#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p8x h ALA 36 N 0.00 1.00 -0.01 6.98 0.00 -1.87 0.18 119.26 125.54 2p8x h ALA 36 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2p8x h ALA 36 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2p8x h ALA 36 CO 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 179.25 178.87 2p8x h ALA 37 N 2.09 1.34 0.00 0.00 0.00 -2.00 -3.27 119.26 117.43 2p8x h ALA 37 Ca 0.00 -0.36 -0.32 0.00 0.00 0.00 0.00 54.91 54.24 2p8x h ALA 37 Cb 0.58 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2p8x h ALA 37 CO 0.00 0.49 -1.90 0.39 0.00 0.00 0.00 179.25 178.23 2p8x n GLU 38 N -4.08 0.65 -3.88 0.00 -0.58 -0.55 -4.87 120.64 107.34 2p8x n GLU 38 Ca -0.02 0.22 -0.27 0.00 -0.42 0.00 0.00 57.16 56.67 2p8x n GLU 38 Cb 0.42 -1.72 -0.17 0.00 -0.57 0.00 0.00 31.44 29.41 2p8x n GLU 38 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 2p8x s ASN 39 N -5.97 2.45 0.33 1.62 3.84 0.52 -4.99 114.94 112.73 2p8x s ASN 39 Ca -0.07 -0.47 0.18 0.00 0.21 0.00 0.00 52.86 52.72 2p8x s ASN 39 Cb 0.07 -0.82 0.99 0.00 -0.55 0.00 0.00 41.25 40.95 2p8x s ASN 39 CO 0.82 -0.17 1.52 -0.81 -2.79 0.00 0.00 177.10 175.67 2p8x n PRO 40 N 4.94 0.12 -0.55 0.43 -0.04 -1.25 -2.02 135.00 136.62 2p8x n PRO 40 Ca -0.11 0.61 0.06 0.00 -0.04 0.00 0.00 63.50 64.02 2p8x n PRO 40 Cb 0.49 -2.02 0.29 0.00 -0.04 0.00 0.00 33.50 32.21 2p8x n PRO 40 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2p8x n ASN 41 N -2.18 4.07 -4.35 3.54 3.02 -1.26 -4.74 115.26 113.36 2p8x n ASN 41 Ca -0.01 -2.48 -0.35 0.00 -0.03 0.00 0.00 54.58 51.71 2p8x n ASN 41 Cb 0.15 -0.56 -0.14 0.00 -0.61 0.00 0.00 39.78 38.63 2p8x n ASN 41 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2p8x s VAL 42 N -1.99 3.58 0.05 2.41 1.01 -0.86 -5.08 120.40 119.53 2p8x s VAL 42 Ca 0.40 -0.43 -0.31 0.00 0.00 0.00 0.00 61.98 61.65 2p8x s VAL 42 Cb 0.28 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 2p8x s VAL 42 CO 0.16 0.42 1.17 -1.61 0.00 0.00 0.00 175.10 175.24 2p8x s GLU 43 N 1.37 4.45 0.17 2.72 2.02 -1.26 -4.80 118.70 123.37 2p8x s GLU 43 Ca 0.04 1.72 -0.25 0.00 0.02 0.00 0.00 54.97 56.51 2p8x s GLU 43 Cb -0.14 -3.36 -0.08 0.00 0.10 0.00 0.00 34.13 30.64 2p8x s GLU 43 CO -0.01 -0.23 0.78 0.14 0.02 0.00 0.00 175.26 175.96 2p8x s VAL 44 N 1.05 4.36 -0.12 2.63 -7.23 -1.26 -4.88 120.40 114.95 2p8x s VAL 44 Ca 0.58 1.70 0.02 0.00 -1.81 0.00 0.00 61.98 62.48 2p8x s VAL 44 Cb -0.28 -4.13 0.01 0.00 0.56 0.00 0.00 36.38 32.53 2p8x s VAL 44 CO 0.29 0.51 -0.20 -0.54 -0.31 0.00 0.00 175.10 174.85 2p8x s LYS 45 N -1.18 2.75 0.56 4.82 -0.14 -1.26 -5.13 119.74 120.16 2p8x s LYS 45 Ca 0.36 -0.76 -0.02 0.00 -1.36 0.00 0.00 55.97 54.20 2p8x s LYS 45 Cb -0.23 -2.23 0.03 0.00 -1.68 0.00 0.00 37.83 33.71 2p8x s LYS 45 CO 0.26 -0.01 0.82 0.34 -0.76 0.00 0.00 175.35 176.00 2p8x s ASP 46 N 0.81 5.37 0.26 2.83 -1.08 -1.26 -4.95 116.67 118.65 2p8x s ASP 46 Ca -0.08 0.27 -0.02 0.00 -0.52 0.00 0.00 52.55 52.19 2p8x s ASP 46 Cb -0.16 -1.21 0.56 0.00 -1.46 0.00 0.00 42.92 40.65 2p8x s ASP 46 