#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 5.43 1.10 1.61 0.15 -1.26 -5.09 113.70 115.64 2yu8 s SER 2 Ca 0.00 0.00 -0.20 0.00 0.70 0.00 0.00 55.95 56.46 2yu8 s SER 2 Cb 0.00 -1.93 0.07 0.00 -1.71 0.00 0.00 66.02 62.45 2yu8 s SER 2 CO 0.00 0.14 -0.18 -0.24 1.20 0.00 0.00 173.24 174.16 2yu8 n SER 3 N 3.76 -2.46 0.00 5.45 2.88 -1.26 -5.04 113.62 116.96 2yu8 n SER 3 Ca -0.17 -0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.27 2yu8 n SER 3 Cb 0.52 -0.91 0.00 0.00 -0.75 0.00 0.00 64.21 63.08 2yu8 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu8 n GLY 4 N 2.20 0.29 3.51 0.46 0.00 -1.26 -5.15 105.19 105.24 2yu8 n GLY 4 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2yu8 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu8 s SER 5 N -1.00 -0.55 0.05 1.61 0.01 -1.26 -5.08 113.70 107.48 2yu8 s SER 5 Ca 0.00 0.44 -0.26 0.00 1.31 0.00 0.00 55.95 57.44 2yu8 s SER 5 Cb 0.00 0.48 -0.13 0.00 0.21 0.00 0.00 66.02 66.58 2yu8 s SER 5 CO 0.00 -0.62 1.40 -1.28 0.41 0.00 0.00 173.24 173.15 2yu8 h SER 6 N 2.62 -0.93 -6.06 2.44 0.87 -2.08 -3.48 113.55 106.93 2yu8 h SER 6 Ca -0.26 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2yu8 h SER 6 Cb 1.19 0.29 -0.00 0.00 -0.44 0.00 0.00 62.40 63.43 2yu8 h SER 6 CO 0.36 -0.52 -0.98 0.61 -0.53 0.00 0.00 176.83 175.78 2yu8 n GLY 7 N -1.43 -1.07 3.59 5.77 0.00 -1.26 -4.99 105.19 105.80 2yu8 n GLY 7 Ca -0.10 0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 2yu8 n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yu8 s THR 8 N -1.12 3.35 0.00 2.61 -4.23 -1.26 -5.04 115.64 109.96 2yu8 s THR 8 Ca -0.00 -1.48 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2yu8 s THR 8 Cb 0.00 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.20 2yu8 s THR 8 CO 0.19 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.84 2yu8 n GLY 9 N 0.22 2.48 3.00 3.99 0.00 -1.26 -5.05 105.19 108.57 2yu8 n GLY 9 Ca -0.11 -0.59 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 2yu8 n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2yu8 n GLU 10 N 0.00 3.80 -1.35 1.61 2.13 -1.26 -5.05 120.64 120.51 2yu8 n GLU 10 Ca 0.00 -4.55 -0.36 0.00 0.66 0.00 0.00 57.16 52.91 2yu8 n GLU 10 Cb 0.00 -2.47 0.07 0.00 0.27 0.00 0.00 31.44 29.31 2yu8 n GLU 10 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2yu8 n LYS 11 N 1.63 0.46 0.07 5.31 4.76 -1.26 -4.86 118.16 124.27 2yu8 n LYS 11 Ca 0.26 0.20 0.09 0.00 -2.87 0.00 0.00 58.31 55.99 2yu8 n LYS 11 Cb 0.36 -2.01 0.40 0.00 -1.84 0.00 0.00 35.03 31.93 2yu8 n LYS 11 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2yu8 n PRO 12 N -1.17 0.10 -3.58 1.97 -0.04 -1.26 -4.52 135.00 126.49 2yu8 n PRO 12 Ca 0.12 0.34 -0.41 0.00 -0.04 0.00 0.00 63.50 63.51 2yu8 n PRO 12 Cb 0.49 -1.69 -0.11 0.00 -0.04 0.00 0.00 33.50 32.16 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 -3.16 3.23 0.04 0.54 2.02 -1.25 -5.07 117.35 113.70 2yu8 s TYR 13 Ca 0.05 -0.76 0.04 0.00 -0.37 0.00 0.00 57.07 56.04 2yu8 s TYR 13 Cb 0.09 -2.