#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4hir s VAL 2 N 0.00 4.86 0.08 1.55 1.01 -1.26 -5.12 120.40 121.52 4hir s VAL 2 Ca 0.00 -1.18 -0.01 0.00 0.00 0.00 0.00 61.98 60.79 4hir s VAL 2 Cb 0.00 -3.63 0.02 0.00 0.00 0.00 0.00 36.38 32.77 4hir s VAL 2 CO 0.00 -0.33 0.11 -1.22 0.00 0.00 0.00 175.10 173.66 4hir n TYR 3 N -1.26 -3.87 -3.84 5.22 4.01 -1.26 -5.11 117.16 111.05 4hir n TYR 3 Ca -0.08 -0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 4hir n TYR 3 Cb 0.57 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 4hir n TYR 3 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 4hir n THR 4 N -2.02 0.00 -3.32 -0.72 -2.24 -1.26 -4.98 114.28 99.74 4hir n THR 4 Ca 0.01 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.49 4hir n THR 4 Cb 0.05 -0.06 -0.05 0.00 -2.10 0.00 0.00 70.33 68.17 4hir n THR 4 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 4hir s ASP 5 N -0.83 6.57 1.10 3.42 1.11 -1.26 -2.10 116.67 124.68 4hir s ASP 5 Ca 0.00 0.91 -0.18 0.00 0.18 0.00 0.00 52.55 53.45 4hir s ASP 5 Cb 0.00 -2.22 0.26 0.00 1.07 0.00 0.00 42.92 42.03 4hir s ASP 5 CO 0.00 -0.15 1.25 0.00 1.18 0.00 0.00 175.17 177.45 4hir n THR 7 N -4.30 0.00 -3.77 0.00 -2.24 -1.26 -4.97 114.28 97.75 4hir n THR 7 Ca 0.16 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.86 4hir n THR 7 Cb 0.59 0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 68.84 4hir n THR 7 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 4hir s GLU 8 N 0.00 1.61 0.45 -0.78 2.02 -1.26 -5.14 118.70 115.60 4hir s GLU 8 Ca 0.00 -0.85 -0.05 0.00 0.02 0.00 0.00 54.97 54.10 4hir s GLU 8 Cb 0.00 0.58 -0.04 0.00 0.10 0.00 0.00 34.13 34.77 4hir s GLU 8 CO 0.00 -0.73 0.74 -1.12 0.02 0.00 0.00 175.26 174.17 4hir s SER 9 N -2.88 6.29 0.00 -0.19 0.01 -1.26 -4.15 113.70 111.51 4hir s SER 9 Ca 0.09 0.87 0.00 0.00 1.31 0.00 0.00 55.95 58.23 4hir s SER 9 Cb -0.04 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 63.96 4hir s SER 9 CO 0.03 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 173.77 4hir n GLY 10 N -2.08 2.65 2.55 3.44 0.00 0.50 -4.86 105.19 107.40 4hir n GLY 10 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 4hir n GLY 10 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 4hir n GLN 11 N -0.31 -1.13 0.04 1.61 6.02 -1.25 -3.88 117.38 118.47 4hir n GLN 11 Ca 0.00 -0.61 0.00 0.00 -0.01 0.00 0.00 57.00 56.38 4hir n GLN 11 Cb 0.00 -1.24 0.00 0.00 1.02 0.00 0.00 30.24 30.02 4hir n GLN 11 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 4hir n ASN 12 N -1.27 -0.21 -1.97 1.08 4.13 -0.39 -2.39 115.26 114.23 4hir n ASN 12 Ca 0.06 0.13 -0.09 0.00 1.68 0.00 0.00 54.58 56.36 4hir n ASN 12 Cb 0.25 0.31 -0.13 0.00 -1.54 0.00 0.00 39.78 38.68 4hir n ASN 12 