#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 2.71 0.24 1.55 1.01 -1.26 -5.10 120.40 119.56 1hic s VAL 2 Ca 0.00 -1.74 0.02 0.00 0.00 0.00 0.00 61.98 60.26 1hic s VAL 2 Cb 0.00 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.70 1hic s VAL 2 CO 0.00 -0.28 0.20 -1.22 0.00 0.00 0.00 175.10 173.79 1hic n TYR 3 N 4.50 -1.29 -4.04 5.22 4.01 -1.26 -5.17 117.16 119.12 1hic n TYR 3 Ca -0.08 -1.00 -0.09 0.00 -0.16 0.00 0.00 57.90 56.56 1hic n TYR 3 Cb 0.42 -0.20 -0.08 0.00 -0.31 0.00 0.00 39.34 39.17 1hic n TYR 3 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1hic s THR 4 N -1.11 0.10 0.84 -0.72 -4.23 -1.26 -4.97 115.64 104.29 1hic s THR 4 Ca 0.15 -1.62 -0.12 0.00 -1.18 0.00 0.00 61.69 58.92 1hic s THR 4 Cb -0.01 -1.87 0.09 0.00 1.34 0.00 0.00 72.50 72.05 1hic s THR 4 CO 0.10 -0.44 1.10 -1.81 -0.54 0.00 0.00 174.62 173.03 1hic s ASP 5 N -2.99 4.12 0.17 3.99 1.11 -1.26 -0.39 116.67 121.41 1hic s ASP 5 Ca 0.19 1.29 -0.20 0.00 0.18 0.00 0.00 52.55 54.00 1hic s ASP 5 Cb 0.05 -1.99 -0.08 0.00 1.07 0.00 0.00 42.92 41.98 1hic s ASP 5 CO -0.01 -2.20 0.67 0.00 1.18 0.00 0.00 175.17 174.81 1hic n THR 7 N 1.14 0.00 -3.81 0.00 -2.24 -1.26 -5.00 114.28 103.10 1hic n THR 7 Ca -0.05 -0.27 -0.11 0.00 -2.27 0.00 0.00 64.05 61.34 1hic n THR 7 Cb 0.51 0.48 -0.08 0.00 -2.10 0.00 0.00 70.33 69.13 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 -2.77 0.69 0.70 -0.78 -1.05 -1.26 -5.10 118.70 109.13 1hic s GLU 8 Ca -0.01 -0.50 -0.13 0.00 -0.15 0.00 0.00 54.97 54.18 1hic s GLU 8 Cb 0.10 0.29 0.02 0.00 -0.44 0.00 0.00 34.13 34.10 1hic s GLU 8 CO 0.60 -0.20 1.09 -1.12 0.95 0.00 0.00 175.26 176.58 1hic s SER 9 N -1.88 4.98 0.00 0.83 0.01 -1.26 -3.68 113.70 112.70 1hic s SER 9 Ca -0.08 1.84 0.00 0.00 1.31 0.00 0.00 55.95 59.03 1hic s SER 9 Cb -0.02 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1hic s SER 9 CO -0.02 -1.71 0.00 0.61 0.41 0.00 0.00 173.24 172.53 1hic n GLY 10 N -1.09 0.65 3.98 3.44 0.00 0.36 -4.97 105.19 107.56 1hic n GLY 10 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.17 3.11 0.25 1.61 0.74 -1.22 -1.25 119.66 122.73 1hic s GLN 11 Ca 0.00 -0.83 -0.00 0.00 0.05 0.00 0.00 55.36 54.57 1hic s GLN 11 Cb 0.00 -2.74 0.00 0.00 1.10 0.00 0.00 33.01 31.38 1hic s GLN 11 CO 0.00 -0.04 0.34 0.27 -0.55 0.00 0.00 175.29 175.31 1hic n ASN 12 N -1.78 -0.93 -2.26 6.67 0.23 0.17 -0.15 115.26 117.21 1hic n ASN 12 Ca 0.00 -2.40 -0.16 0.00 -0.53 0.00 0.00 54.58 51.49 1hic n ASN 12 Cb 0.58 1.77 0.03 0.00 -2.08 0.00 0.00 39.78 40.08 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 -2.38 -3.82 -4.53 4.77 0.73 -1.32 117.00 110.45 1hic n LEU 13 Ca 0.01 -0.21 -0.12 0.00 -0.03 0.00 0.00 56.01 55.66 1hic n LEU 13 Cb 