#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1plf h ASP 22 N 0.00 0.35 -4.46 4.31 3.58 -2.00 -3.48 116.42 114.73 1plf h ASP 22 Ca 0.00 -0.84 -0.34 0.00 0.42 0.00 0.00 57.03 56.27 1plf h ASP 22 Cb 0.00 -0.11 -0.19 0.00 1.72 0.00 0.00 39.33 40.74 1plf h ASP 22 CO 0.00 1.67 -0.75 -0.76 -2.88 0.00 0.00 179.24 176.52 1plf s LEU 23 N -7.46 2.35 0.33 2.28 1.43 -1.26 -5.16 118.68 111.19 1plf s LEU 23 Ca -0.22 -0.72 0.03 0.00 -1.03 0.00 0.00 54.13 52.20 1plf s LEU 23 Cb 0.05 -0.34 -0.06 0.00 0.03 0.00 0.00 46.19 45.87 1plf s LEU 23 CO 0.75 -0.20 0.07 0.00 0.23 0.00 0.00 176.35 177.20 1plf s GLN 24 N -2.31 1.66 0.35 1.70 -2.07 -1.25 -4.84 119.66 112.90 1plf s GLN 24 Ca 0.01 -1.93 -0.27 0.00 -1.82 0.00 0.00 55.36 51.35 1plf s GLN 24 Cb -0.06 -0.79 -0.09 0.00 -1.09 0.00 0.00 33.01 30.98 1plf s GLN 24 CO 0.01 -0.23 1.22 0.00 -1.32 0.00 0.00 175.29 174.98 1plf h VAL 26 N 2.75 1.50 -3.46 0.00 3.04 -2.00 -3.43 116.25 114.65 1plf h VAL 26 Ca -0.49 -2.39 -0.60 0.00 -1.01 0.00 0.00 66.70 62.21 1plf h VAL 26 Cb 1.23 2.29 -0.10 0.00 -2.01 0.00 0.00 31.29 32.70 1plf h VAL 26 CO 0.64 0.69 0.46 0.00 -1.01 0.00 0.00 177.57 178.35 1plf h LEU 28 N 9.71 0.00 -8.34 0.00 6.46 -2.02 -3.49 115.31 117.64 1plf h LEU 28 Ca -0.24 -0.53 -0.16 0.00 -0.12 0.00 0.00 57.88 56.83 1plf h LEU 28 Cb 1.09 0.00 -0.15 0.00 -0.73 0.00 0.00 40.66 40.87 1plf h LEU 28 CO 0.92 0.89 -0.67 -0.54 -0.62 0.00 0.00 178.44 178.42 1plf s LYS 29 N -2.03 0.74 0.11 1.25 1.02 -1.26 -5.17 119.74 114.40 1plf s LYS 29 Ca -0.14 -1.31 0.02 0.00 0.02 0.00 0.00 55.97 54.56 1plf s LYS 29 Cb -0.00 0.14 -0.04 0.00 -0.52 0.00 0.00 37.83 37.40 1plf s LYS 29 CO 0.42 -0.14 0.21 0.95 -0.92 0.00 0.00 175.35 175.88 1plf s THR 30 N -3.90 5.16 0.11 2.17 -4.23 -1.26 -4.17 115.64 109.52 1plf s THR 30 Ca 0.13 -0.62 0.09 0.00 -1.18 0.00 0.00 61.69 60.11 1plf s THR 30 Cb 0.07 -3.58 -0.04 0.00 1.34 0.00 0.00 72.50 70.30 1plf s THR 30 CO -0.06 0.03 -0.23 -0.89 -0.54 0.00 0.00 174.62 172.93 1plf s THR 31 N -1.60 1.93 0.00 3.99 2.01 -0.04 -4.95 115.64 116.96 1plf s THR 31 Ca 0.34 -1.61 0.00 0.00 0.31 0.00 0.00 61.69 60.72 1plf s THR 31 Cb -0.12 -1.73 0.00 0.00 0.01 0.00 0.00 72.50 70.66 1plf s THR 31 CO 0.27 0.01 0.04 -0.24 -0.69 0.00 0.00 174.62 174.01 1plf n SER 32 N 1.06 0.08 -1.86 3.53 2.88 -1.26 -4.50 113.62 113.55 1plf n SER 32 Ca -0.19 -0.70 -0.18 0.00 -1.33 0.00 0.00 58.87 56.47 1plf n SER 32 Cb 0.53 0.04 0.08 0.00 -0.75 0.00 0.00 64.21 64.11 1plf n SER 32 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1plf n GLY 33 N 0.04 4.00 3.90 0.46 0.00 -1.26 -4.96 105.19 107.37 1plf n GLY 33 Ca 0.00 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 1plf n GLY 33 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1plf