#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu8 s SER 2 N 0.00 2.30 0.08 1.61 0.01 -1.26 -5.02 113.70 111.42 2yu8 s SER 2 Ca 0.00 -0.62 -0.18 0.00 1.31 0.00 0.00 55.95 56.46 2yu8 s SER 2 Cb 0.00 -0.16 -0.09 0.00 0.21 0.00 0.00 66.02 65.98 2yu8 s SER 2 CO 0.00 -0.35 1.48 -1.28 0.41 0.00 0.00 173.24 173.50 2yu8 h SER 3 N 8.40 0.46 -1.12 2.44 0.87 -2.09 -3.48 113.55 119.02 2yu8 h SER 3 Ca -0.16 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2yu8 h SER 3 Cb 1.14 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.97 2yu8 h SER 3 CO 0.30 0.71 0.00 0.61 -0.53 0.00 0.00 176.83 177.92 2yu8 n GLY 4 N -0.19 0.52 0.47 5.77 0.00 -1.26 -5.02 105.19 105.48 2yu8 n GLY 4 Ca -0.04 -0.56 -0.17 0.00 0.00 0.00 0.00 46.02 45.26 2yu8 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2yu8 h SER 5 N 0.00 -1.39 -4.11 1.61 0.02 -2.05 -3.44 113.55 104.19 2yu8 h SER 5 Ca 0.00 0.12 -0.40 0.00 -0.84 0.00 0.00 61.79 60.67 2yu8 h SER 5 Cb 0.37 0.48 -0.18 0.00 0.14 0.00 0.00 62.40 63.21 2yu8 h SER 5 CO 0.00 -0.60 -0.76 -0.94 -1.14 0.00 0.00 176.83 173.39 2yu8 s SER 6 N -4.34 1.92 0.00 3.07 1.04 -1.26 -5.00 113.70 109.12 2yu8 s SER 6 Ca -0.16 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.47 2yu8 s SER 6 Cb 0.05 -0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.11 2yu8 s SER 6 CO 0.57 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.25 2yu8 n GLY 7 N 0.58 0.12 3.54 7.32 0.00 -1.26 -5.17 105.19 110.31 2yu8 n GLY 7 Ca -0.16 -0.12 -0.12 0.00 0.00 0.00 0.00 46.02 45.63 2yu8 n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2yu8 s THR 8 N 0.00 0.00 0.00 2.61 -1.32 -1.26 -5.16 115.64 110.51 2yu8 s THR 8 Ca 0.00 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 2yu8 s THR 8 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 2yu8 s THR 8 CO 0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 2yu8 n GLY 9 N 0.46 3.01 3.35 6.08 0.00 -1.26 -5.19 105.19 111.64 2yu8 n GLY 9 Ca -0.12 -0.16 -0.20 0.00 0.00 0.00 0.00 46.02 45.53 2yu8 n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yu8 s GLU 10 N -1.23 1.71 0.60 1.61 8.01 -1.26 -5.14 118.70 123.00 2yu8 s GLU 10 Ca 0.00 -2.00 -0.18 0.00 0.01 0.00 0.00 54.97 52.80 2yu8 s GLU 10 Cb 0.00 -0.04 -0.03 0.00 -4.31 0.00 0.00 34.13 29.75 2yu8 s GLU 10 CO 0.00 -0.53 1.18 0.15 0.01 0.00 0.00 175.26 176.07 2yu8 s LYS 11 N -3.67 2.96 0.08 1.61 -0.14 -1.26 -4.91 119.74 114.41 2yu8 s LYS 11 Ca 0.35 1.73 0.17 0.00 -1.36 0.00 0.00 55.97 56.86 2yu8 s LYS 11 Cb 0.03 -1.94 0.73 0.00 -1.68 0.00 0.00 37.83 34.97 2yu8 s LYS 11 CO 0.20 -1.19 1.54 -0.35 -0.76 0.00 0.00 175.35 174.79 2yu8 n PRO 12 N -1.72 0.06 -3.11 -1.68 -0.04 -1.26 -4.51 135.00 122.75 2yu8 n PRO 12 Ca 0.13 0.31 -0.44 0.00 -0.04 0.00 0.00 63.50 63.46 2yu8 n PRO 12 Cb 0.50 -1.62 -0.06 0.00 -0.04 0.00 0.00 33.50 