#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 -0.09 -0.10 1.61 1.04 -1.26 -5.16 113.70 109.73 2egm s SER 2 Ca 0.00 -0.83 -0.04 0.00 0.48 0.00 0.00 55.95 55.56 2egm s SER 2 Cb 0.00 0.55 0.05 0.00 0.10 0.00 0.00 66.02 66.72 2egm s SER 2 CO 0.00 -1.07 0.21 -0.55 0.98 0.00 0.00 173.24 172.81 2egm s SER 3 N -2.98 0.47 0.00 7.02 0.15 -1.26 -5.12 113.70 111.98 2egm s SER 3 Ca 0.19 0.46 0.00 0.00 0.70 0.00 0.00 55.95 57.30 2egm s SER 3 Cb 0.00 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.78 2egm s SER 3 CO 0.05 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.86 2egm n GLY 4 N 5.21 3.27 3.26 9.45 0.00 -1.26 -5.10 105.19 120.02 2egm n GLY 4 Ca -0.08 -1.94 -0.27 0.00 0.00 0.00 0.00 46.02 43.73 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 0.00 2.62 0.24 1.61 0.15 -1.26 -5.15 113.70 111.91 2egm s SER 5 Ca 0.00 -0.48 0.02 0.00 0.70 0.00 0.00 55.95 56.19 2egm s SER 5 Cb 0.00 -0.25 -0.05 0.00 -1.71 0.00 0.00 66.02 64.01 2egm s SER 5 CO 0.00 0.22 0.05 -0.94 1.20 0.00 0.00 173.24 173.77 2egm s SER 6 N -0.92 1.48 0.00 5.45 1.04 -1.26 -5.09 113.70 114.41 2egm s SER 6 Ca 0.09 -1.30 0.00 0.00 0.48 0.00 0.00 55.95 55.22 2egm s SER 6 Cb -0.09 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.12 2egm s SER 6 CO 0.01 -0.63 0.00 0.61 0.98 0.00 0.00 173.24 174.21 2egm n GLY 7 N -0.43 2.24 2.94 7.32 0.00 -1.26 -5.16 105.19 110.84 2egm n GLY 7 Ca -0.03 -0.69 -0.16 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 0.40 0.67 2.61 -1.32 -1.26 -5.15 115.64 111.59 2egm s THR 8 Ca 0.00 -0.19 -0.15 0.00 -1.21 0.00 0.00 61.69 60.15 2egm s THR 8 Cb 0.00 -0.36 0.00 0.00 -1.51 0.00 0.00 72.50 70.63 2egm s THR 8 CO 0.00 0.13 1.11 -2.16 -2.21 0.00 0.00 174.62 171.49 2egm s PRO 9 N 0.07 2.77 -0.25 7.08 0.04 -1.26 -5.07 135.00 138.37 2egm s PRO 9 Ca -0.00 1.38 -0.13 0.00 0.04 0.00 0.00 61.00 62.28 2egm s PRO 9 Cb -0.04 -1.95 0.08 0.00 0.04 0.00 0.00 34.50 32.63 2egm s PRO 9 CO -0.00 -1.27 0.61 0.20 0.04 0.00 0.00 177.00 176.57 2egm s GLY 10 N -2.62 -0.57 0.22 0.56 0.00 -1.26 -5.17 107.32 98.48 2egm s GLY 10 Ca 0.67 2.18 -0.21 0.00 0.00 0.00 0.00 44.72 47.35 2egm s GLY 10 CO 0.42 2.33 0.99 1.09 0.00 0.00 0.00 173.10 177.94 2egm s ARG 11 N 1.79 1.47 -0.41 2.90 1.70 -1.26 -5.12 118.95 120.02 2egm s ARG 11 Ca -0.09 -0.94 0.03 0.00 -0.47 0.00 0.00 55.73 54.26 2egm s ARG 11 Cb -0.07 0.41 0.27 0.00 -0.57 0.00 0.00 34.95 35.00 2egm s ARG 11 CO -0.18 -0.69 1.09 0.41 -1.08 0.00 0.00 175.30 174.85 2egm n GLY 12 N -0.66 -0.67 3.15 3.88 0.00 -1.26 -5.15 105.19 104.48 2egm n GLY 12 Ca -0.04 0.50 -0.20 0.00 0.00 0.00 0.00 46.02 46.28 