#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em7 n SER 2 N 0.00 7.43 -0.11 1.61 3.41 -1.26 -4.69 113.62 120.02 2em7 n SER 2 Ca 0.00 -3.65 -0.05 0.00 -0.26 0.00 0.00 58.87 54.90 2em7 n SER 2 Cb 0.00 -1.02 0.01 0.00 -0.26 0.00 0.00 64.21 62.94 2em7 n SER 2 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2em7 h SER 3 N 2.14 -0.35 -2.82 4.04 4.64 -2.09 -3.40 113.55 115.71 2em7 h SER 3 Ca 0.54 0.11 -0.65 0.00 -0.47 0.00 0.00 61.79 61.32 2em7 h SER 3 Cb 0.69 0.23 -0.09 0.00 -0.31 0.00 0.00 62.40 62.92 2em7 h SER 3 CO 1.40 -0.13 -0.49 -0.83 -0.87 0.00 0.00 176.83 175.92 2em7 s GLY 4 N -2.95 2.12 0.02 -0.77 0.00 -1.26 -5.10 107.32 99.37 2em7 s GLY 4 Ca -0.14 -0.66 -0.01 0.00 0.00 0.00 0.00 44.72 43.91 2em7 s GLY 4 CO 0.70 -0.27 0.15 -0.45 0.00 0.00 0.00 173.10 173.24 2em7 s SER 5 N -0.70 6.12 -0.28 1.64 0.15 -1.26 -5.03 113.70 114.34 2em7 s SER 5 Ca 0.13 0.24 -0.12 0.00 0.70 0.00 0.00 55.95 56.90 2em7 s SER 5 Cb -0.12 -1.85 -0.13 0.00 -1.71 0.00 0.00 66.02 62.21 2em7 s SER 5 CO 0.03 0.23 -0.33 -1.54 1.20 0.00 0.00 173.24 172.82 2em7 n SER 6 N 0.78 1.96 0.00 5.45 3.41 -1.26 -5.11 113.62 118.86 2em7 n SER 6 Ca -0.10 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2em7 n SER 6 Cb 0.52 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2em7 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2em7 n GLY 7 N 1.38 -1.16 3.18 5.00 0.00 -1.26 -4.90 105.19 107.42 2em7 n GLY 7 Ca -0.54 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 42.88 2em7 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2em7 s THR 8 N -0.41 4.24 0.00 2.61 2.01 -1.26 -5.00 115.64 117.83 2em7 s THR 8 Ca 0.00 -2.44 0.00 0.00 0.31 0.00 0.00 61.69 59.56 2em7 s THR 8 Cb 0.00 -3.74 0.00 0.00 0.01 0.00 0.00 72.50 68.77 2em7 s THR 8 CO 0.00 -0.87 0.00 0.61 -0.69 0.00 0.00 174.62 173.67 2em7 n GLY 9 N 4.10 -0.28 2.95 4.40 0.00 -1.26 -5.03 105.19 110.07 2em7 n GLY 9 Ca 0.04 -2.23 -0.24 0.00 0.00 0.00 0.00 46.02 43.59 2em7 n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2em7 s GLU 10 N 0.00 1.38 0.01 1.61 0.41 -1.26 -5.12 118.70 115.73 2em7 s GLU 10 Ca 0.00 -0.27 -0.07 0.00 -0.41 0.00 0.00 54.97 54.22 2em7 s GLU 10 Cb 0.00 -1.28 -0.05 0.00 -1.78 0.00 0.00 34.13 31.02 2em7 s GLU 10 CO 0.00 -0.08 0.29 0.15 -0.49 0.00 0.00 175.26 175.12 2em7 s LYS 11 N 1.03 3.61 0.08 1.61 -0.14 -1.26 -5.02 119.74 119.66 2em7 s LYS 11 Ca -0.08 -0.03 -0.16 0.00 -1.36 0.00 0.00 55.97 54.33 2em7 s LYS 11 Cb -0.14 -3.07 -0.10 0.00 -1.68 0.00 0.00 37.83 32.83 2em7 s LYS 11 CO -0.00 0.64 1.40 -1.00 -0.76 0.00 0.00 175.35 175.63 2em7 h PRO 12 N 3.99 0.61 -5.26 -1.68 0.13 -1.91 -3.43 132.00 124.45 2em7 h PRO 12 Ca -0.50 -0.32 -0.61 0.00 -0.87 0.00 0.00 66.00 63.70 