#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 1.59 0.28 3.34 1.01 -1.26 -5.15 120.40 120.20 1hic s VAL 2 Ca 0.00 -0.98 0.11 0.00 0.00 0.00 0.00 61.98 61.11 1hic s VAL 2 Cb 0.00 -1.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.99 1hic s VAL 2 CO 0.00 0.34 -0.12 -0.31 0.00 0.00 0.00 175.10 175.02 1hic s TYR 3 N -0.60 2.45 0.26 5.22 2.02 -1.26 -5.16 117.35 120.28 1hic s TYR 3 Ca 0.07 -0.29 -0.02 0.00 -0.37 0.00 0.00 57.07 56.47 1hic s TYR 3 Cb -0.08 -1.08 -0.03 0.00 -0.40 0.00 0.00 41.96 40.37 1hic s TYR 3 CO 0.00 0.68 0.28 0.95 -1.57 0.00 0.00 175.55 175.88 1hic s THR 4 N -2.44 0.00 0.96 -0.71 -4.23 -1.26 -4.95 115.64 103.01 1hic s THR 4 Ca 0.31 -1.83 -0.11 0.00 -1.18 0.00 0.00 61.69 58.87 1hic s THR 4 Cb -0.05 -2.47 0.17 0.00 1.34 0.00 0.00 72.50 71.48 1hic s THR 4 CO 0.17 0.00 1.11 -1.81 -0.54 0.00 0.00 174.62 173.55 1hic s ASP 5 N -3.19 2.64 0.66 3.99 1.11 -1.26 -0.97 116.67 119.65 1hic s ASP 5 Ca 0.35 1.99 -0.08 0.00 0.18 0.00 0.00 52.55 54.99 1hic s ASP 5 Cb 0.04 -2.49 0.02 0.00 1.07 0.00 0.00 42.92 41.56 1hic s ASP 5 CO 0.16 -3.25 1.00 0.00 1.18 0.00 0.00 175.17 174.27 1hic n THR 7 N -2.83 0.60 -3.59 0.00 -2.24 -1.26 -5.06 114.28 99.89 1hic n THR 7 Ca 0.06 -0.63 -0.11 0.00 -2.27 0.00 0.00 64.05 61.10 1hic n THR 7 Cb 0.58 0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 69.51 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 -0.60 1.28 0.54 -0.78 -1.05 -1.26 -5.11 118.70 111.71 1hic s GLU 8 Ca 0.00 -0.68 -0.12 0.00 -0.15 0.00 0.00 54.97 54.02 1hic s GLU 8 Cb 0.00 0.54 -0.05 0.00 -0.44 0.00 0.00 34.13 34.17 1hic s GLU 8 CO 0.00 -0.54 0.95 -1.12 0.95 0.00 0.00 175.26 175.49 1hic s SER 9 N -2.81 6.39 -0.19 0.83 0.01 -1.26 -4.13 113.70 112.54 1hic s SER 9 Ca 0.04 1.35 0.00 0.00 1.31 0.00 0.00 55.95 58.66 1hic s SER 9 Cb -0.00 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.80 1hic s SER 9 CO -0.09 -0.68 0.00 0.61 0.41 0.00 0.00 173.24 173.49 1hic n GLY 10 N -2.14 0.48 3.76 3.44 0.00 -0.22 -4.92 105.19 105.58 1hic n GLY 10 Ca 0.05 -0.97 -0.23 0.00 0.00 0.00 0.00 46.02 44.87 1hic n GLY 10 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1hic s GLN 11 N -2.53 2.42 0.33 1.61 0.74 -1.18 -0.88 119.66 120.17 1hic s GLN 11 Ca 0.00 -1.54 0.03 0.00 0.05 0.00 0.00 55.36 53.90 1hic s GLN 11 Cb 0.00 -2.22 -0.01 0.00 1.10 0.00 0.00 33.01 31.88 1hic s GLN 11 CO 0.00 0.06 0.37 0.27 -0.55 0.00 0.00 175.29 175.44 1hic n ASN 12 N -1.22 -0.99 -3.41 6.67 6.94 0.82 0.09 115.26 124.16 1hic n ASN 12 Ca -0.02 -2.97 -0.18 0.00 -0.02 0.00 0.00 54.58 51.39 1hic n ASN 12 Cb 0.61 2.02 0.07 0.00 -2.36 0.00 0.00 39.78 40.13 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 -4.49 -3.63 -4.53 4.77 0.73 -3.78 117.00 106.06 1hic n LEU 13 Ca 0.04 -0.71 -0.07 0.00 -0.03 0.00 0.00 56.01 55.24 1hic n LEU 13 Cb 0.57 -3.05 -0.02 0.00 -2.33 0.00 0.00 43.42 38.59 1hic n LEU 13 CO 0.29 0.28 0.63 0.00 -1.33 0.00 0.00 177.39 177.26 1hic s LEU 15 N -2.75 4.19 0.09 0.00 1.43 -0.15 -0.91 118.68 120.58 1hic s LEU 15 Ca 0.08 1.70 0.00 0.00 -1.03 0.00 0.00 54.13 54.88 1hic s LEU 15 Cb -0.02 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.66 1hic s LEU 15 CO -0.03 -0.73 0.00 0.00 0.23 0.00 0.00 176.35 175.81 1hic s GLU 17 N -1.66 3.66 6.62 0.00 8.01 -1.25 -4.69 118.70 129.40 1hic s GLU 17 Ca 0.00 -1.94 0.00 0.00 0.01 0.00 0.00 54.97 53.04 1hic s GLU 17 Cb 0.00 -4.87 0.00 0.00 -4.31 0.00 0.00 34.13 24.95 1hic s GLU 17 CO 0.00 -1.71 0.00 0.41 0.01 0.00 0.00 175.26 173.97 1hic n GLY 18 N 5.15 2.81 0.03 -1.39 0.00 -1.26 -1.73 105.19 108.81 1hic n GLY 18 Ca 0.24 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 46.07 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 3.33 0.16 -4.68 1.61 2.88 -1.26 -4.75 113.62 110.91 1hic n SER 19 Ca 0.00 -0.21 -0.42 0.00 -1.33 0.00 0.00 58.87 56.91 1hic n SER 19 Cb 0.00 -0.22 -0.03 0.00 -0.75 0.00 0.00 64.21 63.21 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 -2.61 7.07 0.12 -3.46 0.01 -0.70 -4.91 114.94 110.45 1hic s ASN 20 Ca 0.26 1.71 -0.26 0.00 -0.71 0.00 0.00 52.86 53.86 1hic s ASN 20 Cb 0.20 -2.55 -0.07 0.00 0.41 0.00 0.00 41.25 39.24 1hic s ASN 20 CO 0.48 -0.60 0.82 -0.69 -1.51 0.00 0.00 177.10 175.61 1hic s VAL 21 N 2.48 4.51 -0.87 1.60 1.01 -1.26 -3.07 120.40 124.79 1hic s VAL 21 Ca 0.54 1.78 -0.25 0.00 0.00 0.00 0.00 61.98 64.05 1hic s VAL 21 Cb -0.22 -4.18 0.03 0.00 0.00 0.00 0.00 36.38 32.00 1hic s VAL 21 CO 0.19 0.42 1.48 0.00 0.00 0.00 0.00 175.10 177.19 1hic n GLY 23 N 6.26 -1.49 3.65 0.00 0.00 -1.26 -0.19 105.19 112.15 1hic n GLY 23 Ca 0.22 -0.99 -0.36 0.00 0.00 0.00 0.00 46.02 44.89 1hic n GLY 23 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1hic n GLN 24 N -4.46 0.76 -0.68 1.61 3.00 -1.26 -2.89 117.38 113.45 1hic n GLN 24 Ca 0.06 0.31 0.00 0.00 -0.01 0.00 0.00 57.00 57.36 1hic n GLN 24 Cb 0.54 -2.31 0.00 0.00 0.00 0.00 0.00 30.24 28.46 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 1.06 0.84 3.28 1.08 0.00 -1.26 -5.03 105.19 105.16 1hic n GLY 25 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.97 1.89 -0.01 1.61 -0.87 -0.90 -0.56 114.94 113.14 1hic s ASN 26 Ca 0.00 -1.07 -0.04 0.00 -1.57 0.00 0.00 52.86 50.18 1hic s ASN 26 Cb 0.00 -0.02 -0.00 0.00 -0.02 0.00 0.00 41.25 41.21 1hic s ASN 26 CO 0.00 -0.36 0.08 -1.59 -2.57 0.00 0.00 177.10 172.66 1hic s LYS 27 N -3.77 0.28 -0.20 -0.60 -2.85 0.64 -4.25 119.74 109.00 1hic s LYS 27 Ca 0.20 -0.23 -0.14 0.00 -1.00 0.00 0.00 55.97 54.80 1hic s LYS 27 Cb 0.03 0.12 -0.04 0.00 -2.06 0.00 0.00 37.83 35.87 1hic s LYS 