#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cyu s SER 3 N 0.00 -0.16 0.32 -1.43 0.15 -1.26 -5.13 113.70 106.18 2cyu s SER 3 Ca 0.00 -0.07 -0.28 0.00 0.70 0.00 0.00 55.95 56.29 2cyu s SER 3 Cb 0.00 0.23 -0.13 0.00 -1.71 0.00 0.00 66.02 64.41 2cyu s SER 3 CO 0.00 -0.39 1.23 -2.65 1.20 0.00 0.00 173.24 172.63 2cyu n PRO 4 N -0.26 1.91 0.12 5.44 -0.01 -1.26 -4.89 135.00 136.06 2cyu n PRO 4 Ca -0.04 0.67 -0.02 0.00 -0.01 0.00 0.00 63.50 64.10 2cyu n PRO 4 Cb 0.60 -2.21 0.09 0.00 -0.01 0.00 0.00 33.50 31.97 2cyu n PRO 4 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2cyu h ALA 5 N 2.58 0.75 -0.06 3.55 0.00 -2.01 -3.09 119.26 120.98 2cyu h ALA 5 Ca -0.44 -0.64 -0.11 0.00 0.00 0.00 0.00 54.91 53.72 2cyu h ALA 5 Cb 1.30 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2cyu h ALA 5 CO 0.63 0.87 -0.45 0.97 0.00 0.00 0.00 179.25 181.28 2cyu h ILE 6 N 0.00 1.33 -0.73 0.00 2.10 -2.00 -2.12 117.51 116.10 2cyu h ILE 6 Ca -0.01 -1.60 0.16 0.00 1.08 0.00 0.00 64.86 64.50 2cyu h ILE 6 Cb 1.31 1.78 -0.04 0.00 -1.09 0.00 0.00 36.82 38.78 2cyu h ILE 6 CO 0.09 0.47 0.49 -0.09 -1.08 0.00 0.00 178.15 178.03 2cyu h ARG 7 N 0.12 0.29 0.30 2.19 2.43 -1.92 0.57 114.38 118.36 2cyu h ARG 7 Ca 0.01 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2cyu h ARG 7 Cb 0.85 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 2cyu h ARG 7 CO 0.07 0.19 -0.14 -0.09 -1.51 0.00 0.00 179.97 178.49 2cyu h ARG 8 N 0.30 -0.39 -0.38 0.20 2.43 -1.50 -1.51 114.38 113.54 2cyu h ARG 8 Ca 0.36 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.63 2cyu h ARG 8 Cb 0.96 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.52 2cyu h ARG 8 CO -0.09 -0.26 -0.16 1.25 -1.51 0.00 0.00 179.97 179.21 2cyu h LEU 9 N -0.64 -0.54 -0.26 3.80 5.85 -1.27 1.65 115.31 123.90 2cyu h LEU 9 Ca -0.04 0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.87 2cyu h LEU 9 Cb 0.31 0.31 -0.05 0.00 0.37 0.00 0.00 40.66 41.59 2cyu h LEU 9 CO 0.07 -0.19 -0.07 0.25 -0.34 0.00 0.00 178.44 178.15 2cyu h LEU 10 N -0.08 -0.26 -0.91 2.25 6.46 0.02 -0.13 115.31 122.66 2cyu h LEU 10 Ca 0.19 0.08 -0.06 0.00 -0.12 0.00 0.00 57.88 57.97 2cyu h LEU 10 Cb 0.37 0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 2cyu h LEU 10 CO -0.44 -0.10 -0.27 0.00 -0.62 0.00 0.00 178.44 177.02 2cyu h ALA 11 N 1.25 0.97 0.13 1.25 0.00 -0.33 -0.56 119.26 121.97 2cyu h ALA 11 Ca 0.13 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2cyu h ALA 11 Cb 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2cyu h ALA 11 CO -0.28 0.34 -0.06 1.49 0.00 0.00 0.00 179.25 180.74 2cyu h GLU 12 N 0.00 -0.17 -0.56 0.00 4.81 0.42 -3.25 114.58 115.83 2cyu h GLU 12 Ca -0.00 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 2cyu h GLU 12 Cb 0.86 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.25 2cyu h GLU 12 CO 0.04 -0.11 0.08 0.45 -0.73 0.00 0.00 179.01 178.73 2cyu h HIS 13 N -0.19 0.95 -2.98 0.92 3.86 -1.37 -3.49 115.15 112.85 2cyu h HIS 13 Ca -0.02 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 2cyu h HIS 13 Cb 0.13 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.34 2cyu h HIS 13 CO 0.18 0.83 0.00 0.09 0.86 0.00 0.00 177.93 179.88 2cyu n ASN 14 N -4.23 -1.99 -4.20 2.45 4.13 -0.22 -5.11 115.26 106.10 2cyu n ASN 14 Ca 0.04 0.00 -0.19 0.00 1.68 0.00 0.00 54.58 56.10 2cyu n ASN 14 Cb 0.27 -0.99 -0.12 0.00 -1.54 0.00 0.00 39.78 37.40 2cyu n ASN 14 