#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fuu h PRO 2 N 0.00 0.00 -5.96 1.61 0.11 -2.09 -3.40 132.00 122.27 2fuu h PRO 2 Ca 0.00 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.53 2fuu h PRO 2 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.05 2fuu h PRO 2 CO 0.00 0.00 -0.09 -0.51 -0.21 0.00 0.00 178.00 177.19 2fuu s LEU 3 N -6.37 4.38 -0.73 2.35 1.43 -1.26 -4.11 118.68 114.37 2fuu s LEU 3 Ca -0.04 1.02 -0.04 0.00 -1.03 0.00 0.00 54.13 54.04 2fuu s LEU 3 Cb 0.12 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.55 2fuu s LEU 3 CO 0.38 0.11 0.63 0.61 0.23 0.00 0.00 176.35 178.31 2fuu n GLY 4 N 2.60 0.10 0.09 -3.19 0.00 -1.26 -4.94 105.19 98.59 2fuu n GLY 4 Ca -0.08 -0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 2fuu n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2fuu h SER 5 N -1.39 -0.16 0.00 1.61 0.87 -1.77 -3.48 113.55 109.24 2fuu h SER 5 Ca -0.31 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 2fuu h SER 5 Cb 1.20 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 2fuu h SER 5 CO 0.30 -0.06 0.00 -0.67 -0.53 0.00 0.00 176.83 175.87 2fuu n ASP 6 N -5.18 0.00 -4.79 6.23 2.03 -1.26 -5.14 116.55 108.44 2fuu n ASP 6 Ca -0.04 0.00 -0.37 0.00 0.52 0.00 0.00 54.79 54.90 2fuu n ASP 6 Cb 0.11 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.44 2fuu n ASP 6 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2fuu s THR 7 N 0.00 4.29 0.43 5.18 2.01 -1.26 -5.08 115.64 121.21 2fuu s THR 7 Ca 0.00 1.72 0.04 0.00 0.31 0.00 0.00 61.69 63.76 2fuu s THR 7 Cb 0.00 -4.00 0.04 0.00 0.01 0.00 0.00 72.50 68.55 2fuu s THR 7 CO 0.00 0.20 0.35 0.29 -0.69 0.00 0.00 174.62 174.77 2fuu n LYS 8 N 0.70 0.84 -0.61 4.92 4.76 -1.26 -5.04 118.16 122.47 2fuu n LYS 8 Ca 0.00 -2.65 -0.29 0.00 -2.87 0.00 0.00 58.31 52.50 2fuu n LYS 8 Cb 0.50 0.24 0.26 0.00 -1.84 0.00 0.00 35.03 34.19 2fuu n LYS 8 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2fuu s LEU 9 N 0.00 0.06 0.00 -0.35 1.43 -1.26 -5.00 118.68 113.56 2fuu s LEU 9 Ca 0.27 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.45 2fuu s LEU 9 Cb -0.02 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.41 2fuu s LEU 9 CO 0.17 -4.59 0.00 -1.22 0.23 0.00 0.00 176.35 170.94 2fuu n TYR 10 N -5.13 0.00 -1.43 0.29 4.01 -1.14 -4.96 117.16 108.80 2fuu n TYR 10 Ca 0.08 0.00 -0.55 0.00 -0.16 0.00 0.00 57.90 57.27 2fuu n TYR 10 Cb 0.58 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.52 