#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 4.58 0.19 3.34 1.01 -1.26 -5.14 120.40 123.13 1hic s VAL 2 Ca 0.00 -0.75 0.08 0.00 0.00 0.00 0.00 61.98 61.32 1hic s VAL 2 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1hic s VAL 2 CO 0.00 0.13 -0.17 -0.31 0.00 0.00 0.00 175.10 174.75 1hic s TYR 3 N -1.39 1.81 0.27 5.22 2.02 -1.26 -5.14 117.35 118.88 1hic s TYR 3 Ca 0.30 -0.50 -0.05 0.00 -0.37 0.00 0.00 57.07 56.44 1hic s TYR 3 Cb -0.12 -0.86 -0.01 0.00 -0.40 0.00 0.00 41.96 40.57 1hic s TYR 3 CO 0.22 0.38 0.38 0.95 -1.57 0.00 0.00 175.55 175.92 1hic s THR 4 N -2.53 0.00 1.05 -0.71 -4.23 -1.26 -4.95 115.64 103.01 1hic s THR 4 Ca 0.20 -1.65 -0.12 0.00 -1.18 0.00 0.00 61.69 58.94 1hic s THR 4 Cb -0.03 -2.45 0.22 0.00 1.34 0.00 0.00 72.50 71.58 1hic s THR 4 CO 0.08 0.00 1.07 -1.81 -0.54 0.00 0.00 174.62 173.41 1hic s ASP 5 N -3.15 2.06 0.49 3.99 1.11 -1.26 -0.58 116.67 119.33 1hic s ASP 5 Ca 0.30 1.39 -0.12 0.00 0.18 0.00 0.00 52.55 54.30 1hic s ASP 5 Cb 0.01 -2.10 -0.06 0.00 1.07 0.00 0.00 42.92 41.85 1hic s ASP 5 CO 0.15 -3.51 0.90 0.00 1.18 0.00 0.00 175.17 173.89 1hic n THR 7 N -1.77 0.00 -3.76 0.00 -2.24 -1.26 -5.02 114.28 100.24 1hic n THR 7 Ca 0.04 -0.26 -0.12 0.00 -2.27 0.00 0.00 64.05 61.44 1hic n THR 7 Cb 0.54 0.92 -0.12 0.00 -2.10 0.00 0.00 70.33 69.58 1hic n THR 7 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1hic s GLU 8 N -2.03 0.30 0.61 -0.78 2.02 -1.26 -5.06 118.70 112.49 1hic s GLU 8 Ca 0.03 0.47 -0.18 0.00 0.02 0.00 0.00 54.97 55.30 1hic s GLU 8 Cb 0.07 0.06 -0.03 0.00 0.10 0.00 0.00 34.13 34.34 1hic s GLU 8 CO 0.41 -0.08 1.21 -1.12 0.02 0.00 0.00 175.26 175.70 1hic s SER 9 N 0.58 5.08 0.00 -0.19 0.01 -1.26 -3.45 113.70 114.46 1hic s SER 9 Ca -0.03 2.40 0.00 0.00 1.31 0.00 0.00 55.95 59.63 1hic s SER 9 Cb -0.05 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.58 1hic s SER 9 CO -0.03 -1.67 0.00 0.61 0.41 0.00 0.00 173.24 172.55 1hic n GLY 10 N 0.52 0.60 3.91 3.44 0.00 0.23 -4.96 105.19 108.93 1hic n GLY 10 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.80 3.45 0.33 1.61 -0.21 -1.22 -1.26 119.66 121.56 1hic s GLN 11 Ca 0.00 -0.34 0.01 0.00 0.02 0.00 0.00 55.36 55.05 1hic s GLN 11 Cb 0.00 -3.07 0.01 0.00 1.00 0.00 0.00 33.01 30.95 1hic s GLN 11 CO 0.00 0.65 0.12 0.27 -2.12 0.00 0.00 175.29 174.21 1hic n ASN 12 N 0.72 2.52 -3.40 5.90 6.94 0.66 0.19 115.26 128.79 1hic n ASN 12 Ca -0.09 -2.31 -0.17 0.00 -0.02 0.00 0.00 54.58 51.99 1hic n ASN 12 Cb 0.52 0.11 0.08 0.00 -2.36 0.00 0.00 39.78 38.12 1hic n ASN 12 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1hic n LEU 13 N 0.00 -4.47 -3.53 -4.53 7.99 -0.77 -3.91 117.00 107.78 1hic n LEU 13 Ca -0.08 -0.68 -0.07 0.00 -0.01 0.00 0.00 56.01 55.17 1hic n LEU 