#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2flg s ILE 2 N 0.00 4.96 -0.82 -1.44 -1.09 -1.26 -4.97 121.20 116.58 2flg s ILE 2 Ca 0.00 -1.00 0.01 0.00 -2.23 0.00 0.00 60.65 57.44 2flg s ILE 2 Cb 0.00 -4.38 0.25 0.00 -1.58 0.00 0.00 42.46 36.75 2flg s ILE 2 CO 0.00 -0.95 0.93 -0.24 -1.23 0.00 0.00 174.94 173.45 2flg n SER 3 N 5.95 4.51 -4.24 3.58 2.88 -1.26 -5.04 113.62 120.00 2flg n SER 3 Ca -0.10 -3.34 -0.18 0.00 -1.33 0.00 0.00 58.87 53.92 2flg n SER 3 Cb 0.43 -0.93 -0.11 0.00 -0.75 0.00 0.00 64.21 62.85 2flg n SER 3 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2flg s GLN 4 N -2.22 1.03 -1.18 -1.46 -0.21 -1.26 -5.04 119.66 109.31 2flg s GLN 4 Ca 0.34 -1.25 -0.08 0.00 0.02 0.00 0.00 55.36 54.38 2flg s GLN 4 Cb 0.05 -0.88 -0.11 0.00 1.00 0.00 0.00 33.01 33.07 2flg s GLN 4 CO -0.02 0.17 3.06 -2.39 -2.12 0.00 0.00 175.29 173.99 2flg n HIS 5 N 0.48 1.85 -0.93 0.91 1.44 -1.26 -4.93 115.22 112.78 2flg n HIS 5 Ca -0.15 -2.66 -0.23 0.00 -2.01 0.00 0.00 57.72 52.66 2flg n HIS 5 Cb 0.57 -2.19 0.19 0.00 0.12 0.00 0.00 29.99 28.68 2flg n HIS 5 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 2flg n GLN 6 N 3.07 -2.64 -2.49 -1.40 6.02 -1.26 -0.11 117.38 118.56 2flg n GLN 6 Ca 0.68 -1.35 -0.37 0.00 -0.01 0.00 0.00 57.00 55.95 2flg n GLN 6 Cb 0.40 -1.26 -0.04 0.00 1.02 0.00 0.00 30.24 30.37 2flg n GLN 6 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2flg n VAL 8 N 0.06 0.07 -2.51 0.00 0.31 -1.26 -4.77 118.33 110.22 2flg n VAL 8 Ca 0.04 -0.05 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 2flg n VAL 8 Cb 0.49 -0.59 0.05 0.00 -0.91 0.00 0.00 33.84 32.87 2flg n VAL 8 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2flg n LYS 9 N -1.92 1.76 -4.43 5.55 4.01 -1.26 -5.07 118.16 116.79 2flg n LYS 9 Ca -0.02 -3.33 -0.25 0.00 -0.51 0.00 0.00 58.31 54.21 2flg n LYS 9 Cb 0.41 -1.43 -0.13 0.00 -0.51 0.00 0.00 35.03 33.38 2flg n LYS 9 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 2flg s LYS 10 N -2.97 1.23 0.00 1.97 2.47 -1.26 -5.09 119.74 116.09 2flg s LYS 10 Ca 0.34 -1.07 0.00 0.00 -1.56 0.00 0.00 55.97 53.68 2flg s LYS 10 Cb 0.36 -1.43 0.00 0.00 -1.46 0.00 0.00 37.83 35.30 2flg s LYS 10 CO -0.05 0.35 0.00 1.04 0.16 0.00 0.00 175.35 176.84 2flg n GLN 11 N 1.41 0.00 -1.28 4.03 1.13 -1.26 -5.01 117.38 116.40 2flg n GLN 11 Ca -0.19 0.16 0.08 0.00 -1.94 0.00 0.00 57.00 55.12 2flg n GLN 11 Cb 0.53 -0.60 -0.04 0.00 0.11 0.00 0.00 30.24 30.24 2flg n GLN 11 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2flg s PRO 13 N -4.66 1.63 0.00 0.00 0.04 -1.26 -4.95 135.00 125.81 2flg s PRO 13 Ca 0.00 0.95 0.29 0.00 0.04 0.00 0.00 61.00 62.28 2flg s PRO 13 Cb 0.00 -1.84 1.21 0.00 