#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuu s SER 2 N 0.00 -1.04 0.26 1.61 1.04 -1.26 -5.17 113.70 109.15 2yuu s SER 2 Ca 0.00 1.37 -0.07 0.00 0.48 0.00 0.00 55.95 57.73 2yuu s SER 2 Cb 0.00 2.16 -0.01 0.00 0.10 0.00 0.00 66.02 68.27 2yuu s SER 2 CO 0.00 -0.20 0.39 -0.44 0.98 0.00 0.00 173.24 173.97 2yuu s SER 3 N 2.81 0.28 0.00 7.02 0.01 -1.26 -5.15 113.70 117.41 2yuu s SER 3 Ca -0.04 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.01 2yuu s SER 3 Cb -0.11 0.56 0.00 0.00 0.21 0.00 0.00 66.02 66.68 2yuu s SER 3 CO -0.19 -1.11 0.00 0.61 0.41 0.00 0.00 173.24 172.96 2yuu n GLY 4 N -0.41 -1.17 3.44 3.44 0.00 -1.26 -5.18 105.19 104.05 2yuu n GLY 4 Ca 0.00 0.93 -0.22 0.00 0.00 0.00 0.00 46.02 46.73 2yuu n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yuu s SER 5 N 0.00 2.99 -0.02 1.61 0.15 -1.26 -5.15 113.70 112.01 2yuu s SER 5 Ca 0.00 -1.13 -0.30 0.00 0.70 0.00 0.00 55.95 55.21 2yuu s SER 5 Cb 0.00 -0.21 0.11 0.00 -1.71 0.00 0.00 66.02 64.21 2yuu s SER 5 CO 0.00 -0.23 1.16 -0.94 1.20 0.00 0.00 173.24 174.43 2yuu s SER 6 N -3.45 -0.13 -0.41 5.45 1.04 -1.26 -5.13 113.70 109.81 2yuu s SER 6 Ca 0.29 -0.14 0.02 0.00 0.48 0.00 0.00 55.95 56.59 2yuu s SER 6 Cb 0.01 0.25 0.14 0.00 0.10 0.00 0.00 66.02 66.52 2yuu s SER 6 CO 0.12 -0.44 0.24 -0.83 0.98 0.00 0.00 173.24 173.31 2yuu s GLY 7 N -2.72 1.42 0.10 7.32 0.00 -1.26 -5.11 107.32 107.07 2yuu s GLY 7 Ca 0.12 -2.38 0.07 0.00 0.00 0.00 0.00 44.72 42.52 2yuu s GLY 7 CO -0.03 1.72 -0.10 -1.59 0.00 0.00 0.00 173.10 173.10 2yuu s LYS 8 N 0.55 2.17 -0.04 2.90 0.00 -1.26 -5.08 119.74 118.98 2yuu s LYS 8 Ca 0.18 -1.00 -0.30 0.00 0.00 0.00 0.00 55.97 54.86 2yuu s LYS 8 Cb -0.23 -2.32 -0.06 0.00 0.00 0.00 0.00 37.83 35.22 2yuu s LYS 8 CO -0.00 0.52 1.64 -1.14 0.00 0.00 0.00 175.35 176.36 2yuu s GLN 9 N -2.14 4.19 0.09 1.78 2.00 -1.26 -4.99 119.66 119.33 2yuu s GLN 9 Ca 0.21 2.19 0.01 0.00 -2.00 0.00 0.00 55.36 55.77 2yuu s GLN 9 Cb -0.11 -3.92 -0.04 0.00 0.80 0.00 0.00 33.01 29.74 2yuu s GLN 9 CO 0.13 -0.82 -0.06 0.00 -0.50 0.00 0.00 175.29 174.04 2yuu s ALA 10 N 3.79 0.92 0.04 1.58 0.00 -1.26 -5.14 121.76 121.68 2yuu s ALA 10 Ca 0.73 -1.33 -0.07 0.00 0.00 0.00 0.00 51.96 51.29 2yuu s ALA 10 Cb -0.34 0.17 -0.00 0.00 0.00 0.00 0.00 23.12 22.95 2yuu s ALA 10 CO 0.30 -0.25 0.13 -1.59 0.00 0.00 0.00 175.76 174.35 2yuu s LYS 11 N -3.82 0.62 -0.14 0.00 -2.85 -1.26 -5.13 119.74 107.15 2yuu s LYS 11 Ca 0.11 -0.68 -0.05 0.00 -1.00 0.00 0.00 55.97 54.35 2yuu s LYS 11 Cb 0.05 0.25 -0.04 0.00 -2.06 