#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 2.32 0.00 1.55 1.01 -1.26 -5.15 120.40 118.87 4hir s VAL 2 Ca 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 61.98 60.08 4hir s VAL 2 Cb 0.00 -2.91 0.00 0.00 0.00 0.00 0.00 36.38 33.47 4hir s VAL 2 CO 0.00 -0.08 0.00 -1.22 0.00 0.00 0.00 175.10 173.80 4hir n TYR 3 N -1.05 -2.78 -3.47 5.22 4.01 -1.26 -5.13 117.16 112.71 4hir n TYR 3 Ca -0.03 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.51 4hir n TYR 3 Cb 0.64 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.70 4hir n TYR 3 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 4hir n THR 4 N -0.99 0.00 -2.89 -0.72 5.66 -1.26 -4.95 114.28 109.12 4hir n THR 4 Ca 0.00 -1.78 -0.28 0.00 -3.05 0.00 0.00 64.05 58.94 4hir n THR 4 Cb 0.00 -0.32 -0.02 0.00 -1.55 0.00 0.00 70.33 68.45 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 -3.93 6.38 1.10 1.09 1.11 -1.26 -2.55 116.67 118.61 4hir s ASP 5 Ca 0.39 0.91 -0.17 0.00 0.18 0.00 0.00 52.55 53.85 4hir s ASP 5 Cb -0.03 -2.23 0.24 0.00 1.07 0.00 0.00 42.92 41.97 4hir s ASP 5 CO 0.25 -0.43 1.17 0.00 1.18 0.00 0.00 175.17 177.34 4hir n THR 7 N -4.36 0.00 -3.57 0.00 -2.24 -1.26 -4.98 114.28 97.87 4hir n THR 7 Ca 0.13 -0.03 -0.09 0.00 -2.27 0.00 0.00 64.05 61.79 4hir n THR 7 Cb 0.59 0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 69.25 4hir n THR 7 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 4hir s GLU 8 N -1.59 1.22 0.82 -0.78 -1.05 -1.26 -5.16 118.70 110.90 4hir s GLU 8 Ca 0.00 -0.54 -0.10 0.00 -0.15 0.00 0.00 54.97 54.18 4hir s GLU 8 Cb 0.00 0.50 0.09 0.00 -0.44 0.00 0.00 34.13 34.28 4hir s GLU 8 CO 0.00 -0.54 1.11 -1.12 0.95 0.00 0.00 175.26 175.66 4hir s SER 9 N -2.73 3.96 0.00 0.83 0.01 -1.26 -3.56 113.70 110.95 4hir s SER 9 Ca 0.06 1.95 0.00 0.00 1.31 0.00 0.00 55.95 59.27 4hir s SER 9 Cb -0.02 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.67 4hir s SER 9 CO -0.06 -2.40 0.00 0.61 0.41 0.00 0.00 173.24 171.80 4hir n GLY 10 N -0.72 3.19 0.00 3.44 0.00 0.86 -4.83 105.19 107.13 4hir n GLY 10 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.32 -0.69 0.00 1.61 6.02 -1.23 -2.69 117.38 119.08 4hir n GLN 11 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 4hir n GLN 11 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 4hir n GLN 11 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 4hir n ASN 12 N -1.82 0.00 -2.05 1.08 2.85 0.74 -2.05 115.26 114.00 4hir n ASN 12 Ca 0.00 0.00 -0.08 0.00 -0.11 0.00 0.00 54.58 54.39 4hir n ASN 12 Cb 0.00 0.01 -0.11 0.00 1.24 0.00 0.00 39.78 40.92 4hir n ASN 12 