#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5hir s VAL 2 N 0.00 -0.23 0.00 3.34 1.01 -1.26 -5.13 120.40 118.13 5hir s VAL 2 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.30 5hir s VAL 2 Cb 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 36.08 5hir s VAL 2 CO 0.00 0.12 0.00 -1.22 0.00 0.00 0.00 175.10 174.00 5hir n TYR 3 N 5.32 0.00 -4.04 5.22 4.02 -1.26 -5.12 117.16 121.30 5hir n TYR 3 Ca -0.04 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.71 5hir n TYR 3 Cb 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.79 5hir n TYR 3 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 5hir s THR 4 N 0.75 0.00 -0.07 -0.72 -4.23 -1.26 -5.03 115.64 105.08 5hir s THR 4 Ca 0.00 -1.48 -0.30 0.00 -1.18 0.00 0.00 61.69 58.73 5hir s THR 4 Cb 0.00 -2.68 -0.02 0.00 1.34 0.00 0.00 72.50 71.14 5hir s THR 4 CO 0.00 0.00 1.07 -1.81 -0.54 0.00 0.00 174.62 173.34 5hir s ASP 5 N -3.21 7.19 1.06 3.99 1.11 -1.26 -1.83 116.67 123.72 5hir s ASP 5 Ca 0.28 1.65 -0.20 0.00 0.18 0.00 0.00 52.55 54.46 5hir s ASP 5 Cb -0.01 -2.56 0.01 0.00 1.07 0.00 0.00 42.92 41.43 5hir s ASP 5 CO 0.19 -0.47 -0.34 0.00 1.18 0.00 0.00 175.17 175.72 5hir n THR 7 N -3.94 0.00 -3.66 0.00 5.66 -1.26 -5.02 114.28 106.06 5hir n THR 7 Ca 0.01 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.89 5hir n THR 7 Cb 0.63 0.33 -0.08 0.00 -1.55 0.00 0.00 70.33 69.67 5hir n THR 7 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 5hir s GLU 8 N 0.00 0.68 0.23 1.09 2.12 -1.26 -5.12 118.70 116.43 5hir s GLU 8 Ca 0.00 0.91 -0.30 0.00 0.36 0.00 0.00 54.97 55.94 5hir s GLU 8 Cb 0.00 0.27 -0.10 0.00 0.26 0.00 0.00 34.13 34.56 5hir s GLU 8 CO 0.00 -0.11 1.47 -1.12 -0.54 0.00 0.00 175.26 174.96 5hir s SER 9 N 0.70 6.63 0.00 -1.70 0.01 -1.26 -3.31 113.70 114.77 5hir s SER 9 Ca -0.03 2.66 0.00 0.00 1.31 0.00 0.00 55.95 59.89 5hir s SER 9 Cb -0.05 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.56 5hir s SER 9 CO -0.05 -0.73 0.00 0.61 0.41 0.00 0.00 173.24 173.48 5hir n GLY 10 N 2.49 0.90 2.70 3.44 0.00 0.20 -4.87 105.19 110.04 5hir n GLY 10 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 5hir n GLY 10 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 5hir n GLN 11 N -0.62 -0.69 0.19 1.61 6.02 -1.21 -0.91 117.38 121.77 5hir n GLN 11 Ca 0.00 -1.54 0.00 0.00 -0.01 0.00 0.00 57.00 55.45 5hir n GLN 11 Cb 0.00 -0.85 0.00 0.00 1.02 0.00 0.00 30.24 30.41 5hir n GLN 11 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 5hir n ASN 12 N -3.46 -2.09 -2.85 1.08 3.02 -1.17 -2.02 115.26 107.77 5hir n ASN 12 Ca 0.12 0.70 -0.28 0.00 -0.03 0.00 0.00 54.58 55.09 5hir n ASN 12 Cb 0.41 2.07 -0.07 0.00 -0.61 0.00 0.00 39.78 41.57 5hir n ASN 12 