#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eoe n SER 2 N 0.00 -1.06 -4.65 1.61 2.88 -1.26 -4.90 113.62 106.24 2eoe n SER 2 Ca 0.00 -1.21 -0.34 0.00 -1.33 0.00 0.00 58.87 55.99 2eoe n SER 2 Cb 0.00 -1.53 -0.10 0.00 -0.75 0.00 0.00 64.21 61.83 2eoe n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2eoe s SER 3 N -3.46 5.04 0.00 -3.46 0.15 -1.26 -5.08 113.70 105.64 2eoe s SER 3 Ca 0.60 0.09 0.00 0.00 0.70 0.00 0.00 55.95 57.33 2eoe s SER 3 Cb -0.35 -1.37 0.00 0.00 -1.71 0.00 0.00 66.02 62.59 2eoe s SER 3 CO 0.98 0.37 0.00 0.61 1.20 0.00 0.00 173.24 176.40 2eoe n GLY 4 N 2.14 -2.30 3.61 9.45 0.00 -1.26 -5.18 105.19 111.65 2eoe n GLY 4 Ca -0.18 -1.22 -0.09 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.33 -0.33 -0.07 1.61 0.15 -1.26 -5.08 113.70 108.38 2eoe s SER 5 Ca 0.00 0.49 -0.14 0.00 0.70 0.00 0.00 55.95 57.00 2eoe s SER 5 Cb 0.00 0.44 -0.10 0.00 -1.71 0.00 0.00 66.02 64.65 2eoe s SER 5 CO 0.00 -0.22 0.55 -1.28 1.20 0.00 0.00 173.24 173.49 2eoe h SER 6 N 3.10 -0.19 0.00 5.45 0.87 -2.06 -3.49 113.55 117.23 2eoe h SER 6 Ca -0.21 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2eoe h SER 6 Cb 1.17 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2eoe h SER 6 CO 0.22 0.37 0.00 0.61 -0.53 0.00 0.00 176.83 177.50 2eoe n GLY 7 N 0.98 0.29 0.07 5.77 0.00 -1.26 -5.08 105.19 105.96 2eoe n GLY 7 Ca -0.06 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 2eoe n GLY 7 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2eoe h THR 8 N 0.00 1.70 0.00 2.61 1.35 -2.05 -3.50 112.91 113.02 2eoe h THR 8 Ca 0.00 -2.09 0.00 0.00 -0.55 0.00 0.00 66.41 63.77 2eoe h THR 8 Cb 0.00 3.12 0.00 0.00 -1.73 0.00 0.00 68.15 69.54 2eoe h THR 8 CO 0.00 0.54 0.00 0.61 -0.25 0.00 0.00 175.52 176.42 2eoe n GLY 9 N 1.30 4.72 3.85 5.82 0.00 -1.26 -5.12 105.19 114.50 2eoe n GLY 9 Ca -0.10 -1.14 -0.36 0.00 0.00 0.00 0.00 46.02 44.43 2eoe n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eoe s GLU 10 N -4.51 3.84 0.35 1.61 2.12 -1.26 -5.08 118.70 115.78 2eoe s GLU 10 Ca 0.00 0.30 -0.22 0.00 0.36 0.00 0.00 54.97 55.42 2eoe s GLU 10 Cb 0.00 -3.09 -0.10 0.00 0.26 0.00 0.00 34.13 31.20 2eoe s GLU 10 CO 0.00 0.62 0.89 0.15 -0.54 0.00 0.00 175.26 176.37 2eoe s LYS 11 N -1.53 4.32 -0.02 4.30 -0.14 -1.26 -5.00 119.74 120.40 2eoe s LYS 11 Ca 0.29 1.09 -0.25 0.00 -1.36 0.00 0.00 55.97 55.74 2eoe s LYS 11 Cb -0.15 -2.51 -0.20 0.00 -1.68 0.00 0.00 37.83 33.29 2eoe s LYS 11 CO 0.16 0.15 1.23 -1.00 -0.76 0.00 0.00 175.35 175.13 2eoe h PRO 12 N 2.57 -0.05 -3.24 -1.68 0.13 -1.95 -3.43 132.00 124.34 2eoe h PRO 12 Ca -0.48 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.22 2eoe h PRO 12 Cb 1.18 0.01 -0.40 0.00 0.13 0.00 0.00 31.00 31.93 2eoe h PRO 12 CO 0.63 0.41 -0.75 0.71 -0.23 0.00 0.00 178.00 178.78 2eoe s TYR 13 