#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gk5 n SER 2 N 0.00 0.00 -3.72 1.20 2.88 -1.26 -5.07 113.62 107.66 1gk5 n SER 2 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 1gk5 n SER 2 Cb 0.00 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.34 1gk5 n SER 2 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1gk5 s TYR 3 N 0.00 2.23 0.67 0.66 6.14 -1.26 -5.11 117.35 120.68 1gk5 s TYR 3 Ca 0.00 -2.63 -0.07 0.00 0.64 0.00 0.00 57.07 55.01 1gk5 s TYR 3 Cb 0.00 -1.96 0.04 0.00 0.42 0.00 0.00 41.96 40.46 1gk5 s TYR 3 CO 0.00 -0.74 0.99 -1.25 0.64 0.00 0.00 175.55 175.19 1gk5 s PRO 4 N -0.07 2.53 0.00 4.97 0.04 -1.26 -5.07 135.00 136.14 1gk5 s PRO 4 Ca 0.21 -0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.19 1gk5 s PRO 4 Cb -0.17 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1gk5 s PRO 4 CO -0.06 -1.04 0.00 0.41 0.04 0.00 0.00 177.00 176.35 1gk5 n GLY 5 N -2.83 -2.03 3.73 0.56 0.00 -1.26 -5.12 105.19 98.25 1gk5 n GLY 5 Ca 0.07 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.41 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 -0.30 1.33 -0.34 0.00 0.04 -1.26 -4.97 135.00 129.50 1gk5 s PRO 7 Ca 0.66 1.33 0.06 0.00 0.04 0.00 0.00 61.00 63.09 1gk5 s PRO 7 Cb -0.51 -1.78 0.46 0.00 0.04 0.00 0.00 34.50 32.71 1gk5 s PRO 7 CO 0.47 -2.35 1.35 0.43 0.04 0.00 0.00 177.00 176.94 1gk5 n SER 8 N -4.02 4.77 -0.38 6.66 7.64 -1.26 -4.53 113.62 122.50 1gk5 n SER 8 Ca 0.10 -3.78 0.05 0.00 1.01 0.00 0.00 58.87 56.25 1gk5 n SER 8 Cb 0.53 -0.48 0.04 0.00 -1.01 0.00 0.00 64.21 63.28 1gk5 n SER 8 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1gk5 n SER 9 N -0.83 1.79 0.10 6.43 2.88 -1.26 -4.43 113.62 118.30 1gk5 n SER 9 Ca 0.43 -1.39 0.12 0.00 -1.33 0.00 0.00 58.87 56.70 1gk5 n SER 9 Cb 0.90 0.02 0.45 0.00 -0.75 0.00 0.00 64.21 64.84 1gk5 n SER 9 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1gk5 n TYR 10 N 0.52 0.71 -1.89 0.66 4.02 -1.26 -4.92 117.16 114.99 1gk5 n TYR 10 Ca 0.06 0.24 -0.02 0.00 -0.01 0.00 0.00 57.90 58.17 1gk5 n TYR 10 Cb 0.24 -0.89 0.01 0.00 -0.02 0.00 0.00 39.34 38.68 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 -2.11 -2.54 -4.00 7.72 -0.08 -1.26 -3.96 116.55 110.31 1gk5 n ASP 11 Ca 0.04 -0.11 -0.33 0.00 -1.51 0.00 0.00 54.79 52.88 1gk5 n ASP 11 Cb 0.31 -1.24 -0.02 0.00 2.34 0.00 0.00 41.12 42.51 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 -1.34 -0.46 0.09 0.27 0.00 -1.26 -4.84 105.19 97.66 1gk5 n GLY 12 Ca -0.02 0.22 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.40 -0.26 -2.82 1.61 3.20 -1.99 -3.40 116.97 111.91 1gk5 h TYR 13 Ca -0.56 0.00 -0.53 0.00 3.14 0.00 0.00 