#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 6.59 -0.04 1.61 1.04 -1.26 -4.76 113.70 116.88 2rnl s SER 2 Ca 0.00 -2.49 -0.00 0.00 0.48 0.00 0.00 55.95 53.93 2rnl s SER 2 Cb 0.00 -2.20 -0.02 0.00 0.10 0.00 0.00 66.02 63.90 2rnl s SER 2 CO 0.00 -0.63 -0.04 -1.54 0.98 0.00 0.00 173.24 172.01 2rnl n SER 3 N 4.25 2.53 -3.31 7.02 3.41 -1.26 -5.05 113.62 121.21 2rnl n SER 3 Ca 0.07 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.71 2rnl n SER 3 Cb 0.45 -0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.30 2rnl n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2rnl s GLY 4 N -4.59 -0.70 -0.00 5.00 0.00 -1.26 -5.16 107.32 100.60 2rnl s GLY 4 Ca -0.05 2.31 -0.06 0.00 0.00 0.00 0.00 44.72 46.92 2rnl s GLY 4 CO 0.08 3.36 0.12 -1.35 0.00 0.00 0.00 173.10 175.31 2rnl s SER 5 N 2.83 0.03 0.18 1.64 1.04 -1.26 -5.17 113.70 112.99 2rnl s SER 5 Ca 0.07 -0.18 0.08 0.00 0.48 0.00 0.00 55.95 56.40 2rnl s SER 5 Cb -0.12 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 66.16 2rnl s SER 5 CO -0.18 -0.33 -0.16 -0.94 0.98 0.00 0.00 173.24 172.61 2rnl s SER 6 N -1.24 2.61 0.07 7.02 1.04 -1.26 -5.09 113.70 116.85 2rnl s SER 6 Ca -0.13 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.36 2rnl s SER 6 Cb -0.07 -0.15 0.00 0.00 0.10 0.00 0.00 66.02 65.90 2rnl s SER 6 CO 0.01 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 174.74 2rnl n GLY 7 N -0.04 -1.81 3.49 7.32 0.00 -1.26 -5.05 105.19 107.85 2rnl n GLY 7 Ca -0.11 -1.45 -0.17 0.00 0.00 0.00 0.00 46.02 44.29 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 -1.84 0.98 -0.19 1.61 -2.85 -1.26 -5.15 119.74 111.05 2rnl s LYS 8 Ca 0.00 0.27 -0.03 0.00 -1.00 0.00 0.00 55.97 55.21 2rnl s LYS 8 Cb 0.00 0.46 0.06 0.00 -2.06 0.00 0.00 37.83 36.29 2rnl s LYS 8 CO 0.00 -0.29 0.05 0.21 0.10 0.00 0.00 175.35 175.43 2rnl s LYS 9 N -1.05 0.48 0.11 1.78 2.36 -1.26 -5.14 119.74 117.02 2rnl s LYS 9 Ca -0.10 -0.34 0.05 0.00 -2.55 0.00 0.00 55.97 53.03 2rnl s LYS 9 Cb -0.01 -2.02 -0.04 0.00 -1.05 0.00 0.00 37.83 34.72 2rnl s LYS 9 CO 0.08 -0.66 -0.13 0.54 1.55 0.00 0.00 175.35 176.73 2rnl s ASN 10 N 1.94 1.86 0.42 1.43 2.20 -1.26 -5.03 114.94 116.49 2rnl s ASN 10 Ca 0.00 -0.80 0.29 0.00 -0.94 0.00 0.00 52.86 51.42 2rnl s ASN 10 Cb -0.17 -0.05 1.22 0.00 -2.00 0.00 0.00 41.25 40.25 2rnl s ASN 10 CO -0.09 -0.17 1.87 1.55 -2.94 0.00 0.00 177.10 177.32 2rnl h PRO 11 N 3.58 0.00 -0.83 3.55 0.13 -1.98 -3.18 132.00 133.27 2rnl h PRO 11 Ca -0.39 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 64.91 2rnl h PRO 11 Cb 1.19 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.22 2rnl h PRO 11 CO 0.50 0.00 0.36 0.00 -0.23 0.00 0.00 178.00 178.63 2rnl n ASN 13 N -5.00 4.18 -0.04 0.00 0.23 -1.20 -0.33 115.26 113.10 2rnl n ASN 13 Ca 0.18 -2.33 -0.05 0.00 -0.53 0.00 0.00 54.58 51.86 2rnl n ASN 13 Cb 0.51 -0.49 -0.02 0.00 -2.08 0.00 0.00 39.78 37.70 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 0.96 1.10 0.00 -2.53 0.00 0.62 -4.81 120.51 115.85 2rnl n ALA 14 Ca 0.22 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2rnl n ALA 14 Cb 0.75 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.25 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 -3.64 2.42 -0.40 0.00 -0.58 -0.28 -4.68 120.64 113.48 2rnl n GLU 15 Ca -0.07 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.71 2rnl n GLU 15 Cb 0.26 -0.87 0.19 0.00 -0.57 0.00 0.00 31.44 30.45 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 -1.43 0.93 -0.04 -0.32 3.01 -0.20 -4.29 117.46 115.12 2rnl n PHE 16 Ca 0.00 -0.34 -0.11 0.00 1.01 0.00 0.00 57.45 58.02 2rnl n PHE 16 Cb 0.23 -0.25 -0.04 0.00 -0.01 0.00 0.00 39.48 39.41 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 2.01 0.26 0.00 -1.08 4.15 -0.83 -2.93 115.11 116.68 2rnl h GLN 17 Ca 0.00 -0.04 -0.18 0.00 0.77 0.00 0.00 58.65 59.21 2rnl h GLN 17 Cb 1.10 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.72 2rnl h GLN 17 CO 0.20 0.28 -0.83 -0.97 -1.93 0.00 0.00 178.83 175.58 2rnl h ASN 18 N 0.17 0.04 -0.65 -0.69 -0.00 -1.84 -3.33 115.58 109.28 2rnl h ASN 18 Ca 0.06 -0.04 0.06 0.00 -0.00 0.00 0.00 56.30 56.39 2rnl h ASN 18 Cb 0.11 -0.01 -0.09 0.00 -0.00 0.00 0.00 38.32 38.32 2rnl h ASN 18 CO -0.01 0.85 -0.51 0.15 -0.00 0.00 0.00 177.43 177.92 2rnl h PHE 19 N 0.02 -1.60 -2.35 0.67 3.57 -1.76 -3.30 116.94 112.19 2rnl h PHE 19 Ca -0.01 0.10 -0.53 0.00 3.53 0.00 0.00 57.97 61.05 2rnl h PHE 19 Cb 1.46 0.78 -0.06 0.00 2.79 0.00 0.00 35.95 40.93 2rnl h PHE 19 CO 0.01 -0.37 1.16 0.00 -2.23 0.00 0.00 178.31 176.87 2rnl h ILE 21 N 6.38 0.56 -2.76 0.00 2.04 -1.62 -3.42 117.51 118.70 2rnl h ILE 21 Ca -0.27 -0.98 -0.60 0.00 1.00 0.00 0.00 64.86 64.01 2rnl h ILE 21 Cb 1.10 0.95 -0.40 0.00 -0.74 0.00 0.00 36.82 37.73 2rnl h ILE 21 CO 1.24 0.15 -0.80 -1.00 0.00 0.00 0.00 178.15 177.74 2rnl s HIS 22 N -3.29 1.75 0.00 1.37 3.76 -1.00 -5.01 115.29 112.88 2rnl s HIS 22 Ca -0.11 -2.39 0.00 0.00 -0.15 0.00 0.00 55.06 52.41 2rnl s HIS 22 Cb 0.00 -1.57 0.00 0.00 1.11 0.00 0.00 32.58 32.12 2rnl s HIS 22 CO 0.38 -0.77 0.00 0.41 -0.85 0.00 0.00 174.74 173.92 2rnl n GLY 23 N 3.21 1.30 3.73 -2.22 0.00 -1.26 -4.28 105.19 105.67 2rnl n GLY 23 Ca 0.17 -0.86 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 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 4.38 -0.09 1.61 2.56 -0.70 -4.78 118.70 119.68 2rnl s GLU 24 Ca 0.00 0.73 -0.09 0.00 0.00 0.00 0.00 54.97 55.61 2rnl s GLU 24 Cb 0.00 -3.41 -0.04 0.00 2.00 0.00 0.00 34.13 32.67 2rnl s GLU 24 CO 0.00 0.18 0.21 0.00 -0.56 0.00 0.00 175.26 175.09 2rnl s