#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 2.30 0.17 1.55 1.01 -1.26 -5.13 120.40 119.05 4hir s VAL 2 Ca 0.00 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.28 4hir s VAL 2 Cb 0.00 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.79 4hir s VAL 2 CO 0.00 0.00 0.07 -1.22 0.00 0.00 0.00 175.10 173.95 4hir n TYR 3 N -2.55 -0.01 -3.17 5.22 4.01 -1.26 -5.14 117.16 114.26 4hir n TYR 3 Ca 0.13 -1.15 -0.17 0.00 -0.16 0.00 0.00 57.90 56.55 4hir n TYR 3 Cb 0.60 0.02 0.05 0.00 -0.31 0.00 0.00 39.34 39.70 4hir n TYR 3 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 4hir n THR 4 N -0.38 0.00 -3.42 -0.72 5.66 -1.26 -4.95 114.28 109.21 4hir n THR 4 Ca -0.02 -1.67 -0.29 0.00 -3.05 0.00 0.00 64.05 59.03 4hir n THR 4 Cb 0.26 -0.51 -0.03 0.00 -1.55 0.00 0.00 70.33 68.50 4hir n THR 4 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 4hir s ASP 5 N -3.99 6.45 1.04 1.09 1.01 -1.26 -2.25 116.67 118.76 4hir s ASP 5 Ca 0.47 0.67 -0.16 0.00 0.71 0.00 0.00 52.55 54.25 4hir s ASP 5 Cb -0.04 -2.13 0.21 0.00 1.01 0.00 0.00 42.92 41.98 4hir s ASP 5 CO 0.30 -0.15 1.17 0.00 0.21 0.00 0.00 175.17 176.70 4hir n THR 7 N -4.16 0.00 -3.94 0.00 5.66 -1.26 -4.95 114.28 105.62 4hir n THR 7 Ca 0.11 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.01 4hir n THR 7 Cb 0.59 0.22 -0.02 0.00 -1.55 0.00 0.00 70.33 69.57 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 1.84 0.39 1.09 0.41 -1.26 -5.14 118.70 116.04 4hir s GLU 8 Ca 0.00 -1.34 -0.06 0.00 -0.41 0.00 0.00 54.97 53.16 4hir s GLU 8 Cb 0.00 0.53 -0.05 0.00 -1.78 0.00 0.00 34.13 32.84 4hir s GLU 8 CO 0.00 -0.81 0.69 -1.12 -0.49 0.00 0.00 175.26 173.53 4hir s SER 9 N -3.05 6.38 0.00 -0.19 0.01 -1.26 -4.34 113.70 111.25 4hir s SER 9 Ca 0.20 0.87 0.00 0.00 1.31 0.00 0.00 55.95 58.32 4hir s SER 9 Cb -0.03 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 63.99 4hir s SER 9 CO 0.11 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 173.98 4hir n GLY 10 N -1.61 2.47 3.01 3.44 0.00 0.70 -4.87 105.19 108.33 4hir n GLY 10 Ca -0.00 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.13 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 -0.02 0.01 1.61 3.00 -1.26 -2.43 117.38 118.29 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 -1.02 0.00 0.00 0.00 0.00 0.00 30.24 29.22 4hir n GLN 11 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 4hir n ASN 12 N 3.40 -0.02 -1.74 1.08 3.02 -1.10 -2.71 115.26 117.20 4hir n ASN 12 Ca -0.02 0.02 -0.04 0.00 -0.03 0.00 0.00 54.58 54.52 4hir n ASN 12 Cb 0.64 0.04 -0.05 0.00 -0.61 0.00 0.00 39.78 39.80 4hir n ASN 12 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 4hir n LEU 13 N -2.54 4.61 0.00 3.41 4.77 -1.18 -2.48 117.00 123.59 4hir n LEU 13 Ca 0.00 -2.35 0.00 0.00 -0.03 0.00 0.00 56.01 53.63 4hir n LEU 13 Cb 0.00 -1.07 0.00 0.00 -2.33 0.00 0.00 43.42 40.02 4hir n LEU 13 CO 0.00 1.06 0.00 0.00 -1.33 0.00 0.00 177.39 177.12 4hir s LEU 15 N 0.00 5.00 -0.24 0.00 1.43 -0.96 -2.97 118.68 120.95 4hir s LEU 15 Ca 0.00 -2.20 -0.17 0.00 -1.03 0.00 0.00 54.13 50.73 4hir s LEU 15 Cb 0.00 -1.74 -0.14 0.00 0.03 0.00 0.00 46.19 44.34 4hir s LEU 15 CO 0.00 -0.45 -0.15 0.00 0.23 0.00 0.00 176.35 175.99 4hir s GLU 17 N -2.47 3.38 2.54 0.00 0.41 -1.22 -4.58 118.70 116.77 4hir s GLU 17 Ca -0.33 -1.78 0.00 0.00 -0.41 0.00 0.00 54.97 52.45 4hir s GLU 17 Cb 0.10 -4.52 0.00 0.00 -1.78 0.00 0.00 34.13 