#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hic s VAL 2 N 0.00 0.26 0.49 2.52 1.01 -1.26 -5.15 120.40 118.27 1hic s VAL 2 Ca 0.00 0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.08 1hic s VAL 2 Cb 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.88 1hic s VAL 2 CO 0.00 0.19 0.76 -0.31 0.00 0.00 0.00 175.10 175.74 1hic s TYR 3 N 2.02 3.34 0.17 5.22 1.51 -1.26 -5.12 117.35 123.22 1hic s TYR 3 Ca 0.04 0.52 0.02 0.00 -1.01 0.00 0.00 57.07 56.64 1hic s TYR 3 Cb -0.13 -2.41 -0.05 0.00 -0.11 0.00 0.00 41.96 39.27 1hic s TYR 3 CO -0.05 -0.44 -0.01 0.95 -1.11 0.00 0.00 175.55 174.89 1hic s THR 4 N -2.72 0.74 0.73 -0.71 -4.23 -1.26 -4.93 115.64 103.27 1hic s THR 4 Ca 0.49 -1.99 -0.11 0.00 -1.18 0.00 0.00 61.69 58.90 1hic s THR 4 Cb -0.10 -2.09 0.03 0.00 1.34 0.00 0.00 72.50 71.68 1hic s THR 4 CO 0.42 -0.51 1.07 -1.81 -0.54 0.00 0.00 174.62 173.25 1hic s ASP 5 N -3.17 5.04 0.81 3.99 1.11 -1.26 -0.73 116.67 122.46 1hic s ASP 5 Ca 0.23 1.53 -0.10 0.00 0.18 0.00 0.00 52.55 54.40 1hic s ASP 5 Cb 0.06 -2.36 0.12 0.00 1.07 0.00 0.00 42.92 41.81 1hic s ASP 5 CO 0.04 -1.65 1.14 0.00 1.18 0.00 0.00 175.17 175.87 1hic n THR 7 N -3.24 0.00 -3.50 0.00 -2.24 -1.26 -5.06 114.28 98.98 1hic n THR 7 Ca 0.11 -0.75 -0.09 0.00 -2.27 0.00 0.00 64.05 61.06 1hic n THR 7 Cb 0.60 0.87 -0.02 0.00 -2.10 0.00 0.00 70.33 69.68 1hic n THR 7 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1hic s GLU 8 N 0.00 0.98 0.48 -0.78 -1.05 -1.26 -5.14 118.70 111.93 1hic s GLU 8 Ca 0.25 -0.38 -0.16 0.00 -0.15 0.00 0.00 54.97 54.53 1hic s GLU 8 Cb 0.29 0.44 -0.08 0.00 -0.44 0.00 0.00 34.13 34.34 1hic s GLU 8 CO -0.13 -0.43 0.93 -1.12 0.95 0.00 0.00 175.26 175.47 1hic s SER 9 N -2.59 6.65 -0.27 0.83 0.01 -1.26 -3.94 113.70 113.12 1hic s SER 9 Ca 0.04 1.50 0.00 0.00 1.31 0.00 0.00 55.95 58.80 1hic s SER 9 Cb -0.01 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.74 1hic s SER 9 CO -0.09 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 173.66 1hic n GLY 10 N -1.38 0.58 3.97 3.44 0.00 0.11 -4.96 105.19 106.95 1hic n GLY 10 Ca 0.06 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.41 1hic n GLY 10 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hic s GLN 11 N -1.50 2.35 0.38 1.61 -0.21 -1.14 -0.54 119.66 120.60 1hic s GLN 11 Ca 0.00 -0.79 -0.09 0.00 0.02 0.00 0.00 55.36 54.50 1hic s GLN 11 Cb 0.00 -2.42 0.04 0.00 1.00 0.00 0.00 33.01 31.62 1hic s GLN 11 CO 0.00 -0.91 0.67 0.54 -2.12 0.00 0.00 175.29 173.47 1hic s ASN 12 N -4.49 0.46 -0.91 5.90 2.20 0.12 -0.21 114.94 118.00 1hic s ASN 12 Ca 0.59 -1.34 -0.03 0.00 -0.94 0.00 0.00 52.86 51.14 1hic s ASN 12 Cb -0.09 0.79 -0.03 0.00 -2.00 0.00 0.00 41.25 39.91 1hic s ASN 12 CO 0.40 -1.56 0.78 -0.11 -2.94 0.00 0.00 177.10 173.68 1hic n LEU 13 N -0.56 -4.45 -3.61 3.54 -0.00 0.58 -2.95 117.00 109.54 1hic n LEU 13 