#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t7c s PRO 2 N 0.00 3.46 0.56 5.56 0.02 -1.26 -4.90 135.00 138.45 1t7c s PRO 2 Ca 0.00 2.34 0.33 0.00 0.02 0.00 0.00 61.00 63.69 1t7c s PRO 2 Cb 0.00 -2.49 1.66 0.00 0.02 0.00 0.00 34.50 33.69 1t7c s PRO 2 CO 0.00 -0.97 2.11 -0.44 -0.33 0.00 0.00 177.00 177.37 1t7c h ASP 3 N 1.97 0.00 0.37 2.53 3.32 -2.02 -2.14 116.42 120.45 1t7c h ASP 3 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1t7c h ASP 3 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1t7c h ASP 3 CO 0.59 0.06 0.00 2.19 -1.72 0.00 0.00 179.24 180.36 1t7c h PHE 4 N 0.00 0.00 0.00 4.55 -5.15 -1.99 -0.65 116.94 113.70 1t7c h PHE 4 Ca -0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1t7c h PHE 4 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.49 1t7c h PHE 4 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.31 1t7c n LEU 6 N -2.78 1.86 -4.77 0.00 4.77 -0.25 -4.58 117.00 111.25 1t7c n LEU 6 Ca 0.01 -0.62 -0.39 0.00 -0.03 0.00 0.00 56.01 54.98 1t7c n LEU 6 Cb 0.25 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 1t7c n LEU 6 CO 0.24 0.32 0.55 -1.61 -1.33 0.00 0.00 177.39 175.55 1t7c s GLU 7 N -2.22 4.67 0.85 3.23 0.41 -1.00 -4.97 118.70 119.67 1t7c s GLU 7 Ca 0.28 1.28 -0.10 0.00 -0.41 0.00 0.00 54.97 56.02 1t7c s GLU 7 Cb 0.20 -3.25 0.11 0.00 -1.78 0.00 0.00 34.13 29.40 1t7c s GLU 7 CO 0.42 0.54 1.12 -1.25 -0.49 0.00 0.00 175.26 175.60 1t7c s PRO 8 N -1.19 1.56 0.48 0.39 0.04 -1.26 -4.91 135.00 130.10 1t7c s PRO 8 Ca 0.38 1.35 -0.24 0.00 0.04 0.00 0.00 61.00 62.52 1t7c s PRO 8 Cb -0.24 -1.80 -0.07 0.00 0.04 0.00 0.00 34.50 32.42 1t7c s PRO 8 CO 0.28 -2.19 1.40 -1.25 0.04 0.00 0.00 177.00 175.28 1t7c s PRO 9 N -4.77 3.53 -0.26 0.56 0.04 -1.26 -5.01 135.00 127.83 1t7c s PRO 9 Ca 0.64 2.34 0.02 0.00 0.04 0.00 0.00 61.00 64.04 1t7c s PRO 9 Cb -0.20 -2.53 0.06 0.00 0.04 0.00 0.00 34.50 31.86 1t7c s PRO 9 CO 0.57 -0.92 -0.10 -0.47 0.04 0.00 0.00 177.00 176.13 1t7c s TYR 10 N -1.24 3.24 0.12 0.56 5.04 -1.26 -4.99 117.35 118.81 1t7c s TYR 10 Ca 0.64 -2.22 -0.13 0.00 -2.44 0.00 0.00 57.07 52.93 1t7c s TYR 10 Cb -0.42 -1.95 -0.09 0.00 0.35 0.00 0.00 41.96 39.84 1t7c s TYR 10 CO 0.53 -0.86 1.40 1.15 -1.34 0.00 0.00 175.55 176.43 1t7c h THR 11 N 6.67 1.29 0.00 4.34 2.02 -1.95 -3.44 112.91 121.84 1t7c h THR 11 Ca -0.21 -1.66 0.00 0.00 0.77 0.00 0.00 66.41 65.31 1t7c h THR 11 Cb 1.05 1.63 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1t7c h THR 11 CO 0.48 0.54 0.00 0.61 0.37 0.00 0.00 175.52 177.52 1t7c n GLY 12 N 0.32 -0.29 0.16 2.16 0.00 -1.26 -0.13 105.19 106.14 1t7c n GLY 12 Ca -0.04 -1.80 0.12 0.00 0.00 0.00 0.00 46.02 44.30 1t7c n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t7c