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 -1.00 1.69 -0.16 1.61 0.15 -1.26 -5.10 113.70 109.63 2egm s SER 13 Ca 0.28 -0.48 -0.29 0.00 0.70 0.00 0.00 55.95 56.15 2egm s SER 13 Cb 0.24 -0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.40 2egm s SER 13 CO -0.16 0.02 1.72 -0.60 1.20 0.00 0.00 173.24 175.42 2egm s ARG 14 N -1.24 3.85 -0.30 5.44 6.06 -1.26 -4.93 118.95 126.57 2egm s ARG 14 Ca 0.01 1.91 -0.16 0.00 -2.50 0.00 0.00 55.73 54.99 2egm s ARG 14 Cb -0.08 -4.07 0.17 0.00 0.06 0.00 0.00 34.95 31.03 2egm s ARG 14 CO 0.01 -1.24 1.09 0.54 -2.50 0.00 0.00 175.30 173.20 2egm s VAL 15 N 5.18 -0.34 -0.21 7.11 0.11 -1.26 -5.11 120.40 125.88 2egm s VAL 15 Ca 0.76 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.79 2egm s VAL 15 Cb -0.29 -1.00 0.06 0.00 -1.53 0.00 0.00 36.38 33.62 2egm s VAL 15 CO 0.31 0.00 0.02 0.42 -3.33 0.00 0.00 175.10 172.52 2egm s THR 16 N 2.28 0.71 -1.42 5.04 -4.23 -1.26 -4.80 115.64 111.97 2egm s THR 16 Ca -0.02 -0.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 2egm s THR 16 Cb -0.04 -1.19 0.00 0.00 1.34 0.00 0.00 72.50 72.61 2egm s THR 16 CO -0.17 -0.21 0.00 0.47 -0.54 0.00 0.00 174.62 174.17 2egm n ASP 17 N 4.98 -4.35 -2.71 3.99 9.92 -1.26 -4.85 116.55 122.27 2egm n ASP 17 Ca -0.09 0.22 -0.19 0.00 -0.53 0.00 0.00 54.79 54.19 2egm n ASP 17 Cb 0.46 -3.78 0.00 0.00 -0.64 0.00 0.00 41.12 37.16 2egm n ASP 17 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2egm n GLN 18 N -2.54 2.26 0.00 -1.24 10.64 -1.26 -4.52 117.38 120.72 2egm n GLN 18 Ca -0.17 -3.97 0.00 0.00 -1.83 0.00 0.00 57.00 51.03 2egm n GLN 18 Cb 0.58 -1.82 0.00 0.00 -0.86 0.00 0.00 30.24 28.14 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 -0.19 0.39 3.13 2.61 0.00 -1.26 -4.47 105.19 105.40 2egm n GLY 19 Ca 0.25 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 0.04 -0.01 -0.12 -0.61 -1.09 -1.26 -3.01 121.20 115.14 2egm s ILE 20 Ca 0.00 0.02 -0.29 0.00 -2.23 0.00 0.00 60.65 58.15 2egm s ILE 20 Cb 0.00 -0.37 -0.03 0.00 -1.58 0.00 0.00 42.46 40.48 2egm s ILE 20 CO 0.00 0.01 1.41 0.00 -1.23 0.00 0.00 174.94 175.12 2egm n PRO 22 N 6.72 0.49 -0.06 0.00 -0.04 -1.26 0.19 135.00 141.04 2egm n PRO 22 Ca 0.15 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.48 2egm n PRO 22 Cb 0.44 -1.15 -0.04 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 0.32 -0.00 0.54 5.02 -1.26 -4.78 118.16 117.34 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 -1.04 -0.07 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 -3.81 0.00 -3.26 2.13 8.25 -1.19 -5.01 115.22 112.32 2egm n HIS 24 Ca -0.22 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.07 2egm n HIS 