USER MOD reduce.3.24.130724 H: found=0, std=0, add=919, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 919 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 37 CYS SG : rot 180:sc= -7.8! USER MOD Set 1.2: A 107 HIS : no HD1:sc= 0.981 K(o=-5.7,f=-15!) USER MOD Set 1.3: A 109 SER OG : rot 57:sc= 1.16 USER MOD Set 2.1: A 53 THR OG1 : rot -27:sc= 0.831 USER MOD Set 2.2: A 91 TYR OH : rot -17:sc= 1.1! USER MOD Set 3.1: A 22 MET CE :methyl -154:sc= 0 (180deg=0) USER MOD Set 3.2: A 25 SER OG : rot 180:sc= 0.0227 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0486) USER MOD Single : A 3 HIS : no HD1:sc= -0.83 K(o=-0.83,f=0.16) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.0033) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.347 K(o=-0.35,f=-0.9) USER MOD Single : A 8 HIS : no HD1:sc= -0.0738 X(o=-0.074,f=0) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 90:sc= 0.0523 USER MOD Single : A 15 GLN : amide:sc= -0.992 K(o=-0.99,f=-2.7) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0.138 X(o=0.14,f=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0.0235 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -110:sc= 0 USER MOD Single : A 35 THR OG1 : rot 119:sc= -0.518 USER MOD Single : A 38 TYR OH : rot 138:sc= -0.0807 USER MOD Single : A 41 THR OG1 : rot -54:sc= 0.668 USER MOD Single : A 43 LYS NZ :NH3+ -174:sc=-0.00881 (180deg=-0.0687) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 167:sc= -0.0246 (180deg=-0.267) USER MOD Single : A 61 SER OG : rot -49:sc= 0.437 USER MOD Single : A 65 TYR OH : rot 30:sc=-0.000936 USER MOD Single : A 67 THR OG1 : rot -170:sc= -2.56! USER MOD Single : A 68 ASN : amide:sc= -1.49 X(o=-1.5,f=-1.6) USER MOD Single : A 69 ASN : amide:sc= -1.2! K(o=-1.2!,f=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -0.978 K(o=-0.98,f=-4.1!) USER MOD Single : A 82 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0569) USER MOD Single : A 84 GLN : amide:sc= -1.75 K(o=-1.7,f=-3.6) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 HIS : no HD1:sc= -1.84 X(o=-1.8,f=-1.9!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= -0.0606 USER MOD Single : A 98 LYS NZ :NH3+ -123:sc= -0.0196 (180deg=-0.401) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -154:sc= -1.35 (180deg=-1.82) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= -0.0386 USER MOD Single : A 110 SER OG : rot 180:sc= 0.104 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -27.376-111.429 -7.827 1.00 52.12 N ATOM 2 CA MET A 1 -26.360-110.965 -8.795 1.00 51.22 C ATOM 3 C MET A 1 -25.459-112.124 -9.213 1.00 31.51 C ATOM 4 O MET A 1 -24.800-112.749 -8.376 1.00 43.23 O ATOM 5 CB MET A 1 -25.526-109.826 -8.197 1.00 33.04 C ATOM 6 CG MET A 1 -26.321-108.552 -7.938 1.00 72.33 C ATOM 7 SD MET A 1 -27.072-107.890 -9.439 1.00 4.50 S ATOM 8 CE MET A 1 -27.858-106.411 -8.801 1.00 20.10 C ATOM 0 H1 MET A 1 -28.044-110.657 -7.628 1.00 52.12 H new ATOM 0 H2 MET A 1 -27.892-112.239 -8.226 1.00 52.12 H new ATOM 0 H3 MET A 1 -26.908-111.718 -6.944 1.00 52.12 H new ATOM 0 HA MET A 1 -26.872-110.586 -9.679 1.00 51.22 H new ATOM 0 HB2 MET A 1 -25.085-110.165 -7.260 1.00 33.04 H new ATOM 0 HB3 MET A 1 -24.702-109.598 -8.873 1.00 33.04 H new ATOM 0 HG2 MET A 1 -27.101-108.757 -7.205 1.00 72.33 H new ATOM 0 HG3 MET A 1 -25.664-107.800 -7.502 1.00 72.33 H new ATOM 0 HE1 MET A 1 -28.366-105.890 -9.612 1.00 20.10 H new ATOM 0 HE2 MET A 1 -28.584-106.686 -8.035 1.00 20.10 H new ATOM 0 HE3 MET A 1 -27.103-105.756 -8.366 1.00 20.10 H new ATOM 20 N ALA A 2 -25.437-112.409 -10.511 1.00 23.30 N ATOM 21 CA ALA A 2 -24.683-113.538 -11.049 1.00 11.25 C ATOM 22 C ALA A 2 -23.924-113.131 -12.308 1.00 62.11 C ATOM 23 O ALA A 2 -23.680-113.960 -13.188 1.00 12.45 O ATOM 24 CB ALA A 2 -25.630-114.695 -11.350 1.00 63.04 C ATOM 0 H ALA A 2 -25.938-111.868 -11.216 1.00 23.30 H new ATOM 0 HA ALA A 2 -23.955-113.858 -10.304 1.00 11.25 H new ATOM 0 HB1 ALA A 2 -25.063-115.535 -11.751 1.00 63.04 H new ATOM 0 HB2 ALA A 2 -26.133-115.002 -10.433 1.00 63.04 H new ATOM 0 HB3 ALA A 2 -26.373-114.376 -12.082 1.00 63.04 H new ATOM 30 N HIS A 3 -23.534-111.859 -12.377 1.00 20.45 N ATOM 31 CA HIS A 3 -22.820-111.334 -13.544 1.00 41.31 C ATOM 32 C HIS A 3 -21.439-111.984 -13.657 1.00 14.54 C ATOM 33 O HIS A 3 -20.440-111.438 -13.178 1.00 61.24 O ATOM 34 CB HIS A 3 -22.670-109.803 -13.457 1.00 23.32 C ATOM 35 CG HIS A 3 -23.963-109.062 -13.300 1.00 30.41 C ATOM 36 ND1 HIS A 3 -24.284-108.330 -12.175 1.00 73.03 N ATOM 37 CD2 HIS A 3 -25.015-108.927 -14.144 1.00 73.32 C ATOM 38 CE1 HIS A 3 -25.472-107.775 -12.336 1.00 11.32 C ATOM 39 NE2 HIS A 3 -25.939-108.122 -13.522 1.00 30.43 N ATOM 0 H HIS A 3 -23.699-111.173 -11.641 1.00 20.45 H new ATOM 0 HA HIS A 3 -23.404-111.574 -14.432 1.00 41.31 H new ATOM 0 HB2 HIS A 3 -22.022-109.561 -12.615 1.00 23.32 H new ATOM 0 HB3 HIS A 3 -22.169-109.448 -14.357 1.00 23.32 H new ATOM 0 HD2 HIS A 3 -25.110-109.370 -15.124 1.00 73.32 H new ATOM 0 HE1 HIS A 3 -25.976-107.144 -11.619 1.00 11.32 H new ATOM 0 HE2 HIS A 3 -26.838-107.839 -13.912 1.00 30.43 H new ATOM 48 N HIS A 4 -21.395-113.164 -14.264 1.00 51.22 N ATOM 49 CA HIS A 4 -20.148-113.910 -14.413 1.00 51.34 C ATOM 50 C HIS A 4 -19.417-113.450 -15.669 1.00 0.14 C ATOM 51 O HIS A 4 -20.046-113.157 -16.686 1.00 74.33 O ATOM 52 CB HIS A 4 -20.424-115.424 -14.473 1.00 24.43 C ATOM 53 CG HIS A 4 -21.032-115.894 -15.764 1.00 72.12 C ATOM 54 ND1 HIS A 4 -22.370-115.762 -16.064 1.00 51.04 N ATOM 55 CD2 HIS A 4 -20.469-116.503 -16.838 1.00 71.54 C ATOM 56 CE1 HIS A 4 -22.604-116.270 -17.260 1.00 1.32 C ATOM 57 NE2 HIS A 4 -21.467-116.726 -17.750 1.00 72.33 N ATOM 0 H HIS A 4 -22.211-113.628 -14.663 1.00 51.22 H new ATOM 0 HA HIS A 4 -19.517-113.716 -13.546 1.00 51.34 H new ATOM 0 HB2 HIS A 4 -19.488-115.958 -14.311 1.00 24.43 H new ATOM 0 HB3 HIS A 4 -21.090-115.692 -13.653 1.00 24.43 H new ATOM 0 HD2 HIS A 4 -19.427-116.764 -16.953 1.00 71.54 H new ATOM 0 HE1 HIS A 4 -23.564-116.306 -17.754 1.00 1.32 H new ATOM 0 HE2 HIS A 4 -21.350-117.172 -18.660 1.00 72.33 H new ATOM 66 N HIS A 5 -18.094-113.370 -15.597 1.00 1.20 N ATOM 67 CA HIS A 5 -17.286-112.930 -16.732 1.00 3.11 C ATOM 68 C HIS A 5 -16.298-114.015 -17.129 1.00 72.12 C ATOM 69 O HIS A 5 -15.765-114.725 -16.275 1.00 25.44 O ATOM 70 CB HIS A 5 -16.537-111.634 -16.392 1.00 71.20 C ATOM 71 CG HIS A 5 -17.443-110.474 -16.107 1.00 35.25 C ATOM 72 ND1 HIS A 5 -17.288-109.647 -15.015 1.00 61.31 N ATOM 73 CD2 HIS A 5 -18.522-110.003 -16.780 1.00 64.31 C ATOM 74 CE1 HIS A 5 -18.225-108.718 -15.032 1.00 14.53 C ATOM 75 NE2 HIS A 5 -18.986-108.913 -16.090 1.00 10.22 N ATOM 0 H HIS A 5 -17.555-113.604 -14.763 1.00 1.20 H new ATOM 0 HA HIS A 5 -17.953-112.736 -17.572 1.00 3.11 H new ATOM 0 HB2 HIS A 5 -15.901-111.809 -15.524 1.00 71.20 H new ATOM 0 HB3 HIS A 5 -15.880-111.376 -17.222 1.00 71.20 H new ATOM 0 HD2 HIS A 5 -18.938-110.410 -17.690 1.00 64.31 H new ATOM 0 HE1 HIS A 5 -18.347-107.931 -14.302 1.00 14.53 H new ATOM 0 HE2 HIS A 5 -19.791-108.344 -16.353 1.00 10.22 H new ATOM 84 N HIS A 6 -16.070-114.145 -18.430 1.00 74.41 N ATOM 85 CA HIS A 6 -15.111-115.105 -18.965 1.00 62.44 C ATOM 86 C HIS A 6 -14.157-114.403 -19.924 1.00 42.35 C ATOM 87 O HIS A 6 -14.553-114.002 -21.022 1.00 32.12 O ATOM 88 CB HIS A 6 -15.831-116.259 -19.680 1.00 4.33 C ATOM 89 CG HIS A 6 -14.893-117.224 -20.343 1.00 54.12 C ATOM 90 ND1 HIS A 6 -14.172-118.163 -19.643 1.00 25.22 N ATOM 91 CD2 HIS A 6 -14.547-117.379 -21.643 1.00 51.05 C ATOM 92 CE1 HIS A 6 -13.420-118.851 -20.479 1.00 34.00 C ATOM 93 NE2 HIS A 6 -13.629-118.399 -21.699 1.00 2.42 N ATOM 0 H HIS A 6 -16.543-113.590 -19.143 1.00 74.41 H new ATOM 0 HA HIS A 6 -14.541-115.524 -18.136 1.00 62.44 H new ATOM 0 HB2 HIS A 6 -16.445-116.798 -18.958 1.00 4.33 H new ATOM 0 HB3 HIS A 6 -16.507-115.847 -20.429 1.00 4.33 H new ATOM 0 HD2 HIS A 6 -14.923-116.808 -22.479 1.00 51.05 H new ATOM 0 HE1 HIS A 6 -12.746-119.651 -20.209 1.00 34.00 H new ATOM 0 HE2 HIS A 6 -13.182-118.749 -22.546 1.00 2.42 H new ATOM 102 N HIS A 7 -12.909-114.239 -19.502 1.00 3.41 N ATOM 103 CA HIS A 7 -11.902-113.584 -20.325 1.00 22.42 C ATOM 104 C HIS A 7 -10.507-114.042 -19.916 1.00 74.24 C ATOM 105 O HIS A 7 -10.234-114.245 -18.732 1.00 22.25 O ATOM 106 CB HIS A 7 -12.023-112.059 -20.192 1.00 14.31 C ATOM 107 CG HIS A 7 -11.094-111.298 -21.087 1.00 52.42 C ATOM 108 ND1 HIS A 7 -9.993-110.611 -20.625 1.00 2.02 N ATOM 109 CD2 HIS A 7 -11.107-111.117 -22.430 1.00 55.24 C ATOM 110 CE1 HIS A 7 -9.372-110.042 -21.641 1.00 30.14 C ATOM 111 NE2 HIS A 7 -10.028-110.335 -22.745 1.00 45.03 N ATOM 0 H HIS A 7 -12.570-114.552 -18.592 1.00 3.41 H new ATOM 0 HA HIS A 7 -12.066-113.859 -21.367 1.00 22.42 H new ATOM 0 HB2 HIS A 7 -13.049-111.765 -20.414 1.00 14.31 H new ATOM 0 HB3 HIS A 7 -11.828-111.777 -19.157 1.00 14.31 H new ATOM 0 HD2 HIS A 7 -11.833-111.515 -23.123 1.00 55.24 H new ATOM 0 HE1 HIS A 7 -8.478-109.439 -21.578 1.00 30.14 H new ATOM 0 HE2 HIS A 7 -9.773-110.029 -23.684 1.00 45.03 H new ATOM 120 N HIS A 8 -9.636-114.208 -20.904 1.00 1.42 N ATOM 121 CA HIS A 8 -8.258-114.625 -20.667 1.00 40.41 C ATOM 122 C HIS A 8 -7.409-113.434 -20.242 1.00 31.21 C ATOM 123 O HIS A 8 -7.734-112.289 -20.559 1.00 1.54 O ATOM 124 CB HIS A 8 -7.663-115.260 -21.932 1.00 5.14 C ATOM 125 CG HIS A 8 -8.267-116.582 -22.294 1.00 51.02 C ATOM 126 ND1 HIS A 8 -7.517-117.711 -22.522 1.00 43.10 N ATOM 127 CD2 HIS A 8 -9.556-116.946 -22.488 1.00 71.51 C ATOM 128 CE1 HIS A 8 -8.315-118.713 -22.837 1.00 10.51 C ATOM 129 NE2 HIS A 8 -9.558-118.276 -22.823 1.00 62.52 N ATOM 0 H HIS A 8 -9.862-114.058 -21.887 1.00 1.42 H new ATOM 0 HA HIS A 8 -8.259-115.365 -19.867 1.00 40.41 H new ATOM 0 HB2 HIS A 8 -7.794-114.572 -22.767 1.00 5.14 H new ATOM 0 HB3 HIS A 8 -6.590-115.389 -21.791 1.00 5.14 H new ATOM 0 HD2 HIS A 8 -10.422-116.308 -22.396 1.00 71.51 H new ATOM 0 HE1 HIS A 8 -8.002-119.721 -23.067 1.00 10.51 H new ATOM 0 HE2 HIS A 8 -10.386-118.835 -23.028 1.00 62.52 H new ATOM 138 N MET A 9 -6.323-113.715 -19.529 1.00 32.43 N ATOM 139 CA MET A 9 -5.406-112.680 -19.063 1.00 63.23 C ATOM 140 C MET A 9 -4.173-113.320 -18.436 1.00 31.31 C ATOM 141 O MET A 9 -4.084-114.549 -18.343 1.00 61.42 O ATOM 142 CB MET A 9 -6.103-111.745 -18.053 1.00 35.41 C ATOM 143 CG MET A 9 -6.523-112.413 -16.744 1.00 51.11 C ATOM 144 SD MET A 9 -5.130-112.746 -15.643 1.00 3.44 S ATOM 145 CE MET A 9 -5.961-113.538 -14.264 1.00 24.31 C ATOM 0 H MET A 9 -6.054-114.661 -19.259 1.00 32.43 H new ATOM 0 HA MET A 9 -5.095-112.081 -19.919 1.00 63.23 H new ATOM 0 HB2 MET A 9 -5.432-110.917 -17.823 1.00 35.41 H new ATOM 0 HB3 MET A 9 -6.987-111.317 -18.526 1.00 35.41 H new ATOM 0 HG2 MET A 9 -7.240-111.773 -16.230 1.00 51.11 H new ATOM 0 HG3 MET A 9 -7.034-113.349 -16.968 1.00 51.11 H new ATOM 0 HE1 MET A 9 -5.229-113.803 -13.501 1.00 24.31 H new ATOM 0 HE2 MET A 9 -6.695-112.853 -13.840 1.00 24.31 H new ATOM 0 HE3 MET A 9 -6.464-114.440 -14.612 1.00 24.31 H new ATOM 155 N GLY A 10 -3.226-112.486 -18.021 1.00 41.12 N ATOM 156 CA GLY A 10 -2.027-112.974 -17.362 1.00 0.44 C ATOM 157 C GLY A 10 -0.858-113.098 -18.316 1.00 11.55 C ATOM 158 O GLY A 10 -1.016-112.932 -19.527 1.00 74.43 O ATOM 0 H GLY A 10 -3.268-111.473 -18.130 1.00 41.12 H new ATOM 0 HA2 GLY A 10 -1.760-112.298 -16.550 1.00 0.44 H new ATOM 0 HA3 GLY A 10 -2.232-113.946 -16.913 1.00 0.44 H new ATOM 162 N THR A 11 0.314-113.382 -17.760 1.00 73.24 N ATOM 163 CA THR A 11 1.542-113.547 -18.531 1.00 53.21 C ATOM 164 C THR A 11 2.446-114.569 -17.844 1.00 62.12 C ATOM 165 O THR A 11 2.314-114.804 -16.641 1.00 32.23 O ATOM 166 CB THR A 11 2.308-112.205 -18.667 1.00 24.22 C ATOM 167 OG1 THR A 11 2.381-111.551 -17.386 1.00 5.43 O ATOM 168 CG2 THR A 11 1.646-111.276 -19.683 1.00 21.21 C ATOM 0 H THR A 11 0.440-113.505 -16.755 1.00 73.24 H new ATOM 0 HA THR A 11 1.269-113.893 -19.528 1.00 53.21 H new ATOM 0 HB THR A 11 3.313-112.431 -19.025 1.00 24.22 H new ATOM 0 HG1 THR A 11 3.190-111.842 -16.916 1.00 5.43 H new ATOM 0 HG21 THR A 11 2.212-110.347 -19.749 1.00 21.21 H new ATOM 0 HG22 THR A 11 1.627-111.760 -20.660 1.00 21.21 H new ATOM 0 HG23 THR A 11 0.626-111.058 -19.366 1.00 21.21 H new ATOM 176 N LEU A 12 3.351-115.181 -18.606 1.00 73.43 N ATOM 177 CA LEU A 12 4.354-116.079 -18.034 1.00 60.44 C ATOM 178 C LEU A 12 5.356-115.269 -17.210 1.00 2.34 C ATOM 179 O LEU A 12 5.963-115.772 -16.264 1.00 43.41 O ATOM 180 CB LEU A 12 5.073-116.850 -19.153 1.00 50.00 C ATOM 181 CG LEU A 12 6.112-117.886 -18.691 1.00 32.44 C ATOM 182 CD1 LEU A 12 5.459-118.977 -17.839 1.00 40.14 C ATOM 183 CD2 LEU A 12 6.835-118.496 -19.894 1.00 54.24 C ATOM 0 H LEU A 12 3.411-115.072 -19.618 1.00 73.43 H new ATOM 0 HA LEU A 12 3.863-116.801 -17.382 1.00 60.44 H new ATOM 0 HB2 LEU A 12 4.323-117.360 -19.757 1.00 50.00 H new ATOM 0 HB3 LEU A 12 5.570-116.130 -19.803 1.00 50.00 H new ATOM 0 HG LEU A 12 6.848-117.374 -18.072 1.00 32.44 H new ATOM 0 HD11 LEU A 12 6.216-119.696 -17.526 1.00 40.14 H new ATOM 0 HD12 LEU A 12 5.001-118.526 -16.959 1.00 40.14 H new ATOM 0 HD13 LEU A 12 4.694-119.487 -18.425 1.00 40.14 H new ATOM 0 HD21 LEU A 12 7.566-119.226 -19.547 1.00 54.24 H new ATOM 0 HD22 LEU A 12 6.110-118.988 -20.543 1.00 54.24 H new ATOM 0 HD23 LEU A 12 7.344-117.709 -20.450 1.00 54.24 H new ATOM 195 N GLU A 13 5.514-114.002 -17.588 1.00 52.03 N ATOM 196 CA GLU A 13 6.385-113.077 -16.874 1.00 22.25 C ATOM 197 C GLU A 13 5.809-112.767 -15.494 1.00 62.32 C ATOM 198 O GLU A 13 4.858-111.991 -15.372 1.00 2.42 O ATOM 199 CB GLU A 13 6.564-111.767 -17.664 1.00 51.21 C ATOM 200 CG GLU A 13 7.191-111.935 -19.047 1.00 55.21 C ATOM 201 CD GLU A 13 6.255-112.572 -20.064 1.00 31.33 C ATOM 202 OE1 GLU A 13 5.439-111.846 -20.671 1.00 45.33 O ATOM 203 OE2 GLU A 13 6.332-113.799 -20.271 1.00 54.41 O ATOM 0 H GLU A 13 5.043-113.591 -18.394 1.00 52.03 H new ATOM 0 HA GLU