#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvh s ASP 2 N 0.00 6.44 0.10 0.00 2.15 -1.26 -4.76 116.67 119.33 1dvh s ASP 2 Ca 0.00 2.78 -0.28 0.00 0.43 0.00 0.00 52.55 55.48 1dvh s ASP 2 Cb 0.00 -2.59 -0.13 0.00 -0.30 0.00 0.00 42.92 39.90 1dvh s ASP 2 CO 0.00 -0.95 1.65 1.23 -0.17 0.00 0.00 175.17 176.93 1dvh h GLY 3 N 7.32 -0.54 0.29 2.66 0.00 -1.90 -1.19 103.07 109.71 1dvh h GLY 3 Ca -0.44 0.27 0.11 0.00 0.00 0.00 0.00 47.33 47.27 1dvh h GLY 3 CO 0.95 -0.22 0.24 0.00 0.00 0.00 0.00 176.54 177.51 1dvh h ALA 4 N 0.13 0.87 0.01 3.60 0.00 -1.89 0.63 119.26 122.61 1dvh h ALA 4 Ca -0.01 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1dvh h ALA 4 Cb 0.48 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1dvh h ALA 4 CO -0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 179.25 179.01 1dvh h ALA 5 N 1.47 -0.02 -0.42 0.00 0.00 -1.88 -2.80 119.26 115.61 1dvh h ALA 5 Ca 0.34 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.26 1dvh h ALA 5 Cb 0.46 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1dvh h ALA 5 CO -0.35 -0.49 0.21 -0.07 0.00 0.00 0.00 179.25 178.56 1dvh h LEU 6 N -0.06 0.32 -1.75 0.00 3.38 -0.45 -2.13 115.31 114.61 1dvh h LEU 6 Ca -0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1dvh h LEU 6 Cb 0.06 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1dvh h LEU 6 CO 0.00 0.23 0.00 0.22 0.09 0.00 0.00 178.44 178.98 1dvh h TYR 7 N 0.43 0.00 -0.97 1.13 3.20 -0.65 -2.78 116.97 117.33 1dvh h TYR 7 Ca 0.18 0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.20 1dvh h TYR 7 Cb 0.07 0.00 -0.10 0.00 1.54 0.00 0.00 36.73 38.25 1dvh h TYR 7 CO -0.10 0.00 0.58 0.87 -1.64 0.00 0.00 178.16 177.87 1dvh h LYS 8 N 0.00 0.79 0.00 1.82 1.57 -1.17 0.13 116.57 119.71 1dvh h LYS 8 Ca 0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1dvh h LYS 8 Cb 0.01 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 1dvh h LYS 8 CO 0.00 0.52 -0.06 0.66 -0.57 0.00 0.00 179.45 180.01 1dvh h SER 9 N 0.81 0.00 0.19 0.86 4.64 -1.70 -2.91 113.55 115.44 1dvh h SER 9 Ca 0.53 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.50 1dvh h SER 9 Cb 0.71 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.76 1dvh h SER 9 CO -0.34 0.06 -2.05 0.00 -0.87 0.00 0.00 176.83 173.63 1dvh h ILE 11 N 0.03 0.31 -0.19 0.00 5.03 -0.80 0.18 117.51 122.08 1dvh h ILE 11 Ca -0.43 0.00 0.04 0.00 -0.12 0.00 0.00 64.86 64.36 1dvh h ILE 11 Cb 2.03 0.33 -0.04 0.00 -3.03 0.00 0.00 36.82 36.10 1dvh h ILE 11 CO 0.05 0.00 -0.09 1.23 -0.68 0.00 0.00 178.15 178.65 1dvh h GLY 12 N 0.00 0.07 0.40 5.37 0.00 -1.73 0.43 103.07 107.60 1dvh h GLY 12 Ca 0.61 0.12 -0.26 0.00 0.00 0.00 0.00 47.33 47.80 1dvh h GLY 12 CO -0.01 -0.11 -1.35 0.00 0.00 0.00 0.00 176.54 175.07 1dvh h HIS 14 N -0.46 0.00 0.00 0.00 -0.00 -1.10 -3.36 115.15 110.24 1dvh h HIS 14 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.06 1dvh h HIS 14 Cb 1.64 