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 5hir n LEU 13 N -3.49 7.07 -4.21 3.41 4.77 -1.26 -2.78 117.00 120.51 5hir n LEU 13 Ca 0.00 -3.75 -0.14 0.00 -0.03 0.00 0.00 56.01 52.08 5hir n LEU 13 Cb 0.00 -1.43 -0.09 0.00 -2.33 0.00 0.00 43.42 39.56 5hir n LEU 13 CO 0.00 1.76 -0.17 0.00 -1.33 0.00 0.00 177.39 177.65 5hir s LEU 15 N -3.22 3.44 0.00 0.00 1.43 -0.76 -3.36 118.68 116.21 5hir s LEU 15 Ca 0.39 -1.80 0.00 0.00 -1.03 0.00 0.00 54.13 51.69 5hir s LEU 15 Cb 0.05 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.69 5hir s LEU 15 CO 0.17 -2.05 0.01 0.00 0.23 0.00 0.00 176.35 174.70 5hir s GLU 17 N -0.01 3.17 7.74 0.00 0.41 -1.21 -4.77 118.70 124.02 5hir s GLU 17 Ca 0.00 0.34 0.00 0.00 -0.41 0.00 0.00 54.97 54.90 5hir s GLU 17 Cb 0.00 -4.18 0.00 0.00 -1.78 0.00 0.00 34.13 28.17 5hir s GLU 17 CO 0.00 -2.11 0.00 0.41 -0.49 0.00 0.00 175.26 173.07 5hir n GLY 18 N 5.36 3.26 1.06 -1.39 0.00 -1.26 -1.49 105.19 110.73 5hir n GLY 18 Ca 0.12 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.10 5hir n GLY 18 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 5hir n SER 19 N 5.85 3.29 -4.85 1.61 2.88 -1.26 -4.85 113.62 116.29 5hir n SER 19 Ca 0.00 -1.96 -0.34 0.00 -1.33 0.00 0.00 58.87 55.24 5hir n SER 19 Cb 0.00 -0.21 -0.06 0.00 -0.75 0.00 0.00 64.21 63.20 5hir n SER 19 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 5hir s ASN 20 N -1.47 6.79 0.26 -3.46 0.01 -0.55 -4.87 114.94 111.65 5hir s ASN 20 Ca 0.35 1.13 -0.05 0.00 -0.71 0.00 0.00 52.86 53.57 5hir s ASN 20 Cb 0.21 -2.31 -0.06 0.00 0.41 0.00 0.00 41.25 39.51 5hir s ASN 20 CO 0.29 -0.02 0.52 -0.69 -1.51 0.00 0.00 177.10 175.69 5hir s VAL 21 N -1.69 5.03 0.00 1.60 1.01 -1.26 -2.39 120.40 122.71 5hir s VAL 21 Ca 0.45 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.53 5hir s VAL 21 Cb -0.13 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.55 5hir s VAL 21 CO 0.20 -0.23 0.00 0.00 0.00 0.00 0.00 175.10 175.07 5hir s GLY 23 N 0.00 -0.22 0.19 0.00 0.00 -1.26 -4.84 107.32 101.19 5hir s GLY 23 Ca 0.00 1.19 -0.30 0.00 0.00 0.00 0.00 44.72 45.61 5hir s GLY 23 CO 0.00 1.84 0.74 -0.18 0.00 0.00 0.00 173.10 175.50 5hir n GLN 24 N 4.88 0.34 0.00 2.90 7.27 -1.26 -1.93 117.38 129.57 5hir n GLN 24 Ca -0.15 0.12 0.00 0.00 0.07 0.00 0.00 57.00 57.04 5hir n GLN 24 Cb 0.52 -1.30 0.00 0.00 2.41 0.00 0.00 30.24 31.87 5hir n GLN 24 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 5hir n GLY 25 N 1.81 0.75 0.00 1.69 0.00 -1.26 -5.07 105.19 103.10 5hir n GLY 25 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 5hir n GLY 25 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 5hir n ASN 26 N 0.00 0.28 -3.15 1.61 4.13 -0.81 -3.54 115.26 113.77 5hir n ASN 26 Ca 0.00 0.00 0.04 