N -4.22 0.25 -0.00 1.56 2.02 -1.26 -5.02 117.35 110.67 2eoe s TYR 13 Ca -0.15 -0.14 -0.04 0.00 -0.37 0.00 0.00 57.07 56.37 2eoe s TYR 13 Cb 0.02 -0.65 -0.00 0.00 -0.40 0.00 0.00 41.96 40.92 2eoe s TYR 13 CO 0.65 -0.39 0.08 0.21 -1.57 0.00 0.00 175.55 174.52 2eoe s LYS 14 N 2.12 0.32 -0.10 -0.62 2.36 -1.26 -1.67 119.74 120.89 2eoe s LYS 14 Ca 0.03 -0.30 -0.12 0.00 -2.55 0.00 0.00 55.97 53.02 2eoe s LYS 14 Cb -0.14 0.13 -0.05 0.00 -1.05 0.00 0.00 37.83 36.72 2eoe s LYS 14 CO -0.06 -0.07 0.29 0.00 1.55 0.00 0.00 175.35 177.06 2eoe n ASN 16 N 2.61 0.43 -0.05 0.00 5.15 -1.26 -2.09 115.26 120.04 2eoe n ASN 16 Ca -0.14 0.08 -0.11 0.00 -0.60 0.00 0.00 54.58 53.80 2eoe n ASN 16 Cb 0.53 1.23 -0.06 0.00 -0.53 0.00 0.00 39.78 40.95 2eoe n ASN 16 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2eoe h GLU 17 N 0.00 0.26 0.00 1.20 4.39 -1.98 -3.39 114.58 115.07 2eoe h GLU 17 Ca 0.00 -0.07 -0.21 0.00 0.34 0.00 0.00 59.36 59.42 2eoe h GLU 17 Cb 0.96 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.54 2eoe h GLU 17 CO 0.00 0.45 -1.72 0.00 -1.16 0.00 0.00 179.01 176.58 2eoe n GLY 19 N 2.34 2.00 3.98 0.00 0.00 -0.89 -5.09 105.19 107.54 2eoe n GLY 19 Ca -0.25 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.07 2.64 0.01 1.61 1.02 -1.22 -4.85 119.74 118.88 2eoe s LYS 20 Ca 0.00 -0.93 0.00 0.00 0.02 0.00 0.00 55.97 55.06 2eoe s LYS 20 Cb 0.00 -2.58 -0.01 0.00 -0.52 0.00 0.00 37.83 34.72 2eoe s LYS 20 CO 0.00 -0.56 -0.02 0.08 -0.92 0.00 0.00 175.35 173.93 2eoe s VAL 21 N -2.63 0.06 0.44 3.17 1.01 -1.26 -0.23 120.40 120.97 2eoe s VAL 21 Ca 0.56 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 62.07 2eoe s VAL 21 Cb -0.10 -0.15 -0.02 0.00 0.00 0.00 0.00 36.38 36.11 2eoe s VAL 21 CO 0.37 -0.28 0.09 -0.36 0.00 0.00 0.00 175.10 174.92 2eoe s PHE 22 N -0.81 1.81 -0.25 5.22 0.40 -0.67 -5.01 117.98 118.67 2eoe s PHE 22 Ca -0.09 -1.20 -0.07 0.00 -0.60 0.00 0.00 56.93 54.98 2eoe s PHE 22 Cb -0.06 -1.29 -0.16 0.00 0.51 0.00 0.00 43.02 42.02 2eoe s PHE 22 CO -0.01 -0.15 -0.17 2.41 0.70 0.00 0.00 175.22 178.00 2eoe n THR 23 N -1.03 1.54 -3.97 0.64 -1.04 -1.26 -4.40 114.28 104.76 2eoe n THR 23 Ca -0.10 -0.47 -0.21 0.00 -2.04 0.00 0.00 64.05 61.23 2eoe n THR 23 Cb 0.65 -1.68 -0.03 0.00 -1.82 0.00 0.00 70.33 67.46 2eoe n THR 23 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2eoe s GLN 24 N -2.51 3.19 0.08 -2.82 -0.21 -1.26 -4.84 119.66 111.30 2eoe s GLN 24 Ca -0.35 -0.92 -0.17 0.00 0.02 0.00 0.00 55.36 53.95 2eoe s GLN 24 Cb 0.11 -2.75 -0.09 0.00 1.00 0.00 0.00 33.01 31.28 2eoe s GLN 24 CO 0.58 0.37 1.43 -2.95 -2.12 0.00 0.00 175.29 172.60 2eoe h ASN 25 N 1.26 0.59 -0.80 5.90 -1.07 -1.95 -3.04 115.58 116.47 2eoe h ASN 25 Ca -0.50 -0.43 0.09 0.00 0.07 0.00 0.00 56.30 55.54 2eoe h ASN 25 Cb 1.24 -0.17 -0.05 0.00 -2.07 