#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y62 s PRO 4 N 0.00 3.96 0.55 2.89 0.02 -1.26 -4.92 135.00 136.23 1y62 s PRO 4 Ca 0.00 2.09 0.25 0.00 0.02 0.00 0.00 61.00 63.36 1y62 s PRO 4 Cb 0.00 -2.72 1.45 0.00 0.02 0.00 0.00 34.50 33.25 1y62 s PRO 4 CO 0.00 -0.48 2.06 0.77 -0.33 0.00 0.00 177.00 179.01 1y62 h SER 5 N 2.63 0.00 -0.28 2.53 0.02 -2.02 -1.58 113.55 114.85 1y62 h SER 5 Ca -0.49 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 60.54 1y62 h SER 5 Cb 1.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 1y62 h SER 5 CO 0.62 0.00 0.24 0.17 -1.14 0.00 0.00 176.83 176.72 1y62 h LEU 6 N 0.00 0.00 -1.64 5.07 8.10 -1.96 -0.42 115.31 124.46 1y62 h LEU 6 Ca 0.15 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 58.10 1y62 h LEU 6 Cb 0.65 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.87 1y62 h LEU 6 CO -0.00 0.00 -0.18 0.00 -4.11 0.00 0.00 178.44 174.15 1y62 n ASP 8 N -4.32 1.04 -4.77 0.00 8.00 -0.17 -4.51 116.55 111.82 1y62 n ASP 8 Ca -0.02 -1.32 -0.38 0.00 0.71 0.00 0.00 54.79 53.77 1y62 n ASP 8 Cb 0.24 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.30 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 -2.02 4.37 0.72 0.64 1.43 -0.72 -5.00 118.68 118.10 1y62 s LEU 9 Ca 0.40 2.06 -0.13 0.00 -1.03 0.00 0.00 54.13 55.44 1y62 s LEU 9 Cb 0.21 -3.91 0.03 0.00 0.03 0.00 0.00 46.19 42.55 1y62 s LEU 9 CO 0.35 -0.23 1.10 -2.16 0.23 0.00 0.00 176.35 175.65 1y62 s PRO 10 N -1.93 2.50 0.21 1.29 0.04 -1.26 -4.87 135.00 130.98 1y62 s PRO 10 Ca 0.50 1.28 -0.30 0.00 0.04 0.00 0.00 61.00 62.52 1y62 s PRO 10 Cb -0.25 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 1y62 s PRO 10 CO 0.32 -1.47 1.41 0.00 0.04 0.00 0.00 177.00 177.29 1y62 s ALA 11 N -2.62 3.61 -0.12 8.56 0.00 -1.26 -4.87 121.76 125.06 1y62 s ALA 11 Ca 0.64 1.24 -0.00 0.00 0.00 0.00 0.00 51.96 53.84 1y62 s ALA 11 Cb -0.19 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.42 1y62 s ALA 11 CO 0.49 -0.67 -0.09 0.34 0.00 0.00 0.00 175.76 175.83 1y62 s ASP 12 N 0.52 2.23 0.58 0.00 -1.08 -1.26 -5.02 116.67 112.64 1y62 s ASP 12 Ca 0.60 -0.33 0.36 0.00 -0.52 0.00 0.00 52.55 52.67 1y62 s ASP 12 Cb -0.40 -0.89 1.61 0.00 -1.46 0.00 0.00 42.92 41.78 1y62 s ASP 12 CO 0.39 -0.10 2.07 0.28 0.52 0.00 0.00 175.17 178.33 1y62 h SER 13 N 8.09 0.00 -3.65 -0.34 0.02 -1.95 -3.42 113.55 112.30 1y62 h SER 13 Ca -0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1y62 h SER 13 Cb 1.