#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ely n SER 2 N 0.00 -5.27 -4.92 1.61 7.64 -1.26 -5.00 113.62 106.42 2ely n SER 2 Ca 0.00 -0.51 -0.26 0.00 1.01 0.00 0.00 58.87 59.11 2ely n SER 2 Cb 0.00 -4.70 -0.02 0.00 -1.01 0.00 0.00 64.21 58.48 2ely n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2ely s SER 3 N -3.48 6.35 0.00 6.43 0.15 -1.26 -4.95 113.70 116.94 2ely s SER 3 Ca 0.44 0.62 0.00 0.00 0.70 0.00 0.00 55.95 57.70 2ely s SER 3 Cb -0.19 -2.10 0.00 0.00 -1.71 0.00 0.00 66.02 62.01 2ely s SER 3 CO 0.67 -0.29 0.00 0.61 1.20 0.00 0.00 173.24 175.43 2ely n GLY 4 N -1.51 -1.76 3.45 9.45 0.00 -1.26 -5.13 105.19 108.42 2ely n GLY 4 Ca -0.03 0.71 -0.50 0.00 0.00 0.00 0.00 46.02 46.20 2ely n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ely n SER 5 N 0.00 -0.65 -4.85 1.61 7.64 -1.26 -4.96 113.62 111.16 2ely n SER 5 Ca 0.00 1.14 -0.21 0.00 1.01 0.00 0.00 58.87 60.81 2ely n SER 5 Cb 0.00 -0.99 -0.04 0.00 -1.01 0.00 0.00 64.21 62.17 2ely n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ely s SER 6 N -0.72 5.45 -0.17 6.43 0.01 -1.26 -5.06 113.70 118.36 2ely s SER 6 Ca 0.69 -0.35 -0.22 0.00 1.31 0.00 0.00 55.95 57.38 2ely s SER 6 Cb -0.96 -1.21 -0.19 0.00 0.21 0.00 0.00 66.02 63.86 2ely s SER 6 CO 0.56 -0.19 0.36 1.23 0.41 0.00 0.00 173.24 175.61 2ely h GLY 7 N 1.35 0.00 0.55 3.44 0.00 -2.05 -3.40 103.07 102.97 2ely h GLY 7 Ca -0.47 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.87 2ely h GLY 7 CO 0.59 0.00 -0.34 -0.84 0.00 0.00 0.00 176.54 175.95 2ely h THR 8 N -1.00 0.29 -3.55 4.70 2.02 -2.03 -3.38 112.91 109.96 2ely h THR 8 Ca -0.18 0.00 -0.57 0.00 0.77 0.00 0.00 66.41 66.44 2ely h THR 8 Cb 1.06 0.29 -0.07 0.00 -1.74 0.00 0.00 68.15 67.69 2ely h THR 8 CO -0.11 0.00 0.90 -0.83 0.37 0.00 0.00 175.52 175.85 2ely s GLY 9 N -2.32 1.39 -0.18 2.16 0.00 -1.26 -5.00 107.32 102.12 2ely s GLY 9 Ca -0.16 -0.30 -0.00 0.00 0.00 0.00 0.00 44.72 44.25 2ely s GLY 9 CO 0.64 2.37 -0.07 -1.83 0.00 0.00 0.00 173.10 174.21 2ely s GLU 10 N 4.15 1.61 0.33 2.90 -1.05 -1.26 -4.49 118.70 120.89 2ely s GLU 10 Ca 0.47 -0.62 -0.28 0.00 -0.15 0.00 0.00 54.97 54.39 2ely s GLU 10 Cb -0.09 -2.14 -0.10 0.00 -0.44 0.00 0.00 34.13 31.36 2ely s GLU 10 CO 0.25 -0.44 1.25 0.15 0.95 0.00 0.00 175.26 177.43 2ely s LYS 11 N 1.56 4.37 0.22 -4.83 1.02 -1.26 -4.94 119.74 115.88 2ely s LYS 11 Ca -0.00 2.10 -0.01 0.00 0.02 0.00 0.00 55.97 58.08 2ely s LYS 11 Cb -0.16 -3.04 0.22 0.00 -0.52 0.00 0.00 37.83 34.33 2ely s LYS 11 CO -0.08 -0.13 1.59 -1.00 -0.92 0.00 0.00 175.35 174.81 2ely h PRO 12 N 3.37 0.52 -5.13 -1.68 0.13 -1.94 -3.42 132.00 123.85 2ely h PRO 12 Ca -0.48 -0.28 -0.65 0.00 -0.87 0.00 0.00 66.00 63.72 2ely h PRO 12 Cb 1.23 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 32.21 2ely h PRO 12 CO 0.65 0.86 -0.15 -0.06 -0.23 0.00 0.00 178.00 179.07 2ely s PHE 13 N -4.18 3.20 -0.05 1.56 0.08 -1.26 -5.04 117.98 112.29 2ely s PHE 13 Ca -0.07 0.15 -0.03 0.00 0.12 0.00 0.00 56.93 57.10 2ely s PHE 13 Cb 0.12 -2.79 0.03 0.00 -0.57 0.00 0.00 43.02 39.81 2ely s PHE 13 CO 0.82 -0.46 0.12 0.15 -0.10 0.00 0.00 175.22 175.75 2ely s LYS 14 N 2.23 0.09 0.16 0.44 1.02 -1.26 -0.06 119.74 122.37 2ely s LYS 14 Ca 0.16 0.28 -0.34 0.00 0.02 0.00 0.00 55.97 56.09 2ely s LYS 14 Cb -0.16 -0.11 -0.14 0.00 -0.52 0.00 0.00 37.83 36.90 2ely s LYS 14 CO 0.12 -0.12 1.53 0.00 -0.92 0.00 0.00 175.35 175.96 2ely n VAL 16 N 3.11 0.01 -0.05 0.00 3.14 -1.26 0.08 118.33 123.36 2ely n VAL 16 Ca 0.16 -0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.46 2ely n VAL 16 Cb 0.28 -0.06 -0.04 0.00 -1.06 0.00 0.00 33.84 32.96 2ely n VAL 16 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2ely n GLU 17 N -0.43 0.22 -0.03 1.45 -0.58 -1.26 -4.84 120.64 115.17 2ely n GLU 17 Ca 0.00 0.07 -0.03 0.00 -0.42 0.00 0.00 57.16 56.78 2ely n GLU 17 Cb 0.03 -1.05 -0.04 0.00 -0.57 0.00 0.00 31.44 29.81 2ely n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ely n GLY 19 N 2.70 1.08 3.28 0.00 0.00 0.11 -4.98 105.19 107.37 2ely n GLY 19 Ca -0.09 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 2ely n GLY 19 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2ely n LYS 20 N -1.72 -4.38 -4.64 1.61 4.81 -1.26 -4.61 118.16 107.98 2ely n LYS 20 Ca 0.00 -1.29 -0.30 0.00 -0.87 0.00 0.00 58.31 55.85 2ely n LYS 20 Cb 0.08 -1.98 -0.17 0.00 0.02 0.00 0.00 35.03 32.98 2ely n LYS 20 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2ely s GLY 21 N -2.91 1.18 0.48 3.14 0.00 -1.26 -3.24 107.32 104.71 2ely s GLY 21 Ca 0.68 -0.88 0.02 0.00 0.00 0.00 0.00 44.72 44.55 2ely s GLY 21 CO 0.59 0.06 0.02 -1.36 0.00 0.00 0.00 173.10 172.42 2ely s PHE 22 N 0.83 1.91 -0.14 1.90 0.40 0.92 -5.00 117.98 118.80 2ely s PHE 22 Ca -0.09 -0.98 0.06 0.00 -0.60 0.00 0.00 56.93 55.32 2ely s PHE 22 Cb -0.16 -1.55 -0.13 0.00 0.51 0.00 0.00 43.02 41.69 2ely s PHE 22 CO -0.00 0.17 -0.04 0.45 0.70 0.00 0.00 175.22 176.49 2ely n SER 23 N -1.24 2.39 -4.32 1.36 2.88 -1.26 -4.31 113.62 109.12 2ely n SER 23 Ca -0.16 -0.04 -0.25 0.00 -1.33 0.00 0.00 58.87 57.09 2ely n SER 23 Cb 0.67 0.30 -0.09 0.00 -0.75 0.00 0.00 64.21 64.34 2ely n SER 23 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ely s ARG 24 N -2.30 1.86 -0.01 -1.46 1.70 -1.26 -4.88 118.95 112.59 2ely s ARG 24 Ca -0.13 -2.10 -0.10 0.00 -0.47 0.00 0.00 55.73 52.92 2ely s ARG 24 Cb 0.04 -0.82 -0.06 0.00 -0.57 0.00 0.00 34.95 33.55 2ely s ARG 24 CO 0.43 -0.35 0.64 0.00 -1.08 0.00 0.00 175.30 174.94 2ely h ARG 25 N 1.86 -0.35 -0.97 3.89 3.08 -1.99 -3.13 114.38 116.77 2ely h ARG 25 Ca -0.38 0.02 0.23 0.00 0.07 0.00 0.00 59.98 59.92 2ely h