#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 7.54 0.25 1.61 0.01 -1.26 -5.04 113.70 116.81 2egm s SER 2 Ca 0.00 1.97 -0.22 0.00 1.31 0.00 0.00 55.95 59.01 2egm s SER 2 Cb 0.00 -2.61 0.03 0.00 0.21 0.00 0.00 66.02 63.65 2egm s SER 2 CO 0.00 0.05 0.75 -0.44 0.41 0.00 0.00 173.24 174.00 2egm s SER 3 N -0.83 -0.28 0.24 2.44 0.01 -1.26 -5.19 113.70 108.84 2egm s SER 3 Ca 0.43 -0.52 0.01 0.00 1.31 0.00 0.00 55.95 57.18 2egm s SER 3 Cb -0.27 0.68 -0.05 0.00 0.21 0.00 0.00 66.02 66.60 2egm s SER 3 CO 0.33 -1.24 0.09 -0.83 0.41 0.00 0.00 173.24 172.00 2egm s GLY 4 N -2.90 1.62 -0.27 3.44 0.00 -1.26 -5.07 107.32 102.88 2egm s GLY 4 Ca 0.10 -1.80 0.12 0.00 0.00 0.00 0.00 44.72 43.13 2egm s GLY 4 CO 0.04 -1.55 1.17 -1.26 0.00 0.00 0.00 173.10 171.51 2egm n SER 5 N -0.40 3.86 -4.77 1.64 2.88 -1.26 -5.08 113.62 110.49 2egm n SER 5 Ca -0.00 -3.28 -0.33 0.00 -1.33 0.00 0.00 58.87 53.92 2egm n SER 5 Cb 0.66 -0.38 0.04 0.00 -0.75 0.00 0.00 64.21 63.77 2egm n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2egm s SER 6 N -3.62 5.22 0.00 -3.46 1.04 -1.26 -5.04 113.70 106.59 2egm s SER 6 Ca 0.44 2.03 0.00 0.00 0.48 0.00 0.00 55.95 58.90 2egm s SER 6 Cb 0.38 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.95 2egm s SER 6 CO 0.01 -1.55 0.00 0.61 0.98 0.00 0.00 173.24 173.29 2egm n GLY 7 N -0.40 1.44 3.80 7.32 0.00 -1.26 -5.16 105.19 110.93 2egm n GLY 7 Ca 0.11 0.49 -0.33 0.00 0.00 0.00 0.00 46.02 46.28 2egm n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2egm s THR 8 N 0.00 3.77 0.25 2.61 -4.23 -1.26 -4.96 115.64 111.82 2egm s THR 8 Ca 0.00 0.95 0.21 0.00 -1.18 0.00 0.00 61.69 61.67 2egm s THR 8 Cb 0.00 -3.41 0.18 0.00 1.34 0.00 0.00 72.50 70.61 2egm s THR 8 CO 0.00 -0.39 1.84 1.55 -0.54 0.00 0.00 174.62 177.08 2egm h PRO 9 N 0.91 0.00 -6.54 3.99 0.13 -2.01 -3.44 132.00 125.04 2egm h PRO 9 Ca -0.48 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.13 2egm h PRO 9 Cb 1.22 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 2egm h PRO 9 CO 0.58 0.29 -0.03 0.20 -0.23 0.00 0.00 178.00 178.82 2egm s GLY 10 N -4.30 2.32 -0.37 1.56 0.00 -1.26 -5.05 107.32 100.22 2egm s GLY 10 Ca -0.01 -0.13 -0.15 0.00 0.00 0.00 0.00 44.72 44.43 2egm s GLY 10 CO 0.66 0.05 0.35 0.50 0.00 0.00 0.00 173.10 174.66 2egm s ARG 11 N -2.80 3.35 0.00 2.90 0.52 -1.26 -4.91 118.95 116.76 2egm s ARG 11 Ca 0.49 -0.62 0.00 0.00 -0.52 0.00 0.00 55.73 55.08 2egm s ARG 11 Cb -0.11 -3.87 0.00 0.00 0.52 0.00 0.00 34.95 31.49 2egm s ARG 11 CO 0.20 -0.62 0.00 0.41 0.02 0.00 0.00 175.30 175.30 2egm n GLY 12 N 5.05 2.16 3.59 -3.53 0.00 -1.26 -5.00 105.19 106.20 2egm n GLY 12 Ca -0.09 -1.46 -0.50 0.00 0.00 0.00 0.00 46.02 43.96 2egm n GLY 