Ca -0.05 -0.55 -0.03 0.00 -0.00 0.00 0.00 56.01 55.38 1hic n LEU 13 Cb 0.61 -2.70 -0.01 0.00 -0.00 0.00 0.00 43.42 41.31 1hic n LEU 13 CO 0.29 0.18 0.97 0.00 -0.00 0.00 0.00 177.39 178.82 1hic s LEU 15 N -2.52 4.21 0.18 0.00 1.43 0.10 -0.88 118.68 121.19 1hic s LEU 15 Ca 0.11 2.27 0.00 0.00 -1.03 0.00 0.00 54.13 55.47 1hic s LEU 15 Cb 0.01 -4.03 0.00 0.00 0.03 0.00 0.00 46.19 42.20 1hic s LEU 15 CO -0.04 -0.59 0.00 0.00 0.23 0.00 0.00 176.35 175.95 1hic s GLU 17 N -1.54 3.10 4.68 0.00 2.02 -1.23 -4.71 118.70 121.02 1hic s GLU 17 Ca 0.00 -1.38 0.00 0.00 0.02 0.00 0.00 54.97 53.61 1hic s GLU 17 Cb 0.00 -4.31 0.00 0.00 0.10 0.00 0.00 34.13 29.92 1hic s GLU 17 CO 0.00 -1.56 0.00 0.41 0.02 0.00 0.00 175.26 174.13 1hic n GLY 18 N 5.24 3.22 0.50 -1.39 0.00 -1.26 -0.68 105.19 110.82 1hic n GLY 18 Ca -0.06 -0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.03 1hic n GLY 18 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1hic n SER 19 N 3.72 1.50 -4.68 1.61 2.88 -1.26 -4.85 113.62 112.54 1hic n SER 19 Ca 0.00 -1.77 -0.42 0.00 -1.33 0.00 0.00 58.87 55.36 1hic n SER 19 Cb 0.00 -0.12 -0.04 0.00 -0.75 0.00 0.00 64.21 63.30 1hic n SER 19 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1hic s ASN 20 N -1.40 7.02 0.07 -3.46 -0.87 0.15 -4.94 114.94 111.50 1hic s ASN 20 Ca 0.28 1.25 -0.30 0.00 -1.57 0.00 0.00 52.86 52.52 1hic s ASN 20 Cb 0.15 -2.47 -0.05 0.00 -0.02 0.00 0.00 41.25 38.86 1hic s ASN 20 CO 0.22 -0.39 1.00 0.54 -2.57 0.00 0.00 177.10 175.90 1hic s VAL 21 N 2.05 4.53 -0.89 1.60 0.11 -1.26 -2.32 120.40 124.22 1hic s VAL 21 Ca 0.40 1.97 -0.20 0.00 -2.93 0.00 0.00 61.98 61.22 1hic s VAL 21 Cb -0.17 -4.26 0.10 0.00 -1.53 0.00 0.00 36.38 30.52 1hic s VAL 21 CO 0.14 0.24 1.15 0.00 -3.33 0.00 0.00 175.10 173.29 1hic n GLY 23 N 5.68 -2.55 3.76 0.00 0.00 -1.26 -0.31 105.19 110.51 1hic n GLY 23 Ca 0.19 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.37 1hic n GLY 23 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hic s GLN 24 N -3.69 3.34 -0.00 1.61 1.11 -1.26 -2.11 119.66 118.67 1hic s GLN 24 Ca 0.20 2.23 0.00 0.00 0.01 0.00 0.00 55.36 57.80 1hic s GLN 24 Cb -0.02 -2.38 0.00 0.00 -1.01 0.00 0.00 33.01 29.60 1hic s GLN 24 CO 0.15 -1.03 0.00 0.41 0.01 0.00 0.00 175.29 174.83 1hic n GLY 25 N 0.67 0.49 3.28 3.09 0.00 -1.26 -5.03 105.19 106.43 1hic n GLY 25 Ca 0.09 -0.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.93 1hic n GLY 25 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hic s ASN 26 N -2.03 1.08 -0.09 1.61 -0.87 -0.90 -0.93 114.94 112.82 1hic s ASN 26 Ca 0.00 -1.31 -0.05 0.00 -1.57 0.00 0.00 52.86 49.93 1hic s ASN 26 Cb 0.00 0.17 0.04 0.00 -0.02 0.00 0.00 41.25 41.44 1hic s ASN 26 CO 0.00 -0.68 0.21 -0.75 -2.57 0.00 0.00 177.10 173.30 1hic s LYS 27 N -4.00 0.18 -0.21 -0.60 2.20 0.52 -2.45 119.74 115.38 1hic s LYS 27 