#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 2.06 0.19 -0.14 -0.02 -1.26 -4.90 135.00 130.93 1y62 n PRO 4 Ca 0.00 0.73 0.18 0.00 -2.02 0.00 0.00 63.50 62.39 1y62 n PRO 4 Cb 0.00 -2.32 0.82 0.00 -0.02 0.00 0.00 33.50 31.98 1y62 n PRO 4 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1y62 h SER 5 N 2.44 0.00 0.45 2.55 0.02 -2.01 -1.33 113.55 115.67 1y62 h SER 5 Ca -0.46 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.43 1y62 h SER 5 Cb 1.29 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.82 1y62 h SER 5 CO 0.62 0.00 -0.30 0.17 -1.14 0.00 0.00 176.83 176.18 1y62 h LEU 6 N 0.00 0.00 -2.53 5.07 8.10 -1.94 -2.51 115.31 121.50 1y62 h LEU 6 Ca 0.10 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 58.09 1y62 h LEU 6 Cb 0.64 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.86 1y62 h LEU 6 CO -0.00 0.30 -0.01 0.00 -4.11 0.00 0.00 178.44 174.62 1y62 n ASP 8 N -3.20 3.77 -4.87 0.00 8.00 -0.94 -4.49 116.55 114.81 1y62 n ASP 8 Ca -0.02 -1.99 -0.33 0.00 0.71 0.00 0.00 54.79 53.16 1y62 n ASP 8 Cb 0.14 -0.42 -0.05 0.00 -0.02 0.00 0.00 41.12 40.77 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 -1.11 4.24 0.70 0.64 1.43 -0.64 -5.06 118.68 118.87 1y62 s LEU 9 Ca 0.45 0.86 -0.13 0.00 -1.03 0.00 0.00 54.13 54.28 1y62 s LEU 9 Cb 0.24 -3.45 0.02 0.00 0.03 0.00 0.00 46.19 43.02 1y62 s LEU 9 CO 0.32 0.01 1.09 -2.16 0.23 0.00 0.00 176.35 175.84 1y62 s PRO 10 N -2.54 2.66 0.24 1.29 0.04 -1.26 -4.91 135.00 130.53 1y62 s PRO 10 Ca 0.43 1.25 -0.30 0.00 0.04 0.00 0.00 61.00 62.42 1y62 s PRO 10 Cb -0.12 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.38 1y62 s PRO 10 CO 0.21 -1.34 1.30 0.00 0.04 0.00 0.00 177.00 177.21 1y62 s ALA 11 N -2.63 3.51 -0.20 8.56 0.00 -1.26 -4.88 121.76 124.86 1y62 s ALA 11 Ca 0.64 1.14 -0.02 0.00 0.00 0.00 0.00 51.96 53.71 1y62 s ALA 11 Cb -0.18 -3.47 0.06 0.00 0.00 0.00 0.00 23.12 19.53 1y62 s ALA 11 CO 0.48 -0.54 0.02 0.34 0.00 0.00 0.00 175.76 176.06 1y62 s ASP 12 N 0.01 3.06 0.58 0.00 -1.08 -1.26 -5.00 116.67 112.97 1y62 s ASP 12 Ca 0.54 -0.88 0.28 0.00 -0.52 0.00 0.00 52.55 51.98 1y62 s ASP 12 Cb -0.37 -0.69 1.49 0.00 -1.46 0.00 0.00 42.92 41.88 1y62 s ASP 12 CO 0.42 -0.29 1.94 0.28 0.52 0.00 0.00 175.17 178.04 1y62 h SER 13 N 8.19 0.00 -3.25 -0.34 0.02 -1.96 -3.41 113.55 112.81 1y62 h SER 13 Ca -0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1y62 h SER 13 Cb 1.