#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 0.84 -4.67 1.61 2.88 -1.26 -4.98 113.62 108.05 2ely n SER 2 Ca 0.00 0.14 -0.43 0.00 -1.33 0.00 0.00 58.87 57.26 2ely n SER 2 Cb 0.00 -0.34 -0.02 0.00 -0.75 0.00 0.00 64.21 63.09 2ely n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2ely s SER 3 N -6.00 7.01 -0.19 -3.46 0.15 -1.26 -4.93 113.70 105.02 2ely s SER 3 Ca -0.15 1.67 -0.15 0.00 0.70 0.00 0.00 55.95 58.02 2ely s SER 3 Cb 0.06 -2.54 -0.08 0.00 -1.71 0.00 0.00 66.02 61.74 2ely s SER 3 CO 0.19 -0.68 -0.23 0.61 1.20 0.00 0.00 173.24 174.33 2ely n GLY 4 N 3.48 -0.68 3.13 9.45 0.00 -1.26 -4.88 105.19 114.43 2ely n GLY 4 Ca 0.13 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 2ely n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ely s SER 5 N -6.28 4.96 -0.77 1.61 0.15 -1.26 -5.05 113.70 107.07 2ely s SER 5 Ca -0.27 -1.63 -0.26 0.00 0.70 0.00 0.00 55.95 54.50 2ely s SER 5 Cb 0.06 -1.73 -0.01 0.00 -1.71 0.00 0.00 66.02 62.63 2ely s SER 5 CO 0.40 -0.36 1.69 -0.55 1.20 0.00 0.00 173.24 175.63 2ely s SER 6 N 1.37 5.61 0.00 5.45 0.15 -1.26 -4.88 113.70 120.15 2ely s SER 6 Ca 0.01 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.32 2ely s SER 6 Cb -0.21 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 2ely s SER 6 CO -0.03 -2.22 0.00 0.61 1.20 0.00 0.00 173.24 172.79 2ely n GLY 7 N 6.07 4.15 3.71 9.45 0.00 -1.26 -5.16 105.19 122.16 2ely n GLY 7 Ca 0.23 -1.22 -0.35 0.00 0.00 0.00 0.00 46.02 44.68 2ely n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ely s THR 8 N -1.88 4.49 0.00 2.61 2.01 -1.26 -4.91 115.64 116.71 2ely s THR 8 Ca 0.00 -0.18 0.00 0.00 0.31 0.00 0.00 61.69 61.82 2ely s THR 8 Cb 0.00 -2.90 0.00 0.00 0.01 0.00 0.00 72.50 69.61 2ely s THR 8 CO 0.00 0.61 0.00 0.61 -0.69 0.00 0.00 174.62 175.15 2ely n GLY 9 N 2.12 -1.33 3.77 4.40 0.00 -1.26 -5.02 105.19 107.87 2ely n GLY 9 Ca -0.19 0.50 -0.26 0.00 0.00 0.00 0.00 46.02 46.07 2ely n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2ely n GLU 10 N 0.00 -5.97 -2.12 1.61 2.13 -1.26 -4.90 120.64 110.13 2ely n GLU 10 Ca 0.00 0.67 -0.42 0.00 0.66 0.00 0.00 57.16 58.07 2ely n GLU 10 Cb 0.00 -5.52 -0.03 0.00 0.27 0.00 0.00 31.44 26.16 2ely n GLU 10 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2ely s LYS 11 N -6.33 4.31 0.10 5.31 2.47 -1.26 -4.94 119.74 119.40 2ely s LYS 11 Ca 0.45 2.16 -0.15 0.00 -1.56 0.00 0.00 55.97 56.86 2ely s LYS 11 Cb -0.22 -3.19 -0.09 0.00 -1.46 0.00 0.00 37.83 32.87 2ely s LYS 11 CO 0.80 -0.40 1.42 -1.00 0.16 0.00 0.00 175.35 176.32 2ely h PRO 12 N 6.03 0.68 -5.39 4.03 0.13 -1.91 -3.43 132.00 132.13 2ely h PRO 12 Ca -0.44 -0.35 -0.62 0.00 -0.87 0.00 0.00 66.00 63.72 2ely h PRO 12 Cb 1.21 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 32.24 2ely h PRO 12 