#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mft h TYR 3 N 0.00 -0.40 -0.90 2.11 -1.99 -2.05 -2.39 116.97 111.34 1mft h TYR 3 Ca 0.00 -0.00 0.09 0.00 2.00 0.00 0.00 58.73 60.82 1mft h TYR 3 Cb 0.00 0.15 -0.06 0.00 2.00 0.00 0.00 36.73 38.81 1mft h TYR 3 CO 0.00 -0.24 0.58 -0.07 -0.00 0.00 0.00 178.16 178.43 1mft h LEU 4 N -0.38 0.83 -0.01 3.88 4.07 -1.99 0.40 115.31 122.12 1mft h LEU 4 Ca -0.02 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1mft h LEU 4 Cb 0.33 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 41.91 1mft h LEU 4 CO 0.01 0.50 0.00 -0.09 -1.08 0.00 0.00 178.44 177.78 1mft h ARG 5 N 0.93 0.01 -0.16 1.13 9.65 -1.95 -1.02 114.38 122.96 1mft h ARG 5 Ca 0.41 -0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 59.17 1mft h ARG 5 Cb 0.35 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.92 1mft h ARG 5 CO -0.17 0.02 -0.40 0.93 2.80 0.00 0.00 179.97 183.14 1mft h GLU 6 N -0.00 0.35 -0.42 0.20 3.07 -0.88 -2.50 114.58 114.40 1mft h GLU 6 Ca 0.00 -0.17 -0.04 0.00 -0.50 0.00 0.00 59.36 58.65 1mft h GLU 6 Cb 0.01 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.90 1mft h GLU 6 CO -0.00 0.70 0.10 -0.07 -1.40 0.00 0.00 179.01 178.34 1mft h LEU 7 N 0.29 0.64 -0.17 1.33 4.07 -0.79 -2.41 115.31 118.27 1mft h LEU 7 Ca 0.03 -0.24 0.02 0.00 0.08 0.00 0.00 57.88 57.77 1mft h LEU 7 Cb 0.84 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 42.40 1mft h LEU 7 CO 0.07 0.71 0.04 0.22 -1.08 0.00 0.00 178.44 178.40 1mft h TYR 8 N 0.54 0.07 -0.31 1.13 3.20 -1.00 -1.70 116.97 118.91 1mft h TYR 8 Ca 0.13 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.01 1mft h TYR 8 Cb 0.32 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1mft h TYR 8 CO 0.02 0.03 0.20 0.87 -1.64 0.00 0.00 178.16 177.64 1mft h LYS 9 N 0.12 0.40 -0.97 1.82 1.57 -1.41 -2.27 116.57 115.84 1mft h LYS 9 Ca 0.07 -0.02 0.13 0.00 -1.87 0.00 0.00 60.65 58.96 1mft h LYS 9 Cb 0.06 -0.09 -0.09 0.00 0.08 0.00 0.00 32.23 32.19 1mft h LYS 9 CO -0.09 0.27 0.59 1.25 -0.57 0.00 0.00 179.45 180.89 1mft h LEU 10 N 0.41 0.83 -1.06 2.94 6.46 -1.13 0.18 115.31 123.95 1mft h LEU 10 Ca 0.11 0.06 -0.09 0.00 -0.12 0.00 0.00 57.88 57.85 1mft h LEU 10 Cb -0.04 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.77 1mft h LEU 10 CO -0.03 0.41 -0.25 -0.33 -0.62 0.00 0.00 178.44 177.63 1mft h GLU 11 N 0.89 0.37 -0.08 1.25 4.39 -0.81 0.32 114.58 120.90 1mft h GLU 11 Ca 0.50 -0.13 -0.16 0.00 0.34 0.00 0.00 59.36 59.91 1mft h GLU 11 Cb 0.57 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.20 1mft h GLU 11 CO -0.30 0.60 -0.57 1.96 -1.16 0.00 0.00 179.01 179.54 1mft h GLN 12 N 0.33 0.53 -0.45 2.33 4.20 -0.43 -0.42 115.11 121.20 1mft h GLN 12 Ca 0.05 -0.46 0.01 0.00 0.06 0.00 0.00 58.65 58.31 1mft h GLN 12 Cb 0.62 