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1y62 h SER 13 CO 0.35 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.65 1y62 n GLY 14 N -1.53 -1.83 0.38 -3.77 0.00 -1.26 -0.12 105.19 97.06 1y62 n GLY 14 Ca 0.08 -1.75 0.07 0.00 0.00 0.00 0.00 46.02 44.42 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 0.32 1.63 -2.68 1.61 3.41 -0.18 -4.84 113.62 112.89 1y62 n SER 15 Ca 0.00 -2.94 -0.07 0.00 -0.26 0.00 0.00 58.87 55.60 1y62 n SER 15 Cb 0.00 -0.39 0.04 0.00 -0.26 0.00 0.00 64.21 63.60 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 -0.92 0.19 0.24 5.00 0.00 -1.22 -4.96 105.19 103.52 1y62 n GLY 16 Ca 0.13 -1.90 0.04 0.00 0.00 0.00 0.00 46.02 44.29 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 -2.00 0.00 -2.04 2.61 -2.24 -1.22 -4.87 114.28 104.51 1y62 n THR 17 Ca 0.05 -0.45 -0.28 0.00 -2.27 0.00 0.00 64.05 61.10 1y62 n THR 17 Cb 0.17 1.13 0.08 0.00 -2.10 0.00 0.00 70.33 69.60 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 -0.97 2.15 -0.44 -0.78 1.02 -0.87 -5.06 119.74 114.79 1y62 s LYS 18 Ca 0.08 -0.02 0.02 0.00 0.02 0.00 0.00 55.97 56.07 1y62 s LYS 18 Cb 0.07 -2.06 0.13 0.00 -0.52 0.00 0.00 37.83 35.45 1y62 s LYS 18 CO 0.16 -1.38 0.23 0.00 -0.92 0.00 0.00 175.35 173.43 1y62 s ALA 19 N -3.41 2.36 0.37 5.17 0.00 -1.26 -4.10 121.76 120.89 1y62 s ALA 19 Ca 0.61 -2.66 0.08 0.00 0.00 0.00 0.00 51.96 49.99 1y62 s ALA 19 Cb -0.11 -1.93 -0.06 0.00 0.00 0.00 0.00 23.12 21.02 1y62 s ALA 19 CO 0.47 -2.02 0.01 -1.21 0.00 0.00 0.00 175.76 173.01 1y62 s GLU 20 N 0.33 2.00 -0.17 0.00 2.02 0.40 -4.99 118.70 118.28 1y62 s GLU 20 Ca 0.17 -1.91 -0.02 0.00 0.02 0.00 0.00 54.97 53.24 1y62 s GLU 20 Cb -0.24 -1.80 -0.01 0.00 0.10 0.00 0.00 34.13 32.18 1y62 s GLU 20 CO -0.01 0.05 -0.10 0.15 0.02 0.00 0.00 175.26 175.37 1y62 s LYS 21 N -3.71 3.36 0.33 1.61 -0.14 -1.26 -1.41 119.74 118.51 1y62 s LYS 21 Ca 0.35 -0.67 0.03 0.00 -1.36 0.00 0.00 55.97 54.32 1y62 s LYS 21 Cb 0.04 -2.79 -0.05 0.00 -1.68 0.00 0.00 37.83 33.36 1y62 s LYS 21 CO 0.19 0.01 0.10 1.03 -0.76 0.00 0.00 175.35 175.92 1y62 s ARG 22 N 0.89 1.66 -0.05 1.68 1.81 -0.81 -4.95 118.95 119.17 1y62 s ARG 22 Ca -0.02 -1.95 0.04 0.00 -1.72 0.00 0.00 55.73 52.08 1y62 s ARG 22 Cb -0.15 -0.51 -0.02 0.00 -0.45 0.00 0.00 34.95 33.82 1y62 s ARG 22 CO 0.00 -0.34 -0.18 0.42 -0.68 0.00 0.00 175.30 174.52 1y62 s ILE 23 N -3.44 2.72 0.09 1.52 -1.09 0.04 -1.16 121.20 119.88 1y62 s ILE 23 Ca 0.33 -0.84 0.04 0.00 -2.23 0.00 0.00 60.65 57.95 1y62 s ILE 23 Cb 0.06 -2.04 -0.03 0.00 -1.58 0.00 0.00 42.46 38.86 1y62 s ILE 23 CO 0.15 0.58 -0.11 -0.72 -1.23 0.00 0.00 174.94 173.61 1y62 s TYR 24 N -0.51 1.10 -0.20 3.97 -0.85 -0.04 -0.05 117.35 120.78 1y62 s TYR 24 Ca 0.07 -0.61 -0.19 0.00 -0.52 0.00 0.00 57.07 55.81 1y62 s TYR 24 Cb -0.12 -0.60 -0.03 0.00 0.38 0.00 0.00 41.96 41.59 1y62 s TYR 24 CO 0.01 0.02 0.55 -0.47 -1.52 0.00 0.00 175.55 174.15 1y62 s TYR 25 N -2.20 3.37 -0.50 -3.49 5.04 -1.26 -1.00 117.35 117.31 1y62 s TYR 25 Ca 0.04 0.82 -0.18 0.00 -2.44 0.00 0.00 57.07 55.31 1y62 s TYR 25 Cb -0.04 -2.71 0.07 0.00 0.35 0.00 0.00 41.96 39.62 1y62 s TYR 25 CO 0.01 -0.13 0.55 1.21 -1.34 0.00 0.00 175.55 175.85 1y62 s ASN 26 N 1.18 6.19 0.44 4.32 3.84 0.14 -4.88 114.94 126.17 1y62 s ASN 26 Ca 0.26 -1.12 0.21 0.00 0.21 0.00 0.00 52.86 52.42 1y62 s ASN 26 Cb -0.16 -2.25 1.02 0.00 -0.55 0.00 0.00 41.25 39.32 1y62 s ASN 26 CO 0.10 -0.82 1.91 0.77 -2.79 0.00 0.00 177.10 176.26 1y62 h SER 27 N 8.92 0.00 0.02 -4.21 4.64 -1.85 0.27 113.55 121.34 1y62 h SER 27 Ca -0.28 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1y62 h SER 27 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1y62 h SER 27 CO 0.95 0.25 -0.01 0.00 -0.87 0.00 0.00 176.83 177.15 1y62 h ALA 28 N 1.75 -0.02 -0.00 5.18 0.00 -1.95 -3.18 119.26 121.03 1y62 h ALA 28 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1y62 h ALA 28 Cb 0.58 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1y62 h ALA 28 CO 0.03 -0.31 -0.32 0.54 0.00 0.00 0.00 179.25 179.19 1y62 n ARG 29 N -4.91 0.13 -3.63 0.00 1.74 -1.18 -4.96 116.66 103.86 1y62 n ARG 29 Ca -0.08 -0.06 -0.20 0.00 -0.77 0.00 0.00 57.85 56.73 1y62 n ARG 29 Cb 0.21 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.20 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 -1.38 -5.22 -3.68 5.56 5.02 0.88 -5.00 118.16 114.34 1y62 n LYS 30 Ca 0.07 0.67 -0.14 0.00 -2.02 0.00 0.00 58.31 56.89 1y62 n LYS 30 Cb 0.33 -5.33 -0.08 0.00 -0.02 0.00 0.00 35.03 29.94 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 -5.82 0.82 -0.24 1.97 -2.07 -0.88 -5.00 119.66 108.45 1y62 s GLN 31 Ca 0.01 -0.10 -0.22 0.00 -1.82 0.00 0.00 55.36 53.23 1y62 s GLN 31 Cb -0.00 0.37 -0.02 0.00 -1.09 0.00 0.00 33.01 32.27 1y62 s GLN 31 CO 0.79 -0.25 0.69 0.00 -1.32 0.00 0.00 175.29 175.21 1y62 s LEU 33 N 2.47 2.54 0.35 0.00 1.43 -0.17 -4.91 118.68 120.39 1y62 s LEU 33 Ca 0.30 -1.15 -0.19 0.00 -1.03 0.00 0.00 54.13 52.05 1y62 s LEU 33 Cb -0.16 -0.75 -0.10 0.00 0.03 0.00 0.00 46.19 45.22 1y62 s LEU 33 CO 0.09 -0.26 0.84 -0.13 0.23 0.00 0.00 176.35 177.12 1y62 s ARG 34 N -3.67 4.21 0.13 1.70 0.52 -1.26 -0.86 118.95 119.71 1y62 s ARG 34 Ca 0.29 0.96 -0.10 0.00 -0.52 0.00 0.00 55.73 56.36 1y62 s ARG 34 Cb 0.02 -2.46 0.00 0.00 0.52 0.00 0.00 34.95 33.03 1y62 s ARG 34 CO 0.12 0.14 0.26 -0.59 0.02 0.00 0.00 175.30 175.25 1y62 s PHE 35 N -1.93 0.20 -0.17 -0.53 -0.12 -0.31 -4.91 117.98 110.21 1y62 s PHE 35 Ca 0.55 -0.59 -0.23 0.00 -0.05 0.00 0.00 56.93 56.61 1y62 s PHE 35 Cb -0.12 -0.01 -0.02 0.00 -0.63 0.00 0.00 43.02 42.24 1y62 s PHE 35 CO 0.17 -0.64 0.73 -0.51 -0.05 0.00 0.00 175.22 174.92 1y62 s ASP 36 N -2.90 6.84 -0.02 1.98 1.01 -1.26 -1.93 116.67 120.39 1y62 s ASP 36 Ca 0.10 1.03 0.07 0.00 0.71 0.00 0.00 52.55 54.46 1y62 s ASP 36 Cb 0.04 -2.40 -0.02 0.00 1.01 0.00 0.00 42.92 41.55 1y62 s ASP 36 CO -0.07 -0.31 -0.24 -0.47 0.21 0.00 0.00 175.17 174.29 1y62 s TYR 37 N 1.90 2.19 -2.15 4.23 5.04 -0.50 -4.22 117.35 123.85 1y62 s TYR 37 Ca 0.34 -0.43 0.16 0.00 -2.44 0.00 0.00 57.07 54.71 1y62 s TYR 37 Cb -0.16 -1.41 0.61 0.00 0.35 0.00 0.00 41.96 41.34 1y62 s TYR 37 CO 0.12 -0.05 1.45 0.25 -1.34 0.00 0.00 175.55 175.98 1y62 n THR 38 N 2.51 0.26 -1.04 4.34 -2.24 0.83 -0.46 114.28 118.48 1y62 n THR 38 Ca -0.16 -0.33 -0.01 0.00 -2.27 0.00 0.00 64.05 61.27 1y62 n THR 38 Cb 0.52 0.24 -0.01 0.00 -2.10 0.00 0.00 70.33 68.98 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 1.04 0.51 3.62 3.38 0.00 -1.26 -2.04 105.19 110.44 1y62 n GLY 39 Ca 0.14 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.09 0.75 3.50 1.61 0.74 -1.26 -4.93 119.66 118.98 1y62 s GLN 40 Ca 0.00 0.77 0.00 0.00 0.05 0.00 0.00 55.36 56.18 1y62 s GLN 40 Cb 0.00 0.36 0.00 0.00 1.10 0.00 0.00 33.01 34.47 1y62 s GLN 40 CO 0.00 -0.11 0.00 0.41 -0.55 0.00 0.00 175.29 175.04 1y62 n GLY 41 N 2.29 0.00 7.00 2.59 0.00 -1.26 -1.01 105.19 114.81 1y62 n GLY 41 Ca -0.14 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.87 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 0.84 -0.02 0.00 -1.26 -4.82 105.19 99.75 1y62 n GLY 42 Ca 0.00 -1.01 -0.06 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.78 0.27 0.00 1.61 0.23 -1.26 -5.01 115.26 110.31 1y62 n ASN 43 Ca 0.00 -1.56 0.10 0.00 -0.53 0.00 0.00 54.58 52.59 1y62 n ASN 43 Cb 0.00 0.37 0.46 0.00 -2.08 0.00 0.00 39.78 38.53 1y62 n ASN 43 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1y62 n GLU 44 N -0.19 0.01 -1.85 -3.83 -0.58 -1.26 -4.05 120.64 108.89 1y62 n GLU 44 Ca 0.01 0.13 -0.41 0.00 -0.42 0.00 0.00 57.16 56.47 1y62 n GLU 44 Cb 0.16 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.52 1y62 n GLU 44 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1y62 n ASN 45 N -1.49 7.10 -3.50 1.62 5.15 -1.26 -4.72 115.26 118.16 1y62 n ASN 45 Ca 0.05 -2.94 -0.10 0.00 -0.60 0.00 0.00 54.58 50.99 1y62 n ASN 45 Cb 0.25 -1.48 -0.09 0.00 -0.53 0.00 0.00 39.78 37.93 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 1.31 0.14 0.06 1.20 3.84 -1.25 -4.42 114.94 115.81 1y62 s ASN 46 Ca 0.54 0.52 0.08 0.00 0.21 0.00 0.00 52.86 54.21 1y62 s ASN 46 Cb 0.16 1.11 -0.03 0.00 -0.55 0.00 0.00 41.25 41.94 