#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1clf n TYR 2 N 0.00 -0.16 -3.77 0.00 4.01 -1.26 -4.86 117.16 111.12 1clf n TYR 2 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1clf n TYR 2 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1clf n TYR 2 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 1clf n LYS 3 N 0.00 0.00 -2.55 -0.72 2.85 -1.08 -4.79 118.16 111.87 1clf n LYS 3 Ca 0.00 0.00 -0.42 0.00 -1.05 0.00 0.00 58.31 56.84 1clf n LYS 3 Cb 0.00 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 1clf n LYS 3 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1clf s ILE 4 N -2.03 3.96 0.79 0.58 -1.09 -1.26 0.14 121.20 122.29 1clf s ILE 4 Ca 0.00 0.84 -0.12 0.00 -2.23 0.00 0.00 60.65 59.14 1clf s ILE 4 Cb 0.00 -4.70 0.07 0.00 -1.58 0.00 0.00 42.46 36.25 1clf s ILE 4 CO 0.00 -1.36 1.10 0.00 -1.23 0.00 0.00 174.94 173.46 1clf s ALA 5 N 5.17 2.33 0.07 9.38 0.00 0.12 -4.84 121.76 134.00 1clf s ALA 5 Ca 0.44 -0.26 0.20 0.00 0.00 0.00 0.00 51.96 52.35 1clf s ALA 5 Cb -0.08 -3.09 1.11 0.00 0.00 0.00 0.00 23.12 21.07 1clf s ALA 5 CO 0.25 -1.67 1.58 0.22 0.00 0.00 0.00 175.76 176.13 1clf h ASP 6 N -1.05 0.00 -0.39 0.00 3.58 -1.90 -0.90 116.42 115.76 1clf h ASP 6 Ca -0.47 0.00 0.11 0.00 0.42 0.00 0.00 57.03 57.09 1clf h ASP 6 Cb 1.27 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.31 1clf h ASP 6 CO 0.60 0.00 0.43 0.28 -2.88 0.00 0.00 179.24 177.67 1clf h SER 7 N 0.00 0.00 -3.94 2.28 0.02 -1.91 -3.43 113.55 106.57 1clf h SER 7 Ca 0.00 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.45 1clf h SER 7 Cb 0.36 0.00 0.21 0.00 0.14 0.00 0.00 62.40 63.10 1clf h SER 7 CO 0.00 0.00 0.09 0.00 -1.14 0.00 0.00 176.83 175.78 1clf s VAL 9 N -2.56 0.53 -0.83 0.00 -7.23 -1.26 -4.95 120.40 104.10 1clf s VAL 9 Ca 0.66 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.71 1clf s VAL 9 Cb -0.23 -2.56 -0.09 0.00 0.56 0.00 0.00 36.38 34.06 1clf s VAL 9 CO 0.60 0.00 2.00 -1.20 -0.31 0.00 0.00 175.10 176.19 1clf n SER 10 N -0.83 3.80 -4.95 4.85 7.64 -1.26 -4.31 113.62 118.55 1clf n SER 10 Ca -0.01 -2.45 -0.21 0.00 1.01 0.00 0.00 58.87 57.21 1clf n SER 10 Cb 0.65 -1.08 0.06 0.00 -1.01 0.00 0.00 64.21 62.83 1clf n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1clf n GLY 12 N -2.07 1.65 0.08 0.00 0.00 -1.26 -4.91 105.19 98.67 1clf n GLY 12 Ca 0.13 -0.51 -0.08 0.00 0.00 0.00 0.00 46.02 45.57 1clf n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1clf h ALA 13 N 1.39 0.36 -3.00 4.61 0.00 -1.98 -3.42 119.26 117.22 1clf h ALA 13 Ca -0.34 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 53.70 1clf h ALA 13 Cb 1.