#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1boe n LEU 14 N 0.00 -1.35 0.00 0.00 4.77 -1.26 -4.40 117.00 114.76 1boe n LEU 14 Ca 0.00 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1boe n LEU 14 Cb 0.00 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 1boe n LEU 14 CO 0.00 -3.69 0.00 0.00 -1.33 0.00 0.00 177.39 172.37 1boe n ALA 15 N -5.02 0.00 -3.27 -1.18 0.00 -1.26 -0.75 120.51 109.03 1boe n ALA 15 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.15 1boe n ALA 15 Cb 0.53 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.84 1boe n ALA 15 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1boe s GLU 16 N 3.43 3.51 0.00 0.00 2.12 -1.26 -4.44 118.70 122.06 1boe s GLU 16 Ca 0.00 -0.57 0.00 0.00 0.36 0.00 0.00 54.97 54.76 1boe s GLU 16 Cb 0.00 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.32 1boe s GLU 16 CO 0.00 -0.11 0.00 0.41 -0.54 0.00 0.00 175.26 175.02 1boe n GLY 17 N 4.58 0.29 3.75 -1.50 0.00 -0.76 -4.98 105.19 106.56 1boe n GLY 17 Ca -0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1boe n GLY 17 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1boe s GLN 18 N -0.81 4.68 -0.01 1.61 -0.44 -1.26 -4.76 119.66 118.66 1boe s GLN 18 Ca 0.00 1.71 -0.30 0.00 -2.50 0.00 0.00 55.36 54.27 1boe s GLN 18 Cb 0.00 -3.23 -0.06 0.00 -1.64 0.00 0.00 33.01 28.08 1boe s GLN 18 CO 0.00 0.25 1.52 -1.12 0.50 0.00 0.00 175.29 176.44 1boe s SER 19 N -0.74 6.75 0.00 6.67 0.01 -1.26 -3.18 113.70 121.95 1boe s SER 19 Ca 0.45 2.21 0.00 0.00 1.31 0.00 0.00 55.95 59.91 1boe s SER 19 Cb -0.30 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.38 1boe s SER 19 CO 0.37 -0.82 0.00 0.00 0.41 0.00 0.00 173.24 173.20 1boe s GLY 21 N 0.00 -0.23 0.65 0.00 0.00 -1.26 -1.08 107.32 105.40 1boe s GLY 21 Ca 0.00 2.28 0.29 0.00 0.00 0.00 0.00 44.72 47.29 1boe s GLY 21 CO 0.00 1.36 1.91 -0.39 0.00 0.00 0.00 173.10 175.98 1boe h VAL 22 N 3.00 0.09 -0.62 1.40 -1.51 0.19 1.67 116.25 120.47 1boe h VAL 22 Ca -0.23 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.24 1boe h VAL 22 Cb 1.17 0.65 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1boe h VAL 22 CO 0.23 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.35 1boe n TYR 23 N -3.08 1.19 0.00 5.19 4.01 -1.24 -4.87 117.16 118.37 1boe n TYR 23 Ca 0.00 -0.51 0.00 0.00 -0.16 0.00 0.00 57.90 57.24 1boe n TYR 23 Cb 0.44 -0.14 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 1boe n TYR 23 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1boe n THR 24 N 1.17 0.00 -2.50 -0.72 -1.04 0.57 -5.07 114.28 106.70 1boe n THR 24 Ca 0.23 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.14 1boe n THR 24 Cb 0.73 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 