0.00 1.68 0.00 0.00 54.58 56.30 5hir n ASN 26 Cb 0.00 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.23 5hir n ASN 26 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 5hir s LYS 27 N 2.81 0.56 0.35 3.52 2.20 0.27 0.15 119.74 129.59 5hir s LYS 27 Ca 0.00 0.78 -0.19 0.00 -0.36 0.00 0.00 55.97 56.20 5hir s LYS 27 Cb 0.00 0.40 -0.10 0.00 -1.51 0.00 0.00 37.83 36.62 5hir s LYS 27 CO 0.00 -0.83 0.82 0.00 -0.36 0.00 0.00 175.35 174.98 5hir s ILE 29 N -1.96 1.60 0.00 0.00 -1.09 -1.18 0.60 121.20 119.17 5hir s ILE 29 Ca 0.55 -1.78 0.00 0.00 -2.23 0.00 0.00 60.65 57.19 5hir s ILE 29 Cb -0.11 -2.13 0.00 0.00 -1.58 0.00 0.00 42.46 38.63 5hir s ILE 29 CO 0.17 -0.54 0.00 0.18 -1.23 0.00 0.00 174.94 173.52 5hir n LEU 30 N 4.56 0.00 0.00 2.97 4.77 -1.26 -3.86 117.00 124.18 5hir n LEU 30 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 5hir n LEU 30 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 5hir n LEU 30 CO 0.17 -0.59 0.00 0.61 -1.33 0.00 0.00 177.39 176.25 5hir n GLY 31 N 4.09 0.00 2.71 -0.72 0.00 -1.19 -4.79 105.19 105.28 5hir n GLY 31 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 5hir n GLY 31 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 5hir n SER 32 N 0.03 -2.01 -3.14 1.61 7.64 -0.70 -4.96 113.62 112.09 5hir n SER 32 Ca 0.00 -2.87 -0.06 0.00 1.01 0.00 0.00 58.87 56.95 5hir n SER 32 Cb 0.00 1.38 0.00 0.00 -1.01 0.00 0.00 64.21 64.58 5hir n SER 32 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 5hir n ASP 33 N -0.19 -7.35 0.00 6.43 9.92 -1.26 -3.13 116.55 120.97 5hir n ASP 33 Ca -0.01 -0.09 0.00 0.00 -0.53 0.00 0.00 54.79 54.16 5hir n ASP 33 Cb 0.78 -4.70 0.00 0.00 -0.64 0.00 0.00 41.12 36.56 5hir n ASP 33 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 5hir n GLY 34 N -1.43 2.82 3.51 0.44 0.00 -1.26 -4.96 105.19 104.30 5hir n GLY 34 Ca -0.03 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 5hir n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 5hir s GLU 35 N 0.00 3.52 0.17 1.61 0.41 -1.18 -4.79 118.70 118.43 5hir s GLU 35 Ca 0.00 -1.28 0.11 0.00 -0.41 0.00 0.00 54.97 53.39 5hir s GLU 35 Cb 0.00 -4.99 -0.10 0.00 -1.78 0.00 0.00 34.13 27.26 5hir s GLU 35 CO 0.00 -2.00 1.30 0.87 -0.49 0.00 0.00 175.26 174.94 5hir h LYS 36 N 9.41 0.00 -2.26 1.61 1.57 -1.86 -1.85 116.57 123.20 5hir h LYS 36 Ca 0.10 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 5hir h LYS 36 Cb 1.02 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.13 5hir h LYS 36 CO 1.27 0.75 0.04 -0.80 -0.57 0.00 0.00 179.45 180.13 5hir s ASN 37 N -6.54 -0.59 -0.30 0.86 -0.87 -1.26 -3.73 114.94 102.51 5hir s ASN 37 Ca 0.02 0.90 -0.00 0.00 -1.57 0.00 0.00 52.86 52.20 5hir s ASN 37 Cb 0.09 0.87 0.19 0.00 -0.02 