A 13 7.359-113.552 -16.761 1.00 22.25 H new ATOM 0 HB2 GLU A 13 5.590-111.291 -17.777 1.00 51.21 H new ATOM 0 HB3 GLU A 13 7.184-111.088 -17.079 1.00 51.21 H new ATOM 0 HG2 GLU A 13 7.505-110.959 -19.416 1.00 55.21 H new ATOM 0 HG3 GLU A 13 8.089-112.546 -18.958 1.00 55.21 H new ATOM 210 N ALA A 14 6.378-113.392 -14.468 1.00 75.13 N ATOM 211 CA ALA A 14 5.979-113.152 -13.083 1.00 74.41 C ATOM 212 C ALA A 14 7.166-113.393 -12.153 1.00 5.34 C ATOM 213 O ALA A 14 8.074-114.157 -12.490 1.00 31.41 O ATOM 214 CB ALA A 14 4.804-114.052 -12.701 1.00 21.45 C ATOM 0 H ALA A 14 7.126-114.077 -14.571 1.00 75.13 H new ATOM 0 HA ALA A 14 5.658-112.115 -12.982 1.00 74.41 H new ATOM 0 HB1 ALA A 14 4.520-113.860 -11.666 1.00 21.45 H new ATOM 0 HB2 ALA A 14 3.957-113.842 -13.355 1.00 21.45 H new ATOM 0 HB3 ALA A 14 5.096-115.097 -12.809 1.00 21.45 H new ATOM 220 N GLN A 15 7.175-112.720 -11.005 1.00 73.23 N ATOM 221 CA GLN A 15 8.244-112.870 -10.027 1.00 10.44 C ATOM 222 C GLN A 15 7.765-112.491 -8.626 1.00 33.22 C ATOM 223 O GLN A 15 6.614-112.082 -8.437 1.00 53.33 O ATOM 224 CB GLN A 15 9.447-112.005 -10.447 1.00 53.15 C ATOM 225 CG GLN A 15 9.140-110.511 -10.611 1.00 42.52 C ATOM 226 CD GLN A 15 9.065-109.748 -9.292 1.00 12.50 C ATOM 227 OE1 GLN A 15 9.758-110.076 -8.327 1.00 73.33 O ATOM 228 NE2 GLN A 15 8.212-108.736 -9.242 1.00 64.32 N ATOM 0 H GLN A 15 6.447-112.061 -10.730 1.00 73.23 H new ATOM 0 HA GLN A 15 8.549-113.916 -9.996 1.00 10.44 H new ATOM 0 HB2 GLN A 15 10.236-112.120 -9.704 1.00 53.15 H new ATOM 0 HB3 GLN A 15 9.839-112.386 -11.390 1.00 53.15 H new ATOM 0 HG2 GLN A 15 9.908-110.059 -11.238 1.00 42.52 H new ATOM 0 HG3 GLN A 15 8.192-110.400 -11.138 1.00 42.52 H new ATOM 0 HE21 GLN A 15 7.656-108.496 -10.063 1.00 64.32 H new ATOM 0 HE22 GLN A 15 8.111-108.196 -8.382 1.00 64.32 H new ATOM 237 N THR A 16 8.656-112.656 -7.652 1.00 2.53 N ATOM 238 CA THR A 16 8.430-112.202 -6.288 1.00 64.02 C ATOM 239 C THR A 16 9.753-112.232 -5.515 1.00 10.20 C ATOM 240 O THR A 16 10.423-113.270 -5.445 1.00 24.02 O ATOM 241 CB THR A 16 7.346-113.042 -5.557 1.00 64.03 C ATOM 242 OG1 THR A 16 7.103-112.498 -4.251 1.00 72.31 O ATOM 243 CG2 THR A 16 7.745-114.512 -5.441 1.00 44.12 C ATOM 0 H THR A 16 9.558-113.111 -7.790 1.00 2.53 H new ATOM 0 HA THR A 16 8.054-111.180 -6.332 1.00 64.02 H new ATOM 0 HB THR A 16 6.434-112.993 -6.152 1.00 64.03 H new ATOM 0 HG1 THR A 16 6.418-113.031 -3.797 1.00 72.31 H new ATOM 0 HG21 THR A 16 6.959-115.063 -4.924 1.00 44.12 H new ATOM 0 HG22 THR A 16 7.886-114.931 -6.438 1.00 44.12 H new ATOM 0 HG23 THR A 16 8.675-114.593 -4.879 1.00 44.12 H new ATOM 251 N GLN A 17 10.145-111.085 -4.972 1.00 71.03 N ATOM 252 CA GLN A 17 11.420-110.962 -4.272 1.00 43.41 C ATOM 253 C GLN A 17 11.488-109.650 -3.497 1.00 71.34 C ATOM 254 O GLN A 17 10.645-108.766 -3.673 1.00 24.31 O ATOM 255 CB GLN A 17 12.592-111.019 -5.267 1.00 10.42 C ATOM 256 CG GLN A 17 12.659-109.815 -6.205 1.00 13.32 C ATOM 257 CD GLN A 17 13.914-109.805 -7.060 1.00 52.11 C ATOM 258 OE1 GLN A 17 13.929-110.326 -8.178 1.00 64.41 O ATOM 259 NE2 GLN A 17 14.981-109.215 -6.537 1.00 14.45 N ATOM 0 H GLN A 17 9.598-110.225 -5.003 1.00 71.03 H new ATOM 0 HA GLN A 17 11.496-111.796 -3.574 1.00 43.41 H new ATOM 0 HB2 GLN A 17 13.527-111.088 -4.711 1.00 10.42 H new ATOM 0 HB3 GLN A 17 12.508-111.928 -5.862 1.00 10.42 H new ATOM 0 HG2 GLN A 17 11.783-109.816 -6.854 1.00 13.32 H new ATOM 0 HG3 GLN A 17 12.619-108.899 -5.616 1.00 13.32 H new ATOM 0 HE21 GLN A 17 14.928-108.795 -5.609 1.00 14.45 H new ATOM 0 HE22 GLN A 17 15.854-109.181 -7.063 1.00 14.45 H new ATOM 268 N GLY A 18 12.500-109.535 -2.643 1.00 1.13 N ATOM 269 CA GLY A 18 12.766-108.287 -1.954 1.00 52.34 C ATOM 270 C GLY A 18 13.592-107.345 -2.813 1.00 34.32 C ATOM 271 O GLY A 18 14.161-107.767 -3.827 1.00 71.43 O ATOM 0 H GLY A 18 13.145-110.291 -2.415 1.00 1.13 H new ATOM 0 HA2 GLY A 18 11.824-107.808 -1.689 1.00 52.34 H new ATOM 0 HA3 GLY A 18 13.294-108.489 -1.022 1.00 52.34 H new ATOM 275 N PRO A 19 13.691-106.058 -2.428 1.00 11.21 N ATOM 276 CA PRO A 19 14.421-105.047 -3.209 1.00 44.43 C ATOM 277 C PRO A 19 15.940-105.176 -3.063 1.00 61.53 C ATOM 278 O PRO A 19 16.697-104.390 -3.635 1.00 33.10 O ATOM 279 CB PRO A 19 13.928-103.727 -2.604 1.00 34.13 C ATOM 280 CG PRO A 19 13.626-104.068 -1.185 1.00 11.35 C ATOM 281 CD PRO A 19 13.090-105.479 -1.207 1.00 74.15 C ATOM 0 HA PRO A 19 14.238-105.141 -4.279 1.00 44.43 H new ATOM 0 HB2 PRO A 19 14.687-102.948 -2.674 1.00 34.13 H new ATOM 0 HB3 PRO A 19 13.043-103.357 -3.122 1.00 34.13 H new ATOM 0 HG2 PRO A 19 14.521-103.999 -0.567 1.00 11.35 H new ATOM 0 HG3 PRO A 19 12.895-103.378 -0.764 1.00 11.35 H new ATOM 0 HD2 PRO A 19 13.382-106.033 -0.315 1.00 74.15 H new ATOM 0 HD3 PRO A 19 12.001-105.494 -1.250 1.00 74.15 H new ATOM 289 N GLY A 20 16.375-106.170 -2.293 1.00 53.25 N ATOM 290 CA GLY A 20 17.795-106.372 -2.059 1.00 63.03 C ATOM 291 C GLY A 20 18.298-105.535 -0.902 1.00 10.53 C ATOM 292 O GLY A 20 19.355-104.913 -0.987 1.00 74.25 O ATOM 0 H GLY A 20 15.767-106.842 -1.825 1.00 53.25 H new ATOM 0 HA2 GLY A 20 17.983-107.426 -1.854 1.00 63.03 H new ATOM 0 HA3 GLY A 20 18.352-106.118 -2.961 1.00 63.03 H new ATOM 296 N SER A 21 17.531-105.511 0.182 1.00 73.15 N ATOM 297 CA SER A 21 17.900-104.760 1.375 1.00 14.22 C ATOM 298 C SER A 21 17.912-105.683 2.594 1.00 10.43 C ATOM 299 O SER A 21 16.854-106.092 3.084 1.00 10.21 O ATOM 300 CB SER A 21 16.912-103.607 1.590 1.00 12.32 C ATOM 301 OG SER A 21 16.801-102.804 0.421 1.00 22.03 O ATOM 0 H SER A 21 16.643-106.007 0.258 1.00 73.15 H new ATOM 0 HA SER A 21 18.900-104.347 1.242 1.00 14.22 H new ATOM 0 HB2 SER A 21 15.933-104.007 1.855 1.00 12.32 H new ATOM 0 HB3 SER A 21 17.242-102.992 2.427 1.00 12.32 H new ATOM 0 HG SER A 21 16.164-102.077 0.583 1.00 22.03 H new ATOM 307 N MET A 22 19.106-106.035 3.055 1.00 63.14 N ATOM 308 CA MET A 22 19.264-106.894 4.227 1.00 73.31 C ATOM 309 C MET A 22 20.392-106.374 5.111 1.00 20.42 C ATOM 310 O MET A 22 21.353-105.781 4.619 1.00 43.13 O ATOM 311 CB MET A 22 19.564-108.345 3.808 1.00 54.34 C ATOM 312 CG MET A 22 20.903-108.522 3.097 1.00 52.42 C ATOM 313 SD MET A 22 21.293-110.252 2.755 1.00 3.25 S ATOM 314 CE MET A 22 22.909-110.089 1.993 1.00 22.13 C ATOM 0 H MET A 22 19.986-105.738 2.633 1.00 63.14 H new ATOM 0 HA MET A 22 18.328-106.879 4.786 1.00 73.31 H new ATOM 0 HB2 MET A 22 19.549-108.979 4.695 1.00 54.34 H new ATOM 0 HB3 MET A 22 18.767-108.695 3.152 1.00 54.34 H new ATOM 0 HG2 MET A 22 20.887-107.966 2.160 1.00 52.42 H new ATOM 0 HG3 MET A 22 21.694-108.091 3.710 1.00 52.42 H new ATOM 0 HE1 MET A 22 23.086-110.936 1.331 1.00 22.13 H new ATOM 0 HE2 MET A 22 22.948-109.164 1.417 1.00 22.13 H new ATOM 0 HE3 MET A 22 23.676-110.067 2.767 1.00 22.13 H new ATOM 324 N GLN A 23 20.266-106.592 6.416 1.00 42.32 N ATOM 325 CA GLN A 23 21.307-106.214 7.364 1.00 71.32 C ATOM 326 C GLN A 23 21.918-107.470 7.980 1.00 74.11 C ATOM 327 O GLN A 23 21.324-108.106 8.854 1.00 61.22 O ATOM 328 CB GLN A 23 20.745-105.283 8.450 1.00 23.42 C ATOM 329 CG GLN A 23 21.802-104.754 9.418 1.00 73.31 C ATOM 330 CD GLN A 23 21.250-103.709 10.372 1.00 45.10 C ATOM 331 OE1 GLN A 23 20.770-104.030 11.462 1.00 2.12 O ATOM 332 NE2 GLN A 23 21.320-102.451 9.970 1.00 73.02 N ATOM 0 H GLN A 23 19.450-107.030 6.842 1.00 42.32 H new ATOM 0 HA GLN A 23 22.088-105.667 6.836 1.00 71.32 H new ATOM 0 HB2 GLN A 23 20.250-104.438 7.971 1.00 23.42 H new ATOM 0 HB3 GLN A 23 19.983-105.819 9.016 1.00 23.42 H new ATOM 0 HG2 GLN A 23 22.211-105.585 9.993 1.00 73.31 H new ATOM 0 HG3 GLN A 23 22.626-104.323 8.850 1.00 73.31 H new ATOM 0 HE21 GLN A 23 21.725-102.228 9.061 1.00 73.02 H new ATOM 0 HE22 GLN A 23 20.969-101.704 10.569 1.00 73.02 H new ATOM 341 N GLY A 24 23.087-107.834 7.477 1.00 4.42 N ATOM 342 CA GLY A 24 23.802-109.010 7.941 1.00 12.50 C ATOM 343 C GLY A 24 25.227-108.975 7.446 1.00 71.41 C ATOM 344 O GLY A 24 26.174-109.209 8.198 1.00 61.51 O ATOM 0 H GLY A 24 23.566-107.322 6.736 1.00 4.42 H new ATOM 0 HA2 GLY A 24 23.787-109.049 9.030 1.00 12.50 H new ATOM 0 HA3 GLY A 24 23.306-109.912 7.583 1.00 12.50 H new ATOM 348 N SER A 25 25.368-108.687 6.159 1.00 41.01 N ATOM 349 CA SER A 25 26.653-108.357 5.566 1.00 14.24 C ATOM 350 C SER A 25 26.872-106.848 5.694 1.00 14.43 C ATOM 351 O SER A 25 25.931-106.116 6.017 1.00 11.33 O ATOM 352 CB SER A 25 26.662-108.792 4.093 1.00 34.44 C ATOM 353 OG SER A 25 25.482-108.364 3.430 1.00 60.00 O ATOM 0 H SER A 25 24.592-108.676 5.497 1.00 41.01 H new ATOM 0 HA SER A 25 27.460-108.879 6.079 1.00 14.24 H new ATOM 0 HB2 SER A 25 27.536-108.376 3.592 1.00 34.44 H new ATOM 0 HB3 SER A 25 26.745-109.877 4.031 1.00 34.44 H new ATOM 0 HG SER A 25 25.511-108.651 2.493 1.00 60.00 H new ATOM 359 N MET A 26 28.096-106.378 5.463 1.00 62.34 N ATOM 360 CA MET A 26 28.369-104.943 5.518 1.00 2.51 C ATOM 361 C MET A 26 27.854-104.276 4.238 1.00 11.11 C ATOM 362 O MET A 26 28.396-104.492 3.149 1.00 5.31 O ATOM 363 CB MET A 26 29.870-104.662 5.749 1.00 50.04 C ATOM 364 CG MET A 26 30.807-105.160 4.655 1.00 55.43 C ATOM 365 SD MET A 26 32.542-104.847 5.053 1.00 2.11 S ATOM 366 CE MET A 26 33.343-105.335 3.529 1.00 34.05 C ATOM 0 H MET A 26 28.904-106.959 5.239 1.00 62.34 H new ATOM 0 HA MET A 26 27.840-104.514 6.369 1.00 2.51 H new ATOM 0 HB2 MET A 26 30.008-103.586 5.859 1.00 50.04 H new ATOM 0 HB3 MET A 26 30.166-105.119 6.693 1.00 50.04 H new ATOM 0 HG2 MET A 26 30.656-106.229 4.508 1.00 55.43 H new ATOM 0 HG3 MET A 26 30.557-104.671 3.714 1.00 55.43 H new ATOM 0 HE1 MET A 26 34.420-105.197 3.624 1.00 34.05 H new ATOM 0 HE2 MET A 26 33.128-106.384 3.325 1.00 34.05 H new ATOM 0 HE3 MET A 26 32.969-104.722 2.709 1.00 34.05 H new ATOM 376 N PRO A 27 26.769-103.479 4.346 1.00 74.34 N ATOM 377 CA PRO A 27 26.094-102.894 3.184 1.00 71.44 C ATOM 378 C PRO A 27 26.950-101.853 2.470 1.00 34.14 C ATOM 379 O PRO A 27 27.219-100.774 3.003 1.00 11.14 O ATOM 380 CB PRO A 27 24.825-102.243 3.770 1.00 53.44 C ATOM 381 CG PRO A 27 24.705-102.792 5.155 1.00 33.13 C ATOM 382 CD PRO A 27 26.110-103.081 5.603 1.00 61.22 C ATOM 0 HA PRO A 27 25.881-103.650 2.429 1.00 71.44 H new ATOM 0 HB2 PRO A 27 24.910-101.156 3.783 1.00 53.44 H new ATOM 0 HB3 PRO A 27 23.946-102.486 3.173 1.00 53.44 H new ATOM 0 HG2 PRO A 27 24.222-102.075 5.819 1.00 33.13 H new ATOM 0 HG3 PRO A 27 24.097-103.697 5.166 1.00 33.13 H new ATOM 0 HD2 PRO A 27 26.582-102.206 6.049 1.00 61.22 H new ATOM 0 HD3 PRO A 27 26.143-103.876 6.348 1.00 61.22 H new ATOM 390 N SER A 28 27.387-102.198 1.269 1.00 3.22 N ATOM 391 CA SER A 28 28.109-101.271 0.409 1.00 34.34 C ATOM 392 C SER A 28 27.117-100.544 -0.497 1.00 61.20 C ATOM 393 O SER A 28 26.063-101.098 -0.833 1.00 25.04 O ATOM 394 CB SER A 28 29.152-102.037 -0.417 1.00 12.32 C ATOM 395 OG SER A 28 28.599-103.235 -0.949 1.00 70.24 O ATOM 0 H SER A 28 27.252-103.124 0.863 1.00 3.22 H new ATOM 0 HA SER A 28 28.632-100.531 1.015 1.00 34.34 H new ATOM 0 HB2 SER A 28 29.513-101.406 -1.229 1.00 12.32 H new ATOM 0 HB3 SER A 28 30.013-102.275 0.208 1.00 12.32 H new ATOM 0 HG SER A 28 29.281-103.706 -1.473 1.00 70.24 H new ATOM 401 N SER A 29 27.444 -99.309 -0.878 1.00 60.23 N ATOM 402 CA SER A 29 26.560 -98.502 -1.711 1.00 32.34 C ATOM 403 C SER A 29 26.293 -99.198 -3.049 1.00 73.11 C ATOM 404 O SER A 29 27.138 -99.201 -3.950 1.00 31.03 O ATOM 405 CB SER A 29 27.164 -97.108 -1.923 1.00 33.44 C ATOM 406 OG SER A 29 27.320 -96.438 -0.679 1.00 52.53 O ATOM 0 H SER A 29 28.317 -98.847 -0.621 1.00 60.23 H new ATOM 0 HA SER A 29 25.604 -98.387 -1.201 1.00 32.34 H new ATOM 0 HB2 SER A 29 28.131 -97.196 -2.419 1.00 33.44 H new ATOM 0 HB3 SER A 29 26.521 -96.523 -2.580 1.00 33.44 H new ATOM 0 HG SER A 29 27.708 -95.551 -0.832 1.00 52.53 H new ATOM 412 N SER A 30 25.117 -99.812 -3.149 1.00 64.34 N ATOM 413 CA SER A 30 24.724-100.567 -4.330 1.00 21.24 C ATOM 414 C SER A 30 24.386 -99.636 -5.491 1.00 2.22 C ATOM 415 O SER A 30 24.465-100.028 -6.657 1.00 33.13 O ATOM 416 CB SER A 30 23.531-101.463 -3.992 1.00 51.34 C ATOM 417 OG SER A 30 23.821-102.286 -2.870 1.00 75.40 O ATOM 0 H SER A 30 24.412 -99.799 -2.412 1.00 64.34 H new ATOM 0 HA SER A 30 25.563-101.190 -4.641 1.00 21.24 H new ATOM 0 HB2 SER A 30 22.656-100.848 -3.781 1.00 51.34 H new ATOM 0 HB3 SER A 30 23.283-102.086 -4.851 1.00 51.34 H new ATOM 0 HG SER A 30 23.045-102.850 -2.669 1.00 75.40 H new ATOM 423 N GLU A 31 24.011 -98.403 -5.167 1.00 40.24 N ATOM 424 CA GLU A 31 23.734 -97.400 -6.187 1.00 62.35 C ATOM 425 C GLU A 31 25.046 -96.780 -6.669 1.00 41.11 C ATOM 426 O GLU A 31 25.584 -95.858 -6.052 1.00 60.14 O ATOM 427 CB GLU A 31 22.746 -96.315 -5.689 1.00 12.31 C ATOM 428 CG GLU A 31 23.122 -95.629 -4.371 1.00 22.01 C ATOM 429 CD GLU A 31 22.846 -96.487 -3.142 1.00 14.11 C ATOM 430 OE1 GLU A 31 21.684 -96.541 -2.694 1.00 62.50 O ATOM 431 OE2 GLU A 31 23.789 -97.111 -2.618 1.00 55.42 O ATOM 0 H GLU A 31 23.892 -98.075 -4.208 1.00 40.24 H new ATOM 0 HA GLU A 31 23.246 -97.896 -7.026 1.00 62.35 H new ATOM 0 HB2 GLU A 31 22.654 -95.551 -6.461 1.00 12.31 H new ATOM 0 HB3 GLU A 31 21.763 -96.771 -5.573 1.00 12.31 H new ATOM 0 HG2 GLU A 31 24.181 -95.370 -4.394 1.00 22.01 H new ATOM 0 HG3 GLU A 31 22.567 -94.695 -4.285 1.00 22.01 H new ATOM 438 N ASP A 32 25.570 -97.321 -7.766 1.00 41.14 N ATOM 439 CA ASP A 32 26.845 -96.872 -8.322 1.00 53.41 C ATOM 440 C ASP A 32 26.699 -95.474 -8.914 1.00 74.21 C ATOM 441 O ASP A 32 27.633 -94.670 -8.890 1.00 0.32 O ATOM 442 CB ASP A 32 27.330 -97.860 -9.391 1.00 20.24 C ATOM 443 CG ASP A 32 28.635 -97.428 -10.037 1.00 71.33 C ATOM 444 OD1 ASP A 32 29.671 -97.403 -9.337 1.00 22.21 O ATOM 445 OD2 ASP A 32 28.637 -97.119 -11.249 1.00 71.55 O ATOM 0 H ASP A 32 25.128 -98.076 -8.291 1.00 41.14 H new ATOM 0 HA ASP A 32 27.585 -96.833 -7.523 1.00 53.41 H new ATOM 0 HB2 ASP A 32 27.461 -98.843 -8.939 1.00 