#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em2 s SER 2 N 0.00 -0.72 -0.01 1.61 0.01 -1.26 -5.16 113.70 108.18 2em2 s SER 2 Ca 0.00 0.87 -0.01 0.00 1.31 0.00 0.00 55.95 58.11 2em2 s SER 2 Cb 0.00 1.78 -0.00 0.00 0.21 0.00 0.00 66.02 68.01 2em2 s SER 2 CO 0.00 -0.26 0.03 -0.44 0.41 0.00 0.00 173.24 172.98 2em2 s SER 3 N 2.74 0.02 -0.03 2.44 0.01 -1.26 -5.09 113.70 112.54 2em2 s SER 3 Ca 0.10 -0.05 -0.07 0.00 1.31 0.00 0.00 55.95 57.24 2em2 s SER 3 Cb -0.14 0.09 -0.04 0.00 0.21 0.00 0.00 66.02 66.14 2em2 s SER 3 CO -0.18 -0.09 0.41 1.23 0.41 0.00 0.00 173.24 175.02 2em2 h GLY 4 N 5.72 -0.26 -4.05 3.44 0.00 -2.08 -3.48 103.07 102.35 2em2 h GLY 4 Ca -0.26 0.10 -0.23 0.00 0.00 0.00 0.00 47.33 46.93 2em2 h GLY 4 CO 0.47 -0.09 -0.43 -1.26 0.00 0.00 0.00 176.54 175.22 2em2 n SER 5 N -3.81 -3.84 -4.56 0.19 2.88 -1.26 -5.00 113.62 98.22 2em2 n SER 5 Ca -0.03 -0.35 -0.28 0.00 -1.33 0.00 0.00 58.87 56.88 2em2 n SER 5 Cb 0.10 -3.30 0.22 0.00 -0.75 0.00 0.00 64.21 60.48 2em2 n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2em2 s SER 6 N -3.40 1.59 0.00 -3.46 1.04 -1.26 -4.95 113.70 103.25 2em2 s SER 6 Ca 0.24 1.31 0.00 0.00 0.48 0.00 0.00 55.95 57.98 2em2 s SER 6 Cb -0.11 -2.04 0.00 0.00 0.10 0.00 0.00 66.02 63.97 2em2 s SER 6 CO 0.45 -3.79 0.00 0.61 0.98 0.00 0.00 173.24 171.49 2em2 n GLY 7 N -0.09 0.58 3.20 7.32 0.00 -1.26 -5.01 105.19 109.94 2em2 n GLY 7 Ca 0.04 -1.54 -0.13 0.00 0.00 0.00 0.00 46.02 44.39 2em2 n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2em2 s SER 8 N -4.00 -0.21 -0.61 1.61 0.15 -1.26 -5.07 113.70 104.31 2em2 s SER 8 Ca 0.00 0.26 0.02 0.00 0.70 0.00 0.00 55.95 56.92 2em2 s SER 8 Cb 0.00 0.42 0.40 0.00 -1.71 0.00 0.00 66.02 65.13 2em2 s SER 8 CO 0.00 -0.31 1.58 0.61 1.20 0.00 0.00 173.24 176.32 2em2 n GLY 9 N 1.93 5.84 0.28 9.45 0.00 -1.26 -4.51 105.19 116.92 2em2 n GLY 9 Ca -0.18 -2.60 0.05 0.00 0.00 0.00 0.00 46.02 43.28 2em2 n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2em2 n GLU 10 N -0.57 0.64 -4.26 1.61 -0.58 -1.26 -5.06 120.64 111.16 2em2 n GLU 10 Ca 0.48 -1.77 -0.33 0.00 -0.42 0.00 0.00 57.16 55.12 2em2 n GLU 10 Cb 0.52 -0.99 -0.09 0.00 -0.57 0.00 0.00 31.44 30.31 2em2 n GLU 10 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2em2 s LYS 11 N -1.41 2.89 0.38 3.49 3.01 -1.26 -5.01 119.74 121.83 2em2 s LYS 11 Ca 0.16 -0.53 0.17 0.00 -1.01 0.00 0.00 55.97 54.75 2em2 s LYS 11 Cb 0.14 -2.74 0.75 0.00 -1.01 0.00 0.00 37.83 34.96 2em2 s LYS 11 CO 0.01 0.65 1.79 -1.00 0.51 0.00 0.00 175.35 177.31 2em2 h PRO 12 N 4.48 0.00 -5.11 -1.68 0.13 -1.86 -3.42 132.00 124.54 2em2 h PRO 12 Ca -0.49 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.01 2em2 h PRO 12 Cb 1.18 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.14 2em2 h PRO 12 CO 0.58 0.38 -0.55 -0.06 -0.23 