69.28 1boe n THR 24 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1boe n GLU 25 N 0.00 0.38 -3.52 -2.82 -0.58 -1.26 -4.97 120.64 107.86 1boe n GLU 25 Ca 0.00 -1.21 -0.42 0.00 -0.42 0.00 0.00 57.16 55.11 1boe n GLU 25 Cb 0.00 -0.26 -0.06 0.00 -0.57 0.00 0.00 31.44 30.55 1boe n GLU 25 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 1boe s ARG 26 N -3.50 3.10 1.00 3.49 3.52 -1.26 -4.86 118.95 120.44 1boe s ARG 26 Ca 0.29 -2.52 -0.20 0.00 -0.13 0.00 0.00 55.73 53.16 1boe s ARG 26 Cb -0.02 -4.08 -0.13 0.00 -1.56 0.00 0.00 34.95 29.16 1boe s ARG 26 CO 0.19 -1.23 -0.89 0.00 -0.81 0.00 0.00 175.30 172.56 1boe n ALA 28 N -3.05 -1.72 -1.54 0.00 0.00 0.07 -4.35 120.51 109.91 1boe n ALA 28 Ca -0.01 0.21 -0.60 0.00 0.00 0.00 0.00 53.44 53.04 1boe n ALA 28 Cb 0.63 -0.66 -0.08 0.00 0.00 0.00 0.00 19.45 19.33 1boe n ALA 28 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1boe n GLN 29 N 0.52 0.00 0.00 0.00 7.27 -1.26 0.19 117.38 124.10 1boe n GLN 29 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.14 1boe n GLN 29 Cb 0.05 -1.48 0.00 0.00 2.41 0.00 0.00 30.24 31.22 1boe n GLN 29 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1boe n GLY 30 N 2.13 3.10 3.81 1.69 0.00 -1.26 -5.02 105.19 109.64 1boe n GLY 30 Ca 0.23 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 1boe n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1boe s LEU 31 N 0.00 4.04 0.07 0.99 1.43 0.51 -2.99 118.68 122.73 1boe s LEU 31 Ca 0.00 1.72 -0.09 0.00 -1.03 0.00 0.00 54.13 54.73 1boe s LEU 31 Cb 0.00 -4.41 -0.00 0.00 0.03 0.00 0.00 46.19 41.81 1boe s LEU 31 CO 0.00 -0.29 0.18 -0.13 0.23 0.00 0.00 176.35 176.34 1boe s ARG 32 N -2.91 0.79 -0.15 1.70 1.81 -1.23 -4.27 118.95 114.69 1boe s ARG 32 Ca 0.59 -0.87 -0.29 0.00 -1.72 0.00 0.00 55.73 53.44 1boe s ARG 32 Cb -0.11 0.32 -0.03 0.00 -0.45 0.00 0.00 34.95 34.68 1boe s ARG 32 CO 0.16 -0.24 1.46 0.00 -0.68 0.00 0.00 175.30 176.00 1boe s LEU 34 N 4.09 2.38 0.07 0.00 2.01 0.13 -4.63 118.68 122.72 1boe s LEU 34 Ca 0.64 -0.78 -0.30 0.00 0.01 0.00 0.00 54.13 53.70 1boe s LEU 34 Cb -0.26 -0.17 -0.05 0.00 0.01 0.00 0.00 46.19 45.72 1boe s LEU 34 CO 0.23 -0.31 1.08 -2.16 1.01 0.00 0.00 176.35 176.20 1boe s PRO 35 N -2.67 4.54 0.67 1.29 0.04 -1.26 -0.85 135.00 136.76 1boe s PRO 35 Ca 0.02 1.60 -0.17 0.00 0.04 0.00 0.00 61.00 62.49 1boe s PRO 35 Cb -0.03 -3.38 -0.05 0.00 0.04 0.00 0.00 34.50 31.09 1boe s PRO 35 CO -0.02 -0.07 0.64 0.54 0.04 0.00 0.00 177.00 178.13 1boe n ARG 36 N 3.50 0.45 -0.10 4.56 1.74 -1.26 -4.93 116.66 120.62 1boe n ARG 36 Ca 0.06 0.19 -0.20 0.00 -0.77 0.00 0.00 57.85 57.13 1boe n ARG 36 Cb 0.48 -1.89 -0.10 0.00 -1.02 0.00 0.00 32.46 29.93 1boe n ARG 36 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1boe