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.67 1y62 h SER 13 CO 0.43 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.73 1y62 n GLY 14 N -0.21 -1.91 0.13 -3.77 0.00 -1.26 -1.23 105.19 96.94 1y62 n GLY 14 Ca -0.00 -1.63 0.09 0.00 0.00 0.00 0.00 46.02 44.48 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 0.55 2.19 -2.79 1.61 3.41 -0.14 -4.85 113.62 113.59 1y62 n SER 15 Ca 0.00 -3.08 -0.09 0.00 -0.26 0.00 0.00 58.87 55.45 1y62 n SER 15 Cb 0.00 -0.42 0.05 0.00 -0.26 0.00 0.00 64.21 63.58 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 -1.34 0.03 0.12 5.00 0.00 -1.23 -4.94 105.19 102.84 1y62 n GLY 16 Ca 0.15 -1.88 0.01 0.00 0.00 0.00 0.00 46.02 44.31 1y62 n GLY 16 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1y62 n THR 17 N -2.14 0.34 -2.20 2.61 -2.24 -1.19 -4.83 114.28 104.64 1y62 n THR 17 Ca 0.06 -0.67 -0.28 0.00 -2.27 0.00 0.00 64.05 60.89 1y62 n THR 17 Cb 0.20 0.87 0.05 0.00 -2.10 0.00 0.00 70.33 69.34 1y62 n THR 17 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1y62 s LYS 18 N -0.49 2.71 -0.48 -0.78 1.02 -0.39 -5.05 119.74 116.28 1y62 s LYS 18 Ca 0.04 0.08 0.03 0.00 0.02 0.00 0.00 55.97 56.14 1y62 s LYS 18 Cb 0.02 -2.17 0.13 0.00 -0.52 0.00 0.00 37.83 35.29 1y62 s LYS 18 CO 0.04 -0.94 0.23 0.00 -0.92 0.00 0.00 175.35 173.76 1y62 s ALA 19 N -3.17 2.97 0.38 5.17 0.00 -1.26 -4.00 121.76 121.85 1y62 s ALA 19 Ca 0.57 -3.01 0.06 0.00 0.00 0.00 0.00 51.96 49.57 1y62 s ALA 19 Cb -0.11 -2.07 -0.07 0.00 0.00 0.00 0.00 23.12 20.87 1y62 s ALA 19 CO 0.47 -1.99 0.02 -1.21 0.00 0.00 0.00 175.76 173.05 1y62 s GLU 20 N 0.01 1.86 -0.10 0.00 2.02 0.45 -4.99 118.70 117.96 1y62 s GLU 20 Ca 0.16 -2.05 0.03 0.00 0.02 0.00 0.00 54.97 53.14 1y62 s GLU 20 Cb -0.25 -1.40 -0.01 0.00 0.10 0.00 0.00 34.13 32.57 1y62 s GLU 20 CO -0.01 -0.09 -0.19 0.15 0.02 0.00 0.00 175.26 175.13 1y62 s LYS 21 N -3.77 3.05 0.29 1.61 -0.14 -1.26 -0.97 119.74 118.55 1y62 s LYS 21 Ca 0.35 -0.80 0.02 0.00 -1.36 0.00 0.00 55.97 54.19 1y62 s LYS 21 Cb 0.10 -2.41 -0.05 0.00 -1.68 0.00 0.00 37.83 33.79 1y62 s LYS 21 CO 0.17 0.26 0.11 1.03 -0.76 0.00 0.00 175.35 176.17 1y62 s ARG 22 N 0.17 1.52 0.03 1.68 1.81 -0.75 -4.90 118.95 118.51 1y62 s ARG 22 Ca -0.11 -1.84 0.05 0.00 -1.72 0.00 0.00 55.73 52.11 1y62 s ARG 22 Cb -0.16 -0.29 -0.03 0.00 -0.45 0.00 0.00 34.95 34.02 1y62 s ARG 22 CO 0.06 -0.34 -0.13 0.42 -0.68 0.00 0.00 175.30 174.63 1y62 s ILE 23 N -3.64 3.20 0.03 1.52 -1.09 0.76 -1.71 121.20 120.27 1y62 s ILE 23 Ca 0.36 -1.02 -0.03 0.00 -2.23 0.00 0.00 60.65 57.73 1y62 s ILE 23 Cb 0.07 -2.38 -0.02 0.00 -1.58 0.00 0.00 42.46 38.55 1y62 s ILE 23 CO 0.15 0.34 0.02 -0.72 -1.23 0.00 0.00 174.94 173.50 1y62 s TYR 24 N -0.98 0.29 -0.16 3.97 -0.85 -0.02 -0.19 117.35 119.41 1y62 s TYR 24 Ca 0.16 -0.64 -0.18 0.00 -0.52 0.00 0.00 57.07 55.90 1y62 s TYR 24 Cb -0.11 -0.22 -0.04 0.00 0.38 0.00 0.00 41.96 41.98 1y62 s TYR 24 CO 