#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1twc n THR 26 N 0.00 0.00 0.00 0.00 -1.04 -1.26 -5.12 114.28 106.86 1twc n THR 26 Ca 0.00 0.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 1twc n THR 26 Cb 0.00 -0.50 0.00 0.00 -1.82 0.00 0.00 70.33 68.01 1twc n THR 26 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1twc n LEU 27 N -3.70 0.52 0.00 -4.42 -0.00 -1.26 -5.13 117.00 103.00 1twc n LEU 27 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1twc n LEU 27 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.95 1twc n LEU 27 CO 0.01 -0.06 0.00 1.17 -0.00 0.00 0.00 177.39 178.51 1twc n LYS 28 N -2.15 0.00 -4.10 1.47 4.81 -1.26 -4.60 118.16 112.33 1twc n LYS 28 Ca 0.00 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.20 1twc n LYS 28 Cb 0.15 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.13 1twc n LYS 28 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1twc s TYR 29 N 0.00 2.63 0.05 5.64 1.51 -1.25 -4.29 117.35 121.65 1twc s TYR 29 Ca 0.00 -0.52 -0.06 0.00 -1.01 0.00 0.00 57.07 55.48 1twc s TYR 29 Cb 0.00 -1.86 -0.01 0.00 -0.11 0.00 0.00 41.96 39.98 1twc s TYR 29 CO 0.00 0.22 0.11 0.42 -1.11 0.00 0.00 175.55 175.19 1twc s ILE 30 N -2.54 0.15 -0.21 2.71 1.01 -0.97 -3.24 121.20 118.11 1twc s ILE 30 Ca 0.40 -1.20 -0.17 0.00 0.00 0.00 0.00 60.65 59.69 1twc s ILE 30 Cb 0.01 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 1twc s ILE 30 CO 0.23 -0.66 0.44 0.00 0.00 0.00 0.00 174.94 174.95 1twc h ALA 32 N 7.49 -0.67 -1.99 0.00 0.00 -1.36 -3.10 119.26 119.63 1twc h ALA 32 Ca -0.35 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1twc h ALA 32 Cb 1.16 0.64 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1twc h ALA 32 CO 0.72 -0.94 0.00 0.39 0.00 0.00 0.00 179.25 179.42 1twc n GLU 33 N -5.45 0.00 -0.35 0.00 -0.58 -1.26 -4.63 120.64 108.37 1twc n GLU 33 Ca -0.07 0.17 0.08 0.00 -0.42 0.00 0.00 57.16 56.92 1twc n GLU 33 Cb 0.36 -1.09 0.26 0.00 -0.57 0.00 0.00 31.44 30.40 1twc n GLU 33 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1twc n SER 35 N 1.05 -2.68 -3.62 0.00 2.88 -1.17 -4.95 113.62 105.13 1twc n SER 35 Ca 0.19 -0.07 -0.12 0.00 -1.33 0.00 0.00 58.87 57.54 1twc n SER 35 Cb 0.55 -1.59 -0.12 0.00 -0.75 0.00 0.00 64.21 62.30 1twc n SER 35 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1twc s SER 36 N -2.94 0.26 -0.54 -3.46 1.04 -1.26 -4.85 113.70 101.95 1twc s SER 36 Ca 0.08 0.61 -0.32 0.00 0.48 0.00 0.00 55.95 56.80 1twc s SER 36 Cb -0.03 0.89 -0.13 0.00 0.10 0.00 0.00 66.02 66.85 1twc s SER 36 CO 0.10 -0.25 2.37 0.29 0.98 0.00 0.00 173.24 176.73 1twc n LYS 37 N 5.36 0.79 -0.23 4.02 4.76 -1.26 -3.75 118.16 127.85 1twc n LYS 37 Ca -0.06 0.14 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 1twc n LYS 37 Cb 0.50 -2.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.20 1twc n LYS 37 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1twc n LEU 38 N 11.62 0.00 0.00 -0.35 7.94 -1.20 -4.97 117.00 130.05 1twc n LEU 38 Ca 0.46 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.36 1twc n LEU 38 Cb 0.26 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.21 1twc n LEU 38 CO 0.79 -0.21 0.00 -0.24 -1.11 0.00 0.00 177.39 176.62 1twc n SER 39 N -1.27 0.00 0.00 1.96 2.88 -1.26 -3.85 113.62 112.08 1twc n SER 39 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1twc n SER 39 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1twc n SER 39 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1twc n LEU 40 N 0.00 0.00 0.00 2.46 4.77 -1.26 -5.01 117.00 117.96 1twc n LEU 40 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1twc n LEU 40 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1twc n LEU 40 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.52 1twc n SER 41 N 