#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 4.32 -1.26 -4.39 117.00 113.79 1boe n LEU 14 Ca 0.00 -0.14 0.00 0.00 -0.02 0.00 0.00 56.01 55.85 1boe n LEU 14 Cb 0.00 -1.11 0.00 0.00 -1.62 0.00 0.00 43.42 40.69 1boe n LEU 14 CO 0.00 -3.22 0.00 0.00 -1.22 0.00 0.00 177.39 172.95 1boe n ALA 15 N -4.71 0.00 -2.70 -1.18 0.00 -1.26 -0.29 120.51 110.37 1boe n ALA 15 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.08 1boe n ALA 15 Cb 0.58 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.96 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 1.09 4.27 0.00 0.00 2.12 -1.26 -3.90 118.70 121.01 1boe s GLU 16 Ca 0.00 0.33 0.00 0.00 0.36 0.00 0.00 54.97 55.66 1boe s GLU 16 Cb 0.00 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.91 1boe s GLU 16 CO 0.00 0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.20 1boe n GLY 17 N 3.54 0.23 3.77 -1.50 0.00 -1.06 -4.99 105.19 105.17 1boe n GLY 17 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.97 4.22 -0.17 1.61 -0.44 -1.25 -4.78 119.66 117.87 1boe s GLN 18 Ca 0.00 1.73 -0.29 0.00 -2.50 0.00 0.00 55.36 54.30 1boe s GLN 18 Cb 0.00 -2.75 -0.00 0.00 -1.64 0.00 0.00 33.01 28.62 1boe s GLN 18 CO 0.00 -0.15 1.08 -1.12 0.50 0.00 0.00 175.29 175.60 1boe s SER 19 N -1.21 7.10 0.00 6.67 0.01 -1.26 -2.88 113.70 122.14 1boe s SER 19 Ca 0.54 1.51 0.00 0.00 1.31 0.00 0.00 55.95 59.31 1boe s SER 19 Cb -0.28 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.40 1boe s SER 19 CO 0.36 -0.62 0.00 0.00 0.41 0.00 0.00 173.24 173.39 1boe s GLY 21 N 0.00 -0.26 0.67 0.00 0.00 -1.26 0.65 107.32 107.12 1boe s GLY 21 Ca 0.00 2.21 0.30 0.00 0.00 0.00 0.00 44.72 47.23 1boe s GLY 21 CO 0.00 1.35 1.92 -0.39 0.00 0.00 0.00 173.10 175.98 1boe h VAL 22 N 3.04 0.00 -0.57 1.40 -1.51 0.35 1.53 116.25 120.48 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 0.67 0.00 0.00 -2.13 0.00 0.00 31.29 30.99 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 -2.89 0.88 0.00 5.19 4.01 -1.18 -4.84 117.16 118.34 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 0.38 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 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 1.13 0.00 -3.12 -0.72 -1.04 0.52 -5.05 114.28 106.00 1boe n THR 24 Ca 0.20 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 62.06 1boe n THR 24 Cb 0.55 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 69.10 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 0.73 -3.37 -2.82 -0.58 -1.26 -4.99 120.64 108.35 1boe n GLU 25 Ca 0.00 -2.31 -0.46 0.00 -0.42 0.00 0.00 57.16 53.97 1boe n GLU 25 Cb 0.00 -0.12 -0.03 0.00 -0.57 0.00 0.00 31.44 30.71 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 -3.89 3.39 1.01 3.49 1.81 -1.26 -4.88 118.95 118.62 1boe s ARG 26 Ca 0.42 -2.34 -0.22 0.00 -1.72 0.00 0.00 55.73 51.87 1boe s ARG 26 Cb -0.03 -4.33 -0.14 0.00 -0.45 0.00 0.00 34.95 30.00 1boe s ARG 26 CO 0.27 -1.28 -1.01 0.00 -0.68 0.00 0.00 175.30 172.60 1boe n ALA 28 N -3.20 -1.75 -1.48 0.00 0.00 0.61 -4.39 120.51 110.30 1boe n ALA 28 Ca -0.01 0.24 -0.58 0.00 0.00 0.00 0.00 53.44 53.09 1boe n ALA 28 Cb 0.66 -0.72 -0.08 0.00 0.00 0.00 0.00 19.45 19.30 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 0.65 0.00 0.00 0.00 7.27 -1.26 0.16 117.38 124.19 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 -1.37 0.00 0.00 2.41 0.00 0.00 30.24 31.31 