58.73 60.79 1gk5 h TYR 13 Cb 1.12 0.10 0.04 0.00 1.54 0.00 0.00 36.73 39.53 1gk5 h TYR 13 CO 0.34 -0.13 0.89 0.00 -1.64 0.00 0.00 178.16 177.62 1gk5 s LEU 15 N 1.44 2.71 -0.20 0.00 1.43 -1.24 -4.54 118.68 118.28 1gk5 s LEU 15 Ca 0.70 -1.39 -0.10 0.00 -1.03 0.00 0.00 54.13 52.31 1gk5 s LEU 15 Cb -0.42 -0.78 0.01 0.00 0.03 0.00 0.00 46.19 45.03 1gk5 s LEU 15 CO 0.31 -0.50 0.20 0.59 0.23 0.00 0.00 176.35 177.18 1gk5 n ASN 16 N -0.93 -6.75 -3.47 2.29 3.02 -1.26 -3.62 115.26 104.54 1gk5 n ASN 16 Ca -0.05 0.50 -0.22 0.00 -0.03 0.00 0.00 54.58 54.78 1gk5 n ASN 16 Cb 0.67 -2.69 0.05 0.00 -0.61 0.00 0.00 39.78 37.19 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 0.71 -1.10 3.24 7.41 0.00 -1.26 -4.55 105.19 109.64 1gk5 n GLY 17 Ca -0.01 0.51 -0.43 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.36 2.26 -0.38 -0.02 0.00 -1.24 -4.34 107.32 100.24 1gk5 s GLY 18 Ca 0.40 -2.83 -0.20 0.00 0.00 0.00 0.00 44.72 42.09 1gk5 s GLY 18 CO 0.81 1.16 0.60 0.14 0.00 0.00 0.00 173.10 175.82 1gk5 s VAL 19 N 0.93 4.90 0.31 1.40 1.01 -1.18 -4.86 120.40 122.90 1gk5 s VAL 19 Ca 0.10 0.36 -0.29 0.00 0.00 0.00 0.00 61.98 62.15 1gk5 s VAL 19 Cb -0.22 -4.09 -0.13 0.00 0.00 0.00 0.00 36.38 31.94 1gk5 s VAL 19 CO -0.02 -0.38 1.29 0.00 0.00 0.00 0.00 175.10 175.98 1gk5 s MET 21 N -1.45 0.44 -0.48 0.00 0.00 -0.53 -4.91 119.30 112.38 1gk5 s MET 21 Ca 0.59 -0.98 -0.26 0.00 0.00 0.00 0.00 55.69 55.05 1gk5 s MET 21 Cb -0.61 -1.15 0.03 0.00 0.00 0.00 0.00 34.83 33.11 1gk5 s MET 21 CO 0.59 -1.15 0.95 -1.58 0.00 0.00 0.00 175.02 173.83 1gk5 s HIS 22 N 1.48 2.89 -0.16 4.11 2.46 -1.26 -3.03 115.29 121.78 1gk5 s HIS 22 Ca 0.15 0.36 -0.24 0.00 0.47 0.00 0.00 55.06 55.80 1gk5 s HIS 22 Cb -0.20 -4.04 -0.02 0.00 -0.13 0.00 0.00 32.58 28.19 1gk5 s HIS 22 CO -0.12 -1.16 0.77 0.42 -2.47 0.00 0.00 174.74 172.18 1gk5 s ILE 23 N 3.88 4.93 0.12 0.89 1.01 -1.23 -4.95 121.20 125.86 1gk5 s ILE 23 Ca 0.37 1.51 -0.08 0.00 0.00 0.00 0.00 60.65 62.45 1gk5 s ILE 23 Cb -0.10 -4.08 -0.16 0.00 0.01 0.00 0.00 42.46 38.13 1gk5 s ILE 23 CO 0.26 0.07 1.32 -0.08 0.00 0.00 0.00 174.94 176.52 1gk5 h GLU 24 N 7.30 0.60 0.00 2.79 4.57 -1.95 -2.29 114.58 125.60 1gk5 h GLU 24 Ca -0.31 -0.54 0.00 0.00 -1.18 0.00 0.00 59.36 57.33 1gk5 h GLU 24 Cb 1.14 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1gk5 h GLU 24 CO 0.81 1.16 0.00 -1.13 -1.18 0.00 0.00 179.01 178.67 1gk5 n SER 25 N -3.86 0.00 -0.40 1.04 3.41 -1.26 -3.03 113.62 109.53 1gk5 n SER 25 Ca -0.07 0.30 0.39 0.00 -0.26 0.00 0.00 58.87 59.23 1gk5 n SER 25 Cb 0.78 0.00 0.71 0.00 -0.26 0.00 0.00 64.21 65.44 1gk5 n SER 25 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1gk5 