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 4hir n LEU 13 N -1.16 4.01 0.00 1.20 4.77 -1.26 -3.12 117.00 121.44 4hir n LEU 13 Ca 0.00 -2.45 0.00 0.00 -0.03 0.00 0.00 56.01 53.53 4hir n LEU 13 Cb 0.00 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 40.04 4hir n LEU 13 CO 0.00 1.12 0.00 0.00 -1.33 0.00 0.00 177.39 177.18 4hir s LEU 15 N 0.00 1.95 0.02 0.00 1.43 -1.06 -2.08 118.68 118.95 4hir s LEU 15 Ca 0.00 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 4hir s LEU 15 Cb 0.00 -1.15 0.00 0.00 0.03 0.00 0.00 46.19 45.07 4hir s LEU 15 CO 0.00 0.16 0.00 0.00 0.23 0.00 0.00 176.35 176.74 4hir s GLU 17 N -1.19 3.68 7.62 0.00 0.41 -1.25 -4.88 118.70 123.09 4hir s GLU 17 Ca 0.00 -1.60 0.00 0.00 -0.41 0.00 0.00 54.97 52.96 4hir s GLU 17 Cb 0.00 -5.18 0.00 0.00 -1.78 0.00 0.00 34.13 27.17 4hir s GLU 17 CO 0.00 -2.01 0.00 0.41 -0.49 0.00 0.00 175.26 173.17 4hir n GLY 18 N 5.93 2.79 0.98 -1.39 0.00 -1.26 -2.38 105.19 109.86 4hir n GLY 18 Ca 0.32 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 46.20 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 7.90 3.01 -4.70 1.61 2.88 -1.26 -4.90 113.62 118.16 4hir n SER 19 Ca 0.00 -1.95 -0.42 0.00 -1.33 0.00 0.00 58.87 55.16 4hir n SER 19 Cb 0.00 -0.09 -0.03 0.00 -0.75 0.00 0.00 64.21 63.34 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 -1.81 7.30 0.42 -3.46 0.02 -1.00 -4.97 114.94 111.44 4hir s ASN 20 Ca 0.33 1.63 -0.22 0.00 -1.02 0.00 0.00 52.86 53.58 4hir s ASN 20 Cb 0.21 -2.56 -0.10 0.00 0.02 0.00 0.00 41.25 38.81 4hir s ASN 20 CO 0.31 -0.35 0.98 -0.69 0.02 0.00 0.00 177.10 177.36 4hir s VAL 21 N 1.42 4.18 -0.14 1.60 1.01 -1.26 -2.74 120.40 124.47 4hir s VAL 21 Ca 0.51 1.45 -0.06 0.00 0.00 0.00 0.00 61.98 63.89 4hir s VAL 21 Cb -0.20 -3.64 0.06 0.00 0.00 0.00 0.00 36.38 32.60 4hir s VAL 21 CO 0.24 -0.20 0.30 0.00 0.00 0.00 0.00 175.10 175.44 4hir n GLY 23 N 5.04 -1.82 3.54 0.00 0.00 -1.18 -4.11 105.19 106.66 4hir n GLY 23 Ca -0.12 0.65 -0.60 0.00 0.00 0.00 0.00 46.02 45.95 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 0.01 0.00 1.61 7.27 -1.26 0.23 117.38 125.24 4hir n GLN 24 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 4hir n GLN 24 Cb 0.00 -1.51 0.00 0.00 2.41 0.00 0.00 30.24 31.14 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 1.89 3.05 0.00 1.69 0.00 -1.26 -4.92 105.19 105.64 4hir n GLY 25 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 0.20 0.00 -3.93 1.61 5.03 0.64 -4.49 115.26 114.32 4hir n ASN 26 Ca 0.00 -0.23 -0.12 0.00 0.87 0.00 0.00 54.58 55.10 4hir n ASN 26 Cb 0.00 0.00 -0.13 0.00 -1.02 0.00 0.00 39.78 38.63 