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 1mft h GLN 12 CO 0.04 1.09 0.30 1.96 -0.67 0.00 0.00 178.83 181.55 1mft h GLN 13 N 0.12 0.58 0.10 1.46 4.20 -0.57 -1.01 115.11 120.00 1mft h GLN 13 Ca -0.05 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.64 1mft h GLN 13 Cb 1.22 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.85 1mft h GLN 13 CO 0.12 0.39 -0.17 0.00 -0.67 0.00 0.00 178.83 178.49 1mft h ALA 14 N 1.17 -0.29 -0.74 3.87 0.00 -0.90 -1.87 119.26 120.51 1mft h ALA 14 Ca 0.17 -0.03 0.17 0.00 0.00 0.00 0.00 54.91 55.22 1mft h ALA 14 Cb -0.06 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1mft h ALA 14 CO -0.04 -0.70 0.50 0.52 0.00 0.00 0.00 179.25 179.53 1mft h MET 15 N -0.34 0.26 -0.10 0.00 2.86 -0.56 0.11 114.93 117.16 1mft h MET 15 Ca 0.02 -0.02 -0.22 0.00 -2.06 0.00 0.00 59.70 57.43 1mft h MET 15 Cb 0.35 -0.06 0.01 0.00 0.06 0.00 0.00 31.60 31.96 1mft h MET 15 CO -0.10 0.17 -0.83 -0.22 1.06 0.00 0.00 176.91 177.00 1mft h LYS 16 N 0.26 0.66 -0.20 1.72 3.64 -0.56 -2.57 116.57 119.53 1mft h LYS 16 Ca 0.36 -0.58 -0.19 0.00 -1.27 0.00 0.00 60.65 58.97 1mft h LYS 16 Cb 1.03 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1mft h LYS 16 CO -0.09 1.19 -0.63 -0.07 -2.27 0.00 0.00 179.45 177.59 1mft h LEU 17 N 0.43 0.81 -0.40 5.20 -0.00 -0.28 -2.33 115.31 118.74 1mft h LEU 17 Ca -0.06 -0.47 -0.18 0.00 -0.00 0.00 0.00 57.88 57.16 1mft h LEU 17 Cb 1.45 -0.23 -0.00 0.00 -0.00 0.00 0.00 40.66 41.87 1mft h LEU 17 CO 0.16 1.24 -0.65 1.88 -0.00 0.00 0.00 178.44 181.07 1mft h TYR 18 N 0.52 0.75 0.67 1.13 -1.99 -1.14 0.22 116.97 117.13 1mft h TYR 18 Ca -0.01 -0.30 -0.03 0.00 2.00 0.00 0.00 58.73 60.39 1mft h TYR 18 Cb 1.23 -0.13 0.01 0.00 2.00 0.00 0.00 36.73 39.83 1mft h TYR 18 CO 0.07 1.07 -0.32 -0.09 -0.00 0.00 0.00 178.16 178.88 1mft h ARG 19 N 0.42 -0.86 -0.94 4.88 2.43 -1.48 0.85 114.38 119.68 1mft h ARG 19 Ca -0.01 0.06 0.15 0.00 -0.81 0.00 0.00 59.98 59.36 1mft h ARG 19 Cb 1.22 0.20 -0.08 0.00 -0.42 0.00 0.00 29.97 30.89 1mft h ARG 19 CO 0.12 -0.55 0.60 0.93 -1.51 0.00 0.00 179.97 179.56 1mft h GLU 20 N -1.00 0.75 -0.05 0.20 5.08 -1.43 -0.04 114.58 118.09 1mft h GLU 20 Ca -0.09 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1mft h GLU 20 Cb 0.72 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1mft h GLU 20 CO 0.15 0.50 -0.03 0.00 -1.00 0.00 0.00 179.01 178.63 1mft h ALA 21 N 1.59 0.07 -0.10 3.43 0.00 -0.11 -2.99 119.26 121.16 1mft h ALA 21 Ca 0.48 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.19 1mft h ALA 21 Cb 0.70 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1mft h ALA 21 CO -0.25 -0.18 -0.10 0.77 0.00 0.00 0.00 179.25 179.49 1mft h SER 22 N -0.29 -0.32 -0.82 0.00 0.02 0.16 -1.95 113.55 110.36 1mft h SER 22 Ca 0.01 0.06 0.09 0.00 -0.84 0.00 0.00 61.79 61.12 1mft h SER 