#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqc s PRO 7 N 0.00 4.19 0.26 1.20 0.02 -1.26 -5.03 135.00 134.38 2qqc s PRO 7 Ca 0.00 2.45 0.09 0.00 0.02 0.00 0.00 61.00 63.56 2qqc s PRO 7 Cb 0.00 -3.03 -0.04 0.00 0.02 0.00 0.00 34.50 31.45 2qqc s PRO 7 CO 0.00 -0.48 0.04 -0.51 -0.33 0.00 0.00 177.00 175.72 2qqc s LEU 8 N -1.19 3.34 -1.35 -5.54 1.43 -1.26 -4.57 118.68 109.55 2qqc s LEU 8 Ca 0.57 -0.54 -0.00 0.00 -1.03 0.00 0.00 54.13 53.12 2qqc s LEU 8 Cb -0.45 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 43.90 2qqc s LEU 8 CO 0.52 -0.00 0.02 1.41 0.23 0.00 0.00 176.35 178.54 2qqc n HIS 9 N -0.90 -1.28 -0.30 0.29 8.25 -1.26 -4.85 115.22 115.16 2qqc n HIS 9 Ca -0.07 0.02 0.01 0.00 -0.26 0.00 0.00 57.72 57.42 2qqc n HIS 9 Cb 0.58 -3.26 0.19 0.00 1.12 0.00 0.00 29.99 28.63 2qqc n HIS 9 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qqc h ALA 10 N 1.00 1.41 0.00 -1.41 0.00 -1.98 -2.09 119.26 116.19 2qqc h ALA 10 Ca -0.38 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2qqc h ALA 10 Cb 1.28 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2qqc h ALA 10 CO 0.44 0.52 0.00 0.66 0.00 0.00 0.00 179.25 180.88 2qqc n TYR 11 N -4.43 0.80 1.32 0.00 4.02 -1.26 -1.62 117.16 115.99 2qqc n TYR 11 Ca 0.11 0.34 0.13 0.00 -0.01 0.00 0.00 57.90 58.48 2qqc n TYR 11 Cb 0.07 -1.05 0.45 0.00 -0.02 0.00 0.00 39.34 38.79 2qqc n TYR 11 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2qqc n PHE 12 N -2.26 0.00 -3.03 -0.72 3.72 -0.79 -4.88 117.46 109.51 2qqc n PHE 12 Ca 0.01 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.40 2qqc n PHE 12 Cb 0.17 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 2qqc n PHE 12 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2qqc n LYS 13 N -0.63 0.99 -2.42 -1.08 5.02 -0.64 -5.08 118.16 114.33 2qqc n LYS 13 Ca 0.14 -0.24 -0.38 0.00 -2.02 0.00 0.00 58.31 55.80 2qqc n LYS 13 Cb 0.33 -0.02 -0.03 0.00 -0.02 0.00 0.00 35.03 35.29 2qqc n LYS 13 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qqc s LEU 14 N 0.00 4.29 0.46 -0.35 1.02 -1.26 -4.98 118.68 117.86 2qqc s LEU 14 Ca 0.05 2.24 -0.24 0.00 0.02 0.00 0.00 54.13 56.20 2qqc s LEU 14 Cb -0.00 -3.94 -0.09 0.00 0.02 0.00 0.00 46.19 42.18 2qqc s LEU 14 CO 0.03 -0.46 1.19 -2.65 0.02 0.00 0.00 176.35 174.47 2qqc n PRO 15 N 0.38 1.64 -0.01 1.29 -0.02 -1.26 -4.92 135.00 132.10 2qqc n PRO 15 Ca 0.03 0.59 0.01 0.00 -2.02 0.00 0.00 63.50 62.11 2qqc n PRO 15 Cb 0.47 -2.31 