0.07 -0.30 0.48 -0.47 -1.52 0.00 0.00 175.55 173.81 1y62 s TYR 25 N -2.47 3.44 -0.53 -3.49 5.04 -1.26 -1.04 117.35 117.05 1y62 s TYR 25 Ca -0.06 0.81 -0.16 0.00 -2.44 0.00 0.00 57.07 55.21 1y62 s TYR 25 Cb -0.02 -2.59 0.11 0.00 0.35 0.00 0.00 41.96 39.82 1y62 s TYR 25 CO -0.04 0.05 0.49 1.21 -1.34 0.00 0.00 175.55 175.92 1y62 s ASN 26 N 0.86 6.18 0.53 4.32 3.84 0.74 -4.83 114.94 126.59 1y62 s ASN 26 Ca 0.24 -1.65 0.23 0.00 0.21 0.00 0.00 52.86 51.89 1y62 s ASN 26 Cb -0.15 -2.21 1.39 0.00 -0.55 0.00 0.00 41.25 39.73 1y62 s ASN 26 CO 0.10 -0.83 2.06 0.28 -2.79 0.00 0.00 177.10 175.92 1y62 h SER 27 N 8.88 0.00 0.06 -4.21 0.02 -1.85 0.39 113.55 116.83 1y62 h SER 27 Ca -0.30 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1y62 h SER 27 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1y62 h SER 27 CO 1.00 0.00 -0.03 0.00 -1.14 0.00 0.00 176.83 176.67 1y62 h ALA 28 N 1.82 -0.08 -0.00 3.77 0.00 -1.96 -3.25 119.26 119.57 1y62 h ALA 28 Ca 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1y62 h ALA 28 Cb 0.62 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1y62 h ALA 28 CO -0.00 -0.22 -0.09 0.54 0.00 0.00 0.00 179.25 179.48 1y62 n ARG 29 N -4.83 0.61 -3.94 0.00 1.74 -1.05 -4.93 116.66 104.25 1y62 n ARG 29 Ca -0.08 -0.17 -0.26 0.00 -0.77 0.00 0.00 57.85 56.56 1y62 n ARG 29 Cb 0.30 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.23 1y62 n ARG 29 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1y62 n LYS 30 N -1.04 -3.74 -3.96 5.56 5.02 0.13 -4.98 118.16 115.15 1y62 n LYS 30 Ca 0.14 0.45 -0.08 0.00 -2.02 0.00 0.00 58.31 56.80 1y62 n LYS 30 Cb 0.27 -4.79 -0.09 0.00 -0.02 0.00 0.00 35.03 30.40 1y62 n LYS 30 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1y62 s GLN 31 N -6.51 0.65 -0.53 1.97 -1.52 -1.09 -4.98 119.66 107.65 1y62 s GLN 31 Ca 0.15 -0.95 -0.16 0.00 -1.95 0.00 0.00 55.36 52.45 1y62 s GLN 31 Cb -0.08 0.25 0.12 0.00 -0.22 0.00 0.00 33.01 33.08 1y62 s GLN 31 CO 0.88 -0.16 0.49 0.00 -0.25 0.00 0.00 175.29 176.24 1y62 s LEU 33 N 1.66 3.59 0.56 0.00 2.01 -0.20 -4.83 118.68 121.46 1y62 s LEU 33 Ca 0.04 -0.52 -0.08 0.00 0.01 0.00 0.00 54.13 53.57 1y62 s LEU 33 Cb -0.29 -2.25 -0.03 0.00 0.01 0.00 0.00 46.19 43.64 1y62 s LEU 33 CO 0.04 -0.45 0.91 -0.13 1.01 0.00 0.00 176.35 177.73 1y62 s ARG 34 N -4.06 3.45 0.13 1.70 0.52 -1.26 -0.84 118.95 118.59 1y62 s ARG 34 Ca 0.44 0.40 -0.24 0.00 -0.52 0.00 0.00 55.73 55.80 1y62 s ARG 34 Cb -0.06 -2.23 0.08 0.00 0.52 0.00 0.00 34.95 33.26 1y62 s ARG 34 CO 0.28 -0.45 0.65 -0.59 0.02 0.00 0.00 175.30 175.20 1y62 s PHE 35 N -2.97 -0.51 -0.10 -0.53 -0.12 -0.70 -4.87 117.98 108.18 1y62 s PHE 35 Ca 0.52 0.31 -0.24 0.00 -0.05 