#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 1.62 0.53 1.61 0.01 -1.26 -5.12 113.70 111.09 2rnl s SER 2 Ca 0.00 -1.24 -0.14 0.00 1.31 0.00 0.00 55.95 55.88 2rnl s SER 2 Cb 0.00 0.05 -0.12 0.00 0.21 0.00 0.00 66.02 66.16 2rnl s SER 2 CO 0.00 -0.56 -0.28 -1.20 0.41 0.00 0.00 173.24 171.61 2rnl n SER 3 N -0.40 -3.57 0.00 2.44 7.64 -1.26 -4.97 113.62 113.50 2rnl n SER 3 Ca -0.04 0.41 0.00 0.00 1.01 0.00 0.00 58.87 60.24 2rnl n SER 3 Cb 0.64 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 2rnl n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rnl n GLY 4 N 2.28 2.14 2.99 0.23 0.00 -1.26 -5.06 105.19 106.51 2rnl n GLY 4 Ca 0.04 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 2rnl n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rnl s SER 5 N 1.00 5.18 0.11 1.61 0.15 -1.26 -5.04 113.70 115.45 2rnl s SER 5 Ca 0.00 -3.64 -0.25 0.00 0.70 0.00 0.00 55.95 52.76 2rnl s SER 5 Cb 0.00 -1.74 0.08 0.00 -1.71 0.00 0.00 66.02 62.64 2rnl s SER 5 CO 0.00 -0.16 0.78 -0.55 1.20 0.00 0.00 173.24 174.51 2rnl s SER 6 N -0.72 -0.40 0.70 5.45 0.15 -1.26 -5.16 113.70 112.46 2rnl s SER 6 Ca 0.24 -0.13 -0.16 0.00 0.70 0.00 0.00 55.95 56.60 2rnl s SER 6 Cb -0.09 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 2rnl s SER 6 CO -0.12 -0.87 1.07 0.61 1.20 0.00 0.00 173.24 175.13 2rnl n GLY 7 N -0.35 -0.15 2.74 9.45 0.00 -1.26 -4.90 105.19 110.73 2rnl n GLY 7 Ca -0.11 -0.29 -0.37 0.00 0.00 0.00 0.00 46.02 45.26 2rnl n GLY 7 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2rnl n LYS 8 N -1.92 3.08 -3.91 1.61 4.81 -1.26 -4.84 118.16 115.72 2rnl n LYS 8 Ca 0.14 -3.33 -0.30 0.00 -0.87 0.00 0.00 58.31 53.95 2rnl n LYS 8 Cb 0.49 -2.28 -0.14 0.00 0.02 0.00 0.00 35.03 33.12 2rnl n LYS 8 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2rnl s LYS 9 N -3.29 1.44 0.02 1.64 2.20 -1.26 -5.09 119.74 115.39 2rnl s LYS 9 Ca 0.53 -1.94 0.03 0.00 -0.36 0.00 0.00 55.97 54.22 2rnl s LYS 9 Cb 0.38 -2.89 -0.01 0.00 -1.51 0.00 0.00 37.83 33.79 2rnl s LYS 9 CO -0.31 -1.02 -0.09 -0.80 -0.36 0.00 0.00 175.35 172.77 2rnl s ASN 10 N 0.65 1.02 0.34 1.43 -0.87 -1.26 -5.04 114.94 111.21 2rnl s ASN 10 Ca 0.13 -0.32 0.13 0.00 -1.57 0.00 0.00 52.86 51.23 2rnl s ASN 10 Cb -0.21 -0.06 0.60 0.00 -0.02 0.00 0.00 41.25 41.55 2rnl s ASN 10 CO -0.08 -0.00 1.74 1.55 -2.57 0.00 0.00 177.10 177.74 2rnl h PRO 11 N 5.33 0.00 -0.75 -0.60 0.13 -1.98 -2.81 132.00 131.32 2rnl h PRO 11 Ca -0.33 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 65.02 2rnl h PRO 11 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2rnl h PRO 11 CO 0.46 0.46 0.79 0.00 -0.23 0.00 0.00 178.00 179.48 2rnl n ASN 13 N -3.58 0.27 -0.00 0.00 0.23 -1.16 -1.86 115.26 109.16 2rnl n ASN 13 Ca 0.16 -0.63 -0.00 0.00 -0.53 0.00 0.00 54.58 