#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rnl n SER 2 N 0.00 5.68 -3.75 1.61 7.64 -1.26 -5.00 113.62 118.53 2rnl n SER 2 Ca 0.00 -3.76 -0.10 0.00 1.01 0.00 0.00 58.87 56.02 2rnl n SER 2 Cb 0.00 -0.55 -0.06 0.00 -1.01 0.00 0.00 64.21 62.60 2rnl n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2rnl s SER 3 N -3.04 -0.08 -0.34 6.43 0.15 -1.26 -5.11 113.70 110.46 2rnl s SER 3 Ca 0.54 -0.51 0.01 0.00 0.70 0.00 0.00 55.95 56.69 2rnl s SER 3 Cb 0.43 0.43 0.30 0.00 -1.71 0.00 0.00 66.02 65.47 2rnl s SER 3 CO -0.04 -0.83 1.30 0.61 1.20 0.00 0.00 173.24 175.48 2rnl n GLY 4 N -0.18 -1.49 3.32 9.45 0.00 -1.26 -5.15 105.19 109.88 2rnl n GLY 4 Ca -0.14 0.88 -0.36 0.00 0.00 0.00 0.00 46.02 46.39 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 1.01 -2.76 -4.05 1.61 2.88 -1.26 -4.99 113.62 106.06 2rnl n SER 5 Ca -0.02 0.50 -0.27 0.00 -1.33 0.00 0.00 58.87 57.76 2rnl n SER 5 Cb 0.73 -1.05 -0.17 0.00 -0.75 0.00 0.00 64.21 62.97 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 -1.33 2.13 0.00 -3.46 0.15 -1.26 -5.11 113.70 104.82 2rnl s SER 6 Ca 0.58 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.87 2rnl s SER 6 Cb -0.33 -0.96 0.00 0.00 -1.71 0.00 0.00 66.02 63.01 2rnl s SER 6 CO 0.66 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.74 2rnl n GLY 7 N 3.96 1.85 3.97 9.45 0.00 -1.26 -5.03 105.19 118.13 2rnl n GLY 7 Ca -0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 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 2.56 0.24 1.61 1.02 -1.26 -5.02 119.74 118.89 2rnl s LYS 8 Ca 0.00 -0.74 -0.30 0.00 0.02 0.00 0.00 55.97 54.96 2rnl s LYS 8 Cb 0.00 -2.48 -0.15 0.00 -0.52 0.00 0.00 37.83 34.69 2rnl s LYS 8 CO 0.00 -0.71 1.05 1.63 -0.92 0.00 0.00 175.35 176.41 2rnl n LYS 9 N -2.35 1.23 -4.24 1.68 4.01 -1.26 -4.98 118.16 112.24 2rnl n LYS 9 Ca 0.07 0.43 -0.24 0.00 -0.51 0.00 0.00 58.31 58.07 2rnl n LYS 9 Cb 0.60 -1.84 -0.07 0.00 -0.51 0.00 0.00 35.03 33.20 2rnl n LYS 9 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2rnl s ASN 10 N -0.35 4.70 0.43 4.39 4.22 -1.26 -5.03 114.94 122.05 2rnl s ASN 10 Ca 0.65 -0.51 0.22 0.00 -2.14 0.00 0.00 52.86 51.07 2rnl s ASN 10 Cb -0.77 -0.95 0.93 0.00 1.28 0.00 0.00 41.25 41.74 2rnl s ASN 10 CO 0.56 0.04 1.85 1.55 -2.04 0.00 0.00 177.10 179.06 2rnl h PRO 11 N 2.20 0.00 -0.86 3.55 0.13 -1.98 -3.04 132.00 132.00 2rnl h PRO 11 Ca -0.46 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.89 2rnl h PRO 11 Cb 1.23 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.31 2rnl h PRO 11 CO 0.59 0.27 0.59 0.00 -0.23 0.00 0.00 178.00 179.22 2rnl n ASN 13 N -4.42 3.42 -0.00 0.00 0.23 -1.15 -1.63 115.26 111.71 2rnl n ASN 13 Ca 0.18 -2.79 -0.01 0.00 -0.53 0.00 0.00 54.58 51.43 2rnl n ASN 13 Cb 0.78 -0.45 -0.00 0.00 -2.08 0.00 0.00 39.78 