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2cyu s LEU 15 N -1.58 2.28 -0.46 3.41 1.43 -1.24 -5.08 118.68 117.44 2cyu s LEU 15 Ca 0.00 -0.63 -0.24 0.00 -1.03 0.00 0.00 54.13 52.22 2cyu s LEU 15 Cb 0.00 -0.59 0.03 0.00 0.03 0.00 0.00 46.19 45.66 2cyu s LEU 15 CO 0.00 -0.05 0.87 -0.62 0.23 0.00 0.00 176.35 176.79 2cyu s ASP 16 N -1.78 6.46 0.23 2.29 2.15 -1.26 -4.88 116.67 119.88 2cyu s ASP 16 Ca -0.00 0.00 0.06 0.00 0.43 0.00 0.00 52.55 53.04 2cyu s ASP 16 Cb -0.10 -2.43 0.30 0.00 -0.30 0.00 0.00 42.92 40.40 2cyu s ASP 16 CO 0.03 -1.01 0.96 0.00 -0.17 0.00 0.00 175.17 174.98 2cyu n ALA 17 N 7.02 0.37 0.21 3.66 0.00 -1.26 -0.66 120.51 129.86 2cyu n ALA 17 Ca 0.04 0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.66 2cyu n ALA 17 Cb 0.48 -0.44 0.72 0.00 0.00 0.00 0.00 19.45 20.21 2cyu n ALA 17 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2cyu h SER 18 N 0.00 0.00 0.00 0.00 0.02 -2.00 -3.30 113.55 108.27 2cyu h SER 18 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2cyu h SER 18 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.40 2cyu h SER 18 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 2cyu n ALA 19 N -2.50 0.00 -0.72 3.77 0.00 0.17 -4.86 120.51 116.38 2cyu n ALA 19 Ca -0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.15 2cyu n ALA 19 Cb 0.21 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.78 2cyu n ALA 19 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2cyu n ILE 20 N -0.06 0.00 -0.15 0.00 2.08 -1.24 -5.04 119.36 114.95 2cyu n ILE 20 Ca 0.00 -0.14 0.00 0.00 0.56 0.00 0.00 62.75 63.17 2cyu n ILE 20 Cb 0.00 -0.40 0.00 0.00 -0.75 0.00 0.00 39.64 38.49 2cyu n ILE 20 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 2cyu n LYS 21 N -0.68 2.38 -3.42 0.38 5.02 -1.26 -4.96 118.16 115.62 2cyu n LYS 21 Ca 0.01 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.14 2cyu n LYS 21 Cb 0.55 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.46 2cyu n LYS 21 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2cyu s GLY 22 N 0.00 -0.14 -0.09 0.72 0.00 -1.26 -4.63 107.32 101.91 2cyu s GLY 22 Ca 0.00 0.14 0.03 0.00 0.00 0.00 0.00 44.72 44.89 2cyu s GLY 22 CO 0.00 2.47 1.01 -0.37 0.00 0.00 0.00 173.10 176.21 2cyu n THR 23 N 5.32 1.11 0.00 0.90 5.66 -1.22 -3.74 114.28 122.32 2cyu n THR 23 Ca -0.04 -0.48 0.00 0.00 -3.05 0.00 0.00 64.05 60.48 2cyu n THR 23 Cb 0.48 -0.55 0.00 0.00 -1.55 0.00 0.00 70.33 68.71 2cyu n THR 23 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2cyu n GLY 24 N 0.13 1.25 3.05 1.09 0.00 -1.00 -4.97 105.19 104.74 2cyu n GLY 24 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 2cyu n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cyu s VAL 25 N 0.00 -0.59 0.00 1.61 0.11 -1.26 -4.87 120.40 115.40 2cyu s VAL 25 Ca 0.00 0.06 0.00 0.00 -2.93 0.00 0.00 61.98 59.11 2cyu s VAL 25 Cb 0.00 -0.71 0.00 0.00 -1.53 0.00 0.00 36.38 34.14 2cyu s VAL 25 CO 0.00 -0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.35 2cyu n GLY 26 N 5.37 2.01 0.00 6.54 0.00 -1.26 -3.98 105.19 113.87 2cyu n GLY 26 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2cyu n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cyu n GLY 27 N -0.47 -0.11 3.25 -0.02 0.00 -1.26 -5.09 105.19 101.49 2cyu n GLY 27 Ca 0.00 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 2cyu n GLY 27 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2cyu