#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 5.84 -0.28 1.61 0.01 -1.26 -5.09 113.70 114.53 2em2 s SER 2 Ca 0.00 0.23 -0.18 0.00 1.31 0.00 0.00 55.95 57.31 2em2 s SER 2 Cb 0.00 -1.90 0.08 0.00 0.21 0.00 0.00 66.02 64.41 2em2 s SER 2 CO 0.00 0.29 0.73 -0.44 0.41 0.00 0.00 173.24 174.23 2em2 s SER 3 N -0.33 -0.86 0.00 2.44 0.01 -1.26 -5.04 113.70 108.67 2em2 s SER 3 Ca 0.09 1.43 0.00 0.00 1.31 0.00 0.00 55.95 58.78 2em2 s SER 3 Cb -0.12 1.38 0.00 0.00 0.21 0.00 0.00 66.02 67.49 2em2 s SER 3 CO 0.02 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.04 2em2 n GLY 4 N 3.87 1.53 3.79 3.44 0.00 -1.26 -4.93 105.19 111.62 2em2 n GLY 4 Ca -0.18 -0.51 -0.38 0.00 0.00 0.00 0.00 46.02 44.95 2em2 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2em2 s SER 5 N -4.00 6.67 -0.06 1.61 1.04 -1.26 -5.08 113.70 112.61 2em2 s SER 5 Ca 0.00 0.79 0.05 0.00 0.48 0.00 0.00 55.95 57.28 2em2 s SER 5 Cb 0.00 -2.23 -0.01 0.00 0.10 0.00 0.00 66.02 63.88 2em2 s SER 5 CO 0.00 0.20 -0.23 -0.44 0.98 0.00 0.00 173.24 173.76 2em2 s SER 6 N -0.31 2.81 0.00 7.02 0.01 -1.26 -5.04 113.70 116.93 2em2 s SER 6 Ca 0.22 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.01 2em2 s SER 6 Cb -0.15 -0.87 0.00 0.00 0.21 0.00 0.00 66.02 65.20 2em2 s SER 6 CO 0.10 0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.56 2em2 n GLY 7 N 3.12 0.97 3.30 3.44 0.00 -1.26 -5.01 105.19 109.75 2em2 n GLY 7 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2em2 n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2em2 n SER 8 N 0.00 -2.35 0.00 1.61 7.64 -1.26 -4.80 113.62 114.46 2em2 n SER 8 Ca 0.00 -0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2em2 n SER 8 Cb 0.00 -1.00 0.00 0.00 -1.01 0.00 0.00 64.21 62.20 2em2 n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2em2 n GLY 9 N 1.94 0.96 0.11 0.23 0.00 -1.26 -5.09 105.19 102.08 2em2 n GLY 9 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 2em2 n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2em2 n GLU 10 N 0.00 0.54 -1.60 1.61 2.13 -1.26 -4.98 120.64 117.09 2em2 n GLU 10 Ca 0.00 0.31 -0.39 0.00 0.66 0.00 0.00 57.16 57.74 2em2 n GLU 10 Cb 0.00 -1.52 0.04 0.00 0.27 0.00 0.00 31.44 30.23 2em2 n GLU 10 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2em2 n LYS 11 N -4.41 0.97 -0.03 5.31 4.76 -1.26 -4.93 118.16 118.56 2em2 n LYS 11 Ca -0.29 0.37 -0.13 0.00 -2.87 0.00 0.00 58.31 55.39 2em2 n LYS 11 Cb 0.63 -2.08 -0.09 0.00 -1.84 0.00 0.00 35.03 31.65 2em2 n LYS 11 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 2em2 h PRO 12 N 0.72 0.17 -5.90 1.97 0.13 -1.91 -3.43 132.00 123.75 2em2 h PRO 12 Ca -0.47 -0.09 -0.58 0.00 -0.87 0.00 0.00 66.00 63.99 2em2 h PRO 12 Cb 1.36 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.42 2em2 