#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 3.93 0.41 1.61 0.15 -1.26 -5.12 113.70 113.43 2egm s SER 2 Ca 0.00 -1.86 -0.21 0.00 0.70 0.00 0.00 55.95 54.57 2egm s SER 2 Cb 0.00 -0.89 -0.15 0.00 -1.71 0.00 0.00 66.02 63.26 2egm s SER 2 CO 0.00 -0.38 0.11 -0.24 1.20 0.00 0.00 173.24 173.93 2egm n SER 3 N 4.55 -2.77 0.00 5.45 2.88 -1.26 -4.70 113.62 117.77 2egm n SER 3 Ca 0.01 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.36 2egm n SER 3 Cb 0.40 -0.90 0.00 0.00 -0.75 0.00 0.00 64.21 62.97 2egm n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2egm n GLY 4 N 2.31 -1.27 3.61 0.46 0.00 -1.26 -5.08 105.19 103.96 2egm n GLY 4 Ca 0.11 -2.11 -0.09 0.00 0.00 0.00 0.00 46.02 43.93 2egm n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2egm s SER 5 N -4.00 -0.36 0.10 1.61 0.15 -1.26 -5.06 113.70 104.88 2egm s SER 5 Ca 0.00 0.54 -0.30 0.00 0.70 0.00 0.00 55.95 56.89 2egm s SER 5 Cb 0.00 0.50 -0.11 0.00 -1.71 0.00 0.00 66.02 64.70 2egm s SER 5 CO 0.00 -0.22 1.61 0.77 1.20 0.00 0.00 173.24 176.60 2egm h SER 6 N 3.24 -1.00 -3.68 5.45 4.64 -1.98 -3.48 113.55 116.74 2egm h SER 6 Ca -0.22 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 2egm h SER 6 Cb 1.17 0.36 0.00 0.00 -0.31 0.00 0.00 62.40 63.62 2egm h SER 6 CO 0.21 -0.47 0.00 0.61 -0.87 0.00 0.00 176.83 176.31 2egm n GLY 7 N -1.45 4.24 2.99 -0.77 0.00 -1.26 -5.13 105.19 103.80 2egm n GLY 7 Ca -0.08 -1.46 -0.21 0.00 0.00 0.00 0.00 46.02 44.27 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 -2.00 0.78 0.53 2.61 -1.32 -1.26 -5.14 115.64 109.84 2egm s THR 8 Ca 0.00 -0.33 -0.20 0.00 -1.21 0.00 0.00 61.69 59.94 2egm s THR 8 Cb 0.00 -0.72 -0.06 0.00 -1.51 0.00 0.00 72.50 70.21 2egm s THR 8 CO 0.00 0.25 1.13 -2.16 -2.21 0.00 0.00 174.62 171.64 2egm s PRO 9 N 0.37 3.42 0.00 7.08 0.04 -1.26 -5.06 135.00 139.59 2egm s PRO 9 Ca -0.06 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.62 2egm s PRO 9 Cb -0.10 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.37 2egm s PRO 9 CO 0.01 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.66 2egm n GLY 10 N 0.20 3.23 2.81 0.56 0.00 -1.26 -5.07 105.19 105.66 2egm n GLY 10 Ca 0.11 -2.06 -0.29 0.00 0.00 0.00 0.00 46.02 43.78 2egm n GLY 10 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2egm n ARG 11 N -0.15 2.17 0.00 1.61 0.63 -1.26 -4.94 116.66 114.72 2egm n ARG 11 Ca 0.00 -4.54 0.00 0.00 -0.92 0.00 0.00 57.85 52.39 2egm n ARG 11 Cb 0.00 -2.30 0.00 0.00 0.45 0.00 0.00 32.46 30.61 2egm n ARG 11 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2egm n GLY 12 N 1.69 1.26 3.34 5.14 0.00 -1.26 -5.08 105.19 110.29 2egm n GLY 12 Ca 0.23 0.31 -0.53 0.00 0.00 0.00 0.00 46.02 46.02 2egm n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2egm n SER 13 N 0.00 0.71 -4.48 1.61 3.41 -1.26 -4.81 113.62 108.81 2egm n SER 13 Ca 0.00 0.49 -0.44 0.00 -0.26 0.00 0.00 58.87 58.67 2egm n SER 13 Cb 0.00 -0.94 -0.02 0.00 -0.26 0.00 0.00 64.21 63.00 2egm n SER 13 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2egm s ARG 14 N 6.98 3.80 0.08 4.33 3.52 -1.26 -4.99 118.95 131.41 2egm s ARG 14 Ca 1.24 -2.01 0.06 0.00 -0.13 0.00 0.00 55.73 54.89 2egm s ARG 14 Cb -1.37 -5.06 -0.04 0.00 -1.56 0.00 0.00 34.95 26.93 2egm s ARG 14 CO 0.59 -1.85 -0.09 0.08 -0.81 0.00 0.00 175.30 173.22 2egm s VAL 15 N 2.63 3.42 0.00 7.11 1.01 -1.26 -5.01 120.40 128.30 2egm s VAL 15 Ca 0.39 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 61.21 2egm s VAL 15 Cb -0.03 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2egm s VAL 15 CO -0.05 0.17 0.00 1.07 0.00 0.00 0.00 175.10 176.29 2egm n THR 16 N 0.88 0.00 -1.14 3.92 5.66 -1.26 -4.99 114.28 117.35 2egm n THR 16 Ca -0.14 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.51 2egm n THR 16 Cb 0.52 -0.28 0.09 0.00 -1.55 0.00 0.00 70.33 69.11 2egm n THR 16 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 2egm n ASP 17 N -1.41 -0.91 -3.25 1.09 5.68 -1.26 -1.81 116.55 114.67 2egm n ASP 17 Ca 0.00 0.54 -0.22 0.00 -0.50 0.00 0.00 54.79 54.60 2egm n ASP 17 Cb 0.18 -1.28 -0.04 0.00 -1.14 0.00 0.00 41.12 38.84 2egm n ASP 17 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2egm n GLN 18 N -1.44 -1.35 0.00 0.11 10.64 -1.26 -4.80 117.38 119.28 2egm n GLN 18 Ca 0.10 0.07 0.00 0.00 -1.83 0.00 0.00 57.00 55.34 2egm n GLN 18 Cb 0.51 -3.57 0.00 0.00 -0.86 0.00 0.00 30.24 26.32 2egm n GLN 18 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2egm n GLY 19 N -0.75 0.93 3.04 2.61 0.00 -0.75 -4.14 105.19 106.13 2egm n GLY 19 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.01 -0.09 -0.61 -1.09 -1.26 -1.79 121.20 116.35 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 -0.26 -0.04 0.00 -1.58 0.00 0.00 42.46 40.58 2egm s ILE 20 CO 0.00 0.01 1.37 0.00 -1.23 0.00 0.00 174.94 175.09 2egm n PRO 22 N 6.23 0.49 -0.06 0.00 -0.04 -1.26 0.18 135.00 140.55 2egm n PRO 22 Ca 0.14 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.48 2egm n PRO 22 Cb 0.44 -1.17 -0.04 0.00 -0.04 0.00 0.00 33.50 32.70 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 0.30 -0.00 0.54 5.02 -1.26 -4.78 118.16 117.31 2egm n LYS 23 Ca 0.04 0.13 0.06 0.00 -2.02 0.00 0.00 58.31 56.52 2egm n LYS 23 Cb 0.02 -1.02 -0.09 0.00 -0.02 0.00 0.00 35.03 33.92 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 -3.79 0.00 -3.38 2.13 8.25 -1.19 -5.00 115.22 112.23 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 -0.11 0.06 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 -1.54 -6.43 -4.28 -0.41 3.00 0.48 -4.96 117.38 103.24 2egm n GLN 25 Ca 0.01 0.68 -0.34 0.00 -0.01 0.00 0.00 57.00 57.33 2egm n GLN 25 Cb 0.26 -5.25 -0.11 0.00 0.00 0.00 0.00 30.24 25.14 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 -6.06 3.58 -0.48 -1.09 8.01 -1.25 -4.72 118.70 116.69 2egm s GLU 26 Ca 0.47 -0.43 -0.43 0.00 0.01 0.00 0.00 54.97 54.59 2egm s GLU 26 Cb -0.21 -2.97 -0.18 0.00 -4.31 0.00 0.00 34.13 26.46 2egm s GLU 26 CO 0.58 0.38 2.14 0.00 0.01 0.00 0.00 175.26 178.38 2egm n ALA 27 N 3.15 0.32 -1.94 5.21 0.00 -1.26 -2.77 120.51 123.21 2egm n ALA 27 Ca -0.17 0.16 -0.41 0.00 0.00 0.00 0.00 53.44 53.02 2egm n ALA 27 Cb 0.53 -2.13 -0.03 0.00 0.00 0.00 0.00 19.45 17.81 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 6.14 3.43 -0.07 0.00 1.43 -0.74 -4.45 118.68 124.43 2egm s LEU 28 Ca 1.19 1.06 0.10 0.00 -1.03 0.00 0.00 54.13 55.44 2egm s LEU 28 Cb -1.42 -3.14 0.15 0.00 0.03 0.00 0.00 46.19 41.81 2egm s LEU 28 CO 0.64 -2.03 1.04 2.29 0.23 0.00 0.00 176.35 178.52 2egm n LYS 29 N 8.72 1.20 -4.06 1.70 0.00 -1.14 -4.36 118.16 120.22 2egm n LYS 29 Ca 0.24 -1.88 -0.11 0.00 -0.00 0.00 0.00 58.31 56.56 2egm n LYS 29 Cb 0.49 -1.11 -0.11 0.00 -0.00 0.00 0.00 35.03 34.30 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 -1.68 2.31 -0.09 -5.58 1.43 -1.02 -1.58 118.68 112.47 2egm s LEU 30 Ca 0.17 -0.65 -0.00 0.00 -1.03 0.00 0.00 54.13 52.61 2egm s LEU 30 Cb 0.15 -0.04 0.02 0.00 0.03 0.00 0.00 46.19 46.35 2egm s LEU 30 CO 0.02 -0.31 -0.06 0.12 0.23 0.00 0.00 176.35 176.35 2egm s PHE 31 N -2.00 1.22 -0.36 0.29 5.36 0.12 -0.14 117.98 122.46 2egm s PHE 31 Ca -0.07 -0.53 -0.29 0.00 -0.96 0.00 0.00 56.93 55.09 2egm s PHE 31 Cb -0.06 -1.05 0.00 0.00 -0.34 0.00 0.00 43.02 41.57 2egm s PHE 31 CO -0.02 -0.41 1.44 0.00 -1.46 0.00 0.00 175.22 174.78 2egm n GLU 33 N 7.91 0.74 -0.05 0.00 1.02 -1.05 0.65 120.64 129.85 2egm n GLU 33 Ca 0.17 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.26 2egm n GLU 33 Cb 0.47 -1.27 -0.08 0.00 -0.02 0.00 0.00 31.44 30.55 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 -0.77 0.69 0.20 2.62 0.31 -1.26 -4.65 118.33 115.46 2egm n VAL 34 Ca 0.10 -0.42 0.06 0.00 -0.01 0.00 0.00 64.34 64.07 2egm n VAL 34 Cb 0.04 -0.75 -0.08 0.00 -0.91 0.00 0.00 33.84 32.14 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 1.66 -3.11 4.52 8.00 -1.11 -5.02 116.55 119.09 2egm n ASP 35 Ca -0.17 -0.29 -0.18 0.00 0.71 0.00 0.00 54.79 54.86 2egm n ASP 35 Cb 0.82 