#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y62 n PRO 4 N 0.00 0.85 0.23 -0.14 -0.02 -1.26 -4.91 135.00 129.75 1y62 n PRO 4 Ca 0.00 0.34 0.08 0.00 -2.02 0.00 0.00 63.50 61.90 1y62 n PRO 4 Cb 0.00 -2.34 0.57 0.00 -0.02 0.00 0.00 33.50 31.71 1y62 n PRO 4 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1y62 h SER 5 N 0.24 0.00 -0.17 2.55 0.87 -2.03 -2.77 113.55 112.25 1y62 h SER 5 Ca -0.49 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.12 1y62 h SER 5 Cb 1.35 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.30 1y62 h SER 5 CO 0.50 0.18 0.12 0.17 -0.53 0.00 0.00 176.83 177.27 1y62 h LEU 6 N 0.00 0.00 -2.39 2.23 8.10 -1.96 -2.60 115.31 118.69 1y62 h LEU 6 Ca -0.00 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.98 1y62 h LEU 6 Cb 0.36 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.58 1y62 h LEU 6 CO 0.02 0.00 -0.03 0.00 -4.11 0.00 0.00 178.44 174.33 1y62 n ASP 8 N -3.30 0.90 -4.74 0.00 8.00 -0.98 -4.38 116.55 112.06 1y62 n ASP 8 Ca -0.02 -0.73 -0.33 0.00 0.71 0.00 0.00 54.79 54.41 1y62 n ASP 8 Cb 0.16 0.18 0.08 0.00 -0.02 0.00 0.00 41.12 41.52 1y62 n ASP 8 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1y62 s LEU 9 N -2.64 3.27 0.34 0.64 1.43 -0.88 -4.93 118.68 115.92 1y62 s LEU 9 Ca 0.20 2.15 -0.09 0.00 -1.03 0.00 0.00 54.13 55.37 1y62 s LEU 9 Cb 0.19 -4.57 -0.06 0.00 0.03 0.00 0.00 46.19 41.78 1y62 s LEU 9 CO 0.57 -2.08 0.67 -2.16 0.23 0.00 0.00 176.35 173.58 1y62 s PRO 10 N -4.15 3.74 0.22 1.29 0.04 -1.26 -4.89 135.00 129.99 1y62 s PRO 10 Ca 0.69 0.30 -0.31 0.00 0.04 0.00 0.00 61.00 61.72 1y62 s PRO 10 Cb -0.24 -2.51 -0.11 0.00 0.04 0.00 0.00 34.50 31.68 1y62 s PRO 10 CO 0.46 0.09 1.63 0.00 0.04 0.00 0.00 177.00 179.22 1y62 s ALA 11 N -2.20 3.83 -0.20 8.56 0.00 -1.26 -4.87 121.76 125.61 1y62 s ALA 11 Ca 0.48 1.50 -0.01 0.00 0.00 0.00 0.00 51.96 53.93 1y62 s ALA 11 Cb -0.10 -3.65 0.06 0.00 0.00 0.00 0.00 23.12 19.42 1y62 s ALA 11 CO 0.29 -0.88 -0.00 0.34 0.00 0.00 0.00 175.76 175.51 1y62 s ASP 12 N 0.96 3.20 0.59 0.00 -1.08 -1.26 -5.01 116.67 114.07 1y62 s ASP 12 Ca 0.70 -0.92 0.29 0.00 -0.52 0.00 0.00 52.55 52.10 1y62 s ASP 12 Cb -0.47 -0.81 1.75 0.00 -1.46 0.00 0.00 42.92 41.93 1y62 s ASP 12 CO 0.36 -0.27 2.19 0.28 0.52 0.00 0.00 175.17 178.25 1y62 h SER 13 N 8.14 0.00 -0.63 -0.34 0.02 -1.94 -3.41 113.55 115.39 1y62 h SER 13 Ca -0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1y62 h SER 13 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1y62 h SER 13 CO 0.37 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.67 1y62 n GLY 14 N -1.36 -1.78 0.00 -3.77 0.00 -1.26 -0.56 105.19 96.46 1y62 n GLY 14 Ca -0.01 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1y62 