#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4hir n VAL 2 N 0.00 0.00 -4.17 3.34 0.31 -1.26 -5.11 118.33 111.45 4hir n VAL 2 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.17 4hir n VAL 2 Cb 0.00 -1.94 -0.05 0.00 -0.91 0.00 0.00 33.84 30.93 4hir n VAL 2 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 4hir n TYR 3 N -0.56 -0.96 -3.89 3.52 4.01 -1.26 -5.10 117.16 112.92 4hir n TYR 3 Ca 0.00 -2.39 -0.26 0.00 -0.16 0.00 0.00 57.90 55.09 4hir n TYR 3 Cb 0.00 0.35 0.00 0.00 -0.31 0.00 0.00 39.34 39.38 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 -0.55 0.00 -3.17 -0.72 -2.24 -1.26 -4.98 114.28 101.36 4hir n THR 4 Ca 0.05 -2.16 -0.31 0.00 -2.27 0.00 0.00 64.05 59.36 4hir n THR 4 Cb 0.54 -0.02 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 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 -4.18 6.63 1.17 3.42 1.11 -1.26 -2.40 116.67 121.16 4hir s ASP 5 Ca 0.30 1.07 -0.16 0.00 0.18 0.00 0.00 52.55 53.94 4hir s ASP 5 Cb -0.02 -2.29 0.24 0.00 1.07 0.00 0.00 42.92 41.92 4hir s ASP 5 CO 0.19 -0.22 0.94 0.00 1.18 0.00 0.00 175.17 177.27 4hir n THR 7 N -4.28 0.00 -3.76 0.00 5.66 -1.26 -4.94 114.28 105.70 4hir n THR 7 Ca 0.13 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.08 4hir n THR 7 Cb 0.49 0.08 -0.01 0.00 -1.55 0.00 0.00 70.33 69.33 4hir n THR 7 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 4hir s GLU 8 N 0.00 1.28 0.14 1.09 1.03 -1.26 -5.14 118.70 115.84 4hir s GLU 8 Ca 0.00 -0.70 -0.25 0.00 0.03 0.00 0.00 54.97 54.05 4hir s GLU 8 Cb 0.00 0.44 -0.07 0.00 -0.80 0.00 0.00 34.13 33.70 4hir s GLU 8 CO 0.00 -0.59 0.78 -1.12 -1.33 0.00 0.00 175.26 173.00 4hir s SER 9 N -2.92 7.35 0.00 0.83 0.01 -1.26 -4.30 113.70 113.41 4hir s SER 9 Ca 0.12 1.60 0.00 0.00 1.31 0.00 0.00 55.95 58.98 4hir s SER 9 Cb -0.02 -2.49 0.00 0.00 0.21 0.00 0.00 66.02 63.71 4hir s SER 9 CO 0.02 0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.44 4hir n GLY 10 N 1.80 2.77 0.01 3.44 0.00 -0.39 -4.85 105.19 107.96 4hir n GLY 10 Ca -0.05 -0.48 -0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.96 0.05 1.61 6.02 -1.26 -3.65 117.38 119.18 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 -0.01 0.00 0.00 1.02 0.00 0.00 30.24 31.25 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 -2.22 -0.18 -2.56 1.08 4.13 0.29 -3.36 115.26 112.44 4hir n ASN 12 Ca 0.00 0.17 -0.18 0.00 1.68 0.00 0.00 54.58 56.25 4hir n ASN 12 Cb 0.00 0.27 -0.09 0.00 -1.54 0.00 0.00 39.78 38.42 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 -2.81 5.20 0.00 3.41 4.77 -1.26 -3.02 117.00 123.30 4hir n LEU 13 Ca 0.00 -3.01 0.00 0.00 -0.03 0.00 0.00 56.01 52.97 4hir n LEU 13 Cb 0.00 -1.20 0.00 0.00 -2.33 0.00 0.00 43.42 39.89 4hir n LEU 13 CO 0.00 1.28 0.00 0.00 -1.33 0.00 0.00 177.39 177.34 4hir s LEU 15 N 0.00 2.30 -0.01 0.00 1.43 -1.01 -2.42 118.68 118.96 4hir s LEU 15 Ca 0.00 -0.52 -0.04 0.00 -1.03 0.00 0.00 54.13 52.54 4hir s LEU 15 Cb 0.00 -1.50 -0.01 0.00 0.03 0.00 0.00 46.19 44.71 4hir s LEU 15 CO 0.00 0.11 -0.09 0.00 0.23 0.00 0.00 176.35 176.60 4hir s GLU 17 N -1.78 3.48 5.08 0.00 8.01 -1.26 -4.86 118.70 127.38 4hir s GLU 17 Ca -0.07 -1.60 0.00 0.00 0.01 0.00 0.00 54.97 53.30 4hir s GLU 17 Cb 0.01 -4.74 0.00 0.00 -4.31 0.00 0.00 34.13 25.09 4hir s GLU 17 CO 0.11 -1.75 0.00 0.41 0.01 0.00 0.00 175.26 174.04 4hir n GLY 18 N 5.40 1.59 0.00 -1.39 0.00 -1.26 -2.36 105.19 107.17 4hir n GLY 18 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 9.05 1.18 -4.75 1.61 2.88 -1.26 -4.96 113.62 117.37 4hir n SER 19 Ca 0.00 -1.30 -0.40 0.00 -1.33 0.00 0.00 58.87 55.84 4hir n SER 19 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 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 -0.30 7.42 0.34 -3.46 0.01 -1.00 -4.94 114.94 113.02 4hir s ASN 20 Ca 0.00 2.05 -0.22 0.00 -0.71 0.00 0.00 52.86 53.98 4hir s ASN 20 Cb 0.00 -2.61 -0.10 0.00 0.41 0.00 0.00 41.25 38.95 4hir s ASN 20 CO 0.00 -0.06 0.88 -0.69 -1.51 0.00 0.00 177.10 175.72 4hir s VAL 21 N -0.75 4.38 -0.16 1.60 1.01 -1.26 -2.48 120.40 122.74 4hir s VAL 21 Ca 0.45 1.52 -0.04 0.00 0.00 0.00 0.00 61.98 63.91 4hir s VAL 21 Cb -0.28 -3.81 0.07 0.00 0.00 0.00 0.00 36.38 32.36 4hir s VAL 21 CO 0.35 -0.03 0.20 0.00 0.00 0.00 0.00 175.10 175.62 4hir n GLY 23 N 5.32 -2.39 3.53 0.00 0.00 -1.17 -4.23 105.19 106.25 4hir n GLY 23 Ca -0.05 0.83 -0.57 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.11 0.30 0.00 1.61 7.27 -1.26 0.22 117.38 125.41 4hir n GLN 24 Ca 0.00 0.11 0.00 0.00 0.07 0.00 0.00 57.00 57.18 4hir n GLN 24 Cb 0.00 -1.65 0.00 0.00 2.41 0.00 0.00 30.24 31.00 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 1.82 2.52 0.00 1.69 0.00 -1.26 -4.90 105.19 105.07 4hir n GLY 25 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 4hir n GLY 25 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 4hir n ASN 26 N 0.94 1.76 -3.68 1.61 0.23 0.60 -4.23 115.26 112.50 4hir n ASN 26 Ca 0.00 -0.69 -0.09 0.00 -0.53 0.00 0.00 54.58 53.27 4hir n ASN 26 Cb 0.00 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 37.60 4hir n ASN 26 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 