#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jyv h VAL 6 N 0.00 1.18 0.00 2.41 2.07 -1.97 -3.27 116.25 116.67 3jyv h VAL 6 Ca 0.00 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.82 3jyv h VAL 6 Cb 0.00 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 3jyv h VAL 6 CO 0.00 0.24 0.00 0.79 0.02 0.00 0.00 177.57 178.62 3jyv n TRP 7 N -4.31 0.25 -2.50 1.57 7.02 -1.26 -4.52 117.44 113.69 3jyv n TRP 7 Ca 0.02 0.11 -0.42 0.00 -1.02 0.00 0.00 57.50 56.18 3jyv n TRP 7 Cb 0.22 -0.68 -0.03 0.00 -2.42 0.00 0.00 31.31 28.40 3jyv n TRP 7 CO 0.00 0.00 0.00 0.12 -2.02 0.00 0.00 177.69 175.79 3jyv s PHE 8 N -3.13 3.38 -1.45 -5.99 5.36 -1.24 -4.94 117.98 109.98 3jyv s PHE 8 Ca 0.03 1.35 0.27 0.00 -0.96 0.00 0.00 56.93 57.62 3jyv s PHE 8 Cb 0.06 -3.36 1.38 0.00 -0.34 0.00 0.00 43.02 40.77 3jyv s PHE 8 CO 0.19 -1.01 1.93 0.43 -1.46 0.00 0.00 175.22 175.30 3jyv n SER 9 N 4.48 0.00 -4.00 6.13 7.64 -1.26 -4.18 113.62 122.43 3jyv n SER 9 Ca 0.09 -0.13 -0.32 0.00 1.01 0.00 0.00 58.87 59.53 3jyv n SER 9 Cb 0.47 -0.28 -0.13 0.00 -1.01 0.00 0.00 64.21 63.27 3jyv n SER 9 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3jyv s HIS 10 N -2.55 3.32 0.98 1.43 5.65 -1.26 -5.10 115.29 117.76 3jyv s HIS 10 Ca 0.26 -3.02 -0.15 0.00 0.25 0.00 0.00 55.06 52.41 3jyv s HIS 10 Cb 0.18 -2.94 0.18 0.00 -1.18 0.00 0.00 32.58 28.82 3jyv s HIS 10 CO 0.41 -0.80 1.18 -1.25 -0.65 0.00 0.00 174.74 173.63 3jyv s PRO 11 N -0.05 0.57 -0.05 2.88 0.04 -1.26 -5.02 135.00 132.11 3jyv s PRO 11 Ca 0.16 0.05 -0.20 0.00 0.04 0.00 0.00 61.00 61.04 3jyv s PRO 11 Cb -0.24 -1.80 -0.15 0.00 0.04 0.00 0.00 34.50 32.36 3jyv s PRO 11 CO -0.02 -2.53 0.85 -0.09 0.04 0.00 0.00 177.00 175.24 3jyv h ARG 12 N -1.74 -0.23 0.00 4.56 2.43 -1.98 -3.47 114.38 113.95 3jyv h ARG 12 Ca -0.48 0.02 -0.34 0.00 -0.81 0.00 0.00 59.98 58.37 3jyv h ARG 12 Cb 1.30 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.89 3jyv h ARG 12 CO 0.51 0.18 -0.12 0.54 -1.51 0.00 0.00 179.97 179.56 3jyv n ARG 13 N -4.94 0.88 -0.02 0.20 1.74 -1.26 -5.06 116.66 108.21 3jyv n ARG 13 Ca -0.08 -2.11 -0.16 0.00 -0.77 0.00 0.00 57.85 54.74 3jyv n ARG 13 Cb 0.26 0.08 -0.13 0.00 -1.02 0.00 0.00 32.46 31.65 3jyv n ARG 13 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3jyv h PHE 14 N 0.39 0.26 -2.98 -1.55 -5.15 -1.99 -3.42 116.94 102.50 3jyv h PHE 14 Ca -0.20 -0.17 -0.60 0.00 -0.20 0.00 0.00 57.97 56.80 3jyv h PHE 14 Cb 0.80 -0.02 -0.40 0.00 0.22 0.00 0.00 35.95 36.55 3jyv h PHE 14 CO 0.00 1.06 -0.76 0.20 -2.00 0.00 0.00 178.31 176.82 3jyv s GLY 15 N -4.15 1.39 0.00 6.09 0.00 -1.26 -4.64 107.32 104.75 3jyv s GLY 15 Ca -0.16 -2.23 0.00 0.00 0.00 0.00 0.00 44.72 42.33 3jyv s GLY 15 CO 0.75 1.64 0.00 0.28 0.00 0.00 0.00 173.10 175.77 3jyv n LYS 16 N 3.98 0.00 -2.19 2.90 5.02 -1.26 -5.16 118.16 121.45 3jyv n LYS 16 Ca 0.06 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.95 3jyv n LYS 16 Cb 0.37 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.35 3jyv n LYS 16 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3jyv