ARG 25 Cb 1.27 0.08 -0.18 0.00 0.08 0.00 0.00 29.97 31.22 2ely h ARG 25 CO 0.64 -0.23 -0.09 0.77 -1.07 0.00 0.00 179.97 179.99 2ely h SER 26 N -0.64 -0.65 -0.93 7.04 0.02 -1.98 1.32 113.55 117.73 2ely h SER 26 Ca -0.04 0.28 0.16 0.00 -0.84 0.00 0.00 61.79 61.36 2ely h SER 26 Cb 0.28 0.53 -0.08 0.00 0.14 0.00 0.00 62.40 63.27 2ely h SER 26 CO 0.06 -0.33 0.59 0.00 -1.14 0.00 0.00 176.83 176.01 2ely h ALA 27 N 1.97 1.84 0.00 3.77 0.00 -1.99 0.32 119.26 125.17 2ely h ALA 27 Ca 0.53 0.03 -0.22 0.00 0.00 0.00 0.00 54.91 55.25 2ely h ALA 27 Cb 0.99 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2ely h ALA 27 CO -0.94 -0.12 -1.15 1.25 0.00 0.00 0.00 179.25 178.29 2ely h LEU 28 N 0.68 0.00 -0.60 0.00 5.85 0.16 -3.18 115.31 118.23 2ely h LEU 28 Ca 0.48 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 59.05 2ely h LEU 28 Cb 0.82 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 2ely h LEU 28 CO -0.24 0.97 -0.63 0.78 -0.34 0.00 0.00 178.44 178.98 2ely h ASN 29 N 0.00 0.30 -0.34 1.25 2.35 0.13 -2.57 115.58 116.70 2ely h ASN 29 Ca -0.08 -0.18 -0.17 0.00 -0.55 0.00 0.00 56.30 55.32 2ely h ASN 29 Cb 1.81 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 40.09 2ely h ASN 29 CO 0.11 0.86 -0.46 1.62 -1.65 0.00 0.00 177.43 177.90 2ely h VAL 30 N 0.19 1.27 0.00 2.81 3.04 -0.53 -2.93 116.25 120.10 2ely h VAL 30 Ca -0.01 -1.64 0.00 0.00 -1.01 0.00 0.00 66.70 64.04 2ely h VAL 30 Cb 1.16 1.51 0.00 0.00 -2.01 0.00 0.00 31.29 31.94 2ely h VAL 30 CO 0.10 0.54 0.00 -0.74 -1.01 0.00 0.00 177.57 176.46 2ely h HIS 31 N 0.71 0.00 -0.52 3.17 -0.00 -1.53 -3.04 115.15 113.94 2ely h HIS 31 Ca 0.04 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.35 2ely h HIS 31 Cb 1.07 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.46 2ely h HIS 31 CO 0.07 0.00 0.07 0.45 -0.00 0.00 0.00 177.93 178.52 2ely h HIS 32 N 0.00 0.87 0.00 5.26 -0.00 -1.26 -1.87 115.15 118.15 2ely h HIS 32 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 60.37 60.27 2ely h HIS 32 Cb 0.61 -0.25 0.00 0.00 -0.00 0.00 0.00 27.41 27.77 2ely h HIS 32 CO 0.00 0.76 0.03 1.63 -0.00 0.00 0.00 177.93 180.35 2ely n LYS 33 N -4.24 0.12 0.00 2.45 4.01 -1.15 -0.04 118.16 119.30 2ely n LYS 33 Ca 0.03 0.61 0.14 0.00 -0.51 0.00 0.00 58.31 58.58 2ely n LYS 33 Cb 0.26 -1.91 0.57 0.00 -0.51 0.00 0.00 35.03 33.45 2ely n LYS 33 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2ely n LEU 34 N -2.13 0.49 -0.55 -0.35 4.77 -0.70 -3.40 117.00 115.13 2ely n LEU 34 Ca -0.01 0.02 0.09 0.00 -0.03 0.00 0.00 56.01 56.07 2ely n LEU 34 Cb 0.05 -0.20 0.20 0.00 -2.33 0.00 0.00 43.42 41.14 2ely n LEU 34 CO 0.08 0.09 0.65 1.41 -1.33 0.00 0.00 177.39 178.29 2ely n HIS 35 N -0.99 0.54 -4.75 -1.77 8.25 0.95 -5.00 115.22 112.45 2ely n HIS 35 Ca 0.13 -0.88 -0.33 0.00 -0.26 0.00 0.00 57.72 