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.05 1dvh h HIS 14 CO 0.12 0.04 0.00 0.41 -0.00 0.00 0.00 177.93 178.50 1dvh n GLY 15 N -0.06 -2.11 0.00 2.45 0.00 0.15 -0.57 105.19 105.04 1dvh n GLY 15 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1dvh n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dvh n ALA 16 N -1.57 0.00 -3.03 4.61 0.00 -1.26 -1.04 120.51 118.23 1dvh n ALA 16 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1dvh n ALA 16 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1dvh n ALA 16 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1dvh n ASP 17 N -2.97 -0.67 -1.78 0.00 8.00 -1.26 -4.94 116.55 112.93 1dvh n ASP 17 Ca 0.00 -3.06 -0.20 0.00 0.71 0.00 0.00 54.79 52.24 1dvh n ASP 17 Cb 0.00 0.27 -0.07 0.00 -0.02 0.00 0.00 41.12 41.30 1dvh n ASP 17 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dvh n GLY 18 N 1.00 1.26 0.17 0.44 0.00 -0.20 -4.52 105.19 103.34 1dvh n GLY 18 Ca 0.17 -0.03 -0.04 0.00 0.00 0.00 0.00 46.02 46.12 1dvh n GLY 18 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1dvh h SER 19 N 0.00 0.24 -3.05 1.61 4.64 -1.40 -3.25 113.55 112.34 1dvh h SER 19 Ca -0.44 -0.13 -0.61 0.00 -0.47 0.00 0.00 61.79 60.15 1dvh h SER 19 Cb 1.34 -0.07 -0.07 0.00 -0.31 0.00 0.00 62.40 63.29 1dvh h SER 19 CO 0.60 0.75 -0.27 -0.54 -0.87 0.00 0.00 176.83 176.50 1dvh s LYS 20 N -3.84 3.96 -1.03 4.77 1.02 0.26 -4.99 119.74 119.89 1dvh s LYS 20 Ca -0.04 0.26 -0.23 0.00 0.02 0.00 0.00 55.97 55.98 1dvh s LYS 20 Cb 0.12 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 34.12 1dvh s LYS 20 CO 0.79 0.55 1.83 0.00 -0.92 0.00 0.00 175.35 177.60 1dvh s ALA 21 N -0.56 2.05 0.01 5.17 0.00 -1.26 -4.54 121.76 122.63 1dvh s ALA 21 Ca 0.21 -1.95 -0.31 0.00 0.00 0.00 0.00 51.96 49.91 1dvh s ALA 21 Cb -0.15 -4.59 -0.16 0.00 0.00 0.00 0.00 23.12 18.22 1dvh s ALA 21 CO 0.10 -4.55 0.82 0.00 0.00 0.00 0.00 175.76 172.12 1dvh n ALA 22 N 12.60 -2.97 0.00 0.00 0.00 -1.26 -3.00 120.51 125.88 1dvh n ALA 22 Ca 0.41 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.32 1dvh n ALA 22 Cb 0.47 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1dvh n ALA 22 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1dvh n MET 23 N 1.16 0.00 -0.21 0.00 1.56 -1.26 -0.53 117.12 117.84 1dvh n MET 23 Ca 0.16 0.00 0.12 0.00 -0.27 0.00 0.00 57.70 57.71 1dvh n MET 23 Cb 0.07 0.00 0.43 0.00 2.15 0.00 0.00 33.22 35.87 1dvh n MET 23 CO 0.00 0.00 0.00 0.78 -0.73 0.00 0.00 175.97 176.02 1dvh h GLY 24 N 0.00 0.95 0.00 -5.12 0.00 -1.93 -3.45 103.07 93.53 1dvh h GLY 24 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 1dvh h GLY 24 CO 0.00 0.10 0.00 1.44 0.00 0.00 0.00 176.54 178.08 1dvh n SER 25 N -4.51 0.00 -4.69 0.19 7.64 0.31 -5.05 113.62 107.50 1dvh n SER 25 Ca 0.15 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.64 1dvh n SER 25 Cb 0.45 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.69 1dvh