#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y1b n PRO 2 N 0.00 0.82 -0.46 1.97 -0.02 -1.26 -4.54 135.00 131.50 1y1b n PRO 2 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.38 1y1b n PRO 2 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.44 1y1b n PRO 2 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1y1b n ASP 3 N -0.90 2.78 -4.71 2.55 9.92 -1.26 -4.83 116.55 120.10 1y1b n ASP 3 Ca 0.00 -2.05 -0.24 0.00 -0.53 0.00 0.00 54.79 51.98 1y1b n ASP 3 Cb 0.00 -0.74 -0.07 0.00 -0.64 0.00 0.00 41.12 39.67 1y1b n ASP 3 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1y1b s PRO 5 N -3.84 3.25 0.00 0.00 0.04 -1.26 -4.25 135.00 128.95 1y1b s PRO 5 Ca 0.38 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.49 1y1b s PRO 5 Cb -0.00 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.51 1y1b s PRO 5 CO 0.22 -0.85 0.00 -0.11 0.04 0.00 0.00 177.00 176.30 1y1b n LEU 6 N -2.41 0.00 -1.72 -3.56 0.00 -1.26 -5.02 117.00 103.02 1y1b n LEU 6 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.09 1y1b n LEU 6 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.95 1y1b n LEU 6 CO 0.51 0.00 -0.46 -0.38 0.00 0.00 0.00 177.39 177.06 1y1b n ILE 7 N 0.00 -5.49 0.00 1.96 5.41 -1.26 -5.08 119.36 114.90 1y1b n ILE 7 Ca 0.00 2.50 0.00 0.00 1.00 0.00 0.00 62.75 66.25 1y1b n ILE 7 Cb 0.00 -3.35 0.00 0.00 -0.71 0.00 0.00 39.64 35.58 1y1b n ILE 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1y1b s THR 9 N 0.00 2.96 -0.81 0.00 -4.23 -1.26 -4.99 115.64 107.30 1y1b s THR 9 Ca 0.00 -0.71 0.15 0.00 -1.18 0.00 0.00 61.69 59.95 1y1b s THR 9 Cb 0.00 -2.21 0.69 0.00 1.34 0.00 0.00 72.50 72.32 1y1b s THR 9 CO 0.00 0.54 1.58 0.23 -0.54 0.00 0.00 174.62 176.43 1y1b n MET 10 N 3.28 3.94 -3.13 3.99 2.81 -1.26 -4.61 117.12 122.14 1y1b n MET 10 Ca -0.18 -2.70 -0.41 0.00 -1.81 0.00 0.00 57.70 52.60 1y1b n MET 10 Cb 0.53 -2.00 -0.01 0.00 -0.71 0.00 0.00 33.22 31.03 1y1b n MET 10 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1y1b n GLN 11 N 0.82 4.04 0.00 0.03 6.02 -1.26 -4.98 117.38 122.05 1y1b n GLN 11 Ca 0.24 -4.56 0.00 0.00 -0.01 0.00 0.00 57.00 52.67 1y1b n GLN 11 Cb 0.95 -2.48 0.00 0.00 1.02 0.00 0.00 30.24 29.73 1y1b n GLN 11 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 1y1b n TYR 12 N 1.48 0.00 -3.07 1.08 9.36 -1.26 -4.80 117.16 119.95 1y1b n TYR 12 Ca 0.26 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 61.23 1y1b n TYR 12 Cb 0.35 0.00 -0.05 0.00 -0.63 0.00 0.00 39.34 39.01 1y1b n TYR 12 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1y1b n ASP 13 N 0.00 3.53 -4.51 2.98 -0.08 -1.03 -5.06 116.55 112.38 1y1b n ASP 13 Ca 0.00 -3.48 -0.53 0.00 -1.51 0.00 0.00 54.79 49.27 1y1b n ASP 13 Cb 0.00 -0.59 -0.07 0.00 2.34 0.00 0.00 41.12 42.80 1y1b n ASP 13 