#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 0.65 -2.38 3.34 0.31 -1.26 -4.95 118.33 114.04 4hir n VAL 2 Ca 0.00 -0.83 -0.21 0.00 -0.01 0.00 0.00 64.34 63.29 4hir n VAL 2 Cb 0.00 0.84 0.12 0.00 -0.91 0.00 0.00 33.84 33.89 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 1.48 -3.23 -4.38 3.52 4.01 -1.26 -5.12 117.16 112.18 4hir n TYR 3 Ca 0.20 -1.39 -0.27 0.00 -0.16 0.00 0.00 57.90 56.29 4hir n TYR 3 Cb 0.60 -0.68 -0.04 0.00 -0.31 0.00 0.00 39.34 38.91 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 -2.85 0.00 -2.81 -0.72 -2.24 -1.26 -4.96 114.28 99.44 4hir n THR 4 Ca 0.14 -2.05 -0.31 0.00 -2.27 0.00 0.00 64.05 59.56 4hir n THR 4 Cb 0.50 0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.94 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 -3.60 6.56 0.39 3.42 1.01 -1.26 -1.92 116.67 121.27 4hir s ASP 5 Ca 0.10 1.22 -0.24 0.00 0.71 0.00 0.00 52.55 54.33 4hir s ASP 5 Cb -0.01 -2.36 -0.09 0.00 1.01 0.00 0.00 42.92 41.47 4hir s ASP 5 CO 0.06 -0.41 1.05 0.00 0.21 0.00 0.00 175.17 176.08 4hir n THR 7 N 0.04 0.81 -3.82 0.00 5.66 -1.26 -4.95 114.28 110.76 4hir n THR 7 Ca 0.04 -0.91 -0.06 0.00 -3.05 0.00 0.00 64.05 60.08 4hir n THR 7 Cb 0.49 0.62 -0.01 0.00 -1.55 0.00 0.00 70.33 69.88 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 -0.91 1.63 0.45 1.09 2.02 -1.26 -5.14 118.70 116.58 4hir s GLU 8 Ca 0.12 -0.92 -0.12 0.00 0.02 0.00 0.00 54.97 54.07 4hir s GLU 8 Cb 0.07 0.54 -0.06 0.00 0.10 0.00 0.00 34.13 34.77 4hir s GLU 8 CO 0.09 -0.75 0.84 -1.12 0.02 0.00 0.00 175.26 174.33 4hir s SER 9 N -2.96 6.51 0.00 -0.19 0.01 -1.26 -3.94 113.70 111.87 4hir s SER 9 Ca 0.12 1.24 0.00 0.00 1.31 0.00 0.00 55.95 58.62 4hir s SER 9 Cb -0.04 -2.37 0.00 0.00 0.21 0.00 0.00 66.02 63.82 4hir s SER 9 CO 0.06 -0.48 0.00 0.61 0.41 0.00 0.00 173.24 173.84 4hir n GLY 10 N -1.50 1.07 1.78 3.44 0.00 0.35 -4.86 105.19 105.48 4hir n GLY 10 Ca 0.03 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.84 0.00 1.61 3.00 -1.22 -3.60 117.38 113.33 4hir n GLN 11 Ca 0.00 -0.90 0.00 0.00 -0.01 0.00 0.00 57.00 56.09 4hir n GLN 11 Cb 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 30.24 29.44 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 -3.85 0.00 -2.17 1.08 4.13 -0.77 -1.71 115.26 111.96 4hir n ASN 12 Ca 0.08 0.00 -0.13 0.00 1.68 0.00 0.00 54.58 56.21 4hir n ASN 12 Cb 0.29 0.14 -0.14 0.00 -1.54 0.00 0.00 39.78 38.53 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 -2.25 4.92 0.00 3.41 4.77 -1.26 -2.09 117.00 124.50 4hir n LEU 13 Ca 