#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yth s SER 2 N 0.00 3.45 -0.21 1.61 0.01 -1.26 -5.11 113.70 112.20 2yth s SER 2 Ca 0.00 -1.17 -0.17 0.00 1.31 0.00 0.00 55.95 55.92 2yth s SER 2 Cb 0.00 -0.77 0.06 0.00 0.21 0.00 0.00 66.02 65.52 2yth s SER 2 CO 0.00 -0.34 0.54 -0.94 0.41 0.00 0.00 173.24 172.91 2yth s SER 3 N 1.71 -0.61 -0.33 2.44 1.04 -1.26 -5.08 113.70 111.62 2yth s SER 3 Ca 0.02 1.12 0.17 0.00 0.48 0.00 0.00 55.95 57.74 2yth s SER 3 Cb -0.17 1.09 0.44 0.00 0.10 0.00 0.00 66.02 67.48 2yth s SER 3 CO -0.15 -0.20 0.93 0.61 0.98 0.00 0.00 173.24 175.42 2yth n GLY 4 N 3.27 1.82 3.52 7.32 0.00 -1.26 -5.10 105.19 114.76 2yth n GLY 4 Ca -0.16 -1.31 -0.09 0.00 0.00 0.00 0.00 46.02 44.45 2yth n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yth s SER 5 N -2.95 -0.42 -0.33 1.61 1.04 -1.26 -5.07 113.70 106.32 2yth s SER 5 Ca 0.29 -0.09 0.08 0.00 0.48 0.00 0.00 55.95 56.71 2yth s SER 5 Cb 0.44 0.51 0.45 0.00 0.10 0.00 0.00 66.02 67.52 2yth s SER 5 CO 0.02 -0.85 1.16 -0.24 0.98 0.00 0.00 173.24 174.31 2yth n SER 6 N -0.34 4.59 0.00 7.02 2.88 -1.26 -5.02 113.62 121.50 2yth n SER 6 Ca -0.11 -3.62 0.00 0.00 -1.33 0.00 0.00 58.87 53.81 2yth n SER 6 Cb 0.63 -0.39 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 2yth n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yth n GLY 7 N -0.62 5.56 3.31 0.46 0.00 -1.26 -5.19 105.19 107.45 2yth n GLY 7 Ca 0.40 -0.84 -0.13 0.00 0.00 0.00 0.00 46.02 45.45 2yth n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yth s SER 8 N 1.06 0.50 -0.45 1.61 0.01 -1.26 -5.12 113.70 110.06 2yth s SER 8 Ca 0.00 -1.40 0.07 0.00 1.31 0.00 0.00 55.95 55.93 2yth s SER 8 Cb 0.00 0.48 0.25 0.00 0.21 0.00 0.00 66.02 66.96 2yth s SER 8 CO 0.00 -0.99 0.74 0.61 0.41 0.00 0.00 173.24 174.01 2yth n GLY 9 N -0.39 1.28 3.62 3.44 0.00 -1.26 -5.11 105.19 106.77 2yth n GLY 9 Ca 0.02 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 2yth n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yth s GLU 10 N -0.15 3.90 -0.10 1.61 0.41 -1.26 -5.02 118.70 118.08 2yth s GLU 10 Ca 0.33 0.77 0.03 0.00 -0.41 0.00 0.00 54.97 55.68 2yth s GLU 10 Cb 0.21 -3.80 -0.01 0.00 -1.78 0.00 0.00 34.13 28.75 2yth s GLU 10 CO -0.18 -1.03 -0.18 0.21 -0.49 0.00 0.00 175.26 173.58 2yth s LYS 11 N 3.76 3.05 0.28 1.61 2.47 -1.26 -5.02 119.74 124.64 2yth s LYS 11 Ca 0.43 -0.78 0.06 0.00 -1.56 0.00 0.00 55.97 54.12 2yth s LYS 11 Cb -0.11 -2.43 0.39 0.00 -1.46 0.00 0.00 37.83 34.23 2yth s LYS 11 CO 0.20 0.28 1.66 -1.00 0.16 0.00 0.00 175.35 176.65 2yth h PRO 12 N 6.45 0.24 -4.10 4.03 0.13 -1.95 -3.38 132.00 133.43 2yth h PRO 12 Ca -0.27 -0.13 -0.77 0.00 -0.87 0.00 0.00 66.00 63.97 2yth h PRO 12 Cb 1.21 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.10 2yth h PRO 12 CO 0.51 0.66 0.25 -0.06 -0.23 0.00 