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 4hir n LEU 13 N -2.72 4.67 0.00 3.41 4.77 -1.26 -1.62 117.00 124.26 4hir n LEU 13 Ca 0.00 -2.76 0.00 0.00 -0.03 0.00 0.00 56.01 53.22 4hir n LEU 13 Cb 0.00 -1.22 0.00 0.00 -2.33 0.00 0.00 43.42 39.87 4hir n LEU 13 CO 0.00 1.36 0.00 0.00 -1.33 0.00 0.00 177.39 177.42 4hir s LEU 15 N 0.00 2.40 0.00 0.00 1.43 -0.89 -2.23 118.68 119.38 4hir s LEU 15 Ca 0.00 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.56 4hir s LEU 15 Cb 0.00 -1.56 0.00 0.00 0.03 0.00 0.00 46.19 44.66 4hir s LEU 15 CO 0.00 0.03 0.00 0.00 0.23 0.00 0.00 176.35 176.61 4hir s GLU 17 N -0.65 3.43 7.78 0.00 0.41 -1.26 -4.81 118.70 123.60 4hir s GLU 17 Ca 0.00 -0.81 0.00 0.00 -0.41 0.00 0.00 54.97 53.75 4hir s GLU 17 Cb 0.00 -4.97 0.00 0.00 -1.78 0.00 0.00 34.13 27.38 4hir s GLU 17 CO 0.00 -2.22 0.00 0.41 -0.49 0.00 0.00 175.26 172.96 4hir n GLY 18 N 6.40 2.85 0.54 -1.39 0.00 -1.26 -2.38 105.19 109.96 4hir n GLY 18 Ca 0.24 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 46.09 4hir n GLY 18 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 4hir n SER 19 N 9.19 2.39 -4.73 1.61 2.88 -1.26 -4.92 113.62 118.78 4hir n SER 19 Ca 0.00 -1.71 -0.41 0.00 -1.33 0.00 0.00 58.87 55.42 4hir n SER 19 Cb 0.00 -0.11 -0.04 0.00 -0.75 0.00 0.00 64.21 63.31 4hir n SER 19 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 4hir s ASN 20 N -0.96 7.42 0.37 -3.46 0.01 -1.00 -4.92 114.94 112.39 4hir s ASN 20 Ca 0.18 1.91 -0.25 0.00 -0.71 0.00 0.00 52.86 53.98 4hir s ASN 20 Cb 0.11 -2.59 -0.09 0.00 0.41 0.00 0.00 41.25 39.08 4hir s ASN 20 CO 0.15 -0.11 1.04 -0.69 -1.51 0.00 0.00 177.10 175.98 4hir s VAL 21 N -0.13 3.74 -0.29 1.60 1.01 -1.26 -2.49 120.40 122.58 4hir s VAL 21 Ca 0.48 1.42 -0.03 0.00 0.00 0.00 0.00 61.98 63.84 4hir s VAL 21 Cb -0.26 -3.78 0.11 0.00 0.00 0.00 0.00 36.38 32.46 4hir s VAL 21 CO 0.32 0.09 0.17 0.00 0.00 0.00 0.00 175.10 175.68 4hir n GLY 23 N 5.24 0.02 3.62 0.00 0.00 -0.64 -4.23 105.19 109.20 4hir n GLY 23 Ca -0.05 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 4hir n GLY 23 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 4hir s GLN 24 N -1.20 4.04 0.00 1.61 0.74 -1.26 -3.19 119.66 120.39 4hir s GLN 24 Ca 0.00 0.69 0.00 0.00 0.05 0.00 0.00 55.36 56.10 4hir s GLN 24 Cb 0.00 -3.70 0.00 0.00 1.10 0.00 0.00 33.01 30.41 4hir s GLN 24 CO 0.00 -0.61 0.00 0.41 -0.55 0.00 0.00 175.29 174.54 4hir n GLY 25 N 4.07 3.16 3.31 2.59 0.00 -1.26 -4.98 105.19 112.07 4hir n GLY 25 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 4hir n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4hir s ASN 26 N -0.59 1.74 0.09 1.61 4.22 -1.19 -2.81 114.94 118.00 4hir s ASN 26 Ca 0.00 -1.19 0.09 0.00 -2.14 0.00 0.00 