s ILE 34 N -2.42 5.04 -0.30 -0.61 -5.25 -1.26 -5.05 121.20 111.34 1plf s ILE 34 Ca 0.36 0.07 -0.26 0.00 -0.99 0.00 0.00 60.65 59.83 1plf s ILE 34 Cb 0.30 -3.71 0.01 0.00 2.95 0.00 0.00 42.46 42.00 1plf s ILE 34 CO 0.03 -0.25 0.92 0.21 -1.79 0.00 0.00 174.94 174.06 1plf s ASN 35 N -3.01 6.80 0.55 4.36 3.84 -1.26 -4.94 114.94 121.27 1plf s ASN 35 Ca 0.44 0.88 0.42 0.00 0.21 0.00 0.00 52.86 54.80 1plf s ASN 35 Cb -0.11 -2.47 1.62 0.00 -0.55 0.00 0.00 41.25 39.75 1plf s ASN 35 CO 0.28 -0.72 1.70 -0.65 -2.79 0.00 0.00 177.10 174.93 1plf h PRO 36 N 8.04 0.01 -0.00 0.43 0.11 -1.96 -0.77 132.00 137.86 1plf h PRO 36 Ca -0.22 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1plf h PRO 36 Cb 1.08 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1plf h PRO 36 CO 0.95 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.28 1plf n ARG 37 N -4.10 1.08 0.00 1.05 1.74 -1.26 -3.40 116.66 111.77 1plf n ARG 37 Ca 0.34 -0.11 0.13 0.00 -0.77 0.00 0.00 57.85 57.43 1plf n ARG 37 Cb 1.57 -1.48 0.22 0.00 -1.02 0.00 0.00 32.46 31.75 1plf n ARG 37 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1plf n HIS 38 N -0.84 0.00 -3.29 -1.55 8.25 -0.29 -4.96 115.22 112.53 1plf n HIS 38 Ca 0.22 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.30 1plf n HIS 38 Cb 0.13 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.18 1plf n HIS 38 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1plf s ILE 39 N -2.02 5.17 -0.15 1.59 -1.09 -1.22 -1.44 121.20 122.05 1plf s ILE 39 Ca 0.31 1.00 0.17 0.00 -2.23 0.00 0.00 60.65 59.89 1plf s ILE 39 Cb 0.20 -3.83 -0.25 0.00 -1.58 0.00 0.00 42.46 37.00 1plf s ILE 39 CO 0.32 0.33 0.43 -1.54 -1.23 0.00 0.00 174.94 173.25 1plf n SER 40 N 3.62 1.04 -3.73 3.58 3.41 0.20 -4.80 113.62 116.94 1plf n SER 40 Ca -0.07 -0.15 -0.14 0.00 -0.26 0.00 0.00 58.87 58.26 1plf n SER 40 Cb 0.52 1.65 -0.08 0.00 -0.26 0.00 0.00 64.21 66.04 1plf n SER 40 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1plf s SER 41 N -3.74 -0.25 -0.08 4.04 0.15 -1.10 -4.97 113.70 107.75 1plf s SER 41 Ca -0.04 0.14 0.02 0.00 0.70 0.00 0.00 55.95 56.76 1plf s SER 41 Cb 0.11 0.35 0.02 0.00 -1.71 0.00 0.00 66.02 64.79 1plf s SER 41 CO 0.71 -0.49 -0.12 -0.22 1.20 0.00 0.00 173.24 174.32 1plf s LEU 42 N -1.40 1.55 -0.15 3.45 2.96 -1.26 -1.20 118.68 122.63 1plf s LEU 42 Ca -0.12 -0.32 -0.00 0.00 -0.22 0.00 0.00 54.13 53.47 1plf s LEU 42 Cb -0.04 -0.86 -0.01 0.00 0.50 0.00 0.00 46.19 45.78 1plf s LEU 42 CO 0.04 -0.00 -0.13 -0.70 -1.32 0.00 0.00 176.35 174.23 1plf s GLU 43 N 0.94 3.30 -0.35 1.98 2.12 0.46 -4.99 118.70 122.16 1plf s GLU 43 Ca -0.09 -0.71 -0.09 0.00 0.36 0.00 0.00 54.97 54.44 1plf s GLU 43 Cb -0.15 -2.67 0.03 