s GLY 17 N 0.00 0.51 0.00 0.72 0.00 -1.26 -4.93 107.32 102.36 3jyv s GLY 17 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 44.04 3jyv s GLY 17 CO 0.00 3.16 0.00 -1.14 0.00 0.00 0.00 173.10 175.12 3jyv n SER 18 N 11.33 0.00 -4.41 1.64 3.41 -1.26 -5.02 113.62 119.30 3jyv n SER 18 Ca 0.16 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.48 3jyv n SER 18 Cb 0.50 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.33 3jyv n SER 18 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3jyv s ARG 19 N 2.70 1.61 0.19 4.33 0.52 -1.26 -5.04 118.95 121.99 3jyv s ARG 19 Ca 0.00 -1.24 -0.03 0.00 -0.52 0.00 0.00 55.73 53.93 3jyv s ARG 19 Cb 0.00 -1.99 -0.03 0.00 0.52 0.00 0.00 34.95 33.45 3jyv s ARG 19 CO 0.00 0.47 0.18 -0.65 0.02 0.00 0.00 175.30 175.32 3jyv s GLN 20 N -1.91 1.19 0.62 3.54 -1.52 -1.26 -4.84 119.66 115.48 3jyv s GLN 20 Ca 0.15 -1.50 -0.10 0.00 -1.95 0.00 0.00 55.36 51.95 3jyv s GLN 20 Cb -0.10 0.30 -0.02 0.00 -0.22 0.00 0.00 33.01 32.97 3jyv s GLN 20 CO 0.06 -0.40 1.00 0.00 -0.25 0.00 0.00 175.29 175.70 3jyv h ARG 22 N -0.31 0.08 0.18 0.00 1.12 -1.86 -3.43 114.38 110.15 3jyv h ARG 22 Ca -0.45 -0.13 -0.01 0.00 -1.11 0.00 0.00 59.98 58.28 3jyv h ARG 22 Cb 1.21 0.05 0.00 0.00 -0.01 0.00 0.00 29.97 31.22 3jyv h ARG 22 CO 0.62 1.06 -0.09 0.28 -3.11 0.00 0.00 179.97 178.74 3jyv h VAL 23 N -0.75 0.00 -4.80 0.20 2.07 -1.93 -3.45 116.25 107.59 3jyv h VAL 23 Ca -0.30 -0.13 -0.42 0.00 0.82 0.00 0.00 66.70 66.66 3jyv h VAL 23 Cb 1.43 0.00 0.11 0.00 -1.52 0.00 0.00 31.29 31.31 3jyv h VAL 23 CO -0.10 0.00 0.21 0.00 0.02 0.00 0.00 177.57 177.70 3jyv h SER 25 N -0.95 0.00 -2.51 0.00 4.64 -1.87 -3.38 113.55 109.48 3jyv h SER 25 Ca -0.34 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.40 3jyv h SER 25 Cb 1.14 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 63.42 3jyv h SER 25 CO 0.32 0.36 -0.94 -1.20 -0.87 0.00 0.00 176.83 174.49 3jyv n SER 26 N -3.02 -2.98 0.00 4.97 7.64 -1.26 -3.98 113.62 114.99 3jyv n SER 26 Ca -0.01 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.43 3jyv n SER 26 Cb 0.70 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.91 3jyv n SER 26 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3jyv n HIS 27 N -2.01 0.00 -2.41 1.43 1.44 -1.26 -2.17 115.22 110.25 3jyv n HIS 27 Ca 0.07 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.41 3jyv n HIS 27 Cb 0.50 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.58 3jyv n HIS 27 CO 0.00 0.00 0.00 -0.08 -2.81 0.00 0.00 176.34 173.45 3jyv s THR 28 N -1.72 3.88 -0.12 0.61 -1.32 -1.26 -4.19 115.64 111.51 3jyv s THR 28 Ca 0.00 -1.29 -0.01 0.00 -1.21 0.00 0.00 61.69 59.18 3jyv s THR 28 Cb 0.00 -4.91 0.00 0.00 -1.51 0.00 0.00 72.50 66.09 3jyv s THR 28 CO 0.00 -1.67 0.02 0.61 -2.21 0.00 0.00 174.62 171.38 3jyv n GLY 29 N 5.96 -3.56 0.00 6.08 0.00 -1.26 -4.63 105.19 107.78 3jyv n GLY 29 Ca 0.44 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.61 3jyv n GLY 29 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3jyv n LEU 30 N 0.38 0.00 -3.75 0.99 4.77 -1.26 -3.88 117.00 114.25 3jyv n LEU 30 Ca -0.04 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.81 3jyv n LEU 30 Cb 0.06 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 3jyv n LEU 30 CO 0.18 0.00 0.04 -0.69 -1.33 0.00 0.00 177.39 175.59 3jyv s VAL 31 N 3.24 0.01 0.01 4.08 1.01 -1.25 -4.81 120.40 122.69 3jyv s VAL 31 Ca 0.00 -0.10 -0.18 0.00 0.00 0.00 0.00 61.98 61.70 3jyv s VAL 31 Cb 0.00 -0.54 -0.33 0.00 0.00 0.00 0.00 36.38 35.52 3jyv s VAL 31 CO 0.00 -0.05 0.99 0.03 0.00 0.00 0.00 175.10 176.07 3jyv h ARG 32 N 5.19 0.48 -0.44 2.72 3.08 -1.98 -3.34 114.38 120.09 3jyv h ARG 32 Ca -0.27 -0.76 -0.09 0.00 0.07 0.00 0.00 59.98 58.93 3jyv h ARG 32 Cb 1.18 0.27 -0.02 0.00 0.08 0.00 0.00 29.97 31.49 3jyv h ARG 32 CO 0.30 1.35 -0.08 1.57 -1.07 0.00 0.00 179.97 182.04 3jyv h LYS 33 N -0.00 0.77 -4.03 0.04 2.10 -1.99 -3.39 116.57 110.06 3jyv h LYS 33 Ca -0.20 -0.24 -0.52 0.00 -2.00 0.00 0.00 60.65 57.69 3jyv h LYS 33 Cb 1.92 -0.07 -0.38 0.00 -0.90 0.00 0.00 32.23 32.80 3jyv h LYS 33 CO 0.22 0.84 -0.79 0.71 -2.00 0.00 0.00 179.45 178.43 3jyv s TYR 34 N -4.84 1.38 -1.23 0.07 1.51 -1.25 -5.01 117.35 107.99 3jyv s TYR 34 Ca -0.09 -0.80 0.25 0.00 -1.01 0.00 0.00 57.07 55.42 3jyv s TYR 34 Cb 0.14 -1.17 1.19 0.00 -0.11 0.00 0.00 41.96 42.01 3jyv s TYR 34 CO 0.82 -0.54 1.83 -3.47 -1.11 0.00 0.00 175.55 173.08 3jyv n ASP 35 N 4.96 0.00 -3.15 2.29 2.03 -1.25 -3.88 116.55 117.54 3jyv n ASP 35 Ca -0.11 0.19 -0.13 0.00 0.52 0.00 0.00 54.79 55.26 3jyv n ASP 35 Cb 0.49 -0.38 0.08 0.00 -0.72 0.00 0.00 41.12 40.58 3jyv n ASP 35 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3jyv n LEU 36 N -1.38 0.00 0.00 -2.67 4.32 -1.26 -4.14 117.00 111.86 3jyv n LEU 36 Ca 0.09 -0.93 0.00 0.00 -0.02 0.00 0.00 56.01 55.15 3jyv n LEU 36 Cb 0.24 -0.41 0.00 0.00 -1.62 0.00 0.00 43.42 41.64 3jyv n LEU 36 CO 0.21 -0.85 0.00 0.59 -1.22 0.00 0.00 177.39 176.13 3jyv n ASN 37 N -3.16 -1.06 0.05 -1.43 3.02 -1.26 -4.56 115.26 106.87 3jyv n ASN 37 Ca 0.08 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.52 3jyv n ASN 37 Cb 0.30 0.66 -0.05 0.00 -0.61 0.00 0.00 39.78 40.08 3jyv n ASN 37 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3jyv h ILE 38 N 0.00 0.65 0.00 2.41 2.04 -1.92 -3.43 117.51 117.26 3jyv h ILE 38 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3jyv h ILE 38 Cb 0.00 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 3jyv h ILE 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.15 3jyv h ARG 40 N 0.00 0.00 0.20 0.00 2.47 -1.82 -3.41 114.38 111.82 3jyv h ARG 40 Ca 0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 3jyv h ARG 40 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3jyv h ARG 40 CO 0.00 0.64 -0.10 1.96 0.56 0.00 0.00 179.97 183.04 3jyv h GLN 41 N 0.00 -0.26 -0.06 0.04 4.20 -1.92 -2.02 115.11 115.09 3jyv h GLN 41 Ca -0.02 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.70 3jyv h GLN 41 Cb 1.54 0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.38 3jyv h GLN 41 CO 0.08 -0.09 0.00 0.00 -0.67 