#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 4.10 -0.39 2.41 -1.09 -1.26 -4.94 121.20 120.03 2flg s ILE 2 Ca 0.00 1.58 -0.27 0.00 -2.23 0.00 0.00 60.65 59.73 2flg s ILE 2 Cb 0.00 -4.01 -0.04 0.00 -1.58 0.00 0.00 42.46 36.83 2flg s ILE 2 CO 0.00 0.17 2.07 -0.44 -1.23 0.00 0.00 174.94 175.50 2flg s SER 3 N 0.73 5.32 0.32 3.58 0.01 -1.26 -4.95 113.70 117.45 2flg s SER 3 Ca 0.55 1.24 0.04 0.00 1.31 0.00 0.00 55.95 59.09 2flg s SER 3 Cb -0.28 -2.52 0.04 0.00 0.21 0.00 0.00 66.02 63.47 2flg s SER 3 CO 0.31 -2.17 0.31 0.00 0.41 0.00 0.00 173.24 172.10 2flg n GLN 4 N 8.79 0.94 -4.14 12.44 -0.00 -1.26 -5.16 117.38 128.99 2flg n GLN 4 Ca 0.28 -1.92 -0.11 0.00 -0.00 0.00 0.00 57.00 55.25 2flg n GLN 4 Cb 0.49 0.09 -0.09 0.00 -0.00 0.00 0.00 30.24 30.73 2flg n GLN 4 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.06 173.68 2flg s HIS 5 N -1.40 0.92 0.02 2.61 -3.43 -1.26 -5.15 115.29 107.59 2flg s HIS 5 Ca 0.24 -1.20 -0.00 0.00 -0.80 0.00 0.00 55.06 53.29 2flg s HIS 5 Cb -0.02 -0.38 0.00 0.00 -1.43 0.00 0.00 32.58 30.75 2flg s HIS 5 CO 0.15 -0.69 0.03 0.94 -2.00 0.00 0.00 174.74 173.18 2flg n GLN 6 N -0.26 0.05 -3.53 -0.38 7.27 -1.26 -4.54 117.38 114.73 2flg n GLN 6 Ca -0.00 -0.12 -0.34 0.00 0.07 0.00 0.00 57.00 56.60 2flg n GLN 6 Cb 0.65 0.14 -0.05 0.00 2.41 0.00 0.00 30.24 33.38 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 0.76 0.00 -2.72 0.00 0.31 -1.26 -4.80 118.33 110.62 2flg n VAL 8 Ca -0.07 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.26 2flg n VAL 8 Cb 0.52 -0.70 0.05 0.00 -0.91 0.00 0.00 33.84 32.80 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 -1.86 1.56 -4.54 5.55 4.76 -1.26 -5.07 118.16 117.30 2flg n LYS 9 Ca 0.00 -3.30 -0.26 0.00 -2.87 0.00 0.00 58.31 51.88 2flg n LYS 9 Cb 0.40 -1.38 -0.17 0.00 -1.84 0.00 0.00 35.03 32.04 2flg n LYS 9 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2flg s LYS 10 N -3.16 1.91 -0.14 1.97 2.47 -1.26 -5.11 119.74 116.42 2flg s LYS 10 Ca 0.30 -0.47 -0.29 0.00 -1.56 0.00 0.00 55.97 53.95 2flg s LYS 10 Cb 0.34 -1.61 -0.01 0.00 -1.46 0.00 0.00 37.83 35.09 2flg s LYS 10 CO -0.06 -0.01 1.14 -0.65 0.16 0.00 0.00 175.35 175.93 2flg s GLN 11 N 0.82 4.31 0.04 4.03 -1.52 -1.26 -4.98 119.66 121.10 2flg s GLN 11 Ca -0.11 1.54 -0.02 0.00 -1.95 0.00 0.00 55.36 54.81 2flg s GLN 11 Cb -0.15 -3.63 -0.02 0.00 -0.22 0.00 0.00 33.01 28.98 2flg s GLN 11 CO 0.02 -0.54 0.02 0.00 -0.25 0.00 0.00 175.29 174.54 2flg s PRO 13 N -2.65 1.10 0.00 0.00 0.04 -1.26 -4.95 135.00 127.28 2flg s PRO 13 Ca -0.05 0.76 0.28 0.00 0.04 0.00 0.00 61.00 62.03 2flg s PRO 13 Cb -0.01 -1.80 1.05 0.00 0.04 0.00 