n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y62 n SER 15 N 0.05 1.22 -2.23 1.61 3.41 -0.63 -4.83 113.62 112.22 1y62 n SER 15 Ca 0.00 -1.34 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 1y62 n SER 15 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1y62 n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y62 n GLY 16 N -0.17 -1.52 0.00 5.00 0.00 -1.23 -4.93 105.19 102.34 1y62 n GLY 16 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1y62 n GLY 16 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1y62 n THR 17 N -2.01 0.33 -2.54 2.61 -1.04 -1.04 -4.84 114.28 105.76 1y62 n THR 17 Ca 0.00 -0.67 -0.29 0.00 -2.04 0.00 0.00 64.05 61.06 1y62 n THR 17 Cb 0.00 0.83 -0.01 0.00 -1.82 0.00 0.00 70.33 69.34 1y62 n THR 17 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1y62 s LYS 18 N -0.33 3.60 -0.67 -2.82 1.02 -0.30 -5.04 119.74 115.19 1y62 s LYS 18 Ca 0.00 0.36 -0.02 0.00 0.02 0.00 0.00 55.97 56.34 1y62 s LYS 18 Cb 0.00 -2.32 0.17 0.00 -0.52 0.00 0.00 37.83 35.16 1y62 s LYS 18 CO 0.00 -0.24 0.49 0.00 -0.92 0.00 0.00 175.35 174.68 1y62 s ALA 19 N -2.75 3.70 0.44 5.17 0.00 -1.26 -3.99 121.76 123.07 1y62 s ALA 19 Ca 0.50 -3.42 0.01 0.00 0.00 0.00 0.00 51.96 49.04 1y62 s ALA 19 Cb -0.10 -2.62 -0.00 0.00 0.00 0.00 0.00 23.12 20.39 1y62 s ALA 19 CO 0.44 -2.11 0.03 0.39 0.00 0.00 0.00 175.76 174.50 1y62 n GLU 20 N 3.12 0.85 -4.33 0.00 1.02 -0.43 -5.00 120.64 115.85 1y62 n GLU 20 Ca 0.11 -3.26 -0.19 0.00 -0.02 0.00 0.00 57.16 53.80 1y62 n GLU 20 Cb 0.37 1.04 -0.15 0.00 -0.02 0.00 0.00 31.44 32.68 1y62 n GLU 20 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1y62 s LYS 21 N -3.59 0.82 0.33 3.49 -0.14 -1.26 -1.57 119.74 117.83 1y62 s LYS 21 Ca 0.04 -0.27 0.03 0.00 -1.36 0.00 0.00 55.97 54.41 1y62 s LYS 21 Cb 0.00 -0.78 -0.04 0.00 -1.68 0.00 0.00 37.83 35.32 1y62 s LYS 21 CO 0.03 0.11 0.11 1.03 -0.76 0.00 0.00 175.35 175.87 1y62 s ARG 22 N 0.14 1.67 -0.14 1.68 1.81 -0.22 -4.87 118.95 119.02 1y62 s ARG 22 Ca -0.02 -1.96 -0.00 0.00 -1.72 0.00 0.00 55.73 52.03 1y62 s ARG 22 Cb -0.07 -0.49 -0.01 0.00 -0.45 0.00 0.00 34.95 33.92 1y62 s ARG 22 CO 0.00 -0.35 -0.12 0.42 -0.68 0.00 0.00 175.30 174.56 1y62 s ILE 23 N -3.44 3.06 0.08 1.52 -1.09 0.16 -1.02 121.20 120.47 1y62 s ILE 23 Ca 0.33 -0.65 0.06 0.00 -2.23 0.00 0.00 60.65 58.15 1y62 s ILE 23 Cb 0.06 -2.29 -0.03 0.00 -1.58 0.00 0.00 42.46 38.61 1y62 s ILE 23 CO 0.15 0.52 -0.15 -0.72 -1.23 0.00 0.00 174.94 173.51 1y62 s TYR 24 N 0.45 1.29 -0.19 3.97 -0.85 -0.36 0.45 117.35 122.11 1y62 s TYR 24 Ca -0.09 -0.47 -0.23 0.00 -0.52 0.00 0.00 57.07 55.76 1y62 s TYR 24 Cb -0.16 -0.72 -0.02 0.00 0.38 0.00 0.00 41.96 41.45 1y62 s TYR 24 CO 0.05 0.08 0.75 -0.47 -1.52 0.00 0.00 175.55 174.44 