h PRO 12 CO 0.52 0.61 0.23 -0.06 -0.23 0.00 0.00 178.00 179.06 2em2 s PHE 13 N -4.28 3.46 -0.04 1.56 0.08 -1.24 -5.00 117.98 112.52 2em2 s PHE 13 Ca -0.15 1.17 0.00 0.00 0.12 0.00 0.00 56.93 58.08 2em2 s PHE 13 Cb 0.03 -2.89 0.02 0.00 -0.57 0.00 0.00 43.02 39.61 2em2 s PHE 13 CO 0.71 -0.12 -0.02 0.21 -0.10 0.00 0.00 175.22 175.91 2em2 s LYS 14 N 1.66 0.52 0.06 0.44 2.47 -1.26 -0.80 119.74 122.83 2em2 s LYS 14 Ca 0.36 0.01 -0.31 0.00 -1.56 0.00 0.00 55.97 54.47 2em2 s LYS 14 Cb -0.17 -0.65 -0.08 0.00 -1.46 0.00 0.00 37.83 35.47 2em2 s LYS 14 CO 0.14 -0.13 1.60 0.00 0.16 0.00 0.00 175.35 177.12 2em2 n LYS 16 N 5.46 2.72 0.00 0.00 4.81 -1.26 -2.40 118.16 127.49 2em2 n LYS 16 Ca 0.15 -1.70 0.00 0.00 -0.87 0.00 0.00 58.31 55.89 2em2 n LYS 16 Cb 0.41 -1.84 0.00 0.00 0.02 0.00 0.00 35.03 33.62 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 0.13 0.00 -0.02 1.64 1.02 -1.26 -4.93 120.64 117.22 2em2 n GLU 17 Ca 0.20 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.31 2em2 n GLU 17 Cb 0.88 -0.92 -0.01 0.00 -0.02 0.00 0.00 31.44 31.37 2em2 n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2em2 n GLY 19 N 2.96 1.77 3.90 0.00 0.00 -1.01 -5.06 105.19 107.75 2em2 n GLY 19 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 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 3.00 0.37 1.61 2.20 -1.26 -4.76 119.74 120.90 2em2 s LYS 20 Ca 0.00 0.28 0.09 0.00 -0.36 0.00 0.00 55.97 55.97 2em2 s LYS 20 Cb 0.00 -2.15 -0.07 0.00 -1.51 0.00 0.00 37.83 34.10 2em2 s LYS 20 CO 0.00 -0.80 -0.03 0.00 -0.36 0.00 0.00 175.35 174.16 2em2 s ALA 21 N -3.15 3.09 0.26 3.13 0.00 -1.26 0.16 121.76 123.99 2em2 s ALA 21 Ca 0.55 -2.14 -0.15 0.00 0.00 0.00 0.00 51.96 50.22 2em2 s ALA 21 Cb -0.11 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.98 2em2 s ALA 21 CO 0.49 0.00 0.56 -0.06 0.00 0.00 0.00 175.76 176.75 2em2 s PHE 22 N -2.63 0.19 -0.21 0.00 0.40 0.02 -4.93 117.98 110.83 2em2 s PHE 22 Ca 0.34 -0.59 0.03 0.00 -0.60 0.00 0.00 56.93 56.11 2em2 s PHE 22 Cb 0.05 0.36 -0.15 0.00 0.51 0.00 0.00 43.02 43.79 2em2 s PHE 22 CO 0.18 -1.08 -0.16 0.54 0.70 0.00 0.00 175.22 175.39 2em2 n ARG 23 N -0.41 0.62 -4.31 0.44 1.74 -1.26 -3.70 116.66 109.77 2em2 n ARG 23 Ca -0.02 0.11 -0.17 0.00 -0.77 0.00 0.00 57.85 56.99 2em2 n ARG 23 Cb 0.61 -1.42 -0.10 0.00 -1.02 0.00 0.00 32.46 30.53 2em2 n ARG 23 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2em2 s GLN 24 N -2.42 1.25 0.22 5.56 -1.52 -1.26 -4.83 119.66 116.67 2em2 s GLN 24 Ca -0.26 -1.58 -0.07 0.00 -1.95 0.00 0.00 55.36 51.50 2em2 s GLN 24 Cb 0.07 -0.81 0.31 0.00 -0.22 0.00 0.00 33.01 32.36 2em2 s GLN 24 CO 0.51 0.06 1.80 -0.91 -0.25 0.00 0.00 175.29 176.50 2em2 h ASN 25 N 2.59 0.57 -0.76 5.90 2.35 -2.00 -2.10 115.58 122.12 2em2 h ASN 25 Ca -0.38 0.04 0.18 0.00 -0.55 0.00 0.00 56.30 55.59 2em2 h ASN 25 Cb 1.21 -0.07 -0.13 0.00 0.05 0.00 0.00 38.32 39.38 2em2 h ASN 25 CO 0.64 0.35 0.04 -0.29 -1.65 0.00 0.00 177.43 176.51 2em2 h ILE 26 N 0.70 0.35 0.81 2.81 6.09 -1.97 0.20 117.51 126.50 2em2 h ILE 26 Ca 0.34 -0.04 -0.04 0.00 -1.37 0.00 0.00 64.86 63.75 2em2 h ILE 26 Cb 0.27 0.22 0.00 0.00 0.47 0.00 0.00 36.82 37.78 2em2 h ILE 26 CO -0.22 0.02 -0.45 0.45 -3.07 0.00 0.00 178.15 174.89 2em2 h HIS 27 N 0.12 -1.18 -0.28 2.19 3.86 -1.80 0.16 115.15 118.23 2em2 h HIS 27 Ca 0.42 -0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.68 2em2 h HIS 27 Cb 0.76 0.41 -0.08 0.00 1.06 0.00 0.00 27.41 29.56 2em2 h HIS 27 CO -0.40 -0.69 -0.27 1.25 0.86 0.00 0.00 177.93 178.69 2em2 h LEU 28 N -1.16 -0.87 -2.14 2.43 5.85 -1.26 0.21 115.31 118.38 2em2 h LEU 28 Ca -0.11 0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.78 2em2 h LEU 28 Cb 0.91 0.41 -0.00 0.00 0.37 0.00 0.00 40.66 42.34 2em2 h LEU 28 CO 0.14 -0.30 0.04 0.00 -0.34 0.00 0.00 178.44 177.99 2em2 h ALA 29 N 0.77 1.90 0.00 1.25 0.00 -0.58 0.28 119.26 122.88 2em2 h ALA 29 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2em2 h ALA 29 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2em2 h ALA 29 CO -0.43 -0.07 -0.14 1.03 0.00 0.00 0.00 179.25 179.64 2em2 h SER 30 N 0.00 0.00 0.04 0.00 0.87 0.22 -3.33 113.55 111.36 2em2 h SER 30 Ca 0.03 -0.03 -0.38 0.00 -1.23 0.00 0.00 61.79 60.18 2em2 h SER 30 Cb 0.11 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.03 2em2 h SER 30 CO -0.00 0.01 -2.24 1.57 -0.53 0.00 0.00 176.83 175.65 2em2 n HIS 31 N -2.51 0.51 -0.26 2.24 -0.00 0.28 -4.27 115.22 111.20 2em2 n HIS 31 Ca 0.05 0.12 0.28 0.00 -0.00 0.00 0.00 57.72 58.17 2em2 n HIS 31 Cb 0.47 -1.06 0.66 0.00 -0.00 0.00 0.00 29.99 30.05 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 -0.15 0.15 -1.88 0.27 3.38 -0.67 0.39 115.31 116.80 2em2 h LEU 32 Ca -0.52 0.02 0.13 0.00 0.09 0.00 0.00 57.88 57.60 2em2 h LEU 32 Cb 1.88 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.60 2em2 h LEU 32 CO -0.07 0.04 0.37 0.08 0.09 0.00 0.00 178.44 178.95 2em2 h ARG 33 N 0.14 0.13 0.00 1.13 0.11 -1.74 0.44 114.38 114.58 2em2 h ARG 33 Ca 0.51 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.59 2em2 h ARG 33 Cb 1.77 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.82 2em2 h ARG 33 CO -0.10 0.08 0.00 0.44 0.10 0.00 0.00 179.97 180.50 2em2 n ILE 34 N -4.42 0.82 -0.04 0.08 -6.64 0.14 -2.60 119.36 106.70 2em2 n ILE 34 Ca 0.09 0.18 0.02 0.00 -1.77 0.00 0.00 62.75 61.28 2em2 n ILE 34 Cb 0.51 -1.03 -0.14 0.00 -1.44 0.00 0.00 39.64 37.54 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 -1.97 0.00 -1.42 4.28 8.25 0.14 -4.50 115.22 120.00 2em2 n HIS 35 Ca 0.03 