#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gk5 s SER 2 N 0.00 0.33 -0.43 6.41 1.04 -1.26 -5.10 113.70 114.69 1gk5 s SER 2 Ca 0.00 -0.04 0.08 0.00 0.48 0.00 0.00 55.95 56.47 1gk5 s SER 2 Cb 0.00 -0.08 0.18 0.00 0.10 0.00 0.00 66.02 66.22 1gk5 s SER 2 CO 0.00 -0.00 0.65 -0.47 0.98 0.00 0.00 173.24 174.40 1gk5 s TYR 3 N 0.23 -1.69 -0.60 5.02 5.04 -1.26 -4.98 117.35 119.11 1gk5 s TYR 3 Ca -0.02 0.05 0.00 0.00 -2.44 0.00 0.00 57.07 54.66 1gk5 s TYR 3 Cb -0.04 0.31 0.00 0.00 0.35 0.00 0.00 41.96 42.57 1gk5 s TYR 3 CO -0.01 -1.20 0.61 -2.30 -1.34 0.00 0.00 175.55 171.31 1gk5 n PRO 4 N 4.07 0.00 -0.61 4.97 -0.02 -1.26 -4.63 135.00 137.51 1gk5 n PRO 4 Ca 0.13 0.18 -0.29 0.00 -2.02 0.00 0.00 63.50 61.50 1gk5 n PRO 4 Cb 0.57 -1.69 0.17 0.00 -0.02 0.00 0.00 33.50 32.52 1gk5 n PRO 4 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gk5 n GLY 5 N -1.11 -2.59 3.57 -1.23 0.00 -1.26 -4.72 105.19 97.86 1gk5 n GLY 5 Ca 0.00 -0.83 -0.24 0.00 0.00 0.00 0.00 46.02 44.95 1gk5 n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gk5 s PRO 7 N -3.63 2.67 -0.34 0.00 0.05 -1.26 -5.02 135.00 127.47 1gk5 s PRO 7 Ca 0.32 -0.14 0.06 0.00 0.05 0.00 0.00 61.00 61.29 1gk5 s PRO 7 Cb -0.03 -2.26 0.46 0.00 0.05 0.00 0.00 34.50 32.72 1gk5 s PRO 7 CO 0.18 -0.86 1.32 0.45 0.05 0.00 0.00 177.00 178.14 1gk5 n SER 8 N -2.66 5.08 -0.19 6.66 2.88 -1.26 -4.53 113.62 119.59 1gk5 n SER 8 Ca 0.06 -3.77 0.03 0.00 -1.33 0.00 0.00 58.87 53.86 1gk5 n SER 8 Cb 0.59 -0.45 0.02 0.00 -0.75 0.00 0.00 64.21 63.61 1gk5 n SER 8 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1gk5 n SER 9 N -0.77 1.34 0.10 -3.46 3.41 -1.26 -4.50 113.62 108.48 1gk5 n SER 9 Ca 0.45 -1.17 0.12 0.00 -0.26 0.00 0.00 58.87 58.01 1gk5 n SER 9 Cb 0.92 0.08 0.45 0.00 -0.26 0.00 0.00 64.21 65.39 1gk5 n SER 9 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1gk5 n TYR 10 N 0.19 0.77 -1.93 7.33 4.02 -1.26 -4.92 117.16 121.35 1gk5 n TYR 10 Ca 0.03 0.26 -0.03 0.00 -0.01 0.00 0.00 57.90 58.16 1gk5 n TYR 10 Cb 0.13 -0.93 0.01 0.00 -0.02 0.00 0.00 39.34 38.53 1gk5 n TYR 10 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1gk5 n ASP 11 N -2.16 -2.49 -4.06 7.72 -0.08 -1.26 -3.94 116.55 110.27 1gk5 n ASP 11 Ca 0.04 -0.11 -0.34 0.00 -1.51 0.00 0.00 54.79 52.87 1gk5 n ASP 11 Cb 0.32 -1.25 -0.03 0.00 2.34 0.00 0.00 41.12 42.49 1gk5 n ASP 11 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1gk5 n GLY 12 N -1.31 -0.42 0.14 0.27 0.00 -1.26 -4.84 105.19 97.77 1gk5 n GLY 12 Ca -0.02 0.22 -0.05 0.00 0.00 0.00 0.00 46.02 46.17 1gk5 n GLY 12 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1gk5 h TYR 13 N -1.67 -0.37 -3.15 1.61 3.20 -1.99 -3.41 116.97 111.19 1gk5 h TYR 13 Ca -0.60 -0.00 -0.53 