#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 -1.40 0.00 0.00 4.32 -1.26 -4.38 117.00 114.28 1boe n LEU 14 Ca 0.00 -0.44 0.00 0.00 -0.02 0.00 0.00 56.01 55.55 1boe n LEU 14 Cb 0.00 -0.98 0.00 0.00 -1.62 0.00 0.00 43.42 40.82 1boe n LEU 14 CO 0.00 -3.65 0.00 0.00 -1.22 0.00 0.00 177.39 172.52 1boe n ALA 15 N -4.99 0.00 -2.75 -1.18 0.00 -1.26 -0.89 120.51 109.45 1boe n ALA 15 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.15 1boe n ALA 15 Cb 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.89 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 2.69 4.10 0.00 0.00 -6.30 -1.26 -4.16 118.70 113.77 1boe s GLU 16 Ca 0.00 -0.27 0.00 0.00 -2.50 0.00 0.00 54.97 52.20 1boe s GLU 16 Cb 0.00 -3.38 0.00 0.00 0.00 0.00 0.00 34.13 30.75 1boe s GLU 16 CO 0.00 0.24 0.00 0.41 0.02 0.00 0.00 175.26 175.93 1boe n GLY 17 N 3.69 0.49 3.66 -1.50 0.00 -0.36 -4.97 105.19 106.21 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 -0.84 4.21 -0.10 1.61 -0.44 -1.26 -4.73 119.66 118.12 1boe s GLN 18 Ca 0.00 1.97 -0.31 0.00 -2.50 0.00 0.00 55.36 54.52 1boe s GLN 18 Cb 0.00 -3.84 -0.09 0.00 -1.64 0.00 0.00 33.01 27.44 1boe s GLN 18 CO 0.00 -0.75 2.04 0.43 0.50 0.00 0.00 175.29 177.51 1boe n SER 19 N 6.66 3.56 0.00 6.67 7.64 -1.26 -3.43 113.62 133.46 1boe n SER 19 Ca 0.15 0.68 0.00 0.00 1.01 0.00 0.00 58.87 60.71 1boe n SER 19 Cb 0.44 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 1boe n SER 19 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1boe s GLY 21 N 0.00 -0.05 0.64 0.00 0.00 -1.26 0.26 107.32 106.91 1boe s GLY 21 Ca 0.00 2.53 0.28 0.00 0.00 0.00 0.00 44.72 47.53 1boe s GLY 21 CO 0.00 1.08 1.84 -0.39 0.00 0.00 0.00 173.10 175.63 1boe h VAL 22 N 2.24 0.14 -0.32 1.40 -1.51 0.43 2.23 116.25 120.87 1boe h VAL 22 Ca -0.12 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 1boe h VAL 22 Cb 1.18 0.60 0.00 0.00 -2.13 0.00 0.00 31.29 30.93 1boe h VAL 22 CO 0.25 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.37 1boe n TYR 23 N -3.18 0.42 0.00 5.19 4.02 -1.24 -4.81 117.16 117.56 1boe n TYR 23 Ca 0.02 -0.21 0.00 0.00 -0.01 0.00 0.00 57.90 57.70 1boe n TYR 23 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.87 1boe n TYR 23 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1boe n THR 24 N 0.58 0.00 -3.23 -0.72 -1.04 0.75 -5.03 114.28 105.59 1boe n THR 24 Ca 0.14 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.13 1boe n THR 24 Cb 0.34 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.86 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 1.15 -3.45 -2.82 -0.58 -1.26 -4.98 120.64 108.70 1boe n GLU 25 Ca 0.00 -0.37 -0.44 0.00 -0.42 0.00 0.00 57.16 55.93 1boe n GLU 25 Cb 0.00 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.83 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 -2.28 3.33 1.01 3.49 3.00 -1.26 -4.80 118.95 121.44 1boe s ARG 26 Ca 0.05 -2.53 -0.21 0.00 0.00 0.00 0.00 55.73 53.04 1boe s ARG 26 Cb -0.00 -4.23 -0.12 0.00 0.00 0.00 0.00 34.95 30.60 1boe s ARG 26 CO 0.03 -1.26 -0.90 0.00 0.00 0.00 0.00 175.30 173.17 1boe n ALA 28 N -3.24 -1.79 -1.46 0.00 0.00 -0.07 -4.36 120.51 109.60 1boe n ALA 28 Ca -0.01 0.24 -0.57 0.00 0.00 0.00 0.00 53.44 53.10 1boe n ALA 28 Cb 0.65 -0.71 -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 0.58 0.00 0.00 0.00 7.27 -1.26 0.17 117.38 124.14 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 