#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 -1.87 0.00 0.00 4.77 -1.26 -4.50 117.00 114.14 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 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 1boe n LEU 14 CO 0.00 -3.34 0.00 0.00 -1.33 0.00 0.00 177.39 172.72 1boe n ALA 15 N -4.73 0.00 -2.88 -1.18 0.00 -1.26 -2.23 120.51 108.22 1boe n ALA 15 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.12 1boe n ALA 15 Cb 0.56 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.90 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 3.52 3.85 0.00 0.00 2.12 -1.26 -4.30 118.70 122.62 1boe s GLU 16 Ca 0.00 -0.40 0.00 0.00 0.36 0.00 0.00 54.97 54.93 1boe s GLU 16 Cb 0.00 -3.26 0.00 0.00 0.26 0.00 0.00 34.13 31.13 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 4.09 0.09 3.73 -1.50 0.00 -0.67 -4.98 105.19 105.94 1boe n GLY 17 Ca -0.16 0.00 -0.42 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 -0.94 4.47 0.02 1.61 -0.44 -1.26 -4.73 119.66 118.39 1boe s GLN 18 Ca 0.00 1.82 -0.30 0.00 -2.50 0.00 0.00 55.36 54.38 1boe s GLN 18 Cb 0.00 -3.29 -0.07 0.00 -1.64 0.00 0.00 33.01 28.00 1boe s GLN 18 CO 0.00 -0.16 1.68 -1.12 0.50 0.00 0.00 175.29 176.19 1boe s SER 19 N 0.56 6.61 0.00 6.67 0.01 -1.26 -3.16 113.70 123.14 1boe s SER 19 Ca 0.56 2.42 0.00 0.00 1.31 0.00 0.00 55.95 60.23 1boe s SER 19 Cb -0.31 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.37 1boe s SER 19 CO 0.33 -0.91 0.00 0.00 0.41 0.00 0.00 173.24 173.06 1boe s GLY 21 N 0.00 -0.37 0.60 0.00 0.00 -1.26 -0.04 107.32 106.25 1boe s GLY 21 Ca 0.00 2.02 0.32 0.00 0.00 0.00 0.00 44.72 47.06 1boe s GLY 21 CO 0.00 1.37 1.97 -0.39 0.00 0.00 0.00 173.10 176.04 1boe h VAL 22 N 3.23 0.00 -0.65 1.40 -1.51 0.20 1.32 116.25 120.23 1boe h VAL 22 Ca -0.25 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.22 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 0.23 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.35 1boe n TYR 23 N -2.80 0.90 0.00 5.19 4.01 -1.11 -4.88 117.16 118.47 1boe n TYR 23 Ca -0.02 -0.44 0.00 0.00 -0.16 0.00 0.00 57.90 57.28 1boe n TYR 23 Cb 0.25 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 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 1.38 0.00 -0.95 -0.72 -1.04 0.45 -5.04 114.28 108.37 1boe n THR 24 Ca 0.22 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 1boe n THR 24 Cb 0.56 0.00 0.00 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 0.40 -3.86 -2.82 -0.58 -1.26 -4.96 120.64 107.56 1boe n GLU 25 Ca 0.00 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.42 1boe n GLU 25 Cb 0.00 0.00 -0.12 0.00 -0.57 0.00 0.00 31.44 30.75 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 -2.03 2.30 1.00 3.49 3.52 -1.26 -4.88 118.95 121.09 1boe s ARG 26 Ca 0.00 -2.76 -0.20 0.00 -0.13 0.00 0.00 55.73 52.64 1boe s ARG 26 Cb 0.00 -3.49 -0.13 0.00 -1.56 0.00 0.00 34.95 29.78 1boe s ARG 26 CO 0.00 -1.16 -0.83 0.00 -0.81 0.00 0.00 175.30 172.49 1boe n ALA 28 N -3.05 -1.91 -0.29 0.00 0.00 -0.95 -4.52 120.51 109.78 1boe n ALA 28 Ca -0.01 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1boe n ALA 28 Cb 0.62 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.29 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 0.59 0.00 -0.45 0.00 7.27 -1.26 0.30 117.38 123.83 1boe n GLN 29 Ca 0.09 0.57 0.41 0.00 0.07 0.00 0.00 57.00 58.14 1boe n GLN 29 Cb 0.07 -0.93 0.77 0.00 