38.02 2rnl n ASN 13 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2rnl n ALA 14 N -0.44 1.84 0.00 -2.53 0.00 0.83 -4.83 120.51 115.37 2rnl n ALA 14 Ca 0.18 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2rnl n ALA 14 Cb 0.74 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.24 2rnl n ALA 14 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2rnl n GLU 15 N -2.92 0.77 -0.68 0.00 -0.58 -0.70 -4.63 120.64 111.91 2rnl n GLU 15 Ca -0.02 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.78 2rnl n GLU 15 Cb 0.07 -0.99 0.32 0.00 -0.57 0.00 0.00 31.44 30.27 2rnl n GLU 15 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2rnl n PHE 16 N -1.55 1.59 -0.21 -0.32 3.01 -0.38 -4.35 117.46 115.25 2rnl n PHE 16 Ca 0.00 -0.56 -0.07 0.00 1.01 0.00 0.00 57.45 57.83 2rnl n PHE 16 Cb 0.08 -0.39 0.07 0.00 -0.01 0.00 0.00 39.48 39.23 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 3.24 1.04 -0.93 -1.08 -0.00 -1.45 -2.55 115.11 113.37 2rnl h GLN 17 Ca 0.00 -0.28 -0.31 0.00 -0.00 0.00 0.00 58.65 58.06 2rnl h GLN 17 Cb 1.60 -0.12 -0.18 0.00 0.00 0.00 0.00 27.48 28.78 2rnl h GLN 17 CO 0.36 0.97 0.39 -1.71 0.00 0.00 0.00 178.83 178.84 2rnl n ASN 18 N -4.21 3.80 -0.03 -0.69 5.15 -1.26 -4.42 115.26 113.59 2rnl n ASN 18 Ca 0.04 -3.11 -0.03 0.00 -0.60 0.00 0.00 54.58 50.88 2rnl n ASN 18 Cb 0.30 -0.73 -0.01 0.00 -0.53 0.00 0.00 39.78 38.81 2rnl n ASN 18 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 2rnl n PHE 19 N -0.49 0.15 -1.94 1.20 -0.00 -0.96 -4.75 117.46 110.67 2rnl n PHE 19 Ca 0.40 0.06 -0.24 0.00 -0.00 0.00 0.00 57.45 57.67 2rnl n PHE 19 Cb 1.30 -0.30 -0.07 0.00 -0.00 0.00 0.00 39.48 40.41 2rnl n PHE 19 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2rnl h ILE 21 N 6.76 0.05 -2.81 0.00 2.04 -1.72 -3.35 117.51 118.49 2rnl h ILE 21 Ca 0.13 0.00 -0.61 0.00 1.00 0.00 0.00 64.86 65.38 2rnl h ILE 21 Cb 0.97 0.05 -0.40 0.00 -0.74 0.00 0.00 36.82 36.71 2rnl h ILE 21 CO 1.17 0.00 -0.76 -1.00 0.00 0.00 0.00 178.15 177.55 2rnl s HIS 22 N -5.81 2.22 0.00 1.37 3.76 -1.10 -5.01 115.29 110.72 2rnl s HIS 22 Ca -0.16 -2.70 0.00 0.00 -0.15 0.00 0.00 55.06 52.05 2rnl s HIS 22 Cb 0.07 -1.84 0.00 0.00 1.11 0.00 0.00 32.58 31.92 2rnl s HIS 22 CO 0.62 -0.72 0.00 0.41 -0.85 0.00 0.00 174.74 174.20 2rnl n GLY 23 N 2.77 0.84 3.77 -2.22 0.00 -1.26 -4.28 105.19 104.82 2rnl n GLY 23 Ca 0.20 -0.95 -0.39 0.00 0.00 0.00 0.00 46.02 44.88 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 4.26 -0.20 1.61 2.12 -0.69 -4.84 118.70 118.97 2rnl s GLU 24 Ca 0.00 0.66 -0.12 0.00 0.36 0.00 0.00 54.97 55.87 2rnl s GLU 24 Cb 0.00 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 31.01 2rnl s GLU 24 CO 0.00 0.41 0.20 0.00 -0.54 0.00 0.00 175.26 175.33 2rnl s LYS 26 N 0.58 0.29 -0.06 0.00 2.47 -1.12 -4.99 