#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2flg n ILE 2 N 0.00 1.81 -2.55 1.53 -6.64 -1.26 -5.00 119.36 107.25 2flg n ILE 2 Ca 0.00 -2.68 -0.41 0.00 -1.77 0.00 0.00 62.75 57.89 2flg n ILE 2 Cb 0.00 -0.07 -0.03 0.00 -1.44 0.00 0.00 39.64 38.10 2flg n ILE 2 CO 0.00 0.00 0.00 -0.55 -1.77 0.00 0.00 176.55 174.23 2flg s SER 3 N -2.94 6.19 0.31 7.28 0.15 -1.26 -4.99 113.70 118.44 2flg s SER 3 Ca 0.35 -0.55 -0.29 0.00 0.70 0.00 0.00 55.95 56.16 2flg s SER 3 Cb 0.34 -2.56 -0.10 0.00 -1.71 0.00 0.00 66.02 61.99 2flg s SER 3 CO -0.06 -1.81 1.40 0.00 1.20 0.00 0.00 173.24 173.98 2flg s GLN 4 N 5.67 4.27 1.15 5.44 -2.07 -1.26 -4.98 119.66 127.88 2flg s GLN 4 Ca 0.36 2.33 -0.17 0.00 -1.82 0.00 0.00 55.36 56.05 2flg s GLN 4 Cb -0.07 -3.07 0.17 0.00 -1.09 0.00 0.00 33.01 28.95 2flg s GLN 4 CO 0.13 -0.36 0.28 -2.39 -1.32 0.00 0.00 175.29 171.63 2flg n HIS 5 N 1.40 -1.56 -3.83 9.60 1.44 -1.26 -5.04 115.22 115.96 2flg n HIS 5 Ca 0.03 0.01 -0.03 0.00 -2.01 0.00 0.00 57.72 55.73 2flg n HIS 5 Cb 0.41 -1.57 0.02 0.00 0.12 0.00 0.00 29.99 28.97 2flg n HIS 5 CO 0.00 0.00 0.00 0.94 -2.81 0.00 0.00 176.34 174.47 2flg n GLN 6 N -2.91 0.56 -2.74 -1.40 7.27 -1.26 -4.58 117.38 112.32 2flg n GLN 6 Ca 0.02 -1.28 -0.41 0.00 0.07 0.00 0.00 57.00 55.39 2flg n GLN 6 Cb 0.59 1.74 -0.04 0.00 2.41 0.00 0.00 30.24 34.94 2flg n GLN 6 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2flg n VAL 8 N 3.06 0.00 -1.76 0.00 0.24 -1.26 -4.73 118.33 113.89 2flg n VAL 8 Ca 0.03 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 2flg n VAL 8 Cb 0.50 1.08 0.00 0.00 -1.47 0.00 0.00 33.84 33.95 2flg n VAL 8 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2flg n LYS 9 N -0.42 0.00 -4.27 7.34 2.85 -1.26 -5.11 118.16 117.29 2flg n LYS 9 Ca 0.00 -0.57 -0.23 0.00 -1.05 0.00 0.00 58.31 56.46 2flg n LYS 9 Cb 0.02 -0.35 -0.07 0.00 -0.65 0.00 0.00 35.03 33.98 2flg n LYS 9 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2flg s LYS 10 N 0.00 2.37 0.00 -1.58 2.47 -1.26 -5.09 119.74 116.64 2flg s LYS 10 Ca 0.00 -1.34 0.00 0.00 -1.56 0.00 0.00 55.97 53.07 2flg s LYS 10 Cb 0.00 -2.23 0.00 0.00 -1.46 0.00 0.00 37.83 34.14 2flg s LYS 10 CO 0.00 0.38 0.00 1.04 0.16 0.00 0.00 175.35 176.93 2flg n GLN 11 N -0.81 0.00 -1.30 4.03 6.02 -1.26 -5.02 117.38 119.04 2flg n GLN 11 Ca -0.07 0.07 0.07 0.00 -0.01 0.00 0.00 57.00 57.06 2flg n GLN 11 Cb 0.58 -0.36 -0.04 0.00 1.02 0.00 0.00 30.24 31.44 2flg n GLN 11 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2flg n PRO 13 N -3.23 -2.30 0.00 0.00 -0.04 -1.26 -4.98 135.00 123.19 2flg n PRO 13 Ca -0.04 -1.04 0.10 0.00 -0.04 0.00 0.00 63.50 62.48 2flg n PRO 13 Cb 0.50 -0.98 0.04 0.00 -0.04 0.00 0.00 33.50 33.03 2flg