0.00 0.26 0.00 0.00 34.13 31.60 1plf s GLU 43 CO 0.00 0.07 0.15 0.08 -0.54 0.00 0.00 175.26 175.03 1plf s VAL 44 N 0.70 4.26 -0.17 3.70 1.01 -1.26 -1.73 120.40 126.91 1plf s VAL 44 Ca -0.06 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 1plf s VAL 44 Cb -0.15 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 1plf s VAL 44 CO 0.02 -0.15 -0.06 -0.63 0.00 0.00 0.00 175.10 174.28 1plf s ILE 45 N 1.51 3.56 0.87 2.22 1.01 -0.41 -4.96 121.20 124.99 1plf s ILE 45 Ca 0.01 -0.46 -0.12 0.00 0.00 0.00 0.00 60.65 60.08 1plf s ILE 45 Cb -0.19 -2.56 0.11 0.00 0.01 0.00 0.00 42.46 39.83 1plf s ILE 45 CO 0.05 0.48 1.10 -0.83 0.00 0.00 0.00 174.94 175.73 1plf s GLY 46 N 0.69 1.62 0.55 6.18 0.00 -1.26 -0.61 107.32 114.49 1plf s GLY 46 Ca -0.03 -0.13 -0.18 0.00 0.00 0.00 0.00 44.72 44.38 1plf s GLY 46 CO 0.02 0.34 1.08 0.00 0.00 0.00 0.00 173.10 174.54 1plf s ALA 47 N -3.01 2.74 0.00 3.20 0.00 -1.26 -4.60 121.76 118.83 1plf s ALA 47 Ca 0.63 0.60 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1plf s ALA 47 Cb -0.17 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.67 1plf s ALA 47 CO 0.56 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 176.03 1plf n GLY 48 N -0.38 2.35 0.19 0.00 0.00 0.22 -4.97 105.19 102.60 1plf n GLY 48 Ca 0.10 -0.65 0.06 0.00 0.00 0.00 0.00 46.02 45.53 1plf n GLY 48 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1plf h LEU 49 N 0.00 0.00 -1.33 0.99 3.38 -2.00 -3.23 115.31 113.12 1plf h LEU 49 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1plf h LEU 49 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1plf h LEU 49 CO 0.00 0.36 -0.33 1.12 0.09 0.00 0.00 178.44 179.68 1plf h HIS 50 N 0.00 0.00 -1.22 1.13 2.07 -1.94 -3.45 115.15 111.75 1plf h HIS 50 Ca -0.00 0.00 0.15 0.00 -2.85 0.00 0.00 60.37 57.67 1plf h HIS 50 Cb 0.98 0.00 -0.27 0.00 2.57 0.00 0.00 27.41 30.69 1plf h HIS 50 CO 0.00 0.33 0.37 0.00 -3.07 0.00 0.00 177.93 175.56 1plf n PRO 52 N 4.16 0.15 -4.28 0.00 -0.04 -1.25 0.70 135.00 134.44 1plf n PRO 52 Ca -0.14 0.14 -0.18 0.00 -0.04 0.00 0.00 63.50 63.28 1plf n PRO 52 Cb 0.55 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.41 1plf n PRO 52 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1plf s SER 53 N -2.76 2.16 0.56 3.54 1.04 -1.26 -4.72 113.70 112.26 1plf s SER 53 Ca 0.14 -0.92 -0.20 0.00 0.48 0.00 0.00 55.95 55.46 1plf s SER 53 Cb 0.13 -0.08 -0.05 0.00 0.10 0.00 0.00 66.02 66.12 1plf s SER 53 CO 0.31 -0.19 1.19 -2.84 0.98 0.00 0.00 173.24 172.70 1plf s PRO 54 N -3.19 3.20 0.08 4.02 0.02 -1.26 -4.18 135.00 133.68 1plf s PRO 54 Ca 0.15 1.78 0.06 0.00 0.02 0.00 0.00 61.00 63.01 1plf s PRO 54 Cb -0.02 -2.03 -0.03 0.00 0.02 0.00 0.00 34.50 32.44 1plf s PRO 54 CO 0.04 -1.02 -0.15 -0.65 -0.33 0.00 0.00 177.00 174.89 1plf s GLN 55 N -3.21 0.87 -0.28 5.54 -0.21 0.22 -4.94 119.66 117.66 1plf s GLN 55 Ca 0.74 -0.98 0.03 0.00 0.02 0.00 0.00 55.36 55.16 1plf s GLN 55 Cb -0.29 -0.92 0.07 0.00 1.00 0.00 0.00 33.01 32.87 1plf s GLN 55 CO 0.32 0.21 -0.06 -0.51 -2.12 0.00 0.00 175.29 173.13 1plf s LEU 56 N -1.75 3.61 -0.22 2.90 1.43 -1.26 -1.29 118.68 122.10 1plf s LEU 56 Ca -0.01 -1.55 -0.02 0.00 -1.03 0.00 0.00 54.13 51.52 1plf s LEU 56 Cb -0.10 -1.50 0.01 0.00 0.03 0.00 0.00 46.19 44.62 1plf s LEU 56 CO 0.03 -0.24 -0.09 -0.63 0.23 0.00 0.00 176.35 175.64 1plf s ILE 57 N 1.10 2.91 -0.13 -0.59 1.01 -0.70 -1.45 121.20 123.35 1plf s ILE 57 Ca -0.04 -0.72 -0.04 0.00 0.00 0.00 0.00 60.65 59.85 1plf s ILE 57 Cb -0.20 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 1plf s ILE 57 CO -0.06 0.41 0.02 0.00 0.00 0.00 0.00 174.94 175.30 1plf s ALA 58 N 1.40 3.28 -0.25 9.38 0.00 -0.57 -0.41 121.76 134.59 1plf s ALA 58 Ca 0.04 -0.78 -0.10 0.00 0.00 0.00 0.00 51.96 51.13 1plf s ALA 58 Cb -0.14 -1.64 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 1plf s ALA 58 CO -0.06 0.39 0.14 0.99 0.00 0.00 0.00 175.76 177.22 1plf s THR 59 N -0.25 4.99 0.67 0.00 2.01 -0.34 -2.13 115.64 120.59 1plf s THR 59 Ca 0.06 0.06 -0.13 0.00 0.31 0.00 0.00 61.69 61.99 1plf s THR 59 Cb -0.12 -3.35 -0.00 0.00 0.01 0.00 0.00 72.50 69.04 1plf s THR 59 CO 0.02 0.31 1.06 -0.76 -0.69 0.00 0.00 174.62 174.57 1plf s LEU 60 N 1.46 3.26 0.20 4.42 1.43 0.12 0.59 118.68 130.16 1plf s LEU 60 Ca 0.07 1.73 0.19 0.00 -1.03 0.00 0.00 54.13 55.08 1plf s LEU 60 Cb -0.15 -4.51 0.85 0.00 0.03 0.00 0.00 46.19 42.41 1plf s LEU 60 CO 0.07 -1.42 1.58 0.29 0.23 0.00 0.00 176.35 177.10 1plf n LYS 61 N -2.75 0.12 0.02 1.70 5.02 -0.52 -0.46 118.16 121.31 1plf n LYS 61 Ca 0.08 0.45 0.13 0.00 -2.02 0.00 0.00 58.31 56.95 1plf n LYS 61 Cb 0.53 -1.78 0.33 0.00 -0.02 0.00 0.00 35.03 34.09 1plf n LYS 61 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1plf n THR 62 N -2.02 0.14 0.00 -0.18 -2.24 -1.26 -4.96 114.28 103.76 1plf n THR 62 Ca 0.01 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1plf n THR 62 Cb 0.15 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 1plf n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1plf n GLY 63 N 1.44 1.68 3.77 3.38 0.00 0.39 -5.04 105.19 110.81 1plf n GLY 63 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1plf n GLY 63 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1plf s ARG 64 N -0.82 3.95 -0.05 1.61 3.52 -1.26 -4.73 118.95 121.17 1plf s ARG 64 Ca 0.00 1.79 0.04 0.00 -0.13 0.00 0.00 55.73 57.43 1plf s ARG 64 Cb 0.00 -2.56 -0.02 0.00 -1.56 0.00 0.00 34.95 30.80 1plf s ARG 64 CO 0.00 -0.39 -0.15 0.15 -0.81 0.00 0.00 175.30 174.10 1plf s LYS 65 N -2.47 2.54 0.09 5.12 1.02 -1.26 0.16 119.74 124.95 1plf s LYS 65 Ca 0.60 -0.71 -0.03 0.00 0.02 0.00 0.00 55.97 55.85 1plf s LYS 65 Cb -0.29 -2.37 -0.03 0.00 -0.52 0.00 0.00 37.83 34.61 1plf s LYS 65 CO 0.36 0.59 0.06 0.96 -0.92 0.00 0.00 175.35 176.40 1plf s ILE 66 N -0.65 0.15 0.04 2.17 -4.36 -0.91 -5.01 121.20 112.64 1plf s ILE 66 Ca 0.10 -1.74 0.05 0.00 -0.26 0.00 0.00 60.65 58.80 1plf s ILE 66 Cb -0.11 -1.72 -0.04 0.00 1.25 0.00 0.00 42.46 41.84 1plf s ILE 66 CO 0.01 -0.70 -0.08 0.00 0.24 0.00 0.00 174.94 174.41 1plf s LEU 68 N -1.68 3.40 -0.24 0.00 1.43 -0.53 -0.87 118.68 120.19 1plf s LEU 68 Ca 0.19 -0.52 -0.14 0.00 -1.03 0.00 0.00 54.13 52.63 1plf s LEU 68 Cb -0.11 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 1plf s LEU 68 CO 0.10 -0.01 0.31 -0.62 0.23 0.00 0.00 176.35 176.35 1plf s ASP 69 N -3.72 6.26 0.25 2.29 2.15 -1.26 -4.40 116.67 118.24 1plf s ASP 69 Ca 0.32 0.30 0.17 0.00 0.43 0.00 0.00 52.55 53.77 1plf s ASP 69 Cb -0.07 -2.18 0.93 0.00 -0.30 0.00 0.00 42.92 41.30 1plf s ASP 69 CO 0.22 -0.06 1.53 1.67 -0.17 0.00 0.00 175.17 178.35 1plf n GLN 70 N 4.70 0.11 -0.89 4.34 7.27 -1.26 -1.25 117.38 130.39 1plf n GLN 70 Ca -0.11 0.61 0.07 0.00 0.07 0.00 0.00 57.00 57.64 1plf n GLN 70 Cb 0.51 -1.86 0.40 0.00 2.41 0.00 0.00 30.24 31.70 1plf n GLN 70 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 1plf n GLN 71 N -2.10 4.87 -4.34 3.69 7.27 -1.26 -4.75 117.38 120.76 1plf n GLN 71 Ca -0.01 -3.12 -0.26 0.00 0.07 0.00 0.00 57.00 53.68 1plf n GLN 71 Cb 0.03 -2.27 -0.17 0.00 2.41 0.00 0.00 30.24 30.25 1plf n GLN 71 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 1plf s ASN 72 N -0.77 1.96 0.00 1.69 3.84 -0.38 -5.01 114.94 116.27 1plf s ASN 72 Ca 0.54 -0.31 0.20 0.00 0.21 0.00 0.00 52.86 53.49 1plf s ASN 72 Cb 0.41 -0.85 1.15 0.00 -0.55 0.00 0.00 41.25 41.41 1plf s ASN 72 CO 0.16 -0.02 1.57 -0.81 -2.79 0.00 0.00 177.10 175.21 1plf n PRO 73 N 4.22 0.58 -0.37 0.43 -0.04 -1.26 -3.34 135.00 135.22 1plf n PRO 73 Ca -0.19 0.01 0.03 0.00 -0.04 0.00 0.00 63.50 63.31 1plf n PRO 73 Cb 0.51 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.66 1plf n PRO 73 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1plf h LEU 74 N 0.00 1.02 -2.06 1.53 5.85 -1.95 -0.57 115.31 119.13 1plf h LEU 74 Ca 0.00 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1plf h LEU 74 Cb 0.02 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.85 1plf h LEU 74 CO 0.00 0.63 0.09 0.10 -0.34 0.00 0.00 178.44 178.92 1plf h TYR 75 N 1.14 0.00 -0.02 1.25 -0.00 -1.85 -0.98 116.97 116.51 1plf h TYR 75 Ca 0.44 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 59.03 1plf h TYR 75 Cb 