1.34 0.07 0.00 -0.02 0.00 0.00 41.12 43.33 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 -1.67 -6.40 -3.85 -1.24 1.02 0.21 -5.02 120.64 103.68 2egm n GLU 36 Ca -0.01 0.71 -0.12 0.00 -0.02 0.00 0.00 57.16 57.72 2egm n GLU 36 Cb 0.26 -5.37 -0.14 0.00 -0.02 0.00 0.00 31.44 26.17 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 -5.80 -0.01 0.11 3.49 -1.05 -1.23 -4.96 118.70 109.25 2egm s GLU 37 Ca 0.33 0.03 -0.31 0.00 -0.15 0.00 0.00 54.97 54.87 2egm s GLU 37 Cb -0.15 -0.04 -0.08 0.00 -0.44 0.00 0.00 34.13 33.42 2egm s GLU 37 CO 0.62 -0.03 1.41 0.00 0.95 0.00 0.00 175.26 178.22 2egm s ALA 38 N 0.17 3.61 0.41 -0.84 0.00 -1.26 -2.15 121.76 121.70 2egm s ALA 38 Ca -0.01 1.12 0.03 0.00 0.00 0.00 0.00 51.96 53.10 2egm s ALA 38 Cb -0.02 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 2egm s ALA 38 CO -0.00 -0.67 0.08 0.96 0.00 0.00 0.00 175.76 176.13 2egm s ILE 39 N 1.27 0.89 0.34 0.00 -4.36 0.80 -4.95 121.20 115.20 2egm s ILE 39 Ca 0.65 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 59.13 2egm s ILE 39 Cb -0.37 -2.43 -0.04 0.00 1.25 0.00 0.00 42.46 40.87 2egm s ILE 39 CO 0.30 0.00 0.14 0.00 0.24 0.00 0.00 174.94 175.62 2egm h VAL 41 N 1.56 0.11 -0.04 0.00 -1.51 -1.86 0.11 116.25 114.63 2egm h VAL 41 Ca -0.44 0.00 0.03 0.00 -1.23 0.00 0.00 66.70 65.06 2egm h VAL 41 Cb 1.25 0.11 -0.04 0.00 -2.13 0.00 0.00 31.29 30.49 2egm h VAL 41 CO 0.63 0.00 -0.18 0.58 -1.23 0.00 0.00 177.57 177.37 2egm h VAL 42 N -0.01 0.55 -0.31 7.19 2.07 -1.95 -1.80 116.25 121.99 2egm h VAL 42 Ca 0.40 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.99 2egm h VAL 42 Cb 0.63 0.55 -0.07 0.00 -1.52 0.00 0.00 31.29 30.88 2egm h VAL 42 CO -0.90 0.00 -0.16 0.00 0.02 0.00 0.00 177.57 176.53 2egm h ARG 44 N -0.12 0.59 0.00 0.00 1.12 -0.82 0.47 114.38 115.62 2egm h ARG 44 Ca 0.16 -0.04 -0.11 0.00 -1.11 0.00 0.00 59.98 58.88 2egm h ARG 44 Cb 0.37 -0.13 -0.02 0.00 -0.01 0.00 0.00 29.97 30.18 2egm h ARG 44 CO -0.39 0.39 -0.54 0.93 -3.11 0.00 0.00 179.97 177.25 2egm h GLU 45 N 0.61 0.00 -6.56 0.20 4.39 -0.36 -2.88 114.58 109.98 2egm h GLU 45 Ca 0.43 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.60 2egm h GLU 45 Cb 0.56 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.23 2egm h GLU 45 CO -0.34 0.54 0.67 -1.12 -1.16 0.00 0.00 179.01 177.61 2egm s SER 46 N -6.87 6.90 0.50 1.42 0.01 0.54 -4.66 113.70 111.53 2egm s SER 46 Ca -0.02 2.28 0.45 0.00 1.31 0.00 0.00 55.95 59.97 2egm s SER 46 Cb 0.13 -2.59 1.53 0.00 0.21 0.00 0.00 66.02 65.30 2egm s SER 46 CO 0.75 -0.58 1.39 -1.14 0.41 0.00 0.00 173.24 174.06 2egm n ARG 47 N 3.63 0.00 -0.26 12.44 0.63 -1.26 0.48 116.66 132.32 