -1.919 27.670 -18.602 1.00 0.00 C ATOM 1660 O SER A 106 -1.946 28.871 -18.776 1.00 0.00 O ATOM 1661 CB SER A 106 -3.016 25.490 -19.148 1.00 0.00 C ATOM 1662 OG SER A 106 -4.245 25.928 -18.581 1.00 0.00 O ATOM 0 H SER A 106 -0.912 25.221 -20.449 1.00 0.00 H new ATOM 0 HA SER A 106 -2.906 27.195 -20.456 1.00 0.00 H new ATOM 0 HB2 SER A 106 -3.204 24.754 -19.930 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.406 24.999 -18.389 1.00 0.00 H new ATOM 0 HG SER A 106 -4.727 25.159 -18.211 1.00 0.00 H new ATOM 1668 N VAL A 107 -1.589 27.158 -17.451 1.00 0.00 N ATOM 1669 CA VAL A 107 -1.195 28.040 -16.318 1.00 0.00 C ATOM 1670 C VAL A 107 -2.156 29.229 -16.272 1.00 0.00 C ATOM 1671 O VAL A 107 -1.902 30.270 -16.847 1.00 0.00 O ATOM 1672 CB VAL A 107 0.233 28.541 -16.535 1.00 0.00 C ATOM 1673 CG1 VAL A 107 0.534 29.674 -15.554 1.00 0.00 C ATOM 1674 CG2 VAL A 107 1.219 27.394 -16.308 1.00 0.00 C ATOM 0 H VAL A 107 -1.575 26.159 -17.244 1.00 0.00 H new ATOM 0 HA VAL A 107 -1.239 27.488 -15.379 1.00 0.00 H new ATOM 0 HB VAL A 107 0.334 28.909 -17.556 1.00 0.00 H new ATOM 0 HG11 VAL A 107 1.552 30.030 -15.710 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -0.166 30.493 -15.719 1.00 0.00 H new ATOM 0 HG13 VAL A 107 0.430 29.308 -14.533 1.00 0.00 H new ATOM 0 HG21 VAL A 107 2.236 27.753 -16.463 1.00 0.00 H new ATOM 0 HG22 VAL A 107 1.117 27.023 -15.288 1.00 0.00 H new ATOM 0 HG23 VAL A 107 1.007 26.588 -17.011 1.00 0.00 H new ATOM 1684 N VAL A 108 -3.258 29.076 -15.588 1.00 0.00 N ATOM 1685 CA VAL A 108 -4.233 30.197 -15.472 1.00 0.00 C ATOM 1686 C VAL A 108 -4.599 30.403 -14.007 1.00 0.00 C ATOM 1687 O VAL A 108 -5.138 29.525 -13.363 1.00 0.00 O ATOM 1688 CB VAL A 108 -5.495 29.851 -16.259 1.00 0.00 C ATOM 1689 CG1 VAL A 108 -6.551 30.930 -16.032 1.00 0.00 C ATOM 1690 CG2 VAL A 108 -5.162 29.767 -17.749 1.00 0.00 C ATOM 0 H VAL A 108 -3.525 28.219 -15.103 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.787 31.109 -15.870 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.881 28.890 -15.919 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.451 30.682 -16.594 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.790 30.987 -14.970 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.166 31.892 -16.369 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -6.063 29.520 -18.310 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.774 30.727 -18.090 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.411 28.994 -17.911 1.00 0.00 H new ATOM 1700 N ALA A 109 -4.321 31.561 -13.478 1.00 0.00 N ATOM 1701 CA ALA A 109 -4.663 31.821 -12.057 1.00 0.00 C ATOM 1702 C ALA A 109 -6.183 31.840 -11.917 1.00 0.00 C ATOM 1703 O ALA A 109 -6.898 32.058 -12.876 1.00 0.00 O ATOM 1704 CB ALA A 109 -4.087 33.174 -11.633 1.00 0.00 C ATOM 0 H ALA A 109 -3.873 32.335 -13.968 1.00 0.00 H new ATOM 0 HA ALA A 109 -4.243 31.042 -11.421 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -4.338 33.365 -10.590 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -3.003 33.161 -11.749 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -4.509 33.961 -12.258 1.00 0.00 H new ATOM 1710 N THR A 110 -6.694 31.608 -10.743 1.00 0.00 N ATOM 1711 CA THR A 110 -8.172 31.612 -10.573 1.00 0.00 C ATOM 1712 C THR A 110 -8.703 33.038 -10.726 1.00 0.00 C ATOM 1713 O THR A 110 -8.014 33.997 -10.440 1.00 0.00 O ATOM 1714 CB THR A 110 -8.519 31.085 -9.178 1.00 0.00 C ATOM 1715 OG1 THR A 110 -9.770 31.622 -8.769 1.00 0.00 O ATOM 1716 CG2 THR A 110 -7.435 31.501 -8.183 1.00 0.00 C ATOM 0 H THR A 110 -6.156 31.417 -9.898 1.00 0.00 H new ATOM 0 HA THR A 110 -8.628 30.975 -11.331 1.00 0.00 H new ATOM 0 HB THR A 110 -8.580 29.997 -9.208 1.00 0.00 H new ATOM 0 HG1 THR A 110 -9.995 31.285 -7.877 1.00 0.00 H new ATOM 0 HG21 THR A 110 -7.687 31.124 -7.192 1.00 0.00 H new ATOM 0 HG22 THR A 110 -6.476 31.088 -8.496 1.00 0.00 H new ATOM 0 HG23 THR A 110 -7.369 32.588 -8.151 1.00 0.00 H new ATOM 1724 N PRO A 111 -9.922 33.177 -11.176 1.00 0.00 N ATOM 1725 CA PRO A 111 -10.563 34.504 -11.371 1.00 0.00 C ATOM 1726 C PRO A 111 -10.157 35.509 -10.289 1.00 0.00 C ATOM 1727 CB PRO A 111 -12.055 34.189 -11.277 1.00 0.00 C ATOM 1728 CG PRO A 111 -12.192 32.810 -11.831 1.00 0.00 C ATOM 1729 CD PRO A 111 -10.862 32.093 -11.561 1.00 0.00 C ATOM 0 HA PRO A 111 -10.269 34.968 -12.313 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -12.405 34.237 -10.246 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -12.647 34.905 -11.848 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -13.019 32.283 -11.356 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -12.405 32.841 -12.900 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -10.964 31.356 -10.765 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -10.512 31.561 -12.446 1.00 0.00 H new TER 1737 PRO A 111 ATOM 1738 N MET B 1 26.908 21.620 -6.479 1.00 0.00 N ATOM 1739 CA MET B 1 27.670 21.743 -7.753 1.00 0.00 C ATOM 1740 C MET B 1 26.824 22.495 -8.783 1.00 0.00 C ATOM 1741 O MET B 1 27.281 23.426 -9.415 1.00 0.00 O ATOM 1742 CB MET B 1 28.003 20.348 -8.286 1.00 0.00 C ATOM 1743 CG MET B 1 28.940 20.470 -9.488 1.00 0.00 C ATOM 1744 SD MET B 1 29.275 18.824 -10.161 1.00 0.00 S ATOM 1745 CE MET B 1 30.449 19.335 -11.441 1.00 0.00 C ATOM 0 H1 MET B 1 27.483 21.109 -5.779 1.00 0.00 H new ATOM 0 H2 MET B 1 26.683 22.568 -6.116 1.00 0.00 H new ATOM 0 H3 MET B 1 26.026 21.097 -6.651 1.00 0.00 H new ATOM 0 HA MET B 1 28.594 22.292 -7.572 1.00 0.00 H new ATOM 0 HB2 MET B 1 28.473 19.751 -7.504 1.00 0.00 H new ATOM 0 HB3 MET B 1 27.089 19.830 -8.576 1.00 0.00 H new ATOM 0 HG2 MET B 1 28.488 21.102 -10.252 1.00 0.00 H new ATOM 0 HG3 MET B 1 29.872 20.949 -9.189 1.00 0.00 H new ATOM 0 HE1 MET B 1 30.792 18.459 -11.991 1.00 0.00 H new ATOM 0 HE2 MET B 1 29.960 20.026 -12.128 1.00 0.00 H new ATOM 0 HE3 MET B 1 31.302 19.828 -10.976 1.00 0.00 H new ATOM 1754 N ALA B 2 25.594 22.097 -8.957 1.00 0.00 N ATOM 1755 CA ALA B 2 24.722 22.784 -9.954 1.00 0.00 C ATOM 1756 C ALA B 2 25.504 22.997 -11.251 1.00 0.00 C ATOM 1757 O ALA B 2 25.760 24.112 -11.659 1.00 0.00 O ATOM 1758 CB ALA B 2 24.283 24.138 -9.396 1.00 0.00 C ATOM 0 H ALA B 2 25.154 21.327 -8.453 1.00 0.00 H new ATOM 0 HA ALA B 2 23.844 22.171 -10.155 1.00 0.00 H new ATOM 0 HB1 ALA B 2 23.646 24.642 -10.123 1.00 0.00 H new ATOM 0 HB2 ALA B 2 23.728 23.987 -8.470 1.00 0.00 H new ATOM 0 HB3 ALA B 2 25.162 24.752 -9.197 1.00 0.00 H new ATOM 1764 N THR B 3 25.884 21.933 -11.904 1.00 0.00 N ATOM 1765 CA THR B 3 26.652 22.069 -13.174 1.00 0.00 C ATOM 1766 C THR B 3 25.760 22.714 -14.232 1.00 0.00 C ATOM 1767 O THR B 3 26.157 23.627 -14.928 1.00 0.00 O ATOM 1768 CB THR B 3 27.080 20.683 -13.656 1.00 0.00 C ATOM 1769 OG1 THR B 3 27.894 20.814 -14.811 1.00 0.00 O ATOM 1770 CG2 THR B 3 25.842 19.848 -13.991 1.00 0.00 C ATOM 0 H THR B 3 25.695 20.974 -11.612 1.00 0.00 H new ATOM 0 HA THR B 3 27.533 22.688 -13.006 1.00 0.00 H new ATOM 0 HB THR B 3 27.646 20.185 -12.868 1.00 0.00 H new ATOM 0 HG1 THR B 3 28.170 19.926 -15.119 1.00 0.00 H new ATOM 0 HG21 THR B 3 26.151 18.861 -14.334 1.00 0.00 H new ATOM 0 HG22 THR B 3 25.221 19.745 -13.101 1.00 0.00 H new ATOM 0 HG23 THR B 3 25.271 20.343 -14.777 1.00 0.00 H new ATOM 1778 N SER B 4 24.551 22.245 -14.343 1.00 0.00 N ATOM 1779 CA SER B 4 23.604 22.823 -15.335 1.00 0.00 C ATOM 1780 C SER B 4 22.246 23.001 -14.672 1.00 0.00 C ATOM 1781 O SER B 4 22.005 23.972 -13.985 1.00 0.00 O ATOM 1782 CB SER B 4 23.454 21.878 -16.521 1.00 0.00 C ATOM 1783 OG SER B 4 24.734 21.576 -17.058 1.00 0.00 O ATOM 0 H SER B 4 24.174 21.479 -13.784 1.00 0.00 H new ATOM 0 HA SER B 4 23.986 23.783 -15.684 1.00 0.00 H new ATOM 0 HB2 SER B 4 22.955 20.961 -16.207 1.00 0.00 H new ATOM 0 HB3 SER B 4 22.827 22.336 -17.286 1.00 0.00 H new ATOM 0 HG SER B 4 24.634 20.967 -17.819 1.00 0.00 H new ATOM 1789 N GLY B 5 21.355 22.073 -14.853 1.00 0.00 N ATOM 1790 CA GLY B 5 20.019 22.209 -14.212 1.00 0.00 C ATOM 1791 C GLY B 5 20.064 21.630 -12.792 1.00 0.00 C ATOM 1792 O GLY B 5 21.014 20.979 -12.404 1.00 0.00 O ATOM 0 H GLY B 5 21.490 21.231 -15.413 1.00 0.00 H new ATOM 0 HA2 GLY B 5 19.727 23.259 -14.178 1.00 0.00 H new ATOM 0 HA3 GLY B 5 19.267 21.688 -14.804 1.00 0.00 H new ATOM 1796 N PHE B 6 19.035 21.849 -12.024 1.00 0.00 N ATOM 1797 CA PHE B 6 19.003 21.301 -10.644 1.00 0.00 C ATOM 1798 C PHE B 6 17.658 20.600 -10.443 1.00 0.00 C ATOM 1799 O PHE B 6 16.619 21.131 -10.786 1.00 0.00 O ATOM 1800 CB PHE B 6 19.169 22.441 -9.638 1.00 0.00 C ATOM 1801 CG PHE B 6 19.938 21.938 -8.436 1.00 0.00 C ATOM 1802 CD1 PHE B 6 19.434 20.877 -7.670 1.00 0.00 C ATOM 1803 CD2 PHE B 6 21.156 22.533 -8.082 1.00 0.00 C ATOM 1804 CE1 PHE B 6 20.144 20.413 -6.555 1.00 0.00 C ATOM 1805 CE2 PHE B 6 21.866 22.069 -6.967 1.00 0.00 C ATOM 1806 CZ PHE B 6 21.360 21.010 -6.203 1.00 0.00 C ATOM 0 H PHE B 6 18.212 22.387 -12.295 1.00 0.00 H new ATOM 0 HA PHE B 6 19.815 20.590 -10.492 1.00 0.00 H new ATOM 0 HB2 PHE B 6 19.698 23.275 -10.100 1.00 0.00 H new ATOM 0 HB3 PHE B 6 18.193 22.814 -9.329 1.00 0.00 H new ATOM 0 HD1 PHE B 6 18.495 20.416 -7.940 1.00 0.00 H new ATOM 0 HD2 PHE B 6 21.548 23.350 -8.669 1.00 0.00 H new ATOM 0 HE1 PHE B 6 19.753 19.595 -5.968 1.00 0.00 H new ATOM 0 HE2 PHE B 6 22.805 22.529 -6.696 1.00 0.00 H new ATOM 0 HZ PHE B 6 21.908 20.654 -5.343 1.00 0.00 H new ATOM 1816 N LYS B 7 17.662 19.395 -9.939 1.00 0.00 N ATOM 1817 CA LYS B 7 16.369 18.667 -9.767 1.00 0.00 C ATOM 1818 C LYS B 7 15.844 18.723 -8.338 1.00 0.00 C ATOM 1819 O LYS B 7 16.492 18.318 -7.391 1.00 0.00 O ATOM 1820 CB LYS B 7 16.556 17.193 -10.146 1.00 0.00 C ATOM 1821 CG LYS B 7 15.180 16.544 -10.346 1.00 0.00 C ATOM 1822 CD LYS B 7 15.338 15.030 -10.532 1.00 0.00 C ATOM 1823 CE LYS B 7 15.365 14.344 -9.164 1.00 0.00 C ATOM 1824 NZ LYS B 7 15.452 12.870 -9.351 1.00 0.00 N ATOM 0 H LYS B 7 18.495 18.887 -9.641 1.00 0.00 H new ATOM 0 HA LYS B 7 15.645 19.160 -10.416 1.00 0.00 H new ATOM 0 HB2 LYS B 7 17.146 17.112 -11.059 1.00 0.00 H new ATOM 0 HB3 LYS B 7 17.107 16.671 -9.364 1.00 0.00 H new ATOM 0 HG2 LYS B 7 14.543 16.749 -9.485 1.00 0.00 H new ATOM 0 HG3 LYS B 7 14.688 16.977 -11.217 1.00 0.00 H new ATOM 0 HD2 LYS B 7 14.515 14.639 -11.130 1.00 0.00 H new ATOM 0 HD3 LYS B 7 16.257 14.814 -11.076 1.00 0.00 H new ATOM 0 HE2 LYS B 7 16.217 14.699 -8.584 1.00 0.00 H new ATOM 0 HE3 LYS B 7 14.467 14.598 -8.600 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 14.607 12.418 -8.946 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 15.508 12.652 -10.366 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 16.301 12.509 -8.871 1.00 0.00 H new ATOM 1838 N HIS B 8 14.626 19.168 -8.209 1.00 0.00 N ATOM 1839 CA HIS B 8 13.939 19.197 -6.893 1.00 0.00 C ATOM 1840 C HIS B 8 12.697 18.326 -7.050 1.00 0.00 C ATOM 1841 O HIS B 8 11.870 18.577 -7.903 1.00 0.00 O ATOM 1842 CB HIS B 8 13.511 20.622 -6.529 1.00 0.00 C ATOM 1843 CG HIS B 8 14.729 21.434 -6.167 1.00 0.00 C ATOM 1844 ND1 HIS B 8 15.495 22.083 -7.125 1.00 0.00 N ATOM 1845 CD2 HIS B 8 15.328 21.708 -4.959 1.00 0.00 C ATOM 1846 CE1 HIS B 8 16.501 22.711 -6.485 1.00 0.00 C ATOM 1847 NE2 HIS B 8 16.443 22.513 -5.168 1.00 0.00 N ATOM 0 H HIS B 8 14.065 19.522 -8.984 1.00 0.00 H new ATOM 0 HA HIS B 8 14.601 18.841 -6.104 1.00 0.00 H new ATOM 0 HB2 HIS B 8 12.990 21.082 -7.368 1.00 0.00 H new ATOM 0 HB3 HIS B 8 12.812 20.601 -5.693 1.00 0.00 H new ATOM 0 HD2 HIS B 8 14.986 21.353 -3.998 1.00 0.00 H new ATOM 0 HE1 HIS B 8 17.260 23.301 -6.978 1.00 0.00 H new ATOM 0 HE2 HIS B 8 17.083 22.876 -4.461 1.00 0.00 H new ATOM 1856 N LEU B 9 12.555 17.297 -6.270 1.00 0.00 N ATOM 1857 CA LEU B 9 11.353 16.437 -6.423 1.00 0.00 C ATOM 1858 C LEU B 9 10.793 16.104 -5.051 1.00 0.00 C ATOM 1859 O LEU B 9 11.519 15.914 -4.097 1.00 0.00 O ATOM 1860 CB LEU B 9 11.722 15.148 -7.162 1.00 0.00 C ATOM 1861 CG LEU B 9 10.447 14.362 -7.484 1.00 0.00 C ATOM 1862 CD1 LEU B 9 10.563 13.739 -8.875 1.00 0.00 C ATOM 1863 CD2 LEU B 9 10.255 13.253 -6.447 1.00 0.00 C ATOM 0 H LEU B 9 13.210 17.015 -5.541 1.00 0.00 H new ATOM 0 HA LEU B 9 10.599 16.971 -7.002 1.00 0.00 H new ATOM 0 HB2 LEU B 9 12.259 15.384 -8.081 1.00 0.00 H new ATOM 0 HB3 LEU B 9 12.390 14.543 -6.549 1.00 0.00 H new ATOM 0 HG LEU B 9 9.592 15.038 -7.460 1.00 0.00 H new ATOM 0 HD11 LEU B 9 9.654 13.181 -9.101 1.00 0.00 H new ATOM 0 HD12 LEU B 9 10.698 14.527 -9.616 1.00 0.00 H new ATOM 0 HD13 LEU B 9 11.419 13.065 -8.901 1.00 0.00 H new ATOM 0 HD21 LEU B 9 9.348 12.694 -6.676 1.00 0.00 H new ATOM 0 HD22 LEU B 9 11.112 12.580 -6.471 1.00 0.00 H new ATOM 0 HD23 LEU B 9 10.168 13.694 -5.454 1.00 0.00 H new ATOM 1875 N VAL B 10 9.500 16.041 -4.946 1.00 0.00 N ATOM 1876 CA VAL B 10 8.876 15.738 -3.638 1.00 0.00 C ATOM 1877 C VAL B 10 7.877 14.589 -3.802 1.00 0.00 C ATOM 1878 O VAL B 10 7.087 14.571 -4.722 1.00 0.00 O ATOM 1879 CB VAL B 10 8.147 16.989 -3.136 1.00 0.00 C ATOM 1880 CG1 VAL B 10 7.014 17.334 -4.103 1.00 0.00 C ATOM 1881 CG2 VAL B 10 7.565 