53.57 2rnl n ASN 13 Cb 1.05 0.92 -0.00 0.00 -2.08 0.00 0.00 39.78 39.67 2rnl n ASN 13 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2rnl h ALA 14 N 0.55 -0.02 0.00 -2.53 0.00 0.12 -3.41 119.26 113.97 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 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2rnl h ALA 14 CO 0.00 -0.02 -1.01 -1.91 0.00 0.00 0.00 179.25 176.31 2rnl n GLU 15 N -2.21 0.55 -0.49 0.00 2.13 -0.78 -4.61 120.64 115.22 2rnl n GLU 15 Ca -0.00 -0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.87 2rnl n GLU 15 Cb 0.00 -1.01 0.24 0.00 0.27 0.00 0.00 31.44 30.95 2rnl n GLU 15 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2rnl n PHE 16 N -1.58 1.16 -0.28 4.31 3.01 -0.26 -4.31 117.46 119.51 2rnl n PHE 16 Ca -0.00 -0.42 -0.01 0.00 1.01 0.00 0.00 57.45 58.03 2rnl n PHE 16 Cb 0.07 -0.29 0.17 0.00 -0.01 0.00 0.00 39.48 39.43 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 2.50 1.12 0.00 -1.08 -0.00 -1.50 -2.82 115.11 113.33 2rnl h GLN 17 Ca 0.00 -0.09 -0.12 0.00 -0.00 0.00 0.00 58.65 58.44 2rnl h GLN 17 Cb 1.26 -0.24 -0.02 0.00 0.00 0.00 0.00 27.48 28.48 2rnl h GLN 17 CO 0.25 0.78 -1.71 -1.71 0.00 0.00 0.00 178.83 176.43 2rnl n ASN 18 N -4.38 0.41 0.00 -0.69 4.05 -1.26 -4.57 115.26 108.82 2rnl n ASN 18 Ca 0.09 0.17 0.00 0.00 0.45 0.00 0.00 54.58 55.29 2rnl n ASN 18 Cb 0.05 0.98 0.00 0.00 1.23 0.00 0.00 39.78 42.05 2rnl n ASN 18 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 177.26 174.54 2rnl n PHE 19 N -2.61 0.00 -1.72 1.20 -0.00 -1.06 -4.43 117.46 108.83 2rnl n PHE 19 Ca -0.10 0.00 -0.38 0.00 -0.00 0.00 0.00 57.45 56.97 2rnl n PHE 19 Cb 0.75 -0.32 0.05 0.00 -0.00 0.00 0.00 39.48 39.96 2rnl n PHE 19 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2rnl n ILE 21 N -1.37 0.44 -3.76 0.00 5.41 -1.16 -4.94 119.36 113.99 2rnl n ILE 21 Ca 0.12 0.20 -0.33 0.00 1.00 0.00 0.00 62.75 63.74 2rnl n ILE 21 Cb 0.46 -1.35 -0.10 0.00 -0.71 0.00 0.00 39.64 37.94 2rnl n ILE 21 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 2rnl s HIS 22 N -1.42 3.60 0.00 1.39 3.76 -0.88 -5.02 115.29 116.72 2rnl s HIS 22 Ca -0.02 -3.05 0.00 0.00 -0.15 0.00 0.00 55.06 51.84 2rnl s HIS 22 Cb 0.00 -3.04 0.00 0.00 1.11 0.00 0.00 32.58 30.65 2rnl s HIS 22 CO 0.04 -0.71 0.00 0.41 -0.85 0.00 0.00 174.74 173.62 2rnl n GLY 23 N 2.63 2.75 3.86 -2.22 0.00 -1.26 -4.22 105.19 106.73 2rnl n GLY 23 Ca 0.15 -1.12 -0.31 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.08 3.87 -0.09 1.61 2.56 -0.53 -4.80 118.70 119.24 2rnl s GLU 24 Ca 0.00 0.67 -0.01 0.00 0.00 0.00 0.00 54.97 55.63 2rnl s GLU 24 Cb 0.00 -2.30 -0.03 0.00 2.00 0.00 0.00 34.13 33.80 2rnl s GLU 24 CO 0.00 -0.10 -0.03 0.00 -0.56 0.00 0.00 175.26 174.58 2rnl s LYS 26 N -0.66 0.28 -0.01 0.00 2.47 -0.53 -4.92 