#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eoe s SER 2 N 0.00 -0.45 0.29 1.61 0.15 -1.26 -5.18 113.70 108.86 2eoe s SER 2 Ca 0.00 0.80 0.10 0.00 0.70 0.00 0.00 55.95 57.54 2eoe s SER 2 Cb 0.00 0.98 -0.05 0.00 -1.71 0.00 0.00 66.02 65.24 2eoe s SER 2 CO 0.00 -0.13 -0.01 -0.94 1.20 0.00 0.00 173.24 173.35 2eoe s SER 3 N 0.72 4.32 0.00 5.45 1.04 -1.26 -5.10 113.70 118.88 2eoe s SER 3 Ca -0.02 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.60 2eoe s SER 3 Cb -0.04 -0.67 0.00 0.00 0.10 0.00 0.00 66.02 65.40 2eoe s SER 3 CO -0.11 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.64 2eoe n GLY 4 N -0.90 1.93 3.57 7.32 0.00 -1.26 -5.18 105.19 110.67 2eoe n GLY 4 Ca -0.05 0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 2eoe n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eoe s SER 5 N 2.00 3.09 -0.09 1.61 0.01 -1.26 -5.15 113.70 113.90 2eoe s SER 5 Ca 0.00 -1.59 -0.03 0.00 1.31 0.00 0.00 55.95 55.64 2eoe s SER 5 Cb 0.00 0.34 0.05 0.00 0.21 0.00 0.00 66.02 66.61 2eoe s SER 5 CO 0.00 -0.82 0.13 -0.55 0.41 0.00 0.00 173.24 172.41 2eoe s SER 6 N -3.65 1.15 0.07 2.44 0.15 -1.26 -5.14 113.70 107.45 2eoe s SER 6 Ca 0.23 0.07 -0.27 0.00 0.70 0.00 0.00 55.95 56.68 2eoe s SER 6 Cb 0.04 0.09 0.08 0.00 -1.71 0.00 0.00 66.02 64.52 2eoe s SER 6 CO 0.12 -0.27 0.88 -0.83 1.20 0.00 0.00 173.24 174.34 2eoe s GLY 7 N 2.24 -0.39 -0.29 9.45 0.00 -1.26 -5.17 107.32 111.90 2eoe s GLY 7 Ca 0.04 0.64 -0.16 0.00 0.00 0.00 0.00 44.72 45.24 2eoe s GLY 7 CO -0.06 0.20 0.88 -1.08 0.00 0.00 0.00 173.10 173.03 2eoe s THR 8 N -3.25 -0.04 0.00 0.90 -1.32 -1.26 -5.10 115.64 105.57 2eoe s THR 8 Ca 0.07 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.55 2eoe s THR 8 Cb -0.01 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.98 2eoe s THR 8 CO -0.05 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 2eoe n GLY 9 N 3.99 0.65 3.63 6.08 0.00 -1.26 -5.05 105.19 113.24 2eoe n GLY 9 Ca -0.19 -0.69 -0.46 0.00 0.00 0.00 0.00 46.02 44.69 2eoe n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2eoe n GLU 10 N 0.00 1.69 -3.70 1.61 -0.58 -1.26 -4.93 120.64 113.47 2eoe n GLU 10 Ca 0.00 0.60 -0.34 0.00 -0.42 0.00 0.00 57.16 57.00 2eoe n GLU 10 Cb 0.00 -2.18 -0.08 0.00 -0.57 0.00 0.00 31.44 28.61 2eoe n GLU 10 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2eoe n LYS 11 N 1.79 2.46 -0.10 3.49 5.02 -1.26 -4.89 118.16 124.67 2eoe n LYS 11 Ca 0.12 -4.49 -0.12 0.00 -2.02 0.00 0.00 58.31 51.81 2eoe n LYS 11 Cb 0.29 -2.38 0.00 0.00 -0.02 0.00 0.00 35.03 32.93 2eoe n LYS 11 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2eoe h PRO 12 N 5.79 0.87 -4.52 1.97 0.13 -1.92 -3.41 132.00 130.91 2eoe h PRO 12 Ca 0.16 -0.45 -0.61 0.00 -0.87 0.00 0.00 66.00 64.22 2eoe h PRO 12 Cb 0.79 0.01 -0.37 0.00 0.13 0.00 0.00 31.00 31.56 2eoe h PRO 12 CO 0.83 1.10 -0.80 0.71 -0.23 0.00 