#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 -0.13 -0.24 1.61 0.15 -1.26 -5.16 113.70 108.68 2eoe s SER 2 Ca 0.00 0.24 -0.20 0.00 0.70 0.00 0.00 55.95 56.69 2eoe s SER 2 Cb 0.00 0.27 0.06 0.00 -1.71 0.00 0.00 66.02 64.64 2eoe s SER 2 CO 0.00 -0.06 0.61 -0.55 1.20 0.00 0.00 173.24 174.44 2eoe s SER 3 N -0.01 -0.69 0.00 5.45 0.15 -1.26 -5.05 113.70 112.30 2eoe s SER 3 Ca -0.01 1.26 0.00 0.00 0.70 0.00 0.00 55.95 57.91 2eoe s SER 3 Cb -0.01 1.25 0.00 0.00 -1.71 0.00 0.00 66.02 65.54 2eoe s SER 3 CO 0.00 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.83 2eoe n GLY 4 N 3.13 0.00 2.52 9.45 0.00 -1.26 -5.06 105.19 113.97 2eoe n GLY 4 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 2eoe n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eoe n SER 5 N 0.00 3.00 -0.30 1.61 7.64 -1.26 -4.94 113.62 119.37 2eoe n SER 5 Ca 0.00 -2.96 -0.07 0.00 1.01 0.00 0.00 58.87 56.85 2eoe n SER 5 Cb 0.00 -0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 62.69 2eoe n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2eoe n SER 6 N -0.47 -0.73 0.00 6.43 7.64 -1.26 -4.91 113.62 120.31 2eoe n SER 6 Ca 0.23 1.29 0.00 0.00 1.01 0.00 0.00 58.87 61.40 2eoe n SER 6 Cb 0.82 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.84 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 -1.20 0.73 2.95 0.23 0.00 -1.26 -5.01 105.19 101.63 2eoe n GLY 7 Ca 0.02 -2.12 -0.31 0.00 0.00 0.00 0.00 46.02 43.62 2eoe n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eoe s THR 8 N -1.01 2.11 0.00 2.61 2.01 -1.26 -5.00 115.64 115.11 2eoe s THR 8 Ca 0.00 -2.45 0.00 0.00 0.31 0.00 0.00 61.69 59.55 2eoe s THR 8 Cb 0.00 -2.54 0.00 0.00 0.01 0.00 0.00 72.50 69.97 2eoe s THR 8 CO 0.00 -0.67 0.00 0.61 -0.69 0.00 0.00 174.62 173.87 2eoe n GLY 9 N 4.04 -0.84 3.81 4.40 0.00 -1.26 -5.16 105.19 110.19 2eoe n GLY 9 Ca 0.04 0.85 -0.38 0.00 0.00 0.00 0.00 46.02 46.53 2eoe n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eoe s GLU 10 N 0.00 4.02 0.42 1.61 -1.05 -1.26 -5.08 118.70 117.35 2eoe s GLU 10 Ca 0.00 0.40 -0.16 0.00 -0.15 0.00 0.00 54.97 55.06 2eoe s GLU 10 Cb 0.00 -3.27 -0.09 0.00 -0.44 0.00 0.00 34.13 30.33 2eoe s GLU 10 CO 0.00 0.57 0.85 0.15 0.95 0.00 0.00 175.26 177.79 2eoe s LYS 11 N -0.69 3.98 -0.02 -4.83 1.02 -1.26 -5.01 119.74 112.94 2eoe s LYS 11 Ca 0.24 0.79 -0.26 0.00 0.02 0.00 0.00 55.97 56.76 2eoe s LYS 11 Cb -0.16 -2.29 -0.20 0.00 -0.52 0.00 0.00 37.83 34.66 2eoe s LYS 11 CO 0.12 -0.04 1.27 -1.00 -0.92 0.00 0.00 175.35 174.78 2eoe h PRO 12 N 1.59 0.02 -3.04 -1.68 0.13 -1.98 -3.44 132.00 123.60 2eoe h PRO 12 Ca -0.48 -0.01 -0.35 0.00 -0.87 0.00 0.00 66.00 64.29 2eoe h PRO 12 Cb 1.18 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.93 2eoe h PRO 12 CO 0.63 0.50 -0.68 0.71 -0.23 0.00 0.00 