#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 5.02 0.28 2.52 1.01 -1.26 -5.13 120.40 122.85 1hic s VAL 2 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.99 1hic s VAL 2 Cb 0.00 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.56 1hic s VAL 2 CO 0.00 -0.41 0.10 -0.31 0.00 0.00 0.00 175.10 174.48 1hic s TYR 3 N -2.18 1.63 0.16 5.22 2.02 -1.26 -5.17 117.35 117.77 1hic s TYR 3 Ca 0.44 -1.16 -0.06 0.00 -0.37 0.00 0.00 57.07 55.92 1hic s TYR 3 Cb -0.10 -0.97 -0.02 0.00 -0.40 0.00 0.00 41.96 40.46 1hic s TYR 3 CO 0.32 -0.29 0.22 0.95 -1.57 0.00 0.00 175.55 175.18 1hic s THR 4 N -3.65 0.07 0.73 -0.71 -4.23 -1.26 -4.97 115.64 101.61 1hic s THR 4 Ca 0.37 -1.60 -0.11 0.00 -1.18 0.00 0.00 61.69 59.18 1hic s THR 4 Cb 0.08 -1.98 0.04 0.00 1.34 0.00 0.00 72.50 71.97 1hic s THR 4 CO 0.14 -0.30 1.10 -1.81 -0.54 0.00 0.00 174.62 173.21 1hic s ASP 5 N -3.01 5.13 0.42 3.99 1.11 -1.26 -0.39 116.67 122.66 1hic s ASP 5 Ca 0.21 0.94 -0.06 0.00 0.18 0.00 0.00 52.55 53.82 1hic s ASP 5 Cb 0.05 -1.65 -0.05 0.00 1.07 0.00 0.00 42.92 42.34 1hic s ASP 5 CO 0.02 -1.50 0.73 0.00 1.18 0.00 0.00 175.17 175.60 1hic n THR 7 N -1.75 1.23 -4.22 0.00 -2.24 -1.26 -5.05 114.28 100.98 1hic n THR 7 Ca 0.00 -0.50 -0.13 0.00 -2.27 0.00 0.00 64.05 61.16 1hic n THR 7 Cb 0.55 -1.19 -0.10 0.00 -2.10 0.00 0.00 70.33 67.48 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 -2.43 1.00 0.55 -0.78 -1.05 -1.26 -5.03 118.70 109.70 1hic s GLU 8 Ca -0.27 -1.43 -0.19 0.00 -0.15 0.00 0.00 54.97 52.93 1hic s GLU 8 Cb 0.07 -0.42 -0.05 0.00 -0.44 0.00 0.00 34.13 33.29 1hic s GLU 8 CO 0.52 -0.00 1.12 -1.12 0.95 0.00 0.00 175.26 176.73 1hic s SER 9 N -3.13 5.69 -0.03 0.83 0.01 -1.26 -3.43 113.70 112.38 1hic s SER 9 Ca 0.17 2.14 0.00 0.00 1.31 0.00 0.00 55.95 59.57 1hic s SER 9 Cb 0.04 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1hic s SER 9 CO -0.00 -1.24 0.00 0.61 0.41 0.00 0.00 173.24 173.02 1hic n GLY 10 N 0.06 0.43 3.83 3.44 0.00 0.18 -4.95 105.19 108.19 1hic n GLY 10 Ca 0.11 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.49 -0.25 0.26 1.61 -0.21 -1.22 -2.10 119.66 117.27 1hic s GLN 11 Ca 0.00 -0.44 -0.09 0.00 0.02 0.00 0.00 55.36 54.85 1hic s GLN 11 Cb 0.00 -1.75 0.03 0.00 1.00 0.00 0.00 33.01 32.30 1hic s GLN 11 CO 0.00 -3.00 0.50 0.27 -2.12 0.00 0.00 175.29 170.94 1hic n ASN 12 N -4.17 -1.46 -2.08 5.90 0.23 0.10 -0.12 115.26 113.66 1hic n ASN 12 Ca 0.16 -2.12 -0.14 0.00 -0.53 0.00 0.00 54.58 51.95 1hic n ASN 12 Cb 0.59 2.46 0.03 0.00 -2.08 0.00 0.00 39.78 40.79 1hic n ASN 12 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 1hic n LEU 13 N 0.00 -2.39 -3.55 -4.53 7.94 0.84 -2.22 117.00 113.09 1hic n LEU 13 Ca -0.05 -0.21 -0.12 