#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 -1.08 0.00 0.00 4.77 -1.26 -4.55 117.00 114.88 1boe n LEU 14 Ca 0.00 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 1boe n LEU 14 Cb 0.00 -0.92 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1boe n LEU 14 CO 0.00 -3.79 0.00 0.00 -1.33 0.00 0.00 177.39 172.27 1boe n ALA 15 N -5.03 0.00 -2.95 -1.18 0.00 -1.26 -2.54 120.51 107.54 1boe n ALA 15 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.19 1boe n ALA 15 Cb 0.49 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.81 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 3.30 3.58 0.00 0.00 2.12 -1.26 -4.38 118.70 122.05 1boe s GLU 16 Ca 0.00 -0.55 0.00 0.00 0.36 0.00 0.00 54.97 54.78 1boe s GLU 16 Cb 0.00 -2.85 0.00 0.00 0.26 0.00 0.00 34.13 31.54 1boe s GLU 16 CO 0.00 0.26 0.00 0.41 -0.54 0.00 0.00 175.26 175.39 1boe n GLY 17 N 3.45 1.79 3.72 -1.50 0.00 -0.60 -4.96 105.19 107.09 1boe n GLY 17 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.80 4.24 -0.05 1.61 -0.44 -1.26 -4.68 119.66 118.27 1boe s GLN 18 Ca 0.00 2.29 -0.30 0.00 -2.50 0.00 0.00 55.36 54.86 1boe s GLN 18 Cb 0.00 -3.20 -0.06 0.00 -1.64 0.00 0.00 33.01 28.11 1boe s GLN 18 CO 0.00 -0.58 1.73 -1.12 0.50 0.00 0.00 175.29 175.82 1boe s SER 19 N 1.21 6.57 0.00 6.67 0.01 -1.26 -2.98 113.70 123.92 1boe s SER 19 Ca 0.69 2.27 0.00 0.00 1.31 0.00 0.00 55.95 60.22 1boe s SER 19 Cb -0.42 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.28 1boe s SER 19 CO 0.31 -1.00 0.00 0.00 0.41 0.00 0.00 173.24 172.96 1boe s GLY 21 N 0.00 -0.25 0.65 0.00 0.00 -1.26 0.03 107.32 106.49 1boe s GLY 21 Ca 0.00 2.18 0.30 0.00 0.00 0.00 0.00 44.72 47.21 1boe s GLY 21 CO 0.00 1.26 1.94 -0.39 0.00 0.00 0.00 173.10 175.91 1boe h VAL 22 N 2.88 0.09 -0.50 1.40 -1.51 0.23 2.04 116.25 120.88 1boe h VAL 22 Ca -0.22 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.25 1boe h VAL 22 Cb 1.17 0.68 0.00 0.00 -2.13 0.00 0.00 31.29 31.01 1boe h VAL 22 CO 0.26 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.38 1boe n TYR 23 N -3.10 0.72 0.00 5.19 4.01 -1.21 -4.85 117.16 117.92 1boe n TYR 23 Ca -0.00 -0.35 0.00 0.00 -0.16 0.00 0.00 57.90 57.39 1boe n TYR 23 Cb 0.41 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 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 0.96 0.00 -1.72 -0.72 -1.04 0.69 -5.04 114.28 107.41 1boe n THR 24 Ca 0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 1boe n THR 24 Cb 0.45 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.96 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 0.47 -3.65 -2.82 -0.58 -1.26 -4.96 120.64 107.83 1boe n GLU 25 Ca 0.00 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.36 1boe n GLU 25 Cb 0.00 0.00 -0.08 0.00 -0.57 0.00 0.00 31.44 30.79 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 -2.40 2.81 1.02 3.49 3.52 -1.26 -4.89 118.95 121.24 1boe s ARG 26 Ca 0.00 -2.64 -0.21 0.00 -0.13 0.00 0.00 55.73 52.75 1boe s ARG 26 Cb 0.00 -3.86 -0.08 0.00 -1.56 0.00 0.00 34.95 29.45 1boe s ARG 26 CO 0.00 -1.20 -0.74 0.00 -0.81 0.00 0.00 175.30 172.55 1boe n ALA 28 N -3.46 -1.89 -0.32 0.00 0.00 -1.05 -4.50 120.51 109.28 1boe n ALA 28 Ca -0.00 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1boe n ALA 28 Cb 0.65 -0.77 0.00 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 0.59 0.00 -0.31 0.00 7.27 -1.26 0.29 117.38 123.96 1boe n GLN 29 Ca 0.09 0.43 0.35 0.00 0.07 0.00 0.00 57.00 