n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dvh n ALA 26 N 0.00 1.06 -1.72 -0.43 0.00 0.18 -4.80 120.51 114.80 1dvh n ALA 26 Ca 0.00 0.13 -0.42 0.00 0.00 0.00 0.00 53.44 53.15 1dvh n ALA 26 Cb 0.00 -2.25 -0.03 0.00 0.00 0.00 0.00 19.45 17.17 1dvh n ALA 26 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1dvh s LYS 27 N -2.66 3.77 -0.47 0.00 1.02 -1.26 -4.24 119.74 115.90 1dvh s LYS 27 Ca 0.70 2.29 -0.24 0.00 0.02 0.00 0.00 55.97 58.74 1dvh s LYS 27 Cb -0.45 -4.21 -0.13 0.00 -0.52 0.00 0.00 37.83 32.52 1dvh s LYS 27 CO 0.51 -1.37 1.55 -2.30 -0.92 0.00 0.00 175.35 172.81 1dvh n PRO 28 N 7.94 0.00 -0.01 -1.68 -0.02 -1.26 -4.76 135.00 135.21 1dvh n PRO 28 Ca 0.23 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.85 1dvh n PRO 28 Cb 0.43 -0.97 0.58 0.00 -0.02 0.00 0.00 33.50 33.52 1dvh n PRO 28 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1dvh h VAL 29 N 4.81 0.86 -0.10 -1.45 2.07 -1.85 -3.37 116.25 117.24 1dvh h VAL 29 Ca -0.05 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 1dvh h VAL 29 Cb 0.88 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1dvh h VAL 29 CO 0.79 0.04 0.08 1.17 0.02 0.00 0.00 177.57 179.68 1dvh n LYS 30 N -4.45 0.12 0.00 1.57 4.81 -1.22 -0.52 118.16 118.46 1dvh n LYS 30 Ca 0.08 -1.51 0.00 0.00 -0.87 0.00 0.00 58.31 56.01 1dvh n LYS 30 Cb 0.40 -3.72 0.00 0.00 0.02 0.00 0.00 35.03 31.73 1dvh n LYS 30 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1dvh n GLY 31 N 6.08 0.63 3.76 3.14 0.00 -0.92 -4.99 105.19 112.89 1dvh n GLY 31 Ca 0.39 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.03 1dvh n GLY 31 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dvh s GLN 32 N 0.00 3.30 0.00 1.61 -0.21 0.32 -4.99 119.66 119.69 1dvh s GLN 32 Ca 0.00 2.05 0.00 0.00 0.02 0.00 0.00 55.36 57.43 1dvh s GLN 32 Cb 0.00 -2.26 0.00 0.00 1.00 0.00 0.00 33.01 31.75 1dvh s GLN 32 CO 0.00 -1.01 0.00 0.41 -2.12 0.00 0.00 175.29 172.57 1dvh n GLY 33 N 0.62 0.00 0.00 3.09 0.00 -1.26 -4.34 105.19 103.30 1dvh n GLY 33 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1dvh n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dvh n ALA 34 N -2.87 0.00 -0.30 4.61 0.00 -1.26 -4.18 120.51 116.51 1dvh n ALA 34 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1dvh n ALA 34 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 1dvh n ALA 34 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1dvh h GLU 35 N 0.00 1.07 0.11 0.00 4.81 -1.95 0.12 114.58 118.75 1dvh h GLU 35 Ca 0.00 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1dvh h GLU 35 Cb 0.00 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.12 1dvh h GLU 35 CO 0.00 0.71 -0.19 1.49 -0.73 0.00 0.00 179.01 180.29 1dvh h GLU 36 N 1.11 -0.30 -0.72 1.92 4.81 -1.96 0.16 114.58 119.59 1dvh h GLU 36 Ca 0.30 0.02 0.15 0.00 -0.13 0.00 0.00 59.36 59.70 1dvh h GLU 36 Cb -0.12 0.07 -0.14 0.00 0.63 0.00 0.00 28.75 29.20 1dvh h GLU 36 CO -0.07 -0.20 -0.18 -0.07 -0.73 0.00 0.00 179.01 177.76 1dvh h LEU 37 N -0.31 -0.67 -0.00 1.64 3.38 -1.84 0.12 115.31 117.63 1dvh h LEU 37 Ca -0.01 0.22 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1dvh h LEU 37 Cb 0.29 0.45 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 1dvh h LEU 37 CO -0.06 -0.24 0.00 0.22 0.09 0.00 0.00 178.44 178.45 1dvh h TYR 38 N 0.00 0.00 -0.95 1.13 3.20 -0.57 0.62 116.97 120.40 1dvh h TYR 38 Ca 0.35 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.22 1dvh h TYR 38 Cb 0.53 -0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 1dvh h TYR 38 CO -0.58 0.27 0.59 0.87 -1.64 0.00 0.00 178.16 177.68 1dvh h LYS 39 N -0.27 1.27 -0.07 1.82 1.57 0.05 0.21 116.57 121.15 1dvh h LYS 39 Ca 0.00 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1dvh h LYS 39 Cb 0.27 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1dvh h LYS 39 CO 0.00 0.87 -0.02 0.87 -0.57 0.00 0.00 179.45 180.60 1dvh h LYS 40 N 1.30 0.14 -0.65 3.15 1.57 -0.68 0.80 116.57 122.19 1dvh h LYS 40 Ca 0.34 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 59.03 1dvh h LYS 40 Cb -0.09 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 1dvh h LYS 40 CO -0.07 0.49 0.28 0.52 -0.57 0.00 0.00 179.45 180.11 1dvh h MET 41 N -0.22 0.96 -0.73 3.15 2.86 -0.62 0.11 114.93 120.44 1dvh h MET 41 Ca 0.02 -0.16 0.03 0.00 -2.06 0.00 0.00 59.70 57.53 1dvh h MET 41 Cb 0.44 -0.16 -0.05 0.00 0.06 0.00 0.00 31.60 31.89 1dvh h MET 41 CO 0.01 0.79 0.46 -0.22 1.06 0.00 0.00 176.91 179.01 1dvh h LYS 42 N 0.91 0.86 0.00 1.72 3.64 -0.49 0.43 116.57 123.64 1dvh h LYS 42 Ca 0.22 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.57 1dvh h LYS 42 Cb 0.17 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 1dvh h LYS 42 CO -0.02 0.57 -0.14 0.78 -2.27 0.00 0.00 179.45 178.37 1dvh h GLY 43 N 0.89 -0.17 1.79 5.01 0.00 -0.00 -2.20 103.07 108.38 1dvh h GLY 43 Ca 0.30 0.16 -0.06 0.00 0.00 0.00 0.00 47.33 47.73 1dvh h GLY 43 CO -0.12 -0.14 -0.17 -0.97 0.00 0.00 0.00 176.54 175.15 1dvh h TYR 44 N -0.23 0.28 -0.50 5.60 0.05 0.00 0.62 116.97 122.79 1dvh h TYR 44 Ca 0.05 -0.04 0.10 0.00 0.05 0.00 0.00 58.73 58.89 1dvh h TYR 44 Cb 0.29 -0.08 -0.10 0.00 1.01 0.00 0.00 36.73 37.86 1dvh h TYR 44 CO -0.19 0.42 -0.19 0.00 -1.05 0.00 0.00 178.16 177.15 1dvh h ALA 45 N 1.59 0.20 0.03 3.88 0.00 0.48 -2.80 119.26 122.64 1dvh h ALA 45 Ca 0.05 0.18 -0.34 0.00 0.00 0.00 0.00 54.91 54.80 1dvh h ALA 45 Cb 0.45 0.50 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 1dvh h ALA 45 CO 0.03 -0.52 -2.01 -0.40 0.00 0.00 0.00 179.25 176.35 1dvh n ASP 46 N -5.40 1.11 0.00 0.00 5.75 -1.17 -4.67 116.55 112.18 1dvh n ASP 46 Ca 0.04 0.22 0.00 0.00 -0.01 0.00 0.00 54.79 55.04 1dvh n ASP 46 Cb 0.30 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 1dvh n ASP 46 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dvh n GLY 47 N 1.78 1.70 1.79 6.12 0.00 0.10 -5.04 105.19 111.65 1dvh n GLY 47 Ca -0.27 