#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 3.84 0.00 2.52 1.01 -1.26 -5.01 120.40 121.50 2hir s VAL 2 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2hir s VAL 2 Cb 0.00 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.84 2hir s VAL 2 CO 0.00 -0.62 0.00 -1.22 0.00 0.00 0.00 175.10 173.26 2hir n TYR 3 N -2.69 0.00 -3.85 5.22 4.01 -1.26 -5.12 117.16 113.47 2hir n TYR 3 Ca 0.05 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.71 2hir n TYR 3 Cb 0.57 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.59 2hir n TYR 3 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2hir s THR 4 N 2.33 0.00 -0.04 -0.72 -4.23 -1.26 -5.07 115.64 106.65 2hir s THR 4 Ca 0.00 -1.03 -0.22 0.00 -1.18 0.00 0.00 61.69 59.25 2hir s THR 4 Cb 0.00 -2.35 -0.04 0.00 1.34 0.00 0.00 72.50 71.45 2hir s THR 4 CO 0.00 0.00 0.65 -1.81 -0.54 0.00 0.00 174.62 172.92 2hir s ASP 5 N -2.99 6.98 0.78 3.99 1.01 -1.26 -2.27 116.67 122.91 2hir s ASP 5 Ca 0.14 1.18 -0.15 0.00 0.71 0.00 0.00 52.55 54.42 2hir s ASP 5 Cb -0.05 -2.39 -0.02 0.00 1.01 0.00 0.00 42.92 41.47 2hir s ASP 5 CO 0.09 -0.02 0.55 0.00 0.21 0.00 0.00 175.17 176.01 2hir n THR 7 N -2.68 0.00 -3.63 0.00 5.66 -1.26 -5.01 114.28 107.36 2hir n THR 7 Ca 0.10 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.05 2hir n THR 7 Cb 0.51 0.45 -0.06 0.00 -1.55 0.00 0.00 70.33 69.67 2hir n THR 7 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2hir s GLU 8 N 0.00 0.62 0.89 1.09 2.02 -1.26 -5.14 118.70 116.91 2hir s GLU 8 Ca 0.00 1.20 -0.13 0.00 0.02 0.00 0.00 54.97 56.06 2hir s GLU 8 Cb 0.00 0.33 0.03 0.00 0.10 0.00 0.00 34.13 34.60 2hir s GLU 8 CO 0.00 -0.15 0.57 0.43 0.02 0.00 0.00 175.26 176.13 2hir n SER 9 N 4.56 -1.39 -0.00 -0.19 7.64 -1.26 -2.61 113.62 120.37 2hir n SER 9 Ca -0.17 0.42 -0.00 0.00 1.01 0.00 0.00 58.87 60.12 2hir n SER 9 Cb 0.56 -1.26 -0.00 0.00 -1.01 0.00 0.00 64.21 62.50 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 1.34 0.48 0.00 0.23 0.00 0.74 -4.82 105.19 103.16 2hir n GLY 10 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2hir n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2hir n GLN 11 N -2.94 0.29 0.01 1.61 -0.06 -1.07 0.29 117.38 115.51 2hir n GLN 11 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 2hir n GLN 11 Cb 0.01 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.19 2hir n GLN 11 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 2hir n ASN 12 N -1.39 -0.25 -0.49 1.69 3.02 0.59 -2.19 115.26 116.25 2hir n ASN 12 Ca 0.00 0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 2hir n ASN 12 Cb 0.00 0.63 0.00 0.00 -0.61 0.00 0.00 39.78 39.80 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 -2.43 0.79 -4.98 3.41 4.77 -1.26 -1.58 117.00 115.72 2hir n LEU 13 Ca 0.00 -0.40 -0.22 0.00 -0.03 0.00 0.00 56.01 55.37 2hir n LEU 13 Cb 0.00 -0.40 0.03 0.00 -2.33 0.00 0.00 43.42 40.73 2hir n LEU 13 CO 0.00 0.20 0.23 0.00 -1.33 0.00 0.00 177.39 176.49 2hir n LEU 15 N -2.05 6.69 0.00 0.00 4.77 -0.96 -1.74 117.00 123.71 2hir n LEU 15 Ca 0.09 -4.11 0.00 0.00 -0.03 0.00 0.00 56.01 51.97 2hir n LEU 15 Cb 0.62 -1.