#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eom s SER 2 N 0.00 1.03 -0.01 1.61 1.04 -1.26 -5.08 113.70 111.04 2eom s SER 2 Ca 0.00 -1.21 -0.23 0.00 0.48 0.00 0.00 55.95 54.99 2eom s SER 2 Cb 0.00 0.16 -0.14 0.00 0.10 0.00 0.00 66.02 66.14 2eom s SER 2 CO 0.00 -0.62 1.03 -1.28 0.98 0.00 0.00 173.24 173.35 2eom h SER 3 N 2.68 -0.46 -4.01 7.02 0.87 -2.15 -3.50 113.55 114.01 2eom h SER 3 Ca -0.37 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 2eom h SER 3 Cb 1.21 0.12 0.00 0.00 -0.44 0.00 0.00 62.40 63.29 2eom h SER 3 CO 0.62 -0.05 -0.67 0.61 -0.53 0.00 0.00 176.83 176.81 2eom n GLY 4 N -0.12 -4.06 3.88 5.77 0.00 -1.26 -4.96 105.19 104.44 2eom n GLY 4 Ca -0.09 -0.87 -0.31 0.00 0.00 0.00 0.00 46.02 44.75 2eom n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eom s SER 5 N -3.49 5.92 0.26 1.61 0.01 -1.26 -5.09 113.70 111.66 2eom s SER 5 Ca 0.00 1.30 0.09 0.00 1.31 0.00 0.00 55.95 58.65 2eom s SER 5 Cb 0.00 -2.25 -0.05 0.00 0.21 0.00 0.00 66.02 63.93 2eom s SER 5 CO 0.00 -1.05 -0.15 -0.94 0.41 0.00 0.00 173.24 171.51 2eom s SER 6 N -4.25 3.12 0.00 2.44 1.04 -1.26 -5.04 113.70 109.74 2eom s SER 6 Ca 0.56 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.93 2eom s SER 6 Cb -0.11 -0.23 0.00 0.00 0.10 0.00 0.00 66.02 65.78 2eom s SER 6 CO 0.53 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.24 2eom n GLY 7 N -0.55 0.00 2.25 7.32 0.00 -1.26 -5.06 105.19 107.89 2eom n GLY 7 Ca -0.06 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 2eom n GLY 7 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2eom n HIS 8 N 0.00 3.00 -2.44 1.61 -0.00 -1.26 -5.03 115.22 111.11 2eom n HIS 8 Ca 0.00 -2.59 -0.09 0.00 -0.00 0.00 0.00 57.72 55.03 2eom n HIS 8 Cb 0.00 -0.70 0.05 0.00 -0.00 0.00 0.00 29.99 29.34 2eom n HIS 8 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2eom n GLY 9 N -0.73 0.80 3.30 -1.41 0.00 -1.26 -5.14 105.19 100.76 2eom n GLY 9 Ca 0.50 -2.00 -0.11 0.00 0.00 0.00 0.00 46.02 44.41 2eom n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eom s GLU 10 N -3.48 0.99 -0.04 1.61 1.03 -1.26 -5.16 118.70 112.39 2eom s GLU 10 Ca 0.27 -0.64 -0.01 0.00 0.03 0.00 0.00 54.97 54.62 2eom s GLU 10 Cb -0.02 0.43 0.03 0.00 -0.80 0.00 0.00 34.13 33.77 2eom s GLU 10 CO 0.18 -0.36 0.03 0.50 -1.33 0.00 0.00 175.26 174.28 2eom s ARG 11 N -3.39 0.09 0.00 -4.83 3.00 -1.26 -5.09 118.95 107.46 2eom s ARG 11 Ca 0.01 0.25 0.00 0.00 -1.00 0.00 0.00 55.73 54.98 2eom s ARG 11 Cb 0.01 -0.51 0.00 0.00 0.00 0.00 0.00 34.95 34.45 2eom s ARG 11 CO -0.09 -0.26 0.00 0.41 0.00 0.00 0.00 175.30 175.36 2eom n GLY 12 N 4.83 -0.20 2.93 8.12 0.00 -1.26 -4.77 105.19 114.84 2eom n GLY 12 Ca -0.13 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 45.05 2eom n GLY 12 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2eom