20.24 H new ATOM 0 HB3 ASP A 32 26.564 -97.962 -10.160 1.00 20.24 H new ATOM 450 N VAL A 33 25.507 -95.199 -9.425 1.00 64.33 N ATOM 451 CA VAL A 33 25.136 -93.872 -9.898 1.00 3.41 C ATOM 452 C VAL A 33 23.859 -93.450 -9.185 1.00 52.31 C ATOM 453 O VAL A 33 22.834 -94.131 -9.288 1.00 55.05 O ATOM 454 CB VAL A 33 24.917 -93.845 -11.436 1.00 32.24 C ATOM 455 CG1 VAL A 33 24.506 -92.449 -11.908 1.00 21.34 C ATOM 456 CG2 VAL A 33 26.172 -94.318 -12.171 1.00 54.35 C ATOM 0 H VAL A 33 24.766 -95.893 -9.524 1.00 64.33 H new ATOM 0 HA VAL A 33 25.949 -93.181 -9.677 1.00 3.41 H new ATOM 0 HB VAL A 33 24.104 -94.532 -11.671 1.00 32.24 H new ATOM 0 HG11 VAL A 33 24.359 -92.459 -12.988 1.00 21.34 H new ATOM 0 HG12 VAL A 33 23.577 -92.158 -11.418 1.00 21.34 H new ATOM 0 HG13 VAL A 33 25.289 -91.734 -11.655 1.00 21.34 H new ATOM 0 HG21 VAL A 33 25.996 -94.291 -13.246 1.00 54.35 H new ATOM 0 HG22 VAL A 33 27.007 -93.663 -11.924 1.00 54.35 H new ATOM 0 HG23 VAL A 33 26.409 -95.338 -11.868 1.00 54.35 H new ATOM 466 N THR A 34 23.913 -92.338 -8.465 1.00 32.15 N ATOM 467 CA THR A 34 22.801 -91.926 -7.626 1.00 71.11 C ATOM 468 C THR A 34 21.694 -91.324 -8.485 1.00 2.24 C ATOM 469 O THR A 34 21.860 -90.258 -9.080 1.00 60.35 O ATOM 470 CB THR A 34 23.264 -90.908 -6.561 1.00 3.00 C ATOM 471 OG1 THR A 34 24.385 -91.444 -5.837 1.00 50.55 O ATOM 472 CG2 THR A 34 22.135 -90.573 -5.586 1.00 1.10 C ATOM 0 H THR A 34 24.714 -91.707 -8.446 1.00 32.15 H new ATOM 0 HA THR A 34 22.414 -92.805 -7.111 1.00 71.11 H new ATOM 0 HB THR A 34 23.556 -89.990 -7.071 1.00 3.00 H new ATOM 0 HG1 THR A 34 24.111 -91.658 -4.921 1.00 50.55 H new ATOM 0 HG21 THR A 34 22.492 -89.854 -4.849 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.296 -90.144 -6.134 1.00 1.10 H new ATOM 0 HG23 THR A 34 21.810 -91.482 -5.079 1.00 1.10 H new ATOM 480 N THR A 35 20.580 -92.041 -8.568 1.00 71.32 N ATOM 481 CA THR A 35 19.445 -91.635 -9.384 1.00 44.34 C ATOM 482 C THR A 35 18.215 -91.407 -8.510 1.00 64.43 C ATOM 483 O THR A 35 17.838 -92.274 -7.719 1.00 74.11 O ATOM 484 CB THR A 35 19.133 -92.709 -10.446 1.00 51.43 C ATOM 485 OG1 THR A 35 20.311 -92.966 -11.229 1.00 13.30 O ATOM 486 CG2 THR A 35 17.984 -92.278 -11.360 1.00 62.32 C ATOM 0 H THR A 35 20.439 -92.920 -8.071 1.00 71.32 H new ATOM 0 HA THR A 35 19.703 -90.703 -9.886 1.00 44.34 H new ATOM 0 HB THR A 35 18.825 -93.618 -9.930 1.00 51.43 H new ATOM 0 HG1 THR A 35 20.574 -93.905 -11.127 1.00 13.30 H new ATOM 0 HG21 THR A 35 17.792 -93.059 -12.096 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.087 -92.113 -10.763 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.254 -91.355 -11.873 1.00 62.32 H new ATOM 494 N LEU A 36 17.623 -90.225 -8.641 1.00 13.40 N ATOM 495 CA LEU A 36 16.409 -89.861 -7.922 1.00 32.23 C ATOM 496 C LEU A 36 15.519 -89.035 -8.843 1.00 30.20 C ATOM 497 O LEU A 36 16.003 -88.138 -9.538 1.00 35.32 O ATOM 498 CB LEU A 36 16.749 -89.053 -6.654 1.00 70.33 C ATOM 499 CG LEU A 36 17.502 -89.818 -5.550 1.00 3.23 C ATOM 500 CD1 LEU A 36 17.891 -88.876 -4.412 1.00 10.31 C ATOM 501 CD2 LEU A 36 16.657 -90.980 -5.026 1.00 4.14 C ATOM 0 H LEU A 36 17.975 -89.488 -9.253 1.00 13.40 H new ATOM 0 HA LEU A 36 15.887 -90.768 -7.616 1.00 32.23 H new ATOM 0 HB2 LEU A 36 17.349 -88.191 -6.946 1.00 70.33 H new ATOM 0 HB3 LEU A 36 15.821 -88.667 -6.233 1.00 70.33 H new ATOM 0 HG LEU A 36 18.416 -90.229 -5.980 1.00 3.23 H new ATOM 0 HD11 LEU A 36 18.422 -89.436 -3.642 1.00 10.31 H new ATOM 0 HD12 LEU A 36 18.537 -88.087 -4.797 1.00 10.31 H new ATOM 0 HD13 LEU A 36 16.992 -88.432 -3.983 1.00 10.31 H new ATOM 0 HD21 LEU A 36 17.207 -91.508 -4.247 1.00 4.14 H new ATOM 0 HD22 LEU A 36 15.724 -90.595 -4.614 1.00 4.14 H new ATOM 0 HD23 LEU A 36 16.437 -91.667 -5.843 1.00 4.14 H new ATOM 513 N CYS A 37 14.230 -89.342 -8.871 1.00 71.23 N ATOM 514 CA CYS A 37 13.297 -88.592 -9.708 1.00 40.31 C ATOM 515 C CYS A 37 12.780 -87.372 -8.950 1.00 32.44 C ATOM 516 O CYS A 37 12.473 -87.458 -7.761 1.00 34.41 O ATOM 517 CB CYS A 37 12.133 -89.477 -10.155 1.00 1.21 C ATOM 518 SG CYS A 37 12.649 -91.022 -10.938 1.00 21.43 S ATOM 0 H CYS A 37 13.807 -90.097 -8.331 1.00 71.23 H new ATOM 0 HA CYS A 37 13.826 -88.256 -10.600 1.00 40.31 H new ATOM 0 HB2 CYS A 37 11.512 -89.709 -9.290 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.511 -88.917 -10.853 1.00 1.21 H new ATOM 0 HG CYS A 37 11.598 -91.707 -11.281 1.00 21.43 H new ATOM 524 N TYR A 38 12.687 -86.243 -9.644 1.00 44.52 N ATOM 525 CA TYR A 38 12.294 -84.976 -9.030 1.00 13.14 C ATOM 526 C TYR A 38 10.927 -84.543 -9.541 1.00 33.50 C ATOM 527 O TYR A 38 10.622 -84.698 -10.721 1.00 34.40 O ATOM 528 CB TYR A 38 13.331 -83.883 -9.345 1.00 2.52 C ATOM 529 CG TYR A 38 14.640 -84.014 -8.584 1.00 51.01 C ATOM 530 CD1 TYR A 38 15.249 -85.249 -8.397 1.00 5.21 C ATOM 531 CD2 TYR A 38 15.266 -82.893 -8.048 1.00 74.21 C ATOM 532 CE1 TYR A 38 16.436 -85.366 -7.704 1.00 42.41 C ATOM 533 CE2 TYR A 38 16.453 -83.004 -7.353 1.00 41.03 C ATOM 534 CZ TYR A 38 17.033 -84.241 -7.185 1.00 0.42 C ATOM 535 OH TYR A 38 18.211 -84.356 -6.488 1.00 72.24 O ATOM 0 H TYR A 38 12.880 -86.178 -10.643 1.00 44.52 H new ATOM 0 HA TYR A 38 12.244 -85.120 -7.951 1.00 13.14 H new ATOM 0 HB2 TYR A 38 13.544 -83.900 -10.414 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.893 -82.910 -9.123 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.784 -86.135 -8.802 1.00 5.21 H new ATOM 0 HD2 TYR A 38 14.816 -81.920 -8.178 1.00 74.21 H new ATOM 0 HE1 TYR A 38 16.894 -86.335 -7.570 1.00 42.41 H new ATOM 0 HE2 TYR A 38 16.925 -82.124 -6.942 1.00 41.03 H new ATOM 0 HH TYR A 38 18.816 -83.630 -6.747 1.00 72.24 H new ATOM 545 N ARG A 39 10.107 -84.010 -8.644 1.00 41.31 N ATOM 546 CA ARG A 39 8.799 -83.485 -9.006 1.00 13.40 C ATOM 547 C ARG A 39 8.426 -82.333 -8.076 1.00 14.02 C ATOM 548 O ARG A 39 8.254 -82.527 -6.871 1.00 25.40 O ATOM 549 CB ARG A 39 7.733 -84.591 -8.954 1.00 74.33 C ATOM 550 CG ARG A 39 6.338 -84.120 -9.364 1.00 12.21 C ATOM 551 CD ARG A 39 5.370 -85.284 -9.537 1.00 54.31 C ATOM 552 NE ARG A 39 5.134 -86.010 -8.287 1.00 25.32 N ATOM 553 CZ ARG A 39 4.760 -87.291 -8.226 1.00 14.22 C ATOM 554 NH1 ARG A 39 4.692 -88.019 -9.335 1.00 32.13 N ATOM 555 NH2 ARG A 39 4.489 -87.854 -7.054 1.00 64.21 N ATOM 0 H ARG A 39 10.329 -83.930 -7.652 1.00 41.31 H new ATOM 0 HA ARG A 39 8.844 -83.111 -10.029 1.00 13.40 H new ATOM 0 HB2 ARG A 39 8.038 -85.408 -9.608 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.688 -84.993 -7.942 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.950 -83.435 -8.610 1.00 12.21 H new ATOM 0 HG3 ARG A 39 6.404 -83.561 -10.298 1.00 12.21 H new ATOM 0 HD2 ARG A 39 4.421 -84.909 -9.920 1.00 54.31 H new ATOM 0 HD3 ARG A 39 5.765 -85.973 -10.284 1.00 54.31 H new ATOM 0 HE ARG A 39 5.263 -85.507 -7.409 1.00 25.32 H new ATOM 0 HH11 ARG A 39 4.926 -87.600 -10.235 1.00 32.13 H new ATOM 0 HH12 ARG A 39 4.406 -88.997 -9.286 1.00 32.13 H new ATOM 0 HH21 ARG A 39 4.566 -87.308 -6.196 1.00 64.21 H new ATOM 0 HH22 ARG A 39 4.204 -88.832 -7.012 1.00 64.21 H new ATOM 569 N VAL A 40 8.319 -81.133 -8.635 1.00 72.34 N ATOM 570 CA VAL A 40 7.974 -79.948 -7.852 1.00 72.44 C ATOM 571 C VAL A 40 6.586 -79.453 -8.239 1.00 70.43 C ATOM 572 O VAL A 40 6.203 -79.505 -9.406 1.00 61.43 O ATOM 573 CB VAL A 40 9.008 -78.799 -8.039 1.00 33.24 C ATOM 574 CG1 VAL A 40 8.893 -78.161 -9.421 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.858 -77.745 -6.938 1.00 22.25 C ATOM 0 H VAL A 40 8.466 -80.953 -9.628 1.00 72.34 H new ATOM 0 HA VAL A 40 7.987 -80.239 -6.802 1.00 72.44 H new ATOM 0 HB VAL A 40 10.003 -79.237 -7.960 1.00 33.24 H new ATOM 0 HG11 VAL A 40 9.630 -77.363 -9.516 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.075 -78.916 -10.186 1.00 32.30 H new ATOM 0 HG13 VAL A 40 7.892 -77.748 -9.549 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.591 -76.953 -7.090 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.854 -77.322 -6.974 1.00 22.25 H new ATOM 0 HG23 VAL A 40 9.022 -78.209 -5.965 1.00 22.25 H new ATOM 585 N THR A 41 5.835 -78.994 -7.256 1.00 2.24 N ATOM 586 CA THR A 41 4.496 -78.480 -7.477 1.00 62.42 C ATOM 587 C THR A 41 4.500 -76.961 -7.347 1.00 74.20 C ATOM 588 O THR A 41 5.098 -76.419 -6.414 1.00 2.33 O ATOM 589 CB THR A 41 3.495 -79.089 -6.466 1.00 55.34 C ATOM 590 OG1 THR A 41 3.949 -78.857 -5.124 1.00 61.12 O ATOM 591 CG2 THR A 41 3.321 -80.588 -6.695 1.00 64.10 C ATOM 0 H THR A 41 6.136 -78.967 -6.282 1.00 2.24 H new ATOM 0 HA THR A 41 4.182 -78.761 -8.482 1.00 62.42 H new ATOM 0 HB THR A 41 2.530 -78.604 -6.615 1.00 55.34 H new ATOM 0 HG1 THR A 41 4.866 -79.188 -5.027 1.00 61.12 H new ATOM 0 HG21 THR A 41 2.612 -80.987 -5.970 1.00 64.10 H new ATOM 0 HG22 THR A 41 2.944 -80.761 -7.703 1.00 64.10 H new ATOM 0 HG23 THR A 41 4.282 -81.088 -6.576 1.00 64.10 H new ATOM 599 N GLY A 42 3.863 -76.281 -8.290 1.00 41.40 N ATOM 600 CA GLY A 42 3.781 -74.830 -8.246 1.00 24.42 C ATOM 601 C GLY A 42 2.559 -74.359 -7.484 1.00 40.24 C ATOM 602 O GLY A 42 1.782 -75.179 -6.984 1.00 32.35 O ATOM 0 H GLY A 42 3.398 -76.709 -9.091 1.00 41.40 H new ATOM 0 HA2 GLY A 42 4.679 -74.429 -7.776 1.00 24.42 H new ATOM 0 HA3 GLY A 42 3.750 -74.437 -9.262 1.00 24.42 H new ATOM 606 N LYS A 43 2.411 -73.042 -7.354 1.00 4.30 N ATOM 607 CA LYS A 43 1.200 -72.455 -6.788 1.00 54.14 C ATOM 608 C LYS A 43 0.006 -72.873 -7.653 1.00 34.03 C ATOM 609 O LYS A 43 -0.906 -73.562 -7.194 1.00 15.12 O ATOM 610 CB LYS A 43 1.347 -70.916 -6.732 1.00 24.05 C ATOM 611 CG LYS A 43 0.382 -70.193 -5.784 1.00 42.10 C ATOM 612 CD LYS A 43 -1.085 -70.351 -6.187 1.00 4.43 C ATOM 613 CE LYS A 43 -2.014 -69.509 -5.319 1.00 3.20 C ATOM 614 NZ LYS A 43 -1.890 -69.832 -3.872 1.00 10.25 N ATOM 0 H LYS A 43 3.117 -72.361 -7.634 1.00 4.30 H new ATOM 0 HA LYS A 43 1.038 -72.811 -5.770 1.00 54.14 H new ATOM 0 HB2 LYS A 43 2.368 -70.677 -6.434 1.00 24.05 H new ATOM 0 HB3 LYS A 43 1.207 -70.519 -7.737 1.00 24.05 H new ATOM 0 HG2 LYS A 43 0.518 -70.578 -4.773 1.00 42.10 H new ATOM 0 HG3 LYS A 43 0.633 -69.133 -5.758 1.00 42.10 H new ATOM 0 HD2 LYS A 43 -1.206 -70.063 -7.231 1.00 4.43 H new ATOM 0 HD3 LYS A 43 -1.370 -71.400 -6.110 1.00 4.43 H new ATOM 0 HE2 LYS A 43 -1.792 -68.453 -5.473 1.00 3.20 H new ATOM 0 HE3 LYS A 43 -3.045 -69.667 -5.636 1.00 3.20 H new ATOM 0 HZ1 LYS A 43 -2.611 -69.308 -3.336 1.00 10.25 H new ATOM 0 HZ2 LYS A 43 -2.028 -70.853 -3.731 1.00 10.25 H new ATOM 0 HZ3 LYS A 43 -0.944 -69.561 -3.536 1.00 10.25 H new ATOM 628 N VAL A 44 0.030 -72.442 -8.910 1.00 15.21 N ATOM 629 CA VAL A 44 -0.942 -72.872 -9.913 1.00 11.51 C ATOM 630 C VAL A 44 -0.206 -73.491 -11.098 1.00 43.13 C ATOM 631 O VAL A 44 1.019 -73.631 -11.063 1.00 73.31 O ATOM 632 CB VAL A 44 -1.830 -71.701 -10.405 1.00 65.30 C ATOM 633 CG1 VAL A 44 -2.751 -71.209 -9.288 1.00 4.45 C ATOM 634 CG2 VAL A 44 -0.972 -70.557 -10.950 1.00 65.34 C ATOM 0 H VAL A 44 0.724 -71.784 -9.264 1.00 15.21 H new ATOM 0 HA VAL A 44 -1.598 -73.608 -9.448 1.00 11.51 H new ATOM 0 HB VAL A 44 -2.455 -72.070 -11.218 1.00 65.30 H new ATOM 0 HG11 VAL A 44 -3.364 -70.387 -9.658 1.00 4.45 H new ATOM 0 HG12 VAL A 44 -3.396 -72.025 -8.962 1.00 4.45 H new ATOM 0 HG13 VAL A 44 -2.150 -70.864 -8.447 1.00 4.45 H new ATOM 0 HG21 VAL A 44 -1.618 -69.747 -11.289 1.00 65.34 H new ATOM 0 HG22 VAL A 44 -0.313 -70.190 -10.163 1.00 65.34 H new ATOM 0 HG23 VAL A 44 -0.373 -70.918 -11.786 1.00 65.34 H new ATOM 644 N GLN A 45 -0.948 -73.868 -12.136 1.00 50.12 N ATOM 645 CA GLN A 45 -0.345 -74.391 -13.361 1.00 32.13 C ATOM 646 C GLN A 45 0.620 -73.362 -13.963 1.00 53.04 C ATOM 647 O GLN A 45 0.198 -72.380 -14.576 1.00 31.24 O ATOM 648 CB GLN A 45 -1.440 -74.768 -14.371 1.00 23.21 C ATOM 649 CG GLN A 45 -2.323 -75.928 -13.914 1.00 74.44 C ATOM 650 CD GLN A 45 -3.533 -76.141 -14.810 1.00 75.11 C ATOM 651 OE1 GLN A 45 -3.477 -76.889 -15.788 1.00 53.52 O ATOM 652 NE2 GLN A 45 -4.639 -75.493 -14.474 1.00 75.34 N ATOM 0 H GLN A 45 -1.967 -73.822 -12.154 1.00 50.12 H new ATOM 0 HA GLN A 45 0.223 -75.289 -13.118 1.00 32.13 H new ATOM 0 HB2 GLN A 45 -2.067 -73.896 -14.556 1.00 23.21 H new ATOM 0 HB3 GLN A 45 -0.972 -75.031 -15.320 1.00 23.21 H new ATOM 0 HG2 GLN A 45 -1.730 -76.842 -13.890 1.00 74.44 H new ATOM 0 HG3 GLN A 45 -2.661 -75.741 -12.895 1.00 74.44 H new ATOM 0 HE21 GLN A 45 -4.644 -74.883 -13.657 1.00 75.34 H new ATOM 0 HE22 GLN A 45 -5.485 -75.604 -15.033 1.00 75.34 H new ATOM 661 N GLY A 46 1.917 -73.588 -13.751 1.00 33.40 N ATOM 662 CA GLY A 46 2.940 -72.684 -14.247 1.00 5.31 C ATOM 663 C GLY A 46 4.058 -73.425 -14.950 1.00 42.35 C ATOM 664 O GLY A 46 4.044 -74.655 -15.019 1.00 52.52 O ATOM 0 H GLY A 46 2.278 -74.392 -13.238 1.00 33.40 H new ATOM 0 HA2 GLY A 46 2.489 -71.969 -14.936 1.00 5.31 H new ATOM 0 HA3 GLY A 46 3.351 -72.111 -13.416 1.00 5.31 H new ATOM 668 N VAL A 47 5.032 -72.680 -15.461 1.00 50.43 N ATOM 669 CA VAL A 47 6.127 -73.260 -16.235 1.00 62.01 C ATOM 670 C VAL A 47 7.454 -73.132 -15.491 1.00 63.33 C ATOM 671 O VAL A 47 7.583 -72.346 -14.548 1.00 24.14 O ATOM 672 CB VAL A 47 6.253 -72.591 -17.632 1.00 61.21 C ATOM 673 CG1 VAL A 47 4.979 -72.800 -18.449 1.00 73.20 C ATOM 674 CG2 VAL A 47 6.573 -71.100 -17.498 1.00 13.12 C ATOM 0 H VAL A 47 5.087 -71.667 -15.353 1.00 50.43 H new ATOM 0 HA VAL A 47 5.894 -74.316 -16.372 1.00 62.01 H new ATOM 0 HB VAL A 47 7.079 -73.067 -18.161 1.00 61.21 H new ATOM 0 HG11 VAL A 47 5.089 -72.324 -19.423 1.00 73.20 H new ATOM 0 HG12 VAL A 47 4.805 -73.867 -18.585 1.00 73.20 H new ATOM 0 HG13 VAL A 47 4.133 -72.358 -17.923 1.00 73.20 H new ATOM 0 HG21 VAL A 47 6.656 -70.655 -18.490 1.00 13.12 H new ATOM 0 HG22 VAL A 47 5.775 -70.605 -16.944 1.00 13.12 H new ATOM 0 HG23 VAL A 47 7.516 -70.977 -16.965 1.00 13.12 H new ATOM 684 N PHE A 48 8.438 -73.908 -15.931 1.00 44.21 N ATOM 685 CA PHE A 48 9.773 -73.903 -15.332 1.00 43.23 C ATOM 686 C PHE A 48 10.748 -73.229 -16.305 1.00 63.04 C ATOM 687 O PHE A 48 10.327 -72.718 -17.346 1.00 45.54 O ATOM 688 CB PHE A 48 10.197 -75.353 -15.031 1.00 61.12 C ATOM 689 CG PHE A 48 11.156 -75.520 -13.875 1.00 53.24 C ATOM 690 CD1 PHE A 48 10.790 -75.138 -12.590 1.00 42.11 C ATOM 691 CD2 PHE A 48 12.410 -76.085 -14.067 1.00 54.45 C ATOM 692 CE1 PHE A 48 11.655 -75.311 -11.526 1.00 23.41 C ATOM 693 CE2 PHE A 48 13.277 -76.264 -13.006 1.00 23.53 C ATOM 694 CZ PHE A 48 12.900 -75.876 -11.734 1.00 52.33 C ATOM 0 H PHE A 48 8.336 -74.558 -16.711 1.00 44.21 H new ATOM 0 HA PHE A 48 9.774 -73.345 -14.395 1.00 43.23 H new ATOM 0 HB2 PHE A 48 9.302 -75.941 -14.827 1.00 61.12 H new ATOM 0 HB3 PHE A 48 10.656 -75.773 -15.926 1.00 61.12 H new ATOM 0 HD1 PHE A 48 9.817 -74.700 -12.421 1.00 42.11 H new ATOM 0 HD2 PHE A 48 12.712 -76.388 -15.059 1.00 54.45 H new ATOM 0 HE1 PHE A 48 11.359 -75.005 -10.533 1.00 23.41 H new ATOM 0 HE2 PHE A 48 14.248 -76.707 -13.170 1.00 23.53 H new ATOM 0 HZ PHE A 48 13.577 -76.014 -10.904 1.00 52.33 H new ATOM 704 N PHE A 49 12.039 -73.236 -15.985 1.00 15.34 N ATOM 705 CA PHE A 49 13.046 -72.568 -16.817 1.00 4.40 C ATOM 706 C PHE A 49 14.057 -73.564 -17.388 1.00 62.32 C ATOM 707 O PHE A 49 15.071 -73.881 -16.757 1.00 1.00 O ATOM 708 CB PHE A 49 13.745 -71.451 -16.023 1.00 33.40 C ATOM 709 CG PHE A 49 13.767 -71.679 -14.531 1.00 61.25 C ATOM 710 CD1 PHE A 49 14.736 -72.479 -13.943 1.00 61.52 C ATOM 711 CD2 PHE A 49 12.812 -71.089 -13.714 1.00 2.54 C ATOM 712 CE1 PHE A 49 14.750 -72.685 -12.578 1.00 52.45 C ATOM 713 CE2 PHE A 49 12.822 -71.295 -12.349 1.00 70.11 C ATOM 714 CZ PHE A 49 13.793 -72.092 -11.781 1.00 63.23 C ATOM 0 H PHE A 49 12.417 -73.696 -15.156 1.00 15.34 H new ATOM 0 HA PHE A 49 12.534 -72.114 -17.665 1.00 4.40 H new ATOM 0 HB2 PHE A 49 14.770 -71.352 -16.380 1.00 33.40 H new ATOM 0 HB3 PHE A 49 13.244 -70.505 -16.228 1.00 33.40 H new ATOM 0 HD1 PHE A 49 15.489 -72.946 -14.561 1.00 61.52 H new ATOM 0 HD2 PHE A 49 12.051 -70.460 -14.152 1.00 2.54 H new ATOM 0 HE1 PHE A 49 15.510 -73.311 -12.134 1.00 52.45 H new ATOM 0 HE2 PHE A 49 12.070 -70.832 -11.727 1.00 70.11 H new ATOM 0 HZ PHE A 49 13.804 -72.252 -10.713 1.00 63.23 H new ATOM 724 N ARG A 50 13.759 -74.042 -18.597 1.00 20.24 N ATOM 725 CA ARG A 50 14.597 -75.012 -19.306 1.00 11.11 C ATOM 726 C ARG A 50 16.048 -74.545 -19.374 1.00 62.02 C ATOM 727 O ARG A 50 16.974 -75.330 -19.171 1.00 13.04 O ATOM 728 CB ARG A 50 14.044 -75.229 -20.727 1.00 4.24 C ATOM 729 CG ARG A 50 14.868 -76.188 -21.586 1.00 63.42 C ATOM 730 CD ARG A 50 14.307 -76.293 -23.001 1.00 31.41 C ATOM 731 NE ARG A 50 14.286 -74.994 -23.679 1.00 52.04 N ATOM 732 CZ ARG A 50 13.812 -74.791 -24.911 1.00 22.45 C ATOM 733 NH1 ARG A 50 13.299 -75.790 -25.618 1.00 12.14 N ATOM 734 NH2 ARG A 50 13.842 -73.575 -25.437 1.00 70.43 N ATOM 0 H ARG A 50 12.925 -73.766 -19.115 1.00 20.24 H new ATOM 0 HA ARG A 50 14.574 -75.953 -18.756 1.00 11.11 H new ATOM 0 HB2 ARG A 50 13.026 -75.611 -20.653 1.00 4.24 H new ATOM 0 HB3 ARG A 50 13.987 -74.265 -21.233 1.00 4.24 H new ATOM 0 HG2 ARG A 50 15.902 -75.844 -21.628 1.00 63.42 H new ATOM 0 HG3 ARG A 50 14.879 -77.175 -21.123 1.00 63.42 H new ATOM 0 HD2 ARG A 50 14.909 -76.994 -23.579 1.00 31.41 H new ATOM 0 HD3 ARG A 50 13.296 -76.698 -22.961 1.00 31.41 H new ATOM 0 HE ARG A 50 14.659 -74.189 -23.175 1.00 52.04 H new ATOM 0 HH11 ARG A 50 13.263 -76.729 -25.222 1.00 12.14 H new ATOM 0 HH12 ARG A 50 12.941 -75.619 -26.558 1.00 12.14 H new ATOM 0 HH21 ARG A 50 14.226 -72.797 -24.901 1.00 70.43 H new ATOM 0 HH22 ARG A 50 13.481 -73.417 -26.378 1.00 70.43 H new ATOM 748 N LYS A 51 16.225 -73.259 -19.650 1.00 31.42 N ATOM 749 CA LYS A 51 17.548 -72.662 -19.786 1.00 51.24 C ATOM 750 C LYS A 51 18.395 -72.908 -18.537 1.00 43.40 C ATOM 751 O LYS A 51 19.500 -73.448 -18.613 1.00 4.25 O ATOM 752 CB LYS A 51 17.406 -71.156 -20.035 1.00 42.54 C ATOM 753 CG LYS A 51 18.733 -70.422 -20.214 1.00 63.21 C ATOM 754 CD LYS A 51 18.530 -68.917 -20.387 1.00 2.41 C ATOM 755 CE LYS A 51 17.645 -68.603 -21.587 1.00 61.10 C ATOM 756 NZ LYS A 51 17.380 -67.148 -21.720 1.00 63.52 N ATOM 0 H LYS A 51 15.457 -72.601 -19.786 1.00 31.42 H new ATOM 0 HA LYS A 51 18.053 -73.128 -20.632 1.00 51.24 H new ATOM 0 HB2 LYS A 51 16.796 -71.002 -20.925 1.00 42.54 H new ATOM 0 HB3 LYS A 51 16.867 -70.710 -19.199 1.00 42.54 H new ATOM 0 HG2 LYS A 51 19.370 -70.606 -19.349 1.00 63.21 H new ATOM 0 HG3 LYS A 51 19.255 -70.821 -21.084 1.00 63.21 H new ATOM 0 HD2 LYS A 51 18.079 -68.504 -19.484 1.00 2.41 H new ATOM 0 HD3 LYS A 51 19.498 -68.431 -20.511 1.00 2.41 H new ATOM 0 HE2 LYS A 51 18.124 -68.968 -22.495 1.00 61.10 H new ATOM 0 HE3 LYS A 51 16.699 -69.136 -21.489 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 16.775 -66.980 -22.549 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 16.900 -66.803 -20.865 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 18.280 -66.641 -21.840 1.00 63.52 H new ATOM 770 N TYR A 52 17.856 -72.532 -17.381 1.00 33.33 N ATOM 771 CA TYR A 52 18.604 -72.605 -16.130 1.00 52.21 C ATOM 772 C TYR A 52 18.728 -74.049 -15.650 1.00 31.13 C ATOM 773 O TYR A 52 19.701 -74.403 -14.981 1.00 33.12 O ATOM 774 CB TYR A 52 17.946 -71.729 -15.056 1.00 51.11 C ATOM 775 CG TYR A 52 17.767 -70.280 -15.481 1.00 65.03 C ATOM 776 CD1 TYR A 52 18.754 -69.618 -16.208 1.00 73.20 C ATOM 777 CD2 TYR A 52 16.608 -69.581 -15.168 1.00 31.11 C ATOM 778 CE1 TYR A 52 18.587 -68.304 -16.604 1.00 34.30 C ATOM 779 CE2 TYR A 52 16.435 -68.268 -15.563 1.00 52.05 C ATOM 780 CZ TYR A 52 17.427 -67.634 -16.280 1.00 23.30 C ATOM 781 OH TYR A 52 17.253 -66.328 -16.683 1.00 53.21 O ATOM 0 H TYR A 52 16.906 -72.174 -17.284 1.00 33.33 H new ATOM 0 HA TYR A 52 19.609 -72.225 -16.314 1.00 52.21 H new ATOM 0 HB2 TYR A 52 16.972 -72.148 -14.803 1.00 51.11 H new ATOM 0 HB3 TYR A 52 18.552 -71.762 -14.150 1.00 51.11 H new ATOM 0 HD1 TYR A 52 19.664 -70.139 -16.466 1.00 73.20 H new ATOM 0 HD2 TYR A 52 15.828 -70.073 -14.606 1.00 31.11 H new ATOM 0 HE1 TYR A 52 19.363 -67.804 -17.165 1.00 34.30 H new ATOM 0 HE2 TYR A 52 15.527 -67.741 -15.311 1.00 52.05 H new ATOM 0 HH TYR A 52 16.381 -66.004 -16.374 1.00 53.21 H new ATOM 791 N THR A 53 17.742 -74.879 -15.988 1.00 44.10 N ATOM 792 CA THR A 53 17.810 -76.306 -15.688 1.00 3.41 C ATOM 793 C THR A 53 18.969 -76.944 -16.459 1.00 73.23 C ATOM 794 O THR A 53 19.772 -77.698 -15.898 1.00 72.33 O ATOM 795 CB THR A 53 16.482 -77.012 -16.046 1.00 45.12 C ATOM 796 OG1 THR A 53 15.390 -76.339 -15.403 1.00 53.20 O ATOM 797 CG2 THR A 53 16.499 -78.477 -15.617 1.00 71.23 C ATOM 0 H THR A 53 16.890 -74.588 -16.468 1.00 44.10 H new ATOM 0 HA THR A 53 17.979 -76.425 -14.618 1.00 3.41 H new ATOM 0 HB THR A 53 16.359 -76.974 -17.128 1.00 45.12 H new ATOM 0 HG1 THR A 53 15.711 -75.901 -14.587 1.00 53.20 H new ATOM 0 HG21 THR A 53 15.551 -78.945 -15.883 1.00 71.23 H new ATOM 0 HG22 THR A 53 17.314 -78.995 -16.123 1.00 71.23 H new ATOM 0 HG23 THR A 53 16.644 -78.539 -14.538 1.00 71.23 H new ATOM 805 N LYS A 54 19.059 -76.606 -17.746 1.00 52.34 N ATOM 806 CA LYS A 54 20.138 -77.075 -18.609 1.00 30.44 C ATOM 807 C LYS A 54 21.488 -76.635 -18.050 1.00 3.54 C ATOM 808 O LYS A 54 22.391 -77.450 -17.879 1.00 44.10 O ATOM 809 CB LYS A 54 19.949 -76.535 -20.039 1.00 40.44 C ATOM 810 CG LYS A 54 21.131 -76.792 -20.978 1.00 35.45 C ATOM 811 CD LYS A 54 21.376 -78.282 -21.231 1.00 30.33 C ATOM 812 CE LYS A 54 20.185 -78.956 -21.906 1.00 3.15 C ATOM 813 NZ LYS A 54 20.476 -80.364 -22.288 1.00 23.31 N ATOM 0 H LYS A 54 18.386 -76.001 -18.216 1.00 52.34 H new ATOM 0 HA LYS A 54 20.113 -78.164 -18.642 1.00 30.44 H new ATOM 0 HB2 LYS A 54 19.055 -76.987 -20.469 1.00 40.44 H new ATOM 0 HB3 LYS A 54 19.770 -75.461 -19.987 1.00 40.44 H new ATOM 0 HG2 LYS A 54 20.949 -76.292 -21.929 1.00 35.45 H new ATOM 0 HG3 LYS A 54 22.031 -76.348 -20.552 1.00 35.45 H new ATOM 0 HD2 LYS A 54 22.261 -78.402 -21.856 1.00 30.33 H new ATOM 0 HD3 LYS A 54 21.584 -78.780 -20.284 1.00 30.33 H new ATOM 0 HE2 LYS A 54 19.328 -78.934 -21.233 1.00 3.15 H new ATOM 0 HE3 LYS A 54 19.906 -78.391 -22.795 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 19.639 -80.781 -22.743 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 21.277 -80.385 -22.951 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 20.717 -80.912 -21.437 1.00 23.31 H new ATOM 827 N LYS A 55 21.606 -75.342 -17.754 1.00 61.15 N ATOM 828 CA LYS A 55 22.854 -74.774 -17.241 1.00 23.30 C ATOM 829 C LYS A 55 23.265 -75.443 -15.929 1.00 15.04 C ATOM 830 O LYS A 55 24.440 -75.750 -15.719 1.00 2.24 O ATOM 831 CB LYS A 55 22.715 -73.257 -17.044 1.00 11.43 C ATOM 832 CG LYS A 55 22.445 -72.499 -18.340 1.00 64.44 C ATOM 833 CD LYS A 55 22.416 -70.987 -18.124 1.00 65.33 C ATOM 834 CE LYS A 55 23.753 -70.469 -17.605 1.00 14.41 C ATOM 835 NZ LYS A 55 24.881 -70.834 -18.502 1.00 63.50 N ATOM 0 H LYS A 55 20.851 -74.665 -17.861 1.00 61.15 H new ATOM 0 HA LYS A 55 23.635 -74.962 -17.978 1.00 23.30 H new ATOM 0 HB2 LYS A 55 21.904 -73.062 -16.342 1.00 11.43 H new ATOM 0 HB3 LYS A 55 23.628 -72.872 -16.590 1.00 11.43 H new ATOM 0 HG2 LYS A 55 23.215 -72.746 -19.071 1.00 64.44 H new ATOM 0 HG3 LYS A 55 21.492 -72.824 -18.758 1.00 64.44 H new ATOM 0 HD2 LYS A 55 22.172 -70.489 -19.062 1.00 65.33 H new ATOM 0 HD3 LYS A 55 21.627 -70.735 -17.415 1.00 65.33 H new ATOM 0 HE2 LYS A 55 23.707 -69.385 -17.505 1.00 14.41 H new ATOM 0 HE3 LYS A 55 23.936 -70.874 -16.610 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 25.725 -70.286 -18.239 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 25.084 -71.850 -18.408 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 24.624 -70.622 -19.487 1.00 63.50 H new ATOM 849 N GLU A 56 22.287 -75.678 -15.058 1.00 61.35 N ATOM 850 CA GLU A 56 22.544 -76.304 -13.760 1.00 4.44 C ATOM 851 C GLU A 56 23.113 -77.704 -13.956 1.00 34.44 C ATOM 852 O GLU A 56 24.193 -78.028 -13.459 1.00 61.15 O ATOM 853 CB GLU A 56 21.253 -76.387 -12.932 1.00 12.34 C ATOM 854 CG GLU A 56 21.471 -76.868 -11.498 1.00 53.51 C ATOM 855 CD GLU A 56 22.237 -75.858 -10.651 1.00 25.14 C ATOM 856 OE1 GLU A 56 21.838 -74.670 -10.631 1.00 63.10 O ATOM 857 OE2 GLU A 56 23.237 -76.238 -10.005 1.00 24.04 O ATOM 0 H GLU A 56 21.308 -75.445 -15.226 1.00 61.35 H new ATOM 0 HA GLU A 56 23.268 -75.690 -13.224 1.00 4.44 H new ATOM 0 HB2 GLU A 56 20.784 -75.404 -12.908 1.00 12.34 H new ATOM 0 HB3 GLU A 56 20.556 -77.061 -13.430 1.00 12.34 H new ATOM 0 HG2 GLU A 56 20.505 -77.067 -11.034 1.00 53.51 H new ATOM 0 HG3 GLU A 56 22.017 -77.811 -11.514 1.00 53.51 H new ATOM 864 N ALA A 57 22.378 -78.524 -14.696 1.00 2.01 N ATOM 865 CA ALA A 57 22.776 -79.904 -14.946 1.00 74.43 C ATOM 866 C ALA A 57 24.105 -79.962 -15.697 1.00 71.13 C ATOM 867 O ALA A 57 24.955 -80.803 -15.410 1.00 12.10 O ATOM 868 CB ALA A 57 21.683 -80.624 -15.723 1.00 4.12 C ATOM 0 H ALA A 57 21.498 -78.256 -15.136 1.00 2.01 H new ATOM 0 HA ALA A 57 22.916 -80.406 -13.989 1.00 74.43 H new ATOM 0 HB1 ALA A 57 21.986 -81.655 -15.907 1.00 4.12 H new ATOM 0 HB2 ALA A 57 20.759 -80.615 -15.145 1.00 4.12 H new ATOM 0 HB3 ALA A 57 21.520 -80.118 -16.675 1.00 4.12 H new ATOM 874 N ASP A 58 24.285 -79.045 -16.637 1.00 44.45 N ATOM 875 CA ASP A 58 25.499 -78.991 -17.454 1.00 61.14 C ATOM 876 C ASP A 58 26.711 -78.617 -16.599 1.00 50.21 C ATOM 877 O ASP A 58 27.813 -79.141 -16.795 1.00 33.21 O ATOM 878 CB ASP A 58 25.315 -77.980 -18.596 1.00 0.41 C ATOM 879 CG ASP A 58 26.520 -77.890 -19.520 1.00 35.12 C ATOM 880 OD1 ASP A 58 26.858 -78.905 -20.168 1.00 32.14 O ATOM 881 OD2 ASP A 58 27.114 -76.797 -19.632 1.00 22.10 O ATOM 0 H ASP A 58 23.602 -78.320 -16.857 1.00 44.45 H new ATOM 0 HA ASP A 58 25.677 -79.978 -17.880 1.00 61.14 H new ATOM 0 HB2 ASP A 58 24.438 -78.258 -19.180 1.00 0.41 H new ATOM 0 HB3 ASP A 58 25.117 -76.996 -18.172 1.00 0.41 H new ATOM 886 N ALA A 59 26.495 -77.714 -15.644 1.00 41.11 N ATOM 887 CA ALA A 59 27.556 -77.258 -14.745 1.00 31.13 C ATOM 888 C ALA A 59 27.900 -78.320 -13.694 1.00 41.12 C ATOM 889 O ALA A 59 29.069 -78.652 -13.489 1.00 73.43 O ATOM 890 CB ALA A 59 27.150 -75.951 -14.066 1.00 33.22 C ATOM 0 H ALA A 59 25.588 -77.280 -15.472 1.00 41.11 H new ATOM 0 HA ALA A 59 28.449 -77.085 -15.346 1.00 31.13 H new ATOM 0 HB1 ALA A 59 27.949 -75.624 -13.400 1.00 33.22 H new ATOM 0 HB2 ALA A 59 26.973 -75.187 -14.823 1.00 33.22 H new ATOM 0 HB3 ALA A 59 26.239 -76.108 -13.489 1.00 33.22 H new ATOM 896 N LEU A 60 26.872 -78.846 -13.031 1.00 54.24 N ATOM 897 CA LEU A 60 27.054 -79.807 -11.932 1.00 74.52 C ATOM 898 C LEU A 60 27.118 -81.257 -12.440 1.00 2.20 C ATOM 899 O LEU A 60 27.313 -82.181 -11.653 1.00 5.04 O ATOM 900 CB LEU A 60 25.929 -79.647 -10.887 1.00 10.34 C ATOM 901 CG LEU A 60 26.149 -78.574 -9.805 1.00 60.33 C ATOM 902 CD1 LEU A 60 27.254 -79.001 -8.841 1.00 41.11 C ATOM 903 CD2 LEU A 60 26.470 -77.220 -10.434 1.00 51.52 C ATOM 0 H LEU A 60 25.897 -78.625 -13.233 1.00 54.24 H new ATOM 0 HA LEU A 60 28.011 -79.587 -11.459 1.00 74.52 H new ATOM 0 HB2 LEU A 60 25.003 -79.416 -11.414 1.00 10.34 H new ATOM 0 HB3 LEU A 60 25.783 -80.607 -10.392 1.00 10.34 H new ATOM 0 HG LEU A 60 25.223 -78.469 -9.239 1.00 60.33 H new ATOM 0 HD11 LEU A 60 27.394 -78.230 -8.084 1.00 41.11 H new ATOM 0 HD12 LEU A 60 26.974 -79.937 -8.358 1.00 41.11 H new ATOM 0 HD13 LEU A 60 28.184 -79.142 -9.392 1.00 41.11 H new ATOM 0 HD21 LEU A 60 26.621 -76.480 -9.648 1.00 51.52 H new ATOM 0 HD22 LEU A 60 27.377 -77.303 -11.033 1.00 51.52 H new ATOM 0 HD23 LEU A 60 25.642 -76.909 -11.071 1.00 51.52 H new ATOM 915 N SER A 61 26.955 -81.442 -13.749 1.00 74.52 N ATOM 916 CA SER A 61 27.133 -82.745 -14.394 1.00 3.53 C ATOM 917 C SER A 61 26.047 -83.748 -13.975 1.00 64.03 C ATOM 918 O SER A 61 26.339 -84.907 -13.665 1.00 34.12 O ATOM 919 CB SER A 61 28.539 -83.299 -14.073 1.00 74.53 C ATOM 920 OG SER A 61 28.808 -84.495 -14.794 