0.00 0.00 38.32 37.27 2eoe h ASN 25 CO 0.60 0.90 0.52 0.77 0.07 0.00 0.00 177.43 180.29 2eoe h SER 26 N 0.30 0.68 -0.52 6.14 4.64 -1.98 0.29 113.55 123.10 2eoe h SER 26 Ca 0.05 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 2eoe h SER 26 Cb 0.69 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 2eoe h SER 26 CO 0.05 0.41 0.29 0.45 -0.87 0.00 0.00 176.83 177.15 2eoe h HIS 27 N 0.76 0.70 0.09 4.77 3.86 -1.95 0.16 115.15 123.54 2eoe h HIS 27 Ca 0.37 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.56 2eoe h HIS 27 Cb 0.42 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.66 2eoe h HIS 27 CO -0.00 0.51 -0.04 1.25 0.86 0.00 0.00 177.93 180.51 2eoe h LEU 28 N 0.69 -0.10 0.08 2.43 5.85 -1.24 -2.52 115.31 120.50 2eoe h LEU 28 Ca 0.18 -0.43 0.02 0.00 0.84 0.00 0.00 57.88 58.50 2eoe h LEU 28 Cb 0.04 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 2eoe h LEU 28 CO -0.03 0.41 -0.35 0.00 -0.34 0.00 0.00 178.44 178.13 2eoe h ALA 29 N 0.17 -0.57 -0.13 1.25 0.00 -0.95 0.23 119.26 119.26 2eoe h ALA 29 Ca -0.01 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.89 2eoe h ALA 29 Cb 0.52 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2eoe h ALA 29 CO 0.02 -0.89 0.15 -0.97 0.00 0.00 0.00 179.25 177.56 2eoe h ASN 30 N -0.55 0.00 0.07 0.00 -0.73 -1.06 -2.70 115.58 110.62 2eoe h ASN 30 Ca 0.04 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.21 2eoe h ASN 30 Cb 0.60 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.19 2eoe h ASN 30 CO -0.23 0.00 -0.03 -0.74 -0.37 0.00 0.00 177.43 176.06 2eoe h HIS 31 N 0.00 -0.09 -1.15 0.67 2.76 -0.56 -3.28 115.15 113.50 2eoe h HIS 31 Ca 0.06 -0.00 0.33 0.00 -2.20 0.00 0.00 60.37 58.56 2eoe h HIS 31 Cb 0.35 0.03 -0.05 0.00 1.55 0.00 0.00 27.41 29.30 2eoe h HIS 31 CO 0.00 0.21 1.20 1.04 -1.30 0.00 0.00 177.93 179.08 2eoe n GLN 32 N -4.81 0.01 -0.15 5.26 6.02 0.60 -0.03 117.38 124.29 2eoe n GLN 32 Ca -0.04 0.98 -0.04 0.00 -0.01 0.00 0.00 57.00 57.89 2eoe n GLN 32 Cb 0.17 -2.41 0.02 0.00 1.02 0.00 0.00 30.24 29.04 2eoe n GLN 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2eoe h ARG 33 N 0.00 -0.07 0.00 -1.09 3.08 -1.60 0.61 114.38 115.31 2eoe h ARG 33 Ca 0.55 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.60 2eoe h ARG 33 Cb 2.94 0.02 0.00 0.00 0.08 0.00 0.00 29.97 33.01 2eoe h ARG 33 CO -0.01 -0.04 0.33 -0.84 -1.07 0.00 0.00 179.97 178.34 2eoe h ILE 34 N -0.07 0.00 0.00 2.04 3.07 -0.68 -0.64 117.51 121.24 2eoe h ILE 34 Ca 0.23 0.00 -0.41 0.00 1.55 0.00 0.00 64.86 66.22 2eoe h ILE 34 Cb 0.42 0.42 -0.07 0.00 -0.27 0.00 0.00 36.82 37.32 2eoe h ILE 34 CO -0.52 0.00 -2.47 1.41 -1.05 0.00 0.00 178.15 175.52 2eoe n HIS 35 N -2.38 0.07 -1.71 0.16 8.25 0.19 -4.97 115.22 114.82 2eoe n HIS 35 Ca -0.01 0.02 -0.43 0.00 -0.26 0.00 0.00 57.72 57.04 