s HIS 13 N -4.00 -0.47 -0.06 1.61 3.76 -0.02 -4.94 115.29 111.17 2eom s HIS 13 Ca 0.00 0.76 -0.08 0.00 -0.15 0.00 0.00 55.06 55.59 2eom s HIS 13 Cb 0.00 -0.10 -0.04 0.00 1.11 0.00 0.00 32.58 33.54 2eom s HIS 13 CO 0.00 -0.49 0.22 0.50 -0.85 0.00 0.00 174.74 174.12 2eom s ARG 14 N 2.43 3.56 0.46 1.40 3.52 -1.26 -0.88 118.95 128.18 2eom s ARG 14 Ca 0.05 -0.04 -0.10 0.00 -0.13 0.00 0.00 55.73 55.51 2eom s ARG 14 Cb -0.14 -3.16 -0.06 0.00 -1.56 0.00 0.00 34.95 30.04 2eom s ARG 14 CO -0.11 0.73 0.83 0.00 -0.81 0.00 0.00 175.30 175.94 2eom n SER 16 N -1.75 1.91 0.14 0.00 2.88 -1.26 -3.19 113.62 112.34 2eom n SER 16 Ca 0.03 -0.01 -0.13 0.00 -1.33 0.00 0.00 58.87 57.42 2eom n SER 16 Cb 0.54 0.67 -0.07 0.00 -0.75 0.00 0.00 64.21 64.61 2eom n SER 16 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2eom h ASP 17 N 0.00 -0.39 0.00 -3.46 3.32 -1.99 -3.37 116.42 110.53 2eom h ASP 17 Ca -0.36 0.03 -0.27 0.00 0.02 0.00 0.00 57.03 56.46 2eom h ASP 17 Cb 1.77 0.13 -0.04 0.00 0.22 0.00 0.00 39.33 41.41 2eom h ASP 17 CO 0.01 -0.23 -1.95 0.00 -1.72 0.00 0.00 179.24 175.34 2eom n GLY 19 N 2.35 1.57 2.84 0.00 0.00 -1.19 -5.07 105.19 105.69 2eom n GLY 19 Ca -0.31 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.52 2eom n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2eom n LYS 20 N -0.26 -0.33 -4.07 1.61 5.02 -1.25 -4.76 118.16 114.12 2eom n LYS 20 Ca 0.00 -1.80 -0.12 0.00 -2.02 0.00 0.00 58.31 54.37 2eom n LYS 20 Cb 0.00 -0.69 -0.11 0.00 -0.02 0.00 0.00 35.03 34.21 2eom n LYS 20 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2eom s PHE 21 N -2.57 0.64 0.24 2.13 5.36 -1.26 -1.01 117.98 121.50 2eom s PHE 21 Ca 0.51 -0.60 -0.09 0.00 -0.96 0.00 0.00 56.93 55.79 2eom s PHE 21 Cb -0.02 -0.39 -0.01 0.00 -0.34 0.00 0.00 43.02 42.26 2eom s PHE 21 CO 0.35 -0.12 0.39 -0.06 -1.46 0.00 0.00 175.22 174.32 2eom s PHE 22 N -1.88 0.62 0.00 10.12 0.40 -0.05 -4.96 117.98 122.22 2eom s PHE 22 Ca -0.07 -0.93 0.00 0.00 -0.60 0.00 0.00 56.93 55.33 2eom s PHE 22 Cb -0.07 -0.01 0.00 0.00 0.51 0.00 0.00 43.02 43.45 2eom s PHE 22 CO -0.01 -0.92 0.00 1.28 0.70 0.00 0.00 175.22 176.27 2eom n LEU 23 N -0.37 1.81 -4.57 -0.37 7.99 -1.26 -0.84 117.00 119.39 2eom n LEU 23 Ca -0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 56.01 55.61 2eom n LEU 23 Cb 0.63 0.00 -0.11 0.00 -0.11 0.00 0.00 43.42 43.83 2eom n LEU 23 CO 0.26 0.30 -0.17 -1.10 -1.51 0.00 0.00 177.39 175.16 2eom s GLN 24 N -1.98 3.87 0.09 3.23 -1.52 -1.26 -4.73 119.66 117.35 2eom s GLN 24 Ca 0.00 -0.37 -0.17 0.00 -1.95 0.00 0.00 55.36 52.86 2eom s GLN 24 Cb 0.00 -3.65 -0.04 0.00 -0.22 0.00 0.00 33.01 29.10 2eom s GLN 24 CO 0.00 -0.21 1.30 0.00 -0.25 0.00 0.00 175.29 176.13 2eom h ALA 25 N 8.37 -0.33 -0.95 6.09 0.00 -1.96 0.42 119.26 130.90 2eom h ALA 25 Ca -0.35 0.06 0.14 0.00 