#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 -0.32 -4.36 0.00 4.01 -1.26 -4.79 117.16 110.43 1clf n TYR 2 Ca 0.00 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.56 1clf n TYR 2 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 38.98 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 -0.10 0.71 -2.76 -0.72 2.85 -1.05 -4.64 118.16 112.46 1clf n LYS 3 Ca 0.00 -2.45 -0.43 0.00 -1.05 0.00 0.00 58.31 54.38 1clf n LYS 3 Cb 0.00 1.29 -0.04 0.00 -0.65 0.00 0.00 35.03 35.63 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 -2.61 4.33 0.87 0.58 1.01 -1.26 0.29 121.20 124.41 1clf s ILE 4 Ca 0.14 0.65 -0.12 0.00 0.00 0.00 0.00 60.65 61.32 1clf s ILE 4 Cb 0.01 -4.55 0.11 0.00 0.01 0.00 0.00 42.46 38.04 1clf s ILE 4 CO 0.10 -1.05 1.16 0.00 0.00 0.00 0.00 174.94 175.15 1clf s ALA 5 N 4.13 2.21 0.60 9.38 0.00 0.52 -4.74 121.76 133.85 1clf s ALA 5 Ca 0.37 -0.61 0.29 0.00 0.00 0.00 0.00 51.96 52.00 1clf s ALA 5 Cb -0.10 -2.99 1.28 0.00 0.00 0.00 0.00 23.12 21.31 1clf s ALA 5 CO 0.24 -2.01 1.66 0.22 0.00 0.00 0.00 175.76 175.88 1clf h ASP 6 N -1.30 0.00 0.00 0.00 1.82 -1.91 -0.20 116.42 114.83 1clf h ASP 6 Ca -0.48 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.16 1clf h ASP 6 Cb 1.33 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.34 1clf h ASP 6 CO 0.63 0.00 0.19 0.28 -1.61 0.00 0.00 179.24 178.73 1clf h SER 7 N 0.00 0.00 -3.88 2.28 0.02 -1.92 -3.43 113.55 106.63 1clf h SER 7 Ca 0.34 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.75 1clf h SER 7 Cb 1.91 0.00 0.19 0.00 0.14 0.00 0.00 62.40 64.64 1clf h SER 7 CO -0.00 0.00 0.01 0.00 -1.14 0.00 0.00 176.83 175.70 1clf s VAL 9 N -2.21 1.57 -0.59 0.00 -7.23 -1.26 -4.96 120.40 105.72 1clf s VAL 9 Ca 0.68 -1.95 -0.14 0.00 -1.81 0.00 0.00 61.98 58.75 1clf s VAL 9 Cb -0.28 -1.80 -0.13 0.00 0.56 0.00 0.00 36.38 34.73 1clf s VAL 9 CO 0.56 -0.47 1.79 -1.20 -0.31 0.00 0.00 175.10 175.47 1clf n SER 10 N 0.12 2.73 -1.20 4.85 7.64 -1.26 -4.60 113.62 121.90 1clf n SER 10 Ca -0.12 -2.43 0.00 0.00 1.01 0.00 0.00 58.87 57.33 1clf n SER 10 Cb 0.58 -0.92 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 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 5.00 1.81 0.12 0.00 0.00 -1.26 -4.96 105.19 105.91 1clf n GLY 12 Ca 0.00 -0.56 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 1clf n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1clf n ALA 13 N -0.97 1.15 -1.28 4.61 0.00 -1.26 -4.87 120.51 117.90 1clf n ALA 13 Ca -0.05 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.61 1clf n ALA 13 Cb 0.84 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.74 1clf n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1clf n ALA 15 N -3.00 0.00 0.79 0.00 0.00 -1.26 -1.87 120.51 115.17 1clf n ALA 15 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1clf n ALA 15 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1clf n ALA 15 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1clf n SER 16 N 3.42 0.07 -0.30 