#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2egm s SER 2 N 0.00 5.70 0.59 1.61 0.01 -1.26 -4.94 113.70 115.41 2egm s SER 2 Ca 0.00 1.41 -0.19 0.00 1.31 0.00 0.00 55.95 58.48 2egm s SER 2 Cb 0.00 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.66 2egm s SER 2 CO 0.00 -1.84 1.06 -1.54 0.41 0.00 0.00 173.24 171.33 2egm n SER 3 N 10.94 1.22 0.00 2.44 3.41 -1.26 -4.95 113.62 125.41 2egm n SER 3 Ca 0.25 0.85 0.00 0.00 -0.26 0.00 0.00 58.87 59.71 2egm n SER 3 Cb 0.47 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 62.99 2egm n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2egm n GLY 4 N 1.17 -0.88 3.76 5.00 0.00 -1.26 -5.15 105.19 107.83 2egm n GLY 4 Ca 0.13 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 45.01 2egm n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2egm s SER 5 N -4.00 5.50 -0.51 1.61 1.04 -1.26 -5.01 113.70 111.07 2egm s SER 5 Ca 0.00 2.40 0.05 0.00 0.48 0.00 0.00 55.95 58.88 2egm s SER 5 Cb 0.00 -2.60 0.19 0.00 0.10 0.00 0.00 66.02 63.71 2egm s SER 5 CO 0.00 -1.39 0.45 -1.54 0.98 0.00 0.00 173.24 171.74 2egm n SER 6 N -1.22 0.97 0.00 7.02 3.41 -1.26 -5.09 113.62 117.45 2egm n SER 6 Ca 0.11 -2.75 0.00 0.00 -0.26 0.00 0.00 58.87 55.98 2egm n SER 6 Cb 0.49 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 2egm n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2egm n GLY 7 N 2.21 -0.40 3.69 5.00 0.00 -1.26 -5.00 105.19 109.43 2egm n GLY 7 Ca 0.26 -2.25 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 2egm n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2egm s THR 8 N -0.36 2.92 0.15 2.61 -1.32 -1.26 -4.91 115.64 113.47 2egm s THR 8 Ca 0.00 0.39 -0.10 0.00 -1.21 0.00 0.00 61.69 60.77 2egm s THR 8 Cb 0.00 -3.25 -0.04 0.00 -1.51 0.00 0.00 72.50 67.70 2egm s THR 8 CO 0.00 -0.00 1.49 1.55 -2.21 0.00 0.00 174.62 175.44 2egm h PRO 9 N 8.37 0.91 -0.71 7.08 0.13 -2.02 -3.49 132.00 142.27 2egm h PRO 9 Ca -0.43 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.22 2egm h PRO 9 Cb 1.20 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2egm h PRO 9 CO 0.93 1.13 0.00 0.41 -0.23 0.00 0.00 178.00 180.25 2egm n GLY 10 N 0.12 -0.79 1.07 1.56 0.00 -1.26 -5.09 105.19 100.80 2egm n GLY 10 Ca -0.02 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2egm n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2egm n ARG 11 N 0.14 0.00 0.00 1.61 5.12 -1.26 -5.14 116.66 117.14 2egm n ARG 11 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2egm n ARG 11 Cb 0.00 -0.