2fuu n TYR 10 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2fuu n ILE 12 N 3.18 0.23 0.18 0.00 -0.00 -1.26 0.28 119.36 121.97 2fuu n ILE 12 Ca 0.25 0.30 0.08 0.00 -0.00 0.00 0.00 62.75 63.38 2fuu n ILE 12 Cb -0.04 -1.30 0.10 0.00 -0.00 0.00 0.00 39.64 38.40 2fuu n ILE 12 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2fuu n LYS 14 N -3.12 0.00 -3.63 0.00 2.85 0.81 -5.13 118.16 109.94 2fuu n LYS 14 Ca 0.03 0.25 -0.15 0.00 -1.05 0.00 0.00 58.31 57.39 2fuu n LYS 14 Cb 0.62 -0.76 -0.08 0.00 -0.65 0.00 0.00 35.03 34.16 2fuu n LYS 14 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2fuu s THR 15 N -0.50 0.01 0.47 0.58 -4.23 -1.26 -5.00 115.64 105.71 2fuu s THR 15 Ca 0.00 -0.08 -0.08 0.00 -1.18 0.00 0.00 61.69 60.35 2fuu s THR 15 Cb 0.00 -0.85 0.12 0.00 1.34 0.00 0.00 72.50 73.10 2fuu s THR 15 CO 0.00 -0.04 0.43 -0.81 -0.54 0.00 0.00 174.62 173.66 2fuu n PRO 16 N 1.90 -1.78 -2.85 3.99 -0.04 -1.26 -2.88 135.00 132.08 2fuu n PRO 16 Ca -0.17 -0.69 -0.41 0.00 -0.04 0.00 0.00 63.50 62.19 2fuu n PRO 16 Cb 0.56 -0.63 -0.04 0.00 -0.04 0.00 0.00 33.50 33.35 2fuu n PRO 16 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2fuu s TYR 17 N -1.79 3.60 -0.09 0.54 5.04 -1.26 -4.86 117.35 118.54 2fuu s TYR 17 Ca 0.28 1.48 -0.03 0.00 -2.44 0.00 0.00 57.07 56.36 2fuu s TYR 17 Cb -0.03 -2.99 0.04 0.00 0.35 0.00 0.00 41.96 39.34 2fuu s TYR 17 CO 0.21 -0.00 0.10 -0.51 -1.34 0.00 0.00 175.55 174.00 2fuu s ASP 18 N 0.94 1.33 0.00 4.32 1.01 -1.26 -4.97 116.67 118.05 2fuu s ASP 18 Ca 0.45 -0.03 0.00 0.00 0.71 0.00 0.00 52.55 53.68 2fuu s ASP 18 Cb -0.19 -0.05 0.00 0.00 1.01 0.00 0.00 42.92 43.69 2fuu s ASP 18 CO 0.22 -0.27 0.24 -0.62 0.21 0.00 0.00 175.17 174.95 2fuu n GLU 19 N 5.30 0.00 0.00 8.23 1.02 -1.26 0.34 120.64 134.27 2fuu n GLU 19 Ca -0.04 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.21 2fuu n GLU 19 Cb 0.50 -1.29 0.07 0.00 -0.02 0.00 0.00 31.44 30.70 2fuu n GLU 19 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2fuu n SER 20 N -0.71 2.04 -4.13 1.62 7.64 -1.26 -4.82 113.62 113.99 2fuu n SER 20 Ca 0.00 -1.51 -0.28 0.00 1.01 0.00 0.00 58.87 58.09 2fuu n SER 20 Cb 0.00 0.36 -0.17 0.00 -1.01 0.00 0.00 64.21 63.39 2fuu n SER 20 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2fuu s LYS 21 N -2.40 2.32 -0.12 1.43 2.47 1.04 -5.12 119.74 119.36 2fuu s LYS 21 Ca 0.21 -0.66 -0.01 0.00 -1.56 0.00 0.00 55.97 53.95 