#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rnl s SER 2 N 0.00 5.13 0.36 1.61 0.01 -1.26 -5.10 113.70 114.45 2rnl s SER 2 Ca 0.00 0.03 -0.26 0.00 1.31 0.00 0.00 55.95 57.03 2rnl s SER 2 Cb 0.00 -1.37 -0.09 0.00 0.21 0.00 0.00 66.02 64.77 2rnl s SER 2 CO 0.00 0.31 1.13 -0.55 0.41 0.00 0.00 173.24 174.53 2rnl s SER 3 N -1.35 6.82 0.00 2.44 0.15 -1.26 -4.84 113.70 115.67 2rnl s SER 3 Ca 0.18 2.27 0.00 0.00 0.70 0.00 0.00 55.95 59.09 2rnl s SER 3 Cb -0.11 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 2rnl s SER 3 CO 0.08 -0.46 0.00 0.61 1.20 0.00 0.00 173.24 174.67 2rnl n GLY 4 N 0.74 0.30 4.13 9.45 0.00 -1.26 -5.01 105.19 113.55 2rnl n GLY 4 Ca 0.03 -2.12 -0.35 0.00 0.00 0.00 0.00 46.02 43.58 2rnl n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2rnl n SER 5 N 0.00 -0.96 -4.55 1.61 2.88 -1.26 -4.85 113.62 106.48 2rnl n SER 5 Ca 0.00 -1.09 -0.40 0.00 -1.33 0.00 0.00 58.87 56.05 2rnl n SER 5 Cb 0.00 -1.39 -0.10 0.00 -0.75 0.00 0.00 64.21 61.98 2rnl n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2rnl s SER 6 N -3.28 6.16 0.00 -3.46 0.15 -1.26 -4.93 113.70 107.09 2rnl s SER 6 Ca 0.54 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 57.03 2rnl s SER 6 Cb -0.31 -2.19 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 2rnl s SER 6 CO 0.89 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.65 2rnl n GLY 7 N 4.94 0.55 3.22 9.45 0.00 -1.26 -4.98 105.19 117.11 2rnl n GLY 7 Ca -0.10 -1.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.27 2rnl n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rnl s LYS 8 N 0.00 0.97 -0.03 1.61 1.02 -1.26 -5.16 119.74 116.89 2rnl s LYS 8 Ca 0.00 -1.41 -0.01 0.00 0.02 0.00 0.00 55.97 54.57 2rnl s LYS 8 Cb 0.00 -0.45 0.02 0.00 -0.52 0.00 0.00 37.83 36.88 2rnl s LYS 8 CO 0.00 0.03 0.05 0.15 -0.92 0.00 0.00 175.35 174.67 2rnl s LYS 9 N -3.79 0.02 -0.02 1.68 3.01 -1.26 -5.14 119.74 114.24 2rnl s LYS 9 Ca 0.15 0.17 -0.06 0.00 -1.01 0.00 0.00 55.97 55.22 2rnl s LYS 9 Cb 0.04 -0.13 0.01 0.00 -1.01 0.00 0.00 37.83 36.73 2rnl s LYS 9 CO -0.02 -0.11 0.13 -0.80 0.51 0.00 0.00 175.35 175.07 2rnl s ASN 10 N 0.68 -0.04 0.50 2.83 -0.87 -1.26 -5.03 114.94 111.75 2rnl s ASN 10 Ca -0.06 -0.00 0.32 0.00 -1.57 0.00 0.00 52.86 51.55 2rnl s ASN 10 Cb -0.08 0.24 1.34 0.00 -0.02 0.00 0.00 41.25 42.73 2rnl s ASN 10 CO -0.02 -0.23 1.95 1.55 -2.57 0.00 0.00 177.10 177.78 2rnl h PRO 11 N 5.00 0.00 0.00 -0.60 0.13 -2.00 0.83 132.00 135.37 2rnl h PRO 11 Ca -0.28 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.81 2rnl h PRO 11 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2rnl h PRO 11 CO 0.41 0.00 -0.16 0.00 -0.23 0.00 0.00 178.00 178.02 2rnl n ASN 13 N -3.35 0.29 -0.09 0.00 3.02 -1.02 -2.75 115.26 111.36 2rnl n ASN 13 Ca -0.00 -0.69 -0.14 0.00 -0.03 0.00 0.00 54.58 53.71 2rnl n ASN 13 Cb 0.37 