16.734 -1.744 1.00 0.00 C ATOM 0 H VAL B 10 8.846 16.187 -5.715 1.00 0.00 H new ATOM 0 HA VAL B 10 9.642 15.445 -2.920 1.00 0.00 H new ATOM 0 HB VAL B 10 8.853 17.817 -3.081 1.00 0.00 H new ATOM 0 HG11 VAL B 10 6.492 18.224 -3.750 1.00 0.00 H new ATOM 0 HG12 VAL B 10 7.427 17.525 -5.094 1.00 0.00 H new ATOM 0 HG13 VAL B 10 6.314 16.500 -4.156 1.00 0.00 H new ATOM 0 HG21 VAL B 10 7.049 17.629 -1.396 1.00 0.00 H new ATOM 0 HG22 VAL B 10 6.860 15.904 -1.791 1.00 0.00 H new ATOM 0 HG23 VAL B 10 8.371 16.488 -1.052 1.00 0.00 H new ATOM 1891 N VAL B 11 7.885 13.651 -2.898 1.00 0.00 N ATOM 1892 CA VAL B 11 6.915 12.525 -2.984 1.00 0.00 C ATOM 1893 C VAL B 11 5.998 12.662 -1.784 1.00 0.00 C ATOM 1894 O VAL B 11 6.458 12.798 -0.669 1.00 0.00 O ATOM 1895 CB VAL B 11 7.634 11.175 -2.944 1.00 0.00 C ATOM 1896 CG1 VAL B 11 6.917 10.203 -3.880 1.00 0.00 C ATOM 1897 CG2 VAL B 11 9.085 11.347 -3.404 1.00 0.00 C ATOM 0 H VAL B 11 8.522 13.615 -2.102 1.00 0.00 H new ATOM 0 HA VAL B 11 6.361 12.563 -3.922 1.00 0.00 H new ATOM 0 HB VAL B 11 7.625 10.786 -1.926 1.00 0.00 H new ATOM 0 HG11 VAL B 11 7.422 9.237 -3.858 1.00 0.00 H new ATOM 0 HG12 VAL B 11 5.884 10.079 -3.554 1.00 0.00 H new ATOM 0 HG13 VAL B 11 6.932 10.598 -4.896 1.00 0.00 H new ATOM 0 HG21 VAL B 11 9.593 10.383 -3.374 1.00 0.00 H new ATOM 0 HG22 VAL B 11 9.100 11.733 -4.423 1.00 0.00 H new ATOM 0 HG23 VAL B 11 9.596 12.047 -2.743 1.00 0.00 H new ATOM 1907 N VAL B 12 4.716 12.690 -1.978 1.00 0.00 N ATOM 1908 CA VAL B 12 3.843 12.898 -0.797 1.00 0.00 C ATOM 1909 C VAL B 12 2.603 12.003 -0.805 1.00 0.00 C ATOM 1910 O VAL B 12 2.098 11.597 -1.834 1.00 0.00 O ATOM 1911 CB VAL B 12 3.406 14.354 -0.797 1.00 0.00 C ATOM 1912 CG1 VAL B 12 4.596 15.226 -1.205 1.00 0.00 C ATOM 1913 CG2 VAL B 12 2.274 14.539 -1.813 1.00 0.00 C ATOM 0 H VAL B 12 4.243 12.581 -2.875 1.00 0.00 H new ATOM 0 HA VAL B 12 4.411 12.639 0.096 1.00 0.00 H new ATOM 0 HB VAL B 12 3.058 14.639 0.196 1.00 0.00 H new ATOM 0 HG11 VAL B 12 4.295 16.274 -1.209 1.00 0.00 H new ATOM 0 HG12 VAL B 12 5.411 15.085 -0.495 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.931 14.941 -2.202 1.00 0.00 H new ATOM 0 HG21 VAL B 12 1.956 15.582 -1.818 1.00 0.00 H new ATOM 0 HG22 VAL B 12 2.628 14.263 -2.806 1.00 0.00 H new ATOM 0 HG23 VAL B 12 1.432 13.904 -1.539 1.00 0.00 H new ATOM 1923 N LYS B 13 2.101 11.736 0.370 1.00 0.00 N ATOM 1924 CA LYS B 13 0.879 10.909 0.522 1.00 0.00 C ATOM 1925 C LYS B 13 -0.108 11.720 1.368 1.00 0.00 C ATOM 1926 O LYS B 13 0.291 12.592 2.116 1.00 0.00 O ATOM 1927 CB LYS B 13 1.227 9.589 1.217 1.00 0.00 C ATOM 1928 CG LYS B 13 1.833 8.621 0.193 1.00 0.00 C ATOM 1929 CD LYS B 13 2.158 7.290 0.874 1.00 0.00 C ATOM 1930 CE LYS B 13 0.896 6.431 0.943 1.00 0.00 C ATOM 1931 NZ LYS B 13 1.243 5.076 1.463 1.00 0.00 N ATOM 0 H LYS B 13 2.499 12.066 1.249 1.00 0.00 H new ATOM 0 HA LYS B 13 0.443 10.667 -0.447 1.00 0.00 H new ATOM 0 HB2 LYS B 13 1.933 9.767 2.028 1.00 0.00 H new ATOM 0 HB3 LYS B 13 0.333 9.153 1.662 1.00 0.00 H new ATOM 0 HG2 LYS B 13 1.134 8.460 -0.628 1.00 0.00 H new ATOM 0 HG3 LYS B 13 2.737 9.051 -0.238 1.00 0.00 H new ATOM 0 HD2 LYS B 13 2.937 6.767 0.320 1.00 0.00 H new ATOM 0 HD3 LYS B 13 2.545 7.468 1.877 1.00 0.00 H new ATOM 0 HE2 LYS B 13 0.157 6.903 1.591 1.00 0.00 H new ATOM 0 HE3 LYS B 13 0.445 6.348 -0.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 0.384 4.492 1.510 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 1.933 4.627 0.828 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 1.654 5.164 2.414 1.00 0.00 H new ATOM 1945 N PHE B 14 -1.382 11.478 1.241 1.00 0.00 N ATOM 1946 CA PHE B 14 -2.369 12.284 2.022 1.00 0.00 C ATOM 1947 C PHE B 14 -3.061 11.438 3.103 1.00 0.00 C ATOM 1948 O PHE B 14 -3.225 10.242 2.965 1.00 0.00 O ATOM 1949 CB PHE B 14 -3.420 12.826 1.056 1.00 0.00 C ATOM 1950 CG PHE B 14 -4.336 11.702 0.629 1.00 0.00 C ATOM 1951 CD1 PHE B 14 -5.376 11.286 1.472 1.00 0.00 C ATOM 1952 CD2 PHE B 14 -4.148 11.080 -0.609 1.00 0.00 C ATOM 1953 CE1 PHE B 14 -6.224 10.244 1.076 1.00 0.00 C ATOM 1954 CE2 PHE B 14 -4.995 10.039 -1.005 1.00 0.00 C ATOM 1955 CZ PHE B 14 -6.034 9.623 -0.163 1.00 0.00 C ATOM 0 H PHE B 14 -1.784 10.763 0.635 1.00 0.00 H new ATOM 0 HA PHE B 14 -1.841 13.096 2.522 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -3.996 13.618 1.535 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -2.936 13.267 0.184 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -5.523 11.769 2.427 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -3.349 11.403 -1.260 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -7.023 9.920 1.726 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -4.848 9.556 -1.960 1.00 0.00 H new ATOM 0 HZ PHE B 14 -6.689 8.822 -0.471 1.00 0.00 H new ATOM 1965 N LYS B 15 -3.496 12.071 4.169 1.00 0.00 N ATOM 1966 CA LYS B 15 -4.222 11.334 5.246 1.00 0.00 C ATOM 1967 C LYS B 15 -5.537 12.064 5.533 1.00 0.00 C ATOM 1968 O LYS B 15 -6.467 11.500 6.077 1.00 0.00 O ATOM 1969 CB LYS B 15 -3.371 11.271 6.519 1.00 0.00 C ATOM 1970 CG LYS B 15 -3.137 12.682 7.053 1.00 0.00 C ATOM 1971 CD LYS B 15 -2.180 12.624 8.247 1.00 0.00 C ATOM 1972 CE LYS B 15 -2.170 13.980 8.954 1.00 0.00 C ATOM 1973 NZ LYS B 15 -1.008 14.052 9.884 1.00 0.00 N ATOM 0 H LYS B 15 -3.377 13.070 4.337 1.00 0.00 H new ATOM 0 HA LYS B 15 -4.423 10.313 4.920 1.00 0.00 H new ATOM 0 HB2 LYS B 15 -3.873 10.665 7.273 1.00 0.00 H new ATOM 0 HB3 LYS B 15 -2.417 10.790 6.306 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -2.720 13.314 6.269 1.00 0.00 H new ATOM 0 HG3 LYS B 15 -4.084 13.130 7.354 1.00 0.00 H new ATOM 0 HD2 LYS B 15 -2.492 11.842 8.940 1.00 0.00 H new ATOM 0 HD3 LYS B 15 -1.175 12.369 7.910 1.00 0.00 H new ATOM 0 HE2 LYS B 15 -2.111 14.783 8.220 1.00 0.00 H new ATOM 0 HE3 LYS B 15 -3.099 14.120 9.506 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 -1.004 14.975 10.363 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 -1.083 13.294 10.592 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 -0.125 13.937 9.346 1.00 0.00 H new ATOM 1987 N GLU B 16 -5.631 13.304 5.138 1.00 0.00 N ATOM 1988 CA GLU B 16 -6.898 14.062 5.337 1.00 0.00 C ATOM 1989 C GLU B 16 -7.755 13.840 4.087 1.00 0.00 C ATOM 1990 O GLU B 16 -8.870 13.363 4.145 1.00 0.00 O ATOM 1991 CB GLU B 16 -6.591 15.561 5.488 1.00 0.00 C ATOM 1992 CG GLU B 16 -5.739 15.802 6.738 1.00 0.00 C ATOM 1993 CD GLU B 16 -5.502 17.304 6.919 1.00 0.00 C ATOM 1994 OE1 GLU B 16 -5.849 18.054 6.020 1.00 0.00 O ATOM 1995 OE2 GLU B 16 -4.978 17.683 7.955 1.00 0.00 O ATOM 0 H GLU B 16 -4.882 13.827 4.684 1.00 0.00 H new ATOM 0 HA GLU B 16 -7.415 13.723 6.235 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -6.065 15.923 4.605 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -7.521 16.125 5.558 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -6.241 15.395 7.616 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -4.785 15.282 6.646 1.00 0.00 H new ATOM 2002 N ASP B 17 -7.202 14.181 2.955 1.00 0.00 N ATOM 2003 CA ASP B 17 -7.889 13.996 1.647 1.00 0.00 C ATOM 2004 C ASP B 17 -7.319 15.051 0.705 1.00 0.00 C ATOM 2005 O ASP B 17 -8.020 15.912 0.209 1.00 0.00 O ATOM 2006 CB ASP B 17 -9.400 14.189 1.795 1.00 0.00 C ATOM 2007 CG ASP B 17 -9.677 15.386 2.710 1.00 0.00 C ATOM 2008 OD1 ASP B 17 -8.747 16.122 2.990 1.00 0.00 O ATOM 2009 OD2 ASP B 17 -10.819 15.545 3.112 1.00 0.00 O ATOM 0 H ASP B 17 -6.272 14.594 2.882 1.00 0.00 H new ATOM 0 HA ASP B 17 -7.726 12.988 1.265 1.00 0.00 H new ATOM 0 HB2 ASP B 17 -9.854 14.353 0.817 1.00 0.00 H new ATOM 0 HB3 ASP B 17 -9.853 13.289 2.210 1.00 0.00 H new ATOM 2014 N THR B 18 -6.031 15.020 0.503 1.00 0.00 N ATOM 2015 CA THR B 18 -5.376 16.054 -0.348 1.00 0.00 C ATOM 2016 C THR B 18 -6.110 16.289 -1.663 1.00 0.00 C ATOM 2017 O THR B 18 -6.046 15.503 -2.589 1.00 0.00 O ATOM 2018 CB THR B 18 -3.939 15.650 -0.666 1.00 0.00 C ATOM 2019 OG1 THR B 18 -3.228 15.444 0.544 1.00 0.00 O ATOM 2020 CG2 THR B 18 -3.281 16.770 -1.469 1.00 0.00 C ATOM 0 H THR B 18 -5.400 14.319 0.893 1.00 0.00 H new ATOM 0 HA THR B 18 -5.400 16.979 0.228 1.00 0.00 H new ATOM 0 HB THR B 18 -3.929 14.727 -1.246 1.00 0.00 H new ATOM 0 HG1 THR B 18 -2.766 16.271 0.797 1.00 0.00 H new ATOM 0 HG21 THR B 18 -2.253 16.494 -1.703 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.834 16.927 -2.395 1.00 0.00 H new ATOM 0 HG23 THR B 18 -3.286 17.689 -0.883 1.00 0.00 H new ATOM 2028 N LYS B 19 -6.756 17.414 -1.762 1.00 0.00 N ATOM 2029 CA LYS B 19 -7.427 17.784 -3.027 1.00 0.00 C ATOM 2030 C LYS B 19 -6.314 18.225 -3.971 1.00 0.00 C ATOM 2031 O LYS B 19 -5.951 19.380 -4.022 1.00 0.00 O ATOM 2032 CB LYS B 19 -8.394 18.945 -2.777 1.00 0.00 C ATOM 2033 CG LYS B 19 -7.900 19.769 -1.582 1.00 0.00 C ATOM 2034 CD LYS B 19 -8.454 19.175 -0.283 1.00 0.00 C ATOM 2035 CE LYS B 19 -7.551 19.568 0.892 1.00 0.00 C ATOM 2036 NZ LYS B 19 -8.086 18.986 2.154 1.00 0.00 N ATOM 0 H LYS B 19 -6.846 18.098 -1.010 1.00 0.00 H new ATOM 0 HA LYS B 19 -8.001 16.956 -3.442 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -8.461 19.575 -3.664 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -9.396 18.563 -2.580 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -6.810 19.773 -1.556 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -8.220 20.806 -1.685 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -9.468 19.535 -0.111 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -8.511 18.089 -0.363 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -6.536 19.212 0.718 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -7.498 20.654 0.975 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -7.453 19.226 2.943 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -9.033 19.373 2.340 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -8.146 17.952 2.061 1.00 0.00 H new ATOM 2050 N VAL B 20 -5.739 17.297 -4.683 1.00 0.00 N ATOM 2051 CA VAL B 20 -4.595 17.634 -5.579 1.00 0.00 C ATOM 2052 C VAL B 20 -5.006 18.701 -6.596 1.00 0.00 C ATOM 2053 O VAL B 20 -4.220 19.542 -6.983 1.00 0.00 O ATOM 2054 CB VAL B 20 -4.169 16.377 -6.327 1.00 0.00 C ATOM 2055 CG1 VAL B 20 -3.546 15.383 -5.345 1.00 0.00 C ATOM 2056 CG2 VAL B 20 -5.398 15.739 -6.982 1.00 0.00 C ATOM 0 H VAL B 20 -6.013 16.314 -4.684 1.00 0.00 H new ATOM 0 HA VAL B 20 -3.773 18.019 -4.975 1.00 0.00 H new ATOM 0 HB VAL B 20 -3.438 16.638 -7.092 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -3.242 14.484 -5.881 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -2.675 15.836 -4.872 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -4.277 15.120 -4.581 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -5.098 14.839 -7.519 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -6.126 15.478 -6.213 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -5.846 16.446 -7.681 1.00 0.00 H new ATOM 2066 N ASP B 21 -6.228 18.663 -7.038 1.00 0.00 N ATOM 2067 CA ASP B 21 -6.702 19.670 -8.030 1.00 0.00 C ATOM 2068 C ASP B 21 -6.742 21.067 -7.400 1.00 0.00 C ATOM 2069 O ASP B 21 -6.372 22.041 -8.026 1.00 0.00 O ATOM 2070 CB ASP B 21 -8.096 19.275 -8.503 1.00 0.00 C ATOM 2071 CG ASP B 21 -9.062 19.339 -7.319 1.00 0.00 C ATOM 2072 OD1 ASP B 21 -8.597 19.243 -6.193 1.00 0.00 O ATOM 2073 OD2 ASP B 21 -10.250 19.494 -7.552 1.00 0.00 O ATOM 0 H ASP B 21 -6.925 17.975 -6.755 1.00 0.00 H new ATOM 0 HA ASP B 21 -6.015 19.696 -8.876 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -8.428 19.945 -9.296 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -8.080 18.269 -8.922 1.00 0.00 H new ATOM 2078 N GLU B 22 -7.166 21.186 -6.170 1.00 0.00 N ATOM 2079 CA GLU B 22 -7.165 22.531 -5.527 1.00 0.00 C ATOM 2080 C GLU B 22 -5.710 22.933 -5.331 1.00 0.00 C ATOM 2081 O GLU B 22 -5.339 24.086 -5.445 1.00 0.00 O ATOM 2082 CB GLU B 22 -7.874 22.467 -4.175 1.00 0.00 C ATOM 2083 CG GLU B 22 -9.372 22.271 -4.399 1.00 0.00 C ATOM 2084 CD GLU B 22 -10.110 22.408 -3.067 1.00 0.00 C ATOM 2085 OE1 GLU B 22 -9.459 22.722 -2.083 1.00 0.00 O ATOM 2086 OE2 GLU B 22 -11.312 22.201 -3.053 1.00 0.00 O ATOM 0 H GLU B 22 -7.509 20.421 -5.589 1.00 0.00 H new ATOM 0 HA GLU B 22 -7.689 23.257 -6.149 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -7.473 21.646 -3.580 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -7.696 23.384 -3.614 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -9.744 23.009 -5.110 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -9.560 21.288 -4.832 1.00 0.00 H new ATOM 2093 N ILE B 23 -4.879 21.965 -5.084 1.00 0.00 N ATOM 2094 CA ILE B 23 -3.432 22.230 -4.952 1.00 0.00 C ATOM 2095 C ILE B 23 -2.959 22.728 -6.316 1.00 0.00 C ATOM 2096 O ILE B 23 -2.236 23.700 -6.431 1.00 0.00 O ATOM 2097 CB ILE B 23 -2.740 20.911 -4.592 1.00 0.00 C ATOM 2098 CG1 ILE B 23 -2.573 20.830 -3.074 1.00 0.00 C ATOM 2099 CG2 ILE B 23 -1.373 20.825 -5.271 1.00 0.00 C ATOM 2100 CD1 ILE B 23 -3.890 21.203 -2.392 1.00 0.00 C ATOM 0 H ILE B 23 -5.149 20.988 -4.967 1.00 0.00 H new ATOM 0 HA ILE