119.74 116.91 2rnl s LYS 26 Ca 0.11 -0.39 -0.30 0.00 -1.56 0.00 0.00 55.97 53.83 2rnl s LYS 26 Cb -0.12 -1.70 -0.03 0.00 -1.46 0.00 0.00 37.83 34.51 2rnl s LYS 26 CO 0.01 -0.80 1.21 -0.47 0.16 0.00 0.00 175.35 175.46 2rnl s TYR 27 N 2.01 3.16 -0.00 4.03 5.04 -1.26 -3.65 117.35 126.68 2rnl s TYR 27 Ca 0.04 1.19 -0.27 0.00 -2.44 0.00 0.00 57.07 55.59 2rnl s TYR 27 Cb -0.16 -3.44 -0.04 0.00 0.35 0.00 0.00 41.96 38.67 2rnl s TYR 27 CO -0.19 -1.38 0.83 0.42 -1.34 0.00 0.00 175.55 173.89 2rnl s ILE 28 N 2.26 4.87 -0.16 3.14 -1.09 0.71 -4.94 121.20 125.98 2rnl s ILE 28 Ca 0.56 1.75 -0.16 0.00 -2.23 0.00 0.00 60.65 60.57 2rnl s ILE 28 Cb -0.25 -4.18 -0.12 0.00 -1.58 0.00 0.00 42.46 36.33 2rnl s ILE 28 CO 0.22 0.25 0.12 -0.08 -1.23 0.00 0.00 174.94 174.22 2rnl h GLU 29 N 6.41 0.00 -0.01 2.79 4.22 -1.94 0.21 114.58 126.26 2rnl h GLU 29 Ca -0.42 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.03 2rnl h GLU 29 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 2rnl h GLU 29 CO 0.74 0.53 0.49 1.12 -2.18 0.00 0.00 179.01 179.71 2rnl h HIS 30 N -1.00 0.00 0.00 0.92 2.07 -1.98 0.37 115.15 115.53 2rnl h HIS 30 Ca -0.14 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.38 2rnl h HIS 30 Cb 0.83 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.81 2rnl h HIS 30 CO -0.00 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.14 2rnl n LEU 31 N -2.81 1.01 -3.73 6.12 4.77 -1.26 -5.00 117.00 116.11 2rnl n LEU 31 Ca -0.01 -1.01 -0.31 0.00 -0.03 0.00 0.00 56.01 54.64 2rnl n LEU 31 Cb 0.53 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.56 2rnl n LEU 31 CO 0.11 0.25 -0.12 -0.62 -1.33 0.00 0.00 177.39 175.68 2rnl n GLU 32 N -0.21 -0.79 -5.17 3.23 1.02 0.13 -4.87 120.64 113.98 2rnl n GLU 32 Ca 0.00 0.10 -0.30 0.00 -0.02 0.00 0.00 57.16 56.94 2rnl n GLU 32 Cb 0.28 -3.43 -0.16 0.00 -0.02 0.00 0.00 31.44 28.11 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 -2.67 2.02 0.15 0.62 0.00 -0.41 -4.92 121.76 116.54 2rnl s ALA 33 Ca 0.60 -0.96 -0.16 0.00 0.00 0.00 0.00 51.96 51.43 2rnl s ALA 33 Cb -0.35 -0.64 -0.07 0.00 0.00 0.00 0.00 23.12 22.06 2rnl s ALA 33 CO 0.75 0.38 0.59 0.54 0.00 0.00 0.00 175.76 178.02 2rnl s VAL 34 N -0.10 4.78 0.17 0.00 0.11 -1.26 -0.21 120.40 123.89 2rnl s VAL 34 Ca -0.04 0.99 -0.06 0.00 -2.93 0.00 0.00 61.98 59.94 2rnl s VAL 34 Cb -0.13 -3.79 -0.02 0.00 -1.53 0.00 0.00 36.38 30.91 2rnl s VAL 34 CO 0.04 0.29 0.22 0.28 -3.33 0.00 0.00 175.10 172.59 2rnl s THR 35 N -1.41 0.06 -0.23 5.04 -1.32 -1.24 -4.95 115.64 111.58 2rnl s THR 35 Ca 0.37 -1.64 -0.00 0.00 -1.21 0.00 0.00 61.69 59.22 2rnl s THR 35 Cb -0.16 -2.05 0.06 0.00 -1.51 0.00 0.00 72.50 68.84 2rnl s THR 35 CO 0.19 -0.26 -0.02 0.00 -2.21 0.00 0.00 174.62 172.32 2rnl s LYS 37 N 1.50 3.45 -0.17 0.00 2.20 0.17 -4.84 