56.38 2ely n HIS 35 Cb 0.29 -0.23 -0.12 0.00 1.12 0.00 0.00 29.99 31.05 2ely n HIS 35 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2ely s THR 36 N -2.66 3.41 0.00 1.59 -4.23 -1.22 -5.03 115.64 107.50 2ely s THR 36 Ca 0.36 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 60.28 2ely s THR 36 Cb 0.29 -2.37 0.00 0.00 1.34 0.00 0.00 72.50 71.76 2ely s THR 36 CO 0.07 0.59 0.00 0.61 -0.54 0.00 0.00 174.62 175.35 2ely n GLY 37 N 2.30 1.38 2.98 3.99 0.00 -1.26 -4.96 105.19 109.62 2ely n GLY 37 Ca -0.18 -1.64 -0.50 0.00 0.00 0.00 0.00 46.02 43.70 2ely n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ely n GLU 38 N 1.46 0.00 -4.95 1.61 1.02 -1.26 -4.94 120.64 113.57 2ely n GLU 38 Ca 0.00 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.83 2ely n GLU 38 Cb 0.00 -1.27 -0.14 0.00 -0.02 0.00 0.00 31.44 30.00 2ely n GLU 38 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2ely s LYS 39 N 0.08 2.10 0.00 3.49 -0.14 -1.26 -5.00 119.74 119.00 2ely s LYS 39 Ca 0.78 -0.94 0.16 0.00 -1.36 0.00 0.00 55.97 54.60 2ely s LYS 39 Cb -1.08 -2.13 0.93 0.00 -1.68 0.00 0.00 37.83 33.87 2ely s LYS 39 CO 0.49 0.55 1.34 -0.35 -0.76 0.00 0.00 175.35 176.63 2ely n PRO 40 N 2.01 0.49 0.00 -1.68 -0.04 -1.26 -2.82 135.00 131.69 2ely n PRO 40 Ca -0.16 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.41 2ely n PRO 40 Cb 0.52 -1.50 0.63 0.00 -0.04 0.00 0.00 33.50 33.11 2ely n PRO 40 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2ely n SER 41 N -1.00 0.00 -4.89 3.54 3.41 -1.26 -4.78 113.62 108.64 2ely n SER 41 Ca 0.12 -0.42 -0.22 0.00 -0.26 0.00 0.00 58.87 58.08 2ely n SER 41 Cb 0.05 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 63.85 2ely n SER 41 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2ely s GLY 42 N -2.25 1.37 0.27 5.00 0.00 -1.13 -5.00 107.32 105.58 2ely s GLY 42 Ca 0.29 -1.31 0.24 0.00 0.00 0.00 0.00 44.72 43.94 2ely s GLY 42 CO 0.30 -1.34 1.72 -1.55 0.00 0.00 0.00 173.10 172.23 2ely n PRO 43 N -1.17 0.20 -2.84 2.90 -0.04 -1.26 -4.64 135.00 128.15 2ely n PRO 43 Ca -0.08 0.43 -0.42 0.00 -0.04 0.00 0.00 63.50 63.39 2ely n PRO 43 Cb 0.57 -1.89 -0.04 0.00 -0.04 0.00 0.00 33.50 32.10 2ely n PRO 43 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2ely s SER 44 N -4.29 6.72 -0.26 3.54 1.04 -1.26 -5.01 113.70 114.19 2ely s SER 44 Ca 0.04 0.72 -0.01 0.00 0.48 0.00 0.00 55.95 57.18 2ely s SER 44 Cb 0.09 -2.45 0.08 0.00 0.10 0.00 0.00 66.02 63.84 2ely s SER 44 CO 0.39 -0.73 0.04 -0.44 0.98 0.00 0.00 173.24 173.48 2ely s SER 45 N 1.69 3.68 0.00 7.02 0.01 -1.26 -4.95 113.70 119.89 2ely s SER 45 Ca 0.37 -1.30 0.00 0.00 1.31 0.00 0.00 55.95 56.32 2ely s SER 45 Cb -0.13 -0.89 0.00 0.00 0.21 0.00 0.00 66.02 65.21 2ely s SER 45 CO 0.15 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 174.07