#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 -1.88 0.00 0.00 4.77 -1.26 -4.41 117.00 114.22 1boe n LEU 14 Ca 0.00 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 1boe n LEU 14 Cb 0.00 -1.04 0.00 0.00 -2.33 0.00 0.00 43.42 40.05 1boe n LEU 14 CO 0.00 -3.39 0.00 0.00 -1.33 0.00 0.00 177.39 172.67 1boe n ALA 15 N -4.85 0.00 -2.74 -1.18 0.00 -1.26 -0.66 120.51 109.82 1boe n ALA 15 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.11 1boe n ALA 15 Cb 0.57 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.92 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 2.92 4.01 0.00 0.00 2.12 -1.26 -4.16 118.70 122.32 1boe s GLU 16 Ca 0.00 -0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.02 1boe s GLU 16 Cb 0.00 -3.43 0.00 0.00 0.26 0.00 0.00 34.13 30.96 1boe s GLU 16 CO 0.00 0.09 0.00 0.41 -0.54 0.00 0.00 175.26 175.22 1boe n GLY 17 N 4.15 0.42 3.76 -1.50 0.00 -0.66 -4.98 105.19 106.38 1boe n GLY 17 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.00 4.32 -0.27 1.61 -0.44 -1.26 -4.72 119.66 117.90 1boe s GLN 18 Ca 0.00 2.23 -0.29 0.00 -2.50 0.00 0.00 55.36 54.80 1boe s GLN 18 Cb 0.00 -3.10 -0.01 0.00 -1.64 0.00 0.00 33.01 28.26 1boe s GLN 18 CO 0.00 -0.29 1.37 -1.12 0.50 0.00 0.00 175.29 175.74 1boe s SER 19 N -0.03 6.63 0.00 6.67 0.01 -1.25 -3.05 113.70 122.68 1boe s SER 19 Ca 0.54 1.34 0.00 0.00 1.31 0.00 0.00 55.95 59.14 1boe s SER 19 Cb -0.40 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.29 1boe s SER 19 CO 0.47 -1.09 0.00 0.00 0.41 0.00 0.00 173.24 173.03 1boe s GLY 21 N 0.00 -0.40 0.65 0.00 0.00 -1.25 0.25 107.32 106.58 1boe s GLY 21 Ca 0.00 1.80 0.28 0.00 0.00 0.00 0.00 44.72 46.80 1boe s GLY 21 CO 0.00 1.11 1.85 -0.39 0.00 0.00 0.00 173.10 175.68 1boe h VAL 22 N 2.91 0.07 -0.58 1.40 -1.51 0.26 1.43 116.25 120.24 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 1.15 0.61 0.00 0.00 -2.13 0.00 0.00 31.29 30.93 1boe h VAL 22 CO 0.31 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.43 1boe n TYR 23 N -3.02 1.65 0.00 5.19 4.01 -1.22 -4.90 117.16 118.88 1boe n TYR 23 Ca 0.00 -0.68 0.00 0.00 -0.16 0.00 0.00 57.90 57.06 1boe n TYR 23 Cb 0.48 -0.35 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 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 0.76 0.00 -2.15 -0.72 -1.04 0.49 -5.03 114.28 106.58 1boe n THR 24 Ca 0.26 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 62.15 1boe n THR 24 Cb 1.01 0.00 0.07 0.00 -1.82 0.00 0.00 70.33 69.58 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 0.04 -3.46 -2.82 -0.58 -1.26 -4.97 120.64 107.58 1boe n GLU 25 Ca 0.00 -1.20 -0.43 0.00 -0.42 0.00 0.00 57.16 55.11 1boe n GLU 25 Cb 0.00 -0.40 -0.04 0.00 -0.57 0.00 0.00 31.44 30.43 1boe n GLU 25 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1boe s ARG 26 N -3.86 3.41 1.00 3.49 1.70 -1.26 -4.85 118.95 118.59 1boe s ARG 26 Ca 0.33 -2.68 -0.19 0.00 -0.47 0.00 0.00 55.73 52.71 1boe s ARG 26 Cb -0.02 -4.23 -0.13 0.00 -0.57 0.00 0.00 34.95 30.00 1boe s ARG 26 CO 0.22 -1.25 -0.82 0.00 -1.08 0.00 0.00 175.30 172.37 1boe n ALA 28 N -2.96 -1.66 -1.25 0.00 0.00 0.17 -4.34 120.51 110.48 1boe n ALA 28 Ca -0.01 0.24 -0.49 0.00 0.00 0.00 0.00 53.44 53.19 1boe n ALA 28 Cb 0.61 -0.74 -0.07 0.00 0.00 0.00 0.00 19.45 19.25 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 0.75 0.00 0.00 0.00 7.27 -1.26 0.18 117.38 124.32 1boe n GLN 29 