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1clf h ALA 13 CO -0.05 1.15 0.00 0.00 0.00 0.00 0.00 179.25 180.35 1clf n ALA 15 N -3.00 0.00 -0.31 0.00 0.00 -1.26 -0.87 120.51 115.07 1clf n ALA 15 Ca 0.00 0.00 0.32 0.00 0.00 0.00 0.00 53.44 53.76 1clf n ALA 15 Cb 0.00 0.00 0.69 0.00 0.00 0.00 0.00 19.45 20.14 1clf n ALA 15 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1clf h SER 16 N 0.00 0.12 -0.56 0.00 0.02 -1.91 0.56 113.55 111.78 1clf h SER 16 Ca 0.00 0.02 0.16 0.00 -0.84 0.00 0.00 61.79 61.14 1clf h SER 16 Cb 0.00 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1clf h SER 16 CO 0.00 0.02 0.46 -0.33 -1.14 0.00 0.00 176.83 175.84 1clf h GLU 17 N 0.10 0.00 -6.22 3.45 4.39 -1.28 -3.41 114.58 111.61 1clf h GLU 17 Ca 0.57 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.71 1clf h GLU 17 Cb 2.05 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.67 1clf h GLU 17 CO -0.09 0.00 0.96 0.00 -1.16 0.00 0.00 179.01 178.73 1clf h PRO 19 N 8.67 0.30 -0.49 0.00 0.11 -1.89 0.13 132.00 138.83 1clf h PRO 19 Ca -0.33 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1clf h PRO 19 Cb 1.14 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1clf h PRO 19 CO 0.96 0.20 0.00 1.55 -0.21 0.00 0.00 178.00 180.49 1clf n VAL 20 N -4.52 0.70 -1.71 3.15 3.14 -1.26 -4.96 118.33 112.87 1clf n VAL 20 Ca 0.24 -0.85 -0.15 0.00 -2.96 0.00 0.00 64.34 60.62 1clf n VAL 20 Cb 0.91 0.79 -0.05 0.00 -1.06 0.00 0.00 33.84 34.43 1clf n VAL 20 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1clf n ASN 21 N 1.43 -4.21 -2.45 6.55 5.15 0.43 -4.83 115.26 117.34 1clf n ASN 21 Ca 0.20 0.31 -0.25 0.00 -0.60 0.00 0.00 54.58 54.24 1clf n ASN 21 Cb 0.58 -3.76 -0.07 0.00 -0.53 0.00 0.00 39.78 36.00 1clf n ASN 21 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1clf n ALA 22 N -0.03 6.46 -2.86 5.20 0.00 -1.26 -4.80 120.51 123.22 1clf n ALA 22 Ca -0.16 -2.92 -0.13 0.00 0.00 0.00 0.00 53.44 50.23 1clf n ALA 22 Cb 0.54 -2.18 -0.12 0.00 0.00 0.00 0.00 19.45 17.69 1clf n ALA 22 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1clf s ILE 23 N -1.81 0.43 0.08 0.00 1.01 -1.26 -2.08 121.20 117.58 1clf s ILE 23 Ca 0.60 -0.85 -0.27 0.00 0.00 0.00 0.00 60.65 60.13 1clf s ILE 23 Cb 0.37 -0.49 0.08 0.00 0.01 0.00 0.00 42.46 42.44 1clf s ILE 23 CO -0.19 -0.29 1.04 -0.44 0.00 0.00 0.00 174.94 175.05 1clf s SER 24 N -1.22 -0.17 -0.19 3.58 0.01 -0.91 -4.93 113.70 109.86 1clf s SER 24 Ca -0.08 -0.28 -0.29 0.00 1.31 0.00 0.00 55.95 56.61 1clf s SER 24 Cb -0.08 0.39 -0.02 0.00 0.21 0.00 0.00 66.02 66.51 1clf s SER 24 CO 0.00 -0.70 1.47 -1.58 0.41 0.00 0.00 173.24 172.84 1clf s GLN 25 N -3.03 4.00 -0.05 12.44 0.74 -1.26 -0.36 119.66 132.14 1clf s GLN 25 Ca 0.12 1.68 -0.04 0.00 0.05 0.00 0.00 55.36 57.17 1clf s GLN 25 Cb 0.00 -3.93 -0.01 0.00 1.10 0.00 0.00 33.01 30.17 1clf s GLN 25 CO -0.01 -1.03 -0.07 0.41 -0.55 0.00 0.00 175.29 174.04 1clf n GLY 26 N 4.24 -0.64 0.58 2.59 0.00 -0.33 -4.88 105.19 106.75 1clf n GLY 26 Ca 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1clf n GLY 26 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1clf n ASP 27 N -3.06 0.00 -0.03 1.61 2.03 -1.26 -4.99 116.55 110.85 1clf n ASP 27 Ca -0.03 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.24 1clf n ASP 27 Cb 0.10 -0.10 -0.02 0.00 -0.72 0.00 0.00 41.12 40.39 1clf n ASP 27 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1clf n SER 28 N -2.21 1.41 -1.31 1.67 7.64 -1.26 -5.09 113.62 114.48 1clf n SER 28 Ca 0.00 0.22 0.00 0.00 1.01 0.00 0.00 