0.00 0.00 -4.52 -1.43 3.41 -1.26 -5.06 113.62 104.76 1twc n SER 41 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.27 1twc n SER 41 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 1twc n SER 41 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1twc s ARG 42 N 0.83 3.32 -0.43 4.33 3.00 -1.26 -4.11 118.95 124.63 1twc s ARG 42 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 55.73 55.19 1twc s ARG 42 Cb 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 34.95 32.17 1twc s ARG 42 CO 0.00 0.39 0.00 2.41 0.00 0.00 0.00 175.30 178.10 1twc n THR 43 N 3.05 0.00 0.02 0.02 -1.04 -1.26 -4.90 114.28 110.18 1twc n THR 43 Ca -0.18 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 61.91 1twc n THR 43 Cb 0.53 -1.15 -0.10 0.00 -1.82 0.00 0.00 70.33 67.78 1twc n THR 43 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1twc n ASP 44 N -0.93 0.38 0.00 8.00 8.00 -1.26 -5.10 116.55 125.64 1twc n ASP 44 Ca -0.04 0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.61 1twc n ASP 44 Cb 0.52 1.17 0.00 0.00 -0.02 0.00 0.00 41.12 42.78 1twc n ASP 44 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1twc n ALA 45 N -2.30 0.00 -2.42 2.24 0.00 -1.26 -4.89 120.51 111.88 1twc n ALA 45 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.34 1twc n ALA 45 Cb 0.66 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.16 1twc n ALA 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1twc n VAL 46 N 0.00 0.03 0.00 0.00 0.31 -1.26 -4.73 118.33 112.67 1twc n VAL 46 Ca 0.00 -0.67 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 1twc n VAL 46 Cb 0.00 0.82 0.00 0.00 -0.91 0.00 0.00 33.84 33.75 1twc n VAL 46 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1twc n ARG 47 N -0.93 0.00 -0.58 5.55 0.63 -1.26 -4.50 116.66 115.57 1twc n ARG 47 Ca -0.21 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.72 1twc n ARG 47 Cb 0.82 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.73 1twc n ARG 47 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1twc n LYS 49 N 0.00 0.60 0.00 0.00 5.02 -1.26 -4.95 118.16 117.57 1twc n LYS 49 Ca 0.00 -2.15 0.00 0.00 -2.02 0.00 0.00 58.31 54.14 1twc n LYS 49 Cb 0.00 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 1twc n LYS 49 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1twc n ASP 50 N 2.35 0.00 -4.31 4.39 2.03 -1.26 -5.07 116.55 114.68 1twc n ASP 50 Ca 0.16 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.29 1twc n ASP 50 Cb 0.57 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.87 1twc n ASP 50 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1twc n GLY 52 N -0.05 5.60 3.69 0.00 0.00 -1.26 -4.47 105.19 108.71 1twc n GLY 52 Ca -0.11 -2.03 -0.38 0.00 0.00 0.00 0.00 46.02 43.51 1twc n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1twc s HIS 53 N -3.65 3.43 -0.49 1.61 3.76 -1.26 -4.64 115.29 114.05 1twc s HIS 53 Ca 0.60 0.69 0.00 0.00 -0.15 0.00 0.00 55.06 56.20 1twc s HIS 53 Cb 0.48 -2.50 0.00 0.00 1.11 0.00 0.00 32.58 31.67 1twc s HIS 53 CO 0.02 0.08 0.68 -2.13 -0.85 0.00 0.00 174.74 172.54 1twc n ARG 54 N 4.10 0.90 -4.01 1.40 0.63 -1.26 -4.49 116.66 113.92 1twc n ARG 54 Ca -0.09 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.54 1twc n ARG 54 Cb 0.51 -1.25 -0.16 0.00 0.45 0.00 0.00 32.46 32.01 1twc n ARG 54 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1twc s ILE 55 N -0.44 1.58 -0.02 5.15 1.01 -1.26 -4.85 121.20 122.37 1twc s ILE 55 Ca 0.00 -0.71 0.06 0.00 0.00 0.00 0.00 60.65 60.00 1twc s ILE 55 Cb 0.00 -1.52 -0.01 0.00 0.01 0.00 0.00 42.46 40.93 1twc s ILE 55 CO 0.00 0.40 -0.19 -0.76 0.00 0.00 0.00 174.94 174.39 1twc s LEU 56 N 1.47 2.03 -0.38 2.97 1.43 -1.26 -0.90 118.68 124.04 1twc s LEU 56 Ca 0.04 -0.35 -0.14 0.00 -1.03 0.00 0.00 54.13 52.65 1twc