B 23 -3.207 22.967 -4.181 1.00 0.00 H new ATOM 0 HB ILE B 23 -3.351 20.078 -4.939 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -2.274 19.823 -2.784 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -1.780 21.503 -2.749 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -0.894 19.883 -5.006 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -1.500 20.876 -6.352 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -0.749 21.655 -4.940 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -3.769 21.145 -1.310 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -4.170 22.219 -2.672 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -4.672 20.512 -2.707 1.00 0.00 H new ATOM 2112 N LEU B 24 -3.407 22.071 -7.348 1.00 0.00 N ATOM 2113 CA LEU B 24 -3.057 22.481 -8.730 1.00 0.00 C ATOM 2114 C LEU B 24 -3.425 23.954 -8.920 1.00 0.00 C ATOM 2115 O LEU B 24 -2.739 24.688 -9.603 1.00 0.00 O ATOM 2116 CB LEU B 24 -3.853 21.611 -9.701 1.00 0.00 C ATOM 2117 CG LEU B 24 -3.200 21.628 -11.080 1.00 0.00 C ATOM 2118 CD1 LEU B 24 -2.097 20.569 -11.137 1.00 0.00 C ATOM 2119 CD2 LEU B 24 -4.262 21.316 -12.137 1.00 0.00 C ATOM 0 H LEU B 24 -4.012 21.252 -7.288 1.00 0.00 H new ATOM 0 HA LEU B 24 -1.990 22.356 -8.914 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -3.903 20.588 -9.327 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -4.878 21.976 -9.771 1.00 0.00 H new ATOM 0 HG LEU B 24 -2.766 22.610 -11.270 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -1.631 20.582 -12.122 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -1.346 20.785 -10.377 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -2.528 19.585 -10.952 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -3.805 21.326 -13.126 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -4.689 20.332 -11.944 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -5.050 22.068 -12.094 1.00 0.00 H new ATOM 2131 N LYS B 25 -4.492 24.405 -8.308 1.00 0.00 N ATOM 2132 CA LYS B 25 -4.862 25.843 -8.450 1.00 0.00 C ATOM 2133 C LYS B 25 -3.712 26.663 -7.879 1.00 0.00 C ATOM 2134 O LYS B 25 -3.385 27.727 -8.368 1.00 0.00 O ATOM 2135 CB LYS B 25 -6.150 26.149 -7.675 1.00 0.00 C ATOM 2136 CG LYS B 25 -6.519 27.624 -7.872 1.00 0.00 C ATOM 2137 CD LYS B 25 -6.814 28.268 -6.515 1.00 0.00 C ATOM 2138 CE LYS B 25 -5.514 28.413 -5.722 1.00 0.00 C ATOM 2139 NZ LYS B 25 -5.624 29.571 -4.789 1.00 0.00 N ATOM 0 H LYS B 25 -5.114 23.846 -7.724 1.00 0.00 H new ATOM 0 HA LYS B 25 -5.037 26.086 -9.498 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -6.960 25.509 -8.025 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -6.010 25.935 -6.615 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -5.702 28.150 -8.365 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -7.390 27.707 -8.522 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -7.276 29.245 -6.658 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -7.525 27.658 -5.958 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -5.314 27.500 -5.162 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -4.675 28.560 -6.403 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -4.740 29.668 -4.251 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -5.795 30.440 -5.333 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -6.414 29.413 -4.131 1.00 0.00 H new ATOM 2153 N GLY B 26 -3.080 26.154 -6.858 1.00 0.00 N ATOM 2154 CA GLY B 26 -1.925 26.875 -6.267 1.00 0.00 C ATOM 2155 C GLY B 26 -0.702 26.595 -7.136 1.00 0.00 C ATOM 2156 O GLY B 26 0.053 27.486 -7.474 1.00 0.00 O ATOM 0 H GLY B 26 -3.316 25.269 -6.409 1.00 0.00 H new ATOM 0 HA2 GLY B 26 -2.125 27.946 -6.224 1.00 0.00 H new ATOM 0 HA3 GLY B 26 -1.750 26.542 -5.244 1.00 0.00 H new ATOM 2160 N LEU B 27 -0.513 25.358 -7.514 1.00 0.00 N ATOM 2161 CA LEU B 27 0.654 25.004 -8.366 1.00 0.00 C ATOM 2162 C LEU B 27 0.605 25.846 -9.645 1.00 0.00 C ATOM 2163 O LEU B 27 1.519 26.592 -9.939 1.00 0.00 O ATOM 2164 CB LEU B 27 0.596 23.512 -8.713 1.00 0.00 C ATOM 2165 CG LEU B 27 2.008 22.983 -8.983 1.00 0.00 C ATOM 2166 CD1 LEU B 27 2.687 23.861 -10.040 1.00 0.00 C ATOM 2167 CD2 LEU B 27 2.823 23.029 -7.690 1.00 0.00 C ATOM 0 H LEU B 27 -1.120 24.577 -7.267 1.00 0.00 H new ATOM 0 HA LEU B 27 1.584 25.206 -7.834 1.00 0.00 H new ATOM 0 HB2 LEU B 27 0.141 22.957 -7.893 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -0.033 23.358 -9.590 1.00 0.00 H new ATOM 0 HG LEU B 27 1.949 21.956 -9.343 1.00 0.00 H new ATOM 0 HD11 LEU B 27 3.692 23.486 -10.233 1.00 0.00 H new ATOM 0 HD12 LEU B 27 2.106 23.835 -10.962 1.00 0.00 H new ATOM 0 HD13 LEU B 27 2.746 24.887 -9.677 1.00 0.00 H new ATOM 0 HD21 LEU B 27 3.828 22.653 -7.880 1.00 0.00 H new ATOM 0 HD22 LEU B 27 2.882 24.057 -7.333 1.00 0.00 H new ATOM 0 HD23 LEU B 27 2.341 22.410 -6.934 1.00 0.00 H new ATOM 2179 N GLU B 28 -0.461 25.756 -10.401 1.00 0.00 N ATOM 2180 CA GLU B 28 -0.539 26.557 -11.655 1.00 0.00 C ATOM 2181 C GLU B 28 -0.331 28.019 -11.272 1.00 0.00 C ATOM 2182 O GLU B 28 0.371 28.757 -11.935 1.00 0.00 O ATOM 2183 CB GLU B 28 -1.915 26.382 -12.311 1.00 0.00 C ATOM 2184 CG GLU B 28 -3.008 26.865 -11.351 1.00 0.00 C ATOM 2185 CD GLU B 28 -3.346 28.326 -11.657 1.00 0.00 C ATOM 2186 OE1 GLU B 28 -2.529 28.985 -12.279 1.00 0.00 O ATOM 2187 OE2 GLU B 28 -4.415 28.758 -11.263 1.00 0.00 O ATOM 0 H GLU B 28 -1.271 25.168 -10.205 1.00 0.00 H new ATOM 0 HA GLU B 28 0.219 26.229 -12.367 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -1.959 26.947 -13.242 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -2.077 25.335 -12.565 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -3.898 26.245 -11.455 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -2.670 26.767 -10.319 1.00 0.00 H new ATOM 2194 N ASN B 29 -0.913 28.427 -10.180 1.00 0.00 N ATOM 2195 CA ASN B 29 -0.718 29.820 -9.704 1.00 0.00 C ATOM 2196 C ASN B 29 0.776 30.010 -9.419 1.00 0.00 C ATOM 2197 O ASN B 29 1.380 30.987 -9.814 1.00 0.00 O ATOM 2198 CB ASN B 29 -1.549 30.018 -8.427 1.00 0.00 C ATOM 2199 CG ASN B 29 -1.318 31.414 -7.850 1.00 0.00 C ATOM 2200 OD1 ASN B 29 -0.891 31.530 -6.623 1.00 0.00 O flip ATOM 2201 ND2 ASN B 29 -1.536 32.407 -8.516 1.00 0.00 N flip ATOM 0 H ASN B 29 -1.518 27.851 -9.595 1.00 0.00 H new ATOM 0 HA ASN B 29 -1.040 30.550 -10.446 1.00 0.00 H new ATOM 0 HB2 ASN B 29 -2.607 29.880 -8.650 1.00 0.00 H new ATOM 0 HB3 ASN B 29 -1.278 29.263 -7.689 1.00 0.00 H new ATOM 0 HD21 ASN B 29 -1.870 32.314 -9.475 1.00 0.00 H new ATOM 0 HD22 ASN B 29 -1.385 33.333 -8.116 1.00 0.00 H new ATOM 2208 N LEU B 30 1.375 29.055 -8.753 1.00 0.00 N ATOM 2209 CA LEU B 30 2.835 29.135 -8.448 1.00 0.00 C ATOM 2210 C LEU B 30 3.595 29.364 -9.756 1.00 0.00 C ATOM 2211 O LEU B 30 4.464 30.207 -9.846 1.00 0.00 O ATOM 2212 CB LEU B 30 3.276 27.807 -7.818 1.00 0.00 C ATOM 2213 CG LEU B 30 4.687 27.917 -7.222 1.00 0.00 C ATOM 2214 CD1 LEU B 30 5.721 28.063 -8.339 1.00 0.00 C ATOM 2215 CD2 LEU B 30 4.770 29.126 -6.288 1.00 0.00 C ATOM 0 H LEU B 30 0.910 28.216 -8.405 1.00 0.00 H new ATOM 0 HA LEU B 30 3.041 29.953 -7.758 1.00 0.00 H new ATOM 0 HB2 LEU B 30 2.571 27.519 -7.039 1.00 0.00 H new ATOM 0 HB3 LEU B 30 3.257 27.020 -8.572 1.00 0.00 H new ATOM 0 HG LEU B 30 4.897 27.010 -6.656 1.00 0.00 H new ATOM 0 HD11 LEU B 30 6.718 28.140 -7.904 1.00 0.00 H new ATOM 0 HD12 LEU B 30 5.676 27.192 -8.992 1.00 0.00 H new ATOM 0 HD13 LEU B 30 5.507 28.962 -8.918 1.00 0.00 H new ATOM 0 HD21 LEU B 30 5.775 29.195 -5.871 1.00 0.00 H new ATOM 0 HD22 LEU B 30 4.546 30.034 -6.848 1.00 0.00 H new ATOM 0 HD23 LEU B 30 4.048 29.011 -5.479 1.00 0.00 H new ATOM 2227 N VAL B 31 3.260 28.617 -10.783 1.00 0.00 N ATOM 2228 CA VAL B 31 3.945 28.801 -12.099 1.00 0.00 C ATOM 2229 C VAL B 31 3.804 30.257 -12.528 1.00 0.00 C ATOM 2230 O VAL B 31 4.688 30.830 -13.135 1.00 0.00 O ATOM 2231 CB VAL B 31 3.302 27.894 -13.149 1.00 0.00 C ATOM 2232 CG1 VAL B 31 4.022 28.063 -14.489 1.00 0.00 C ATOM 2233 CG2 VAL B 31 3.414 26.440 -12.690 1.00 0.00 C ATOM 0 H VAL B 31 2.544 27.891 -10.765 1.00 0.00 H new ATOM 0 HA VAL B 31 4.999 28.542 -12.004 1.00 0.00 H new ATOM 0 HB VAL B 31 2.253 28.163 -13.270 1.00 0.00 H new ATOM 0 HG11 VAL B 31 3.561 27.415 -15.234 1.00 0.00 H new ATOM 0 HG12 VAL B 31 3.947 29.101 -14.814 1.00 0.00 H new ATOM 0 HG13 VAL B 31 5.072 27.794 -14.374 1.00 0.00 H new ATOM 0 HG21 VAL B 31 2.957 25.787 -13.434 1.00 0.00 H new ATOM 0 HG22 VAL B 31 4.465 26.176 -12.572 1.00 0.00 H new ATOM 0 HG23 VAL B 31 2.900 26.319 -11.737 1.00 0.00 H new ATOM 2243 N SER B 32 2.701 30.868 -12.201 1.00 0.00 N ATOM 2244 CA SER B 32 2.510 32.294 -12.563 1.00 0.00 C ATOM 2245 C SER B 32 3.791 33.060 -12.223 1.00 0.00 C ATOM 2246 O SER B 32 4.212 33.937 -12.946 1.00 0.00 O ATOM 2247 CB SER B 32 1.343 32.866 -11.756 1.00 0.00 C ATOM 2248 OG SER B 32 0.260 31.946 -11.771 1.00 0.00 O ATOM 0 H SER B 32 1.924 30.439 -11.698 1.00 0.00 H new ATOM 0 HA SER B 32 2.293 32.387 -13.627 1.00 0.00 H new ATOM 0 HB2 SER B 32 1.656 33.058 -10.730 1.00 0.00 H new ATOM 0 HB3 SER B 32 1.029 33.821 -12.178 1.00 0.00 H new ATOM 0 HG SER B 32 -0.541 32.378 -11.408 1.00 0.00 H new ATOM 2254 N GLN B 33 4.400 32.740 -11.111 1.00 0.00 N ATOM 2255 CA GLN B 33 5.673 33.412 -10.733 1.00 0.00 C ATOM 2256 C GLN B 33 6.828 32.995 -11.661 1.00 0.00 C ATOM 2257 O GLN B 33 7.501 33.839 -12.217 1.00 0.00 O ATOM 2258 CB GLN B 33 6.025 33.035 -9.290 1.00 0.00 C ATOM 2259 CG GLN B 33 7.518 33.275 -9.044 1.00 0.00 C ATOM 2260 CD GLN B 33 7.909 34.659 -9.564 1.00 0.00 C ATOM 2261 OE1 GLN B 33 7.157 35.604 -9.432 1.00 0.00 O ATOM 2262 NE2 GLN B 33 9.062 34.819 -10.155 1.00 0.00 N ATOM 0 H GLN B 33 4.067 32.040 -10.448 1.00 0.00 H new ATOM 0 HA GLN B 33 5.534 34.489 -10.827 1.00 0.00 H new ATOM 0 HB2 GLN B 33 5.432 33.628 -8.594 1.00 0.00 H new ATOM 0 HB3 GLN B 33 5.780 31.989 -9.107 1.00 0.00 H new ATOM 0 HG2 GLN B 33 7.738 33.200 -7.979 1.00 0.00 H new ATOM 0 HG3 GLN B 33 8.107 32.507 -9.546 1.00 0.00 H new ATOM 0 HE21 GLN B 33 9.693 34.025 -10.266 1.00 0.00 H new ATOM 0 HE22 GLN B 33 9.332 35.738 -10.506 1.00 0.00 H new ATOM 2271 N ILE B 34 7.100 31.722 -11.833 1.00 0.00 N ATOM 2272 CA ILE B 34 8.207 31.350 -12.771 1.00 0.00 C ATOM 2273 C ILE B 34 7.898 31.833 -14.183 1.00 0.00 C ATOM 2274 O ILE B 34 8.172 31.150 -15.148 1.00 0.00 O ATOM 2275 CB ILE B 34 8.446 29.844 -12.805 1.00 0.00 C ATOM 2276 CG1 ILE B 34 8.449 29.285 -11.383 1.00 0.00 C ATOM 2277 CG2 ILE B 34 9.812 29.578 -13.448 1.00 0.00 C ATOM 2278 CD1 ILE B 34 8.530 27.759 -11.441 1.00 0.00 C ATOM 0 H ILE B 34 6.619 30.945 -11.379 1.00 0.00 H new ATOM 0 HA ILE B 34 9.110 31.835 -12.400 1.00 0.00 H new ATOM 0 HB ILE B 34 7.654 29.362 -13.379 1.00 0.00 H new ATOM 0 HG12 ILE B 34 9.295 29.685 -10.824 1.00 0.00 H new ATOM 0 HG13 ILE B 34 7.546 29.593 -10.857 1.00 0.00 H new ATOM 0 HG21 ILE B 34 9.997 28.504 -13.479 1.00 0.00 H new ATOM 0 HG22 ILE B 34 9.821 29.977 -14.462 1.00 0.00 H new ATOM 0 HG23 ILE B 34 10.591 30.063 -12.860 1.00 0.00 H new ATOM 0 HD11 ILE B 34 8.532 27.356 -10.428 1.00 0.00 H new ATOM 0 HD12 ILE B 34 7.669 27.369 -11.985 1.00 0.00 H new ATOM 0 HD13 ILE B 34 9.446 27.462 -11.952 1.00 0.00 H new ATOM 2290 N ASP B 35 7.376 33.016 -14.333 1.00 0.00 N ATOM 2291 CA ASP B 35 7.144 33.511 -15.709 1.00 0.00 C ATOM 2292 C ASP B 35 8.519 33.545 -16.361 1.00 0.00 C ATOM 2293 O ASP B 35 8.680 33.826 -17.531 1.00 0.00 O ATOM 2294 CB ASP B 35 6.550 34.918 -15.662 1.00 0.00 C ATOM 2295 CG ASP B 35 6.138 35.351 -17.069 1.00 0.00 C ATOM 2296 OD1 ASP B 35 6.260 34.544 -17.975 1.00 0.00 O ATOM 2297 OD2 ASP B 35 5.699 36.481 -17.216 1.00 0.00 O ATOM 0 H ASP B 35 7.106 33.647 -13.579 1.00 0.00 H new ATOM 0 HA ASP B 35 6.448 32.879 -16.261 1.00 0.00 H new ATOM 0 HB2 ASP B 35 5.686 34.936 -14.998 1.00 0.00 H new ATOM 0 HB3 ASP B 35 7.280 35.618 -15.255 1.00 0.00 H new ATOM 2302 N THR B 36 9.514 33.238 -15.571 1.00 0.00 N ATOM 2303 CA THR B 36 10.907 33.209 -16.067 1.00 0.00 C ATOM 2304 C THR B 36 11.118 31.935 -16.880 1.00 0.00 C ATOM 2305 O THR B 36 12.178 31.696 -17.420 1.00 0.00 O ATOM 2306 CB THR B 36 11.862 33.212 -14.866 1.00 0.00 C ATOM 2307 OG1 THR B 36 11.541 32.129 -14.001 1.00 0.00 O ATOM 2308 CG2 THR B 36 11.715 34.532 -14.107 1.00 0.00 C ATOM 0 H THR B 36 9.410 33.003 -14.584 1.00 0.00 H new ATOM 0 HA THR B 36 11.101 34.080 -16.694 1.00 0.00 H new ATOM 0 HB THR B 36 12.889 33.104 -15.216 1.00 0.00 H new ATOM 0 HG1 THR B 36 12.152 32.130 -13.235 1.00 0.00 H new ATOM 0 HG21 THR B 36 12.392 34.538 -13.253 1.00 0.00 H new ATOM 0 HG22 THR B 36 11.960 35.362 -14.770 1.00 0.00 H new ATOM 0 HG23 THR B 36 10.688 34.638 -13.757 1.00 0.00 H new ATOM 2316 N VAL B 37 10.113 31.111 -16.979 1.00 0.00 N ATOM 2317 CA VAL B 37 10.252 29.882 -17.805 1.00 0.00 C ATOM 2318 C VAL B 37 11.703 29.407 -17.756 1.00 0.00 C ATOM 2319 O VAL B 37 12.302 29.092 -18.764 1.00 0.00 O ATOM 2320 CB VAL B 37 9.882 30.190 -19.250 1.00 0.00 C ATOM 2321 CG1 VAL B 37 8.387 30.495 -19.354 1.00 0.00 C ATOM 2322 CG2 VAL B 37 