27.93 4hir s GLU 17 CO 0.51 -1.55 0.00 0.41 -0.49 0.00 0.00 175.26 174.14 4hir n GLY 18 N 4.98 0.48 0.00 -1.39 0.00 -1.26 -0.47 105.19 107.53 4hir n GLY 18 Ca 0.08 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.69 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 4.62 0.58 -4.76 1.61 2.88 -1.26 -4.95 113.62 112.34 4hir n SER 19 Ca 0.00 -1.13 -0.39 0.00 -1.33 0.00 0.00 58.87 56.01 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 -0.13 7.54 0.10 -3.46 0.01 0.38 -4.91 114.94 114.47 4hir s ASN 20 Ca 0.00 1.96 -0.27 0.00 -0.71 0.00 0.00 52.86 53.84 4hir s ASN 20 Cb 0.00 -2.61 -0.06 0.00 0.41 0.00 0.00 41.25 38.99 4hir s ASN 20 CO 0.00 0.08 0.85 -0.69 -1.51 0.00 0.00 177.10 175.83 4hir s VAL 21 N -1.26 4.56 0.25 1.60 1.01 -1.26 -2.51 120.40 122.79 4hir s VAL 21 Ca 0.43 1.84 -0.08 0.00 0.00 0.00 0.00 61.98 64.17 4hir s VAL 21 Cb -0.25 -4.21 -0.07 0.00 0.00 0.00 0.00 36.38 31.85 4hir s VAL 21 CO 0.31 0.37 0.55 0.00 0.00 0.00 0.00 175.10 176.34 4hir s GLY 23 N -2.62 1.40 0.04 0.00 0.00 -1.25 -3.09 107.32 101.80 4hir s GLY 23 Ca 0.46 -1.08 -0.30 0.00 0.00 0.00 0.00 44.72 43.80 4hir s GLY 23 CO 0.24 0.01 0.75 -0.18 0.00 0.00 0.00 173.10 173.92 4hir n GLN 24 N 4.09 0.00 0.00 2.90 7.27 -1.26 -2.65 117.38 127.73 4hir n GLN 24 Ca -0.20 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.87 4hir n GLN 24 Cb 0.52 -1.11 0.00 0.00 2.41 0.00 0.00 30.24 32.06 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 1.30 0.81 0.00 1.69 0.00 -1.26 -5.08 105.19 102.65 4hir n GLY 25 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 0.00 0.21 -3.30 1.61 5.03 -1.08 -4.14 115.26 113.58 4hir n ASN 26 Ca 0.00 0.00 -0.07 0.00 0.87 0.00 0.00 54.58 55.38 4hir n ASN 26 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 38.70 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 2.81 0.41 0.57 3.52 2.20 0.75 -3.25 119.74 126.75 4hir s LYS 27 Ca 0.00 0.37 -0.14 0.00 -0.36 0.00 0.00 55.97 55.84 4hir s LYS 27 Cb 0.00 -0.28 -0.05 0.00 -1.51 0.00 0.00 37.83 35.99 4hir s LYS 27 CO 0.00 -0.86 1.01 0.00 -0.36 0.00 0.00 175.35 175.14 4hir s ILE 29 N -2.88 -0.01 -0.49 0.00 -1.09 0.05 0.25 121.20 117.04 4hir s ILE 29 Ca 0.57 0.04 -0.29 0.00 -2.23 0.00 0.00 60.65 58.75 4hir s ILE 29 Cb -0.11 -0.06 0.02 0.00 -1.58 0.00 0.00 42.46 40.73 4hir s ILE 29 CO 0.43 0.02 1.29 -0.76 -1.23 0.00 0.00 174.94 174.68 4hir s LEU 30 N 0.22 3.55 0.00 2.97 1.43 -1.26 -1.22 118.68 124.36 4hir s LEU 30 Ca -0.02 0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.58 4hir s LEU 30 Cb -0.03 -3.40 0.00 0.00 0.03 0.00 0.00 46.19 42.79 4hir s LEU 30 CO -0.01 -1.43 0.00 0.61 0.23 0.00 0.00 176.35 175.75 4hir n GLY 31 N 5.03 1.30 0.00 -3.19 0.00 -0.07 -4.83 105.19 103.44 4hir n GLY 31 Ca 0.13 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.15 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 -3.50 1.61 2.88 1.15 -4.73 113.62 111.02 4hir n SER 32 Ca 0.00 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.17 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 4.24 -0.34 -3.46 5.68 -1.26 -3.05 116.55 118.36 4hir n ASP 33 Ca 0.00 -2.62 -0.03 0.00 -0.50 0.00 0.00 54.79 51.64 4hir n ASP 33 Cb 0.00 -1.31 -0.00 0.00 -1.14 0.00 0.00 41.12 38.67 4hir n ASP 33 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 4hir n GLY 34 N 4.12 0.31 0.00 6.12 0.00 -1.26 -4.98 105.19 109.50 4hir n GLY 34 Ca 0.53 