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.85 2egm n ARG 11 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2egm n GLY 12 N 2.67 -0.06 3.44 -0.13 0.00 -1.26 -4.79 105.19 105.06 2egm n GLY 12 Ca 0.00 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.70 2egm n GLY 12 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2egm s SER 13 N -4.00 4.22 0.36 1.61 0.15 -1.26 -5.12 113.70 109.65 2egm s SER 13 Ca 0.00 -0.23 0.07 0.00 0.70 0.00 0.00 55.95 56.49 2egm s SER 13 Cb 0.00 -1.42 -0.02 0.00 -1.71 0.00 0.00 66.02 62.86 2egm s SER 13 CO 0.00 0.23 0.33 -0.13 1.20 0.00 0.00 173.24 174.87 2egm s ARG 14 N -0.02 2.69 0.65 5.44 1.81 -1.26 -5.13 118.95 123.13 2egm s ARG 14 Ca -0.02 -1.35 -0.11 0.00 -1.72 0.00 0.00 55.73 52.53 2egm s ARG 14 Cb -0.14 -2.47 0.15 0.00 -0.45 0.00 0.00 34.95 32.04 2egm s ARG 14 CO 0.04 0.00 0.88 1.33 -0.68 0.00 0.00 175.30 176.87 2egm n VAL 15 N -1.45 0.00 0.00 3.52 0.24 -1.26 -5.06 118.33 114.32 2egm n VAL 15 Ca 0.00 -0.66 0.00 0.00 -2.04 0.00 0.00 64.34 61.64 2egm n VAL 15 Cb 0.60 -1.66 0.00 0.00 -1.47 0.00 0.00 33.84 31.32 2egm n VAL 15 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 2egm n THR 16 N -3.20 0.00 -1.26 3.34 5.66 -1.26 -4.86 114.28 112.69 2egm n THR 16 Ca 0.11 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.16 2egm n THR 16 Cb 0.39 -1.19 0.07 0.00 -1.55 0.00 0.00 70.33 68.04 2egm n THR 16 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2egm n ASP 17 N -2.82 1.34 -2.55 1.09 2.03 -1.26 -4.79 116.55 109.58 2egm n ASP 17 Ca 0.00 -2.44 -0.16 0.00 0.52 0.00 0.00 54.79 52.70 2egm n ASP 17 Cb 0.41 -0.27 0.02 0.00 -0.72 0.00 0.00 41.12 40.56 2egm n ASP 17 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2egm n GLN 18 N -0.74 2.28 0.00 -0.67 6.02 -1.26 -4.60 117.38 118.41 2egm n GLN 18 Ca 0.08 -3.83 0.00 0.00 -0.01 0.00 0.00 57.00 53.23 2egm n GLN 18 Cb 0.61 -1.75 0.00 0.00 1.02 0.00 0.00 30.24 30.12 2egm n GLN 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2egm n GLY 19 N -0.33 1.55 3.16 1.08 0.00 -1.26 -4.33 105.19 105.06 2egm n GLY 19 Ca 0.23 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.13 2egm n GLY 19 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2egm s ILE 20 N 0.09 -0.01 -0.07 -0.61 -1.09 -1.26 -2.90 121.20 115.34 2egm s ILE 20 Ca 0.00 0.03 -0.30 0.00 -2.23 0.00 0.00 60.65 58.15 2egm s ILE 20 Cb 0.00 -0.41 -0.05 0.00 -1.58 0.00 0.00 42.46 40.42 2egm s ILE 20 CO 0.00 0.01 1.57 0.00 -1.23 0.00 0.00 174.94 175.29 2egm n PRO 22 N 6.95 0.49 -0.06 0.00 -0.04 -1.26 0.18 135.00 141.26 2egm n PRO 22 Ca 0.16 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.50 2egm n PRO 22 Cb 0.43 -1.17 -0.04 0.00 -0.04 0.00 0.00 33.50 32.68 2egm n PRO 22 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2egm n LYS 23 N -0.67 0.32 -0.00 0.54 5.02 -1.26 -4.78 118.16 117.32 2egm n LYS 23 Ca 0.04 0.14 0.07 0.00 -2.02 0.00 0.00 58.31 56.53 2egm n LYS 23 Cb 0.02 -1.04 -0.09 0.00 -0.02 0.00 0.00 35.03 33.90 2egm n LYS 23 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2egm n HIS 24 N -3.84 0.00 -3.39 2.13 8.25 -1.19 -5.00 115.22 112.17 2egm n HIS 24 Ca -0.22 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.05 2egm n HIS 24 Cb 0.55 -0.10 0.07 0.00 1.12 0.00 0.00 29.99 31.62 2egm n HIS 24 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2egm n GLN 25 N -1.53 -6.47 -4.43 -0.41 1.13 0.48 -4.97 117.38 101.18 2egm n GLN 25 Ca 0.01 0.67 -0.34 0.00 -1.94 0.00 0.00 57.00 55.40 2egm n GLN 25 Cb 0.26 -5.25 -0.12 0.00 0.11 0.00 0.00 30.24 25.24 2egm n GLN 25 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2egm s GLU 26 N -6.05 3.45 -0.48 -1.09 8.01 -1.25 -4.73 118.70 116.54 2egm s GLU 26 Ca 0.47 -0.51 -0.44 0.00 0.01 0.00 0.00 54.97 54.50 2egm s GLU 26 Cb -0.21 -2.85 -0.19 0.00 -4.31 0.00 0.00 34.13 26.58 2egm s GLU 26 CO 0.59 0.37 2.03 0.00 0.01 0.00 0.00 175.26 178.26 2egm n ALA 27 N 3.14 -0.04 -1.95 5.21 0.00 -1.26 -2.83 120.51 122.78 2egm n ALA 27 Ca -0.18 0.24 -0.42 0.00 0.00 0.00 0.00 53.44 53.08 2egm n ALA 27 Cb 0.53 -2.08 -0.03 0.00 0.00 0.00 0.00 19.45 17.87 2egm n ALA 27 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2egm s LEU 28 N 5.44 3.46 -0.07 0.00 1.43 -1.14 -4.48 118.68 123.33 2egm s LEU 28 Ca 1.16 1.19 0.10 0.00 -1.03 0.00 0.00 54.13 55.55 2egm s LEU 28 Cb -1.45 -3.30 0.17 0.00 0.03 0.00 0.00 46.19 41.64 2egm s LEU 28 CO 0.68 -1.90 1.08 2.29 0.23 0.00 0.00 176.35 178.73 2egm n LYS 29 N 8.61 0.65 -4.00 1.70 0.00 -1.11 -4.56 118.16 119.43 2egm n LYS 29 Ca 0.24 -1.86 -0.09 0.00 -0.00 0.00 0.00 58.31 56.61 2egm n LYS 29 Cb 0.48 -0.98 -0.11 0.00 -0.00 0.00 0.00 35.03 34.42 2egm n LYS 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2egm s LEU 30 N -1.44 2.25 -0.08 -5.58 1.43 -1.01 -1.97 118.68 112.29 2egm s LEU 30 Ca 0.18 -0.62 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 2egm s LEU 30 Cb 0.16 0.17 0.02 0.00 0.03 0.00 0.00 46.19 46.57 2egm s LEU 30 CO 0.00 -0.39 -0.07 0.12 0.23 0.00 0.00 176.35 176.25 2egm s PHE 31 N -2.13 1.16 -0.37 0.29 5.36 0.12 -0.26 117.98 122.16 2egm s PHE 31 Ca -0.10 -0.46 -0.29 0.00 -0.96 0.00 0.00 56.93 55.12 2egm s PHE 31 Cb -0.05 -0.98 0.01 0.00 -0.34 0.00 0.00 43.02 41.66 2egm s PHE 31 CO -0.03 -0.34 1.30 0.00 -1.46 0.00 0.00 175.22 174.68 2egm n GLU 33 N 7.62 0.80 -0.04 0.00 1.02 -0.91 0.41 120.64 129.54 2egm n GLU 33 Ca 0.15 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.24 2egm n GLU 33 Cb 0.47 -1.17 -0.06 0.00 -0.02 0.00 0.00 31.44 30.66 2egm n GLU 33 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2egm n VAL 34 N -0.67 0.56 0.36 2.62 0.31 -1.26 -4.68 118.33 115.56 2egm n VAL 34 Ca 0.07 -0.29 0.07 0.00 -0.01 0.00 0.00 64.34 64.17 2egm n VAL 34 Cb 0.03 -0.82 -0.09 0.00 -0.91 0.00 0.00 33.84 32.05 2egm n VAL 34 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2egm n ASP 35 N -2.49 1.14 -3.50 4.52 8.00 -1.16 -5.01 116.55 118.06 2egm n ASP 35 Ca -0.15 -0.46 -0.21 0.00 0.71 0.00 0.00 54.79 54.68 2egm n ASP 35 Cb 0.73 1.28 0.08 0.00 -0.02 0.00 0.00 41.12 43.19 2egm n ASP 35 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2egm n GLU 36 N -1.61 -7.42 -3.86 -1.24 -0.58 0.17 -5.01 120.64 101.09 2egm n GLU 36 Ca 0.00 0.82 -0.15 0.00 -0.42 0.00 0.00 57.16 57.42 2egm n GLU 36 Cb 0.28 -5.83 -0.15 0.00 -0.57 0.00 0.00 31.44 25.16 2egm n GLU 36 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 2egm s GLU 37 N -5.97 0.07 0.30 3.49 -1.05 -1.23 -4.96 118.70 109.34 2egm s GLU 37 Ca 0.38 0.08 -0.30 0.00 -0.15 0.00 0.00 54.97 54.99 2egm s GLU 37 Cb -0.17 -0.23 -0.11 0.00 -0.44 0.00 0.00 34.13 33.19 2egm s GLU 37 CO 0.72 -0.09 1.51 0.00 0.95 0.00 0.00 175.26 178.34 2egm s ALA 38 N 0.66 3.66 0.35 -0.84 0.00 -1.26 -2.58 121.76 121.74 2egm s ALA 38 Ca -0.06 1.47 0.05 0.00 0.00 0.00 0.00 51.96 53.43 2egm s ALA 38 Cb -0.08 -3.60 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 2egm s ALA 38 CO -0.02 -0.89 0.21 0.96 0.00 0.00 0.00 175.76 176.02 2egm s ILE 39 N -0.27 0.22 0.41 0.00 -4.36 0.64 -4.94 121.20 112.89 2egm s ILE 39 Ca 0.59 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 59.06 2egm s ILE 39 Cb -0.45 -2.44 -0.05 0.00 1.25 0.00 0.00 42.46 40.77 2egm s ILE 39 CO 0.49 0.00 0.20 0.00 0.24 0.00 0.00 174.94 175.88 2egm h VAL 41 N 1.38 0.34 -0.16 0.00 -1.51 -1.86 -0.57 116.25 113.88 2egm h VAL 41 Ca -0.43 -0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.08 2egm h VAL 41 Cb 1.25 0.34 -0.04 0.00 -2.13 0.00 0.00 31.29 30.71 2egm h VAL 41 CO 0.68 0.00 -0.11 0.58 -1.23 0.00 0.00 177.57 177.49 2egm h VAL 42 N 0.00 0.67 -0.26 7.19 2.07 -1.95 -1.56 116.25 122.41 2egm h VAL 42 Ca 0.32 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.90 2egm h VAL 42 Cb 0.49 0.67 -0.07 0.00 -1.52 0.00 0.00 31.29 30.87 2egm h VAL 42 CO -0.68 0.00 -0.19 0.00 0.02 0.00 0.00 177.57 176.73 2egm h ARG 44 N -0.17 -0.02 -0.11 0.00 1.12 -0.90 -0.85 114.38 113.45 2egm h ARG 44 Ca 0.14 0.00 -0.05 0.00 -1.11 0.00 0.00 59.98 58.97 2egm h ARG 44 Cb 0.39 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.35 2egm h ARG 44 CO -0.37 -0.02 -0.14 0.93 -3.11 0.00 0.00 179.97 177.26 2egm h GLU 45 N -0.02 0.16 -6.55 0.20 5.08 -0.60 -2.54 114.58 110.31 2egm h GLU 45 Ca 0.14 -0.04 -0.53 0.00 -1.00 0.00 0.00 59.36 57.94 2egm h GLU 45 Cb 0.24 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 29.49 2egm h GLU 45 CO -0.31 0.31 0.65 -1.12 -1.00 0.00 0.00 179.01 177.54 2egm s SER 46 N -6.92 6.93 0.49 1.42 0.01 0.10 -4.67 113.70 111.07 2egm s SER 46 Ca -0.05 2.23 0.41 0.00 1.31 0.00 0.00 55.95 59.85 2egm s SER 46 Cb 0.16 -2.59 1.40 0.00 0.21 0.00 0.00 66.02 65.20 2egm s SER 46 CO 0.72 -0.56 1.32 -2.11 0.41 0.00 0.00 173.24 173.02 