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.20 2em2 n HIS 35 Cb 0.23 -0.57 0.01 0.00 1.12 0.00 0.00 29.99 30.78 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 -2.32 3.32 0.00 1.59 -2.24 -0.56 -4.71 114.28 109.37 2em2 n THR 36 Ca -0.13 -2.98 0.00 0.00 -2.27 0.00 0.00 64.05 58.67 2em2 n THR 36 Cb 0.70 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.56 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 0.07 1.34 3.29 3.38 0.00 -1.25 -4.88 105.19 107.14 2em2 n GLY 37 Ca 0.49 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.93 2em2 n GLY 37 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2em2 n GLU 38 N -0.21 0.00 -1.82 1.61 4.07 -1.26 -4.82 120.64 118.22 2em2 n GLU 38 Ca 0.00 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.71 2em2 n GLU 38 Cb 0.00 -1.36 0.02 0.00 -0.06 0.00 0.00 31.44 30.04 2em2 n GLU 38 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2em2 s LYS 39 N 1.46 3.57 0.39 5.31 -0.14 -1.26 -4.96 119.74 124.11 2em2 s LYS 39 Ca 0.89 2.35 -0.26 0.00 -1.36 0.00 0.00 55.97 57.59 2em2 s LYS 39 Cb -1.26 -2.56 -0.09 0.00 -1.68 0.00 0.00 37.83 32.25 2em2 s LYS 39 CO 0.64 -0.89 1.19 -1.25 -0.76 0.00 0.00 175.35 174.28 2em2 s PRO 40 N -2.56 4.07 0.55 -1.68 0.04 -1.26 -4.99 135.00 129.17 2em2 s PRO 40 Ca 0.63 1.90 -0.21 0.00 0.04 0.00 0.00 61.00 63.37 2em2 s PRO 40 Cb -0.42 -2.72 -0.05 0.00 0.04 0.00 0.00 34.50 31.35 2em2 s PRO 40 CO 0.53 -0.33 1.29 0.45 0.04 0.00 0.00 177.00 178.99 2em2 s SER 41 N -1.04 5.37 0.00 6.66 0.15 -1.26 -4.78 113.70 118.80 2em2 s SER 41 Ca 0.56 2.61 0.00 0.00 0.70 0.00 0.00 55.95 59.82 2em2 s SER 41 Cb -0.32 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.36 2em2 s SER 41 CO 0.41 -1.49 0.00 0.61 1.20 0.00 0.00 173.24 173.97 2em2 n GLY 42 N 0.66 -2.15 3.64 9.45 0.00 -1.26 -5.04 105.19 110.49 2em2 n GLY 42 Ca 0.11 -1.16 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 2em2 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em2 s PRO 43 N -5.05 -0.29 -0.50 1.61 0.04 -1.26 -4.92 135.00 124.63 2em2 s PRO 43 Ca 0.00 0.27 -0.04 0.00 0.04 0.00 0.00 61.00 61.27 2em2 s PRO 43 Cb 0.00 -1.68 0.04 0.00 0.04 0.00 0.00 34.50 32.90 2em2 s PRO 43 CO 0.00 -3.16 2.82 0.43 0.04 0.00 0.00 177.00 177.13 2em2 n SER 44 N -4.43 6.51 -4.37 6.66 7.64 -1.26 -4.85 113.62 119.52 2em2 n SER 44 Ca 0.08 -3.13 -0.46 0.00 1.01 0.00 0.00 58.87 56.37 2em2 n SER 44 Cb 0.58 -1.26 -0.02 0.00 -1.01 0.00 0.00 64.21 62.50 2em2 n SER 44 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2em2 s SER 45 N 0.52 6.69 0.00 6.43 0.15 -1.26 -5.35 113.70 120.87 2em2 s SER 45 Ca 0.59 -2.43 0.00 0.00 0.70 0.00 0.00 55.95 54.82 2em2 s SER 45 Cb 0.36 -2.27 0.00 0.00 -1.71 0.00 0.00 66.02 62.40 2em2 s SER 45 CO -0.19 -0.75 0.00 0.61 1.20 0.00 0.00 173.24 174.11