1.00 63.03 O ATOM 0 H SER A 61 26.696 -80.695 -14.393 1.00 74.52 H new ATOM 0 HA SER A 61 27.037 -82.603 -15.470 1.00 3.53 H new ATOM 0 HB2 SER A 61 29.291 -82.549 -14.318 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.619 -83.493 -13.003 1.00 74.53 H new ATOM 0 HG SER A 61 28.058 -85.117 -14.688 1.00 63.03 H new ATOM 926 N LEU A 62 24.789 -83.307 -14.001 1.00 73.12 N ATOM 927 CA LEU A 62 23.659 -84.210 -13.775 1.00 32.44 C ATOM 928 C LEU A 62 23.019 -84.575 -15.109 1.00 13.42 C ATOM 929 O LEU A 62 22.793 -83.709 -15.955 1.00 54.02 O ATOM 930 CB LEU A 62 22.590 -83.590 -12.850 1.00 62.02 C ATOM 931 CG LEU A 62 23.018 -83.325 -11.395 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.768 -84.523 -10.814 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.844 -82.053 -11.301 1.00 20.31 C ATOM 0 H LEU A 62 24.527 -82.337 -14.175 1.00 73.12 H new ATOM 0 HA LEU A 62 24.049 -85.101 -13.283 1.00 32.44 H new ATOM 0 HB2 LEU A 62 22.264 -82.647 -13.288 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.724 -84.251 -12.837 1.00 62.02 H new ATOM 0 HG LEU A 62 22.118 -83.183 -10.797 1.00 31.13 H new ATOM 0 HD11 LEU A 62 24.058 -84.307 -9.786 1.00 22.14 H new ATOM 0 HD12 LEU A 62 23.122 -85.401 -10.832 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.660 -84.717 -11.409 1.00 22.14 H new ATOM 0 HD21 LEU A 62 24.136 -81.885 -10.264 1.00 20.31 H new ATOM 0 HD22 LEU A 62 24.737 -82.153 -11.918 1.00 20.31 H new ATOM 0 HD23 LEU A 62 23.252 -81.208 -11.653 1.00 20.31 H new ATOM 945 N VAL A 63 22.745 -85.860 -15.297 1.00 63.31 N ATOM 946 CA VAL A 63 22.046 -86.338 -16.485 1.00 53.30 C ATOM 947 C VAL A 63 20.662 -86.850 -16.091 1.00 24.01 C ATOM 948 O VAL A 63 20.397 -87.070 -14.912 1.00 52.40 O ATOM 949 CB VAL A 63 22.836 -87.458 -17.217 1.00 11.42 C ATOM 950 CG1 VAL A 63 24.178 -86.931 -17.721 1.00 23.31 C ATOM 951 CG2 VAL A 63 23.039 -88.671 -16.309 1.00 10.23 C ATOM 0 H VAL A 63 22.998 -86.595 -14.637 1.00 63.31 H new ATOM 0 HA VAL A 63 21.952 -85.500 -17.176 1.00 53.30 H new ATOM 0 HB VAL A 63 22.247 -87.777 -18.077 1.00 11.42 H new ATOM 0 HG11 VAL A 63 24.715 -87.731 -18.230 1.00 23.31 H new ATOM 0 HG12 VAL A 63 24.008 -86.108 -18.416 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.770 -86.577 -16.877 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.595 -89.439 -16.847 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.598 -88.372 -15.422 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.069 -89.068 -16.009 1.00 10.23 H new ATOM 961 N GLY A 64 19.781 -87.016 -17.068 1.00 15.23 N ATOM 962 CA GLY A 64 18.433 -87.479 -16.786 1.00 55.25 C ATOM 963 C GLY A 64 17.417 -86.876 -17.731 1.00 30.41 C ATOM 964 O GLY A 64 17.609 -86.914 -18.955 1.00 63.55 O ATOM 0 H GLY A 64 19.974 -86.838 -18.054 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.399 -88.566 -16.863 1.00 55.25 H new ATOM 0 HA3 GLY A 64 18.169 -87.224 -15.760 1.00 55.25 H new ATOM 968 N TYR A 65 16.334 -86.322 -17.185 1.00 73.32 N ATOM 969 CA TYR A 65 15.289 -85.716 -18.016 1.00 13.32 C ATOM 970 C TYR A 65 14.324 -84.882 -17.176 1.00 31.43 C ATOM 971 O TYR A 65 14.115 -85.171 -16.004 1.00 30.44 O ATOM 972 CB TYR A 65 14.552 -86.811 -18.825 1.00 12.34 C ATOM 973 CG TYR A 65 13.050 -86.915 -18.603 1.00 12.32 C ATOM 974 CD1 TYR A 65 12.529 -87.727 -17.600 1.00 2.54 C ATOM 975 CD2 TYR A 65 12.156 -86.226 -19.417 1.00 43.24 C ATOM 976 CE1 TYR A 65 11.165 -87.847 -17.414 1.00 14.21 C ATOM 977 CE2 TYR A 65 10.792 -86.336 -19.234 1.00 74.34 C ATOM 978 CZ TYR A 65 10.302 -87.149 -18.232 1.00 4.14 C ATOM 979 OH TYR A 65 8.940 -87.277 -18.056 1.00 22.34 O ATOM 0 H TYR A 65 16.157 -86.279 -16.181 1.00 73.32 H new ATOM 0 HA TYR A 65 15.759 -85.032 -18.723 1.00 13.32 H new ATOM 0 HB2 TYR A 65 14.730 -86.631 -19.885 1.00 12.34 H new ATOM 0 HB3 TYR A 65 15.001 -87.775 -18.585 1.00 12.34 H new ATOM 0 HD1 TYR A 65 13.202 -88.273 -16.956 1.00 2.54 H new ATOM 0 HD2 TYR A 65 12.536 -85.594 -20.206 1.00 43.24 H new ATOM 0 HE1 TYR A 65 10.777 -88.484 -16.633 1.00 14.21 H new ATOM 0 HE2 TYR A 65 10.113 -85.789 -19.871 1.00 74.34 H new ATOM 0 HH TYR A 65 8.748 -87.463 -17.113 1.00 22.34 H new ATOM 989 N VAL A 66 13.763 -83.830 -17.779 1.00 23.54 N ATOM 990 CA VAL A 66 12.769 -82.975 -17.110 1.00 72.34 C ATOM 991 C VAL A 66 11.643 -82.611 -18.078 1.00 10.41 C ATOM 992 O VAL A 66 11.883 -82.486 -19.277 1.00 63.31 O ATOM 993 CB VAL A 66 13.413 -81.674 -16.540 1.00 1.11 C ATOM 994 CG1 VAL A 66 12.356 -80.631 -16.167 1.00 51.44 C ATOM 995 CG2 VAL A 66 14.283 -81.987 -15.323 1.00 12.42 C ATOM 0 H VAL A 66 13.980 -83.546 -18.734 1.00 23.54 H new ATOM 0 HA VAL A 66 12.362 -83.544 -16.274 1.00 72.34 H new ATOM 0 HB VAL A 66 14.038 -81.255 -17.329 1.00 1.11 H new ATOM 0 HG11 VAL A 66 12.846 -79.740 -15.774 1.00 51.44 H new ATOM 0 HG12 VAL A 66 11.778 -80.366 -17.052 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.690 -81.043 -15.409 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.722 -81.065 -14.942 1.00 12.42 H new ATOM 0 HG22 VAL A 66 13.671 -82.445 -14.546 1.00 12.42 H new ATOM 0 HG23 VAL A 66 15.078 -82.675 -15.611 1.00 12.42 H new ATOM 1005 N THR A 67 10.427 -82.448 -17.544 1.00 33.35 N ATOM 1006 CA THR A 67 9.264 -82.034 -18.324 1.00 62.00 C ATOM 1007 C THR A 67 8.178 -81.482 -17.398 1.00 43.22 C ATOM 1008 O THR A 67 8.202 -81.717 -16.187 1.00 43.20 O ATOM 1009 CB THR A 67 8.667 -83.190 -19.163 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.612 -82.688 -19.994 1.00 12.03 O ATOM 1011 CG2 THR A 67 8.117 -84.300 -18.275 1.00 52.41 C ATOM 0 H THR A 67 10.225 -82.601 -16.556 1.00 33.35 H new ATOM 0 HA THR A 67 9.609 -81.262 -19.012 1.00 62.00 H new ATOM 0 HB THR A 67 9.467 -83.605 -19.776 1.00 20.20 H new ATOM 0 HG1 THR A 67 7.133 -83.438 -20.403 1.00 12.03 H new ATOM 0 HG21 THR A 67 7.706 -85.094 -18.898 1.00 52.41 H new ATOM 0 HG22 THR A 67 8.919 -84.702 -17.656 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.332 -83.898 -17.635 1.00 52.41 H new ATOM 1019 N ASN A 68 7.238 -80.739 -17.971 1.00 24.14 N ATOM 1020 CA ASN A 68 6.120 -80.176 -17.213 1.00 73.40 C ATOM 1021 C ASN A 68 4.908 -81.097 -17.319 1.00 73.12 C ATOM 1022 O ASN A 68 4.793 -81.872 -18.269 1.00 10.52 O ATOM 1023 CB ASN A 68 5.770 -78.779 -17.748 1.00 71.15 C ATOM 1024 CG ASN A 68 4.672 -78.077 -16.959 1.00 11.14 C ATOM 1025 OD1 ASN A 68 3.866 -77.345 -17.526 1.00 14.14 O ATOM 1026 ND2 ASN A 68 4.652 -78.260 -15.646 1.00 71.23 N ATOM 0 H ASN A 68 7.226 -80.510 -18.965 1.00 24.14 H new ATOM 0 HA ASN A 68 6.409 -80.088 -16.166 1.00 73.40 H new ATOM 0 HB2 ASN A 68 6.667 -78.160 -17.735 1.00 71.15 H new ATOM 0 HB3 ASN A 68 5.458 -78.866 -18.789 1.00 71.15 H new ATOM 0 HD21 ASN A 68 3.952 -77.786 -15.076 1.00 71.23 H new ATOM 0 HD22 ASN A 68 5.336 -78.875 -15.206 1.00 71.23 H new ATOM 1033 N ASN A 69 4.033 -81.042 -16.319 1.00 74.00 N ATOM 1034 CA ASN A 69 2.782 -81.807 -16.314 1.00 52.24 C ATOM 1035 C ASN A 69 1.607 -80.861 -16.082 1.00 5.25 C ATOM 1036 O ASN A 69 1.731 -79.880 -15.340 1.00 52.52 O ATOM 1037 CB ASN A 69 2.798 -82.902 -15.226 1.00 72.13 C ATOM 1038 CG ASN A 69 3.442 -84.215 -15.667 1.00 72.22 C ATOM 1039 OD1 ASN A 69 3.076 -85.285 -15.180 1.00 2.34 O ATOM 1040 ND2 ASN A 69 4.394 -84.158 -16.587 1.00 31.15 N ATOM 0 H ASN A 69 4.168 -80.467 -15.487 1.00 74.00 H new ATOM 0 HA ASN A 69 2.676 -82.297 -17.282 1.00 52.24 H new ATOM 0 HB2 ASN A 69 3.331 -82.524 -14.354 1.00 72.13 H new ATOM 0 HB3 ASN A 69 1.773 -83.101 -14.912 1.00 72.13 H new ATOM 0 HD21 ASN A 69 4.844 -85.015 -16.909 1.00 31.15 H new ATOM 0 HD22 ASN A 69 4.677 -83.257 -16.973 1.00 31.15 H new ATOM 1047 N GLU A 70 0.460 -81.175 -16.689 1.00 63.52 N ATOM 1048 CA GLU A 70 -0.722 -80.311 -16.616 1.00 54.22 C ATOM 1049 C GLU A 70 -1.295 -80.257 -15.196 1.00 23.41 C ATOM 1050 O GLU A 70 -2.247 -79.523 -14.930 1.00 22.31 O ATOM 1051 CB GLU A 70 -1.803 -80.782 -17.598 1.00 35.24 C ATOM 1052 CG GLU A 70 -2.302 -82.199 -17.340 1.00 73.50 C ATOM 1053 CD GLU A 70 -3.538 -82.535 -18.156 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -4.656 -82.205 -17.703 1.00 22.30 O ATOM 1055 OE2 GLU A 70 -3.405 -83.118 -19.254 1.00 32.11 O ATOM 0 H GLU A 70 0.324 -82.024 -17.238 1.00 63.52 H new ATOM 0 HA GLU A 70 -0.404 -79.306 -16.893 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -2.648 -80.096 -17.548 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -1.407 -80.727 -18.612 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -1.510 -82.909 -17.577 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -2.527 -82.315 -16.280 1.00 73.50 H new ATOM 1062 N ASP A 71 -0.717 -81.045 -14.292 1.00 53.44 N ATOM 1063 CA ASP A 71 -1.092 -81.019 -12.876 1.00 52.32 C ATOM 1064 C ASP A 71 -0.541 -79.768 -12.193 1.00 60.33 C ATOM 1065 O ASP A 71 -0.784 -79.539 -11.005 1.00 61.33 O ATOM 1066 CB ASP A 71 -0.574 -82.274 -12.153 1.00 72.43 C ATOM 1067 CG ASP A 71 -1.283 -83.548 -12.588 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -1.222 -83.890 -13.789 1.00 44.11 O ATOM 1069 OD2 ASP A 71 -1.910 -84.215 -11.732 1.00 23.34 O ATOM 0 H ASP A 71 0.019 -81.715 -14.515 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.180 -81.002 -12.819 1.00 52.32 H new ATOM 0 HB2 ASP A 71 0.495 -82.378 -12.339 1.00 72.43 H new ATOM 0 HB3 ASP A 71 -0.699 -82.144 -11.078 1.00 72.43 H new ATOM 1074 N GLY A 72 0.203 -78.963 -12.948 1.00 2.22 N ATOM 1075 CA GLY A 72 0.835 -77.785 -12.387 1.00 24.21 C ATOM 1076 C GLY A 72 2.081 -78.156 -11.619 1.00 64.40 C ATOM 1077 O GLY A 72 2.352 -77.617 -10.541 1.00 24.14 O ATOM 0 H GLY A 72 0.379 -79.108 -13.942 1.00 2.22 H new ATOM 0 HA2 GLY A 72 1.089 -77.089 -13.186 1.00 24.21 H new ATOM 0 HA3 GLY A 72 0.136 -77.272 -11.727 1.00 24.21 H new ATOM 1081 N SER A 73 2.830 -79.100 -12.172 1.00 74.30 N ATOM 1082 CA SER A 73 4.033 -79.605 -11.536 1.00 53.52 C ATOM 1083 C SER A 73 5.108 -79.907 -12.581 1.00 5.24 C ATOM 1084 O SER A 73 4.797 -80.208 -13.736 1.00 20.32 O ATOM 1085 CB SER A 73 3.694 -80.863 -10.725 1.00 23.04 C ATOM 1086 OG SER A 73 2.965 -81.797 -11.507 1.00 33.31 O ATOM 0 H SER A 73 2.620 -79.534 -13.071 1.00 74.30 H new ATOM 0 HA SER A 73 4.427 -78.844 -10.862 1.00 53.52 H new ATOM 0 HB2 SER A 73 4.613 -81.325 -10.365 1.00 23.04 H new ATOM 0 HB3 SER A 73 3.111 -80.586 -9.847 1.00 23.04 H new ATOM 0 HG SER A 73 2.764 -82.589 -10.967 1.00 33.31 H new ATOM 1092 N VAL A 74 6.367 -79.799 -12.178 1.00 2.14 N ATOM 1093 CA VAL A 74 7.494 -80.120 -13.046 1.00 23.14 C ATOM 1094 C VAL A 74 8.165 -81.391 -12.542 1.00 45.15 C ATOM 1095 O VAL A 74 8.570 -81.458 -11.382 1.00 50.12 O ATOM 1096 CB VAL A 74 8.527 -78.968 -13.086 1.00 61.55 C ATOM 1097 CG1 VAL A 74 9.616 -79.241 -14.125 1.00 25.24 C ATOM 1098 CG2 VAL A 74 7.827 -77.638 -13.357 1.00 44.21 C ATOM 0 H VAL A 74 6.636 -79.488 -11.245 1.00 2.14 H new ATOM 0 HA VAL A 74 7.117 -80.266 -14.058 1.00 23.14 H new ATOM 0 HB VAL A 74 9.012 -78.907 -12.112 1.00 61.55 H new ATOM 0 HG11 VAL A 74 10.328 -78.416 -14.131 1.00 25.24 H new ATOM 0 HG12 VAL A 74 10.135 -80.166 -13.874 1.00 25.24 H new ATOM 0 HG13 VAL A 74 9.162 -79.336 -15.111 1.00 25.24 H new ATOM 0 HG21 VAL A 74 8.565 -76.837 -13.382 1.00 44.21 H new ATOM 0 HG22 VAL A 74 7.312 -77.687 -14.316 1.00 44.21 H new ATOM 0 HG23 VAL A 74 7.104 -77.440 -12.566 1.00 44.21 H new ATOM 1108 N SER A 75 8.281 -82.392 -13.404 1.00 24.41 N ATOM 1109 CA SER A 75 8.767 -83.704 -12.996 1.00 33.53 C ATOM 1110 C SER A 75 9.879 -84.187 -13.924 1.00 25.55 C ATOM 1111 O SER A 75 9.978 -83.751 -15.074 1.00 44.43 O ATOM 1112 CB SER A 75 7.595 -84.699 -12.973 1.00 45.42 C ATOM 1113 OG SER A 75 8.025 -86.033 -12.737 1.00 50.11 O ATOM 0 H SER A 75 8.044 -82.320 -14.394 1.00 24.41 H new ATOM 0 HA SER A 75 9.189 -83.631 -11.994 1.00 33.53 H new ATOM 0 HB2 SER A 75 6.887 -84.405 -12.198 1.00 45.42 H new ATOM 0 HB3 SER A 75 7.064 -84.654 -13.924 1.00 45.42 H new ATOM 0 HG SER A 75 7.248 -86.630 -12.729 1.00 50.11 H new ATOM 1119 N GLY A 76 10.714 -85.084 -13.414 1.00 32.44 N ATOM 1120 CA GLY A 76 11.819 -85.618 -14.184 1.00 51.54 C ATOM 1121 C GLY A 76 12.701 -86.530 -13.353 1.00 43.42 C ATOM 1122 O GLY A 76 12.301 -86.971 -12.276 1.00 53.55 O ATOM 0 H GLY A 76 10.642 -85.455 -12.467 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.431 -86.170 -15.040 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.417 -84.796 -14.579 1.00 51.54 H new ATOM 1126 N VAL A 77 13.901 -86.818 -13.853 1.00 42.05 N ATOM 1127 CA VAL A 77 14.841 -87.704 -13.173 1.00 43.44 C ATOM 1128 C VAL A 77 16.253 -87.115 -13.217 1.00 74.14 C ATOM 1129 O VAL A 77 16.676 -86.576 -14.251 1.00 42.33 O ATOM 1130 CB VAL A 77 14.868 -89.117 -13.820 1.00 53.04 C ATOM 1131 CG1 VAL A 77 15.766 -90.064 -13.029 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.458 -89.698 -13.957 1.00 44.22 C ATOM 0 H VAL A 77 14.247 -86.445 -14.737 1.00 42.05 H new ATOM 0 HA VAL A 77 14.505 -87.798 -12.140 1.00 43.44 H new ATOM 0 HB VAL A 77 15.283 -89.009 -14.822 1.00 53.04 H new ATOM 0 HG11 VAL A 77 15.767 -91.045 -13.503 1.00 73.25 H new ATOM 0 HG12 VAL A 77 16.782 -89.670 -13.009 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.391 -90.154 -12.009 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.514 -90.686 -14.413 1.00 44.22 H new ATOM 0 HG22 VAL A 77 13.000 -89.779 -12.971 1.00 44.22 H new ATOM 0 HG23 VAL A 77 12.854 -89.043 -14.585 1.00 44.22 H new ATOM 1142 N VAL A 78 16.957 -87.209 -12.088 1.00 11.12 N ATOM 1143 CA VAL A 78 18.353 -86.785 -11.978 1.00 13.11 C ATOM 1144 C VAL A 78 19.242 -88.000 -11.714 1.00 3.40 C ATOM 1145 O VAL A 78 18.900 -88.858 -10.901 1.00 63.53 O ATOM 1146 CB VAL A 78 18.553 -85.764 -10.828 1.00 55.53 C ATOM 1147 CG1 VAL A 78 20.033 -85.432 -10.636 1.00 52.34 C ATOM 1148 CG2 VAL A 78 17.750 -84.492 -11.080 1.00 23.42 C ATOM 0 H VAL A 78 16.573 -87.583 -11.220 1.00 11.12 H new ATOM 0 HA VAL A 78 18.626 -86.307 -12.919 1.00 13.11 H new ATOM 