178.00 178.92 2eoe s TYR 13 N -4.26 -0.06 -0.27 1.56 2.02 -1.26 -5.05 117.35 110.04 2eoe s TYR 13 Ca -0.16 0.26 -0.09 0.00 -0.37 0.00 0.00 57.07 56.71 2eoe s TYR 13 Cb 0.02 -0.43 0.12 0.00 -0.40 0.00 0.00 41.96 41.27 2eoe s TYR 13 CO 0.68 -0.36 0.57 0.21 -1.57 0.00 0.00 175.55 175.08 2eoe s LYS 14 N 2.24 0.50 -0.43 -0.62 2.20 -1.26 -1.57 119.74 120.80 2eoe s LYS 14 Ca 0.04 1.31 -0.28 0.00 -0.36 0.00 0.00 55.97 56.68 2eoe s LYS 14 Cb -0.13 0.67 -0.00 0.00 -1.51 0.00 0.00 37.83 36.86 2eoe s LYS 14 CO -0.07 -0.21 1.57 0.00 -0.36 0.00 0.00 175.35 176.28 2eoe h ASN 16 N 11.80 0.99 -0.46 0.00 7.08 -1.95 1.21 115.58 134.25 2eoe h ASN 16 Ca -0.29 -0.42 0.05 0.00 -3.08 0.00 0.00 56.30 52.56 2eoe h ASN 16 Cb 1.13 -0.27 -0.08 0.00 -2.08 0.00 0.00 38.32 37.01 2eoe h ASN 16 CO 1.10 1.20 -0.52 -0.08 -2.08 0.00 0.00 177.43 177.04 2eoe h GLU 17 N 0.78 -0.30 0.04 4.14 4.81 -1.98 -3.25 114.58 118.82 2eoe h GLU 17 Ca 0.09 0.02 -0.32 0.00 -0.13 0.00 0.00 59.36 59.02 2eoe h GLU 17 Cb 0.85 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 2eoe h GLU 17 CO 0.08 -0.20 -1.77 0.00 -0.73 0.00 0.00 179.01 176.38 2eoe n GLY 19 N 1.64 0.83 3.78 0.00 0.00 0.41 -5.09 105.19 106.75 2eoe n GLY 19 Ca -0.37 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.40 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 0.35 2.25 -0.00 1.61 1.02 -0.66 -4.90 119.74 119.40 2eoe s LYS 20 Ca 0.00 -1.89 -0.01 0.00 0.02 0.00 0.00 55.97 54.10 2eoe s LYS 20 Cb 0.00 -2.00 -0.00 0.00 -0.52 0.00 0.00 37.83 35.31 2eoe s LYS 20 CO 0.00 -0.22 0.02 0.08 -0.92 0.00 0.00 175.35 174.31 2eoe s VAL 21 N -2.64 0.01 0.05 3.17 1.01 -1.26 -0.26 120.40 120.48 2eoe s VAL 21 Ca 0.38 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 62.28 2eoe s VAL 21 Cb 0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 36.38 36.31 2eoe s VAL 21 CO 0.21 -0.06 -0.09 -0.36 0.00 0.00 0.00 175.10 174.81 2eoe s PHE 22 N -0.17 0.77 0.04 5.22 0.40 -0.61 -4.98 117.98 118.66 2eoe s PHE 22 Ca -0.02 -0.49 -0.12 0.00 -0.60 0.00 0.00 56.93 55.70 2eoe s PHE 22 Cb -0.01 -0.45 -0.33 0.00 0.51 0.00 0.00 43.02 42.73 2eoe s PHE 22 CO -0.00 -0.06 1.03 1.79 0.70 0.00 0.00 175.22 178.68 2eoe h THR 23 N 4.46 1.33 -2.63 0.64 1.35 -2.00 -3.36 112.91 112.70 2eoe h THR 23 Ca -0.37 -2.81 -0.55 0.00 -0.55 0.00 0.00 66.41 62.13 2eoe h THR 23 Cb 1.20 3.00 -0.03 0.00 -1.73 0.00 0.00 68.15 70.59 2eoe h THR 23 CO 0.41 0.84 -0.46 -1.58 -0.25 0.00 0.00 175.52 174.47 2eoe s GLN 24 N -2.62 3.45 0.11 4.72 0.74 -1.26 -4.92 119.66 119.88 2eoe s GLN 24 Ca -0.08 -0.55 -0.14 0.00 0.05 0.00 0.00 55.36 54.64 2eoe s GLN 24 Cb 0.05 -2.97 -0.08 0.00 1.10 0.00 0.00 33.01 31.11 2eoe s GLN 24 CO 0.92 0.53 1.43 -2.95 -0.55 0.00 0.00 175.29 174.67 2eoe h ASN 25 N 2.29 0.82 -0.76 6.67 7.08 -1.97 -3.07 115.58 