2eoe n HIS 35 Cb 0.36 -1.01 -0.01 0.00 1.12 0.00 0.00 29.99 30.45 2eoe n HIS 35 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2eoe n THR 36 N -3.62 1.61 0.00 1.59 -1.04 0.18 -3.59 114.28 109.40 2eoe n THR 36 Ca -0.48 -0.40 0.00 0.00 -2.04 0.00 0.00 64.05 61.13 2eoe n THR 36 Cb 0.95 -1.68 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 2eoe n THR 36 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2eoe n GLY 37 N 1.25 3.55 2.17 3.41 0.00 -1.26 -4.92 105.19 109.39 2eoe n GLY 37 Ca 0.06 -0.85 -0.18 0.00 0.00 0.00 0.00 46.02 45.06 2eoe n GLY 37 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2eoe n VAL 38 N 0.00 3.09 -3.64 1.61 0.31 -1.24 -4.78 118.33 113.68 2eoe n VAL 38 Ca 0.00 -2.06 -0.09 0.00 -0.01 0.00 0.00 64.34 62.18 2eoe n VAL 38 Cb 0.00 -1.80 -0.07 0.00 -0.91 0.00 0.00 33.84 31.05 2eoe n VAL 38 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2eoe s LYS 39 N -0.18 0.74 -0.59 5.55 2.36 -1.26 -5.11 119.74 121.24 2eoe s LYS 39 Ca 0.61 1.16 -0.27 0.00 -2.55 0.00 0.00 55.97 54.92 2eoe s LYS 39 Cb 0.33 0.21 -0.02 0.00 -1.05 0.00 0.00 37.83 37.30 2eoe s LYS 39 CO -0.09 -0.14 1.85 -1.25 1.55 0.00 0.00 175.35 177.27 2eoe s PRO 40 N 1.30 2.69 -0.43 4.03 0.04 -1.26 -4.91 135.00 136.45 2eoe s PRO 40 Ca -0.07 0.66 0.02 0.00 0.04 0.00 0.00 61.00 61.65 2eoe s PRO 40 Cb -0.05 -4.37 0.15 0.00 0.04 0.00 0.00 34.50 30.27 2eoe s PRO 40 CO -0.14 -2.66 0.28 -1.54 0.04 0.00 0.00 177.00 172.98 2eoe s SER 41 N 7.90 2.96 0.00 6.66 1.04 -1.26 -5.01 113.70 126.00 2eoe s SER 41 Ca 0.68 -2.74 0.00 0.00 0.48 0.00 0.00 55.95 54.37 2eoe s SER 41 Cb -0.13 -0.75 0.00 0.00 0.10 0.00 0.00 66.02 65.24 2eoe s SER 41 CO 0.22 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.81 2eoe n GLY 42 N 3.34 0.82 0.21 7.32 0.00 -1.26 -4.66 105.19 110.96 2eoe n GLY 42 Ca 0.16 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.33 2eoe n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eoe h PRO 43 N 0.00 0.00 -5.48 1.61 0.13 -2.05 -3.38 132.00 122.83 2eoe h PRO 43 Ca 0.00 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.45 2eoe h PRO 43 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 2eoe h PRO 43 CO 0.00 0.00 1.61 0.45 -0.23 0.00 0.00 178.00 179.83 2eoe s SER 44 N -4.97 6.80 -0.15 1.44 0.15 -1.26 -4.92 113.70 110.78 2eoe s SER 44 Ca 0.02 -2.32 -0.02 0.00 0.70 0.00 0.00 55.95 54.33 2eoe s SER 44 Cb 0.09 -2.50 0.05 0.00 -1.71 0.00 0.00 66.02 61.95 2eoe s SER 44 CO 0.46 -1.11 -0.00 -0.55 1.20 0.00 0.00 173.24 173.24 2eoe s SER 45 N 3.91 2.53 0.00 5.45 0.15 -1.26 -4.90 113.70 119.59 2eoe s SER 45 Ca 0.46 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 56.53 2eoe s SER 45 Cb -0.00 -0.66 0.00 0.00 -1.71 0.00 0.00 66.02 63.65 2eoe s SER 45 CO -0.01 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.81