#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 1.56 0.08 1.61 0.15 -1.26 -5.10 113.70 110.74 2egm s SER 2 Ca 0.00 -0.39 -0.36 0.00 0.70 0.00 0.00 55.95 55.90 2egm s SER 2 Cb 0.00 -0.12 -0.18 0.00 -1.71 0.00 0.00 66.02 64.01 2egm s SER 2 CO 0.00 0.06 1.03 -1.20 1.20 0.00 0.00 173.24 174.33 2egm n SER 3 N 2.15 0.24 0.03 5.45 7.64 -1.26 -4.82 113.62 123.04 2egm n SER 3 Ca -0.17 1.15 0.00 0.00 1.01 0.00 0.00 58.87 60.86 2egm n SER 3 Cb 0.55 -1.01 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 2egm n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2egm n GLY 4 N 1.82 -0.83 2.41 0.23 0.00 -1.26 -4.95 105.19 102.61 2egm n GLY 4 Ca 0.19 0.16 -0.31 0.00 0.00 0.00 0.00 46.02 46.06 2egm n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2egm n SER 5 N -2.64 7.15 -0.08 1.61 7.64 -1.26 -4.26 113.62 121.77 2egm n SER 5 Ca 0.00 -3.04 -0.15 0.00 1.01 0.00 0.00 58.87 56.69 2egm n SER 5 Cb 0.00 -1.33 -0.06 0.00 -1.01 0.00 0.00 64.21 61.81 2egm n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2egm n SER 6 N 1.63 1.42 0.00 6.43 2.88 -1.26 -5.06 113.62 119.66 2egm n SER 6 Ca 0.56 0.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.24 2egm n SER 6 Cb 0.45 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 2egm n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2egm n GLY 7 N 2.17 2.74 3.90 0.46 0.00 -1.26 -5.04 105.19 108.17 2egm n GLY 7 Ca -0.30 -0.74 -0.32 0.00 0.00 0.00 0.00 46.02 44.67 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 5.26 -1.52 2.61 -4.23 -1.26 -4.98 115.64 111.51 2egm s THR 8 Ca 0.00 -0.05 0.15 0.00 -1.18 0.00 0.00 61.69 60.61 2egm s THR 8 Cb 0.00 -3.61 0.29 0.00 1.34 0.00 0.00 72.50 70.51 2egm s THR 8 CO 0.00 0.14 1.40 -0.81 -0.54 0.00 0.00 174.62 174.80 2egm n PRO 9 N 0.37 0.26 0.00 3.99 -0.04 -1.26 -4.90 135.00 133.42 2egm n PRO 9 Ca -0.05 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 2egm n PRO 9 Cb 0.52 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 2egm n PRO 9 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2egm n GLY 10 N -0.03 3.47 3.53 0.55 0.00 -1.26 -5.16 105.19 106.28 2egm n GLY 10 Ca 0.08 -1.24 -0.25 0.00 0.00 0.00 0.00 46.02 44.61 2egm n GLY 10 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2egm s ARG 11 N -2.36 1.78 0.00 1.61 3.03 -1.26 -5.02 118.95 116.74 2egm s ARG 11 Ca 0.00 -1.90 0.00 0.00 2.03 0.00 0.00 55.73 55.86 2egm s ARG 11 Cb 0.00 -1.68 0.00 0.00 -1.03 0.00 0.00 34.95 32.24 2egm s ARG 11 CO 0.00 0.16 0.00 0.41 -1.13 0.00 0.00 175.30 174.74 2egm n GLY 12 N -0.75 0.62 3.54 3.88 0.00 -1.26 -5.00 105.19 106.22 2egm n GLY 12 Ca -0.05 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 