0.04 -1.38 0.00 0.00 2.41 0.00 0.00 30.24 31.32 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 2.16 3.08 3.85 1.69 0.00 -1.26 -5.03 105.19 109.68 1boe n GLY 30 Ca 0.22 -0.74 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 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 3.48 -0.08 0.99 1.43 0.44 -2.86 118.68 122.09 1boe s LEU 31 Ca 0.00 1.52 -0.20 0.00 -1.03 0.00 0.00 54.13 54.42 1boe s LEU 31 Cb 0.00 -4.50 0.04 0.00 0.03 0.00 0.00 46.19 41.77 1boe s LEU 31 CO 0.00 -0.70 0.46 -0.13 0.23 0.00 0.00 176.35 176.21 1boe s ARG 32 N -4.48 0.74 -0.45 1.70 0.52 -1.22 -4.38 118.95 111.38 1boe s ARG 32 Ca 0.58 0.20 -0.27 0.00 -0.52 0.00 0.00 55.73 55.71 1boe s ARG 32 Cb -0.10 0.34 -0.05 0.00 0.52 0.00 0.00 34.95 35.66 1boe s ARG 32 CO 0.40 -0.18 2.18 0.00 0.02 0.00 0.00 175.30 177.71 1boe s LEU 34 N 10.14 2.37 0.35 0.00 2.01 0.16 -4.39 118.68 129.33 1boe s LEU 34 Ca 0.89 -0.79 -0.26 0.00 0.01 0.00 0.00 54.13 53.98 1boe s LEU 34 Cb -0.20 -1.02 -0.09 0.00 0.01 0.00 0.00 46.19 44.89 1boe s LEU 34 CO 0.27 0.08 1.01 -2.16 1.01 0.00 0.00 176.35 176.57 1boe s PRO 35 N -2.35 4.40 0.56 1.29 0.04 -1.26 -0.64 135.00 137.03 1boe s PRO 35 Ca 0.14 1.48 0.34 0.00 0.04 0.00 0.00 61.00 63.00 1boe s PRO 35 Cb -0.08 -2.73 1.60 0.00 0.04 0.00 0.00 34.50 33.32 1boe s PRO 35 CO 0.07 0.07 2.08 0.00 0.04 0.00 0.00 177.00 179.26 1boe h ARG 36 N 2.94 0.00 -5.66 4.56 3.08 -1.94 -3.47 114.38 113.89 1boe h ARG 36 Ca -0.47 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.26 1boe h ARG 36 Cb 1.20 0.00 0.16 0.00 0.08 0.00 0.00 29.97 31.42 1boe h ARG 36 CO 0.64 0.05 -0.83 1.04 -1.07 0.00 0.00 179.97 179.80 1boe n GLN 37 N -3.24 -4.13 0.00 0.04 6.02 -1.26 -4.97 117.38 109.84 1boe n GLN 37 Ca -0.01 0.80 0.00 0.00 -0.01 0.00 0.00 57.00 57.78 1boe n GLN 37 Cb 0.25 -5.64 0.00 0.00 1.02 0.00 0.00 30.24 25.86 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 -3.13 0.00 -0.02 1.08 8.00 -1.26 -5.03 116.55 116.19 1boe n ASP 38 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1boe n ASP 38 Cb 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.74 1boe n ASP 38 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1boe n GLU 39 N 0.00 1.56 -1.08 -1.24 0.00 -1.26 -4.69 120.64 113.93 1boe n GLU 39 Ca 0.00 -0.37 -0.23 0.00 0.00 0.00 0.00 57.16 56.56 1boe n GLU 39 Cb 0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 31.44 30.49 1boe n GLU 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1boe n GLU 40 N -0.30 2.65 -3.76 5.31 1.02 -1.26 -4.67 120.64 119.63 1boe n GLU 40 Ca 0.00 -1.50 -0.29 0.00 -0.02 0.00 0.00 57.16 55.36 1boe n GLU 40 Cb 0.02 -2.35 0.01 0.00 -0.02 0.00 0.00 31.44 29.10 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 3.08 -1.13 -1.76 3.49 5.02 -1.26 -4.89 118.16 120.72 1boe n LYS 41 Ca 0.57 0.62 -0.30 0.00 -2.02 0.00 0.00 58.31 57.17 1boe n LYS 41 Cb 0.55 -3.06 0.19 0.00 -0.02 0.00 0.00 35.03 32.69 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 -5.53 0.36 -1.59 1.97 0.04 -1.26 -3.73 135.00 125.26 1boe s PRO 42 Ca 0.21 -0.30 0.00 0.00 0.04 0.00 0.00 61.00 60.95 1boe s PRO 42 Cb -0.10 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1boe s PRO 42 CO 0.89 -2.62 0.00 1.28 0.04 0.00 0.00 177.00 176.60 1boe n LEU 43 N -3.94 -1.06 -2.07 -3.56 4.77 -1.26 -4.57 117.00 105.32 1boe n LEU 43 Ca 0.14 0.37 -0.02 0.00 -0.03 