0.43 -2.31 -0.09 0.00 -2.33 0.00 0.00 43.42 39.12 1hic n LEU 13 CO 0.21 0.17 -0.07 0.00 -1.33 0.00 0.00 177.39 176.37 1hic s LEU 15 N -1.64 3.50 -0.06 0.00 1.43 0.47 -1.87 118.68 120.52 1hic s LEU 15 Ca -0.11 0.85 -0.08 0.00 -1.03 0.00 0.00 54.13 53.76 1hic s LEU 15 Cb -0.04 -3.35 -0.03 0.00 0.03 0.00 0.00 46.19 42.80 1hic s LEU 15 CO 0.00 -1.67 -0.15 0.00 0.23 0.00 0.00 176.35 174.76 1hic s GLU 17 N -2.06 3.10 6.88 0.00 0.41 -1.26 -4.70 118.70 121.07 1hic s GLU 17 Ca -0.13 -1.43 0.00 0.00 -0.41 0.00 0.00 54.97 53.01 1hic s GLU 17 Cb 0.02 -4.31 0.00 0.00 -1.78 0.00 0.00 34.13 28.06 1hic s GLU 17 CO 0.19 -1.53 0.00 0.41 -0.49 0.00 0.00 175.26 173.83 1hic n GLY 18 N 5.22 3.32 0.09 -1.39 0.00 -1.26 -1.02 105.19 110.15 1hic n GLY 18 Ca -0.07 -0.20 0.15 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 3.20 0.33 -4.67 1.61 2.88 -1.26 -4.78 113.62 110.93 1hic n SER 19 Ca 0.00 -0.71 -0.43 0.00 -1.33 0.00 0.00 58.87 56.41 1hic n SER 19 Cb 0.00 -0.09 -0.02 0.00 -0.75 0.00 0.00 64.21 63.35 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 -2.30 6.98 -0.11 -3.46 -0.87 -0.19 -4.93 114.94 110.06 1hic s ASN 20 Ca 0.36 1.77 -0.25 0.00 -1.57 0.00 0.00 52.86 53.16 1hic s ASN 20 Cb 0.21 -2.55 -0.02 0.00 -0.02 0.00 0.00 41.25 38.87 1hic s ASN 20 CO 0.43 -0.69 0.80 -0.69 -2.57 0.00 0.00 177.10 174.38 1hic s VAL 21 N 2.92 4.94 -0.95 1.60 1.01 -1.26 -2.99 120.40 125.66 1hic s VAL 21 Ca 0.56 1.61 -0.24 0.00 0.00 0.00 0.00 61.98 63.91 1hic s VAL 21 Cb -0.23 -4.12 0.02 0.00 0.00 0.00 0.00 36.38 32.04 1hic s VAL 21 CO 0.18 0.12 1.61 0.00 0.00 0.00 0.00 175.10 177.01 1hic s GLY 23 N 5.97 1.67 0.74 0.00 0.00 -1.26 -0.19 107.32 114.23 1hic s GLY 23 Ca 0.54 0.48 -0.16 0.00 0.00 0.00 0.00 44.72 45.57 1hic s GLY 23 CO -0.04 0.94 0.47 0.61 0.00 0.00 0.00 173.10 175.08 1hic n GLN 24 N -4.34 0.25 0.00 2.90 10.64 -1.26 -2.62 117.38 122.95 1hic n GLN 24 Ca 0.10 0.12 0.00 0.00 -1.83 0.00 0.00 57.00 55.40 1hic n GLN 24 Cb 0.52 -1.79 0.00 0.00 -0.86 0.00 0.00 30.24 28.11 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 1.70 3.14 3.58 2.61 0.00 -1.26 -4.99 105.19 109.97 1hic n GLY 25 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.13 3.82 -0.07 1.61 0.01 -1.08 0.13 114.94 118.23 1hic s ASN 26 Ca 0.00 -1.23 -0.07 0.00 -0.71 0.00 0.00 52.86 50.84 1hic s ASN 26 Cb 0.00 -0.38 0.02 0.00 0.41 0.00 0.00 41.25 41.30 1hic s ASN 26 CO 0.00 -0.28 0.20 -0.54 -1.51 0.00 0.00 177.10 174.97 1hic s LYS 27 N -3.65 0.27 -0.21 -0.60 3.01 0.73 -1.68 119.74 117.61 1hic s LYS 27 Ca 0.34 0.22 -0.22 0.00 -1.01 0.00 0.00 55.97 55.30 1hic s LYS 27 Cb 0.04 0.13 -0.02 0.00 -1.01 0.00 0.00 37.83 36.97 1hic s LYS 27 CO 0.17 -0.04 0.68 0.00 0.51 0.00 0.00 