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 6.42 0.29 1.61 0.15 -1.26 -5.03 113.70 111.87 2egm s SER 13 Ca 0.00 -0.12 -0.13 0.00 0.70 0.00 0.00 55.95 56.40 2egm s SER 13 Cb 0.00 -2.44 -0.08 0.00 -1.71 0.00 0.00 66.02 61.79 2egm s SER 13 CO 0.00 -1.13 0.67 -0.60 1.20 0.00 0.00 173.24 173.37 2egm s ARG 14 N 3.84 3.92 -0.20 5.44 3.52 -1.26 -5.08 118.95 129.13 2egm s ARG 14 Ca 0.34 0.52 -0.28 0.00 -0.13 0.00 0.00 55.73 56.18 2egm s ARG 14 Cb -0.11 -2.51 0.11 0.00 -1.56 0.00 0.00 34.95 30.88 2egm s ARG 14 CO 0.23 0.21 0.93 0.54 -0.81 0.00 0.00 175.30 176.40 2egm s VAL 15 N -1.93 0.00 0.65 7.11 0.11 -1.26 -5.15 120.40 119.93 2egm s VAL 15 Ca 0.52 0.00 -0.16 0.00 -2.93 0.00 0.00 61.98 59.41 2egm s VAL 15 Cb -0.11 -1.00 -0.13 0.00 -1.53 0.00 0.00 36.38 33.61 2egm s VAL 15 CO 0.19 0.00 -0.39 1.07 -3.33 0.00 0.00 175.10 172.64 2egm n THR 16 N 1.48 0.00 -2.77 5.04 5.66 -1.26 -4.86 114.28 117.57 2egm n THR 16 Ca -0.13 -0.44 -0.40 0.00 -3.05 0.00 0.00 64.05 60.02 2egm n THR 16 Cb 0.57 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.30 2egm n THR 16 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2egm s ASP 17 N -0.89 7.52 -1.03 1.09 1.01 -1.26 -4.99 116.67 118.12 2egm s ASP 17 Ca 0.44 1.81 -0.03 0.00 0.71 0.00 0.00 52.55 55.48 2egm s ASP 17 Cb -0.31 -2.58 0.31 0.00 1.01 0.00 0.00 42.92 41.35 2egm s ASP 17 CO 0.66 0.04 1.47 0.00 0.21 0.00 0.00 175.17 177.54 2egm n GLN 18 N 2.25 4.45 0.00 8.23 3.00 -1.26 -4.85 117.38 129.20 2egm n GLN 18 Ca -0.00 -4.59 0.00 0.00 -0.01 0.00 0.00 57.00 52.40 2egm n GLN 18 Cb 0.48 -2.48 0.00 0.00 0.00 0.00 0.00 30.24 28.24 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 1.08 0.70 3.07 1.08 0.00 -1.26 -4.54 105.19 105.32 2egm n GLY 19 Ca 0.29 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.19 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 0.24 0.02 -0.16 -0.61 -1.09 -1.26 -3.07 121.20 115.27 2egm s ILE 20 Ca 0.00 -0.20 -0.29 0.00 -2.23 0.00 0.00 60.65 57.93 2egm s ILE 20 Cb 0.00 -0.30 -0.02 0.00 -1.58 0.00 0.00 42.46 40.56 2egm s ILE 20 CO 0.00 -0.11 1.39 0.00 -1.23 0.00 0.00 174.94 174.99 2egm n PRO 22 N 6.91 0.49 -0.07 0.00 -0.04 -1.26 0.19 135.00 141.22 2egm n PRO 22 Ca 0.15 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.48 2egm n PRO 22 Cb 0.45 -1.15 -0.05 0.00 -0.04 0.00 0.00 33.50 32.71 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 -0.65 0.33 -0.00 0.54 5.02 -1.26 -4.78 118.16 117.35 2egm n LYS 23 Ca 0.04 0.14 0.06 0.00 -2.02 0.00 0.00 58.31 56.52 2egm n LYS 23 Cb 0.02 -1.06 -0.07 0.00 -0.02 0.00 0.00 35.03 33.89 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 -3.83 0.00 -3.24 2.13 8.25 -1.19 -5.02 115.22 112.33 2egm n HIS 24 Ca -0.24 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.06 2egm n HIS 24 Cb 0.59 -0.09 0.08 0.00 1.12 0.00 0.00 29.99 31.69 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 -1.49 -5.77 -5.24 -0.41 1.13 0.49 -4.97 117.38 101.12 2egm n GLN 25 Ca 0.01 0.72 -0.32 0.00 -1.94 0.00 0.00 57.00 55.47 2egm n GLN 25 Cb 0.22 -5.36 -0.17 0.00 0.11 0.00 0.00 30.24 25.04 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 -5.27 2.72 -0.49 -1.09 0.41 -1.25 -4.77 118.70 108.97 2egm s GLU 26 Ca 0.06 -0.89 -0.46 0.00 -0.41 0.00 0.00 54.97 53.27 2egm s GLU 26 Cb -0.03 -2.20 -0.19 0.00 -1.78 0.00 0.00 34.13 29.93 2egm s GLU 26 CO 0.62 0.31 1.76 0.00 -0.49 0.00 0.00 175.26 177.46 2egm n ALA 27 N 3.16 -0.83 -2.13 5.21 0.00 -1.26 -2.96 120.51 121.70 2egm n ALA 27 Ca -0.18 0.40 -0.39 0.00 0.00 0.00 0.00 53.44 53.27 2egm n ALA 27 Cb 0.52 -1.99 -0.03 0.00 0.00 0.00 0.00 19.45 17.95 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 3.91 3.26 -0.13 0.00 1.43 -1.17 -4.31 118.68 121.67 2egm s LEU 28 Ca 1.09 0.17 0.17 0.00 -1.03 0.00 0.00 54.13 54.53 2egm s LEU 28 Cb -1.46 -2.54 0.32 0.00 0.03 0.00 0.00 46.19 42.54 2egm s LEU 28 CO 0.76 -2.29 1.20 2.29 0.23 0.00 0.00 176.35 178.55 2egm n LYS 29 N 9.22 1.78 -3.99 1.70 2.85 -1.19 -4.71 118.16 123.83 2egm n LYS 29 Ca 0.18 -2.55 -0.08 0.00 -1.05 0.00 0.00 58.31 54.80 2egm n LYS 29 Cb 0.51 -1.54 -0.09 0.00 -0.65 0.00 0.00 35.03 33.26 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 -2.71 2.09 -0.05 -5.58 1.43 -0.96 -1.70 118.68 111.21 2egm s LEU 30 Ca 0.32 -0.75 -0.01 0.00 -1.03 0.00 0.00 54.13 52.65 2egm s LEU 30 Cb 0.27 0.44 0.03 0.00 0.03 0.00 0.00 46.19 46.96 2egm s LEU 30 CO 0.04 -0.56 0.03 0.12 0.23 0.00 0.00 176.35 176.21 2egm s PHE 31 N -3.24 0.36 -0.17 0.29 5.36 0.96 -0.52 117.98 121.01 2egm s PHE 31 Ca 0.01 0.05 -0.29 0.00 -0.96 0.00 0.00 56.93 55.73 2egm s PHE 31 Cb 0.03 -0.62 -0.03 0.00 -0.34 0.00 0.00 43.02 42.06 2egm s PHE 31 CO -0.08 -0.25 1.61 0.00 -1.46 0.00 0.00 175.22 175.05 2egm n GLU 33 N 7.45 0.96 -0.05 0.00 1.02 -1.03 -0.09 120.64 128.90 2egm n GLU 33 Ca 0.18 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.27 2egm n GLU 33 Cb 0.44 -1.33 -0.06 0.00 -0.02 0.00 0.00 31.44 30.47 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 -0.83 0.60 0.23 2.62 0.31 -1.26 -4.66 118.33 115.35 2egm n VAL 34 Ca 0.15 -0.34 0.08 0.00 -0.01 0.00 0.00 64.34 64.23 2egm n VAL 34 Cb 0.07 -0.80 -0.12 0.00 -0.91 0.00 0.00 33.84 32.08 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 -2.45 0.97 -3.25 4.52 8.00 -1.20 -5.01 116.55 118.14 2egm n ASP 35 Ca -0.15 -0.27 -0.19 0.00 0.71 0.00 0.00 54.79 