#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bbl s SER 13 N 0.00 0.20 0.35 -1.43 0.01 -1.26 -5.02 113.70 106.55 1bbl s SER 13 Ca 0.00 -0.92 0.24 0.00 1.31 0.00 0.00 55.95 56.59 1bbl s SER 13 Cb 0.00 0.34 1.27 0.00 0.21 0.00 0.00 66.02 67.84 1bbl s SER 13 CO 0.00 -0.76 1.74 1.55 0.41 0.00 0.00 173.24 176.18 1bbl h PRO 14 N 2.78 0.00 -0.02 12.44 0.13 -2.07 -0.61 132.00 144.64 1bbl h PRO 14 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1bbl h PRO 14 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1bbl h PRO 14 CO 0.56 0.00 -0.32 0.00 -0.23 0.00 0.00 178.00 178.01 1bbl n ALA 15 N -1.81 3.22 -0.10 -0.56 0.00 -1.26 -4.25 120.51 115.75 1bbl n ALA 15 Ca -0.01 -0.60 -0.05 0.00 0.00 0.00 0.00 53.44 52.78 1bbl n ALA 15 Cb 0.07 -0.88 0.14 0.00 0.00 0.00 0.00 19.45 18.78 1bbl n ALA 15 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1bbl h ILE 16 N 2.61 1.25 -0.13 0.00 2.10 -1.50 -0.52 117.51 121.32 1bbl h ILE 16 Ca 0.00 -1.10 -0.02 0.00 1.08 0.00 0.00 64.86 64.82 1bbl h ILE 16 Cb 0.74 0.99 -0.01 0.00 -1.09 0.00 0.00 36.82 37.45 1bbl h ILE 16 CO 0.00 0.38 0.02 0.03 -1.08 0.00 0.00 178.15 177.50 1bbl h ARG 17 N 0.71 0.23 0.00 2.19 3.08 -1.74 -2.43 114.38 116.41 1bbl h ARG 17 Ca 0.13 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1bbl h ARG 17 Cb 0.53 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1bbl h ARG 17 CO 0.03 0.43 0.00 0.54 -1.07 0.00 0.00 179.97 179.90 1bbl n ARG 18 N -4.81 0.12 0.12 0.04 1.74 -1.15 -2.72 116.66 110.00 1bbl n ARG 18 Ca -0.05 0.28 0.01 0.00 -0.77 0.00 0.00 57.85 57.32 1bbl n ARG 18 Cb 0.18 -1.69 0.33 0.00 -1.02 0.00 0.00 32.46 30.26 1bbl n ARG 18 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1bbl h LEU 19 N 0.00 0.19 0.01 0.55 5.85 -0.57 0.11 115.31 121.45 1bbl h LEU 19 Ca 0.00 -0.06 -0.22 0.00 0.84 0.00 0.00 57.88 58.44 1bbl h LEU 19 Cb 0.40 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1bbl h LEU 19 CO 0.00 0.47 -1.10 -0.07 -0.34 0.00 0.00 178.44 177.40 1bbl h LEU 20 N 0.17 0.03 -0.12 2.25 3.38 -1.55 -3.11 115.31 116.35 1bbl h LEU 20 Ca 0.03 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1bbl h LEU 20 Cb 0.58 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1bbl h LEU 20 CO 0.04 1.02 -0.30 0.00 0.09 0.00 0.00 178.44 179.30 1bbl n ALA 21 N -2.39 3.10 -0.02 1.53 0.00 -1.02 -1.91 120.51 119.80 1bbl n ALA 21 Ca -0.03 -0.30 -0.21 0.00 0.00 0.00 0.00 53.44 52.90 1bbl n ALA 21 Cb 0.96 -1.23 -0.13 0.00 0.00 0.00 0.00 19.45 19.05 1bbl n ALA 21 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1bbl h GLU 22 N 0.30 0.18 -0.09 0.00 4.81 -0.79 -3.36 114.58 115.63 1bbl h GLU 22 Ca 0.00 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1bbl h GLU 22 Cb 0.48 0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1bbl h GLU 22 CO 0.00 1.14 0.00 0.72 -0.73 0.00 0.00 179.01 180.14 1bbl n HIS 23 N -4.00 0.08 -2.95 0.92 8.25 -1.18 -5.02 115.22 111.33 1bbl n HIS 23 Ca -0.27 -0.04 -0.01 0.00 -0.26 0.00 0.00 57.72 57.14 1bbl n HIS 23 Cb 0.85 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.96 1bbl n HIS 23 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1bbl n ASN 24 N 1.13 -7.35 -3.82 