n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2flg n GLN 14 N -3.51 1.66 -0.20 0.54 0.00 -1.26 -4.18 117.38 110.43 2flg n GLN 14 Ca 0.09 -1.32 0.07 0.00 0.00 0.00 0.00 57.00 55.85 2flg n GLN 14 Cb 0.35 -1.40 0.18 0.00 0.00 0.00 0.00 30.24 29.38 2flg n GLN 14 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2flg n ASN 15 N 0.53 3.08 -4.20 2.61 4.13 -1.26 -4.97 115.26 115.18 2flg n ASN 15 Ca 0.10 -1.94 -0.22 0.00 1.68 0.00 0.00 54.58 54.20 2flg n ASN 15 Cb 0.47 -0.26 -0.13 0.00 -1.54 0.00 0.00 39.78 38.31 2flg n ASN 15 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2flg s SER 16 N -1.04 2.07 -1.02 6.41 0.01 -1.26 -3.86 113.70 115.01 2flg s SER 16 Ca 0.29 -0.53 -0.02 0.00 1.31 0.00 0.00 55.95 57.00 2flg s SER 16 Cb 0.16 -0.14 0.31 0.00 0.21 0.00 0.00 66.02 66.55 2flg s SER 16 CO 0.21 0.07 1.48 0.61 0.41 0.00 0.00 173.24 176.02 2flg n GLY 17 N 1.70 5.36 3.23 3.44 0.00 0.83 -4.80 105.19 114.95 2flg n GLY 17 Ca -0.18 -2.66 -0.34 0.00 0.00 0.00 0.00 46.02 42.83 2flg n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2flg s PHE 19 N -2.22 -0.36 -0.05 0.00 -0.71 -1.19 -4.56 117.98 108.90 2flg s PHE 19 Ca 0.50 0.83 -0.27 0.00 -1.04 0.00 0.00 56.93 56.96 2flg s PHE 19 Cb -0.14 0.40 -0.03 0.00 -1.21 0.00 0.00 43.02 42.05 2flg s PHE 19 CO 0.70 -0.20 0.84 0.50 -1.34 0.00 0.00 175.22 175.73 2flg s ARG 20 N -0.05 4.47 0.89 1.99 3.52 -1.25 -1.16 118.95 127.36 2flg s ARG 20 Ca 0.04 1.13 -0.13 0.00 -0.13 0.00 0.00 55.73 56.64 2flg s ARG 20 Cb -0.04 -3.47 0.13 0.00 -1.56 0.00 0.00 34.95 30.01 2flg s ARG 20 CO -0.07 -0.05 1.20 -1.01 -0.81 0.00 0.00 175.30 174.56 2flg s HIS 21 N 1.10 2.43 0.40 5.12 3.76 0.86 -4.60 115.29 124.36 2flg s HIS 21 Ca 0.44 0.66 0.31 0.00 -0.15 0.00 0.00 55.06 56.32 2flg s HIS 21 Cb -0.19 -3.62 1.60 0.00 1.11 0.00 0.00 32.58 31.48 2flg s HIS 21 CO 0.21 -2.21 2.11 -0.07 -0.85 0.00 0.00 174.74 173.93 2flg h LEU 22 N -1.36 0.00 -3.31 0.89 3.38 -1.97 -1.74 115.31 111.20 2flg h LEU 22 Ca -0.47 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.28 2flg h LEU 22 Cb 1.31 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.92 2flg h LEU 22 CO 0.57 0.08 0.28 0.47 0.09 0.00 0.00 178.44 179.93 2flg n ASP 23 N -3.45 4.10 -3.52 -0.43 8.00 -1.26 -4.89 116.55 115.10 2flg n ASP 23 Ca -0.02 -3.02 -0.19 0.00 0.71 0.00 0.00 54.79 52.28 2flg n ASP 23 Cb 0.22 -0.71 0.07 0.00 -0.02 0.00 0.00 41.12 40.68 2flg n ASP 23 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2flg n GLU 24 N -0.21 -5.58 -3.80 -1.24 1.02 -0.65 -5.00 120.64 105.18 2flg n GLU 24 Ca 0.35 0.76 -0.29 0.00 -0.02 0.00 0.00 57.16 57.97 2flg n GLU 24 Cb 1.23 -5.58 -0.16 0.00 -0.02 0.00 0.00 31.44 26.90 2flg n GLU 24 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2flg s