2egm n ARG 47 Ca 0.10 0.97 0.06 0.00 -0.92 0.00 0.00 57.85 58.05 2egm n ARG 47 Cb 0.43 -2.24 0.19 0.00 0.45 0.00 0.00 32.46 31.29 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 -0.13 0.00 6.15 0.02 -1.89 -2.85 113.55 114.85 2egm h SER 48 Ca 0.83 0.17 -0.10 0.00 -0.84 0.00 0.00 61.79 61.85 2egm h SER 48 Cb 3.36 0.26 -0.21 0.00 0.14 0.00 0.00 62.40 65.96 2egm h SER 48 CO -0.01 -0.11 -0.77 1.41 -1.14 0.00 0.00 176.83 176.21 2egm n HIS 49 N -5.24 0.00 -0.00 3.45 8.25 0.18 -4.82 115.22 117.04 2egm n HIS 49 Ca 0.15 -0.86 -0.18 0.00 -0.26 0.00 0.00 57.72 56.57 2egm n HIS 49 Cb 0.49 -0.18 -0.14 0.00 1.12 0.00 0.00 29.99 31.28 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 0.91 0.18 0.00 -0.41 1.63 -0.89 -3.32 116.57 114.66 2egm h LYS 50 Ca -0.12 -0.30 -0.03 0.00 -0.85 0.00 0.00 60.65 59.34 2egm h LYS 50 Cb 1.51 0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 33.25 2egm h LYS 50 CO 0.05 1.14 -0.16 1.96 -3.45 0.00 0.00 179.45 179.00 2egm h GLN 51 N -0.62 0.00 -6.81 1.90 1.08 -1.86 -3.45 115.11 105.35 2egm h GLN 51 Ca -0.10 0.00 -0.51 0.00 -1.45 0.00 0.00 58.65 56.59 2egm h GLN 51 Cb 1.40 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.85 2egm h GLN 51 CO 0.08 0.16 0.50 -1.01 -0.95 0.00 0.00 178.83 177.61 2egm s HIS 52 N -3.34 3.50 -0.96 2.96 3.76 -1.25 -4.93 115.29 115.02 2egm s HIS 52 Ca 0.04 1.65 -0.24 0.00 -0.15 0.00 0.00 55.06 56.36 2egm s HIS 52 Cb 0.07 -3.35 -0.01 0.00 1.11 0.00 0.00 32.58 30.41 2egm s HIS 52 CO 0.66 -0.76 1.74 0.45 -0.85 0.00 0.00 174.74 175.98 2egm s SER 53 N -0.78 5.71 0.40 1.40 0.15 -1.26 -4.94 113.70 114.38 2egm s SER 53 Ca 0.45 -1.03 -0.10 0.00 0.70 0.00 0.00 55.95 55.97 2egm s SER 53 Cb -0.33 -2.56 -0.06 0.00 -1.71 0.00 0.00 66.02 61.35 2egm s SER 53 CO 0.43 -2.23 0.76 -0.69 1.20 0.00 0.00 173.24 172.71 2egm s VAL 54 N 7.96 4.79 0.06 4.45 1.01 -1.26 -2.54 120.40 134.86 2egm s VAL 54 Ca 0.60 0.60 0.03 0.00 0.00 0.00 0.00 61.98 63.21 2egm s VAL 54 Cb -0.04 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 2egm s VAL 54 CO -0.04 -0.50 -0.09 0.68 0.00 0.00 0.00 175.10 175.15 2egm s VAL 55 N -2.35 0.68 -0.51 2.92 -7.23 -0.52 -4.93 120.40 108.45 2egm s VAL 55 Ca 0.51 -1.32 -0.27 0.00 -1.81 0.00 0.00 61.98 59.09 2egm s VAL 55 Cb -0.10 -0.93 -0.02 0.00 0.56 0.00 0.00 36.38 35.89 2egm s VAL 55 CO 0.31 -0.47 1.80 -2.16 -0.31 0.00 0.00 175.10 174.27 2egm s PRO 56 N -2.13 2.91 0.00 4.82 0.04 -1.26 0.13 135.00 139.51 2egm s PRO 56 Ca -0.04 0.87 0.00 0.00 0.04 0.00 0.00 61.00 61.88 2egm s PRO 56 Cb -0.07 -4.30 0.00 0.00 0.04 0.00 0.00 34.50 30.17 2egm s PRO 56 CO -0.00 -2.38 0.00 1.28 0.04 0.00 0.00 177.00 175.94