54.89 2egm n ASP 35 Cb 0.76 1.55 0.08 0.00 -0.02 0.00 0.00 41.12 43.49 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 -1.89 -6.69 -3.82 -1.24 1.02 0.86 -5.02 120.64 103.87 2egm n GLU 36 Ca -0.01 0.75 -0.13 0.00 -0.02 0.00 0.00 57.16 57.75 2egm n GLU 36 Cb 0.39 -5.54 -0.15 0.00 -0.02 0.00 0.00 31.44 26.13 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 -5.79 0.00 0.09 3.49 -1.05 -1.23 -4.97 118.70 109.24 2egm s GLU 37 Ca 0.31 0.11 -0.31 0.00 -0.15 0.00 0.00 54.97 54.93 2egm s GLU 37 Cb -0.14 -0.10 -0.09 0.00 -0.44 0.00 0.00 34.13 33.37 2egm s GLU 37 CO 0.66 -0.08 1.63 0.00 0.95 0.00 0.00 175.26 178.42 2egm s ALA 38 N 0.48 3.70 0.36 -0.84 0.00 -1.26 -2.30 121.76 121.90 2egm s ALA 38 Ca -0.04 1.24 0.05 0.00 0.00 0.00 0.00 51.96 53.21 2egm s ALA 38 Cb -0.06 -3.68 -0.07 0.00 0.00 0.00 0.00 23.12 19.32 2egm s ALA 38 CO -0.01 -1.02 0.04 0.96 0.00 0.00 0.00 175.76 175.72 2egm s ILE 39 N 2.30 1.46 0.53 0.00 -4.36 0.32 -4.96 121.20 116.50 2egm s ILE 39 Ca 0.73 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 59.20 2egm s ILE 39 Cb -0.40 -2.85 0.05 0.00 1.25 0.00 0.00 42.46 40.50 2egm s ILE 39 CO 0.32 0.00 0.61 0.00 0.24 0.00 0.00 174.94 176.11 2egm h VAL 41 N 0.49 1.03 -0.16 0.00 -1.51 -1.85 -1.69 116.25 112.56 2egm h VAL 41 Ca -0.34 -0.34 -0.03 0.00 -1.23 0.00 0.00 66.70 64.76 2egm h VAL 41 Cb 1.29 -0.04 -0.01 0.00 -2.13 0.00 0.00 31.29 30.40 2egm h VAL 41 CO 0.48 0.18 -0.01 0.58 -1.23 0.00 0.00 177.57 177.57 2egm h VAL 42 N 0.98 1.26 -0.25 7.19 2.07 -1.94 -2.63 116.25 122.94 2egm h VAL 42 Ca 0.40 -0.89 0.04 0.00 0.82 0.00 0.00 66.70 67.08 2egm h VAL 42 Cb 0.28 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 2egm h VAL 42 CO -0.16 0.26 -0.01 0.00 0.02 0.00 0.00 177.57 177.68 2egm h ARG 44 N 0.06 0.04 -0.43 0.00 1.12 -1.31 -0.98 114.38 112.88 2egm h ARG 44 Ca 0.12 -0.00 0.02 0.00 -1.11 0.00 0.00 59.98 59.00 2egm h ARG 44 Cb 0.16 -0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 30.09 2egm h ARG 44 CO -0.21 0.03 0.28 0.93 -3.11 0.00 0.00 179.97 177.89 2egm h GLU 45 N 0.04 0.51 -6.70 0.20 5.08 -1.06 -1.25 114.58 111.40 2egm h GLU 45 Ca 0.15 -0.03 -0.58 0.00 -1.00 0.00 0.00 59.36 57.90 2egm h GLU 45 Cb 0.21 -0.12 0.13 0.00 0.50 0.00 0.00 28.75 29.47 2egm h GLU 45 CO -0.28 0.34 0.30 0.45 -1.00 0.00 0.00 179.01 178.82 2egm n SER 46 N -4.48 1.82 0.00 1.42 2.88 -0.37 -4.57 113.62 110.32 2egm n SER 46 Ca 0.04 1.09 0.03 0.00 -1.33 0.00 0.00 58.87 58.70 2egm n SER 46 Cb 0.10 -1.41 0.16 0.00 -0.75 0.00 0.00 64.21 62.31 2egm n SER 46 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2egm n ARG 47 N 0.19 0.12 0.12 -1.46 0.63 -1.26 0.29 116.66 115.30 2egm n ARG 47 