0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2qqc n PRO 15 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2qqc n ASN 16 N -0.01 1.94 -4.13 2.55 0.23 -1.26 -5.03 115.26 109.55 2qqc n ASN 16 Ca 0.09 -2.09 -0.11 0.00 -0.53 0.00 0.00 54.58 51.93 2qqc n ASN 16 Cb 0.41 -0.05 -0.10 0.00 -2.08 0.00 0.00 39.78 37.95 2qqc n ASN 16 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2qqc s THR 17 N -1.18 0.60 -0.01 5.53 -4.23 -1.26 -5.15 115.64 109.94 2qqc s THR 17 Ca 0.04 -1.63 0.02 0.00 -1.18 0.00 0.00 61.69 58.94 2qqc s THR 17 Cb 0.03 -1.30 0.00 0.00 1.34 0.00 0.00 72.50 72.58 2qqc s THR 17 CO 0.00 -0.71 -0.05 -0.69 -0.54 0.00 0.00 174.62 172.63 2qqc s VAL 18 N -2.87 0.43 -0.05 2.29 1.01 -1.26 -5.15 120.40 114.81 2qqc s VAL 18 Ca 0.04 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2qqc s VAL 18 Cb 0.00 -0.38 0.02 0.00 0.00 0.00 0.00 36.38 36.02 2qqc s VAL 18 CO -0.03 0.13 -0.07 -0.44 0.00 0.00 0.00 175.10 174.69 2qqc s SER 19 N 0.04 1.14 -0.14 3.32 0.01 -1.26 -5.12 113.70 111.68 2qqc s SER 19 Ca 0.00 -0.17 -0.15 0.00 1.31 0.00 0.00 55.95 56.93 2qqc s SER 19 Cb -0.04 -0.54 -0.04 0.00 0.21 0.00 0.00 66.02 65.61 2qqc s SER 19 CO -0.00 -0.03 0.36 -0.76 0.41 0.00 0.00 173.24 173.23 2qqc s LEU 20 N 0.81 4.26 0.12 2.44 1.43 -1.26 -5.07 118.68 121.41 2qqc s LEU 20 Ca -0.12 0.63 0.01 0.00 -1.03 0.00 0.00 54.13 53.61 2qqc s LEU 20 Cb -0.15 -2.50 -0.04 0.00 0.03 0.00 0.00 46.19 43.53 2qqc s LEU 20 CO 0.01 0.07 -0.00 0.68 0.23 0.00 0.00 176.35 177.33 2qqc s VAL 21 N 0.49 0.45 -0.12 -1.59 -7.23 -1.26 -5.17 120.40 105.97 2qqc s VAL 21 Ca 0.20 -1.92 -0.30 0.00 -1.81 0.00 0.00 61.98 58.15 2qqc s VAL 21 Cb -0.14 -1.90 0.09 0.00 0.56 0.00 0.00 36.38 35.00 2qqc s VAL 21 CO 0.06 -0.65 0.81 0.00 -0.31 0.00 0.00 175.10 175.01 2qqc s ALA 22 N -3.80 -1.84 0.17 1.32 0.00 -1.26 -5.08 121.76 111.27 2qqc s ALA 22 Ca 0.18 1.51 -0.24 0.00 0.00 0.00 0.00 51.96 53.41 2qqc s ALA 22 Cb 0.07 -0.45 0.06 0.00 0.00 0.00 0.00 23.12 22.80 2qqc s ALA 22 CO -0.01 -0.34 0.96 0.20 0.00 0.00 0.00 175.76 176.57 2qqc s GLY 23 N -0.91 -0.18 0.16 0.00 0.00 -1.26 -4.11 107.32 101.02 2qqc s GLY 23 Ca -0.06 0.04 -0.11 0.00 0.00 0.00 0.00 44.72 44.58 2qqc s GLY 23 CO 0.05 0.22 0.34 -1.35 0.00 0.00 0.00 173.10 172.37 2qqc s SER 24 N -2.99 -0.04 -0.18 1.64 1.04 -1.26 -4.85 113.70 107.05 2qqc s SER 24 Ca 0.13 -0.72 -0.35 0.00 0.48 0.00 0.00 55.95 55.49 2qqc s SER 24 Cb -0.02 0.47 0.14 0.00 0.10 0.00 0.00 66.02 66.71 2qqc s SER 24 CO 