0.00 0.00 178.00 178.11 2em2 s PHE 13 N -3.86 3.23 -0.09 1.56 0.08 -1.20 -5.02 117.98 112.68 2em2 s PHE 13 Ca -0.01 0.02 -0.01 0.00 0.12 0.00 0.00 56.93 57.05 2em2 s PHE 13 Cb 0.13 -2.20 0.03 0.00 -0.57 0.00 0.00 43.02 40.40 2em2 s PHE 13 CO 0.70 -0.02 -0.04 0.21 -0.10 0.00 0.00 175.22 175.97 2em2 s LYS 14 N 0.99 1.10 0.08 0.44 2.36 -1.26 -0.84 119.74 122.61 2em2 s LYS 14 Ca 0.05 -0.10 -0.33 0.00 -2.55 0.00 0.00 55.97 53.05 2em2 s LYS 14 Cb -0.14 -1.28 -0.12 0.00 -1.05 0.00 0.00 37.83 35.25 2em2 s LYS 14 CO 0.03 -0.26 1.76 0.00 1.55 0.00 0.00 175.35 178.43 2em2 n LYS 16 N 5.16 1.98 0.00 0.00 4.81 -1.26 -2.41 118.16 126.44 2em2 n LYS 16 Ca 0.19 -1.20 0.00 0.00 -0.87 0.00 0.00 58.31 56.43 2em2 n LYS 16 Cb 0.32 -1.62 0.00 0.00 0.02 0.00 0.00 35.03 33.75 2em2 n LYS 16 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2em2 n GLU 17 N 0.04 0.00 -0.03 1.64 -0.58 -1.26 -4.95 120.64 115.50 2em2 n GLU 17 Ca 0.17 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.87 2em2 n GLU 17 Cb 0.80 -0.63 -0.02 0.00 -0.57 0.00 0.00 31.44 31.02 2em2 n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2em2 n GLY 19 N 2.86 1.80 3.82 0.00 0.00 -1.01 -5.05 105.19 107.61 2em2 n GLY 19 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 2em2 n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2em2 s LYS 20 N 0.00 4.26 -0.01 1.61 2.36 -1.26 -4.74 119.74 121.96 2em2 s LYS 20 Ca 0.00 1.01 0.01 0.00 -2.55 0.00 0.00 55.97 54.44 2em2 s LYS 20 Cb 0.00 -2.50 -0.04 0.00 -1.05 0.00 0.00 37.83 34.24 2em2 s LYS 20 CO 0.00 0.16 0.03 0.00 1.55 0.00 0.00 175.35 177.08 2em2 s ALA 21 N -1.89 3.38 -0.01 3.13 0.00 -1.26 -0.11 121.76 124.99 2em2 s ALA 21 Ca 0.54 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.60 2em2 s ALA 21 Cb -0.13 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.57 2em2 s ALA 21 CO 0.18 0.66 -0.06 -0.06 0.00 0.00 0.00 175.76 176.47 2em2 s PHE 22 N -1.11 0.64 0.21 0.00 0.40 -0.02 -4.97 117.98 113.14 2em2 s PHE 22 Ca 0.20 -0.13 -0.04 0.00 -0.60 0.00 0.00 56.93 56.36 2em2 s PHE 22 Cb -0.12 -0.45 0.18 0.00 0.51 0.00 0.00 43.02 43.13 2em2 s PHE 22 CO 0.11 -0.05 1.59 0.07 0.70 0.00 0.00 175.22 177.64 2em2 h ARG 23 N 6.26 0.68 -6.00 0.44 0.11 -1.96 -3.17 114.38 110.73 2em2 h ARG 23 Ca -0.31 -0.32 -0.56 0.00 0.10 0.00 0.00 59.98 58.89 2em2 h ARG 23 Cb 1.18 -0.01 -0.14 0.00 1.11 0.00 0.00 29.97 32.11 2em2 h ARG 23 CO 0.49 0.92 -0.75 -0.65 0.10 0.00 0.00 179.97 180.08 2em2 s GLN 24 N -4.38 1.54 0.13 0.08 -1.52 -1.26 -4.77 119.66 109.49 2em2 s GLN 24 Ca -0.08 -1.69 -0.15 0.00 -1.95 0.00 0.00 55.36 51.49 2em2 s GLN 24 Cb 0.12 -1.54 -0.00 0.00 -0.22 0.00 0.00 33.01 31.37 2em2 s GLN 24 CO 0.83 0.28 1.63 -2.95 -0.25 0.00 0.00 175.29 174.84 2em2 h ASN 25 N 2.43 0.65 -0.73 5.90 -1.07 -2.00 -3.02 115.58 117.74 2em2 h ASN 25 Ca -0.40 -0.24 0.16 0.00 0.07 0.00 0.00 56.30 55.89 2em2 h ASN 25 Cb 1.24 -0.17 -0.13 0.00 -2.07 0.00 0.00 38.32 37.19 2em2 h ASN 25 CO 0.60 0.72 -0.06 -0.29 0.07 0.00 0.00 177.43 178.47 2em2 h ILE 26 N 0.55 0.33 0.17 6.14 2.10 -1.98 0.16 117.51 124.97 2em2 h ILE 26 Ca 0.13 -0.02 0.00 0.00 1.08 0.00 0.00 64.86 66.05 2em2 h ILE 26 Cb 0.33 0.26 -0.01 0.00 -1.09 0.00 0.00 36.82 36.31 2em2 h ILE 26 CO 0.00 0.01 -0.14 0.45 -1.08 0.00 0.00 178.15 177.40 2em2 h HIS 27 N 0.06 -0.35 0.01 2.19 3.86 -1.95 0.60 115.15 119.57 2em2 h HIS 27 Ca 0.38 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.62 2em2 h HIS 27 Cb 0.64 0.13 -0.04 0.00 1.06 0.00 0.00 27.41 29.21 2em2 h HIS 27 CO -0.47 -0.21 -0.20 1.25 0.86 0.00 0.00 177.93 179.16 2em2 h LEU 28 N -0.32 -0.59 -1.46 2.43 5.85 -1.06 0.66 115.31 120.82 2em2 h LEU 28 Ca -0.01 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.85 2em2 h LEU 28 Cb 0.29 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 2em2 h LEU 28 CO -0.02 -0.27 0.42 0.00 -0.34 0.00 0.00 178.44 178.24 2em2 h ALA 29 N 0.56 1.75 0.00 1.25 0.00 -0.63 0.30 119.26 122.49 2em2 h ALA 29 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2em2 h ALA 29 Cb 0.40 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2em2 h ALA 29 CO -0.18 0.16 0.00 0.77 0.00 0.00 0.00 179.25 180.00 2em2 h SER 30 N 0.67 0.00 0.05 0.00 0.02 0.07 -3.26 113.55 111.10 2em2 h SER 30 Ca 0.27 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.85 2em2 h SER 30 Cb 0.22 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 2em2 h SER 30 CO -0.08 0.00 -2.16 1.57 -1.14 0.00 0.00 176.83 175.02 2em2 n HIS 31 N -2.31 0.65 -0.34 3.45 -0.00 0.27 -4.31 115.22 112.63 2em2 n HIS 31 Ca 0.04 0.16 0.18 0.00 -0.00 0.00 0.00 57.72 58.10 2em2 n HIS 31 Cb 0.37 -1.08 0.39 0.00 -0.00 0.00 0.00 29.99 29.67 2em2 n HIS 31 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2em2 h LEU 32 N -0.16 0.62 -1.94 0.27 3.38 -0.57 0.58 115.31 117.49 2em2 h LEU 32 Ca -0.50 0.15 0.17 0.00 0.09 0.00 0.00 57.88 57.79 2em2 h LEU 32 Cb 1.87 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 42.65 2em2 h LEU 32 CO -0.06 0.06 0.44 0.08 0.09 0.00 0.00 178.44 179.06 2em2 h ARG 33 N 0.53 0.06 0.00 1.13 0.11 -1.75 0.31 114.38 114.78 2em2 h ARG 33 Ca 0.65 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.73 2em2 h ARG 33 Cb 1.27 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.34 2em2 h ARG 33 CO -0.50 0.04 0.00 0.44 0.10 0.00 0.00 179.97 180.05 2em2 n ILE 34 N -4.37 1.38 -0.04 0.08 -6.64 0.20 -1.51 119.36 108.46 2em2 n ILE 34 Ca 0.12 0.59 -0.02 0.00 -1.77 0.00 0.00 62.75 61.67 2em2 n ILE 34 Cb 0.66 -1.57 -0.10 0.00 -1.44 0.00 0.00 39.64 37.19 2em2 n ILE 34 CO 0.00 0.00 0.00 1.41 -1.77 0.00 0.00 176.55 176.19 2em2 n HIS 35 N -1.94 0.00 -1.61 4.28 8.25 0.11 -5.01 115.22 