24 Cb 0.56 -0.06 0.07 0.00 1.12 0.00 0.00 29.99 31.68 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 -1.43 -5.87 -5.02 -0.41 1.13 0.49 -4.97 117.38 101.31 2egm n GLN 25 Ca 0.01 0.69 -0.32 0.00 -1.94 0.00 0.00 57.00 55.44 2egm n GLN 25 Cb 0.22 -5.26 -0.15 0.00 0.11 0.00 0.00 30.24 25.16 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 -5.50 2.91 -0.49 -1.09 0.41 -1.25 -4.74 118.70 108.94 2egm s GLU 26 Ca 0.19 -0.79 -0.41 0.00 -0.41 0.00 0.00 54.97 53.56 2egm s GLU 26 Cb -0.09 -2.39 -0.17 0.00 -1.78 0.00 0.00 34.13 29.71 2egm s GLU 26 CO 0.60 0.34 2.18 0.00 -0.49 0.00 0.00 175.26 177.89 2egm n ALA 27 N 3.12 0.43 -1.78 5.21 0.00 -1.26 -2.58 120.51 123.65 2egm n ALA 27 Ca -0.18 0.10 -0.37 0.00 0.00 0.00 0.00 53.44 52.99 2egm n ALA 27 Cb 0.52 -2.21 -0.03 0.00 0.00 0.00 0.00 19.45 17.74 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 6.52 3.35 -0.21 0.00 1.43 -1.16 -4.43 118.68 124.17 2egm s LEU 28 Ca 1.18 0.73 0.13 0.00 -1.03 0.00 0.00 54.13 55.14 2egm s LEU 28 Cb -1.33 -2.51 0.42 0.00 0.03 0.00 0.00 46.19 42.80 2egm s LEU 28 CO 0.61 -2.67 1.28 2.29 0.23 0.00 0.00 176.35 178.08 2egm n LYS 29 N 9.09 1.68 -3.80 1.70 2.85 -1.10 -4.53 118.16 124.06 2egm n LYS 29 Ca 0.30 -3.08 -0.09 0.00 -1.05 0.00 0.00 58.31 54.38 2egm n LYS 29 Cb 0.54 -1.65 -0.07 0.00 -0.65 0.00 0.00 35.03 33.19 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 -3.13 1.14 -0.13 -5.58 1.43 -0.89 -2.81 118.68 108.72 2egm s LEU 30 Ca 0.38 -0.52 -0.03 0.00 -1.03 0.00 0.00 54.13 52.93 2egm s LEU 30 Cb 0.36 1.24 0.05 0.00 0.03 0.00 0.00 46.19 47.87 2egm s LEU 30 CO -0.02 -0.74 0.06 0.12 0.23 0.00 0.00 176.35 176.00 2egm s PHE 31 N -3.68 0.35 -0.14 0.29 5.36 0.17 0.24 117.98 120.57 2egm s PHE 31 Ca 0.03 -0.22 -0.29 0.00 -0.96 0.00 0.00 56.93 55.49 2egm s PHE 31 Cb 0.03 -0.70 -0.05 0.00 -0.34 0.00 0.00 43.02 41.96 2egm s PHE 31 CO -0.10 -0.42 1.93 0.00 -1.46 0.00 0.00 175.22 175.17 2egm n GLU 33 N 8.00 0.89 -0.04 0.00 1.02 -0.70 -0.15 120.64 129.65 2egm n GLU 33 Ca 0.23 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.32 2egm n GLU 33 Cb 0.44 -1.08 -0.05 0.00 -0.02 0.00 0.00 31.44 30.73 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 -0.58 0.53 0.33 2.62 0.31 -1.26 -4.68 118.33 115.60 2egm n VAL 34 Ca 0.03 -0.27 0.08 0.00 -0.01 0.00 0.00 64.34 64.17 2egm n VAL 34 Cb 0.02 -0.82 -0.10 0.00 -0.91 0.00 0.00 33.84 32.02 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 -2.50 1.09 -3.05 4.52 8.00 -1.18 -5.01 116.55 118.42 2egm n ASP 35 Ca -0.14 -0.41 -0.17 0.00 0.71 0.00 0.00 54.79 54.78 2egm n ASP 35 Cb 0.72 1.38 0.07 0.00 -0.02 0.00 0.00 41.12 43.27 