#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 0.05 -0.42 1.61 0.01 -1.26 -5.13 113.70 108.56 2eoe s SER 2 Ca 0.00 -1.03 -0.16 0.00 1.31 0.00 0.00 55.95 56.07 2eoe s SER 2 Cb 0.00 0.60 0.02 0.00 0.21 0.00 0.00 66.02 66.85 2eoe s SER 2 CO 0.00 -1.17 0.34 -0.55 0.41 0.00 0.00 173.24 172.26 2eoe s SER 3 N -3.05 6.13 0.00 2.44 0.15 -1.26 -5.01 113.70 113.10 2eoe s SER 3 Ca 0.24 -0.89 0.00 0.00 0.70 0.00 0.00 55.95 56.00 2eoe s SER 3 Cb -0.01 -2.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.13 2eoe s SER 3 CO 0.11 -0.50 0.14 0.61 1.20 0.00 0.00 173.24 174.80 2eoe n GLY 4 N 5.15 -1.53 3.33 9.45 0.00 -1.26 -5.00 105.19 115.34 2eoe n GLY 4 Ca -0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 2eoe n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eoe s SER 5 N -1.75 -0.39 -0.35 1.61 0.15 -1.26 -5.04 113.70 106.67 2eoe s SER 5 Ca 0.00 0.56 -0.02 0.00 0.70 0.00 0.00 55.95 57.20 2eoe s SER 5 Cb 0.00 0.63 0.17 0.00 -1.71 0.00 0.00 66.02 65.11 2eoe s SER 5 CO 0.00 -0.34 2.22 -1.20 1.20 0.00 0.00 173.24 175.12 2eoe n SER 6 N 1.93 6.46 -1.20 5.45 7.64 -1.26 -4.94 113.62 127.71 2eoe n SER 6 Ca -0.17 -3.09 0.00 0.00 1.01 0.00 0.00 58.87 56.61 2eoe n SER 6 Cb 0.57 -1.10 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 2eoe n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eoe n GLY 7 N 0.50 -4.43 3.15 0.23 0.00 -1.26 -5.08 105.19 98.30 2eoe n GLY 7 Ca 0.35 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 2eoe n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2eoe s THR 8 N -1.73 0.32 -0.12 2.61 -4.23 -1.26 -5.17 115.64 106.05 2eoe s THR 8 Ca 0.00 -1.90 -0.32 0.00 -1.18 0.00 0.00 61.69 58.30 2eoe s THR 8 Cb 0.00 -1.85 0.13 0.00 1.34 0.00 0.00 72.50 72.12 2eoe s THR 8 CO 0.00 -0.68 1.07 -0.83 -0.54 0.00 0.00 174.62 173.64 2eoe s GLY 9 N -3.03 -0.33 -0.68 3.99 0.00 -1.26 -5.11 107.32 100.91 2eoe s GLY 9 Ca 0.17 1.52 -0.19 0.00 0.00 0.00 0.00 44.72 46.22 2eoe s GLY 9 CO -0.02 0.57 0.83 1.85 0.00 0.00 0.00 173.10 176.32 2eoe s GLU 10 N -2.40 3.19 -0.03 2.90 2.12 -1.26 -5.03 118.70 118.17 2eoe s GLU 10 Ca 0.06 -1.38 -0.02 0.00 0.36 0.00 0.00 54.97 53.99 2eoe s GLU 10 Cb -0.01 -4.37 -0.04 0.00 0.26 0.00 0.00 34.13 29.97 2eoe s GLU 10 CO -0.06 -1.62 0.09 0.15 -0.54 0.00 0.00 175.26 173.29 2eoe s LYS 11 N 2.77 3.15 0.03 4.30 -0.14 -1.26 -5.03 119.74 123.55 2eoe s LYS 11 Ca 0.17 -0.40 -0.22 0.00 -1.36 0.00 0.00 55.97 54.16 2eoe s LYS 11 Cb -0.19 -2.93 -0.16 0.00 -1.68 0.00 0.00 37.83 32.88 2eoe s LYS 11 CO 0.03 0.68 1.33 -1.00 -0.76 0.00 0.00 175.35 175.63 2eoe h PRO 12 N 4.35 0.28 -2.79 -1.68 0.13 -1.96 -3.44 132.00 126.88 2eoe h PRO 12 Ca -0.50 -0.14 -0.21 0.00 -0.87 0.00 0.00 66.00 64.27 2eoe h PRO 12 Cb 1.19 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.00 2eoe h PRO 12 CO 0.61 0.68 -0.52 0.71 -0.23 0.00 0.00 178.00 179.25 2eoe s TYR 13 N -4.31 -0.46 -0.11 1.56 2.02 -1.26 -5.02 117.35 109.78 2eoe s TYR 13 Ca -0.15 0.97 -0.04 0.00 -0.37 0.00 0.00 57.07 57.48 2eoe s TYR 13 Cb 0.04 -0.03 0.06 0.00 -0.40 0.00 0.00 41.96 41.63 2eoe s TYR 13 CO 0.73 -0.39 0.22 0.21 -1.57 0.00 0.00 175.55 174.76 2eoe s LYS 14 N 2.43 0.10 -0.26 -0.62 2.20 -1.26 -1.46 119.74 120.88 2eoe s LYS 14 Ca 0.02 0.66 -0.29 0.00 -0.36 0.00 0.00 55.97 56.00 2eoe s LYS 14 Cb -0.12 -0.13 -0.01 0.00 -1.51 0.00 0.00 37.83 36.05 2eoe s LYS 14 CO -0.09 -0.29 1.49 0.00 -0.36 0.00 0.00 175.35 176.11 2eoe h ASN 16 N 10.23 0.77 -0.80 0.00 -1.24 -1.95 0.78 115.58 123.37 2eoe h ASN 16 Ca -0.31 -0.63 0.13 0.00 0.71 0.00 0.00 56.30 56.20 2eoe h ASN 16 Cb 1.13 -0.24 -0.14 0.00 0.73 0.00 0.00 38.32 39.81 2eoe h ASN 16 CO 1.02 1.44 -0.38 -0.33 -1.29 0.00 0.00 177.43 177.89 2eoe h GLU 17 N 0.32 -0.08 0.00 6.67 4.39 -1.98 -3.25 114.58 120.65 2eoe h GLU 17 Ca -0.12 0.01 -0.29 0.00 0.34 0.00 0.00 59.36 59.29 2eoe h GLU 17 Cb 1.69 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 30.31 2eoe h GLU 17 CO 0.19 -0.05 -2.06 0.00 -1.16 0.00 0.00 179.01 175.94 2eoe n GLY 19 N 2.34 0.94 3.84 0.00 0.00 0.26 -5.09 105.19 107.48 2eoe n GLY 19 Ca -0.34 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.46 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 0.12 2.67 -0.02 1.61 1.02 -0.60 -4.87 119.74 119.68 2eoe s LYS 20 Ca 0.00 -1.34 0.03 0.00 0.02 0.00 0.00 55.97 54.68 2eoe s LYS 20 Cb 0.00 -2.44 -0.00 0.00 -0.52 0.00 0.00 37.83 34.87 2eoe s LYS 20 CO 0.00 0.08 -0.10 0.08 -0.92 0.00 0.00 175.35 174.48 2eoe s VAL 21 N -2.33 0.86 0.07 3.17 1.01 -1.26 0.13 120.40 122.04 2eoe s VAL 21 Ca 0.41 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 62.01 2eoe s VAL 21 Cb -0.05 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 2eoe s VAL 21 CO 0.26 0.25 -0.15 -0.36 0.00 0.00 0.00 175.10 175.10 2eoe s PHE 22 N -0.05 1.30 0.04 5.22 0.40 -0.53 -5.00 117.98 119.36 2eoe s PHE 22 Ca 0.01 -0.43 -0.16 0.00 -0.60 0.00 0.00 56.93 55.75 2eoe s PHE 22 Cb -0.06 -0.74 -0.29 0.00 0.51 0.00 0.00 43.02 42.44 2eoe s PHE 22 CO 0.00 0.07 1.08 1.15 0.70 0.00 0.00 175.22 178.22 2eoe h THR 23 N 4.31 1.31 -2.92 0.64 2.02 -2.01 -3.35 112.91 112.92 2eoe h THR 23 Ca -0.41 -2.44 -0.65 0.00 0.77 0.00 0.00 66.41 63.68 2eoe h THR 23 Cb 1.19 2.74 -0.07 0.00 -1.74 0.00 0.00 68.15 70.27 2eoe h THR 23 CO 0.41 0.74 -0.53 -1.10 0.37 0.00 0.00 175.52 175.41 2eoe s GLN 24 N -2.94 3.29 0.20 6.66 -0.21 -1.26 -4.88 119.66 120.52 2eoe s GLN 24 Ca -0.10 -0.39 -0.08 0.00 0.02 0.00 0.00 55.36 54.81 2eoe s GLN 24 Cb 0.05 -3.00 0.13 0.00 1.00 0.00 0.00 33.01 31.19 2eoe s GLN 24 CO 0.92 0.66 1.74 -0.97 -2.12 0.00 0.00 175.29 175.52 2eoe h ASN 25 N 3.92 1.08 -0.88 5.90 -1.24 -1.95 -2.77 115.58 119.64 2eoe h ASN 25 Ca -0.49 -0.21 0.09 0.00 0.71 0.00 0.00 56.30 56.40 2eoe h ASN 25 Cb 1.19 -0.28 -0.07 0.00 0.73 0.00 0.00 38.32 39.88 2eoe h ASN 25 CO 0.66 1.00 0.53 0.77 -1.29 0.00 0.00 177.43 179.10 2eoe h SER 26 N 1.10 0.79 -0.22 1.15 4.64 -1.99 -1.49 113.55 117.54 2eoe h SER 26 Ca 0.24 0.04 0.01 0.00 -0.47 0.00 0.00 61.79 61.61 2eoe h SER 26 Cb 0.30 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 2eoe h SER 26 CO -0.01 0.47 0.10 0.45 -0.87 0.00 0.00 176.83 176.97 2eoe h HIS 27 N 0.91 0.19 -0.21 4.77 3.86 -1.91 0.19 115.15 122.95 2eoe h HIS 27 Ca 0.41 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.64 2eoe h HIS 27 Cb 0.32 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.72 2eoe h HIS 27 CO -0.04 0.10 0.11 1.25 0.86 0.00 0.00 177.93 180.22 2eoe h LEU 28 N 0.22 0.18 0.01 2.43 5.85 -1.30 -0.97 115.31 121.73 2eoe h LEU 28 Ca 0.09 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 2eoe h LEU 28 Cb 0.03 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2eoe h LEU 28 CO -0.07 0.14 -0.01 0.00 -0.34 0.00 0.00 178.44 178.16 2eoe h ALA 29 N 1.10 -0.01 0.00 1.25 0.00 -1.05 0.99 119.26 121.54 2eoe h ALA 29 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2eoe h ALA 29 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2eoe h ALA 29 CO -0.05 -0.46 0.00 -1.71 0.00 0.00 0.00 179.25 177.04 2eoe n ASN 30 N -5.05 0.00 -0.11 0.00 5.15 0.65 -2.92 115.26 112.98 2eoe n ASN 30 Ca -0.07 0.36 -0.18 0.00 -0.60 0.00 0.00 54.58 54.08 2eoe n ASN 30 Cb 0.08 -0.41 -0.07 0.00 -0.53 0.00 0.00 39.78 38.86 2eoe n ASN 30 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 2eoe n HIS 31 N -1.41 0.25 0.30 1.20 -0.00 -0.38 -4.30 115.22 110.88 2eoe n HIS 31 Ca 0.03 0.11 0.09 0.00 0.46 0.00 0.00 57.72 58.41 2eoe n HIS 31 Cb 0.08 -0.81 0.42 0.00 -0.12 0.00 0.00 29.99 29.56 2eoe n HIS 31 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 2eoe h GLN 32 N -1.00 0.00 -0.62 1.57 1.08 -0.72 0.16 115.11 115.58 2eoe h GLN 32 Ca -0.33 0.00 0.18 0.00 -1.45 0.00 0.00 58.65 57.05 2eoe h GLN 32 Cb 1.22 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.63 2eoe h GLN 32 CO -0.20 0.00 0.54 0.07 -0.95 0.00 0.00 178.83 178.30 2eoe h ARG 33 N 0.00 0.00 0.00 1.46 0.11 -1.73 0.75 114.38 114.97 2eoe h ARG 33 Ca 0.03 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.03 2eoe h ARG 33 Cb 1.40 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.47 2eoe h ARG 33 CO -0.00 0.00 -0.39 -0.84 0.10 0.00 0.00 179.97 178.83 2eoe h ILE 34 N 0.00 0.82 0.00 0.08 3.07 -0.97 -3.37 117.51 117.13 2eoe h ILE 34 Ca 0.30 -1.70 0.00 0.00 1.55 0.00 0.00 64.86 65.00 2eoe h ILE 34 Cb 1.38 2.08 0.00 0.00 -0.27 0.00 0.00 36.82 40.01 2eoe h ILE 34 CO -0.00 0.39 -0.47 1.41 -1.05 0.00 0.00 178.15 178.43 2eoe n HIS 35 N -3.39 0.39 -1.49 0.16 8.25 0.24 -4.97 115.22 114.42 2eoe n HIS 35 Ca 