0.00 3.14 0.00 0.00 58.73 60.74 1gk5 h TYR 13 Cb 1.22 0.13 0.03 0.00 1.54 0.00 0.00 36.73 39.65 1gk5 h TYR 13 CO 0.38 -0.20 0.72 0.00 -1.64 0.00 0.00 178.16 177.43 1gk5 s LEU 15 N 0.53 2.46 -0.17 0.00 1.43 -1.21 -4.59 118.68 117.13 1gk5 s LEU 15 Ca 0.62 -1.41 -0.07 0.00 -1.03 0.00 0.00 54.13 52.24 1gk5 s LEU 15 Cb -0.38 -0.60 0.01 0.00 0.03 0.00 0.00 46.19 45.25 1gk5 s LEU 15 CO 0.35 -0.58 0.14 0.59 0.23 0.00 0.00 176.35 177.07 1gk5 n ASN 16 N -0.88 -6.89 -3.44 2.29 3.02 -1.26 -3.72 115.26 104.37 1gk5 n ASN 16 Ca -0.05 0.60 -0.21 0.00 -0.03 0.00 0.00 54.58 54.89 1gk5 n ASN 16 Cb 0.67 -2.82 0.05 0.00 -0.61 0.00 0.00 39.78 37.06 1gk5 n ASN 16 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gk5 n GLY 17 N 0.82 -1.11 3.34 7.41 0.00 -1.26 -4.46 105.19 109.92 1gk5 n GLY 17 Ca -0.00 0.52 -0.46 0.00 0.00 0.00 0.00 46.02 46.07 1gk5 n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gk5 s GLY 18 N -3.35 2.20 -0.29 -0.02 0.00 -1.24 -4.32 107.32 100.30 1gk5 s GLY 18 Ca 0.38 -2.74 -0.20 0.00 0.00 0.00 0.00 44.72 42.17 1gk5 s GLY 18 CO 0.80 1.35 0.60 0.14 0.00 0.00 0.00 173.10 175.99 1gk5 s VAL 19 N 1.44 4.98 0.43 1.40 1.01 -1.12 -4.90 120.40 123.63 1gk5 s VAL 19 Ca 0.11 0.87 -0.25 0.00 0.00 0.00 0.00 61.98 62.72 1gk5 s VAL 19 Cb -0.21 -3.95 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 1gk5 s VAL 19 CO -0.01 -0.07 1.12 0.00 0.00 0.00 0.00 175.10 176.14 1gk5 s MET 21 N -2.12 0.76 -0.30 0.00 0.00 -1.09 -4.85 119.30 111.69 1gk5 s MET 21 Ca 0.63 -0.87 -0.19 0.00 0.00 0.00 0.00 55.69 55.25 1gk5 s MET 21 Cb -0.53 -0.53 -0.01 0.00 0.00 0.00 0.00 34.83 33.75 1gk5 s MET 21 CO 0.57 -1.23 0.58 -1.58 0.00 0.00 0.00 175.02 173.36 1gk5 s HIS 22 N 1.32 3.22 -0.18 4.11 2.46 -1.26 -3.15 115.29 121.81 1gk5 s HIS 22 Ca 0.20 0.53 -0.20 0.00 0.47 0.00 0.00 55.06 56.05 1gk5 s HIS 22 Cb -0.10 -2.92 -0.03 0.00 -0.13 0.00 0.00 32.58 29.40 1gk5 s HIS 22 CO -0.05 -0.44 0.57 0.42 -2.47 0.00 0.00 174.74 172.77 1gk5 s ILE 23 N 2.51 5.07 0.14 0.89 1.01 -1.25 -4.96 121.20 124.62 1gk5 s ILE 23 Ca 0.23 1.09 -0.06 0.00 0.00 0.00 0.00 60.65 61.92 1gk5 s ILE 23 Cb -0.15 -3.90 -0.14 0.00 0.01 0.00 0.00 42.46 38.28 1gk5 s ILE 23 CO 0.11 0.17 1.36 -0.08 0.00 0.00 0.00 174.94 176.50 1gk5 h GLU 24 N 7.34 0.52 0.00 2.79 4.81 -1.96 -2.45 114.58 125.62 1gk5 h GLU 24 Ca -0.34 -0.46 0.00 0.00 -0.13 0.00 0.00 59.36 58.43 1gk5 h GLU 24 Cb 1.15 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1gk5 h GLU 24 CO 0.76 1.09 0.00 0.43 -0.73 0.00 0.00 179.01 180.56 1gk5 n SER 25 N -3.84 0.00 0.23 1.04 7.64 -1.26 -3.28 113.62 114.16 1gk5 n SER 25 Ca -0.06 0.32 0.09 0.00 1.01 0.00 0.00 58.87 60.24 1gk5 n SER 25 Cb 0.76 -0.07 0.32 0.00 -1.01 0.00 0.00 64.21 64.21 1gk5 n