#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 -5.04 -4.26 1.61 7.64 -1.26 -4.91 113.62 107.40 2ely n SER 2 Ca 0.00 -0.63 -0.35 0.00 1.01 0.00 0.00 58.87 58.90 2ely n SER 2 Cb 0.00 -4.72 0.07 0.00 -1.01 0.00 0.00 64.21 58.55 2ely n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2ely n SER 3 N -3.00 -3.46 -1.60 6.43 3.41 -1.26 -5.01 113.62 109.13 2ely n SER 3 Ca -0.05 0.37 -0.04 0.00 -0.26 0.00 0.00 58.87 58.89 2ely n SER 3 Cb 0.58 -1.01 -0.00 0.00 -0.26 0.00 0.00 64.21 63.51 2ely n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ely n GLY 4 N 2.34 2.26 3.92 5.00 0.00 -1.26 -5.17 105.19 112.28 2ely n GLY 4 Ca 0.04 -1.28 -0.29 0.00 0.00 0.00 0.00 46.02 44.50 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 -1.68 3.78 -0.12 1.61 0.15 -1.26 -5.11 113.70 111.07 2ely s SER 5 Ca 0.07 0.41 -0.29 0.00 0.70 0.00 0.00 55.95 56.84 2ely s SER 5 Cb -0.01 -0.67 0.08 0.00 -1.71 0.00 0.00 66.02 63.71 2ely s SER 5 CO 0.05 -2.32 0.77 -0.55 1.20 0.00 0.00 173.24 172.39 2ely s SER 6 N -4.75 -0.61 0.00 5.45 0.15 -1.26 -5.03 113.70 107.65 2ely s SER 6 Ca 0.68 0.80 0.00 0.00 0.70 0.00 0.00 55.95 58.14 2ely s SER 6 Cb -0.07 0.68 0.00 0.00 -1.71 0.00 0.00 66.02 64.93 2ely s SER 6 CO 0.50 -0.47 0.00 0.61 1.20 0.00 0.00 173.24 175.09 2ely n GLY 7 N 1.28 0.36 3.90 9.45 0.00 -1.26 -5.08 105.19 113.84 2ely n GLY 7 Ca -0.16 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.89 5.24 -0.93 2.61 2.01 -1.26 -5.05 115.64 115.38 2ely s THR 8 Ca 0.00 -0.08 -0.01 0.00 0.31 0.00 0.00 61.69 61.91 2ely s THR 8 Cb 0.00 -3.62 0.27 0.00 0.01 0.00 0.00 72.50 69.16 2ely s THR 8 CO 0.00 0.10 1.11 0.61 -0.69 0.00 0.00 174.62 175.75 2ely n GLY 9 N 0.25 4.77 3.44 4.40 0.00 -1.26 -5.01 105.19 111.78 2ely n GLY 9 Ca -0.04 -2.68 -0.43 0.00 0.00 0.00 0.00 46.02 42.87 2ely n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2ely s GLU 10 N -2.28 2.99 -0.03 1.61 -1.05 -1.26 -5.03 118.70 113.65 2ely s GLU 10 Ca 0.33 -1.08 -0.32 0.00 -0.15 0.00 0.00 54.97 53.74 2ely s GLU 10 Cb 0.04 -4.03 -0.11 0.00 -0.44 0.00 0.00 34.13 29.59 2ely s GLU 10 CO 0.01 -0.86 1.91 1.63 0.95 0.00 0.00 175.26 178.89 2ely n LYS 11 N 5.27 2.47 -0.05 -4.83 4.01 -1.26 -4.88 118.16 118.89 2ely n LYS 11 Ca -0.11 0.91 -0.10 0.00 -0.51 0.00 0.00 58.31 58.50 2ely n LYS 11 Cb 0.46 -2.80 0.05 0.00 -0.51 0.00 0.00 35.03 32.24 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 9.65 0.70 -6.24 1.97 0.13 -1.95 -3.43 132.00 132.84 2ely h PRO 12 Ca -0.49 -0.37 -0.57 0.00 -0.87 0.00 0.00 66.00 63.70 2ely h PRO 12 Cb 1.26 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.35 2ely h PRO 12 CO 0.94 0.98 0.90 -0.06 -0.23 0.00 0.00 178.00 180.53 