119.74 116.38 2rnl s LYS 26 Ca 0.10 0.18 -0.30 0.00 -1.56 0.00 0.00 55.97 54.39 2rnl s LYS 26 Cb -0.12 -0.81 -0.05 0.00 -1.46 0.00 0.00 37.83 35.39 2rnl s LYS 26 CO 0.02 -0.78 1.43 -0.47 0.16 0.00 0.00 175.35 175.70 2rnl s TYR 27 N 2.40 2.75 -0.16 4.03 5.04 -1.26 -3.54 117.35 126.62 2rnl s TYR 27 Ca 0.09 0.75 -0.25 0.00 -2.44 0.00 0.00 57.07 55.23 2rnl s TYR 27 Cb -0.15 -3.69 -0.02 0.00 0.35 0.00 0.00 41.96 38.45 2rnl s TYR 27 CO -0.20 -2.59 0.80 0.42 -1.34 0.00 0.00 175.55 172.64 2rnl s ILE 28 N 2.63 4.91 -0.08 3.14 -1.09 0.99 -4.95 121.20 126.74 2rnl s ILE 28 Ca 0.65 1.58 -0.04 0.00 -2.23 0.00 0.00 60.65 60.60 2rnl s ILE 28 Cb -0.31 -4.11 -0.01 0.00 -1.58 0.00 0.00 42.46 36.44 2rnl s ILE 28 CO 0.26 0.06 -0.08 -0.08 -1.23 0.00 0.00 174.94 173.87 2rnl h GLU 29 N 7.29 0.00 -1.53 2.79 4.22 -1.94 0.13 114.58 125.55 2rnl h GLU 29 Ca -0.31 0.00 0.47 0.00 0.08 0.00 0.00 59.36 59.61 2rnl h GLU 29 Cb 1.14 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.29 2rnl h GLU 29 CO 0.82 0.00 1.04 1.12 -2.18 0.00 0.00 179.01 179.81 2rnl h HIS 30 N -0.60 0.29 0.00 0.92 2.07 -1.98 1.24 115.15 117.09 2rnl h HIS 30 Ca 0.00 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.53 2rnl h HIS 30 Cb 0.23 -0.07 0.00 0.00 2.57 0.00 0.00 27.41 30.14 2rnl h HIS 30 CO -0.10 -0.12 -1.64 1.28 -3.07 0.00 0.00 177.93 174.28 2rnl n LEU 31 N -4.39 0.20 -3.42 6.12 4.77 -1.26 -5.01 117.00 114.01 2rnl n LEU 31 Ca 0.38 -0.12 -0.17 0.00 -0.03 0.00 0.00 56.01 56.08 2rnl n LEU 31 Cb 1.61 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 42.78 2rnl n LEU 31 CO 0.31 0.05 0.08 -0.62 -1.33 0.00 0.00 177.39 175.88 2rnl n GLU 32 N -2.00 -5.73 -3.78 3.23 1.02 0.43 -5.02 120.64 108.79 2rnl n GLU 32 Ca -0.02 0.83 -0.13 0.00 -0.02 0.00 0.00 57.16 57.83 2rnl n GLU 32 Cb 0.45 -5.80 -0.12 0.00 -0.02 0.00 0.00 31.44 25.96 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 -3.39 -0.65 0.23 0.62 0.00 0.24 -4.98 121.76 113.82 2rnl s ALA 33 Ca 0.08 0.77 -0.19 0.00 0.00 0.00 0.00 51.96 52.61 2rnl s ALA 33 Cb -0.01 -0.45 -0.08 0.00 0.00 0.00 0.00 23.12 22.58 2rnl s ALA 33 CO 0.74 -0.13 0.73 0.54 0.00 0.00 0.00 175.76 177.63 2rnl s VAL 34 N 0.21 4.57 0.19 0.00 0.11 -1.26 -0.00 120.40 124.22 2rnl s VAL 34 Ca -0.01 1.27 -0.16 0.00 -2.93 0.00 0.00 61.98 60.15 2rnl s VAL 34 Cb -0.02 -3.85 0.02 0.00 -1.53 0.00 0.00 36.38 31.00 2rnl s VAL 34 CO -0.00 0.19 0.49 0.28 -3.33 0.00 0.00 175.10 172.73 2rnl s THR 35 N -1.54 0.03 -0.14 5.04 -1.32 -1.23 -4.91 115.64 111.56 2rnl s THR 35 Ca 0.43 -0.87 -0.00 0.00 -1.21 0.00 0.00 61.69 60.04 2rnl s THR 35 Cb -0.16 -1.62 0.03 0.00 -1.51 0.00 0.00 72.50 69.23 2rnl s THR 35 CO 0.21 -0.14 -0.07 0.00 -2.21 0.00 0.00 174.62 172.40 2rnl s LYS 37 N 1.64 3.68 -0.01 0.00 2.47 0.53 -4.71 119.74 123.33 