#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hir s VAL 2 N 0.00 2.12 0.00 3.34 1.01 -1.26 -5.10 120.40 120.51 2hir s VAL 2 Ca 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 61.98 60.23 2hir s VAL 2 Cb 0.00 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.51 2hir s VAL 2 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 175.10 173.88 2hir n TYR 3 N -1.24 0.00 -3.96 5.22 4.02 -1.26 -5.16 117.16 114.78 2hir n TYR 3 Ca -0.03 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.90 2hir n TYR 3 Cb 0.65 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.98 2hir n TYR 3 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 2hir s THR 4 N 0.67 0.00 -0.02 -0.72 -1.32 -1.26 -5.09 115.64 107.89 2hir s THR 4 Ca 0.00 -0.08 -0.23 0.00 -1.21 0.00 0.00 61.69 60.16 2hir s THR 4 Cb 0.00 -2.86 -0.04 0.00 -1.51 0.00 0.00 72.50 68.09 2hir s THR 4 CO 0.00 0.00 0.70 -1.81 -2.21 0.00 0.00 174.62 171.30 2hir s ASP 5 N -3.79 7.05 0.97 8.08 1.01 -1.26 -2.75 116.67 125.97 2hir s ASP 5 Ca 0.29 1.26 -0.14 0.00 0.71 0.00 0.00 52.55 54.67 2hir s ASP 5 Cb 0.01 -2.42 -0.02 0.00 1.01 0.00 0.00 42.92 41.50 2hir s ASP 5 CO -0.02 -0.04 0.05 0.00 0.21 0.00 0.00 175.17 175.37 2hir n THR 7 N -3.30 0.00 -3.42 0.00 5.66 -1.26 -4.68 114.28 107.28 2hir n THR 7 Ca 0.04 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 61.06 2hir n THR 7 Cb 0.54 0.27 -0.03 0.00 -1.55 0.00 0.00 70.33 69.56 2hir n THR 7 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 2hir s GLU 8 N 0.00 0.40 0.99 1.09 2.12 -1.26 -4.82 118.70 117.21 2hir s GLU 8 Ca 0.00 0.94 -0.16 0.00 0.36 0.00 0.00 54.97 56.12 2hir s GLU 8 Cb 0.00 0.56 -0.06 0.00 0.26 0.00 0.00 34.13 34.89 2hir s GLU 8 CO 0.00 -0.20 -0.30 0.43 -0.54 0.00 0.00 175.26 174.66 2hir n SER 9 N 5.22 -4.05 0.00 -1.70 7.64 -1.26 -2.78 113.62 116.68 2hir n SER 9 Ca -0.09 0.22 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2hir n SER 9 Cb 0.51 -0.94 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 2hir n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hir n GLY 10 N 2.58 2.88 0.00 0.23 0.00 0.23 -4.88 105.19 106.23 2hir n GLY 10 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2hir n GLY 10 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2hir n GLN 11 N -0.13 -0.98 0.00 1.61 6.02 -1.12 -4.01 117.38 118.77 2hir n GLN 11 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2hir n GLN 11 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2hir n GLN 11 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2hir n ASN 12 N -2.65 0.00 -0.71 1.08 3.02 -1.05 -1.15 115.26 113.80 2hir n ASN 12 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.58 2hir n ASN 12 Cb 0.00 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.29 