CO 0.83 0.96 -0.51 -0.06 -0.23 0.00 0.00 178.00 178.99 2ely s PHE 13 N -4.37 3.42 -0.17 1.56 0.40 -1.00 -5.01 117.98 112.80 2ely s PHE 13 Ca -0.12 0.33 -0.09 0.00 -0.60 0.00 0.00 56.93 56.45 2ely s PHE 13 Cb 0.08 -2.08 0.06 0.00 0.51 0.00 0.00 43.02 41.60 2ely s PHE 13 CO 0.82 0.38 0.40 0.15 0.70 0.00 0.00 175.22 177.68 2ely s LYS 14 N -0.02 0.37 -0.08 0.44 1.02 -1.26 -0.21 119.74 120.00 2ely s LYS 14 Ca 0.09 0.83 -0.39 0.00 0.02 0.00 0.00 55.97 56.52 2ely s LYS 14 Cb -0.11 0.04 -0.17 0.00 -0.52 0.00 0.00 37.83 37.06 2ely s LYS 14 CO -0.00 -0.18 1.44 0.00 -0.92 0.00 0.00 175.35 175.69 2ely n VAL 16 N 3.09 0.00 -0.02 0.00 3.14 -1.26 0.74 118.33 124.02 2ely n VAL 16 Ca 0.22 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.58 2ely n VAL 16 Cb 0.14 -0.14 -0.02 0.00 -1.06 0.00 0.00 33.84 32.75 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 -0.37 2.84 0.00 1.45 1.02 -1.26 -4.87 120.64 119.44 2ely n GLU 17 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2ely n GLU 17 Cb 0.05 -1.08 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 2ely n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ely n GLY 19 N 2.11 1.70 1.09 0.00 0.00 0.23 -4.96 105.19 105.36 2ely n GLY 19 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2ely n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ely n LYS 20 N -1.20 -1.11 -4.01 1.61 4.76 -1.25 -4.49 118.16 112.46 2ely n LYS 20 Ca 0.00 -0.33 -0.23 0.00 -2.87 0.00 0.00 58.31 54.89 2ely n LYS 20 Cb 0.00 -0.56 -0.17 0.00 -1.84 0.00 0.00 35.03 32.46 2ely n LYS 20 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2ely s GLY 21 N -1.61 0.56 0.22 0.72 0.00 -1.26 -3.51 107.32 102.44 2ely s GLY 21 Ca 0.15 -0.21 -0.05 0.00 0.00 0.00 0.00 44.72 44.61 2ely s GLY 21 CO 0.13 0.73 0.26 -1.36 0.00 0.00 0.00 173.10 172.86 2ely s PHE 22 N 1.43 0.86 0.00 1.90 0.08 0.71 -4.97 117.98 117.98 2ely s PHE 22 Ca -0.02 -1.13 0.00 0.00 0.12 0.00 0.00 56.93 55.89 2ely s PHE 22 Cb -0.13 -0.27 0.00 0.00 -0.57 0.00 0.00 43.02 42.04 2ely s PHE 22 CO -0.03 -0.78 0.16 0.43 -0.10 0.00 0.00 175.22 174.90 2ely n SER 23 N -0.32 0.32 -4.26 1.36 7.64 -1.26 -2.39 113.62 114.70 2ely n SER 23 Ca 0.01 -0.64 -0.14 0.00 1.01 0.00 0.00 58.87 59.11 2ely n SER 23 Cb 0.64 0.48 -0.10 0.00 -1.01 0.00 0.00 64.21 64.22 2ely n SER 23 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ely s ARG 24 N -0.48 1.26 0.15 1.43 3.03 -1.26 -4.93 118.95 118.14 2ely s ARG 24 Ca 0.00 -1.66 -0.04 0.00 2.03 0.00 0.00 55.73 56.07 2ely s ARG 24 Cb 0.00 -0.13 -0.03 0.00 -1.03 0.00 0.00 34.95 33.76 2ely s ARG 24 CO 0.00 -0.27 1.36 0.00 -1.13 0.00 0.00 175.30 175.26 2ely h ARG 25 N 2.54 0.45 -0.05 3.89 3.08 -1.98 -2.98 114.38 119.33 2ely h ARG 25 Ca -0.37 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.25 