#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 0.42 0.00 1.55 1.01 -1.26 -5.12 120.40 117.00 4hir s VAL 2 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 61.98 59.99 4hir s VAL 2 Cb 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.85 4hir s VAL 2 CO 0.00 -0.06 0.00 -1.22 0.00 0.00 0.00 175.10 173.82 4hir n TYR 3 N -0.38 -0.70 -2.90 5.22 4.02 -1.26 -5.14 117.16 116.01 4hir n TYR 3 Ca -0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.68 4hir n TYR 3 Cb 0.66 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 40.05 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 0.40 2.20 0.38 -0.72 -4.23 -1.26 -4.91 115.64 107.49 4hir s THR 4 Ca 0.00 -0.88 -0.08 0.00 -1.18 0.00 0.00 61.69 59.56 4hir s THR 4 Cb 0.00 -2.32 -0.06 0.00 1.34 0.00 0.00 72.50 71.46 4hir s THR 4 CO 0.00 0.00 0.70 -1.81 -0.54 0.00 0.00 174.62 172.97 4hir s ASP 5 N -4.67 6.46 0.83 3.99 1.11 -1.26 -2.43 116.67 120.70 4hir s ASP 5 Ca 0.63 0.96 -0.12 0.00 0.18 0.00 0.00 52.55 54.20 4hir s ASP 5 Cb -0.06 -2.25 0.09 0.00 1.07 0.00 0.00 42.92 41.77 4hir s ASP 5 CO 0.40 -0.35 1.11 0.00 1.18 0.00 0.00 175.17 177.51 4hir n THR 7 N -3.52 0.07 -3.74 0.00 -2.24 -1.26 -4.98 114.28 98.62 4hir n THR 7 Ca 0.07 -0.19 -0.06 0.00 -2.27 0.00 0.00 64.05 61.60 4hir n THR 7 Cb 0.57 1.50 0.02 0.00 -2.10 0.00 0.00 70.33 70.33 4hir n THR 7 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 4hir n GLU 8 N -0.04 0.87 -2.22 -0.78 0.28 -1.26 -5.14 120.64 112.36 4hir n GLU 8 Ca 0.00 -1.77 -0.30 0.00 -0.16 0.00 0.00 57.16 54.93 4hir n GLU 8 Cb 0.23 2.25 -0.00 0.00 1.43 0.00 0.00 31.44 35.35 4hir n GLU 8 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 4hir s SER 9 N -2.92 6.32 0.00 -1.84 0.01 -1.26 -3.83 113.70 110.18 4hir s SER 9 Ca 0.16 1.30 0.00 0.00 1.31 0.00 0.00 55.95 58.72 4hir s SER 9 Cb -0.04 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.78 4hir s SER 9 CO 0.09 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 173.63 4hir n GLY 10 N -2.33 2.97 3.29 3.44 0.00 0.65 -4.87 105.19 108.34 4hir n GLY 10 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 -1.83 0.11 1.61 3.00 -1.25 -1.46 117.38 115.56 4hir n GLN 11 Ca 0.00 -0.52 0.00 0.00 -0.01 0.00 0.00 57.00 56.47 4hir n GLN 11 Cb 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 30.24 28.49 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 -2.13 -0.77 -1.68 1.08 3.02 -0.83 -3.11 115.26 110.84 4hir n ASN 12 Ca 0.01 0.40 -0.02 0.00 -0.03 0.00 0.00 54.58 54.94 4hir n ASN 12 Cb 0.61 0.88 -0.03 0.00 -0.61 0.00 0.00 39.78 40.63 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 -3.16 4.40 0.00 3.41 4.77 -1.21 -3.10 117.00 122.11 4hir n LEU 13 Ca 0.00 -2.12 0.00 0.00 -0.03 0.00 0.00 56.01 53.86 4hir n LEU 13 Cb 0.00 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 4hir n LEU 13 CO 0.00 0.92 0.00 0.00 -1.33 0.00 0.00 177.39 176.98 4hir s LEU 15 N 0.00 4.73 0.00 0.00 1.43 -1.02 -2.35 118.68 121.47 4hir s LEU 15 Ca 0.00 -1.36 0.00 0.00 -1.03 0.00 0.00 54.13 51.74 4hir s LEU 15 Cb 0.00 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.31 4hir s LEU 15 CO 0.00 -0.43 0.00 0.00 0.23 0.00 0.00 176.35 176.15 4hir s GLU 17 N -0.57 3.90 5.54 0.00 2.02 -1.26 -4.66 118.70 123.67 4hir s GLU 17 Ca 0.00 0.62 0.00 0.00 0.02 0.00 0.00 54.97 55.61 4hir s GLU 17 Cb 0.00 -3.77 0.00 0.00 0.10 0.00 0.00 34.13 30.46 4hir s GLU 17 CO 0.00 -0.84 0.00 0.41 0.02 0.00 0.00 175.26 174.85 4hir n GLY 18 N 4.26 1.30 0.00 -1.39 0.00 -1.26 -2.23 105.19 105.86 