12 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2egm n SER 13 N 0.00 1.51 -3.90 1.61 2.88 -1.26 -4.97 113.62 109.49 2egm n SER 13 Ca 0.00 1.13 -0.20 0.00 -1.33 0.00 0.00 58.87 58.47 2egm n SER 13 Cb 0.00 -1.21 -0.09 0.00 -0.75 0.00 0.00 64.21 62.16 2egm n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2egm s ARG 14 N 0.00 1.70 0.17 -1.46 1.70 -1.26 -5.17 118.95 114.64 2egm s ARG 14 Ca 0.78 -1.99 0.02 0.00 -0.47 0.00 0.00 55.73 54.06 2egm s ARG 14 Cb -0.89 -0.13 -0.04 0.00 -0.57 0.00 0.00 34.95 33.32 2egm s ARG 14 CO 0.50 -0.50 0.31 0.08 -1.08 0.00 0.00 175.30 174.62 2egm s VAL 15 N -3.48 5.29 -0.23 4.99 1.01 -1.26 -5.03 120.40 121.69 2egm s VAL 15 Ca 0.34 -0.61 0.08 0.00 0.00 0.00 0.00 61.98 61.79 2egm s VAL 15 Cb 0.04 -3.74 -0.20 0.00 0.00 0.00 0.00 36.38 32.48 2egm s VAL 15 CO 0.19 -0.12 -0.11 1.07 0.00 0.00 0.00 175.10 176.13 2egm n THR 16 N -0.61 1.41 -2.89 3.92 5.66 -1.26 -4.31 114.28 116.20 2egm n THR 16 Ca -0.06 -0.67 -0.40 0.00 -3.05 0.00 0.00 64.05 59.87 2egm n THR 16 Cb 0.54 -1.04 -0.05 0.00 -1.55 0.00 0.00 70.33 68.23 2egm n THR 16 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 2egm s ASP 17 N -6.05 7.41 -0.61 1.09 1.47 -1.26 -3.94 116.67 114.77 2egm s ASP 17 Ca -0.25 1.68 -0.08 0.00 1.18 0.00 0.00 52.55 55.08 2egm s ASP 17 Cb 0.08 -2.53 0.08 0.00 -0.34 0.00 0.00 42.92 40.20 2egm s ASP 17 CO 0.67 0.09 0.19 0.00 0.68 0.00 0.00 175.17 176.80 2egm n GLN 18 N 2.18 -1.56 0.00 2.11 -0.00 -1.26 -4.75 117.38 114.10 2egm n GLN 18 Ca -0.02 0.05 0.00 0.00 -0.00 0.00 0.00 57.00 57.02 2egm n GLN 18 Cb 0.49 -2.99 0.00 0.00 -0.00 0.00 0.00 30.24 27.74 2egm n GLN 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2egm n GLY 19 N -0.59 0.30 2.98 2.61 0.00 -1.25 -4.25 105.19 104.99 2egm n GLY 19 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 0.24 -0.19 -0.61 -1.09 -1.26 -0.94 121.20 117.34 2egm s ILE 20 Ca 0.00 -0.76 -0.27 0.00 -2.23 0.00 0.00 60.65 57.40 2egm s ILE 20 Cb 0.00 -0.32 -0.00 0.00 -1.58 0.00 0.00 42.46 40.55 2egm s ILE 20 CO 0.00 -0.34 0.92 0.00 -1.23 0.00 0.00 174.94 174.29 2egm n PRO 22 N 5.68 0.49 -0.04 0.00 -0.04 -1.26 0.17 135.00 139.99 2egm n PRO 22 Ca 0.08 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.44 2egm n PRO 22 Cb 0.48 -1.13 -0.03 0.00 -0.04 0.00 0.00 33.50 32.77 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 -0.63 0.27 -0.00 0.54 5.02 -1.26 -4.79 118.16 117.30 2egm n LYS 23 Ca 0.03 0.11 0.07 0.00 -2.02 0.00 0.00 58.31 56.50 2egm n LYS 23 Cb 0.01 -0.96 -0.09 0.00 -0.02 0.00 0.00 35.03 33.98 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 -3.76 0.00 -3.31 2.13 8.25 -1.20 -5.01 115.22 112.32 2egm n HIS 24 Ca -0.17 