0.00 0.00 178.83 178.15 3jyv h PHE 43 N 0.04 0.36 0.00 0.00 3.57 -1.67 -2.14 116.94 117.10 3jyv h PHE 43 Ca 0.00 -0.14 -0.16 0.00 3.53 0.00 0.00 57.97 61.19 3jyv h PHE 43 Cb 0.04 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 3jyv h PHE 43 CO 0.00 0.84 -0.79 0.00 -2.23 0.00 0.00 178.31 176.14 3jyv h ARG 44 N -0.23 0.00 -0.17 1.11 -0.00 -1.71 -2.90 114.38 110.48 3jyv h ARG 44 Ca -0.01 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.44 3jyv h ARG 44 Cb 0.85 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.81 3jyv h ARG 44 CO 0.05 0.76 -0.01 0.93 0.00 0.00 0.00 179.97 181.69 3jyv h GLU 45 N 0.00 0.30 -0.06 0.04 5.08 -1.65 -2.78 114.58 115.50 3jyv h GLU 45 Ca -0.01 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3jyv h GLU 45 Cb 1.60 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.82 3jyv h GLU 45 CO 0.10 0.54 0.00 1.63 -1.00 0.00 0.00 179.01 180.27 3jyv n LYS 46 N -4.72 1.32 0.08 2.33 5.02 -0.80 -2.05 118.16 119.35 3jyv n LYS 46 Ca -0.05 -0.48 -0.23 0.00 -2.02 0.00 0.00 58.31 55.53 3jyv n LYS 46 Cb 0.23 -1.36 -0.15 0.00 -0.02 0.00 0.00 35.03 33.73 3jyv n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3jyv h ALA 47 N 3.86 0.08 0.00 7.82 0.00 -1.40 -3.33 119.26 126.29 3jyv h ALA 47 Ca 0.00 -1.06 -0.01 0.00 0.00 0.00 0.00 54.91 53.84 3jyv h ALA 47 Cb 0.22 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3jyv h ALA 47 CO 0.00 0.91 -0.06 -0.91 0.00 0.00 0.00 179.25 179.19 3jyv h ASN 48 N 0.06 0.00 0.00 0.00 2.35 -1.13 -3.22 115.58 113.64 3jyv h ASN 48 Ca -0.32 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 3jyv h ASN 48 Cb 2.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.44 3jyv h ASN 48 CO 0.19 0.06 0.00 0.47 -1.65 0.00 0.00 177.43 176.50 3jyv n ASP 49 N -3.17 0.00 -3.65 5.81 8.00 -0.96 -4.94 116.55 117.64 3jyv n ASP 49 Ca 0.01 0.84 -0.07 0.00 0.71 0.00 0.00 54.79 56.28 3jyv n ASP 49 Cb 0.35 -0.46 -0.07 0.00 -0.02 0.00 0.00 41.12 40.92 3jyv n ASP 49 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3jyv s ILE 50 N -2.36 -0.20 0.00 0.53 2.07 -1.21 -5.11 121.20 114.91 3jyv s ILE 50 Ca 0.00 0.02 0.00 0.00 -1.41 0.00 0.00 60.65 59.26 3jyv s ILE 50 Cb 0.00 -0.92 0.00 0.00 0.13 0.00 0.00 42.46 41.67 3jyv s ILE 50 CO 0.00 0.01 0.00 0.61 -1.91 0.00 0.00 174.94 173.65 3jyv n GLY 51 N 4.54 -1.40 3.80 1.50 0.00 -1.25 -4.72 105.19 107.67 3jyv n GLY 51 Ca -0.19 -1.29 -0.07 0.00 0.00 0.00 0.00 46.02 44.47 3jyv n GLY 51 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3jyv s PHE 52 N 0.00 -0.06 -0.15 1.61 5.36 -1.26 -4.66 117.98 118.81 3jyv s PHE 52 Ca 0.00 -0.38 -0.28 0.00 -0.96 0.00 0.00 56.93 55.31 3jyv s PHE 52 Cb 0.00 0.60 0.07 0.00 -0.34 0.00 0.00 43.02 43.35 3jyv s PHE 52 CO 0.00 -1.20 0.69 -1.58 -1.46 0.00 0.00 175.22 171.67 3jyv s HIS 53 N -3.89 -0.71 0.00 10.12 5.65 -1.26 -5.13 115.29 120.07 3jyv s HIS 53 Ca 0.14 1.48 0.00 0.00 0.25 0.00 0.00 55.06 56.93 3jyv s HIS 53 Cb -0.05 0.34 0.00 0.00 -1.18 0.00 0.00 32.58 31.69 3jyv s HIS 53 CO 0.08 -0.50 0.00 1.17 -0.65 0.00 0.00 174.74 174.84