58.87 60.10 1clf n SER 28 Cb 0.00 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1clf n SER 28 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1clf n ILE 29 N -3.88 0.00 -1.81 0.44 -5.35 -1.26 -4.64 119.36 102.86 1clf n ILE 29 Ca -0.07 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.08 1clf n ILE 29 Cb 0.26 -0.86 0.04 0.00 -1.74 0.00 0.00 39.64 37.34 1clf n ILE 29 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1clf s PHE 30 N 1.10 2.80 0.05 4.28 0.40 -1.26 -1.18 117.98 124.17 1clf s PHE 30 Ca 0.00 1.53 -0.04 0.00 -0.60 0.00 0.00 56.93 57.81 1clf s PHE 30 Cb 0.00 -3.07 -0.02 0.00 0.51 0.00 0.00 43.02 40.44 1clf s PHE 30 CO 0.00 -1.44 0.06 0.54 0.70 0.00 0.00 175.22 175.08 1clf s VAL 31 N -2.49 0.16 0.06 -0.44 0.11 0.52 -4.65 120.40 113.67 1clf s VAL 31 Ca 0.64 -1.28 0.07 0.00 -2.93 0.00 0.00 61.98 58.48 1clf s VAL 31 Cb -0.18 -1.06 -0.03 0.00 -1.53 0.00 0.00 36.38 33.58 1clf s VAL 31 CO 0.42 -0.71 -0.19 -0.63 -3.33 0.00 0.00 175.10 170.66 1clf s ILE 32 N -3.01 1.54 -1.08 7.04 1.01 -1.26 -2.15 121.20 123.28 1clf s ILE 32 Ca -0.02 -1.23 -0.23 0.00 0.00 0.00 0.00 60.65 59.17 1clf s ILE 32 Cb 0.01 -1.36 -0.06 0.00 0.01 0.00 0.00 42.46 41.06 1clf s ILE 32 CO -0.06 0.09 1.92 -1.81 0.00 0.00 0.00 174.94 175.07 1clf s ASP 33 N -1.34 5.18 0.53 3.58 1.01 -0.88 -4.79 116.67 119.95 1clf s ASP 33 Ca 0.06 -1.32 0.22 0.00 0.71 0.00 0.00 52.55 52.22 1clf s ASP 33 Cb -0.09 -2.58 1.37 0.00 1.01 0.00 0.00 42.92 42.64 1clf s ASP 33 CO 0.02 -2.84 2.06 0.00 0.21 0.00 0.00 175.17 174.62 1clf h ALA 34 N 10.23 2.27 -0.94 5.23 0.00 -1.89 0.45 119.26 134.62 1clf h ALA 34 Ca 0.18 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.31 1clf h ALA 34 Cb 0.96 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.60 1clf h ALA 34 CO 1.23 -0.39 -0.04 0.22 0.00 0.00 0.00 179.25 180.27 1clf h ASP 35 N 0.00 -0.55 0.00 0.00 1.82 -1.95 -3.27 116.42 112.46 1clf h ASP 35 Ca 0.15 0.27 -0.32 0.00 -0.39 0.00 0.00 57.03 56.73 1clf h ASP 35 Cb 0.61 0.49 -0.06 0.00 0.68 0.00 0.00 39.33 41.05 1clf h ASP 35 CO -0.00 -0.31 -2.22 0.41 -1.61 0.00 0.00 179.24 175.50 1clf n THR 36 N -5.49 1.23 -1.64 2.25 -1.04 0.13 -4.95 114.28 104.77 1clf n THR 36 Ca 0.19 -0.64 -0.49 0.00 -2.04 0.00 0.00 64.05 61.08 1clf n THR 36 Cb 0.63 -0.85 -0.05 0.00 -1.82 0.00 0.00 70.33 68.25 1clf n THR 36 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1clf n ILE 38 N 3.20 3.01 -3.37 0.00 -5.35 -1.26 -4.29 119.36 111.30 1clf n ILE 38 Ca 0.18 -2.89 -0.24 0.00 -0.27 0.00 0.00 62.75 59.53 1clf n ILE 38 Cb 0.25 -0.74 0.00 0.00 -1.74 0.00 0.00 39.64 37.41 1clf n ILE 38 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1clf n ASP 39 N -1.00 -4.16 0.15 7.28 9.92 -1.26 -4.85 116.55 122.63 1clf n ASP 39 Ca 0.50 -0.42 0.13 0.00 -0.53 0.00 0.00 54.79 54.47 1clf n ASP 39 Cb 1.06 -3.41 0.37 0.00 -0.64 0.00 0.00 41.12 38.49 1clf n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1clf n GLY 41 N 1.06 2.86 0.16 0.00 0.00 -1.26 -4.94 105.19 103.06 1clf n GLY 41 Ca 0.05 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 