2em7 h PRO 12 Cb 1.20 0.01 -0.13 0.00 0.13 0.00 0.00 31.00 32.21 2em7 h PRO 12 CO 0.66 0.92 -0.41 0.71 -0.23 0.00 0.00 178.00 179.65 2em7 s TYR 13 N -4.35 3.37 0.06 1.56 2.02 -1.20 -5.00 117.35 113.81 2em7 s TYR 13 Ca -0.13 0.39 0.05 0.00 -0.37 0.00 0.00 57.07 57.01 2em7 s TYR 13 Cb 0.08 -2.31 -0.03 0.00 -0.40 0.00 0.00 41.96 39.30 2em7 s TYR 13 CO 0.81 0.13 -0.14 0.21 -1.57 0.00 0.00 175.55 174.99 2em7 s LYS 14 N 0.86 0.83 0.12 -0.62 2.20 -1.26 -0.02 119.74 121.85 2em7 s LYS 14 Ca 0.11 -0.86 -0.28 0.00 -0.36 0.00 0.00 55.97 54.58 2em7 s LYS 14 Cb -0.13 -0.82 -0.06 0.00 -1.51 0.00 0.00 37.83 35.30 2em7 s LYS 14 CO 0.04 0.19 0.88 0.00 -0.36 0.00 0.00 175.35 176.10 2em7 n GLU 16 N 2.44 2.30 -0.10 0.00 4.07 -1.26 -2.37 120.64 125.72 2em7 n GLU 16 Ca -0.01 -2.02 -0.16 0.00 -0.06 0.00 0.00 57.16 54.91 2em7 n GLU 16 Cb 0.49 -1.44 -0.08 0.00 -0.06 0.00 0.00 31.44 30.35 2em7 n GLU 16 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2em7 n GLU 17 N 1.14 0.45 0.00 5.31 -0.58 -1.26 -4.87 120.64 120.83 2em7 n GLU 17 Ca 0.19 0.14 0.00 0.00 -0.42 0.00 0.00 57.16 57.07 2em7 n GLU 17 Cb 0.47 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 30.03 2em7 n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2em7 n GLY 19 N 3.21 0.69 3.64 0.00 0.00 -1.00 -5.03 105.19 106.70 2em7 n GLY 19 Ca 0.00 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 2em7 n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2em7 s LYS 20 N -0.06 3.07 0.09 1.61 2.47 -1.26 -4.79 119.74 120.87 2em7 s LYS 20 Ca 0.00 -0.44 -0.15 0.00 -1.56 0.00 0.00 55.97 53.82 2em7 s LYS 20 Cb 0.00 -2.79 -0.06 0.00 -1.46 0.00 0.00 37.83 33.51 2em7 s LYS 20 CO 0.00 0.62 0.50 0.20 0.16 0.00 0.00 175.35 176.83 2em7 s GLY 21 N -0.66 2.50 0.20 5.54 0.00 -1.26 -0.94 107.32 112.69 2em7 s GLY 21 Ca 0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 44.72 44.67 2em7 s GLY 21 CO 0.02 0.18 0.12 -1.36 0.00 0.00 0.00 173.10 172.06 2em7 s PHE 22 N -1.28 1.15 -0.16 1.90 0.40 0.98 -4.99 117.98 115.98 2em7 s PHE 22 Ca 0.32 -1.34 -0.13 0.00 -0.60 0.00 0.00 56.93 55.18 2em7 s PHE 22 Cb -0.16 -0.58 -0.06 0.00 0.51 0.00 0.00 43.02 42.72 2em7 s PHE 22 CO 0.18 -0.59 -0.28 -0.89 0.70 0.00 0.00 175.22 174.33 2em7 n ILE 23 N -0.26 1.37 -3.03 0.64 5.41 -1.26 -3.25 119.36 118.97 2em7 n ILE 23 Ca 0.01 0.02 -0.37 0.00 1.00 0.00 0.00 62.75 63.40 2em7 n ILE 23 Cb 0.66 -2.06 -0.06 0.00 -0.71 0.00 0.00 39.64 37.47 2em7 n ILE 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2em7 h ARG 25 N 3.57 0.93 0.28 0.00 2.43 -2.00 -3.09 114.38 116.49 2em7 h ARG 25 Ca -0.48 -0.31 -0.01 0.00 -0.81 0.00 0.00 59.98 58.38 2em7 h ARG 25 Cb 1.20 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2em7 h ARG 