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 2.98 3.87 1.69 0.00 -1.26 -5.04 105.19 109.83 1boe n GLY 30 Ca 0.23 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 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 3.02 0.01 0.99 1.43 0.41 -2.77 118.68 121.76 1boe s LEU 31 Ca 0.00 1.27 -0.20 0.00 -1.03 0.00 0.00 54.13 54.17 1boe s LEU 31 Cb 0.00 -4.15 0.04 0.00 0.03 0.00 0.00 46.19 42.11 1boe s LEU 31 CO 0.00 -1.20 0.43 -0.13 0.23 0.00 0.00 176.35 175.68 1boe s ARG 32 N -5.27 0.86 -0.29 1.70 0.52 -1.14 -4.53 118.95 110.81 1boe s ARG 32 Ca 0.57 -0.18 -0.29 0.00 -0.52 0.00 0.00 55.73 55.31 1boe s ARG 32 Cb -0.11 0.39 -0.02 0.00 0.52 0.00 0.00 34.95 35.73 1boe s ARG 32 CO 0.53 -0.28 1.64 0.00 0.02 0.00 0.00 175.30 177.21 1boe s LEU 34 N 5.76 2.38 0.03 0.00 2.01 0.78 -4.63 118.68 125.00 1boe s LEU 34 Ca 0.72 -0.78 -0.30 0.00 0.01 0.00 0.00 54.13 53.79 1boe s LEU 34 Cb -0.22 -0.37 -0.04 0.00 0.01 0.00 0.00 46.19 45.57 1boe s LEU 34 CO 0.31 -0.21 1.02 -2.16 1.01 0.00 0.00 176.35 176.32 1boe s PRO 35 N -2.58 4.55 0.66 1.29 0.04 -1.26 0.14 135.00 137.84 1boe s PRO 35 Ca 0.04 1.49 -0.02 0.00 0.04 0.00 0.00 61.00 62.56 1boe s PRO 35 Cb -0.04 -3.43 0.07 0.00 0.04 0.00 0.00 34.50 31.14 1boe s PRO 35 CO 0.01 -0.06 0.93 1.03 0.04 0.00 0.00 177.00 178.95 1boe s ARG 36 N 0.90 2.12 -0.19 4.56 1.81 -1.26 -4.78 118.95 122.10 1boe s ARG 36 Ca 0.53 -0.71 -0.06 0.00 -1.72 0.00 0.00 55.73 53.77 1boe s ARG 36 Cb -0.23 -2.32 0.01 0.00 -0.45 0.00 0.00 34.95 31.95 1boe s ARG 36 CO 0.29 -1.14 0.24 1.04 -0.68 0.00 0.00 175.30 175.04 1boe n GLN 37 N -2.71 -1.22 0.00 3.54 1.13 -1.26 -4.70 117.38 112.16 1boe n GLN 37 Ca 0.10 1.33 0.14 0.00 -1.94 0.00 0.00 57.00 56.63 1boe n GLN 37 Cb 0.60 -3.43 0.82 0.00 0.11 0.00 0.00 30.24 28.34 1boe n GLN 37 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1boe n ASP 38 N -0.28 0.00 0.06 1.08 9.92 -1.26 -3.02 116.55 123.04 1boe n ASP 38 Ca 0.05 -1.06 0.03 0.00 -0.53 0.00 0.00 54.79 53.28 1boe n ASP 38 Cb 0.18 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 40.61 1boe n ASP 38 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 1boe h GLU 39 N 0.00 0.00 0.00 -1.24 4.57 -2.00 -3.47 114.58 112.44 1boe h GLU 39 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1boe h GLU 39 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1boe h GLU 39 CO 0.00 0.23 0.00 0.39 -1.18 0.00 0.00 179.01 178.45 1boe n GLU 40 N -2.86 3.25 -3.06 1.92 1.02 -1.17 -5.07 120.64 114.67 1boe n GLU 40 Ca -0.06 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.91 1boe n GLU 40 Cb 0.76 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 32.17 1boe n GLU 40 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1boe n LYS 41 N 0.00 0.91 -1.21 3.49 3.00 -1.26 -5.00 118.16 118.09 1boe n LYS 41 Ca 0.00 -2.93 -0.35 0.00 -0.00 0.00 0.00 58.31 55.03 1boe n LYS 41 Cb 0.00 -1.45 -0.03 0.00 0.00 0.00 0.00 35.03 33.54 1boe n LYS 41 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1boe n PRO 42 N 0.64 3.39 0.10 1.64 -0.04 -1.26 -4.41 135.00 135.06 1boe n PRO 42 Ca 0.19 -2.03 0.11 0.00 -0.04 0.00 0.00 63.50 61.73 1boe n PRO 42 Cb 0.64 -2.71 -0.00 0.00 -0.04 0.00 0.00 33.50 31.39 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 7.10 0.00 -3.82 1.53 4.07 -1.96 -3.34 115.31 118.89 1boe h LEU 43 Ca 0.79 0.00 -0.55 0.00 0.08 0.00 0.00 57.88 