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 2hir n LEU 15 CO 0.40 1.02 0.21 0.00 -1.33 0.00 0.00 177.39 177.68 2hir s GLU 17 N -1.39 4.41 0.00 0.00 0.41 -1.18 -4.78 118.70 116.17 2hir s GLU 17 Ca 0.00 1.86 0.00 0.00 -0.41 0.00 0.00 54.97 56.42 2hir s GLU 17 Cb 0.00 -3.31 0.00 0.00 -1.78 0.00 0.00 34.13 29.04 2hir s GLU 17 CO 0.00 -0.29 0.00 0.41 -0.49 0.00 0.00 175.26 174.89 2hir n GLY 18 N 3.19 0.09 0.00 -1.39 0.00 -1.26 -0.05 105.19 105.77 2hir n GLY 18 Ca 0.09 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 0.23 1.19 -4.83 1.61 2.88 -1.26 -4.89 113.62 108.55 2hir n SER 19 Ca 0.00 -1.24 -0.37 0.00 -1.33 0.00 0.00 58.87 55.93 2hir n SER 19 Cb 0.00 0.00 -0.06 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 -0.24 6.92 0.23 -3.46 0.01 0.93 -4.86 114.94 114.47 2hir s ASN 20 Ca 0.00 1.16 -0.22 0.00 -0.71 0.00 0.00 52.86 53.09 2hir s ASN 20 Cb 0.00 -2.32 -0.08 0.00 0.41 0.00 0.00 41.25 39.25 2hir s ASN 20 CO 0.00 0.17 0.77 -0.69 -1.51 0.00 0.00 177.10 175.84 2hir s VAL 21 N -1.33 4.46 0.00 1.60 1.01 -1.26 -1.94 120.40 122.94 2hir s VAL 21 Ca 0.35 1.47 0.00 0.00 0.00 0.00 0.00 61.98 63.80 2hir s VAL 21 Cb -0.17 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.27 2hir s VAL 21 CO 0.19 0.26 0.00 0.00 0.00 0.00 0.00 175.10 175.55 2hir s GLY 23 N 0.00 -0.23 0.57 0.00 0.00 -1.16 -4.75 107.32 101.74 2hir s GLY 23 Ca 0.00 2.96 -0.13 0.00 0.00 0.00 0.00 44.72 47.55 2hir s GLY 23 CO 0.00 3.50 -0.36 -0.18 0.00 0.00 0.00 173.10 176.06 2hir n GLN 24 N 5.15 0.00 0.00 2.90 7.27 -1.26 -0.93 117.38 130.51 2hir n GLN 24 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.00 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 2.65 0.00 1.69 0.00 -1.26 -4.97 105.19 105.56 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 0.44 -3.16 1.61 5.15 -0.11 -2.79 115.26 116.41 2hir n ASN 26 Ca 0.00 0.00 0.03 0.00 -0.60 0.00 0.00 54.58 54.01 2hir n ASN 26 Cb 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.24 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 2.67 0.56 0.59 1.20 2.20 0.53 -1.34 119.74 126.15 2hir s LYS 27 Ca 0.00 0.69 -0.14 0.00 -0.36 0.00 0.00 55.97 56.16 2hir s LYS 27 Cb 0.00 0.33 -0.05 0.00 -1.51 0.00 0.00 37.83 36.60 2hir s LYS 27 CO 0.00 -0.90 1.02 0.00 -0.36 0.00 0.00 175.35 175.11 2hir s ILE 29 N -2.82 -0.36 -0.13 0.00 -1.09 0.10 0.26 121.20 117.16 2hir s ILE 29 Ca 0.58 0.26 -0.18 0.00 -2.23 0.00 0.00 60.65 59.09 2hir s ILE 29 Cb -0.12 -0.42 -0.04 0.00 -1.58 0.00 0.00 42.46 40.30 2hir s ILE 29 CO 0.43 0.09 0.47 -0.76 -1.23 0.00 0.00 174.94 173.94 2hir s LEU 30 N 2.37 4.26 0.00 2.97 1.43 -1.26 0.25 118.68 128.69 2hir s LEU 30 Ca 0.02 0.77 0.00 0.00 -1.03 0.00 0.00 54.13 53.90 2hir s LEU 30 Cb -0.12 -2.67 0.00 0.00 0.03 0.00 0.00 46.19 43.42 2hir s LEU 30 CO -0.08 -0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.10 2hir n GLY 31 N 3.35 -1.33 2.44 -3.19 0.00 -0.62 -4.67 105.19 101.17 2hir n GLY 31 Ca -0.07 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 2hir n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2hir s SER 32 N -0.49 1.77 -0.74 1.61 0.15 0.48 -4.91 113.70 111.59 2hir s SER 32 Ca 0.00 -3.13 -0.00 0.00 0.70 0.00 0.00 55.95 53.52 2hir s SER 32 Cb 0.00 -0.55 0.00 0.00 -1.71 0.00 0.00 66.02 63.76 2hir s SER 32 CO 0.00 -0.16 0.53 0.47 1.20 0.00 0.00 173.24 175.28 2hir n ASP 33 N 2.78 -4.22 0.00 5.45 8.00 -1.26 -1.68 116.55 125.62 2hir n ASP 33 Ca 0.29 -0.88 0.00 0.00 0.71 0.00 0.00 54.79 54.91 2hir n ASP 33 Cb 0.46 -1.41 0.00 0.00 -0.02 0.00 0.00 41.12 40.16 2hir n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2hir n GLY 34 N -1.52 0.74 2.59 0.44 0.00 -1.26 -5.02 105.19 101.16 2hir n GLY 34 Ca -0.29 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 