#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lir s THR 3 N 0.00 1.13 -0.38 -2.13 -4.23 -0.98 -4.89 115.64 104.16 1lir s THR 3 Ca 0.00 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.56 1lir s THR 3 Cb 0.00 -2.37 0.47 0.00 1.34 0.00 0.00 72.50 71.94 1lir s THR 3 CO 0.00 0.00 1.49 1.67 -0.54 0.00 0.00 174.62 177.24 1lir n GLN 4 N -1.09 2.79 -4.46 3.99 7.27 -1.26 -4.73 117.38 119.89 1lir n GLN 4 Ca -0.12 -3.63 -0.24 0.00 0.07 0.00 0.00 57.00 53.08 1lir n GLN 4 Cb 0.66 -2.13 -0.10 0.00 2.41 0.00 0.00 30.24 31.09 1lir n GLN 4 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 1lir s GLU 5 N -3.54 1.66 0.28 3.69 -6.30 -1.26 -5.06 118.70 108.17 1lir s GLU 5 Ca 0.52 -1.77 0.06 0.00 -2.50 0.00 0.00 54.97 51.28 1lir s GLU 5 Cb 0.43 -1.67 -0.03 0.00 0.00 0.00 0.00 34.13 32.87 1lir s GLU 5 CO 0.01 0.28 0.33 -1.54 0.02 0.00 0.00 175.26 174.36 1lir s SER 6 N -3.50 5.81 0.19 -1.70 1.04 -1.26 -1.53 113.70 112.75 1lir s SER 6 Ca 0.29 -0.19 -0.01 0.00 0.48 0.00 0.00 55.95 56.52 1lir s SER 6 Cb -0.03 -1.41 -0.04 0.00 0.10 0.00 0.00 66.02 64.64 1lir s SER 6 CO 0.14 -0.20 0.13 0.00 0.98 0.00 0.00 173.24 174.29 1lir n THR 8 N -0.25 0.00 -4.27 0.00 -1.04 -1.26 -4.36 114.28 103.11 1lir n THR 8 Ca 0.01 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.87 1lir n THR 8 Cb 0.66 -0.97 -0.10 0.00 -1.82 0.00 0.00 70.33 68.09 1lir n THR 8 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1lir s ALA 9 N -1.99 1.48 0.06 2.41 0.00 -1.26 -4.98 121.76 117.48 1lir s ALA 9 Ca 0.00 -1.78 -0.18 0.00 0.00 0.00 0.00 51.96 50.00 1lir s ALA 9 Cb 0.00 1.12 -0.14 0.00 0.00 0.00 0.00 23.12 24.10 1lir s ALA 9 CO 0.00 -0.49 1.32 1.03 0.00 0.00 0.00 175.76 177.62 1lir h SER 10 N 2.50 0.57 -0.87 0.00 0.87 -1.91 0.39 113.55 115.12 1lir h SER 10 Ca -0.37 -0.54 0.22 0.00 -1.23 0.00 0.00 61.79 59.87 1lir h SER 10 Cb 1.24 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 62.99 1lir h SER 10 CO 0.58 1.01 0.60 -1.13 -0.53 0.00 0.00 176.83 177.36 1lir h ASN 11 N 0.16 0.20 0.36 6.23 -0.73 -1.96 0.25 115.58 120.09 1lir h ASN 11 Ca 0.01 0.02 -0.32 0.00 1.87 0.00 0.00 56.30 57.88 1lir h ASN 11 Cb 0.90 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 39.46 1lir h ASN 11 CO 0.07 0.08 -1.68 -0.61 -0.37 0.00 0.00 177.43 174.92 1lir h GLN 12 N 0.20 0.24 -0.38 6.67 4.15 -1.90 -3.31 115.11 120.78 1lir h GLN 12 Ca 0.43 -0.40 0.08 0.00 0.77 0.00 0.00 58.65 59.53 1lir h GLN 12 Cb 1.38 0.15 -0.02 0.00 0.21 0.00 0.00 27.48 29.20 1lir h GLN 12 CO -0.09 1.08 0.26 0.00 -1.93 0.00 0.00 178.83 178.15 1lir h TRP 14 N 0.17 0.61 -0.46 