SER 25 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1gk5 h LEU 26 N 0.00 0.00 -1.67 -3.43 -0.00 -2.00 -3.43 115.31 104.78 1gk5 h LEU 26 Ca 0.00 0.00 -0.48 0.00 -0.00 0.00 0.00 57.88 57.40 1gk5 h LEU 26 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.62 1gk5 h LEU 26 CO 0.00 0.00 -0.85 -0.67 -0.00 0.00 0.00 178.44 176.92 1gk5 n ASP 27 N -2.79 -1.42 -1.10 -0.43 -0.08 -0.92 -4.95 116.55 104.85 1gk5 n ASP 27 Ca 0.04 -0.93 0.00 0.00 -1.51 0.00 0.00 54.79 52.38 1gk5 n ASP 27 Cb 0.90 -3.37 0.00 0.00 2.34 0.00 0.00 41.12 40.99 1gk5 n ASP 27 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1gk5 n SER 28 N -2.95 0.61 -4.05 1.67 2.88 -1.22 -5.05 113.62 105.52 1gk5 n SER 28 Ca -0.22 -0.84 -0.28 0.00 -1.33 0.00 0.00 58.87 56.20 1gk5 n SER 28 Cb 0.64 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.94 1gk5 n SER 28 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1gk5 s TYR 29 N -1.48 1.87 0.11 0.66 5.04 -1.26 -3.79 117.35 118.50 1gk5 s TYR 29 Ca 0.00 -0.85 -0.01 0.00 -2.44 0.00 0.00 57.07 53.76 1gk5 s TYR 29 Cb 0.00 -1.36 -0.04 0.00 0.35 0.00 0.00 41.96 40.91 1gk5 s TYR 29 CO 0.00 -0.44 0.04 0.95 -1.34 0.00 0.00 175.55 174.76 1gk5 s THR 30 N 0.96 0.13 0.03 4.34 -4.23 -1.19 -5.06 115.64 110.62 1gk5 s THR 30 Ca -0.08 -1.87 0.02 0.00 -1.18 0.00 0.00 61.69 58.58 1gk5 s THR 30 Cb -0.15 -1.91 -0.02 0.00 1.34 0.00 0.00 72.50 71.76 1gk5 s THR 30 CO -0.01 -0.59 -0.07 0.00 -0.54 0.00 0.00 174.62 173.41 1gk5 s ASN 32 N -1.47 6.35 0.19 0.00 3.84 -0.84 -4.95 114.94 118.06 1gk5 s ASN 32 Ca -0.11 0.40 0.10 0.00 0.21 0.00 0.00 52.86 53.47 1gk5 s ASN 32 Cb -0.10 -2.16 -0.04 0.00 -0.55 0.00 0.00 41.25 38.40 1gk5 s ASN 32 CO 0.00 0.09 -0.20 0.00 -2.79 0.00 0.00 177.10 174.20 1gk5 s VAL 34 N -1.98 2.32 0.12 0.00 1.01 -1.26 -5.04 120.40 115.56 1gk5 s VAL 34 Ca 0.19 -0.34 -0.30 0.00 0.00 0.00 0.00 61.98 61.53 1gk5 s VAL 34 Cb -0.06 -2.98 -0.06 0.00 0.00 0.00 0.00 36.38 33.28 1gk5 s VAL 34 CO 0.08 0.00 1.11 -0.63 0.00 0.00 0.00 175.10 175.66 1gk5 s ILE 35 N -3.19 4.08 0.00 2.22 -1.09 -1.26 -3.21 121.20 118.75 1gk5 s ILE 35 Ca 0.60 1.65 0.00 0.00 -2.23 0.00 0.00 60.65 60.68 1gk5 s ILE 35 Cb -0.10 -4.06 0.00 0.00 -1.58 0.00 0.00 42.46 36.72 1gk5 s ILE 35 CO 0.44 0.22 0.00 0.61 -1.23 0.00 0.00 174.94 174.98 1gk5 n GLY 36 N 2.52 1.98 3.66 6.18 0.00 -1.26 -4.77 105.19 113.49 1gk5 n GLY 36 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1gk5 n GLY 36 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gk5 s TYR 37 N -2.08 3.35 0.41 1.61 2.02 -1.20 0.11 117.35 121.56 1gk5 s TYR 37 Ca 0.00 0.52 0.04 0.00 -0.37 0.00 0.00 57.07 57.26 1gk5 s TYR 37 Cb 0.00 -2.49 -0.02 0.00 -0.40 0.00 0.00 41.96 39.05 1gk5 s TYR 37 CO 0.00 -0.03 0.13 