2hir n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hir s GLU 35 N -0.89 0.63 0.00 1.61 2.02 -0.68 -4.95 118.70 116.45 2hir s GLU 35 Ca 0.00 -1.20 0.00 0.00 0.02 0.00 0.00 54.97 53.79 2hir s GLU 35 Cb 0.00 -1.60 0.00 0.00 0.10 0.00 0.00 34.13 32.63 2hir s GLU 35 CO 0.00 -1.11 0.58 1.63 0.02 0.00 0.00 175.26 176.38 2hir n LYS 36 N 4.42 0.61 0.00 1.61 5.02 -1.26 0.18 118.16 128.74 2hir n LYS 36 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2hir n LYS 36 Cb 0.39 -1.03 0.00 0.00 -0.02 0.00 0.00 35.03 34.37 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 -0.44 0.00 -4.53 4.39 4.05 -1.20 -2.66 115.26 114.87 2hir n ASN 37 Ca 0.00 0.00 -0.26 0.00 0.45 0.00 0.00 54.58 54.77 2hir n ASN 37 Cb 0.01 0.00 -0.10 0.00 1.23 0.00 0.00 39.78 40.92 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 0.00 1.80 -0.60 1.20 0.74 0.14 -4.79 119.66 118.15 2hir s GLN 38 Ca 0.00 -1.91 0.06 0.00 0.05 0.00 0.00 55.36 53.56 2hir s GLN 38 Cb 0.00 -1.72 0.24 0.00 1.10 0.00 0.00 33.01 32.63 2hir s GLN 38 CO 0.00 0.17 0.67 0.00 -0.55 0.00 0.00 175.29 175.59 2hir s VAL 40 N -2.10 5.14 0.00 0.00 1.01 0.15 -4.74 120.40 119.87 2hir s VAL 40 Ca 0.37 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.46 2hir s VAL 40 Cb 0.13 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 33.11 2hir s VAL 40 CO -0.05 0.35 0.00 1.07 0.00 0.00 0.00 175.10 176.47 2hir n THR 41 N 4.32 0.00 0.00 3.92 5.66 -1.26 0.20 114.28 127.11 2hir n THR 41 Ca -0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 2hir n THR 41 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 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 0.00 0.62 2.83 1.09 0.00 -1.12 -3.78 105.19 104.83 2hir n GLY 42 Ca 0.00 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.71 2hir n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hir s GLU 43 N -0.88 1.07 0.00 1.61 0.41 -0.76 -1.66 118.70 118.49 2hir s GLU 43 Ca 0.00 -1.50 0.00 0.00 -0.41 0.00 0.00 54.97 53.06 2hir s GLU 43 Cb 0.00 -2.46 0.00 0.00 -1.78 0.00 0.00 34.13 29.89 2hir s GLU 43 CO 0.00 -1.00 0.00 0.41 -0.49 0.00 0.00 175.26 174.18 2hir n GLY 44 N 4.43 0.71 3.54 -1.39 0.00 -0.45 -4.92 105.19 107.12 2hir n GLY 44 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 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 1.54 0.00 0.10 2.61 2.01 0.83 -4.89 115.64 117.84 2hir s THR 45 Ca 0.00 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.70 2hir s THR 45 Cb 0.00 -1.00 -0.06 0.00 0.01 0.00 0.00 72.50 71.45 2hir s THR 45 CO 0.00 0.00 1.07 -2.16 -0.69 0.00 0.00 174.62 172.84 2hir s PRO 46 N -1.35 4.57 0.20 4.92 0.04 -1.26 -0.30 135.00 141.81 2hir s PRO 46 Ca -0.05 1.62 -0.08 0.00 0.04 0.00 0.00 61.00 62.53 2hir s PRO 46 Cb -0.00 -3.35 0.12 0.00 0.04 0.00 0.00 34.50 31.31 2hir s PRO 46 CO 0.04 -0.01 1.72 -0.22 0.04 0.00 0.00 177.00 178.57 2hir h LYS 47 N 5.99 1.15 -7.02 4.56 3.11 -1.94 -3.43 116.57 118.98 2hir h LYS 47 Ca -0.43 -0.27 -0.52 0.00 -2.81 0.00 0.00 60.65 56.62 2hir h LYS 47 Cb 1.21 -0.15 0.09 0.00 -1.00 0.00 0.00 32.23 32.38 2hir h LYS 47 CO 0.75 1.01 0.54 -1.25 -2.81 0.00 0.00 179.45 177.68 2hir s PRO 48 N -5.34 3.51 0.00 1.90 0.05 -1.26 -5.08 135.00 128.78 2hir s PRO 48 Ca -0.12 1.97 0.00 0.00 0.05 0.00 0.00 61.00 62.90 2hir s PRO 48 Cb 0.15 -2.35 0.00 0.00 0.05 0.00 0.00 34.50 32.34 2hir s PRO 48 CO 0.85 -0.81 0.16 1.04 0.05 0.00 0.00 177.00 178.28