#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 1.98 -0.12 2.41 -5.25 -1.26 -5.06 121.20 113.91 2flg s ILE 2 Ca 0.00 0.00 0.00 0.00 -0.99 0.00 0.00 60.65 59.66 2flg s ILE 2 Cb 0.00 -2.59 0.02 0.00 2.95 0.00 0.00 42.46 42.84 2flg s ILE 2 CO 0.00 0.00 -0.11 -0.55 -1.79 0.00 0.00 174.94 172.49 2flg s SER 3 N -3.70 2.32 -0.37 4.36 0.15 -1.26 -5.11 113.70 110.09 2flg s SER 3 Ca 0.65 -0.37 -0.19 0.00 0.70 0.00 0.00 55.95 56.74 2flg s SER 3 Cb -0.17 -0.97 0.00 0.00 -1.71 0.00 0.00 66.02 63.17 2flg s SER 3 CO 0.56 -0.06 0.54 -1.58 1.20 0.00 0.00 173.24 173.89 2flg s GLN 4 N 1.43 3.54 1.26 5.44 2.00 -1.26 -5.06 119.66 127.01 2flg s GLN 4 Ca 0.01 -0.22 -0.16 0.00 -2.00 0.00 0.00 55.36 52.99 2flg s GLN 4 Cb -0.13 -3.84 0.30 0.00 0.80 0.00 0.00 33.01 30.14 2flg s GLN 4 CO -0.07 -0.72 0.85 -2.39 -0.50 0.00 0.00 175.29 172.47 2flg n HIS 5 N 5.83 -2.08 -3.83 1.67 1.44 -1.26 -5.06 115.22 111.94 2flg n HIS 5 Ca -0.04 -0.32 -0.07 0.00 -2.01 0.00 0.00 57.72 55.27 2flg n HIS 5 Cb 0.49 -1.57 0.02 0.00 0.12 0.00 0.00 29.99 29.05 2flg n HIS 5 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 2flg s GLN 6 N -4.43 1.96 0.30 -1.40 -0.21 -1.26 -4.68 119.66 109.94 2flg s GLN 6 Ca 0.66 -1.25 -0.29 0.00 0.02 0.00 0.00 55.36 54.50 2flg s GLN 6 Cb -0.20 0.56 -0.10 0.00 1.00 0.00 0.00 33.01 34.26 2flg s GLN 6 CO 0.63 -0.92 1.18 0.00 -2.12 0.00 0.00 175.29 174.06 2flg n VAL 8 N 1.02 0.04 -2.34 0.00 0.31 -1.26 -4.73 118.33 111.37 2flg n VAL 8 Ca -0.01 -0.08 0.02 0.00 -0.01 0.00 0.00 64.34 64.27 2flg n VAL 8 Cb 0.44 0.10 0.06 0.00 -0.91 0.00 0.00 33.84 33.53 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 -1.72 0.78 -4.48 5.55 4.01 -1.26 -5.07 118.16 115.97 2flg n LYS 9 Ca -0.01 -2.61 -0.21 0.00 -0.51 0.00 0.00 58.31 54.96 2flg n LYS 9 Cb 0.20 -0.70 -0.14 0.00 -0.51 0.00 0.00 35.03 33.88 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 -1.44 1.06 -0.00 1.97 2.47 -1.26 -5.08 119.74 117.46 2flg s LYS 10 Ca 0.35 -0.71 -0.00 0.00 -1.56 0.00 0.00 55.97 54.04 2flg s LYS 10 Cb 0.38 -1.07 -0.00 0.00 -1.46 0.00 0.00 37.83 35.67 2flg s LYS 10 CO -0.12 0.28 -0.00 1.96 0.16 0.00 0.00 175.35 177.63 2flg h GLN 11 N 5.17 0.00 -3.09 4.03 1.08 -1.98 -3.48 115.11 116.84 2flg h GLN 11 Ca -0.38 0.00 0.15 0.00 -1.45 0.00 0.00 58.65 56.97 2flg h GLN 11 Cb 1.17 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 28.52 2flg h GLN 11 CO 0.45 0.00 -0.96 0.00 -0.95 0.00 0.00 178.83 177.37 2flg s PRO 13 N -4.68 1.75 0.00 0.00 0.04 -1.26 -4.95 135.00 125.90 2flg s PRO 13 Ca 0.00 0.99 0.29 0.00 0.04 0.00 0.00 61.00 62.32 2flg s PRO 13 Cb 0.00 -1.85 1.25 0.00 0.04 0.00 0.00 34.50 33.94 2flg s PRO 