0.00 178.00 179.13 2yth s PHE 13 N -4.04 3.61 0.11 1.56 0.08 -1.25 -5.02 117.98 113.02 2yth s PHE 13 Ca -0.04 -1.84 0.10 0.00 0.12 0.00 0.00 56.93 55.26 2yth s PHE 13 Cb 0.13 -3.92 -0.04 0.00 -0.57 0.00 0.00 43.02 38.62 2yth s PHE 13 CO 0.78 -1.10 -0.23 -0.65 -0.10 0.00 0.00 175.22 173.92 2yth s GLN 14 N 0.75 1.63 1.35 0.44 -0.21 -1.26 -1.67 119.66 120.69 2yth s GLN 14 Ca 0.21 -1.24 -0.19 0.00 0.02 0.00 0.00 55.36 54.16 2yth s GLN 14 Cb -0.09 -2.00 0.35 0.00 1.00 0.00 0.00 33.01 32.26 2yth s GLN 14 CO -0.09 0.47 0.95 0.00 -2.12 0.00 0.00 175.29 174.51 2yth n GLU 16 N -5.48 0.82 -0.06 0.00 -0.58 -1.26 -3.22 120.64 110.86 2yth n GLU 16 Ca 0.08 -0.05 -0.04 0.00 -0.42 0.00 0.00 57.16 56.74 2yth n GLU 16 Cb 0.58 -1.16 -0.15 0.00 -0.57 0.00 0.00 31.44 30.13 2yth n GLU 16 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2yth n GLU 17 N -1.85 0.67 0.00 3.49 4.07 -1.26 -4.54 120.64 121.22 2yth n GLU 17 Ca -0.03 -0.02 0.00 0.00 -0.06 0.00 0.00 57.16 57.05 2yth n GLU 17 Cb 0.30 -1.56 0.00 0.00 -0.06 0.00 0.00 31.44 30.11 2yth n GLU 17 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2yth n GLY 19 N -0.09 -0.79 2.32 0.00 0.00 -1.20 -4.84 105.19 100.59 2yth n GLY 19 Ca 0.00 0.34 -0.17 0.00 0.00 0.00 0.00 46.02 46.19 2yth n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yth n LYS 20 N -3.69 -0.55 -4.46 1.61 4.76 -1.26 -4.58 118.16 109.99 2yth n LYS 20 Ca -0.14 -1.33 -0.32 0.00 -2.87 0.00 0.00 58.31 53.65 2yth n LYS 20 Cb 0.49 -0.72 -0.16 0.00 -1.84 0.00 0.00 35.03 32.79 2yth n LYS 20 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2yth s ARG 21 N -4.57 2.94 -0.01 1.97 0.52 -1.26 -3.19 118.95 115.35 2yth s ARG 21 Ca 0.44 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.83 2yth s ARG 21 Cb -0.01 -2.44 0.01 0.00 0.52 0.00 0.00 34.95 33.03 2yth s ARG 21 CO 0.30 -0.09 0.00 -0.06 0.02 0.00 0.00 175.30 175.48 2yth s PHE 22 N 1.00 0.04 0.04 -0.53 0.08 -0.67 -5.03 117.98 112.92 2yth s PHE 22 Ca -0.03 0.03 -0.16 0.00 0.12 0.00 0.00 56.93 56.89 2yth s PHE 22 Cb -0.15 -0.09 -0.25 0.00 -0.57 0.00 0.00 43.02 41.96 2yth s PHE 22 CO -0.06 -0.03 1.13 1.15 -0.10 0.00 0.00 175.22 177.32 2yth h THR 23 N 5.47 1.33 -3.06 0.64 2.02 -2.00 -3.33 112.91 113.98 2yth h THR 23 Ca -0.30 -2.26 -0.64 0.00 0.77 0.00 0.00 66.41 63.98 2yth h THR 23 Cb 1.18 2.55 -0.07 0.00 -1.74 0.00 0.00 68.15 70.07 2yth h THR 23 CO 0.50 0.68 -0.56 -1.58 0.37 0.00 0.00 175.52 174.93 2yth s GLN 24 N -3.17 3.12 0.14 6.66 2.00 -1.26 -4.88 119.66 122.26 2yth s GLN 24 Ca -0.11 -0.56 -0.15 0.00 -2.00 0.00 0.00 55.36 52.55 2yth s GLN 24 Cb 0.05 -2.87 0.01 0.00 0.80 0.00 0.00 33.01 31.01 2yth s GLN 24 CO 0.89 0.60 1.69 -2.95 -0.50 0.00 0.00 175.29 175.03 2yth h ASN 25 N 3.40 0.61 -0.59 6.67 7.08 -1.95 -2.93 115.58 127.87 2yth h ASN 25 Ca -0.47 -0.17 0.10 