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 -1.72 -6.01 -3.73 -1.24 1.02 0.79 -5.02 120.64 104.72 2egm n GLU 36 Ca -0.00 0.70 -0.14 0.00 -0.02 0.00 0.00 57.16 57.69 2egm n GLU 36 Cb 0.33 -5.31 -0.15 0.00 -0.02 0.00 0.00 31.44 26.28 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 -5.55 0.06 0.12 3.49 -1.05 -1.23 -4.97 118.70 109.58 2egm s GLU 37 Ca 0.21 0.38 -0.31 0.00 -0.15 0.00 0.00 54.97 55.10 2egm s GLU 37 Cb -0.09 -0.22 -0.10 0.00 -0.44 0.00 0.00 34.13 33.28 2egm s GLU 37 CO 0.61 -0.19 1.77 0.00 0.95 0.00 0.00 175.26 178.39 2egm s ALA 38 N 1.38 3.76 0.48 -0.84 0.00 -1.26 -2.43 121.76 122.85 2egm s ALA 38 Ca -0.07 1.41 0.02 0.00 0.00 0.00 0.00 51.96 53.32 2egm s ALA 38 Cb -0.12 -3.73 -0.02 0.00 0.00 0.00 0.00 23.12 19.25 2egm s ALA 38 CO -0.05 -1.15 0.04 0.96 0.00 0.00 0.00 175.76 175.56 2egm s ILE 39 N 2.48 1.00 0.44 0.00 -4.36 0.14 -4.94 121.20 115.96 2egm s ILE 39 Ca 0.78 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 59.23 2egm s ILE 39 Cb -0.45 -2.21 0.06 0.00 1.25 0.00 0.00 42.46 41.11 2egm s ILE 39 CO 0.35 0.00 0.47 0.00 0.24 0.00 0.00 174.94 175.99 2egm h VAL 41 N 0.36 1.22 -0.07 0.00 -1.51 -1.86 -2.36 116.25 112.04 2egm h VAL 41 Ca -0.24 -0.77 -0.02 0.00 -1.23 0.00 0.00 66.70 64.44 2egm h VAL 41 Cb 0.98 0.60 -0.00 0.00 -2.13 0.00 0.00 31.29 30.74 2egm h VAL 41 CO 0.37 0.29 -0.03 0.58 -1.23 0.00 0.00 177.57 177.55 2egm h VAL 42 N 0.84 1.32 -0.66 7.19 2.07 -1.95 -2.77 116.25 122.28 2egm h VAL 42 Ca 0.19 -1.03 0.09 0.00 0.82 0.00 0.00 66.70 66.77 2egm h VAL 42 Cb 0.25 1.86 -0.07 0.00 -1.52 0.00 0.00 31.29 31.82 2egm h VAL 42 CO -0.01 0.29 0.30 0.00 0.02 0.00 0.00 177.57 178.17 2egm h ARG 44 N 0.53 0.55 0.00 0.00 1.12 -1.41 -1.68 114.38 113.49 2egm h ARG 44 Ca 0.33 -0.03 -0.07 0.00 -1.11 0.00 0.00 59.98 59.10 2egm h ARG 44 Cb 0.36 -0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 30.19 2egm h ARG 44 CO -0.28 0.37 -0.31 0.93 -3.11 0.00 0.00 179.97 177.57 2egm h GLU 45 N 0.57 0.00 -6.75 0.20 5.08 -1.03 -2.82 114.58 109.83 2egm h GLU 45 Ca 0.20 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 58.04 2egm h GLU 45 Cb 0.02 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.31 2egm h GLU 45 CO -0.09 0.31 0.61 -1.54 -1.00 0.00 0.00 179.01 177.29 2egm s SER 46 N -6.55 6.95 0.56 1.42 1.04 0.19 -4.67 113.70 112.64 2egm s SER 46 Ca -0.02 2.43 0.40 0.00 0.48 0.00 0.00 55.95 59.24 2egm s SER 46 Cb 0.13 -2.62 1.52 0.00 0.10 0.00 0.00 66.02 65.14 2egm s SER 46 CO 0.68 -0.44 1.65 0.08 0.98 0.00 0.00 173.24 176.18 2egm h ARG 47 N 4.56 0.00 -0.66 4.02 -0.00 -1.85 0.38 114.38 120.83 2egm h ARG 47 Ca -0.46 0.00 0.12 0.00 -0.00 