58.20 1boe h LEU 43 Cb 0.32 0.00 -0.32 0.00 1.08 0.00 0.00 40.66 41.74 1boe h LEU 43 CO 1.67 0.04 0.09 1.57 -1.08 0.00 0.00 178.44 180.73 1boe n HIS 44 N -2.70 2.75 0.00 1.13 -0.00 -1.26 -4.54 115.22 110.60 1boe n HIS 44 Ca -0.01 -2.47 0.00 0.00 0.46 0.00 0.00 57.72 55.70 1boe n HIS 44 Cb 0.57 -0.88 0.00 0.00 -0.12 0.00 0.00 29.99 29.57 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 -0.88 2.11 0.42 1.57 0.00 -1.25 -4.69 120.51 117.80 1boe n ALA 45 Ca 0.52 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.95 1boe n ALA 45 Cb 0.88 0.46 0.10 0.00 0.00 0.00 0.00 19.45 20.89 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 2.82 -0.07 0.00 -0.00 -1.26 0.73 117.00 116.75 1boe n LEU 46 Ca 0.00 -1.44 -0.14 0.00 -0.00 0.00 0.00 56.01 54.44 1boe n LEU 46 Cb 0.46 -0.57 -0.05 0.00 -0.00 0.00 0.00 43.42 43.26 1boe n LEU 46 CO 0.00 0.44 -0.96 0.18 -0.00 0.00 0.00 177.39 177.05 1boe n LEU 47 N 0.14 1.29 -0.07 1.47 4.77 -1.26 0.26 117.00 123.60 1boe n LEU 47 Ca 0.10 0.13 -0.16 0.00 -0.03 0.00 0.00 56.01 56.05 1boe n LEU 47 Cb 0.61 -0.40 -0.13 0.00 -2.33 0.00 0.00 43.42 41.17 1boe n LEU 47 CO 0.12 0.35 0.18 0.45 -1.33 0.00 0.00 177.39 177.15 1boe h HIS 48 N -0.40 0.02 0.00 -1.77 3.86 -1.86 -3.11 115.15 111.89 1boe h HIS 48 Ca -0.33 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.86 1boe h HIS 48 Cb 1.32 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.79 1boe h HIS 48 CO -0.03 1.12 0.00 0.41 0.86 0.00 0.00 177.93 180.29 1boe n GLY 49 N 1.58 0.00 0.00 2.45 0.00 -1.22 -4.66 105.19 103.34 1boe n GLY 49 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 0.45 -1.11 1.61 1.74 0.22 -4.33 116.66 115.25 1boe n ARG 50 Ca 0.00 -0.62 -0.11 0.00 -0.77 0.00 0.00 57.85 56.35 1boe n ARG 50 Cb 0.00 -0.76 0.07 0.00 -1.02 0.00 0.00 32.46 30.75 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 -0.12 -0.38 3.21 -0.13 0.00 0.21 -4.57 105.19 103.40 1boe n GLY 51 Ca 0.00 -1.82 -0.18 0.00 0.00 0.00 0.00 46.02 44.02 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 -1.78 1.22 -0.43 1.61 -7.23 0.12 0.11 120.40 114.02 1boe s VAL 52 Ca 0.31 -1.54 -0.18 0.00 -1.81 0.00 0.00 61.98 58.76 1boe s VAL 52 Cb -0.01 -1.33 0.03 0.00 0.56 0.00 0.00 36.38 35.62 1boe s VAL 52 CO 0.21 -0.34 0.46 0.00 -0.31 0.00 0.00 175.10 175.13 1boe s LEU 54 N 2.21 3.48 0.57 0.00 2.01 -0.94 -2.58 118.68 123.44 1boe s LEU 54 Ca 0.13 -0.59 -0.18 0.00 0.01 0.00 0.00 54.13 53.49 1boe s LEU 54 Cb -0.17 -2.05 -0.08 0.00 0.01 0.00 0.00 46.19 43.90 1boe s LEU 54 CO 0.14 -0.34 0.65 -0.46 1.01 0.00 0.00 176.35 177.34 1boe n ASN 55 N -1.31 -0.54 -1.91 2.29 2.04 -1.26 -2.90 115.26 111.68 1boe n ASN 55 Ca -0.02 0.76 -0.15 0.00 -0.44 0.00 0.00 54.58 54.72 1boe n ASN 55 Cb 0.60 -1.23 0.02 0.00 -2.53 0.00 0.00 39.78 36.64 1boe n ASN 55 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 1boe n GLU 56 N -0.31 1.77 0.00 -3.83 0.28 -1.12 -4.41 120.64 113.03 1boe n GLU 56 Ca 0.12 -1.43 0.00 0.00 -0.16 0.00 0.00 57.16 55.70 1boe n GLU 56 Cb 0.47 -1.60 0.00 0.00 1.43 0.00 0.00 31.44 31.74 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 0.62 0.00 0.00 3.44 5.02 -1.26 -5.07 118.16 120.90 1boe n LYS 57 Ca 0.28 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 1boe n LYS 57 Cb 0.57 -0.16 0.00 0.00 -0.02 0.00 0.00 35.03 35.42 1boe n LYS 57 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31