0.00 -2.97 0.00 0.00 -0.03 0.00 0.00 56.01 53.01 4hir n LEU 13 Cb 0.00 -1.27 0.00 0.00 -2.33 0.00 0.00 43.42 39.82 4hir n LEU 13 CO 0.00 1.47 0.00 0.00 -1.33 0.00 0.00 177.39 177.53 4hir s LEU 15 N 0.00 1.91 -0.07 0.00 1.43 -0.81 -1.61 118.68 119.54 4hir s LEU 15 Ca 0.00 -0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 52.61 4hir s LEU 15 Cb 0.00 -1.21 -0.04 0.00 0.03 0.00 0.00 46.19 44.98 4hir s LEU 15 CO 0.00 0.09 -0.07 0.00 0.23 0.00 0.00 176.35 176.60 4hir s GLU 17 N -2.13 3.49 1.33 0.00 2.02 -1.24 -4.72 118.70 117.45 4hir s GLU 17 Ca -0.09 -0.63 0.00 0.00 0.02 0.00 0.00 54.97 54.27 4hir s GLU 17 Cb 0.03 -3.66 0.00 0.00 0.10 0.00 0.00 34.13 30.60 4hir s GLU 17 CO 0.14 -0.39 0.00 0.41 0.02 0.00 0.00 175.26 175.44 4hir n GLY 18 N 5.04 0.47 0.00 -1.39 0.00 -1.26 0.26 105.19 108.31 4hir n GLY 18 Ca -0.13 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.51 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 4.00 0.72 -4.72 1.61 2.88 -1.26 -5.02 113.62 111.82 4hir n SER 19 Ca 0.00 -1.29 -0.42 0.00 -1.33 0.00 0.00 58.87 55.84 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 -0.29 7.42 0.60 -3.46 0.01 0.14 -4.90 114.94 114.47 4hir s ASN 20 Ca 0.00 1.72 -0.18 0.00 -0.71 0.00 0.00 52.86 53.68 4hir s ASN 20 Cb 0.00 -2.58 -0.03 0.00 0.41 0.00 0.00 41.25 39.05 4hir s ASN 20 CO 0.00 -0.17 1.18 -0.69 -1.51 0.00 0.00 177.10 175.91 4hir s VAL 21 N 0.53 2.81 -0.22 1.60 1.01 -1.26 -2.73 120.40 122.13 4hir s VAL 21 Ca 0.49 0.47 -0.04 0.00 0.00 0.00 0.00 61.98 62.91 4hir s VAL 21 Cb -0.22 -3.14 0.12 0.00 0.00 0.00 0.00 36.38 33.14 4hir s VAL 21 CO 0.29 -0.14 0.37 0.00 0.00 0.00 0.00 175.10 175.62 4hir n GLY 23 N 5.37 2.28 3.70 0.00 0.00 -0.89 -3.89 105.19 111.76 4hir n GLY 23 Ca -0.05 -0.24 -0.44 0.00 0.00 0.00 0.00 46.02 45.30 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 2.34 0.00 1.61 -0.06 -1.25 -0.22 117.38 119.80 4hir n GLN 24 Ca 0.00 0.84 0.00 0.00 -2.00 0.00 0.00 57.00 55.84 4hir n GLN 24 Cb 0.00 -2.57 0.00 0.00 -4.06 0.00 0.00 30.24 23.61 4hir n GLN 24 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 4hir n GLY 25 N 2.59 1.95 0.00 1.69 0.00 -1.26 -4.86 105.19 105.31 4hir n GLY 25 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.26 0.57 -3.20 1.61 3.02 0.69 -4.53 115.26 113.69 4hir n ASN 26 Ca 0.00 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.56 4hir n ASN 26 Cb 0.00 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 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 2.37 0.52 0.72 3.52 2.20 0.53 -4.11 