25 CO 0.65 0.96 -0.17 0.00 -1.51 0.00 0.00 179.97 179.90 2em7 h ARG 26 N 0.84 -0.42 -0.52 0.20 3.08 -2.01 -2.96 114.38 112.59 2em7 h ARG 26 Ca 0.14 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.32 2em7 h ARG 26 Cb 0.59 0.09 -0.11 0.00 0.08 0.00 0.00 29.97 30.63 2em7 h ARG 26 CO 0.04 -0.28 -0.28 -0.44 -1.07 0.00 0.00 179.97 177.94 2em7 h ASP 27 N -0.43 -0.97 -0.81 7.04 3.32 -1.97 -1.25 116.42 121.36 2em7 h ASP 27 Ca -0.03 0.20 0.12 0.00 0.02 0.00 0.00 57.03 57.35 2em7 h ASP 27 Cb 0.36 0.50 -0.13 0.00 0.22 0.00 0.00 39.33 40.27 2em7 h ASP 27 CO 0.03 -0.28 -0.40 0.25 -1.72 0.00 0.00 179.24 177.12 2em7 h LEU 28 N -0.15 -1.42 -0.27 1.55 5.85 -1.44 0.14 115.31 119.57 2em7 h LEU 28 Ca 0.23 0.28 0.05 0.00 0.84 0.00 0.00 57.88 59.27 2em7 h LEU 28 Cb 0.52 0.71 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 2em7 h LEU 28 CO -0.61 -0.30 -0.02 1.88 -0.34 0.00 0.00 178.44 179.05 2em7 h TYR 29 N -0.09 -0.04 -0.98 1.25 -1.99 -1.18 -1.65 116.97 112.28 2em7 h TYR 29 Ca 0.27 0.02 0.14 0.00 2.00 0.00 0.00 58.73 61.17 2em7 h TYR 29 Cb 0.56 0.06 -0.09 0.00 2.00 0.00 0.00 36.73 39.27 2em7 h TYR 29 CO -0.79 -0.06 0.62 1.15 -0.00 0.00 0.00 178.16 179.08 2em7 h THR 30 N 0.06 0.85 -0.24 -2.88 2.02 -0.18 0.86 112.91 113.39 2em7 h THR 30 Ca 0.13 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 2em7 h THR 30 Cb 0.18 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.47 2em7 h THR 30 CO -0.23 0.16 0.02 -0.74 0.37 0.00 0.00 175.52 175.10 2em7 h HIS 31 N 0.87 0.36 -0.78 3.16 -0.00 -0.05 -2.13 115.15 116.58 2em7 h HIS 31 Ca 0.51 -0.02 0.23 0.00 -0.00 0.00 0.00 60.37 61.09 2em7 h HIS 31 Cb 0.65 -0.11 -0.03 0.00 -0.00 0.00 0.00 27.41 27.92 2em7 h HIS 31 CO -0.00 0.35 0.59 1.25 -0.00 0.00 0.00 177.93 180.12 2em7 h HIS 32 N 0.35 0.00 -1.21 5.26 6.17 -0.47 -0.19 115.15 125.06 2em7 h HIS 32 Ca 0.08 0.00 0.35 0.00 0.71 0.00 0.00 60.37 61.51 2em7 h HIS 32 Cb 0.21 0.00 -0.05 0.00 2.52 0.00 0.00 27.41 30.09 2em7 h HIS 32 CO 0.00 0.00 0.98 0.52 0.71 0.00 0.00 177.93 180.14 2em7 h MET 33 N 0.00 0.00 -0.37 5.26 2.86 -1.46 0.91 114.93 122.13 2em7 h MET 33 Ca 0.37 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.89 2em7 h MET 33 Cb 1.55 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.20 2em7 h MET 33 CO -0.00 0.00 -0.24 -0.39 1.06 0.00 0.00 176.91 177.33 2em7 h VAL 34 N 0.00 1.27 -0.49 -2.22 -1.51 -1.25 -2.65 116.25 109.40 2em7 h VAL 34 Ca 0.58 -1.36 -0.11 0.00 -1.23 0.00 0.00 66.70 64.58 2em7 h VAL 34 Cb 2.52 1.25 -0.07 0.00 -2.13 0.00 0.00 31.29 32.87 2em7 h VAL 34 CO -0.01 0.45 0.14 1.41 -1.23 0.00 0.00 177.57 178.33 2em7 n HIS 35 N -4.10 1.68 -0.00 5.19 8.25 0.31 -3.96 115.22 122.58 2em7 n HIS 35 Ca -0.00 -0.79 -0.00 0.00 -0.26 