0.00 0.00 56.93 57.47 1y62 s PHE 35 Cb -0.11 0.56 -0.03 0.00 -0.63 0.00 0.00 43.02 42.81 1y62 s PHE 35 CO 0.49 -0.80 0.73 -0.51 -0.05 0.00 0.00 175.22 175.08 1y62 s ASP 36 N -2.70 6.95 -0.04 1.98 1.01 -1.26 -1.80 116.67 120.81 1y62 s ASP 36 Ca 0.02 1.15 0.07 0.00 0.71 0.00 0.00 52.55 54.50 1y62 s ASP 36 Cb -0.01 -2.42 -0.02 0.00 1.01 0.00 0.00 42.92 41.49 1y62 s ASP 36 CO -0.12 -0.20 -0.25 -0.47 0.21 0.00 0.00 175.17 174.34 1y62 s TYR 37 N 1.24 2.32 -2.37 4.23 5.04 -0.14 -4.27 117.35 123.40 1y62 s TYR 37 Ca 0.37 -0.55 0.28 0.00 -2.44 0.00 0.00 57.07 54.73 1y62 s TYR 37 Cb -0.17 -1.51 1.18 0.00 0.35 0.00 0.00 41.96 41.81 1y62 s TYR 37 CO 0.16 -0.12 1.81 0.25 -1.34 0.00 0.00 175.55 176.32 1y62 n THR 38 N 2.68 0.02 -0.73 4.34 -2.24 -0.37 -0.41 114.28 117.57 1y62 n THR 38 Ca -0.17 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1y62 n THR 38 Cb 0.52 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 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 1.13 0.64 3.52 3.38 0.00 -1.26 -1.26 105.19 111.34 1y62 n GLY 39 Ca 0.20 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 1y62 n GLY 39 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1y62 s GLN 40 N -0.27 0.84 3.42 1.61 0.74 -1.26 -4.92 119.66 119.82 1y62 s GLN 40 Ca 0.00 0.63 0.00 0.00 0.05 0.00 0.00 55.36 56.04 1y62 s GLN 40 Cb 0.00 0.40 0.00 0.00 1.10 0.00 0.00 33.01 34.51 1y62 s GLN 40 CO 0.00 -0.17 0.00 0.41 -0.55 0.00 0.00 175.29 174.98 1y62 n GLY 41 N 2.09 0.18 3.92 2.59 0.00 -1.26 -0.97 105.19 111.74 1y62 n GLY 41 Ca -0.16 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 0.09 2.84 -0.02 0.00 -1.26 -4.74 105.19 102.10 1y62 n GLY 42 Ca 0.00 -1.36 -0.14 0.00 0.00 0.00 0.00 46.02 44.52 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 1.17 -1.02 0.28 1.61 0.23 -1.26 -4.97 115.26 111.29 1y62 n ASN 43 Ca 0.00 -2.68 0.16 0.00 -0.53 0.00 0.00 54.58 51.52 1y62 n ASN 43 Cb 0.00 1.99 0.81 0.00 -2.08 0.00 0.00 39.78 40.50 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 -3.76 -3.83 4.39 -1.95 -3.32 114.58 106.11 1y62 h GLU 44 Ca -0.22 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 58.82 1y62 h GLU 44 Cb 1.02 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.67 1y62 h GLU 44 CO 0.31 0.07 3.14 -1.71 -1.16 0.00 0.00 179.01 179.66 1y62 n ASN 45 N -3.38 5.03 -3.61 1.42 2.85 -1.26 -4.69 115.26 111.62 1y62 n ASN 45 Ca -0.01 -2.69 -0.09 0.00 -0.11 0.00 0.00 54.58 51.67 1y62 n ASN 45 Cb 0.23 -1.49 -0.10 0.00 1.24 0.00 0.00 39.78 39.66 1y62 n ASN 45 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 1y62 s ASN 46 N 3.25 -0.06 0.03 1.20 3.84 -1.25 -4.51 114.94 117.43 1y62 s ASN 46 Ca 0.54 0.80 0.04 0.00 