119.74 125.50 4hir s LYS 27 Ca 0.00 0.70 -0.11 0.00 -0.36 0.00 0.00 55.97 56.20 4hir s LYS 27 Cb 0.00 0.22 0.02 0.00 -1.51 0.00 0.00 37.83 36.56 4hir s LYS 27 CO 0.00 -0.80 1.08 0.00 -0.36 0.00 0.00 175.35 175.27 4hir s ILE 29 N -3.20 -0.30 0.38 0.00 -1.09 0.14 0.13 121.20 117.26 4hir s ILE 29 Ca 0.59 0.30 -0.24 0.00 -2.23 0.00 0.00 60.65 59.07 4hir s ILE 29 Cb -0.13 -0.36 -0.10 0.00 -1.58 0.00 0.00 42.46 40.30 4hir s ILE 29 CO 0.54 0.11 0.97 -0.76 -1.23 0.00 0.00 174.94 174.57 4hir s LEU 30 N 2.32 4.17 -0.22 2.97 1.43 -1.26 -1.11 118.68 126.98 4hir s LEU 30 Ca 0.03 1.84 -0.04 0.00 -1.03 0.00 0.00 54.13 54.92 4hir s LEU 30 Cb -0.12 -4.22 0.07 0.00 0.03 0.00 0.00 46.19 41.95 4hir s LEU 30 CO -0.07 -0.26 0.09 -0.83 0.23 0.00 0.00 176.35 175.51 4hir s GLY 31 N -1.79 0.49 0.00 -3.19 0.00 0.02 -4.84 107.32 98.01 4hir s GLY 31 Ca 0.56 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.60 4hir s GLY 31 CO 0.21 1.78 0.19 -1.26 0.00 0.00 0.00 173.10 174.02 4hir n SER 32 N 5.21 0.20 -3.20 1.64 2.88 -1.22 0.41 113.62 119.55 4hir n SER 32 Ca -0.07 -1.04 -0.33 0.00 -1.33 0.00 0.00 58.87 56.11 4hir n SER 32 Cb 0.46 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.89 4hir n SER 32 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 4hir n ASP 33 N -0.02 7.54 -0.40 -3.46 -0.08 -1.26 -3.07 116.55 115.79 4hir n ASP 33 Ca 0.00 -2.49 -0.05 0.00 -1.51 0.00 0.00 54.79 50.73 4hir n ASP 33 Cb 0.27 -1.42 -0.02 0.00 2.34 0.00 0.00 41.12 42.28 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 3.57 0.78 3.16 0.27 0.00 -1.26 -4.99 105.19 106.72 4hir n GLY 34 Ca 0.68 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.68 0.92 -3.95 1.61 1.02 -1.18 -5.14 120.64 111.25 4hir n GLU 35 Ca -0.05 -3.18 -0.36 0.00 -0.02 0.00 0.00 57.16 53.55 4hir n GLU 35 Cb 0.19 0.80 -0.06 0.00 -0.02 0.00 0.00 31.44 32.35 4hir n GLU 35 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 4hir s LYS 36 N -3.62 3.37 0.69 3.49 -2.85 0.17 -3.38 119.74 117.60 4hir s LYS 36 Ca 0.03 -0.21 -0.16 0.00 -1.00 0.00 0.00 55.97 54.63 4hir s LYS 36 Cb -0.00 -3.11 0.01 0.00 -2.06 0.00 0.00 37.83 32.67 4hir s LYS 36 CO 0.02 0.75 1.21 -0.80 0.10 0.00 0.00 175.35 176.63 4hir s ASN 37 N -1.20 4.52 0.02 0.03 0.01 -0.49 -0.80 114.94 117.03 4hir s ASN 37 Ca 0.17 2.38 -0.16 0.00 -0.71 0.00 0.00 52.86 54.54 4hir s ASN 37 Cb -0.12 -2.59 0.03 0.00 0.41 0.00 0.00 41.25 38.97 4hir s ASN 37 CO 0.07 -2.05 0.34 -1.58 -1.51 0.00 0.00 177.10 172.37 4hir s GLN 38 N -3.73 0.79 -0.30 -0.60 0.74 -0.27 -4.73 119.66 