13 CO 0.00 -1.95 1.87 0.00 0.04 0.00 0.00 177.00 176.96 2flg n GLN 14 N -3.71 0.83 -0.58 4.56 10.64 -1.26 -3.38 117.38 124.48 2flg n GLN 14 Ca 0.08 -0.30 0.08 0.00 -1.83 0.00 0.00 57.00 55.03 2flg n GLN 14 Cb 0.54 -1.49 0.32 0.00 -0.86 0.00 0.00 30.24 28.74 2flg n GLN 14 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2flg n ASN 15 N -0.82 4.54 -4.16 2.61 4.13 -1.26 -4.97 115.26 115.33 2flg n ASN 15 Ca 0.16 -2.69 -0.10 0.00 1.68 0.00 0.00 54.58 53.62 2flg n ASN 15 Cb 0.27 -0.56 -0.10 0.00 -1.54 0.00 0.00 39.78 37.86 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 -1.21 0.87 -0.74 6.41 0.01 -1.22 -3.54 113.70 114.28 2flg s SER 16 Ca 0.46 -1.06 0.03 0.00 1.31 0.00 0.00 55.95 56.69 2flg s SER 16 Cb 0.33 0.16 0.29 0.00 0.21 0.00 0.00 66.02 67.01 2flg s SER 16 CO 0.17 -0.56 1.05 0.61 0.41 0.00 0.00 173.24 174.92 2flg n GLY 17 N -0.05 5.26 3.24 3.44 0.00 0.31 -4.70 105.19 112.69 2flg n GLY 17 Ca -0.11 -2.74 -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 -0.30 -0.33 0.00 -0.71 -1.22 -4.52 117.98 108.67 2flg s PHE 19 Ca 0.51 0.73 -0.27 0.00 -1.04 0.00 0.00 56.93 56.86 2flg s PHE 19 Cb -0.12 0.40 0.01 0.00 -1.21 0.00 0.00 43.02 42.10 2flg s PHE 19 CO 0.69 -0.15 0.95 0.50 -1.34 0.00 0.00 175.22 175.88 2flg s ARG 20 N 0.24 3.96 1.47 1.99 3.52 -1.25 -1.56 118.95 127.32 2flg s ARG 20 Ca 0.04 0.78 -0.24 0.00 -0.13 0.00 0.00 55.73 56.17 2flg s ARG 20 Cb -0.05 -3.76 0.38 0.00 -1.56 0.00 0.00 34.95 29.96 2flg s ARG 20 CO -0.11 -0.87 0.90 -1.01 -0.81 0.00 0.00 175.30 173.41 2flg s HIS 21 N 3.43 -0.95 0.07 5.12 3.76 0.81 -4.71 115.29 122.82 2flg s HIS 21 Ca 0.40 0.53 0.22 0.00 -0.15 0.00 0.00 55.06 56.06 2flg s HIS 21 Cb -0.13 -2.82 0.75 0.00 1.11 0.00 0.00 32.58 31.50 2flg s HIS 21 CO 0.16 -5.22 1.75 -0.07 -0.85 0.00 0.00 174.74 170.52 2flg h LEU 22 N -3.59 0.00 -3.61 0.89 -0.00 -1.96 -2.95 115.31 104.08 2flg h LEU 22 Ca -0.41 0.00 -0.39 0.00 -0.00 0.00 0.00 57.88 57.08 2flg h LEU 22 Cb 1.35 0.00 -0.23 0.00 -0.00 0.00 0.00 40.66 41.78 2flg h LEU 22 CO 0.25 0.27 0.49 -0.67 -0.00 0.00 0.00 178.44 178.78 2flg n ASP 23 N -3.36 3.79 -3.55 -0.43 2.03 -1.26 -4.88 116.55 108.88 2flg n ASP 23 Ca 0.01 -3.28 -0.19 0.00 0.52 0.00 0.00 54.79 51.84 2flg n ASP 23 Cb 0.49 -0.77 0.07 0.00 -0.72 0.00 0.00 41.12 40.18 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 -0.72 -6.08 -3.85 -0.67 1.02 -1.11 -4.99 120.64 104.24 2flg n GLU 24 Ca 0.47 0.76 -0.30 0.00 -0.02 0.00 0.00 57.16 58.07 2flg n GLU 24 Cb 1.44 -5.62 -0.15 0.00 -0.02 0.00 0.00 31.44 27.08 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 -5.66 1.14 0.06 3.49 3.52 -1.26 -4.87 118.95 115.37 2flg s ARG 