#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 4.27 0.16 3.34 1.01 -1.26 -4.95 120.40 122.98 1hic s VAL 2 Ca 0.00 -1.13 -0.04 0.00 0.00 0.00 0.00 61.98 60.81 1hic s VAL 2 Cb 0.00 -4.94 -0.03 0.00 0.00 0.00 0.00 36.38 31.41 1hic s VAL 2 CO 0.00 -1.76 0.17 -0.31 0.00 0.00 0.00 175.10 173.20 1hic s TYR 3 N 3.98 0.74 0.14 5.22 2.02 -1.26 -5.13 117.35 123.06 1hic s TYR 3 Ca 0.40 -1.08 -0.09 0.00 -0.37 0.00 0.00 57.07 55.93 1hic s TYR 3 Cb -0.02 -0.32 -0.00 0.00 -0.40 0.00 0.00 41.96 41.22 1hic s TYR 3 CO -0.10 -0.64 0.25 0.95 -1.57 0.00 0.00 175.55 174.45 1hic s THR 4 N -4.04 0.09 0.60 -0.71 -4.23 -1.26 -4.96 115.64 101.13 1hic s THR 4 Ca 0.25 -1.28 -0.12 0.00 -1.18 0.00 0.00 61.69 59.36 1hic s THR 4 Cb 0.05 -1.63 -0.05 0.00 1.34 0.00 0.00 72.50 72.22 1hic s THR 4 CO 0.04 -0.43 1.01 -1.81 -0.54 0.00 0.00 174.62 172.89 1hic s ASP 5 N -2.92 6.29 0.46 3.99 1.01 -1.26 -0.16 116.67 124.07 1hic s ASP 5 Ca 0.12 1.42 -0.12 0.00 0.71 0.00 0.00 52.55 54.69 1hic s ASP 5 Cb 0.04 -2.47 -0.06 0.00 1.01 0.00 0.00 42.92 41.44 1hic s ASP 5 CO -0.04 -0.82 0.85 0.00 0.21 0.00 0.00 175.17 175.37 1hic n THR 7 N -1.58 0.00 -3.88 0.00 -2.24 -1.26 -5.01 114.28 100.30 1hic n THR 7 Ca 0.04 -0.25 -0.10 0.00 -2.27 0.00 0.00 64.05 61.46 1hic n THR 7 Cb 0.54 0.68 -0.09 0.00 -2.10 0.00 0.00 70.33 69.36 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 -1.97 0.55 0.34 -0.78 -1.05 -1.26 -5.07 118.70 109.46 1hic s GLU 8 Ca -0.00 -0.54 -0.26 0.00 -0.15 0.00 0.00 54.97 54.02 1hic s GLU 8 Cb 0.04 0.22 -0.09 0.00 -0.44 0.00 0.00 34.13 33.86 1hic s GLU 8 CO 0.24 -0.14 1.02 -1.12 0.95 0.00 0.00 175.26 176.21 1hic s SER 9 N -1.72 7.09 0.00 0.83 0.01 -1.26 -3.53 113.70 115.12 1hic s SER 9 Ca -0.10 2.01 0.00 0.00 1.31 0.00 0.00 55.95 59.16 1hic s SER 9 Cb -0.05 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.59 1hic s SER 9 CO -0.01 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 173.99 1hic n GLY 10 N 0.62 0.75 3.97 3.44 0.00 0.84 -4.96 105.19 109.85 1hic n GLY 10 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.43 1.94 0.10 1.61 -0.21 -1.22 -3.00 119.66 118.44 1hic s GLN 11 Ca 0.00 -0.77 -0.01 0.00 0.02 0.00 0.00 55.36 54.60 1hic s GLN 11 Cb 0.00 -2.29 0.01 0.00 1.00 0.00 0.00 33.01 31.72 1hic s GLN 11 CO 0.00 -1.29 0.15 0.27 -2.12 0.00 0.00 175.29 172.30 1hic n ASN 12 N -2.80 -0.43 -2.60 5.90 0.23 0.60 -0.27 115.26 115.88 1hic n ASN 12 Ca 0.12 -1.49 -0.14 0.00 -0.53 0.00 0.00 54.58 52.53 1hic n ASN 12 Cb 0.60 0.77 0.06 0.00 -2.08 0.00 0.00 39.78 39.13 1hic n ASN 12 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1hic n LEU 13 N 0.00 -3.12 -3.51 -4.53 7.99 -0.20 -0.85 117.00 112.78 1hic n LEU 13 Ca -0.00 -0.39 -0.16 0.00 -0.01 0.00 0.00 56.01 55.45 1hic n LEU 13 Cb 0.16 -2.23 -0.05 0.00 -0.11 0.00 0.00 43.42 41.19 1hic n LEU 13 CO 0.08 0.37 0.48 0.00 -1.51 0.00 0.00 177.39 176.80 1hic n LEU 15 N 0.60 4.28 0.02 0.00 4.77 0.78 -0.75 117.00 126.69 1hic n LEU 15 Ca -0.17 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.94 1hic n LEU 15 Cb 0.59 -1.