0.00 -3.08 0.00 0.00 56.30 52.68 2yth h ASN 25 Cb 1.17 -0.16 -0.07 0.00 -2.08 0.00 0.00 38.32 37.17 2yth h ASN 25 CO 0.69 0.61 0.19 -1.28 -2.08 0.00 0.00 177.43 175.56 2yth h SER 26 N 0.57 0.15 -1.00 6.14 0.87 -1.98 -0.30 113.55 118.00 2yth h SER 26 Ca 0.15 0.09 0.21 0.00 -1.23 0.00 0.00 61.79 61.00 2yth h SER 26 Cb 0.19 0.08 -0.11 0.00 -0.44 0.00 0.00 62.40 62.13 2yth h SER 26 CO -0.01 0.10 0.61 0.45 -0.53 0.00 0.00 176.83 177.44 2yth h HIS 27 N 0.35 1.02 0.18 2.24 3.86 -1.94 0.21 115.15 121.08 2yth h HIS 27 Ca 0.30 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.53 2yth h HIS 27 Cb 0.39 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.56 2yth h HIS 27 CO -0.19 0.19 -0.09 1.25 0.86 0.00 0.00 177.93 179.95 2yth h LEU 28 N 0.70 -0.20 -0.87 2.43 5.85 -1.12 -0.95 115.31 121.14 2yth h LEU 28 Ca 0.59 0.01 0.23 0.00 0.84 0.00 0.00 57.88 59.55 2yth h LEU 28 Cb 1.01 0.05 -0.14 0.00 0.37 0.00 0.00 40.66 41.94 2yth h LEU 28 CO -0.39 0.19 0.19 0.45 -0.34 0.00 0.00 178.44 178.54 2yth h HIS 29 N -0.92 0.26 -0.06 1.25 3.86 -0.86 0.45 115.15 119.13 2yth h HIS 29 Ca -0.02 0.05 -0.18 0.00 -1.16 0.00 0.00 60.37 59.05 2yth h HIS 29 Cb 0.18 0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 2yth h HIS 29 CO 0.01 -0.24 -0.75 0.66 0.86 0.00 0.00 177.93 178.47 2yth h SER 30 N 0.17 0.44 0.08 2.45 4.64 -0.71 -3.07 113.55 117.55 2yth h SER 30 Ca 0.54 -0.29 -0.01 0.00 -0.47 0.00 0.00 61.79 61.55 2yth h SER 30 Cb 1.08 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2yth h SER 30 CO -0.68 1.04 -0.06 -0.74 -0.87 0.00 0.00 176.83 175.51 2yth h HIS 31 N 0.24 0.00 -0.81 4.77 -0.00 0.13 -2.02 115.15 117.46 2yth h HIS 31 Ca -0.03 0.00 0.22 0.00 -0.00 0.00 0.00 60.37 60.56 2yth h HIS 31 Cb 1.32 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 28.70 2yth h HIS 31 CO 0.04 0.06 0.57 1.96 -0.00 0.00 0.00 177.93 180.57 2yth h GLN 32 N 0.00 0.07 -0.88 5.26 4.20 -1.03 0.80 115.11 123.53 2yth h GLN 32 Ca -0.00 -0.00 0.17 0.00 0.06 0.00 0.00 58.65 58.88 2yth h GLN 32 Cb 0.12 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 27.81 2yth h GLN 32 CO 0.01 0.05 0.57 0.00 -0.67 0.00 0.00 178.83 178.79 2yth h ARG 33 N 0.07 0.53 -0.81 1.46 3.08 -1.55 0.94 114.38 118.09 2yth h ARG 33 Ca 0.39 -0.03 0.24 0.00 0.07 0.00 0.00 59.98 60.65 2yth h ARG 33 Cb 1.45 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.34 2yth h ARG 33 CO -0.04 0.35 0.61 -0.39 -1.07 0.00 0.00 179.97 179.43 2yth h VAL 34 N 0.54 0.54 -0.29 2.04 -1.51 -1.04 0.75 116.25 117.28 2yth h VAL 34 Ca 0.45 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.89 2yth h VAL 34 Cb 0.92 0.57 -0.02 0.00 -2.13 0.00 0.00 31.29 30.63 2yth h VAL 34 CO -0.19 0.00 0.04 1.41 -1.23 0.00 0.00 177.57 177.60 2yth n HIS 35 N -4.20 1.03 -0.22 5.19 8.25 0.32 -4.62 115.22 120.97 2yth n HIS 35 Ca 0.17 -0.45 -0.06 0.00 -0.26 0.00 0.00 57.72 57.12 2yth n HIS 35 Cb 0.90 -0.33 -0.05 0.00 1.12 0.00 0.00 29.99 31.63 2yth n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2yth n THR 36 N 0.21 -0.35 0.00 1.59 -2.24 0.26 -4.78 114.28 108.96 2yth n THR 36 Ca 0.15 1.54 0.00 0.00 -2.27 0.00 0.00 64.05 63.47 2yth n THR 36 Cb 0.74 -1.