22 Cb 0.47 0.16 -0.07 0.00 0.14 0.00 0.00 62.40 63.09 1mft h SER 22 CO 0.01 -0.14 0.47 -0.33 -1.14 0.00 0.00 176.83 175.69 1mft h GLU 23 N -0.13 0.76 0.00 3.45 4.39 -1.09 -2.15 114.58 119.81 1mft h GLU 23 Ca 0.07 -0.05 -0.15 0.00 0.34 0.00 0.00 59.36 59.57 1mft h GLU 23 Cb 0.23 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1mft h GLU 23 CO -0.18 0.51 -0.73 0.87 -1.16 0.00 0.00 179.01 178.32 1mft h LYS 24 N 0.79 0.00 -6.35 2.33 6.56 -1.41 -3.45 116.57 115.05 1mft h LYS 24 Ca 0.39 0.00 -0.64 0.00 -1.06 0.00 0.00 60.65 59.34 1mft h LYS 24 Cb 0.35 0.00 0.05 0.00 -0.57 0.00 0.00 32.23 32.06 1mft h LYS 24 CO -0.24 0.73 0.70 0.00 -2.06 0.00 0.00 179.45 178.58 1mft n ALA 25 N -2.37 0.18 0.30 3.86 0.00 -0.74 -4.86 120.51 116.89 1mft n ALA 25 Ca -0.00 0.45 0.03 0.00 0.00 0.00 0.00 53.44 53.92 1mft n ALA 25 Cb 0.73 -2.24 -0.01 0.00 0.00 0.00 0.00 19.45 17.93 1mft n ALA 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mft n ARG 26 N 3.62 3.22 -3.20 0.00 1.74 -1.26 -4.85 116.66 115.92 1mft n ARG 26 Ca 0.19 -0.32 -0.40 0.00 -0.77 0.00 0.00 57.85 56.56 1mft n ARG 26 Cb 0.23 -0.92 -0.07 0.00 -1.02 0.00 0.00 32.46 30.69 1mft n ARG 26 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1mft s ASN 27 N -1.26 6.56 0.14 0.55 3.84 -1.26 -4.97 114.94 118.54 1mft s ASN 27 Ca 0.04 0.68 -0.27 0.00 0.21 0.00 0.00 52.86 53.52 1mft s ASN 27 Cb 0.05 -2.31 -0.01 0.00 -0.55 0.00 0.00 41.25 38.43 1mft s ASN 27 CO 0.20 -0.24 1.59 -0.65 -2.79 0.00 0.00 177.10 175.21 1mft h PRO 28 N 7.64 -0.37 -0.06 0.43 0.11 -2.00 -1.73 132.00 136.01 1mft h PRO 28 Ca -0.31 0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.86 1mft h PRO 28 Cb 1.15 0.08 -0.05 0.00 0.11 0.00 0.00 31.00 32.29 1mft h PRO 28 CO 0.75 -0.25 -0.30 0.93 -0.21 0.00 0.00 178.00 178.92 1mft h GLU 29 N -0.39 -0.39 -0.18 1.05 3.07 -2.00 -1.13 114.58 114.62 1mft h GLU 29 Ca 0.11 0.03 0.05 0.00 -0.50 0.00 0.00 59.36 59.05 1mft h GLU 29 Cb 0.59 0.09 -0.07 0.00 -0.84 0.00 0.00 28.75 28.52 1mft h GLU 29 CO -0.47 -0.26 -0.44 0.87 -1.40 0.00 0.00 179.01 177.31 1mft h LYS 30 N -0.41 -0.46 -0.61 2.33 6.56 -1.93 -1.59 116.57 120.47 1mft h LYS 30 Ca 0.08 0.03 0.12 0.00 -1.06 0.00 0.00 60.65 59.82 1mft h LYS 30 Cb 0.52 0.10 -0.11 0.00 -0.57 0.00 0.00 32.23 32.18 1mft h LYS 30 CO -0.29 -0.31 -0.12 -0.22 -2.06 0.00 0.00 179.45 176.45 1mft h LYS 31 N -0.48 0.02 -0.77 3.15 3.64 -0.93 0.21 116.57 121.42 1mft h LYS 31 Ca 0.08 -0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.55 1mft h LYS 31 Cb 0.63 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.39 1mft h LYS 31 CO -0.44 0.01 0.50 0.77 -2.27 0.00 0.00 179.45 178.03 1mft h SER 32 N 0.02 0.62 0.18 4.20 0.02 -0.30 -0.06 113.55 118.22 1mft h SER 32 Ca 0.30 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.26 1mft h SER 32 