10.685 31.400 -19.727 1.00 0.00 C ATOM 0 H VAL B 37 9.207 31.235 -16.527 1.00 0.00 H new ATOM 0 HA VAL B 37 9.590 29.108 -17.415 1.00 0.00 H new ATOM 0 HB VAL B 37 10.111 29.326 -19.873 1.00 0.00 H new ATOM 0 HG11 VAL B 37 8.132 30.714 -20.391 1.00 0.00 H new ATOM 0 HG12 VAL B 37 7.815 29.632 -19.014 1.00 0.00 H new ATOM 0 HG13 VAL B 37 8.147 31.357 -18.731 1.00 0.00 H new ATOM 0 HG21 VAL B 37 10.424 31.625 -20.761 1.00 0.00 H new ATOM 0 HG22 VAL B 37 10.454 32.260 -19.099 1.00 0.00 H new ATOM 0 HG23 VAL B 37 11.750 31.179 -19.662 1.00 0.00 H new ATOM 2332 N LYS B 38 12.265 29.345 -16.586 1.00 0.00 N ATOM 2333 CA LYS B 38 13.641 28.809 -16.440 1.00 0.00 C ATOM 2334 C LYS B 38 13.589 27.674 -15.428 1.00 0.00 C ATOM 2335 O LYS B 38 14.430 27.549 -14.563 1.00 0.00 O ATOM 2336 CB LYS B 38 14.587 29.904 -15.938 1.00 0.00 C ATOM 2337 CG LYS B 38 14.098 30.424 -14.589 1.00 0.00 C ATOM 2338 CD LYS B 38 15.215 31.219 -13.912 1.00 0.00 C ATOM 2339 CE LYS B 38 15.831 32.190 -14.919 1.00 0.00 C ATOM 2340 NZ LYS B 38 16.608 33.232 -14.192 1.00 0.00 N ATOM 0 H LYS B 38 11.825 29.646 -15.716 1.00 0.00 H new ATOM 0 HA LYS B 38 14.011 28.454 -17.402 1.00 0.00 H new ATOM 0 HB2 LYS B 38 15.598 29.509 -15.842 1.00 0.00 H new ATOM 0 HB3 LYS B 38 14.631 30.720 -16.660 1.00 0.00 H new ATOM 0 HG2 LYS B 38 13.220 31.056 -14.727 1.00 0.00 H new ATOM 0 HG3 LYS B 38 13.794 29.591 -13.955 1.00 0.00 H new ATOM 0 HD2 LYS B 38 14.819 31.767 -13.057 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.979 30.541 -13.530 1.00 0.00 H new ATOM 0 HE2 LYS B 38 16.481 31.652 -15.609 1.00 0.00 H new ATOM 0 HE3 LYS B 38 15.048 32.656 -15.517 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 17.027 33.893 -14.877 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 15.976 33.752 -13.551 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 17.364 32.779 -13.640 1.00 0.00 H new ATOM 2354 N SER B 39 12.585 26.851 -15.531 1.00 0.00 N ATOM 2355 CA SER B 39 12.417 25.750 -14.551 1.00 0.00 C ATOM 2356 C SER B 39 11.227 24.879 -14.975 1.00 0.00 C ATOM 2357 O SER B 39 10.607 25.135 -15.988 1.00 0.00 O ATOM 2358 CB SER B 39 12.170 26.360 -13.179 1.00 0.00 C ATOM 2359 OG SER B 39 11.821 25.340 -12.258 1.00 0.00 O ATOM 0 H SER B 39 11.870 26.896 -16.257 1.00 0.00 H new ATOM 0 HA SER B 39 13.310 25.127 -14.513 1.00 0.00 H new ATOM 0 HB2 SER B 39 13.063 26.882 -12.837 1.00 0.00 H new ATOM 0 HB3 SER B 39 11.371 27.099 -13.238 1.00 0.00 H new ATOM 0 HG SER B 39 12.440 24.587 -12.354 1.00 0.00 H new ATOM 2365 N PHE B 40 10.913 23.839 -14.248 1.00 0.00 N ATOM 2366 CA PHE B 40 9.763 22.991 -14.673 1.00 0.00 C ATOM 2367 C PHE B 40 9.002 22.419 -13.476 1.00 0.00 C ATOM 2368 O PHE B 40 9.536 22.247 -12.397 1.00 0.00 O ATOM 2369 CB PHE B 40 10.306 21.837 -15.519 1.00 0.00 C ATOM 2370 CG PHE B 40 11.016 22.397 -16.719 1.00 0.00 C ATOM 2371 CD1 PHE B 40 10.289 22.734 -17.862 1.00 0.00 C ATOM 2372 CD2 PHE B 40 12.402 22.576 -16.686 1.00 0.00 C ATOM 2373 CE1 PHE B 40 10.948 23.256 -18.980 1.00 0.00 C ATOM 2374 CE2 PHE B 40 13.062 23.098 -17.803 1.00 0.00 C ATOM 2375 CZ PHE B 40 12.336 23.439 -18.950 1.00 0.00 C ATOM 0 H PHE B 40 11.392 23.545 -13.397 1.00 0.00 H new ATOM 0 HA PHE B 40 9.068 23.609 -15.242 1.00 0.00 H new ATOM 0 HB2 PHE B 40 10.990 21.227 -14.928 1.00 0.00 H new ATOM 0 HB3 PHE B 40 9.490 21.186 -15.835 1.00 0.00 H new ATOM 0 HD1 PHE B 40 9.219 22.592 -17.883 1.00 0.00 H new ATOM 0 HD2 PHE B 40 12.961 22.312 -15.801 1.00 0.00 H new ATOM 0 HE1 PHE B 40 10.387 23.518 -19.865 1.00 0.00 H new ATOM 0 HE2 PHE B 40 14.133 23.238 -17.781 1.00 0.00 H new ATOM 0 HZ PHE B 40 12.846 23.843 -19.812 1.00 0.00 H new ATOM 2385 N GLU B 41 7.743 22.102 -13.684 1.00 0.00 N ATOM 2386 CA GLU B 41 6.898 21.539 -12.588 1.00 0.00 C ATOM 2387 C GLU B 41 5.716 20.745 -13.179 1.00 0.00 C ATOM 2388 O GLU B 41 4.954 21.250 -13.980 1.00 0.00 O ATOM 2389 CB GLU B 41 6.346 22.673 -11.740 1.00 0.00 C ATOM 2390 CG GLU B 41 7.490 23.570 -11.268 1.00 0.00 C ATOM 2391 CD GLU B 41 6.969 24.564 -10.228 1.00 0.00 C ATOM 2392 OE1 GLU B 41 5.764 24.629 -10.054 1.00 0.00 O ATOM 2393 OE2 GLU B 41 7.785 25.240 -9.622 1.00 0.00 O ATOM 0 H GLU B 41 7.264 22.212 -14.578 1.00 0.00 H new ATOM 0 HA GLU B 41 7.513 20.876 -11.979 1.00 0.00 H new ATOM 0 HB2 GLU B 41 5.629 23.256 -12.318 1.00 0.00 H new ATOM 0 HB3 GLU B 41 5.810 22.269 -10.881 1.00 0.00 H new ATOM 0 HG2 GLU B 41 8.287 22.963 -10.838 1.00 0.00 H new ATOM 0 HG3 GLU B 41 7.918 24.106 -12.115 1.00 0.00 H new ATOM 2400 N TRP B 42 5.551 19.513 -12.773 1.00 0.00 N ATOM 2401 CA TRP B 42 4.412 18.695 -13.285 1.00 0.00 C ATOM 2402 C TRP B 42 3.893 17.844 -12.133 1.00 0.00 C ATOM 2403 O TRP B 42 4.427 17.892 -11.043 1.00 0.00 O ATOM 2404 CB TRP B 42 4.903 17.793 -14.425 1.00 0.00 C ATOM 2405 CG TRP B 42 3.837 17.647 -15.466 1.00 0.00 C ATOM 2406 CD1 TRP B 42 3.485 18.608 -16.353 1.00 0.00 C ATOM 2407 CD2 TRP B 42 2.977 16.503 -15.742 1.00 0.00 C ATOM 2408 NE1 TRP B 42 2.461 18.129 -17.149 1.00 0.00 N ATOM 2409 CE2 TRP B 42 2.112 16.837 -16.812 1.00 0.00 C ATOM 2410 CE3 TRP B 42 2.862 15.221 -15.174 1.00 0.00 C ATOM 2411 CZ2 TRP B 42 1.166 15.933 -17.299 1.00 0.00 C ATOM 2412 CZ3 TRP B 42 1.912 14.308 -15.663 1.00 0.00 C ATOM 2413 CH2 TRP B 42 1.066 14.664 -16.724 1.00 0.00 C ATOM 0 H TRP B 42 6.159 19.037 -12.106 1.00 0.00 H new ATOM 0 HA TRP B 42 3.617 19.336 -13.666 1.00 0.00 H new ATOM 0 HB2 TRP B 42 5.802 18.217 -14.872 1.00 0.00 H new ATOM 0 HB3 TRP B 42 5.174 16.813 -14.032 1.00 0.00 H new ATOM 0 HD1 TRP B 42 3.931 19.589 -16.427 1.00 0.00 H new ATOM 0 HE1 TRP B 42 2.017 18.665 -17.895 1.00 0.00 H new ATOM 0 HE3 TRP B 42 3.508 14.937 -14.357 1.00 0.00 H new ATOM 0 HZ2 TRP B 42 0.516 16.213 -18.115 1.00 0.00 H new ATOM 0 HZ3 TRP B 42 1.833 13.327 -15.219 1.00 0.00 H new ATOM 0 HH2 TRP B 42 0.338 13.958 -17.096 1.00 0.00 H new ATOM 2424 N GLY B 43 2.862 17.070 -12.337 1.00 0.00 N ATOM 2425 CA GLY B 43 2.354 16.233 -11.201 1.00 0.00 C ATOM 2426 C GLY B 43 1.886 14.867 -11.700 1.00 0.00 C ATOM 2427 O GLY B 43 1.747 14.640 -12.885 1.00 0.00 O ATOM 0 H GLY B 43 2.356 16.978 -13.218 1.00 0.00 H new ATOM 0 HA2 GLY B 43 3.141 16.104 -10.458 1.00 0.00 H new ATOM 0 HA3 GLY B 43 1.530 16.746 -10.706 1.00 0.00 H new ATOM 2431 N GLU B 44 1.628 13.956 -10.800 1.00 0.00 N ATOM 2432 CA GLU B 44 1.187 12.600 -11.220 1.00 0.00 C ATOM 2433 C GLU B 44 0.267 12.014 -10.155 1.00 0.00 C ATOM 2434 O GLU B 44 0.449 12.225 -8.974 1.00 0.00 O ATOM 2435 CB GLU B 44 2.398 11.673 -11.386 1.00 0.00 C ATOM 2436 CG GLU B 44 3.378 12.265 -12.400 1.00 0.00 C ATOM 2437 CD GLU B 44 4.495 11.257 -12.663 1.00 0.00 C ATOM 2438 OE1 GLU B 44 4.587 10.297 -11.917 1.00 0.00 O ATOM 2439 OE2 GLU B 44 5.242 11.463 -13.607 1.00 0.00 O ATOM 0 H GLU B 44 1.704 14.095 -9.792 1.00 0.00 H new ATOM 0 HA GLU B 44 0.661 12.683 -12.171 1.00 0.00 H new ATOM 0 HB2 GLU B 44 2.895 11.536 -10.426 1.00 0.00 H new ATOM 0 HB3 GLU B 44 2.069 10.688 -11.718 1.00 0.00 H new ATOM 0 HG2 GLU B 44 2.860 12.503 -13.329 1.00 0.00 H new ATOM 0 HG3 GLU B 44 3.795 13.198 -12.020 1.00 0.00 H new ATOM 2446 N ASP B 45 -0.699 11.256 -10.577 1.00 0.00 N ATOM 2447 CA ASP B 45 -1.597 10.546 -9.628 1.00 0.00 C ATOM 2448 C ASP B 45 -1.520 9.061 -9.980 1.00 0.00 C ATOM 2449 O ASP B 45 -1.336 8.713 -11.131 1.00 0.00 O ATOM 2450 CB ASP B 45 -3.031 11.063 -9.767 1.00 0.00 C ATOM 2451 CG ASP B 45 -3.096 12.526 -9.330 1.00 0.00 C ATOM 2452 OD1 ASP B 45 -2.138 12.985 -8.725 1.00 0.00 O ATOM 2453 OD2 ASP B 45 -4.097 13.166 -9.603 1.00 0.00 O ATOM 0 H ASP B 45 -0.910 11.094 -11.562 1.00 0.00 H new ATOM 0 HA ASP B 45 -1.293 10.715 -8.595 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -3.364 10.967 -10.801 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -3.705 10.461 -9.158 1.00 0.00 H new ATOM 2458 N LYS B 46 -1.632 8.173 -9.034 1.00 0.00 N ATOM 2459 CA LYS B 46 -1.440 6.734 -9.376 1.00 0.00 C ATOM 2460 C LYS B 46 -2.358 5.871 -8.511 1.00 0.00 C ATOM 2461 O LYS B 46 -2.490 6.087 -7.323 1.00 0.00 O ATOM 2462 CB LYS B 46 0.014 6.324 -9.159 1.00 0.00 C ATOM 2463 CG LYS B 46 0.178 5.775 -7.738 1.00 0.00 C ATOM 2464 CD LYS B 46 -0.141 6.877 -6.728 1.00 0.00 C ATOM 2465 CE LYS B 46 -0.650 6.250 -5.429 1.00 0.00 C ATOM 2466 NZ LYS B 46 -2.070 6.650 -5.205 1.00 0.00 N ATOM 0 H LYS B 46 -1.844 8.373 -8.056 1.00 0.00 H new ATOM 0 HA LYS B 46 -1.690 6.587 -10.427 1.00 0.00 H new ATOM 0 HB2 LYS B 46 0.304 5.568 -9.889 1.00 0.00 H new ATOM 0 HB3 LYS B 46 0.672 7.180 -9.309 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -0.486 4.924 -7.586 1.00 0.00 H new ATOM 0 HG3 LYS B 46 1.196 5.415 -7.591 1.00 0.00 H new ATOM 0 HD2 LYS B 46 0.750 7.473 -6.531 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -0.893 7.552 -7.137 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -0.571 5.164 -5.482 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -0.033 6.574 -4.591 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -2.379 6.324 -4.267 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -2.151 7.686 -5.255 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -2.671 6.220 -5.937 1.00 0.00 H new ATOM 2480 N GLU B 47 -2.993 4.898 -9.106 1.00 0.00 N ATOM 2481 CA GLU B 47 -3.800 3.921 -8.316 1.00 0.00 C ATOM 2482 C GLU B 47 -3.431 2.497 -8.741 1.00 0.00 C ATOM 2483 O GLU B 47 -3.956 1.531 -8.227 1.00 0.00 O ATOM 2484 CB GLU B 47 -5.300 4.159 -8.552 1.00 0.00 C ATOM 2485 CG GLU B 47 -5.688 5.557 -8.068 1.00 0.00 C ATOM 2486 CD GLU B 47 -7.196 5.754 -8.230 1.00 0.00 C ATOM 2487 OE1 GLU B 47 -7.820 4.916 -8.861 1.00 0.00 O ATOM 2488 OE2 GLU B 47 -7.705 6.738 -7.716 1.00 0.00 O ATOM 0 H GLU B 47 -2.988 4.736 -10.113 1.00 0.00 H new ATOM 0 HA GLU B 47 -3.585 4.054 -7.256 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -5.531 4.055 -9.612 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -5.884 3.406 -8.023 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -5.404 5.683 -7.023 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -5.149 6.313 -8.638 1.00 0.00 H new ATOM 2495 N SER B 48 -2.531 2.359 -9.682 1.00 0.00 N ATOM 2496 CA SER B 48 -2.138 0.996 -10.144 1.00 0.00 C ATOM 2497 C SER B 48 -1.814 0.102 -8.941 1.00 0.00 C ATOM 2498 O SER B 48 -2.334 0.292 -7.859 1.00 0.00 O ATOM 2499 CB SER B 48 -0.900 1.104 -11.037 1.00 0.00 C ATOM 2500 OG SER B 48 -0.445 -0.202 -11.368 1.00 0.00 O ATOM 0 H SER B 48 -2.053 3.130 -10.148 1.00 0.00 H new ATOM 0 HA SER B 48 -2.965 0.558 -10.702 1.00 0.00 H new ATOM 0 HB2 SER B 48 -1.139 1.659 -11.944 1.00 0.00 H new ATOM 0 HB3 SER B 48 -0.113 1.656 -10.523 1.00 0.00 H new ATOM 0 HG SER B 48 0.525 -0.254 -11.236 1.00 0.00 H new ATOM 2506 N HIS B 49 -0.952 -0.863 -9.115 1.00 0.00 N ATOM 2507 CA HIS B 49 -0.638 -1.801 -7.996 1.00 0.00 C ATOM 2508 C HIS B 49 0.166 -1.068 -6.921 1.00 0.00 C ATOM 2509 O HIS B 49 0.868 -0.116 -7.195 1.00 0.00 O ATOM 2510 CB HIS B 49 0.171 -2.987 -8.532 1.00 0.00 C ATOM 2511 CG HIS B 49 -0.663 -3.757 -9.520 1.00 0.00 C ATOM 2512 ND1 HIS B 49 -0.612 -3.506 -10.884 1.00 0.00 N ATOM 2513 CD2 HIS B 49 -1.571 -4.776 -9.360 1.00 0.00 C ATOM 2514 CE1 HIS B 49 -1.466 -4.355 -11.486 1.00 0.00 C ATOM 2515 NE2 HIS B 49 -2.072 -5.148 -10.601 1.00 0.00 N ATOM 0 H HIS B 49 -0.450 -1.044 -9.985 1.00 0.00 H new ATOM 0 HA HIS B 49 -1.567 -2.168 -7.560 1.00 0.00 H new ATOM 0 HB2 HIS B 49 1.084 -2.632 -9.009 1.00 0.00 H new ATOM 0 HB3 HIS B 49 0.473 -3.636 -7.710 1.00 0.00 H new ATOM 0 HD2 HIS B 49 -1.852 -5.219 -8.416 1.00 0.00 H new ATOM 0 HE1 HIS B 49 -1.639 -4.390 -12.552 1.00 0.00 H new ATOM 0 HE2 HIS B 49 -2.760 -5.876 -10.795 1.00 0.00 H new ATOM 2524 N ASP B 50 0.060 -1.503 -5.695 1.00 0.00 N ATOM 2525 CA ASP B 50 0.815 -0.839 -4.593 1.00 0.00 C ATOM 2526 C ASP B 50 2.326 -1.046 -4.764 1.00 0.00 C ATOM 2527 O ASP B 50 3.110 -0.145 -4.545 1.00 0.00 O ATOM 2528 CB ASP B 50 0.377 -1.430 -3.252 1.00 0.00 C ATOM 2529 CG ASP B 50 -1.083 -1.058 -2.978 1.00 0.00 C ATOM 2530 OD1 ASP B 50 -1.602 -0.216 -3.691 1.00 0.00 O ATOM 2531 OD2 ASP B 50 -1.656 -1.622 -2.062 1.00 0.00 O ATOM 0 H ASP B 50 -0.519 -2.292 -5.408 1.00 0.00 H new ATOM 0 HA ASP B 50 0.603 0.230 -4.622 1.00 0.00 H new ATOM 0 HB2 ASP B 50 0.490 -2.514 -3.267 1.00 0.00 H new ATOM 0 HB3 ASP B 50 1.015 -1.054 -2.452 1.00 0.00 H new ATOM 2536 N MET B 51 2.741 -2.227 -5.131 1.00 0.00 N ATOM 2537 CA MET B 51 4.202 -2.484 -5.302 1.00 0.00 C ATOM 2538 C MET B 51 4.749 -1.722 -6.517 1.00 0.00 C ATOM 2539 O MET B 51 5.878 -1.274 -6.511 1.00 0.00 O ATOM 2540 CB MET B 51 4.443 -3.982 -5.484 1.00 0.00 C ATOM 2541 CG MET B 51 5.933 -4.280 -5.322 1.00 0.00 C ATOM 2542 SD MET B 51 6.814 -3.797 -6.828 1.00 0.00 S ATOM 2543 CE MET B 51 8.378 -3.339 -6.042 1.00 0.00 C ATOM 0 H MET B 51 2.134 -3.025 -5.320 1.00 0.00 H new ATOM 0 HA MET B 51 4.722 -2.135 -4.410 1.00 0.00 H new ATOM 0 HB2 MET B 51 3.866 -4.546 -4.751 1.00 0.00 H new ATOM 0 HB3 MET B 51 4.103 -4.299 -6.470 1.00 0.00 H new ATOM 0 HG2 MET B 51 6.332 -3.737 -4.465 1.00 0.00 H new ATOM 0 HG3 MET B 51 6.083 -5.342 -5.125 1.00 0.00 H new ATOM 0 HE1 MET B 51 9.172 -3.331 -6.789 1.00 0.00 H new ATOM 0 HE2 MET B 51 8.286 -2.347 -5.599 1.00 0.00 H new ATOM 0 HE3 MET B 51 8.620 -4.063 -5.264 1.00 0.00 H new ATOM 2553 N LEU B 52 3.971 -1.561 -7.555 1.00 0.00 N ATOM 2554 CA LEU B 52 4.480 -0.811 -8.742 1.00 0.00 C ATOM 2555 C LEU B 52 4.213 0.686 -8.545 1.00 0.00 C ATOM 2556 O LEU B 52 5.111 1.501 -8.605 1.00 0.00 O ATOM 2557 CB LEU B 52 3.760 -1.284 -10.009 1.00 0.00 C ATOM 2558 CG LEU B 52 3.922 -2.799 -10.171 1.00 0.00 C ATOM 2559 CD1 LEU B 52 3.227 -3.250 -11.459 1.00 0.00 C ATOM 2560 CD2 LEU B 52 5.410 -3.152 -10.254 1.00 0.00 C ATOM 0 H LEU B 52 3.016 -1.911 -7.633 1.00 0.00 H new ATOM 0 HA LEU B 52 5.550 -0.991 -8.847 1.00 0.00 H new ATOM 0 HB2 LEU B 52 2.702 -1.027 -9.953 1.00 0.00 H new ATOM 0 HB3 LEU B 52 4.167 -0.771 -10.881 1.00 0.00 H new ATOM 0 HG LEU B 52 3.475 -3.302 -9.314 1.00 0.00 H new ATOM 0 HD11 LEU B 52 3.341 -4.328 -11.576 1.00 0.00 H new ATOM 0 HD12 LEU B 52 2.167 -3.001 -11.407 1.00 0.00 H new ATOM 0 HD13 LEU B 52 3.677 -2.743 -12.312 1.00 0.00 H new ATOM 0 HD21 LEU B 52 5.522 -4.230 -10.369 1.00 0.00 H new ATOM 0 HD22 LEU B 52 5.856 -2.647 -11.111 1.00 0.00 H new ATOM 0 HD23 LEU B 52 5.912 -2.830 -9.341 1.00 0.00 H new ATOM 2572 N ARG B 53 2.977 1.052 -8.330 1.00 0.00 N ATOM 2573 CA ARG B 53 2.630 2.493 -8.149 1.00 0.00 C ATOM 2574 C ARG B 53 3.381 3.101 -6.956 1.00 0.00 C ATOM 2575 O ARG B 53 3.159 4.236 -6.588 1.00 0.00 O ATOM 2576 CB ARG B 53 1.124 2.610 -7.909 1.00 0.00 C ATOM 2577 CG ARG B 53 0.842 2.637 -6.403 1.00 0.00 C ATOM 2578 CD ARG B 53 -0.623 2.285 -6.163 1.00 0.00 C ATOM 2579 NE ARG B 53 -0.899 2.287 -4.695 1.00 0.00 N ATOM 2580 CZ ARG B 53 -2.122 2.314 -4.248 1.00 0.00 C ATOM 2581 NH1 ARG B 53 -3.115 2.345 -5.086 1.00 0.00 N ATOM 2582 NH2 ARG B 53 -2.348 2.294 -2.961 1.00 0.00 N ATOM 0 H ARG B 53 2.187 0.410 -8.272 1.00 0.00 H new ATOM 0 HA ARG B 53 2.921 3.037 -9.047 1.00 0.00 H new ATOM 0 HB2 ARG B 53 0.741 3.517 -8.377 1.00 0.00 H new ATOM 0 HB3 ARG B 53 0.606 1.770 -8.371 1.00 0.00 H new ATOM 0 HG2 ARG B 53 1.489 1.928 -5.887 1.00 0.00 H new ATOM 0 HG3 ARG B 53 1.063 3.624 -5.997 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -1.269 3.004 -6.667 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -0.847 1.305 -6.585 1.00 0.00 H new ATOM 0 HE ARG B 53 -0.121 2.267 -4.035 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -2.935 2.348 -6.090 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -4.074 2.366 -4.740 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -1.567 2.257 -2.306 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -3.306 2.315 -2.611 1.00 0.00 H new ATOM 2596 N GLN B 54 4.258 2.360 -6.342 1.00 0.00 N ATOM 2597 CA GLN B 54 5.024 2.915 -5.184 1.00 0.00 C ATOM 2598 C GLN B 54 4.060 3.350 -4.069 1.00 0.00 C ATOM 2599 O GLN B 54 4.439 3.493 -2.923 1.00 0.00 O ATOM 2600 CB GLN B 54 5.868 4.110 -5.641 1.00 0.00 C ATOM 2601 CG GLN B 54 7.344 3.697 -5.695 1.00 0.00 C ATOM 2602 CD GLN B 54 8.220 4.942 -5.841 1.00 0.00 C ATOM 2603 OE1 GLN B 54 9.204 4.932 -6.697 1.00 0.00 O flip ATOM 2604 NE2 GLN B 54 8.006 5.933 -5.172 1.00 0.00 N flip ATOM 0 H GLN B 54 4.480 1.395 -6.588 1.00 0.00 H new ATOM 0 HA GLN B 54 5.684 2.140 -4.795 1.00 0.00 H new ATOM 0 HB2 GLN B 54 5.537 4.449 -6.623 1.00 0.00 H new ATOM 0 HB3 GLN B 54 5.737 4.946 -4.954 1.00 0.00 H new ATOM 0 HG2 GLN B 54 7.614 3.154 -4.789 1.00 0.00 H new ATOM 0 HG3 GLN B 54 7.513 3.021 -6.533 1.00 0.00 H new ATOM 0 HE21 GLN B 54 7.236 5.940 -4.503 1.00 0.00 H new ATOM 0 HE22 GLN B 54 8.596 6.758 -5.279 1.00 0.00 H new ATOM 2613 N GLY B 55 2.807 3.523 -4.398 1.00 0.00 N ATOM 2614 CA GLY B 55 1.784 3.925 -3.381 1.00 0.00 C ATOM 2615 C GLY B 55 1.756 5.443 -3.129 1.00 0.00 C ATOM 2616 O GLY B 55 0.807 5.950 -2.565 1.00 0.00 O ATOM 0 H GLY B 55 2.441 3.401 -5.342 1.00 0.00 H new ATOM 0 HA2 GLY B 55 0.799 3.599 -3.715 1.00 0.00 H new ATOM 0 HA3 GLY B 55 1.989 3.410 -2.443 1.00 0.00 H new ATOM 2620 N PHE B 56 2.769 6.178 -3.505 1.00 0.00 N ATOM 2621 CA PHE B 56 2.730 7.654 -3.248 1.00 0.00 C ATOM 2622 C PHE B 56 1.532 8.280 -3.973 1.00 0.00 C ATOM 2623 O PHE B 56 1.440 8.247 -5.184 1.00 0.00 O ATOM 2624 CB PHE B 56 4.033 8.303 -3.723 1.00 0.00 C ATOM 2625 CG PHE B 56 4.011 8.448 -5.221 1.00 0.00 C ATOM 2626 CD1 PHE B 56 4.041 7.307 -6.029 1.00 0.00 C ATOM 2627 CD2 PHE B 56 3.959 9.719 -5.802 1.00 0.00 C ATOM 2628 CE1 PHE B 56 4.021 7.437 -7.421 1.00 0.00 C ATOM 2629 CE2 PHE B 56 3.938 9.850 -7.194 1.00 0.00 C ATOM 2630 CZ PHE B 56 3.969 8.710 -8.004 1.00 0.00 C ATOM 0 H PHE B 56 3.608 5.832 -3.970 1.00 0.00 H new ATOM 0 HA PHE B 56 2.622 7.826 -2.177 1.00 0.00 H new ATOM 0 HB2 PHE B 56 4.156 9.280 -3.255 1.00 0.00 H new ATOM 0 HB3 PHE B 56 4.885 7.695 -3.419 1.00 0.00 H new ATOM 0 HD1 PHE B 56 4.080 6.326 -5.578 1.00 0.00 H new ATOM 0 HD2 PHE B 56 3.935 10.599 -5.176 1.00 0.00 H new ATOM 0 HE1 PHE B 56 4.046 6.557 -8.046 1.00 0.00 H new ATOM 0 HE2 PHE B 56 3.898 10.831 -7.644 1.00 0.00 H new ATOM 0 HZ PHE B 56 3.953 8.811 -9.079 1.00 0.00 H new ATOM 2640 N THR B 57 0.605 8.843 -3.235 1.00 0.00 N ATOM 2641 CA THR B 57 -0.637 9.388 -3.863 1.00 0.00 C ATOM 2642 C THR B 57 -0.298 10.333 -5.020 1.00 0.00 C ATOM 2643 O THR B 57 -1.027 10.423 -5.988 1.00 0.00 O ATOM 2644 CB THR B 57 -1.450 10.158 -2.817 1.00 0.00 C ATOM 2645 OG1 THR B 57 -0.709 11.287 -2.377 1.00 0.00 O ATOM 2646 CG2 THR B 57 -1.751 9.247 -1.625 1.00 0.00 C ATOM 0 H THR B 57 0.657 8.948 -2.222 1.00 0.00 H new ATOM 0 HA THR B 57 -1.217 8.549 -4.249 1.00 0.00 H new ATOM 0 HB THR B 57 -2.388 10.490 -3.262 1.00 0.00 H new ATOM 0 HG1 THR B 57 -1.326 11.987 -2.079 1.00 0.00 H new ATOM 0 HG21 THR B 57 -2.329 9.798 -0.883 1.00 0.00 H new ATOM 0 HG22 THR B 57 -2.323 8.383 -1.963 1.00 0.00 H new ATOM 0 HG23 THR B 57 -0.815 8.910 -1.179 1.00 0.00 H new ATOM 2654 N HIS B 58 0.786 11.058 -4.929 1.00 0.00 N ATOM 2655 CA HIS B 58 1.140 11.986 -6.040 1.00 0.00 C ATOM 2656 C HIS B 58 2.494 12.644 -5.767 1.00 0.00 C ATOM 2657 O HIS B 58 2.951 12.707 -4.644 1.00 0.00 O ATOM 2658 CB HIS B 58 0.073 13.080 -6.146 1.00 0.00 C ATOM 2659 CG HIS B 58 -0.658 13.201 -4.832 1.00 0.00 C ATOM 2660 ND1 HIS B 58 -0.146 13.926 -3.766 1.00 0.00 N ATOM 2661 CD2 HIS B 58 -1.859 12.690 -4.396 1.00 0.00 C ATOM 2662 CE1 HIS B 58 -1.026 13.832 -2.750 1.00 0.00 C ATOM 2663 NE2 HIS B 58 -2.084 13.091 -3.084 1.00 0.00 N ATOM 0 H HIS B 58 1.435 11.048 -4.142 1.00 0.00 H new ATOM 0 HA HIS B 58 1.193 11.419 -6.969 1.00 0.00 H new ATOM 0 HB2 HIS B 58 0.537 14.032 -6.405 1.00 0.00 H new ATOM 0 HB3 HIS B 58 -0.630 12.841 -6.944 1.00 0.00 H new ATOM 0 HD2 HIS B 58 -2.524 12.073 -4.982 1.00 0.00 H new ATOM 0 HE1 HIS B 58 -0.892 14.298 -1.785 1.00 0.00 H new ATOM 0 HE2 HIS B 58 -2.889 12.866 -2.499 1.00 0.00 H new ATOM 2672 N ALA B 59 3.127 13.149 -6.790 1.00 0.00 N ATOM 2673 CA ALA B 59 4.453 13.796 -6.602 1.00 0.00 C ATOM 2674 C ALA B 59 4.565 14.998 -7.537 1.00 0.00 C ATOM 2675 O ALA B 59 3.749 15.195 -8.416 1.00 0.00 O ATOM 2676 CB ALA B 59 5.574 12.801 -6.915 1.00 0.00 C ATOM 0 H ALA B 59 2.781 13.141 -7.749 1.00 0.00 H new ATOM 0 HA ALA B 59 4.548 14.123 -5.566 1.00 0.00 H new ATOM 0 HB1 ALA B 59 6.540 13.285 -6.774 1.00 0.00 H new ATOM 0 HB2 ALA B 59 5.497 11.944 -6.246 1.00 0.00 H new ATOM 0 HB3 ALA B 59 5.484 12.465 -7.948 1.00 0.00 H new ATOM 2682 N PHE B 60 5.572 15.802 -7.353 1.00 0.00 N ATOM 2683 CA PHE B 60 5.761 16.978 -8.238 1.00 0.00 C ATOM 2684 C PHE B 60 7.208 17.013 -8.719 1.00 0.00 C ATOM 2685 O PHE B 60 8.134 16.971 -7.933 1.00 0.00 O ATOM 2686 CB PHE B 60 5.467 18.259 -7.450 1.00 0.00 C ATOM 2687 CG PHE B 60 4.009 18.302 -7.064 1.00 0.00 C ATOM 2688 CD1 PHE B 60 3.072 18.869 -7.936 1.00 0.00 C ATOM 2689 CD2 PHE B 60 3.593 17.768 -5.839 1.00 0.00 C ATOM 2690 CE1 PHE B 60 1.717 18.902 -7.584 1.00 0.00 C ATOM 2691 CE2 PHE B 60 2.238 17.802 -5.485 1.00 0.00 C ATOM 2692 CZ PHE B 60 1.301 18.368 -6.358 1.00 0.00 C ATOM 0 H PHE B 60 6.276 15.693 -6.623 1.00 0.00 H new ATOM 0 HA PHE B 60 5.086 16.907 -9.091 1.00 0.00 H new ATOM 0 HB2 PHE B 60 6.090 18.298 -6.556 1.00 0.00 H new ATOM 0 HB3 PHE B 60 5.719 19.132 -8.052 1.00 0.00 H new ATOM 0 HD1 PHE B 60 3.394 19.281 -8.881 1.00 0.00 H new ATOM 0 HD2 PHE B 60 4.316 17.330 -5.167 1.00 0.00 H new ATOM 0 HE1 PHE B 60 0.994 19.339 -8.257 1.00 0.00 H new ATOM 0 HE2 PHE B 60 1.916 17.392 -4.539 1.00 0.00 H new ATOM 0 HZ PHE B 60 0.256 18.393 -6.086 1.00 0.00 H new ATOM 2702 N SER B 61 7.418 17.105 -10.000 1.00 0.00 N ATOM 2703 CA SER B 61 8.812 17.119 -10.525 1.00 0.00 C ATOM 2704 C SER B 61 9.255 18.578 -10.661 1.00 0.00 C ATOM 2705 O SER B 61 8.911 19.257 -11.607 1.00 0.00 O ATOM 2706 CB SER B 61 8.866 16.424 -11.882 1.00 0.00 C ATOM 2707 OG SER B 61 10.173 16.566 -12.426 1.00 0.00 O ATOM 0 H SER B 61 6.686 17.171 -10.707 1.00 0.00 H new ATOM 0 HA SER B 61 9.477 16.588 -9.844 1.00 0.00 H new ATOM 0 HB2 SER B 61 8.616 15.369 -11.774 1.00 0.00 H new ATOM 0 HB3 SER B 61 8.129 16.859 -12.557 1.00 0.00 H new ATOM 0 HG SER B 61 10.215 16.120 -13.298 1.00 0.00 H new ATOM 2713 N MET B 62 9.980 19.078 -9.700 1.00 0.00 N ATOM 2714 CA MET B 62 10.457 20.482 -9.788 1.00 0.00 C ATOM 2715 C MET B 62 11.913 20.532 -10.219 1.00 0.00 C ATOM 2716 O MET B 62 12.805 20.131 -9.500 1.00 0.00 O ATOM 2717 CB MET B 62 10.309 21.154 -8.419 1.00 0.00 C ATOM 2718 CG MET B 62 8.826 21.310 -8.083 1.00 0.00 C ATOM 2719 SD MET B 62 8.657 22.081 -6.456 1.00 0.00 S ATOM 2720 CE MET B 62 8.823 20.572 -5.471 1.00 0.00 C ATOM 0 H MET B 62 10.262 18.574 -8.859 1.00 0.00 H new ATOM 0 HA MET B 62 9.857 21.008 -10.531 1.00 0.00 H new ATOM 0 HB2 MET B 62 10.805 20.557 -7.654 1.00 0.00 H new ATOM 0 HB3 MET B 62 10.795 22.130 -8.427 1.00 0.00 H new ATOM 0 HG2 MET B 62 8.333 21.920 -8.840 1.00 0.00 H new ATOM 0 HG3 MET B 62 8.336 20.336 -8.089 1.00 0.00 H new ATOM 0 HE1 MET B 62 8.624 20.798 -4.423 1.00 0.00 H new ATOM 0 HE2 MET B 62 8.109 19.827 -5.823 1.00 0.00 H new ATOM 0 HE3 MET B 62 9.835 20.181 -5.572 1.00 0.00 H new ATOM 2730 N THR B 63 12.147 21.057 -11.386 1.00 0.00 N ATOM 2731 CA THR B 63 13.535 21.154 -11.912 1.00 0.00 C ATOM 2732 C THR B 63 13.812 22.635 -12.219 1.00 0.00 C ATOM 2733 O THR B 63 12.931 23.361 -12.639 1.00 0.00 O ATOM 2734 CB THR B 63 13.651 20.297 -13.176 1.00 0.00 C ATOM 2735 OG1 THR B 63 13.516 18.928 -12.816 1.00 0.00 O ATOM 2736 CG2 THR B 63 15.014 20.514 -13.838 1.00 0.00 C ATOM 0 H THR B 63 11.427 21.428 -12.006 1.00 0.00 H new ATOM 0 HA THR B 63 14.265 20.789 -11.189 1.00 0.00 H new ATOM 0 HB THR B 63 12.868 20.581 -13.879 1.00 0.00 H new ATOM 0 HG1 THR B 63 13.587 18.370 -13.619 1.00 0.00 H new ATOM 0 HG21 THR B 63 15.085 19.899 -14.735 1.00 0.00 H new ATOM 0 HG22 THR B 63 15.124 21.564 -14.108 1.00 0.00 H new ATOM 0 HG23 THR B 63 15.805 20.233 -13.143 1.00 0.00 H new ATOM 2744 N PHE B 64 15.001 23.107 -11.971 1.00 0.00 N ATOM 2745 CA PHE B 64 15.290 24.548 -12.232 1.00 0.00 C ATOM 2746 C PHE B 64 16.405 24.679 -13.270 1.00 0.00 C ATOM 2747 O PHE B 64 17.161 23.757 -13.499 1.00 0.00 O ATOM 2748 CB PHE B 64 15.751 25.196 -10.917 1.00 0.00 C ATOM 2749 CG PHE B 64 14.591 25.281 -9.955 1.00 0.00 C ATOM 2750 CD1 PHE B 64 14.207 24.155 -9.217 1.00 0.00 C ATOM 2751 CD2 PHE B 64 13.898 26.487 -9.800 1.00 0.00 C ATOM 2752 CE1 PHE B 64 13.131 24.233 -8.327 1.00 0.00 C ATOM 2753 CE2 PHE B 64 12.822 26.566 -8.909 1.00 0.00 C ATOM 2754 CZ PHE B 64 12.438 25.439 -8.173 1.00 0.00 C ATOM 0 H PHE B 64 15.781 22.564 -11.602 1.00 0.00 H new ATOM 0 HA PHE B 64 14.393 25.040 -12.609 1.00 0.00 H new ATOM 0 HB2 PHE B 64 16.559 24.611 -10.476 1.00 0.00 H new ATOM 0 HB3 PHE B 64 16.148 26.192 -11.111 1.00 0.00 H new ATOM 0 HD1 PHE B 64 14.743 23.225 -9.335 1.00 0.00 H new ATOM 0 HD2 PHE B 64 14.194 27.357 -10.368 1.00 0.00 H new ATOM 0 HE1 PHE B 64 12.835 23.363 -7.759 1.00 0.00 H new ATOM 0 HE2 PHE B 64 12.288 27.497 -8.789 1.00 0.00 H new ATOM 0 HZ PHE B 64 11.607 25.500 -7.486 1.00 0.00 H new ATOM 2764 N GLU B 65 16.541 25.832 -13.880 1.00 0.00 N ATOM 2765 CA GLU B 65 17.619 25.999 -14.896 1.00 0.00 C ATOM 2766 C GLU B 65 18.914 26.302 -14.150 1.00 0.00 C ATOM 2767 O GLU B 65 19.996 25.954 -14.578 1.00 0.00 O ATOM 2768 CB GLU B 65 17.298 27.169 -15.829 1.00 0.00 C ATOM 2769 CG GLU B 65 18.319 27.193 -16.969 1.00 0.00 C ATOM 2770 CD GLU B 65 18.081 28.421 -17.851 1.00 0.00 C ATOM 2771 OE1 GLU B 65 17.174 29.180 -17.542 1.00 0.00 O ATOM 2772 OE2 GLU B 65 18.806 28.583 -18.817 1.00 0.00 O ATOM 0 H GLU B 65 15.958 26.654 -13.719 1.00 0.00 H new ATOM 0 HA GLU B 65 17.708 25.092 -15.494 1.00 0.00 H new ATOM 0 HB2 GLU B 65 16.289 27.065 -16.229 1.00 0.00 H new ATOM 0 HB3 GLU B 65 17.327 28.109 -15.278 1.00 0.00 H new ATOM 0 HG2 GLU B 65 19.330 27.216 -16.563 1.00 0.00 H new ATOM 0 HG3 GLU B 65 18.235 26.284 -17.565 1.00 0.00 H new ATOM 2779 N ASN B 66 18.791 26.935 -13.017 1.00 0.00 N ATOM 2780 CA ASN B 66 19.982 27.280 -12.203 1.00 0.00 C ATOM 2781 C ASN B 66 19.507 27.745 -10.824 1.00 