32.29 2yu8 n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2yu8 s TYR 13 N -3.10 3.00 0.05 0.54 1.51 -1.26 -5.03 117.35 113.06 2yu8 s TYR 13 Ca 0.06 -0.62 0.04 0.00 -1.01 0.00 0.00 57.07 55.54 2yu8 s TYR 13 Cb 0.09 -3.74 -0.02 0.00 -0.11 0.00 0.00 41.96 38.18 2yu8 s TYR 13 CO 0.30 -1.16 -0.11 0.21 -1.11 0.00 0.00 175.55 173.68 2yu8 s LYS 14 N 2.81 0.70 -0.21 -0.62 2.47 -1.26 -0.41 119.74 123.20 2yu8 s LYS 14 Ca 0.15 -0.77 -0.17 0.00 -1.56 0.00 0.00 55.97 53.63 2yu8 s LYS 14 Cb -0.20 -0.61 -0.04 0.00 -1.46 0.00 0.00 37.83 35.53 2yu8 s LYS 14 CO 0.11 0.14 0.44 0.00 0.16 0.00 0.00 175.35 176.20 2yu8 n ASN 16 N 4.75 2.68 -0.10 0.00 3.02 -1.26 -2.60 115.26 121.74 2yu8 n ASN 16 Ca -0.07 -2.29 -0.21 0.00 -0.03 0.00 0.00 54.58 51.98 2yu8 n ASN 16 Cb 0.51 -0.47 -0.07 0.00 -0.61 0.00 0.00 39.78 39.13 2yu8 n ASN 16 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2yu8 n GLU 17 N 0.33 0.44 -0.03 3.52 -0.58 -1.26 -4.90 120.64 118.15 2yu8 n GLU 17 Ca 0.12 0.19 -0.06 0.00 -0.42 0.00 0.00 57.16 56.99 2yu8 n GLU 17 Cb 0.55 -1.24 -0.02 0.00 -0.57 0.00 0.00 31.44 30.16 2yu8 n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2yu8 n GLY 19 N 2.73 0.76 3.30 0.00 0.00 -1.07 -5.08 105.19 105.83 2yu8 n GLY 19 Ca -0.12 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.47 2yu8 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yu8 s LYS 20 N 0.00 2.49 0.11 1.61 1.02 -1.26 -4.89 119.74 118.83 2yu8 s LYS 20 Ca 0.00 -0.89 0.02 0.00 0.02 0.00 0.00 55.97 55.12 2yu8 s LYS 20 Cb 0.00 -2.17 -0.04 0.00 -0.52 0.00 0.00 37.83 35.10 2yu8 s LYS 20 CO 0.00 0.43 0.21 0.08 -0.92 0.00 0.00 175.35 175.15 2yu8 s VAL 21 N -0.28 5.12 0.12 3.17 1.01 -1.26 -0.62 120.40 127.67 2yu8 s VAL 21 Ca -0.00 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 2yu8 s VAL 21 Cb -0.13 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2yu8 s VAL 21 CO 0.03 0.01 0.04 -0.36 0.00 0.00 0.00 175.10 174.82 2yu8 s PHE 22 N -1.62 0.81 -0.04 5.22 0.40 0.45 -4.98 117.98 118.21 2yu8 s PHE 22 Ca 0.33 -1.21 -0.14 0.00 -0.60 0.00 0.00 56.93 55.32 2yu8 s PHE 22 Cb -0.12 -0.47 -0.31 0.00 0.51 0.00 0.00 43.02 42.63 2yu8 s PHE 22 CO 0.27 -0.50 0.74 0.00 0.70 0.00 0.00 175.22 176.43 2yu8 h THR 23 N 2.91 1.07 -2.10 0.64 1.03 -1.98 -3.36 112.91 111.13 2yu8 h THR 23 Ca -0.35 -2.54 -0.59 0.00 -0.01 0.00 0.00 66.41 62.92 2yu8 h THR 23 Cb 1.19 2.85 -0.14 0.00 -1.07 0.00 0.00 68.15 70.99 2yu8 h THR 23 CO 0.60 0.81 -0.68 -1.10 -0.01 0.00 0.00 175.52 175.14 2yu8 s GLN 24 N -2.55 1.76 0.02 0.00 -1.52 -1.26 -4.88 119.66 111.23 2yu8 s GLN 24 Ca -0.15 -1.90 -0.26 0.00 -1.95 0.00 0.00 55.36 51.09 2yu8 s GLN 24 Cb 0.05 -1.58 -0.17 0.00 -0.22 0.00 0.00 33.01 31.09 2yu8 s GLN 24 CO 0.86 0.12 1.31 -2.95 -0.25 0.00 0.00 175.29 174.38 2yu8 h ASN 25 N 2.08 -0.45 -0.40 5.90 7.08 -1.99 -3.18 115.58 124.61 2yu8 h ASN 25 Ca -0.42 -0.11 0.04 0.00 -3.08 0.00 0.00 56.30 52.73 2yu8 h ASN 25 Cb 1.25 0.12 -0.05 0.00 -2.08 0.00 0.00 38.32 37.56 2yu8 h ASN 25 CO 0.70 -0.13 -0.24 -1.20 -2.08 0.00 0.00 177.43 174.48 2yu8 n SER 26 N -5.22 -0.42 -0.25 6.14 7.64 -1.26 0.85 113.62 121.10 2yu8 n SER 26 Ca -0.10 1.03 0.02 0.00 1.01 0.00 0.00 58.87 60.82 2yu8 n SER 26 Cb 0.28 -0.25 0.09 0.00 -1.01 0.00 0.00 64.21 63.32 2yu8 n SER 26 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 2yu8 h HIS 27 N 0.00 -0.36 0.03 1.43 3.86 -2.00 0.18 115.15 118.30 2yu8 h HIS 27 Ca 0.06 0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 2yu8 h HIS 27 Cb 0.16 0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 2yu8 h HIS 27 CO -0.71 -0.31 -0.05 1.25 0.86 0.00 0.00 177.93 178.98 2yu8 h LEU 28 N 0.01 -0.13 -0.08 2.43 5.85 0.48 -0.49 115.31 123.38 2yu8 h LEU 28 Ca 0.36 0.02 0.03 0.00 0.84 0.00 0.00 57.88 59.13 2yu8 h LEU 28 Cb 0.56 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 2yu8 h LEU 28 CO -0.75 -0.07 -0.16 0.00 -0.34 0.00 0.00 178.44 177.12 2yu8 h ALA 29 N 0.86 -0.13 -1.00 1.25 0.00 0.13 -0.96 119.26 119.42 2yu8 h ALA 29 Ca 0.01 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2yu8 h ALA 29 Cb 0.11 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 18.13 2yu8 h ALA 29 CO -0.03 -0.63 0.65 0.00 0.00 0.00 0.00 179.25 179.24 2yu8 h ARG 30 N -0.22 1.14 -0.49 0.00 3.08 -0.58 -2.15 114.38 115.17 2yu8 h ARG 30 Ca 0.08 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2yu8 h ARG 30 Cb 0.33 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 2yu8 h ARG 30 CO -0.21 0.76 0.27 1.25 -1.07 0.00 0.00 179.97 180.96 2yu8 h HIS 31 N 1.18 0.68 -1.16 3.04 2.76 -0.33 -2.27 115.15 119.04 2yu8 h HIS 31 Ca 0.43 -0.02 0.34 0.00 -2.20 0.00 0.00 60.37 58.92 2yu8 h HIS 31 Cb 0.15 -0.22 -0.05 0.00 1.55 0.00 0.00 27.41 28.85 2yu8 h HIS 31 CO -0.00 0.51 1.11 0.00 -1.30 0.00 0.00 177.93 178.24 2yu8 h ARG 32 N 0.65 0.00 -0.59 5.26 3.08 -0.50 0.35 114.38 122.63 2yu8 h ARG 32 Ca 0.17 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.32 2yu8 h ARG 32 Cb 0.06 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.03 2yu8 h ARG 32 CO -0.03 0.00 0.18 0.00 -1.07 0.00 0.00 179.97 179.05 2yu8 h ARG 33 N 0.00 0.33 -0.37 0.04 2.47 -1.48 0.50 114.38 115.86 2yu8 h ARG 33 Ca 0.55 -0.02 0.11 0.00 -1.26 0.00 0.00 59.98 59.36 2yu8 h ARG 33 Cb 2.76 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 30.99 2yu8 h ARG 33 CO -0.01 0.22 0.86 -0.39 0.56 0.00 0.00 179.97 181.21 2yu8 h VAL 34 N 0.34 0.05 -2.95 2.04 -1.51 -0.50 -2.57 116.25 111.15 2yu8 h VAL 34 Ca 0.30 0.00 -0.81 0.00 -1.23 0.00 0.00 66.70 64.97 2yu8 h VAL 34 Cb 0.41 0.23 -0.28 0.00 -2.13 0.00 0.00 31.29 29.52 2yu8 h VAL 34 CO -0.34 0.00 0.78 1.41 -1.23 0.00 0.00 177.57 178.19 2yu8 