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1y1b n PRO 14 N 0.09 1.12 -5.15 -0.67 -0.04 -1.21 -3.84 135.00 125.29 1y1b n PRO 14 Ca 0.29 0.34 -0.31 0.00 -0.04 0.00 0.00 63.50 63.79 1y1b n PRO 14 Cb 0.45 -2.34 -0.17 0.00 -0.04 0.00 0.00 33.50 31.40 1y1b n PRO 14 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1y1b s VAL 15 N 6.17 1.95 -0.03 0.52 -7.23 -0.73 -0.75 120.40 120.30 1y1b s VAL 15 Ca 1.07 -0.96 -0.30 0.00 -1.81 0.00 0.00 61.98 59.97 1y1b s VAL 15 Cb -0.93 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 1y1b s VAL 15 CO 0.54 0.54 1.04 0.00 -0.31 0.00 0.00 175.10 176.91 1y1b s GLY 17 N 1.10 1.90 -0.82 0.00 0.00 0.98 -2.16 107.32 108.31 1y1b s GLY 17 Ca 0.52 -0.77 -0.23 0.00 0.00 0.00 0.00 44.72 44.25 1y1b s GLY 17 CO 0.25 -0.40 2.41 -1.26 0.00 0.00 0.00 173.10 174.09 1y1b n SER 18 N 2.45 0.75 0.00 1.64 2.88 0.43 -1.74 113.62 120.03 1y1b n SER 18 Ca -0.18 -0.66 0.00 0.00 -1.33 0.00 0.00 58.87 56.69 1y1b n SER 18 Cb 0.54 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 1y1b n SER 18 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1y1b n ASP 19 N 12.92 0.00 0.00 -3.46 2.03 -1.26 -3.01 116.55 123.77 1y1b n ASP 19 Ca 0.54 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.85 1y1b n ASP 19 Cb 0.30 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.70 1y1b n ASP 19 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1y1b n GLY 20 N 0.00 1.69 2.85 0.27 0.00 -0.71 -5.13 105.19 104.15 1y1b n GLY 20 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1y1b n GLY 20 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y1b s ILE 21 N -2.00 0.21 -0.56 -0.61 -1.09 -1.20 -5.01 121.20 110.94 1y1b s ILE 21 Ca 0.00 0.02 -0.20 0.00 -2.23 0.00 0.00 60.65 58.25 1y1b s ILE 21 Cb 0.00 -0.27 0.08 0.00 -1.58 0.00 0.00 42.46 40.69 1y1b s ILE 21 CO 0.00 0.13 0.71 -0.89 -1.23 0.00 0.00 174.94 173.66 1y1b s THR 22 N 0.75 4.76 0.72 2.92 2.01 -1.26 -0.02 115.64 125.52 1y1b s THR 22 Ca -0.08 -0.62 -0.10 0.00 0.31 0.00 0.00 61.69 61.20 1y1b s THR 22 Cb -0.11 -4.43 0.04 0.00 0.01 0.00 0.00 72.50 68.01 1y1b s THR 22 CO -0.01 -1.02 1.08 -0.31 -0.69 0.00 0.00 174.62 173.67 1y1b s TYR 23 N 2.89 3.17 -0.77 4.92 1.51 0.02 -4.85 117.35 124.24 1y1b s TYR 23 Ca 0.15 0.85 0.26 0.00 -1.01 0.00 0.00 57.07 57.32 1y1b s TYR 23 Cb -0.20 -3.15 0.91 0.00 -0.11 0.00 0.00 41.96 39.41 1y1b s TYR 23 CO 0.10 -1.31 1.79 0.41 -1.11 0.00 0.00 175.55 175.43 1y1b n GLY 24 N -3.02 -1.60 3.65 0.71 0.00 -1.26 -1.78 105.19 101.88 1y1b n GLY 24 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 1y1b n GLY 24 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1y1b s ASN 25 N -4.13 -0.02 0.55 1.61 0.01 -1.25 -2.48 114.94 109.23 1y1b s ASN 25 Ca 0.11 0.02 0.34 0.00 -0.71 0.00 0.00 52.86 52.62 1y1b s ASN 25 Cb 0.13 0.02 1.51 