119.74 122.05 2rnl s LYS 37 Ca -0.04 1.29 -0.21 0.00 -0.36 0.00 0.00 55.97 56.65 2rnl s LYS 37 Cb -0.18 -4.13 -0.03 0.00 -1.51 0.00 0.00 37.83 31.98 2rnl s LYS 37 CO -0.07 -1.71 0.62 0.00 -0.36 0.00 0.00 175.35 173.83 2rnl n GLN 39 N 4.75 -3.54 0.11 0.00 1.13 -1.26 -4.81 117.38 113.77 2rnl n GLN 39 Ca -0.02 -0.90 -0.00 0.00 -1.94 0.00 0.00 57.00 54.14 2rnl n GLN 39 Cb 0.50 -1.22 0.28 0.00 0.11 0.00 0.00 30.24 29.92 2rnl n GLN 39 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 2rnl h GLN 40 N 0.00 0.21 -0.16 -1.09 5.75 -1.98 -3.06 115.11 114.79 2rnl h GLN 40 Ca -0.24 -0.08 -0.13 0.00 -0.15 0.00 0.00 58.65 58.05 2rnl h GLN 40 Cb 0.82 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.36 2rnl h GLN 40 CO 0.15 0.53 -0.40 0.93 -2.65 0.00 0.00 178.83 177.38 2rnl h GLU 41 N 0.18 0.55 -6.47 1.69 4.39 -1.95 -3.45 114.58 109.52 2rnl h GLU 41 Ca 0.02 -0.38 -0.45 0.00 0.34 0.00 0.00 59.36 58.89 2rnl h GLU 41 Cb 0.68 0.06 0.01 0.00 -0.10 0.00 0.00 28.75 29.41 2rnl h GLU 41 CO 0.05 1.00 -0.24 0.71 -1.16 0.00 0.00 179.01 179.37 2rnl s TYR 42 N -3.93 3.22 0.31 4.33 2.02 -1.15 -4.35 117.35 117.80 2rnl s TYR 42 Ca -0.13 0.02 -0.09 0.00 -0.37 0.00 0.00 57.07 56.50 2rnl s TYR 42 Cb 0.06 -2.07 0.01 0.00 -0.40 0.00 0.00 41.96 39.57 2rnl s TYR 42 CO 0.82 -0.09 0.54 -0.59 -1.57 0.00 0.00 175.55 174.66 2rnl s PHE 43 N -2.32 0.58 0.00 2.71 -0.71 -1.19 -4.10 117.98 112.96 2rnl s PHE 43 Ca 0.45 -0.96 0.00 0.00 -1.04 0.00 0.00 56.93 55.38 2rnl s PHE 43 Cb -0.10 0.21 0.00 0.00 -1.21 0.00 0.00 43.02 41.93 2rnl s PHE 43 CO 0.34 -1.16 0.00 0.41 -1.34 0.00 0.00 175.22 173.47 2rnl n GLY 44 N -0.48 0.17 0.06 1.99 0.00 -1.26 -3.49 105.19 102.17 2rnl n GLY 44 Ca -0.02 -1.42 -0.05 0.00 0.00 0.00 0.00 46.02 44.53 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 2.19 0.33 0.02 1.61 2.13 -1.26 -4.58 120.64 121.08 2rnl n GLU 45 Ca 0.00 0.17 0.01 0.00 0.66 0.00 0.00 57.16 58.00 2rnl n GLU 45 Cb 0.00 -1.12 0.33 0.00 0.27 0.00 0.00 31.44 30.91 2rnl n GLU 45 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2rnl h ARG 46 N -0.64 0.47 -2.88 5.31 3.08 -1.85 -3.40 114.38 114.48 2rnl h ARG 46 Ca 0.00 -0.09 -0.15 0.00 0.07 0.00 0.00 59.98 59.81 2rnl h ARG 46 Cb 0.60 -0.07 0.05 0.00 0.08 0.00 0.00 29.97 30.63 2rnl h ARG 46 CO 0.00 0.50 -0.26 0.00 -1.07 0.00 0.00 179.97 179.14 2rnl n GLY 48 N -1.07 -0.95 3.93 0.00 0.00 -1.26 -2.71 105.19 103.13 2rnl n GLY 48 Ca -0.01 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 45.25 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 -3.41 3.52 0.00 1.61 8.01 -1.26 -4.97 118.70 122.21 2rnl s GLU 49 Ca -0.06 -0.28 0.00 0.00 0.01 0.00 0.00 54.97 54.64 2rnl s GLU 49 Cb 0.14 -2.71 0.00 0.00 -4.31 0.00 0.00 34.13 27.24 2rnl s GLU 49 CO 0.87 0.24 0.00 0.36 0.01 0.00 0.00 175.26 176.73