0.00 0.00 37.83 36.04 2yuu s LYS 11 CO -0.05 -0.16 0.03 0.42 0.10 0.00 0.00 175.35 175.68 2yuu s ILE 12 N -2.50 4.52 -0.53 3.79 1.01 -1.26 -4.16 121.20 122.06 2yuu s ILE 12 Ca -0.06 -0.15 -0.18 0.00 0.00 0.00 0.00 60.65 60.27 2yuu s ILE 12 Cb -0.02 -2.98 0.08 0.00 0.01 0.00 0.00 42.46 39.56 2yuu s ILE 12 CO -0.04 0.53 0.58 -1.00 0.00 0.00 0.00 174.94 175.01 2yuu s HIS 13 N -0.15 3.10 -0.39 3.97 3.76 -0.97 -4.95 115.29 119.67 2yuu s HIS 13 Ca 0.06 -0.84 -0.06 0.00 -0.15 0.00 0.00 55.06 54.07 2yuu s HIS 13 Cb -0.12 -3.62 -0.20 0.00 1.11 0.00 0.00 32.58 29.74 2yuu s HIS 13 CO 0.02 -1.05 3.19 0.66 -0.85 0.00 0.00 174.74 176.70 2yuu n TYR 14 N 5.89 0.57 -3.13 1.40 4.01 -1.25 -3.37 117.16 121.28 2yuu n TYR 14 Ca -0.10 -1.75 -0.39 0.00 -0.16 0.00 0.00 57.90 55.50 2yuu n TYR 14 Cb 0.43 -1.70 -0.06 0.00 -0.31 0.00 0.00 39.34 37.70 2yuu n TYR 14 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2yuu s ILE 15 N 1.52 4.61 -0.52 -0.72 1.09 -1.25 -3.92 121.20 122.00 2yuu s ILE 15 Ca 0.61 1.44 0.00 0.00 -1.10 0.00 0.00 60.65 61.61 2yuu s ILE 15 Cb 0.26 -4.01 0.00 0.00 -1.06 0.00 0.00 42.46 37.64 2yuu s ILE 15 CO -0.01 0.52 0.00 0.29 -0.10 0.00 0.00 174.94 175.63 2yuu n LYS 16 N 1.85 -2.07 -2.58 2.79 4.76 -1.26 0.16 118.16 121.80 2yuu n LYS 16 Ca -0.08 0.29 -0.07 0.00 -2.87 0.00 0.00 58.31 55.58 2yuu n LYS 16 Cb 0.50 -4.67 0.01 0.00 -1.84 0.00 0.00 35.03 29.03 2yuu n LYS 16 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2yuu n ASN 17 N -0.88 -3.11 -3.72 4.39 5.15 -1.25 -3.02 115.26 112.82 2yuu n ASN 17 Ca -0.06 -0.11 -0.17 0.00 -0.60 0.00 0.00 54.58 53.64 2yuu n ASN 17 Cb 0.41 -1.95 -0.01 0.00 -0.53 0.00 0.00 39.78 37.70 2yuu n ASN 17 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 2yuu n HIS 18 N -3.57 -0.49 -1.90 1.20 8.25 0.41 -3.79 115.22 115.32 2yuu n HIS 18 Ca -0.03 -1.46 0.05 0.00 -0.26 0.00 0.00 57.72 56.01 2yuu n HIS 18 Cb 0.54 -0.26 0.08 0.00 1.12 0.00 0.00 29.99 31.47 2yuu n HIS 18 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2yuu n GLU 19 N -1.16 0.63 -1.36 -0.41 1.02 -1.24 -3.92 120.64 114.20 2yuu n GLU 19 Ca -0.04 -2.20 -0.52 0.00 -0.02 0.00 0.00 57.16 54.38 2yuu n GLU 19 Cb 0.39 -0.79 -0.13 0.00 -0.02 0.00 0.00 31.44 30.89 2yuu n GLU 19 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2yuu n PHE 20 N -0.37 0.93 -3.85 -0.32 3.72 -1.22 -4.12 117.46 112.24 2yuu n PHE 20 Ca 0.10 0.59 -0.36 0.00 -0.05 0.00 0.00 57.45 57.73 2yuu n PHE 20 Cb 0.84 -2.34 -0.11 0.00 -0.94 0.00 0.00 39.48 36.93 2yuu n PHE 20 