Ca 0.33 0.43 -0.18 0.00 -0.36 0.00 0.00 55.97 56.18 1hic s LYS 27 Cb 0.07 -0.08 -0.03 0.00 -1.51 0.00 0.00 37.83 36.27 1hic s LYS 27 CO 0.10 -0.13 0.51 0.00 -0.36 0.00 0.00 175.35 175.46 1hic s ILE 29 N 1.69 4.07 0.96 0.00 -1.09 0.65 0.05 121.20 127.53 1hic s ILE 29 Ca 0.23 -0.92 -0.12 0.00 -2.23 0.00 0.00 60.65 57.62 1hic s ILE 29 Cb -0.15 -3.23 0.16 0.00 -1.58 0.00 0.00 42.46 37.66 1hic s ILE 29 CO 0.09 -0.11 1.09 -0.76 -1.23 0.00 0.00 174.94 174.02 1hic s LEU 30 N 1.48 1.96 0.11 2.97 1.43 -1.26 -0.43 118.68 124.94 1hic s LEU 30 Ca 0.01 1.47 -0.34 0.00 -1.03 0.00 0.00 54.13 54.24 1hic s LEU 30 Cb -0.19 -3.77 -0.18 0.00 0.03 0.00 0.00 46.19 42.08 1hic s LEU 30 CO 0.04 -2.99 0.95 0.61 0.23 0.00 0.00 176.35 175.19 1hic n GLY 31 N -0.77 -0.59 2.66 -3.19 0.00 -1.11 -4.80 105.19 97.39 1hic n GLY 31 Ca 0.06 0.57 -0.22 0.00 0.00 0.00 0.00 46.02 46.44 1hic n GLY 31 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hic s SER 32 N -0.27 2.36 -0.10 1.61 0.01 -1.26 -4.87 113.70 111.18 1hic s SER 32 Ca 0.78 -1.11 -0.00 0.00 1.31 0.00 0.00 55.95 56.93 1hic s SER 32 Cb -1.05 0.16 -0.01 0.00 0.21 0.00 0.00 66.02 65.33 1hic s SER 32 CO 0.55 -0.39 0.09 -0.67 0.41 0.00 0.00 173.24 173.23 1hic n ASP 33 N 5.11 -2.47 -2.09 2.44 2.03 -1.26 -4.19 116.55 116.13 1hic n ASP 33 Ca -0.01 -0.06 -0.18 0.00 0.52 0.00 0.00 54.79 55.05 1hic n ASP 33 Cb 0.44 -1.04 -0.01 0.00 -0.72 0.00 0.00 41.12 39.79 1hic n ASP 33 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1hic n GLY 34 N -1.40 -0.36 3.95 0.27 0.00 -1.26 -5.01 105.19 101.37 1hic n GLY 34 Ca -0.01 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 1hic n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hic s GLU 35 N -4.90 2.47 0.62 1.61 0.41 -1.26 -5.14 118.70 112.51 1hic s GLU 35 Ca 0.00 -1.61 0.05 0.00 -0.41 0.00 0.00 54.97 53.00 1hic s GLU 35 Cb 0.00 -2.46 0.09 0.00 -1.78 0.00 0.00 34.13 29.99 1hic s GLU 35 CO 0.00 -0.46 0.85 0.15 -0.49 0.00 0.00 175.26 175.31 1hic s LYS 36 N -4.33 2.12 0.38 1.61 1.02 -1.26 -4.21 119.74 115.07 1hic s LYS 36 Ca 0.50 -1.33 -0.25 0.00 0.02 0.00 0.00 55.97 54.90 1hic s LYS 36 Cb -0.05 -2.52 -0.09 0.00 -0.52 0.00 0.00 37.83 34.65 1hic s LYS 36 CO 0.30 -1.03 1.12 1.21 -0.92 0.00 0.00 175.35 176.03 1hic s ASN 37 N -4.65 6.70 -0.06 2.83 3.84 -1.26 -2.75 114.94 119.58 1hic s ASN 37 Ca 0.63 2.23 -0.02 0.00 0.21 0.00 0.00 52.86 55.90 1hic s ASN 37 Cb -0.06 -2.61 0.04 0.00 -0.55 0.00 0.00 41.25 38.07 1hic s ASN 37 CO 0.41 -0.54 0.11 -1.10 -2.79 0.00 0.00 177.10 173.18 1hic s GLN 38 N -2.25 0.01 -0.53 0.43 -0.21 0.43 -4.83 119.66 112.70 1hic s GLN 38 Ca 0.56 0.41 -0.17 0.00 0.02 0.00 0.00 55.36 56.18 1hic s GLN 38 Cb -0.28 -0.30 0.10 0.00 1.00 0.00 0.00 33.01 33.53 1hic s GLN 38 CO 0.35 -0.25 0.54 0.00 -2.12 0.00 0.00 175.29 173.81 1hic s VAL 40 N 2.04 4.36 0.49 0.00 -7.23 0.72 -4.90 