h PRO 13 N 0.00 0.00 -7.23 1.61 0.13 -1.95 -3.44 132.00 121.12 1t7c h PRO 13 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 1t7c h PRO 13 Cb 0.00 0.00 0.09 0.00 0.13 0.00 0.00 31.00 31.22 1t7c h PRO 13 CO 0.00 0.00 0.37 0.00 -0.23 0.00 0.00 178.00 178.14 1t7c n GLU 15 N -2.48 2.19 -2.17 0.00 1.02 -1.23 -4.39 120.64 113.58 1t7c n GLU 15 Ca 0.09 -3.13 -0.27 0.00 -0.02 0.00 0.00 57.16 53.82 1t7c n GLU 15 Cb 0.53 -2.07 0.14 0.00 -0.02 0.00 0.00 31.44 30.01 1t7c n GLU 15 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1t7c s ALA 16 N -3.34 2.85 -0.51 0.62 0.00 -0.41 -5.04 121.76 115.93 1t7c s ALA 16 Ca 0.53 -1.29 0.06 0.00 0.00 0.00 0.00 51.96 51.27 1t7c s ALA 16 Cb 0.46 -2.52 0.23 0.00 0.00 0.00 0.00 23.12 21.28 1t7c s ALA 16 CO 0.06 -1.92 0.56 -2.13 0.00 0.00 0.00 175.76 172.33 1t7c n ARG 17 N -3.33 1.32 -3.69 0.00 0.63 -1.26 -4.29 116.66 106.04 1t7c n ARG 17 Ca 0.14 -3.80 -0.36 0.00 -0.92 0.00 0.00 57.85 52.90 1t7c n ARG 17 Cb 0.60 -1.73 -0.10 0.00 0.45 0.00 0.00 32.46 31.69 1t7c n ARG 17 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1t7c s ILE 18 N -1.42 5.25 -0.08 5.15 1.01 -0.52 -4.91 121.20 125.68 1t7c s ILE 18 Ca 0.35 0.14 -0.30 0.00 0.00 0.00 0.00 60.65 60.85 1t7c s ILE 18 Cb 0.12 -3.44 -0.03 0.00 0.01 0.00 0.00 42.46 39.12 1t7c s ILE 18 CO -0.10 0.35 1.22 -0.63 0.00 0.00 0.00 174.94 175.78 1t7c s ILE 19 N 1.05 4.26 0.26 2.92 1.01 -1.26 0.21 121.20 129.65 1t7c s ILE 19 Ca 0.07 1.57 0.01 0.00 0.00 0.00 0.00 60.65 62.30 1t7c s ILE 19 Cb -0.14 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.27 1t7c s ILE 19 CO 0.04 -0.04 0.10 -0.13 0.00 0.00 0.00 174.94 174.92 1t7c s ARG 20 N 2.54 1.41 0.04 2.79 1.81 -0.62 -4.93 118.95 121.99 1t7c s ARG 20 Ca 0.56 -1.76 0.07 0.00 -1.72 0.00 0.00 55.73 52.87 1t7c s ARG 20 Cb -0.24 -0.21 -0.03 0.00 -0.45 0.00 0.00 34.95 34.01 1t7c s ARG 20 CO 0.20 -0.31 -0.18 0.71 -0.68 0.00 0.00 175.30 175.04 1t7c s TYR 21 N -3.78 2.55 0.04 -0.53 1.51 0.23 -0.85 117.35 116.52 1t7c s TYR 21 Ca 0.38 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 56.19 1t7c s TYR 21 Cb 0.08 -1.46 -0.03 0.00 -0.11 0.00 0.00 41.96 40.44 1t7c s TYR 21 CO 0.14 0.25 -0.06 -0.59 -1.11 0.00 0.00 175.55 174.18 1t7c s PHE 22 N -0.93 0.60 -0.07 2.71 -0.71 0.31 -0.39 117.98 119.51 1t7c s PHE 22 Ca 0.15 -0.59 -0.25 0.00 -1.04 0.00 0.00 56.93 55.20 1t7c s PHE 22 Cb -0.10 -0.37 -0.03 0.00 -1.21 0.00 0.00 43.02 41.30 1t7c s PHE 22 CO 0.05 -0.13 0.76 -0.47 -1.34 0.00 0.00 175.22 174.09 1t7c s TYR 23 N -1.81 3.57 -0.48 3.49 5.04 -1.26 -0.24 117.35 125.67 1t7c s TYR 23 Ca -0.08 1.32 -0.10 0.00 -2.44 0.00 0.00 57.07 55.77 1t7c s TYR 23 Cb -0.07 -2.88 0.12 0.00 0.35 0.00 0.00 41.96 39.48 