2hir n ASN 12 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2hir n LEU 13 N -0.31 1.94 -4.95 3.41 4.77 -1.26 -1.51 117.00 119.09 2hir n LEU 13 Ca 0.00 -0.98 -0.23 0.00 -0.03 0.00 0.00 56.01 54.77 2hir n LEU 13 Cb 0.00 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 40.74 2hir n LEU 13 CO 0.00 0.35 0.15 0.00 -1.33 0.00 0.00 177.39 176.56 2hir n LEU 15 N -1.91 5.24 0.00 0.00 4.77 -1.11 -1.35 117.00 122.65 2hir n LEU 15 Ca 0.06 -3.79 0.00 0.00 -0.03 0.00 0.00 56.01 52.24 2hir n LEU 15 Cb 0.63 -1.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 2hir n LEU 15 CO 0.40 0.16 0.00 0.00 -1.33 0.00 0.00 177.39 176.61 2hir s GLU 17 N -0.73 3.01 4.77 0.00 0.41 -1.15 -4.64 118.70 120.37 2hir s GLU 17 Ca 0.00 -0.83 0.00 0.00 -0.41 0.00 0.00 54.97 53.73 2hir s GLU 17 Cb 0.00 -5.23 0.00 0.00 -1.78 0.00 0.00 34.13 27.12 2hir s GLU 17 CO 0.00 -2.97 0.00 0.41 -0.49 0.00 0.00 175.26 172.21 2hir n GLY 18 N 6.60 1.50 0.17 -1.39 0.00 -1.26 -2.21 105.19 108.60 2hir n GLY 18 Ca 0.39 -0.67 0.14 0.00 0.00 0.00 0.00 46.02 45.89 2hir n GLY 18 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2hir n SER 19 N 1.58 0.51 -4.88 1.61 2.88 -1.26 -4.69 113.62 109.38 2hir n SER 19 Ca 0.00 -1.25 -0.32 0.00 -1.33 0.00 0.00 58.87 55.98 2hir n SER 19 Cb 0.00 -0.01 -0.05 0.00 -0.75 0.00 0.00 64.21 63.40 2hir n SER 19 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2hir s ASN 20 N -1.90 6.62 0.41 -3.46 0.01 -0.94 -4.81 114.94 110.86 2hir s ASN 20 Ca 0.41 0.93 -0.19 0.00 -0.71 0.00 0.00 52.86 53.29 2hir s ASN 20 Cb 0.20 -2.23 -0.10 0.00 0.41 0.00 0.00 41.25 39.53 2hir s ASN 20 CO 0.33 -0.09 0.90 -0.69 -1.51 0.00 0.00 177.10 176.04 2hir s VAL 21 N -1.85 4.46 0.00 1.60 1.01 -1.26 -1.62 120.40 122.74 2hir s VAL 21 Ca 0.47 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.81 2hir s VAL 21 Cb -0.11 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.66 2hir s VAL 21 CO 0.22 -0.31 0.00 0.00 0.00 0.00 0.00 175.10 175.01 2hir s GLY 23 N 0.00 -0.48 0.57 0.00 0.00 -0.61 -4.82 107.32 101.99 2hir s GLY 23 Ca 0.00 2.59 -0.13 0.00 0.00 0.00 0.00 44.72 47.18 2hir s GLY 23 CO 0.00 3.62 -0.37 -0.18 0.00 0.00 0.00 173.10 176.17 2hir n GLN 24 N 5.39 0.00 0.00 2.90 7.27 -1.26 -1.17 117.38 130.52 2hir n GLN 24 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.01 2hir n GLN 24 Cb 0.53 -0.74 0.00 0.00 2.41 0.00 0.00 30.24 32.44 2hir n GLN 24 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2hir n GLY 25 N 2.25 2.24 0.00 1.69 0.00 -1.20 -4.98 105.19 105.19 2hir n GLY 25 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2hir n GLY 25 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2hir n ASN 26 N 0.00 0.80 -3.40 1.61 5.15 -0.31 -4.47 115.26 