0.03 -0.92 1.19 -0.55 0.98 0.00 0.00 173.24 173.97 2qqc s SER 25 N -2.93 -0.15 0.56 7.02 0.15 -1.26 -4.49 113.70 112.60 2qqc s SER 25 Ca 0.13 -0.00 -0.00 0.00 0.70 0.00 0.00 55.95 56.78 2qqc s SER 25 Cb 0.02 0.15 0.03 0.00 -1.71 0.00 0.00 66.02 64.52 2qqc s SER 25 CO -0.02 -0.25 0.80 -1.61 1.20 0.00 0.00 173.24 173.36 2qqc s GLU 26 N -2.45 2.57 -0.07 5.44 0.41 -1.26 -4.77 118.70 118.56 2qqc s GLU 26 Ca 0.09 -0.65 -0.29 0.00 -0.41 0.00 0.00 54.97 53.71 2qqc s GLU 26 Cb -0.01 -2.45 0.10 0.00 -1.78 0.00 0.00 34.13 30.00 2qqc s GLU 26 CO -0.05 -0.73 0.86 0.20 -0.49 0.00 0.00 175.26 175.05 2qqc s GLY 27 N -4.41 -0.42 0.40 -1.39 0.00 -1.26 -4.42 107.32 95.82 2qqc s GLY 27 Ca 0.56 1.49 0.21 0.00 0.00 0.00 0.00 44.72 46.98 2qqc s GLY 27 CO 0.39 0.77 1.75 0.83 0.00 0.00 0.00 173.10 176.85 2qqc h GLU 28 N 2.48 0.00 -4.29 2.90 5.08 -1.99 -3.44 114.58 115.32 2qqc h GLU 28 Ca -0.22 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.00 2qqc h GLU 28 Cb 1.19 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.29 2qqc h GLU 28 CO 0.33 0.31 -0.67 0.95 -1.00 0.00 0.00 179.01 178.93 2qqc s THR 29 N -3.58 0.20 0.21 1.13 -4.23 -1.26 -5.03 115.64 103.08 2qqc s THR 29 Ca 0.01 -1.84 -0.10 0.00 -1.18 0.00 0.00 61.69 58.58 2qqc s THR 29 Cb 0.10 -1.65 0.14 0.00 1.34 0.00 0.00 72.50 72.44 2qqc s THR 29 CO 0.67 -0.87 1.75 -0.65 -0.54 0.00 0.00 174.62 174.98 2qqc h PRO 30 N 3.08 0.43 -0.67 3.99 0.11 -1.99 0.67 132.00 137.61 2qqc h PRO 30 Ca -0.34 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.68 2qqc h PRO 30 Cb 1.15 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 2qqc h PRO 30 CO 0.64 0.28 0.19 1.25 -0.21 0.00 0.00 178.00 180.16 2qqc h LEU 31 N 0.44 0.97 -0.75 2.35 5.85 -1.98 0.54 115.31 122.73 2qqc h LEU 31 Ca 0.30 -0.18 -0.12 0.00 0.84 0.00 0.00 57.88 58.72 2qqc h LEU 31 Cb 0.35 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2qqc h LEU 31 CO -0.28 0.92 -0.34 0.78 -0.34 0.00 0.00 178.44 179.18 2qqc h ASN 32 N 0.99 0.59 -0.40 1.25 4.21 -1.75 -0.56 115.58 119.92 2qqc h ASN 32 Ca 0.22 -0.24 -0.06 0.00 1.21 0.00 0.00 56.30 57.43 2qqc h ASN 32 Cb 0.31 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 37.33 2qqc h ASN 32 CO -0.00 0.88 0.00 0.00 -1.29 0.00 0.00 177.43 177.02 2qqc h ALA 33 N 1.15 0.54 -0.19 -0.83 0.00 -0.37 -0.07 119.26 119.48 2qqc h ALA 33 Ca 0.05 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.73 2qqc h ALA 33 Cb 0.81 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2qqc