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.12 2egm n HIS 24 Cb 0.49 -0.09 0.08 0.00 1.12 0.00 0.00 29.99 31.58 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 -1.51 -6.14 -5.00 -0.41 3.00 0.45 -4.96 117.38 102.81 2egm n GLN 25 Ca 0.01 0.73 -0.32 0.00 -0.01 0.00 0.00 57.00 57.41 2egm n GLN 25 Cb 0.26 -5.43 -0.15 0.00 0.00 0.00 0.00 30.24 24.93 2egm n GLN 25 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2egm s GLU 26 N -5.49 2.83 -0.47 -1.09 0.41 -1.25 -4.74 118.70 108.89 2egm s GLU 26 Ca 0.17 -0.77 -0.43 0.00 -0.41 0.00 0.00 54.97 53.53 2egm s GLU 26 Cb -0.07 -2.38 -0.18 0.00 -1.78 0.00 0.00 34.13 29.72 2egm s GLU 26 CO 0.63 0.39 2.13 0.00 -0.49 0.00 0.00 175.26 177.92 2egm n ALA 27 N 2.97 0.31 -1.85 5.21 0.00 -1.26 -2.56 120.51 123.33 2egm n ALA 27 Ca -0.18 0.16 -0.36 0.00 0.00 0.00 0.00 53.44 53.06 2egm n ALA 27 Cb 0.52 -2.16 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 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 6.10 3.31 -0.19 0.00 1.43 -0.12 -4.41 118.68 124.80 2egm s LEU 28 Ca 1.17 0.53 0.14 0.00 -1.03 0.00 0.00 54.13 54.95 2egm s LEU 28 Cb -1.38 -2.52 0.39 0.00 0.03 0.00 0.00 46.19 42.70 2egm s LEU 28 CO 0.64 -2.65 1.24 2.29 0.23 0.00 0.00 176.35 178.10 2egm n LYS 29 N 9.09 1.60 -3.89 1.70 2.85 -1.17 -4.39 118.16 123.96 2egm n LYS 29 Ca 0.28 -2.97 -0.09 0.00 -1.05 0.00 0.00 58.31 54.48 2egm n LYS 29 Cb 0.52 -1.61 -0.07 0.00 -0.65 0.00 0.00 35.03 33.22 2egm n LYS 29 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2egm s LEU 30 N -3.07 1.22 -0.05 -5.58 1.43 -1.00 -2.48 118.68 109.15 2egm s LEU 30 Ca 0.37 -0.72 -0.02 0.00 -1.03 0.00 0.00 54.13 52.72 2egm s LEU 30 Cb 0.34 1.11 0.04 0.00 0.03 0.00 0.00 46.19 47.70 2egm s LEU 30 CO -0.01 -0.79 0.09 0.12 0.23 0.00 0.00 176.35 175.99 2egm s PHE 31 N -3.90 -0.01 -0.21 0.29 5.36 0.16 -0.96 117.98 118.71 2egm s PHE 31 Ca 0.09 0.36 -0.29 0.00 -0.96 0.00 0.00 56.93 56.13 2egm s PHE 31 Cb 0.04 -0.42 -0.03 0.00 -0.34 0.00 0.00 43.02 42.28 2egm s PHE 31 CO -0.07 -0.22 1.63 0.00 -1.46 0.00 0.00 175.22 175.10 2egm n GLU 33 N 7.65 0.96 -0.05 0.00 1.02 -1.05 -0.08 120.64 129.10 2egm n GLU 33 Ca 0.19 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.28 2egm n GLU 33 Cb 0.45 -1.19 -0.07 0.00 -0.02 0.00 0.00 31.44 30.61 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 -0.69 0.63 0.19 2.62 0.31 -1.26 -4.67 118.33 115.46 2egm n VAL 34 Ca 0.09 -0.37 0.06 0.00 -0.01 0.00 0.00 64.34 64.11 2egm n VAL 34 Cb 0.04 -0.78 -0.09 0.00 -0.91 0.00 0.00 33.84 32.10 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 -2.41 1.59 -2.96 4.52 8.00 -1.19 -5.02 116.55 119.07 2egm n ASP 35 Ca -0.16 -0.26 -0.16 0.00 0.71 0.00 0.00 54.79 54.92 2egm