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.60 1dvh n GLY 47 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1dvh n SER 48 N 0.00 5.01 -3.42 1.61 2.88 0.18 -4.82 113.62 115.04 1dvh n SER 48 Ca 0.00 -2.98 -0.12 0.00 -1.33 0.00 0.00 58.87 54.43 1dvh n SER 48 Cb 0.00 -0.87 -0.02 0.00 -0.75 0.00 0.00 64.21 62.57 1dvh n SER 48 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1dvh s TYR 49 N -1.86 -0.54 0.14 0.66 5.04 -1.23 -4.76 117.35 114.79 1dvh s TYR 49 Ca 0.32 0.36 0.03 0.00 -2.44 0.00 0.00 57.07 55.33 1dvh s TYR 49 Cb 0.26 0.55 -0.01 0.00 0.35 0.00 0.00 41.96 43.11 1dvh s TYR 49 CO 0.03 -0.84 0.10 0.41 -1.34 0.00 0.00 175.55 173.90 1dvh n GLY 50 N -0.33 3.63 0.00 8.97 0.00 -1.26 -4.66 105.19 111.54 1dvh n GLY 50 Ca -0.17 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.05 1dvh n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dvh n GLY 51 N 0.05 0.83 0.31 -0.02 0.00 -1.26 -4.86 105.19 100.24 1dvh n GLY 51 Ca 0.02 -1.15 0.15 0.00 0.00 0.00 0.00 46.02 45.04 1dvh n GLY 51 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1dvh h GLU 52 N 0.00 0.23 -0.92 1.61 5.08 -1.99 -2.03 114.58 116.56 1dvh h GLU 52 Ca 0.00 -0.01 -0.47 0.00 -1.00 0.00 0.00 59.36 57.88 1dvh h GLU 52 Cb 0.00 -0.05 -0.42 0.00 0.50 0.00 0.00 28.75 28.78 1dvh h GLU 52 CO 0.00 0.15 -0.91 0.54 -1.00 0.00 0.00 179.01 177.79 1dvh n ARG 53 N -5.18 2.84 -0.25 2.33 5.12 -1.26 -4.89 116.66 115.36 1dvh n ARG 53 Ca 0.24 -4.00 0.20 0.00 -1.93 0.00 0.00 57.85 52.36 1dvh n ARG 53 Cb 0.75 -1.99 0.53 0.00 -1.16 0.00 0.00 32.46 30.58 1dvh n ARG 53 CO 0.00 0.00 0.00 1.57 -1.93 0.00 0.00 177.63 177.27 1dvh h LYS 54 N 2.48 0.36 0.03 5.56 2.10 -1.70 -0.55 116.57 124.87 1dvh h LYS 54 Ca 0.18 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.81 1dvh h LYS 54 Cb 1.27 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1dvh h LYS 54 CO 0.63 0.24 -0.02 0.00 -2.00 0.00 0.00 179.45 178.30 1dvh h ALA 55 N 1.60 -0.04 -0.54 0.07 0.00 -1.90 0.19 119.26 118.64 1dvh h ALA 55 Ca 0.49 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.28 1dvh h ALA 55 Cb 1.27 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1dvh h ALA 55 CO -0.18 -0.40 0.35 0.52 0.00 0.00 0.00 179.25 179.53 1dvh h MET 56 N -0.29 0.68 0.64 0.00 2.86 -1.65 0.17 114.93 117.35 1dvh h MET 56 Ca -0.00 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 1dvh h MET 56 Cb 0.27 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1dvh h MET 56 CO 0.01 0.45 -0.41 0.52 1.06 0.00 0.00 176.91 178.54 1dvh h MET 57 N 0.70 -0.96 -0.71 1.72 2.07 -1.02 0.79 114.93 117.53 1dvh h MET 57 Ca 0.21 0.07 0.16 0.00 -2.07 0.00 0.00 59.70 58.06 1dvh h MET 57 Cb -0.05 0.22 -0.12 0.00 -1.87 0.00 0.00 31.60 29.78 1dvh h MET 57 CO -0.06 -0.64 0.04 1.15 1.07 0.00 0.00 176.91 178.47 1dvh h THR 58 N -0.99 0.42 -0.38 2.22 2.02 -0.39 0.15 112.91 115.95 1dvh h THR 58 Ca -0.08 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.05 