0.00 0.41 0.00 0.00 41.25 43.32 1y1b s ASN 25 CO 0.55 -0.02 1.83 0.00 -1.51 0.00 0.00 177.10 177.95 1y1b h ALA 26 N 2.05 2.96 -0.01 0.60 0.00 -1.89 0.68 119.26 123.64 1y1b h ALA 26 Ca -0.08 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1y1b h ALA 26 Cb 1.19 0.08 0.01 0.00 0.00 0.00 0.00 17.79 19.06 1y1b h ALA 26 CO 0.21 -1.30 -0.44 0.00 0.00 0.00 0.00 179.25 177.73 1y1b h MET 28 N -0.24 0.00 0.09 0.00 2.86 -0.13 -0.63 114.93 116.88 1y1b h MET 28 Ca -0.05 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1y1b h MET 28 Cb 1.15 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.81 1y1b h MET 28 CO 0.09 0.00 -0.04 1.25 1.06 0.00 0.00 176.91 179.27 1y1b h LEU 29 N 0.00 -0.10 -1.01 1.22 6.46 -0.65 -1.91 115.31 119.32 1y1b h LEU 29 Ca 0.20 -0.19 0.28 0.00 -0.12 0.00 0.00 57.88 58.04 1y1b h LEU 29 Cb 0.78 0.03 -0.13 0.00 -0.73 0.00 0.00 40.66 40.61 1y1b h LEU 29 CO -0.00 0.14 0.59 0.17 -0.62 0.00 0.00 178.44 178.71 1y1b h LEU 30 N -0.33 0.61 -1.02 2.25 8.10 -0.92 2.24 115.31 126.24 1y1b h LEU 30 Ca -0.01 0.16 -0.07 0.00 0.11 0.00 0.00 57.88 58.06 1y1b h LEU 30 Cb 0.28 0.07 -0.02 0.00 -0.44 0.00 0.00 40.66 40.56 1y1b h LEU 30 CO 0.02 0.01 -0.06 1.23 -4.11 0.00 0.00 178.44 175.53 1y1b h GLY 31 N 0.48 0.69 1.00 0.17 0.00 -1.27 -2.63 103.07 101.49 1y1b h GLY 31 Ca 0.68 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1y1b h GLY 31 CO -0.52 0.43 0.25 0.00 0.00 0.00 0.00 176.54 176.70 1y1b h ALA 32 N 1.35 0.50 -0.05 3.60 0.00 0.44 0.41 119.26 125.51 1y1b h ALA 32 Ca 0.11 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1y1b h ALA 32 Cb 0.46 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1y1b h ALA 32 CO 0.02 -0.03 -0.04 0.66 0.00 0.00 0.00 179.25 179.87 1y1b h SER 33 N 0.53 -0.12 0.06 0.00 4.64 -0.68 0.35 113.55 118.34 1y1b h SER 33 Ca 0.14 0.03 -0.14 0.00 -0.47 0.00 0.00 61.79 61.35 1y1b h SER 33 Cb -0.04 0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1y1b h SER 33 CO -0.03 -0.05 -0.46 0.00 -0.87 0.00 0.00 176.83 175.41 1y1b h ARG 35 N 0.38 0.28 0.00 0.00 2.47 0.08 -3.40 114.38 114.19 1y1b h ARG 35 Ca 0.02 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 1y1b h ARG 35 Cb 0.96 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.29 1y1b h ARG 35 CO 0.08 0.69 0.00 0.45 0.56 0.00 0.00 179.97 181.75 1y1b n SER 36 N -3.98 0.00 0.00 7.04 2.88 0.09 -5.07 113.62 114.58 1y1b n SER 36 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1y1b n SER 36 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1y1b n SER 36 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1y1b n ASP 37 N 0.00 0.00 -4.78 -3.46 2.03 -0.99 -5.07 116.55 104.28 1y1b n ASP 37 Ca 0.00 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.93 1y1b n ASP 37 Cb 0.00 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.34 