0.00 0.00 41.25 42.38 5hir s ASN 37 CO 0.79 -0.39 0.65 -1.58 -2.57 0.00 0.00 177.10 174.00 5hir s GLN 38 N -0.46 0.52 -1.21 -0.60 0.74 -1.25 -4.93 119.66 112.47 5hir s GLN 38 Ca -0.06 0.78 -0.20 0.00 0.05 0.00 0.00 55.36 55.93 5hir s GLN 38 Cb -0.03 0.42 0.04 0.00 1.10 0.00 0.00 33.01 34.53 5hir s GLN 38 CO 0.05 -0.71 1.72 0.00 -0.55 0.00 0.00 175.29 175.80 5hir s VAL 40 N 5.68 4.61 1.01 0.00 0.11 -1.11 -4.90 120.40 125.80 5hir s VAL 40 Ca 0.55 -0.74 -0.14 0.00 -2.93 0.00 0.00 61.98 58.72 5hir s VAL 40 Cb 0.02 -3.65 0.20 0.00 -1.53 0.00 0.00 36.38 31.42 5hir s VAL 40 CO 0.05 -0.34 1.14 0.28 -3.33 0.00 0.00 175.10 172.89 5hir s THR 41 N -2.25 1.90 -1.28 5.04 -1.32 -1.26 0.94 115.64 117.41 5hir s THR 41 Ca 0.42 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.90 5hir s THR 41 Cb -0.10 -2.64 0.00 0.00 -1.51 0.00 0.00 72.50 68.25 5hir s THR 41 CO 0.33 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.35 5hir n GLY 42 N -1.76 0.41 2.81 6.08 0.00 -1.23 -3.95 105.19 107.55 5hir n GLY 42 Ca 0.09 -1.61 -0.29 0.00 0.00 0.00 0.00 46.02 44.21 5hir n GLY 42 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 5hir s GLU 43 N -1.27 1.01 0.00 1.61 2.12 -1.13 -3.67 118.70 117.37 5hir s GLU 43 Ca 0.00 -0.87 0.00 0.00 0.36 0.00 0.00 54.97 54.46 5hir s GLU 43 Cb 0.00 -2.27 0.00 0.00 0.26 0.00 0.00 34.13 32.12 5hir s GLU 43 CO 0.00 -0.75 0.00 0.41 -0.54 0.00 0.00 175.26 174.38 5hir n GLY 44 N 4.83 1.24 2.92 -1.50 0.00 0.39 -4.81 105.19 108.27 5hir n GLY 44 Ca -0.07 -1.98 -0.15 0.00 0.00 0.00 0.00 46.02 43.81 5hir n GLY 44 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 5hir s THR 45 N 1.01 0.30 -0.48 2.61 -1.32 -0.09 -4.90 115.64 112.78 5hir s THR 45 Ca 0.00 -0.14 -0.26 0.00 -1.21 0.00 0.00 61.69 60.07 5hir s THR 45 Cb 0.00 -0.27 -0.06 0.00 -1.51 0.00 0.00 72.50 70.66 5hir s THR 45 CO 0.00 0.10 2.26 -2.16 -2.21 0.00 0.00 174.62 172.61 5hir s PRO 46 N 0.04 2.36 -0.55 7.08 0.04 -1.26 -3.04 135.00 139.67 5hir s PRO 46 Ca 0.00 1.32 -0.38 0.00 0.04 0.00 0.00 61.00 61.98 5hir s PRO 46 Cb -0.03 -4.51 -0.17 0.00 0.04 0.00 0.00 34.50 29.83 5hir s PRO 46 CO -0.00 -3.00 2.28 1.17 0.04 0.00 0.00 177.00 177.49 5hir n LYS 47 N 9.00 0.37 -0.43 4.56 4.81 -1.26 -4.86 118.16 130.33 5hir n LYS 47 Ca 0.32 0.08 -0.29 0.00 -0.87 0.00 0.00 58.31 57.56 5hir n LYS 47 Cb 0.53 -1.88 0.27 0.00 0.02 0.00 0.00 35.03 33.97 5hir n LYS 47 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 5hir n PRO 48 N 7.97 -2.99 0.00 1.64 -0.02 -1.26 -4.97 135.00 135.37 5hir n PRO 48 Ca 0.52 -0.85 0.13 0.00 -2.02 0.00 0.00 63.50 61.28 5hir n PRO 48 Cb 0.08 -2.09 0.78 0.00 -0.02 0.00 0.00 33.50 32.26 5hir n PRO 48 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52