1clf n GLY 41 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1clf h ASN 42 N 0.00 -0.35 -0.63 1.61 -1.24 -1.92 0.45 115.58 113.51 1clf h ASN 42 Ca 0.00 0.08 0.08 0.00 0.71 0.00 0.00 56.30 57.17 1clf h ASN 42 Cb 0.00 0.19 -0.07 0.00 0.73 0.00 0.00 38.32 39.18 1clf h ASN 42 CO 0.00 -0.14 0.29 0.00 -1.29 0.00 0.00 177.43 176.30 1clf h ALA 44 N 1.39 1.34 -0.98 0.00 0.00 -1.31 -1.71 119.26 118.00 1clf h ALA 44 Ca 0.31 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.24 1clf h ALA 44 Cb 0.31 -0.36 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 1clf h ALA 44 CO -0.25 0.56 0.63 -0.97 0.00 0.00 0.00 179.25 179.22 1clf h ASN 45 N 1.27 1.00 0.23 0.00 -0.00 0.52 -3.08 115.58 115.53 1clf h ASN 45 Ca 0.40 0.01 -0.33 0.00 -0.00 0.00 0.00 56.30 56.38 1clf h ASN 45 Cb 0.00 -0.20 0.03 0.00 -0.00 0.00 0.00 38.32 38.15 1clf h ASN 45 CO -0.13 0.64 -1.51 -0.37 -0.00 0.00 0.00 177.43 176.06 1clf h VAL 46 N 1.13 1.20 -1.98 2.57 -1.51 -0.94 -3.47 116.25 113.25 1clf h VAL 46 Ca 0.42 -2.63 -0.63 0.00 -1.23 0.00 0.00 66.70 62.63 1clf h VAL 46 Cb 0.18 2.98 0.02 0.00 -2.13 0.00 0.00 31.29 32.35 1clf h VAL 46 CO -0.17 0.81 1.02 0.00 -1.23 0.00 0.00 177.57 178.00 1clf h PRO 48 N 8.39 0.00 -0.09 0.00 0.13 -1.91 -1.37 132.00 137.15 1clf h PRO 48 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1clf h PRO 48 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1clf h PRO 48 CO 0.94 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 180.04 1clf n VAL 49 N -4.07 1.93 -3.94 1.56 0.24 -1.26 -5.02 118.33 107.77 1clf n VAL 49 Ca -0.01 -2.03 -0.31 0.00 -2.04 0.00 0.00 64.34 59.95 1clf n VAL 49 Cb 0.17 -0.18 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 1clf n VAL 49 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1clf n GLY 50 N -1.03 -0.51 0.09 7.63 0.00 -0.52 -4.91 105.19 105.94 1clf n GLY 50 Ca 0.17 0.26 -0.03 0.00 0.00 0.00 0.00 46.02 46.41 1clf n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1clf h ALA 51 N 0.95 0.70 -0.37 4.61 0.00 -1.89 -3.41 119.26 119.85 1clf h ALA 51 Ca -0.66 -1.08 -0.19 0.00 0.00 0.00 0.00 54.91 52.99 1clf h ALA 51 Cb 1.38 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 19.49 1clf h ALA 51 CO 0.58 1.18 0.58 -2.14 0.00 0.00 0.00 179.25 179.44 1clf s PRO 52 N -2.79 1.95 0.03 0.00 0.02 -1.26 0.16 135.00 133.11 1clf s PRO 52 Ca -0.03 -0.64 -0.27 0.00 0.02 0.00 0.00 61.00 60.07 1clf s PRO 52 Cb 0.08 -5.09 0.08 0.00 0.02 0.00 0.00 34.50 29.60 1clf s PRO 52 CO 0.81 -4.49 0.72 0.14 -0.33 0.00 0.00 177.00 173.85 1clf s VAL 53 N 13.38 0.00 0.21 3.83 -7.23 0.12 -4.50 120.40 126.20 1clf s VAL 53 Ca 0.75 0.00 -0.12 0.00 -1.81 0.00 0.00 61.98 60.81 1clf s VAL 53 Cb -0.04 -1.00 -0.07 0.00 0.56 0.00 0.00 36.38 35.83 1clf s VAL 53 CO 0.13 0.00 0.57 -1.58 -0.31 0.00 0.00 175.10 173.90 1clf s GLN 54 N -2.54 3.89 0.00 4.82 0.74 -1.26 -2.22 119.66 123.08 1clf s GLN 54 Ca -0.02 0.39 0.00 0.00 0.05 0.00 0.00 55.36 55.78 1clf s GLN 54 Cb -0.01 -2.73 0.00 0.00 1.10 0.00 0.00 33.01 31.37 1clf s GLN 54 CO -0.03 0.36 0.00 -0.85 -0.55 0.00 0.00 175.29 174.22