27 CO 0.03 -0.06 0.33 0.00 0.10 0.00 0.00 175.35 175.76 1hic s ILE 29 N 1.06 5.18 -1.13 0.00 1.09 -0.01 -1.05 121.20 126.35 1hic s ILE 29 Ca 0.17 -0.11 -0.21 0.00 -1.10 0.00 0.00 60.65 59.40 1hic s ILE 29 Cb -0.14 -3.84 -0.06 0.00 -1.06 0.00 0.00 42.46 37.35 1hic s ILE 29 CO 0.06 -0.14 1.92 0.18 -0.10 0.00 0.00 174.94 176.86 1hic n LEU 30 N 5.35 4.08 -0.14 2.97 4.32 -1.26 -1.69 117.00 130.63 1hic n LEU 30 Ca -0.10 -3.35 0.00 0.00 -0.02 0.00 0.00 56.01 52.55 1hic n LEU 30 Cb 0.49 -1.57 -0.00 0.00 -1.62 0.00 0.00 43.42 40.72 1hic n LEU 30 CO 0.41 -0.76 -0.04 0.61 -1.22 0.00 0.00 177.39 176.38 1hic n GLY 31 N 5.21 -2.90 2.41 -0.72 0.00 -1.15 -4.81 105.19 103.23 1hic n GLY 31 Ca 0.48 -1.26 -0.16 0.00 0.00 0.00 0.00 46.02 45.08 1hic n GLY 31 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hic n SER 32 N -1.61 -0.69 -0.95 1.61 3.41 -1.23 -4.93 113.62 109.24 1hic n SER 32 Ca -0.00 -3.14 0.00 0.00 -0.26 0.00 0.00 58.87 55.47 1hic n SER 32 Cb 0.04 0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 1hic n SER 32 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1hic n ASP 33 N 0.82 -1.26 0.00 4.04 -0.08 -1.26 -4.19 116.55 114.62 1hic n ASP 33 Ca 0.17 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.45 1hic n ASP 33 Cb 0.63 -0.36 0.00 0.00 2.34 0.00 0.00 41.12 43.73 1hic n ASP 33 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1hic n GLY 34 N -0.90 2.55 3.65 0.27 0.00 -1.26 -5.00 105.19 104.50 1hic n GLY 34 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 0.80 0.82 1.61 2.02 -1.26 -5.05 118.70 117.64 1hic s GLU 35 Ca 0.00 1.35 -0.07 0.00 0.02 0.00 0.00 54.97 56.26 1hic s GLU 35 Cb 0.00 -1.72 0.16 0.00 0.10 0.00 0.00 34.13 32.67 1hic s GLU 35 CO 0.00 -2.71 1.14 0.15 0.02 0.00 0.00 175.26 173.85 1hic s LYS 36 N -4.66 1.26 0.51 1.61 -0.14 -1.26 -3.51 119.74 113.56 1hic s LYS 36 Ca 0.66 -0.78 -0.18 0.00 -1.36 0.00 0.00 55.97 54.31 1hic s LYS 36 Cb -0.22 -2.12 -0.13 0.00 -1.68 0.00 0.00 37.83 33.68 1hic s LYS 36 CO 0.59 -1.85 0.13 0.09 -0.76 0.00 0.00 175.35 173.55 1hic n ASN 37 N -3.24 -2.63 -3.16 2.83 4.13 -1.26 -2.94 115.26 109.00 1hic n ASN 37 Ca 0.15 0.70 0.04 0.00 1.68 0.00 0.00 54.58 57.15 1hic n ASN 37 Cb 0.60 -0.97 -0.01 0.00 -1.54 0.00 0.00 39.78 37.86 1hic n ASN 37 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1hic s GLN 38 N -1.38 0.56 -0.72 3.52 -2.07 -0.68 -4.82 119.66 114.07 1hic s GLN 38 Ca 0.61 0.79 -0.27 0.00 -1.82 0.00 0.00 55.36 54.68 1hic s GLN 38 Cb -0.49 0.40 0.03 0.00 -1.09 0.00 0.00 33.01 31.86 1hic s GLN 38 CO 0.62 -0.81 1.24 0.00 -1.32 0.00 0.00 175.29 175.01 1hic s VAL 40 N 5.50 1.98 1.11 0.00 -7.23 0.50 -4.91 120.40 117.34 1hic s VAL 40 Ca 0.34 -1.39 -0.18 0.00 -1.81 0.00 0.00 61.98 58.94 1hic s VAL 40 Cb -0.09 -2.36 