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.18 2yu8 s TYR 13 CO 0.32 -0.58 -0.11 0.21 -1.57 0.00 0.00 175.55 173.83 2yu8 s LYS 14 N 1.60 0.73 -0.20 -0.62 2.47 -1.26 -0.76 119.74 121.69 2yu8 s LYS 14 Ca 0.03 -0.72 -0.18 0.00 -1.56 0.00 0.00 55.97 53.54 2yu8 s LYS 14 Cb -0.19 -0.66 -0.03 0.00 -1.46 0.00 0.00 37.83 35.49 2yu8 s LYS 14 CO 0.07 0.15 0.52 0.00 0.16 0.00 0.00 175.35 176.26 2yu8 n ASN 16 N 4.82 3.00 -0.12 0.00 4.13 -1.26 -2.66 115.26 123.17 2yu8 n ASN 16 Ca -0.05 -2.34 -0.25 0.00 1.68 0.00 0.00 54.58 53.63 2yu8 n ASN 16 Cb 0.50 -0.50 -0.09 0.00 -1.54 0.00 0.00 39.78 38.16 2yu8 n ASN 16 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2yu8 n GLU 17 N 0.39 0.51 -0.01 3.52 -0.58 -1.26 -4.90 120.64 118.32 2yu8 n GLU 17 Ca 0.14 0.22 -0.02 0.00 -0.42 0.00 0.00 57.16 57.08 2yu8 n GLU 17 Cb 0.61 -1.36 -0.01 0.00 -0.57 0.00 0.00 31.44 30.12 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 3.06 0.93 3.86 0.00 0.00 -1.09 -5.09 105.19 106.86 2yu8 n GLY 19 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 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 3.36 0.04 1.61 1.02 -1.25 -4.86 119.74 119.66 2yu8 s LYS 20 Ca 0.00 -0.23 0.03 0.00 0.02 0.00 0.00 55.97 55.79 2yu8 s LYS 20 Cb 0.00 -3.10 -0.04 0.00 -0.52 0.00 0.00 37.83 34.17 2yu8 s LYS 20 CO 0.00 0.74 -0.00 0.08 -0.92 0.00 0.00 175.35 175.25 2yu8 s VAL 21 N -1.09 4.08 0.08 3.17 1.01 -1.26 0.13 120.40 126.53 2yu8 s VAL 21 Ca 0.18 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.41 2yu8 s VAL 21 Cb -0.12 -2.88 -0.03 0.00 0.00 0.00 0.00 36.38 33.35 2yu8 s VAL 21 CO 0.08 0.26 -0.10 -0.36 0.00 0.00 0.00 175.10 174.98 2yu8 s PHE 22 N -1.19 0.98 0.16 5.22 0.40 0.06 -5.00 117.98 118.61 2yu8 s PHE 22 Ca 0.22 -0.64 -0.03 0.00 -0.60 0.00 0.00 56.93 55.89 2yu8 s PHE 22 Cb -0.12 -0.55 0.02 0.00 0.51 0.00 0.00 43.02 42.88 2yu8 s PHE 22 CO 0.14 -0.03 1.40 0.00 0.70 0.00 0.00 175.22 177.43 2yu8 h THR 23 N 3.73 1.37 -1.36 0.64 1.03 -1.97 -3.33 112.91 113.02 2yu8 h THR 23 Ca -0.37 -2.18 -0.62 0.00 -0.01 0.00 0.00 66.41 63.23 2yu8 h THR 23 Cb 1.19 2.15 -0.13 0.00 -1.07 0.00 0.00 68.15 70.29 2yu8 h THR 23 CO 0.51 0.66 -0.55 -1.10 -0.01 0.00 0.00 175.52 175.02 2yu8 s GLN 24 N -3.57 2.02 -0.11 0.00 -0.21 -1.26 -4.83 119.66 111.71 2yu8 s GLN 24 Ca -0.06 -2.23 -0.21 0.00 0.02 0.00 0.00 55.36 52.88 2yu8 s GLN 24 Cb 0.10 -1.36 -0.18 0.00 1.00 0.00 0.00 33.01 32.56 2yu8 s GLN 24 CO 0.85 -0.26 0.65 -0.97 -2.12 0.00 0.00 175.29 173.44 2yu8 h ASN 25 