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 1hic n LEU 15 CO 0.20 0.14 0.00 0.00 -1.33 0.00 0.00 177.39 176.40 1hic s GLU 17 N -1.16 3.60 6.70 0.00 2.02 -1.21 -4.61 118.70 124.04 1hic s GLU 17 Ca 0.00 -1.82 0.00 0.00 0.02 0.00 0.00 54.97 53.17 1hic s GLU 17 Cb 0.00 -4.88 0.00 0.00 0.10 0.00 0.00 34.13 29.35 1hic s GLU 17 CO 0.00 -1.73 0.00 0.41 0.02 0.00 0.00 175.26 173.96 1hic n GLY 18 N 5.36 3.37 0.00 -1.39 0.00 -1.26 -0.94 105.19 110.33 1hic n GLY 18 Ca 0.23 -0.13 0.06 0.00 0.00 0.00 0.00 46.02 46.18 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 3.85 0.00 -4.64 1.61 2.88 -1.26 -4.77 113.62 111.30 1hic n SER 19 Ca 0.00 -1.60 -0.42 0.00 -1.33 0.00 0.00 58.87 55.52 1hic n SER 19 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 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 -1.38 6.82 0.06 -3.46 0.01 -0.12 -4.94 114.94 111.94 1hic s ASN 20 Ca 0.17 0.96 -0.31 0.00 -0.71 0.00 0.00 52.86 52.98 1hic s ASN 20 Cb 0.08 -2.45 -0.06 0.00 0.41 0.00 0.00 41.25 39.23 1hic s ASN 20 CO 0.13 -0.61 1.29 0.54 -1.51 0.00 0.00 177.10 176.94 1hic s VAL 21 N 3.01 3.77 -1.10 1.60 0.11 -1.26 -1.55 120.40 124.98 1hic s VAL 21 Ca 0.36 1.25 -0.22 0.00 -2.93 0.00 0.00 61.98 60.44 1hic s VAL 21 Cb -0.14 -3.80 0.02 0.00 -1.53 0.00 0.00 36.38 30.92 1hic s VAL 21 CO 0.10 0.08 1.70 0.00 -3.33 0.00 0.00 175.10 173.64 1hic n GLY 23 N 6.31 -0.55 3.51 0.00 0.00 -1.26 -1.03 105.19 112.16 1hic n GLY 23 Ca 0.41 -0.61 -0.49 0.00 0.00 0.00 0.00 46.02 45.33 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 -3.26 0.64 0.00 1.61 10.64 -1.26 -0.90 117.38 124.85 1hic n GLN 24 Ca 0.12 0.23 0.00 0.00 -1.83 0.00 0.00 57.00 55.51 1hic n GLN 24 Cb 0.51 -1.51 0.00 0.00 -0.86 0.00 0.00 30.24 28.39 1hic n GLN 24 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1hic n GLY 25 N 1.75 2.70 3.91 2.61 0.00 -1.26 -5.02 105.19 109.88 1hic n GLY 25 Ca 0.15 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 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 0.40 5.29 -0.02 1.61 0.01 -0.08 -0.09 114.94 122.06 1hic s ASN 26 Ca 0.00 0.72 -0.00 0.00 -0.71 0.00 0.00 52.86 52.87 1hic s ASN 26 Cb 0.00 -1.56 0.03 0.00 0.41 0.00 0.00 41.25 40.13 1hic s ASN 26 CO 0.00 -1.31 0.03 -0.75 -1.51 0.00 0.00 177.10 173.57 1hic s LYS 27 N -5.16 -0.04 0.03 -0.60 2.20 0.91 -3.82 119.74 113.26 1hic s LYS 27 Ca 0.57 0.22 -0.22 0.00 -0.36 0.00 0.00 55.97 56.17 1hic s LYS 27 Cb -0.11 -0.30 -0.06 0.00 -1.51 