0.00 C ATOM 2782 O ASN B 66 18.324 27.844 -10.568 1.00 0.00 O ATOM 2783 CB ASN B 66 20.759 28.399 -12.892 1.00 0.00 C ATOM 2784 CG ASN B 66 19.918 29.674 -12.906 1.00 0.00 C ATOM 2785 OD1 ASN B 66 18.733 29.636 -12.638 1.00 0.00 O ATOM 2786 ND2 ASN B 66 20.481 30.811 -13.211 1.00 0.00 N ATOM 0 H ASN B 66 17.900 27.231 -12.617 1.00 0.00 H new ATOM 0 HA ASN B 66 20.634 26.413 -12.096 1.00 0.00 H new ATOM 0 HB2 ASN B 66 21.699 28.577 -12.370 1.00 0.00 H new ATOM 0 HB3 ASN B 66 21.011 28.106 -13.911 1.00 0.00 H new ATOM 0 HD21 ASN B 66 19.927 31.667 -13.224 1.00 0.00 H new ATOM 0 HD22 ASN B 66 21.475 30.844 -13.436 1.00 0.00 H new ATOM 2793 N LYS B 67 20.416 28.004 -9.926 1.00 0.00 N ATOM 2794 CA LYS B 67 20.018 28.447 -8.559 1.00 0.00 C ATOM 2795 C LYS B 67 19.322 29.813 -8.592 1.00 0.00 C ATOM 2796 O LYS B 67 18.565 30.149 -7.703 1.00 0.00 O ATOM 2797 CB LYS B 67 21.270 28.543 -7.682 1.00 0.00 C ATOM 2798 CG LYS B 67 21.926 27.165 -7.580 1.00 0.00 C ATOM 2799 CD LYS B 67 23.009 27.191 -6.497 1.00 0.00 C ATOM 2800 CE LYS B 67 24.112 28.170 -6.898 1.00 0.00 C ATOM 2801 NZ LYS B 67 25.354 27.871 -6.126 1.00 0.00 N ATOM 0 H LYS B 67 21.421 27.928 -10.080 1.00 0.00 H new ATOM 0 HA LYS B 67 19.317 27.718 -8.153 1.00 0.00 H new ATOM 0 HB2 LYS B 67 21.971 29.261 -8.107 1.00 0.00 H new ATOM 0 HB3 LYS B 67 21.005 28.906 -6.689 1.00 0.00 H new ATOM 0 HG2 LYS B 67 21.176 26.411 -7.341 1.00 0.00 H new ATOM 0 HG3 LYS B 67 22.363 26.887 -8.539 1.00 0.00 H new ATOM 0 HD2 LYS B 67 22.575 27.487 -5.542 1.00 0.00 H new ATOM 0 HD3 LYS B 67 23.426 26.193 -6.362 1.00 0.00 H new ATOM 0 HE2 LYS B 67 24.309 28.093 -7.967 1.00 0.00 H new ATOM 0 HE3 LYS B 67 23.791 29.194 -6.706 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 26.103 28.538 -6.401 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 25.162 27.966 -5.108 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 25.664 26.900 -6.330 1.00 0.00 H new ATOM 2815 N ASP B 68 19.578 30.615 -9.592 1.00 0.00 N ATOM 2816 CA ASP B 68 18.938 31.968 -9.638 1.00 0.00 C ATOM 2817 C ASP B 68 17.412 31.842 -9.705 1.00 0.00 C ATOM 2818 O ASP B 68 16.697 32.535 -9.011 1.00 0.00 O ATOM 2819 CB ASP B 68 19.443 32.741 -10.859 1.00 0.00 C ATOM 2820 CG ASP B 68 18.933 34.182 -10.790 1.00 0.00 C ATOM 2821 OD1 ASP B 68 18.320 34.528 -9.793 1.00 0.00 O ATOM 2822 OD2 ASP B 68 19.165 34.918 -11.738 1.00 0.00 O ATOM 0 H ASP B 68 20.196 30.397 -10.373 1.00 0.00 H new ATOM 0 HA ASP B 68 19.205 32.507 -8.729 1.00 0.00 H new ATOM 0 HB2 ASP B 68 20.533 32.729 -10.886 1.00 0.00 H new ATOM 0 HB3 ASP B 68 19.096 32.264 -11.775 1.00 0.00 H new ATOM 2827 N GLY B 69 16.902 30.969 -10.528 1.00 0.00 N ATOM 2828 CA GLY B 69 15.422 30.809 -10.598 1.00 0.00 C ATOM 2829 C GLY B 69 14.929 30.181 -9.296 1.00 0.00 C ATOM 2830 O GLY B 69 13.851 30.475 -8.818 1.00 0.00 O ATOM 0 H GLY B 69 17.439 30.365 -11.150 1.00 0.00 H new ATOM 0 HA2 GLY B 69 14.945 31.777 -10.754 1.00 0.00 H new ATOM 0 HA3 GLY B 69 15.151 30.180 -11.446 1.00 0.00 H new ATOM 2834 N TYR B 70 15.717 29.314 -8.722 1.00 0.00 N ATOM 2835 CA TYR B 70 15.312 28.652 -7.451 1.00 0.00 C ATOM 2836 C TYR B 70 15.232 29.679 -6.311 1.00 0.00 C ATOM 2837 O TYR B 70 14.274 29.699 -5.565 1.00 0.00 O ATOM 2838 CB TYR B 70 16.327 27.561 -7.105 1.00 0.00 C ATOM 2839 CG TYR B 70 15.971 26.926 -5.781 1.00 0.00 C ATOM 2840 CD1 TYR B 70 15.085 25.845 -5.743 1.00 0.00 C ATOM 2841 CD2 TYR B 70 16.526 27.419 -4.593 1.00 0.00 C ATOM 2842 CE1 TYR B 70 14.745 25.259 -4.519 1.00 0.00 C ATOM 2843 CE2 TYR B 70 16.186 26.831 -3.367 1.00 0.00 C ATOM 2844 CZ TYR B 70 15.297 25.750 -3.331 1.00 0.00 C ATOM 2845 OH TYR B 70 14.963 25.172 -2.125 1.00 0.00 O ATOM 0 H TYR B 70 16.630 29.034 -9.082 1.00 0.00 H new ATOM 0 HA TYR B 70 14.326 28.206 -7.579 1.00 0.00 H new ATOM 0 HB2 TYR B 70 16.341 26.804 -7.889 1.00 0.00 H new ATOM 0 HB3 TYR B 70 17.329 27.987 -7.056 1.00 0.00 H new ATOM 0 HD1 TYR B 70 14.662 25.462 -6.660 1.00 0.00 H new ATOM 0 HD2 TYR B 70 17.215 28.251 -4.622 1.00 0.00 H new ATOM 0 HE1 TYR B 70 14.056 24.428 -4.491 1.00 0.00 H new ATOM 0 HE2 TYR B 70 16.610 27.212 -2.450 1.00 0.00 H new ATOM 0 HH TYR B 70 15.435 25.632 -1.400 1.00 0.00 H new ATOM 2855 N VAL B 71 16.208 30.541 -6.160 1.00 0.00 N ATOM 2856 CA VAL B 71 16.119 31.534 -5.046 1.00 0.00 C ATOM 2857 C VAL B 71 15.024 32.549 -5.381 1.00 0.00 C ATOM 2858 O VAL B 71 14.384 33.098 -4.508 1.00 0.00 O ATOM 2859 CB VAL B 71 17.457 32.257 -4.839 1.00 0.00 C ATOM 2860 CG1 VAL B 71 18.576 31.247 -4.574 1.00 0.00 C ATOM 2861 CG2 VAL B 71 17.793 33.056 -6.103 1.00 0.00 C ATOM 0 H VAL B 71 17.042 30.600 -6.744 1.00 0.00 H new ATOM 0 HA VAL B 71 15.878 31.010 -4.121 1.00 0.00 H new ATOM 0 HB VAL B 71 17.371 32.923 -3.980 1.00 0.00 H new ATOM 0 HG11 VAL B 71 19.518 31.777 -4.430 1.00 0.00 H new ATOM 0 HG12 VAL B 71 18.342 30.672 -3.678 1.00 0.00 H new ATOM 0 HG13 VAL B 71 18.666 30.572 -5.425 1.00 0.00 H new ATOM 0 HG21 VAL B 71 18.742 33.573 -5.965 1.00 0.00 H new ATOM 0 HG22 VAL B 71 17.870 32.378 -6.953 1.00 0.00 H new ATOM 0 HG23 VAL B 71 17.006 33.786 -6.292 1.00 0.00 H new ATOM 2871 N ALA B 72 14.794 32.784 -6.643 1.00 0.00 N ATOM 2872 CA ALA B 72 13.747 33.765 -7.038 1.00 0.00 C ATOM 2873 C ALA B 72 12.373 33.246 -6.602 1.00 0.00 C ATOM 2874 O ALA B 72 11.675 33.876 -5.834 1.00 0.00 O ATOM 2875 CB ALA B 72 13.757 33.927 -8.560 1.00 0.00 C ATOM 0 H ALA B 72 15.286 32.339 -7.417 1.00 0.00 H new ATOM 0 HA ALA B 72 13.948 34.724 -6.560 1.00 0.00 H new ATOM 0 HB1 ALA B 72 12.991 34.645 -8.855 1.00 0.00 H new ATOM 0 HB2 ALA B 72 14.735 34.287 -8.881 1.00 0.00 H new ATOM 0 HB3 ALA B 72 13.552 32.965 -9.030 1.00 0.00 H new ATOM 2881 N PHE B 73 11.971 32.108 -7.106 1.00 0.00 N ATOM 2882 CA PHE B 73 10.624 31.566 -6.762 1.00 0.00 C ATOM 2883 C PHE B 73 10.499 31.310 -5.249 1.00 0.00 C ATOM 2884 O PHE B 73 9.595 31.807 -4.606 1.00 0.00 O ATOM 2885 CB PHE B 73 10.408 30.254 -7.522 1.00 0.00 C ATOM 2886 CG PHE B 73 10.085 29.148 -6.542 1.00 0.00 C ATOM 2887 CD1 PHE B 73 8.762 28.937 -6.132 1.00 0.00 C ATOM 2888 CD2 PHE B 73 11.109 28.333 -6.043 1.00 0.00 C ATOM 2889 CE1 PHE B 73 8.465 27.912 -5.225 1.00 0.00 C ATOM 2890 CE2 PHE B 73 10.811 27.309 -5.135 1.00 0.00 C ATOM 2891 CZ PHE B 73 9.489 27.099 -4.726 1.00 0.00 C ATOM 0 H PHE B 73 12.520 31.530 -7.743 1.00 0.00 H new ATOM 0 HA PHE B 73 9.868 32.298 -7.046 1.00 0.00 H new ATOM 0 HB2 PHE B 73 9.595 30.367 -8.239 1.00 0.00 H new ATOM 0 HB3 PHE B 73 11.302 30.000 -8.091 1.00 0.00 H new ATOM 0 HD1 PHE B 73 7.971 29.565 -6.515 1.00 0.00 H new ATOM 0 HD2 PHE B 73 12.129 28.494 -6.359 1.00 0.00 H new ATOM 0 HE1 PHE B 73 7.445 27.749 -4.910 1.00 0.00 H new ATOM 0 HE2 PHE B 73 11.601 26.681 -4.750 1.00 0.00 H new ATOM 0 HZ PHE B 73 9.259 26.310 -4.026 1.00 0.00 H new ATOM 2901 N THR B 74 11.375 30.530 -4.675 1.00 0.00 N ATOM 2902 CA THR B 74 11.264 30.241 -3.212 1.00 0.00 C ATOM 2903 C THR B 74 11.281 31.545 -2.409 1.00 0.00 C ATOM 2904 O THR B 74 10.642 31.657 -1.379 1.00 0.00 O ATOM 2905 CB THR B 74 12.444 29.369 -2.765 1.00 0.00 C ATOM 2906 OG1 THR B 74 12.259 28.982 -1.410 1.00 0.00 O ATOM 2907 CG2 THR B 74 13.750 30.149 -2.901 1.00 0.00 C ATOM 0 H THR B 74 12.159 30.082 -5.150 1.00 0.00 H new ATOM 0 HA THR B 74 10.325 29.718 -3.033 1.00 0.00 H new ATOM 0 HB THR B 74 12.493 28.481 -3.395 1.00 0.00 H new ATOM 0 HG1 THR B 74 13.012 28.423 -1.124 1.00 0.00 H new ATOM 0 HG21 THR B 74 14.583 29.523 -2.582 1.00 0.00 H new ATOM 0 HG22 THR B 74 13.893 30.440 -3.942 1.00 0.00 H new ATOM 0 HG23 THR B 74 13.707 31.042 -2.277 1.00 0.00 H new ATOM 2915 N SER B 75 12.023 32.524 -2.852 1.00 0.00 N ATOM 2916 CA SER B 75 12.102 33.807 -2.091 1.00 0.00 C ATOM 2917 C SER B 75 10.771 34.568 -2.158 1.00 0.00 C ATOM 2918 O SER B 75 10.453 35.344 -1.281 1.00 0.00 O ATOM 2919 CB SER B 75 13.211 34.672 -2.687 1.00 0.00 C ATOM 2920 OG SER B 75 12.946 34.891 -4.067 1.00 0.00 O ATOM 0 H SER B 75 12.578 32.492 -3.707 1.00 0.00 H new ATOM 0 HA SER B 75 12.317 33.582 -1.046 1.00 0.00 H new ATOM 0 HB2 SER B 75 13.268 35.625 -2.160 1.00 0.00 H new ATOM 0 HB3 SER B 75 14.177 34.181 -2.564 1.00 0.00 H new ATOM 0 HG SER B 75 12.871 34.029 -4.527 1.00 0.00 H new ATOM 2926 N HIS B 76 9.990 34.361 -3.187 1.00 0.00 N ATOM 2927 CA HIS B 76 8.691 35.094 -3.288 1.00 0.00 C ATOM 2928 C HIS B 76 7.759 34.653 -2.149 1.00 0.00 C ATOM 2929 O HIS B 76 7.842 33.541 -1.672 1.00 0.00 O ATOM 2930 CB HIS B 76 8.030 34.773 -4.632 1.00 0.00 C ATOM 2931 CG HIS B 76 8.709 35.542 -5.731 1.00 0.00 C ATOM 2932 ND1 HIS B 76 9.640 34.956 -6.578 1.00 0.00 N ATOM 2933 CD2 HIS B 76 8.603 36.851 -6.137 1.00 0.00 C ATOM 2934 CE1 HIS B 76 10.055 35.901 -7.442 1.00 0.00 C ATOM 2935 NE2 HIS B 76 9.452 37.069 -7.217 1.00 0.00 N ATOM 0 H HIS B 76 10.192 33.722 -3.956 1.00 0.00 H new ATOM 0 HA HIS B 76 8.875 36.166 -3.214 1.00 0.00 H new ATOM 0 HB2 HIS B 76 8.093 33.703 -4.832 1.00 0.00 H new ATOM 0 HB3 HIS B 76 6.971 35.029 -4.597 1.00 0.00 H new ATOM 0 HD1 HIS B 76 9.953 33.986 -6.551 1.00 0.00 H new ATOM 0 HD2 HIS B 76 7.961 37.594 -5.688 1.00 0.00 H new ATOM 0 HE1 HIS B 76 10.785 35.734 -8.220 1.00 0.00 H new ATOM 2944 N PRO B 77 6.872 35.514 -1.721 1.00 0.00 N ATOM 2945 CA PRO B 77 5.896 35.195 -0.632 1.00 0.00 C ATOM 2946 C PRO B 77 4.787 34.236 -1.098 1.00 0.00 C ATOM 2947 O PRO B 77 4.042 33.705 -0.301 1.00 0.00 O ATOM 2948 CB PRO B 77 5.316 36.570 -0.288 1.00 0.00 C ATOM 2949 CG PRO B 77 5.407 37.345 -1.560 1.00 0.00 C ATOM 2950 CD PRO B 77 6.702 36.894 -2.248 1.00 0.00 C ATOM 0 HA PRO B 77 6.364 34.685 0.210 1.00 0.00 H new ATOM 0 HB2 PRO B 77 4.284 36.491 0.055 1.00 0.00 H new ATOM 0 HB3 PRO B 77 5.881 37.050 0.510 1.00 0.00 H new ATOM 0 HG2 PRO B 77 4.542 37.153 -2.195 1.00 0.00 H new ATOM 0 HG3 PRO B 77 5.425 38.417 -1.362 1.00 0.00 H new ATOM 0 HD2 PRO B 77 6.612 36.907 -3.334 1.00 0.00 H new ATOM 0 HD3 PRO B 77 7.545 37.535 -1.990 1.00 0.00 H new ATOM 2958 N LEU B 78 4.676 34.021 -2.384 1.00 0.00 N ATOM 2959 CA LEU B 78 3.626 33.095 -2.920 1.00 0.00 C ATOM 2960 C LEU B 78 3.975 31.630 -2.626 1.00 0.00 C ATOM 2961 O LEU B 78 3.103 30.787 -2.521 1.00 0.00 O ATOM 2962 CB LEU B 78 3.541 33.283 -4.436 1.00 0.00 C ATOM 2963 CG LEU B 78 2.180 32.811 -4.954 1.00 0.00 C ATOM 2964 CD1 LEU B 78 1.725 33.738 -6.079 1.00 0.00 C ATOM 2965 CD2 LEU B 78 2.305 31.382 -5.495 1.00 0.00 C ATOM 0 H LEU B 78 5.271 34.449 -3.093 1.00 0.00 H new ATOM 0 HA LEU B 78 2.676 33.328 -2.439 1.00 0.00 H new ATOM 0 HB2 LEU B 78 3.690 34.333 -4.688 1.00 0.00 H new ATOM 0 HB3 LEU B 78 4.338 32.722 -4.924 1.00 0.00 H new ATOM 0 HG LEU B 78 1.453 32.829 -4.142 1.00 0.00 H new ATOM 0 HD11 LEU B 78 0.756 33.408 -6.453 1.00 0.00 H new ATOM 0 HD12 LEU B 78 1.640 34.756 -5.699 1.00 0.00 H new ATOM 0 HD13 LEU B 78 2.454 33.713 -6.889 1.00 0.00 H new ATOM 0 HD21 LEU B 78 1.336 31.046 -5.864 1.00 0.00 H new ATOM 0 HD22 LEU B 78 3.029 31.363 -6.309 1.00 0.00 H new ATOM 0 HD23 LEU B 78 2.639 30.719 -4.697 1.00 0.00 H new ATOM 2977 N HIS B 79 5.235 31.308 -2.524 1.00 0.00 N ATOM 2978 CA HIS B 79 5.624 29.890 -2.260 1.00 0.00 C ATOM 2979 C HIS B 79 5.549 29.591 -0.764 1.00 0.00 C ATOM 2980 O HIS B 79 5.247 28.486 -0.353 1.00 0.00 O ATOM 2981 CB HIS B 79 7.055 29.658 -2.743 1.00 0.00 C ATOM 2982 CG HIS B 79 7.490 28.266 -2.371 1.00 0.00 C ATOM 2983 ND1 HIS B 79 6.737 27.144 -2.693 1.00 0.00 N ATOM 2984 CD2 HIS B 79 8.598 27.797 -1.709 1.00 0.00 C ATOM 2985 CE1 HIS B 79 7.396 26.068 -2.228 1.00 0.00 C ATOM 2986 NE2 HIS B 79 8.533 26.412 -1.621 1.00 0.00 N ATOM 0 H HIS B 79 6.012 31.963 -2.612 1.00 0.00 H new ATOM 0 HA HIS B 79 4.938 29.232 -2.793 1.00 0.00 H new ATOM 0 HB2 HIS B 79 7.112 29.792 -3.823 1.00 0.00 H new ATOM 0 HB3 HIS B 79 7.725 30.392 -2.295 1.00 0.00 H new ATOM 0 HD2 HIS B 79 9.396 28.410 -1.317 1.00 0.00 H new ATOM 0 HE1 HIS B 79 7.048 25.051 -2.333 1.00 0.00 H new ATOM 0 HE2 HIS B 79 9.212 25.789 -1.184 1.00 0.00 H new ATOM 2995 N VAL B 80 5.830 30.561 0.055 1.00 0.00 N ATOM 2996 CA VAL B 80 5.786 30.336 1.524 1.00 0.00 C ATOM 2997 C VAL B 80 4.363 29.978 1.956 1.00 0.00 C ATOM 2998 O VAL B 80 4.116 28.918 2.495 1.00 0.00 O ATOM 2999 CB VAL B 80 6.229 31.613 2.232 1.00 0.00 C ATOM 3000 CG1 VAL B 80 5.990 31.474 3.734 1.00 0.00 C ATOM 3001 CG2 VAL B 80 7.718 31.842 1.964 1.00 0.00 C ATOM 0 H VAL B 80 6.090 31.505 -0.231 1.00 0.00 H new ATOM 0 HA VAL B 80 6.451 29.514 1.787 1.00 0.00 H new ATOM 0 HB VAL B 80 5.656 32.461 1.857 1.00 0.00 H new ATOM 0 HG11 VAL B 80 6.307 32.387 4.239 1.00 0.00 H new ATOM 0 HG12 VAL B 80 4.929 31.306 3.920 1.00 0.00 H new ATOM 0 HG13 VAL B 80 6.563 30.630 4.117 1.00 0.00 H new ATOM 0 HG21 VAL B 80 8.042 32.753 2.467 1.00 0.00 H new ATOM 0 HG22 VAL B 80 8.290 30.995 2.343 1.00 0.00 H new ATOM 0 HG23 VAL B 80 7.884 31.941 0.891 1.00 0.00 H new ATOM 3011 N GLU B 81 3.428 30.856 1.728 1.00 0.00 N ATOM 3012 CA GLU B 81 2.019 30.556 2.104 1.00 0.00 C ATOM 3013 C GLU B 81 1.599 29.219 1.494 1.00 0.00 C ATOM 3014 O GLU B 81 0.879 28.447 2.096 1.00 0.00 O ATOM 3015 