2egm n ARG 47 N 3.68 0.00 -0.27 12.44 1.85 -1.26 0.41 116.66 133.52 2egm n ARG 47 Ca 0.09 0.93 0.07 0.00 -1.00 0.00 0.00 57.85 57.95 2egm n ARG 47 Cb 0.44 -2.17 0.20 0.00 -1.05 0.00 0.00 32.46 29.88 2egm n ARG 47 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2egm h SER 48 N 0.00 -0.16 0.00 2.89 4.64 -1.89 -2.87 113.55 116.16 2egm h SER 48 Ca 0.76 0.18 -0.12 0.00 -0.47 0.00 0.00 61.79 62.14 2egm h SER 48 Cb 3.18 0.29 -0.27 0.00 -0.31 0.00 0.00 62.40 65.28 2egm h SER 48 CO -0.01 -0.14 -0.87 1.41 -0.87 0.00 0.00 176.83 176.35 2egm n HIS 49 N -5.26 0.00 -0.03 4.77 8.25 0.17 -4.84 115.22 118.27 2egm n HIS 49 Ca 0.16 -0.81 -0.16 0.00 -0.26 0.00 0.00 57.72 56.65 2egm n HIS 49 Cb 0.53 -0.18 -0.13 0.00 1.12 0.00 0.00 29.99 31.33 2egm n HIS 49 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2egm h LYS 50 N 1.00 0.11 0.00 -0.41 1.63 -0.78 -3.31 116.57 114.80 2egm h LYS 50 Ca -0.16 -0.17 -0.03 0.00 -0.85 0.00 0.00 60.65 59.43 2egm h LYS 50 Cb 1.62 0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 33.31 2egm h LYS 50 CO 0.07 1.06 -0.16 1.96 -3.45 0.00 0.00 179.45 178.93 2egm h GLN 51 N -0.76 0.00 -6.78 1.90 4.20 -1.86 -3.45 115.11 108.36 2egm h GLN 51 Ca -0.05 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.15 2egm h GLN 51 Cb 1.20 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.00 2egm h GLN 51 CO 0.05 0.16 0.50 -1.01 -0.67 0.00 0.00 178.83 177.87 2egm s HIS 52 N -3.45 3.51 -0.93 2.96 3.76 -1.25 -4.93 115.29 114.96 2egm s HIS 52 Ca 0.03 1.62 -0.24 0.00 -0.15 0.00 0.00 55.06 56.32 2egm s HIS 52 Cb 0.08 -3.34 -0.02 0.00 1.11 0.00 0.00 32.58 30.41 2egm s HIS 52 CO 0.64 -0.78 1.83 -1.12 -0.85 0.00 0.00 174.74 174.46 2egm s SER 53 N -0.63 5.47 0.27 1.40 0.01 -1.26 -4.92 113.70 114.04 2egm s SER 53 Ca 0.47 -0.87 -0.13 0.00 1.31 0.00 0.00 55.95 56.72 2egm s SER 53 Cb -0.33 -2.56 -0.08 0.00 0.21 0.00 0.00 66.02 63.26 2egm s SER 53 CO 0.41 -2.45 0.66 -0.69 0.41 0.00 0.00 173.24 171.58 2egm s VAL 54 N 8.86 4.77 0.09 3.43 1.01 -1.26 -2.14 120.40 135.16 2egm s VAL 54 Ca 0.64 0.80 0.05 0.00 0.00 0.00 0.00 61.98 63.48 2egm s VAL 54 Cb -0.05 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 2egm s VAL 54 CO -0.03 -0.08 -0.13 0.68 0.00 0.00 0.00 175.10 175.54 2egm s VAL 55 N -1.84 1.13 -0.51 2.92 -7.23 -0.28 -4.93 120.40 109.65 2egm s VAL 55 Ca 0.49 -1.46 -0.27 0.00 -1.81 0.00 0.00 61.98 58.93 2egm s VAL 55 Cb -0.11 -1.22 -0.02 0.00 0.56 0.00 0.00 36.38 35.58 2egm s VAL 55 CO 0.19 -0.33 1.80 -2.16 -0.31 0.00 0.00 175.10 174.30 2egm s PRO 56 N -2.13 2.91 0.00 4.82 0.04 -1.26 0.14 135.00 139.52 2egm s PRO 56 Ca 0.02 0.87 0.00 0.00 0.04 0.00 0.00 61.00 61.93 2egm s PRO 56 Cb -0.08 -4.30 0.00 0.00 0.04 0.00 0.00 34.50 30.16 2egm s PRO 56 CO 0.02 -2.38 0.00 1.28 0.04 0.00 0.00 177.00 175.96