Cb 0.47 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1mft h SER 32 CO -0.61 0.37 -0.08 0.58 -1.14 0.00 0.00 176.83 175.95 1mft h VAL 33 N 0.69 0.89 -0.57 2.27 2.07 0.21 -1.45 116.25 120.36 1mft h VAL 33 Ca 0.35 -1.00 0.03 0.00 0.82 0.00 0.00 66.70 66.90 1mft h VAL 33 Cb 0.46 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 1mft h VAL 33 CO -0.13 0.21 0.34 -0.07 0.02 0.00 0.00 177.57 177.94 1mft h LEU 34 N -0.78 0.55 -1.41 2.57 -0.00 -0.92 -1.53 115.31 113.78 1mft h LEU 34 Ca -0.02 0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.83 1mft h LEU 34 Cb 0.52 -0.11 -0.02 0.00 -0.00 0.00 0.00 40.66 41.05 1mft h LEU 34 CO 0.04 0.38 0.05 1.56 -0.00 0.00 0.00 178.44 180.48 1mft h GLN 35 N 0.67 0.45 -0.49 1.13 4.20 -1.08 0.01 115.11 120.01 1mft h GLN 35 Ca 0.23 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.74 1mft h GLN 35 Cb 0.04 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 1mft h GLN 35 CO -0.11 0.43 -0.21 -0.22 -0.67 0.00 0.00 178.83 178.05 1mft h LYS 36 N 0.44 1.00 -0.08 1.46 1.63 -0.33 -2.15 116.57 118.54 1mft h LYS 36 Ca 0.10 -0.42 -0.19 0.00 -0.85 0.00 0.00 60.65 59.28 1mft h LYS 36 Cb 0.20 -0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 31.80 1mft h LYS 36 CO -0.00 1.10 -0.76 0.82 -3.45 0.00 0.00 179.45 177.16 1mft h ILE 37 N 0.86 1.37 -0.49 2.00 2.04 -0.92 -2.32 117.51 120.04 1mft h ILE 37 Ca 0.11 -2.16 0.06 0.00 1.00 0.00 0.00 64.86 63.87 1mft h ILE 37 Cb 0.79 2.13 -0.05 0.00 -0.74 0.00 0.00 36.82 38.95 1mft h ILE 37 CO 0.07 0.65 0.21 0.25 0.00 0.00 0.00 178.15 179.32 1mft h LEU 38 N 0.31 0.25 -0.83 1.44 5.85 -0.90 0.32 115.31 121.75 1mft h LEU 38 Ca -0.04 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.77 1mft h LEU 38 Cb 1.35 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 42.34 1mft h LEU 38 CO 0.14 0.18 0.52 -0.08 -0.34 0.00 0.00 178.44 178.85 1mft h GLU 39 N 0.41 0.94 -0.59 1.25 4.81 -1.23 -0.46 114.58 119.71 1mft h GLU 39 Ca 0.23 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 59.30 1mft h GLU 39 Cb 0.20 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 1mft h GLU 39 CO -0.20 0.63 -0.05 -0.44 -0.73 0.00 0.00 179.01 178.22 1mft h ASP 40 N 0.97 1.05 -0.61 1.04 3.32 -0.38 -1.62 116.42 120.20 1mft h ASP 40 Ca 0.35 -0.32 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 1mft h ASP 40 Cb 0.10 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1mft h ASP 40 CO -0.15 1.13 0.06 -0.33 -1.72 0.00 0.00 179.24 178.23 1mft h GLU 41 N 0.96 1.05 -0.47 3.56 4.39 0.25 -2.08 114.58 122.23 1mft h GLU 41 Ca 0.16 -0.29 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1mft h GLU 41 Cb 0.61 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.12 1mft h GLU 41 CO 0.04 0.99 0.30 0.93 -1.16 0.00 0.00 179.01 180.10 1mft h GLU 42 N 0.97 0.64 -0.98 2.33 