0.00 7.64 -1.26 -0.59 113.62 122.60 1clf n SER 16 Ca 0.00 -0.87 -0.06 0.00 1.01 0.00 0.00 58.87 58.96 1clf n SER 16 Cb 0.00 -0.04 0.07 0.00 -1.01 0.00 0.00 64.21 63.23 1clf n SER 16 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1clf h GLU 17 N 0.10 1.19 -6.34 1.43 4.57 -1.67 -3.44 114.58 110.43 1clf h GLU 17 Ca 0.00 -0.21 -0.56 0.00 -1.18 0.00 0.00 59.36 57.42 1clf h GLU 17 Cb 0.04 -0.20 0.02 0.00 -0.16 0.00 0.00 28.75 28.45 1clf h GLU 17 CO 0.00 0.95 1.19 0.00 -1.18 0.00 0.00 179.01 179.97 1clf h PRO 19 N 10.11 0.22 -0.27 0.00 0.11 -1.89 -0.22 132.00 140.06 1clf h PRO 19 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1clf h PRO 19 Cb 1.25 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1clf h PRO 19 CO 0.94 0.14 0.00 1.55 -0.21 0.00 0.00 178.00 180.43 1clf n VAL 20 N -4.76 0.55 -4.08 3.15 3.14 -1.26 -4.99 118.33 110.08 1clf n VAL 20 Ca 0.32 -0.78 -0.28 0.00 -2.96 0.00 0.00 64.34 60.64 1clf n VAL 20 Cb 1.17 0.86 -0.04 0.00 -1.06 0.00 0.00 33.84 34.77 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 0.86 -0.49 0.06 6.55 5.15 -0.10 -4.85 115.26 122.44 1clf n ASN 21 Ca 0.13 -1.07 0.09 0.00 -0.60 0.00 0.00 54.58 53.12 1clf n ASN 21 Cb 0.44 -2.67 0.37 0.00 -0.53 0.00 0.00 39.78 37.39 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 -4.43 1.60 -2.90 5.20 0.00 -1.26 -4.81 120.51 113.91 1clf n ALA 22 Ca -0.25 0.01 -0.34 0.00 0.00 0.00 0.00 53.44 52.86 1clf n ALA 22 Cb 0.66 -1.28 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 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 -3.14 5.46 0.16 0.00 1.01 -1.26 -0.75 121.20 122.68 1clf s ILE 23 Ca 0.05 -0.05 -0.25 0.00 0.00 0.00 0.00 60.65 60.41 1clf s ILE 23 Cb 0.09 -3.50 0.06 0.00 0.01 0.00 0.00 42.46 39.12 1clf s ILE 23 CO 0.30 0.41 0.97 -0.44 0.00 0.00 0.00 174.94 176.18 1clf s SER 24 N -1.67 -0.16 0.15 3.58 0.01 -0.86 -4.80 113.70 109.96 1clf s SER 24 Ca 0.24 -0.44 -0.31 0.00 1.31 0.00 0.00 55.95 56.74 1clf s SER 24 Cb -0.12 0.49 -0.09 0.00 0.21 0.00 0.00 66.02 66.51 1clf s SER 24 CO 0.14 -0.92 1.47 -1.58 0.41 0.00 0.00 173.24 172.76 1clf s GLN 25 N -3.17 4.27 0.00 12.44 0.74 -1.26 -0.56 119.66 132.12 1clf s GLN 25 Ca 0.13 2.22 0.00 0.00 0.05 0.00 0.00 55.36 57.76 1clf s GLN 25 Cb -0.02 -3.19 0.00 0.00 1.10 0.00 0.00 33.01 30.90 1clf s GLN 25 CO 0.03 -0.50 0.00 0.41 -0.55 0.00 0.00 175.29 174.68 1clf n GLY 26 N 3.42 -0.29 0.13 2.59 0.00 0.07 -4.82 105.19 106.28 1clf n GLY 26 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 1clf n GLY 26 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1clf n ASP 27 N -0.78 1.95 0.12 1.61 5.75 -1.26 -4.95 116.55 118.99 1clf n ASP 27 Ca 0.00 0.35 0.00 0.00 -0.01 0.00 0.00 54.79 55.13 1clf n ASP 27 Cb 0.00 -0.81 0.00 0.00 -1.03 0.00 0.00 41.12 39.28 1clf n ASP 27 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1clf n SER 28 N -4.31 -0.28 -0.01 -1.12 7.64 -1.26 -5.12 113.62 109.15 1clf n SER 28 Ca -0.43 0.40 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1clf