CO -0.01 -1.12 1.66 0.22 0.52 0.00 0.00 175.17 176.45 2p8x h TYR 47 N -0.03 0.25 -0.00 -5.34 3.20 -2.00 -0.10 116.97 112.95 2p8x h TYR 47 Ca -0.44 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.48 2p8x h TYR 47 Cb 1.28 0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.57 2p8x h TYR 47 CO 0.40 -0.16 -0.05 0.41 -1.64 0.00 0.00 178.16 177.12 2p8x n GLY 48 N -1.38 -1.26 0.03 1.82 0.00 -1.26 -2.22 105.19 100.92 2p8x n GLY 48 Ca 0.17 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2p8x n GLY 48 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2p8x n ASP 49 N -1.27 0.49 -0.11 1.61 8.00 -0.06 -3.80 116.55 121.41 2p8x n ASP 49 Ca 0.12 0.05 -0.22 0.00 0.71 0.00 0.00 54.79 55.45 2p8x n ASP 49 Cb 0.27 0.02 -0.07 0.00 -0.02 0.00 0.00 41.12 41.32 2p8x n ASP 49 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2p8x n ILE 50 N -1.74 1.22 -2.48 0.53 5.41 -0.94 -4.59 119.36 116.77 2p8x n ILE 50 Ca 0.05 -0.26 -0.43 0.00 1.00 0.00 0.00 62.75 63.11 2p8x n ILE 50 Cb 0.38 -1.83 0.00 0.00 -0.71 0.00 0.00 39.64 37.48 2p8x n ILE 50 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2p8x n ASP 51 N -4.01 4.96 -0.05 4.38 8.00 -1.04 -4.68 116.55 124.11 2p8x n ASP 51 Ca -0.41 -3.01 0.07 0.00 0.71 0.00 0.00 54.79 52.15 2p8x n ASP 51 Cb 0.77 -1.56 -0.07 0.00 -0.02 0.00 0.00 41.12 40.24 2p8x n ASP 51 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 2p8x n LYS 52 N 5.21 2.16 -2.30 -1.24 2.85 -1.25 -4.68 118.16 118.91 2p8x n LYS 52 Ca 0.41 -0.10 -0.33 0.00 -1.05 0.00 0.00 58.31 57.24 2p8x n LYS 52 Cb 0.40 -1.19 -0.01 0.00 -0.65 0.00 0.00 35.03 33.57 2p8x n LYS 52 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2p8x s ALA 53 N -2.29 2.80 0.38 0.58 0.00 -1.26 -4.89 121.76 117.07 2p8x s ALA 53 Ca 0.06 0.52 0.08 0.00 0.00 0.00 0.00 51.96 52.63 2p8x s ALA 53 Cb 0.11 -3.25 0.74 0.00 0.00 0.00 0.00 23.12 20.72 2p8x s ALA 53 CO 0.57 -0.56 1.90 -1.35 0.00 0.00 0.00 175.76 176.31 2p8x h PRO 54 N 1.03 0.29 -0.40 0.00 0.11 -1.99 -1.77 132.00 129.26 2p8x h PRO 54 Ca -0.48 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 65.47 2p8x h PRO 54 Cb 1.22 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2p8x h PRO 54 CO 0.58 0.41 -0.09 0.93 -0.21 0.00 0.00 178.00 179.62 2p8x h GLU 55 N 0.28 0.78 -0.78 1.05 3.07 -1.98 -1.89 114.58 115.10 2p8x h GLU 55 Ca 0.06 -0.30 -0.03 0.00 -0.50 0.00 0.00 59.36 58.59 2p8x h GLU 55 Cb 0.37 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.20 2p8x h GLU 55 CO 0.02 0.91 0.36 0.93 -1.40 0.00 0.00 179.01 179.82 2p8x h GLU 56 N 0.59 1.14 -0.66 2.33 5.08 -1.67 -0.69 114.58 120.69 2p8x h GLU 56 Ca 0.10 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2p8x h GLU 56 Cb 0.62 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2p8x h GLU 56 CO 0.04 0.90 0.21 0.00 -1.00 0.00 0.00 179.01 179.16 2p8x h ARG 57 N 1.11 1.01 -0.16 2.33 2.47 -1.29 0.68 114.38 120.54 2p8x h ARG 57 Ca 0.27 -0.20 -0.16 0.00 -1.26 0.00 0.00 59.98 58.63 2p8x h ARG 57 Cb 0.15 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.30 2p8x h ARG 57 