#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 -3.39 1.55 0.31 -1.26 -5.11 118.33 110.43 4hir n VAL 2 Ca 0.00 -0.99 0.00 0.00 -0.01 0.00 0.00 64.34 63.34 4hir n VAL 2 Cb 0.00 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 31.50 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 -3.43 -0.50 -4.06 3.52 4.02 -1.26 -5.16 117.16 110.28 4hir n TYR 3 Ca 0.15 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.81 4hir n TYR 3 Cb 0.52 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.82 4hir n TYR 3 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 4hir n THR 4 N -0.17 0.00 -3.21 -0.72 5.66 -1.26 -4.99 114.28 109.60 4hir n THR 4 Ca 0.00 -1.82 -0.29 0.00 -3.05 0.00 0.00 64.05 58.89 4hir n THR 4 Cb 0.00 0.04 -0.03 0.00 -1.55 0.00 0.00 70.33 68.79 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 -3.50 6.49 1.09 1.09 1.01 -1.26 -2.42 116.67 119.17 4hir s ASP 5 Ca 0.17 0.86 -0.17 0.00 0.71 0.00 0.00 52.55 54.12 4hir s ASP 5 Cb -0.01 -2.20 0.23 0.00 1.01 0.00 0.00 42.92 41.95 4hir s ASP 5 CO 0.11 -0.24 1.11 0.00 0.21 0.00 0.00 175.17 176.36 4hir n THR 7 N -4.07 0.00 -3.83 0.00 5.66 -1.26 -4.97 114.28 105.80 4hir n THR 7 Ca 0.14 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 61.08 4hir n THR 7 Cb 0.53 0.11 -0.01 0.00 -1.55 0.00 0.00 70.33 69.40 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 1.76 0.48 1.09 0.41 -1.26 -5.16 118.70 116.02 4hir s GLU 8 Ca 0.00 -1.01 -0.01 0.00 -0.41 0.00 0.00 54.97 53.53 4hir s GLU 8 Cb 0.00 0.57 -0.00 0.00 -1.78 0.00 0.00 34.13 32.92 4hir s GLU 8 CO 0.00 -0.81 0.72 -1.12 -0.49 0.00 0.00 175.26 173.56 4hir s SER 9 N -2.97 5.81 0.00 -0.19 0.01 -1.26 -4.28 113.70 110.81 4hir s SER 9 Ca 0.12 0.40 0.00 0.00 1.31 0.00 0.00 55.95 57.78 4hir s SER 9 Cb -0.05 -1.60 0.00 0.00 0.21 0.00 0.00 66.02 64.58 4hir s SER 9 CO 0.07 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 173.57 4hir n GLY 10 N -2.18 2.70 0.42 3.44 0.00 0.14 -4.89 105.19 104.83 4hir n GLY 10 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.96 -1.29 0.07 1.61 3.00 -1.26 -3.15 117.38 115.41 4hir n GLN 11 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 57.00 56.84 4hir n GLN 11 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 30.24 30.01 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 -2.43 -0.73 -2.06 1.08 4.13 -0.81 -3.15 115.26 111.29 4hir n ASN 12 Ca 0.01 0.26 -0.10 0.00 1.68 0.00 0.00 54.58 56.43 4hir n ASN 12 Cb 0.06 0.86 -0.14 0.00 -1.54 0.00 0.00 39.78 39.02 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 -2.87 4.50 0.00 3.41 4.77 -1.26 -3.14 117.00 122.41 4hir n LEU 13 Ca 0.00 -2.79 0.00 0.00 -0.03 0.00 0.00 56.01 53.19 4hir n LEU 13 Cb 0.00 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 39.88 4hir n LEU 13 CO 0.00 1.38 0.00 0.00 -1.33 0.00 0.00 177.39 177.44 4hir s LEU 15 N 0.00 2.55 0.06 0.00 1.43 -1.02 -2.65 118.68 119.05 4hir s LEU 15 Ca 0.00 -0.51 -0.02 0.00 -1.03 0.00 0.00 54.13 52.58 4hir s LEU 15 Cb 0.00 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.59 4hir s LEU 15 CO 0.00 -0.01 -0.04 0.00 0.23 0.00 0.00 176.35 176.54 4hir s GLU 17 N -1.97 3.44 4.36 0.00 0.41 -1.24 -4.63 118.70 119.07 4hir s GLU 17 Ca -0.03 -0.97 0.00 0.00 -0.41 0.00 0.00 54.97 53.56 4hir s GLU 17 Cb 0.00 -5.26 0.00 0.00 -1.78 0.00 0.00 34.13 27.09 4hir s GLU 17 CO 0.05 -2.35 0.00 0.41 -0.49 0.00 0.00 175.26 172.88 4hir n GLY 