h LEU 26 N 0.00 0.00 -1.82 1.04 -0.00 -2.01 -3.44 115.31 109.08 1gk5 h LEU 26 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.88 57.59 1gk5 h LEU 26 Cb 0.00 0.00 0.16 0.00 -0.00 0.00 0.00 40.66 40.82 1gk5 h LEU 26 CO 0.00 0.00 -0.73 -0.67 -0.00 0.00 0.00 178.44 177.04 1gk5 n ASP 27 N -3.83 -2.81 -1.12 -0.43 -0.08 -0.87 -5.01 116.55 102.40 1gk5 n ASP 27 Ca 0.30 -0.59 -0.01 0.00 -1.51 0.00 0.00 54.79 52.98 1gk5 n ASP 27 Cb 1.53 -4.80 -0.00 0.00 2.34 0.00 0.00 41.12 40.18 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 -2.99 -0.05 -4.17 1.67 2.88 -1.19 -5.05 113.62 104.72 1gk5 n SER 28 Ca -0.23 -1.11 -0.32 0.00 -1.33 0.00 0.00 58.87 55.87 1gk5 n SER 28 Cb 0.65 0.10 -0.17 0.00 -0.75 0.00 0.00 64.21 64.05 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 -2.93 2.62 0.14 0.66 5.04 -1.26 -3.48 117.35 118.14 1gk5 s TYR 29 Ca 0.02 -1.30 -0.00 0.00 -2.44 0.00 0.00 57.07 53.35 1gk5 s TYR 29 Cb 0.00 -1.78 -0.04 0.00 0.35 0.00 0.00 41.96 40.48 1gk5 s TYR 29 CO 0.01 -0.59 0.04 0.95 -1.34 0.00 0.00 175.55 174.62 1gk5 s THR 30 N 0.77 0.30 0.03 4.34 -4.23 -1.17 -5.05 115.64 110.63 1gk5 s THR 30 Ca -0.08 -1.93 0.02 0.00 -1.18 0.00 0.00 61.69 58.51 1gk5 s THR 30 Cb -0.16 -2.06 -0.02 0.00 1.34 0.00 0.00 72.50 71.60 1gk5 s THR 30 CO -0.01 -0.48 -0.06 0.00 -0.54 0.00 0.00 174.62 173.53 1gk5 s ASN 32 N -1.21 6.23 0.22 0.00 3.84 -1.01 -4.95 114.94 118.07 1gk5 s ASN 32 Ca -0.08 0.26 0.11 0.00 0.21 0.00 0.00 52.86 53.35 1gk5 s ASN 32 Cb -0.08 -2.14 -0.04 0.00 -0.55 0.00 0.00 41.25 38.44 1gk5 s ASN 32 CO 0.00 0.05 -0.15 0.00 -2.79 0.00 0.00 177.10 174.21 1gk5 s VAL 34 N -1.99 2.49 0.10 0.00 1.01 -1.26 -5.04 120.40 115.70 1gk5 s VAL 34 Ca 0.26 -0.51 -0.30 0.00 0.00 0.00 0.00 61.98 61.43 1gk5 s VAL 34 Cb -0.07 -2.99 -0.06 0.00 0.00 0.00 0.00 36.38 33.26 1gk5 s VAL 34 CO 0.14 0.00 1.18 -0.63 0.00 0.00 0.00 175.10 175.79 1gk5 s ILE 35 N -2.97 3.94 0.00 2.22 -1.09 -1.26 -3.16 121.20 118.89 1gk5 s ILE 35 Ca 0.59 1.47 0.00 0.00 -2.23 0.00 0.00 60.65 60.48 1gk5 s ILE 35 Cb -0.10 -3.94 0.00 0.00 -1.58 0.00 0.00 42.46 36.84 1gk5 s ILE 35 CO 0.41 0.16 0.00 0.61 -1.23 0.00 0.00 174.94 174.89 1gk5 n GLY 36 N 2.86 1.80 3.56 6.18 0.00 -1.26 -4.94 105.19 113.39 1gk5 n GLY 36 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.88 3.20 0.00 1.61 2.02 -1.19 0.21 117.35 121.33 1gk5 s TYR 37 Ca 0.00 -0.05 0.00 0.00 -0.37 0.00 0.00 57.07 56.65 1gk5 s TYR 37 Cb 0.00 -2.27 0.00 0.00 -0.40 0.00 0.00 41.96 39.29 1gk5 s TYR 37 CO 0.00 -0.14 0.00 0.43 -1.57 0.00 0.00 175.55 174.27 1gk5 n SER 38 N 4.65 0.03 -0.49 2.29 7.64 0.79 -4.77 113.62 123.76 1gk5 n SER 38 Ca -0.15 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.75 1gk5 n SER 38 Cb 0.52 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.71 1gk5 n SER 38 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gk5 n GLY 39 N 0.16 -1.77 3.63 0.23 0.00 -1.26 0.31 105.19 106.49 1gk5 n GLY 39 Ca 0.00 -1.29 -0.43 0.00 0.00 0.00 0.00 46.02 44.31 1gk5 n GLY 39 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gk5 s ASP 40 N -4.07 6.15 -0.85 1.61 2.15 -1.26 -2.14 116.67 118.26 1gk5 s ASP 40 Ca 0.00 1.96 -0.03 0.00 0.43 0.00 0.00 52.55 54.91 1gk5 s ASP 40 Cb 0.00 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.10 1gk5 s ASP 40 CO 0.00 -1.39 0.73 0.54 -0.17 0.00 0.00 175.17 174.88 1gk5 n ARG 41 N 7.92 -4.86 -1.45 4.34 1.74 -1.26 -2.24 116.66 120.84 1gk5 n ARG 41 Ca 0.22 0.57 -0.03 0.00 -0.77 0.00 0.00 57.85 57.84 1gk5 n ARG 41 Cb 0.44 -4.78 -0.01 0.00 -1.02 0.00 0.00 32.46 27.10 1gk5 n ARG 41 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1gk5 h GLU 43 N 0.00 -0.09 -5.33 0.00 4.57 -0.51 -3.34 114.58 109.89 1gk5 h GLU 43 Ca -0.05 0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 57.99 1gk5 h GLU 43 Cb 0.40 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 1gk5 h GLU 43 CO 0.07 0.28 0.61 1.58 -1.18 0.00 0.00 179.01 180.37 1gk5 n HIS 44 N -4.95 1.03 -2.48 0.92 -0.00 0.15 -4.77 115.22 105.11 1gk5 n HIS 44 Ca -0.08 0.02 -0.41 0.00 0.46 0.00 0.00 57.72 57.70 1gk5 n HIS 44 Cb 0.22 -2.33 -0.04 0.00 -0.12 0.00 0.00 29.99 27.72 1gk5 n HIS 44 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1gk5 s ALA 45 N 12.25 3.37 -0.34 1.57 0.00 -1.26 -0.15 121.76 137.20 1gk5 s ALA 45 Ca 1.01 0.83 0.16 0.00 0.00 0.00 0.00 51.96 53.96 1gk5 s ALA 45 Cb -0.27 -3.39 0.43 0.00 0.00 0.00 0.00 23.12 19.89 1gk5 s ALA 45 CO 0.19 -0.30 0.92 -3.47 0.00 0.00 0.00 175.76 173.10 1gk5 n ASP 46 N 2.91 1.15 -3.82 0.00 2.03 0.58 -4.93 116.55 114.46 1gk5 n ASP 46 Ca 0.05 -2.78 -0.12 0.00 0.52 0.00 0.00 54.79 52.45 1gk5 n ASP 46 Cb 0.46 -0.47 -0.13 0.00 -0.72 0.00 0.00 41.12 40.26 1gk5 n ASP 46 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1gk5 s LEU 47 N -2.96 1.46 -0.04 -2.67 2.96 -1.22 -4.62 118.68 111.59 1gk5 s LEU 47 Ca 0.30 0.26 0.05 0.00 -0.22 0.00 0.00 54.13 54.52 1gk5 s LEU 47 Cb 0.43 0.43 0.08 0.00 0.50 0.00 0.00 46.19 47.63 1gk5 s LEU 47 CO 0.01 -0.05 0.93 0.18 -1.32 0.00 0.00 176.35 176.10 1gk5 n LEU 48 N 3.10 1.10 0.00 -0.68 4.32 -1.26 -5.10 117.00 118.48 1gk5 n LEU 48 Ca -0.13 -1.58 0.00 0.00 -0.02 0.00 0.00 56.01 54.27 1gk5 n LEU 48 Cb 0.59 -0.12 0.00 0.00 -1.62 0.00 0.00 43.42 42.27 1gk5 n LEU 48 CO 0.22 0.38 0.00 0.00 -1.22 0.00 0.00 177.39 176.77