0.01 0.17 -0.40 0.00 -0.26 0.00 0.00 57.72 57.24 2eoe n HIS 35 Cb 0.58 -0.50 0.02 0.00 1.12 0.00 0.00 29.99 31.20 2eoe n HIS 35 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2eoe n THR 36 N -3.84 2.10 0.00 1.59 5.66 0.26 -3.75 114.28 116.30 2eoe n THR 36 Ca -0.07 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.43 2eoe n THR 36 Cb 0.24 -0.70 0.00 0.00 -1.55 0.00 0.00 70.33 68.32 2eoe n THR 36 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2eoe n GLY 37 N 1.68 3.53 3.76 1.09 0.00 -1.26 -4.84 105.19 109.15 2eoe n GLY 37 Ca 0.11 -0.97 -0.40 0.00 0.00 0.00 0.00 46.02 44.76 2eoe n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2eoe s VAL 38 N 0.00 3.24 0.24 1.61 1.01 -1.25 -4.93 120.40 120.33 2eoe s VAL 38 Ca 0.00 1.23 -0.18 0.00 0.00 0.00 0.00 61.98 63.03 2eoe s VAL 38 Cb 0.00 -3.78 -0.12 0.00 0.00 0.00 0.00 36.38 32.48 2eoe s VAL 38 CO 0.00 0.29 0.19 0.29 0.00 0.00 0.00 175.10 175.87 2eoe n LYS 39 N 1.19 0.00 -2.17 2.72 5.02 -1.26 -4.78 118.16 118.88 2eoe n LYS 39 Ca -0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 2eoe n LYS 39 Cb 0.44 -0.75 -0.03 0.00 -0.02 0.00 0.00 35.03 34.68 2eoe n LYS 39 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2eoe s PRO 40 N -0.75 4.25 0.07 1.97 0.04 -1.26 -5.00 135.00 134.32 2eoe s PRO 40 Ca 0.46 2.02 -0.20 0.00 0.04 0.00 0.00 61.00 63.32 2eoe s PRO 40 Cb -0.56 -3.68 0.04 0.00 0.04 0.00 0.00 34.50 30.34 2eoe s PRO 40 CO 0.45 -0.66 0.46 0.45 0.04 0.00 0.00 177.00 177.74 2eoe s SER 41 N 2.24 -0.35 0.00 6.66 0.15 -1.26 -5.16 113.70 115.98 2eoe s SER 41 Ca 0.66 0.00 0.00 0.00 0.70 0.00 0.00 55.95 57.31 2eoe s SER 41 Cb -0.32 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 2eoe s SER 41 CO 0.27 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.57 2eoe n GLY 42 N 0.26 3.10 3.77 9.45 0.00 -1.26 -4.91 105.19 115.60 2eoe n GLY 42 Ca -0.18 -1.78 -0.35 0.00 0.00 0.00 0.00 46.02 43.71 2eoe n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eoe s PRO 43 N -3.85 3.34 -1.63 1.61 0.04 -1.26 -3.39 135.00 129.85 2eoe s PRO 43 Ca 0.00 1.60 -0.17 0.00 0.04 0.00 0.00 61.00 62.47 2eoe s PRO 43 Cb 0.00 -2.00 0.17 0.00 0.04 0.00 0.00 34.50 32.70 2eoe s PRO 43 CO 0.00 -0.86 0.42 0.45 0.04 0.00 0.00 177.00 177.05 2eoe n SER 44 N -1.34 -1.09 -4.89 6.66 2.88 -1.26 -4.88 113.62 109.70 2eoe n SER 44 Ca 0.12 -1.13 -0.31 0.00 -1.33 0.00 0.00 58.87 56.21 2eoe n SER 44 Cb 0.51 -1.44 -0.05 0.00 -0.75 0.00 0.00 64.21 62.48 2eoe n SER 44 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2eoe s SER 45 N -3.29 6.55 0.00 -3.46 0.15 -1.22 -5.23 113.70 107.19 2eoe s SER 45 Ca 0.59 0.75 0.00 0.00 0.70 0.00 0.00 55.95 57.99 2eoe s SER 45 Cb -0.34 -2.16 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 2eoe s SER 45 CO 0.92 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.94