1y62 s TYR 25 N -1.35 3.39 -0.54 -3.49 5.04 -1.26 -1.36 117.35 117.78 1y62 s TYR 25 Ca -0.00 1.12 -0.16 0.00 -2.44 0.00 0.00 57.07 55.58 1y62 s TYR 25 Cb -0.09 -2.94 0.12 0.00 0.35 0.00 0.00 41.96 39.40 1y62 s TYR 25 CO 0.03 -0.23 0.51 1.21 -1.34 0.00 0.00 175.55 175.72 1y62 s ASN 26 N 1.20 6.19 0.45 4.32 3.84 -0.83 -4.81 114.94 125.29 1y62 s ASN 26 Ca 0.34 -1.73 0.14 0.00 0.21 0.00 0.00 52.86 51.82 1y62 s ASN 26 Cb -0.16 -2.22 1.02 0.00 -0.55 0.00 0.00 41.25 39.34 1y62 s ASN 26 CO 0.11 -0.86 2.01 0.77 -2.79 0.00 0.00 177.10 176.33 1y62 h SER 27 N 8.90 0.01 -0.57 -4.21 4.64 -1.85 -2.37 113.55 118.10 1y62 h SER 27 Ca -0.30 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.99 1y62 h SER 27 Cb 1.10 -0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.16 1y62 h SER 27 CO 1.03 0.17 0.26 0.00 -0.87 0.00 0.00 176.83 177.42 1y62 h ALA 28 N 1.83 0.74 0.00 5.18 0.00 -1.95 -3.19 119.26 121.87 1y62 h ALA 28 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1y62 h ALA 28 Cb 0.29 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1y62 h ALA 28 CO 0.02 0.33 -0.54 0.00 0.00 0.00 0.00 179.25 179.06 1y62 h ARG 29 N 0.78 0.00 -3.26 0.00 3.08 -1.91 -3.48 114.38 109.60 1y62 h ARG 29 Ca 0.19 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.05 1y62 h ARG 29 Cb 0.16 0.00 0.06 0.00 0.08 0.00 0.00 29.97 30.27 1y62 h ARG 29 CO -0.02 0.00 -0.33 1.63 -1.07 0.00 0.00 179.97 180.18 1y62 n LYS 30 N -2.19 -3.73 -3.59 0.04 5.02 -0.92 -5.05 118.16 107.73 1y62 n LYS 30 Ca 0.03 0.42 -0.16 0.00 -2.02 0.00 0.00 58.31 56.58 1y62 n LYS 30 Cb 0.45 -4.21 -0.07 0.00 -0.02 0.00 0.00 35.03 31.18 1y62 n LYS 30 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1y62 s GLN 31 N -5.57 0.92 -0.46 1.97 -2.07 -1.20 -5.07 119.66 108.18 1y62 s GLN 31 Ca 0.27 0.35 -0.26 0.00 -1.82 0.00 0.00 55.36 53.90 1y62 s GLN 31 Cb -0.12 0.43 0.03 0.00 -1.09 0.00 0.00 33.01 32.26 1y62 s GLN 31 CO 0.33 -0.25 0.98 0.00 -1.32 0.00 0.00 175.29 175.04 1y62 s LEU 33 N 3.93 3.40 0.03 0.00 1.43 -0.46 -4.90 118.68 122.11 1y62 s LEU 33 Ca 0.40 -0.73 -0.12 0.00 -1.03 0.00 0.00 54.13 52.65 1y62 s LEU 33 Cb -0.09 -2.02 -0.06 0.00 0.03 0.00 0.00 46.19 44.05 1y62 s LEU 33 CO 0.27 -0.58 0.39 -0.60 0.23 0.00 0.00 176.35 176.06 1y62 s ARG 34 N -4.08 3.81 0.11 1.70 3.52 -1.26 -1.22 118.95 121.53 1y62 s ARG 34 Ca 0.46 0.26 -0.09 0.00 -0.13 0.00 0.00 55.73 56.24 1y62 s ARG 34 Cb -0.03 -3.10 -0.00 0.00 -1.56 0.00 0.00 34.95 30.25 1y62 s ARG 34 CO 0.27 0.63 0.22 -0.59 -0.81 0.00 0.00 175.30 175.02 1y62 s PHE 35 N -1.24 0.24 -0.03 5.12 -0.12 -0.19 -4.94 117.98 116.82 1y62 s PHE 35 Ca 0.28 -0.65 -0.30 0.00 -0.05 0.00 0.00 56.93 56.22 1y62 s PHE 35 Cb -0.15 -0.06 -0.03 0.00 -0.63 0.00 0.00 43.02 42.15 