0.00 -1.11 0.00 0.00 56.01 54.52 1hic n LEU 13 Cb 0.40 -2.08 -0.04 0.00 0.53 0.00 0.00 43.42 42.24 1hic n LEU 13 CO 0.19 0.20 0.26 0.00 -1.11 0.00 0.00 177.39 176.93 1hic s LEU 15 N -2.63 3.99 -0.09 0.00 1.43 0.48 -1.16 118.68 120.69 1hic s LEU 15 Ca 0.01 1.70 -0.08 0.00 -1.03 0.00 0.00 54.13 54.73 1hic s LEU 15 Cb 0.00 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.67 1hic s LEU 15 CO -0.10 -1.15 -0.15 0.00 0.23 0.00 0.00 176.35 175.18 1hic s GLU 17 N -1.88 3.49 5.43 0.00 -1.05 -1.25 -4.64 118.70 118.80 1hic s GLU 17 Ca -0.12 -0.56 0.00 0.00 -0.15 0.00 0.00 54.97 54.13 1hic s GLU 17 Cb 0.02 -3.13 0.00 0.00 -0.44 0.00 0.00 34.13 30.57 1hic s GLU 17 CO 0.18 -0.19 0.00 0.41 0.95 0.00 0.00 175.26 176.61 1hic n GLY 18 N 4.83 3.33 1.56 -3.83 0.00 -1.26 -0.80 105.19 109.02 1hic n GLY 18 Ca -0.17 -0.03 0.08 0.00 0.00 0.00 0.00 46.02 45.90 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 4.10 4.63 -4.61 1.61 2.88 -1.26 -4.90 113.62 116.07 1hic n SER 19 Ca 0.00 -2.49 -0.41 0.00 -1.33 0.00 0.00 58.87 54.64 1hic n SER 19 Cb 0.00 -0.58 -0.06 0.00 -0.75 0.00 0.00 64.21 62.82 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 -0.84 6.61 -0.32 -3.46 -0.87 0.02 -4.97 114.94 111.11 1hic s ASN 20 Ca 0.48 0.64 -0.29 0.00 -1.57 0.00 0.00 52.86 52.12 1hic s ASN 20 Cb 0.32 -2.37 0.02 0.00 -0.02 0.00 0.00 41.25 39.20 1hic s ASN 20 CO 0.22 -0.51 1.07 0.54 -2.57 0.00 0.00 177.10 175.85 1hic s VAL 21 N 2.74 4.51 -1.22 1.60 0.11 -1.26 -2.08 120.40 124.79 1hic s VAL 21 Ca 0.29 1.73 -0.13 0.00 -2.93 0.00 0.00 61.98 60.95 1hic s VAL 21 Cb -0.15 -4.42 0.17 0.00 -1.53 0.00 0.00 36.38 30.46 1hic s VAL 21 CO 0.11 -0.48 1.50 0.00 -3.33 0.00 0.00 175.10 172.90 1hic n GLY 23 N 3.84 -2.03 3.69 0.00 0.00 -1.26 -0.11 105.19 109.31 1hic n GLY 23 Ca 0.37 -1.54 -0.40 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.12 1.61 -0.12 1.61 6.02 -1.26 -1.56 117.38 121.57 1hic n GLN 24 Ca 0.04 0.59 0.00 0.00 -0.01 0.00 0.00 57.00 57.62 1hic n GLN 24 Cb 0.15 -2.36 0.00 0.00 1.02 0.00 0.00 30.24 29.05 1hic n GLN 24 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1hic n GLY 25 N 0.92 1.33 3.52 1.08 0.00 -1.25 -5.04 105.19 105.74 1hic n GLY 25 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.00 2.88 -0.04 1.61 -0.87 -0.60 -0.78 114.94 114.13 1hic s ASN 26 Ca 0.00 -1.42 -0.03 0.00 -1.57 0.00 0.00 52.86 49.84 1hic s ASN 26 Cb 0.00 -0.07 0.01 0.00 -0.02 0.00 0.00 41.25 41.17 1hic s ASN 26 CO 0.00 -0.61 0.10 -0.75 -2.57 0.00 0.00 177.10 173.27 1hic s LYS 27 N -3.83 0.11 0.03 -0.60 2.20 0.55 -2.42 119.74 115.78 1hic s LYS 27 Ca 0.33 0.15 -0.09 0.00 -0.36 0.00 0.00 55.97 56.00 1hic s LYS 27 Cb 0.08 0.04 -0.05 0.00 -1.51 0.00 0.00 37.83 