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2yuu s ILE 21 N 7.31 4.74 -0.26 4.37 1.01 0.47 -2.30 121.20 136.54 2yuu s ILE 21 Ca 1.26 -0.04 -0.43 0.00 0.00 0.00 0.00 60.65 61.44 2yuu s ILE 21 Cb -1.37 -3.18 -0.19 0.00 0.01 0.00 0.00 42.46 37.72 2yuu s ILE 21 CO 0.58 0.38 1.44 0.00 0.00 0.00 0.00 174.94 177.34 2yuu n ALA 22 N 4.26 -1.84 -3.10 9.38 0.00 -1.26 -3.29 120.51 124.66 2yuu n ALA 22 Ca -0.16 0.51 -0.12 0.00 0.00 0.00 0.00 53.44 53.68 2yuu n ALA 22 Cb 0.52 -1.93 -0.09 0.00 0.00 0.00 0.00 19.45 17.95 2yuu n ALA 22 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2yuu s THR 23 N 1.95 0.08 -0.10 0.00 -1.32 -1.22 -4.94 115.64 110.09 2yuu s THR 23 Ca 0.98 -0.65 -0.04 0.00 -1.21 0.00 0.00 61.69 60.77 2yuu s THR 23 Cb -1.31 -0.63 -0.04 0.00 -1.51 0.00 0.00 72.50 69.01 2yuu s THR 23 CO 0.69 -0.36 0.06 0.12 -2.21 0.00 0.00 174.62 172.92 2yuu s PHE 24 N -1.69 3.34 -0.27 9.09 2.19 -1.26 -2.13 117.98 127.25 2yuu s PHE 24 Ca -0.12 0.33 0.02 0.00 0.33 0.00 0.00 56.93 57.49 2yuu s PHE 24 Cb -0.05 -1.84 0.06 0.00 -1.31 0.00 0.00 43.02 39.87 2yuu s PHE 24 CO 0.01 0.58 -0.09 -0.06 1.83 0.00 0.00 175.22 177.49 2yuu s PHE 25 N -0.96 3.25 0.33 10.12 0.08 -1.26 -4.98 117.98 124.57 2yuu s PHE 25 Ca 0.14 -2.21 0.26 0.00 0.12 0.00 0.00 56.93 55.24 2yuu s PHE 25 Cb -0.12 -1.97 1.26 0.00 -0.57 0.00 0.00 43.02 41.63 2yuu s PHE 25 CO 0.04 -0.86 1.99 0.78 -0.10 0.00 0.00 175.22 177.06 2yuu h GLY 26 N 7.82 0.00 -3.22 4.36 0.00 -1.98 -3.44 103.07 106.62 2yuu h GLY 26 Ca -0.20 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.48 2yuu h GLY 26 CO 0.48 0.00 -0.80 1.20 0.00 0.00 0.00 176.54 177.42 2yuu s GLN 27 N -4.03 1.65 -1.06 4.80 1.11 -1.26 -5.05 119.66 115.82 2yuu s GLN 27 Ca -0.02 -1.48 -0.23 0.00 0.01 0.00 0.00 55.36 53.64 2yuu s GLN 27 Cb 0.12 -1.92 -0.07 0.00 -1.01 0.00 0.00 33.01 30.14 2yuu s GLN 27 CO 0.60 0.41 1.94 -1.25 0.01 0.00 0.00 175.29 177.00 2yuu s PRO 28 N -2.74 2.52 0.56 2.91 0.04 -1.26 -4.88 135.00 132.14 2yuu s PRO 28 Ca 0.22 -0.79 -0.09 0.00 0.04 0.00 0.00 61.00 60.37 2yuu s PRO 28 Cb -0.08 -5.17 0.14 0.00 0.04 0.00 0.00 34.50 29.43 2yuu s PRO 28 CO 0.11 -3.72 0.47 -2.37 0.04 0.00 0.00 177.00 171.53 2yuu n THR 29 N 7.83 0.00 -4.32 1.26 5.66 -1.26 -4.52 114.28 118.95 2yuu n THR 29 Ca 0.43 -0.19 -0.35 0.00 -3.05 0.00 0.00 64.05 60.89 2yuu n THR 29 Cb 0.47 -1.03 -0.10 0.00 -1.55 0.00 0.00 70.33 68.12 2yuu n THR 29 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 2yuu s PHE 30 N -1.84 3.15 0.38 1.09 5.36 -1.26 -2.12 117.98 122.75 2yuu