1t7c s TYR 23 CO -0.01 0.04 0.37 1.21 -1.34 0.00 0.00 175.55 175.81 1t7c s ASN 24 N 0.88 5.77 0.53 4.32 3.84 -0.06 -4.79 114.94 125.42 1t7c s ASN 24 Ca 0.40 -1.90 0.18 0.00 0.21 0.00 0.00 52.86 51.75 1t7c s ASN 24 Cb -0.18 -2.04 1.32 0.00 -0.55 0.00 0.00 41.25 39.80 1t7c s ASN 24 CO 0.19 -0.72 2.13 0.00 -2.79 0.00 0.00 177.10 175.92 1t7c h ALA 25 N 8.51 2.05 -0.11 1.71 0.00 -1.83 0.19 119.26 129.78 1t7c h ALA 25 Ca -0.22 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1t7c h ALA 25 Cb 1.08 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1t7c h ALA 25 CO 0.89 -0.10 -0.29 0.87 0.00 0.00 0.00 179.25 180.62 1t7c h LYS 26 N 0.00 0.20 0.00 0.00 1.57 -1.92 -3.17 116.57 113.25 1t7c h LYS 26 Ca 0.04 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 1t7c h LYS 26 Cb 0.15 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1t7c h LYS 26 CO -0.00 0.48 -2.02 0.00 -0.57 0.00 0.00 179.45 177.33 1t7c n ALA 27 N -2.48 2.49 -0.88 3.86 0.00 -0.78 -5.00 120.51 117.72 1t7c n ALA 27 Ca -0.01 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.77 1t7c n ALA 27 Cb 0.38 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1t7c n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t7c n GLY 28 N 1.44 0.50 3.20 0.00 0.00 0.60 -5.04 105.19 105.90 1t7c n GLY 28 Ca -0.10 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 1t7c n GLY 28 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1t7c s LEU 29 N 0.00 1.20 -0.05 0.99 0.05 -1.18 -4.73 118.68 114.95 1t7c s LEU 29 Ca 0.00 -1.36 -0.17 0.00 0.05 0.00 0.00 54.13 52.65 1t7c s LEU 29 Cb 0.00 0.40 -0.05 0.00 -2.05 0.00 0.00 46.19 44.49 1t7c s LEU 29 CO 0.00 -0.83 0.47 0.00 -0.55 0.00 0.00 176.35 175.44 1t7c s GLN 31 N -0.18 1.57 0.39 0.00 2.00 0.67 -4.91 119.66 119.19 1t7c s GLN 31 Ca 0.26 -1.66 -0.08 0.00 -2.00 0.00 0.00 55.36 51.88 1t7c s GLN 31 Cb -0.16 -1.69 -0.06 0.00 0.80 0.00 0.00 33.01 31.91 1t7c s GLN 31 CO 0.13 0.33 0.71 0.95 -0.50 0.00 0.00 175.29 176.91 1t7c s THR 32 N -2.30 4.87 0.19 -0.34 -4.23 -1.26 -0.53 115.64 112.05 1t7c s THR 32 Ca 0.26 0.38 -0.18 0.00 -1.18 0.00 0.00 61.69 60.97 1t7c s THR 32 Cb -0.05 -3.76 0.03 0.00 1.34 0.00 0.00 72.50 70.06 1t7c s THR 32 CO 0.12 -0.52 0.53 0.72 -0.54 0.00 0.00 174.62 174.93 1t7c s PHE 33 N -2.35 -0.15 -0.24 3.99 -0.71 -0.03 -4.89 117.98 113.60 1t7c s PHE 33 Ca 0.48 -0.18 -0.17 0.00 -1.04 0.00 0.00 56.93 56.03 1t7c s PHE 33 Cb -0.10 0.41 -0.03 0.00 -1.21 0.00 0.00 43.02 42.08 1t7c s PHE 33 CO 0.33 -0.91 0.45 0.08 -1.34 0.00 0.00 175.22 173.83 1t7c s VAL 34 N -3.86 5.13 -0.15 -2.49 1.01 -1.26 -1.59 120.40 117.19 1t7c s VAL 34 Ca 0.08 0.77 -0.08 0.00 0.00 0.00 0.00 61.98 62.76 1t7c s VAL 34 Cb -0.01 