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.16 1boe n GLN 29 Cb 0.03 -1.12 0.00 0.00 2.41 0.00 0.00 30.24 31.56 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 2.40 3.08 3.76 1.69 0.00 -1.26 -5.03 105.19 109.83 1boe n GLY 30 Ca 0.21 -0.86 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 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 4.59 0.01 0.99 1.43 0.48 -3.13 118.68 123.05 1boe s LEU 31 Ca 0.00 1.97 -0.01 0.00 -1.03 0.00 0.00 54.13 55.07 1boe s LEU 31 Cb 0.00 -3.68 -0.01 0.00 0.03 0.00 0.00 46.19 42.53 1boe s LEU 31 CO 0.00 0.08 -0.01 -0.13 0.23 0.00 0.00 176.35 176.52 1boe s ARG 32 N -1.35 0.27 0.05 1.70 1.81 -1.23 -4.10 118.95 116.10 1boe s ARG 32 Ca 0.43 -0.49 -0.30 0.00 -1.72 0.00 0.00 55.73 53.65 1boe s ARG 32 Cb -0.26 0.10 -0.09 0.00 -0.45 0.00 0.00 34.95 34.25 1boe s ARG 32 CO 0.32 -0.05 1.90 0.00 -0.68 0.00 0.00 175.30 176.79 1boe s LEU 34 N 3.90 2.49 0.53 0.00 2.01 0.55 -4.41 118.68 123.76 1boe s LEU 34 Ca 0.85 -0.94 -0.18 0.00 0.01 0.00 0.00 54.13 53.87 1boe s LEU 34 Cb -0.43 -0.63 -0.06 0.00 0.01 0.00 0.00 46.19 45.08 1boe s LEU 34 CO 0.39 -0.16 1.03 -2.16 1.01 0.00 0.00 176.35 176.46 1boe s PRO 35 N -3.26 3.63 0.24 1.29 0.04 -1.26 0.40 135.00 136.08 1boe s PRO 35 Ca 0.17 1.22 -0.04 0.00 0.04 0.00 0.00 61.00 62.39 1boe s PRO 35 Cb -0.02 -2.08 0.06 0.00 0.04 0.00 0.00 34.50 32.50 1boe s PRO 35 CO 0.05 -0.55 0.29 0.54 0.04 0.00 0.00 177.00 177.36 1boe n ARG 36 N -1.51 -0.62 0.00 4.56 1.74 -1.26 -4.83 116.66 114.74 1boe n ARG 36 Ca 0.09 -0.45 0.00 0.00 -0.77 0.00 0.00 57.85 56.71 1boe n ARG 36 Cb 0.53 -0.33 0.00 0.00 -1.02 0.00 0.00 32.46 31.64 1boe n ARG 36 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1boe n GLN 37 N -1.81 0.00 -1.99 5.56 3.00 -1.26 -4.70 117.38 116.17 1boe n GLN 37 Ca 0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.73 1boe n GLN 37 Cb 0.13 0.00 0.03 0.00 0.00 0.00 0.00 30.24 30.40 1boe n GLN 37 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1boe n ASP 38 N 0.00 5.83 0.00 1.08 9.92 -1.26 -4.72 116.55 127.40 1boe n ASP 38 Ca 0.00 -3.76 0.00 0.00 -0.53 0.00 0.00 54.79 50.50 1boe n ASP 38 Cb 0.00 -0.61 0.00 0.00 -0.64 0.00 0.00 41.12 39.87 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 -0.66 0.00 -3.65 -1.24 0.00 -1.26 -4.98 120.64 108.85 1boe n GLU 39 Ca 0.48 0.08 -0.03 0.00 0.00 0.00 0.00 57.16 57.69 1boe n GLU 39 Cb 0.71 -0.73 -0.05 0.00 0.00 0.00 0.00 31.44 31.36 1boe n GLU 39 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 1boe s GLU 40 N -0.52 0.61 -1.00 5.31 2.02 -1.26 -4.97 118.70 118.89 1boe s GLU 40 Ca 0.00 1.36 -0.15 0.00 0.02 0.00 0.00 54.97 56.20 1boe s GLU 40 Cb 0.00 0.61 0.01 0.00 0.10 0.00 0.00 34.13 34.85 1boe s GLU 40 CO 0.00 -0.19 0.70 1.17 0.02 0.00 0.00 175.26 176.96 1boe n LYS 41 N 5.07 -1.11 -1.77 1.61 4.81 -1.26 -4.92 118.16 120.59 1boe n LYS 41 Ca -0.15 0.61 -0.30 0.00 -0.87 0.00 0.00 58.31 57.60 1boe n LYS 41 Cb 0.52 -3.37 0.22 0.00 0.02 0.00 0.00 35.03 32.42 1boe n LYS 41 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1boe s PRO 42 N -5.58 -0.04 -1.42 1.64 0.04 -1.26 -3.90 135.00 124.48 1boe s PRO 42 Ca 0.26 -0.46 0.00 0.00 0.04 0.00 0.00 61.00 60.84 1boe s PRO 42 Cb -0.12 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.65 1boe s PRO 42 CO 0.88 -2.86 0.00 1.28 0.04 0.00 0.00 177.00 176.34 1boe n LEU 43 N -4.07 -0.86 -2.18 -3.56 4.77 -1.26 -4.58 117.00 105.26 1boe n LEU 