175.35 176.67 1hic s ILE 29 N 2.14 5.25 -1.16 0.00 1.09 0.03 -0.49 121.20 128.06 1hic s ILE 29 Ca 0.30 0.15 -0.11 0.00 -1.10 0.00 0.00 60.65 59.89 1hic s ILE 29 Cb -0.16 -3.46 -0.07 0.00 -1.06 0.00 0.00 42.46 37.71 1hic s ILE 29 CO 0.10 0.32 2.32 0.18 -0.10 0.00 0.00 174.94 177.76 1hic n LEU 30 N 4.52 6.09 -1.28 2.97 4.32 -1.26 -1.13 117.00 131.22 1hic n LEU 30 Ca -0.15 -3.47 0.16 0.00 -0.02 0.00 0.00 56.01 52.53 1hic n LEU 30 Cb 0.52 -1.30 -0.08 0.00 -1.62 0.00 0.00 43.42 40.94 1hic n LEU 30 CO 0.34 0.90 -0.54 0.61 -1.22 0.00 0.00 177.39 177.49 1hic n GLY 31 N 3.90 -3.15 2.78 -0.72 0.00 -1.09 -4.72 105.19 102.20 1hic n GLY 31 Ca 0.56 -1.10 -0.02 0.00 0.00 0.00 0.00 46.02 45.45 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 -4.09 0.97 0.00 1.61 3.41 -1.26 -4.98 113.62 109.28 1hic n SER 32 Ca -0.07 -2.18 0.00 0.00 -0.26 0.00 0.00 58.87 56.35 1hic n SER 32 Cb 0.61 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 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 -0.65 0.00 0.00 4.04 5.68 -1.26 -4.98 116.55 119.38 1hic n ASP 33 Ca 0.03 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.32 1hic n ASP 33 Cb 0.82 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.80 1hic n ASP 33 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hic n GLY 34 N 0.00 0.90 3.98 6.12 0.00 -1.26 -5.03 105.19 109.90 1hic n GLY 34 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.02 2.25 0.79 1.61 8.01 -1.26 -5.13 118.70 124.95 1hic s GLU 35 Ca 0.00 -0.86 -0.06 0.00 0.01 0.00 0.00 54.97 54.06 1hic s GLU 35 Cb 0.00 -2.42 0.14 0.00 -4.31 0.00 0.00 34.13 27.54 1hic s GLU 35 CO 0.00 -0.97 1.09 0.15 0.01 0.00 0.00 175.26 175.54 1hic s LYS 36 N -4.91 1.43 0.41 1.61 -0.14 -1.26 -4.16 119.74 112.73 1hic s LYS 36 Ca 0.60 -0.81 -0.22 0.00 -1.36 0.00 0.00 55.97 54.18 1hic s LYS 36 Cb -0.09 -2.17 -0.14 0.00 -1.68 0.00 0.00 37.83 33.75 1hic s LYS 36 CO 0.41 -1.70 0.39 0.09 -0.76 0.00 0.00 175.35 173.77 1hic n ASN 37 N -3.11 -1.57 -3.46 2.83 4.13 -1.26 -2.66 115.26 110.17 1hic n ASN 37 Ca 0.14 0.88 -0.04 0.00 1.68 0.00 0.00 54.58 57.24 1hic n ASN 37 Cb 0.60 -1.03 -0.06 0.00 -1.54 0.00 0.00 39.78 37.75 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 0.45 -0.43 3.52 -2.07 -0.28 -4.77 119.66 114.69 1hic s GLN 38 Ca 0.62 1.00 -0.23 0.00 -1.82 0.00 0.00 55.36 54.93 1hic s GLN 38 Cb -0.62 0.32 0.02 0.00 -1.09 0.00 0.00 33.01 31.64 1hic s GLN 38 CO 0.59 -0.43 0.79 0.00 -1.32 0.00 0.00 175.29 174.93 1hic s VAL 40 N 3.28 1.90 0.57 0.00 -7.23 0.26 -4.89 120.40 114.30 1hic s VAL 40 Ca 0.31 -1.94 -0.20 0.00 -1.81 0.00 0.00 61.98 58.34 1hic s VAL 40 Cb -0.12 -1.