2ely h ARG 25 Cb 1.23 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.38 2ely h ARG 25 CO 0.60 1.06 -0.01 0.77 -1.07 0.00 0.00 179.97 181.32 2ely h SER 26 N 0.28 0.10 -0.70 7.04 0.02 -1.97 1.09 113.55 119.42 2ely h SER 26 Ca -0.06 -0.34 0.07 0.00 -0.84 0.00 0.00 61.79 60.62 2ely h SER 26 Cb 1.44 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.91 2ely h SER 26 CO 0.15 0.41 0.46 0.00 -1.14 0.00 0.00 176.83 176.71 2ely h ALA 27 N 0.69 1.75 0.00 3.77 0.00 -1.99 0.41 119.26 123.88 2ely h ALA 27 Ca 0.01 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 2ely h ALA 27 Cb 0.37 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2ely h ALA 27 CO 0.00 0.14 -1.34 1.25 0.00 0.00 0.00 179.25 179.31 2ely h LEU 28 N 0.70 0.00 -0.26 0.00 5.85 -1.39 -3.26 115.31 116.95 2ely h LEU 28 Ca 0.30 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.83 2ely h LEU 28 Cb 0.29 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 2ely h LEU 28 CO -0.10 0.64 -0.89 0.78 -0.34 0.00 0.00 178.44 178.53 2ely h ASN 29 N 0.00 0.24 -0.19 1.25 2.35 0.22 -2.77 115.58 116.67 2ely h ASN 29 Ca -0.16 -0.20 -0.11 0.00 -0.55 0.00 0.00 56.30 55.29 2ely h ASN 29 Cb 1.63 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.92 2ely h ASN 29 CO 0.06 1.01 -0.30 1.62 -1.65 0.00 0.00 177.43 178.17 2ely h VAL 30 N 0.10 1.34 0.00 2.81 3.04 -0.36 -3.06 116.25 120.12 2ely h VAL 30 Ca -0.04 -1.51 -0.04 0.00 -1.01 0.00 0.00 66.70 64.10 2ely h VAL 30 Cb 1.52 1.85 -0.01 0.00 -2.01 0.00 0.00 31.29 32.65 2ely h VAL 30 CO 0.13 0.46 -0.18 -0.74 -1.01 0.00 0.00 177.57 176.24 2ely h HIS 31 N 0.20 0.00 -0.95 3.17 -0.00 -1.62 -2.92 115.15 113.03 2ely h HIS 31 Ca 0.02 0.00 0.05 0.00 -0.00 0.00 0.00 60.37 60.44 2ely h HIS 31 Cb 0.88 0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 28.23 2ely h HIS 31 CO 0.09 0.18 0.61 0.45 -0.00 0.00 0.00 177.93 179.26 2ely h HIS 32 N 0.00 1.14 -0.33 5.26 -0.00 -1.38 -0.64 115.15 119.21 2ely h HIS 32 Ca -0.00 0.03 0.09 0.00 -0.00 0.00 0.00 60.37 60.49 2ely h HIS 32 Cb 0.55 -0.38 -0.01 0.00 -0.00 0.00 0.00 27.41 27.58 2ely h HIS 32 CO 0.00 0.62 0.30 0.87 -0.00 0.00 0.00 177.93 179.72 2ely h LYS 33 N 1.15 0.00 0.00 2.45 6.56 -1.59 0.37 116.57 125.50 2ely h LYS 33 Ca 0.40 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.99 2ely h LYS 33 Cb 0.10 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.76 2ely h LYS 33 CO -0.15 0.00 0.00 1.28 -2.06 0.00 0.00 179.45 178.52 2ely n LEU 34 N -3.96 0.00 -0.63 2.94 4.77 -0.25 -1.61 117.00 118.26 2ely n LEU 34 Ca 0.05 0.28 0.06 0.00 -0.03 0.00 0.00 56.01 56.37 2ely n LEU 34 Cb 0.47 -0.28 0.17 0.00 -2.33 0.00 0.00 43.42 41.45 2ely n LEU 34 CO 0.30 -0.15 0.64 1.41 -1.33 0.00 0.00 177.39 178.26 2ely n HIS 35 N -1.28 0.55 -3.70 -1.77 