36.38 1hic s LYS 27 CO 0.15 -0.02 0.34 0.00 -0.36 0.00 0.00 175.35 175.46 1hic s ILE 29 N -1.29 2.27 -0.07 0.00 -1.09 0.71 0.50 121.20 122.22 1hic s ILE 29 Ca 0.29 -1.00 -0.24 0.00 -2.23 0.00 0.00 60.65 57.47 1hic s ILE 29 Cb -0.14 -2.03 -0.03 0.00 -1.58 0.00 0.00 42.46 38.68 1hic s ILE 29 CO 0.16 0.43 0.72 -0.76 -1.23 0.00 0.00 174.94 174.25 1hic s LEU 30 N 1.29 4.30 0.99 2.97 2.01 -1.26 -1.23 118.68 127.75 1hic s LEU 30 Ca 0.03 1.20 -0.12 0.00 0.01 0.00 0.00 54.13 55.24 1hic s LEU 30 Cb -0.14 -3.11 0.18 0.00 0.01 0.00 0.00 46.19 43.13 1hic s LEU 30 CO -0.10 -0.15 1.10 -0.83 1.01 0.00 0.00 176.35 177.39 1hic s GLY 31 N 0.84 1.56 -0.30 -3.19 0.00 -1.25 -4.74 107.32 100.25 1hic s GLY 31 Ca 0.38 -0.43 0.19 0.00 0.00 0.00 0.00 44.72 44.86 1hic s GLY 31 CO 0.18 0.18 1.15 1.44 0.00 0.00 0.00 173.10 176.05 1hic n SER 32 N -4.12 0.85 0.00 1.64 7.64 -1.26 -4.91 113.62 113.45 1hic n SER 32 Ca 0.05 -2.25 0.00 0.00 1.01 0.00 0.00 58.87 57.68 1hic n SER 32 Cb 0.58 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 1hic n SER 32 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1hic n ASP 33 N -0.61 0.00 0.00 6.43 5.75 -1.26 -5.00 116.55 121.87 1hic n ASP 33 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.81 1hic n ASP 33 Cb 0.82 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.91 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 0.00 0.51 3.82 6.12 0.00 -1.26 -4.99 105.19 109.39 1hic n GLY 34 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.52 1.55 0.48 1.61 8.01 -1.26 -5.11 118.70 123.47 1hic s GLU 35 Ca 0.00 0.29 0.03 0.00 0.01 0.00 0.00 54.97 55.30 1hic s GLU 35 Cb 0.00 -1.89 0.02 0.00 -4.31 0.00 0.00 34.13 27.95 1hic s GLU 35 CO 0.00 -1.92 0.69 0.15 0.01 0.00 0.00 175.26 174.19 1hic s LYS 36 N -5.34 2.76 0.47 1.61 1.02 -1.26 -4.67 119.74 114.32 1hic s LYS 36 Ca 0.63 -0.82 -0.17 0.00 0.02 0.00 0.00 55.97 55.63 1hic s LYS 36 Cb -0.14 -2.58 -0.08 0.00 -0.52 0.00 0.00 37.83 34.51 1hic s LYS 36 CO 0.52 -0.46 0.93 -0.80 -0.92 0.00 0.00 175.35 174.62 1hic s ASN 37 N -4.34 6.70 -0.03 2.83 -0.87 -1.26 -3.93 114.94 114.03 1hic s ASN 37 Ca 0.54 1.52 -0.01 0.00 -1.57 0.00 0.00 52.86 53.34 1hic s ASN 37 Cb -0.10 -2.48 0.03 0.00 -0.02 0.00 0.00 41.25 38.68 1hic s ASN 37 CO 0.37 -0.48 0.04 -1.10 -2.57 0.00 0.00 177.10 173.35 1hic s GLN 38 N -3.75 -0.01 -0.45 -0.60 -0.21 -0.36 -4.62 119.66 109.67 1hic s GLN 38 Ca 0.58 0.23 -0.18 0.00 0.02 0.00 0.00 55.36 56.02 1hic s GLN 38 Cb -0.10 -0.36 0.04 0.00 1.00 0.00 0.00 33.01 33.59 1hic s GLN 38 CO 0.26 -0.22 0.52 0.00 -2.12 0.00 0.00 175.29 173.73 1hic s VAL 40 N 2.33 3.52 0.56 0.00 -7.23 0.99 -4.91 120.40 115.67 1hic s VAL 40 Ca 0.14 -0.64 -0.14 0.00 -1.81 0.00 