CB GLU B 81 1.105 31.664 1.578 1.00 0.00 C ATOM 3016 CG GLU B 81 -0.314 31.446 2.104 1.00 0.00 C ATOM 3017 CD GLU B 81 -1.249 32.494 1.497 1.00 0.00 C ATOM 3018 OE1 GLU B 81 -0.782 33.283 0.694 1.00 0.00 O ATOM 3019 OE2 GLU B 81 -2.417 32.487 1.849 1.00 0.00 O ATOM 0 H GLU B 81 3.578 31.768 1.298 1.00 0.00 H new ATOM 0 HA GLU B 81 1.938 30.500 3.190 1.00 0.00 H new ATOM 0 HB2 GLU B 81 1.477 32.638 1.896 1.00 0.00 H new ATOM 0 HB3 GLU B 81 1.105 31.663 0.488 1.00 0.00 H new ATOM 0 HG2 GLU B 81 -0.658 30.444 1.848 1.00 0.00 H new ATOM 0 HG3 GLU B 81 -0.326 31.519 3.191 1.00 0.00 H new ATOM 3026 N PHE B 82 2.041 28.938 0.299 1.00 0.00 N ATOM 3027 CA PHE B 82 1.677 27.645 -0.344 1.00 0.00 C ATOM 3028 C PHE B 82 2.388 26.492 0.367 1.00 0.00 C ATOM 3029 O PHE B 82 1.822 25.437 0.577 1.00 0.00 O ATOM 3030 CB PHE B 82 2.097 27.671 -1.815 1.00 0.00 C ATOM 3031 CG PHE B 82 1.745 26.353 -2.462 1.00 0.00 C ATOM 3032 CD1 PHE B 82 0.452 26.141 -2.960 1.00 0.00 C ATOM 3033 CD2 PHE B 82 2.709 25.345 -2.567 1.00 0.00 C ATOM 3034 CE1 PHE B 82 0.125 24.920 -3.561 1.00 0.00 C ATOM 3035 CE2 PHE B 82 2.382 24.123 -3.169 1.00 0.00 C ATOM 3036 CZ PHE B 82 1.091 23.911 -3.666 1.00 0.00 C ATOM 0 H PHE B 82 2.638 29.548 -0.259 1.00 0.00 H new ATOM 0 HA PHE B 82 0.599 27.501 -0.273 1.00 0.00 H new ATOM 0 HB2 PHE B 82 1.595 28.488 -2.333 1.00 0.00 H new ATOM 0 HB3 PHE B 82 3.169 27.853 -1.895 1.00 0.00 H new ATOM 0 HD1 PHE B 82 -0.292 26.920 -2.880 1.00 0.00 H new ATOM 0 HD2 PHE B 82 3.705 25.509 -2.184 1.00 0.00 H new ATOM 0 HE1 PHE B 82 -0.872 24.756 -3.944 1.00 0.00 H new ATOM 0 HE2 PHE B 82 3.126 23.345 -3.250 1.00 0.00 H new ATOM 0 HZ PHE B 82 0.839 22.969 -4.131 1.00 0.00 H new ATOM 3046 N SER B 83 3.628 26.678 0.738 1.00 0.00 N ATOM 3047 CA SER B 83 4.378 25.580 1.415 1.00 0.00 C ATOM 3048 C SER B 83 3.706 25.227 2.745 1.00 0.00 C ATOM 3049 O SER B 83 3.584 24.071 3.095 1.00 0.00 O ATOM 3050 CB SER B 83 5.816 26.024 1.673 1.00 0.00 C ATOM 3051 OG SER B 83 6.564 24.926 2.171 1.00 0.00 O ATOM 0 H SER B 83 4.153 27.542 0.601 1.00 0.00 H new ATOM 0 HA SER B 83 4.378 24.701 0.770 1.00 0.00 H new ATOM 0 HB2 SER B 83 6.264 26.396 0.752 1.00 0.00 H new ATOM 0 HB3 SER B 83 5.832 26.845 2.390 1.00 0.00 H new ATOM 0 HG SER B 83 7.488 25.208 2.336 1.00 0.00 H new ATOM 3057 N ALA B 84 3.265 26.205 3.490 1.00 0.00 N ATOM 3058 CA ALA B 84 2.607 25.897 4.792 1.00 0.00 C ATOM 3059 C ALA B 84 1.405 24.996 4.530 1.00 0.00 C ATOM 3060 O ALA B 84 1.243 23.957 5.140 1.00 0.00 O ATOM 3061 CB ALA B 84 2.135 27.187 5.457 1.00 0.00 C ATOM 0 H ALA B 84 3.331 27.196 3.256 1.00 0.00 H new ATOM 0 HA ALA B 84 3.317 25.398 5.451 1.00 0.00 H new ATOM 0 HB1 ALA B 84 1.656 26.952 6.407 1.00 0.00 H new ATOM 0 HB2 ALA B 84 2.990 27.839 5.633 1.00 0.00 H new ATOM 0 HB3 ALA B 84 1.422 27.692 4.806 1.00 0.00 H new ATOM 3067 N ALA B 85 0.568 25.382 3.609 1.00 0.00 N ATOM 3068 CA ALA B 85 -0.610 24.544 3.279 1.00 0.00 C ATOM 3069 C ALA B 85 -0.126 23.262 2.604 1.00 0.00 C ATOM 3070 O ALA B 85 -0.603 22.182 2.887 1.00 0.00 O ATOM 3071 CB ALA B 85 -1.533 25.303 2.328 1.00 0.00 C ATOM 0 H ALA B 85 0.652 26.244 3.071 1.00 0.00 H new ATOM 0 HA ALA B 85 -1.158 24.303 4.190 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -2.397 24.684 2.088 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -1.868 26.224 2.804 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -0.993 25.543 1.412 1.00 0.00 H new ATOM 3077 N PHE B 86 0.838 23.367 1.727 1.00 0.00 N ATOM 3078 CA PHE B 86 1.349 22.142 1.057 1.00 0.00 C ATOM 3079 C PHE B 86 1.525 21.059 2.114 1.00 0.00 C ATOM 3080 O PHE B 86 1.353 19.886 1.851 1.00 0.00 O ATOM 3081 CB PHE B 86 2.695 22.429 0.388 1.00 0.00 C ATOM 3082 CG PHE B 86 2.997 21.348 -0.625 1.00 0.00 C ATOM 3083 CD1 PHE B 86 2.182 21.195 -1.751 1.00 0.00 C ATOM 3084 CD2 PHE B 86 4.096 20.498 -0.434 1.00 0.00 C ATOM 3085 CE1 PHE B 86 2.461 20.194 -2.688 1.00 0.00 C ATOM 3086 CE2 PHE B 86 4.376 19.499 -1.375 1.00 0.00 C ATOM 3087 CZ PHE B 86 3.559 19.347 -2.500 1.00 0.00 C ATOM 0 H PHE B 86 1.288 24.240 1.450 1.00 0.00 H new ATOM 0 HA PHE B 86 0.644 21.817 0.292 1.00 0.00 H new ATOM 0 HB2 PHE B 86 2.670 23.403 -0.101 1.00 0.00 H new ATOM 0 HB3 PHE B 86 3.485 22.469 1.138 1.00 0.00 H new ATOM 0 HD1 PHE B 86 1.336 21.850 -1.898 1.00 0.00 H new ATOM 0 HD2 PHE B 86 4.725 20.613 0.436 1.00 0.00 H new ATOM 0 HE1 PHE B 86 1.829 20.075 -3.556 1.00 0.00 H new ATOM 0 HE2 PHE B 86 5.224 18.845 -1.232 1.00 0.00 H new ATOM 0 HZ PHE B 86 3.776 18.575 -3.224 1.00 0.00 H new ATOM 3097 N THR B 87 1.841 21.443 3.323 1.00 0.00 N ATOM 3098 CA THR B 87 2.006 20.425 4.390 1.00 0.00 C ATOM 3099 C THR B 87 0.621 20.086 4.929 1.00 0.00 C ATOM 3100 O THR B 87 0.158 18.968 4.836 1.00 0.00 O ATOM 3101 CB THR B 87 2.858 20.992 5.525 1.00 0.00 C ATOM 3102 OG1 THR B 87 3.977 21.675 4.977 1.00 0.00 O ATOM 3103 CG2 THR B 87 3.350 19.857 6.425 1.00 0.00 C ATOM 0 H THR B 87 1.990 22.410 3.612 1.00 0.00 H new ATOM 0 HA THR B 87 2.497 19.538 3.989 1.00 0.00 H new ATOM 0 HB THR B 87 2.255 21.683 6.115 1.00 0.00 H new ATOM 0 HG1 THR B 87 4.524 22.041 5.703 1.00 0.00 H new ATOM 0 HG21 THR B 87 3.957 20.269 7.232 1.00 0.00 H new ATOM 0 HG22 THR B 87 2.494 19.330 6.847 1.00 0.00 H new ATOM 0 HG23 THR B 87 3.950 19.162 5.838 1.00 0.00 H new ATOM 3111 N ALA B 88 -0.046 21.059 5.482 1.00 0.00 N ATOM 3112 CA ALA B 88 -1.416 20.827 6.014 1.00 0.00 C ATOM 3113 C ALA B 88 -2.173 19.855 5.109 1.00 0.00 C ATOM 3114 O ALA B 88 -3.048 19.138 5.548 1.00 0.00 O ATOM 3115 CB ALA B 88 -2.175 22.152 6.042 1.00 0.00 C ATOM 0 H ALA B 88 0.302 22.012 5.589 1.00 0.00 H new ATOM 0 HA ALA B 88 -1.339 20.409 7.018 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -3.180 21.988 6.431 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -1.649 22.859 6.683 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -2.239 22.556 5.032 1.00 0.00 H new ATOM 3121 N VAL B 89 -1.858 19.838 3.843 1.00 0.00 N ATOM 3122 CA VAL B 89 -2.573 18.925 2.911 1.00 0.00 C ATOM 3123 C VAL B 89 -1.730 17.672 2.618 1.00 0.00 C ATOM 3124 O VAL B 89 -1.994 16.956 1.670 1.00 0.00 O ATOM 3125 CB VAL B 89 -2.856 19.674 1.606 1.00 0.00 C ATOM 3126 CG1 VAL B 89 -3.511 21.017 1.932 1.00 0.00 C ATOM 3127 CG2 VAL B 89 -1.541 19.926 0.859 1.00 0.00 C ATOM 0 H VAL B 89 -1.136 20.418 3.415 1.00 0.00 H new ATOM 0 HA VAL B 89 -3.508 18.606 3.372 1.00 0.00 H new ATOM 0 HB VAL B 89 -3.520 19.076 0.981 1.00 0.00 H new ATOM 0 HG11 VAL B 89 -3.715 21.556 1.007 1.00 0.00 H new ATOM 0 HG12 VAL B 89 -4.445 20.846 2.466 1.00 0.00 H new ATOM 0 HG13 VAL B 89 -2.840 21.608 2.555 1.00 0.00 H new ATOM 0 HG21 VAL B 89 -1.746 20.459 -0.069 1.00 0.00 H new ATOM 0 HG22 VAL B 89 -0.877 20.525 1.483 1.00 0.00 H new ATOM 0 HG23 VAL B 89 -1.063 18.973 0.632 1.00 0.00 H new ATOM 3137 N ILE B 90 -0.729 17.388 3.410 1.00 0.00 N ATOM 3138 CA ILE B 90 0.081 16.164 3.151 1.00 0.00 C ATOM 3139 C ILE B 90 0.158 15.298 4.408 1.00 0.00 C ATOM 3140 O ILE B 90 -0.029 15.762 5.516 1.00 0.00 O ATOM 3141 CB ILE B 90 1.496 16.560 2.721 1.00 0.00 C ATOM 3142 CG1 ILE B 90 1.469 17.041 1.268 1.00 0.00 C ATOM 3143 CG2 ILE B 90 2.416 15.340 2.839 1.00 0.00 C ATOM 3144 CD1 ILE B 90 2.844 17.586 0.882 1.00 0.00 C ATOM 0 H ILE B 90 -0.441 17.944 4.215 1.00 0.00 H new ATOM 0 HA ILE B 90 -0.398 15.593 2.356 1.00 0.00 H new ATOM 0 HB ILE B 90 1.866 17.361 3.361 1.00 0.00 H new ATOM 0 HG12 ILE B 90 1.194 16.219 0.607 1.00 0.00 H new ATOM 0 HG13 ILE B 90 0.712 17.816 1.145 1.00 0.00 H new ATOM 0 HG21 ILE B 90 3.426 15.615 2.534 1.00 0.00 H new ATOM 0 HG22 ILE B 90 2.431 14.994 3.872 1.00 0.00 H new ATOM 0 HG23 ILE B 90 2.047 14.542 2.194 1.00 0.00 H new ATOM 0 HD11 ILE B 90 2.823 17.928 -0.153 1.00 0.00 H new ATOM 0 HD12 ILE B 90 3.101 18.420 1.535 1.00 0.00 H new ATOM 0 HD13 ILE B 90 3.590 16.799 0.989 1.00 0.00 H new ATOM 3156 N ASP B 91 0.459 14.040 4.223 1.00 0.00 N ATOM 3157 CA ASP B 91 0.566 13.090 5.368 1.00 0.00 C ATOM 3158 C ASP B 91 2.051 12.859 5.671 1.00 0.00 C ATOM 3159 O ASP B 91 2.449 12.650 6.800 1.00 0.00 O ATOM 3160 CB ASP B 91 -0.058 11.762 4.946 1.00 0.00 C ATOM 3161 CG ASP B 91 0.110 10.717 6.047 1.00 0.00 C ATOM 3162 OD1 ASP B 91 0.627 11.056 7.096 1.00 0.00 O ATOM 3163 OD2 ASP B 91 -0.289 9.582 5.818 1.00 0.00 O ATOM 0 H ASP B 91 0.638 13.624 3.309 1.00 0.00 H new ATOM 0 HA ASP B 91 0.059 13.488 6.247 1.00 0.00 H new ATOM 0 HB2 ASP B 91 -1.117 11.904 4.730 1.00 0.00 H new ATOM 0 HB3 ASP B 91 0.411 11.409 4.027 1.00 0.00 H new ATOM 3168 N LYS B 92 2.862 12.916 4.649 1.00 0.00 N ATOM 3169 CA LYS B 92 4.329 12.715 4.811 1.00 0.00 C ATOM 3170 C LYS B 92 5.059 13.491 3.701 1.00 0.00 C ATOM 3171 O LYS B 92 4.532 13.673 2.623 1.00 0.00 O ATOM 3172 CB LYS B 92 4.635 11.222 4.665 1.00 0.00 C ATOM 3173 CG LYS B 92 4.592 10.833 3.181 1.00 0.00 C ATOM 3174 CD LYS B 92 4.742 9.310 3.031 1.00 0.00 C ATOM 3175 CE LYS B 92 5.225 8.976 1.613 1.00 0.00 C ATOM 3176 NZ LYS B 92 4.971 7.535 1.319 1.00 0.00 N ATOM 0 H LYS B 92 2.562 13.097 3.691 1.00 0.00 H new ATOM 0 HA LYS B 92 4.657 13.070 5.788 1.00 0.00 H new ATOM 0 HB2 LYS B 92 5.617 10.999 5.082 1.00 0.00 H new ATOM 0 HB3 LYS B 92 3.909 10.635 5.227 1.00 0.00 H new ATOM 0 HG2 LYS B 92 3.651 11.159 2.738 1.00 0.00 H new ATOM 0 HG3 LYS B 92 5.391 11.340 2.640 1.00 0.00 H new ATOM 0 HD2 LYS B 92 5.451 8.930 3.766 1.00 0.00 H new ATOM 0 HD3 LYS B 92 3.788 8.820 3.226 1.00 0.00 H new ATOM 0 HE2 LYS B 92 4.708 9.602 0.886 1.00 0.00 H new ATOM 0 HE3 LYS B 92 6.289 9.193 1.521 1.00 0.00 H new ATOM 0 HZ1 LYS B 92 5.851 6.995 1.445 1.00 0.00 H new ATOM 0 HZ2 LYS B 92 4.245 7.171 1.968 1.00 0.00 H new ATOM 0 HZ3 LYS B 92 4.640 7.434 0.338 1.00 0.00 H new ATOM 3190 N ILE B 93 6.259 13.965 3.947 1.00 0.00 N ATOM 3191 CA ILE B 93 6.969 14.747 2.887 1.00 0.00 C ATOM 3192 C ILE B 93 8.346 14.126 2.619 1.00 0.00 C ATOM 3193 O ILE B 93 9.157 13.966 3.512 1.00 0.00 O ATOM 3194 CB ILE B 93 7.120 16.220 3.316 1.00 0.00 C ATOM 3195 CG1 ILE B 93 7.540 17.066 2.104 1.00 0.00 C ATOM 3196 CG2 ILE B 93 8.183 16.350 4.406 1.00 0.00 C ATOM 3197 CD1 ILE B 93 6.302 17.480 1.304 1.00 0.00 C ATOM 0 H ILE B 93 6.770 13.846 4.822 1.00 0.00 H new ATOM 0 HA ILE B 93 6.381 14.715 1.970 1.00 0.00 H new ATOM 0 HB ILE B 93 6.164 16.571 3.704 1.00 0.00 H new ATOM 0 HG12 ILE B 93 8.081 17.951 2.437 1.00 0.00 H new ATOM 0 HG13 ILE B 93 8.220 16.497 1.470 1.00 0.00 H new ATOM 0 HG21 ILE B 93 8.278 17.396 4.698 1.00 0.00 H new ATOM 0 HG22 ILE B 93 7.891 15.756 5.272 1.00 0.00 H new ATOM 0 HG23 ILE B 93 9.139 15.991 4.026 1.00 0.00 H new ATOM 0 HD11 ILE B 93 6.607 18.080 0.446 1.00 0.00 H new ATOM 0 HD12 ILE B 93 5.779 16.589 0.957 1.00 0.00 H new ATOM 0 HD13 ILE B 93 5.638 18.066 1.939 1.00 0.00 H new ATOM 3209 N VAL B 94 8.605 13.777 1.384 1.00 0.00 N ATOM 3210 CA VAL B 94 9.927 13.177 1.006 1.00 0.00 C ATOM 3211 C VAL B 94 10.517 13.988 -0.161 1.00 0.00 C ATOM 3212 O VAL B 94 9.837 14.255 -1.129 1.00 0.00 O ATOM 3213 CB VAL B 94 9.702 11.730 0.544 1.00 0.00 C ATOM 3214 CG1 VAL B 94 11.038 11.061 0.235 1.00 0.00 C ATOM 3215 CG2 VAL B 94 8.982 10.940 1.639 1.00 0.00 C ATOM 0 H VAL B 94 7.950 13.883 0.610 1.00 0.00 H new ATOM 0 HA VAL B 94 10.607 13.193 1.858 1.00 0.00 H new ATOM 0 HB VAL B 94 9.091 11.744 -0.358 1.00 0.00 H new ATOM 0 HG11 VAL B 94 10.865 10.036 -0.091 1.00 0.00 H new ATOM 0 HG12 VAL B 94 11.547 11.612 -0.556 1.00 0.00 H new ATOM 0 HG13 VAL B 94 11.658 11.056 1.131 1.00 0.00 H new ATOM 0 HG21 VAL B 94 8.826 9.914 1.305 1.00 0.00 H new ATOM 0 HG22 VAL B 94 9.588 10.938 2.545 1.00 0.00 H new ATOM 0 HG23 VAL B 94 8.018 11.404 1.849 1.00 0.00 H new ATOM 3225 N LEU B 95 11.767 14.392 -0.097 1.00 0.00 N ATOM 3226 CA LEU B 95 12.322 15.203 -1.232 1.00 0.00 C ATOM 3227 C LEU B 95 13.780 14.832 -1.538 1.00 0.00 C ATOM 3228 O LEU B 95 14.596 14.661 -0.652 1.00 0.00 O ATOM 3229 CB LEU B 95 12.268 16.692 -0.893 1.00 0.00 C ATOM 3230 CG LEU B 95 11.013 17.007 -0.081 1.00 0.00 C ATOM 3231 CD1 LEU B 95 11.217 16.561 1.368 1.00 0.00 C ATOM 3232 CD2 LEU B 95 10.759 18.516 -0.118 1.00 0.00 C ATOM 0 H LEU B 95 12.412 14.202 0.670 1.00 0.00 H new ATOM 0 HA LEU B 95 11.710 14.986 -2.107 1.00 0.00 H new ATOM 0 HB2 LEU B 95 13.156 16.975 -0.327 1.00 0.00 H new ATOM 0 HB3 LEU B 95 12.273 17.281 -1.810 1.00 0.00 H new ATOM 0 HG LEU B 95 10.159 16.479 -0.505 1.00 0.00 H new ATOM 0 HD11 LEU B 95 10.322 16.786 1.947 1.00 0.00 H new ATOM 0 HD12 LEU B 95 11.407 15.488 1.395 1.00 0.00 H new ATOM 0 HD13 LEU B 95 12.068 17.091 1.795 1.00 0.00 H new ATOM 0 HD21 LEU B 95 9.864 18.749 0.460 1.00 0.00 H new ATOM 0 HD22 LEU B 95 11.614 19.039 0.310 1.00 0.00 H new ATOM 0 HD23 LEU B 95 10.618 18.836 -1.150 1.00 0.00 H new ATOM 3244 N LEU B 96 14.110 14.743 -2.805 1.00 0.00 N ATOM 3245 CA LEU B 96 15.514 14.437 -3.212 1.00 0.00 C ATOM 3246 C LEU B 96 16.065 15.599 -4.048 1.00 0.00 C ATOM 3247 O LEU B 96 15.485 15.980 -5.045 1.00 0.00 O ATOM 3248 CB LEU B 96 15.546 13.173 -4.082 1.00 0.00 C ATOM 3249 CG LEU B 96 14.432 12.209 -3.680 1.00 