1y62 s PHE 35 CO 0.15 -0.60 0.98 -0.51 -0.05 0.00 0.00 175.22 175.19 1y62 s ASP 36 N -2.90 7.32 0.05 1.98 1.01 -1.26 -1.06 116.67 121.81 1y62 s ASP 36 Ca 0.09 1.60 0.08 0.00 0.71 0.00 0.00 52.55 55.03 1y62 s ASP 36 Cb 0.04 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.39 1y62 s ASP 36 CO -0.07 -0.30 -0.22 -0.47 0.21 0.00 0.00 175.17 174.31 1y62 s TYR 37 N 1.27 1.91 -2.70 4.23 5.04 -0.61 -4.14 117.35 122.35 1y62 s TYR 37 Ca 0.50 -0.38 0.24 0.00 -2.44 0.00 0.00 57.07 54.99 1y62 s TYR 37 Cb -0.20 -1.13 0.47 0.00 0.35 0.00 0.00 41.96 41.45 1y62 s TYR 37 CO 0.25 0.11 1.42 0.25 -1.34 0.00 0.00 175.55 176.24 1y62 n THR 38 N 1.74 0.15 0.00 4.34 -2.24 0.27 -1.32 114.28 117.22 1y62 n THR 38 Ca -0.17 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 1y62 n THR 38 Cb 0.53 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.83 1y62 n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y62 n GLY 39 N 1.33 3.35 3.07 3.38 0.00 -1.26 -1.15 105.19 113.91 1y62 n GLY 39 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 1y62 n GLY 39 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1y62 s GLN 40 N -0.70 0.53 3.45 1.61 -0.21 -1.26 -4.94 119.66 118.15 1y62 s GLN 40 Ca 0.00 -0.93 0.00 0.00 0.02 0.00 0.00 55.36 54.45 1y62 s GLN 40 Cb 0.00 0.19 0.00 0.00 1.00 0.00 0.00 33.01 34.20 1y62 s GLN 40 CO 0.00 -0.11 0.00 0.41 -2.12 0.00 0.00 175.29 173.47 1y62 n GLY 41 N 0.68 0.18 7.00 3.09 0.00 -1.26 -1.60 105.19 113.27 1y62 n GLY 41 Ca -0.18 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1y62 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y62 n GLY 42 N 0.00 0.17 3.02 -0.02 0.00 -1.26 -4.78 105.19 102.33 1y62 n GLY 42 Ca 0.00 -0.97 -0.19 0.00 0.00 0.00 0.00 46.02 44.85 1y62 n GLY 42 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1y62 n ASN 43 N 2.40 -0.41 0.31 1.61 0.23 -1.26 -4.98 115.26 113.16 1y62 n ASN 43 Ca 0.00 -3.05 0.20 0.00 -0.53 0.00 0.00 54.58 51.20 1y62 n ASN 43 Cb 0.00 1.49 0.94 0.00 -2.08 0.00 0.00 39.78 40.13 1y62 n ASN 43 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1y62 h GLU 44 N 0.00 0.00 -3.98 -3.83 4.39 -1.93 -3.33 114.58 105.90 1y62 h GLU 44 Ca -0.23 0.00 -0.71 0.00 0.34 0.00 0.00 59.36 58.75 1y62 h GLU 44 Cb 1.13 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.72 1y62 h GLU 44 CO 0.34 0.00 2.99 -1.71 -1.16 0.00 0.00 179.01 179.47 1y62 n ASN 45 N -3.10 4.04 -3.40 1.42 5.15 -1.26 -4.75 115.26 113.37 1y62 n ASN 45 Ca -0.01 -2.87 -0.09 0.00 -0.60 0.00 0.00 54.58 51.01 1y62 n ASN 45 Cb 0.19 -1.64 -0.08 0.00 -0.53 0.00 0.00 39.78 37.72 1y62 n ASN 45 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1y62 s ASN 46 N 2.94 0.10 0.04 1.20 3.84 -1.25 -4.46 114.94 117.35 1y62 s ASN 46 Ca 0.46 