h ALA 33 CO 0.07 0.31 0.05 0.35 0.00 0.00 0.00 179.25 180.03 2qqc h PHE 34 N 0.53 0.10 -0.45 0.00 3.57 -0.65 -0.48 116.94 119.55 2qqc h PHE 34 Ca 0.11 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.67 2qqc h PHE 34 Cb 0.47 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.15 2qqc h PHE 34 CO 0.04 0.04 0.19 0.22 -2.23 0.00 0.00 178.31 176.56 2qqc h ASP 35 N 0.14 0.23 -0.73 0.41 3.58 -0.88 -0.53 116.42 118.64 2qqc h ASP 35 Ca 0.08 0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.59 2qqc h ASP 35 Cb 0.06 0.01 -0.04 0.00 1.72 0.00 0.00 39.33 41.08 2qqc h ASP 35 CO -0.10 0.17 0.48 1.23 -2.88 0.00 0.00 179.24 178.14 2qqc h GLY 36 N 0.37 1.03 0.87 -0.78 0.00 -0.46 0.03 103.07 104.13 2qqc h GLY 36 Ca 0.21 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 2qqc h GLY 36 CO -0.19 0.36 -0.01 0.00 0.00 0.00 0.00 176.54 176.70 2qqc h ALA 37 N 1.55 0.38 -0.47 3.60 0.00 0.08 0.11 119.26 124.51 2qqc h ALA 37 Ca 0.27 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2qqc h ALA 37 Cb -0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2qqc h ALA 37 CO -0.06 0.13 0.29 -0.07 0.00 0.00 0.00 179.25 179.54 2qqc h LEU 38 N 0.29 0.55 -0.80 0.00 4.07 -0.61 0.75 115.31 119.56 2qqc h LEU 38 Ca 0.08 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.00 2qqc h LEU 38 Cb 0.45 -0.14 -0.04 0.00 1.08 0.00 0.00 40.66 42.01 2qqc h LEU 38 CO 0.02 0.43 0.52 -0.07 -1.08 0.00 0.00 178.44 178.25 2qqc h LEU 39 N 0.63 0.93 -1.15 1.67 3.38 -0.80 -0.53 115.31 119.43 2qqc h LEU 39 Ca 0.17 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 2qqc h LEU 39 Cb -0.03 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2qqc h LEU 39 CO -0.03 0.69 -0.12 -1.13 0.09 0.00 0.00 178.44 177.94 2qqc h ASN 40 N 1.09 0.44 1.31 -0.43 -0.73 -0.16 -2.06 115.58 115.04 2qqc h ASN 40 Ca 0.29 -0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.36 2qqc h ASN 40 Cb -0.10 -0.12 0.00 0.00 0.27 0.00 0.00 38.32 38.37 2qqc h ASN 40 CO -0.06 0.59 0.00 0.00 -0.37 0.00 0.00 177.43 177.59 2qqc h ALA 41 N 1.46 1.00 0.00 1.57 0.00 0.00 -3.44 119.26 119.85 2qqc h ALA 41 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2qqc h ALA 41 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2qqc h ALA 41 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2qqc n GLY 42 N 0.82 0.90 1.56 0.00 0.00 -0.58 -4.46 105.19 103.43 2qqc n GLY 42 Ca 0.04 -0.02 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 2qqc n