0 HB VAL A 78 18.186 -86.225 -9.911 1.00 55.53 H new ATOM 0 HG11 VAL A 78 20.142 -84.714 -9.823 1.00 52.34 H new ATOM 0 HG12 VAL A 78 20.581 -86.342 -10.393 1.00 52.34 H new ATOM 0 HG13 VAL A 78 20.432 -85.003 -11.555 1.00 52.34 H new ATOM 0 HG21 VAL A 78 17.908 -83.793 -10.259 1.00 23.42 H new ATOM 0 HG22 VAL A 78 18.077 -84.034 -12.014 1.00 23.42 H new ATOM 0 HG23 VAL A 78 16.690 -84.738 -11.148 1.00 23.42 H new ATOM 1158 N GLN A 79 20.377 -88.063 -12.405 1.00 61.04 N ATOM 1159 CA GLN A 79 21.325 -89.166 -12.267 1.00 72.34 C ATOM 1160 C GLN A 79 22.741 -88.604 -12.160 1.00 51.25 C ATOM 1161 O GLN A 79 23.124 -87.735 -12.949 1.00 1.41 O ATOM 1162 CB GLN A 79 21.243 -90.102 -13.488 1.00 75.34 C ATOM 1163 CG GLN A 79 19.846 -90.246 -14.084 1.00 65.40 C ATOM 1164 CD GLN A 79 19.828 -91.074 -15.360 1.00 13.34 C ATOM 1165 OE1 GLN A 79 19.045 -90.814 -16.271 1.00 12.03 O ATOM 1166 NE2 GLN A 79 20.674 -92.091 -15.429 1.00 41.24 N ATOM 0 H GLN A 79 20.666 -87.351 -13.076 1.00 61.04 H new ATOM 0 HA GLN A 79 21.078 -89.732 -11.369 1.00 72.34 H new ATOM 0 HB2 GLN A 79 21.917 -89.731 -14.260 1.00 75.34 H new ATOM 0 HB3 GLN A 79 21.604 -91.089 -13.198 1.00 75.34 H new ATOM 0 HG2 GLN A 79 19.189 -90.708 -13.348 1.00 65.40 H new ATOM 0 HG3 GLN A 79 19.442 -89.255 -14.294 1.00 65.40 H new ATOM 0 HE21 GLN A 79 21.310 -92.278 -14.654 1.00 41.24 H new ATOM 0 HE22 GLN A 79 20.689 -92.687 -16.257 1.00 41.24 H new ATOM 1175 N GLY A 80 23.504 -89.082 -11.182 1.00 73.20 N ATOM 1176 CA GLY A 80 24.891 -88.666 -11.036 1.00 70.11 C ATOM 1177 C GLY A 80 25.428 -88.961 -9.650 1.00 45.11 C ATOM 1178 O GLY A 80 24.887 -89.820 -8.953 1.00 30.00 O ATOM 0 H GLY A 80 23.186 -89.754 -10.483 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.503 -89.178 -11.779 1.00 70.11 H new ATOM 0 HA3 GLY A 80 24.972 -87.598 -11.237 1.00 70.11 H new ATOM 1182 N PRO A 81 26.510 -88.281 -9.227 1.00 21.24 N ATOM 1183 CA PRO A 81 27.036 -88.410 -7.865 1.00 24.25 C ATOM 1184 C PRO A 81 26.098 -87.770 -6.840 1.00 43.11 C ATOM 1185 O PRO A 81 25.599 -86.663 -7.055 1.00 61.12 O ATOM 1186 CB PRO A 81 28.377 -87.666 -7.916 1.00 14.12 C ATOM 1187 CG PRO A 81 28.245 -86.710 -9.059 1.00 1.43 C ATOM 1188 CD PRO A 81 27.309 -87.353 -10.051 1.00 73.32 C ATOM 0 HA PRO A 81 27.139 -89.451 -7.558 1.00 24.25 H new ATOM 0 HB2 PRO A 81 28.572 -87.140 -6.982 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.206 -88.356 -8.072 1.00 14.12 H new ATOM 0 HG2 PRO A 81 27.851 -85.752 -8.720 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.216 -86.513 -9.514 1.00 1.43 H new ATOM 0 HD2 PRO A 81 26.680 -86.613 -10.545 1.00 73.32 H new ATOM 0 HD3 PRO A 81 27.855 -87.881 -10.833 1.00 73.32 H new ATOM 1196 N LYS A 82 25.887 -88.462 -5.723 1.00 34.24 N ATOM 1197 CA LYS A 82 24.926 -88.046 -4.699 1.00 65.22 C ATOM 1198 C LYS A 82 25.068 -86.569 -4.320 1.00 10.03 C ATOM 1199 O LYS A 82 24.073 -85.885 -4.079 1.00 13.55 O ATOM 1200 CB LYS A 82 25.047 -88.955 -3.454 1.00 54.13 C ATOM 1201 CG LYS A 82 26.481 -89.240 -2.979 1.00 14.43 C ATOM 1202 CD LYS A 82 27.089 -88.086 -2.182 1.00 71.14 C ATOM 1203 CE LYS A 82 28.488 -88.419 -1.670 1.00 51.01 C ATOM 1204 NZ LYS A 82 29.065 -87.312 -0.862 1.00 4.33 N ATOM 0 H LYS A 82 26.377 -89.328 -5.500 1.00 34.24 H new ATOM 0 HA LYS A 82 23.929 -88.158 -5.125 1.00 65.22 H new ATOM 0 HB2 LYS A 82 24.496 -88.494 -2.634 1.00 54.13 H new ATOM 0 HB3 LYS A 82 24.559 -89.905 -3.671 1.00 54.13 H new ATOM 0 HG2 LYS A 82 26.481 -90.139 -2.363 1.00 14.43 H new ATOM 0 HG3 LYS A 82 27.110 -89.447 -3.845 1.00 14.43 H new ATOM 0 HD2 LYS A 82 27.135 -87.196 -2.810 1.00 71.14 H new ATOM 0 HD3 LYS A 82 26.441 -87.847 -1.338 1.00 71.14 H new ATOM 0 HE2 LYS A 82 28.446 -89.325 -1.066 1.00 51.01 H new ATOM 0 HE3 LYS A 82 29.143 -88.630 -2.516 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 29.935 -87.640 -0.396 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 29.287 -86.508 -1.483 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 28.377 -87.013 -0.141 1.00 4.33 H new ATOM 1218 N GLU A 83 26.299 -86.077 -4.287 1.00 45.34 N ATOM 1219 CA GLU A 83 26.561 -84.698 -3.875 1.00 53.14 C ATOM 1220 C GLU A 83 26.077 -83.694 -4.924 1.00 41.52 C ATOM 1221 O GLU A 83 25.524 -82.648 -4.577 1.00 1.31 O ATOM 1222 CB GLU A 83 28.049 -84.506 -3.560 1.00 53.44 C ATOM 1223 CG GLU A 83 28.993 -85.125 -4.577 1.00 34.25 C ATOM 1224 CD GLU A 83 30.449 -84.904 -4.213 1.00 42.22 C ATOM 1225 OE1 GLU A 83 31.019 -83.875 -4.628 1.00 53.32 O ATOM 1226 OE2 GLU A 83 31.023 -85.753 -3.496 1.00 25.22 O ATOM 0 H GLU A 83 27.133 -86.608 -4.539 1.00 45.34 H new ATOM 0 HA GLU A 83 25.993 -84.505 -2.965 1.00 53.14 H new ATOM 0 HB2 GLU A 83 28.258 -83.438 -3.492 1.00 53.44 H new ATOM 0 HB3 GLU A 83 28.258 -84.935 -2.580 1.00 53.44 H new ATOM 0 HG2 GLU A 83 28.796 -86.195 -4.649 1.00 34.25 H new ATOM 0 HG3 GLU A 83 28.797 -84.698 -5.560 1.00 34.25 H new ATOM 1233 N GLN A 84 26.273 -84.014 -6.200 1.00 71.32 N ATOM 1234 CA GLN A 84 25.820 -83.141 -7.284 1.00 73.41 C ATOM 1235 C GLN A 84 24.303 -83.243 -7.451 1.00 4.41 C ATOM 1236 O GLN A 84 23.640 -82.259 -7.776 1.00 35.12 O ATOM 1237 CB GLN A 84 26.548 -83.466 -8.599 1.00 70.43 C ATOM 1238 CG GLN A 84 27.937 -82.829 -8.719 1.00 43.51 C ATOM 1239 CD GLN A 84 28.927 -83.297 -7.661 1.00 53.33 C ATOM 1240 OE1 GLN A 84 29.655 -84.271 -7.859 1.00 64.14 O ATOM 1241 NE2 GLN A 84 28.973 -82.606 -6.533 1.00 5.13 N ATOM 0 H GLN A 84 26.740 -84.866 -6.510 1.00 71.32 H new ATOM 0 HA GLN A 84 26.066 -82.112 -7.021 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.647 -84.548 -8.689 1.00 70.43 H new ATOM 0 HB3 GLN A 84 25.933 -83.131 -9.435 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.343 -83.051 -9.706 1.00 43.51 H new ATOM 0 HG3 GLN A 84 27.835 -81.746 -8.653 1.00 43.51 H new ATOM 0 HE21 GLN A 84 28.356 -81.804 -6.401 1.00 5.13 H new ATOM 0 HE22 GLN A 84 29.625 -82.875 -5.796 1.00 5.13 H new ATOM 1250 N VAL A 85 23.761 -84.438 -7.224 1.00 33.13 N ATOM 1251 CA VAL A 85 22.311 -84.630 -7.167 1.00 22.34 C ATOM 1252 C VAL A 85 21.738 -83.770 -6.034 1.00 73.43 C ATOM 1253 O VAL A 85 20.691 -83.129 -6.173 1.00 53.31 O ATOM 1254 CB VAL A 85 21.953 -86.126 -6.928 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.443 -86.332 -6.832 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.546 -87.004 -8.031 1.00 25.24 C ATOM 0 H VAL A 85 24.303 -85.289 -7.076 1.00 33.13 H new ATOM 0 HA VAL A 85 21.878 -84.329 -8.121 1.00 22.34 H new ATOM 0 HB VAL A 85 22.389 -86.422 -5.974 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.230 -87.388 -6.665 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.048 -85.746 -6.002 1.00 71.00 H new ATOM 0 HG13 VAL A 85 19.972 -86.009 -7.760 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.285 -88.046 -7.846 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.146 -86.695 -8.997 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.631 -86.897 -8.037 1.00 25.24 H new ATOM 1266 N ASP A 86 22.463 -83.742 -4.919 1.00 15.30 N ATOM 1267 CA ASP A 86 22.113 -82.898 -3.779 1.00 63.23 C ATOM 1268 C ASP A 86 22.223 -81.419 -4.162 1.00 64.31 C ATOM 1269 O ASP A 86 21.430 -80.587 -3.723 1.00 72.04 O ATOM 1270 CB ASP A 86 23.020 -83.216 -2.583 1.00 35.40 C ATOM 1271 CG ASP A 86 22.710 -82.365 -1.362 1.00 14.31 C ATOM 1272 OD1 ASP A 86 21.816 -82.745 -0.575 1.00 61.35 O ATOM 1273 OD2 ASP A 86 23.372 -81.323 -1.174 1.00 32.10 O ATOM 0 H ASP A 86 23.305 -84.300 -4.780 1.00 15.30 H new ATOM 0 HA ASP A 86 21.082 -83.104 -3.492 1.00 63.23 H new ATOM 0 HB2 ASP A 86 22.913 -84.269 -2.322 1.00 35.40 H new ATOM 0 HB3 ASP A 86 24.060 -83.063 -2.871 1.00 35.40 H new ATOM 1278 N ALA A 87 23.206 -81.097 -4.997 1.00 21.34 N ATOM 1279 CA ALA A 87 23.346 -79.744 -5.526 1.00 34.53 C ATOM 1280 C ALA A 87 22.118 -79.375 -6.351 1.00 20.20 C ATOM 1281 O ALA A 87 21.608 -78.249 -6.280 1.00 62.15 O ATOM 1282 CB ALA A 87 24.607 -79.634 -6.373 1.00 10.13 C ATOM 0 H ALA A 87 23.916 -81.753 -5.322 1.00 21.34 H new ATOM 0 HA ALA A 87 23.429 -79.048 -4.691 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.698 -78.619 -6.761 1.00 10.13 H new ATOM 0 HB2 ALA A 87 25.478 -79.868 -5.761 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.549 -80.336 -7.205 1.00 10.13 H new ATOM 1288 N PHE A 88 21.641 -80.345 -7.121 1.00 23.24 N ATOM 1289 CA PHE A 88 20.490 -80.147 -7.983 1.00 53.22 C ATOM 1290 C PHE A 88 19.221 -79.959 -7.148 1.00 41.43 C ATOM 1291 O PHE A 88 18.365 -79.146 -7.494 1.00 24.23 O ATOM 1292 CB PHE A 88 20.333 -81.333 -8.946 1.00 13.44 C ATOM 1293 CG PHE A 88 19.534 -81.003 -10.183 1.00 60.45 C ATOM 1294 CD1 PHE A 88 18.147 -81.060 -10.181 1.00 41.43 C ATOM 1295 CD2 PHE A 88 20.181 -80.628 -11.353 1.00 2.04 C ATOM 1296 CE1 PHE A 88 17.425 -80.752 -11.320 1.00 43.45 C ATOM 1297 CE2 PHE A 88 19.463 -80.319 -12.491 1.00 65.45 C ATOM 1298 CZ PHE A 88 18.084 -80.381 -12.476 1.00 72.11 C ATOM 0 H PHE A 88 22.040 -81.283 -7.164 1.00 23.24 H new ATOM 0 HA PHE A 88 20.649 -79.244 -8.572 1.00 53.22 H new ATOM 0 HB2 PHE A 88 21.322 -81.682 -9.244 1.00 13.44 H new ATOM 0 HB3 PHE A 88 19.850 -82.156 -8.420 1.00 13.44 H new ATOM 0 HD1 PHE A 88 17.626 -81.348 -9.280 1.00 41.43 H new ATOM 0 HD2 PHE A 88 21.260 -80.577 -11.373 1.00 2.04 H new ATOM 0 HE1 PHE A 88 16.346 -80.802 -11.305 1.00 43.45 H new ATOM 0 HE2 PHE A 88 19.980 -80.029 -13.393 1.00 65.45 H new ATOM 0 HZ PHE A 88 17.522 -80.140 -13.366 1.00 72.11 H new ATOM 1308 N VAL A 89 19.100 -80.703 -6.046 1.00 5.13 N ATOM 1309 CA VAL A 89 17.933 -80.560 -5.175 1.00 63.22 C ATOM 1310 C VAL A 89 17.967 -79.207 -4.457 1.00 22.42 C ATOM 1311 O VAL A 89 16.922 -78.596 -4.226 1.00 63.11 O ATOM 1312 CB VAL A 89 17.777 -81.727 -4.156 1.00 62.24 C ATOM 1313 CG1 VAL A 89 18.786 -81.635 -3.016 1.00 41.30 C ATOM 1314 CG2 VAL A 89 16.350 -81.778 -3.613 1.00 71.34 C ATOM 0 H VAL A 89 19.782 -81.397 -5.740 1.00 5.13 H new ATOM 0 HA VAL A 89 17.055 -80.604 -5.819 1.00 63.22 H new ATOM 0 HB VAL A 89 17.983 -82.654 -4.691 1.00 62.24 H new ATOM 0 HG11 VAL A 89 18.638 -82.470 -2.331 1.00 41.30 H new ATOM 0 HG12 VAL A 89 19.797 -81.673 -3.421 1.00 41.30 H new ATOM 0 HG13 VAL A 89 18.645 -80.697 -2.480 1.00 41.30 H new ATOM 0 HG21 VAL A 89 16.260 -82.600 -2.903 1.00 71.34 H new ATOM 0 HG22 VAL A 89 16.117 -80.838 -3.112 1.00 71.34 H new ATOM 0 HG23 VAL A 89 15.653 -81.932 -4.436 1.00 71.34 H new ATOM 1324 N LYS A 90 19.171 -78.737 -4.107 1.00 72.24 N ATOM 1325 CA LYS A 90 19.337 -77.378 -3.581 1.00 63.21 C ATOM 1326 C LYS A 90 18.812 -76.366 -4.597 1.00 31.12 C ATOM 1327 O LYS A 90 18.059 -75.453 -4.253 1.00 14.12 O ATOM 1328 CB LYS A 90 20.809 -77.079 -3.258 1.00 12.24 C ATOM 1329 CG LYS A 90 21.345 -77.833 -2.045 1.00 73.32 C ATOM 1330 CD LYS A 90 22.794 -77.467 -1.737 1.00 40.24 C ATOM 1331 CE LYS A 90 23.302 -78.164 -0.479 1.00 1.53 C ATOM 1332 NZ LYS A 90 24.736 -77.873 -0.224 1.00 60.33 N ATOM 0 H LYS A 90 20.036 -79.272 -4.178 1.00 72.24 H new ATOM 0 HA LYS A 90 18.767 -77.299 -2.655 1.00 63.21 H new ATOM 0 HB2 LYS A 90 21.419 -77.329 -4.126 1.00 12.24 H new ATOM 0 HB3 LYS A 90 20.922 -76.009 -3.086 1.00 12.24 H new ATOM 0 HG2 LYS A 90 20.723 -77.612 -1.177 1.00 73.32 H new ATOM 0 HG3 LYS A 90 21.273 -78.906 -2.224 1.00 73.32 H new ATOM 0 HD2 LYS A 90 23.425 -77.740 -2.583 1.00 40.24 H new ATOM 0 HD3 LYS A 90 22.877 -76.387 -1.612 1.00 40.24 H new ATOM 0 HE2 LYS A 90 22.709 -77.844 0.378 1.00 1.53 H new ATOM 0 HE3 LYS A 90 23.162 -79.240 -0.579 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 25.042 -78.365 0.640 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 25.305 -78.201 -1.030 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 24.866 -76.848 -0.103 1.00 60.33 H new ATOM 1346 N TYR A 91 19.215 -76.551 -5.850 1.00 10.11 N ATOM 1347 CA TYR A 91 18.709 -75.749 -6.963 1.00 12.44 C ATOM 1348 C TYR A 91 17.181 -75.834 -7.036 1.00 44.40 C ATOM 1349 O TYR A 91 16.492 -74.822 -7.187 1.00 2.03 O ATOM 1350 CB TYR A 91 19.355 -76.240 -8.271 1.00 54.24 C ATOM 1351 CG TYR A 91 18.576 -75.927 -9.540 1.00 52.31 C ATOM 1352 CD1 TYR A 91 18.555 -74.644 -10.077 1.00 71.31 C ATOM 1353 CD2 TYR A 91 17.880 -76.930 -10.213 1.00 52.30 C ATOM 1354 CE1 TYR A 91 17.864 -74.371 -11.242 1.00 23.41 C ATOM 1355 CE2 TYR A 91 17.185 -76.661 -11.375 1.00 24.51 C ATOM 1356 CZ TYR A 91 17.180 -75.382 -11.886 1.00 4.44 C ATOM 1357 OH TYR A 91 16.497 -75.116 -13.051 1.00 53.33 O ATOM 0 H TYR A 91 19.898 -77.257 -6.124 1.00 10.11 H new ATOM 0 HA TYR A 91 18.972 -74.702 -6.809 1.00 12.44 H new ATOM 0 HB2 TYR A 91 20.347 -75.797 -8.355 1.00 54.24 H new ATOM 0 HB3 TYR A 91 19.492 -77.319 -8.206 1.00 54.24 H new ATOM 0 HD1 TYR A 91 19.087 -73.849 -9.576 1.00 71.31 H new ATOM 0 HD2 TYR A 91 17.885 -77.935 -9.818 1.00 52.30 H new ATOM 0 HE1 TYR A 91 17.859 -73.370 -11.647 1.00 23.41 H new ATOM 0 HE2 TYR A 91 16.648 -77.450 -11.881 1.00 24.51 H new ATOM 0 HH TYR A 91 16.366 -74.149 -13.140 1.00 53.33 H new ATOM 1367 N LEU A 92 16.666 -77.048 -6.899 1.00 51.34 N ATOM 1368 CA LEU A 92 15.233 -77.304 -6.983 1.00 60.14 C ATOM 1369 C LEU A 92 14.495 -76.622 -5.826 1.00 5.34 C ATOM 1370 O LEU A 92 13.345 -76.212 -5.967 1.00 21.55 O ATOM 1371 CB LEU A 92 14.968 -78.825 -6.972 1.00 42.10 C ATOM 1372 CG LEU A 92 13.934 -79.333 -7.994 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.566 -78.702 -7.754 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.417 -79.071 -9.419 1.00 4.50 C ATOM 0 H LEU A 92 17.227 -77.882 -6.727 1.00 51.34 H new ATOM 0 HA LEU A 92 14.857 -76.888 -7.918 1.00 60.14 H new ATOM 0 HB2 LEU A 92 15.912 -79.340 -7.151 1.00 42.10 H new ATOM 0 HB3 LEU A 92 14.634 -79.109 -5.974 1.00 42.10 H new ATOM 0 HG LEU A 92 13.827 -80.410 -7.862 1.00 14.12 H new ATOM 0 HD11 LEU A 92 11.857 -79.080 -8.491 1.00 1.11 H new ATOM 0 HD12 LEU A 92 12.219 -78.956 -6.753 1.00 1.11 H new ATOM 0 HD13 LEU A 92 12.644 -77.619 -7.847 1.00 1.11 H