0.04 0.00 0.00 34.50 33.91 2flg s PRO 13 CO 0.00 -2.02 1.84 1.04 0.04 0.00 0.00 177.00 177.90 2flg n GLN 14 N -3.75 1.09 -0.62 4.56 6.02 -1.26 -3.51 117.38 119.90 2flg n GLN 14 Ca 0.08 -0.48 0.07 0.00 -0.01 0.00 0.00 57.00 56.66 2flg n GLN 14 Cb 0.54 -1.49 0.30 0.00 1.02 0.00 0.00 30.24 30.61 2flg n GLN 14 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2flg n ASN 15 N -0.54 4.38 -4.18 1.08 4.13 -1.26 -4.98 115.26 113.88 2flg n ASN 15 Ca 0.17 -3.05 -0.14 0.00 1.68 0.00 0.00 54.58 53.24 2flg n ASN 15 Cb 0.29 -0.60 -0.10 0.00 -1.54 0.00 0.00 39.78 37.82 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 -1.61 0.60 -0.57 6.41 0.01 -1.23 -3.80 113.70 113.51 2flg s SER 16 Ca 0.47 -1.42 0.06 0.00 1.31 0.00 0.00 55.95 56.37 2flg s SER 16 Cb 0.37 0.33 0.29 0.00 0.21 0.00 0.00 66.02 67.22 2flg s SER 16 CO 0.11 -0.82 0.79 0.61 0.41 0.00 0.00 173.24 174.34 2flg n GLY 17 N -0.36 4.81 3.24 3.44 0.00 0.49 -4.69 105.19 112.12 2flg n GLY 17 Ca 0.02 -2.58 -0.34 0.00 0.00 0.00 0.00 46.02 43.12 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 -0.21 -0.05 0.00 -0.71 -1.22 -4.47 117.98 109.09 2flg s PHE 19 Ca 0.51 0.49 -0.27 0.00 -1.04 0.00 0.00 56.93 56.61 2flg s PHE 19 Cb -0.13 0.44 -0.03 0.00 -1.21 0.00 0.00 43.02 42.10 2flg s PHE 19 CO 0.69 -0.12 0.87 0.50 -1.34 0.00 0.00 175.22 175.83 2flg s ARG 20 N -0.16 4.47 0.82 1.99 3.52 0.84 -1.48 118.95 128.95 2flg s ARG 20 Ca 0.05 1.19 -0.12 0.00 -0.13 0.00 0.00 55.73 56.72 2flg s ARG 20 Cb -0.04 -3.48 0.09 0.00 -1.56 0.00 0.00 34.95 29.96 2flg s ARG 20 CO -0.10 -0.07 1.15 -1.01 -0.81 0.00 0.00 175.30 174.46 2flg s HIS 21 N 1.18 2.87 0.61 5.12 3.76 0.80 -4.73 115.29 124.90 2flg s HIS 21 Ca 0.45 0.85 0.31 0.00 -0.15 0.00 0.00 55.06 56.52 2flg s HIS 21 Cb -0.19 -3.39 1.77 0.00 1.11 0.00 0.00 32.58 31.88 2flg s HIS 21 CO 0.22 -1.86 2.12 -0.07 -0.85 0.00 0.00 174.74 174.30 2flg h LEU 22 N -1.13 0.00 -3.89 0.89 3.38 -1.97 0.61 115.31 113.21 2flg h LEU 22 Ca -0.47 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 56.98 2flg h LEU 22 Cb 1.32 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.78 2flg h LEU 22 CO 0.64 0.00 0.67 -0.67 0.09 0.00 0.00 178.44 179.17 2flg n ASP 23 N -3.59 4.60 -3.92 -0.43 2.03 -1.26 -4.88 116.55 109.10 2flg n ASP 23 Ca 0.00 -3.55 -0.31 0.00 0.52 0.00 0.00 54.79 51.45 2flg n ASP 23 Cb 0.29 -0.86 0.01 0.00 -0.72 0.00 0.00 41.12 39.85 2flg n ASP 23 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2flg n GLU 24 N -0.98 -4.97 -3.88 -0.67 1.02 0.20 -4.94 120.64 106.43 2flg n GLU 24 Ca 0.57 0.56 -0.35 0.00 -0.02 0.00 0.00 57.16 57.92 2flg n GLU 24 Cb 1.38 -5.41 -0.13 0.00 -0.02 0.00 0.00 31.44 27.26 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 -6.63 2.15 0.10 3.49 3.52 -1.23 -4.81 118.95 115.54 2flg s ARG 25 Ca 0.66 -1.54 -0.30 0.00 -0.13 0.00 0.00 55.73 54.42 2flg s ARG 25 Cb -0.34 -3.31 -0.06 0.00 -1.56 0.00 0.00 34.95 29.68 2flg s ARG 25 CO 0.82 -0.82 1.05 -1.21 -0.81 0.00 0.00 175.30 174.33 2flg s GLU 26 N 1.16 4.59 -0.33 5.12 8.01 -1.26 -0.14 118.70 135.84 2flg s GLU 26 Ca 0.02 1.58 0.01 0.00 0.01 0.00 0.00 54.97 56.59 2flg s GLU 26 Cb -0.21 -3.36 0.10 0.00 -4.31 0.00 0.00 34.13 26.36 2flg s GLU 26 CO -0.03 0.03 0.11 -2.00 0.01 0.00 0.00 175.26 173.38 2flg s GLU 27 N 0.28 0.96 -1.13 1.61 2.12 -0.55 -4.93 118.70 117.06 2flg s GLU 27 Ca 0.51 -1.38 -0.21 0.00 0.36 0.00 0.00 54.97 54.25 2flg s GLU 27 Cb -0.26 -2.32 -0.07 0.00 0.26 0.00 0.00 34.13 31.75 2flg s GLU 27 CO 0.31 -1.00 1.91 0.00 -0.54 0.00 0.00 175.26 175.94 2flg s LYS 29 N 5.56 3.53 0.60 0.00 2.20 -1.26 -4.83 119.74 125.53 2flg s LYS 29 Ca 0.62 -0.10 -0.18 0.00 -0.36 0.00 0.00 55.97 55.95 2flg s LYS 29 Cb 0.04 -3.14 -0.05 0.00 -1.51 0.00 0.00 37.83 33.17 2flg s LYS 29 CO 0.11 0.71 0.92 0.00 -0.36 0.00 0.00 175.35 176.73 2flg n LEU 31 N -0.65 0.00 0.00 0.00 4.77 -1.25 -4.48 117.00 115.38 2flg n LEU 31 Ca 0.14 -0.67 0.13 0.00 -0.03 0.00 0.00 56.01 55.58 2flg n LEU 31 Cb 0.47 -0.84 0.66 0.00 -2.33 0.00 0.00 43.42 41.39 2flg n LEU 31 CO 0.49 -2.61 0.93 0.00 -1.33 0.00 0.00 177.39 174.88 2flg n LEU 32 N 0.00 0.00 -1.43 2.23 -0.00 -1.26 -2.98 117.00 113.56 2flg n LEU 32 Ca 0.10 0.25 -0.10 0.00 -0.00 0.00 0.00 56.01 56.26 2flg n LEU 32 Cb 0.46 -0.25 0.18 0.00 -0.00 0.00 0.00 43.42 43.81 2flg n LEU 32 CO 0.30 -0.04 0.79 0.59 -0.00 0.00 0.00 177.39 179.03 2flg n ASN 33 N -1.25 2.99 -3.63 1.45 3.02 -1.26 -4.88 115.26 111.70 2flg n ASN 33 Ca 0.13 -3.77 -0.29 0.00 -0.03 0.00 0.00 54.58 50.62 2flg n ASN 33 Cb 0.19 -0.67 -0.15 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 -3.31 0.79 -0.84 3.10 1.51 -1.16 -2.76 117.35 114.69 2flg s TYR 34 Ca 0.48 -1.05 -0.25 0.00 -1.01 0.00 0.00 57.07 55.23 2flg s TYR 34 Cb 0.42 -1.12 0.02 0.00 -0.11 0.00 0.00 41.96 41.17 2flg s TYR 34 CO 0.01 -0.78 1.48 0.15 -1.11 0.00 0.00 175.55 175.31 2flg s LYS 35 N 1.94 3.19 -0.38 -0.62 1.02 -1.13 -4.77 119.74 118.99 2flg s LYS 35 Ca 0.07 -0.43 -0.35 0.00 0.02 0.00 0.00 55.97 55.27 2flg s LYS 35 Cb -0.16 -4.70 -0.12 0.00 -0.52 0.00 0.00 37.83 32.33 2flg s LYS 35 CO -0.27 -2.37 2.21 0.94 -0.92 0.00 0.00 175.35 174.94 2flg n GLN 36 N 9.13 0.98 -0.07 1.68 7.27 -1.26 -4.55 117.38 130.57 2flg n GLN 36 Ca 0.19 0.26 -0.09 0.00 0.07 0.00 0.00 57.00 57.43 2flg n GLN 36 Cb 0.50 -2.41 -0.06 0.00 2.41 0.00 0.00 30.24 30.68 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 12.38 0.00 0.00 