s ARG 28 N 0.00 1.82 0.47 1.61 3.52 -1.25 -4.88 118.95 120.25 2cyu s ARG 28 Ca 0.00 -0.80 -0.21 0.00 -0.13 0.00 0.00 55.73 54.59 2cyu s ARG 28 Cb 0.00 -1.76 -0.09 0.00 -1.56 0.00 0.00 34.95 31.54 2cyu s ARG 28 CO 0.00 0.48 1.02 -1.17 -0.81 0.00 0.00 175.30 174.82 2cyu s LEU 29 N -0.52 3.88 -0.10 -0.88 2.96 -1.26 -2.39 118.68 120.37 2cyu s LEU 29 Ca 0.09 1.88 -0.07 0.00 -0.22 0.00 0.00 54.13 55.81 2cyu s LEU 29 Cb -0.09 -4.54 0.04 0.00 0.50 0.00 0.00 46.19 42.10 2cyu s LEU 29 CO -0.01 -0.68 0.26 0.42 -1.32 0.00 0.00 176.35 175.02 2cyu s THR 30 N -2.00 -0.02 0.25 3.68 -4.23 -1.26 -4.86 115.64 107.19 2cyu s THR 30 Ca 0.66 0.09 0.21 0.00 -1.18 0.00 0.00 61.69 61.46 2cyu s THR 30 Cb -0.15 -0.38 0.21 0.00 1.34 0.00 0.00 72.50 73.51 2cyu s THR 30 CO 0.19 0.04 1.58 0.03 -0.54 0.00 0.00 174.62 175.92 2cyu h ARG 31 N 6.64 0.00 -0.75 3.99 3.08 -1.99 -2.05 114.38 123.30 2cyu h ARG 31 Ca -0.35 0.00 0.10 0.00 0.07 0.00 0.00 59.98 59.80 2cyu h ARG 31 Cb 1.17 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.17 2cyu h ARG 31 CO 0.36 0.00 0.49 1.49 -1.07 0.00 0.00 179.97 181.24 2cyu h GLU 32 N 0.00 0.61 0.00 0.04 4.81 -1.99 -2.09 114.58 115.96 2cyu h GLU 32 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2cyu h GLU 32 Cb 0.56 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.80 2cyu h GLU 32 CO 0.00 0.40 -0.25 0.22 -0.73 0.00 0.00 179.01 178.66 2cyu h ASP 33 N 0.63 0.00 -0.78 1.04 1.82 -1.79 -3.05 116.42 114.28 2cyu h ASP 33 Ca 0.35 0.00 0.23 0.00 -0.39 0.00 0.00 57.03 57.21 2cyu h ASP 33 Cb 0.50 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.48 2cyu h ASP 33 CO -0.12 0.39 1.17 0.52 -1.61 0.00 0.00 179.24 179.58 2cyu n VAL 34 N -3.51 0.00 -0.08 2.25 0.31 -1.24 0.74 118.33 116.79 2cyu n VAL 34 Ca -0.03 1.19 -0.20 0.00 -0.01 0.00 0.00 64.34 65.29 2cyu n VAL 34 Cb 0.13 -2.19 -0.12 0.00 -0.91 0.00 0.00 33.84 30.75 2cyu n VAL 34 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2cyu h GLU 35 N 0.00 0.03 -1.17 5.55 5.08 -1.52 -2.98 114.58 119.57 2cyu h GLU 35 Ca 0.37 -0.05 0.34 0.00 -1.00 0.00 0.00 59.36 59.02 2cyu h GLU 35 Cb 2.70 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 31.87 2cyu h GLU 35 CO -0.00 1.03 0.76 0.87 -1.00 0.00 0.00 179.01 180.67 2cyu h LYS 36 N -0.90 0.23 0.43 2.33 1.57 0.43 0.22 116.57 120.88 2cyu h LYS 36 Ca -0.27 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.48 2cyu h LYS 36 Cb 1.30 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.56 2cyu h LYS 36 CO -0.13 0.15 -0.21 1.25 -0.57 0.00 0.00 179.45 179.95 2cyu h HIS 37 N 0.24 -0.53 0.00 -1.35 2.76 -1.58 -3.42 115.15 111.26 2cyu h HIS 37 Ca 0.68 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.84 2cyu h HIS 37 Cb 2.01 0.18 0.00 0.00 1.55 0.00 0.00 27.41 31.14 2cyu h HIS 37 CO -0.00 -0.33 0.00 1.28 -1.30 0.00 0.00 177.93 177.57 2cyu n LEU 38 N -4.76 0.00 -3.16 0.26 4.77 0.61 -4.92 117.00 109.79 2cyu n LEU 38 Ca -0.07 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.69 2cyu n LEU 38 Cb 0.23 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.34 2cyu n LEU 38 CO 0.17 0.00 -0.13 0.00 -1.33 0.00 0.00 177.39 176.11 2cyu n ALA 39 N -3.00 -2.67 -1.10 -1.18 0.00 -0.19 -4.98 120.51 107.39 2cyu n ALA 39 Ca 0.00 0.76 0.00 0.00 0.00 0.00 0.00 53.44 54.20 2cyu n ALA 39 Cb 0.00 -2.96 0.00 0.00 0.00 0.00 0.00 19.45 16.49 2cyu n ALA 39 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67