114.64 2hir n ASN 26 Ca 0.00 -0.21 -0.16 0.00 -0.60 0.00 0.00 54.58 53.61 2hir n ASN 26 Cb 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.15 2hir n ASN 26 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2hir s LYS 27 N 1.32 0.31 0.62 1.20 2.20 0.29 -1.67 119.74 124.01 2hir s LYS 27 Ca 0.00 0.04 -0.14 0.00 -0.36 0.00 0.00 55.97 55.51 2hir s LYS 27 Cb 0.00 -0.71 -0.03 0.00 -1.51 0.00 0.00 37.83 35.58 2hir s LYS 27 CO 0.00 -0.91 1.04 0.00 -0.36 0.00 0.00 175.35 175.13 2hir s ILE 29 N -2.75 0.00 -0.47 0.00 -1.09 -0.91 0.74 121.20 116.72 2hir s ILE 29 Ca 0.60 0.13 -0.18 0.00 -2.23 0.00 0.00 60.65 58.97 2hir s ILE 29 Cb -0.14 -0.40 0.05 0.00 -1.58 0.00 0.00 42.46 40.39 2hir s ILE 29 CO 0.44 0.01 0.54 -0.76 -1.23 0.00 0.00 174.94 173.94 2hir s LEU 30 N 2.11 5.01 0.33 2.97 1.43 -1.26 0.13 118.68 129.40 2hir s LEU 30 Ca 0.04 -0.87 0.12 0.00 -1.03 0.00 0.00 54.13 52.38 2hir s LEU 30 Cb -0.14 -2.41 0.99 0.00 0.03 0.00 0.00 46.19 44.66 2hir s LEU 30 CO -0.06 -0.76 1.68 1.23 0.23 0.00 0.00 176.35 178.68 2hir h GLY 31 N 9.37 1.95 -5.44 -3.19 0.00 -1.82 -3.37 103.07 100.56 2hir h GLY 31 Ca -0.27 -0.24 0.06 0.00 0.00 0.00 0.00 47.33 46.88 2hir h GLY 31 CO 0.90 -0.41 -0.23 -0.45 0.00 0.00 0.00 176.54 176.35 2hir s SER 32 N -5.01 -0.74 -0.72 0.19 0.15 -1.26 -4.81 113.70 101.50 2hir s SER 32 Ca -0.10 -0.41 -0.09 0.00 0.70 0.00 0.00 55.95 56.04 2hir s SER 32 Cb 0.29 0.95 0.01 0.00 -1.71 0.00 0.00 66.02 65.56 2hir s SER 32 CO 0.79 -0.08 0.63 0.47 1.20 0.00 0.00 173.24 176.25 2hir n ASP 33 N 3.85 -5.50 0.00 5.45 9.92 -1.26 -1.96 116.55 127.05 2hir n ASP 33 Ca 0.08 -0.62 0.00 0.00 -0.53 0.00 0.00 54.79 53.72 2hir n ASP 33 Cb 0.61 -2.30 0.00 0.00 -0.64 0.00 0.00 41.12 38.80 2hir n ASP 33 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2hir n GLY 34 N -1.30 1.09 0.00 0.44 0.00 -1.26 -4.98 105.19 99.18 2hir n GLY 34 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2hir n GLY 34 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hir n GLU 35 N -2.00 0.00 -0.72 1.61 -0.58 -0.83 -4.25 120.64 113.88 2hir n GLU 35 Ca 0.00 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.68 2hir n GLU 35 Cb 0.00 0.00 -0.08 0.00 -0.57 0.00 0.00 31.44 30.79 2hir n GLU 35 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2hir n LYS 36 N 0.00 1.43 -1.53 3.49 5.02 -1.26 -4.76 118.16 120.56 2hir n LYS 36 Ca 0.00 -0.49 -0.56 0.00 -2.02 0.00 0.00 58.31 55.24 2hir n LYS 36 Cb 0.00 -1.51 -0.07 0.00 -0.02 0.00 0.00 35.03 33.42 2hir n LYS 36 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2hir n ASN 37 N 2.04 0.47 -4.04 4.39 4.05 -1.25 -2.82 115.26 118.11 2hir n ASN 37 Ca 0.21 1.15 -0.21 0.00 0.45 0.00 0.00 54.58 56.17 2hir n ASN 37 Cb 0.68 -1.01 -0.09 0.00 1.23 