0.39 0.06 0.00 0.21 0.00 0.00 52.86 53.98 1y62 s ASN 46 Cb 0.13 1.19 -0.02 0.00 -0.55 0.00 0.00 41.25 42.00 1y62 s ASN 46 CO -0.08 -0.29 -0.18 -0.36 -2.79 0.00 0.00 177.10 173.41 1y62 s PHE 47 N 2.57 1.55 0.02 0.43 0.40 0.17 -4.91 117.98 118.21 1y62 s PHE 47 Ca 0.10 -0.36 0.10 0.00 -0.60 0.00 0.00 56.93 56.18 1y62 s PHE 47 Cb -0.15 -0.93 -0.14 0.00 0.51 0.00 0.00 43.02 42.32 1y62 s PHE 47 CO -0.15 0.06 1.26 0.00 0.70 0.00 0.00 175.22 177.08 1y62 h ARG 48 N 4.96 0.00 -5.74 0.44 3.08 -1.92 0.46 114.38 115.65 1y62 h ARG 48 Ca -0.40 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 58.98 1y62 h ARG 48 Cb 1.17 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 30.90 1y62 h ARG 48 CO 0.44 0.80 -0.88 1.03 -1.07 0.00 0.00 179.97 180.29 1y62 s ARG 49 N -2.78 2.59 0.43 0.04 0.52 -1.26 -4.80 118.95 113.70 1y62 s ARG 49 Ca 0.01 -0.86 0.13 0.00 -0.52 0.00 0.00 55.73 54.49 1y62 s ARG 49 Cb 0.09 -2.13 1.01 0.00 0.52 0.00 0.00 34.95 34.45 1y62 s ARG 49 CO 0.80 0.31 2.00 1.15 0.02 0.00 0.00 175.30 179.58 1y62 h THR 50 N 5.27 0.93 -0.09 0.02 2.02 -1.97 -1.93 112.91 117.17 1y62 h THR 50 Ca -0.28 -0.14 -0.15 0.00 0.77 0.00 0.00 66.41 66.61 1y62 h THR 50 Cb 1.19 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1y62 h THR 50 CO 0.47 0.08 -0.59 0.22 0.37 0.00 0.00 175.52 176.07 1y62 h TYR 51 N 0.42 0.36 -0.22 3.16 3.20 -1.98 -0.12 116.97 121.79 1y62 h TYR 51 Ca 0.25 -0.14 -0.09 0.00 3.14 0.00 0.00 58.73 61.89 1y62 h TYR 51 Cb 0.43 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1y62 h TYR 51 CO -0.00 0.80 -0.25 -0.44 -1.64 0.00 0.00 178.16 176.63 1y62 h ASP 52 N 0.21 0.41 -0.25 -2.11 3.32 -1.79 0.56 116.42 116.78 1y62 h ASP 52 Ca -0.00 -0.13 -0.10 0.00 0.02 0.00 0.00 57.03 56.81 1y62 h ASP 52 Cb 1.09 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.53 1y62 h ASP 52 CO 0.09 0.66 -0.25 0.00 -1.72 0.00 0.00 179.24 178.02 1y62 h GLN 54 N 0.33 0.46 0.00 0.00 4.20 -0.51 0.64 115.11 120.23 1y62 h GLN 54 Ca 0.04 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1y62 h GLN 54 Cb 0.81 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.53 1y62 h GLN 54 CO 0.06 0.53 0.00 2.89 -0.67 0.00 0.00 178.83 181.64 1y62 n ARG 55 N -4.69 0.11 -0.13 1.46 1.85 0.14 -0.43 116.66 114.98 1y62 n ARG 55 Ca -0.02 0.10 -0.18 0.00 -1.00 0.00 0.00 57.85 56.74 1y62 n ARG 55 Cb 0.18 -1.50 -0.12 0.00 -1.05 0.00 0.00 32.46 29.97 1y62 n ARG 55 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1y62 n THR 56 N -1.43 1.49 0.02 8.89 -1.04 -1.07 -4.80 114.28 116.34 1y62 n THR 56 Ca 0.07 -0.57 0.02 0.00 -2.04 0.00 0.00 64.05 61.54 1y62 n THR 56 Cb 0.24 -1.43 -0.03 0.00 -1.82 0.00 0.00 70.33 67.28 1y62 n THR 56 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43