#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 -1.33 0.00 0.00 4.77 -1.26 -4.41 117.00 114.77 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 -0.97 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 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 -5.01 0.00 -3.16 -1.18 0.00 -1.26 -1.15 120.51 108.74 1boe n ALA 15 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.16 1boe n ALA 15 Cb 0.52 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 3.60 3.53 0.00 0.00 2.12 -1.26 -4.43 118.70 122.27 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 -2.95 0.00 0.00 0.26 0.00 0.00 34.13 31.44 1boe s GLU 16 CO 0.00 0.04 0.00 0.41 -0.54 0.00 0.00 175.26 175.17 1boe n GLY 17 N 4.11 0.69 3.76 -1.50 0.00 -0.61 -4.98 105.19 106.66 1boe n GLY 17 Ca -0.18 0.00 -0.41 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 -0.93 4.44 -0.22 1.61 -0.44 -1.26 -4.71 119.66 118.14 1boe s GLN 18 Ca 0.00 2.07 -0.29 0.00 -2.50 0.00 0.00 55.36 54.64 1boe s GLN 18 Cb 0.00 -3.14 -0.01 0.00 -1.64 0.00 0.00 33.01 28.22 1boe s GLN 18 CO 0.00 -0.11 1.39 -1.12 0.50 0.00 0.00 175.29 175.95 1boe s SER 19 N -0.34 6.69 0.00 6.67 0.01 -1.26 -2.88 113.70 122.58 1boe s SER 19 Ca 0.50 1.52 0.00 0.00 1.31 0.00 0.00 55.95 59.28 1boe s SER 19 Cb -0.37 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.32 1boe s SER 19 CO 0.46 -1.01 0.00 0.00 0.41 0.00 0.00 173.24 173.10 1boe s GLY 21 N 0.00 -0.28 0.65 0.00 0.00 -1.26 0.22 107.32 106.65 1boe s GLY 21 Ca 0.00 2.05 0.32 0.00 0.00 0.00 0.00 44.72 47.09 1boe s GLY 21 CO 0.00 1.15 1.97 -0.39 0.00 0.00 0.00 173.10 175.83 1boe h VAL 22 N 2.77 0.00 -0.62 1.40 -1.51 0.16 1.49 116.25 119.94 1boe h VAL 22 Ca -0.21 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.26 1boe h VAL 22 Cb 1.16 0.71 0.00 0.00 -2.13 0.00 0.00 31.29 31.03 1boe h VAL 22 CO 0.29 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.41 1boe n TYR 23 N -2.88 0.82 0.00 5.19 4.01 -1.16 -4.87 117.16 118.27 1boe n TYR 23 Ca -0.02 -0.41 0.00 0.00 -0.16 0.00 0.00 57.90 57.31 1boe n TYR 23 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 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 1.32 0.00 -1.90 -0.72 -1.04 0.51 -5.03 114.28 107.42 1boe n THR 24 Ca 0.21 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.17 1boe n THR 24 Cb 0.53 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.07 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 0.20 -3.59 -2.82 -0.58 -1.26 -4.97 120.64 107.61 1boe n GLU 25 Ca 0.00 -0.51 -0.40 0.00 -0.42 0.00 0.00 57.16 55.83 1boe n GLU 25 Cb 0.00 -0.19 -0.07 0.00 -0.57 0.00 0.00 31.44 30.61 1boe n GLU 25 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1boe s ARG 26 N -3.19 2.96 1.00 3.49 0.52 -1.26 -4.87 118.95 117.61 1boe s ARG 26 Ca 0.14 -2.60 -0.20 0.00 -0.52 0.00 0.00 55.73 52.56 1boe s ARG 26 Cb -0.01 -3.97 -0.14 0.00 0.52 0.00 0.00 34.95 31.35 1boe s ARG 26 CO 0.10 -1.22 -0.89 0.00 0.02 0.00 0.00 175.30 173.31 1boe n ALA 28 N -2.89 -1.80 -1.52 0.00 0.00 -0.30 -4.33 120.51 109.66 1boe n ALA 28 Ca -0.01 0.25 -0.59 0.00 0.00 0.00 0.00 53.44 53.08 1boe n ALA 28 Cb 0.61 -0.74 -0.08 0.00 0.00 0.00 0.00 19.45 19.24 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 0.64 0.00 0.00 0.00 7.27 -1.26 0.19 117.38 124.22 1boe n GLN 29 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.15 1boe n GLN 29 Cb 0.03 -1.39 0.00 0.00 2.41 