4hir n GLY 18 Ca 0.06 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 10.51 0.40 -4.83 1.61 2.88 -1.26 -5.00 113.62 117.93 4hir n SER 19 Ca 0.00 -1.13 -0.33 0.00 -1.33 0.00 0.00 58.87 56.09 4hir n SER 19 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 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 6.62 0.18 -3.46 0.01 -0.95 -4.86 114.94 112.36 4hir s ASN 20 Ca 0.00 1.65 -0.21 0.00 -0.71 0.00 0.00 52.86 53.59 4hir s ASN 20 Cb 0.00 -2.52 -0.08 0.00 0.41 0.00 0.00 41.25 39.06 4hir s ASN 20 CO 0.00 -0.59 0.71 -0.69 -1.51 0.00 0.00 177.10 175.02 4hir s VAL 21 N -2.44 4.54 0.07 1.60 1.01 -1.26 -2.45 120.40 121.48 4hir s VAL 21 Ca 0.61 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.98 4hir s VAL 21 Cb -0.11 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 4hir s VAL 21 CO 0.26 0.36 0.22 0.00 0.00 0.00 0.00 175.10 175.94 4hir s GLY 23 N -2.56 1.75 -0.32 0.00 0.00 -1.26 -3.34 107.32 101.60 4hir s GLY 23 Ca 0.35 -1.71 -0.30 0.00 0.00 0.00 0.00 44.72 43.06 4hir s GLY 23 CO 0.28 0.68 1.13 -0.18 0.00 0.00 0.00 173.10 175.01 4hir n GLN 24 N 4.66 0.00 0.00 2.90 7.27 -1.26 -2.53 117.38 128.43 4hir n GLN 24 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.93 4hir n GLN 24 Cb 0.44 -0.97 0.00 0.00 2.41 0.00 0.00 30.24 32.12 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 3.20 0.97 0.93 1.69 0.00 -1.26 -5.08 105.19 105.64 4hir n GLY 25 Ca 0.24 0.00 -0.07 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 0.00 1.50 -3.51 1.61 3.02 -1.05 -3.97 115.26 112.87 4hir n ASN 26 Ca 0.00 -1.47 -0.20 0.00 -0.03 0.00 0.00 54.58 52.88 4hir n ASN 26 Cb 0.00 -0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.03 4hir n ASN 26 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 4hir s LYS 27 N -2.55 0.18 0.39 3.52 2.20 0.33 -2.18 119.74 121.63 4hir s LYS 27 Ca 0.07 0.10 -0.15 0.00 -0.36 0.00 0.00 55.97 55.63 4hir s LYS 27 Cb -0.01 -1.28 -0.08 0.00 -1.51 0.00 0.00 37.83 34.95 4hir s LYS 27 CO 0.04 -0.70 0.82 0.00 -0.36 0.00 0.00 175.35 175.15 4hir s ILE 29 N -2.24 1.25 0.16 0.00 -1.09 -0.07 0.24 121.20 119.45 4hir s ILE 29 Ca 0.55 -0.56 -0.30 0.00 -2.23 0.00 0.00 60.65 58.11 4hir s ILE 29 Cb -0.10 -1.12 -0.07 0.00 -1.58 0.00 0.00 42.46 39.59 4hir s ILE 29 CO 0.23 0.38 0.99 -0.76 -1.23 0.00 0.00 174.94 174.55 4hir s LEU 30 N 0.52 4.54 0.00 2.97 1.43 -1.26 -1.97 118.68 124.90 4hir s LEU 30 Ca -0.13 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.87 4hir s LEU 30 Cb -0.15 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.47 4hir s LEU 30 CO 0.04 -0.04 0.60 0.61 0.23 0.00 0.00 176.35 177.78 4hir n GLY 31 N 2.00 -3.44 4.84 -3.19 0.00 0.17 -4.68 105.19 100.88 4hir n GLY 31 Ca 0.01 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.64 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 -1.27 0.00 0.00 1.61 3.41 -1.26 -3.92 113.62 112.19 4hir n SER 32 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.69 4hir n SER 32 Cb 0.00 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 64.41 4hir n SER 32 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 4hir n ASP 33 N 3.40 0.00 -0.45 4.04 -0.08 -1.26 -2.84 116.55 119.36 4hir n ASP 33 Ca 0.00 -1.35 -0.01 0.00 -1.51 0.00 0.00 54.79 51.91 4hir n ASP 33 Cb 0.00 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.45 4hir n ASP 33 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 4hir n GLY 34 N 0.64 0.22 0.44 0.27 0.00 -1.25 -5.01 105.19 100.49 4hir n GLY 34 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 