Ca 0.08 0.16 -0.24 0.00 -0.92 0.00 0.00 57.85 56.93 2egm n ARG 47 Cb 0.38 -1.50 -0.15 0.00 0.45 0.00 0.00 32.46 31.64 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 0.82 0.00 6.15 0.02 -1.87 -3.39 113.55 115.27 2egm h SER 48 Ca 0.00 -0.90 -0.18 0.00 -0.84 0.00 0.00 61.79 59.86 2egm h SER 48 Cb 0.04 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.28 2egm h SER 48 CO 0.00 1.65 -1.73 1.41 -1.14 0.00 0.00 176.83 177.03 2egm n HIS 49 N -3.79 0.00 -0.06 3.45 8.25 -0.83 -4.69 115.22 117.55 2egm n HIS 49 Ca -0.16 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.28 2egm n HIS 49 Cb 1.05 -0.52 -0.02 0.00 1.12 0.00 0.00 29.99 31.62 2egm n HIS 49 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2egm n LYS 50 N -2.37 -0.07 -0.34 -0.41 3.00 0.15 0.25 118.16 118.36 2egm n LYS 50 Ca -0.17 0.65 0.17 0.00 -0.00 0.00 0.00 58.31 58.97 2egm n LYS 50 Cb 0.82 -0.97 0.38 0.00 0.00 0.00 0.00 35.03 35.26 2egm n LYS 50 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 2egm h GLN 51 N 0.00 0.56 -6.96 1.64 4.20 -1.82 -3.41 115.11 109.32 2egm h GLN 51 Ca 0.02 -0.03 -0.53 0.00 0.06 0.00 0.00 58.65 58.17 2egm h GLN 51 Cb 0.06 -0.13 0.10 0.00 0.30 0.00 0.00 27.48 27.81 2egm h GLN 51 CO -0.14 0.37 0.65 -1.01 -0.67 0.00 0.00 178.83 178.02 2egm s HIS 52 N -5.78 2.69 -0.93 2.96 3.76 0.68 -4.91 115.29 113.76 2egm s HIS 52 Ca -0.11 1.35 -0.24 0.00 -0.15 0.00 0.00 55.06 55.92 2egm s HIS 52 Cb 0.27 -3.76 0.03 0.00 1.11 0.00 0.00 32.58 30.23 2egm s HIS 52 CO 0.80 -2.40 1.49 0.45 -0.85 0.00 0.00 174.74 174.22 2egm s SER 53 N -0.65 6.22 0.36 1.40 0.15 -1.26 -4.95 113.70 114.97 2egm s SER 53 Ca 0.58 -1.08 -0.09 0.00 0.70 0.00 0.00 55.95 56.07 2egm s SER 53 Cb -0.40 -2.57 -0.06 0.00 -1.71 0.00 0.00 66.02 61.28 2egm s SER 53 CO 0.52 -1.76 0.69 -0.69 1.20 0.00 0.00 173.24 173.20 2egm s VAL 54 N 5.90 4.87 0.06 4.45 1.01 -1.26 -2.46 120.40 132.97 2egm s VAL 54 Ca 0.47 0.42 0.03 0.00 0.00 0.00 0.00 61.98 62.91 2egm s VAL 54 Cb -0.03 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 2egm s VAL 54 CO -0.02 -0.45 -0.09 0.68 0.00 0.00 0.00 175.10 175.21 2egm s VAL 55 N -2.27 0.72 -0.41 2.92 -7.23 -0.77 -4.93 120.40 108.43 2egm s VAL 55 Ca 0.49 -1.34 -0.28 0.00 -1.81 0.00 0.00 61.98 59.04 2egm s VAL 55 Cb -0.10 -0.97 -0.01 0.00 0.56 0.00 0.00 36.38 35.86 2egm s VAL 55 CO 0.31 -0.46 1.74 -2.16 -0.31 0.00 0.00 175.10 174.22 2egm s PRO 56 N -2.14 3.22 0.00 4.82 0.04 -1.26 -0.03 135.00 139.65 2egm s PRO 56 Ca -0.03 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.15 2egm s PRO 56 Cb -0.07 -4.21 0.00 0.00 0.04 0.00 0.00 34.50 30.27 2egm s PRO 56 CO -0.00 -2.00 0.08 1.28 0.04 0.00 0.00 177.00 176.40