0.00 0.00 30.24 31.30 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 2.69 2.70 3.83 1.69 0.00 -1.26 -5.04 105.19 109.80 1boe n GLY 30 Ca 0.24 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 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 4.26 -0.01 0.99 1.43 0.49 -2.64 118.68 123.20 1boe s LEU 31 Ca 0.00 1.26 -0.05 0.00 -1.03 0.00 0.00 54.13 54.31 1boe s LEU 31 Cb 0.00 -3.64 -0.00 0.00 0.03 0.00 0.00 46.19 42.58 1boe s LEU 31 CO 0.00 -0.02 0.10 -0.13 0.23 0.00 0.00 176.35 176.53 1boe s ARG 32 N -2.28 0.35 0.00 1.70 0.52 -1.22 -4.24 118.95 113.79 1boe s ARG 32 Ca 0.45 -0.28 -0.30 0.00 -0.52 0.00 0.00 55.73 55.07 1boe s ARG 32 Cb -0.14 0.15 -0.08 0.00 0.52 0.00 0.00 34.95 35.39 1boe s ARG 32 CO 0.20 -0.07 1.92 0.00 0.02 0.00 0.00 175.30 177.36 1boe s LEU 34 N 4.58 2.33 -0.11 0.00 2.01 0.64 -4.52 118.68 123.61 1boe s LEU 34 Ca 0.86 -0.70 -0.30 0.00 0.01 0.00 0.00 54.13 54.01 1boe s LEU 34 Cb -0.40 -0.46 -0.01 0.00 0.01 0.00 0.00 46.19 45.33 1boe s LEU 34 CO 0.39 -0.14 1.02 -2.16 1.01 0.00 0.00 176.35 176.47 1boe s PRO 35 N -2.16 4.41 0.86 1.29 0.04 -1.26 0.26 135.00 138.44 1boe s PRO 35 Ca 0.02 1.40 -0.11 0.00 0.04 0.00 0.00 61.00 62.35 1boe s PRO 35 Cb -0.07 -3.55 0.16 0.00 0.04 0.00 0.00 34.50 31.08 1boe s PRO 35 CO 0.02 -0.34 1.19 1.03 0.04 0.00 0.00 177.00 178.95 1boe s ARG 36 N 2.08 1.17 -0.08 4.56 1.81 -1.26 -4.81 118.95 122.42 1boe s ARG 36 Ca 0.48 -0.54 -0.02 0.00 -1.72 0.00 0.00 55.73 53.93 1boe s ARG 36 Cb -0.18 -2.01 0.00 0.00 -0.45 0.00 0.00 34.95 32.30 1boe s ARG 36 CO 0.18 -1.98 0.07 1.04 -0.68 0.00 0.00 175.30 173.92 1boe n GLN 37 N -3.40 -0.64 0.15 3.54 1.13 -1.26 -4.64 117.38 112.26 1boe n GLN 37 Ca 0.14 0.93 0.13 0.00 -1.94 0.00 0.00 57.00 56.25 1boe n GLN 37 Cb 0.60 -2.21 0.37 0.00 0.11 0.00 0.00 30.24 29.11 1boe n GLN 37 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 1boe h ASP 38 N 0.55 0.00 -1.34 1.08 5.19 -2.02 -3.26 116.42 116.61 1boe h ASP 38 Ca 0.00 0.00 -0.66 0.00 -0.62 0.00 0.00 57.03 55.75 1boe h ASP 38 Cb 0.12 0.00 -0.26 0.00 0.18 0.00 0.00 39.33 39.37 1boe h ASP 38 CO 0.03 0.00 0.86 1.21 -3.12 0.00 0.00 179.24 178.22 1boe n GLU 39 N -2.56 2.60 0.00 3.56 2.13 -1.26 -4.90 120.64 120.21 1boe n GLU 39 Ca 0.04 -3.12 0.00 0.00 0.66 0.00 0.00 57.16 54.74 1boe n GLU 39 Cb 0.43 -2.20 0.00 0.00 0.27 0.00 0.00 31.44 29.93 1boe n GLU 39 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1boe n GLU 40 N -0.48 0.00 -3.19 5.31 2.13 -1.23 -5.08 120.64 118.10 1boe n GLU 40 Ca 0.55 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 58.18 1boe n GLU 40 Cb 0.48 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.15 1boe n GLU 40 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1boe n LYS 41 N 0.00 0.96 -1.23 5.31 4.01 -1.26 -4.99 118.16 120.96 1boe n LYS 41 Ca 0.00 -3.38 -0.36 0.00 -0.51 0.00 0.00 58.31 54.06 1boe n LYS 41 Cb 0.00 -1.62 -0.03 0.00 -0.51 0.00 0.00 35.03 32.87 1boe n LYS 41 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 1boe n PRO 42 N 0.51 3.46 -0.01 1.97 -0.04 -1.26 -4.31 135.00 135.32 1boe n PRO 42 Ca 0.24 -2.08 0.10 0.00 -0.04 0.00 0.00 63.50 61.72 1boe n PRO 42 Cb 0.63 -2.74 -0.15 0.00 -0.04 0.00 0.00 33.50 31.20 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 3.64 0.04 -1.72 1.53 7.99 -1.26 -4.27 117.00 122.95 1boe n LEU 43 Ca 0.74 -0.02 -0.13 0.00 -0.01 0.00 0.00 56.01 56.59 1boe n LEU 43 