#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ely h SER 2 N 0.00 -0.08 -0.98 1.61 0.87 -2.07 -3.33 113.55 109.56 2ely h SER 2 Ca 0.00 -0.01 0.32 0.00 -1.23 0.00 0.00 61.79 60.88 2ely h SER 2 Cb 0.00 0.02 -0.17 0.00 -0.44 0.00 0.00 62.40 61.81 2ely h SER 2 CO 0.00 0.41 0.28 -1.28 -0.53 0.00 0.00 176.83 175.71 2ely h SER 3 N -1.03 -0.06 -6.92 6.23 0.87 -2.12 -3.44 113.55 107.09 2ely h SER 3 Ca -0.01 0.26 -0.59 0.00 -1.23 0.00 0.00 61.79 60.22 2ely h SER 3 Cb 0.08 0.36 -0.15 0.00 -0.44 0.00 0.00 62.40 62.25 2ely h SER 3 CO 0.02 -0.34 -0.96 0.61 -0.53 0.00 0.00 176.83 175.63 2ely n GLY 4 N -1.38 -0.24 0.74 5.77 0.00 -1.25 -4.84 105.19 103.99 2ely n GLY 4 Ca 0.29 0.19 -0.02 0.00 0.00 0.00 0.00 46.02 46.48 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 -2.83 0.92 -4.80 1.61 7.64 -1.26 -5.05 113.62 109.85 2ely n SER 5 Ca -0.30 0.02 -0.35 0.00 1.01 0.00 0.00 58.87 59.25 2ely n SER 5 Cb 0.68 -0.07 -0.05 0.00 -1.01 0.00 0.00 64.21 63.76 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 -5.02 6.85 0.00 6.43 0.01 -1.26 -4.62 113.70 116.09 2ely s SER 6 Ca -0.03 1.88 0.00 0.00 1.31 0.00 0.00 55.95 59.11 2ely s SER 6 Cb 0.01 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2ely s SER 6 CO 0.05 -0.42 0.00 0.61 0.41 0.00 0.00 173.24 173.88 2ely n GLY 7 N 0.00 1.00 2.59 3.44 0.00 -1.26 -5.11 105.19 105.85 2ely n GLY 7 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 2ely n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ely s THR 8 N -1.95 1.04 0.00 2.61 -4.23 -1.26 -5.09 115.64 106.76 2ely s THR 8 Ca 0.00 -2.69 0.00 0.00 -1.18 0.00 0.00 61.69 57.82 2ely s THR 8 Cb 0.00 -1.72 0.00 0.00 1.34 0.00 0.00 72.50 72.12 2ely s THR 8 CO 0.00 -1.04 0.00 0.61 -0.54 0.00 0.00 174.62 173.65 2ely n GLY 9 N 3.17 0.01 0.00 3.99 0.00 -1.26 -4.68 105.19 106.42 2ely n GLY 9 Ca 0.18 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.79 2ely n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ely n GLU 10 N 1.56 1.79 -1.65 1.61 4.71 -1.26 -5.05 120.64 122.34 2ely n GLU 10 Ca 0.00 0.00 -0.54 0.00 -0.01 0.00 0.00 57.16 56.61 2ely n GLU 10 Cb 0.00 -0.85 -0.06 0.00 -1.01 0.00 0.00 31.44 29.51 2ely n GLU 10 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2ely n LYS 11 N -1.80 1.20 -0.09 3.49 4.01 -1.26 -4.87 118.16 118.84 2ely n LYS 11 Ca 0.00 0.44 -0.12 0.00 -0.51 0.00 0.00 58.31 58.12 2ely n LYS 11 Cb 0.35 -2.11 0.01 0.00 -0.51 0.00 0.00 35.03 32.77 2ely n LYS 11 CO 0.00 0.00 0.00 -1.00 -1.11 0.00 0.00 177.40 175.29 2ely h PRO 12 N 6.04 0.86 -6.81 1.97 0.13 -1.97 -3.44 132.00 128.77 2ely h PRO 12 Ca -0.47 -0.45 -0.50 0.00 -0.87 0.00 0.00 66.00 63.71 2ely h PRO 12 Cb 1.32 0.02 0.01 0.00 0.13 0.00 0.00 31.00 32.48 2ely h PRO 12 CO 0.87 1.09 0.45 -0.06 -0.23 0.00 0.00 