0.00 C ATOM 3250 CD1 LEU B 96 13.077 12.777 -4.107 1.00 0.00 C ATOM 3251 CD2 LEU B 96 14.661 10.870 -4.387 1.00 0.00 C ATOM 0 H LEU B 96 13.459 14.871 -3.580 1.00 0.00 H new ATOM 0 HA LEU B 96 16.113 14.288 -2.314 1.00 0.00 H new ATOM 0 HB2 LEU B 96 15.436 13.446 -5.132 1.00 0.00 H new ATOM 0 HB3 LEU B 96 16.513 12.681 -3.980 1.00 0.00 H new ATOM 0 HG LEU B 96 14.439 12.071 -2.599 1.00 0.00 H new ATOM 0 HD11 LEU B 96 12.285 12.086 -3.818 1.00 0.00 H new ATOM 0 HD12 LEU B 96 12.915 13.738 -3.619 1.00 0.00 H new ATOM 0 HD13 LEU B 96 13.064 12.912 -5.188 1.00 0.00 H new ATOM 0 HD21 LEU B 96 13.872 10.172 -4.108 1.00 0.00 H new ATOM 0 HD22 LEU B 96 14.647 11.021 -5.466 1.00 0.00 H new ATOM 0 HD23 LEU B 96 15.627 10.462 -4.090 1.00 0.00 H new ATOM 3263 N ASP B 97 17.188 16.150 -3.669 1.00 0.00 N ATOM 3264 CA ASP B 97 17.776 17.270 -4.466 1.00 0.00 C ATOM 3265 C ASP B 97 19.172 16.858 -4.950 1.00 0.00 C ATOM 3266 O ASP B 97 20.025 16.489 -4.167 1.00 0.00 O ATOM 3267 CB ASP B 97 17.890 18.526 -3.598 1.00 0.00 C ATOM 3268 CG ASP B 97 18.867 18.265 -2.448 1.00 0.00 C ATOM 3269 OD1 ASP B 97 19.049 17.110 -2.101 1.00 0.00 O ATOM 3270 OD2 ASP B 97 19.417 19.225 -1.933 1.00 0.00 O ATOM 0 H ASP B 97 17.723 15.875 -2.845 1.00 0.00 H new ATOM 0 HA ASP B 97 17.133 17.485 -5.319 1.00 0.00 H new ATOM 0 HB2 ASP B 97 18.236 19.367 -4.200 1.00 0.00 H new ATOM 0 HB3 ASP B 97 16.911 18.798 -3.203 1.00 0.00 H new ATOM 3275 N PHE B 98 19.410 16.906 -6.234 1.00 0.00 N ATOM 3276 CA PHE B 98 20.751 16.503 -6.761 1.00 0.00 C ATOM 3277 C PHE B 98 21.042 17.211 -8.091 1.00 0.00 C ATOM 3278 O PHE B 98 20.277 17.104 -9.026 1.00 0.00 O ATOM 3279 CB PHE B 98 20.760 14.988 -7.003 1.00 0.00 C ATOM 3280 CG PHE B 98 22.117 14.552 -7.502 1.00 0.00 C ATOM 3281 CD1 PHE B 98 23.199 14.486 -6.615 1.00 0.00 C ATOM 3282 CD2 PHE B 98 22.293 14.212 -8.848 1.00 0.00 C ATOM 3283 CE1 PHE B 98 24.457 14.081 -7.076 1.00 0.00 C ATOM 3284 CE2 PHE B 98 23.551 13.805 -9.309 1.00 0.00 C ATOM 3285 CZ PHE B 98 24.631 13.739 -8.424 1.00 0.00 C ATOM 0 H PHE B 98 18.738 17.205 -6.940 1.00 0.00 H new ATOM 0 HA PHE B 98 21.512 16.782 -6.032 1.00 0.00 H new ATOM 0 HB2 PHE B 98 20.517 14.463 -6.079 1.00 0.00 H new ATOM 0 HB3 PHE B 98 19.993 14.723 -7.731 1.00 0.00 H new ATOM 0 HD1 PHE B 98 23.063 14.747 -5.576 1.00 0.00 H new ATOM 0 HD2 PHE B 98 21.458 14.264 -9.531 1.00 0.00 H new ATOM 0 HE1 PHE B 98 25.293 14.032 -6.394 1.00 0.00 H new ATOM 0 HE2 PHE B 98 23.687 13.542 -10.348 1.00 0.00 H new ATOM 0 HZ PHE B 98 25.601 13.424 -8.779 1.00 0.00 H new ATOM 3295 N PRO B 99 22.135 17.925 -8.182 1.00 0.00 N ATOM 3296 CA PRO B 99 22.525 18.632 -9.437 1.00 0.00 C ATOM 3297 C PRO B 99 22.385 17.738 -10.673 1.00 0.00 C ATOM 3298 O PRO B 99 22.760 16.582 -10.655 1.00 0.00 O ATOM 3299 CB PRO B 99 23.987 19.007 -9.201 1.00 0.00 C ATOM 3300 CG PRO B 99 24.109 19.176 -7.725 1.00 0.00 C ATOM 3301 CD PRO B 99 23.125 18.179 -7.099 1.00 0.00 C ATOM 0 HA PRO B 99 21.885 19.492 -9.637 1.00 0.00 H new ATOM 0 HB2 PRO B 99 24.658 18.229 -9.566 1.00 0.00 H new ATOM 0 HB3 PRO B 99 24.249 19.926 -9.726 1.00 0.00 H new ATOM 0 HG2 PRO B 99 25.128 18.978 -7.393 1.00 0.00 H new ATOM 0 HG3 PRO B 99 23.870 20.197 -7.429 1.00 0.00 H new ATOM 0 HD2 PRO B 99 23.627 17.261 -6.793 1.00 0.00 H new ATOM 0 HD3 PRO B 99 22.648 18.593 -6.211 1.00 0.00 H new ATOM 3309 N VAL B 100 21.840 18.254 -11.741 1.00 0.00 N ATOM 3310 CA VAL B 100 21.680 17.430 -12.971 1.00 0.00 C ATOM 3311 C VAL B 100 22.431 18.075 -14.137 1.00 0.00 C ATOM 3312 O VAL B 100 22.423 19.280 -14.302 1.00 0.00 O ATOM 3313 CB VAL B 100 20.191 17.323 -13.318 1.00 0.00 C ATOM 3314 CG1 VAL B 100 20.031 16.691 -14.702 1.00 0.00 C ATOM 3315 CG2 VAL B 100 19.489 16.450 -12.274 1.00 0.00 C ATOM 0 H VAL B 100 21.498 19.212 -11.814 1.00 0.00 H new ATOM 0 HA VAL B 100 22.090 16.436 -12.792 1.00 0.00 H new ATOM 0 HB VAL B 100 19.746 18.318 -13.322 1.00 0.00 H new ATOM 0 HG11 VAL B 100 18.972 16.616 -14.947 1.00 0.00 H new ATOM 0 HG12 VAL B 100 20.532 17.311 -15.445 1.00 0.00 H new ATOM 0 HG13 VAL B 100 20.475 15.695 -14.701 1.00 0.00 H new ATOM 0 HG21 VAL B 100 18.430 16.372 -12.518 1.00 0.00 H new ATOM 0 HG22 VAL B 100 19.935 15.455 -12.272 1.00 0.00 H new ATOM 0 HG23 VAL B 100 19.602 16.900 -11.288 1.00 0.00 H new ATOM 3325 N ALA B 101 23.073 17.282 -14.949 1.00 0.00 N ATOM 3326 CA ALA B 101 23.818 17.844 -16.116 1.00 0.00 C ATOM 3327 C ALA B 101 23.150 17.389 -17.420 1.00 0.00 C ATOM 3328 O ALA B 101 23.397 16.304 -17.912 1.00 0.00 O ATOM 3329 CB ALA B 101 25.260 17.338 -16.083 1.00 0.00 C ATOM 0 H ALA B 101 23.115 16.267 -14.857 1.00 0.00 H new ATOM 0 HA ALA B 101 23.808 18.933 -16.065 1.00 0.00 H new ATOM 0 HB1 ALA B 101 25.808 17.745 -16.933 1.00 0.00 H new ATOM 0 HB2 ALA B 101 25.737 17.658 -15.157 1.00 0.00 H new ATOM 0 HB3 ALA B 101 25.265 16.249 -16.136 1.00 0.00 H new ATOM 3335 N ALA B 102 22.308 18.212 -17.988 1.00 0.00 N ATOM 3336 CA ALA B 102 21.638 17.822 -19.258 1.00 0.00 C ATOM 3337 C ALA B 102 22.690 17.574 -20.338 1.00 0.00 C ATOM 3338 O ALA B 102 22.905 18.394 -21.212 1.00 0.00 O ATOM 3339 CB ALA B 102 20.700 18.944 -19.708 1.00 0.00 C ATOM 0 H ALA B 102 22.058 19.133 -17.627 1.00 0.00 H new ATOM 0 HA ALA B 102 21.063 16.910 -19.097 1.00 0.00 H new ATOM 0 HB1 ALA B 102 20.210 18.657 -20.638 1.00 0.00 H new ATOM 0 HB2 ALA B 102 19.947 19.119 -18.940 1.00 0.00 H new ATOM 0 HB3 ALA B 102 21.274 19.857 -19.867 1.00 0.00 H new ATOM 3345 N VAL B 103 23.349 16.449 -20.286 1.00 0.00 N ATOM 3346 CA VAL B 103 24.395 16.147 -21.302 1.00 0.00 C ATOM 3347 C VAL B 103 24.445 14.638 -21.540 1.00 0.00 C ATOM 3348 O VAL B 103 24.721 13.866 -20.644 1.00 0.00 O ATOM 3349 CB VAL B 103 25.753 16.633 -20.795 1.00 0.00 C ATOM 3350 CG1 VAL B 103 25.653 18.104 -20.393 1.00 0.00 C ATOM 3351 CG2 VAL B 103 26.170 15.800 -19.579 1.00 0.00 C ATOM 0 H VAL B 103 23.207 15.725 -19.582 1.00 0.00 H new ATOM 0 HA VAL B 103 24.157 16.655 -22.237 1.00 0.00 H new ATOM 0 HB VAL B 103 26.496 16.523 -21.585 1.00 0.00 H new ATOM 0 HG11 VAL B 103 26.622 18.449 -20.032 1.00 0.00 H new ATOM 0 HG12 VAL B 103 25.355 18.698 -21.257 1.00 0.00 H new ATOM 0 HG13 VAL B 103 24.910 18.216 -19.603 1.00 0.00 H new ATOM 0 HG21 VAL B 103 27.138 16.145 -19.216 1.00 0.00 H new ATOM 0 HG22 VAL B 103 25.426 15.911 -18.790 1.00 0.00 H new ATOM 0 HG23 VAL B 103 26.243 14.751 -19.864 1.00 0.00 H new ATOM 3361 N LYS B 104 24.181 14.212 -22.746 1.00 0.00 N ATOM 3362 CA LYS B 104 24.207 12.754 -23.045 1.00 0.00 C ATOM 3363 C LYS B 104 24.741 12.536 -24.462 1.00 0.00 C ATOM 3364 O LYS B 104 25.051 11.429 -24.854 1.00 0.00 O ATOM 3365 CB LYS B 104 22.790 12.187 -22.946 1.00 0.00 C ATOM 3366 CG LYS B 104 22.452 11.896 -21.484 1.00 0.00 C ATOM 3367 CD LYS B 104 23.067 10.555 -21.075 1.00 0.00 C ATOM 3368 CE LYS B 104 22.892 10.350 -19.569 1.00 0.00 C ATOM 3369 NZ LYS B 104 23.454 11.523 -18.838 1.00 0.00 N ATOM 0 H LYS B 104 23.948 14.813 -23.537 1.00 0.00 H new ATOM 0 HA LYS B 104 24.853 12.248 -22.328 1.00 0.00 H new ATOM 0 HB2 LYS B 104 22.074 12.897 -23.360 1.00 0.00 H new ATOM 0 HB3 LYS B 104 22.711 11.274 -23.536 1.00 0.00 H new ATOM 0 HG2 LYS B 104 22.834 12.693 -20.846 1.00 0.00 H new ATOM 0 HG3 LYS B 104 21.371 11.869 -21.348 1.00 0.00 H new ATOM 0 HD2 LYS B 104 22.589 9.742 -21.621 1.00 0.00 H new ATOM 0 HD3 LYS B 104 24.125 10.534 -21.335 1.00 0.00 H new ATOM 0 HE2 LYS B 104 21.836 10.230 -19.328 1.00 0.00 H new ATOM 0 HE3 LYS B 104 23.397 9.436 -19.255 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 23.998 11.192 -18.016 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 24.079 12.061 -19.472 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 22.678 12.136 -18.516 1.00 0.00 H new ATOM 3383 N SER B 105 24.847 13.581 -25.237 1.00 0.00 N ATOM 3384 CA SER B 105 25.357 13.419 -26.625 1.00 0.00 C ATOM 3385 C SER B 105 26.543 12.455 -26.610 1.00 0.00 C ATOM 3386 O SER B 105 26.856 11.819 -27.596 1.00 0.00 O ATOM 3387 CB SER B 105 25.808 14.778 -27.161 1.00 0.00 C ATOM 3388 OG SER B 105 26.859 15.275 -26.344 1.00 0.00 O ATOM 0 H SER B 105 24.603 14.535 -24.969 1.00 0.00 H new ATOM 0 HA SER B 105 24.570 13.022 -27.266 1.00 0.00 H new ATOM 0 HB2 SER B 105 26.147 14.682 -28.192 1.00 0.00 H new ATOM 0 HB3 SER B 105 24.972 15.477 -27.164 1.00 0.00 H new ATOM 0 HG SER B 105 27.154 16.146 -26.684 1.00 0.00 H new ATOM 3394 N SER B 106 27.205 12.342 -25.491 1.00 0.00 N ATOM 3395 CA SER B 106 28.356 11.405 -25.400 1.00 0.00 C ATOM 3396 C SER B 106 27.918 10.016 -25.863 1.00 0.00 C ATOM 3397 O SER B 106 28.109 9.638 -27.002 1.00 0.00 O ATOM 3398 CB SER B 106 28.842 11.336 -23.953 1.00 0.00 C ATOM 3399 OG SER B 106 29.994 10.502 -23.884 1.00 0.00 O ATOM 0 H SER B 106 26.997 12.859 -24.637 1.00 0.00 H new ATOM 0 HA SER B 106 29.167 11.759 -26.037 1.00 0.00 H new ATOM 0 HB2 SER B 106 29.080 12.335 -23.589 1.00 0.00 H new ATOM 0 HB3 SER B 106 28.054 10.942 -23.311 1.00 0.00 H new ATOM 0 HG SER B 106 30.310 10.457 -22.957 1.00 0.00 H new ATOM 3405 N VAL B 107 27.330 9.254 -24.985 1.00 0.00 N ATOM 3406 CA VAL B 107 26.842 7.902 -25.367 1.00 0.00 C ATOM 3407 C VAL B 107 27.906 7.227 -26.232 1.00 0.00 C ATOM 3408 O VAL B 107 27.881 7.306 -27.446 1.00 0.00 O ATOM 3409 CB VAL B 107 25.542 8.036 -26.164 1.00 0.00 C ATOM 3410 CG1 VAL B 107 25.199 6.696 -26.815 1.00 0.00 C ATOM 3411 CG2 VAL B 107 24.406 8.453 -25.228 1.00 0.00 C ATOM 0 H VAL B 107 27.166 9.512 -24.012 1.00 0.00 H new ATOM 0 HA VAL B 107 26.654 7.305 -24.475 1.00 0.00 H new ATOM 0 HB VAL B 107 25.671 8.793 -26.938 1.00 0.00 H new ATOM 0 HG11 VAL B 107 24.273 6.793 -27.382 1.00 0.00 H new ATOM 0 HG12 VAL B 107 26.006 6.400 -27.486 1.00 0.00 H new ATOM 0 HG13 VAL B 107 25.073 5.938 -26.042 1.00 0.00 H new ATOM 0 HG21 VAL B 107 23.482 8.548 -25.798 1.00 0.00 H new ATOM 0 HG22 VAL B 107 24.278 7.698 -24.452 1.00 0.00 H new ATOM 0 HG23 VAL B 107 24.648 9.410 -24.767 1.00 0.00 H new ATOM 3421 N VAL B 108 28.841 6.559 -25.611 1.00 0.00 N ATOM 3422 CA VAL B 108 29.901 5.850 -26.383 1.00 0.00 C ATOM 3423 C VAL B 108 30.016 4.415 -25.888 1.00 0.00 C ATOM 3424 O VAL B 108 30.322 4.166 -24.739 1.00 0.00 O ATOM 3425 CB VAL B 108 31.236 6.561 -26.172 1.00 0.00 C ATOM 3426 CG1 VAL B 108 32.352 5.762 -26.846 1.00 0.00 C ATOM 3427 CG2 VAL B 108 31.172 7.962 -26.782 1.00 0.00 C ATOM 0 H VAL B 108 28.916 6.474 -24.597 1.00 0.00 H new ATOM 0 HA VAL B 108 29.643 5.852 -27.442 1.00 0.00 H new ATOM 0 HB VAL B 108 31.439 6.640 -25.104 1.00 0.00 H new ATOM 0 HG11 VAL B 108 33.305 6.270 -26.695 1.00 0.00 H new ATOM 0 HG12 VAL B 108 32.399 4.764 -26.410 1.00 0.00 H new ATOM 0 HG13 VAL B 108 32.148 5.682 -27.914 1.00 0.00 H new ATOM 0 HG21 VAL B 108 32.125 8.469 -26.631 1.00 0.00 H new ATOM 0 HG22 VAL B 108 30.967 7.885 -27.850 1.00 0.00 H new ATOM 0 HG23 VAL B 108 30.378 8.532 -26.301 1.00 0.00 H new ATOM 3437 N ALA B 109 29.783 3.464 -26.749 1.00 0.00 N ATOM 3438 CA ALA B 109 29.888 2.045 -26.325 1.00 0.00 C ATOM 3439 C ALA B 109 31.349 1.738 -26.007 1.00 0.00 C ATOM 3440 O ALA B 109 32.247 2.415 -26.471 1.00 0.00 O ATOM 3441 CB ALA B 109 29.402 1.137 -27.458 1.00 0.00 C ATOM 0 H ALA B 109 29.525 3.610 -27.725 1.00 0.00 H new ATOM 0 HA ALA B 109 29.273 1.870 -25.442 1.00 0.00 H new ATOM 0 HB1 ALA B 109 29.479 0.095 -27.148 1.00 0.00 H new ATOM 0 HB2 ALA B 109 28.363 1.371 -27.691 1.00 0.00 H new ATOM 0 HB3 ALA B 109 30.018 1.298 -28.343 1.00 0.00 H new ATOM 3447 N THR B 110 31.609 0.737 -25.218 1.00 0.00 N ATOM 3448 CA THR B 110 33.021 0.415 -24.882 1.00 0.00 C ATOM 3449 C THR B 110 33.732 -0.138 -26.118 1.00 0.00 C ATOM 3450 O THR B 110 33.117 -0.740 -26.976 1.00 0.00 O ATOM 3451 CB THR B 110 33.046 -0.634 -23.768 1.00 0.00 C ATOM 3452 OG1 THR B 110 34.253 -1.379 -23.848 1.00 0.00 O ATOM 3453 CG2 THR B 110 31.854 -1.578 -23.918 1.00 0.00 C ATOM 0 H THR B 110 30.909 0.130 -24.792 1.00 0.00 H new ATOM 0 HA THR B 110 33.531 1.319 -24.549 1.00 0.00 H new ATOM 0 HB THR B 110 32.988 -0.134 -22.801 1.00 0.00 H new ATOM 0 HG1 THR B 110 34.271 -2.050 -23.134 1.00 0.00 H new ATOM 0 HG21 THR B 110 31.877 -2.323 -23.122 1.00 0.00 H new ATOM 0 HG22 THR B 110 30.928 -1.007 -23.854 1.00 0.00 H new ATOM 0 HG23 THR B 110 31.906 -2.079 -24.885 1.00 0.00 H new ATOM 3461 N PRO B 111 35.020 0.067 -26.209 1.00 0.00 N ATOM 3462 CA PRO B 111 35.833 -0.418 -27.356 1.00 0.00 C ATOM 3463 C PRO B 111 35.353 -1.778 -27.872 1.00 0.00 C ATOM 3464 CB PRO B 111 37.236 -0.536 -26.762 1.00 0.00 C ATOM 3465 CG PRO B 111 37.314 0.551 -25.742 1.00 0.00 C ATOM 3466 CD PRO B 111 35.885 0.779 -25.233 1.00 0.00 C ATOM 0 HA PRO B 111 35.772 0.249 -28.216 1.00 0.00 H new ATOM 0 HB2 PRO B 111 37.392 -1.515 -26.309 1.00 0.00 H new ATOM 0 HB3 PRO B 111 38.001 -0.414 -27.529 1.00 0.00 H new ATOM 0 HG2 PRO B 111 37.976 0.267 -24.924 1.00 0.00 H new ATOM 0 HG3 PRO B 111 37.720 1.464 -26.179 1.00 0.00 H new ATOM 0 HD2 PRO B 111 35.755 0.383 -24.226 1.00 0.00 H new ATOM 0 HD3 PRO B 111 35.644 1.841 -25.191 1.00 0.00 H new TER 3474 PRO B 111