#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 3.23 -0.86 1.61 0.15 -1.26 -5.06 113.70 111.51 2rnl s SER 2 Ca 0.00 -0.92 -0.25 0.00 0.70 0.00 0.00 55.95 55.48 2rnl s SER 2 Cb 0.00 -0.23 -0.02 0.00 -1.71 0.00 0.00 66.02 64.05 2rnl s SER 2 CO 0.00 0.04 1.81 -0.55 1.20 0.00 0.00 173.24 175.75 2rnl s SER 3 N -2.93 5.44 0.00 5.45 0.15 -1.26 -4.36 113.70 116.20 2rnl s SER 3 Ca 0.22 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.28 2rnl s SER 3 Cb -0.06 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2rnl s SER 3 CO 0.10 -2.42 0.00 0.61 1.20 0.00 0.00 173.24 172.73 2rnl n GLY 4 N 6.55 -0.90 0.38 9.45 0.00 -1.26 -5.01 105.19 114.41 2rnl n GLY 4 Ca 0.33 0.67 -0.11 0.00 0.00 0.00 0.00 46.02 46.91 2rnl n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2rnl h SER 5 N 0.00 -1.25 -1.93 1.61 0.87 -2.05 -3.38 113.55 107.42 2rnl h SER 5 Ca 0.00 0.17 -0.59 0.00 -1.23 0.00 0.00 61.79 60.14 2rnl h SER 5 Cb 0.00 0.52 -0.00 0.00 -0.44 0.00 0.00 62.40 62.48 2rnl h SER 5 CO 0.00 -0.40 1.48 -0.24 -0.53 0.00 0.00 176.83 177.14 2rnl n SER 6 N -5.43 3.21 0.00 6.23 2.88 -1.26 -4.87 113.62 114.38 2rnl n SER 6 Ca -0.03 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 2rnl n SER 6 Cb 0.35 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 62.28 2rnl n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2rnl n GLY 7 N 5.79 -0.01 3.64 0.46 0.00 -1.26 -4.86 105.19 108.95 2rnl n GLY 7 Ca 0.30 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.23 2rnl n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rnl s LYS 8 N 0.25 0.73 0.01 1.61 -2.85 -1.26 -5.10 119.74 113.12 2rnl s LYS 8 Ca 0.00 1.09 -0.01 0.00 -1.00 0.00 0.00 55.97 56.05 2rnl s LYS 8 Cb 0.00 0.24 -0.04 0.00 -2.06 0.00 0.00 37.83 35.97 2rnl s LYS 8 CO 0.00 -0.12 0.12 0.15 0.10 0.00 0.00 175.35 175.60 2rnl s LYS 9 N 1.11 3.19 -0.02 1.78 1.02 -1.26 -5.12 119.74 120.44 2rnl s LYS 9 Ca -0.06 -0.46 -0.12 0.00 0.02 0.00 0.00 55.97 55.36 2rnl s LYS 9 Cb -0.05 -2.93 0.02 0.00 -0.52 0.00 0.00 37.83 34.35 2rnl s LYS 9 CO -0.12 0.64 0.25 -0.80 -0.92 0.00 0.00 175.35 174.41 2rnl s ASN 10 N -1.93 -0.14 0.39 2.83 -0.87 -1.26 -5.04 114.94 108.92 2rnl s ASN 10 Ca 0.26 0.08 0.18 0.00 -1.57 0.00 0.00 52.86 51.81 2rnl s ASN 10 Cb -0.12 0.32 0.80 0.00 -0.02 0.00 0.00 41.25 42.23 2rnl s ASN 10 CO 0.17 -0.37 1.80 1.55 -2.57 0.00 0.00 177.10 177.69 2rnl h PRO 11 N 4.30 0.00 -1.13 -0.60 0.13 -1.98 -2.46 132.00 130.26 2rnl h PRO 11 Ca -0.29 0.00 0.35 0.00 -0.87 0.00 0.00 66.00 65.19 2rnl h PRO 11 Cb 1.18 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.19 2rnl h PRO 11 CO 0.39 0.35 0.70 0.00 -0.23 0.00 0.00 178.00 179.20 2rnl n ASN 13 N -4.82 1.10 0.01 0.00 3.02 -1.19 -0.97 115.26 112.41 2rnl n ASN 13 Ca 0.32 -0.52 -0.00 0.00 -0.03 0.00 0.00 54.58 54.36 2rnl n ASN 13 Cb 1.13 1.12 -0.00 0.00 -0.61 0.00 0.00 39.78 41.42 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 1.16 -0.43 0.00 5.41 0.00 -0.37 -3.39 119.26 121.64 2rnl h ALA 14 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2rnl h ALA 14 Cb 0.