178.00 180.13 2ely s PHE 13 N -4.36 3.62 -0.13 1.56 0.40 -1.19 -4.98 117.98 112.91 2ely s PHE 13 Ca -0.10 1.73 -0.10 0.00 -0.60 0.00 0.00 56.93 57.86 2ely s PHE 13 Cb 0.11 -3.22 0.04 0.00 0.51 0.00 0.00 43.02 40.46 2ely s PHE 13 CO 0.87 -0.39 0.33 0.15 0.70 0.00 0.00 175.22 176.88 2ely s LYS 14 N -1.50 0.36 0.08 0.44 1.02 -1.26 -1.79 119.74 117.09 2ely s LYS 14 Ca 0.45 0.52 -0.31 0.00 0.02 0.00 0.00 55.97 56.66 2ely s LYS 14 Cb -0.30 0.11 -0.08 0.00 -0.52 0.00 0.00 37.83 37.03 2ely s LYS 14 CO 0.38 -0.08 1.59 0.00 -0.92 0.00 0.00 175.35 176.32 2ely n VAL 16 N 4.54 0.00 -0.06 0.00 3.14 -1.26 0.90 118.33 125.59 2ely n VAL 16 Ca 0.15 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.45 2ely n VAL 16 Cb 0.41 -0.18 -0.08 0.00 -1.06 0.00 0.00 33.84 32.93 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 -0.63 1.25 0.00 1.45 1.02 -1.26 -4.84 120.64 117.63 2ely n GLU 17 Ca 0.06 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 2ely n GLU 17 Cb 0.03 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 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 2.36 1.87 1.44 0.00 0.00 0.26 -4.97 105.19 106.14 2ely n GLY 19 Ca 0.00 -0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.03 -2.60 -3.96 1.61 5.02 -1.26 -4.58 118.16 111.37 2ely n LYS 20 Ca 0.00 -0.69 -0.23 0.00 -2.02 0.00 0.00 58.31 55.36 2ely n LYS 20 Cb 0.03 -0.76 -0.17 0.00 -0.02 0.00 0.00 35.03 34.11 2ely n LYS 20 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2ely s GLY 21 N -2.91 0.59 0.13 0.72 0.00 -1.26 -3.24 107.32 101.35 2ely s GLY 21 Ca 0.30 -0.25 0.07 0.00 0.00 0.00 0.00 44.72 44.84 2ely s GLY 21 CO 0.24 0.81 -0.15 -1.36 0.00 0.00 0.00 173.10 172.63 2ely s PHE 22 N 1.56 1.53 -1.11 1.90 0.40 -0.74 -4.99 117.98 116.53 2ely s PHE 22 Ca -0.00 -0.53 0.16 0.00 -0.60 0.00 0.00 56.93 55.96 2ely s PHE 22 Cb -0.13 -0.79 0.52 0.00 0.51 0.00 0.00 43.02 43.13 2ely s PHE 22 CO -0.04 0.20 1.44 0.45 0.70 0.00 0.00 175.22 177.97 2ely n SER 23 N 0.48 3.77 -3.65 1.36 2.88 -1.26 -3.17 113.62 114.03 2ely n SER 23 Ca -0.15 -2.25 -0.02 0.00 -1.33 0.00 0.00 58.87 55.12 2ely n SER 23 Cb 0.57 -0.42 -0.05 0.00 -0.75 0.00 0.00 64.21 63.56 2ely n SER 23 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2ely s ARG 24 N -1.46 0.54 0.26 -1.46 3.52 -1.26 -5.02 118.95 114.06 2ely s ARG 24 Ca 0.39 1.38 0.06 0.00 -0.13 0.00 0.00 55.73 57.43 2ely s ARG 24 Cb 0.23 0.78 0.74 0.00 -1.56 0.00 0.00 34.95 35.14 2ely s ARG 24 CO 0.21 -0.21 1.25 2.89 -0.81 0.00 0.00 175.30 178.63 2ely n ARG 25 N 5.44 -0.06 -0.02 5.12 1.85 -1.26 0.14 116.66 127.88 2ely n ARG 25 Ca -0.11 1.16 -0.12 0.00 -1.00 0.00 0.00 57.85 57.78 2ely n ARG 25 Cb 0.49 -1.91 -0.07 0.00 -1.05 0.00 0.00 32.46 29.92 2ely n ARG 25 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 