new ATOM 0 HD21 LEU A 92 13.674 -79.436 -10.128 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.561 -78.000 -9.563 1.00 4.50 H new ATOM 0 HD23 LEU A 92 15.362 -79.589 -9.584 1.00 4.50 H new ATOM 1386 N HIS A 93 15.170 -76.503 -4.682 1.00 5.42 N ATOM 1387 CA HIS A 93 14.575 -75.883 -3.494 1.00 23.34 C ATOM 1388 C HIS A 93 14.301 -74.397 -3.723 1.00 11.23 C ATOM 1389 O HIS A 93 13.474 -73.796 -3.033 1.00 14.15 O ATOM 1390 CB HIS A 93 15.475 -76.072 -2.263 1.00 35.40 C ATOM 1391 CG HIS A 93 15.526 -77.487 -1.768 1.00 30.45 C ATOM 1392 ND1 HIS A 93 16.561 -77.992 -1.006 1.00 2.31 N ATOM 1393 CD2 HIS A 93 14.648 -78.507 -1.925 1.00 73.34 C ATOM 1394 CE1 HIS A 93 16.317 -79.258 -0.725 1.00 65.23 C ATOM 1395 NE2 HIS A 93 15.167 -79.592 -1.270 1.00 2.30 N ATOM 0 H HIS A 93 16.128 -76.827 -4.551 1.00 5.42 H new ATOM 0 HA HIS A 93 13.624 -76.382 -3.308 1.00 23.34 H new ATOM 0 HB2 HIS A 93 16.485 -75.745 -2.508 1.00 35.40 H new ATOM 0 HB3 HIS A 93 15.118 -75.428 -1.460 1.00 35.40 H new ATOM 0 HD2 HIS A 93 13.714 -78.471 -2.466 1.00 73.34 H new ATOM 0 HE1 HIS A 93 16.954 -79.910 -0.145 1.00 65.23 H new ATOM 0 HE2 HIS A 93 14.731 -80.513 -1.214 1.00 2.30 H new ATOM 1404 N LYS A 94 14.995 -73.804 -4.690 1.00 64.43 N ATOM 1405 CA LYS A 94 14.739 -72.419 -5.069 1.00 13.01 C ATOM 1406 C LYS A 94 13.412 -72.336 -5.818 1.00 4.10 C ATOM 1407 O LYS A 94 12.733 -71.305 -5.806 1.00 53.20 O ATOM 1408 CB LYS A 94 15.885 -71.876 -5.936 1.00 13.44 C ATOM 1409 CG LYS A 94 15.706 -70.417 -6.361 1.00 34.11 C ATOM 1410 CD LYS A 94 15.507 -69.494 -5.160 1.00 31.12 C ATOM 1411 CE LYS A 94 15.319 -68.042 -5.581 1.00 75.41 C ATOM 1412 NZ LYS A 94 14.998 -67.169 -4.422 1.00 1.31 N ATOM 0 H LYS A 94 15.736 -74.259 -5.223 1.00 64.43 H new ATOM 0 HA LYS A 94 14.680 -71.806 -4.169 1.00 13.01 H new ATOM 0 HB2 LYS A 94 16.820 -71.971 -5.385 1.00 13.44 H new ATOM 0 HB3 LYS A 94 15.977 -72.495 -6.828 1.00 13.44 H new ATOM 0 HG2 LYS A 94 16.580 -70.094 -6.926 1.00 34.11 H new ATOM 0 HG3 LYS A 94 14.847 -70.336 -7.027 1.00 34.11 H new ATOM 0 HD2 LYS A 94 14.637 -69.822 -4.591 1.00 31.12 H new ATOM 0 HD3 LYS A 94 16.369 -69.571 -4.497 1.00 31.12 H new ATOM 0 HE2 LYS A 94 16.227 -67.684 -6.066 1.00 75.41 H new ATOM 0 HE3 LYS A 94 14.518 -67.978 -6.317 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 14.877 -66.189 -4.748 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 14.118 -67.496 -3.975 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 15.774 -67.211 -3.731 1.00 1.31 H new ATOM 1426 N GLY A 95 13.044 -73.446 -6.453 1.00 31.54 N ATOM 1427 CA GLY A 95 11.790 -73.530 -7.171 1.00 21.24 C ATOM 1428 C GLY A 95 11.742 -72.605 -8.365 1.00 10.52 C ATOM 1429 O GLY A 95 12.004 -73.019 -9.492 1.00 3.03 O ATOM 0 H GLY A 95 13.603 -74.298 -6.481 1.00 31.54 H new ATOM 0 HA2 GLY A 95 11.634 -74.556 -7.504 1.00 21.24 H new ATOM 0 HA3 GLY A 95 10.971 -73.287 -6.494 1.00 21.24 H new ATOM 1433 N SER A 96 11.417 -71.346 -8.117 1.00 75.45 N ATOM 1434 CA SER A 96 11.312 -70.350 -9.170 1.00 64.44 C ATOM 1435 C SER A 96 11.557 -68.954 -8.595 1.00 73.22 C ATOM 1436 O SER A 96 10.762 -68.461 -7.799 1.00 41.20 O ATOM 1437 CB SER A 96 9.927 -70.417 -9.838 1.00 73.31 C ATOM 1438 OG SER A 96 9.674 -71.701 -10.385 1.00 75.44 O ATOM 0 H SER A 96 11.219 -70.987 -7.183 1.00 75.45 H new ATOM 0 HA SER A 96 12.069 -70.558 -9.926 1.00 64.44 H new ATOM 0 HB2 SER A 96 9.157 -70.174 -9.106 1.00 73.31 H new ATOM 0 HB3 SER A 96 9.865 -69.666 -10.626 1.00 73.31 H new ATOM 0 HG SER A 96 8.786 -71.711 -10.800 1.00 75.44 H new ATOM 1444 N PRO A 97 12.660 -68.288 -8.994 1.00 15.32 N ATOM 1445 CA PRO A 97 13.014 -66.954 -8.476 1.00 63.34 C ATOM 1446 C PRO A 97 12.018 -65.870 -8.900 1.00 3.15 C ATOM 1447 O PRO A 97 12.131 -64.713 -8.485 1.00 13.01 O ATOM 1448 CB PRO A 97 14.401 -66.690 -9.089 1.00 53.52 C ATOM 1449 CG PRO A 97 14.445 -67.544 -10.311 1.00 13.42 C ATOM 1450 CD PRO A 97 13.653 -68.779 -9.974 1.00 51.42 C ATOM 0 HA PRO A 97 13.003 -66.927 -7.386 1.00 63.34 H new ATOM 0 HB2 PRO A 97 14.530 -65.637 -9.338 1.00 53.52 H new ATOM 0 HB3 PRO A 97 15.198 -66.953 -8.393 1.00 53.52 H new ATOM 0 HG2 PRO A 97 14.015 -67.025 -11.167 1.00 13.42 H new ATOM 0 HG3 PRO A 97 15.472 -67.797 -10.575 1.00 13.42 H new ATOM 0 HD2 PRO A 97 13.173 -69.202 -10.856 1.00 51.42 H new ATOM 0 HD3 PRO A 97 14.285 -69.559 -9.550 1.00 51.42 H new ATOM 1458 N LYS A 98 11.050 -66.246 -9.732 1.00 53.54 N ATOM 1459 CA LYS A 98 10.042 -65.310 -10.218 1.00 24.34 C ATOM 1460 C LYS A 98 8.630 -65.774 -9.833 1.00 74.31 C ATOM 1461 O LYS A 98 7.646 -65.090 -10.120 1.00 21.32 O ATOM 1462 CB LYS A 98 10.160 -65.159 -11.749 1.00 51.22 C ATOM 1463 CG LYS A 98 9.242 -64.090 -12.342 1.00 43.41 C ATOM 1464 CD LYS A 98 9.634 -62.687 -11.879 1.00 31.02 C ATOM 1465 CE LYS A 98 8.490 -61.693 -12.048 1.00 2.21 C ATOM 1466 NZ LYS A 98 7.361 -61.997 -11.127 1.00 75.23 N ATOM 0 H LYS A 98 10.943 -67.197 -10.085 1.00 53.54 H new ATOM 0 HA LYS A 98 10.216 -64.341 -9.750 1.00 24.34 H new ATOM 0 HB2 LYS A 98 11.192 -64.917 -12.001 1.00 51.22 H new ATOM 0 HB3 LYS A 98 9.934 -66.117 -12.217 1.00 51.22 H new ATOM 0 HG2 LYS A 98 9.283 -64.139 -13.430 1.00 43.41 H new ATOM 0 HG3 LYS A 98 8.211 -64.294 -12.052 1.00 43.41 H new ATOM 0 HD2 LYS A 98 9.934 -62.721 -10.832 1.00 31.02 H new ATOM 0 HD3 LYS A 98 10.499 -62.345 -12.448 1.00 31.02 H new ATOM 0 HE2 LYS A 98 8.853 -60.683 -11.858 1.00 2.21 H new ATOM 0 HE3 LYS A 98 8.136 -61.716 -13.079 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 6.490 -62.135 -11.679 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 7.573 -62.863 -10.592 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 7.229 -61.205 -10.466 1.00 75.23 H new ATOM 1480 N SER A 99 8.532 -66.924 -9.162 1.00 22.33 N ATOM 1481 CA SER A 99 7.232 -67.524 -8.859 1.00 33.13 C ATOM 1482 C SER A 99 7.245 -68.225 -7.496 1.00 51.15 C ATOM 1483 O SER A 99 8.221 -68.132 -6.746 1.00 65.20 O ATOM 1484 CB SER A 99 6.850 -68.519 -9.967 1.00 24.15 C ATOM 1485 OG SER A 99 6.871 -67.898 -11.243 1.00 42.35 O ATOM 0 H SER A 99 9.333 -67.455 -8.820 1.00 22.33 H new ATOM 0 HA SER A 99 6.489 -66.728 -8.815 1.00 33.13 H new ATOM 0 HB2 SER A 99 7.542 -69.361 -9.958 1.00 24.15 H new ATOM 0 HB3 SER A 99 5.856 -68.921 -9.772 1.00 24.15 H new ATOM 0 HG SER A 99 6.626 -68.553 -11.930 1.00 42.35 H new ATOM 1491 N VAL A 100 6.147 -68.915 -7.183 1.00 74.22 N ATOM 1492 CA VAL A 100 6.002 -69.633 -5.916 1.00 45.42 C ATOM 1493 C VAL A 100 5.782 -71.127 -6.167 1.00 51.00 C ATOM 1494 O VAL A 100 4.899 -71.512 -6.944 1.00 74.34 O ATOM 1495 CB VAL A 100 4.811 -69.077 -5.088 1.00 21.34 C ATOM 1496 CG1 VAL A 100 4.698 -69.791 -3.743 1.00 13.01 C ATOM 1497 CG2 VAL A 100 4.936 -67.565 -4.891 1.00 20.43 C ATOM 0 H VAL A 100 5.337 -68.992 -7.798 1.00 74.22 H new ATOM 0 HA VAL A 100 6.923 -69.488 -5.352 1.00 45.42 H new ATOM 0 HB VAL A 100 3.897 -69.269 -5.650 1.00 21.34 H new ATOM 0 HG11 VAL A 100 3.856 -69.382 -3.184 1.00 13.01 H new ATOM 0 HG12 VAL A 100 4.540 -70.857 -3.909 1.00 13.01 H new ATOM 0 HG13 VAL A 100 5.617 -69.644 -3.175 1.00 13.01 H new ATOM 0 HG21 VAL A 100 4.089 -67.203 -4.308 1.00 20.43 H new ATOM 0 HG22 VAL A 100 5.862 -67.342 -4.362 1.00 20.43 H new ATOM 0 HG23 VAL A 100 4.946 -67.071 -5.863 1.00 20.43 H new ATOM 1507 N VAL A 101 6.591 -71.958 -5.518 1.00 73.33 N ATOM 1508 CA VAL A 101 6.437 -73.409 -5.579 1.00 33.12 C ATOM 1509 C VAL A 101 5.842 -73.917 -4.267 1.00 14.21 C ATOM 1510 O VAL A 101 6.279 -73.526 -3.182 1.00 71.23 O ATOM 1511 CB VAL A 101 7.779 -74.136 -5.870 1.00 1.53 C ATOM 1512 CG1 VAL A 101 8.273 -73.806 -7.278 1.00 0.11 C ATOM 1513 CG2 VAL A 101 8.839 -73.782 -4.827 1.00 23.20 C ATOM 0 H VAL A 101 7.369 -71.647 -4.937 1.00 73.33 H new ATOM 0 HA VAL A 101 5.764 -73.633 -6.407 1.00 33.12 H new ATOM 0 HB VAL A 101 7.600 -75.209 -5.809 1.00 1.53 H new ATOM 0 HG11 VAL A 101 9.214 -74.324 -7.464 1.00 0.11 H new ATOM 0 HG12 VAL A 101 7.531 -74.128 -8.009 1.00 0.11 H new ATOM 0 HG13 VAL A 101 8.427 -72.731 -7.367 1.00 0.11 H new ATOM 0 HG21 VAL A 101 9.766 -74.306 -5.058 1.00 23.20 H new ATOM 0 HG22 VAL A 101 9.017 -72.707 -4.840 1.00 23.20 H new ATOM 0 HG23 VAL A 101 8.490 -74.080 -3.838 1.00 23.20 H new ATOM 1523 N LYS A 102 4.835 -74.766 -4.375 1.00 25.24 N ATOM 1524 CA LYS A 102 4.105 -75.262 -3.214 1.00 22.23 C ATOM 1525 C LYS A 102 4.922 -76.302 -2.442 1.00 52.51 C ATOM 1526 O LYS A 102 5.085 -76.194 -1.225 1.00 64.20 O ATOM 1527 CB LYS A 102 2.757 -75.850 -3.660 1.00 14.41 C ATOM 1528 CG LYS A 102 1.964 -76.511 -2.538 1.00 2.24 C ATOM 1529 CD LYS A 102 0.544 -76.897 -2.966 1.00 35.55 C ATOM 1530 CE LYS A 102 0.520 -77.818 -4.190 1.00 34.44 C ATOM 1531 NZ LYS A 102 0.604 -77.065 -5.475 1.00 11.03 N ATOM 0 H LYS A 102 4.499 -75.132 -5.266 1.00 25.24 H new ATOM 0 HA LYS A 102 3.923 -74.426 -2.539 1.00 22.23 H new ATOM 0 HB2 LYS A 102 2.153 -75.055 -4.098 1.00 14.41 H new ATOM 0 HB3 LYS A 102 2.935 -76.584 -4.446 1.00 14.41 H new ATOM 0 HG2 LYS A 102 2.493 -77.403 -2.201 1.00 2.24 H new ATOM 0 HG3 LYS A 102 1.911 -75.832 -1.687 1.00 2.24 H new ATOM 0 HD2 LYS A 102 0.041 -77.392 -2.135 1.00 35.55 H new ATOM 0 HD3 LYS A 102 -0.022 -75.992 -3.187 1.00 35.55 H new ATOM 0 HE2 LYS A 102 1.352 -78.519 -4.129 1.00 34.44 H new ATOM 0 HE3 LYS A 102 -0.396 -78.408 -4.178 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 0.159 -77.621 -6.233 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 0.110 -76.155 -5.377 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 1.602 -76.893 -5.712 1.00 11.03 H new ATOM 1545 N LYS A 103 5.446 -77.299 -3.151 1.00 12.03 N ATOM 1546 CA LYS A 103 6.186 -78.389 -2.512 1.00 72.44 C ATOM 1547 C LYS A 103 7.085 -79.116 -3.509 1.00 14.24 C ATOM 1548 O LYS A 103 6.697 -79.343 -4.653 1.00 53.50 O ATOM 1549 CB LYS A 103 5.204 -79.396 -1.890 1.00 61.22 C ATOM 1550 CG LYS A 103 5.873 -80.652 -1.334 1.00 3.35 C ATOM 1551 CD LYS A 103 4.850 -81.695 -0.892 1.00 22.31 C ATOM 1552 CE LYS A 103 5.516 -82.996 -0.463 1.00 15.43 C ATOM 1553 NZ LYS A 103 4.520 -84.013 -0.038 1.00 35.52 N ATOM 0 H LYS A 103 5.373 -77.376 -4.165 1.00 12.03 H new ATOM 0 HA LYS A 103 6.814 -77.951 -1.736 1.00 72.44 H new ATOM 0 HB2 LYS A 103 4.654 -78.904 -1.088 1.00 61.22 H new ATOM 0 HB3 LYS A 103 4.473 -79.689 -2.644 1.00 61.22 H new ATOM 0 HG2 LYS A 103 6.525 -81.083 -2.094 1.00 3.35 H new ATOM 0 HG3 LYS A 103 6.505 -80.382 -0.488 1.00 3.35 H new ATOM 0 HD2 LYS A 103 4.261 -81.298 -0.065 1.00 22.31 H new ATOM 0 HD3 LYS A 103 4.157 -81.894 -1.710 1.00 22.31 H new ATOM 0 HE2 LYS A 103 6.108 -83.390 -1.289 1.00 15.43 H new ATOM 0 HE3 LYS A 103 6.206 -82.798 0.358 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 5.013 -84.884 0.246 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 3.972 -83.647 0.766 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 3.877 -84.221 -0.829 1.00 35.52 H new ATOM 1567 N VAL A 104 8.279 -79.485 -3.057 1.00 20.25 N ATOM 1568 CA VAL A 104 9.196 -80.311 -3.842 1.00 63.52 C ATOM 1569 C VAL A 104 9.113 -81.768 -3.373 1.00 23.40 C ATOM 1570 O VAL A 104 8.975 -82.034 -2.175 1.00 41.12 O ATOM 1571 CB VAL A 104 10.655 -79.794 -3.728 1.00 12.25 C ATOM 1572 CG1 VAL A 104 11.120 -79.759 -2.272 1.00 24.45 C ATOM 1573 CG2 VAL A 104 11.602 -80.633 -4.586 1.00 13.11 C ATOM 0 H VAL A 104 8.639 -79.222 -2.140 1.00 20.25 H new ATOM 0 HA VAL A 104 8.900 -80.251 -4.889 1.00 63.52 H new ATOM 0 HB VAL A 104 10.675 -78.772 -4.106 1.00 12.25 H new ATOM 0 HG11 VAL A 104 12.146 -79.392 -2.226 1.00 24.45 H new ATOM 0 HG12 VAL A 104 10.472 -79.096 -1.699 1.00 24.45 H new ATOM 0 HG13 VAL A 104 11.075 -80.764 -1.851 1.00 24.45 H new ATOM 0 HG21 VAL A 104 12.618 -80.250 -4.488 1.00 13.11 H new ATOM 0 HG22 VAL A 104 11.572 -81.670 -4.253 1.00 13.11 H new ATOM 0 HG23 VAL A 104 11.292 -80.578 -5.630 1.00 13.11 H new ATOM 1583 N SER A 105 9.188 -82.707 -4.314 1.00 70.15 N ATOM 1584 CA SER A 105 9.035 -84.120 -4.006 1.00 14.10 C ATOM 1585 C SER A 105 10.072 -84.928 -4.778 1.00 74.04 C ATOM 1586 O SER A 105 10.419 -84.580 -5.910 1.00 24.02 O ATOM 1587 CB SER A 105 7.617 -84.583 -4.361 1.00 4.52 C ATOM 1588 OG SER A 105 6.639 -83.790 -3.706 1.00 72.03 O ATOM 0 H SER A 105 9.355 -82.509 -5.301 1.00 70.15 H new ATOM 0 HA SER A 105 9.192 -84.277 -2.939 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.472 -84.526 -5.440 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.491 -85.628 -4.077 1.00 4.52 H new ATOM 0 HG SER A 105 5.744 -84.106 -3.951 1.00 72.03 H new ATOM 1594 N ILE A 106 10.576 -85.992 -4.165 1.00 60.24 N ATOM 1595 CA ILE A 106 11.588 -86.834 -4.791 1.00 10.30 C ATOM 1596 C ILE A 106 11.104 -88.289 -4.813 1.00 61.14 C ATOM 1597 O ILE A 106 10.240 -88.667 -4.017 1.00 52.41 O ATOM 1598 CB ILE A 106 12.947 -86.742 -4.038 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.272 -85.285 -3.643 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.063 -87.306 -4.911 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.525 -84.364 -4.820 1.00 61.02 C ATOM 0 H ILE A 106 10.299 -86.293 -3.231 1.00 60.24 H new ATOM 0 HA ILE A 106 11.743 -86.480 -5.810 1.00 10.30 H new ATOM 0 HB ILE A 106 12.868 -87.330 -3.124 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.445 -84.887 -3.055 1.00 61.14 H new ATOM 0 HG13 ILE A 106 14.151 -85.283 -2.999 1.00 61.14 H new ATOM 0 HG21 ILE A 106 15.011 -87.238 -4.378 1.00 61.45 H new ATOM 0 HG22 ILE A 106 13.851 -88.350 -5.144 1.00 61.45 H new ATOM 0 HG23 ILE A 106 14.126 -86.734 -5.836 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.746 -83.361 -4.456 1.00 61.02 H new ATOM 0 HD12 ILE A 106 14.372 -84.735 -5.397 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.639 -84.333 -5.455 1.00 61.02 H new ATOM 1613 N HIS A 107 11.641 -89.101 -5.727 1.00 62.33 N ATOM 1614 CA HIS A 107 11.252 -90.511 -5.826 1.00 42.21 C ATOM 1615 C HIS A 107 12.495 -91.399 -5.957 1.00 3.14 C ATOM 1616 O HIS