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1t7c s VAL 34 CO -0.04 0.16 0.11 -0.47 0.00 0.00 0.00 175.10 174.87 1t7c s TYR 35 N 1.88 3.44 -0.65 5.22 5.04 0.13 -4.43 117.35 127.99 1t7c s TYR 35 Ca 0.20 0.36 0.23 0.00 -2.44 0.00 0.00 57.07 55.42 1t7c s TYR 35 Cb -0.15 -2.02 0.91 0.00 0.35 0.00 0.00 41.96 41.05 1t7c s TYR 35 CO 0.09 0.48 1.71 0.41 -1.34 0.00 0.00 175.55 176.90 1t7c n GLY 36 N 2.72 -1.36 0.00 8.97 0.00 0.81 -1.43 105.19 114.89 1t7c n GLY 36 Ca -0.18 0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1t7c n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t7c n GLY 37 N 0.43 1.34 3.16 -0.02 0.00 -1.26 -1.29 105.19 107.54 1t7c n GLY 37 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 1t7c n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t7c n ARG 39 N 0.93 -6.18 -1.79 0.00 1.74 -1.26 -4.46 116.66 105.64 1t7c n ARG 39 Ca -0.20 0.70 -0.40 0.00 -0.77 0.00 0.00 57.85 57.18 1t7c n ARG 39 Cb 0.58 -5.30 0.01 0.00 -1.02 0.00 0.00 32.46 26.73 1t7c n ARG 39 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1t7c s ALA 40 N -3.23 3.34 0.79 7.54 0.00 -1.26 -4.86 121.76 124.08 1t7c s ALA 40 Ca 0.45 1.51 -0.05 0.00 0.00 0.00 0.00 51.96 53.86 1t7c s ALA 40 Cb -0.20 -3.60 0.15 0.00 0.00 0.00 0.00 23.12 19.47 1t7c s ALA 40 CO 0.55 -1.16 1.09 0.15 0.00 0.00 0.00 175.76 176.39 1t7c s LYS 41 N -2.35 1.39 0.38 0.00 1.02 -1.26 -5.00 119.74 113.92 1t7c s LYS 41 Ca 0.59 -0.88 0.19 0.00 0.02 0.00 0.00 55.97 55.89 1t7c s LYS 41 Cb -0.45 -2.18 0.70 0.00 -0.52 0.00 0.00 37.83 35.38 1t7c s LYS 41 CO 0.59 -1.72 1.74 0.00 -0.92 0.00 0.00 175.35 175.04 1t7c h ARG 42 N -0.85 0.00 -3.33 1.68 3.08 -1.95 -3.31 114.38 109.70 1t7c h ARG 42 Ca -0.39 0.00 -0.72 0.00 0.07 0.00 0.00 59.98 58.94 1t7c h ARG 42 Cb 1.26 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.24 1t7c h ARG 42 CO 0.40 0.35 2.88 -1.71 -1.07 0.00 0.00 179.97 180.83 1t7c n ASN 43 N -3.51 6.29 -3.43 7.04 5.15 -1.26 -4.70 115.26 120.85 1t7c n ASN 43 Ca -0.00 -2.91 -0.06 0.00 -0.60 0.00 0.00 54.58 51.01 1t7c n ASN 43 Cb 0.50 -1.52 -0.07 0.00 -0.53 0.00 0.00 39.78 38.15 1t7c n ASN 43 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1t7c s ASN 44 N 1.73 -0.25 0.12 1.20 3.84 -1.25 -4.50 114.94 115.84 1t7c s ASN 44 Ca 0.52 0.65 0.07 0.00 0.21 0.00 0.00 52.86 54.31 1t7c s ASN 44 Cb 0.15 1.42 -0.04 0.00 -0.55 0.00 0.00 41.25 42.24 1t7c s ASN 44 CO -0.06 -0.27 -0.16 -0.36 -2.79 0.00 0.00 177.10 173.46 1t7c s PHE 45 N 2.64 1.51 -0.81 0.43 0.40 0.48 -4.92 117.98 117.70 1t7c s PHE 45 Ca 0.08 -0.50 0.26 0.00 -0.60 0.00 0.00 56.93 56.18 1t7c s PHE 45 Cb -0.14 -0.80 0.77 0.00 0.51 0.00 0.00 43.02 43.36 1t7c s PHE 45 CO -0.16 0.17 1.66 1.63 0.70 0.00 0.00 175.22 179.22 1t7c