n SER 28 Cb 0.78 0.45 0.00 0.00 -1.01 0.00 0.00 64.21 64.43 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 -3.26 0.00 -3.54 0.44 -5.35 -1.26 -4.59 119.36 101.80 1clf n ILE 29 Ca 0.00 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.16 1clf n ILE 29 Cb 0.00 -0.90 -0.05 0.00 -1.74 0.00 0.00 39.64 36.95 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 2.09 3.46 -0.02 4.28 0.40 -1.26 -0.75 117.98 126.19 1clf s PHE 30 Ca 0.00 0.72 0.02 0.00 -0.60 0.00 0.00 56.93 57.07 1clf s PHE 30 Cb 0.00 -2.14 0.00 0.00 0.51 0.00 0.00 43.02 41.40 1clf s PHE 30 CO 0.00 0.36 -0.06 0.54 0.70 0.00 0.00 175.22 176.76 1clf s VAL 31 N -1.72 0.55 -0.10 -0.44 0.11 0.28 -4.60 120.40 114.48 1clf s VAL 31 Ca 0.44 -0.25 -0.12 0.00 -2.93 0.00 0.00 61.98 59.12 1clf s VAL 31 Cb -0.12 -0.49 -0.05 0.00 -1.53 0.00 0.00 36.38 34.20 1clf s VAL 31 CO 0.23 0.17 0.27 -0.63 -3.33 0.00 0.00 175.10 171.81 1clf s ILE 32 N 0.12 5.29 -0.51 7.04 1.01 -1.26 -2.03 121.20 130.86 1clf s ILE 32 Ca -0.01 0.51 -0.27 0.00 0.00 0.00 0.00 60.65 60.88 1clf s ILE 32 Cb -0.06 -3.57 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 1clf s ILE 32 CO -0.00 0.52 1.99 -1.81 0.00 0.00 0.00 174.94 175.64 1clf s ASP 33 N -0.47 5.21 0.32 3.58 1.11 0.07 -4.83 116.67 121.67 1clf s ASP 33 Ca 0.18 0.76 0.05 0.00 0.18 0.00 0.00 52.55 53.72 1clf s ASP 33 Cb -0.14 -2.52 0.56 0.00 1.07 0.00 0.00 42.92 41.89 1clf s ASP 33 CO 0.06 -2.34 1.80 0.00 1.18 0.00 0.00 175.17 175.88 1clf h ALA 34 N 15.60 1.27 -0.88 5.23 0.00 -1.90 0.16 119.26 138.75 1clf h ALA 34 Ca -0.28 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.36 1clf h ALA 34 Cb 1.19 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1clf h ALA 34 CO 1.16 0.48 0.58 0.22 0.00 0.00 0.00 179.25 181.69 1clf h ASP 35 N 0.35 1.00 0.15 0.00 3.58 -1.94 -3.03 116.42 116.52 1clf h ASP 35 Ca 0.06 -0.02 -0.23 0.00 0.42 0.00 0.00 57.03 57.26 1clf h ASP 35 Cb 0.53 -0.25 0.03 0.00 1.72 0.00 0.00 39.33 41.36 1clf h ASP 35 CO 0.04 0.71 -0.98 0.74 -2.88 0.00 0.00 179.24 176.87 1clf h THR 36 N 1.17 1.43 -1.88 2.25 2.02 -1.78 -3.45 112.91 112.68 1clf h THR 36 Ca 0.33 -2.51 -0.61 0.00 0.77 0.00 0.00 66.41 64.39 1clf h THR 36 Cb -0.11 3.04 0.01 0.00 -1.74 0.00 0.00 68.15 69.35 1clf h THR 36 CO -0.08 0.73 1.26 0.00 0.37 0.00 0.00 175.52 177.80 1clf n ILE 38 N 6.16 0.00 -2.26 0.00 -5.35 -1.26 -4.39 119.36 112.26 1clf n ILE 38 Ca 0.27 -0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.71 1clf n ILE 38 Cb 0.33 -0.50 0.01 0.00 -1.74 0.00 0.00 39.64 37.74 1clf n ILE 38 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1clf n ASP 39 N -1.04 -5.30 0.00 7.28 -0.08 -1.26 -4.82 116.55 111.32 1clf n ASP 39 Ca 0.22 0.28 0.00 0.00 -1.51 0.00 0.00 54.79 53.78 1clf n ASP 39 Cb 0.13 -3.44 0.00 0.00 2.34 0.00 0.00 41.12 40.15 1clf n ASP 39 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1clf n GLY 41 N 3.04 2.86 3.40 0.00 0.00 -1.26 -5.05 105.19 108.17 1clf n GLY 41 Ca 0.00 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 