0.00 0.00 37.83 35.85 1hic s LYS 27 CO 0.46 -0.20 0.67 0.00 -0.36 0.00 0.00 175.35 175.93 1hic s ILE 29 N -0.26 3.34 0.51 0.00 -1.09 0.65 -0.11 121.20 124.25 1hic s ILE 29 Ca 0.34 -0.52 -0.20 0.00 -2.23 0.00 0.00 60.65 58.04 1hic s ILE 29 Cb -0.19 -2.49 -0.07 0.00 -1.58 0.00 0.00 42.46 38.12 1hic s ILE 29 CO 0.20 0.45 1.08 -0.76 -1.23 0.00 0.00 174.94 174.69 1hic s LEU 30 N 1.12 3.80 0.50 2.97 1.02 -1.26 -0.74 118.68 126.09 1hic s LEU 30 Ca 0.01 2.05 -0.20 0.00 0.02 0.00 0.00 54.13 56.01 1hic s LEU 30 Cb -0.15 -4.57 -0.07 0.00 0.02 0.00 0.00 46.19 41.42 1hic s LEU 30 CO -0.01 -0.99 1.08 -0.83 0.02 0.00 0.00 176.35 175.62 1hic s GLY 31 N -1.87 2.57 -1.34 -3.19 0.00 -1.21 -4.88 107.32 97.39 1hic s GLY 31 Ca 0.70 0.70 -0.11 0.00 0.00 0.00 0.00 44.72 46.01 1hic s GLY 31 CO 0.23 1.04 2.00 -1.14 0.00 0.00 0.00 173.10 175.24 1hic n SER 32 N -1.04 4.71 -4.22 1.64 3.41 -1.26 -4.66 113.62 112.21 1hic n SER 32 Ca 0.10 -3.02 -0.36 0.00 -0.26 0.00 0.00 58.87 55.33 1hic n SER 32 Cb 0.52 -1.54 -0.03 0.00 -0.26 0.00 0.00 64.21 62.90 1hic n SER 32 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1hic n ASP 33 N 4.57 -3.31 0.02 4.04 5.75 -1.26 -4.08 116.55 122.28 1hic n ASP 33 Ca 0.44 -1.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.21 1hic n ASP 33 Cb 0.37 -2.79 0.00 0.00 -1.03 0.00 0.00 41.12 37.67 1hic n ASP 33 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1hic n GLY 34 N -1.41 -1.46 3.66 6.12 0.00 -1.26 -5.13 105.19 105.70 1hic n GLY 34 Ca 0.07 0.59 -0.30 0.00 0.00 0.00 0.00 46.02 46.38 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 -2.00 0.78 0.56 1.61 2.02 -1.26 -5.06 118.70 115.35 1hic s GLU 35 Ca 0.00 1.03 0.05 0.00 0.02 0.00 0.00 54.97 56.07 1hic s GLU 35 Cb 0.00 -1.74 0.07 0.00 0.10 0.00 0.00 34.13 32.56 1hic s GLU 35 CO 0.00 -2.63 0.78 0.15 0.02 0.00 0.00 175.26 173.58 1hic s LYS 36 N -4.75 2.34 0.62 1.61 3.01 -1.26 -4.25 119.74 117.05 1hic s LYS 36 Ca 0.65 -1.23 -0.19 0.00 -1.01 0.00 0.00 55.97 54.20 1hic s LYS 36 Cb -0.21 -2.57 -0.02 0.00 -1.01 0.00 0.00 37.83 34.02 1hic s LYS 36 CO 0.59 -0.82 1.30 -0.80 0.51 0.00 0.00 175.35 176.13 1hic s ASN 37 N -4.55 4.83 -0.04 2.83 -0.87 -1.26 -3.33 114.94 112.55 1hic s ASN 37 Ca 0.60 2.64 -0.02 0.00 -1.57 0.00 0.00 52.86 54.51 1hic s ASN 37 Cb -0.08 -2.62 0.03 0.00 -0.02 0.00 0.00 41.25 38.56 1hic s ASN 37 CO 0.39 -1.85 0.07 -1.10 -2.57 0.00 0.00 177.10 172.03 1hic s GLN 38 N -3.25 -0.03 -0.54 -0.60 -0.21 0.09 -4.74 119.66 110.38 1hic s GLN 38 Ca 0.79 0.34 -0.13 0.00 0.02 0.00 0.00 55.36 56.38 1hic s GLN 38 Cb -0.38 -0.36 0.13 0.00 1.00 0.00 0.00 33.01 33.41 1hic s GLN 38 CO 0.41 -0.26 0.45 0.00 -2.12 0.00 0.00 175.29 173.78 1hic s VAL 40 N 1.34 1.93 -0.11 0.00 -7.23 0.12 -4.87 120.40 