0.26 0.00 0.56 0.00 0.00 36.38 34.74 1hic s VAL 40 CO 0.15 0.00 1.20 -0.89 -0.31 0.00 0.00 175.10 175.25 1hic s THR 41 N -2.68 1.75 0.00 5.32 2.01 -1.26 -0.26 115.64 120.51 1hic s THR 41 Ca 0.42 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.42 1hic s THR 41 Cb -0.03 -2.70 0.00 0.00 0.01 0.00 0.00 72.50 69.78 1hic s THR 41 CO 0.26 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.80 1hic n GLY 42 N -2.13 0.70 3.89 4.40 0.00 0.28 -4.10 105.19 108.23 1hic n GLY 42 Ca 0.14 -1.69 -0.29 0.00 0.00 0.00 0.00 46.02 44.18 1hic n GLY 42 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1hic s GLU 43 N -3.46 2.70 0.28 1.61 2.12 -1.26 -2.08 118.70 118.60 1hic s GLU 43 Ca 0.00 0.29 -0.17 0.00 0.36 0.00 0.00 54.97 55.46 1hic s GLU 43 Cb 0.00 -2.06 0.06 0.00 0.26 0.00 0.00 34.13 32.39 1hic s GLU 43 CO 0.00 -1.08 0.83 0.41 -0.54 0.00 0.00 175.26 174.89 1hic n GLY 44 N -2.98 0.87 3.88 -1.50 0.00 -1.26 -4.68 105.19 99.52 1hic n GLY 44 Ca 0.07 -1.19 -0.32 0.00 0.00 0.00 0.00 46.02 44.57 1hic n GLY 44 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1hic s THR 45 N -2.14 5.05 1.01 2.61 -1.32 -0.06 -4.70 115.64 116.08 1hic s THR 45 Ca 0.18 0.32 -0.15 0.00 -1.21 0.00 0.00 61.69 60.83 1hic s THR 45 Cb -0.04 -3.63 0.20 0.00 -1.51 0.00 0.00 72.50 67.52 1hic s THR 45 CO 0.08 0.06 1.15 -2.16 -2.21 0.00 0.00 174.62 171.54 1hic s PRO 46 N -2.54 0.32 -0.16 7.08 0.04 -1.26 -0.12 135.00 138.36 1hic s PRO 46 Ca 0.42 0.11 -0.06 0.00 0.04 0.00 0.00 61.00 61.51 1hic s PRO 46 Cb -0.12 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1hic s PRO 46 CO 0.22 -2.72 0.04 0.21 0.04 0.00 0.00 177.00 174.79 1hic s LYS 47 N -5.36 3.75 0.52 4.56 2.20 -1.25 -4.76 119.74 119.40 1hic s LYS 47 Ca 0.67 -0.37 -0.20 0.00 -0.36 0.00 0.00 55.97 55.72 1hic s LYS 47 Cb -0.12 -3.10 -0.07 0.00 -1.51 0.00 0.00 37.83 33.03 1hic s LYS 47 CO 0.55 0.37 1.10 -1.25 -0.36 0.00 0.00 175.35 175.75 1hic s PRO 48 N 0.09 3.51 0.62 4.03 0.04 -1.26 -5.03 135.00 136.99 1hic s PRO 48 Ca 0.04 1.54 -0.15 0.00 0.04 0.00 0.00 61.00 62.46 1hic s PRO 48 Cb -0.12 -2.05 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 1hic s PRO 48 CO 0.01 -0.71 1.08 -0.65 0.04 0.00 0.00 177.00 176.78 1hic s GLN 49 N -3.25 3.10 0.24 4.56 -1.52 -1.26 -5.08 119.66 116.45 1hic s GLN 49 Ca 0.71 1.28 0.08 0.00 -1.95 0.00 0.00 55.36 55.47 1hic s GLN 49 Cb -0.22 -2.00 -0.04 0.00 -0.22 0.00 0.00 33.01 30.54 1hic s GLN 49 CO 0.25 -1.00 0.11 0.45 -0.25 0.00 0.00 175.29 174.85 1hic s SER 50 N -2.71 5.14 0.00 5.90 0.15 -1.26 -5.32 113.70 115.60 1hic s SER 50 Ca 0.65 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.93 1hic s SER 50 Cb -0.18 -1.19 0.00 0.00 -1.71 0.00 0.00 66.02 62.94 1hic s SER 50 CO 0.39 0.00 0.00 1.57 1.20 0.00 0.00 173.24 176.40