25 Ca 0.05 -1.12 -0.30 0.00 -0.13 0.00 0.00 55.73 54.23 2flg s ARG 25 Cb -0.02 -2.42 -0.05 0.00 -1.56 0.00 0.00 34.95 30.90 2flg s ARG 25 CO 0.76 -0.82 1.05 -1.21 -0.81 0.00 0.00 175.30 174.28 2flg s GLU 26 N 1.44 4.56 -0.36 5.12 2.02 -1.26 -0.13 118.70 130.09 2flg s GLU 26 Ca 0.04 1.56 0.02 0.00 0.02 0.00 0.00 54.97 56.61 2flg s GLU 26 Cb -0.18 -3.39 0.11 0.00 0.10 0.00 0.00 34.13 30.77 2flg s GLU 26 CO -0.14 -0.04 0.12 -2.00 0.02 0.00 0.00 175.26 173.22 2flg s GLU 27 N 0.63 1.17 -1.14 1.61 2.56 -0.60 -4.93 118.70 118.00 2flg s GLU 27 Ca 0.52 -1.63 -0.21 0.00 0.00 0.00 0.00 54.97 53.66 2flg s GLU 27 Cb -0.25 -2.56 -0.06 0.00 2.00 0.00 0.00 34.13 33.26 2flg s GLU 27 CO 0.30 -1.01 1.91 0.00 -0.56 0.00 0.00 175.26 175.90 2flg s LYS 29 N 5.42 3.57 0.51 0.00 -2.85 -1.26 -4.83 119.74 120.30 2flg s LYS 29 Ca 0.61 -0.02 -0.21 0.00 -1.00 0.00 0.00 55.97 55.36 2flg s LYS 29 Cb 0.05 -3.17 -0.09 0.00 -2.06 0.00 0.00 37.83 32.56 2flg s LYS 29 CO 0.10 0.73 0.82 0.00 0.10 0.00 0.00 175.35 177.10 2flg n LEU 31 N 0.23 -0.89 0.00 0.00 4.77 -1.23 -4.46 117.00 115.42 2flg n LEU 31 Ca 0.11 -0.61 0.11 0.00 -0.03 0.00 0.00 56.01 55.59 2flg n LEU 31 Cb 0.44 -0.91 0.53 0.00 -2.33 0.00 0.00 43.42 41.14 2flg n LEU 31 CO 0.53 -3.92 0.85 0.00 -1.33 0.00 0.00 177.39 173.51 2flg n LEU 32 N -3.68 0.00 -1.67 2.23 -0.00 -1.26 -2.73 117.00 109.89 2flg n LEU 32 Ca 0.09 0.33 -0.11 0.00 -0.00 0.00 0.00 56.01 56.32 2flg n LEU 32 Cb 0.48 -0.33 0.21 0.00 -0.00 0.00 0.00 43.42 43.79 2flg n LEU 32 CO 0.34 -0.09 0.97 0.59 -0.00 0.00 0.00 177.39 179.20 2flg n ASN 33 N -1.33 3.39 -3.69 1.45 3.02 -1.26 -4.87 115.26 111.97 2flg n ASN 33 Ca 0.09 -3.58 -0.28 0.00 -0.03 0.00 0.00 54.58 50.78 2flg n ASN 33 Cb 0.19 -0.72 -0.16 0.00 -0.61 0.00 0.00 39.78 38.47 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 -3.20 0.84 0.60 3.10 1.51 -1.11 -3.06 117.35 116.03 2flg s TYR 34 Ca 0.51 -0.80 0.29 0.00 -1.01 0.00 0.00 57.07 56.06 2flg s TYR 34 Cb 0.43 -0.99 1.65 0.00 -0.11 0.00 0.00 41.96 42.94 2flg s TYR 34 CO 0.07 -0.62 2.05 0.87 -1.11 0.00 0.00 175.55 176.81 2flg h LYS 35 N 8.28 0.00 -5.43 -0.62 1.57 -1.83 -3.45 116.57 115.09 2flg h LYS 35 Ca -0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2flg h LYS 35 Cb 1.11 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 2flg h LYS 35 CO 0.34 0.00 -1.04 0.94 -0.57 0.00 0.00 179.45 179.12 2flg n GLN 36 N -3.69 -2.90 0.10 3.15 7.27 -1.26 -4.91 117.38 115.14 2flg n GLN 36 Ca 0.03 2.41 -0.09 0.00 0.07 0.00 0.00 57.00 59.41 2flg n GLN 36 Cb 0.39 -4.21 -0.05 0.00 2.41 0.00 0.00 30.24 28.78 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 3.44 -0.44 0.00 