57.94 1boe n GLN 29 Cb 0.07 -0.72 0.74 0.00 2.41 0.00 0.00 30.24 32.73 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 0.00 -1.42 1.69 0.00 -1.98 -3.40 103.07 97.96 1boe h GLY 30 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 1boe h GLY 30 CO 0.00 0.00 0.39 1.08 0.00 0.00 0.00 176.54 178.01 1boe s LEU 31 N -8.10 3.26 0.06 3.11 1.43 0.85 -1.31 118.68 117.99 1boe s LEU 31 Ca -0.05 1.37 -0.22 0.00 -1.03 0.00 0.00 54.13 54.19 1boe s LEU 31 Cb 0.22 -4.40 0.05 0.00 0.03 0.00 0.00 46.19 42.09 1boe s LEU 31 CO 0.77 -0.85 0.53 -0.13 0.23 0.00 0.00 176.35 176.90 1boe s ARG 32 N -5.14 1.07 -0.23 1.70 0.52 -1.21 -4.54 118.95 111.12 1boe s ARG 32 Ca 0.54 -0.27 -0.29 0.00 -0.52 0.00 0.00 55.73 55.19 1boe s ARG 32 Cb -0.11 0.49 -0.02 0.00 0.52 0.00 0.00 34.95 35.83 1boe s ARG 32 CO 0.53 -0.40 1.51 0.00 0.02 0.00 0.00 175.30 176.96 1boe s LEU 34 N 4.82 2.36 -0.64 0.00 2.01 0.23 -4.64 118.68 122.82 1boe s LEU 34 Ca 0.66 -0.74 -0.27 0.00 0.01 0.00 0.00 54.13 53.79 1boe s LEU 34 Cb -0.23 -0.16 0.03 0.00 0.01 0.00 0.00 46.19 45.84 1boe s LEU 34 CO 0.27 -0.29 1.20 -2.16 1.01 0.00 0.00 176.35 176.38 1boe s PRO 35 N -2.48 3.37 0.00 1.29 0.04 -1.26 0.10 135.00 136.05 1boe s PRO 35 Ca -0.01 -0.01 0.00 0.00 0.04 0.00 0.00 61.00 61.03 1boe s PRO 35 Cb -0.04 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.41 1boe s PRO 35 CO -0.01 -1.86 0.00 0.54 0.04 0.00 0.00 177.00 175.71 1boe n ARG 36 N 8.72 0.00 -1.23 4.56 5.12 -1.26 -4.70 116.66 127.87 1boe n ARG 36 Ca 0.06 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.75 1boe n ARG 36 Cb 0.49 0.00 -0.01 0.00 -1.16 0.00 0.00 32.46 31.78 1boe n ARG 36 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1boe n GLN 37 N 0.00 2.16 -0.93 5.56 6.02 -1.26 -4.73 117.38 124.20 1boe n GLN 37 Ca 0.00 -2.07 -0.15 0.00 -0.01 0.00 0.00 57.00 54.77 1boe n GLN 37 Cb 0.00 -1.93 -0.13 0.00 1.02 0.00 0.00 30.24 29.21 1boe n GLN 37 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1boe n ASP 38 N 0.55 5.18 0.03 1.08 8.00 -1.26 -4.53 116.55 125.60 1boe n ASP 38 Ca 0.42 -2.38 0.11 0.00 0.71 0.00 0.00 54.79 53.64 1boe n ASP 38 Cb 0.57 -1.28 0.55 0.00 -0.02 0.00 0.00 41.12 40.94 1boe n ASP 38 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1boe h GLU 39 N 3.75 0.27 -5.94 -1.24 4.81 -1.99 -1.85 114.58 112.38 1boe h GLU 39 Ca 0.28 -0.02 -0.64 0.00 -0.13 0.00 0.00 59.36 58.86 1boe h GLU 39 Cb 1.12 -0.06 -0.10 0.00 0.63 0.00 0.00 28.75 30.35 1boe h GLU 39 CO 0.53 0.18 1.76 -2.00 -0.73 0.00 0.00 179.01 178.75 1boe s GLU 40 N -5.27 3.76 -0.42 1.92 2.56 -1.26 -4.22 118.70 115.77 1boe s GLU 40 Ca -0.07 -1.53 -0.00 0.00 0.00 0.00 0.00 54.97 53.38 1boe s GLU 40 Cb 0.19 -5.41 0.00 0.00 2.00 0.00 0.00 34.13 30.91 1boe s GLU 40 CO 0.72 -2.21 0.40 1.63 -0.56 0.00 0.00 175.26 175.25 1boe n LYS 41 N 8.54 -0.77 -1.84 4.30 5.02 -1.25 -4.96 118.16 127.21 1boe n LYS 41 Ca 0.39 1.08 -0.30 0.00 -2.02 0.00 0.00 58.31 57.46 1boe n LYS 41 Cb 0.49 -3.94 0.21 0.00 -0.02 0.00 0.00 35.03 31.77 1boe n LYS 41 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1boe s PRO 42 N -2.98 0.13 -0.88 1.97 0.04 -0.70 -4.01 135.00 128.58 1boe s PRO 42 Ca 0.00 -0.49 0.00 0.00 0.04 0.00 0.00 61.00 60.55 1boe s PRO 42 Cb -0.00 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.74 1boe s PRO 42 CO 0.43 -2.74 0.00 1.28 0.04 0.00 0.00 177.00 176.01 1boe n LEU 43 N -3.98 -0.05 -2.08 -3.56 7.99 -1.26 -4.61 117.00 109.45 1boe n