18 N 6.81 1.37 0.00 -1.39 0.00 -1.26 -1.93 105.19 108.79 4hir n GLY 18 Ca 0.32 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 8.03 0.73 -4.74 1.61 2.88 -1.26 -4.97 113.62 115.91 4hir n SER 19 Ca 0.00 -1.17 -0.41 0.00 -1.33 0.00 0.00 58.87 55.96 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 -0.17 7.47 0.45 -3.46 0.01 -0.81 -4.87 114.94 113.57 4hir s ASN 20 Ca 0.00 1.92 -0.24 0.00 -0.71 0.00 0.00 52.86 53.84 4hir s ASN 20 Cb 0.00 -2.60 -0.07 0.00 0.41 0.00 0.00 41.25 38.99 4hir s ASN 20 CO 0.00 -0.05 1.23 -0.69 -1.51 0.00 0.00 177.10 176.09 4hir s VAL 21 N -0.41 2.81 -0.16 1.60 1.01 -1.26 -2.61 120.40 121.38 4hir s VAL 21 Ca 0.46 0.64 -0.05 0.00 0.00 0.00 0.00 61.98 63.03 4hir s VAL 21 Cb -0.26 -3.34 0.08 0.00 0.00 0.00 0.00 36.38 32.86 4hir s VAL 21 CO 0.32 0.03 0.32 0.00 0.00 0.00 0.00 175.10 175.76 4hir n GLY 23 N 5.36 -1.99 3.64 0.00 0.00 -1.19 -4.29 105.19 106.73 4hir n GLY 23 Ca -0.07 0.67 -0.47 0.00 0.00 0.00 0.00 46.02 46.15 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 2.10 0.00 1.61 7.27 -1.26 0.10 117.38 127.20 4hir n GLN 24 Ca 0.00 0.73 0.00 0.00 0.07 0.00 0.00 57.00 57.80 4hir n GLN 24 Cb 0.00 -2.75 0.00 0.00 2.41 0.00 0.00 30.24 29.90 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 4.87 2.96 0.00 1.69 0.00 -1.26 -4.98 105.19 108.47 4hir n GLY 25 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 0.00 -3.82 1.61 3.02 0.29 -4.57 115.26 111.79 4hir n ASN 26 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.46 4hir n ASN 26 Cb 0.00 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.10 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 1.52 0.89 0.23 3.52 2.20 0.64 -4.14 119.74 124.59 4hir s LYS 27 Ca 0.00 -0.91 0.11 0.00 -0.36 0.00 0.00 55.97 54.81 4hir s LYS 27 Cb 0.00 0.37 -0.05 0.00 -1.51 0.00 0.00 37.83 36.64 4hir s LYS 27 CO 0.00 -0.29 -0.20 0.00 -0.36 0.00 0.00 175.35 174.49 4hir s ILE 29 N -2.24 -0.03 0.01 0.00 -1.09 -0.38 0.28 121.20 117.74 4hir s ILE 29 Ca 0.24 0.09 -0.30 0.00 -2.23 0.00 0.00 60.65 58.45 4hir s ILE 29 Cb -0.06 -0.36 -0.04 0.00 -1.58 0.00 0.00 42.46 40.42 4hir s ILE 29 CO 0.11 0.04 1.11 -0.76 -1.23 0.00 0.00 174.94 174.21 4hir s LEU 30 N 0.83 4.34 0.00 2.97 1.43 -1.26 -1.14 118.68 125.86 4hir s LEU 30 Ca -0.06 1.83 0.00 0.00 -1.03 0.00 0.00 54.13 54.87 4hir s LEU 30 Cb -0.07 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.58 4hir s LEU 30 CO -0.05 -0.42 0.00 0.61 0.23 0.00 0.00 176.35 176.72 4hir n GLY 31 N 3.13 1.19 0.00 -3.19 0.00 -0.32 -4.83 105.19 101.18 4hir n GLY 31 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 4hir n GLY 31 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 4hir n SER 32 N 0.00 2.99 -3.61 1.61 7.64 -1.22 -4.66 113.62 116.37 4hir n SER 32 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 4hir n SER 32 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 4hir n SER 32 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 4hir n ASP 33 N 0.00 5.29 0.00 6.43 8.00 -1.26 -0.29 116.55 134.72 4hir n ASP 33 Ca 0.00 -2.76 0.00 0.00 0.71 0.00 0.00 54.79 52.74 4hir n ASP 33 Cb 0.00 -1.63 0.00 0.00 -0.02 0.00 0.00 41.12 39.47 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 3.95 1.08 0.00 0.44 0.00 -1.26 -4.87 105.19 104.53 4hir n GLY 34 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.62 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 0.00 1.57 0.00 