#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 3.32 0.00 3.34 1.01 -1.26 -5.12 120.40 121.69 4hir s VAL 2 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 60.81 4hir s VAL 2 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.23 4hir s VAL 2 CO 0.00 -0.08 0.00 -1.22 0.00 0.00 0.00 175.10 173.80 4hir n TYR 3 N -1.61 0.00 -3.25 5.22 4.02 -1.26 -5.15 117.16 115.13 4hir n TYR 3 Ca 0.02 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.70 4hir n TYR 3 Cb 0.60 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.96 4hir n TYR 3 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 4hir s THR 4 N -0.74 1.96 0.38 -0.72 -4.23 -1.26 -4.90 115.64 106.13 4hir s THR 4 Ca 0.00 -1.12 -0.14 0.00 -1.18 0.00 0.00 61.69 59.25 4hir s THR 4 Cb 0.00 -2.08 -0.08 0.00 1.34 0.00 0.00 72.50 71.68 4hir s THR 4 CO 0.00 0.00 0.79 -1.81 -0.54 0.00 0.00 174.62 173.06 4hir s ASP 5 N -4.59 6.67 1.10 3.99 1.01 -1.26 -2.12 116.67 121.46 4hir s ASP 5 Ca 0.55 1.28 -0.14 0.00 0.71 0.00 0.00 52.55 54.95 4hir s ASP 5 Cb -0.05 -2.38 0.20 0.00 1.01 0.00 0.00 42.92 41.71 4hir s ASP 5 CO 0.35 -0.34 0.93 0.00 0.21 0.00 0.00 175.17 176.32 4hir n THR 7 N -3.87 0.00 -3.45 0.00 5.66 -1.26 -4.96 114.28 106.41 4hir n THR 7 Ca 0.12 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.99 4hir n THR 7 Cb 0.45 0.39 -0.03 0.00 -1.55 0.00 0.00 70.33 69.58 4hir n THR 7 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 4hir s GLU 8 N 0.00 1.21 0.21 1.09 0.41 -1.26 -5.08 118.70 115.27 4hir s GLU 8 Ca 0.00 -0.32 -0.30 0.00 -0.41 0.00 0.00 54.97 53.94 4hir s GLU 8 Cb 0.00 0.56 -0.08 0.00 -1.78 0.00 0.00 34.13 32.83 4hir s GLU 8 CO 0.00 -0.50 0.97 -1.12 -0.49 0.00 0.00 175.26 174.11 4hir s SER 9 N -2.42 7.56 0.00 -0.19 0.01 -1.26 -4.12 113.70 113.28 4hir s SER 9 Ca -0.01 1.94 0.00 0.00 1.31 0.00 0.00 55.95 59.19 4hir s SER 9 Cb -0.01 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 4hir s SER 9 CO -0.08 0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.24 4hir n GLY 10 N 1.68 2.59 0.00 3.44 0.00 -0.00 -4.85 105.19 108.05 4hir n GLY 10 Ca -0.01 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 0.00 -0.35 0.05 1.61 6.02 -1.26 -4.00 117.38 119.45 4hir n GLN 11 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 4hir n GLN 11 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 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 -1.57 -0.16 -2.30 1.08 4.13 -0.42 -3.82 115.26 112.21 4hir n ASN 12 Ca 0.00 0.17 -0.14 0.00 1.68 0.00 0.00 54.58 56.29 4hir n ASN 12 Cb 0.00 0.24 -0.12 0.00 -1.54 0.00 0.00 39.78 38.36 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 -2.82 4.86 0.00 3.41 4.77 -1.26 -3.21 117.00 122.75 4hir n LEU 13 Ca 0.00 -2.91 0.00 0.00 -0.03 0.00 0.00 56.01 53.07 4hir n LEU 13 Cb 0.00 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 39.88 4hir n LEU 13 CO 0.00 1.35 0.00 0.00 -1.33 0.00 0.00 177.39 177.41 4hir s LEU 15 N 0.00 2.76 0.00 0.00 1.43 -0.90 -2.76 118.68 119.22 4hir s LEU 15 Ca 0.00 -0.83 0.04 0.00 -1.03 0.00 0.00 54.13 52.31 4hir s LEU 15 Cb 0.00 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 4hir s LEU 15 CO 0.00 -0.08 0.29 0.00 0.23 0.00 0.00 176.35 176.79 4hir n GLU 17 N -0.70 1.54 0.00 0.00 4.07 -1.20 -4.20 120.64 120.16 4hir n GLU 17 Ca 0.01 -4.09 0.00 0.00 -0.06 0.00 0.00 57.16 53.02 4hir n GLU 17 Cb 0.07 -1.99 0.00 0.00 -0.06 0.00 0.00 31.44 29.46 4hir n GLU 17 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 4hir n GLY 18 N 1.71 1.53 0.00 8.31 0.00 -1.26 -1.87 105.19 113.60 4hir n GLY 18 Ca 0.25 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.61 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 3.50 0.25 -4.78 1.61 2.88 -1.26 -4.99 113.62 110.82 4hir n SER 19 Ca 0.00 -1.02 -0.39 0.00 -1.33 0.00 0.00 58.87 56.13 4hir n SER 19 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 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 -0.02 7.33 0.38 -3.46 0.01 -0.78 -4.95 114.94 113.44 4hir s ASN 20 Ca 0.00 1.57 -0.25 0.00 -0.71 0.00 0.00 52.86 53.47 4hir s ASN 20 Cb 0.00 -2.47 -0.09 0.00 0.41 0.00 0.00 41.25 39.10 4hir s ASN 20 CO 0.00 0.22 1.09 -0.69 -1.51 0.00 0.00 177.10 176.21 4hir s VAL 21 N -1.14 3.53 -0.17 1.60 1.01 -1.26 -2.44 120.40 121.53 4hir s VAL 21 Ca 0.34 1.25 -0.06 0.00 0.00 0.00 0.00 61.98 63.52 4hir s VAL 21 Cb -0.22 -3.69 0.08 0.00 0.00 0.00 0.00 36.38 32.55 4hir s VAL 21 CO 0.25 0.09 0.35 0.00 0.00 0.00 0.00 175.10 175.79 4hir n GLY 23 N 5.37 -2.02 3.50 0.00 0.00 -1.20 -4.25 105.19 106.60 4hir n GLY 23 Ca -0.07 0.70 -0.53 0.00 0.00 0.00 0.00 46.02 46.11 4hir n GLY 23 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 4hir n GLN 24 N 0.00 0.34 0.00 1.61 7.27 -1.26 0.19 117.38 125.52 4hir n GLN 24 Ca 0.00 0.12 0.00 0.00 0.07 0.00 0.00 57.00 57.19 4hir n GLN 24 Cb 0.00 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.15 4hir n GLN 24 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 4hir n GLY 25 N 1.81 2.19 0.00 1.69 0.00 -1.26 -4.85 105.19 104.76 4hir n GLY 25 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 4hir n GLY 25 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 4hir n ASN 26 N 0.63 1.11 -3.65 1.61 5.03 0.49 -4.55 115.26 115.93 4hir n ASN 26 Ca 0.00 0.00 -0.15 0.00 0.87 0.00 