0.00 178.00 179.60 2eoe s TYR 13 N -4.36 2.43 -0.07 1.56 2.02 -1.26 -5.10 117.35 112.56 2eoe s TYR 13 Ca -0.10 -1.64 0.00 0.00 -0.37 0.00 0.00 57.07 54.96 2eoe s TYR 13 Cb 0.11 -1.63 0.02 0.00 -0.40 0.00 0.00 41.96 40.07 2eoe s TYR 13 CO 0.87 -0.75 -0.05 0.21 -1.57 0.00 0.00 175.55 174.26 2eoe s LYS 14 N 1.39 0.99 -1.17 -0.62 2.20 -1.26 -2.39 119.74 118.87 2eoe s LYS 14 Ca -0.03 -0.11 -0.21 0.00 -0.36 0.00 0.00 55.97 55.26 2eoe s LYS 14 Cb -0.17 -1.07 -0.02 0.00 -1.51 0.00 0.00 37.83 35.06 2eoe s LYS 14 CO -0.08 -0.16 1.83 0.00 -0.36 0.00 0.00 175.35 176.58 2eoe h ASN 16 N 9.22 0.07 0.23 0.00 -1.07 -1.95 1.41 115.58 123.50 2eoe h ASN 16 Ca 0.28 0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.67 2eoe h ASN 16 Cb 0.93 0.01 -0.04 0.00 -2.07 0.00 0.00 38.32 37.15 2eoe h ASN 16 CO 1.32 -0.01 -0.52 -0.33 0.07 0.00 0.00 177.43 177.96 2eoe h GLU 17 N 0.05 -0.80 0.00 4.14 3.07 -1.98 -3.36 114.58 115.70 2eoe h GLU 17 Ca 0.66 0.05 -0.40 0.00 -0.50 0.00 0.00 59.36 59.18 2eoe h GLU 17 Cb 2.49 0.18 -0.06 0.00 -0.84 0.00 0.00 28.75 30.52 2eoe h GLU 17 CO -0.08 -0.53 -2.38 0.00 -1.40 0.00 0.00 179.01 174.62 2eoe n GLY 19 N 1.75 1.34 4.01 0.00 0.00 0.47 -5.06 105.19 107.70 2eoe n GLY 19 Ca -0.47 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.35 2eoe n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eoe s LYS 20 N 0.00 2.28 -0.13 1.61 1.02 -1.21 -4.83 119.74 118.48 2eoe s LYS 20 Ca 0.00 -1.32 -0.11 0.00 0.02 0.00 0.00 55.97 54.56 2eoe s LYS 20 Cb 0.00 -2.57 0.04 0.00 -0.52 0.00 0.00 37.83 34.78 2eoe s LYS 20 CO 0.00 -0.87 0.34 0.08 -0.92 0.00 0.00 175.35 173.98 2eoe s VAL 21 N -2.73 -0.01 0.12 3.17 1.01 -1.26 -0.51 120.40 120.18 2eoe s VAL 21 Ca 0.61 0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.66 2eoe s VAL 21 Cb -0.07 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 2eoe s VAL 21 CO 0.39 0.01 -0.12 -0.36 0.00 0.00 0.00 175.10 175.02 2eoe s PHE 22 N 0.42 1.27 -0.01 5.22 0.40 -1.01 -5.03 117.98 119.25 2eoe s PHE 22 Ca -0.02 -0.62 -0.21 0.00 -0.60 0.00 0.00 56.93 55.49 2eoe s PHE 22 Cb -0.04 -0.67 -0.24 0.00 0.51 0.00 0.00 43.02 42.58 2eoe s PHE 22 CO -0.02 0.09 1.07 1.15 0.70 0.00 0.00 175.22 178.21 2eoe h THR 23 N 3.40 1.45 -3.19 0.64 2.02 -1.99 -3.38 112.91 111.86 2eoe h THR 23 Ca -0.38 -2.11 -0.62 0.00 0.77 0.00 0.00 66.41 64.07 2eoe h THR 23 Cb 1.19 2.67 -0.13 0.00 -1.74 0.00 0.00 68.15 70.15 2eoe h THR 23 CO 0.54 0.61 -0.52 -1.58 0.37 0.00 0.00 175.52 174.93 2eoe s GLN 24 N -3.12 3.95 0.28 6.66 0.74 -1.26 -4.92 119.66 121.99 2eoe s GLN 24 Ca -0.14 -0.26 0.02 0.00 0.05 0.00 0.00 55.36 55.04 2eoe s GLN 24 Cb 0.03 -3.28 0.69 0.00 1.10 0.00 0.00 33.01 31.55 2eoe s GLN 24 CO 0.81 0.38 1.68 -2.95 -0.55 0.00 0.00 175.29 174.67 2eoe h ASN 25 N 6.36 0.22 -0.51 6.67 7.08 -1.99 0.34 115.58 133.75 2eoe h ASN 25 Ca -0.42 0.16 0.10 0.00 -3.08 0.00 