2fuu s LYS 21 Cb 0.19 -1.84 -0.02 0.00 -1.46 0.00 0.00 37.83 34.69 2fuu s LYS 21 CO 0.52 0.13 -0.08 -0.59 0.16 0.00 0.00 175.35 175.50 2fuu s PHE 22 N 0.41 2.93 0.51 4.03 -0.71 -1.26 -4.63 117.98 119.27 2fuu s PHE 22 Ca -0.15 -0.30 0.06 0.00 -1.04 0.00 0.00 56.93 55.50 2fuu s PHE 22 Cb -0.16 -1.85 0.02 0.00 -1.21 0.00 0.00 43.02 39.82 2fuu s PHE 22 CO 0.06 0.02 0.36 0.71 -1.34 0.00 0.00 175.22 175.03 2fuu s TYR 23 N 0.01 1.88 -0.14 3.49 1.51 -1.26 -2.26 117.35 120.57 2fuu s TYR 23 Ca -0.01 -0.77 -0.08 0.00 -1.01 0.00 0.00 57.07 55.20 2fuu s TYR 23 Cb -0.14 -1.94 0.05 0.00 -0.11 0.00 0.00 41.96 39.82 2fuu s TYR 23 CO 0.03 -0.34 0.35 0.96 -1.11 0.00 0.00 175.55 175.44 2fuu s ILE 24 N -2.72 -0.04 -0.13 2.71 -0.00 -1.19 -4.91 121.20 114.91 2fuu s ILE 24 Ca 0.36 0.12 -0.22 0.00 -0.00 0.00 0.00 60.65 60.90 2fuu s ILE 24 Cb -0.02 -0.52 -0.03 0.00 -0.00 0.00 0.00 42.46 41.90 2fuu s ILE 24 CO 0.22 0.05 0.68 -0.83 -0.00 0.00 0.00 174.94 175.06 2fuu s GLY 25 N 1.38 2.31 -0.29 6.27 0.00 -1.26 -3.10 107.32 112.63 2fuu s GLY 25 Ca -0.09 -0.05 -0.33 0.00 0.00 0.00 0.00 44.72 44.25 2fuu s GLY 25 CO -0.11 1.28 2.19 0.00 0.00 0.00 0.00 173.10 176.46 2fuu h ASP 27 N 13.22 0.30 0.00 0.00 1.82 -1.88 1.07 116.42 130.95 2fuu h ASP 27 Ca -0.33 0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.45 2fuu h ASP 27 Cb 1.29 0.12 0.00 0.00 0.68 0.00 0.00 39.33 41.42 2fuu h ASP 27 CO 0.99 0.03 -0.92 -2.11 -1.61 0.00 0.00 179.24 175.62 2fuu n ARG 28 N -5.04 2.04 0.08 0.28 0.00 -1.26 -4.44 116.66 108.32 2fuu n ARG 28 Ca 0.20 -0.04 -0.04 0.00 -0.00 0.00 0.00 57.85 57.97 2fuu n ARG 28 Cb 0.58 -1.03 -0.07 0.00 -0.00 0.00 0.00 32.46 31.93 2fuu n ARG 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2fuu n GLN 30 N -3.28 0.00 -4.32 0.00 10.64 0.37 -4.92 117.38 115.87 2fuu n GLN 30 Ca -0.01 0.00 -0.18 0.00 -1.83 0.00 0.00 57.00 54.99 2fuu n GLN 30 Cb 0.88 -2.79 -0.09 0.00 -0.86 0.00 0.00 30.24 27.38 2fuu n GLN 30 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 2fuu s ASN 31 N -2.19 1.36 0.01 2.61 6.03 -1.25 -4.67 114.94 116.84 2fuu s ASN 31 Ca 0.00 -1.51 -0.01 0.00 -1.03 0.00 0.00 52.86 50.31 2fuu s ASN 31 Cb 0.00 0.34 -0.04 0.00 -3.03 0.00 0.00 41.25 38.52 2fuu s ASN 31 CO 0.00 -0.85 0.15 0.26 -2.03 0.00 0.00 177.10 174.63 2fuu s TRP 32 N -3.68 3.45 0.04 1.54 0.52 -1.26 0.15 118.94 119.70 2fuu s TRP 32 Ca 0.36 0.27 -0.00 0.00 0.02 0.00 0.00 56.10 56.76 2fuu s TRP 32 Cb 