3.69 4.57 -1.92 -3.50 114.58 129.80 2flg h GLU 37 Ca -0.25 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 2flg h GLU 37 Cb 1.33 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.92 2flg h GLU 37 CO 1.04 0.45 0.00 0.41 -1.18 0.00 0.00 179.01 179.73 2flg n GLY 38 N 1.62 0.67 2.43 1.92 0.00 -1.26 -5.01 105.19 105.55 2flg n GLY 38 Ca -0.12 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 2flg n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2flg n ASP 39 N 0.00 4.23 -3.59 1.61 9.92 -1.26 -5.04 116.55 122.43 2flg n ASP 39 Ca 0.00 -3.54 -0.06 0.00 -0.53 0.00 0.00 54.79 50.66 2flg n ASP 39 Cb 0.00 -0.45 -0.03 0.00 -0.64 0.00 0.00 41.12 40.00 2flg n ASP 39 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 2flg s LYS 40 N -3.51 0.37 0.16 -1.24 -2.85 -1.26 -5.16 119.74 106.25 2flg s LYS 40 Ca 0.45 -0.06 -0.20 0.00 -1.00 0.00 0.00 55.97 55.16 2flg s LYS 40 Cb 0.41 0.17 -0.08 0.00 -2.06 0.00 0.00 37.83 36.27 2flg s LYS 40 CO -0.12 -0.15 0.68 0.00 0.10 0.00 0.00 175.35 175.86 2flg s VAL 42 N -1.31 0.20 -0.96 0.00 -7.23 -1.26 -5.05 120.40 104.80 2flg s VAL 42 Ca 0.37 -0.26 -0.24 0.00 -1.81 0.00 0.00 61.98 60.03 2flg s VAL 42 Cb -0.19 -0.73 -0.08 0.00 0.56 0.00 0.00 36.38 35.94 2flg s VAL 42 CO 0.22 -0.18 2.02 -1.83 -0.31 0.00 0.00 175.10 175.02 2flg s GLU 43 N 2.01 2.31 -0.58 4.82 -1.05 -1.26 -2.83 118.70 122.12 2flg s GLU 43 Ca 0.01 -0.37 -0.15 0.00 -0.15 0.00 0.00 54.97 54.31 2flg s GLU 43 Cb -0.16 -5.06 0.02 0.00 -0.44 0.00 0.00 34.13 28.50 2flg s GLU 43 CO -0.08 -3.81 0.64 -1.71 0.95 0.00 0.00 175.26 171.26 2flg n ASN 44 N 15.13 -6.73 -0.03 0.83 4.05 -1.11 -4.93 115.26 122.46 2flg n ASN 44 Ca 0.42 -0.06 -0.13 0.00 0.45 0.00 0.00 54.58 55.26 2flg n ASN 44 Cb 0.46 -3.76 -0.09 0.00 1.23 0.00 0.00 39.78 37.63 2flg n ASN 44 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2flg h PRO 45 N 1.23 0.14 -1.05 1.20 0.13 -1.92 -3.49 132.00 128.24 2flg h PRO 45 Ca -0.26 -0.07 0.33 0.00 -0.87 0.00 0.00 66.00 65.13 2flg h PRO 45 Cb 1.18 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.10 2flg h PRO 45 CO 0.26 0.58 0.98 0.54 -0.23 0.00 0.00 178.00 180.14 2flg s ASN 46 N -5.86 -0.01 -1.12 1.44 4.22 -1.26 -5.07 114.94 107.28 2flg s ASN 46 Ca -0.15 -0.00 -0.23 0.00 -2.14 0.00 0.00 52.86 50.34 2flg s ASN 46 Cb 0.03 0.02 -0.10 0.00 1.28 0.00 0.00 41.25 42.47 2flg s ASN 46 CO 0.70 -0.02 1.93 -0.81 -2.04 0.00 0.00 177.10 176.86 2flg n PRO 47 N -0.01 1.57 0.00 3.55 -0.04 -1.26 -5.11 135.00 133.69 2flg n PRO 47 Ca 0.05 -2.36 0.02 0.00 -0.04 0.00 0.00 63.50 61.17 2flg n PRO 47 Cb 0.56 -3.60 0.11 0.00 -0.04 0.00 0.00 33.50 30.53 2flg n PRO 47 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71