N 1.63 -0.03 -0.82 5.90 -1.24 -1.98 -3.30 115.58 115.74 2yu8 h ASN 25 Ca -0.42 -0.65 0.11 0.00 0.71 0.00 0.00 56.30 56.04 2yu8 h ASN 25 Cb 1.28 0.01 -0.12 0.00 0.73 0.00 0.00 38.32 40.21 2yu8 h ASN 25 CO 0.73 0.76 -0.37 -1.20 -1.29 0.00 0.00 177.43 176.07 2yu8 n SER 26 N -4.71 -0.63 -0.22 1.15 7.64 -1.26 0.14 113.62 115.73 2yu8 n SER 26 Ca -0.07 1.43 0.02 0.00 1.01 0.00 0.00 58.87 61.26 2yu8 n SER 26 Cb 0.33 -0.28 0.14 0.00 -1.01 0.00 0.00 64.21 63.39 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 0.38 -0.57 1.43 3.86 -1.99 0.23 115.15 118.49 2yu8 h HIS 27 Ca 0.24 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.39 2yu8 h HIS 27 Cb 0.44 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 2yu8 h HIS 27 CO -0.75 0.04 -0.00 1.25 0.86 0.00 0.00 177.93 179.33 2yu8 h LEU 28 N 0.38 0.97 -0.20 2.43 5.85 0.11 -1.02 115.31 123.83 2yu8 h LEU 28 Ca 0.35 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 2yu8 h LEU 28 Cb 0.51 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2yu8 h LEU 28 CO -0.38 1.02 0.02 0.00 -0.34 0.00 0.00 178.44 178.77 2yu8 h ALA 29 N 1.07 0.26 0.00 1.25 0.00 0.11 0.20 119.26 122.16 2yu8 h ALA 29 Ca 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2yu8 h ALA 29 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2yu8 h ALA 29 CO 0.03 -0.05 0.00 2.89 0.00 0.00 0.00 179.25 182.12 2yu8 n ARG 30 N -4.73 0.19 -0.10 0.00 1.85 0.66 -3.36 116.66 111.17 2yu8 n ARG 30 Ca -0.04 0.37 -0.21 0.00 -1.00 0.00 0.00 57.85 56.97 2yu8 n ARG 30 Cb 0.20 -1.83 -0.11 0.00 -1.05 0.00 0.00 32.46 29.67 2yu8 n ARG 30 CO 0.00 0.00 0.00 1.58 -0.01 0.00 0.00 177.63 179.20 2yu8 n HIS 31 N -2.19 0.93 -0.32 2.89 -0.00 -0.39 -4.27 115.22 111.87 2yu8 n HIS 31 Ca 0.03 0.40 0.18 0.00 0.46 0.00 0.00 57.72 58.80 2yu8 n HIS 31 Cb 0.26 -1.07 0.37 0.00 -0.12 0.00 0.00 29.99 29.44 2yu8 n HIS 31 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2yu8 h ARG 32 N -1.00 0.18 -1.11 1.57 3.08 -0.61 0.58 114.38 117.08 2yu8 h ARG 32 Ca -0.35 -0.01 0.32 0.00 0.07 0.00 0.00 59.98 60.01 2yu8 h ARG 32 Cb 1.27 -0.04 -0.12 0.00 0.08 0.00 0.00 29.97 31.16 2yu8 h ARG 32 CO -0.21 0.12 0.70 0.07 -1.07 0.00 0.00 179.97 179.58 2yu8 h ARG 33 N 0.19 0.30 -1.37 0.04 -0.00 -1.74 0.29 114.38 112.09 2yu8 h ARG 33 Ca 0.64 -0.02 0.41 0.00 -0.00 0.00 0.00 59.98 61.01 2yu8 h ARG 33 Cb 1.41 -0.07 -0.09 0.00 -0.00 0.00 0.00 29.97 31.22 2yu8 h ARG 33 CO -0.69 0.20 0.93 -0.39 -0.00 0.00 0.00 179.97 180.02 2yu8 h VAL 34 N 0.31 0.24 -1.78 0.08 -1.51 -0.04 -2.55 116.25 111.01 2yu8 h VAL 34 Ca 0.69 -0.04 -0.77 0.00 -1.23 0.00 0.00 66.70 65.35 2yu8 h VAL 34 Cb 1.82 0.13 -0.18 0.00 -2.13 0.00 0.00 31.29 30.92 2yu8 h VAL 34 CO -0.40 0.02 1.70 1.41 -1.23 0.00 0.00 177.57 179.07 2yu8 n HIS 35 