119.30 2em2 n HIS 35 Ca -0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 2em2 n HIS 35 Cb 0.04 -0.51 0.01 0.00 1.12 0.00 0.00 29.99 30.65 2em2 n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2em2 n THR 36 N -2.30 2.50 -2.67 1.59 -2.24 -0.57 -5.00 114.28 105.59 2em2 n THR 36 Ca -0.14 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 2em2 n THR 36 Cb 0.72 -1.15 0.00 0.00 -2.10 0.00 0.00 70.33 67.81 2em2 n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2em2 n GLY 37 N 1.20 6.20 0.35 3.38 0.00 -1.26 -5.00 105.19 110.06 2em2 n GLY 37 Ca 0.10 -1.68 0.01 0.00 0.00 0.00 0.00 46.02 44.45 2em2 n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2em2 n GLU 38 N 0.00 1.29 -4.19 1.61 -0.58 -1.26 -4.82 120.64 112.70 2em2 n GLU 38 Ca 0.00 -0.33 -0.31 0.00 -0.42 0.00 0.00 57.16 56.10 2em2 n GLU 38 Cb 0.00 -1.27 -0.08 0.00 -0.57 0.00 0.00 31.44 29.52 2em2 n GLU 38 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 2em2 s LYS 39 N -1.62 2.68 -0.36 3.49 -2.85 -1.26 -5.06 119.74 114.75 2em2 s LYS 39 Ca 0.06 -0.73 -0.28 0.00 -1.00 0.00 0.00 55.97 54.02 2em2 s LYS 39 Cb 0.04 -2.61 -0.01 0.00 -2.06 0.00 0.00 37.83 33.19 2em2 s LYS 39 CO 0.03 0.58 1.70 -1.25 0.10 0.00 0.00 175.35 176.51 2em2 s PRO 40 N -1.99 3.37 -0.43 1.78 0.04 -1.26 -4.91 135.00 131.59 2em2 s PRO 40 Ca 0.23 1.27 -0.28 0.00 0.04 0.00 0.00 61.00 62.27 2em2 s PRO 40 Cb -0.12 -4.16 -0.08 0.00 0.04 0.00 0.00 34.50 30.18 2em2 s PRO 40 CO 0.15 -1.82 2.36 0.45 0.04 0.00 0.00 177.00 178.18 2em2 n SER 41 N 10.02 2.44 0.00 6.66 2.88 -1.26 -4.63 113.62 129.72 2em2 n SER 41 Ca 0.21 -0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2em2 n SER 41 Cb 0.47 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 2em2 n SER 41 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2em2 n GLY 42 N 6.03 -0.49 0.00 0.46 0.00 -1.26 -4.38 105.19 105.54 2em2 n GLY 42 Ca 0.37 -1.80 0.07 0.00 0.00 0.00 0.00 46.02 44.66 2em2 n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2em2 n PRO 43 N -0.53 0.04 -2.36 1.61 -0.04 -1.26 -4.74 135.00 127.72 2em2 n PRO 43 Ca 0.00 0.23 -0.42 0.00 -0.04 0.00 0.00 63.50 63.27 2em2 n PRO 43 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2em2 n PRO 43 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2em2 s SER 44 N -2.91 6.98 -0.29 3.54 0.01 -1.26 -5.00 113.70 114.77 2em2 s SER 44 Ca 0.08 1.97 -0.01 0.00 1.31 0.00 0.00 55.95 59.30 2em2 s SER 44 Cb 0.09 -2.56 0.09 0.00 0.21 0.00 0.00 66.02 63.85 2em2 s SER 44 CO 0.25 -0.61 0.08 -0.44 0.41 0.00 0.00 173.24 172.93 2em2 s SER 45 N 1.52 3.85 0.00 2.44 0.01 -1.26 -4.64 113.70 115.62 2em2 s SER 45 Ca 0.59 -1.49 0.29 0.00 1.31 0.00 0.00 55.95 56.66 2em2 s SER 45 Cb -0.28 -0.84 1.34 0.00 0.21 0.00 0.00 66.02 66.45 2em2 s SER 45 CO 0.25 -0.39 1.91 0.61 0.41 0.00 0.00 173.24 176.03