111.57 4hir s GLN 38 Ca 0.76 -0.35 -0.07 0.00 0.05 0.00 0.00 55.36 55.75 4hir s GLN 38 Cb -0.30 0.35 0.01 0.00 1.10 0.00 0.00 33.01 34.17 4hir s GLN 38 CO 0.42 -0.25 0.09 0.00 -0.55 0.00 0.00 175.29 175.00 4hir s VAL 40 N 1.50 1.53 0.07 0.00 0.11 -0.92 -4.96 120.40 117.72 4hir s VAL 40 Ca 0.02 -2.07 -0.21 0.00 -2.93 0.00 0.00 61.98 56.80 4hir s VAL 40 Cb -0.17 -1.89 -0.06 0.00 -1.53 0.00 0.00 36.38 32.72 4hir s VAL 40 CO 0.03 -0.59 0.62 0.28 -3.33 0.00 0.00 175.10 172.11 4hir s THR 41 N -2.86 4.72 -0.38 5.04 -1.32 -1.26 0.20 115.64 119.79 4hir s THR 41 Ca 0.18 1.33 0.00 0.00 -1.21 0.00 0.00 61.69 61.99 4hir s THR 41 Cb -0.01 -3.96 0.00 0.00 -1.51 0.00 0.00 72.50 67.02 4hir s THR 41 CO 0.05 0.50 0.00 0.61 -2.21 0.00 0.00 174.62 173.57 4hir n GLY 42 N 1.93 -0.72 3.45 6.08 0.00 -1.26 -4.66 105.19 110.02 4hir n GLY 42 Ca -0.08 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 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 -0.15 3.01 0.31 1.61 -6.30 -1.26 -4.40 118.70 111.52 4hir s GLU 43 Ca 0.00 -1.02 0.03 0.00 -2.50 0.00 0.00 54.97 51.48 4hir s GLU 43 Cb 0.00 -4.02 -0.06 0.00 0.00 0.00 0.00 34.13 30.06 4hir s GLU 43 CO 0.00 -0.85 0.07 0.20 0.02 0.00 0.00 175.26 174.69 4hir s GLY 44 N 1.95 2.02 -0.03 -1.50 0.00 -1.26 -4.97 107.32 103.53 4hir s GLY 44 Ca 0.07 -1.99 0.04 0.00 0.00 0.00 0.00 44.72 42.83 4hir s GLY 44 CO 0.10 -1.77 -0.13 -1.08 0.00 0.00 0.00 173.10 170.22 4hir s THR 45 N -3.39 3.17 -0.43 0.90 -1.32 -1.24 -4.96 115.64 108.37 4hir s THR 45 Ca 0.36 -0.76 -0.28 0.00 -1.21 0.00 0.00 61.69 59.80 4hir s THR 45 Cb 0.08 -2.28 -0.00 0.00 -1.51 0.00 0.00 72.50 68.79 4hir s THR 45 CO 0.15 0.54 1.63 -2.16 -2.21 0.00 0.00 174.62 172.57 4hir s PRO 46 N -0.91 3.30 -0.75 7.08 0.04 -1.26 -1.84 135.00 140.66 4hir s PRO 46 Ca 0.13 1.01 -0.18 0.00 0.04 0.00 0.00 61.00 61.99 4hir s PRO 46 Cb -0.11 -4.16 -0.19 0.00 0.04 0.00 0.00 34.50 30.08 4hir s PRO 46 CO 0.02 -1.90 1.91 -1.91 0.04 0.00 0.00 177.00 175.15 4hir n GLU 47 N 8.46 0.00 -1.80 4.56 0.00 -1.26 -4.70 120.64 125.90 4hir n GLU 47 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.92 4hir n GLU 47 Cb 0.48 -1.02 -0.03 0.00 0.00 0.00 0.00 31.44 30.88 4hir n GLU 47 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.13 175.88 4hir s PRO 48 N 6.32 3.57 0.00 5.31 0.05 -1.26 -4.94 135.00 144.05 4hir s PRO 48 Ca 1.01 2.01 0.20 0.00 0.05 0.00 0.00 61.00 64.27 4hir s PRO 48 Cb -0.86 -4.22 0.16 0.00 0.05 0.00 0.00 34.50 29.63 4hir s PRO 48 CO 0.39 -1.59 1.12 0.00 0.05 0.00 0.00 177.00 176.97