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2rnl h ALA 14 CO 0.00 -0.43 -0.60 0.39 0.00 0.00 0.00 179.25 178.61 2rnl n GLU 15 N -2.11 2.60 -0.71 0.00 4.71 -0.72 -4.63 120.64 119.79 2rnl n GLU 15 Ca -0.00 0.00 0.07 0.00 -0.01 0.00 0.00 57.16 57.22 2rnl n GLU 15 Cb 0.01 -0.79 0.34 0.00 -1.01 0.00 0.00 31.44 29.99 2rnl n GLU 15 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 2rnl n PHE 16 N -1.24 1.66 -0.33 -0.32 3.01 0.78 -4.43 117.46 116.58 2rnl n PHE 16 Ca 0.00 -0.60 -0.02 0.00 1.01 0.00 0.00 57.45 57.84 2rnl n PHE 16 Cb 0.00 -0.38 0.10 0.00 -0.01 0.00 0.00 39.48 39.19 2rnl n PHE 16 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 2rnl h GLN 17 N 3.57 1.14 0.00 -1.08 4.15 -1.17 -1.38 115.11 120.35 2rnl h GLN 17 Ca 0.00 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.32 2rnl h GLN 17 Cb 1.63 -0.26 -0.00 0.00 0.21 0.00 0.00 27.48 29.06 2rnl h GLN 17 CO 0.36 0.75 -0.14 -0.97 -1.93 0.00 0.00 178.83 176.90 2rnl h ASN 18 N 1.17 0.00 0.13 -0.69 -1.24 -1.83 -3.33 115.58 109.79 2rnl h ASN 18 Ca 0.34 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.34 2rnl h ASN 18 Cb -0.09 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 38.95 2rnl h ASN 18 CO -0.09 0.14 -0.17 0.15 -1.29 0.00 0.00 177.43 176.18 2rnl h PHE 19 N 0.00 -0.47 -3.43 0.67 3.04 -1.54 -3.37 116.94 111.84 2rnl h PHE 19 Ca -0.00 0.01 -0.56 0.00 3.98 0.00 0.00 57.97 61.40 2rnl h PHE 19 Cb 0.85 0.19 -0.07 0.00 2.56 0.00 0.00 35.95 39.48 2rnl h PHE 19 CO 0.00 -0.21 0.94 0.00 -2.02 0.00 0.00 178.31 177.01 2rnl h ILE 21 N 6.19 0.24 -3.05 0.00 2.04 -1.72 -3.44 117.51 117.77 2rnl h ILE 21 Ca -0.24 -1.21 -0.61 0.00 1.00 0.00 0.00 64.86 63.80 2rnl h ILE 21 Cb 1.06 0.48 -0.40 0.00 -0.74 0.00 0.00 36.82 37.22 2rnl h ILE 21 CO 1.16 0.08 -0.73 -1.00 0.00 0.00 0.00 178.15 177.66 2rnl s HIS 22 N -1.85 2.08 0.00 1.37 3.76 -0.65 -4.99 115.29 115.01 2rnl s HIS 22 Ca -0.08 -2.43 0.00 0.00 -0.15 0.00 0.00 55.06 52.40 2rnl s HIS 22 Cb 0.01 -1.96 0.00 0.00 1.11 0.00 0.00 32.58 31.73 2rnl s HIS 22 CO 0.16 -0.79 0.00 0.41 -0.85 0.00 0.00 174.74 173.67 2rnl n GLY 23 N 3.64 1.57 3.69 -2.22 0.00 -1.26 -4.44 105.19 106.18 2rnl n GLY 23 Ca 0.07 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.60 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 4.37 0.06 1.61 2.12 -0.80 -4.82 118.70 119.22 2rnl s GLU 24 Ca 0.00 0.94 -0.07 0.00 0.36 0.00 0.00 54.97 56.20 2rnl s GLU 24 Cb 0.00 -3.51 -0.05 0.00 0.26 0.00 0.00 34.13 30.83 2rnl s GLU 24 CO 0.00 -0.13 0.33 0.00 -0.54 0.00 0.00 175.26 