1.61 1.02 -1.08 -5.07 120.64 118.69 4hir n GLU 35 Ca 0.00 -1.04 0.00 0.00 -0.02 0.00 0.00 57.16 56.10 4hir n GLU 35 Cb 0.00 -0.84 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 4hir n GLU 35 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 4hir n LYS 36 N -0.28 2.28 -1.81 3.49 4.81 0.60 -3.44 118.16 123.81 4hir n LYS 36 Ca 0.00 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.01 4hir n LYS 36 Cb 0.28 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.31 4hir n LYS 36 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 4hir s ASN 37 N -1.88 5.63 0.05 3.14 0.01 -1.26 -1.17 114.94 119.46 4hir s ASN 37 Ca 0.00 1.54 0.04 0.00 -0.71 0.00 0.00 52.86 53.72 4hir s ASN 37 Cb 0.00 -2.52 -0.04 0.00 0.41 0.00 0.00 41.25 39.10 4hir s ASN 37 CO 0.00 -1.88 -0.02 -1.58 -1.51 0.00 0.00 177.10 172.11 4hir s GLN 38 N 6.09 2.58 -0.85 -0.60 0.74 -0.29 -4.07 119.66 123.25 4hir s GLN 38 Ca 0.89 -0.77 -0.16 0.00 0.05 0.00 0.00 55.36 55.38 4hir s GLN 38 Cb -0.27 -2.55 0.19 0.00 1.10 0.00 0.00 33.01 31.48 4hir s GLN 38 CO 0.34 0.57 0.88 0.00 -0.55 0.00 0.00 175.29 176.54 4hir s VAL 40 N 1.10 4.82 0.35 0.00 0.11 0.38 -4.74 120.40 122.41 4hir s VAL 40 Ca 0.22 0.97 -0.28 0.00 -2.93 0.00 0.00 61.98 59.97 4hir s VAL 40 Cb -0.09 -3.79 -0.10 0.00 -1.53 0.00 0.00 36.38 30.87 4hir s VAL 40 CO -0.09 0.38 1.35 0.28 -3.33 0.00 0.00 175.10 173.69 4hir s THR 41 N -1.31 2.56 -5.00 5.04 -1.32 -1.26 0.23 115.64 114.58 4hir s THR 41 Ca 0.34 0.55 0.00 0.00 -1.21 0.00 0.00 61.69 61.37 4hir s THR 41 Cb -0.17 -3.35 0.00 0.00 -1.51 0.00 0.00 72.50 67.47 4hir s THR 41 CO 0.19 0.13 0.00 0.61 -2.21 0.00 0.00 174.62 173.33 4hir n GLY 42 N 0.71 -0.00 3.40 6.08 0.00 -1.26 -4.56 105.19 109.55 4hir n GLY 42 Ca 0.01 -1.27 -0.33 0.00 0.00 0.00 0.00 46.02 44.43 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 3.08 0.07 1.61 -1.05 -1.26 -3.82 118.70 115.33 4hir s GLU 43 Ca 0.00 -0.69 0.01 0.00 -0.15 0.00 0.00 54.97 54.13 4hir s GLU 43 Cb 0.00 -2.54 -0.04 0.00 -0.44 0.00 0.00 34.13 31.12 4hir s GLU 43 CO 0.00 0.35 -0.05 0.20 0.95 0.00 0.00 175.26 176.71 4hir s GLY 44 N -0.02 0.62 0.18 -3.83 0.00 -1.26 -4.92 107.32 98.10 4hir s GLY 44 Ca -0.04 -1.22 -0.18 0.00 0.00 0.00 0.00 44.72 43.28 4hir s GLY 44 CO 0.04 -1.32 0.66 -1.08 0.00 0.00 0.00 173.10 171.40 4hir s THR 45 N -3.43 4.65 0.46 0.90 -1.32 -1.19 -4.75 115.64 110.97 4hir s THR 45 Ca 0.07 1.18 -0.24 0.00 -1.21 0.00 0.00 61.69 61.49 4hir s THR 45 Cb 0.04 -3.85 -0.08 0.00 -1.51 0.00 0.00 72.50 67.11 4hir s THR 45 CO -0.06 0.27 1.32 -0.81 -2.21 0.00 0.00 174.62 173.13 4hir n PRO 46 N 0.90 1.93 -2.31 7.08 -0.04 -1.26 -1.93 135.00 139.37 4hir n PRO 46 Ca -0.04 0.69 -0.43 0.00 -0.04 0.00 0.00 63.50 63.68 4hir n PRO 46 Cb 0.51 -2.48 -0.02 0.00 -0.04 0.00 0.00 33.50 31.46 4hir n PRO 46 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 4hir s GLU 47 N -2.44 4.06 0.35 0.54 -6.30 -1.26 -4.77 118.70 108.88 4hir s GLU 47 Ca 0.64 1.62 -0.29 0.00 -2.50 0.00 0.00 54.97 54.44 4hir s GLU 47 Cb -0.47 -3.88 -0.11 0.00 0.00 0.00 0.00 34.13 29.67 4hir s GLU 47 CO 0.56 -0.95 1.54 -2.14 0.02 0.00 0.00 175.26 174.28 4hir s PRO 48 N 3.98 4.10 0.00 4.30 0.02 -1.26 -4.96 135.00 141.17 4hir s PRO 48 Ca 0.61 2.60 0.28 0.00 0.02 0.00 0.00 61.00 64.51 4hir s PRO 48 Cb -0.22 -2.98 1.02 0.00 0.02 0.00 0.00 34.50 32.34 4hir s PRO 48 CO 0.22 -0.59 1.73 0.00 -0.33 0.00 0.00 177.00 178.02