n ASP 35 Cb 0.78 1.39 0.07 0.00 -0.02 0.00 0.00 41.12 43.35 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 -1.73 -5.75 -3.81 -1.24 1.02 0.88 -5.03 120.64 104.99 2egm n GLU 36 Ca -0.01 0.67 -0.13 0.00 -0.02 0.00 0.00 57.16 57.68 2egm n GLU 36 Cb 0.29 -5.21 -0.14 0.00 -0.02 0.00 0.00 31.44 26.36 2egm n GLU 36 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2egm s GLU 37 N -5.47 0.08 0.15 3.49 -1.05 -1.22 -4.97 118.70 109.70 2egm s GLU 37 Ca 0.19 0.19 -0.31 0.00 -0.15 0.00 0.00 54.97 54.88 2egm s GLU 37 Cb -0.08 -0.05 -0.10 0.00 -0.44 0.00 0.00 34.13 33.46 2egm s GLU 37 CO 0.58 -0.07 1.57 0.00 0.95 0.00 0.00 175.26 178.29 2egm s ALA 38 N 0.46 3.76 0.37 -0.84 0.00 -1.26 -2.20 121.76 122.04 2egm s ALA 38 Ca -0.03 1.34 0.04 0.00 0.00 0.00 0.00 51.96 53.30 2egm s ALA 38 Cb -0.05 -3.63 -0.05 0.00 0.00 0.00 0.00 23.12 19.40 2egm s ALA 38 CO -0.02 -0.80 0.08 0.96 0.00 0.00 0.00 175.76 175.98 2egm s ILE 39 N 1.30 0.98 0.54 0.00 -4.36 -0.13 -4.94 121.20 114.59 2egm s ILE 39 Ca 0.70 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 59.16 2egm s ILE 39 Cb -0.43 -2.60 0.05 0.00 1.25 0.00 0.00 42.46 40.73 2egm s ILE 39 CO 0.31 0.00 0.53 0.00 0.24 0.00 0.00 174.94 176.02 2egm h VAL 41 N 0.58 1.10 -0.06 0.00 -1.51 -1.86 -2.17 116.25 112.34 2egm h VAL 41 Ca -0.35 -0.32 -0.01 0.00 -1.23 0.00 0.00 66.70 64.79 2egm h VAL 41 Cb 1.30 0.08 -0.00 0.00 -2.13 0.00 0.00 31.29 30.54 2egm h VAL 41 CO 0.52 0.17 -0.01 0.58 -1.23 0.00 0.00 177.57 177.60 2egm h VAL 42 N 0.94 1.28 -0.55 7.19 2.07 -1.95 -2.67 116.25 122.57 2egm h VAL 42 Ca 0.32 -0.89 0.09 0.00 0.82 0.00 0.00 66.70 67.04 2egm h VAL 42 Cb 0.09 1.76 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 2egm h VAL 42 CO -0.10 0.24 0.14 0.00 0.02 0.00 0.00 177.57 177.88 2egm h ARG 44 N 0.29 0.63 -0.06 0.00 1.12 -1.38 -1.79 114.38 113.19 2egm h ARG 44 Ca 0.28 -0.04 -0.09 0.00 -1.11 0.00 0.00 59.98 59.02 2egm h ARG 44 Cb 0.37 -0.14 -0.01 0.00 -0.01 0.00 0.00 29.97 30.17 2egm h ARG 44 CO -0.33 0.42 -0.38 0.93 -3.11 0.00 0.00 179.97 177.50 2egm h GLU 45 N 0.65 0.12 -6.54 0.20 5.08 -0.92 -2.76 114.58 110.41 2egm h GLU 45 Ca 0.24 -0.05 -0.53 0.00 -1.00 0.00 0.00 59.36 58.02 2egm h GLU 45 Cb 0.07 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.33 2egm h GLU 45 CO -0.12 0.49 0.60 -1.12 -1.00 0.00 0.00 179.01 177.86 2egm s SER 46 N -6.90 7.02 0.48 1.42 0.01 0.49 -4.69 113.70 111.53 2egm s SER 46 Ca -0.04 2.15 0.40 0.00 1.31 0.00 0.00 55.95 59.77 2egm s SER 46 Cb 0.14 -2.59 1.39 0.00 0.21 0.00 0.00 66.02 65.17 2egm s SER 46 CO 0.75 -0.49 1.30 -1.14 0.41 0.00 0.00 173.24 174.07 2egm n ARG 47 N 3.58 0.00 -0.24 12.44 0.63 -1.26 0.27 116.66 132.07 2egm n ARG 47 Ca 