0.00 0.00 0.00 54.91 54.77 2eom h ALA 25 Cb 1.18 1.19 -0.15 0.00 0.00 0.00 0.00 17.79 20.01 2eom h ALA 25 CO 0.56 -0.56 -0.38 -1.13 0.00 0.00 0.00 179.25 177.74 2eom n SER 26 N -4.25 -0.64 -0.02 0.00 3.41 -1.26 0.21 113.62 111.07 2eom n SER 26 Ca 0.01 1.66 0.08 0.00 -0.26 0.00 0.00 58.87 60.36 2eom n SER 26 Cb 0.15 -0.37 0.48 0.00 -0.26 0.00 0.00 64.21 64.21 2eom n SER 26 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2eom h ASN 27 N 0.00 0.38 0.50 4.04 4.21 -1.41 -0.09 115.58 123.21 2eom h ASN 27 Ca 0.32 -0.00 -0.20 0.00 1.21 0.00 0.00 56.30 57.63 2eom h ASN 27 Cb 0.56 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.66 2eom h ASN 27 CO -0.94 0.26 -0.86 0.15 -1.29 0.00 0.00 177.43 174.75 2eom h PHE 28 N 0.44 0.37 -0.01 1.19 3.57 0.41 -3.13 116.94 119.77 2eom h PHE 28 Ca 0.20 -0.19 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2eom h PHE 28 Cb 0.24 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.94 2eom h PHE 28 CO -0.00 0.99 -0.02 0.82 -2.23 0.00 0.00 178.31 177.87 2eom h ILE 29 N 0.15 1.44 0.00 1.41 2.04 0.11 -2.73 117.51 119.93 2eom h ILE 29 Ca -0.05 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 64.49 2eom h ILE 29 Cb 1.47 2.32 0.00 0.00 -0.74 0.00 0.00 36.82 39.87 2eom h ILE 29 CO 0.14 0.35 0.00 0.00 0.00 0.00 0.00 178.15 178.63 2eom n GLN 30 N -4.79 0.09 -0.07 2.37 1.13 -0.17 -1.60 117.38 114.34 2eom n GLN 30 Ca -0.09 0.22 -0.14 0.00 -1.94 0.00 0.00 57.00 55.06 2eom n GLN 30 Cb 0.29 -1.50 -0.14 0.00 0.11 0.00 0.00 30.24 29.00 2eom n GLN 30 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 2eom n HIS 31 N -1.28 0.45 0.53 1.08 -0.00 -1.11 -4.12 115.22 110.77 2eom n HIS 31 Ca 0.03 0.13 0.08 0.00 -0.00 0.00 0.00 57.72 57.96 2eom n HIS 31 Cb 0.05 -1.07 0.36 0.00 -0.00 0.00 0.00 29.99 29.33 2eom n HIS 31 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2eom n ARG 32 N -3.09 0.03 0.03 1.57 5.12 -0.63 -2.78 116.66 116.90 2eom n ARG 32 Ca -0.33 0.25 -0.19 0.00 -1.93 0.00 0.00 57.85 55.65 2eom n ARG 32 Cb 1.07 -1.55 -0.11 0.00 -1.16 0.00 0.00 32.46 30.71 2eom n ARG 32 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2eom h ARG 33 N 0.00 0.57 -1.10 5.56 3.08 -1.70 -3.26 114.38 117.54 2eom h ARG 33 Ca 0.00 -0.62 0.35 0.00 0.07 0.00 0.00 59.98 59.78 2eom h ARG 33 Cb 0.29 0.18 -0.14 0.00 0.08 0.00 0.00 29.97 30.38 2eom h ARG 33 CO 0.00 1.24 0.66 -0.84 -1.07 0.00 0.00 179.97 179.96 2eom h ILE 34 N 0.16 0.26 0.00 2.04 3.07 -1.72 1.54 117.51 122.86 2eom h ILE 34 Ca -0.11 -0.08 -0.12 0.00 1.55 0.00 0.00 64.86 66.10 2eom h ILE 34 Cb 1.55 -0.01 -0.02 0.00 -0.27 0.00 0.00 36.82 38.08 2eom h ILE 34 CO 0.17 0.05 -0.56 0.45 -1.05 0.00 0.00 178.15 177.21 2eom h HIS 35 N 0.25 0.00 -2.68 0.16 3.86 -1.74 -3.43 115.15 111.57 2eom h HIS 35 Ca 0.75 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 