#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x22 s LYS 2 N 0.00 0.95 -0.71 1.61 -0.14 -1.26 -5.08 119.74 115.11 1x22 s LYS 2 Ca 0.00 -0.05 0.05 0.00 -1.36 0.00 0.00 55.97 54.61 1x22 s LYS 2 Cb 0.00 -1.14 0.17 0.00 -1.68 0.00 0.00 37.83 35.18 1x22 s LYS 2 CO 0.00 -0.24 0.51 1.51 -0.76 0.00 0.00 175.35 176.37 1x22 n ILE 3 N 4.85 1.71 -1.78 2.17 0.00 -1.26 -5.03 119.36 120.03 1x22 n ILE 3 Ca -0.12 -4.89 -0.28 0.00 0.00 0.00 0.00 62.75 57.46 1x22 n ILE 3 Cb 0.50 -2.19 -0.08 0.00 0.00 0.00 0.00 39.64 37.87 1x22 n ILE 3 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1x22 n PRO 4 N 1.94 1.19 0.01 9.51 -0.02 -1.26 -4.67 135.00 141.69 1x22 n PRO 4 Ca 0.20 -2.16 -0.18 0.00 -2.02 0.00 0.00 63.50 59.33 1x22 n PRO 4 Cb 0.35 -3.62 -0.10 0.00 -0.02 0.00 0.00 33.50 30.11 1x22 n PRO 4 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1x22 h VAL 5 N 6.01 1.33 0.00 -1.45 3.04 -1.99 -2.40 116.25 120.79 1x22 h VAL 5 Ca 0.20 -2.08 0.00 0.00 -1.01 0.00 0.00 66.70 63.81 1x22 h VAL 5 Cb 0.91 2.32 0.00 0.00 -2.01 0.00 0.00 31.29 32.50 1x22 h VAL 5 CO 1.31 0.64 0.10 0.11 -1.01 0.00 0.00 177.57 178.71 1x22 h LYS 6 N 0.27 0.00 0.16 4.17 1.57 -2.00 0.16 116.57 120.89 1x22 h LYS 6 Ca -0.09 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.35 1x22 h LYS 6 Cb 1.46 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.77 1x22 h LYS 6 CO 0.16 0.00 -1.79 0.00 -0.57 0.00 0.00 179.45 177.25 1x22 h ALA 7 N 1.79 0.25 -0.08 3.86 0.00 -1.89 -2.96 119.26 120.24 1x22 h ALA 7 Ca 0.00 -1.22 -0.05 0.00 0.00 0.00 0.00 54.91 53.64 1x22 h ALA 7 Cb 0.20 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1x22 h ALA 7 CO 0.00 1.09 -0.17 0.97 0.00 0.00 0.00 179.25 181.14 1x22 h ILE 8 N 0.03 1.17 0.08 0.00 2.10 -0.36 -1.82 117.51 118.72 1x22 h ILE 8 Ca -0.37 -0.77 -0.00 0.00 1.08 0.00 0.00 64.86 64.80 1x22 h ILE 8 Cb 2.03 1.30 0.00 0.00 -1.09 0.00 0.00 36.82 39.07 1x22 h ILE 8 CO 0.13 0.23 -0.04 0.11 -1.08 0.00 0.00 178.15 177.50 1x22 h LYS 9 N 0.12 -0.11 -0.19 2.19 1.79 -0.92 -2.60 116.57 116.84 1x22 h LYS 9 Ca 0.02 0.01 0.06 0.00 -2.18 0.00 0.00 60.65 58.56 1x22 h LYS 9 Cb 0.38 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 1x22 h LYS 9 CO 0.03 0.40 0.28 0.87 -1.08 0.00 0.00 179.45 179.95 1x22 h LYS 10 N -0.72 0.00 -0.00 3.15 1.57 -1.33 -0.44 116.57 118.80 1x22 h LYS 10 Ca -0.01 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 1x22 h LYS 10 Cb 0.56 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.88 1x22 h LYS 10 CO 0.02 0.00 -0.27 0.00 -0.57 0.00 0.00 179.45 178.63 1x22 h ALA 11 N 1.62 0.04 0.00 3.86 0.00 -1.20 -2.62 119.26 120.95 1x22 h ALA 11 Ca 0.09 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1x22 h ALA 11 Cb 0.66 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1x22 h ALA 11 CO -0.00 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.76 1x22 n GLY 12 N 1.03 -0.90 0.07 0.00 0.00 -0.23 -1.86 105.19 103.30 1x22 n GLY 12 Ca -0.10 0.16 -0.07 0.00 0.00 0.00 0.00 46.02 46.01 1x22 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x22 h ALA 13 N 2.05 0.04 -0.70 4.61 0.00 -1.29 -2.65 119.26 121.32 1x22 h ALA 13 Ca 0.00 -0.42 0.10 0.00 0.00 0.00 0.00 54.91 54.59 1x22 h ALA 13 Cb 0.06 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1x22 h ALA 13 CO 0.00 0.25 0.33 0.00 0.00 0.00 0.00 179.25 179.83 1x22 h ALA 14 N -0.73 0.96 -0.59 0.00 0.00 -1.18 -0.44 119.26 117.29 1x22 h ALA 14 Ca -0.05 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1x22 h ALA 14 Cb 0.53 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1x22 h ALA 14 CO -0.03 -0.09 0.11 0.82 0.00 0.00 0.00 179.25 180.06 1x22 h ILE 15 N 0.55 1.26 -0.65 0.00 2.04 -1.54 -2.21 117.51 116.97 1x22 h ILE 15 Ca 0.35 -0.96 0.14 0.00 1.00 0.00 0.00 64.86 65.39 1x22 h ILE 15 Cb 0.41 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1x22 h ILE 15 CO -0.29 0.35 0.44 1.23 0.00 0.00 0.00 178.15 179.88 1x22 h GLY 16 N 0.87 0.44 1.69 5.37 0.00 -0.73 0.44 103.07 111.15 1x22 h GLY 16 Ca 0.18 -0.12 -0.23 0.00 0.00 0.00 0.00 47.33 47.16 1x22 h GLY 16 CO 0.01 0.05 -1.03 1.70 0.00 0.00 0.00 176.54 177.27 1x22 h LYS 17 N 0.28 0.26 -0.09 4.80 3.11 -0.79 -2.86 116.57 121.27 1x22 h LYS 17 Ca 0.31 -0.34 0.01 0.00 -2.81 0.00 0.00 60.65 57.83 1x22 h LYS 17 Cb 0.84 0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 32.16 1x22 h LYS 17 CO -0.07 1.09 -0.00 0.78 -2.81 0.00 0.00 179.45 178.43 1x22 h GLY 18 N 1.70 0.08 0.92 5.01 0.00 -0.34 0.15 103.07 110.59 1x22 h GLY 18 Ca -0.08 0.01 -0.06 0.00 0.00 0.00 0.00 47.33 47.20 1x22 h GLY 18 CO 0.16 -0.01 -0.02 1.41 0.00 0.00 0.00 176.54 178.08 1x22 h LEU 19 N 0.03 0.62 -0.98 3.11 3.38 -1.53 -2.90 115.31 117.05 1x22 h LEU 19 Ca 0.04 -0.32 0.09 0.00 0.09 0.00 0.00 57.88 57.78 1x22 h LEU 19 Cb 0.05 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.56 1x22 h LEU 19 CO -0.07 0.80 0.62 0.03 0.09 0.00 0.00 178.44 179.90 1x22 h ARG 20 N 0.43 1.03 0.12 1.13 2.47 -1.29 0.79 114.38 119.07 1x22 h ARG 20 Ca 0.10 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.76 1x22 h ARG 20 Cb 0.49 -0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 28.56 1x22 h ARG 20 CO 0.02 0.68 -0.15 0.00 0.56 0.00 0.00 179.97 181.09 1x22 h ALA 21 N 1.48 -0.27 -0.31 0.04 0.00 -0.77 -0.17 119.26 119.26 1x22 h ALA 21 Ca 0.45 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.31 1x22 h ALA 21 Cb 0.30 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1x22 h ALA 21 CO -0.21 -0.68 0.09 0.82 0.00 0.00 0.00 179.25 179.27 1x22 h ILE 22 N -0.31 1.14 0.85 0.00 5.03 -1.20 -2.05 117.51 120.97 1x22 h ILE 22 Ca 0.01 -0.46 -0.04 0.00 -0.12 0.00 0.00 64.86 64.24 1x22 h ILE 22 Cb 0.31 0.80 0.01 0.00 -3.03 0.00 0.00 36.82 34.91 1x22 h ILE 22 CO -0.06 0.17 -0.41 -1.13 -0.68 0.00 0.00 178.15 176.04 1x22 h ASN 23 N 0.44 -0.97 -0.88 1.72 -0.73 -0.04 0.88 115.58 116.00 1x22 h ASN 23 Ca 0.11 0.03 0.20 0.00 1.87 0.00 0.00 56.30 58.51 1x22 h ASN 23 Cb 0.14 0.25 -0.06 0.00 0.27 0.00 0.00 38.32 38.92 1x22 h ASN 23 CO -0.01 -0.67 0.58 -0.29 -0.37 0.00 0.00 177.43 176.68 1x22 h ILE 24 N -1.19 0.69 -0.16 2.57 2.10 -0.91 0.50 117.51 121.11 1x22 h ILE 24 Ca -0.12 -0.13 -0.07 0.00 1.08 0.00 0.00 64.86 65.62 1x22 h ILE 24 Cb 0.88 0.26 -0.00 0.00 -1.09 0.00 0.00 36.82 36.87 1x22 h ILE 24 CO 0.19 0.07 -0.16 0.00 -1.08 0.00 0.00 178.15 177.17 1x22 h ALA 25 N 1.61 0.23 0.00 0.18 0.00 -1.10 -2.17 119.26 118.01 1x22 h ALA 25 Ca 0.45 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1x22 h ALA 25 Cb 1.14 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1x22 h ALA 25 CO -0.16 0.12 0.00 0.43 0.00 0.00 0.00 179.25 179.64 1x22 n SER 26 N -4.53 0.00 -0.07 0.00 7.64 0.28 -3.47 113.62 113.47 1x22 n SER 26 Ca -0.06 -0.18 -0.06 0.00 1.01 0.00 0.00 58.87 59.59 1x22 n SER 26 Cb 0.37 -0.20 -0.02 0.00 -1.01 0.00 0.00 64.21 63.35 1x22 n SER 26 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1x22 n THR 27 N -1.20 1.43 -0.28 0.44 -1.04 0.01 -4.17 114.28 109.46 1x22 n THR 27 Ca 0.11 0.20 -0.03 0.00 -2.04 0.00 0.00 64.05 62.29 1x22 n THR 27 Cb 0.13 -2.38 0.00 0.00 -1.82 0.00 0.00 70.33 66.27 1x22 n THR 27 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1x22 n ALA 28 N -3.67 -0.19 -0.18 2.41 0.00 -0.85 0.93 120.51 118.96 1x22 n ALA 28 Ca -0.09 0.69 -0.03 0.00 0.00 0.00 0.00 53.44 54.01 1x22 n ALA 28 Cb 0.30 -0.26 0.04 0.00 0.00 0.00 0.00 19.45 19.53 1x22 n ALA 28 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1x22 h HIS 29 N 0.00 -0.45 0.00 0.00 2.07 -1.78 0.50 115.15 115.50 1x22 h HIS 29 Ca 0.21 0.05 -0.00 0.00 -2.85 0.00 0.00 60.37 57.79 1x22 h HIS 29 Cb 0.39 0.28 -0.00 0.00 2.57 0.00 0.00 27.41 30.65 1x22 h HIS 29 CO -0.66 -0.28 -0.00 -0.44 -3.07 0.00 0.00 177.93 173.47 1x22 h ASP 30 N -0.06 0.00 0.09 3.10 5.19 0.40 -1.90 116.42 123.25 1x22 h ASP 30 Ca 0.26 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.67 1x22 h ASP 30 Cb 0.46 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.97 1x22 h ASP 30 CO -0.60 0.00 -0.04 0.58 -3.12 0.00 0.00 179.24 176.06 1x22 h VAL 31 N 0.00 0.00 -0.19 -1.35 2.07 0.76 -2.79 116.25 114.75 1x22 h VAL 31 Ca -0.00 -0.46 0.05 0.00 0.82 0.00 0.00 66.70 67.11 1x22 h VAL 31 Cb 0.01 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.77 1x22 h VAL 31 CO 0.00 0.00 0.48 1.88 0.02 0.00 0.00 177.57 179.95 1x22 h TYR 32 N -0.58 0.00 0.36 1.57 0.05 -1.21 0.35 116.97 117.51 1x22 h TYR 32 Ca -0.01 