n LYS 46 N 0.73 0.17 -3.87 0.44 5.02 -1.26 -0.60 118.16 118.79 1t7c n LYS 46 Ca -0.17 0.10 -0.11 0.00 -2.02 0.00 0.00 58.31 56.12 1t7c n LYS 46 Cb 0.56 -1.66 -0.09 0.00 -0.02 0.00 0.00 35.03 33.81 1t7c n LYS 46 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1t7c s SER 47 N -3.87 0.04 0.32 4.39 1.04 -1.26 -4.88 113.70 109.48 1t7c s SER 47 Ca 0.10 -0.27 0.02 0.00 0.48 0.00 0.00 55.95 56.28 1t7c s SER 47 Cb 0.15 0.23 0.54 0.00 0.10 0.00 0.00 66.02 67.05 1t7c s SER 47 CO 0.62 -0.44 1.90 0.00 0.98 0.00 0.00 173.24 176.31 1t7c h ALA 48 N 3.97 1.37 -0.28 5.32 0.00 -1.97 -2.58 119.26 125.09 1t7c h ALA 48 Ca -0.31 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1t7c h ALA 48 Cb 1.19 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1t7c h ALA 48 CO 0.44 0.47 0.14 1.49 0.00 0.00 0.00 179.25 181.79 1t7c h GLU 49 N 0.73 0.40 -0.52 0.00 4.81 -1.99 -0.21 114.58 117.81 1t7c h GLU 49 Ca 0.17 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.39 1t7c h GLU 49 Cb 0.17 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 1t7c h GLU 49 CO -0.01 0.37 0.28 -0.44 -0.73 0.00 0.00 179.01 178.48 1t7c h ASP 50 N 0.33 0.42 -0.01 1.04 3.32 -1.92 -0.75 116.42 118.84 1t7c h ASP 50 Ca 0.10 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.18 1t7c h ASP 50 Cb 0.10 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1t7c h ASP 50 CO -0.01 0.29 -0.04 0.00 -1.72 0.00 0.00 179.24 177.76 1t7c h LEU 52 N -0.07 0.31 -0.95 0.00 3.38 -0.73 0.30 115.31 117.56 1t7c h LEU 52 Ca 0.02 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1t7c h LEU 52 Cb 0.10 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1t7c h LEU 52 CO -0.05 0.47 -0.27 0.03 0.09 0.00 0.00 178.44 178.71 1t7c h ARG 53 N 0.31 0.00 0.01 1.13 3.08 -0.87 -0.54 114.38 117.50 1t7c h ARG 53 Ca 0.06 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.74 1t7c h ARG 53 Cb 0.42 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.41 1t7c h ARG 53 CO 0.02 0.27 -2.34 2.41 -1.07 0.00 0.00 179.97 179.26 1t7c n THR 54 N -3.39 1.50 0.04 2.04 -1.04 -0.72 -4.71 114.28 108.00 1t7c n THR 54 Ca 0.00 -0.69 0.00 0.00 -2.04 0.00 0.00 64.05 61.33 1t7c n THR 54 Cb 0.47 -1.13 -0.00 0.00 -1.82 0.00 0.00 70.33 67.86 1t7c n THR 54 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1t7c n GLY 56 N 0.59 0.60 1.64 0.00 0.00 -0.21 -1.39 105.19 106.41 1t7c n GLY 56 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 46.02 46.81 1t7c n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t7c n GLY 57 N 3.09 1.06 0.00 -0.02 0.00 -1.26 -4.96 105.19 103.10 1t7c n GLY 57 Ca 0.21 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.30 1t7c n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32