4hir s LYS 27 N -1.06 0.42 0.66 -3.83 2.20 0.24 -3.82 119.74 114.55 4hir s LYS 27 Ca 0.00 0.94 -0.06 0.00 -0.36 0.00 0.00 55.97 56.49 4hir s LYS 27 Cb 0.00 0.12 0.04 0.00 -1.51 0.00 0.00 37.83 36.48 4hir s LYS 27 CO 0.00 -0.18 0.96 0.00 -0.36 0.00 0.00 175.35 175.77 4hir s ILE 29 N -3.13 -0.03 -0.51 0.00 -1.09 -0.76 -1.27 121.20 114.40 4hir s ILE 29 Ca 0.58 0.12 -0.28 0.00 -2.23 0.00 0.00 60.65 58.84 4hir s ILE 29 Cb -0.11 -0.36 0.01 0.00 -1.58 0.00 0.00 42.46 40.42 4hir s ILE 29 CO 0.44 0.05 1.46 -0.76 -1.23 0.00 0.00 174.94 174.91 4hir s LEU 30 N 1.04 3.45 0.00 2.97 1.43 -1.26 0.29 118.68 126.60 4hir s LEU 30 Ca -0.08 0.49 0.00 0.00 -1.03 0.00 0.00 54.13 53.51 4hir s LEU 30 Cb -0.09 -3.17 0.00 0.00 0.03 0.00 0.00 46.19 42.96 4hir s LEU 30 CO -0.07 -1.68 0.00 0.61 0.23 0.00 0.00 176.35 175.44 4hir n GLY 31 N 5.25 1.25 0.00 -3.19 0.00 1.10 -4.76 105.19 104.84 4hir n GLY 31 Ca 0.15 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.49 4hir n GLY 31 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 4hir n SER 32 N 0.00 0.00 -3.57 1.61 3.41 -1.20 -4.34 113.62 109.53 4hir n SER 32 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 4hir n SER 32 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 4hir n SER 32 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 4hir n ASP 33 N 0.00 2.43 -2.90 4.04 8.00 -1.26 -3.07 116.55 123.78 4hir n ASP 33 Ca 0.00 -2.62 -0.22 0.00 0.71 0.00 0.00 54.79 52.66 4hir n ASP 33 Cb 0.00 -1.02 0.02 0.00 -0.02 0.00 0.00 41.12 40.10 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 4.53 -0.52 0.00 0.44 0.00 -1.26 -4.93 105.19 103.46 4hir n GLY 34 Ca 0.48 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.60 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 -3.76 0.00 0.00 1.61 1.02 -1.18 -5.09 120.64 113.25 4hir n GLU 35 Ca -0.13 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 4hir n GLU 35 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.05 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 0.00 -4.46 3.49 5.02 -1.26 -4.42 118.16 116.53 4hir n LYS 36 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 4hir n LYS 36 Cb 0.00 -0.06 -0.10 0.00 -0.02 0.00 0.00 35.03 34.85 4hir n LYS 36 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 4hir s ASN 37 N -1.00 3.50 0.12 4.39 0.01 -1.26 0.35 114.94 121.04 4hir s ASN 37 Ca 0.00 -1.02 -0.14 0.00 -0.71 0.00 0.00 52.86 50.99 4hir s ASN 37 Cb 0.00 -0.28 0.03 0.00 0.41 0.00 0.00 41.25 41.40 4hir s ASN 37 CO 0.00 0.03 0.35 -1.58 -1.51 0.00 0.00 177.10 174.38 4hir s GLN 