13 Cb 0.40 -3.10 -0.02 0.00 -0.11 0.00 0.00 43.42 40.60 1hic n LEU 13 CO 0.23 0.29 0.77 0.00 -1.51 0.00 0.00 177.39 177.17 1hic s LEU 15 N -2.33 4.27 0.20 0.00 1.43 0.25 -0.25 118.68 122.24 1hic s LEU 15 Ca 0.06 2.19 0.00 0.00 -1.03 0.00 0.00 54.13 55.35 1hic s LEU 15 Cb -0.01 -3.99 0.00 0.00 0.03 0.00 0.00 46.19 42.22 1hic s LEU 15 CO -0.07 -0.45 0.00 0.00 0.23 0.00 0.00 176.35 176.06 1hic s GLU 17 N -1.68 3.19 6.33 0.00 2.02 -1.24 -4.63 118.70 122.69 1hic s GLU 17 Ca 0.00 -1.42 0.00 0.00 0.02 0.00 0.00 54.97 53.57 1hic s GLU 17 Cb 0.00 -4.38 0.00 0.00 0.10 0.00 0.00 34.13 29.85 1hic s GLU 17 CO 0.00 -1.60 0.00 0.41 0.02 0.00 0.00 175.26 174.09 1hic n GLY 18 N 5.21 3.27 0.74 -1.39 0.00 -1.26 -1.23 105.19 110.52 1hic n GLY 18 Ca -0.01 -0.15 0.04 0.00 0.00 0.00 0.00 46.02 45.89 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 3.37 2.06 -4.67 1.61 2.88 -1.26 -4.82 113.62 112.78 1hic n SER 19 Ca 0.00 -2.16 -0.40 0.00 -1.33 0.00 0.00 58.87 54.98 1hic n SER 19 Cb 0.00 -0.36 -0.05 0.00 -0.75 0.00 0.00 64.21 63.04 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 -0.66 6.77 0.16 -3.46 0.01 -0.37 -4.97 114.94 112.41 1hic s ASN 20 Ca 0.19 0.93 -0.30 0.00 -0.71 0.00 0.00 52.86 52.97 1hic s ASN 20 Cb 0.12 -2.37 -0.08 0.00 0.41 0.00 0.00 41.25 39.33 1hic s ASN 20 CO 0.09 -0.26 1.25 -0.69 -1.51 0.00 0.00 177.10 175.99 1hic s VAL 21 N 1.75 3.52 -0.90 1.60 1.01 -1.26 -1.82 120.40 124.30 1hic s VAL 21 Ca 0.31 1.21 -0.24 0.00 0.00 0.00 0.00 61.98 63.25 1hic s VAL 21 Cb -0.16 -3.77 -0.00 0.00 0.00 0.00 0.00 36.38 32.44 1hic s VAL 21 CO 0.12 0.16 1.71 0.00 0.00 0.00 0.00 175.10 177.08 1hic n GLY 23 N 6.63 -2.09 3.58 0.00 0.00 -1.26 -1.84 105.19 110.20 1hic n GLY 23 Ca 0.33 -0.32 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1hic n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hic n GLN 24 N 0.12 1.28 -0.47 1.61 -0.00 -1.26 -1.19 117.38 117.47 1hic n GLN 24 Ca 0.09 0.45 0.00 0.00 -0.00 0.00 0.00 57.00 57.54 1hic n GLN 24 Cb 0.49 -1.83 0.00 0.00 -0.00 0.00 0.00 30.24 28.90 1hic n GLN 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1hic n GLY 25 N 1.39 1.27 3.52 2.61 0.00 -1.26 -5.01 105.19 107.71 1hic n GLY 25 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.13 3.27 0.04 1.61 0.01 -0.33 -0.21 114.94 116.19 1hic s ASN 26 Ca 0.00 -1.30 -0.09 0.00 -0.71 0.00 0.00 52.86 50.77 1hic s ASN 26 Cb 0.00 -0.27 0.00 0.00 0.41 0.00 0.00 41.25 41.39 1hic s ASN 26 CO 0.00 -0.41 0.17 -1.59 -1.51 0.00 0.00 177.10 173.76 1hic s LYS 27 N -3.73 0.67 -0.19 -0.60 -2.85 0.11 -4.07 119.74 109.08 1hic s LYS 27 Ca 0.34 -0.67 -0.06 0.00 -1.00 0.00 0.00 55.97 54.57 1hic s LYS 27 Cb 0.07 0.28 -0.03 0.00 -2.06 0.00 0.00 37.83 36.08 1hic s LYS 27 CO 0.16 -0.19 0.03 