126.64 2eoe h ASN 25 Ca -0.48 -0.48 0.07 0.00 -3.08 0.00 0.00 56.30 52.34 2eoe h ASN 25 Cb 1.19 -0.23 -0.05 0.00 -2.08 0.00 0.00 38.32 37.15 2eoe h ASN 25 CO 0.70 1.14 0.50 0.28 -2.08 0.00 0.00 177.43 177.96 2eoe h SER 26 N 0.52 0.69 -0.64 6.14 0.02 -1.98 -0.82 113.55 117.48 2eoe h SER 26 Ca 0.04 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2eoe h SER 26 Cb 0.92 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.29 2eoe h SER 26 CO 0.08 0.43 0.40 0.45 -1.14 0.00 0.00 176.83 177.05 2eoe h HIS 27 N 0.77 0.83 0.18 3.45 3.86 -1.94 0.35 115.15 122.65 2eoe h HIS 27 Ca 0.34 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.54 2eoe h HIS 27 Cb 0.31 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.51 2eoe h HIS 27 CO -0.00 0.55 -0.09 1.25 0.86 0.00 0.00 177.93 180.50 2eoe h LEU 28 N 0.87 -0.21 -0.64 2.43 5.85 -1.31 -1.64 115.31 120.66 2eoe h LEU 28 Ca 0.23 -0.31 0.05 0.00 0.84 0.00 0.00 57.88 58.69 2eoe h LEU 28 Cb -0.05 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 2eoe h LEU 28 CO -0.05 0.26 0.37 0.00 -0.34 0.00 0.00 178.44 178.68 2eoe h ALA 29 N -0.10 0.85 0.00 1.25 0.00 -1.13 0.26 119.26 120.39 2eoe h ALA 29 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2eoe h ALA 29 Cb 0.51 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2eoe h ALA 29 CO 0.04 0.08 0.00 -1.71 0.00 0.00 0.00 179.25 177.66 2eoe n ASN 30 N -4.76 0.00 -0.10 0.00 2.85 0.12 -3.60 115.26 109.77 2eoe n ASN 30 Ca 0.07 0.33 -0.16 0.00 -0.11 0.00 0.00 54.58 54.71 2eoe n ASN 30 Cb 0.13 -0.43 -0.06 0.00 1.24 0.00 0.00 39.78 40.66 2eoe n ASN 30 CO 0.00 0.00 0.00 1.57 -2.11 0.00 0.00 177.26 176.72 2eoe n HIS 31 N -1.43 0.43 -0.09 1.20 -0.00 0.10 -4.27 115.22 111.16 2eoe n HIS 31 Ca 0.07 0.19 0.23 0.00 0.46 0.00 0.00 57.72 58.67 2eoe n HIS 31 Cb 0.22 -0.82 0.45 0.00 -0.12 0.00 0.00 29.99 29.71 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 -0.79 1.57 4.20 -0.65 0.49 115.11 118.92 2eoe h GLN 32 Ca -0.26 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.55 2eoe h GLN 32 Cb 1.11 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.82 2eoe h GLN 32 CO -0.16 0.00 0.44 0.07 -0.67 0.00 0.00 178.83 178.51 2eoe h ARG 33 N 0.00 0.71 -1.56 1.46 0.11 -1.74 -0.73 114.38 112.63 2eoe h ARG 33 Ca 0.37 -0.04 0.45 0.00 0.10 0.00 0.00 59.98 60.86 2eoe h ARG 33 Cb 2.47 -0.16 -0.06 0.00 1.11 0.00 0.00 29.97 33.33 2eoe h ARG 33 CO -0.00 0.47 1.13 -0.84 0.10 0.00 0.00 179.97 180.83 2eoe h ILE 34 N 0.74 0.21 -0.94 0.08 3.07 -0.28 0.54 117.51 120.93 2eoe h ILE 34 Ca 0.39 0.00 -0.54 0.00 1.55 0.00 0.00 64.86 66.26 2eoe h ILE 34 Cb 0.37 0.21 -0.22 0.00 -0.27 0.00 0.00 36.82 36.92 2eoe h ILE 34 CO -0.25 0.00 0.67 1.41 -1.05 0.00 0.00 178.15 178.92 2eoe n HIS 35 N -4.04 2.36 -0.06 0.16 8.25 -0.28 -4.45 115.22 117.16 2eoe n HIS 35 Ca 0.34 -2.41 -0.19 0.00 -0.26 0.00 0.00 57.72 55.20 2eoe n HIS 35 Cb 1.62 -1.24 -0.13 0.00 1.12 0.00 0.00 29.99 31.37 2eoe n HIS 35 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2eoe h THR 36 N 1.26 1.29 0.00 1.59 1.35 -0.07 -3.49 112.91 114.84 2eoe h THR 36 Ca 0.46 -2.31 0.00 0.00 -0.55 0.00 0.00 66.41 64.01 2eoe h THR 36 Cb 0.74 2.