0.21 0.00 0.00 52.86 54.45 1y62 s ASN 46 Cb 0.15 1.20 -0.02 0.00 -0.55 0.00 0.00 41.25 42.03 1y62 s ASN 46 CO -0.04 -0.24 -0.11 -0.36 -2.79 0.00 0.00 177.10 173.55 1y62 s PHE 47 N 2.57 1.00 0.03 0.43 0.40 0.73 -4.94 117.98 118.20 1y62 s PHE 47 Ca 0.01 -0.32 0.10 0.00 -0.60 0.00 0.00 56.93 56.12 1y62 s PHE 47 Cb -0.13 -0.60 -0.14 0.00 0.51 0.00 0.00 43.02 42.66 1y62 s PHE 47 CO -0.12 0.00 1.25 0.00 0.70 0.00 0.00 175.22 177.05 1y62 h ARG 48 N 5.13 0.00 -5.79 0.44 3.08 -1.93 0.22 114.38 115.53 1y62 h ARG 48 Ca -0.35 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.04 1y62 h ARG 48 Cb 1.18 0.00 -0.31 0.00 0.08 0.00 0.00 29.97 30.92 1y62 h ARG 48 CO 0.45 0.80 -0.87 1.03 -1.07 0.00 0.00 179.97 180.31 1y62 s ARG 49 N -2.77 2.33 0.23 0.04 0.52 -1.26 -4.79 118.95 113.24 1y62 s ARG 49 Ca 0.01 -0.82 -0.06 0.00 -0.52 0.00 0.00 55.73 54.34 1y62 s ARG 49 Cb 0.09 -1.98 0.34 0.00 0.52 0.00 0.00 34.95 33.92 1y62 s ARG 49 CO 0.80 0.34 1.79 1.15 0.02 0.00 0.00 175.30 179.40 1y62 h THR 50 N 5.13 0.88 0.00 0.02 2.02 -1.95 -2.18 112.91 116.82 1y62 h THR 50 Ca -0.32 -0.23 -0.04 0.00 0.77 0.00 0.00 66.41 66.60 1y62 h THR 50 Cb 1.18 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 1y62 h THR 50 CO 0.47 0.12 -0.18 0.22 0.37 0.00 0.00 175.52 176.53 1y62 h TYR 51 N 0.66 0.00 -0.31 3.16 3.20 -1.98 -0.53 116.97 121.17 1y62 h TYR 51 Ca 0.36 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 62.07 1y62 h TYR 51 Cb 0.34 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1y62 h TYR 51 CO -0.09 0.18 -0.43 -0.44 -1.64 0.00 0.00 178.16 175.73 1y62 h ASP 52 N 0.00 0.85 -0.27 -2.11 3.32 -1.82 -1.44 116.42 114.94 1y62 h ASP 52 Ca -0.00 -0.40 -0.08 0.00 0.02 0.00 0.00 57.03 56.57 1y62 h ASP 52 Cb 0.35 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1y62 h ASP 52 CO 0.02 1.16 -0.08 0.00 -1.72 0.00 0.00 179.24 178.62 1y62 h GLN 54 N 0.61 -0.23 0.00 0.00 4.20 -0.85 0.26 115.11 119.10 1y62 h GLN 54 Ca 0.11 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1y62 h GLN 54 Cb 0.51 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1y62 h GLN 54 CO 0.03 0.10 0.00 2.89 -0.67 0.00 0.00 178.83 181.18 1y62 n ARG 55 N -5.04 0.06 -0.10 1.46 1.85 -0.57 -0.83 116.66 113.50 1y62 n ARG 55 Ca -0.09 0.33 -0.24 0.00 -1.00 0.00 0.00 57.85 56.85 1y62 n ARG 55 Cb 0.23 -1.62 -0.12 0.00 -1.05 0.00 0.00 32.46 29.90 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 -1.74 1.57 -0.02 8.89 -1.04 -0.94 -4.74 114.28 116.26 1y62 n THR 56 Ca 0.03 -0.34 0.05 0.00 -2.04 0.00 0.00 64.05 61.75 1y62 n THR 56 Cb 0.17 -1.84 -0.12 0.00 -1.82 0.00 0.00 70.33 66.72 1y62 n THR 56 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43