0.06 -1.77 -0.03 0.00 -1.15 0.00 0.00 33.47 30.57 2fuu s TRP 32 CO 0.16 0.60 -0.04 0.71 0.02 0.00 0.00 176.95 178.41 2fuu s TYR 33 N -1.33 0.46 0.19 -1.98 2.02 -1.18 -0.11 117.35 115.42 2fuu s TYR 33 Ca 0.28 -0.77 -0.30 0.00 -0.37 0.00 0.00 57.07 55.91 2fuu s TYR 33 Cb -0.12 -0.32 -0.08 0.00 -0.40 0.00 0.00 41.96 41.04 2fuu s TYR 33 CO 0.20 -0.25 1.15 -1.01 -1.57 0.00 0.00 175.55 174.06 2fuu s HIS 34 N -2.60 3.50 0.16 2.71 3.76 -1.26 -3.15 115.29 118.41 2fuu s HIS 34 Ca -0.04 1.52 -0.30 0.00 -0.15 0.00 0.00 55.06 56.10 2fuu s HIS 34 Cb -0.02 -3.35 -0.04 0.00 1.11 0.00 0.00 32.58 30.27 2fuu s HIS 34 CO -0.05 -0.90 1.55 0.78 -0.85 0.00 0.00 174.74 175.27 2fuu h GLY 35 N 5.02 -0.77 1.71 -2.22 0.00 -1.77 0.45 103.07 105.48 2fuu h GLY 35 Ca -0.45 0.71 -0.05 0.00 0.00 0.00 0.00 47.33 47.55 2fuu h GLY 35 CO 0.73 -0.06 -0.07 3.21 0.00 0.00 0.00 176.54 180.34 2fuu h ARG 36 N -0.18 0.36 0.00 4.80 3.08 -1.85 0.57 114.38 121.16 2fuu h ARG 36 Ca 0.15 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2fuu h ARG 36 Cb 0.51 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.51 2fuu h ARG 36 CO -0.78 0.45 0.18 0.00 -1.07 0.00 0.00 179.97 178.74 2fuu n VAL 38 N -2.37 0.46 -2.37 0.00 0.24 -0.32 -4.49 118.33 109.49 2fuu n VAL 38 Ca -0.01 -0.50 -0.04 0.00 -2.04 0.00 0.00 64.34 61.75 2fuu n VAL 38 Cb 0.21 0.83 0.02 0.00 -1.47 0.00 0.00 33.84 33.43 2fuu n VAL 38 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fuu n GLY 39 N -0.23 0.35 3.72 7.63 0.00 0.12 -5.07 105.19 111.71 2fuu n GLY 39 Ca 0.00 -0.39 -0.24 0.00 0.00 0.00 0.00 46.02 45.39 2fuu n GLY 39 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2fuu s ILE 40 N -3.07 2.65 1.04 -0.61 2.07 0.18 -4.92 121.20 118.53 2fuu s ILE 40 Ca 0.02 -1.74 -0.12 0.00 -1.41 0.00 0.00 60.65 57.41 2fuu s ILE 40 Cb -0.01 -2.95 0.21 0.00 0.13 0.00 0.00 42.46 39.84 2fuu s ILE 40 CO 0.14 -0.11 1.08 -0.76 -1.91 0.00 0.00 174.94 173.39 2fuu s LEU 41 N -3.85 1.75 -0.10 8.50 1.02 -1.26 -4.09 118.68 120.65 2fuu s LEU 41 Ca 0.39 1.76 -0.16 0.00 0.02 0.00 0.00 54.13 56.14 2fuu s LEU 41 Cb 0.00 -3.91 -0.13 0.00 0.02 0.00 0.00 46.19 42.18 2fuu s LEU 41 CO 0.22 -3.60 0.50 -0.61 0.02 0.00 0.00 176.35 172.89 2fuu h GLN 42 N -2.21 -0.07 0.00 1.70 4.15 -1.99 -3.25 115.11 113.43 2fuu h GLN 42 Ca -0.53 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.89 2fuu h GLN 42 Cb 1.30 0.02 0.00 0.00 0.21 0.00 0.00 27.48 29.01 2fuu h GLN 