CO -0.03 0.86 -0.56 0.00 0.56 0.00 0.00 179.97 180.80 2p8x h ALA 58 N 1.25 0.74 0.00 0.04 0.00 -0.88 -3.24 119.26 117.17 2p8x h ALA 58 Ca 0.22 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2p8x h ALA 58 Cb 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2p8x h ALA 58 CO -0.01 0.69 -1.37 0.54 0.00 0.00 0.00 179.25 179.10 2p8x n ARG 59 N -3.94 0.60 -2.08 0.00 1.74 -0.31 -4.98 116.66 107.68 2p8x n ARG 59 Ca -0.03 -0.01 -0.08 0.00 -0.77 0.00 0.00 57.85 56.97 2p8x n ARG 59 Cb 0.60 -1.69 -0.01 0.00 -1.02 0.00 0.00 32.46 30.34 2p8x n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2p8x n GLY 60 N 1.23 0.12 3.28 -0.13 0.00 0.23 -5.03 105.19 104.89 2p8x n GLY 60 Ca -0.01 -0.58 -0.16 0.00 0.00 0.00 0.00 46.02 45.27 2p8x n GLY 60 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2p8x s ILE 61 N -2.37 0.23 0.14 -0.61 -4.36 -1.10 -5.03 121.20 108.09 2p8x s ILE 61 Ca 0.00 -2.00 -0.27 0.00 -0.26 0.00 0.00 60.65 58.12 2p8x s ILE 61 Cb 0.00 -2.53 -0.07 0.00 1.25 0.00 0.00 42.46 41.11 2p8x s ILE 61 CO 0.00 0.00 0.83 -0.89 0.24 0.00 0.00 174.94 175.12 2p8x s THR 62 N -3.79 4.44 0.00 8.37 2.01 -1.26 -4.48 115.64 120.92 2p8x s THR 62 Ca 0.38 1.80 0.00 0.00 0.31 0.00 0.00 61.69 64.18 2p8x s THR 62 Cb 0.06 -4.19 0.00 0.00 0.01 0.00 0.00 72.50 68.38 2p8x s THR 62 CO 0.16 0.45 0.00 -0.38 -0.69 0.00 0.00 174.62 174.16 2p8x n ILE 63 N 2.08 0.00 -3.86 1.82 5.41 -1.26 -5.05 119.36 118.50 2p8x n ILE 63 Ca -0.03 0.00 -0.32 0.00 1.00 0.00 0.00 62.75 63.40 2p8x n ILE 63 Cb 0.49 -0.52 -0.04 0.00 -0.71 0.00 0.00 39.64 38.85 2p8x n ILE 63 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 2p8x s ASN 64 N -3.98 6.40 0.27 4.38 0.01 -1.26 -5.06 114.94 115.69 2p8x s ASN 64 Ca 0.00 0.37 -0.29 0.00 -0.71 0.00 0.00 52.86 52.22 2p8x s ASN 64 Cb 0.00 -2.00 -0.09 0.00 0.41 0.00 0.00 41.25 39.56 2p8x s ASN 64 CO 0.00 0.18 1.19 0.42 -1.51 0.00 0.00 177.10 177.38 2p8x s THR 65 N -1.48 3.26 0.06 1.60 -4.23 -1.26 -5.03 115.64 108.55 2p8x s THR 65 Ca 0.34 1.20 0.07 0.00 -1.18 0.00 0.00 61.69 62.12 2p8x s THR 65 Cb -0.13 -3.77 -0.03 0.00 1.34 0.00 0.00 72.50 69.91 2p8x s THR 65 CO 0.24 0.26 -0.15 0.00 -0.54 0.00 0.00 174.62 174.43 2p8x s ALA 66 N -0.83 2.72 -0.17 3.99 0.00 -1.26 -5.12 121.76 121.10 2p8x s ALA 66 Ca 0.48 -1.20 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 2p8x s ALA 66 Cb -0.35 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 21.95 2p8x s ALA 66 CO 0.43 0.59 -0.06 -1.01 0.00 0.00 0.00 175.76 175.72 2p8x s HIS 67 N -1.01 2.96 0.32 0.00 3.76 -1.26 -5.12 115.29 114.94 2p8x s HIS 67 Ca 0.16 -0.50 0.04 0.00 -0.15 0.00 0.00 55.06 54.62 2p8x s HIS 67 Cb -0.11 -1.97 -0.06 0.00 1.11 0.00 0.00 32.58 31.55 2p8x s HIS 67 CO 0.08 -0.18 0.05 0.14 -0.85 0.00 0.00 174.74 173.97 2p8x s VAL 68 N 0.61 1.22 0.00 -0.90 -7.23 -1.26 -5.18 120.40 107.67 2p8x s VAL 68 Ca -0.04 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.12 2p8x s VAL 68 Cb -0.15 -2.74 0.00 0.00 0.56 0.00 0.00 36.38 34.05 2p8x s VAL 68 CO 0.03 -0.04 0.23 1.21 -0.31 0.00 0.00 175.10 176.21