0.45 -1.57 0.00 0.00 175.55 174.53 1gk5 s SER 38 N 1.13 2.81 0.00 2.29 0.15 -0.07 -4.78 113.70 115.23 1gk5 s SER 38 Ca 0.16 -1.68 0.00 0.00 0.70 0.00 0.00 55.95 55.13 1gk5 s SER 38 Cb -0.15 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 1gk5 s SER 38 CO 0.08 -0.94 0.00 0.61 1.20 0.00 0.00 173.24 174.19 1gk5 n GLY 39 N -0.92 2.82 0.40 9.45 0.00 -1.26 0.20 105.19 115.89 1gk5 n GLY 39 Ca -0.06 -1.75 0.13 0.00 0.00 0.00 0.00 46.02 44.34 1gk5 n GLY 39 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1gk5 h ASP 40 N 0.00 0.00 -0.42 1.61 2.03 -2.01 0.98 116.42 118.61 1gk5 h ASP 40 Ca 0.00 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 56.04 1gk5 h ASP 40 Cb 0.00 0.00 -0.40 0.00 -0.83 0.00 0.00 39.33 38.10 1gk5 h ASP 40 CO 0.00 0.00 -1.08 0.54 -1.03 0.00 0.00 179.24 177.67 1gk5 n ARG 41 N -2.88 1.76 -4.13 4.15 1.74 -1.26 -4.99 116.66 111.04 1gk5 n ARG 41 Ca 0.08 -3.45 -0.37 0.00 -0.77 0.00 0.00 57.85 53.35 1gk5 n ARG 41 Cb 1.09 -1.54 -0.03 0.00 -1.02 0.00 0.00 32.46 30.96 1gk5 n ARG 41 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1gk5 n GLU 43 N -4.72 0.65 -1.67 0.00 4.07 0.53 -4.43 120.64 115.08 1gk5 n GLU 43 Ca -0.23 0.27 -0.17 0.00 -0.06 0.00 0.00 57.16 56.97 1gk5 n GLU 43 Cb 0.64 -1.60 -0.06 0.00 -0.06 0.00 0.00 31.44 30.36 1gk5 n GLU 43 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 1gk5 s HIS 44 N -2.50 1.27 -0.13 4.31 2.46 0.26 -4.79 115.29 116.16 1gk5 s HIS 44 Ca -0.32 1.69 -0.29 0.00 0.47 0.00 0.00 55.06 56.61 1gk5 s HIS 44 Cb 0.09 -3.57 -0.02 0.00 -0.13 0.00 0.00 32.58 28.95 1gk5 s HIS 44 CO 0.62 -1.65 1.28 0.00 -2.47 0.00 0.00 174.74 172.51 1gk5 s ALA 45 N 13.69 3.63 -0.35 1.58 0.00 -1.26 -0.89 121.76 138.15 1gk5 s ALA 45 Ca 0.88 0.53 0.15 0.00 0.00 0.00 0.00 51.96 53.51 1gk5 s ALA 45 Cb -0.12 -3.61 0.41 0.00 0.00 0.00 0.00 23.12 19.80 1gk5 s ALA 45 CO 0.07 -1.10 0.90 -3.47 0.00 0.00 0.00 175.76 172.16 1gk5 n ASP 46 N 6.33 0.79 -4.54 0.00 2.03 0.29 -4.98 116.55 116.48 1gk5 n ASP 46 Ca 0.14 -2.86 -0.29 0.00 0.52 0.00 0.00 54.79 52.29 1gk5 n ASP 46 Cb 0.45 -0.33 0.22 0.00 -0.72 0.00 0.00 41.12 40.74 1gk5 n ASP 46 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1gk5 n LEU 47 N 0.05 0.33 -0.10 -2.67 4.77 -1.25 -4.50 117.00 113.63 1gk5 n LEU 47 Ca 0.14 0.06 0.04 0.00 -0.03 0.00 0.00 56.01 56.21 1gk5 n LEU 47 Cb 0.76 -1.34 0.05 0.00 -2.33 0.00 0.00 43.42 40.56 1gk5 n LEU 47 CO 0.21 -2.88 0.45 0.18 -1.33 0.00 0.00 177.39 174.03 1gk5 n LEU 48 N -4.64 1.53 0.00 2.23 4.32 -1.26 -5.03 117.00 114.15 1gk5 n LEU 48 Ca 0.06 -1.96 0.00 0.00 -0.02 0.00 0.00 56.01 54.10 1gk5 n LEU 48 Cb 0.53 -0.16 0.00 0.00 -1.62 0.00 0.00 43.42 42.18 1gk5 n LEU 48 CO 0.54 0.47 0.00 0.00 -1.22 0.00 0.00 177.39 177.18