43 Ca 0.16 0.33 -0.02 0.00 -0.03 0.00 0.00 56.01 56.46 1boe n LEU 43 Cb 0.59 -2.25 0.05 0.00 -2.33 0.00 0.00 43.42 39.48 1boe n LEU 43 CO 0.43 -0.82 0.46 1.57 -1.33 0.00 0.00 177.39 177.70 1boe n HIS 44 N -1.97 -0.95 0.00 -1.77 -0.00 -1.25 -5.01 115.22 104.27 1boe n HIS 44 Ca -0.13 -0.84 0.00 0.00 0.46 0.00 0.00 57.72 57.20 1boe n HIS 44 Cb 0.50 1.08 0.00 0.00 -0.12 0.00 0.00 29.99 31.45 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 -0.64 2.77 1.37 1.57 0.00 -1.25 -4.78 120.51 119.54 1boe n ALA 45 Ca -0.11 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.39 1boe n ALA 45 Cb 0.68 0.16 0.34 0.00 0.00 0.00 0.00 19.45 20.63 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 -2.47 0.00 -0.02 0.00 -0.00 -0.32 -2.35 117.00 111.85 1boe n LEU 46 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 56.00 1boe n LEU 46 Cb 0.16 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.58 1boe n LEU 46 CO 0.00 0.00 -0.07 -0.07 -0.00 0.00 0.00 177.39 177.25 1boe h LEU 47 N 0.00 0.00 -0.69 1.47 3.38 -1.86 1.80 115.31 119.41 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 0.21 0.00 1.41 0.09 0.00 0.00 178.44 180.15 1boe n HIS 48 N -2.93 0.12 0.00 1.13 8.25 -1.25 -3.44 115.22 117.10 1boe n HIS 48 Ca -0.02 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1boe n HIS 48 Cb 0.06 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.17 1boe n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1boe n GLY 49 N 1.01 -0.28 0.00 -1.41 0.00 -0.99 -4.99 105.19 98.54 1boe n GLY 49 Ca 0.16 -0.21 0.00 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 0.00 -4.13 1.61 1.74 -1.02 -3.20 116.66 111.66 1boe n ARG 50 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 1boe n ARG 50 Cb 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.35 1boe n ARG 50 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1boe s GLY 51 N 0.00 1.07 -0.04 -0.13 0.00 0.70 -1.17 107.32 107.75 1boe s GLY 51 Ca 0.00 -1.44 0.04 0.00 0.00 0.00 0.00 44.72 43.32 1boe s GLY 51 CO 0.00 -1.24 -0.15 -1.34 0.00 0.00 0.00 173.10 170.37 1boe s VAL 52 N -4.08 1.25 -0.47 1.40 -7.23 0.16 0.28 120.40 111.72 1boe s VAL 52 Ca 0.29 -0.62 -0.26 0.00 -1.81 0.00 0.00 61.98 59.59 1boe s VAL 52 Cb 0.06 -1.08 0.03 0.00 0.56 0.00 0.00 36.38 35.94 1boe s VAL 52 CO 0.06 0.37 0.95 0.00 -0.31 0.00 0.00 175.10 176.17 1boe s LEU 54 N 3.84 3.47 0.49 0.00 2.96 -1.01 -1.65 118.68 126.78 1boe s LEU 54 Ca 0.38 -0.19 -0.19 0.00 -0.22 0.00 0.00 54.13 53.91 1boe s LEU 54 Cb -0.10 -2.19 -0.13 0.00 0.50 0.00 0.00 46.19 44.27 1boe s LEU 54 CO 0.27 0.17 0.21 -0.46 -1.32 0.00 0.00 176.35 175.22 1boe n ASN 55 N 0.52 -2.31 -2.05 3.68 0.23 -1.26 -3.52 115.26 110.55 1boe n ASN 55 Ca -0.11 0.75 -0.18 0.00 -0.53 0.00 0.00 54.58 54.51 1boe n ASN 55 Cb 0.52 -0.99 -0.00 0.00 -2.08 0.00 0.00 39.78 37.22 1boe n ASN 55 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1boe n GLU 56 N 0.87 1.94 0.00 -3.83 0.28 -1.18 -4.45 120.64 114.27 1boe n GLU 56 Ca 0.10 -1.67 0.00 0.00 -0.16 0.00 0.00 57.16 55.43 1boe n GLU 56 Cb 0.45 -1.76 0.00 0.00 1.43 0.00 0.00 31.44 31.56 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 0.69 0.00 0.00 3.44 5.02 -1.26 -5.08 118.16 120.96 1boe n LYS 57 Ca 0.35 0.14 0.05 0.00 -2.02 0.00 0.00 58.31 56.83 1boe n LYS 57 Cb 0.59 -0.54 0.32 0.00 -0.02 0.00 0.00 35.03 35.38 1boe n LYS 57 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33