0.00 6.55 -1.25 -0.92 115.95 120.64 1lir h TRP 14 Ca 0.17 0.03 0.02 0.00 0.95 0.00 0.00 58.89 60.06 1lir h TRP 14 Cb 0.48 -0.17 -0.03 0.00 -0.86 0.00 0.00 29.16 28.58 1lir h TRP 14 CO -0.00 0.22 0.27 1.03 -1.05 0.00 0.00 178.44 178.91 1lir h SER 15 N 0.58 0.44 -0.28 -3.49 0.87 -1.28 0.25 113.55 110.64 1lir h SER 15 Ca 0.34 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.92 1lir h SER 15 Cb 0.36 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.22 1lir h SER 15 CO -0.27 0.32 0.17 0.40 -0.53 0.00 0.00 176.83 176.92 1lir h ILE 16 N 0.55 1.04 0.00 2.23 5.03 -1.23 -0.92 117.51 124.22 1lir h ILE 16 Ca 0.18 -0.12 -0.04 0.00 -0.12 0.00 0.00 64.86 64.76 1lir h ILE 16 Cb 0.01 0.66 -0.01 0.00 -3.03 0.00 0.00 36.82 34.46 1lir h ILE 16 CO -0.08 0.06 -0.21 0.00 -0.68 0.00 0.00 178.15 177.24 1lir h LYS 18 N 0.00 0.00 -0.00 0.00 3.64 0.25 0.86 116.57 121.31 1lir h LYS 18 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1lir h LYS 18 Cb 0.43 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1lir h LYS 18 CO 0.03 0.67 -0.87 2.89 -2.27 0.00 0.00 179.45 179.89 1lir n ARG 19 N -3.67 0.26 -0.00 1.90 1.85 -0.47 -3.69 116.66 112.83 1lir n ARG 19 Ca -0.01 -0.21 -0.01 0.00 -1.00 0.00 0.00 57.85 56.62 1lir n ARG 19 Cb 0.67 -1.50 -0.00 0.00 -1.05 0.00 0.00 32.46 30.58 1lir n ARG 19 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1lir n LEU 20 N -1.19 0.36 -2.09 2.89 4.32 0.16 -4.80 117.00 116.66 1lir n LEU 20 Ca 0.05 0.05 -0.26 0.00 -0.02 0.00 0.00 56.01 55.84 1lir n LEU 20 Cb 0.36 -0.28 0.13 0.00 -1.62 0.00 0.00 43.42 42.01 1lir n LEU 20 CO 0.40 -0.51 1.16 1.41 -1.22 0.00 0.00 177.39 178.62 1lir n HIS 21 N -2.84 2.81 -2.60 -1.77 8.25 0.13 -4.96 115.22 114.24 1lir n HIS 21 Ca -0.01 -2.34 -0.11 0.00 -0.26 0.00 0.00 57.72 55.00 1lir n HIS 21 Cb 0.05 -1.03 -0.03 0.00 1.12 0.00 0.00 29.99 30.11 1lir n HIS 21 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1lir n ASN 22 N -1.01 -0.26 -4.24 0.41 3.02 0.25 -4.73 115.26 108.69 1lir n ASN 22 Ca 0.56 -0.37 -0.13 0.00 -0.03 0.00 0.00 54.58 54.60 1lir n ASN 22 Cb 1.10 -0.47 -0.10 0.00 -0.61 0.00 0.00 39.78 39.70 1lir n ASN 22 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1lir s THR 23 N -2.24 0.36 -0.13 3.41 -4.23 -0.25 -4.84 115.64 107.73 1lir s THR 23 Ca 0.16 -1.98 0.16 0.00 -1.18 0.00 0.00 61.69 58.85 1lir s THR 23 Cb -0.10 -2.39 0.28 0.00 1.34 0.00 0.00 72.50 71.64 1lir s THR 23 CO 0.30 -0.18 1.15 -3.20 -0.54 0.00 0.00 174.62 172.14 1lir n ASN 24 N -0.30 1.98 -3.82 3.99 2.85 -1.26 -0.34 115.26 118.36 1lir n ASN 24 Ca -0.02 -3.08 -0.35 0.00 -0.11 0.00 0.00 54.58 51.02 1lir n ASN 24 Cb 0.65 -0.42 -0.04 0.00 1.24 0.00 0.00 39.78 41.21 1lir n ASN 24 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1lir n ARG 25 N -1.20 3.24 -4.47 1.20 3.00 -1.26 -4.80 116.66 112.38 1lir n ARG 25 Ca 0.15 -4.58 -0.23 0.00 -0.01 0.00 0.00 57.85 53.18 1lir n ARG 25 Cb 0.67 -2.39 -0.10 0.00 0.00 0.00 0.00 32.46 30.63 1lir n ARG 25 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1lir s GLY 26 N -1.57 1.97 -0.00 -0.13 0.00 -1.26 -1.32 107.32 105.00 1lir s GLY 26 Ca 0.33 -1.98 0.01 0.00 0.00 0.00 0.00 44.72 43.08 1lir s GLY 26 CO -0.00 -1.90 -0.02 1.25 0.00 0.00 0.00 173.10 172.42 1lir s LYS 27 N -3.70 0.21 -0.25 2.90 2.47 0.05 -4.69 119.74 116.73 1lir s LYS 27 Ca 0.31 -0.07 -0.09 0.00 -1.56 0.00 0.00 55.97 54.56 1lir s LYS 27 Cb 0.04 -0.23 -0.04 0.00 -1.46 0.00 0.00 37.83 36.14 1lir s LYS 27 CO 0.14 0.03 0.12 0.00 0.16 0.00 0.00 175.35 175.80 1lir s MET 29 N 1.49 1.01 -0.67 0.00 -1.94 -0.47 -4.80 119.30 113.91 1lir s MET 29 Ca 0.06 -0.27 -0.10 0.00 -1.71 0.00 0.00 55.69 53.68 1lir s MET 29 Cb -0.15 -0.93 0.01 0.00 2.01 0.00 0.00 34.83 35.77 1lir s MET 29 CO 0.06 0.06 0.43 -1.71 -0.01 0.00 0.00 175.02 173.85 1lir n ASN 30 N 3.52 -3.08 -3.50 3.03 2.85 -1.26 -0.24 115.26 116.59 1lir n ASN 30 Ca -0.20 -0.76 -0.21 0.00 -0.11 0.00 0.00 54.58 53.29 1lir n ASN 30 Cb 0.53 -1.08 -0.06 0.00 1.24 0.00 0.00 39.78 40.41 1lir n ASN 30 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 1lir n LYS 31 N -2.67 -0.91 -4.13 1.20 0.00 -1.26 -4.90 118.16 105.48 1lir n LYS 31 Ca -0.17 0.07 -0.15 0.00 -0.00 0.00 0.00 58.31 58.06 1lir n LYS 31 Cb 0.44 -2.41 -0.13 0.00 -0.00 0.00 0.00 35.03 32.93 1lir n LYS 31 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1lir s LYS 32 N -5.31 0.51 -0.08 -1.58 1.02 0.67 -2.35 119.74 112.63 1lir s LYS 32 Ca 0.19 -0.50 -0.02 0.00 0.02 0.00 0.00 55.97 55.66 1lir s LYS 32 Cb -0.11 -0.40 -0.03 0.00 -0.52 0.00 0.00 37.83 36.77 1lir s LYS 32 CO 0.61 0.09 0.02 0.00 -0.92 0.00 0.00 175.35 175.15 1lir s ARG 34 N -1.00 1.40 0.21 0.00 6.06 -0.28 -2.32 118.95 123.02 1lir s ARG 34 Ca 0.14 -1.27 0.06 0.00 -2.50 0.00 0.00 55.73 52.17 1lir s ARG 34 Cb -0.11 -1.81 -0.05 0.00 0.06 0.00 0.00 34.95 33.04 1lir s ARG 34 CO 0.04 0.43 -0.11 0.00 -2.50 0.00 0.00 175.30 173.17 1lir n TYR 36 N -0.38 0.00 0.05 0.00 4.01 -0.44 -4.36 117.16 116.04 1lir n TYR 36 Ca -0.08 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.67 1lir n TYR 36 Cb 0.61 -0.81 0.00 0.00 -0.31 0.00 0.00 39.34 38.84 1lir n TYR 36 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85