s LEU 56 Cb -0.13 -0.99 0.01 0.00 0.03 0.00 0.00 46.19 45.11 1twc s LEU 56 CO -0.10 0.23 0.27 -0.76 0.23 0.00 0.00 176.35 176.21 1twc s LEU 57 N -0.42 4.86 0.36 1.79 1.43 0.10 -4.88 118.68 121.92 1twc s LEU 57 Ca 0.07 -0.78 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 1twc s LEU 57 Cb -0.08 -2.13 0.02 0.00 0.03 0.00 0.00 46.19 44.04 1twc s LEU 57 CO -0.01 -0.38 0.79 0.50 0.23 0.00 0.00 176.35 177.49 1twc h LYS 58 N 8.55 0.00 -1.32 1.70 3.64 -1.86 -2.57 116.57 124.71 1twc h LYS 58 Ca -0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1twc h LYS 58 Cb 1.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1twc h LYS 58 CO 0.69 0.00 -0.31 0.00 -2.27 0.00 0.00 179.45 177.56 1twc n ALA 59 N -1.28 -2.35 -2.02 5.00 0.00 -1.26 -4.64 120.51 113.97 1twc n ALA 59 Ca -0.00 0.16 -0.39 0.00 0.00 0.00 0.00 53.44 53.20 1twc n ALA 59 Cb 0.76 -0.81 -0.06 0.00 0.00 0.00 0.00 19.45 19.34 1twc n ALA 59 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1twc s ARG 60 N -4.00 4.57 0.98 0.00 3.52 -1.26 -4.97 118.95 117.78 1twc s ARG 60 Ca 0.00 1.16 -0.11 0.00 -0.13 0.00 0.00 55.73 56.65 1twc s ARG 60 Cb 0.00 -3.27 0.18 0.00 -1.56 0.00 0.00 34.95 30.30 1twc s ARG 60 CO 0.00 0.54 1.11 0.95 -0.81 0.00 0.00 175.30 177.10 1twc s THR 61 N -1.05 2.09 -0.12 4.11 -4.23 -1.26 -4.91 115.64 110.27 1twc s THR 61 Ca 0.36 0.03 0.17 0.00 -1.18 0.00 0.00 61.69 61.07 1twc s THR 61 Cb -0.23 -2.07 -0.12 0.00 1.34 0.00 0.00 72.50 71.42 1twc s THR 61 CO 0.26 -0.04 0.88 0.11 -0.54 0.00 0.00 174.62 175.29 1twc h LYS 62 N -2.05 0.00 -6.31 3.99 1.57 -2.03 -3.47 116.57 108.26 1twc h LYS 62 Ca -0.48 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 57.65 1twc h LYS 62 Cb 1.28 0.00 0.09 0.00 0.08 0.00 0.00 32.23 33.68 1twc h LYS 62 CO 0.44 0.30 0.14 2.89 -0.57 0.00 0.00 179.45 182.65 1twc n ARG 63 N -2.92 1.01 -4.00 3.15 1.85 -1.26 -4.86 116.66 109.64 1twc n ARG 63 Ca -0.08 0.36 -0.33 0.00 -1.00 0.00 0.00 57.85 56.79 1twc n ARG 63 Cb 0.83 -1.77 -0.06 0.00 -1.05 0.00 0.00 32.46 30.40 1twc n ARG 63 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1twc s LEU 64 N 0.84 4.15 -0.09 2.89 0.20 -1.26 -5.03 118.68 120.38 1twc s LEU 64 Ca 0.70 0.27 0.03 0.00 0.69 0.00 0.00 54.13 55.81 1twc s LEU 64 Cb -0.85 -2.41 0.01 0.00 -0.43 0.00 0.00 46.19 42.51 1twc s LEU 64 CO 0.55 0.28 -0.17 0.68 -0.29 0.00 0.00 176.35 177.39 1twc s VAL 65 N -1.24 1.55 0.08 1.68 -7.23 -1.26 -5.10 120.40 108.90 1twc s VAL 65 Ca 0.24 -0.72 0.05 0.00 -1.81 0.00 0.00 61.98 59.75 1twc s VAL 65 Cb -0.12 -1.38 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 1twc s VAL 65 CO 0.15 0.45 -0.04 -1.58 -0.31 0.00 0.00 175.10 173.77 1twc s GLN 66 N 0.60 2.42 0.02 4.82 0.74 -1.26 -5.13 119.66 121.87 1twc s GLN 66 Ca -0.15 -0.88 0.00 0.00 0.05 0.00 0.00 55.36 54.38 1twc s GLN 66 Cb -0.16 -2.46 -0.02 0.00 1.10 0.00 0.00 33.01 31.46 1twc s GLN 66 CO 0.05 0.54 -0.03 -0.06 -0.55 0.00 0.00 175.29 175.23 1twc s PHE 67 N -1.25 0.26 -0.68 1.67 0.40 -1.26 -5.05 117.98 112.08 1twc s PHE 67 Ca 0.23 -0.45 0.23 0.00 -0.60 0.00 0.00 56.93 56.34 1twc s PHE 67 Cb -0.11 -0.18 0.08 0.00 0.51 0.00 0.00 43.02 43.31 1twc s PHE 67 CO 0.16 -0.15 1.06 0.39 0.70 0.00 0.00 175.22 177.37 1twc n GLU 68 N 1.81 0.24 -3.07 0.44 4.71 -1.26 -4.93 120.64 118.58 1twc n GLU 68 Ca -0.22 -0.00 -0.15 0.00 -0.01 0.00 0.00 57.16 56.77 1twc n GLU 68 Cb 0.56 -1.58 0.04 0.00 -1.01 0.00 0.00 31.44 29.45 1twc n GLU 68 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1twc n ALA 69 N -1.77 -0.78 -0.03 0.62 0.00 -1.26 -5.39 120.51 111.90 1twc n ALA 69 Ca 0.02 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1twc n ALA 69 Cb 0.42 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.43 1twc n ALA 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04