2.41 0.00 0.00 30.24 32.56 1boe n GLN 29 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 1boe h GLY 30 N 0.00 0.08 -1.76 1.69 0.00 -1.99 -3.39 103.07 97.70 1boe h GLY 30 Ca 0.00 -0.01 -0.50 0.00 0.00 0.00 0.00 47.33 46.82 1boe h GLY 30 CO 0.00 -0.02 0.28 1.08 0.00 0.00 0.00 176.54 177.88 1boe s LEU 31 N -8.27 3.48 0.05 3.11 1.43 0.86 -0.71 118.68 118.63 1boe s LEU 31 Ca -0.05 1.25 -0.22 0.00 -1.03 0.00 0.00 54.13 54.08 1boe s LEU 31 Cb 0.25 -4.23 0.05 0.00 0.03 0.00 0.00 46.19 42.28 1boe s LEU 31 CO 0.84 -0.68 0.52 -0.13 0.23 0.00 0.00 176.35 177.12 1boe s ARG 32 N -4.72 1.03 -0.35 1.70 0.52 -1.20 -4.49 118.95 111.44 1boe s ARG 32 Ca 0.53 -0.23 -0.29 0.00 -0.52 0.00 0.00 55.73 55.22 1boe s ARG 32 Cb -0.11 0.47 -0.01 0.00 0.52 0.00 0.00 34.95 35.83 1boe s ARG 32 CO 0.45 -0.37 1.59 0.00 0.02 0.00 0.00 175.30 176.99 1boe s LEU 34 N 5.94 2.45 0.76 0.00 2.01 0.15 -4.65 118.68 125.34 1boe s LEU 34 Ca 0.70 -0.89 -0.11 0.00 0.01 0.00 0.00 54.13 53.84 1boe s LEU 34 Cb -0.19 -0.44 0.05 0.00 0.01 0.00 0.00 46.19 45.62 1boe s LEU 34 CO 0.32 -0.23 1.08 -2.16 1.01 0.00 0.00 176.35 176.37 1boe s PRO 35 N -3.09 2.41 -0.29 1.29 0.04 -1.26 -0.22 135.00 133.87 1boe s PRO 35 Ca 0.11 0.77 -0.28 0.00 0.04 0.00 0.00 61.00 61.64 1boe s PRO 35 Cb -0.02 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.59 1boe s PRO 35 CO 0.02 -1.42 1.02 1.03 0.04 0.00 0.00 177.00 177.69 1boe s ARG 36 N -5.11 4.10 0.08 4.56 0.52 -1.26 -4.80 118.95 117.04 1boe s ARG 36 Ca 0.60 1.07 0.05 0.00 -0.52 0.00 0.00 55.73 56.93 1boe s ARG 36 Cb -0.14 -3.71 -0.23 0.00 0.52 0.00 0.00 34.95 31.39 1boe s ARG 36 CO 0.55 -0.80 1.14 1.96 0.02 0.00 0.00 175.30 178.17 1boe h GLN 37 N 7.93 0.07 -0.08 3.54 7.50 -1.94 -3.26 115.11 128.87 1boe h GLN 37 Ca -0.21 -0.11 0.00 0.00 0.50 0.00 0.00 58.65 58.83 1boe h GLN 37 Cb 1.07 0.04 0.00 0.00 0.05 0.00 0.00 27.48 28.64 1boe h GLN 37 CO 1.00 0.98 0.00 -3.47 -1.50 0.00 0.00 178.83 175.84 1boe n ASP 38 N -3.35 1.47 0.00 1.46 2.03 -1.26 -4.40 116.55 112.49 1boe n ASP 38 Ca -0.05 -1.56 0.00 0.00 0.52 0.00 0.00 54.79 53.70 1boe n ASP 38 Cb 0.98 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 41.33 1boe n ASP 38 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1boe n GLU 39 N 0.16 0.00 0.00 -0.67 4.07 -1.23 -5.09 120.64 117.89 1boe n GLU 39 Ca 0.18 0.24 0.00 0.00 -0.06 0.00 0.00 57.16 57.51 1boe n GLU 39 Cb 0.33 -0.69 0.00 0.00 -0.06 0.00 0.00 31.44 31.02 1boe n GLU 39 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1boe n GLU 40 N -1.83 0.00 -3.01 5.31 1.02 -1.25 -5.05 120.64 115.83 1boe n GLU 40 Ca 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.00 1boe n GLU 40 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.43 1boe n GLU 40 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1boe n LYS 41 N 0.00 1.00 -1.21 3.49 5.02 -1.26 -4.93 118.16 120.26 1boe n LYS 41 Ca 0.00 -2.88 -0.36 0.00 -2.02 0.00 0.00 58.31 53.05 1boe n LYS 41 Cb 0.00 -1.43 -0.03 0.00 -0.02 0.00 0.00 35.03 33.55 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 0.27 3.38 0.24 1.97 -0.04 -1.26 -4.55 135.00 135.00 1boe n PRO 42 Ca 0.18 -2.06 0.14 0.00 -0.04 0.00 0.00 63.50 61.71 1boe n PRO 42 Cb 0.69 -2.74 0.36 0.00 -0.04 0.00 0.00 33.50 31.77 1boe n PRO 42 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1boe h LEU 43 N 7.34 0.00 -3.62 1.53 3.38 -1.94 -3.20 115.31 118.80 1boe h LEU 43 Ca 0.80 