LYS 26 N -1.03 0.22 -0.09 0.00 2.47 -1.16 -4.99 119.74 115.15 2rnl s LYS 26 Ca 0.17 0.65 -0.20 0.00 -1.56 0.00 0.00 55.97 55.03 2rnl s LYS 26 Cb -0.13 -0.28 -0.04 0.00 -1.46 0.00 0.00 37.83 35.92 2rnl s LYS 26 CO 0.06 -0.41 0.57 -0.47 0.16 0.00 0.00 175.35 175.26 2rnl s TYR 27 N 2.45 3.55 -0.06 4.03 5.04 -1.26 -3.77 117.35 127.32 2rnl s TYR 27 Ca 0.04 1.04 -0.08 0.00 -2.44 0.00 0.00 57.07 55.63 2rnl s TYR 27 Cb -0.13 -2.65 -0.04 0.00 0.35 0.00 0.00 41.96 39.48 2rnl s TYR 27 CO -0.11 0.15 0.21 0.42 -1.34 0.00 0.00 175.55 174.88 2rnl s ILE 28 N 0.65 5.38 -0.11 3.14 1.09 -0.31 -4.98 121.20 126.06 2rnl s ILE 28 Ca 0.31 0.26 -0.06 0.00 -1.10 0.00 0.00 60.65 60.06 2rnl s ILE 28 Cb -0.16 -3.50 -0.02 0.00 -1.06 0.00 0.00 42.46 37.72 2rnl s ILE 28 CO 0.14 0.53 -0.12 -0.08 -0.10 0.00 0.00 174.94 175.31 2rnl h GLU 29 N 4.60 0.00 -0.31 2.79 4.22 -1.95 0.27 114.58 124.21 2rnl h GLU 29 Ca -0.53 0.00 0.09 0.00 0.08 0.00 0.00 59.36 59.00 2rnl h GLU 29 Cb 1.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2rnl h GLU 29 CO 0.61 0.00 0.83 1.12 -2.18 0.00 0.00 179.01 179.39 2rnl h HIS 30 N -0.85 0.00 0.00 0.92 2.07 -1.99 0.76 115.15 116.06 2rnl h HIS 30 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2rnl h HIS 30 Cb 0.33 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.31 2rnl h HIS 30 CO -0.14 0.00 -1.13 1.28 -3.07 0.00 0.00 177.93 174.87 2rnl n LEU 31 N -2.93 0.02 -3.81 6.12 4.77 -1.26 -5.02 117.00 114.90 2rnl n LEU 31 Ca 0.06 -0.05 -0.29 0.00 -0.03 0.00 0.00 56.01 55.70 2rnl n LEU 31 Cb 0.94 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 42.05 2rnl n LEU 31 CO 0.12 0.01 0.10 -0.62 -1.33 0.00 0.00 177.39 175.66 2rnl n GLU 32 N -1.62 -5.37 -4.29 3.23 1.02 0.26 -4.97 120.64 108.90 2rnl n GLU 32 Ca -0.01 0.61 -0.21 0.00 -0.02 0.00 0.00 57.16 57.53 2rnl n GLU 32 Cb 0.13 -5.49 -0.11 0.00 -0.02 0.00 0.00 31.44 25.94 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 1.77 0.03 0.62 0.00 -0.94 -4.95 121.76 115.02 2rnl s ALA 33 Ca 0.63 -1.36 0.07 0.00 0.00 0.00 0.00 51.96 51.30 2rnl s ALA 33 Cb -0.31 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 2rnl s ALA 33 CO 0.77 0.21 -0.19 0.54 0.00 0.00 0.00 175.76 177.10 2rnl s VAL 34 N -1.89 2.74 0.20 0.00 0.11 -1.26 -1.16 120.40 119.13 2rnl s VAL 34 Ca 0.11 -1.15 -0.09 0.00 -2.93 0.00 0.00 61.98 57.93 2rnl s VAL 34 Cb -0.06 -2.13 -0.01 0.00 -1.53 0.00 0.00 36.38 32.64 2rnl s VAL 34 CO 0.05 0.38 0.31 0.28 -3.33 0.00 0.00 175.10 172.79 2rnl s THR 35 N -0.88 0.03 -0.27 5.04 -1.32 -1.25 -5.05 115.64 111.95 2rnl s THR 35 Ca 0.14 -1.51 0.02 0.00 -1.21 0.00 0.00 61.69 59.13 2rnl s THR 35 Cb -0.10 -2.08 0.07 0.00 -1.51 0.00 0.00 72.50 68.88 2rnl s THR 35 CO 0.04 -0.15 -0.05 0.00 -2.21 0.00 0.00 174.62 172.25 2rnl s LYS 37 N 1.21 