1y1b n ASP 37 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1y1b s THR 38 N 0.00 4.95 -1.14 5.18 -1.32 -1.26 -4.96 115.64 117.09 1y1b s THR 38 Ca 0.00 1.09 -0.12 0.00 -1.21 0.00 0.00 61.69 61.45 1y1b s THR 38 Cb 0.00 -3.85 -0.07 0.00 -1.51 0.00 0.00 72.50 67.07 1y1b s THR 38 CO 0.00 0.46 2.28 -2.65 -2.21 0.00 0.00 174.62 172.50 1y1b n PRO 39 N 2.50 2.45 -0.91 7.08 -0.02 -1.26 -4.47 135.00 140.37 1y1b n PRO 39 Ca -0.09 -1.93 -0.36 0.00 -2.02 0.00 0.00 63.50 59.10 1y1b n PRO 39 Cb 0.51 -2.80 0.07 0.00 -0.02 0.00 0.00 33.50 31.27 1y1b n PRO 39 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1y1b n ILE 40 N 4.66 0.00 -4.37 4.25 -0.00 -1.26 -5.01 119.36 117.63 1y1b n ILE 40 Ca 0.55 -0.21 -0.19 0.00 -0.00 0.00 0.00 62.75 62.89 1y1b n ILE 40 Cb 0.27 -0.20 -0.06 0.00 -0.00 0.00 0.00 39.64 39.65 1y1b n ILE 40 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1y1b n GLU 41 N 1.03 0.59 -4.23 6.28 1.02 -1.16 -4.89 120.64 119.27 1y1b n GLU 41 Ca -0.00 -2.74 -0.34 0.00 -0.02 0.00 0.00 57.16 54.05 1y1b n GLU 41 Cb 0.66 1.63 -0.10 0.00 -0.02 0.00 0.00 31.44 33.60 1y1b n GLU 41 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1y1b s LEU 42 N 0.00 3.57 0.00 -4.62 1.98 -1.26 0.16 118.68 118.51 1y1b s LEU 42 Ca 0.19 0.03 0.00 0.00 -2.89 0.00 0.00 54.13 51.46 1y1b s LEU 42 Cb 0.01 -1.87 0.00 0.00 0.66 0.00 0.00 46.19 44.99 1y1b s LEU 42 CO 0.14 0.22 0.00 0.55 -1.89 0.00 0.00 176.35 175.37 1y1b n VAL 43 N 3.19 0.00 -3.91 1.68 3.14 -0.92 -4.77 118.33 116.75 1y1b n VAL 43 Ca -0.17 0.00 -0.28 0.00 -2.96 0.00 0.00 64.34 60.92 1y1b n VAL 43 Cb 0.53 -0.49 -0.16 0.00 -1.06 0.00 0.00 33.84 32.65 1y1b n VAL 43 CO 0.00 0.00 0.00 -1.00 -6.46 0.00 0.00 176.83 169.37 1y1b s HIS 44 N -1.71 1.80 -0.48 1.45 3.76 -1.13 -5.02 115.29 113.97 1y1b s HIS 44 Ca 0.00 -1.15 -0.06 0.00 -0.15 0.00 0.00 55.06 53.70 1y1b s HIS 44 Cb 0.00 -1.36 -0.17 0.00 1.11 0.00 0.00 32.58 32.16 1y1b s HIS 44 CO 0.00 -0.63 2.94 1.63 -0.85 0.00 0.00 174.74 177.83 1y1b n LYS 45 N 4.85 2.16 0.00 1.40 5.02 -1.26 0.24 118.16 130.57 1y1b n LYS 45 Ca -0.12 -1.21 0.00 0.00 -2.02 0.00 0.00 58.31 54.95 1y1b n LYS 45 Cb 0.48 -2.18 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 1y1b n LYS 45 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1y1b n GLY 46 N 2.96 1.78 2.48 0.72 0.00 0.07 -4.77 105.19 108.43 1y1b n GLY 46 Ca 0.46 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 1y1b n GLY 46 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1y1b n ARG 47 N 0.00 4.00 -0.25 1.61 1.85 -1.23 -2.68 116.66 119.96 1y1b n ARG 47 Ca 0.00 -3.15 0.00 0.00 -1.00 0.00 0.00 57.85 53.70 1y1b n ARG 47 Cb 0.00 -2.49 0.00 0.00 -1.05 0.00 0.00 32.46 28.92 1y1b n ARG 47 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62