s PHE 30 Ca 0.31 0.08 0.01 0.00 -0.96 0.00 0.00 56.93 56.37 2yuu s PHE 30 Cb -0.03 -1.87 -0.02 0.00 -0.34 0.00 0.00 43.02 40.76 2yuu s PHE 30 CO 0.24 0.33 0.58 0.00 -1.46 0.00 0.00 175.22 174.91 2yuu n SER 32 N -1.87 2.01 0.00 0.00 2.88 -1.22 -3.53 113.62 111.89 2yuu n SER 32 Ca -0.02 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2yuu n SER 32 Cb 0.57 -0.52 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 2yuu n SER 32 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2yuu n VAL 33 N -3.58 0.00 0.03 2.46 0.31 -1.26 -4.28 118.33 112.01 2yuu n VAL 33 Ca -0.45 1.18 -0.12 0.00 -0.01 0.00 0.00 64.34 64.93 2yuu n VAL 33 Cb 0.91 -2.15 -0.14 0.00 -0.91 0.00 0.00 33.84 31.55 2yuu n VAL 33 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2yuu n LYS 35 N -3.30 -3.27 -4.36 0.00 5.02 -1.23 -5.00 118.16 106.02 2yuu n LYS 35 Ca -0.14 0.63 -0.19 0.00 -2.02 0.00 0.00 58.31 56.59 2yuu n LYS 35 Cb 1.02 -4.83 -0.14 0.00 -0.02 0.00 0.00 35.03 31.07 2yuu n LYS 35 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2yuu s ASP 36 N -3.64 1.39 -0.69 4.39 1.01 -1.26 -4.74 116.67 113.13 2yuu s ASP 36 Ca 0.17 -0.35 -0.19 0.00 0.71 0.00 0.00 52.55 52.89 2yuu s ASP 36 Cb -0.02 -0.11 -0.16 0.00 1.01 0.00 0.00 42.92 43.64 2yuu s ASP 36 CO 0.54 0.05 1.80 0.49 0.21 0.00 0.00 175.17 178.26 2yuu n PHE 37 N 2.27 0.33 -1.52 4.23 3.01 -1.26 -4.24 117.46 120.27 2yuu n PHE 37 Ca -0.16 0.23 -0.34 0.00 1.01 0.00 0.00 57.45 58.19 2yuu n PHE 37 Cb 0.55 -1.46 -0.07 0.00 -0.01 0.00 0.00 39.48 38.49 2yuu n PHE 37 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2yuu n VAL 38 N 4.96 1.44 -3.77 -4.37 0.31 -0.90 -4.81 118.33 111.19 2yuu n VAL 38 Ca 0.46 -1.40 -0.13 0.00 -0.01 0.00 0.00 64.34 63.26 2yuu n VAL 38 Cb 0.03 -2.18 -0.09 0.00 -0.91 0.00 0.00 33.84 30.69 2yuu n VAL 38 CO 0.00 0.00 0.00 -1.66 -1.32 0.00 0.00 176.83 173.85 2yuu s TRP 39 N 9.35 -0.18 0.00 3.52 1.48 -1.26 -3.98 118.94 127.87 2yuu s TRP 39 Ca 0.66 0.32 0.00 0.00 -1.06 0.00 0.00 56.10 56.02 2yuu s TRP 39 Cb 0.06 0.09 0.00 0.00 -1.16 0.00 0.00 33.47 32.45 2yuu s TRP 39 CO 0.16 -0.34 0.00 0.41 -4.06 0.00 0.00 176.95 173.12 2yuu n GLY 40 N 1.55 2.38 3.26 3.67 0.00 -1.26 -5.08 105.19 109.71 2yuu n GLY 40 Ca -0.20 0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 2yuu n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yuu s LEU 41 N 0.00 6.22 -1.61 0.99 1.43 -1.26 -4.72 118.68 119.73 2yuu s LEU 41 Ca 0.00 -3.04 -0.17 0.00 -1.03 0.00 0.00 54.13 49.89 2yuu s LEU 41 Cb 0.00 -2.10 0.17 0.00 0.03 