0.19 -0.08 0.00 -0.61 0.00 0.00 39.78 39.65 2rnl n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2rnl h ALA 14 N 0.00 0.14 0.00 5.41 0.00 0.64 -3.40 119.26 122.05 2rnl h ALA 14 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 54.07 2rnl h ALA 14 Cb 0.16 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2rnl h ALA 14 CO 0.00 0.52 -0.97 -0.85 0.00 0.00 0.00 179.25 177.95 2rnl n GLU 15 N -4.53 0.00 -0.23 0.00 0.28 -1.15 -4.68 120.64 110.34 2rnl n GLU 15 Ca -0.20 0.00 0.02 0.00 -0.16 0.00 0.00 57.16 56.82 2rnl n GLU 15 Cb 0.49 -0.80 0.11 0.00 1.43 0.00 0.00 31.44 32.67 2rnl n GLU 15 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2rnl n PHE 16 N -2.66 0.54 -0.31 -1.84 3.72 0.13 -4.28 117.46 112.76 2rnl n PHE 16 Ca 0.00 -0.19 0.17 0.00 -0.05 0.00 0.00 57.45 57.38 2rnl n PHE 16 Cb 0.48 -0.19 0.43 0.00 -0.94 0.00 0.00 39.48 39.26 2rnl n PHE 16 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 2rnl h GLN 17 N 1.09 0.55 0.00 -1.08 3.07 -1.63 0.73 115.11 117.84 2rnl h GLN 17 Ca 0.00 -0.03 -0.25 0.00 0.09 0.00 0.00 58.65 58.46 2rnl h GLN 17 Cb 0.84 -0.12 -0.04 0.00 0.08 0.00 0.00 27.48 28.24 2rnl h GLN 17 CO 0.12 0.36 -1.32 -2.95 0.09 0.00 0.00 178.83 175.13 2rnl h ASN 18 N 0.56 0.01 -0.21 0.06 -1.07 -1.84 -3.38 115.58 109.72 2rnl h ASN 18 Ca 0.55 -0.01 0.02 0.00 0.07 0.00 0.00 56.30 56.92 2rnl h ASN 18 Cb 1.13 -0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 37.34 2rnl h ASN 18 CO -0.29 1.01 -0.19 0.15 0.07 0.00 0.00 177.43 178.18 2rnl h PHE 19 N 0.00 -0.58 -0.61 4.14 3.57 -1.13 -3.12 116.94 119.21 2rnl h PHE 19 Ca -0.13 0.03 -0.44 0.00 3.53 0.00 0.00 57.97 60.96 2rnl h PHE 19 Cb 1.88 0.28 -0.05 0.00 2.79 0.00 0.00 35.95 40.85 2rnl h PHE 19 CO 0.00 -0.15 1.40 0.00 -2.23 0.00 0.00 178.31 177.34 2rnl h ILE 21 N 6.05 0.00 -3.01 0.00 2.04 -1.50 -3.40 117.51 117.69 2rnl h ILE 21 Ca 0.28 -0.02 -0.60 0.00 1.00 0.00 0.00 64.86 65.52 2rnl h ILE 21 Cb 0.92 0.00 -0.40 0.00 -0.74 0.00 0.00 36.82 36.60 2rnl h ILE 21 CO 1.30 0.00 -0.75 -1.00 0.00 0.00 0.00 178.15 177.70 2rnl s HIS 22 N -5.43 1.87 0.00 1.37 3.76 -1.02 -5.02 115.29 110.82 2rnl s HIS 22 Ca -0.16 -2.23 0.00 0.00 -0.15 0.00 0.00 55.06 52.52 2rnl s HIS 22 Cb 0.02 -1.80 0.00 0.00 1.11 0.00 0.00 32.58 31.90 2rnl s HIS 22 CO 0.49 -0.81 0.00 0.41 -0.85 0.00 0.00 174.74 173.98 2rnl n GLY 23 N 3.89 1.96 3.68 -2.22 0.00 -1.26 -4.57 105.19 106.66 2rnl n GLY 23 Ca 0.06 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 2rnl n GLY 23 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rnl s GLU 24 N -2.00 4.34 -0.15 1.61 -6.30 -0.97 -4.79 118.70 110.45 2rnl s GLU 24 Ca 0.00 1.07 -0.10 0.00 -2.50 0.00 0.00 54.97 53.44 2rnl s GLU 24 Cb 0.00 -3.55 -0.05 0.00 0.00 0.00 0.00 34.13 30.53 2rnl s GLU 24 CO 0.00 -0.27 0.18 0.00 0.02 0.00 0.00 175.26 175.19 2rnl s LYS 26 N -0.25 0.60 -0.15 0.00 2.47 -0.72 -5.00 119.74 116.69 2rnl s LYS 26 Ca 0.13 -0.84 -0.27 0.00 -1.56 0.00 0.00 55.97 53.43 2rnl s LYS 26 Cb -0.12 -1.85 -0.01 0.00 -1.46 0.00 0.00 37.83 34.39 2rnl s LYS 26 CO 0.02 -0.93 0.91 -0.47 0.16 0.00 0.00 175.35 175.05 2rnl s TYR 27 N 1.76 3.45 -0.03 4.03 5.04 -1.26 -3.85 117.35 126.48 2rnl s TYR 27 Ca 0.07 1.39 -0.22 0.00 -2.44 0.00 0.00 57.07 55.88 2rnl s TYR 27 Cb -0.17 -3.10 -0.05 0.00 0.35 0.00 0.00 41.96 39.00 2rnl s TYR 27 CO -0.24 -0.25 0.65 0.42 -1.34 0.00 0.00 175.55 174.79 2rnl s ILE 28 N 2.19 4.96 -0.14 3.14 1.09 0.95 -4.95 121.20 128.43 2rnl s ILE 28 Ca 0.42 1.36 -0.10 0.00 -1.10 0.00 0.00 60.65 61.23 2rnl s ILE 28 Cb -0.17 -3.99 -0.06 0.00 -1.06 0.00 0.00 42.46 37.18 2rnl s ILE 28 CO 0.14 0.34 -0.03 -0.33 -0.10 0.00 0.00 174.94 174.95 2rnl h GLU 29 N 6.17 0.00 0.00 2.79 5.08 -1.95 0.33 114.58 127.00 2rnl h GLU 29 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2rnl h GLU 29 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2rnl h GLU 29 CO 0.73 0.19 0.53 1.12 -1.00 0.00 0.00 179.01 180.58 2rnl h HIS 30 N -1.00 0.00 0.00 4.33 2.07 -1.99 0.25 115.15 118.81 2rnl h HIS 30 Ca -0.05 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.45 2rnl h HIS 30 Cb 0.53 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.50 2rnl h HIS 30 CO -0.10 0.00 -1.21 1.28 -3.07 0.00 0.00 177.93 174.83 2rnl n LEU 31 N -2.64 0.00 -3.22 6.12 4.77 -1.26 -5.03 117.00 115.75 2rnl n LEU 31 Ca -0.01 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.77 2rnl n LEU 31 Cb 0.56 0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.74 2rnl n LEU 31 CO 0.08 0.02 0.20 -0.62 -1.33 0.00 0.00 177.39 175.74 2rnl n GLU 32 N -1.76 -6.84 -4.51 3.23 1.02 0.11 -5.01 120.64 106.88 2rnl n GLU 32 Ca -0.02 0.74 -0.23 0.00 -0.02 0.00 0.00 57.16 57.63 2rnl n GLU 32 Cb 0.22 -5.49 -0.14 0.00 -0.02 0.00 0.00 31.44 26.01 2rnl n GLU 32 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2rnl s ALA 33 N -3.29 1.45 0.03 0.62 0.00 -0.58 -4.96 121.76 115.02 2rnl s ALA 33 Ca 0.42 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.49 2rnl s ALA 33 Cb -0.18 -0.27 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 2rnl s ALA 33 CO 0.65 0.31 -0.01 0.54 0.00 0.00 0.00 175.76 177.24 2rnl s VAL 34 N -0.79 4.04 -0.07 0.00 0.11 -1.26 -0.04 120.40 122.39 2rnl s VAL 34 Ca 0.05 -0.75 -0.24 0.00 -2.93 0.00 0.00 61.98 58.11 2rnl s VAL 34 Cb -0.08 -2.83 0.05 0.00 -1.53 0.00 0.00 36.38 31.99 2rnl s VAL 34 CO 0.01 0.30 0.55 0.28 -3.33 0.00 0.00 175.10 172.91 2rnl s THR 35 N -1.14 0.02 -0.18 5.04 -1.32 -1.25 -5.00 115.64 111.80 2rnl s THR 35 Ca 0.21 -0.15 -0.00 0.00 -1.21 0.00 0.00 61.69 60.54 2rnl s THR 35 Cb -0.11 -0.85 0.01 0.00 -1.51 0.00 0.00 72.50 70.03 2rnl s THR 35 CO 0.12 -0.08 -0.15 0.00 -2.21 0.00 0.00 174.62 172.30 2rnl s LYS 37 N 1.20 4.51 -0.21 0.00 