3.69 4.81 -1.89 -3.47 114.58 120.72 2flg h GLU 37 Ca -0.09 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2flg h GLU 37 Cb 0.41 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.89 2flg h GLU 37 CO 0.06 -0.30 0.00 0.41 -0.73 0.00 0.00 179.01 178.46 2flg n GLY 38 N -1.27 -1.78 0.56 1.92 0.00 -1.26 -4.96 105.19 98.40 2flg n GLY 38 Ca -0.05 0.43 0.09 0.00 0.00 0.00 0.00 46.02 46.49 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 -3.16 3.23 -3.71 1.61 8.00 -1.26 -5.02 116.55 116.25 2flg n ASP 39 Ca 0.00 -2.97 -0.10 0.00 0.71 0.00 0.00 54.79 52.43 2flg n ASP 39 Cb 0.00 -0.47 -0.04 0.00 -0.02 0.00 0.00 41.12 40.59 2flg n ASP 39 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2flg s LYS 40 N -2.71 1.32 -0.09 -1.24 -2.85 -1.26 -5.17 119.74 107.75 2flg s LYS 40 Ca 0.36 -0.82 -0.05 0.00 -1.00 0.00 0.00 55.97 54.46 2flg s LYS 40 Cb 0.30 0.51 -0.04 0.00 -2.06 0.00 0.00 37.83 36.54 2flg s LYS 40 CO 0.07 -0.55 0.13 0.00 0.10 0.00 0.00 175.35 175.09 2flg s VAL 42 N -1.08 0.61 -1.16 0.00 -7.23 -1.26 -4.93 120.40 105.34 2flg s VAL 42 Ca 0.18 -0.57 -0.23 0.00 -1.81 0.00 0.00 61.98 59.55 2flg s VAL 42 Cb -0.12 -1.07 -0.08 0.00 0.56 0.00 0.00 36.38 35.67 2flg s VAL 42 CO 0.07 -0.16 1.92 -1.83 -0.31 0.00 0.00 175.10 174.80 2flg s GLU 43 N 1.82 2.58 -0.57 4.82 -1.05 -1.26 -2.75 118.70 122.29 2flg s GLU 43 Ca -0.01 -1.12 -0.17 0.00 -0.15 0.00 0.00 54.97 53.52 2flg s GLU 43 Cb -0.17 -5.24 0.02 0.00 -0.44 0.00 0.00 34.13 28.30 2flg s GLU 43 CO -0.08 -3.83 0.64 -1.71 0.95 0.00 0.00 175.26 171.23 2flg n ASN 44 N 14.03 -6.55 0.25 0.83 4.05 -1.17 -4.86 115.26 121.84 2flg n ASN 44 Ca 0.44 -0.09 0.17 0.00 0.45 0.00 0.00 54.58 55.54 2flg n ASN 44 Cb 0.47 -3.47 0.67 0.00 1.23 0.00 0.00 39.78 38.67 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 1.28 0.00 -2.26 1.20 0.13 -1.94 -3.30 132.00 127.11 2flg h PRO 45 Ca -0.30 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.21 2flg h PRO 45 Cb 1.21 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.93 2flg h PRO 45 CO 0.26 0.00 -0.46 0.09 -0.23 0.00 0.00 178.00 177.66 2flg n ASN 46 N -2.92 4.12 -0.11 1.44 4.13 -1.26 -4.88 115.26 115.78 2flg n ASN 46 Ca 0.01 -3.48 -0.13 0.00 1.68 0.00 0.00 54.58 52.66 2flg n ASN 46 Cb 0.28 -0.71 -0.03 0.00 -1.54 0.00 0.00 39.78 37.77 2flg n ASN 46 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2flg h PRO 47 N 4.15 0.82 -0.03 3.52 0.13 -1.94 -3.55 132.00 135.10 2flg h PRO 47 Ca 0.20 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2flg h PRO 47 Cb 0.64 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2flg h PRO 47 CO 0.88 1.06 0.00 0.25 -0.23 0.00 0.00 178.00 179.97