2ely s PHE 13 N -4.28 2.94 -0.01 1.56 0.08 -1.26 -4.99 117.98 112.02 2ely s PHE 13 Ca -0.09 1.08 0.01 0.00 0.12 0.00 0.00 56.93 58.05 2ely s PHE 13 Cb 0.12 -3.64 0.00 0.00 -0.57 0.00 0.00 43.02 38.94 2ely s PHE 13 CO 0.85 -1.31 -0.03 0.15 -0.10 0.00 0.00 175.22 174.78 2ely s LYS 14 N 3.70 0.29 0.03 0.44 1.02 -1.26 -0.45 119.74 123.52 2ely s LYS 14 Ca 0.51 -0.07 -0.30 0.00 0.02 0.00 0.00 55.97 56.13 2ely s LYS 14 Cb -0.17 -0.33 -0.07 0.00 -0.52 0.00 0.00 37.83 36.75 2ely s LYS 14 CO 0.16 0.02 1.51 0.00 -0.92 0.00 0.00 175.35 176.12 2ely n VAL 16 N 4.67 0.00 -0.12 0.00 3.14 -1.26 0.11 118.33 124.87 2ely n VAL 16 Ca 0.14 0.00 -0.17 0.00 -2.96 0.00 0.00 64.34 61.36 2ely n VAL 16 Cb 0.42 -0.53 -0.12 0.00 -1.06 0.00 0.00 33.84 32.55 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 -0.95 0.65 0.00 1.45 -0.58 -1.26 -4.80 120.64 115.15 2ely n GLU 17 Ca 0.18 0.13 0.00 0.00 -0.42 0.00 0.00 57.16 57.04 2ely n GLU 17 Cb 0.08 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 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 3.05 1.83 2.39 0.00 0.00 0.31 -4.98 105.19 107.80 2ely n GLY 19 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.01 -3.67 -3.71 1.61 5.02 -1.25 -4.58 118.16 110.56 2ely n LYS 20 Ca 0.00 -1.13 -0.24 0.00 -2.02 0.00 0.00 58.31 54.92 2ely n LYS 20 Cb 0.00 -1.33 -0.17 0.00 -0.02 0.00 0.00 35.03 33.50 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 -3.14 0.46 0.42 0.72 0.00 -1.26 -3.18 107.32 101.34 2ely s GLY 21 Ca 0.50 -0.25 0.02 0.00 0.00 0.00 0.00 44.72 44.99 2ely s GLY 21 CO 0.41 1.37 0.18 0.69 0.00 0.00 0.00 173.10 175.75 2ely n PHE 22 N 5.18 -0.03 0.01 1.90 3.01 0.40 -5.02 117.46 122.91 2ely n PHE 22 Ca -0.07 -1.91 0.01 0.00 1.01 0.00 0.00 57.45 56.49 2ely n PHE 22 Cb 0.49 -0.32 -0.01 0.00 -0.01 0.00 0.00 39.48 39.63 2ely n PHE 22 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2ely n SER 23 N -1.60 3.92 -4.15 4.37 2.88 -1.26 -4.11 113.62 113.67 2ely n SER 23 Ca -0.08 -0.08 -0.14 0.00 -1.33 0.00 0.00 58.87 57.23 2ely n SER 23 Cb 0.50 1.06 -0.11 0.00 -0.75 0.00 0.00 64.21 64.91 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 -1.95 0.78 0.06 -1.46 3.52 -1.26 -4.94 118.95 113.70 2ely s ARG 24 Ca -0.00 -1.09 -0.30 0.00 -0.13 0.00 0.00 55.73 54.21 2ely s ARG 24 Cb 0.01 -0.45 -0.15 0.00 -1.56 0.00 0.00 34.95 32.79 2ely s ARG 24 CO 0.06 0.07 1.46 0.00 -0.81 0.00 0.00 175.30 176.08 2ely h ARG 25 N 3.72 -0.91 -0.40 5.12 3.08 -2.00 -2.81 114.38 120.17 2ely h ARG 25 Ca -0.37 0.06 0.08 0.00 0.07 0.00 0.00 59.98 59.82 2ely h ARG 25 Cb 1.19 0.21 -0.09 0.00 0.08 0.00 0.00 29.97 31.35 2ely h ARG 25 CO 0.51 -0.61 -0.34 1.03 -1.07 0.00 0.00 179.97 