1clf n GLY 41 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1clf n ASN 42 N 0.47 -1.95 0.00 1.61 4.13 -1.26 -1.01 115.26 117.26 1clf n ASN 42 Ca 0.00 0.15 0.00 0.00 1.68 0.00 0.00 54.58 56.41 1clf n ASN 42 Cb 0.00 -1.15 0.00 0.00 -1.54 0.00 0.00 39.78 37.09 1clf n ASN 42 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1clf h ALA 44 N 0.00 1.11 0.00 0.00 0.00 -1.54 -0.25 119.26 118.58 1clf h ALA 44 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1clf h ALA 44 Cb 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1clf h ALA 44 CO 0.00 0.65 -0.20 -0.91 0.00 0.00 0.00 179.25 178.79 1clf h ASN 45 N 1.14 0.00 0.20 0.00 2.35 -1.29 -3.25 115.58 114.74 1clf h ASN 45 Ca 0.27 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.67 1clf h ASN 45 Cb 0.17 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 1clf h ASN 45 CO -0.03 0.20 -1.86 -0.37 -1.65 0.00 0.00 177.43 173.72 1clf h VAL 46 N 0.00 0.78 -1.84 2.81 -1.51 -1.38 -3.48 116.25 111.64 1clf h VAL 46 Ca -0.00 -2.46 -0.64 0.00 -1.23 0.00 0.00 66.70 62.37 1clf h VAL 46 Cb 0.40 2.60 0.01 0.00 -2.13 0.00 0.00 31.29 32.17 1clf h VAL 46 CO 0.03 0.85 1.12 0.00 -1.23 0.00 0.00 177.57 178.34 1clf h PRO 48 N 9.50 0.22 -0.11 0.00 0.11 -1.92 -1.07 132.00 138.74 1clf h PRO 48 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1clf h PRO 48 Cb 1.28 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1clf h PRO 48 CO 0.96 0.15 0.00 1.33 -0.21 0.00 0.00 178.00 180.23 1clf n VAL 49 N -4.90 1.93 -4.03 3.15 0.24 -1.26 -5.01 118.33 108.45 1clf n VAL 49 Ca 0.33 -1.99 -0.31 0.00 -2.04 0.00 0.00 64.34 60.33 1clf n VAL 49 Cb 1.14 -0.16 -0.00 0.00 -1.47 0.00 0.00 33.84 33.34 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 -0.95 -0.42 0.18 7.63 0.00 -0.40 -4.90 105.19 106.33 1clf n GLY 50 Ca 0.17 0.16 0.07 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 0.92 0.82 -0.27 4.61 0.00 -1.86 -3.40 119.26 120.08 1clf h ALA 51 Ca -0.60 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.00 1clf h ALA 51 Cb 1.38 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 1clf h ALA 51 CO 0.70 0.36 0.17 -2.14 0.00 0.00 0.00 179.25 178.34 1clf s PRO 52 N -3.10 1.51 0.10 0.00 0.02 -1.26 -0.35 135.00 131.92 1clf s PRO 52 Ca 0.05 -0.15 -0.25 0.00 0.02 0.00 0.00 61.00 60.67 1clf s PRO 52 Cb 0.07 -4.94 0.07 0.00 0.02 0.00 0.00 34.50 29.72 1clf s PRO 52 CO 0.71 -4.88 0.61 0.14 -0.33 0.00 0.00 177.00 173.25 1clf s VAL 53 N 15.34 0.00 0.32 3.83 -7.23 0.14 -4.73 120.40 128.08 1clf s VAL 53 Ca 0.84 -0.02 -0.05 0.00 -1.81 0.00 0.00 61.98 60.94 1clf s VAL 53 Cb -0.08 -1.00 -0.05 0.00 0.56 0.00 0.00 36.38 35.81 1clf s VAL 53 CO 0.13 -0.01 0.59 -1.58 -0.31 0.00 0.00 175.10 173.92 1clf s GLN 54 N -3.04 3.62 0.00 4.82 0.74 -1.26 -2.17 119.66 122.37 1clf s GLN 54 Ca -0.02 0.01 0.00 0.00 0.05 0.00 0.00 55.36 55.40 1clf s GLN 54 Cb -0.01 -2.60 0.00 0.00 1.10 0.00 0.00 33.01 31.50 1clf s GLN 54 CO -0.07 0.15 0.22 0.39 -0.55 0.00 0.00 175.29 175.43