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 2yth n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yth n GLY 37 N -1.13 0.08 3.78 3.38 0.00 -1.26 -5.13 105.19 104.91 2yth n GLY 37 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 2yth n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yth s GLU 38 N 0.00 3.25 -0.03 1.61 -6.30 -1.26 -4.97 118.70 111.00 2yth s GLU 38 Ca 0.00 1.52 -0.30 0.00 -2.50 0.00 0.00 54.97 53.69 2yth s GLU 38 Cb 0.00 -2.00 -0.04 0.00 0.00 0.00 0.00 34.13 32.09 2yth s GLU 38 CO 0.00 -0.92 1.30 0.21 0.02 0.00 0.00 175.26 175.87 2yth s LYS 39 N -3.52 4.32 0.09 4.30 2.47 -1.26 -4.90 119.74 121.24 2yth s LYS 39 Ca 0.70 1.81 0.18 0.00 -1.56 0.00 0.00 55.97 57.10 2yth s LYS 39 Cb -0.22 -3.56 0.74 0.00 -1.46 0.00 0.00 37.83 33.33 2yth s LYS 39 CO 0.31 -0.51 1.55 -0.35 0.16 0.00 0.00 175.35 176.51 2yth n PRO 40 N 5.28 0.07 -3.43 4.03 -0.04 -1.26 -4.50 135.00 135.15 2yth n PRO 40 Ca 0.12 0.32 -0.11 0.00 -0.04 0.00 0.00 63.50 63.79 2yth n PRO 40 Cb 0.45 -1.64 -0.09 0.00 -0.04 0.00 0.00 33.50 32.18 2yth n PRO 40 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2yth s SER 41 N -3.45 0.42 0.31 3.54 0.15 -1.26 -5.15 113.70 108.25 2yth s SER 41 Ca 0.06 0.24 -0.20 0.00 0.70 0.00 0.00 55.95 56.75 2yth s SER 41 Cb 0.09 0.97 0.03 0.00 -1.71 0.00 0.00 66.02 65.40 2yth s SER 41 CO 0.31 -0.29 0.75 -0.83 1.20 0.00 0.00 173.24 174.38 2yth s GLY 42 N 2.50 0.05 0.00 9.45 0.00 -1.26 -5.01 107.32 113.05 2yth s GLY 42 Ca 0.09 -0.43 0.11 0.00 0.00 0.00 0.00 44.72 44.49 2yth s GLY 42 CO -0.14 -0.12 1.11 -1.55 0.00 0.00 0.00 173.10 172.39 2yth n PRO 43 N -0.49 0.49 -1.09 2.90 -0.04 -1.26 -4.84 135.00 130.68 2yth n PRO 43 Ca -0.05 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.11 2yth n PRO 43 Cb 0.59 -1.36 -0.11 0.00 -0.04 0.00 0.00 33.50 32.58 2yth n PRO 43 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2yth n SER 44 N -0.86 0.15 0.00 3.54 3.41 -1.26 -4.76 113.62 113.85 2yth n SER 44 Ca 0.08 0.11 -0.12 0.00 -0.26 0.00 0.00 58.87 58.68 2yth n SER 44 Cb 0.04 -0.66 -0.08 0.00 -0.26 0.00 0.00 64.21 63.26 2yth n SER 44 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2yth h SER 45 N 8.69 0.05 0.00 4.04 0.02 -2.07 -3.54 113.55 120.74 2yth h SER 45 Ca -0.03 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2yth h SER 45 Cb 0.95 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.47 2yth h SER 45 CO 1.02 0.24 0.00 0.61 -1.14 0.00 0.00 176.83 177.56