52.86 49.62 4hir s ASN 26 Cb 0.00 0.02 -0.03 0.00 1.28 0.00 0.00 41.25 42.52 4hir s ASN 26 CO 0.00 -0.50 -0.24 -0.75 -2.04 0.00 0.00 177.10 173.57 4hir s LYS 27 N -3.86 1.41 0.31 3.55 2.20 0.42 -3.95 119.74 119.82 4hir s LYS 27 Ca 0.27 -1.18 0.08 0.00 -0.36 0.00 0.00 55.97 54.78 4hir s LYS 27 Cb 0.05 -1.72 -0.04 0.00 -1.51 0.00 0.00 37.83 34.62 4hir s LYS 27 CO 0.07 0.42 0.16 0.00 -0.36 0.00 0.00 175.35 175.64 4hir s ILE 29 N -2.32 -0.04 -0.30 0.00 -1.09 -0.67 0.19 121.20 116.97 4hir s ILE 29 Ca 0.36 0.16 -0.29 0.00 -2.23 0.00 0.00 60.65 58.65 4hir s ILE 29 Cb -0.05 -0.33 0.01 0.00 -1.58 0.00 0.00 42.46 40.50 4hir s ILE 29 CO 0.24 0.06 1.21 -0.76 -1.23 0.00 0.00 174.94 174.46 4hir s LEU 30 N 1.23 3.92 0.00 2.97 1.43 -1.26 -0.72 118.68 126.25 4hir s LEU 30 Ca -0.09 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.19 4hir s LEU 30 Cb -0.11 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.57 4hir s LEU 30 CO -0.08 -0.98 0.00 0.61 0.23 0.00 0.00 176.35 176.13 4hir n GLY 31 N 4.10 0.09 0.00 -3.19 0.00 -0.07 -4.84 105.19 101.27 4hir n GLY 31 Ca 0.14 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.27 4hir n GLY 31 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 4hir n SER 32 N 0.00 0.00 -3.45 1.61 2.88 0.91 -4.57 113.62 111.01 4hir n SER 32 Ca 0.00 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.19 4hir n SER 32 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 4hir n SER 32 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 4hir n ASP 33 N 0.00 4.61 -0.45 -3.46 5.75 -1.26 -3.13 116.55 118.60 4hir n ASP 33 Ca 0.00 -2.58 -0.04 0.00 -0.01 0.00 0.00 54.79 52.16 4hir n ASP 33 Cb 0.00 -1.29 -0.00 0.00 -1.03 0.00 0.00 41.12 38.80 4hir n ASP 33 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4hir n GLY 34 N 4.04 0.25 0.00 6.12 0.00 -1.26 -4.98 105.19 109.35 4hir n GLY 34 Ca 0.53 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.82 4hir n GLY 34 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 4hir n GLU 35 N -1.55 0.00 -1.10 1.61 1.02 -1.18 -5.10 120.64 114.33 4hir n GLU 35 Ca -0.05 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.05 4hir n GLU 35 Cb 0.49 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.93 4hir n GLU 35 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 4hir n LYS 36 N 0.00 0.66 -0.84 3.49 5.02 -1.26 -3.85 118.16 121.38 4hir n LYS 36 Ca 0.00 -0.49 -0.34 0.00 -2.02 0.00 0.00 58.31 55.46 4hir n LYS 36 Cb 0.00 -0.09 0.10 0.00 -0.02 0.00 0.00 35.03 35.03 4hir n LYS 36 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 4hir n ASN 37 N -2.95 -3.03 -3.64 4.39 4.13 -1.26 0.31 115.26 113.21 4hir n ASN 37 Ca 0.03 0.25 -0.10 0.00 1.68 0.00 0.00 54.58 56.43 4hir n ASN 37 Cb 0.10 -1.07 -0.04 0.00 -1.54 0.00 0.00 39.78 37.23 4hir n ASN 37 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 4hir s GLN 38 N -3.21 1.17 -0.53 3.52 0.74 0.10 -4.29 119.66 117.15 4hir s GLN 38 Ca 0.52 -0.72 0.04 0.00 0.05 0.00 0.00 55.36 55.25 4hir s GLN 38 Cb -0.19 0.49 0.16 0.00 1.10 0.00 0.00 33.01 34.57 4hir s GLN 38 CO 0.71 -0.47 0.35 0.00 -0.55 0.00 0.00 175.29 175.33 4hir s VAL 40 N -0.39 4.93 1.00 0.00 0.11 0.30 -4.82 120.40 121.53 4hir s VAL 40 Ca 0.24 0.99 -0.17 0.00 -2.93 0.00 0.00 61.98 60.11 4hir s VAL 40 Cb -0.10 -3.79 -0.03 0.00 -1.53 0.00 0.00 36.38 30.93 4hir s VAL 40 CO -0.11 0.55 -0.23 1.07 -3.33 0.00 0.00 175.10 173.05 4hir n THR 41 N 1.93 0.00 0.00 5.04 5.66 -1.26 0.16 114.28 125.82 4hir n THR 41 Ca -0.12 -0.27 0.00 0.00 -3.05 0.00 0.00 64.05 60.61 4hir n THR 41 Cb 0.52 -0.38 0.00 0.00 -1.55 0.00 0.00 70.33 68.92 4hir n THR 41 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 4hir n GLY 42 N 2.37 0.52 3.24 1.09 0.00 -1.12 -3.58 105.19 107.72 4hir n GLY 42 Ca 0.02 -1.83 -0.27 0.00 0.00 0.00 0.00 46.02 43.94 4hir n GLY 42 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 4hir s GLU 43 N -1.04 1.62 0.28 1.61 2.12 -1.26 -3.33 118.70 118.70 4hir s GLU 43 Ca 0.00 -0.84 -0.12 0.00 0.36 0.00 0.00 54.97 54.37 4hir s GLU 43 Cb 0.00 -1.64 0.05 0.00 0.26 0.00 0.00 34.13 32.80 4hir s GLU 43 CO 0.00 0.44 0.64 0.41 -0.54 0.00 0.00 175.26 176.20 4hir n GLY 44 N 2.28 1.14 3.90 -1.50 0.00 -1.26 -4.80 105.19 104.95 4hir n GLY 44 Ca -0.16 -1.18 -0.26 0.00 0.00 0.00 0.00 46.02 44.42 4hir n GLY 44 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 4hir s THR 45 N -2.29 5.05 0.00 2.61 -1.32 -1.25 -4.88 115.64 113.56 4hir s THR 45 Ca 0.13 -0.81 0.00 0.00 -1.21 0.00 0.00 61.69 59.80 4hir s THR 45 Cb -0.04 -3.59 0.00 0.00 -1.51 0.00 0.00 72.50 67.36 4hir s THR 45 CO 0.08 -0.09 0.00 -2.65 -2.21 0.00 0.00 174.62 169.75 4hir n PRO 46 N -0.46 1.52 -3.71 7.08 -0.01 -1.26 -1.27 135.00 136.90 4hir n PRO 46 Ca -0.07 0.00 -0.36 0.00 -0.01 0.00 0.00 63.50 63.05 4hir n PRO 46 Cb 0.54 0.00 -0.09 0.00 -0.01 0.00 0.00 33.50 33.94 4hir n PRO 46 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 175.50 173.49 4hir s GLU 47 N 0.00 2.68 -0.10 -0.52 -6.30 -1.26 -3.94 118.70 109.26 4hir s GLU 47 Ca 0.00 -2.66 -0.29 0.00 -2.50 0.00 0.00 54.97 49.51 4hir s GLU 47 Cb 0.00 -3.77 -0.05 0.00 0.00 0.00 0.00 34.13 30.31 4hir s GLU 47 CO 0.00 -1.19 1.73 -1.25 0.02 0.00 0.00 175.26 174.57 4hir s PRO 48 N -0.29 4.00 0.00 4.30 0.04 -1.26 -5.07 135.00 136.71 4hir s PRO 48 Ca 0.19 2.10 0.00 0.00 0.04 0.00 0.00 61.00 63.32 4hir s PRO 48 Cb -0.18 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.31 4hir s PRO 48 CO -0.05 -1.07 0.29 1.04 0.04 0.00 0.00 177.00 177.25