1dvh h THR 58 Cb 0.81 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 1dvh h THR 58 CO 0.07 0.03 0.22 -1.13 0.37 0.00 0.00 175.52 175.08 1dvh h ASN 59 N 0.14 0.45 -0.91 4.18 -1.24 -0.53 0.44 115.58 118.11 1dvh h ASN 59 Ca 0.39 -0.06 0.01 0.00 0.71 0.00 0.00 56.30 57.35 1dvh h ASN 59 Cb 0.67 -0.11 -0.05 0.00 0.73 0.00 0.00 38.32 39.56 1dvh h ASN 59 CO -0.59 0.38 0.61 0.00 -1.29 0.00 0.00 177.43 176.53 1dvh h ALA 60 N 1.10 1.16 0.03 1.57 0.00 0.11 -3.09 119.26 120.13 1dvh h ALA 60 Ca 0.13 -0.06 -0.24 0.00 0.00 0.00 0.00 54.91 54.74 1dvh h ALA 60 Cb 0.01 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1dvh h ALA 60 CO -0.02 0.56 -1.20 0.28 0.00 0.00 0.00 179.25 178.87 1dvh h VAL 61 N 1.24 1.50 -0.90 0.00 2.07 -0.55 -3.36 116.25 116.24 1dvh h VAL 61 Ca 0.33 -3.20 0.18 0.00 0.82 0.00 0.00 66.70 64.83 1dvh h VAL 61 Cb -0.14 2.78 -0.07 0.00 -1.52 0.00 0.00 31.29 32.34 1dvh h VAL 61 CO -0.07 0.87 0.59 0.50 0.02 0.00 0.00 177.57 179.48 1dvh h LYS 62 N 0.02 0.53 0.00 1.57 3.11 -0.03 0.11 116.57 121.88 1dvh h LYS 62 Ca -0.09 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.72 1dvh h LYS 62 Cb 1.86 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 32.97 1dvh h LYS 62 CO 0.13 0.35 0.00 0.36 -2.81 0.00 0.00 179.45 177.48 1dvh n LYS 63 N -4.56 0.53 -1.94 1.90 2.85 -1.26 -4.79 118.16 110.90 1dvh n LYS 63 Ca 0.19 0.04 -0.06 0.00 -1.05 0.00 0.00 58.31 57.43 1dvh n LYS 63 Cb 0.60 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.48 1dvh n LYS 63 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1dvh n TYR 64 N -1.15 -1.59 -3.43 5.58 4.01 0.39 -5.15 117.16 115.82 1dvh n TYR 64 Ca 0.14 -0.55 -0.12 0.00 -0.16 0.00 0.00 57.90 57.22 1dvh n TYR 64 Cb 0.14 -0.11 -0.02 0.00 -0.31 0.00 0.00 39.34 39.03 1dvh n TYR 64 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1dvh s SER 65 N -1.79 -0.55 0.16 7.72 0.01 -1.26 -5.00 113.70 112.99 1dvh s SER 65 Ca 0.09 0.01 -0.02 0.00 1.31 0.00 0.00 55.95 57.34 1dvh s SER 65 Cb -0.01 0.58 0.32 0.00 0.21 0.00 0.00 66.02 67.12 1dvh s SER 65 CO 0.06 -0.93 0.85 0.47 0.41 0.00 0.00 173.24 174.10 1dvh n ASP 66 N -0.35 -0.14 0.27 2.44 9.92 -1.26 -0.09 116.55 127.35 1dvh n ASP 66 Ca -0.16 0.93 -0.16 0.00 -0.53 0.00 0.00 54.79 54.87 1dvh n ASP 66 Cb 0.65 -0.31 -0.08 0.00 -0.64 0.00 0.00 41.12 40.73 1dvh n ASP 66 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 1dvh h GLU 67 N 0.00 -0.63 -0.10 -1.24 4.22 -1.98 0.19 114.58 115.04 1dvh h GLU 67 Ca 0.29 0.04 0.03 0.00 0.08 0.00 0.00 59.36 59.80 1dvh h GLU 67 Cb 0.52 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 1dvh h GLU 67 CO -0.54 -0.39 -0.08 0.93 -2.18 0.00 0.00 179.01 176.74 1dvh h GLU 68 N -0.70 -0.09 -0.44 1.92 4.39 -0.82 0.74 114.58 119.59 1dvh h GLU 68 Ca -0.07 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.68 1dvh h GLU 68 Cb 0.53 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.16 1dvh h GLU 68 