Cb 0.23 0.00 0.20 0.00 -0.11 0.00 0.00 43.42 43.74 1boe n LEU 43 CO 0.83 0.01 1.00 1.57 -1.51 0.00 0.00 177.39 179.28 1boe n HIS 44 N -2.15 2.12 0.02 -1.77 -0.00 -1.26 -4.52 115.22 107.66 1boe n HIS 44 Ca -0.03 -1.64 -0.00 0.00 0.46 0.00 0.00 57.72 56.50 1boe n HIS 44 Cb 0.50 -0.71 -0.00 0.00 -0.12 0.00 0.00 29.99 29.66 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 -1.01 2.99 1.22 1.57 0.00 -1.26 -4.67 120.51 119.35 1boe n ALA 45 Ca 0.46 -0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.95 1boe n ALA 45 Cb 1.36 0.41 0.34 0.00 0.00 0.00 0.00 19.45 21.56 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 -3.18 0.00 -0.07 0.00 -0.00 -1.26 0.95 117.00 113.44 1boe n LEU 46 Ca -0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 56.01 55.95 1boe n LEU 46 Cb 0.33 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.73 1boe n LEU 46 CO 0.00 0.00 -0.43 0.18 -0.00 0.00 0.00 177.39 177.14 1boe n LEU 47 N -0.80 1.69 0.31 1.47 4.77 -1.26 0.17 117.00 123.36 1boe n LEU 47 Ca 0.09 0.49 -0.17 0.00 -0.03 0.00 0.00 56.01 56.39 1boe n LEU 47 Cb 0.04 -0.79 -0.09 0.00 -2.33 0.00 0.00 43.42 40.25 1boe n LEU 47 CO 0.06 -0.41 0.67 0.45 -1.33 0.00 0.00 177.39 176.84 1boe h HIS 48 N -0.91 -0.70 0.00 -1.77 3.86 -1.83 -3.06 115.15 110.73 1boe h HIS 48 Ca 0.00 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1boe h HIS 48 Cb 0.63 0.23 0.00 0.00 1.06 0.00 0.00 27.41 29.33 1boe h HIS 48 CO -0.27 -0.43 0.00 0.41 0.86 0.00 0.00 177.93 178.50 1boe n GLY 49 N -1.36 0.00 0.22 2.45 0.00 -1.13 -4.66 105.19 100.70 1boe n GLY 49 Ca -0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 0.86 -2.76 1.61 5.12 0.27 -4.23 116.66 117.52 1boe n ARG 50 Ca 0.00 -1.97 -0.21 0.00 -1.93 0.00 0.00 57.85 53.74 1boe n ARG 50 Cb 0.00 -1.12 0.05 0.00 -1.16 0.00 0.00 32.46 30.23 1boe n ARG 50 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1boe s GLY 51 N -2.14 1.82 -0.03 -0.13 0.00 0.59 -4.26 107.32 103.18 1boe s GLY 51 Ca 0.20 -1.64 0.07 0.00 0.00 0.00 0.00 44.72 43.35 1boe s GLY 51 CO 0.02 -1.27 -0.23 -1.34 0.00 0.00 0.00 173.10 170.27 1boe s VAL 52 N -2.76 2.28 -0.53 1.40 -7.23 0.74 0.27 120.40 114.56 1boe s VAL 52 Ca 0.60 -1.02 -0.26 0.00 -1.81 0.00 0.00 61.98 59.49 1boe s VAL 52 Cb -0.08 -1.81 0.03 0.00 0.56 0.00 0.00 36.38 35.08 1boe s VAL 52 CO 0.39 0.58 1.01 0.00 -0.31 0.00 0.00 175.10 176.77 1boe s LEU 54 N 4.16 3.61 0.75 0.00 0.20 -1.01 -1.57 118.68 124.83 1boe s LEU 54 Ca 0.36 -0.13 -0.17 0.00 0.69 0.00 0.00 54.13 54.88 1boe s LEU 54 Cb -0.10 -2.30 -0.11 0.00 -0.43 0.00 0.00 46.19 43.24 1boe s LEU 54 CO 0.23 0.16 -0.17 0.59 -0.29 0.00 0.00 176.35 176.87 1boe n ASN 55 N 0.39 -3.79 -1.86 3.68 3.02 -1.26 -3.40 115.26 112.03 1boe n ASN 55 Ca -0.10 0.46 -0.14 0.00 -0.03 0.00 0.00 54.58 54.77 1boe n ASN 55 Cb 0.52 -0.93 0.02 0.00 -0.61 0.00 0.00 39.78 38.78 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 1.12 1.70 0.00 3.52 0.28 -1.08 -4.42 120.64 121.76 1boe n GLU 56 Ca 0.05 -1.31 0.00 0.00 -0.16 0.00 0.00 57.16 55.74 1boe n GLU 56 Cb 0.51 -1.54 0.00 0.00 1.43 0.00 0.00 31.44 31.84 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 0.64 0.00 0.00 3.44 4.76 -1.26 -5.10 118.16 120.64 1boe n LYS 57 Ca 0.26 0.05 0.03 0.00 -2.87 0.00 0.00 58.31 55.78 1boe n LYS 57 Cb 0.57 -0.33 0.19 0.00 -1.84 0.00 0.00 35.03 33.62 1boe n LYS 57 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48