2rnl s LYS 37 Ca 0.03 1.78 -0.22 0.00 -1.56 0.00 0.00 55.97 56.00 2rnl s LYS 37 Cb -0.14 -4.12 -0.05 0.00 -1.46 0.00 0.00 37.83 32.07 2rnl s LYS 37 CO -0.08 -1.44 0.65 0.00 0.16 0.00 0.00 175.35 174.63 2rnl s GLN 39 N 0.10 3.39 0.35 0.00 -1.52 -1.26 -4.83 119.66 115.88 2rnl s GLN 39 Ca 0.34 1.55 0.22 0.00 -1.95 0.00 0.00 55.36 55.52 2rnl s GLN 39 Cb -0.18 -2.02 1.23 0.00 -0.22 0.00 0.00 33.01 31.82 2rnl s GLN 39 CO 0.18 -0.81 1.37 0.94 -0.25 0.00 0.00 175.29 176.72 2rnl n GLN 40 N -1.34 -0.04 -0.02 2.91 7.27 -1.26 0.15 117.38 125.04 2rnl n GLN 40 Ca 0.11 1.16 -0.12 0.00 0.07 0.00 0.00 57.00 58.22 2rnl n GLN 40 Cb 0.51 -2.16 -0.07 0.00 2.41 0.00 0.00 30.24 30.94 2rnl n GLN 40 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 2rnl h GLU 41 N 0.00 0.16 -6.86 3.69 3.07 -1.98 -3.45 114.58 109.22 2rnl h GLU 41 Ca 0.75 -0.04 -0.45 0.00 -0.50 0.00 0.00 59.36 59.12 2rnl h GLU 41 Cb 2.16 -0.02 0.05 0.00 -0.84 0.00 0.00 28.75 30.11 2rnl h GLU 41 CO -0.57 0.36 -0.02 0.71 -1.40 0.00 0.00 179.01 178.09 2rnl s TYR 42 N -5.20 2.19 -0.23 4.33 2.02 0.40 -4.63 117.35 116.24 2rnl s TYR 42 Ca -0.14 -0.25 -0.29 0.00 -0.37 0.00 0.00 57.07 56.01 2rnl s TYR 42 Cb 0.05 -2.71 0.17 0.00 -0.40 0.00 0.00 41.96 39.06 2rnl s TYR 42 CO 0.69 -1.16 1.21 -0.59 -1.57 0.00 0.00 175.55 174.14 2rnl s PHE 43 N -2.84 -0.18 -2.90 2.71 -0.71 -0.90 -4.17 117.98 109.00 2rnl s PHE 43 Ca 0.61 0.30 0.00 0.00 -1.04 0.00 0.00 56.93 56.80 2rnl s PHE 43 Cb -0.08 0.48 0.00 0.00 -1.21 0.00 0.00 43.02 42.21 2rnl s PHE 43 CO 0.40 -0.16 0.00 0.41 -1.34 0.00 0.00 175.22 174.53 2rnl n GLY 44 N 0.63 0.77 0.10 1.99 0.00 -1.26 -4.25 105.19 103.18 2rnl n GLY 44 Ca -0.04 -2.06 -0.03 0.00 0.00 0.00 0.00 46.02 43.89 2rnl n GLY 44 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2rnl h GLU 45 N 1.65 -0.17 -0.94 1.61 4.81 -2.00 -3.35 114.58 116.19 2rnl h GLU 45 Ca 0.00 0.01 -0.44 0.00 -0.13 0.00 0.00 59.36 58.80 2rnl h GLU 45 Cb 0.00 0.04 -0.26 0.00 0.63 0.00 0.00 28.75 29.16 2rnl h GLU 45 CO 0.00 -0.11 0.56 -2.13 -0.73 0.00 0.00 179.01 176.59 2rnl n ARG 46 N -4.31 2.62 -4.08 1.92 0.63 -1.26 -4.36 116.66 107.82 2rnl n ARG 46 Ca -0.02 -2.99 -0.34 0.00 -0.92 0.00 0.00 57.85 53.58 2rnl n ARG 46 Cb 0.07 -2.18 -0.07 0.00 0.45 0.00 0.00 32.46 30.73 2rnl n ARG 46 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2rnl n GLY 48 N -1.34 5.90 3.63 0.00 0.00 -1.26 -2.07 105.19 110.05 2rnl n GLY 48 Ca 0.00 -2.29 -0.12 0.00 0.00 0.00 0.00 46.02 43.61 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 -3.73 0.70 0.00 1.61 2.02 -1.26 -5.06 118.70 112.98 2rnl s GLU 49 Ca 0.61 0.86 0.19 0.00 0.02 0.00 0.00 54.97 56.65 2rnl s GLU 49 Cb 0.48 0.33 0.15 0.00 0.10 0.00 0.00 34.13 35.19 2rnl s GLU 49 CO 0.01 -0.09 1.10 1.63 0.02 0.00 0.00 175.26 177.93