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.89 1hic s VAL 40 CO 0.22 -0.28 1.23 0.28 -0.31 0.00 0.00 175.10 176.23 1hic s THR 41 N -1.99 2.57 0.00 5.32 -1.32 -1.26 -0.20 115.64 118.76 1hic s THR 41 Ca 0.16 0.38 0.00 0.00 -1.21 0.00 0.00 61.69 61.02 1hic s THR 41 Cb -0.06 -3.16 0.00 0.00 -1.51 0.00 0.00 72.50 67.77 1hic s THR 41 CO 0.07 -0.06 0.00 0.61 -2.21 0.00 0.00 174.62 173.03 1hic n GLY 42 N 0.56 0.06 3.33 6.08 0.00 0.24 -4.77 105.19 110.69 1hic n GLY 42 Ca 0.12 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 1hic n GLY 42 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1hic n GLU 43 N 0.00 -1.46 -2.35 1.61 0.28 0.12 -4.78 120.64 114.06 1hic n GLU 43 Ca 0.00 1.30 -0.25 0.00 -0.16 0.00 0.00 57.16 58.05 1hic n GLU 43 Cb 0.00 -2.03 0.11 0.00 1.43 0.00 0.00 31.44 30.95 1hic n GLU 43 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1hic s GLY 44 N -1.38 1.75 -0.12 -1.84 0.00 -0.68 -4.90 107.32 100.16 1hic s GLY 44 Ca 0.23 -1.35 -0.12 0.00 0.00 0.00 0.00 44.72 43.48 1hic s GLY 44 CO 0.57 -0.82 0.26 -1.59 0.00 0.00 0.00 173.10 171.53 1hic s THR 45 N -3.29 5.30 0.62 0.90 2.01 -0.38 -4.70 115.64 116.11 1hic s THR 45 Ca 0.65 0.50 -0.17 0.00 0.31 0.00 0.00 61.69 62.98 1hic s THR 45 Cb -0.07 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1hic s THR 45 CO 0.46 0.50 1.15 -2.16 -0.69 0.00 0.00 174.62 173.87 1hic s PRO 46 N -0.28 2.88 -0.41 4.92 0.04 -1.26 0.46 135.00 141.35 1hic s PRO 46 Ca 0.17 1.60 -0.29 0.00 0.04 0.00 0.00 61.00 62.52 1hic s PRO 46 Cb -0.13 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.48 1hic s PRO 46 CO 0.06 -1.23 1.19 0.21 0.04 0.00 0.00 177.00 177.27 1hic s LYS 47 N -3.68 3.80 0.50 4.56 2.20 -0.43 -4.71 119.74 121.98 1hic s LYS 47 Ca 0.72 0.84 -0.20 0.00 -0.36 0.00 0.00 55.97 56.96 1hic s LYS 47 Cb -0.25 -3.88 -0.07 0.00 -1.51 0.00 0.00 37.83 32.11 1hic s LYS 47 CO 0.36 -1.27 1.09 -1.25 -0.36 0.00 0.00 175.35 173.92 1hic s PRO 48 N 4.32 3.63 0.68 4.03 0.04 -1.26 -5.03 135.00 141.41 1hic s PRO 48 Ca 0.51 1.51 -0.10 0.00 0.04 0.00 0.00 61.00 62.95 1hic s PRO 48 Cb -0.11 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.34 1hic s PRO 48 CO 0.27 -0.60 1.06 -1.14 0.04 0.00 0.00 177.00 176.63 1hic s GLN 49 N -3.17 2.88 0.23 4.56 -0.44 -1.26 -5.10 119.66 117.36 1hic s GLN 49 Ca 0.69 0.38 0.05 0.00 -2.50 0.00 0.00 55.36 53.98 1hic s GLN 49 Cb -0.21 -2.07 -0.03 0.00 -1.64 0.00 0.00 33.01 29.06 1hic s GLN 49 CO 0.24 -0.97 0.29 -1.54 0.50 0.00 0.00 175.29 173.82 1hic s SER 50 N -4.35 6.02 0.00 6.67 1.04 -1.26 -5.33 113.70 116.50 1hic s SER 50 Ca 0.57 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.97 1hic s SER 50 Cb -0.11 -1.70 0.00 0.00 0.10 0.00 0.00 66.02 64.31 1hic s SER 50 CO 0.51 -0.04 0.00 0.00 0.98 0.00 0.00 173.24 174.68