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.97 2eoe h THR 36 CO 1.18 0.53 0.00 0.61 -0.25 0.00 0.00 175.52 177.59 2eoe n GLY 37 N 1.58 0.69 3.72 5.82 0.00 -1.26 -4.37 105.19 111.37 2eoe n GLY 37 Ca -0.22 -0.43 -0.35 0.00 0.00 0.00 0.00 46.02 45.02 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 5.39 0.11 1.61 0.11 -1.26 -5.09 120.40 121.27 2eoe s VAL 38 Ca 0.00 0.23 0.09 0.00 -2.93 0.00 0.00 61.98 59.37 2eoe s VAL 38 Cb 0.00 -3.50 -0.04 0.00 -1.53 0.00 0.00 36.38 31.32 2eoe s VAL 38 CO 0.00 0.42 -0.21 -1.59 -3.33 0.00 0.00 175.10 170.38 2eoe s LYS 39 N 0.50 1.17 1.05 1.54 0.00 -1.26 -5.15 119.74 117.59 2eoe s LYS 39 Ca 0.09 -1.21 -0.14 0.00 0.00 0.00 0.00 55.97 54.71 2eoe s LYS 39 Cb -0.12 -1.43 0.21 0.00 0.00 0.00 0.00 37.83 36.49 2eoe s LYS 39 CO -0.00 0.33 1.10 -1.25 0.00 0.00 0.00 175.35 175.52 2eoe s PRO 40 N -2.02 0.02 -1.73 1.78 0.04 -1.26 -3.82 135.00 128.00 2eoe s PRO 40 Ca 0.08 0.37 -0.18 0.00 0.04 0.00 0.00 61.00 61.32 2eoe s PRO 40 Cb -0.10 -1.70 0.16 0.00 0.04 0.00 0.00 34.50 32.90 2eoe s PRO 40 CO 0.05 -2.98 0.65 0.43 0.04 0.00 0.00 177.00 175.19 2eoe n SER 41 N -4.32 -2.32 -4.06 6.66 7.64 -1.26 -4.93 113.62 111.04 2eoe n SER 41 Ca 0.07 -1.11 -0.16 0.00 1.01 0.00 0.00 58.87 58.68 2eoe n SER 41 Cb 0.58 -2.33 -0.13 0.00 -1.01 0.00 0.00 64.21 61.32 2eoe n SER 41 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2eoe s GLY 42 N -3.44 0.52 0.69 0.23 0.00 -1.25 -5.15 107.32 98.92 2eoe s GLY 42 Ca 0.67 -0.64 -0.14 0.00 0.00 0.00 0.00 44.72 44.61 2eoe s GLY 42 CO 0.96 -0.65 1.11 2.56 0.00 0.00 0.00 173.10 177.08 2eoe s PRO 43 N -1.08 2.64 0.02 2.90 0.04 -1.26 -4.93 135.00 133.33 2eoe s PRO 43 Ca -0.04 1.33 -0.31 0.00 0.04 0.00 0.00 61.00 62.02 2eoe s PRO 43 Cb -0.07 -1.93 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 2eoe s PRO 43 CO 0.00 -1.37 1.96 -1.13 0.04 0.00 0.00 177.00 176.51 2eoe n SER 44 N -2.74 4.05 -4.89 6.66 3.41 -1.26 -4.97 113.62 113.89 2eoe n SER 44 Ca 0.10 0.92 -0.30 0.00 -0.26 0.00 0.00 58.87 59.32 2eoe n SER 44 Cb 0.52 -1.50 -0.04 0.00 -0.26 0.00 0.00 64.21 62.93 2eoe n SER 44 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2eoe s SER 45 N 4.37 6.53 0.00 4.04 0.15 -1.26 -5.28 113.70 122.24 2eoe s SER 45 Ca 0.90 0.78 0.30 0.00 0.70 0.00 0.00 55.95 58.63 2eoe s SER 45 Cb -0.48 -2.17 1.46 0.00 -1.71 0.00 0.00 66.02 63.12 2eoe s SER 45 CO 0.44 -0.11 1.98 0.61 1.20 0.00 0.00 173.24 177.35