0.00 0.00 46.19 44.29 2yuu s LEU 41 CO 0.00 -0.42 0.42 -3.20 0.23 0.00 0.00 176.35 173.37 2yuu n ASN 42 N 3.41 -1.09 -4.19 2.29 5.15 -1.26 -4.84 115.26 114.72 2yuu n ASN 42 Ca 0.16 -1.11 -0.41 0.00 -0.60 0.00 0.00 54.58 52.61 2yuu n ASN 42 Cb 0.42 -1.42 -0.06 0.00 -0.53 0.00 0.00 39.78 38.19 2yuu n ASN 42 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2yuu s LYS 43 N -6.62 3.06 0.91 1.20 2.47 -1.26 -5.07 119.74 114.43 2yuu s LYS 43 Ca 0.59 -2.57 -0.16 0.00 -1.56 0.00 0.00 55.97 52.27 2yuu s LYS 43 Cb -0.34 -4.04 -0.07 0.00 -1.46 0.00 0.00 37.83 31.92 2yuu s LYS 43 CO 0.91 -1.23 -0.19 0.00 0.16 0.00 0.00 175.35 175.00 2yuu n GLN 44 N 3.59 -0.06 0.00 4.03 0.00 -1.26 -4.86 117.38 118.81 2yuu n GLN 44 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.12 2yuu n GLN 44 Cb 0.41 -1.39 0.00 0.00 0.00 0.00 0.00 30.24 29.27 2yuu n GLN 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2yuu n GLY 45 N 2.53 4.94 2.95 2.61 0.00 -0.91 -4.73 105.19 112.59 2yuu n GLY 45 Ca 0.03 -1.67 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 2yuu n GLY 45 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yuu s TYR 46 N 3.49 0.42 -0.10 1.61 2.02 -0.93 -3.41 117.35 120.46 2yuu s TYR 46 Ca 0.00 -0.08 -0.04 0.00 -0.37 0.00 0.00 57.07 56.58 2yuu s TYR 46 Cb 0.00 -0.27 0.05 0.00 -0.40 0.00 0.00 41.96 41.34 2yuu s TYR 46 CO 0.00 -0.01 0.21 0.21 -1.57 0.00 0.00 175.55 174.39 2yuu s LYS 47 N -0.12 0.14 -0.27 -0.62 2.20 -1.21 -0.84 119.74 119.03 2yuu s LYS 47 Ca 0.02 0.53 -0.29 0.00 -0.36 0.00 0.00 55.97 55.87 2yuu s LYS 47 Cb -0.02 -0.14 0.01 0.00 -1.51 0.00 0.00 37.83 36.17 2yuu s LYS 47 CO -0.00 -0.20 1.06 0.00 -0.36 0.00 0.00 175.35 175.84 2yuu n ARG 49 N 6.59 0.80 -0.07 0.00 1.85 -1.26 0.53 116.66 125.11 2yuu n ARG 49 Ca 0.12 0.00 -0.14 0.00 -1.00 0.00 0.00 57.85 56.83 2yuu n ARG 49 Cb 0.47 -1.11 -0.05 0.00 -1.05 0.00 0.00 32.46 30.72 2yuu n ARG 49 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 2yuu n GLN 50 N -0.61 0.40 -0.00 2.89 1.13 -1.26 -4.74 117.38 115.18 2yuu n GLN 50 Ca 0.04 0.17 0.09 0.00 -1.94 0.00 0.00 57.00 55.36 2yuu n GLN 50 Cb 0.02 -1.18 -0.12 0.00 0.11 0.00 0.00 30.24 29.07 2yuu n GLN 50 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2yuu n ASN 52 N -1.66 -3.10 -4.21 0.00 3.02 0.19 -4.96 115.26 104.54 2yuu n ASN 52 Ca 0.01 -0.38 -0.38 0.00 -0.03 0.00 0.00 54.58 53.79 2yuu n ASN 52 Cb 0.35 -3.24 -0.11 0.00 -0.61 0.00 0.00 39.78 36.18 2yuu n ASN 52 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yuu s ALA 53 N -3.22 