59.39 2eom h HIS 35 Cb 1.94 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 30.37 2eom h HIS 35 CO -0.01 0.56 1.24 0.95 0.86 0.00 0.00 177.93 181.54 2eom s THR 36 N -3.37 3.55 0.00 2.45 -4.23 0.53 -3.30 115.64 111.26 2eom s THR 36 Ca 0.00 0.53 0.00 0.00 -1.18 0.00 0.00 61.69 61.04 2eom s THR 36 Cb 0.11 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 70.13 2eom s THR 36 CO 0.74 -0.57 0.00 0.61 -0.54 0.00 0.00 174.62 174.85 2eom n GLY 37 N 5.39 3.64 3.59 3.99 0.00 -1.26 -4.98 105.19 115.55 2eom n GLY 37 Ca 0.21 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 45.42 2eom n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eom s GLU 38 N 0.00 2.13 0.14 1.61 2.12 -1.21 -5.07 118.70 118.43 2eom s GLU 38 Ca 0.00 -1.20 -0.25 0.00 0.36 0.00 0.00 54.97 53.88 2eom s GLU 38 Cb 0.00 -2.22 -0.15 0.00 0.26 0.00 0.00 34.13 32.02 2eom s GLU 38 CO 0.00 0.45 0.51 1.63 -0.54 0.00 0.00 175.26 177.31 2eom n LYS 39 N 0.11 0.00 0.00 4.30 5.02 -1.26 -4.94 118.16 121.39 2eom n LYS 39 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 2eom n LYS 39 Cb 0.55 -0.91 0.00 0.00 -0.02 0.00 0.00 35.03 34.65 2eom n LYS 39 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2eom n PRO 40 N 0.91 -0.46 0.12 1.97 -0.04 -1.26 -4.94 135.00 131.29 2eom n PRO 40 Ca 0.15 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.48 2eom n PRO 40 Cb 0.19 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.59 2eom n PRO 40 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2eom h SER 41 N -0.74 -0.89 -1.72 3.54 0.02 -1.92 -3.38 113.55 108.47 2eom h SER 41 Ca 0.00 0.10 -0.44 0.00 -0.84 0.00 0.00 61.79 60.61 2eom h SER 41 Cb 0.00 0.33 -0.30 0.00 0.14 0.00 0.00 62.40 62.57 2eom h SER 41 CO 0.00 -0.40 -0.83 0.61 -1.14 0.00 0.00 176.83 175.07 2eom n GLY 42 N -1.41 1.37 3.63 -3.77 0.00 -1.26 -5.14 105.19 98.60 2eom n GLY 42 Ca -0.07 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 44.90 2eom n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eom s PRO 43 N 0.10 -0.50 0.11 1.61 0.04 -1.26 -5.04 135.00 130.07 2eom s PRO 43 Ca 0.33 0.19 -0.07 0.00 0.04 0.00 0.00 61.00 61.49 2eom s PRO 43 Cb 0.07 -1.66 -0.06 0.00 0.04 0.00 0.00 34.50 32.90 2eom s PRO 43 CO -0.15 -3.28 0.39 0.45 0.04 0.00 0.00 177.00 174.45 2eom s SER 44 N -3.68 6.56 0.12 6.66 0.15 -1.26 -5.09 113.70 117.15 2eom s SER 44 Ca 0.68 0.68 0.01 0.00 0.70 0.00 0.00 55.95 58.02 2eom s SER 44 Cb -0.14 -2.13 -0.04 0.00 -1.71 0.00 0.00 66.02 62.00 2eom s SER 44 CO 0.57 0.11 -0.01 -0.94 1.20 0.00 0.00 173.24 174.16 2eom s SER 45 N -2.11 0.86 0.00 5.45 1.04 -1.26 -5.19 113.70 112.48 2eom s SER 45 Ca 0.37 -1.10 0.09 0.00 0.48 0.00 0.00 55.95 55.79 2eom s SER 45 Cb -0.13 0.17 0.07 0.00 0.10 0.00 0.00 66.02 66.23 2eom s SER 45 CO 0.21 -0.58 0.78 0.61 0.98 0.00 0.00 173.24 175.24