CO 0.11 -0.06 0.20 -0.07 -1.16 0.00 0.00 179.01 178.03 1dvh h LEU 69 N -0.09 0.28 -0.64 1.33 3.38 -0.85 0.16 115.31 118.88 1dvh h LEU 69 Ca 0.07 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1dvh h LEU 69 Cb 0.19 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1dvh h LEU 69 CO -0.16 0.20 0.08 0.50 0.09 0.00 0.00 178.44 179.15 1dvh h LYS 70 N 0.41 1.09 -0.34 1.13 3.64 -0.26 0.11 116.57 122.34 1dvh h LYS 70 Ca 0.19 -0.31 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1dvh h LYS 70 Cb 0.12 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1dvh h LYS 70 CO -0.15 1.01 0.11 0.00 -2.27 0.00 0.00 179.45 178.16 1dvh h ALA 71 N 1.03 0.45 0.63 5.00 0.00 -0.32 0.33 119.26 126.38 1dvh h ALA 71 Ca 0.19 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1dvh h ALA 71 Cb 0.47 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1dvh h ALA 71 CO 0.02 0.08 -0.50 -0.07 0.00 0.00 0.00 179.25 178.78 1dvh h LEU 72 N 0.40 -1.33 -0.61 0.00 3.38 -0.47 -0.69 115.31 115.99 1dvh h LEU 72 Ca 0.11 0.09 0.12 0.00 0.09 0.00 0.00 57.88 58.30 1dvh h LEU 72 Cb 0.24 0.42 -0.09 0.00 0.09 0.00 0.00 40.66 41.31 1dvh h LEU 72 CO -0.00 -0.71 0.07 0.00 0.09 0.00 0.00 178.44 177.89 1dvh h ALA 73 N -0.98 0.67 -0.76 1.53 0.00 -0.83 0.36 119.26 119.25 1dvh h ALA 73 Ca -0.08 0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.09 1dvh h ALA 73 Cb 0.92 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 18.88 1dvh h ALA 73 CO 0.01 -0.35 0.39 0.22 0.00 0.00 0.00 179.25 179.52 1dvh h ASP 74 N 0.19 0.51 0.60 0.00 3.58 -0.69 0.31 116.42 120.93 1dvh h ASP 74 Ca 0.32 0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.80 1dvh h ASP 74 Cb 0.50 -0.03 0.01 0.00 1.72 0.00 0.00 39.33 41.53 1dvh h ASP 74 CO -0.46 0.28 -0.29 0.22 -2.88 0.00 0.00 179.24 176.12 1dvh h TYR 75 N 0.65 -0.74 -0.73 0.28 3.20 0.11 -2.91 116.97 116.82 1dvh h TYR 75 Ca 0.38 -0.02 0.21 0.00 3.14 0.00 0.00 58.73 62.44 1dvh h TYR 75 Cb 0.41 0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.90 1dvh h TYR 75 CO -0.10 -0.41 0.59 0.52 -1.64 0.00 0.00 178.16 177.13 1dvh h MET 76 N -1.04 0.00 -0.57 1.82 2.86 -0.11 0.85 114.93 118.74 1dvh h MET 76 Ca -0.08 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.67 1dvh h MET 76 Cb 0.67 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 1dvh h MET 76 CO 0.13 0.00 0.39 1.03 1.06 0.00 0.00 176.91 179.52 1dvh h SER 77 N 0.00 0.26 -0.85 1.22 0.87 -0.17 -1.37 113.55 113.51 1dvh h SER 77 Ca 0.35 0.01 -0.47 0.00 -1.23 0.00 0.00 61.79 60.44 1dvh h SER 77 Cb 1.53 -0.05 -0.27 0.00 -0.44 0.00 0.00 62.40 63.17 1dvh h SER 77 CO -0.00 0.15 0.48 0.29 -0.53 0.00 0.00 176.83 177.21 1dvh n LYS 78 N -4.45 2.28 0.00 2.24 4.76 0.29 -4.84 118.16 118.44 1dvh n LYS 78 Ca 0.10 -3.14 0.13 0.00 -2.87 0.00 0.00 58.31 52.53 1dvh n LYS 78 Cb 0.44 -2.12 0.38 0.00 -1.84 0.00 0.00 35.03 31.88 1dvh n LYS 78 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92