0.00 54.58 55.30 4hir n ASN 26 Cb 0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 39.78 38.69 4hir n ASN 26 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 4hir s LYS 27 N 1.01 1.60 0.08 3.52 2.20 0.73 -4.23 119.74 124.64 4hir s LYS 27 Ca 0.00 -1.77 -0.00 0.00 -0.36 0.00 0.00 55.97 53.84 4hir s LYS 27 Cb 0.00 0.35 -0.04 0.00 -1.51 0.00 0.00 37.83 36.63 4hir s LYS 27 CO 0.00 -0.60 -0.03 0.00 -0.36 0.00 0.00 175.35 174.36 4hir s ILE 29 N -3.83 -0.06 0.01 0.00 -1.09 0.62 -0.82 121.20 116.03 4hir s ILE 29 Ca 0.11 -0.94 -0.30 0.00 -2.23 0.00 0.00 60.65 57.29 4hir s ILE 29 Cb 0.07 -1.00 -0.03 0.00 -1.58 0.00 0.00 42.46 39.92 4hir s ILE 29 CO -0.07 -0.76 1.00 -1.48 -1.23 0.00 0.00 174.94 172.40 4hir s LEU 30 N 1.90 4.38 0.00 2.97 0.05 -1.26 -1.24 118.68 125.47 4hir s LEU 30 Ca 0.11 1.71 0.00 0.00 0.05 0.00 0.00 54.13 56.00 4hir s LEU 30 Cb -0.17 -3.57 0.00 0.00 -2.05 0.00 0.00 46.19 40.40 4hir s LEU 30 CO -0.28 -0.28 0.05 0.61 -0.55 0.00 0.00 176.35 175.91 4hir n GLY 31 N 2.91 -1.58 0.00 -3.48 0.00 0.64 -4.46 105.19 99.22 4hir n GLY 31 Ca 0.06 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.08 0.00 -3.77 1.61 2.88 -1.22 -4.86 113.62 108.17 4hir n SER 32 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 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 0.47 -1.23 0.00 0.00 175.04 174.28 4hir n ASP 33 N 0.00 3.20 -0.89 -3.46 8.00 -1.26 -3.01 116.55 119.14 4hir n ASP 33 Ca 0.00 -2.76 -0.10 0.00 0.71 0.00 0.00 54.79 52.64 4hir n ASP 33 Cb 0.00 -1.39 -0.03 0.00 -0.02 0.00 0.00 41.12 39.67 4hir n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 4hir n GLY 34 N 4.48 0.86 0.00 0.44 0.00 -1.26 -4.95 105.19 104.76 4hir n GLY 34 Ca 0.50 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.52 0.00 -1.13 1.61 1.02 -1.16 -5.04 120.64 113.41 4hir n GLU 35 Ca -0.11 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.75 4hir n GLU 35 Cb 0.40 0.00 0.18 0.00 -0.02 0.00 0.00 31.44 32.00 4hir n GLU 35 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 4hir s LYS 36 N 1.84 0.33 -0.30 3.49 1.02 -1.26 -4.74 119.74 120.12 4hir s LYS 36 Ca 0.00 0.53 -0.21 0.00 0.02 0.00 0.00 55.97 56.30 4hir s LYS 36 Cb 0.00 -1.72 0.20 0.00 -0.52 0.00 0.00 37.83 35.78 4hir s LYS 36 CO 0.00 -2.80 1.36 1.21 -0.92 0.00 0.00 175.35 174.19 4hir s ASN 37 N -3.41 -0.07 0.02 2.83 3.04 -1.26 0.24 114.94 116.32 4hir s ASN 37 Ca 0.66 0.13 0.04 0.00 0.04 0.00 0.00 52.86 53.73 4hir s ASN 37 Cb -0.19 0.48 -0.01 0.00 -1.54 0.00 0.00 41.25 39.99 4hir s ASN 37 CO 0.58 -0.02 -0.11 -1.58 -3.04 0.00 0.00 177.10 172.92 4hir s GLN 38 N 0.43 0.82 -0.57 0.43 0.74 -0.38 -4.83 119.66 116.31 4hir s GLN 38 Ca 0.01 -0.55 -0.17 0.00 0.05 0.00 0.00 55.36 54.70 4hir s GLN 38 Cb -0.04 -0.79 0.12 0.00 1.10 0.00 0.00 33.01 33.41 4hir s GLN 38 CO -0.13 0.20 0.59 0.00 -0.55 0.00 0.00 175.29 175.40 4hir s VAL 40 N 1.99 3.42 0.45 0.00 0.11 0.72 -4.88 120.40 122.20 4hir s VAL 40 Ca 0.07 -1.60 -0.22 0.00 -2.93 0.00 0.00 61.98 57.30 4hir s VAL 40 Cb -0.27 -2.72 -0.09 0.00 -1.53 0.00 0.00 36.38 31.77 4hir s VAL 40 CO 0.04 -0.14 1.05 0.28 -3.33 0.00 0.00 175.10 172.99 4hir s THR 41 N -1.78 3.75 -5.00 5.04 -1.32 -1.26 0.26 115.64 115.32 4hir s THR 41 Ca 0.27 1.20 0.00 0.00 -1.21 0.00 0.00 61.69 61.95 4hir s THR 41 Cb -0.09 -3.55 0.00 0.00 -1.51 0.00 0.00 72.50 67.35 4hir s THR 41 CO 0.17 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 173.07 4hir n GLY 42 N 0.03 -2.68 3.53 6.08 0.00 -1.26 -4.51 105.19 106.38 4hir n GLY 42 Ca 0.07 -1.37 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 4hir n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4hir s GLU 43 N -1.94 3.37 0.26 1.61 2.02 -1.26 -3.91 118.70 118.85 4hir s GLU 43 Ca 0.00 -0.24 0.05 0.00 0.02 0.00 0.00 54.97 54.79 4hir s GLU 43 Cb 0.00 -3.93 -0.06 0.00 0.10 0.00 0.00 34.13 30.25 4hir s GLU 43 CO 0.00 -1.00 -0.02 0.20 0.02 0.00 0.00 175.26 174.46 4hir s GLY 44 N 2.01 1.72 -0.01 -1.39 0.00 -1.26 -5.04 107.32 103.34 4hir s GLY 44 Ca 0.25 -1.85 -0.00 0.00 0.00 0.00 0.00 44.72 43.11 4hir s GLY 44 CO 0.19 -1.75 0.08 -1.08 0.00 0.00 0.00 173.10 170.54 4hir s THR 45 N -3.25 4.71 0.43 0.90 -1.32 -1.26 -4.86 115.64 110.99 4hir s THR 45 Ca 0.30 -0.40 -0.25 0.00 -1.21 0.00 0.00 61.69 60.12 4hir s THR 45 Cb 0.05 -3.14 -0.10 0.00 -1.51 0.00 0.00 72.50 67.80 4hir s THR 45 CO 0.11 0.36 1.25 -2.65 -2.21 0.00 0.00 174.62 171.47 4hir n PRO 46 N 1.23 1.85 -0.14 7.08 -0.01 -1.26 -1.29 135.00 142.45 4hir n PRO 46 Ca -0.13 0.66 -0.09 0.00 -0.01 0.00 0.00 63.50 63.92 4hir n PRO 46 Cb 0.53 -2.36 -0.01 0.00 -0.01 0.00 0.00 33.50 31.65 4hir n PRO 46 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 175.50 176.98 4hir h GLU 47 N 1.98 0.64 -5.55 -0.52 4.81 -1.88 -3.41 114.58 110.65 4hir h GLU 47 Ca -0.48 -0.14 -0.46 0.00 -0.13 0.00 0.00 59.36 58.16 4hir h GLU 47 Cb 1.30 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.59 4hir h GLU 47 CO 0.59 0.64 1.62 -2.30 -0.73 0.00 0.00 179.01 178.84 4hir n PRO 48 N -4.58 0.93 0.00 0.92 -0.02 -1.26 -5.05 135.00 125.95 4hir n PRO 48 Ca -0.00 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 4hir n PRO 48 Cb 0.19 -3.28 0.00 0.00 -0.02 0.00 0.00 33.50 30.39 4hir n PRO 48 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48