A 107 13.482 -91.019 -6.587 1.00 44.31 O ATOM 1617 CB HIS A 107 10.302 -90.732 -7.012 1.00 1.15 C ATOM 1618 CG HIS A 107 9.579 -92.050 -6.980 1.00 52.33 C ATOM 1619 ND1 HIS A 107 9.992 -93.155 -7.691 1.00 63.51 N ATOM 1620 CD2 HIS A 107 8.456 -92.431 -6.321 1.00 51.43 C ATOM 1621 CE1 HIS A 107 9.161 -94.157 -7.470 1.00 61.40 C ATOM 1622 NE2 HIS A 107 8.222 -93.744 -6.644 1.00 21.31 N ATOM 0 H HIS A 107 12.343 -88.809 -6.406 1.00 62.33 H new ATOM 0 HA HIS A 107 10.724 -90.787 -4.913 1.00 42.21 H new ATOM 0 HB2 HIS A 107 9.567 -89.927 -7.031 1.00 1.15 H new ATOM 0 HB3 HIS A 107 10.872 -90.665 -7.938 1.00 1.15 H new ATOM 0 HD2 HIS A 107 7.858 -91.816 -5.665 1.00 51.43 H new ATOM 0 HE1 HIS A 107 9.238 -95.147 -7.894 1.00 61.40 H new ATOM 0 HE2 HIS A 107 7.446 -94.309 -6.300 1.00 21.31 H new ATOM 1631 N ALA A 108 12.387 -92.597 -5.392 1.00 62.21 N ATOM 1632 CA ALA A 108 13.504 -93.533 -5.197 1.00 71.54 C ATOM 1633 C ALA A 108 13.968 -94.246 -6.475 1.00 51.20 C ATOM 1634 O ALA A 108 14.789 -95.165 -6.399 1.00 13.21 O ATOM 1635 CB ALA A 108 13.133 -94.557 -4.132 1.00 1.01 C ATOM 0 H ALA A 108 11.499 -92.960 -5.046 1.00 62.21 H new ATOM 0 HA ALA A 108 14.352 -92.928 -4.875 1.00 71.54 H new ATOM 0 HB1 ALA A 108 13.962 -95.250 -3.989 1.00 1.01 H new ATOM 0 HB2 ALA A 108 12.922 -94.045 -3.193 1.00 1.01 H new ATOM 0 HB3 ALA A 108 12.249 -95.110 -4.451 1.00 1.01 H new ATOM 1641 N SER A 109 13.429 -93.872 -7.632 1.00 22.12 N ATOM 1642 CA SER A 109 13.633 -94.649 -8.857 1.00 13.31 C ATOM 1643 C SER A 109 15.118 -94.751 -9.222 1.00 70.35 C ATOM 1644 O SER A 109 15.838 -93.755 -9.262 1.00 20.01 O ATOM 1645 CB SER A 109 12.873 -93.999 -10.015 1.00 75.32 C ATOM 1646 OG SER A 109 11.479 -93.956 -9.751 1.00 74.32 O ATOM 0 H SER A 109 12.850 -93.041 -7.750 1.00 22.12 H new ATOM 0 HA SER A 109 13.256 -95.656 -8.677 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.247 -92.988 -10.178 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.055 -94.558 -10.933 1.00 75.32 H new ATOM 0 HG SER A 109 11.319 -93.471 -8.915 1.00 74.32 H new ATOM 1652 N SER A 110 15.546 -95.987 -9.488 1.00 53.15 N ATOM 1653 CA SER A 110 16.935 -96.304 -9.801 1.00 44.34 C ATOM 1654 C SER A 110 17.301 -95.817 -11.205 1.00 21.33 C ATOM 1655 O SER A 110 16.457 -95.263 -11.918 1.00 40.12 O ATOM 1656 CB SER A 110 17.169 -97.818 -9.674 1.00 20.12 C ATOM 1657 OG SER A 110 18.541 -98.149 -9.843 1.00 61.20 O ATOM 0 H SER A 110 14.931 -96.800 -9.491 1.00 53.15 H new ATOM 0 HA SER A 110 17.579 -95.788 -9.089 1.00 44.34 H new ATOM 0 HB2 SER A 110 16.829 -98.159 -8.696 1.00 20.12 H new ATOM 0 HB3 SER A 110 16.572 -98.343 -10.420 1.00 20.12 H new ATOM 0 HG SER A 110 18.657 -99.118 -9.755 1.00 61.20 H new ATOM 1663 N ARG A 111 18.561 -96.038 -11.582 1.00 10.21 N ATOM 1664 CA ARG A 111 19.134 -95.509 -12.822 1.00 70.34 C ATOM 1665 C ARG A 111 18.208 -95.719 -14.022 1.00 33.55 C ATOM 1666 O ARG A 111 17.516 -96.733 -14.134 1.00 43.23 O ATOM 1667 CB ARG A 111 20.510 -96.152 -13.082 1.00 25.13 C ATOM 1668 CG ARG A 111 21.402 -95.381 -14.064 1.00 15.51 C ATOM 1669 CD ARG A 111 21.069 -95.645 -15.530 1.00 32.52 C ATOM 1670 NE ARG A 111 21.236 -97.047 -15.910 1.00 21.10 N ATOM 1671 CZ ARG A 111 20.812 -97.554 -17.071 1.00 63.31 C ATOM 1672 NH1 ARG A 111 20.170 -96.784 -17.943 1.00 42.52 N ATOM 1673 NH2 ARG A 111 21.027 -98.826 -17.365 1.00 12.12 N ATOM 0 H ARG A 111 19.217 -96.593 -11.033 1.00 10.21 H new ATOM 0 HA ARG A 111 19.255 -94.433 -12.697 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.036 -96.248 -12.132 1.00 25.13 H new ATOM 0 HB3 ARG A 111 20.358 -97.161 -13.465 1.00 25.13 H new ATOM 0 HG2 ARG A 111 21.308 -94.313 -13.866 1.00 15.51 H new ATOM 0 HG3 ARG A 111 22.443 -95.648 -13.883 1.00 15.51 H new ATOM 0 HD2 ARG A 111 20.040 -95.342 -15.723 1.00 32.52 H new ATOM 0 HD3 ARG A 111 21.708 -95.025 -16.159 1.00 32.52 H new ATOM 0 HE ARG A 111 21.702 -97.672 -15.252 1.00 21.10 H new ATOM 0 HH11 ARG A 111 19.999 -95.802 -17.727 1.00 42.52 H new ATOM 0 HH12 ARG A 111 19.848 -97.175 -18.828 1.00 42.52 H new ATOM 0 HH21 ARG A 111 21.519 -99.426 -16.703 1.00 12.12 H new ATOM 0 HH22 ARG A 111 20.700 -99.206 -18.253 1.00 12.12 H new ATOM 1687 N VAL A 112 18.235 -94.745 -14.925 1.00 42.33 N ATOM 1688 CA VAL A 112 17.390 -94.736 -16.121 1.00 22.53 C ATOM 1689 C VAL A 112 18.200 -94.228 -17.311 1.00 21.24 C ATOM 1690 O VAL A 112 19.367 -93.855 -17.160 1.00 51.15 O ATOM 1691 CB VAL A 112 16.132 -93.838 -15.946 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.238 -94.346 -14.818 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.535 -92.388 -15.701 1.00 12.43 C ATOM 0 H VAL A 112 18.847 -93.932 -14.850 1.00 42.33 H new ATOM 0 HA VAL A 112 17.052 -95.758 -16.290 1.00 22.53 H new ATOM 0 HB VAL A 112 15.559 -93.886 -16.872 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.368 -93.696 -14.722 1.00 12.25 H new ATOM 0 HG12 VAL A 112 14.910 -95.361 -15.043 1.00 12.25 H new ATOM 0 HG13 VAL A 112 15.797 -94.344 -13.882 1.00 12.25 H new ATOM 0 HG21 VAL A 112 15.640 -91.777 -15.581 1.00 12.43 H new ATOM 0 HG22 VAL A 112 17.140 -92.326 -14.797 1.00 12.43 H new ATOM 0 HG23 VAL A 112 17.113 -92.023 -16.550 1.00 12.43 H new ATOM 1703 N ASP A 113 17.603 -94.238 -18.491 1.00 71.41 N ATOM 1704 CA ASP A 113 18.256 -93.710 -19.686 1.00 61.45 C ATOM 1705 C ASP A 113 17.950 -92.221 -19.823 1.00 54.52 C ATOM 1706 O ASP A 113 16.782 -91.827 -19.872 1.00 71.24 O ATOM 1707 CB ASP A 113 17.790 -94.466 -20.939 1.00 13.55 C ATOM 1708 CG ASP A 113 18.119 -95.950 -20.883 1.00 74.32 C ATOM 1709 OD1 ASP A 113 17.327 -96.721 -20.300 1.00 41.05 O ATOM 1710 OD2 ASP A 113 19.171 -96.359 -21.423 1.00 52.52 O ATOM 0 H ASP A 113 16.665 -94.606 -18.651 1.00 71.41 H new ATOM 0 HA ASP A 113 19.333 -93.848 -19.587 1.00 61.45 H new ATOM 0 HB2 ASP A 113 16.714 -94.340 -21.055 1.00 13.55 H new ATOM 0 HB3 ASP A 113 18.259 -94.027 -21.819 1.00 13.55 H new ATOM 1715 N ALA A 114 18.999 -91.401 -19.861 1.00 61.52 N ATOM 1716 CA ALA A 114 18.849 -89.952 -19.990 1.00 14.04 C ATOM 1717 C ALA A 114 18.047 -89.607 -21.246 1.00 42.21 C ATOM 1718 O ALA A 114 18.325 -90.128 -22.331 1.00 32.43 O ATOM 1719 CB ALA A 114 20.218 -89.274 -20.020 1.00 51.25 C ATOM 0 H ALA A 114 19.967 -91.717 -19.804 1.00 61.52 H new ATOM 0 HA ALA A 114 18.303 -89.581 -19.123 1.00 14.04 H new ATOM 0 HB1 ALA A 114 20.088 -88.196 -20.116 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.753 -89.494 -19.096 1.00 51.25 H new ATOM 0 HB3 ALA A 114 20.791 -89.648 -20.869 1.00 51.25 H new ATOM 1725 N ASP A 115 17.052 -88.733 -21.098 1.00 54.31 N ATOM 1726 CA ASP A 115 16.148 -88.402 -22.206 1.00 31.20 C ATOM 1727 C ASP A 115 16.236 -86.923 -22.564 1.00 74.33 C ATOM 1728 O ASP A 115 16.015 -86.542 -23.717 1.00 33.11 O ATOM 1729 CB ASP A 115 14.706 -88.781 -21.845 1.00 63.02 C ATOM 1730 CG ASP A 115 13.747 -88.653 -23.021 1.00 34.15 C ATOM 1731 OD1 ASP A 115 13.922 -89.389 -24.018 1.00 60.54 O ATOM 1732 OD2 ASP A 115 12.809 -87.832 -22.953 1.00 71.54 O ATOM 0 H ASP A 115 16.850 -88.242 -20.227 1.00 54.31 H new ATOM 0 HA ASP A 115 16.456 -88.977 -23.079 1.00 31.20 H new ATOM 0 HB2 ASP A 115 14.687 -89.807 -21.477 1.00 63.02 H new ATOM 0 HB3 ASP A 115 14.361 -88.144 -21.031 1.00 63.02 H new ATOM 1737 N GLY A 116 16.562 -86.089 -21.577 1.00 25.12 N ATOM 1738 CA GLY A 116 16.742 -84.668 -21.826 1.00 51.02 C ATOM 1739 C GLY A 116 15.956 -83.790 -20.865 1.00 52.42 C ATOM 1740 O GLY A 116 14.825 -84.115 -20.490 1.00 24.24 O ATOM 0 H GLY A 116 16.705 -86.374 -20.608 1.00 25.12 H new ATOM 0 HA2 GLY A 116 17.801 -84.423 -21.749 1.00 51.02 H new ATOM 0 HA3 GLY A 116 16.436 -84.443 -22.848 1.00 51.02 H new ATOM 1744 N PHE A 117 16.560 -82.679 -20.447 1.00 5.24 N ATOM 1745 CA PHE A 117 15.873 -81.724 -19.583 1.00 2.31 C ATOM 1746 C PHE A 117 15.204 -80.667 -20.457 1.00 32.41 C ATOM 1747 O PHE A 117 15.889 -79.868 -21.099 1.00 0.02 O ATOM 1748 CB PHE A 117 16.882 -81.039 -18.640 1.00 64.33 C ATOM 1749 CG PHE A 117 17.702 -81.989 -17.794 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.755 -82.705 -18.350 1.00 52.42 C ATOM 1751 CD2 PHE A 117 17.427 -82.157 -16.445 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.511 -83.566 -17.576 1.00 24.34 C ATOM 1753 CE2 PHE A 117 18.181 -83.014 -15.667 1.00 3.23 C ATOM 1754 CZ PHE A 117 19.223 -83.720 -16.232 1.00 43.44 C ATOM 0 H PHE A 117 17.516 -82.420 -20.691 1.00 5.24 H new ATOM 0 HA PHE A 117 15.128 -82.247 -18.983 1.00 2.31 H new ATOM 0 HB2 PHE A 117 17.560 -80.428 -19.237 1.00 64.33 H new ATOM 0 HB3 PHE A 117 16.340 -80.362 -17.980 1.00 64.33 H new ATOM 0 HD1 PHE A 117 18.986 -82.588 -19.399 1.00 52.42 H new ATOM 0 HD2 PHE A 117 16.611 -81.610 -15.996 1.00 54.12 H new ATOM 0 HE1 PHE A 117 20.326 -84.118 -18.021 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.955 -83.131 -14.617 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.813 -84.392 -15.626 1.00 43.44 H new ATOM 1764 N GLU A 118 13.873 -80.663 -20.488 1.00 33.04 N ATOM 1765 CA GLU A 118 13.134 -79.674 -21.263 1.00 23.02 C ATOM 1766 C GLU A 118 11.669 -79.619 -20.833 1.00 63.02 C ATOM 1767 O GLU A 118 10.991 -80.643 -20.777 1.00 13.12 O ATOM 1768 CB GLU A 118 13.270 -79.970 -22.762 1.00 70.42 C ATOM 1769 CG GLU A 118 12.882 -81.389 -23.162 1.00 51.04 C ATOM 1770 CD GLU A 118 13.149 -81.662 -24.631 1.00 53.34 C ATOM 1771 OE1 GLU A 118 12.396 -81.140 -25.482 1.00 71.34 O ATOM 1772 OE2 GLU A 118 14.110 -82.392 -24.949 1.00 62.15 O ATOM 0 H GLU A 118 13.288 -81.331 -19.987 1.00 33.04 H new ATOM 0 HA GLU A 118 13.562 -78.690 -21.070 1.00 23.02 H new ATOM 0 HB2 GLU A 118 12.649 -79.267 -23.317 1.00 70.42 H new ATOM 0 HB3 GLU A 118 14.302 -79.790 -23.063 1.00 70.42 H new ATOM 0 HG2 GLU A 118 13.440 -82.102 -22.554 1.00 51.04 H new ATOM 0 HG3 GLU A 118 11.825 -81.548 -22.951 1.00 51.04 H new ATOM 1779 N ILE A 119 11.179 -78.422 -20.531 1.00 14.51 N ATOM 1780 CA ILE A 119 9.796 -78.258 -20.101 1.00 51.30 C ATOM 1781 C ILE A 119 8.852 -78.553 -21.266 1.00 62.21 C ATOM 1782 O ILE A 119 8.507 -77.670 -22.056 1.00 44.42 O ATOM 1783 CB ILE A 119 9.517 -76.843 -19.514 1.00 2.53 C ATOM 1784 CG1 ILE A 119 10.230 -76.663 -18.161 1.00 24.02 C ATOM 1785 CG2 ILE A 119 8.013 -76.608 -19.341 1.00 53.12 C ATOM 1786 CD1 ILE A 119 11.742 -76.725 -18.224 1.00 71.13 C ATOM 0 H ILE A 119 11.715 -77.556 -20.576 1.00 14.51 H new ATOM 0 HA ILE A 119 9.616 -78.971 -19.297 1.00 51.30 H new ATOM 0 HB ILE A 119 9.907 -76.110 -20.220 1.00 2.53 H new ATOM 0 HG12 ILE A 119 9.938 -75.702 -17.738 1.00 24.02 H new ATOM 0 HG13 ILE A 119 9.877 -77.434 -17.476 1.00 24.02 H new ATOM 0 HG21 ILE A 119 7.845 -75.613 -18.930 1.00 53.12 H new ATOM 0 HG22 ILE A 119 7.518 -76.689 -20.309 1.00 53.12 H new ATOM 0 HG23 ILE A 119 7.604 -77.355 -18.661 1.00 53.12 H new ATOM 0 HD11 ILE A 119 12.154 -76.588 -17.224 1.00 71.13 H new ATOM 0 HD12 ILE A 119 12.050 -77.695 -18.614 1.00 71.13 H new ATOM 0 HD13 ILE A 119 12.111 -75.937 -18.880 1.00 71.13 H new ATOM 1798 N ARG A 120 8.488 -79.819 -21.384 1.00 2.03 N ATOM 1799 CA ARG A 120 7.578 -80.277 -22.420 1.00 61.44 C ATOM 1800 C ARG A 120 6.132 -80.157 -21.961 1.00 32.31 C ATOM 1801 O ARG A 120 5.816 -80.429 -20.800 1.00 1.25 O ATOM 1802 CB ARG A 120 7.916 -81.724 -22.801 1.00 4.12 C ATOM 1803 CG ARG A 120 9.077 -81.819 -23.776 1.00 2.23 C ATOM 1804 CD ARG A 120 9.376 -83.256 -24.173 1.00 30.01 C ATOM 1805 NE ARG A 120 10.593 -83.352 -24.966 1.00 3.51 N ATOM 1806 CZ ARG A 120 11.156 -84.498 -25.338 1.00 12.41 C ATOM 1807 NH1 ARG A 120 10.544 -85.653 -25.100 1.00 3.32 N ATOM 1808 NH2 ARG A 120 12.328 -84.482 -25.956 1.00 2.32 N ATOM 0 H ARG A 120 8.816 -80.559 -20.763 1.00 2.03 H new ATOM 0 HA ARG A 120 7.697 -79.646 -23.301 1.00 61.44 H new ATOM 0 HB2 ARG A 120 8.158 -82.286 -21.899 1.00 4.12 H new ATOM 0 HB3 ARG A 120 7.037 -82.194 -23.243 1.00 4.12 H new ATOM 0 HG2 ARG A 120 8.848 -81.237 -24.669 1.00 2.23 H new ATOM 0 HG3 ARG A 120 9.965 -81.376 -23.325 1.00 2.23 H new ATOM 0 HD2 ARG A 120 9.476 -83.868 -23.277 1.00 30.01 H new ATOM 0 HD3 ARG A 120 8.538 -83.659 -24.742 1.00 30.01 H new ATOM 0 HE ARG A 120 11.043 -82.484 -25.255 1.00 3.51 H new ATOM 0 HH11 ARG A 120 9.639 -85.663 -24.630 1.00 3.32 H new ATOM 0 HH12 ARG A 120 10.979 -86.530 -25.387 1.00 3.32 H new ATOM 0 HH21 ARG A 120 12.793 -83.594 -26.144 1.00 2.32 H new ATOM 0 HH22 ARG A 120 12.765 -85.358 -26.244 1.00 2.32 H new ATOM 1822 N ARG A 121 5.271 -79.732 -22.881 1.00 14.01 N ATOM 1823 CA ARG A 121 3.845 -79.572 -22.617 1.00 75.33 C ATOM 1824 C ARG A 121 3.056 -80.023 -23.844 1.00 64.21 C ATOM 1825 O ARG A 121 3.128 -79.327 -24.880 1.00 51.44 O ATOM 1826 CB ARG A 121 3.497 -78.109 -22.275 1.00 72.42 C ATOM 1827 CG ARG A 121 4.201 -77.574 -21.032 1.00 14.51 C ATOM 1828 CD ARG A 121 3.726 -76.171 -20.665 1.00 12.45 C ATOM 1829 NE ARG A 121 2.317 -76.151 -20.262 1.00 4.53 N ATOM 1830 CZ ARG A 121 1.608 -75.039 -20.055 1.00 42.14 C ATOM 1831 NH1 ARG A 121 2.158 -73.842 -20.245 1.00 1.44 N ATOM 1832 NH2 ARG A 121 0.342 -75.125 -19.661 1.00 65.01 N ATOM 1833 OXT ARG A 121 2.374 -81.067 -23.776 1.00 0.00 O ATOM 0 H ARG A 121 5.544 -79.488 -23.833 1.00 14.01 H new ATOM 0 HA ARG A 121 3.580 -80.186 -21.756 1.00 75.33 H new ATOM 0 HB2 ARG A 121 3.755 -77.478 -23.125 1.00 72.42 H new ATOM 0 HB3 ARG A 121 2.419 -78.027 -22.132 1.00 72.42 H new ATOM 0 HG2 ARG A 121 4.021 -78.248 -20.195 1.00 14.51 H new ATOM 0 HG3 ARG A 121 5.277 -77.559 -21.203 1.00 14.51 H new ATOM 0 HD2 ARG A 121 4.340 -75.782 -19.853 1.00 12.45 H new ATOM 0 HD3 ARG A 121 3.868 -75.507 -21.517 1.00 12.45 H new ATOM 0 HE ARG A 121 1.847 -77.047 -20.131 1.00 4.53 H new ATOM 0 HH11 ARG A 121 3.128 -73.769 -20.551 1.00 1.44 H new ATOM 0 HH12 ARG A 121 1.609 -72.997 -20.085 1.00 1.44 H new ATOM 0 HH21 ARG A 121 -0.086 -76.039 -19.517 1.00 65.01 H new ATOM 0 HH22 ARG A 121 -0.201 -74.277 -19.502 1.00 65.01 H new TER 1847 ARG A 121