5.08 -0.87 -1.92 114.58 119.82 1mft h GLU 42 Ca 0.19 -0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.60 1mft h GLU 42 Cb 0.48 -0.14 -0.08 0.00 0.50 0.00 0.00 28.75 29.51 1mft h GLU 42 CO 0.02 0.45 0.63 -0.22 -1.00 0.00 0.00 179.01 178.89 1mft h LYS 43 N 0.64 0.98 -0.59 2.33 3.64 -0.96 -2.52 116.57 120.09 1mft h LYS 43 Ca 0.17 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 1mft h LYS 43 Cb -0.03 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.54 1mft h LYS 43 CO -0.03 0.65 0.23 0.45 -2.27 0.00 0.00 179.45 178.47 1mft h HIS 44 N 1.01 0.90 -0.72 1.91 3.86 -0.67 -0.95 115.15 120.49 1mft h HIS 44 Ca 0.47 -0.07 0.08 0.00 -1.16 0.00 0.00 60.37 59.69 1mft h HIS 44 Cb 0.41 -0.27 -0.07 0.00 1.06 0.00 0.00 27.41 28.54 1mft h HIS 44 CO -0.00 0.73 0.39 0.82 0.86 0.00 0.00 177.93 180.72 1mft h ILE 45 N 0.82 0.91 -0.16 2.45 1.08 -1.01 0.10 117.51 121.69 1mft h ILE 45 Ca 0.20 -0.23 -0.02 0.00 -0.39 0.00 0.00 64.86 64.41 1mft h ILE 45 Cb 0.21 0.17 -0.01 0.00 -3.07 0.00 0.00 36.82 34.13 1mft h ILE 45 CO -0.01 0.12 0.03 -0.08 -0.69 0.00 0.00 178.15 177.51 1mft h GLU 46 N 0.68 0.26 -0.62 2.37 4.81 -1.23 -1.98 114.58 118.87 1mft h GLU 46 Ca 0.34 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.45 1mft h GLU 46 Cb 0.30 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1mft h GLU 46 CO -0.23 0.44 0.20 -1.49 -0.73 0.00 0.00 179.01 177.20 1mft h TRP 47 N 0.05 0.96 -0.63 0.92 6.55 -0.61 -2.28 115.95 120.91 1mft h TRP 47 Ca 0.05 -0.08 -0.06 0.00 0.95 0.00 0.00 58.89 59.75 1mft h TRP 47 Cb 0.30 -0.29 -0.03 0.00 -0.86 0.00 0.00 29.16 28.29 1mft h TRP 47 CO 0.02 0.77 0.14 -0.07 -1.05 0.00 0.00 178.44 178.24 1mft h LEU 48 N 0.91 0.94 -2.34 -4.49 3.38 -0.68 -1.10 115.31 111.94 1mft h LEU 48 Ca 0.21 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1mft h LEU 48 Cb 0.25 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1mft h LEU 48 CO -0.01 0.92 0.00 -0.33 0.09 0.00 0.00 178.44 179.11 1mft h GLU 49 N 0.94 0.00 -0.05 1.13 4.39 -0.81 -0.65 114.58 119.54 1mft h GLU 49 Ca 0.20 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.81 1mft h GLU 49 Cb 0.36 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 1mft h GLU 49 CO 0.00 0.00 -0.38 1.15 -1.16 0.00 0.00 179.01 178.62 1mft h THR 50 N 0.00 1.29 0.00 1.13 2.02 -0.75 -3.16 112.91 113.43 1mft h THR 50 Ca 0.00 -1.37 -0.00 0.00 0.77 0.00 0.00 66.41 65.81 1mft h THR 50 Cb 0.22 1.68 -0.00 0.00 -1.74 0.00 0.00 68.15 68.31 1mft h THR 50 CO 0.00 0.40 -0.04 2.30 0.37 0.00 0.00 175.52 178.55 1mft n ILE 51 N -4.07 1.79 1.99 3.11 -5.35 -0.42 -5.12 119.36 111.29 1mft n ILE 51 Ca -0.02 -2.16 0.16 0.00 -0.27 0.00 0.00 62.75 60.46 1mft n ILE 51 Cb 0.43 -0.20 0.94 0.00 -1.74 0.00 0.00 39.64 39.07 1mft n ILE 51 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38