0.00 0.00 39.78 40.59 2hir n ASN 37 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 177.26 172.63 2hir s GLN 38 N 0.10 1.73 -0.41 1.20 2.00 0.12 -4.83 119.66 119.56 2hir s GLN 38 Ca 0.88 -2.01 0.09 0.00 -2.00 0.00 0.00 55.36 52.31 2hir s GLN 38 Cb -1.16 -0.33 0.27 0.00 0.80 0.00 0.00 33.01 32.59 2hir s GLN 38 CO 0.54 -0.45 0.59 0.00 -0.50 0.00 0.00 175.29 175.47 2hir s VAL 40 N -1.59 4.19 0.64 0.00 1.01 -0.51 -4.77 120.40 119.38 2hir s VAL 40 Ca 0.37 -0.24 -0.17 0.00 0.00 0.00 0.00 61.98 61.93 2hir s VAL 40 Cb 0.20 -2.88 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 2hir s VAL 40 CO -0.10 0.46 0.75 1.07 0.00 0.00 0.00 175.10 177.29 2hir n THR 41 N 3.77 2.80 0.00 3.92 5.66 -1.26 -0.54 114.28 128.63 2hir n THR 41 Ca -0.17 -0.46 0.00 0.00 -3.05 0.00 0.00 64.05 60.37 2hir n THR 41 Cb 0.52 -0.93 0.00 0.00 -1.55 0.00 0.00 70.33 68.37 2hir n THR 41 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2hir n GLY 42 N 1.47 0.19 0.00 1.09 0.00 -1.25 -4.43 105.19 102.26 2hir n GLY 42 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2hir n GLY 42 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hir n GLU 43 N 0.00 0.00 0.00 1.61 1.02 -0.67 -4.92 120.64 117.68 2hir n GLU 43 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2hir n GLU 43 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2hir n GLU 43 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hir n GLY 44 N 0.00 0.04 3.07 0.62 0.00 -0.69 -2.19 105.19 106.04 2hir n GLY 44 Ca 0.00 0.61 -0.17 0.00 0.00 0.00 0.00 46.02 46.45 2hir n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hir s THR 45 N 0.00 0.77 0.02 2.61 2.01 -1.26 -4.62 115.64 115.16 2hir s THR 45 Ca 0.00 -0.75 -0.30 0.00 0.31 0.00 0.00 61.69 60.95 2hir s THR 45 Cb 0.00 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.77 2hir s THR 45 CO 0.00 -0.02 1.02 -2.16 -0.69 0.00 0.00 174.62 172.77 2hir s PRO 46 N -0.86 4.54 0.16 4.92 0.04 -1.26 -2.53 135.00 140.01 2hir s PRO 46 Ca -0.01 1.49 -0.31 0.00 0.04 0.00 0.00 61.00 62.21 2hir s PRO 46 Cb -0.06 -3.43 -0.11 0.00 0.04 0.00 0.00 34.50 30.93 2hir s PRO 46 CO 0.00 -0.08 1.75 0.21 0.04 0.00 0.00 177.00 178.93 2hir s LYS 47 N 0.98 4.14 0.80 4.56 2.20 -1.26 -4.92 119.74 126.23 2hir s LYS 47 Ca 0.53 2.57 -0.14 0.00 -0.36 0.00 0.00 55.97 58.57 2hir s LYS 47 Cb -0.23 -3.34 0.05 0.00 -1.51 0.00 0.00 37.83 32.79 2hir s LYS 47 CO 0.28 -0.78 0.97 -2.30 -0.36 0.00 0.00 175.35 173.16 2hir n PRO 48 N 4.84 0.20 0.00 4.03 -0.02 -1.26 -5.06 135.00 137.73 2hir n PRO 48 Ca 0.17 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 2hir n PRO 48 Cb 0.37 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 2hir n PRO 48 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48