42 CO 0.48 0.38 0.00 0.77 -1.93 0.00 0.00 178.83 178.53 2fuu h SER 43 N -0.97 0.00 -0.20 -0.69 0.02 -2.03 -3.21 113.55 106.48 2fuu h SER 43 Ca -0.01 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.00 2fuu h SER 43 Cb 0.49 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 2fuu h SER 43 CO 0.01 0.00 0.96 -0.08 -1.14 0.00 0.00 176.83 176.59 2fuu h GLU 44 N 0.00 0.00 0.24 3.45 4.22 -1.93 0.42 114.58 120.97 2fuu h GLU 44 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 2fuu h GLU 44 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2fuu h GLU 44 CO 0.00 0.00 -0.11 0.00 -2.18 0.00 0.00 179.01 176.72 2fuu h ALA 45 N 0.26 -0.32 0.17 2.92 0.00 -1.79 -3.30 119.26 117.21 2fuu h ALA 45 Ca 0.09 -0.18 -0.36 0.00 0.00 0.00 0.00 54.91 54.47 2fuu h ALA 45 Cb 2.02 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.93 2fuu h ALA 45 CO -0.00 -0.50 -1.83 1.49 0.00 0.00 0.00 179.25 178.41 2fuu h GLU 46 N -0.67 0.36 -0.17 0.00 4.57 -0.49 -3.37 114.58 114.81 2fuu h GLU 46 Ca -0.03 -0.62 0.05 0.00 -1.18 0.00 0.00 59.36 57.58 2fuu h GLU 46 Cb 0.47 0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 2fuu h GLU 46 CO 0.05 1.30 0.22 1.37 -1.18 0.00 0.00 179.01 180.77 2fuu h LEU 47 N 0.10 0.00-10.61 1.64 8.10 -1.54 -3.42 115.31 109.57 2fuu h LEU 47 Ca -0.37 0.00 -0.46 0.00 0.11 0.00 0.00 57.88 57.16 2fuu h LEU 47 Cb 2.08 0.00 0.09 0.00 -0.44 0.00 0.00 40.66 42.39 2fuu h LEU 47 CO 0.15 0.00 0.24 0.27 -4.11 0.00 0.00 178.44 174.99 2fuu s ILE 48 N -4.55 2.23 0.00 0.15 -5.25 -1.24 -4.98 121.20 107.56 2fuu s ILE 48 Ca -0.05 -0.27 0.00 0.00 -0.99 0.00 0.00 60.65 59.34 2fuu s ILE 48 Cb 0.14 -2.96 0.00 0.00 2.95 0.00 0.00 42.46 42.60 2fuu s ILE 48 CO 0.51 0.00 0.15 -0.67 -1.79 0.00 0.00 174.94 173.14 2fuu n ASP 49 N -3.01 0.00 -1.88 4.36 2.03 -1.26 -4.87 116.55 111.92 2fuu n ASP 49 Ca 0.09 -0.79 -0.04 0.00 0.52 0.00 0.00 54.79 54.57 2fuu n ASP 49 Cb 0.60 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 41.04 2fuu n ASP 49 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2fuu n GLU 50 N 0.00 0.72 -2.08 -0.67 1.02 -1.26 -5.13 120.64 113.24 2fuu n GLU 50 Ca 0.00 -1.14 -0.36 0.00 -0.02 0.00 0.00 57.16 55.64 2fuu n GLU 50 Cb 0.40 0.44 0.02 0.00 -0.02 0.00 0.00 31.44 32.28 2fuu n GLU 50 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2fuu s TYR 51 N 0.04 2.54 0.07 -0.32 6.14 -1.26 -5.02 117.35 119.53 2fuu s TYR 51 Ca 0.05 1.50 0.01 0.00 0.64 0.00 0.00 