0.00 34.50 33.78 2flg s PRO 13 CO -0.05 -2.33 1.74 0.00 0.04 0.00 0.00 177.00 176.40 2flg n GLN 14 N -3.94 1.49 -0.51 4.56 10.64 -1.26 -3.66 117.38 124.71 2flg n GLN 14 Ca 0.07 -0.84 0.08 0.00 -1.83 0.00 0.00 57.00 54.48 2flg n GLN 14 Cb 0.56 -1.48 0.28 0.00 -0.86 0.00 0.00 30.24 28.73 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 -0.02 4.17 -3.94 2.61 4.13 -1.26 -4.99 115.26 115.95 2flg n ASN 15 Ca 0.18 -2.90 -0.20 0.00 1.68 0.00 0.00 54.58 53.34 2flg n ASN 15 Cb 0.34 -0.55 -0.09 0.00 -1.54 0.00 0.00 39.78 37.95 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 -1.63 1.74 -0.53 6.41 0.01 -1.24 -3.99 113.70 114.47 2flg s SER 16 Ca 0.43 -1.59 0.07 0.00 1.31 0.00 0.00 55.95 56.17 2flg s SER 16 Cb 0.34 0.42 0.29 0.00 0.21 0.00 0.00 66.02 67.27 2flg s SER 16 CO 0.11 -0.91 0.75 0.61 0.41 0.00 0.00 173.24 174.21 2flg n GLY 17 N -0.63 4.43 3.25 3.44 0.00 0.77 -4.66 105.19 111.78 2flg n GLY 17 Ca 0.01 -2.36 -0.34 0.00 0.00 0.00 0.00 46.02 43.33 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 -0.27 -0.36 0.00 -0.71 -1.22 -4.63 117.98 108.56 2flg s PHE 19 Ca 0.52 0.65 -0.26 0.00 -1.04 0.00 0.00 56.93 56.80 2flg s PHE 19 Cb -0.11 0.41 0.01 0.00 -1.21 0.00 0.00 43.02 42.12 2flg s PHE 19 CO 0.68 -0.13 0.93 0.50 -1.34 0.00 0.00 175.22 175.86 2flg s ARG 20 N 0.19 3.86 1.23 1.99 3.52 -1.22 -1.46 118.95 127.06 2flg s ARG 20 Ca 0.05 0.61 -0.14 0.00 -0.13 0.00 0.00 55.73 56.12 2flg s ARG 20 Cb -0.05 -3.79 0.31 0.00 -1.56 0.00 0.00 34.95 29.86 2flg s ARG 20 CO -0.11 -0.93 1.00 -1.01 -0.81 0.00 0.00 175.30 173.44 2flg s HIS 21 N 3.46 1.05 0.32 5.12 3.76 0.85 -4.75 115.29 125.10 2flg s HIS 21 Ca 0.38 1.09 0.31 0.00 -0.15 0.00 0.00 55.06 56.69 2flg s HIS 21 Cb -0.12 -3.05 1.47 0.00 1.11 0.00 0.00 32.58 31.99 2flg s HIS 21 CO 0.18 -4.16 2.05 -0.07 -0.85 0.00 0.00 174.74 171.88 2flg h LEU 22 N -2.84 0.00 -3.36 0.89 3.38 -1.96 -2.12 115.31 109.31 2flg h LEU 22 Ca -0.61 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.11 2flg h LEU 22 Cb 1.34 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.95 2flg h LEU 22 CO 0.48 0.09 0.31 0.47 0.09 0.00 0.00 178.44 179.88 2flg n ASP 23 N -3.38 4.07 -3.50 -0.43 8.00 -1.26 -4.89 116.55 115.17 2flg n ASP 23 Ca -0.01 -3.05 -0.19 0.00 0.71 0.00 0.00 54.79 52.25 2flg n ASP 23 Cb 0.27 -0.72 0.08 0.00 -0.02 0.00 0.00 41.12 40.73 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 -0.27 -6.52 -3.83 -1.24 1.02 -0.80 -5.00 120.64 104.00 2flg n GLU 24 Ca 0.37 0.81 -0.30 0.00 -0.02 0.00 0.00 57.16 58.02 2flg n GLU 24 Cb 1.26 -5.77 -0.15 0.00 -0.02 0.00 0.00 31.44 26.76 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 -5.58 1.06 0.12 3.49 3.52 -1.24 -4.87 118.95 115.44 2flg s ARG 25 Ca 0.08 -1.00 -0.30 0.00 -0.13 0.00 0.00 55.73 54.38 2flg s ARG 25 Cb -0.04 -2.33 -0.06 0.00 -1.56 0.00 0.00 34.95 30.96 2flg s ARG 25 CO 0.74 -0.79 1.09 -1.21 -0.81 0.00 0.00 175.30 174.32 2flg s GLU 26 N 1.52 4.56 -0.37 5.12 8.01 -1.26 -0.11 118.70 136.18 2flg s GLU 26 Ca 0.03 1.66 0.01 0.00 0.01 0.00 0.00 54.97 56.68 2flg s GLU 26 Cb -0.18 -3.33 0.11 0.00 -4.31 0.00 0.00 34.13 26.42 2flg s GLU 26 CO -0.14 -0.01 0.14 -2.00 0.01 0.00 0.00 175.26 173.27 2flg s GLU 27 N 0.22 1.07 -1.21 1.61 2.56 -0.53 -4.94 118.70 117.49 2flg s GLU 27 Ca 0.52 -1.58 -0.22 0.00 0.00 0.00 0.00 54.97 53.69 2flg s GLU 27 Cb -0.28 -2.34 -0.06 0.00 2.00 0.00 0.00 34.13 33.45 2flg s GLU 27 CO 0.32 -1.05 1.90 0.00 -0.56 0.00 0.00 175.26 175.88 2flg s LYS 29 N 6.08 3.21 0.56 0.00 2.20 -1.26 -4.84 119.74 125.69 2flg s LYS 29 Ca 0.66 -0.38 -0.20 0.00 -0.36 0.00 0.00 55.97 55.69 2flg s LYS 29 Cb 0.00 -2.96 -0.06 0.00 -1.51 0.00 0.00 37.83 33.30 2flg s LYS 29 CO 0.13 0.68 1.10 0.00 -0.36 0.00 0.00 175.35 176.90 2flg n LEU 31 N -0.69 -0.70 0.00 0.00 4.77 -1.26 -4.51 117.00 114.61 2flg n LEU 31 Ca 0.12 -0.67 0.12 0.00 -0.03 0.00 0.00 56.01 55.55 2flg n LEU 31 Cb 0.45 -0.91 0.60 0.00 -2.33 0.00 0.00 43.42 41.24 2flg n LEU 31 CO 0.52 -4.06 0.89 0.18 -1.33 0.00 0.00 177.39 173.59 2flg n LEU 32 N -3.93 0.00 -1.53 2.23 7.99 -1.26 -2.90 117.00 117.60 2flg n LEU 32 Ca 0.11 0.29 -0.12 0.00 -0.01 0.00 0.00 56.01 56.27 2flg n LEU 32 Cb 0.48 -0.29 0.18 0.00 -0.11 0.00 0.00 43.42 43.68 2flg n LEU 32 CO 0.32 -0.06 0.83 0.59 -1.51 0.00 0.00 177.39 177.57 2flg n ASN 33 N -1.29 3.20 -3.62 -1.43 3.02 -1.26 -4.86 115.26 109.03 2flg n ASN 33 Ca 0.11 -3.76 -0.29 0.00 -0.03 0.00 0.00 54.58 50.61 2flg n ASN 33 Cb 0.19 -0.69 -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 -3.33 0.94 -0.69 3.10 1.51 -1.14 -2.62 117.35 115.12 2flg s TYR 34 Ca 0.49 -1.29 -0.25 0.00 -1.01 0.00 0.00 57.07 55.01 2flg s TYR 34 Cb 0.43 -1.26 0.04 0.00 -0.11 0.00 0.00 41.96 41.07 2flg s TYR 34 CO 0.02 -0.85 1.14 0.15 -1.11 0.00 0.00 175.55 174.90 2flg s LYS 35 N 1.83 3.20 -0.30 -0.62 1.02 -1.15 -4.76 119.74 118.95 2flg s LYS 35 Ca 0.10 -0.41 -0.37 0.00 0.02 0.00 0.00 55.97 55.31 2flg s LYS 35 Cb -0.17 -4.17 -0.13 0.00 -0.52 0.00 0.00 37.83 32.84 2flg s LYS 35 CO -0.30 -1.95 2.04 0.94 -0.92 0.00 0.00 175.35 175.16 2flg n GLN 36 N 8.58 1.20 -0.12 1.68 -0.06 -1.26 -4.57 117.38 122.84 2flg n GLN 36 Ca 0.01 0.38 -0.22 0.00 -2.00 0.00 0.00 57.00 55.17 2flg n GLN 36 Cb 0.48 -2.37 -0.12 0.00 -4.06 0.00 0.00 30.24 24.17 2flg n GLN 36 