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 58.33 1boe h LEU 43 Cb 0.27 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.69 1boe h LEU 43 CO 1.73 0.00 -0.56 1.57 0.09 0.00 0.00 178.44 181.27 1boe n HIS 44 N -3.08 2.21 -0.03 1.13 -0.00 -1.26 -4.65 115.22 109.54 1boe n HIS 44 Ca 0.03 -2.13 -0.04 0.00 0.46 0.00 0.00 57.72 56.04 1boe n HIS 44 Cb 0.44 -0.44 -0.04 0.00 -0.12 0.00 0.00 29.99 29.84 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 -0.83 1.85 -0.06 1.57 0.00 -1.21 -4.60 120.51 117.22 1boe n ALA 45 Ca 0.41 -0.36 -0.09 0.00 0.00 0.00 0.00 53.44 53.40 1boe n ALA 45 Cb 0.90 0.21 0.05 0.00 0.00 0.00 0.00 19.45 20.61 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 -2.43 4.84 0.00 0.00 -0.00 -1.26 0.11 117.00 118.26 1boe n LEU 46 Ca -0.11 -2.45 -0.01 0.00 -0.00 0.00 0.00 56.01 53.43 1boe n LEU 46 Cb 0.67 -0.77 -0.00 0.00 -0.00 0.00 0.00 43.42 43.32 1boe n LEU 46 CO 0.10 0.84 -0.09 0.18 -0.00 0.00 0.00 177.39 178.42 1boe n LEU 47 N 0.23 0.60 0.11 1.47 4.77 -1.26 0.19 117.00 123.11 1boe n LEU 47 Ca 0.19 0.09 -0.03 0.00 -0.03 0.00 0.00 56.01 56.23 1boe n LEU 47 Cb 0.76 -0.29 0.16 0.00 -2.33 0.00 0.00 43.42 41.72 1boe n LEU 47 CO 0.21 -0.54 0.51 0.45 -1.33 0.00 0.00 177.39 176.69 1boe h HIS 48 N -0.14 0.17 0.00 -1.77 3.86 -1.87 -2.93 115.15 112.46 1boe h HIS 48 Ca 0.00 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 1boe h HIS 48 Cb 0.14 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.58 1boe h HIS 48 CO -0.06 0.69 0.00 0.41 0.86 0.00 0.00 177.93 179.83 1boe n GLY 49 N 0.19 0.00 0.00 2.45 0.00 -1.23 -4.72 105.19 101.89 1boe n GLY 49 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.10 -0.14 1.61 1.74 0.24 -4.42 116.66 115.59 1boe n ARG 50 Ca 0.00 -0.30 0.00 0.00 -0.77 0.00 0.00 57.85 56.78 1boe n ARG 50 Cb 0.00 -0.68 0.00 0.00 -1.02 0.00 0.00 32.46 30.76 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 -0.03 0.01 2.90 -0.13 0.00 0.30 -4.51 105.19 103.73 1boe n GLY 51 Ca 0.00 -1.79 -0.11 0.00 0.00 0.00 0.00 46.02 44.12 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 0.23 0.04 -0.42 1.61 -7.23 0.70 -1.06 120.40 114.26 1boe s VAL 52 Ca 0.00 -0.26 -0.24 0.00 -1.81 0.00 0.00 61.98 59.67 1boe s VAL 52 Cb 0.00 -0.09 0.02 0.00 0.56 0.00 0.00 36.38 36.87 1boe s VAL 52 CO 0.00 -0.14 0.81 0.00 -0.31 0.00 0.00 175.10 175.46 1boe s LEU 54 N 3.30 3.23 0.66 0.00 2.96 -0.98 -1.67 118.68 126.18 1boe s LEU 54 Ca 0.32 -0.32 -0.17 0.00 -0.22 0.00 0.00 54.13 53.73 1boe s LEU 54 Cb -0.12 -1.98 -0.12 0.00 0.50 0.00 0.00 46.19 44.47 1boe s LEU 54 CO 0.21 0.16 -0.05 0.59 -1.32 0.00 0.00 176.35 175.94 1boe n ASN 55 N 0.51 -3.33 -1.80 3.68 4.13 -1.26 -3.21 115.26 113.98 1boe n ASN 55 Ca -0.12 0.55 -0.12 0.00 1.68 0.00 0.00 54.58 56.57 1boe n ASN 55 Cb 0.53 -0.95 0.02 0.00 -1.54 0.00 0.00 39.78 37.84 1boe n ASN 55 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 1boe n GLU 56 N 1.03 1.60 0.00 3.52 0.28 0.12 -4.34 120.64 122.84 1boe n GLU 56 Ca 0.07 -1.15 0.00 0.00 -0.16 0.00 0.00 57.16 55.92 1boe n GLU 56 Cb 0.50 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.91 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 4.76 -1.26 -5.07 118.16 120.72 1boe n LYS 57 Ca 0.22 0.18 0.04 0.00 -2.87 0.00 0.00 58.31 55.89 1boe n LYS 57 Cb 0.56 -0.64 0.26 0.00 -1.84 0.00 0.00 35.03 33.37 1boe n LYS 57 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48