0.00 0.00 57.72 56.67 2em7 n HIS 35 Cb 0.44 -0.50 -0.00 0.00 1.12 0.00 0.00 29.99 31.05 2em7 n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2em7 n THR 36 N 0.11 0.01 -2.59 1.59 -2.24 -1.02 -5.07 114.28 105.07 2em7 n THR 36 Ca 0.26 -0.01 -0.02 0.00 -2.27 0.00 0.00 64.05 62.02 2em7 n THR 36 Cb 1.04 -0.94 0.01 0.00 -2.10 0.00 0.00 70.33 68.33 2em7 n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2em7 n GLY 37 N 3.04 1.27 3.32 3.38 0.00 -1.10 -5.09 105.19 110.01 2em7 n GLY 37 Ca -0.00 -2.04 -0.30 0.00 0.00 0.00 0.00 46.02 43.68 2em7 n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2em7 n GLU 38 N -1.11 -3.92 -4.90 1.61 1.02 -1.26 -5.02 120.64 107.06 2em7 n GLU 38 Ca 0.01 -1.14 -0.27 0.00 -0.02 0.00 0.00 57.16 55.73 2em7 n GLU 38 Cb 0.04 -2.02 -0.15 0.00 -0.02 0.00 0.00 31.44 29.29 2em7 n GLU 38 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2em7 s LYS 39 N -4.75 1.64 0.75 3.49 0.00 -1.26 -4.98 119.74 114.63 2em7 s LYS 39 Ca 0.68 -0.89 -0.11 0.00 0.00 0.00 0.00 55.97 55.65 2em7 s LYS 39 Cb -0.18 -1.68 0.05 0.00 0.00 0.00 0.00 37.83 36.02 2em7 s LYS 39 CO 0.61 0.45 1.09 -1.25 0.00 0.00 0.00 175.35 176.25 2em7 s PRO 40 N -0.85 2.34 0.26 1.78 0.04 -1.26 -4.94 135.00 132.37 2em7 s PRO 40 Ca 0.09 1.21 -0.30 0.00 0.04 0.00 0.00 61.00 62.03 2em7 s PRO 40 Cb -0.09 -1.91 -0.14 0.00 0.04 0.00 0.00 34.50 32.41 2em7 s PRO 40 CO 0.01 -1.58 1.24 0.45 0.04 0.00 0.00 177.00 177.16 2em7 n SER 41 N -3.34 2.16 -3.38 6.66 2.88 -1.26 -3.55 113.62 113.78 2em7 n SER 41 Ca 0.09 1.17 -0.27 0.00 -1.33 0.00 0.00 58.87 58.53 2em7 n SER 41 Cb 0.53 -1.37 0.03 0.00 -0.75 0.00 0.00 64.21 62.65 2em7 n SER 41 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2em7 n GLY 42 N 1.59 -0.04 3.74 0.46 0.00 -1.26 -4.85 105.19 104.83 2em7 n GLY 42 Ca 0.10 0.87 -0.41 0.00 0.00 0.00 0.00 46.02 46.58 2em7 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em7 s PRO 43 N -2.08 4.40 -0.39 1.61 0.04 -1.23 -4.92 135.00 132.43 2em7 s PRO 43 Ca 0.28 2.05 -0.27 0.00 0.04 0.00 0.00 61.00 63.09 2em7 s PRO 43 Cb -0.03 -3.19 -0.05 0.00 0.04 0.00 0.00 34.50 31.27 2em7 s PRO 43 CO 0.65 -0.22 2.22 0.45 0.04 0.00 0.00 177.00 180.14 2em7 s SER 44 N 0.24 5.04 0.99 6.66 0.15 -1.26 -4.91 113.70 120.60 2em7 s SER 44 Ca 0.56 1.31 -0.17 0.00 0.70 0.00 0.00 55.95 58.35 2em7 s SER 44 Cb -0.36 -2.51 -0.12 0.00 -1.71 0.00 0.00 66.02 61.32 2em7 s SER 44 CO 0.39 -2.38 -0.65 -0.24 1.20 0.00 0.00 173.24 171.56 2em7 n SER 45 N 13.50 -5.18 0.00 5.45 2.88 -1.26 -5.21 113.62 123.79 2em7 n SER 45 Ca 0.31 0.19 0.00 0.00 -1.33 0.00 0.00 58.87 58.04 2em7 n SER 45 Cb 0.50 -0.82 0.00 0.00 -0.75 0.00 0.00 64.21 63.14 2em7 n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42