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.75 1x22 h TYR 32 Cb 0.09 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.84 1x22 h TYR 32 CO 0.02 0.00 -0.17 1.03 -1.05 0.00 0.00 178.16 177.98 1x22 h SER 33 N 0.00 -0.41 -0.35 3.88 0.87 -1.39 -3.27 113.55 112.88 1x22 h SER 33 Ca 0.09 0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.59 1x22 h SER 33 Cb 1.05 0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 63.07 1x22 h SER 33 CO -0.00 -0.05 0.10 0.49 -0.53 0.00 0.00 176.83 176.84 1x22 n PHE 34 N -4.64 1.19 -0.09 2.24 3.72 -0.57 -4.09 117.46 115.22 1x22 n PHE 34 Ca -0.06 -0.60 -0.20 0.00 -0.05 0.00 0.00 57.45 56.53 1x22 n PHE 34 Cb 0.19 -0.39 -0.12 0.00 -0.94 0.00 0.00 39.48 38.22 1x22 n PHE 34 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 1x22 h PHE 35 N 1.54 0.05 -0.29 1.38 -1.00 -0.39 -3.39 116.94 114.83 1x22 h PHE 35 Ca 0.10 -0.04 0.04 0.00 2.81 0.00 0.00 57.97 60.88 1x22 h PHE 35 Cb 1.45 -0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.96 1x22 h PHE 35 CO 0.62 1.41 -0.13 1.63 -1.61 0.00 0.00 178.31 180.23 1x22 n LYS 36 N -4.40 -0.09 -0.51 1.51 5.02 -1.26 0.23 118.16 118.67 1x22 n LYS 36 Ca -0.27 0.44 0.39 0.00 -2.02 0.00 0.00 58.31 56.85 1x22 n LYS 36 Cb 0.67 -0.66 0.60 0.00 -0.02 0.00 0.00 35.03 35.62 1x22 n LYS 36 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1x22 n PRO 37 N -4.41 -0.00 -2.60 1.97 -0.01 -1.26 -3.13 135.00 125.55 1x22 n PRO 37 Ca 0.02 0.83 -0.03 0.00 -0.01 0.00 0.00 63.50 64.31 1x22 n PRO 37 Cb 0.10 -1.87 -0.03 0.00 -0.01 0.00 0.00 33.50 31.70 1x22 n PRO 37 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 175.50 175.85 1x22 n LYS 38 N -3.55 0.08 -0.05 -0.52 2.85 0.61 -5.06 118.16 112.53 1x22 n LYS 38 Ca 0.33 -0.56 -0.01 0.00 -1.05 0.00 0.00 58.31 57.02 1x22 n LYS 38 Cb 1.46 -0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 35.83 1x22 n LYS 38 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1x22 n HIS 39 N -0.49 -0.05 -3.55 5.58 8.25 0.26 -4.77 115.22 120.45 1x22 n HIS 39 Ca -0.29 0.14 -0.21 0.00 -0.26 0.00 0.00 57.72 57.10 1x22 n HIS 39 Cb 0.62 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.45 1x22 n HIS 39 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1x22 n LYS 40 N -3.01 -1.29 0.27 -0.41 3.00 -1.26 -4.86 118.16 110.60 1x22 n LYS 40 Ca 0.00 0.63 -0.12 0.00 -0.00 0.00 0.00 58.31 58.82 1x22 n LYS 40 Cb 0.03 -1.81 -0.06 0.00 0.00 0.00 0.00 35.03 33.19 1x22 n LYS 40 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 1x22 h LYS 41 N 0.02 -0.73 0.00 1.64 1.57 -2.01 -3.55 116.57 113.51 1x22 h LYS 41 Ca -0.53 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1x22 h LYS 41 Cb 1.16 0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1x22 h LYS 41 CO 0.30 -0.49 0.00 1.63 -0.57 0.00 0.00 179.45 180.32