4hir n ASN 26 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 4hir s LYS 27 N 0.30 0.19 0.45 3.52 -2.85 0.33 -4.01 119.74 117.68 4hir s LYS 27 Ca 0.00 -0.25 -0.03 0.00 -1.00 0.00 0.00 55.97 54.69 4hir s LYS 27 Cb 0.00 -0.06 -0.03 0.00 -2.06 0.00 0.00 37.83 35.69 4hir s LYS 27 CO 0.00 0.01 0.72 0.00 0.10 0.00 0.00 175.35 176.18 4hir s ILE 29 N -2.64 -0.35 -0.09 0.00 -1.09 0.49 -0.10 121.20 117.42 4hir s ILE 29 Ca 0.46 -0.81 -0.15 0.00 -2.23 0.00 0.00 60.65 57.93 4hir s ILE 29 Cb -0.10 -0.82 -0.05 0.00 -1.58 0.00 0.00 42.46 39.91 4hir s ILE 29 CO 0.42 -0.55 0.37 -1.48 -1.23 0.00 0.00 174.94 172.47 4hir s LEU 30 N 1.80 4.34 -0.22 2.97 0.05 -1.26 0.14 118.68 126.50 4hir s LEU 30 Ca 0.14 0.74 -0.03 0.00 0.05 0.00 0.00 54.13 55.03 4hir s LEU 30 Cb -0.15 -2.50 0.01 0.00 -2.05 0.00 0.00 46.19 41.50 4hir s LEU 30 CO -0.15 0.17 0.05 0.61 -0.55 0.00 0.00 176.35 176.49 4hir n GLY 31 N 2.72 -3.61 0.00 -3.48 0.00 0.88 -4.08 105.19 97.62 4hir n GLY 31 Ca -0.12 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.56 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 1.12 0.00 -3.60 1.61 7.64 0.10 -4.57 113.62 115.91 4hir n SER 32 Ca -0.09 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.38 4hir n SER 32 Cb 0.22 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.39 4hir n SER 32 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 4hir n ASP 33 N 0.00 3.75 -1.09 6.43 5.75 -1.26 -3.11 116.55 127.02 4hir n ASP 33 Ca 0.00 -2.70 -0.10 0.00 -0.01 0.00 0.00 54.79 51.98 4hir n ASP 33 Cb 0.00 -1.36 -0.01 0.00 -1.03 0.00 0.00 41.12 38.72 4hir n ASP 33 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4hir n GLY 34 N 4.21 0.12 0.00 6.12 0.00 -1.26 -4.97 105.19 109.41 4hir n GLY 34 Ca 0.52 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.06 1.93 -2.57 1.61 1.02 -1.18 -5.12 120.64 114.27 4hir n GLU 35 Ca -0.12 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.82 4hir n GLU 35 Cb 0.55 0.00 0.10 0.00 -0.02 0.00 0.00 31.44 32.07 4hir n GLU 35 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 4hir n LYS 36 N 0.00 0.12 -4.05 3.49 4.76 -1.26 -4.03 118.16 117.19 4hir n LYS 36 Ca 0.00 -2.67 -0.22 0.00 -2.87 0.00 0.00 58.31 52.55 4hir n LYS 36 Cb 0.00 -0.51 -0.04 0.00 -1.84 0.00 0.00 35.03 32.64 4hir n LYS 36 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 4hir s ASN 37 N -4.71 5.68 0.07 4.39 0.01 -1.26 -0.08 114.94 119.03 4hir s ASN 37 Ca 0.61 -0.20 -0.26 0.00 -0.71 0.00 0.00 52.86 52.30 4hir s ASN 37 Cb -0.04 -1.46 0.08 0.00 0.41 0.00 0.00 41.25 40.24 4hir s ASN 37 CO 0.40 -0.07 0.69 -1.58 -1.51 0.00 