1.02 0.81 -4.64 119.74 122.43 2rnl s LYS 37 Ca 0.02 1.14 -0.06 0.00 0.02 0.00 0.00 55.97 57.09 2rnl s LYS 37 Cb -0.14 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.06 2rnl s LYS 37 CO -0.07 0.47 0.03 0.00 -0.92 0.00 0.00 175.35 174.86 2rnl s GLN 39 N 1.01 -1.44 0.47 0.00 -0.21 -1.26 -4.67 119.66 113.56 2rnl s GLN 39 Ca 0.03 0.61 0.23 0.00 0.02 0.00 0.00 55.36 56.25 2rnl s GLN 39 Cb -0.14 -1.51 1.26 0.00 1.00 0.00 0.00 33.01 33.61 2rnl s GLN 39 CO 0.02 -4.01 1.89 1.96 -2.12 0.00 0.00 175.29 173.03 2rnl h GLN 40 N -2.82 0.21 -0.17 2.91 1.08 -2.00 0.48 115.11 114.80 2rnl h GLN 40 Ca -0.58 -0.01 -0.21 0.00 -1.45 0.00 0.00 58.65 56.40 2rnl h GLN 40 Cb 1.34 -0.05 0.01 0.00 -0.05 0.00 0.00 27.48 28.73 2rnl h GLN 40 CO 0.46 0.14 -0.71 0.93 -0.95 0.00 0.00 178.83 178.69 2rnl h GLU 41 N 0.22 0.78 0.00 1.46 4.39 -1.96 -3.46 114.58 116.00 2rnl h GLU 41 Ca 0.42 -0.61 -0.33 0.00 0.34 0.00 0.00 59.36 59.17 2rnl h GLU 41 Cb 1.31 0.12 0.04 0.00 -0.10 0.00 0.00 28.75 30.12 2rnl h GLU 41 CO -0.09 1.23 0.02 0.66 -1.16 0.00 0.00 179.01 179.66 2rnl n TYR 42 N -3.99 -2.80 -3.67 4.33 4.01 0.16 -4.19 117.16 111.01 2rnl n TYR 42 Ca -0.07 -1.36 -0.02 0.00 -0.16 0.00 0.00 57.90 56.28 2rnl n TYR 42 Cb 0.71 -0.46 -0.01 0.00 -0.31 0.00 0.00 39.34 39.28 2rnl n TYR 42 CO 0.00 0.00 0.00 -0.59 -0.46 0.00 0.00 176.86 175.81 2rnl s PHE 43 N -1.85 -0.12 0.00 -0.72 -0.71 -1.18 -4.39 117.98 109.02 2rnl s PHE 43 Ca 0.45 -0.08 0.00 0.00 -1.04 0.00 0.00 56.93 56.26 2rnl s PHE 43 Cb -0.03 0.59 0.00 0.00 -1.21 0.00 0.00 43.02 42.37 2rnl s PHE 43 CO 0.29 -0.56 0.00 0.41 -1.34 0.00 0.00 175.22 174.03 2rnl n GLY 44 N -0.43 0.14 0.13 1.99 0.00 -1.26 -3.73 105.19 102.03 2rnl n GLY 44 Ca -0.07 -1.49 -0.06 0.00 0.00 0.00 0.00 46.02 44.41 2rnl n GLY 44 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2rnl n GLU 45 N 1.47 0.32 -0.18 1.61 0.00 -1.26 -4.62 120.64 117.99 2rnl n GLU 45 Ca 0.00 0.13 -0.01 0.00 0.00 0.00 0.00 57.16 57.28 2rnl n GLU 45 Cb 0.00 -1.06 0.23 0.00 0.00 0.00 0.00 31.44 30.62 2rnl n GLU 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2rnl h ARG 46 N -0.61 0.91 -3.08 5.31 3.08 -1.84 -3.38 114.38 114.76 2rnl h ARG 46 Ca 0.00 -0.10 -0.13 0.00 0.07 0.00 0.00 59.98 59.82 2rnl h ARG 46 Cb 0.61 -0.18 0.06 0.00 0.08 0.00 0.00 29.97 30.54 2rnl h ARG 46 CO 0.00 0.68 -0.26 0.00 -1.07 0.00 0.00 179.97 179.31 2rnl n GLY 48 N -1.05 -0.91 3.87 0.00 0.00 -1.26 -2.42 105.19 103.42 2rnl n GLY 48 Ca -0.06 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 2rnl n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2rnl s GLU 49 N -2.52 3.73 0.00 1.61 2.02 -1.26 -4.90 118.70 117.38 2rnl s GLU 49 Ca -0.12 0.13 0.00 0.00 0.02 0.00 0.00 54.97 55.00 2rnl s GLU 49 Cb 0.07 -3.01 0.00 0.00 0.10 0.00 0.00 34.13 31.29 2rnl s GLU 49 CO 0.80 0.57 0.31 0.36 0.02 0.00 0.00 175.26 177.33