38 N -3.48 1.01 -0.37 -0.60 0.74 0.14 -3.22 119.66 113.88 4hir s GLN 38 Ca 0.29 -0.77 0.01 0.00 0.05 0.00 0.00 55.36 54.94 4hir s GLN 38 Cb -0.05 0.44 0.12 0.00 1.10 0.00 0.00 33.01 34.62 4hir s GLN 38 CO 0.14 -0.38 0.17 0.00 -0.55 0.00 0.00 175.29 174.68 4hir s VAL 40 N 0.98 2.14 0.48 0.00 0.11 -0.69 -4.96 120.40 118.46 4hir s VAL 40 Ca 0.14 -1.50 -0.11 0.00 -2.93 0.00 0.00 61.98 57.58 4hir s VAL 40 Cb -0.21 -2.64 -0.06 0.00 -1.53 0.00 0.00 36.38 31.94 4hir s VAL 40 CO -0.10 0.00 0.86 0.28 -3.33 0.00 0.00 175.10 172.81 4hir s THR 41 N -2.63 4.74 -0.36 5.04 -1.32 -1.26 0.80 115.64 120.66 4hir s THR 41 Ca 0.40 0.71 0.00 0.00 -1.21 0.00 0.00 61.69 61.59 4hir s THR 41 Cb -0.01 -3.78 0.00 0.00 -1.51 0.00 0.00 72.50 67.21 4hir s THR 41 CO 0.24 -0.72 0.00 0.61 -2.21 0.00 0.00 174.62 172.54 4hir n GLY 42 N -1.76 -0.46 2.68 6.08 0.00 -1.26 -4.32 105.19 106.14 4hir n GLY 42 Ca 0.03 -0.48 -0.20 0.00 0.00 0.00 0.00 46.02 45.37 4hir n GLY 42 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 4hir s GLU 43 N -2.00 0.64 0.00 1.61 1.03 -1.26 -4.35 118.70 114.37 4hir s GLU 43 Ca 0.00 -1.03 0.00 0.00 0.03 0.00 0.00 54.97 53.97 4hir s GLU 43 Cb 0.00 -0.87 0.00 0.00 -0.80 0.00 0.00 34.13 32.46 4hir s GLU 43 CO 0.00 -1.21 0.00 0.41 -1.33 0.00 0.00 175.26 173.13 4hir n GLY 44 N 4.11 1.71 3.01 -3.83 0.00 -1.25 -5.01 105.19 103.93 4hir n GLY 44 Ca 0.12 -1.94 -0.08 0.00 0.00 0.00 0.00 46.02 44.11 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 2.14 0.15 0.74 2.61 -1.32 -1.24 -4.85 115.64 113.87 4hir s THR 45 Ca 0.00 -1.18 -0.16 0.00 -1.21 0.00 0.00 61.69 59.14 4hir s THR 45 Cb 0.00 -0.65 -0.01 0.00 -1.51 0.00 0.00 72.50 70.33 4hir s THR 45 CO 0.00 -0.65 0.71 -2.65 -2.21 0.00 0.00 174.62 169.82 4hir n PRO 46 N 1.15 0.33 0.07 7.08 -0.02 -1.26 0.10 135.00 142.45 4hir n PRO 46 Ca -0.21 0.16 -0.22 0.00 -2.02 0.00 0.00 63.50 61.21 4hir n PRO 46 Cb 0.57 -1.99 -0.15 0.00 -0.02 0.00 0.00 33.50 31.90 4hir n PRO 46 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 4hir h GLU 47 N -0.42 0.37 -7.26 -0.52 4.22 -1.91 -3.43 114.58 105.63 4hir h GLU 47 Ca -0.46 -0.63 -0.46 0.00 0.08 0.00 0.00 59.36 57.89 4hir h GLU 47 Cb 1.34 0.24 0.18 0.00 0.50 0.00 0.00 28.75 31.01 4hir h GLU 47 CO 0.44 1.30 0.13 -1.25 -2.18 0.00 0.00 179.01 177.45 4hir s PRO 48 N -2.50 0.01 0.00 0.92 0.05 -1.26 -5.09 135.00 127.13 4hir s PRO 48 Ca -0.14 0.78 0.19 0.00 0.05 0.00 0.00 61.00 61.88 4hir s PRO 48 Cb 0.03 -1.67 1.14 0.00 0.05 0.00 0.00 34.50 34.05 4hir s PRO 48 CO 0.85 -3.08 1.53 1.04 0.05 0.00 0.00 177.00 177.39