0.00 56.30 53.06 2eoe h ASN 25 Cb 1.17 0.17 -0.09 0.00 -2.08 0.00 0.00 38.32 37.49 2eoe h ASN 25 CO 0.71 -0.04 -0.02 0.77 -2.08 0.00 0.00 177.43 176.76 2eoe h SER 26 N 0.34 -0.27 -0.75 6.14 4.64 -1.98 -0.20 113.55 121.47 2eoe h SER 26 Ca 0.54 0.13 0.14 0.00 -0.47 0.00 0.00 61.79 62.13 2eoe h SER 26 Cb 1.03 0.24 -0.10 0.00 -0.31 0.00 0.00 62.40 63.26 2eoe h SER 26 CO -0.55 -0.09 0.28 0.45 -0.87 0.00 0.00 176.83 176.05 2eoe h HIS 27 N 0.09 0.48 0.41 4.77 3.86 -1.34 0.13 115.15 123.56 2eoe h HIS 27 Ca 0.26 0.04 -0.02 0.00 -1.16 0.00 0.00 60.37 59.48 2eoe h HIS 27 Cb 0.40 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.77 2eoe h HIS 27 CO -0.34 0.05 -0.20 1.25 0.86 0.00 0.00 177.93 179.55 2eoe h LEU 28 N 0.42 -0.47 -0.47 2.43 5.85 -1.04 -1.81 115.31 120.22 2eoe h LEU 28 Ca 0.41 -0.11 0.10 0.00 0.84 0.00 0.00 57.88 59.11 2eoe h LEU 28 Cb 0.63 0.12 -0.09 0.00 0.37 0.00 0.00 40.66 41.69 2eoe h LEU 28 CO -0.41 -0.11 -0.15 0.00 -0.34 0.00 0.00 178.44 177.43 2eoe h ALA 29 N -0.48 0.26 -0.15 1.25 0.00 -0.64 0.20 119.26 119.70 2eoe h ALA 29 Ca -0.06 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2eoe h ALA 29 Cb 0.56 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2eoe h ALA 29 CO 0.09 -0.48 0.04 -0.97 0.00 0.00 0.00 179.25 177.94 2eoe h ASN 30 N -0.04 0.18 0.03 0.00 -1.24 -0.77 -2.78 115.58 110.96 2eoe h ASN 30 Ca 0.23 -0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.22 2eoe h ASN 30 Cb 0.39 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.39 2eoe h ASN 30 CO -0.51 0.18 -0.02 -0.74 -1.29 0.00 0.00 177.43 175.06 2eoe h HIS 31 N 0.20 -0.04 -0.01 0.67 2.76 0.19 -2.96 115.15 115.96 2eoe h HIS 31 Ca 0.05 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 2eoe h HIS 31 Cb 0.07 0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.04 2eoe h HIS 31 CO 0.00 0.44 0.63 1.96 -1.30 0.00 0.00 177.93 179.67 2eoe h GLN 32 N -0.54 0.00 -0.99 5.26 1.08 -0.66 0.44 115.11 119.70 2eoe h GLN 32 Ca -0.00 0.00 0.25 0.00 -1.45 0.00 0.00 58.65 57.44 2eoe h GLN 32 Cb 0.50 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.86 2eoe h GLN 32 CO 0.01 0.00 0.65 0.00 -0.95 0.00 0.00 178.83 178.54 2eoe h ARG 33 N 0.00 0.32 0.00 1.46 2.47 -1.51 0.83 114.38 117.95 2eoe h ARG 33 Ca 0.00 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.67 2eoe h ARG 33 Cb 1.26 -0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 29.51 2eoe h ARG 33 CO -0.00 0.22 -0.14 -0.84 0.56 0.00 0.00 179.97 179.77 2eoe h ILE 34 N 0.33 0.29 -0.33 2.04 3.07 -1.13 -2.92 117.51 118.86 2eoe h ILE 34 Ca 0.53 -1.08 0.00 0.00 1.55 0.00 0.00 64.86 65.86 2eoe h ILE 34 Cb 1.45 1.86 0.00 0.00 -0.27 0.00 0.00 36.82 39.86 2eoe h ILE 34 CO -0.20 0.14 0.00 1.41 -1.05 0.00 0.00 178.15 178.45 2eoe n HIS 35 N -3.20 1.09 -3.61 0.16 8.25 0.29 -4.85 115.22 113.34 2eoe n HIS 35 Ca 0.02 -0.39 -0.10 0.00 -0.26 0.00 