57.07 59.27 2fuu s TYR 51 Cb 0.24 -3.48 -0.04 0.00 0.42 0.00 0.00 41.96 39.10 2fuu s TYR 51 CO -0.07 -2.04 -0.05 0.08 0.64 0.00 0.00 175.55 174.11 2fuu s VAL 52 N -1.56 0.48 0.69 3.14 1.01 -1.26 -3.91 120.40 118.99 2fuu s VAL 52 Ca 0.72 -1.79 -0.11 0.00 0.00 0.00 0.00 61.98 60.81 2fuu s VAL 52 Cb -0.30 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.59 2fuu s VAL 52 CO 0.35 -0.87 1.06 0.00 0.00 0.00 0.00 175.10 175.63 2fuu h PRO 54 N -0.65 0.18 -0.35 0.00 0.13 -1.97 -1.77 132.00 127.57 2fuu h PRO 54 Ca -0.44 -0.26 -0.12 0.00 -0.87 0.00 0.00 66.00 64.31 2fuu h PRO 54 Cb 1.21 0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 2fuu h PRO 54 CO 0.59 1.07 -0.27 1.96 -0.23 0.00 0.00 178.00 181.12 2fuu h GLN 55 N 0.07 0.71 0.00 0.86 4.20 -2.01 -2.31 115.11 116.62 2fuu h GLN 55 Ca -0.07 -0.30 -0.05 0.00 0.06 0.00 0.00 58.65 58.30 2fuu h GLN 55 Cb 1.76 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.50 2fuu h GLN 55 CO 0.16 0.90 -0.21 0.00 -0.67 0.00 0.00 178.83 179.00 2fuu h GLN 57 N 0.00 0.70 -0.03 0.00 4.15 -0.72 2.18 115.11 121.38 2fuu h GLN 57 Ca -0.00 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2fuu h GLN 57 Cb 0.88 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.41 2fuu h GLN 57 CO 0.03 0.46 0.00 0.45 -1.93 0.00 0.00 178.83 177.84 2fuu n SER 58 N -4.74 0.03 -2.56 -0.69 2.88 -1.18 -4.86 113.62 102.50 2fuu n SER 58 Ca 0.23 -1.92 -0.06 0.00 -1.33 0.00 0.00 58.87 55.79 2fuu n SER 58 Cb 0.60 -0.02 0.03 0.00 -0.75 0.00 0.00 64.21 64.07 2fuu n SER 58 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2fuu n THR 59 N -0.48 -6.45 -2.11 2.46 -2.24 0.74 -3.29 114.28 102.91 2fuu n THR 59 Ca 0.00 -0.59 -0.09 0.00 -2.27 0.00 0.00 64.05 61.10 2fuu n THR 59 Cb 0.01 -5.41 -0.02 0.00 -2.10 0.00 0.00 70.33 62.81 2fuu n THR 59 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2fuu n GLU 60 N -2.17 -1.54 -0.25 -0.78 0.28 -1.18 -4.68 120.64 110.33 2fuu n GLU 60 Ca -0.03 0.03 0.07 0.00 -0.16 0.00 0.00 57.16 57.07 2fuu n GLU 60 Cb 0.55 -2.28 0.31 0.00 1.43 0.00 0.00 31.44 31.45 2fuu n GLU 60 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 2fuu h ASP 61 N -0.17 0.76 -0.02 -1.84 3.32 -1.78 -3.51 116.42 113.17 2fuu h ASP 61 Ca -0.12 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.94 2fuu h ASP 61 Cb 0.58 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2fuu h ASP 61 CO 0.18 0.46 0.00 0.00 -1.72 0.00 0.00 179.24 178.17