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 2flg n GLU 37 N 7.30 0.64 0.00 3.69 2.13 -1.26 -5.04 120.64 128.10 2flg n GLU 37 Ca 0.36 0.22 0.00 0.00 0.66 0.00 0.00 57.16 58.40 2flg n GLU 37 Cb 0.20 -1.54 0.00 0.00 0.27 0.00 0.00 31.44 30.37 2flg n GLU 37 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2flg n GLY 38 N 1.88 2.09 1.46 8.31 0.00 -1.26 -5.02 105.19 112.65 2flg n GLY 38 Ca -0.47 -0.24 -0.07 0.00 0.00 0.00 0.00 46.02 45.24 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 2.99 -3.49 1.61 9.92 -1.26 -5.04 116.55 121.29 2flg n ASP 39 Ca 0.00 -3.52 -0.14 0.00 -0.53 0.00 0.00 54.79 50.60 2flg n ASP 39 Cb 0.00 -0.43 -0.04 0.00 -0.64 0.00 0.00 41.12 40.01 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 -3.17 1.06 0.29 -1.24 -2.85 -1.26 -5.15 119.74 107.42 2flg s LYS 40 Ca 0.42 -0.08 -0.29 0.00 -1.00 0.00 0.00 55.97 55.02 2flg s LYS 40 Cb 0.38 0.49 -0.10 0.00 -2.06 0.00 0.00 37.83 36.55 2flg s LYS 40 CO -0.03 -0.40 1.11 0.00 0.10 0.00 0.00 175.35 176.13 2flg s VAL 42 N -1.20 0.24 -0.94 0.00 -7.23 -1.26 -5.05 120.40 104.97 2flg s VAL 42 Ca 0.46 -0.24 -0.25 0.00 -1.81 0.00 0.00 61.98 60.15 2flg s VAL 42 Cb -0.32 -0.73 -0.08 0.00 0.56 0.00 0.00 36.38 35.82 2flg s VAL 42 CO 0.41 -0.13 2.04 -0.70 -0.31 0.00 0.00 175.10 176.42 2flg s GLU 43 N 2.00 2.28 -0.56 4.82 2.12 -1.26 -2.96 118.70 125.13 2flg s GLU 43 Ca 0.01 -0.29 -0.17 0.00 0.36 0.00 0.00 54.97 54.89 2flg s GLU 43 Cb -0.16 -5.03 0.02 0.00 0.26 0.00 0.00 34.13 29.23 2flg s GLU 43 CO -0.07 -3.81 0.64 -1.71 -0.54 0.00 0.00 175.26 169.77 2flg n ASN 44 N 15.29 -6.74 0.26 -1.70 4.05 -1.08 -4.86 115.26 120.48 2flg n ASN 44 Ca 0.42 -0.03 0.17 0.00 0.45 0.00 0.00 54.58 55.60 2flg n ASN 44 Cb 0.46 -3.73 0.68 0.00 1.23 0.00 0.00 39.78 38.42 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 1.34 0.00 -2.28 1.20 0.13 -1.90 -3.31 132.00 127.19 2flg h PRO 45 Ca -0.26 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.26 2flg h PRO 45 Cb 1.18 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.89 2flg h PRO 45 CO 0.26 0.00 -0.57 -1.71 -0.23 0.00 0.00 178.00 175.75 2flg n ASN 46 N -2.97 3.75 0.03 1.44 2.85 -1.26 -4.88 115.26 114.22 2flg n ASN 46 Ca 0.01 -3.43 -0.06 0.00 -0.11 0.00 0.00 54.58 50.99 2flg n ASN 46 Cb 0.28 -0.69 0.13 0.00 1.24 0.00 0.00 39.78 40.74 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 4.30 0.46 0.00 1.20 0.13 -1.95 -3.55 132.00 132.60 2flg h PRO 47 Ca 0.20 -0.24 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2flg h PRO 47 Cb 0.67 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.81 2flg h PRO 47 CO 0.84 0.81 0.00 2.41 -0.23 0.00 0.00 178.00 181.83