0.00 177.10 175.02 4hir s GLN 38 N -3.89 1.12 -0.57 -0.60 0.74 0.12 -4.81 119.66 111.78 4hir s GLN 38 Ca 0.34 -0.26 -0.06 0.00 0.05 0.00 0.00 55.36 55.43 4hir s GLN 38 Cb -0.08 0.52 0.15 0.00 1.10 0.00 0.00 33.01 34.70 4hir s GLN 38 CO 0.26 -0.46 0.41 0.00 -0.55 0.00 0.00 175.29 174.95 4hir s VAL 40 N 0.59 5.03 0.43 0.00 0.11 0.21 -4.89 120.40 121.88 4hir s VAL 40 Ca 0.12 -0.30 -0.25 0.00 -2.93 0.00 0.00 61.98 58.63 4hir s VAL 40 Cb -0.21 -3.32 -0.08 0.00 -1.53 0.00 0.00 36.38 31.24 4hir s VAL 40 CO -0.03 0.35 1.28 0.28 -3.33 0.00 0.00 175.10 173.64 4hir s THR 41 N -1.24 2.68 -5.00 5.04 -1.32 -1.26 0.12 115.64 114.66 4hir s THR 41 Ca 0.24 0.57 0.00 0.00 -1.21 0.00 0.00 61.69 61.30 4hir s THR 41 Cb -0.12 -3.32 0.00 0.00 -1.51 0.00 0.00 72.50 67.54 4hir s THR 41 CO 0.16 0.06 0.00 0.61 -2.21 0.00 0.00 174.62 173.23 4hir n GLY 42 N 0.63 0.07 3.40 6.08 0.00 -1.26 -4.59 105.19 109.53 4hir n GLY 42 Ca 0.05 -1.39 -0.39 0.00 0.00 0.00 0.00 46.02 44.29 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 3.10 0.00 1.61 -1.05 -1.26 -3.86 118.70 115.25 4hir s GLU 43 Ca 0.00 -0.88 0.00 0.00 -0.15 0.00 0.00 54.97 53.94 4hir s GLU 43 Cb 0.00 -3.60 0.00 0.00 -0.44 0.00 0.00 34.13 30.09 4hir s GLU 43 CO 0.00 -0.53 0.00 0.41 0.95 0.00 0.00 175.26 176.09 4hir n GLY 44 N 4.97 3.95 3.01 -3.83 0.00 -1.26 -4.90 105.19 107.14 4hir n GLY 44 Ca -0.13 -2.16 -0.10 0.00 0.00 0.00 0.00 46.02 43.62 4hir n GLY 44 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 4hir s THR 45 N -0.19 0.09 1.12 2.61 -1.32 -1.09 -4.89 115.64 111.97 4hir s THR 45 Ca 0.00 -0.72 -0.14 0.00 -1.21 0.00 0.00 61.69 59.62 4hir s THR 45 Cb 0.00 -0.29 0.21 0.00 -1.51 0.00 0.00 72.50 70.91 4hir s THR 45 CO 0.00 -0.39 0.70 -2.65 -2.21 0.00 0.00 174.62 170.06 4hir n PRO 46 N 1.75 -1.90 -1.94 7.08 -0.01 -1.26 0.26 135.00 138.98 4hir n PRO 46 Ca -0.22 -0.52 -0.31 0.00 -0.01 0.00 0.00 63.50 62.43 4hir n PRO 46 Cb 0.56 -2.03 0.01 0.00 -0.01 0.00 0.00 33.50 32.02 4hir n PRO 46 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 175.50 174.28 4hir s GLU 47 N -4.09 3.61 1.24 -0.52 8.01 -1.26 -4.47 118.70 121.22 4hir s GLU 47 Ca 0.64 0.80 -0.16 0.00 0.01 0.00 0.00 54.97 56.26 4hir s GLU 47 Cb -0.21 -2.08 0.31 0.00 -4.31 0.00 0.00 34.13 27.83 4hir s GLU 47 CO 0.65 -0.56 1.01 -1.25 0.01 0.00 0.00 175.26 175.12 4hir s PRO 48 N -4.98 -1.53 0.00 0.39 0.04 -1.26 -5.05 135.00 122.60 4hir s PRO 48 Ca 0.56 0.49 0.16 0.00 0.04 0.00 0.00 61.00 62.25 4hir s PRO 48 Cb -0.11 -1.51 0.12 0.00 0.04 0.00 0.00 34.50 33.04 4hir s PRO 48 CO 0.50 -4.04 1.00 1.04 0.04 0.00 0.00 177.00 175.53