N -4.40 2.89 -3.68 5.19 8.25 0.10 -4.89 115.22 118.68 2yu8 n HIS 35 Ca 0.34 -2.78 -0.27 0.00 -0.26 0.00 0.00 57.72 54.75 2yu8 n HIS 35 Cb 1.40 -1.80 -0.17 0.00 1.12 0.00 0.00 29.99 30.55 2yu8 n HIS 35 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2yu8 s THR 36 N -0.31 0.24 0.03 1.59 -4.23 -0.96 -5.09 115.64 106.91 2yu8 s THR 36 Ca 0.38 -0.36 0.00 0.00 -1.18 0.00 0.00 61.69 60.53 2yu8 s THR 36 Cb 0.08 -0.81 0.00 0.00 1.34 0.00 0.00 72.50 73.11 2yu8 s THR 36 CO 0.03 -0.23 0.00 0.61 -0.54 0.00 0.00 174.62 174.49 2yu8 n GLY 37 N 5.16 -0.53 2.65 3.99 0.00 -1.26 -4.96 105.19 110.23 2yu8 n GLY 37 Ca -0.08 -0.49 -0.04 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.42 -2.43 3.12 -0.02 0.00 -1.26 -5.07 105.19 99.10 2yu8 n GLY 38 Ca 0.00 0.82 -0.10 0.00 0.00 0.00 0.00 46.02 46.74 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 -2.03 0.68 0.00 1.61 -0.14 -1.26 -5.02 119.74 113.58 2yu8 s LYS 39 Ca 0.13 -1.13 0.11 0.00 -1.36 0.00 0.00 55.97 53.72 2yu8 s LYS 39 Cb -0.04 -0.11 0.67 0.00 -1.68 0.00 0.00 37.83 36.67 2yu8 s LYS 39 CO 0.69 -0.03 1.10 -0.35 -0.76 0.00 0.00 175.35 176.01 2yu8 n PRO 40 N 0.43 0.49 -2.83 -1.68 -0.04 -1.26 -4.60 135.00 125.51 2yu8 n PRO 40 Ca -0.16 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.88 2yu8 n PRO 40 Cb 0.59 -1.36 -0.04 0.00 -0.04 0.00 0.00 33.50 32.65 2yu8 n PRO 40 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2yu8 s SER 41 N -1.86 6.25 0.00 3.54 0.15 -1.26 -4.89 113.70 115.63 2yu8 s SER 41 Ca 0.17 -0.64 0.00 0.00 0.70 0.00 0.00 55.95 56.18 2yu8 s SER 41 Cb 0.08 -2.44 0.00 0.00 -1.71 0.00 0.00 66.02 61.95 2yu8 s SER 41 CO 0.13 -1.36 0.00 0.61 1.20 0.00 0.00 173.24 173.82 2yu8 n GLY 42 N 5.23 3.90 3.56 9.45 0.00 -1.26 -5.01 105.19 121.06 2yu8 n GLY 42 Ca -0.01 -1.66 -0.27 0.00 0.00 0.00 0.00 46.02 44.08 2yu8 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yu8 s PRO 43 N -2.79 2.56 0.00 1.61 0.04 -1.26 -4.47 135.00 130.68 2yu8 s PRO 43 Ca 0.00 -0.26 0.00 0.00 0.04 0.00 0.00 61.00 60.78 2yu8 s PRO 43 Cb 0.00 -5.04 0.00 0.00 0.04 0.00 0.00 34.50 29.50 2yu8 s PRO 43 CO 0.00 -3.36 0.00 0.43 0.04 0.00 0.00 177.00 174.11 2yu8 n SER 44 N 13.95 1.52 -0.09 6.66 7.64 -1.26 -4.95 113.62 137.09 2yu8 n SER 44 Ca 0.40 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 60.12 2yu8 n SER 44 Cb 0.47 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.62 2yu8 n SER 44 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2yu8 n SER 45 N -2.27 1.78 0.00 6.43 2.88 -1.26 -5.26 113.62 115.92 2yu8 n SER 45 Ca 0.00 0.30 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2yu8 n SER 45 Cb 0.27 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 2yu8 n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42