h GLN 37 N -0.10 0.00 -2.04 5.56 1.08 -1.97 -3.38 115.11 114.26 1boe h GLN 37 Ca -0.46 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 56.58 1boe h GLN 37 Cb 1.36 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.73 1boe h GLN 37 CO 0.45 0.89 -0.30 -0.25 -0.95 0.00 0.00 178.83 178.66 1boe n ASP 38 N -4.45 5.01 0.00 1.46 9.92 -1.26 -4.80 116.55 122.43 1boe n ASP 38 Ca -0.29 -2.42 0.00 0.00 -0.53 0.00 0.00 54.79 51.54 1boe n ASP 38 Cb 0.63 -1.32 0.00 0.00 -0.64 0.00 0.00 41.12 39.79 1boe n ASP 38 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1boe n GLU 39 N 2.39 3.87 -3.63 -1.24 2.13 -1.26 -5.07 120.64 117.83 1boe n GLU 39 Ca 0.36 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.87 1boe n GLU 39 Cb 0.83 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.45 1boe n GLU 39 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1boe n GLU 40 N 0.00 2.45 -3.11 5.31 4.71 -1.26 -4.81 120.64 123.93 1boe n GLU 40 Ca 0.00 -4.55 -0.12 0.00 -0.01 0.00 0.00 57.16 52.49 1boe n GLU 40 Cb 0.00 -2.33 0.05 0.00 -1.01 0.00 0.00 31.44 28.15 1boe n GLU 40 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1boe n LYS 41 N 1.71 -1.96 -1.21 3.49 5.02 -1.26 -4.83 118.16 119.12 1boe n LYS 41 Ca 0.24 0.93 -0.35 0.00 -2.02 0.00 0.00 58.31 57.10 1boe n LYS 41 Cb 0.37 -5.57 -0.02 0.00 -0.02 0.00 0.00 35.03 29.79 1boe n LYS 41 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1boe n PRO 42 N -2.88 3.10 0.00 1.97 -0.04 -1.26 -4.35 135.00 131.53 1boe n PRO 42 Ca -0.05 -2.05 0.09 0.00 -0.04 0.00 0.00 63.50 61.45 1boe n PRO 42 Cb 0.59 -2.78 -0.07 0.00 -0.04 0.00 0.00 33.50 31.21 1boe n PRO 42 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1boe n LEU 43 N 4.22 1.17 -2.59 1.53 4.32 -1.26 -4.47 117.00 119.91 1boe n LEU 43 Ca 0.66 -0.59 -0.10 0.00 -0.02 0.00 0.00 56.01 55.97 1boe n LEU 43 Cb 0.23 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 42.07 1boe n LEU 43 CO 0.83 0.26 0.03 1.57 -1.22 0.00 0.00 177.39 178.86 1boe n HIS 44 N -0.99 1.75 0.01 -1.77 -0.00 -1.26 -4.85 115.22 108.11 1boe n HIS 44 Ca 0.05 -2.39 0.00 0.00 0.46 0.00 0.00 57.72 55.84 1boe n HIS 44 Cb 0.32 -0.27 0.00 0.00 -0.12 0.00 0.00 29.99 29.92 1boe n HIS 44 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1boe n ALA 45 N -0.50 3.00 1.22 1.57 0.00 -1.26 -4.68 120.51 119.86 1boe n ALA 45 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.70 1boe n ALA 45 Cb 0.83 0.42 0.44 0.00 0.00 0.00 0.00 19.45 21.13 1boe n ALA 45 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1boe n LEU 46 N -3.03 0.00 -0.05 0.00 -0.00 -1.26 0.91 117.00 113.57 1boe n LEU 46 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.99 1boe n LEU 46 Cb 0.39 