n HIS 35 N -2.98 2.66 0.00 5.19 8.25 0.17 -4.34 115.22 124.17 2yu8 n HIS 35 Ca 0.08 -2.76 0.00 0.00 -0.26 0.00 0.00 57.72 54.78 2yu8 n HIS 35 Cb 0.99 -1.34 0.00 0.00 1.12 0.00 0.00 29.99 30.76 2yu8 n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2yu8 n THR 36 N 1.56 0.00 -2.63 1.59 -2.24 -0.97 -4.98 114.28 106.62 2yu8 n THR 36 Ca 0.26 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 62.02 2yu8 n THR 36 Cb 0.34 -0.55 0.11 0.00 -2.10 0.00 0.00 70.33 68.13 2yu8 n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yu8 n GLY 37 N 2.08 1.92 0.31 3.38 0.00 -1.26 -5.00 105.19 106.61 2yu8 n GLY 37 Ca 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 46.02 45.81 2yu8 n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yu8 n GLY 38 N -1.38 -1.63 3.71 -0.02 0.00 -1.26 -4.11 105.19 100.50 2yu8 n GLY 38 Ca -0.17 0.90 -0.41 0.00 0.00 0.00 0.00 46.02 46.33 2yu8 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yu8 s LYS 39 N -5.79 4.48 -1.01 1.61 1.02 -1.26 -4.97 119.74 113.82 2yu8 s LYS 39 Ca -0.11 1.17 -0.24 0.00 0.02 0.00 0.00 55.97 56.81 2yu8 s LYS 39 Cb 0.17 -3.47 -0.06 0.00 -0.52 0.00 0.00 37.83 33.95 2yu8 s LYS 39 CO 0.58 -0.05 1.94 -1.25 -0.92 0.00 0.00 175.35 175.65 2yu8 s PRO 40 N 1.11 2.54 -0.07 -1.68 0.04 -1.26 -4.94 135.00 130.74 2yu8 s PRO 40 Ca 0.45 -0.64 0.01 0.00 0.04 0.00 0.00 61.00 60.86 2yu8 s PRO 40 Cb -0.19 -5.14 -0.03 0.00 0.04 0.00 0.00 34.50 29.19 2yu8 s PRO 40 CO 0.22 -3.61 -0.08 0.45 0.04 0.00 0.00 177.00 174.02 2yu8 s SER 41 N 7.42 4.54 0.00 6.66 0.15 -1.26 -5.01 113.70 126.20 2yu8 s SER 41 Ca 0.69 -0.05 0.00 0.00 0.70 0.00 0.00 55.95 57.29 2yu8 s SER 41 Cb -0.04 -1.12 0.00 0.00 -1.71 0.00 0.00 66.02 63.15 2yu8 s SER 41 CO 0.05 0.36 0.00 0.61 1.20 0.00 0.00 173.24 175.46 2yu8 n GLY 42 N 2.24 -1.87 0.18 9.45 0.00 -1.26 -4.78 105.19 109.16 2yu8 n GLY 42 Ca -0.18 -1.32 0.04 0.00 0.00 0.00 0.00 46.02 44.56 2yu8 n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu8 h PRO 43 N 0.00 0.00 -6.99 1.61 0.13 -2.05 -3.46 132.00 121.24 2yu8 h PRO 43 Ca 0.00 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.54 2yu8 h PRO 43 Cb 0.00 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 30.84 2yu8 h PRO 43 CO 0.00 0.40 -0.88 0.43 -0.23 0.00 0.00 178.00 177.72 2yu8 n SER 44 N -3.81 -2.16 -4.07 1.44 7.64 -1.26 -4.92 113.62 106.48 2yu8 n SER 44 Ca -0.01 -1.15 -0.21 0.00 1.01 0.00 0.00 58.87 58.51 2yu8 n SER 44 Cb 0.47 -2.12 -0.15 0.00 -1.01 0.00 0.00 64.21 61.40 2yu8 n SER 44 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yu8 s SER 45 N -3.39 1.48 0.00 6.43 0.01 -1.26 -5.27 113.70 111.70 2yu8 s SER 45 Ca 0.71 -0.23 0.13 0.00 1.31 0.00 0.00 55.95 57.86 2yu8 s SER 45 Cb -0.40 -0.23 0.10 0.00 0.21 0.00 0.00 66.02 65.69 2yu8 s SER 45 CO 0.98 0.14 0.90 0.61 0.41 0.00 0.00 173.24 176.28