2ely h SER 26 N 0.00 0.13 -0.76 2.89 0.02 -1.97 0.93 113.55 114.78 2ely h SER 26 Ca 0.54 -0.19 0.22 0.00 -0.84 0.00 0.00 61.79 61.52 2ely h SER 26 Cb 1.21 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.69 2ely h SER 26 CO -0.71 0.29 0.58 0.00 -1.14 0.00 0.00 176.83 175.85 2ely h ALA 27 N 0.85 2.67 0.07 3.77 0.00 0.88 0.26 119.26 127.76 2ely h ALA 27 Ca 0.03 -0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 2ely h ALA 27 Cb 0.20 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2ely h ALA 27 CO -0.00 -0.97 -1.83 1.25 0.00 0.00 0.00 179.25 177.69 2ely h LEU 28 N 0.00 0.23 -1.16 0.00 5.85 -0.93 -3.30 115.31 116.00 2ely h LEU 28 Ca 0.36 -0.50 -0.09 0.00 0.84 0.00 0.00 57.88 58.49 2ely h LEU 28 Cb 1.52 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.46 2ely h LEU 28 CO -0.00 1.45 -0.41 0.78 -0.34 0.00 0.00 178.44 179.91 2ely h ASN 29 N 0.04 0.00 -0.28 1.25 2.35 0.13 -2.79 115.58 116.29 2ely h ASN 29 Ca -0.35 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.25 2ely h ASN 29 Cb 2.02 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 40.39 2ely h ASN 29 CO 0.09 0.41 -0.43 1.62 -1.65 0.00 0.00 177.43 177.47 2ely h VAL 30 N 0.00 1.29 0.00 2.81 3.04 -0.73 -2.96 116.25 119.71 2ely h VAL 30 Ca -0.00 -1.62 -0.01 0.00 -1.01 0.00 0.00 66.70 64.05 2ely h VAL 30 Cb 0.75 1.65 -0.00 0.00 -2.01 0.00 0.00 31.29 31.68 2ely h VAL 30 CO 0.05 0.52 -0.06 -0.74 -1.01 0.00 0.00 177.57 176.34 2ely h HIS 31 N 0.53 0.00 -0.79 3.17 -0.00 -1.61 -2.87 115.15 113.59 2ely h HIS 31 Ca 0.02 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.36 2ely h HIS 31 Cb 1.03 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 28.40 2ely h HIS 31 CO 0.08 0.06 0.37 0.45 -0.00 0.00 0.00 177.93 178.89 2ely h HIS 32 N 0.00 1.15 -0.22 5.26 -0.00 -1.32 -1.90 115.15 118.12 2ely h HIS 32 Ca -0.00 -0.06 0.06 0.00 -0.00 0.00 0.00 60.37 60.37 2ely h HIS 32 Cb 0.45 -0.35 -0.01 0.00 -0.00 0.00 0.00 27.41 27.50 2ely h HIS 32 CO 0.00 0.84 0.37 0.87 -0.00 0.00 0.00 177.93 180.01 2ely h LYS 33 N 1.12 0.00 -0.18 2.45 6.56 -1.59 0.13 116.57 125.07 2ely h LYS 33 Ca 0.27 0.00 -0.21 0.00 -1.06 0.00 0.00 60.65 59.65 2ely h LYS 33 Cb 0.13 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 31.79 2ely h LYS 33 CO -0.03 0.00 -0.71 -0.07 -2.06 0.00 0.00 179.45 176.58 2ely h LEU 34 N 0.00 0.88 0.68 2.94 3.38 -1.51 -3.31 115.31 118.38 2ely h LEU 34 Ca 0.11 -0.55 -0.03 0.00 0.09 0.00 0.00 57.88 57.49 2ely h LEU 34 Cb 0.84 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.34 2ely h LEU 34 CO -0.00 1.34 -0.33 0.45 0.09 0.00 0.00 178.44 179.99 2ely h HIS 35 N 0.54 -0.85 -3.84 1.13 3.86 -0.80 -3.42 115.15 111.76 2ely h HIS 35 Ca -0.03 -0.02 -0.49 0.00 -1.16 0.00 0.00 60.37 58.67 2ely h HIS 35 Cb 