0.00 57.72 56.99 2eoe n HIS 35 Cb 0.47 -0.30 -0.06 0.00 1.12 0.00 0.00 29.99 31.22 2eoe n HIS 35 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2eoe s THR 36 N -1.92 0.00 0.00 1.59 -1.32 -1.10 -5.09 115.64 107.80 2eoe s THR 36 Ca 0.30 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.78 2eoe s THR 36 Cb 0.22 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.21 2eoe s THR 36 CO 0.10 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.12 2eoe n GLY 37 N 1.70 -0.62 3.58 6.08 0.00 -1.26 -4.79 105.19 109.89 2eoe n GLY 37 Ca -0.12 0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 2eoe n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eoe s VAL 38 N 0.00 3.40 -0.85 1.61 0.11 -1.26 -5.08 120.40 118.33 2eoe s VAL 38 Ca 0.00 -1.27 -0.05 0.00 -2.93 0.00 0.00 61.98 57.72 2eoe s VAL 38 Cb 0.00 -2.60 0.22 0.00 -1.53 0.00 0.00 36.38 32.47 2eoe s VAL 38 CO 0.00 0.10 0.75 -0.54 -3.33 0.00 0.00 175.10 172.08 2eoe s LYS 39 N -2.24 3.31 0.42 1.54 3.01 -1.26 -4.88 119.74 119.64 2eoe s LYS 39 Ca 0.22 -2.94 0.21 0.00 -1.01 0.00 0.00 55.97 52.45 2eoe s LYS 39 Cb -0.11 -4.09 0.92 0.00 -1.01 0.00 0.00 37.83 33.54 2eoe s LYS 39 CO 0.14 -1.24 1.84 -1.00 0.51 0.00 0.00 175.35 175.60 2eoe h PRO 40 N 6.69 0.00 -2.64 -1.68 0.13 -1.98 -3.35 132.00 129.17 2eoe h PRO 40 Ca 0.11 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.64 2eoe h PRO 40 Cb 0.90 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.62 2eoe h PRO 40 CO 0.83 0.28 -0.75 0.45 -0.23 0.00 0.00 178.00 178.58 2eoe n SER 41 N -3.60 1.79 -3.71 1.44 2.88 -1.26 -5.07 113.62 106.08 2eoe n SER 41 Ca -0.01 -2.94 -0.13 0.00 -1.33 0.00 0.00 58.87 54.46 2eoe n SER 41 Cb 0.42 -0.67 -0.09 0.00 -0.75 0.00 0.00 64.21 63.11 2eoe n SER 41 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2eoe s GLY 42 N -1.12 -0.34 0.31 0.46 0.00 -1.26 -5.04 107.32 100.33 2eoe s GLY 42 Ca 0.30 1.23 0.09 0.00 0.00 0.00 0.00 44.72 46.34 2eoe s GLY 42 CO -0.15 1.04 1.70 -0.56 0.00 0.00 0.00 173.10 175.13 2eoe h PRO 43 N 5.23 0.10 -6.19 2.90 0.13 -1.97 -3.44 132.00 128.75 2eoe h PRO 43 Ca -0.27 -0.05 -0.53 0.00 -0.87 0.00 0.00 66.00 64.27 2eoe h PRO 43 Cb 1.18 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.25 2eoe h PRO 43 CO 0.24 0.55 -0.54 -1.54 -0.23 0.00 0.00 178.00 176.48 2eoe s SER 44 N -6.89 5.55 -0.26 1.44 1.04 -1.26 -5.12 113.70 108.20 2eoe s SER 44 Ca -0.03 -0.18 -0.28 0.00 0.48 0.00 0.00 55.95 55.94 2eoe s SER 44 Cb 0.13 -1.44 0.17 0.00 0.10 0.00 0.00 66.02 64.98 2eoe s SER 44 CO 0.76 0.01 1.25 -0.55 0.98 0.00 0.00 173.24 175.68 2eoe s SER 45 N -3.51 -0.18 0.00 7.02 0.15 -1.26 -5.03 113.70 110.89 2eoe s SER 45 Ca 0.32 0.27 0.00 0.00 0.70 0.00 0.00 55.95 57.24 2eoe s SER 45 Cb -0.09 0.24 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 2eoe s SER 45 CO 0.24 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.17