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 36.93 1plf h TYR 75 CO -0.00 0.00 -0.63 0.87 -0.00 0.00 0.00 178.16 178.40 1plf h LYS 76 N 0.00 0.08 -0.52 0.10 1.57 -1.36 -2.58 116.57 113.87 1plf h LYS 76 Ca 0.05 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1plf h LYS 76 Cb 0.22 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1plf h LYS 76 CO -0.00 0.68 0.02 0.87 -0.57 0.00 0.00 179.45 180.45 1plf h LYS 77 N 0.06 0.90 0.03 3.15 1.57 -1.14 -2.53 116.57 118.61 1plf h LYS 77 Ca -0.01 -0.28 -0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1plf h LYS 77 Cb 1.12 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1plf h LYS 77 CO 0.09 0.92 -0.02 0.82 -0.57 0.00 0.00 179.45 180.69 1plf h ILE 78 N 0.77 1.07 -0.48 1.86 2.04 -1.42 0.48 117.51 121.84 1plf h ILE 78 Ca 0.15 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 1plf h ILE 78 Cb 0.50 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1plf h ILE 78 CO 0.02 0.08 0.29 0.40 0.00 0.00 0.00 178.15 178.94 1plf h ILE 79 N -0.18 1.14 -0.14 -0.67 2.04 -1.45 0.49 117.51 118.73 1plf h ILE 79 Ca -0.00 -0.30 -0.11 0.00 1.00 0.00 0.00 64.86 65.44 1plf h ILE 79 Cb 0.16 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1plf h ILE 79 CO 0.01 0.14 -0.34 0.50 0.00 0.00 0.00 178.15 178.46 1plf h LYS 80 N 0.65 0.48 -0.73 2.37 1.63 -1.13 -2.90 116.57 116.95 1plf h LYS 80 Ca 0.17 -0.33 -0.06 0.00 -0.85 0.00 0.00 60.65 59.58 1plf h LYS 80 Cb -0.02 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.62 1plf h LYS 80 CO -0.03 0.94 0.21 -0.09 -3.45 0.00 0.00 179.45 177.02 1plf h ARG 81 N 0.09 1.15 0.00 1.90 9.65 0.06 -3.12 114.38 124.11 1plf h ARG 81 Ca -0.00 -0.26 -0.10 0.00 -1.10 0.00 0.00 59.98 58.52 1plf h ARG 81 Cb 0.94 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 29.35 1plf h ARG 81 CO 0.07 0.99 -0.48 -0.07 2.80 0.00 0.00 179.97 183.28 1plf h LEU 82 N 1.09 0.00 -0.15 3.80 3.38 -0.10 -2.85 115.31 120.48 1plf h LEU 82 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1plf h LEU 82 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1plf h LEU 82 CO -0.00 0.48 -0.02 0.18 0.09 0.00 0.00 178.44 179.16 1plf n LEU 83 N -3.94 0.25 0.00 1.67 4.77 -1.10 -4.44 117.00 114.22 1plf n LEU 83 Ca -0.01 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1plf n LEU 83 Cb 0.50 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1plf n LEU 83 CO 0.40 0.04 0.02 0.29 -1.33 0.00 0.00 177.39 176.81 1plf n LYS 84 N -0.92 0.00 0.00 3.23 5.02 -1.07 -5.11 118.16 119.31 1plf n LYS 84 Ca 0.20 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.49 1plf n LYS 84 Cb 0.20 -0.30 0.00 0.00 -0.02 0.00 0.00 35.03 34.91 1plf n LYS 84 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33