174.92 2rnl s LYS 26 N -1.99 0.20 -0.22 0.00 2.36 -1.10 -4.96 119.74 114.03 2rnl s LYS 26 Ca 0.32 0.43 -0.29 0.00 -2.55 0.00 0.00 55.97 53.88 2rnl s LYS 26 Cb -0.13 -0.72 0.00 0.00 -1.05 0.00 0.00 37.83 35.93 2rnl s LYS 26 CO 0.19 -0.54 1.16 -0.47 1.55 0.00 0.00 175.35 177.24 2rnl s TYR 27 N 2.39 3.06 -0.35 4.03 5.04 -1.26 -3.69 117.35 126.56 2rnl s TYR 27 Ca 0.06 1.19 -0.21 0.00 -2.44 0.00 0.00 57.07 55.67 2rnl s TYR 27 Cb -0.14 -3.48 0.00 0.00 0.35 0.00 0.00 41.96 38.68 2rnl s TYR 27 CO -0.11 -1.12 0.66 0.42 -1.34 0.00 0.00 175.55 174.06 2rnl s ILE 28 N 3.50 4.87 -0.13 3.14 1.09 0.16 -4.94 121.20 128.88 2rnl s ILE 28 Ca 0.50 0.66 -0.08 0.00 -1.10 0.00 0.00 60.65 60.63 2rnl s ILE 28 Cb -0.17 -4.09 -0.04 0.00 -1.06 0.00 0.00 42.46 37.10 2rnl s ILE 28 CO 0.12 -0.32 -0.09 -0.08 -0.10 0.00 0.00 174.94 174.47 2rnl h GLU 29 N 8.44 0.00 -1.47 2.79 4.81 -1.94 0.35 114.58 127.55 2rnl h GLU 29 Ca -0.26 0.00 0.43 0.00 -0.13 0.00 0.00 59.36 59.40 2rnl h GLU 29 Cb 1.11 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.43 2rnl h GLU 29 CO 0.85 0.08 1.19 -2.39 -0.73 0.00 0.00 179.01 178.00 2rnl n HIS 30 N -4.65 0.00 0.04 0.92 1.44 -1.26 0.22 115.22 111.93 2rnl n HIS 30 Ca -0.07 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.68 2rnl n HIS 30 Cb 0.23 -0.37 -0.06 0.00 0.12 0.00 0.00 29.99 29.91 2rnl n HIS 30 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2rnl n LEU 31 N -3.46 0.04 -2.74 2.39 4.77 -1.26 -5.04 117.00 111.71 2rnl n LEU 31 Ca 0.33 -0.06 -0.12 0.00 -0.03 0.00 0.00 56.01 56.13 2rnl n LEU 31 Cb 1.63 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 42.78 2rnl n LEU 31 CO 0.33 0.01 0.06 -0.62 -1.33 0.00 0.00 177.39 175.84 2rnl n GLU 32 N -1.69 -3.70 -4.01 3.23 1.02 0.60 -5.05 120.64 111.04 2rnl n GLU 32 Ca -0.01 0.61 -0.08 0.00 -0.02 0.00 0.00 57.16 57.66 2rnl n GLU 32 Cb 0.19 -4.80 -0.09 0.00 -0.02 0.00 0.00 31.44 26.71 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 -3.26 0.29 0.02 0.62 0.00 0.99 -4.99 121.76 115.43 2rnl s ALA 33 Ca 0.11 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 51.07 2rnl s ALA 33 Cb -0.01 0.49 -0.03 0.00 0.00 0.00 0.00 23.12 23.56 2rnl s ALA 33 CO 0.52 -0.46 -0.07 0.08 0.00 0.00 0.00 175.76 175.84 2rnl s VAL 34 N -3.93 3.62 0.09 0.00 1.01 -1.26 -0.66 120.40 119.27 2rnl s VAL 34 Ca 0.10 -0.86 -0.14 0.00 0.00 0.00 0.00 61.98 61.08 2rnl s VAL 34 Cb 0.06 -2.60 0.02 0.00 0.00 0.00 0.00 36.38 33.87 2rnl s VAL 34 CO -0.08 0.34 0.33 0.28 0.00 0.00 0.00 175.10 175.98 2rnl s THR 35 N -1.04 0.09 -0.11 3.92 -1.32 -1.24 -4.98 115.64 110.96 2rnl s THR 35 Ca 0.18 -0.72 -0.01 0.00 -1.21 0.00 0.00 61.69 59.93 2rnl s THR 35 Cb -0.11 -1.14 0.03 0.00 -1.51 0.00 0.00 72.50 69.77 2rnl s THR 35 CO 0.09 -0.40 -0.03 0.00 -2.21 0.00 0.00 174.62 172.07 2rnl s LYS 37 N 