0.41 5.03 -0.80 -5.02 115.26 104.83 1bbl n ASN 24 Ca 0.16 0.94 -0.12 0.00 0.87 0.00 0.00 54.58 56.42 1bbl n ASN 24 Cb 0.55 -3.63 -0.13 0.00 -1.02 0.00 0.00 39.78 35.55 1bbl n ASN 24 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1bbl s LEU 25 N -1.40 1.49 -0.45 3.41 1.43 -1.10 -5.05 118.68 117.01 1bbl s LEU 25 Ca 0.01 0.24 -0.24 0.00 -1.03 0.00 0.00 54.13 53.11 1bbl s LEU 25 Cb -0.00 0.39 0.03 0.00 0.03 0.00 0.00 46.19 46.64 1bbl s LEU 25 CO 0.44 -0.05 0.82 -1.81 0.23 0.00 0.00 176.35 175.98 1bbl s ASP 26 N 0.15 6.43 0.42 2.29 1.11 -1.26 -4.88 116.67 120.93 1bbl s ASP 26 Ca -0.01 -0.06 0.29 0.00 0.18 0.00 0.00 52.55 52.95 1bbl s ASP 26 Cb -0.02 -2.40 1.48 0.00 1.07 0.00 0.00 42.92 43.05 1bbl s ASP 26 CO -0.00 -0.95 1.88 0.00 1.18 0.00 0.00 175.17 177.27 1bbl h ALA 27 N 9.01 1.00 0.00 5.23 0.00 -1.98 -1.73 119.26 130.79 1bbl h ALA 27 Ca -0.25 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1bbl h ALA 27 Cb 1.08 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1bbl h ALA 27 CO 0.98 0.00 -0.06 0.77 0.00 0.00 0.00 179.25 180.94 1bbl h SER 28 N 0.00 0.00 0.93 0.00 0.02 -2.04 0.02 113.55 112.48 1bbl h SER 28 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1bbl h SER 28 Cb 0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1bbl h SER 28 CO 0.00 0.06 -0.38 0.00 -1.14 0.00 0.00 176.83 175.37 1bbl n ALA 29 N -2.44 2.84 -2.75 3.77 0.00 -0.65 -4.83 120.51 116.44 1bbl n ALA 29 Ca -0.03 -0.20 -0.34 0.00 0.00 0.00 0.00 53.44 52.87 1bbl n ALA 29 Cb 0.14 -1.27 -0.05 0.00 0.00 0.00 0.00 19.45 18.27 1bbl n ALA 29 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bbl s ILE 30 N -3.09 5.29 -0.24 0.00 -1.09 -0.01 -5.07 121.20 116.99 1bbl s ILE 30 Ca 0.09 0.14 -0.15 0.00 -2.23 0.00 0.00 60.65 58.50 1bbl s ILE 30 Cb 0.15 -3.58 -0.04 0.00 -1.58 0.00 0.00 42.46 37.41 1bbl s ILE 30 CO 0.66 0.33 0.39 -0.54 -1.23 0.00 0.00 174.94 174.55 1bbl s LYS 31 N -1.87 4.08 -1.04 2.79 1.02 -1.26 -4.96 119.74 118.50 1bbl s LYS 31 Ca 0.29 0.12 -0.13 0.00 0.02 0.00 0.00 55.97 56.27 1bbl s LYS 31 Cb -0.13 -3.60 0.21 0.00 -0.52 0.00 0.00 37.83 33.78 1bbl s LYS 31 CO 0.17 -0.18 1.14 0.20 -0.92 0.00 0.00 175.35 175.76 1bbl s GLY 32 N 1.37 2.62 0.00 -3.33 0.00 -1.26 -4.85 107.32 101.87 1bbl s GLY 32 Ca 0.17 -3.38 0.00 0.00 0.00 0.00 0.00 44.72 41.51 1bbl s GLY 32 CO 0.09 1.66 1.14 -1.30 0.00 0.00 0.00 173.10 174.69 1bbl n THR 33 N 4.08 1.14 -0.53 0.90 -2.24 -1.23 -2.58 114.28 113.82 1bbl n THR 33 Ca 0.26 -0.11 -0.30 0.00 -2.27 0.00 0.00 64.05 61.62 1bbl n THR 33 Cb 0.44 -1.08 0.27 0.00 -2.10 0.00 0.00 70.33 67.86 1bbl n THR 33 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1bbl s GLY 34 N 1.24 1.46 -1.07 3.38 0.00 0.30 -4.72 107.32 107.92 1bbl s GLY 34 Ca 0.00 -0.71 -0.24 0.00 0.00 0.00 0.00 44.72 43.77 1bbl s GLY 34 CO 0.00 0.22 1.95 -0.62 0.00 0.00 0.00 173.10 174.65 1bbl n VAL 35 N -5.36 1.55 0.00 1.40 0.31 -1.26 -1.43 118.33 113.54 1bbl n VAL 35 Ca 0.11 -1.57 0.00 0.00 -0.01 0.00 0.00 64.34 62.87 1bbl n VAL 35 Cb 0.59 -2.16 0.00 0.00 -0.91 0.00 0.00 33.84 31.36 1bbl n VAL 35 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bbl n GLY 36 N 5.62 1.28 1.37 2.92 0.00 -1.26 -4.69 105.19 110.44 1bbl n GLY 36 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1bbl n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bbl n GLY 37 N 0.00 0.88 3.95 -0.02 0.00 -0.51 -5.07 105.19 104.41 1bbl n GLY 37 Ca 0.00 -0.61 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 1bbl n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bbl s ARG 38 N -3.09 3.31 -0.38 1.61 0.52 -1.07 -4.69 118.95 115.17 1bbl s ARG 38 Ca 0.00 -0.38 -0.17 0.00 -0.52 0.00 0.00 55.73 54.66 1bbl s ARG 38 Cb 0.00 -2.61 0.01 0.00 0.52 0.00 0.00 34.95 32.87 1bbl s ARG 38 CO 0.00 -0.05 0.42 -1.17 0.02 0.00 0.00 175.30 174.52 1bbl s LEU 39 N -4.44 4.64 0.00 2.53 2.96 -1.26 -0.54 118.68 122.57 1bbl s LEU 39 Ca 0.44 -0.43 0.00 0.00 -0.22 0.00 0.00 54.13 53.92 1bbl s LEU 39 Cb -0.10 -2.39 0.00 0.00 0.50 0.00 0.00 46.19 44.20 1bbl s LEU 39 CO 0.37 -0.48 0.00 0.35 -1.32 0.00 0.00 176.35 175.27 1bbl n THR 40 N 5.37 0.00 -0.01 3.68 -2.24 -1.26 -5.00 114.28 114.81 1bbl n THR 40 Ca -0.08 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.69 1bbl n THR 40 Cb 0.48 -1.16 -0.12 0.00 -2.10 0.00 0.00 70.33 67.43 1bbl n THR 40 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1bbl n ARG 41 N -0.52 0.65 0.00 -0.78 0.63 -1.26 -3.93 116.66 111.45 1bbl n ARG 41 Ca 0.00 0.09 0.11 0.00 -0.92 0.00 0.00 57.85 57.12 1bbl n ARG 41 Cb 0.00 -1.68 0.61 0.00 0.45 0.00 0.00 32.46 31.84 1bbl n ARG 41 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1bbl n GLU 42 N -2.74 0.60 -0.12 -0.14 1.02 -1.26 -1.98 120.64 116.01 1bbl n GLU 42 Ca -0.15 0.02 -0.23 0.00 -0.02 0.00 0.00 57.16 56.77 1bbl n GLU 42 Cb 0.89 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.73 1bbl n GLU 42 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1bbl n ASP 43 N -1.05 1.94 0.08 1.62 8.00 -1.25 -4.20 116.55 121.68 1bbl n ASP 43 Ca 0.15 0.36 -0.03 0.00 0.71 0.00 0.00 54.79 55.98 1bbl n ASP 43 Cb 0.09 -0.82 0.20 0.00 -0.02 0.00 0.00 41.12 40.57 1bbl n ASP 43 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1bbl h VAL 44 N -1.00 1.32 0.21 2.53 2.07 -1.70 -3.20 116.25 116.48 1bbl h VAL 44 Ca -0.48 -1.58 0.01 0.00 0.82 0.00 0.00 66.70 65.48 1bbl h VAL 44 Cb 1.40 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.84 1bbl h VAL 44 CO -0.29 0.47 -0.33 -0.08 0.02 0.00 0.00 177.57 177.36 1bbl h GLU 45 N 0.23 -0.59 -1.18 1.57 4.81 -1.62 -0.29 114.58 117.50 1bbl h GLU 45 Ca 0.02 0.04 0.34 0.00 -0.13 0.00 0.00 59.36 59.62 1bbl h GLU 45 Cb 0.86 0.13 -0.07 0.00 0.63 0.00 0.00 28.75 30.30 1bbl h GLU 45 CO 0.07 -0.39 0.82 0.87 -0.73 0.00 0.00 179.01 179.65 1bbl h LYS 46 N -0.61 0.11 -0.14 1.92 1.57 -1.72 0.55 116.57 118.25 1bbl h LYS 46 Ca 0.01 -0.01 -0.21 0.00 -1.87 0.00 0.00 60.65 58.57 1bbl h LYS 46 Cb 0.60 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.89 1bbl h LYS 46 CO -0.14 0.08 -0.76 1.25 -0.57 0.00 0.00 179.45 179.31 1bbl h HIS 47 N 0.12 0.95 0.00 -1.35 2.76 -1.15 -3.52 115.15 112.95 1bbl h HIS 47 Ca 0.60 -0.42 0.00 0.00 -2.20 0.00 0.00 60.37 58.36 1bbl h HIS 47 Cb 2.12 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 30.93 1bbl h HIS 47 CO -0.00 1.23 0.00 1.28 -1.30 0.00 0.00 177.93 179.14