LEU 43 Ca 0.17 0.21 -0.01 0.00 -0.01 0.00 0.00 56.01 56.36 1boe n LEU 43 Cb 0.59 -2.56 0.06 0.00 -0.11 0.00 0.00 43.42 41.41 1boe n LEU 43 CO 0.43 -0.99 0.44 1.57 -1.51 0.00 0.00 177.39 177.33 1boe n HIS 44 N -2.20 -1.02 -0.01 -1.77 -0.00 -1.26 -5.00 115.22 103.96 1boe n HIS 44 Ca -0.08 -0.84 -0.02 0.00 0.46 0.00 0.00 57.72 57.24 1boe n HIS 44 Cb 0.55 1.05 -0.01 0.00 -0.12 0.00 0.00 29.99 31.47 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 -0.76 2.29 1.27 1.57 0.00 -1.26 -4.63 120.51 119.00 1boe n ALA 45 Ca -0.09 -0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.34 1boe n ALA 45 Cb 0.69 0.46 0.43 0.00 0.00 0.00 0.00 19.45 21.03 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 -2.75 0.00 -0.03 0.00 -0.00 -1.26 0.73 117.00 113.69 1boe n LEU 46 Ca -0.04 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.96 1boe n LEU 46 Cb 0.53 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.95 1boe n LEU 46 CO 0.01 0.00 -0.12 -0.07 -0.00 0.00 0.00 177.39 177.21 1boe h LEU 47 N 0.00 0.00 0.17 1.47 3.38 -1.85 1.63 115.31 120.11 1boe h LEU 47 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 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 0.32 -0.08 0.45 0.09 0.00 0.00 178.44 179.22 1boe h HIS 48 N -0.47 -0.22 0.00 1.13 3.86 -1.85 -3.22 115.15 114.39 1boe h HIS 48 Ca 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1boe h HIS 48 Cb 0.18 0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.72 1boe h HIS 48 CO -0.08 -0.12 0.00 0.41 0.86 0.00 0.00 177.93 179.00 1boe n GLY 49 N -1.15 0.00 0.01 2.45 0.00 -1.14 -4.72 105.19 100.63 1boe n GLY 49 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 0.69 -0.08 1.61 5.12 0.22 -4.47 116.66 119.76 1boe n ARG 50 Ca 0.00 -0.74 0.00 0.00 -1.93 0.00 0.00 57.85 55.18 1boe n ARG 50 Cb 0.00 -0.62 0.00 0.00 -1.16 0.00 0.00 32.46 30.68 1boe n ARG 50 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1boe n GLY 51 N -0.12 -0.24 2.88 -0.13 0.00 0.10 -4.48 105.19 103.21 1boe n GLY 51 Ca 0.00 -1.74 -0.13 0.00 0.00 0.00 0.00 46.02 44.15 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 0.12 0.10 -0.51 1.61 -7.23 0.28 -0.83 120.40 113.94 1boe s VAL 52 Ca 0.00 -0.04 -0.27 0.00 -1.81 0.00 0.00 61.98 59.86 1boe s VAL 52 Cb 0.00 -0.10 0.03 0.00 0.56 0.00 0.00 36.38 36.87 1boe s VAL 52 CO 0.00 0.04 1.06 0.00 -0.31 0.00 0.00 175.10 175.88 1boe s LEU 54 N 4.30 3.36 0.71 0.00 1.98 -0.92 -1.56 118.68 126.55 1boe s LEU 54 Ca 0.40 -0.13 -0.18 0.00 -2.89 0.00 0.00 54.13 51.34 1boe s LEU 54 Cb -0.09 -2.00 -0.15 0.00 0.66 0.00 0.00 46.19 44.62 1boe s LEU 54 CO 0.26 0.24 -0.41 0.59 -1.89 0.00 0.00 176.35 175.15 1boe n ASN 55 N 1.14 -4.65 -1.78 3.68 5.03 -1.26 -3.35 115.26 114.07 1boe n ASN 55 Ca -0.14 0.46 -0.11 0.00 0.87 0.00 0.00 54.58 55.66 1boe n ASN 55 Cb 0.52 -0.81 0.02 0.00 -1.02 0.00 0.00 39.78 38.49 1boe n ASN 55 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 1boe n GLU 56 N 1.91 1.56 -0.02 3.52 0.28 -0.43 -4.25 120.64 123.21 1boe n GLU 56 Ca 0.04 -1.07 -0.03 0.00 -0.16 0.00 0.00 57.16 55.94 1boe n GLU 56 Cb 0.51 -1.43 -0.01 0.00 1.43 0.00 0.00 31.44 31.94 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 0.74 0.15 0.00 3.44 5.02 -1.26 -5.07 118.16 121.18 1boe n LYS 57 Ca 0.21 0.06 0.05 0.00 -2.02 0.00 0.00 58.31 56.61 1boe n LYS 57 Cb 0.55 -0.75 0.33 0.00 -0.02 0.00 0.00 35.03 35.14 1boe n LYS 57 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33