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.80 1boe n LEU 46 CO 0.00 0.00 -0.18 -0.07 -0.00 0.00 0.00 177.39 177.14 1boe h LEU 47 N 0.00 0.00 0.01 1.47 3.38 -1.86 1.47 115.31 119.78 1boe h LEU 47 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1boe h LEU 47 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1boe h LEU 47 CO 0.00 0.48 -0.00 0.45 0.09 0.00 0.00 178.44 179.46 1boe h HIS 48 N -0.70 -0.01 0.00 1.13 3.86 -1.85 -3.28 115.15 114.30 1boe h HIS 48 Ca 0.00 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1boe h HIS 48 Cb 0.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1boe h HIS 48 CO -0.11 0.21 0.00 0.41 0.86 0.00 0.00 177.93 179.29 1boe n GLY 49 N -0.51 0.00 0.76 2.45 0.00 -1.11 -4.78 105.19 102.00 1boe n GLY 49 Ca -0.08 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.98 1boe n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1boe n ARG 50 N 0.00 0.38 -0.56 1.61 1.74 0.26 -4.49 116.66 115.60 1boe n ARG 50 Ca 0.00 -1.82 0.00 0.00 -0.77 0.00 0.00 57.85 55.26 1boe n ARG 50 Cb 0.00 -0.62 0.00 0.00 -1.02 0.00 0.00 32.46 30.82 1boe n ARG 50 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1boe n GLY 51 N -0.19 2.29 2.95 -0.13 0.00 -0.24 -4.31 105.19 105.55 1boe n GLY 51 Ca 0.07 -2.09 -0.13 0.00 0.00 0.00 0.00 46.02 43.87 1boe n GLY 51 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1boe s VAL 52 N 1.35 0.23 -0.43 1.61 -7.23 -0.03 -0.79 120.40 115.11 1boe s VAL 52 Ca 0.00 -0.44 -0.26 0.00 -1.81 0.00 0.00 61.98 59.47 1boe s VAL 52 Cb 0.00 -0.26 0.02 0.00 0.56 0.00 0.00 36.38 36.71 1boe s VAL 52 CO 0.00 -0.14 0.95 0.00 -0.31 0.00 0.00 175.10 175.61 1boe s LEU 54 N 3.76 3.27 0.65 0.00 2.01 -0.96 -1.84 118.68 125.57 1boe s LEU 54 Ca 0.39 -0.33 -0.17 0.00 0.01 0.00 0.00 54.13 54.02 1boe s LEU 54 Cb -0.10 -1.99 -0.11 0.00 0.01 0.00 0.00 46.19 44.00 1boe s LEU 54 CO 0.24 0.14 0.01 0.59 1.01 0.00 0.00 176.35 178.34 1boe n ASN 55 N 0.32 -3.11 -1.91 2.29 3.02 -1.26 -3.47 115.26 111.14 1boe n ASN 55 Ca -0.11 0.57 -0.15 0.00 -0.03 0.00 0.00 54.58 54.85 1boe n ASN 55 Cb 0.53 -0.97 0.01 0.00 -0.61 0.00 0.00 39.78 38.75 1boe n ASN 55 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1boe n GLU 56 N 0.90 1.77 0.00 3.52 0.28 -1.16 -4.46 120.64 121.49 1boe n GLU 56 Ca 0.07 -1.42 0.00 0.00 -0.16 0.00 0.00 57.16 55.66 1boe n GLU 56 Cb 0.49 -1.60 0.00 0.00 1.43 0.00 0.00 31.44 31.76 1boe n GLU 56 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1boe n LYS 57 N 0.65 0.00 0.00 3.44 5.02 -1.26 -5.09 118.16 120.92 1boe n LYS 57 Ca 0.28 0.01 0.04 0.00 -2.02 0.00 0.00 58.31 56.63 1boe n LYS 57 Cb 0.58 -0.18 0.24 0.00 -0.02 0.00 0.00 35.03 35.65 1boe n LYS 57 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33