ARG 25 N -5.52 0.98 0.05 3.49 3.52 -1.25 -4.87 118.95 115.35 2flg s ARG 25 Ca 0.04 -0.67 -0.30 0.00 -0.13 0.00 0.00 55.73 54.68 2flg s ARG 25 Cb -0.01 -2.27 -0.04 0.00 -1.56 0.00 0.00 34.95 31.07 2flg s ARG 25 CO 0.76 -0.66 1.00 -1.21 -0.81 0.00 0.00 175.30 174.39 2flg s GLU 26 N 1.68 4.59 -0.33 5.12 2.02 -1.26 -0.09 118.70 130.43 2flg s GLU 26 Ca -0.02 1.48 0.02 0.00 0.02 0.00 0.00 54.97 56.47 2flg s GLU 26 Cb -0.18 -3.42 0.10 0.00 0.10 0.00 0.00 34.13 30.74 2flg s GLU 26 CO -0.09 0.01 0.07 -2.00 0.02 0.00 0.00 175.26 173.27 2flg s GLU 27 N 0.66 1.20 -1.13 1.61 2.56 -0.31 -4.92 118.70 118.38 2flg s GLU 27 Ca 0.51 -1.59 -0.20 0.00 0.00 0.00 0.00 54.97 53.69 2flg s GLU 27 Cb -0.23 -2.76 -0.06 0.00 2.00 0.00 0.00 34.13 33.08 2flg s GLU 27 CO 0.29 -0.96 1.93 0.00 -0.56 0.00 0.00 175.26 175.96 2flg s LYS 29 N 5.15 3.51 0.53 0.00 2.20 -1.26 -4.82 119.74 125.04 2flg s LYS 29 Ca 0.59 -0.35 -0.22 0.00 -0.36 0.00 0.00 55.97 55.63 2flg s LYS 29 Cb 0.07 -2.92 -0.05 0.00 -1.51 0.00 0.00 37.83 33.41 2flg s LYS 29 CO 0.09 0.50 1.30 0.00 -0.36 0.00 0.00 175.35 176.88 2flg n LEU 31 N -0.95 0.00 0.00 0.00 4.77 -1.25 -4.56 117.00 115.00 2flg n LEU 31 Ca 0.10 -0.70 0.12 0.00 -0.03 0.00 0.00 56.01 55.50 2flg n LEU 31 Cb 0.46 -0.89 0.60 0.00 -2.33 0.00 0.00 43.42 41.26 2flg n LEU 31 CO 0.51 -2.68 0.90 -0.11 -1.33 0.00 0.00 177.39 174.68 2flg n LEU 32 N 0.00 0.00 -1.55 2.23 7.94 -1.26 -2.93 117.00 121.43 2flg n LEU 32 Ca 0.11 0.31 -0.12 0.00 -1.11 0.00 0.00 56.01 55.20 2flg n LEU 32 Cb 0.48 -0.31 0.17 0.00 0.53 0.00 0.00 43.42 44.29 2flg n LEU 32 CO 0.31 -0.06 0.84 0.59 -1.11 0.00 0.00 177.39 177.96 2flg n ASN 33 N -1.31 3.28 -3.68 1.96 3.02 -1.26 -4.88 115.26 112.39 2flg n ASN 33 Ca 0.11 -3.76 -0.28 0.00 -0.03 0.00 0.00 54.58 50.62 2flg n ASN 33 Cb 0.21 -0.69 -0.16 0.00 -0.61 0.00 0.00 39.78 38.53 2flg n ASN 33 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2flg s TYR 34 N -3.34 0.98 -0.89 3.10 1.51 -1.15 -2.98 117.35 114.58 2flg s TYR 34 Ca 0.49 -1.05 -0.25 0.00 -1.01 0.00 0.00 57.07 55.25 2flg s TYR 34 Cb 0.43 -1.16 -0.06 0.00 -0.11 0.00 0.00 41.96 41.06 2flg s TYR 34 CO 0.02 -0.72 2.01 0.15 -1.11 0.00 0.00 175.55 175.90 2flg s LYS 35 N 1.87 2.42 -0.58 -0.62 -0.14 -0.95 -4.74 119.74 117.00 2flg s LYS 35 Ca 0.05 -0.20 -0.31 0.00 -1.36 0.00 0.00 55.97 54.14 2flg s LYS 35 Cb -0.17 -5.03 -0.13 0.00 -1.68 0.00 0.00 37.83 30.82 2flg s LYS 35 CO -0.19 -3.54 2.40 0.94 -0.76 0.00 0.00 175.35 174.19 2flg n GLN 36 N 8.84 0.74 0.09 1.68 7.27 -1.26 -4.46 117.38 130.28 2flg n GLN 36 Ca 0.41 0.11 -0.04 0.00 0.07 0.00 0.00 57.00 57.55 2flg n GLN 36 Cb 0.46 -2.48 -0.02 0.00 2.41 0.00 0.00 30.24 30.62 2flg n GLN 36 CO 0.00 0.00 0.00 1.49 0.07 0.00 0.00 177.06 