0.00 0.10 0.00 0.00 175.35 175.45 1hic s ILE 29 N 0.63 5.14 -0.83 0.00 -1.09 -0.12 -0.60 121.20 124.33 1hic s ILE 29 Ca 0.02 -0.70 -0.25 0.00 -2.23 0.00 0.00 60.65 57.48 1hic s ILE 29 Cb -0.14 -4.10 -0.03 0.00 -1.58 0.00 0.00 42.46 36.62 1hic s ILE 29 CO 0.02 -0.53 1.85 -0.76 -1.23 0.00 0.00 174.94 174.29 1hic s LEU 30 N 1.96 3.23 0.32 2.97 1.02 -1.26 -2.85 118.68 124.07 1hic s LEU 30 Ca 0.08 -0.48 0.00 0.00 0.02 0.00 0.00 54.13 53.75 1hic s LEU 30 Cb -0.21 -2.55 0.00 0.00 0.02 0.00 0.00 46.19 43.45 1hic s LEU 30 CO 0.10 -2.50 0.00 0.61 0.02 0.00 0.00 176.35 174.58 1hic n GLY 31 N 6.50 -2.09 2.94 -3.19 0.00 -1.18 -4.85 105.19 103.31 1hic n GLY 31 Ca 0.33 -1.21 0.04 0.00 0.00 0.00 0.00 46.02 45.17 1hic n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hic s SER 32 N -6.39 -0.29 -1.43 1.61 0.15 -1.26 -4.87 113.70 101.22 1hic s SER 32 Ca 0.00 -0.06 -0.09 0.00 0.70 0.00 0.00 55.95 56.50 1hic s SER 32 Cb 0.00 0.74 0.05 0.00 -1.71 0.00 0.00 66.02 65.10 1hic s SER 32 CO 0.00 -0.04 0.94 0.47 1.20 0.00 0.00 173.24 175.81 1hic n ASP 33 N 4.32 -3.95 0.00 5.45 8.00 -1.26 -1.76 116.55 127.34 1hic n ASP 33 Ca 0.07 -0.75 0.00 0.00 0.71 0.00 0.00 54.79 54.83 1hic n ASP 33 Cb 0.61 -4.16 0.00 0.00 -0.02 0.00 0.00 41.12 37.55 1hic n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hic n GLY 34 N -1.69 0.81 3.79 0.44 0.00 -1.26 -5.09 105.19 102.19 1hic n GLY 34 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.80 0.63 0.90 1.61 8.01 -0.72 -5.09 118.70 123.23 1hic s GLU 35 Ca 0.00 0.06 -0.13 0.00 0.01 0.00 0.00 54.97 54.91 1hic s GLU 35 Cb 0.00 -1.80 0.17 0.00 -4.31 0.00 0.00 34.13 28.19 1hic s GLU 35 CO 0.00 -2.50 1.24 0.15 0.01 0.00 0.00 175.26 174.16 1hic s LYS 36 N -5.46 1.00 0.09 1.61 3.01 -1.26 -4.11 119.74 114.62 1hic s LYS 36 Ca 0.67 -0.49 -0.31 0.00 -1.01 0.00 0.00 55.97 54.83 1hic s LYS 36 Cb -0.11 -1.96 -0.09 0.00 -1.01 0.00 0.00 37.83 34.66 1hic s LYS 36 CO 0.53 -2.13 1.70 -0.80 0.51 0.00 0.00 175.35 175.17 1hic s ASN 37 N -4.82 6.55 -0.13 2.83 -0.87 -1.26 -3.08 114.94 114.16 1hic s ASN 37 Ca 0.71 2.57 0.02 0.00 -1.57 0.00 0.00 52.86 54.60 1hic s ASN 37 Cb -0.05 -2.57 0.00 0.00 -0.02 0.00 0.00 41.25 38.62 1hic s ASN 37 CO 0.51 -0.92 -0.20 -1.10 -2.57 0.00 0.00 177.10 172.81 1hic s GLN 38 N 2.60 3.10 -0.38 -0.60 -1.52 -1.13 -4.54 119.66 117.18 1hic s GLN 38 Ca 0.76 -0.83 -0.13 0.00 -1.95 0.00 0.00 55.36 53.21 1hic s GLN 38 Cb -0.42 -2.45 0.01 0.00 -0.22 0.00 0.00 33.01 29.94 1hic s GLN 38 CO 0.33 0.08 0.26 0.00 -0.25 0.00 0.00 175.29 175.71 1hic s VAL 40 N 1.65 3.23 0.70 0.00 -7.23 0.35 -4.88 120.40 114.23 1hic s VAL 40 Ca 0.04 -1.72 -0.08 0.00 -1.81 0.00 0.00 61.98 58.42 1hic s VAL 40 Cb -0.19 -2.63 0.05 0.00 0.56 0.00 0.00 36.38 34.18 1hic s