GLY 42 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qqc n ILE 43 N -2.19 1.74 0.52 -0.61 3.06 -0.31 -4.87 119.36 116.70 2qqc n ILE 43 Ca 0.00 -3.07 0.13 0.00 -2.50 0.00 0.00 62.75 57.31 2qqc n ILE 43 Cb 0.00 -0.03 0.37 0.00 0.54 0.00 0.00 39.64 40.52 2qqc n ILE 43 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 2qqc h GLY 44 N 1.62 0.00 -2.49 4.50 0.00 -1.72 -3.35 103.07 101.62 2qqc h GLY 44 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.09 2qqc h GLY 44 CO 0.28 0.00 -0.10 0.70 0.00 0.00 0.00 176.54 177.41 2qqc n ASN 45 N -2.46 3.25 -4.35 0.19 3.02 -1.26 -4.78 115.26 108.87 2qqc n ASN 45 Ca 0.05 -3.79 -0.18 0.00 -0.03 0.00 0.00 54.58 50.63 2qqc n ASN 45 Cb 0.44 -0.63 -0.10 0.00 -0.61 0.00 0.00 39.78 38.88 2qqc n ASN 45 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2qqc s VAL 46 N -3.58 1.37 -0.39 2.41 -7.23 -1.26 -5.11 120.40 106.61 2qqc s VAL 46 Ca 0.47 -2.10 -0.20 0.00 -1.81 0.00 0.00 61.98 58.35 2qqc s VAL 46 Cb 0.42 -2.23 0.01 0.00 0.56 0.00 0.00 36.38 35.14 2qqc s VAL 46 CO 0.00 -0.44 0.61 0.20 -0.31 0.00 0.00 175.10 175.16 2qqc s ASN 47 N -3.32 6.36 -0.08 4.85 0.01 -1.26 -5.03 114.94 116.47 2qqc s ASN 47 Ca 0.26 -0.11 -0.27 0.00 -0.71 0.00 0.00 52.86 52.03 2qqc s ASN 47 Cb 0.03 -2.31 -0.03 0.00 0.41 0.00 0.00 41.25 39.36 2qqc s ASN 47 CO 0.08 -0.65 0.87 -0.76 -1.51 0.00 0.00 177.10 175.12 2qqc s LEU 48 N 2.69 4.29 -0.38 0.60 1.43 -1.26 -5.00 118.68 121.05 2qqc s LEU 48 Ca 0.22 1.39 -0.07 0.00 -1.03 0.00 0.00 54.13 54.64 2qqc s LEU 48 Cb -0.14 -3.34 0.07 0.00 0.03 0.00 0.00 46.19 42.80 2qqc s LEU 48 CO 0.16 -0.28 0.18 -0.63 0.23 0.00 0.00 176.35 176.01 2qqc s ILE 49 N 1.37 3.85 0.05 -0.59 -1.09 -1.26 -5.06 121.20 118.47 2qqc s ILE 49 Ca 0.44 -1.39 -0.31 0.00 -2.23 0.00 0.00 60.65 57.17 2qqc s ILE 49 Cb -0.19 -3.32 -0.07 0.00 -1.58 0.00 0.00 42.46 37.31 2qqc s ILE 49 CO 0.20 -0.38 1.51 -0.60 -1.23 0.00 0.00 174.94 174.43 2qqc s ARG 50 N 1.37 4.25 0.02 2.79 3.52 -1.26 -5.00 118.95 124.63 2qqc s ARG 50 Ca 0.01 2.14 0.00 0.00 -0.13 0.00 0.00 55.73 57.75 2qqc s ARG 50 Cb -0.21 -3.53 -0.04 0.00 -1.56 0.00 0.00 34.95 29.61 2qqc s ARG 50 CO 0.01 -0.62 0.09 0.96 -0.81 0.00 0.00 175.30 174.93 2qqc s ILE 51 N 2.31 4.72 0.00 4.11 -4.36 -1.26 -5.35 121.20 121.37 2qqc s ILE 51 Ca 0.68 -0.49 0.00 0.00 -0.26 0.00 0.00 60.65 60.58 2qqc s ILE 51 Cb -0.36 -3.20 0.00 0.00 1.25 0.00 0.00 42.46 40.16 2qqc s ILE 51 CO 0.29 0.28 0.13 -1.54 0.24 0.00 0.00 174.94 174.34