0.00 61.98 59.52 1hic s VAL 40 Cb -0.18 -3.29 -0.06 0.00 0.56 0.00 0.00 36.38 33.41 1hic s VAL 40 CO 0.13 -0.18 1.01 0.28 -0.31 0.00 0.00 175.10 176.02 1hic s THR 41 N -2.56 4.56 0.00 5.32 -1.32 -1.26 -0.33 115.64 120.05 1hic s THR 41 Ca 0.51 1.06 0.00 0.00 -1.21 0.00 0.00 61.69 62.05 1hic s THR 41 Cb -0.10 -3.76 0.00 0.00 -1.51 0.00 0.00 72.50 67.13 1hic s THR 41 CO 0.37 -0.87 0.00 0.61 -2.21 0.00 0.00 174.62 172.52 1hic n GLY 42 N -2.03 0.20 3.60 6.08 0.00 0.04 -4.49 105.19 108.59 1hic n GLY 42 Ca 0.06 -0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 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 0.49 0.32 1.61 0.41 -1.20 -3.55 118.70 116.78 1hic s GLU 43 Ca 0.00 0.22 -0.01 0.00 -0.41 0.00 0.00 54.97 54.77 1hic s GLU 43 Cb 0.00 0.23 -0.01 0.00 -1.78 0.00 0.00 34.13 32.57 1hic s GLU 43 CO 0.00 -0.13 0.39 0.20 -0.49 0.00 0.00 175.26 175.23 1hic s GLY 44 N -0.75 1.61 -0.03 -1.39 0.00 -1.02 -4.64 107.32 101.09 1hic s GLY 44 Ca 0.01 -1.62 -0.24 0.00 0.00 0.00 0.00 44.72 42.87 1hic s GLY 44 CO -0.02 -1.12 0.72 -1.59 0.00 0.00 0.00 173.10 171.08 1hic s THR 45 N -3.35 4.96 0.36 0.90 2.01 -0.89 -4.53 115.64 115.10 1hic s THR 45 Ca 0.33 1.49 -0.28 0.00 0.31 0.00 0.00 61.69 63.55 1hic s THR 45 Cb 0.01 -4.06 -0.10 0.00 0.01 0.00 0.00 72.50 68.36 1hic s THR 45 CO 0.20 0.29 1.31 -2.16 -0.69 0.00 0.00 174.62 173.57 1hic s PRO 46 N 0.52 4.22 -0.19 4.92 0.04 -1.26 0.03 135.00 143.28 1hic s PRO 46 Ca 0.38 2.21 -0.36 0.00 0.04 0.00 0.00 61.00 63.27 1hic s PRO 46 Cb -0.19 -2.96 -0.12 0.00 0.04 0.00 0.00 34.50 31.27 1hic s PRO 46 CO 0.20 -0.29 1.91 1.17 0.04 0.00 0.00 177.00 180.02 1hic n LYS 47 N 0.57 1.71 -2.09 4.56 4.81 -0.94 -4.85 118.16 121.93 1hic n LYS 47 Ca 0.01 0.60 -0.36 0.00 -0.87 0.00 0.00 58.31 57.70 1hic n LYS 47 Cb 0.42 -2.49 0.02 0.00 0.02 0.00 0.00 35.03 33.00 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 4.40 3.18 0.67 1.64 0.04 -1.26 -5.02 135.00 138.65 1hic s PRO 48 Ca 0.97 1.80 -0.16 0.00 0.04 0.00 0.00 61.00 63.65 1hic s PRO 48 Cb -0.81 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 31.71 1hic s PRO 48 CO 0.55 -1.03 1.19 1.14 0.04 0.00 0.00 177.00 178.88 1hic s GLN 49 N -3.21 2.55 0.38 4.56 0.00 -1.26 -4.87 119.66 117.80 1hic s GLN 49 Ca 0.74 1.71 0.00 0.00 -0.00 0.00 0.00 55.36 57.81 1hic s GLN 49 Cb -0.29 -1.89 0.00 0.00 0.00 0.00 0.00 33.01 30.83 1hic s GLN 49 CO 0.33 -1.51 0.00 0.43 0.00 0.00 0.00 175.29 174.54 1hic n SER 50 N -2.28 -6.40 0.00 12.60 7.64 -1.26 -5.30 113.62 118.62 1hic n SER 50 Ca 0.13 0.81 0.00 0.00 1.01 0.00 0.00 58.87 60.82 1hic n SER 50 Cb 0.50 -3.51 0.00 0.00 -1.01 0.00 0.00 64.21 60.19 1hic n SER 50 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03