1y62 s ASN 46 CO -0.06 -0.27 -0.21 -0.36 -2.79 0.00 0.00 177.10 173.40 1y62 s PHE 47 N 2.54 1.84 -0.31 0.43 0.40 0.93 -4.94 117.98 118.88 1y62 s PHE 47 Ca 0.06 -0.39 0.21 0.00 -0.60 0.00 0.00 56.93 56.21 1y62 s PHE 47 Cb -0.14 -1.08 0.17 0.00 0.51 0.00 0.00 43.02 42.49 1y62 s PHE 47 CO -0.14 0.13 1.39 0.00 0.70 0.00 0.00 175.22 177.30 1y62 h ARG 48 N 4.66 0.00 -5.37 0.44 3.08 -1.93 0.15 114.38 115.41 1y62 h ARG 48 Ca -0.44 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.07 1y62 h ARG 48 Cb 1.16 0.00 -0.31 0.00 0.08 0.00 0.00 29.97 30.91 1y62 h ARG 48 CO 0.43 0.12 -0.83 1.03 -1.07 0.00 0.00 179.97 179.64 1y62 s ARG 49 N -3.18 1.60 0.25 0.04 0.52 -1.26 -4.83 118.95 112.10 1y62 s ARG 49 Ca 0.04 -0.59 -0.05 0.00 -0.52 0.00 0.00 55.73 54.61 1y62 s ARG 49 Cb 0.07 -1.44 0.31 0.00 0.52 0.00 0.00 34.95 34.41 1y62 s ARG 49 CO 0.72 0.28 1.91 1.15 0.02 0.00 0.00 175.30 179.38 1y62 h THR 50 N 5.08 1.18 -0.13 0.02 2.02 -1.97 -2.52 112.91 116.59 1y62 h THR 50 Ca -0.34 -0.43 -0.08 0.00 0.77 0.00 0.00 66.41 66.33 1y62 h THR 50 Cb 1.17 -0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1y62 h THR 50 CO 0.48 0.23 -0.26 0.22 0.37 0.00 0.00 175.52 176.56 1y62 h TYR 51 N 1.27 0.26 -0.28 3.16 3.20 -2.00 -1.82 116.97 120.77 1y62 h TYR 51 Ca 0.39 -0.05 -0.11 0.00 3.14 0.00 0.00 58.73 62.10 1y62 h TYR 51 Cb -0.02 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 1y62 h TYR 51 CO -0.00 0.48 -0.29 -0.44 -1.64 0.00 0.00 178.16 176.27 1y62 h ASP 52 N 0.21 0.58 -0.40 -2.11 3.32 -1.89 -2.51 116.42 113.63 1y62 h ASP 52 Ca 0.03 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 56.81 1y62 h ASP 52 Cb 0.58 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1y62 h ASP 52 CO 0.04 0.85 0.04 0.00 -1.72 0.00 0.00 179.24 178.45 1y62 h GLN 54 N 0.52 0.79 0.00 0.00 4.20 -1.05 0.85 115.11 120.42 1y62 h GLN 54 Ca 0.12 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 1y62 h GLN 54 Cb 0.41 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 1y62 h GLN 54 CO 0.01 0.76 -0.13 0.07 -0.67 0.00 0.00 178.83 178.88 1y62 h ARG 55 N 0.68 0.00 0.11 1.46 0.11 -1.51 0.61 114.38 115.83 1y62 h ARG 55 Ca 0.16 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 60.08 1y62 h ARG 55 Cb 0.32 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.42 1y62 h ARG 55 CO 0.00 0.13 -0.66 1.15 0.10 0.00 0.00 179.97 180.69 1y62 h THR 56 N 0.00 1.55 0.00 0.08 2.02 -1.25 -3.42 112.91 111.90 1y62 h THR 56 Ca -0.00 -2.46 -0.20 0.00 0.77 0.00 0.00 66.41 64.51 1y62 h THR 56 Cb 0.86 3.18 -0.04 0.00 -1.74 0.00 0.00 68.15 70.42 1y62 h THR 56 CO 0.02 0.69 -1.99 0.00 0.37 0.00 0.00 175.52 174.61