3.63 -0.09 0.00 2.20 0.15 -4.77 119.74 122.07 2rnl s LYS 37 Ca -0.03 1.82 -0.22 0.00 -0.36 0.00 0.00 55.97 57.17 2rnl s LYS 37 Cb -0.19 -4.15 -0.03 0.00 -1.51 0.00 0.00 37.83 31.95 2rnl s LYS 37 CO -0.07 -1.51 0.67 0.00 -0.36 0.00 0.00 175.35 174.08 2rnl s GLN 39 N 0.97 -2.54 0.28 0.00 -0.21 -1.26 -4.75 119.66 112.15 2rnl s GLN 39 Ca 0.35 0.38 0.01 0.00 0.02 0.00 0.00 55.36 56.12 2rnl s GLN 39 Cb -0.17 -1.40 0.53 0.00 1.00 0.00 0.00 33.01 32.97 2rnl s GLN 39 CO 0.16 -4.68 1.85 0.37 -2.12 0.00 0.00 175.29 170.87 2rnl h GLN 40 N -3.29 1.00 -0.04 2.91 5.75 -1.98 -2.18 115.11 117.28 2rnl h GLN 40 Ca -0.50 -0.06 -0.20 0.00 -0.15 0.00 0.00 58.65 57.75 2rnl h GLN 40 Cb 1.34 -0.23 0.01 0.00 1.07 0.00 0.00 27.48 29.68 2rnl h GLN 40 CO 0.35 0.66 -0.74 0.93 -2.65 0.00 0.00 178.83 177.38 2rnl h GLU 41 N 1.03 0.56 -7.29 1.69 3.07 -1.90 -3.46 114.58 108.29 2rnl h GLU 41 Ca 0.48 -0.56 -0.46 0.00 -0.50 0.00 0.00 59.36 58.31 2rnl h GLU 41 Cb 0.41 0.15 0.08 0.00 -0.84 0.00 0.00 28.75 28.54 2rnl h GLU 41 CO -0.24 1.18 0.24 0.71 -1.40 0.00 0.00 179.01 179.51 2rnl s TYR 42 N -3.39 3.00 0.00 4.33 1.51 -0.82 -4.35 117.35 117.63 2rnl s TYR 42 Ca -0.12 0.52 -0.29 0.00 -1.01 0.00 0.00 57.07 56.17 2rnl s TYR 42 Cb 0.05 -3.13 0.10 0.00 -0.11 0.00 0.00 41.96 38.88 2rnl s TYR 42 CO 0.86 -1.32 1.05 -0.59 -1.11 0.00 0.00 175.55 174.44 2rnl s PHE 43 N -3.23 -0.19 0.00 2.71 -0.71 -1.21 -4.11 117.98 111.25 2rnl s PHE 43 Ca 0.59 0.03 0.00 0.00 -1.04 0.00 0.00 56.93 56.51 2rnl s PHE 43 Cb -0.11 0.56 0.00 0.00 -1.21 0.00 0.00 43.02 42.27 2rnl s PHE 43 CO 0.45 -0.51 0.00 0.41 -1.34 0.00 0.00 175.22 174.24 2rnl n GLY 44 N -0.32 -1.02 0.09 1.99 0.00 -1.26 -3.53 105.19 101.13 2rnl n GLY 44 Ca -0.06 -2.10 -0.08 0.00 0.00 0.00 0.00 46.02 43.78 2rnl n GLY 44 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2rnl n GLU 45 N 0.00 0.65 -0.11 1.61 0.00 -1.26 -4.46 120.64 117.07 2rnl n GLU 45 Ca 0.00 0.20 -0.14 0.00 0.00 0.00 0.00 57.16 57.22 2rnl n GLU 45 Cb 0.00 -1.72 -0.13 0.00 0.00 0.00 0.00 31.44 29.59 2rnl n GLU 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2rnl n ARG 46 N -2.94 0.70 -2.65 3.44 1.74 -1.26 -4.06 116.66 111.63 2rnl n ARG 46 Ca -0.20 0.09 -0.06 0.00 -0.77 0.00 0.00 57.85 56.91 2rnl n ARG 46 Cb 1.05 -1.49 0.02 0.00 -1.02 0.00 0.00 32.46 31.02 2rnl n ARG 46 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2rnl n GLY 48 N -0.94 -0.84 3.73 0.00 0.00 -1.26 -2.37 105.19 103.51 2rnl n GLY 48 Ca -0.02 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.58 4.29 0.00 1.61 0.41 -1.26 -4.90 118.70 116.27 2rnl s GLU 49 Ca -0.11 0.25 0.08 0.00 -0.41 0.00 0.00 54.97 54.77 2rnl s GLU 49 Cb 0.07 -3.43 0.06 0.00 -1.78 0.00 0.00 34.13 29.06 2rnl s GLU 49 CO 0.80 0.21 0.74 0.36 -0.49 0.00 0.00 175.26 176.88