1.82 4.74 -0.13 0.00 1.02 0.13 -4.64 119.74 122.68 2rnl s LYS 37 Ca 0.04 1.58 -0.04 0.00 0.02 0.00 0.00 55.97 57.58 2rnl s LYS 37 Cb -0.13 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 2rnl s LYS 37 CO -0.07 0.33 0.01 0.00 -0.92 0.00 0.00 175.35 174.70 2rnl s GLN 39 N -0.18 0.96 0.40 0.00 -0.21 -1.26 -4.75 119.66 114.62 2rnl s GLN 39 Ca 0.05 1.11 0.24 0.00 0.02 0.00 0.00 55.36 56.78 2rnl s GLN 39 Cb -0.12 -1.75 1.31 0.00 1.00 0.00 0.00 33.01 33.44 2rnl s GLN 39 CO 0.02 -2.53 1.64 -0.56 -2.12 0.00 0.00 175.29 171.74 2rnl h GLN 40 N -1.77 0.15 0.02 2.91 -0.00 -2.00 0.53 115.11 114.96 2rnl h GLN 40 Ca -0.49 -0.01 -0.20 0.00 -0.00 0.00 0.00 58.65 57.95 2rnl h GLN 40 Cb 1.28 -0.03 0.02 0.00 -0.00 0.00 0.00 27.48 28.74 2rnl h GLN 40 CO 0.49 0.10 -0.80 1.05 -0.00 0.00 0.00 178.83 179.67 2rnl h GLU 41 N 0.15 0.51 -7.30 0.06 4.11 -1.97 -3.46 114.58 106.69 2rnl h GLU 41 Ca 0.78 -0.57 -0.48 0.00 0.07 0.00 0.00 59.36 59.16 2rnl h GLU 41 Cb 2.23 0.17 0.07 0.00 0.50 0.00 0.00 28.75 31.72 2rnl h GLU 41 CO -0.50 1.20 0.28 0.71 0.07 0.00 0.00 179.01 180.78 2rnl s TYR 42 N -3.16 3.23 0.30 2.06 2.02 0.19 -4.59 117.35 117.39 2rnl s TYR 42 Ca -0.12 0.78 -0.20 0.00 -0.37 0.00 0.00 57.07 57.16 2rnl s TYR 42 Cb 0.04 -2.95 0.02 0.00 -0.40 0.00 0.00 41.96 38.68 2rnl s TYR 42 CO 0.86 -1.07 0.72 -0.59 -1.57 0.00 0.00 175.55 173.90 2rnl s PHE 43 N -3.19 -0.10 0.00 2.71 -0.71 -1.23 -4.12 117.98 111.34 2rnl s PHE 43 Ca 0.57 -0.39 0.00 0.00 -1.04 0.00 0.00 56.93 56.07 2rnl s PHE 43 Cb -0.11 0.70 0.00 0.00 -1.21 0.00 0.00 43.02 42.40 2rnl s PHE 43 CO 0.48 -1.28 0.00 0.41 -1.34 0.00 0.00 175.22 173.49 2rnl n GLY 44 N -0.47 0.01 0.06 1.99 0.00 -1.26 -3.88 105.19 101.65 2rnl n GLY 44 Ca -0.05 -1.65 -0.04 0.00 0.00 0.00 0.00 46.02 44.28 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 0.27 0.24 0.08 1.61 4.07 -1.26 -4.60 120.64 121.05 2rnl n GLU 45 Ca 0.00 0.10 0.03 0.00 -0.06 0.00 0.00 57.16 57.23 2rnl n GLU 45 Cb 0.00 -0.92 0.43 0.00 -0.06 0.00 0.00 31.44 30.89 2rnl n GLU 45 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2rnl h ARG 46 N -0.46 0.36 -3.62 5.31 3.08 -1.85 -3.35 114.38 113.86 2rnl h ARG 46 Ca 0.00 -0.05 -0.19 0.00 0.07 0.00 0.00 59.98 59.81 2rnl h ARG 46 Cb 0.46 -0.07 0.08 0.00 0.08 0.00 0.00 29.97 30.52 2rnl h ARG 46 CO 0.00 0.34 -0.36 0.00 -1.07 0.00 0.00 179.97 178.87 2rnl n GLY 48 N -1.19 6.00 3.61 0.00 0.00 -1.26 -1.63 105.19 110.71 2rnl n GLY 48 Ca -0.06 -2.26 -0.04 0.00 0.00 0.00 0.00 46.02 43.66 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 -3.52 0.61 0.00 1.61 2.02 -1.26 -4.95 118.70 113.21 2rnl s GLU 49 Ca 0.49 1.32 0.16 0.00 0.02 0.00 0.00 54.97 56.96 2rnl s GLU 49 Cb 0.41 0.52 0.12 0.00 0.10 0.00 0.00 34.13 35.29 2rnl s GLU 49 CO 0.01 -0.18 1.00 0.36 0.02 0.00 0.00 175.26 176.47