111.59 1hic s VAL 40 Ca 0.06 -1.13 -0.06 0.00 -1.81 0.00 0.00 61.98 59.04 1hic s VAL 40 Cb -0.27 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.58 1hic s VAL 40 CO 0.00 0.00 0.13 -0.89 -0.31 0.00 0.00 175.10 174.03 1hic s THR 41 N -2.73 5.39 0.00 5.32 2.01 -1.26 -0.06 115.64 124.31 1hic s THR 41 Ca 0.55 0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.69 1hic s THR 41 Cb -0.05 -3.35 0.00 0.00 0.01 0.00 0.00 72.50 69.11 1hic s THR 41 CO 0.35 0.60 0.00 0.61 -0.69 0.00 0.00 174.62 175.48 1hic n GLY 42 N 1.92 0.18 0.97 4.40 0.00 -0.71 -4.80 105.19 107.15 1hic n GLY 42 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.67 -1.68 1.61 2.13 0.88 -4.96 120.64 115.94 1hic n GLU 43 Ca 0.00 2.03 -0.02 0.00 0.66 0.00 0.00 57.16 59.83 1hic n GLU 43 Cb 0.00 -2.40 0.00 0.00 0.27 0.00 0.00 31.44 29.31 1hic n GLU 43 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hic n GLY 44 N -1.54 2.04 3.74 8.31 0.00 -1.26 -4.79 105.19 111.69 1hic n GLY 44 Ca 0.00 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.47 1hic n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hic s THR 45 N -2.75 3.59 0.37 2.61 2.01 -1.16 -4.67 115.64 115.64 1hic s THR 45 Ca 0.04 1.36 -0.26 0.00 0.31 0.00 0.00 61.69 63.14 1hic s THR 45 Cb -0.01 -3.87 -0.09 0.00 0.01 0.00 0.00 72.50 68.54 1hic s THR 45 CO 0.03 0.23 1.11 -2.16 -0.69 0.00 0.00 174.62 173.14 1hic s PRO 46 N -0.35 4.25 0.72 4.92 0.04 -1.26 -0.29 135.00 143.02 1hic s PRO 46 Ca 0.52 1.73 -0.16 0.00 0.04 0.00 0.00 61.00 63.12 1hic s PRO 46 Cb -0.32 -2.77 -0.01 0.00 0.04 0.00 0.00 34.50 31.44 1hic s PRO 46 CO 0.37 -0.12 0.78 1.17 0.04 0.00 0.00 177.00 179.24 1hic n LYS 47 N 0.32 0.41 -2.21 4.56 4.81 -0.03 -4.81 118.16 121.21 1hic n LYS 47 Ca 0.03 0.19 -0.34 0.00 -0.87 0.00 0.00 58.31 57.32 1hic n LYS 47 Cb 0.47 -2.05 0.00 0.00 0.02 0.00 0.00 35.03 33.47 1hic n LYS 47 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1hic s PRO 48 N -3.08 3.37 -0.23 1.64 0.04 -1.26 -5.01 135.00 130.47 1hic s PRO 48 Ca 0.70 1.45 -0.17 0.00 0.04 0.00 0.00 61.00 63.02 1hic s PRO 48 Cb -0.35 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 1hic s PRO 48 CO 0.54 -0.80 0.47 -1.14 0.04 0.00 0.00 177.00 176.10 1hic s GLN 49 N -3.53 4.11 0.18 4.56 -0.44 -1.26 -4.84 119.66 118.45 1hic s GLN 49 Ca 0.69 0.28 0.00 0.00 -2.50 0.00 0.00 55.36 53.83 1hic s GLN 49 Cb -0.20 -3.60 0.00 0.00 -1.64 0.00 0.00 33.01 27.56 1hic s GLN 49 CO 0.29 -0.22 0.00 0.45 0.50 0.00 0.00 175.29 176.31 1hic n SER 50 N 5.08 -2.55 0.00 6.67 2.88 -1.26 -5.31 113.62 119.13 1hic n SER 50 Ca -0.06 0.55 0.00 0.00 -1.33 0.00 0.00 58.87 58.04 1hic n SER 50 Cb 0.50 -0.96 0.00 0.00 -0.75 0.00 0.00 64.21 63.01 1hic n SER 50 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38