178.62 2flg h GLU 37 N 14.43 -0.26 0.00 3.69 4.81 -1.90 -3.48 114.58 131.87 2flg h GLU 37 Ca -0.20 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 2flg h GLU 37 Cb 1.30 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.74 2flg h GLU 37 CO 1.17 -0.17 0.00 0.41 -0.73 0.00 0.00 179.01 179.68 2flg n GLY 38 N 0.61 -0.69 1.04 1.92 0.00 -1.26 -4.99 105.19 101.82 2flg n GLY 38 Ca -0.03 0.10 0.02 0.00 0.00 0.00 0.00 46.02 46.11 2flg n GLY 38 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2flg n ASP 39 N -3.17 0.56 -3.82 1.61 2.03 -1.26 -5.09 116.55 107.41 2flg n ASP 39 Ca 0.00 -2.02 -0.10 0.00 0.52 0.00 0.00 54.79 53.20 2flg n ASP 39 Cb 0.00 -0.26 -0.07 0.00 -0.72 0.00 0.00 41.12 40.07 2flg n ASP 39 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 2flg s LYS 40 N -0.03 0.82 -0.07 -0.67 -2.85 -1.26 -5.16 119.74 110.52 2flg s LYS 40 Ca 0.19 -0.79 -0.12 0.00 -1.00 0.00 0.00 55.97 54.25 2flg s LYS 40 Cb 0.21 0.34 -0.05 0.00 -2.06 0.00 0.00 37.83 36.27 2flg s LYS 40 CO -0.09 -0.26 0.29 0.00 0.10 0.00 0.00 175.35 175.38 2flg s VAL 42 N -0.83 0.21 -0.90 0.00 -7.23 -1.26 -5.04 120.40 105.35 2flg s VAL 42 Ca 0.19 -0.12 -0.25 0.00 -1.81 0.00 0.00 61.98 59.99 2flg s VAL 42 Cb -0.14 -0.64 -0.08 0.00 0.56 0.00 0.00 36.38 36.08 2flg s VAL 42 CO 0.08 -0.05 2.08 -0.70 -0.31 0.00 0.00 175.10 176.20 2flg s GLU 43 N 2.02 2.23 -0.53 4.82 -6.30 -1.26 -2.24 118.70 117.43 2flg s GLU 43 Ca 0.02 -0.14 -0.19 0.00 -2.50 0.00 0.00 54.97 52.17 2flg s GLU 43 Cb -0.15 -4.99 0.03 0.00 0.00 0.00 0.00 34.13 29.02 2flg s GLU 43 CO -0.07 -3.80 0.64 -1.71 0.02 0.00 0.00 175.26 170.34 2flg n ASN 44 N 15.55 -6.79 0.01 -1.70 4.05 -1.16 -4.84 115.26 120.38 2flg n ASN 44 Ca 0.42 0.04 0.07 0.00 0.45 0.00 0.00 54.58 55.57 2flg n ASN 44 Cb 0.46 -3.76 0.32 0.00 1.23 0.00 0.00 39.78 38.02 2flg n ASN 44 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 2flg n PRO 45 N -0.78 0.02 -3.33 1.20 -0.04 -1.26 -3.70 135.00 127.11 2flg n PRO 45 Ca -0.02 0.27 -0.28 0.00 -0.04 0.00 0.00 63.50 63.43 2flg n PRO 45 Cb 0.57 -1.53 -0.07 0.00 -0.04 0.00 0.00 33.50 32.43 2flg n PRO 45 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2flg n ASN 46 N -1.56 4.07 -0.06 3.54 2.85 -1.26 -4.87 115.26 117.96 2flg n ASN 46 Ca 0.03 -3.48 -0.10 0.00 -0.11 0.00 0.00 54.58 50.92 2flg n ASN 46 Cb 0.17 -0.70 0.04 0.00 1.24 0.00 0.00 39.78 40.53 2flg n ASN 46 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2flg h PRO 47 N 4.11 0.76 0.00 1.20 0.13 -1.94 -3.55 132.00 132.71 2flg h PRO 47 Ca 0.19 -0.40 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2flg h PRO 47 Cb 0.63 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2flg h PRO 47 CO 0.87 1.02 0.00 0.25 -0.23 0.00 0.00 178.00 179.92