VAL 40 CO 0.09 -0.17 1.03 -0.89 -0.31 0.00 0.00 175.10 174.86 1hic s THR 41 N -1.84 2.58 0.00 5.32 2.01 -1.26 0.04 115.64 122.49 1hic s THR 41 Ca 0.26 -0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.16 1hic s THR 41 Cb -0.08 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.30 1hic s THR 41 CO 0.16 -0.14 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 1hic n GLY 42 N -2.95 0.76 0.49 4.40 0.00 0.70 -4.75 105.19 103.85 1hic n GLY 42 Ca 0.07 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.12 1hic n GLY 42 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1hic n GLU 43 N 0.00 -1.22 -3.50 1.61 2.13 0.52 -4.95 120.64 115.24 1hic n GLU 43 Ca 0.00 0.97 -0.10 0.00 0.66 0.00 0.00 57.16 58.69 1hic n GLU 43 Cb 0.00 -1.29 -0.03 0.00 0.27 0.00 0.00 31.44 30.39 1hic n GLU 43 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1hic s GLY 44 N -4.42 -0.48 0.14 8.31 0.00 -1.26 -4.39 107.32 105.23 1hic s GLY 44 Ca 0.00 1.06 -0.10 0.00 0.00 0.00 0.00 44.72 45.68 1hic s GLY 44 CO 0.00 0.42 0.47 -1.08 0.00 0.00 0.00 173.10 172.91 1hic s THR 45 N -2.88 5.00 0.64 0.90 -1.32 -0.39 -4.67 115.64 112.93 1hic s THR 45 Ca 0.03 0.49 -0.15 0.00 -1.21 0.00 0.00 61.69 60.85 1hic s THR 45 Cb -0.01 -3.66 -0.01 0.00 -1.51 0.00 0.00 72.50 67.31 1hic s THR 45 CO -0.07 0.16 1.10 -2.16 -2.21 0.00 0.00 174.62 171.44 1hic s PRO 46 N -2.24 2.92 -0.46 7.08 0.04 -1.26 -0.24 135.00 140.84 1hic s PRO 46 Ca 0.39 1.38 -0.16 0.00 0.04 0.00 0.00 61.00 62.64 1hic s PRO 46 Cb -0.13 -1.97 0.05 0.00 0.04 0.00 0.00 34.50 32.49 1hic s PRO 46 CO 0.20 -1.15 0.43 0.21 0.04 0.00 0.00 177.00 176.73 1hic s LYS 47 N -4.03 3.03 0.22 4.56 2.36 -1.25 -4.82 119.74 119.81 1hic s LYS 47 Ca 0.67 -1.10 -0.29 0.00 -2.55 0.00 0.00 55.97 52.69 1hic s LYS 47 Cb -0.20 -4.07 -0.09 0.00 -1.05 0.00 0.00 37.83 32.42 1hic s LYS 47 CO 0.40 -0.99 0.92 -1.25 1.55 0.00 0.00 175.35 175.97 1hic s PRO 48 N 1.94 4.82 0.51 4.03 0.04 -1.26 -5.06 135.00 140.01 1hic s PRO 48 Ca 0.08 1.45 -0.06 0.00 0.04 0.00 0.00 61.00 62.51 1hic s PRO 48 Cb -0.21 -3.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.01 1hic s PRO 48 CO 0.09 0.51 0.83 -0.65 0.04 0.00 0.00 177.00 177.82 1hic s GLN 49 N -1.10 3.48 0.51 4.56 -1.52 -1.26 -4.94 119.66 119.39 1hic s GLN 49 Ca 0.41 0.24 0.00 0.00 -1.95 0.00 0.00 55.36 54.06 1hic s GLN 49 Cb -0.25 -2.33 0.00 0.00 -0.22 0.00 0.00 33.01 30.21 1hic s GLN 49 CO 0.31 -0.30 0.00 0.43 -0.25 0.00 0.00 175.29 175.48 1hic n SER 50 N -2.35 -6.75 0.00 5.90 7.64 -1.26 -5.34 113.62 111.46 1hic n SER 50 Ca 0.02 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.06 1hic n SER 50 Cb 0.55 -4.14 0.00 0.00 -1.01 0.00 0.00 64.21 59.61 1hic n SER 50 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44