120.40 115.88 1hic s VAL 40 Ca 0.07 -0.30 -0.18 0.00 -1.81 0.00 0.00 61.98 59.77 1hic s VAL 40 Cb -0.25 -3.63 -0.09 0.00 0.56 0.00 0.00 36.38 32.97 1hic s VAL 40 CO 0.06 -0.50 0.98 0.28 -0.31 0.00 0.00 175.10 175.61 1hic s THR 41 N -2.60 4.44 0.00 5.32 -1.32 -1.26 -0.35 115.64 119.87 1hic s THR 41 Ca 0.47 1.30 0.00 0.00 -1.21 0.00 0.00 61.69 62.25 1hic s THR 41 Cb -0.10 -3.66 0.00 0.00 -1.51 0.00 0.00 72.50 67.23 1hic s THR 41 CO 0.40 -0.54 0.00 0.61 -2.21 0.00 0.00 174.62 172.87 1hic n GLY 42 N -1.20 0.32 3.48 6.08 0.00 -0.11 -4.63 105.19 109.13 1hic n GLY 42 Ca 0.07 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 1hic n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hic s GLU 43 N 0.00 1.04 0.25 1.61 0.41 -1.24 -3.28 118.70 117.49 1hic s GLU 43 Ca 0.00 -0.21 -0.12 0.00 -0.41 0.00 0.00 54.97 54.24 1hic s GLU 43 Cb 0.00 0.48 -0.01 0.00 -1.78 0.00 0.00 34.13 32.83 1hic s GLU 43 CO 0.00 -0.42 0.45 0.20 -0.49 0.00 0.00 175.26 175.00 1hic s GLY 44 N -2.18 0.64 0.23 -1.39 0.00 -1.03 -4.52 107.32 99.07 1hic s GLY 44 Ca -0.01 -0.97 -0.29 0.00 0.00 0.00 0.00 44.72 43.46 1hic s GLY 44 CO -0.06 -0.70 0.90 -1.08 0.00 0.00 0.00 173.10 172.16 1hic s THR 45 N -3.98 4.15 0.62 0.90 -1.32 0.30 -4.50 115.64 111.81 1hic s THR 45 Ca 0.24 1.98 -0.15 0.00 -1.21 0.00 0.00 61.69 62.54 1hic s THR 45 Cb -0.00 -4.26 -0.02 0.00 -1.51 0.00 0.00 72.50 66.70 1hic s THR 45 CO 0.10 0.48 1.08 -2.16 -2.21 0.00 0.00 174.62 171.91 1hic s PRO 46 N -1.23 3.11 0.05 7.08 0.04 -1.26 0.12 135.00 142.91 1hic s PRO 46 Ca 0.40 1.29 -0.27 0.00 0.04 0.00 0.00 61.00 62.46 1hic s PRO 46 Cb -0.25 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.24 1hic s PRO 46 CO 0.30 -0.99 0.84 0.21 0.04 0.00 0.00 177.00 177.40 1hic s LYS 47 N -4.07 4.56 0.54 4.56 2.47 -1.15 -4.82 119.74 121.82 1hic s LYS 47 Ca 0.65 1.21 -0.17 0.00 -1.56 0.00 0.00 55.97 56.09 1hic s LYS 47 Cb -0.18 -3.38 -0.06 0.00 -1.46 0.00 0.00 37.83 32.74 1hic s LYS 47 CO 0.39 0.22 1.03 -1.25 0.16 0.00 0.00 175.35 175.89 1hic s PRO 48 N 0.11 3.66 0.08 4.03 0.04 -1.26 -5.06 135.00 136.60 1hic s PRO 48 Ca 0.42 1.17 -0.17 0.00 0.04 0.00 0.00 61.00 62.46 1hic s PRO 48 Cb -0.21 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.18 1hic s PRO 48 CO 0.25 -0.53 0.53 -1.14 0.04 0.00 0.00 177.00 176.16 1hic s GLN 49 N -3.81 4.09 0.26 4.56 0.74 -1.26 -4.93 119.66 119.30 1hic s GLN 49 Ca 0.63 0.61 0.00 0.00 0.05 0.00 0.00 55.36 56.65 1hic s GLN 49 Cb -0.14 -3.15 0.00 0.00 1.10 0.00 0.00 33.01 30.82 1hic s GLN 49 CO 0.30 0.61 0.00 0.43 -0.55 0.00 0.00 175.29 176.08 1hic n SER 50 N 1.50 -5.35 0.00 6.67 7.64 -1.26 -5.35 113.62 117.47 1hic n SER 50 Ca -0.10 0.51 0.10 0.00 1.01 0.00 0.00 58.87 60.40 1hic n SER 50 Cb 0.51 -2.81 0.62 0.00 -1.01 0.00 0.00 64.21 61.52 1hic n SER 50 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03