0.00 0.00 56.01 56.48 1boe n LEU 43 Cb 0.59 -2.27 0.02 0.00 -2.33 0.00 0.00 43.42 39.43 1boe n LEU 43 CO 0.47 -0.82 0.43 1.57 -1.33 0.00 0.00 177.39 177.71 1boe n HIS 44 N -2.02 -0.52 0.00 -1.77 -0.00 -1.25 -5.02 115.22 104.65 1boe n HIS 44 Ca -0.15 -0.54 0.00 0.00 0.46 0.00 0.00 57.72 57.49 1boe n HIS 44 Cb 0.51 0.93 0.00 0.00 -0.12 0.00 0.00 29.99 31.31 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 -0.42 2.69 1.42 1.57 0.00 -1.24 -4.80 120.51 119.72 1boe n ALA 45 Ca -0.11 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.41 1boe n ALA 45 Cb 0.61 0.07 0.47 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 -2.28 0.00 -0.08 0.00 -0.00 -1.26 0.39 117.00 113.77 1boe n LEU 46 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 55.89 1boe n LEU 46 Cb 0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.42 1boe n LEU 46 CO 0.00 0.00 -0.21 -0.07 -0.00 0.00 0.00 177.39 177.11 1boe h LEU 47 N 0.00 0.00 -0.01 1.47 3.38 -1.87 2.58 115.31 120.85 1boe h LEU 47 Ca 0.00 -0.38 -0.07 0.00 0.09 0.00 0.00 57.88 57.52 1boe h LEU 47 Cb 0.00 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.76 1boe h LEU 47 CO 0.00 1.03 -0.27 0.45 0.09 0.00 0.00 178.44 179.74 1boe h HIS 48 N -1.00 0.30 0.00 1.13 3.86 -1.90 -3.29 115.15 114.24 1boe h HIS 48 Ca -0.13 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 1boe h HIS 48 Cb 0.81 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.24 1boe h HIS 48 CO 0.03 0.93 0.00 0.41 0.86 0.00 0.00 177.93 180.16 1boe n GLY 49 N 0.96 -0.15 0.45 2.45 0.00 -1.14 -4.83 105.19 102.93 1boe n GLY 49 Ca -0.09 0.04 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 -0.34 1.61 1.74 0.16 -4.66 116.66 115.18 1boe n ARG 50 Ca 0.00 -0.72 0.00 0.00 -0.77 0.00 0.00 57.85 56.36 1boe n ARG 50 Cb 0.00 -0.38 0.00 0.00 -1.02 0.00 0.00 32.46 31.06 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 0.00 0.16 2.80 -0.13 0.00 0.72 -4.36 105.19 104.39 1boe n GLY 51 Ca 0.00 -1.85 -0.14 0.00 0.00 0.00 0.00 46.02 44.03 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 -0.00 -0.03 -0.46 1.61 -7.23 0.19 -0.05 120.40 114.43 1boe s VAL 52 Ca 0.00 0.14 -0.28 0.00 -1.81 0.00 0.00 61.98 60.04 1boe s VAL 52 Cb 0.00 -0.07 0.03 0.00 0.56 0.00 0.00 36.38 36.90 1boe s VAL 52 CO 0.00 0.07 1.05 0.00 -0.31 0.00 0.00 175.10 175.90 1boe s LEU 54 N 4.11 3.23 0.61 0.00 2.96 -1.04 -1.22 118.68 127.33 1boe s LEU 54 Ca 0.43 -0.35 -0.18 0.00 -0.22 0.00 0.00 54.13 53.82 1boe s LEU 54 Cb -0.09 -1.96 -0.11 0.00 0.50 0.00 0.00 46.19 44.54 1boe s LEU 54 CO 0.28 0.14 0.14 0.59 -1.32 0.00 0.00 176.35 176.18 1boe n ASN 55 N 0.34 -2.59 -1.76 3.68 4.13 -1.26 -3.40 115.26 114.40 1boe n ASN 55 Ca -0.11 0.63 -0.11 0.00 1.68 0.00 0.00 54.58 56.66 1boe n ASN 55 Cb 0.53 -1.01 0.03 0.00 -1.54 0.00 0.00 39.78 37.79 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 0.67 1.56 0.00 3.52 -0.00 -1.13 -4.37 120.64 120.89 1boe n GLU 56 Ca 0.09 -1.09 0.00 0.00 -0.00 0.00 0.00 57.16 56.15 1boe n GLU 56 Cb 0.49 -1.43 0.00 0.00 -0.00 0.00 0.00 31.44 30.50 1boe n GLU 56 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1boe n LYS 57 N 0.65 0.00 0.00 3.44 5.02 -1.26 -5.09 118.16 120.92 1boe n LYS 57 Ca 0.21 0.04 0.01 0.00 -2.02 0.00 0.00 58.31 56.55 1boe n LYS 57 Cb 0.57 -0.30 0.07 0.00 -0.02 0.00 0.00 35.03 35.35 1boe n LYS 57 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31