179.49 2ely h SER 26 N -0.95 -1.13 -1.13 7.04 0.87 -1.97 0.28 113.55 116.55 2ely h SER 26 Ca -0.08 0.20 0.40 0.00 -1.23 0.00 0.00 61.79 61.07 2ely h SER 26 Cb 0.77 0.53 -0.15 0.00 -0.44 0.00 0.00 62.40 63.11 2ely h SER 26 CO 0.05 -0.33 0.68 0.00 -0.53 0.00 0.00 176.83 176.70 2ely h ALA 27 N 0.71 2.34 0.13 6.23 0.00 -1.96 0.70 119.26 127.41 2ely h ALA 27 Ca 0.17 0.18 -0.31 0.00 0.00 0.00 0.00 54.91 54.95 2ely h ALA 27 Cb 0.55 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2ely h ALA 27 CO -0.55 -1.01 -1.57 1.25 0.00 0.00 0.00 179.25 177.37 2ely h LEU 28 N 0.13 0.42 -1.39 0.00 5.85 -0.51 -3.24 115.31 116.57 2ely h LEU 28 Ca 0.80 -0.59 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2ely h LEU 28 Cb 2.21 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 43.09 2ely h LEU 28 CO -0.58 1.49 0.04 0.78 -0.34 0.00 0.00 178.44 179.83 2ely h ASN 29 N 0.07 0.41 -0.26 1.25 2.35 0.34 -2.43 115.58 117.32 2ely h ASN 29 Ca -0.26 -0.06 -0.14 0.00 -0.55 0.00 0.00 56.30 55.30 2ely h ASN 29 Cb 2.03 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 40.29 2ely h ASN 29 CO 0.16 0.45 -0.37 1.62 -1.65 0.00 0.00 177.43 177.64 2ely h VAL 30 N 0.44 1.31 0.00 2.81 3.04 -0.50 -2.92 116.25 120.42 2ely h VAL 30 Ca 0.10 -1.56 -0.00 0.00 -1.01 0.00 0.00 66.70 64.22 2ely h VAL 30 Cb 0.23 1.68 -0.00 0.00 -2.01 0.00 0.00 31.29 31.19 2ely h VAL 30 CO 0.00 0.50 -0.01 -0.74 -1.01 0.00 0.00 177.57 176.31 2ely h HIS 31 N 0.44 0.00 -0.57 3.17 -0.00 -1.50 -2.54 115.15 114.15 2ely h HIS 31 Ca 0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.29 2ely h HIS 31 Cb 0.96 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.35 2ely h HIS 31 CO 0.08 0.01 -0.08 0.45 -0.00 0.00 0.00 177.93 178.39 2ely h HIS 32 N 0.00 1.18 -0.12 5.26 -0.00 -1.24 -2.54 115.15 117.69 2ely h HIS 32 Ca -0.00 -0.23 0.03 0.00 -0.00 0.00 0.00 60.37 60.17 2ely h HIS 32 Cb 0.28 -0.29 -0.00 0.00 -0.00 0.00 0.00 27.41 27.39 2ely h HIS 32 CO 0.00 1.07 0.27 0.87 -0.00 0.00 0.00 177.93 180.13 2ely h LYS 33 N 0.95 0.00 -0.24 2.45 6.56 -1.52 0.29 116.57 125.06 2ely h LYS 33 Ca 0.15 0.00 -0.20 0.00 -1.06 0.00 0.00 60.65 59.54 2ely h LYS 33 Cb 0.65 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.31 2ely h LYS 33 CO 0.04 0.00 -0.64 -0.07 -2.06 0.00 0.00 179.45 176.72 2ely h LEU 34 N 0.00 0.98 0.59 2.94 3.38 -1.59 -3.33 115.31 118.28 2ely h LEU 34 Ca 0.06 -0.57 -0.03 0.00 0.09 0.00 0.00 57.88 57.43 2ely h LEU 34 Cb 0.59 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.06 2ely h LEU 34 CO -0.00 1.37 -0.29 0.45 0.09 0.00 0.00 178.44 180.07 2ely h HIS 35 N 0.63 -0.74 -3.97 1.13 3.86 -1.03 -3.44 115.15 111.59 2ely h HIS 35 Ca -0.01 -0.02 -0.48 0.00 -1.16 0.00 0.00 60.37 58.70 2ely h HIS 35 Cb 1.26 0.24 0.02 0.00 1.06 0.00 0.00 27.41 30.00 2ely h HIS 35 CO 0.08 -0.41 0.41 -0.08 0.86 0.00 0.00 177.93 178.79 2ely s THR 36 N -4.62 3.71 0.00 2.45 -1.32 -1.07 -4.83 115.64 109.95 2ely s THR 36 Ca -0.14 1.29 0.00 0.00 -1.21 0.00 0.00 61.69 61.63 2ely s THR 36 Cb 0.02 -3.66 0.00 0.00 -1.51 0.00 0.00 72.50 67.35 2ely s THR 36 CO 0.45 -0.01 0.00 0.61 -2.21 0.00 0.00 174.62 173.46 2ely n GLY 37 N 0.30 0.00 3.77 6.08 0.00 -1.26 -4.80 105.19 109.28 2ely n GLY 37 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 -0.92 -3.27 1.61 4.71 -1.26 -4.81 120.64 116.70 2ely n GLU 38 Ca 0.00 0.10 -0.34 0.00 -0.01 0.00 0.00 57.16 56.91 2ely n GLU 38 Cb 0.00 -3.74 -0.04 0.00 -1.01 0.00 0.00 31.44 26.65 2ely n GLU 38 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 2ely n LYS 39 N -3.22 3.31 -2.04 3.49 4.81 -1.26 -5.03 118.16 118.22 2ely n LYS 39 Ca 0.09 -4.62 -0.39 0.00 -0.87 0.00 0.00 58.31 52.52 2ely n LYS 39 Cb 0.36 -2.37 -0.03 0.00 0.02 0.00 0.00 35.03 33.01 2ely n LYS 39 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2ely s PRO 40 N -2.54 2.69 0.47 1.64 0.04 -1.26 -4.98 135.00 131.06 2ely s PRO 40 Ca 0.36 0.67 -0.18 0.00 0.04 0.00 0.00 61.00 61.89 2ely s PRO 40 Cb 0.09 -4.37 -0.09 0.00 0.04 0.00 0.00 34.50 30.18 2ely s PRO 40 CO 0.03 -2.65 0.95 0.45 0.04 0.00 0.00 177.00 175.82 2ely s SER 41 N 7.88 6.74 0.00 6.66 0.15 -1.26 -4.91 113.70 128.96 2ely s SER 41 Ca 0.68 1.57 0.00 0.00 0.70 0.00 0.00 55.95 58.90 2ely s SER 41 Cb -0.13 -2.50 0.00 0.00 -1.71 0.00 0.00 66.02 61.67 2ely s SER 41 CO 0.22 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 174.79 2ely n GLY 42 N -1.17 1.66 3.77 9.45 0.00 -1.26 -5.12 105.19 112.52 2ely n GLY 42 Ca 0.06 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.55 2.23 -0.14 1.61 0.04 -1.26 -5.02 135.00 131.91 2ely s PRO 43 Ca 0.00 1.17 -0.11 0.00 0.04 0.00 0.00 61.00 62.10 2ely s PRO 43 Cb 0.00 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.57 2ely s PRO 43 CO 0.00 -1.66 0.03 0.77 0.04 0.00 0.00 177.00 176.18 2ely h SER 44 N -1.14 0.00 -3.28 6.66 0.02 -2.01 -3.47 113.55 110.33 2ely h SER 44 Ca -0.44 -0.19 -0.49 0.00 -0.84 0.00 0.00 61.79 59.83 2ely h SER 44 Cb 1.23 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.78 2ely h SER 44 CO 0.51 0.84 -0.04 -0.44 -1.14 0.00 0.00 176.83 176.57 2ely s SER 45 N -5.93 6.35 0.00 3.07 0.01 -1.26 -5.36 113.70 110.57 2ely s SER 45 Ca -0.14 0.77 0.00 0.00 1.31 0.00 0.00 55.95 57.89 2ely s SER 45 Cb 0.02 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 64.08 2ely s SER 45 CO 0.27 -0.38 0.41 0.61 0.41 0.00 0.00 173.24 174.56