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.62 0.43 -0.35 1.61 -0.58 -1.17 -5.13 120.64 113.82 4hir n GLU 35 Ca -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 4hir n GLU 35 Cb 0.45 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.32 4hir n GLU 35 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 4hir n LYS 36 N 0.00 1.90 -0.97 3.49 4.76 -1.26 -3.55 118.16 122.52 4hir n LYS 36 Ca 0.00 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.11 4hir n LYS 36 Cb 0.00 0.00 0.12 0.00 -1.84 0.00 0.00 35.03 33.31 4hir n LYS 36 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 4hir n ASN 37 N -1.27 -0.47 -3.65 4.39 3.02 -1.26 0.37 115.26 116.38 4hir n ASN 37 Ca 0.00 0.48 -0.15 0.00 -0.03 0.00 0.00 54.58 54.88 4hir n ASN 37 Cb 0.00 -1.35 -0.08 0.00 -0.61 0.00 0.00 39.78 37.74 4hir n ASN 37 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 4hir s GLN 38 N -3.78 0.80 -0.73 3.52 0.74 -0.36 -4.48 119.66 115.36 4hir s GLN 38 Ca 0.66 0.25 -0.10 0.00 0.05 0.00 0.00 55.36 56.21 4hir s GLN 38 Cb -0.27 0.37 0.19 0.00 1.10 0.00 0.00 33.01 34.41 4hir s GLN 38 CO 0.58 -0.20 0.63 0.00 -0.55 0.00 0.00 175.29 175.75 4hir s VAL 40 N 0.24 4.30 0.52 0.00 0.11 -0.72 -4.90 120.40 119.95 4hir s VAL 40 Ca 0.16 -1.47 -0.16 0.00 -2.93 0.00 0.00 61.98 57.58 4hir s VAL 40 Cb -0.15 -3.33 -0.08 0.00 -1.53 0.00 0.00 36.38 31.29 4hir s VAL 40 CO -0.06 -0.35 0.98 0.28 -3.33 0.00 0.00 175.10 172.62 4hir s THR 41 N -2.16 4.55 0.00 5.04 -1.32 -1.26 0.27 115.64 120.75 4hir s THR 41 Ca 0.33 1.18 0.00 0.00 -1.21 0.00 0.00 61.69 61.99 4hir s THR 41 Cb -0.08 -3.73 0.00 0.00 -1.51 0.00 0.00 72.50 67.18 4hir s THR 41 CO 0.24 -0.71 0.00 0.61 -2.21 0.00 0.00 174.62 172.55 4hir n GLY 42 N -1.65 -0.41 2.85 6.08 0.00 -1.26 -4.39 105.19 106.42 4hir n GLY 42 Ca 0.06 0.30 -0.16 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 0.04 0.04 1.61 2.12 -1.25 -4.58 118.70 116.67 4hir s GLU 43 Ca 0.00 0.47 0.01 0.00 0.36 0.00 0.00 54.97 55.80 4hir s GLU 43 Cb 0.00 -0.26 -0.00 0.00 0.26 0.00 0.00 34.13 34.13 4hir s GLU 43 CO 0.00 -0.26 0.04 0.41 -0.54 0.00 0.00 175.26 174.91 4hir n GLY 44 N 4.91 3.68 3.10 -1.50 0.00 -1.20 -4.85 105.19 109.32 4hir n GLY 44 Ca -0.13 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.15 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 -2.24 0.58 0.79 2.61 -1.32 -1.26 -4.85 115.64 109.94 4hir s THR 45 Ca 0.05 -1.41 -0.12 0.00 -1.21 0.00 0.00 61.69 58.99 4hir s THR 45 Cb 0.00 -1.02 0.19 0.00 -1.51 0.00 0.00 72.50 70.16 4hir s THR 45 CO 0.03 -0.59 0.44 -2.65 -2.21 0.00 0.00 174.62 169.64 4hir n PRO 46 N 0.87 -2.84 -2.37 7.08 -0.01 -1.26 -2.69 135.00 133.78 4hir n PRO 46 Ca -0.19 -0.73 -0.30 0.00 -0.01 0.00 0.00 63.50 62.28 4hir n PRO 46 Cb 0.57 -1.05 -0.00 0.00 -0.01 0.00 0.00 33.50 33.01 4hir n PRO 46 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 175.50 174.28 4hir s GLU 47 N -3.75 3.64 1.11 -0.52 8.01 -1.26 -4.59 118.70 121.33 4hir s GLU 47 Ca 0.34 0.51 -0.17 0.00 0.01 0.00 0.00 54.97 55.66 4hir s GLU 47 Cb -0.06 -2.25 0.26 0.00 -4.31 0.00 0.00 34.13 27.77 4hir s GLU 47 CO 0.28 -0.32 0.59 -2.30 0.01 0.00 0.00 175.26 173.53 4hir n PRO 48 N -2.23 -3.09 0.00 0.39 -0.01 -1.26 -5.09 135.00 123.71 4hir n PRO 48 Ca 0.03 -1.00 0.00 0.00 -0.01 0.00 0.00 63.50 62.53 4hir n PRO 48 Cb 0.54 -1.50 0.00 0.00 -0.01 0.00 0.00 33.50 32.53 4hir n PRO 48 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49