8.25 0.13 -5.01 115.22 112.39 2ely n HIS 35 Ca 0.07 -0.64 -0.22 0.00 -0.26 0.00 0.00 57.72 56.68 2ely n HIS 35 Cb 0.11 -0.12 -0.04 0.00 1.12 0.00 0.00 29.99 31.06 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 -1.63 2.65 -0.37 1.59 -4.23 -0.63 -5.02 115.64 107.99 2ely s THR 36 Ca 0.27 -1.42 -0.39 0.00 -1.18 0.00 0.00 61.69 58.97 2ely s THR 36 Cb 0.18 -3.01 -0.15 0.00 1.34 0.00 0.00 72.50 70.87 2ely s THR 36 CO 0.12 -0.02 2.04 0.61 -0.54 0.00 0.00 174.62 176.83 2ely n GLY 37 N -1.47 0.43 2.01 3.99 0.00 -1.26 -4.81 105.19 104.08 2ely n GLY 37 Ca 0.02 0.98 -0.06 0.00 0.00 0.00 0.00 46.02 46.97 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 7.14 1.97 -1.47 1.61 -0.58 -1.26 -5.10 120.64 122.96 2ely n GLU 38 Ca 0.40 -3.41 -0.53 0.00 -0.42 0.00 0.00 57.16 53.20 2ely n GLU 38 Cb 0.13 -1.52 -0.06 0.00 -0.57 0.00 0.00 31.44 29.42 2ely n GLU 38 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2ely n LYS 39 N -0.51 0.12 -0.36 3.49 4.81 -1.26 -4.94 118.16 119.51 2ely n LYS 39 Ca 0.20 0.04 -0.10 0.00 -0.87 0.00 0.00 58.31 57.58 2ely n LYS 39 Cb 0.90 -1.34 0.09 0.00 0.02 0.00 0.00 35.03 34.69 2ely n LYS 39 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2ely n PRO 40 N 1.32 -1.76 -4.01 1.64 -0.04 -1.26 -5.05 135.00 125.85 2ely n PRO 40 Ca 0.19 -0.60 -0.31 0.00 -0.04 0.00 0.00 63.50 62.73 2ely n PRO 40 Cb 0.17 -0.57 -0.15 0.00 -0.04 0.00 0.00 33.50 32.91 2ely n PRO 40 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2ely s SER 41 N -2.53 4.09 -0.33 3.54 0.15 -1.26 -5.07 113.70 112.29 2ely s SER 41 Ca 0.25 -1.26 -0.31 0.00 0.70 0.00 0.00 55.95 55.33 2ely s SER 41 Cb -0.02 -1.36 -0.09 0.00 -1.71 0.00 0.00 66.02 62.84 2ely s SER 41 CO 0.19 -0.21 2.24 0.61 1.20 0.00 0.00 173.24 177.28 2ely n GLY 42 N 4.56 0.64 3.56 9.45 0.00 -1.26 -4.86 105.19 117.28 2ely n GLY 42 Ca -0.13 0.85 -0.39 0.00 0.00 0.00 0.00 46.02 46.35 2ely n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ely s PRO 43 N 6.57 2.76 0.25 1.61 0.04 -1.26 -4.86 135.00 140.10 2ely s PRO 43 Ca 1.06 0.73 -0.03 0.00 0.04 0.00 0.00 61.00 62.80 2ely s PRO 43 Cb -0.60 -4.35 0.51 0.00 0.04 0.00 0.00 34.50 30.11 2ely s PRO 43 CO 0.41 -2.57 1.70 0.77 0.04 0.00 0.00 177.00 177.36 2ely h SER 44 N 14.51 0.18 -3.12 6.66 0.02 -2.07 -3.36 113.55 126.36 2ely h SER 44 Ca -0.27 0.13 -0.57 0.00 -0.84 0.00 0.00 61.79 60.24 2ely h SER 44 Cb 1.16 0.14 -0.05 0.00 0.14 0.00 0.00 62.40 63.79 2ely h SER 44 CO 1.19 0.02 0.92 -0.55 -1.14 0.00 0.00 176.83 177.28 2ely s SER 45 N -5.27 6.80 0.00 3.07 0.15 -1.26 -5.35 113.70 111.84 2ely s SER 45 Ca -0.12 1.29 0.00 0.00 0.70 0.00 0.00 55.95 57.82 2ely s SER 45 Cb 0.22 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.99 2ely s SER 45 CO 0.76 -0.95 0.00 0.61 1.20 0.00 0.00 173.24 174.86