1.32 0.28 -0.00 0.00 1.06 0.00 0.00 27.41 30.07 2ely h HIS 35 CO 0.08 -0.53 0.40 -0.08 0.86 0.00 0.00 177.93 178.66 2ely s THR 36 N -5.98 3.86 0.97 2.45 -1.32 -1.15 -5.05 115.64 109.42 2ely s THR 36 Ca -0.18 1.72 -0.15 0.00 -1.21 0.00 0.00 61.69 61.87 2ely s THR 36 Cb 0.03 -4.03 0.18 0.00 -1.51 0.00 0.00 72.50 67.17 2ely s THR 36 CO 0.61 0.29 1.19 -0.83 -2.21 0.00 0.00 174.62 173.67 2ely s GLY 37 N -1.26 1.64 -0.12 6.08 0.00 -1.26 -4.85 107.32 107.54 2ely s GLY 37 Ca 0.47 -0.81 -0.26 0.00 0.00 0.00 0.00 44.72 44.12 2ely s GLY 37 CO 0.32 -0.14 0.84 -0.54 0.00 0.00 0.00 173.10 173.58 2ely s GLU 38 N -5.51 4.37 0.05 2.90 2.02 -1.26 -5.05 118.70 116.22 2ely s GLU 38 Ca 0.68 1.08 0.06 0.00 0.02 0.00 0.00 54.97 56.81 2ely s GLU 38 Cb -0.10 -3.53 -0.04 0.00 0.10 0.00 0.00 34.13 30.56 2ely s GLU 38 CO 0.53 -0.21 -0.11 0.15 0.02 0.00 0.00 175.26 175.64 2ely s LYS 39 N 1.70 2.24 0.05 1.61 3.01 -1.26 -5.10 119.74 121.99 2ely s LYS 39 Ca 0.41 -0.92 -0.31 0.00 -1.01 0.00 0.00 55.97 54.14 2ely s LYS 39 Cb -0.18 -2.33 -0.07 0.00 -1.01 0.00 0.00 37.83 34.25 2ely s LYS 39 CO 0.16 0.55 1.41 -1.25 0.51 0.00 0.00 175.35 176.73 2ely s PRO 40 N -1.74 4.29 -1.53 -1.68 0.04 -1.26 -3.13 135.00 130.00 2ely s PRO 40 Ca 0.18 2.03 -0.12 0.00 0.04 0.00 0.00 61.00 63.13 2ely s PRO 40 Cb -0.11 -3.45 0.08 0.00 0.04 0.00 0.00 34.50 31.06 2ely s PRO 40 CO 0.09 -0.53 0.84 0.45 0.04 0.00 0.00 177.00 177.89 2ely n SER 41 N 4.84 -3.46 -4.07 6.66 2.88 -1.26 -4.92 113.62 114.29 2ely n SER 41 Ca 0.13 -0.87 -0.35 0.00 -1.33 0.00 0.00 58.87 56.45 2ely n SER 41 Cb 0.43 -3.55 -0.08 0.00 -0.75 0.00 0.00 64.21 60.27 2ely n SER 41 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ely s GLY 42 N -3.57 2.98 -0.02 0.46 0.00 -1.18 -4.91 107.32 101.08 2ely s GLY 42 Ca 0.52 -3.76 -0.26 0.00 0.00 0.00 0.00 44.72 41.22 2ely s GLY 42 CO 0.86 1.16 1.25 -0.56 0.00 0.00 0.00 173.10 175.81 2ely h PRO 43 N 6.05 -0.03 -1.95 2.90 0.13 -1.91 -3.46 132.00 133.72 2ely h PRO 43 Ca 0.13 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.56 2ely h PRO 43 Cb 0.82 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.88 2ely h PRO 43 CO 0.81 0.44 0.80 -1.54 -0.23 0.00 0.00 178.00 178.28 2ely s SER 44 N -5.64 -0.03 0.14 1.44 1.04 -1.26 -5.10 113.70 104.28 2ely s SER 44 Ca -0.16 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.01 2ely s SER 44 Cb 0.02 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.36 2ely s SER 44 CO 0.66 -0.44 0.00 -1.20 0.98 0.00 0.00 173.24 173.24 2ely n SER 45 N -0.85 0.72 0.00 7.02 7.64 -1.26 -5.24 113.62 121.65 2ely n SER 45 Ca -0.03 0.21 0.01 0.00 1.01 0.00 0.00 58.87 60.08 2ely n SER 45 Cb 0.60 -0.13 0.08 0.00 -1.01 0.00 0.00 64.21 63.76 2ely n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64