4hir n GLY 34 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 4hir n GLU 35 N 0.00 -0.54 0.00 1.61 0.00 -1.13 -4.64 120.64 115.94 4hir n GLU 35 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.10 4hir n GLU 35 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.77 4hir n GLU 35 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 4hir n LYS 36 N -0.08 2.61 -3.51 5.31 5.02 -1.26 -4.53 118.16 121.72 4hir n LYS 36 Ca 0.00 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 4hir n LYS 36 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.97 4hir n LYS 36 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 4hir s ASN 37 N -1.00 -0.50 -0.04 4.39 2.20 -1.26 0.41 114.94 119.14 4hir s ASN 37 Ca 0.00 0.31 -0.24 0.00 -0.94 0.00 0.00 52.86 51.99 4hir s ASN 37 Cb 0.00 0.46 0.05 0.00 -2.00 0.00 0.00 41.25 39.76 4hir s ASN 37 CO 0.00 -0.63 0.52 -1.58 -2.94 0.00 0.00 177.10 172.47 4hir s GLN 38 N -2.21 0.88 -0.63 3.55 0.74 -0.83 -4.81 119.66 116.36 4hir s GLN 38 Ca -0.02 0.08 -0.07 0.00 0.05 0.00 0.00 55.36 55.39 4hir s GLN 38 Cb -0.01 0.41 0.16 0.00 1.10 0.00 0.00 33.01 34.67 4hir s GLN 38 CO -0.02 -0.26 0.49 0.00 -0.55 0.00 0.00 175.29 174.95 4hir s VAL 40 N 0.42 4.18 0.88 0.00 0.11 -0.77 -4.89 120.40 120.33 4hir s VAL 40 Ca 0.14 -0.51 -0.14 0.00 -2.93 0.00 0.00 61.98 58.54 4hir s VAL 40 Cb -0.19 -2.83 -0.00 0.00 -1.53 0.00 0.00 36.38 31.82 4hir s VAL 40 CO -0.04 0.44 0.35 1.07 -3.33 0.00 0.00 175.10 173.58 4hir n THR 41 N 1.60 0.58 -1.34 5.04 5.66 -1.26 0.12 114.28 124.67 4hir n THR 41 Ca -0.16 -0.28 0.00 0.00 -3.05 0.00 0.00 64.05 60.56 4hir n THR 41 Cb 0.53 -0.60 0.00 0.00 -1.55 0.00 0.00 70.33 68.70 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 1.71 -0.05 2.50 1.09 0.00 -1.25 -3.99 105.19 105.19 4hir n GLY 42 Ca 0.07 -1.20 -0.26 0.00 0.00 0.00 0.00 46.02 44.62 4hir n GLY 42 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 4hir n GLU 43 N 0.00 2.44 -1.45 1.61 -0.58 -1.26 -3.79 120.64 117.61 4hir n GLU 43 Ca 0.00 -4.52 -0.29 0.00 -0.42 0.00 0.00 57.16 51.93 4hir n GLU 43 Cb 0.00 -2.12 0.17 0.00 -0.57 0.00 0.00 31.44 28.92 4hir n GLU 43 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 4hir s GLY 44 N -2.56 1.61 0.01 0.62 0.00 -0.93 -4.98 107.32 101.10 4hir s GLY 44 Ca 0.41 -0.73 0.01 0.00 0.00 0.00 0.00 44.72 44.41 4hir s GLY 44 CO -0.05 -0.05 0.04 -1.08 0.00 0.00 0.00 173.10 171.96 4hir s THR 45 N -3.28 4.43 0.20 0.90 -1.32 -0.54 -4.79 115.64 111.23 4hir s THR 45 Ca 0.68 -0.54 -0.31 0.00 -1.21 0.00 0.00 61.69 60.30 4hir s THR 45 Cb -0.12 -3.01 -0.11 0.00 -1.51 0.00 0.00 72.50 67.75 4hir s THR 45 CO 0.54 0.34 1.61 -2.16 -2.21 0.00 0.00 174.62 172.75 4hir s PRO 46 N -1.72 4.18 -0.24 7.08 0.04 -1.26 -1.96 135.00 141.12 4hir s PRO 46 Ca 0.22 2.46 -0.36 0.00 0.04 0.00 0.00 61.00 63.36 4hir s PRO 46 Cb -0.12 -3.11 -0.13 0.00 0.04 0.00 0.00 34.50 31.19 4hir s PRO 46 CO 0.13 -0.65 1.97 -1.91 0.04 0.00 0.00 177.00 176.58 4hir n GLU 47 N 3.69 1.47 -1.60 4.56 2.13 -1.26 -4.80 120.64 124.83 4hir n GLU 47 Ca 0.13 0.50 -0.40 0.00 0.66 0.00 0.00 57.16 58.05 4hir n GLU 47 Cb 0.37 -2.44 -0.03 0.00 0.27 0.00 0.00 31.44 29.62 4hir n GLU 47 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 4hir s PRO 48 N 4.79 2.66 0.00 5.31 0.02 -1.26 -4.93 135.00 141.60 4hir s PRO 48 Ca 1.01 1.72 0.08 0.00 0.02 0.00 0.00 61.00 63.83 4hir s PRO 48 Cb -0.85 -4.47 0.48 0.00 0.02 0.00 0.00 34.50 29.68 4hir s PRO 48 CO 0.54 -2.64 0.94 1.04 -0.33 0.00 0.00 177.00 176.55