0.00 0.00 59.98 59.64 2egm h ARG 47 Cb 1.22 0.00 -0.09 0.00 -0.00 0.00 0.00 29.97 31.10 2egm h ARG 47 CO 0.72 0.00 0.21 0.77 -0.00 0.00 0.00 179.97 181.67 2egm h SER 48 N 0.00 0.15 0.00 0.08 0.02 -1.89 -3.01 113.55 108.89 2egm h SER 48 Ca 0.66 0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 61.63 2egm h SER 48 Cb 2.84 0.11 -0.19 0.00 0.14 0.00 0.00 62.40 65.30 2egm h SER 48 CO -0.01 0.07 -0.76 1.41 -1.14 0.00 0.00 176.83 176.40 2egm n HIS 49 N -5.05 0.00 0.05 3.45 8.25 0.10 -4.79 115.22 117.23 2egm n HIS 49 Ca 0.11 -1.01 -0.22 0.00 -0.26 0.00 0.00 57.72 56.33 2egm n HIS 49 Cb 0.35 -0.20 -0.15 0.00 1.12 0.00 0.00 29.99 31.11 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 0.34 0.00 -0.41 1.63 -0.37 -3.34 116.57 115.42 2egm h LYS 50 Ca -0.11 -0.59 0.00 0.00 -0.85 0.00 0.00 60.65 59.10 2egm h LYS 50 Cb 1.44 0.22 0.00 0.00 -0.60 0.00 0.00 32.23 33.28 2egm h LYS 50 CO 0.05 1.28 -0.20 1.96 -3.45 0.00 0.00 179.45 179.09 2egm h GLN 51 N -0.10 0.00 -6.81 1.90 4.20 -1.84 -3.46 115.11 109.00 2egm h GLN 51 Ca -0.30 0.00 -0.48 0.00 0.06 0.00 0.00 58.65 57.93 2egm h GLN 51 Cb 1.93 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.69 2egm h GLN 51 CO 0.14 0.00 0.36 -1.01 -0.67 0.00 0.00 178.83 177.65 2egm s HIS 52 N -3.16 3.84 -0.92 2.96 3.76 -1.25 -4.95 115.29 115.56 2egm s HIS 52 Ca 0.08 1.85 -0.24 0.00 -0.15 0.00 0.00 55.06 56.60 2egm s HIS 52 Cb 0.11 -2.98 -0.03 0.00 1.11 0.00 0.00 32.58 30.79 2egm s HIS 52 CO 0.65 0.28 1.85 -1.12 -0.85 0.00 0.00 174.74 175.56 2egm s SER 53 N -1.33 5.39 0.19 1.40 0.01 -1.26 -4.90 113.70 113.19 2egm s SER 53 Ca 0.45 -0.80 -0.19 0.00 1.31 0.00 0.00 55.95 56.71 2egm s SER 53 Cb -0.24 -2.56 -0.08 0.00 0.21 0.00 0.00 66.02 63.36 2egm s SER 53 CO 0.29 -2.51 0.68 -0.69 0.41 0.00 0.00 173.24 171.42 2egm s VAL 54 N 9.13 4.62 0.10 3.43 1.01 -1.26 -1.73 120.40 135.70 2egm s VAL 54 Ca 0.66 1.24 0.06 0.00 0.00 0.00 0.00 61.98 63.93 2egm s VAL 54 Cb -0.06 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2egm s VAL 54 CO -0.02 0.29 -0.15 0.68 0.00 0.00 0.00 175.10 175.89 2egm s VAL 55 N -1.42 1.33 -0.35 2.92 -7.23 -0.89 -4.93 120.40 109.83 2egm s VAL 55 Ca 0.40 -1.57 -0.28 0.00 -1.81 0.00 0.00 61.98 58.71 2egm s VAL 55 Cb -0.17 -1.40 -0.01 0.00 0.56 0.00 0.00 36.38 35.36 2egm s VAL 55 CO 0.21 -0.30 1.70 -2.16 -0.31 0.00 0.00 175.10 174.23 2egm s PRO 56 N -2.28 3.41 0.00 4.82 0.04 -1.26 0.44 135.00 140.17 2egm s PRO 56 Ca 0.05 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.41 2egm s PRO 56 Cb -0.07 -4.15 0.00 0.00 0.04 0.00 0.00 34.50 30.32 2egm s PRO 56 CO 0.03 -1.77 0.09 1.28 0.04 0.00 0.00 177.00 176.67