0.08 0.92 0.03 0.00 -0.92 0.00 0.00 57.85 57.96 2egm n ARG 47 Cb 0.45 -2.14 0.12 0.00 0.45 0.00 0.00 32.46 31.34 2egm n ARG 47 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 2egm h SER 48 N 0.00 -0.47 0.00 6.15 0.02 -1.89 -2.83 113.55 114.53 2egm h SER 48 Ca 0.75 0.20 -0.08 0.00 -0.84 0.00 0.00 61.79 61.83 2egm h SER 48 Cb 3.14 0.38 -0.17 0.00 0.14 0.00 0.00 62.40 65.89 2egm h SER 48 CO -0.01 -0.20 -0.68 1.41 -1.14 0.00 0.00 176.83 176.21 2egm n HIS 49 N -5.39 0.00 -0.02 3.45 8.25 0.14 -4.82 115.22 116.83 2egm n HIS 49 Ca 0.11 -0.88 -0.17 0.00 -0.26 0.00 0.00 57.72 56.52 2egm n HIS 49 Cb 0.42 -0.18 -0.14 0.00 1.12 0.00 0.00 29.99 31.21 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 0.81 0.13 0.00 -0.41 1.63 -0.91 -3.31 116.57 114.51 2egm h LYS 50 Ca -0.10 -0.22 0.00 0.00 -0.85 0.00 0.00 60.65 59.49 2egm h LYS 50 Cb 1.42 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 33.13 2egm h LYS 50 CO 0.04 1.10 0.00 1.96 -3.45 0.00 0.00 179.45 179.11 2egm h GLN 51 N -0.73 0.00 -6.72 1.90 1.08 -1.86 -3.44 115.11 105.33 2egm h GLN 51 Ca -0.07 0.00 -0.49 0.00 -1.45 0.00 0.00 58.65 56.63 2egm h GLN 51 Cb 1.28 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.69 2egm h GLN 51 CO 0.06 0.00 0.34 -1.01 -0.95 0.00 0.00 178.83 177.27 2egm s HIS 52 N -3.44 3.97 -0.85 2.96 3.76 -1.25 -4.97 115.29 115.48 2egm s HIS 52 Ca 0.04 1.90 -0.25 0.00 -0.15 0.00 0.00 55.06 56.60 2egm s HIS 52 Cb 0.08 -2.98 0.00 0.00 1.11 0.00 0.00 32.58 30.80 2egm s HIS 52 CO 0.57 0.44 1.65 -1.12 -0.85 0.00 0.00 174.74 175.44 2egm s SER 53 N -1.09 5.77 0.39 1.40 0.01 -1.26 -4.93 113.70 113.99 2egm s SER 53 Ca 0.41 -0.67 -0.09 0.00 1.31 0.00 0.00 55.95 56.91 2egm s SER 53 Cb -0.26 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.36 2egm s SER 53 CO 0.32 -2.12 0.73 -0.69 0.41 0.00 0.00 173.24 171.88 2egm s VAL 54 N 7.50 4.84 0.08 3.43 1.01 -1.26 -2.52 120.40 133.49 2egm s VAL 54 Ca 0.55 0.47 0.04 0.00 0.00 0.00 0.00 61.98 63.04 2egm s VAL 54 Cb -0.06 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 2egm s VAL 54 CO 0.04 -0.51 -0.11 0.68 0.00 0.00 0.00 175.10 175.20 2egm s VAL 55 N -2.34 0.92 -0.44 2.92 -7.23 -0.58 -4.92 120.40 108.72 2egm s VAL 55 Ca 0.49 -1.40 -0.28 0.00 -1.81 0.00 0.00 61.98 58.99 2egm s VAL 55 Cb -0.10 -1.09 -0.01 0.00 0.56 0.00 0.00 36.38 35.73 2egm s VAL 55 CO 0.32 -0.40 1.76 -2.16 -0.31 0.00 0.00 175.10 174.31 2egm s PRO 56 N -2.14 3.12 0.00 4.82 0.04 -1.26 0.39 135.00 139.97 2egm s PRO 56 Ca -0.01 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.08 2egm s PRO 56 Cb -0.07 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.23 2egm s PRO 56 CO 0.01 -2.12 0.01 1.28 0.04 0.00 0.00 177.00 176.22