3.20 -0.22 5.41 0.00 -1.23 -4.85 121.76 120.86 2yuu s ALA 53 Ca 0.11 -2.23 -0.23 0.00 0.00 0.00 0.00 51.96 49.60 2yuu s ALA 53 Cb -0.01 -2.51 -0.01 0.00 0.00 0.00 0.00 23.12 20.58 2yuu s ALA 53 CO 0.43 -1.66 0.75 0.00 0.00 0.00 0.00 175.76 175.28 2yuu s ALA 54 N 1.32 3.59 0.34 0.00 0.00 -1.26 -2.80 121.76 122.95 2yuu s ALA 54 Ca 0.04 -0.18 0.04 0.00 0.00 0.00 0.00 51.96 51.86 2yuu s ALA 54 Cb -0.23 -3.16 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2yuu s ALA 54 CO -0.00 -0.76 0.18 0.96 0.00 0.00 0.00 175.76 176.14 2yuu s ILE 55 N 2.42 0.31 0.30 0.00 -4.36 -0.02 -3.40 121.20 116.45 2yuu s ILE 55 Ca 0.33 -2.00 -0.15 0.00 -0.26 0.00 0.00 60.65 58.57 2yuu s ILE 55 Cb -0.16 -2.47 -0.09 0.00 1.25 0.00 0.00 42.46 41.00 2yuu s ILE 55 CO 0.09 0.00 0.71 -1.00 0.24 0.00 0.00 174.94 174.98 2yuu s HIS 56 N -3.47 3.41 0.56 1.37 3.76 -1.26 -2.20 115.29 117.46 2yuu s HIS 56 Ca 0.34 1.19 0.29 0.00 -0.15 0.00 0.00 55.06 56.73 2yuu s HIS 56 Cb 0.04 -2.51 1.47 0.00 1.11 0.00 0.00 32.58 32.68 2yuu s HIS 56 CO 0.19 0.14 1.90 -0.22 -0.85 0.00 0.00 174.74 175.91 2yuu h LYS 57 N 2.42 0.00 0.00 1.40 3.64 -1.88 0.26 116.57 122.41 2yuu h LYS 57 Ca -0.48 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 58.65 2yuu h LYS 57 Cb 1.18 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.95 2yuu h LYS 57 CO 0.66 0.00 -1.63 0.36 -2.27 0.00 0.00 179.45 176.57 2yuu n LYS 58 N -3.98 0.63 0.27 1.90 2.85 -1.26 -3.89 118.16 114.68 2yuu n LYS 58 Ca 0.12 0.27 0.18 0.00 -1.05 0.00 0.00 58.31 57.82 2yuu n LYS 58 Cb 0.76 -1.79 0.77 0.00 -0.65 0.00 0.00 35.03 34.12 2yuu n LYS 58 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2yuu h ILE 60 N 0.00 1.13 0.00 0.00 2.10 -1.49 0.33 117.51 119.58 2yuu h ILE 60 Ca 0.00 -0.31 0.00 0.00 1.08 0.00 0.00 64.86 65.63 2yuu h ILE 60 Cb 0.38 0.14 0.00 0.00 -1.09 0.00 0.00 36.82 36.25 2yuu h ILE 60 CO 0.00 0.17 0.00 0.47 -1.08 0.00 0.00 178.15 177.71 2yuu n ASP 61 N -4.63 0.00 -0.05 2.19 8.00 -1.11 -2.88 116.55 118.07 2yuu n ASP 61 Ca 0.07 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.74 2yuu n ASP 61 Cb 0.06 -0.02 -0.14 0.00 -0.02 0.00 0.00 41.12 41.00 2yuu n ASP 61 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2yuu n LYS 62 N -1.02 0.84 -1.44 -1.24 4.76 -0.01 -5.00 118.16 115.04 2yuu n LYS 62 Ca 0.21 -0.09 -0.41 0.00 -2.87 0.00 0.00 58.31 55.14 2yuu n LYS 62 Cb 0.10 -1.46 0.01 0.00 -1.84 0.00 0.00 35.03 31.85 2yuu n LYS 62 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2yuu n ILE 63 N -2.41 1.70 -3.57 -0.18 5.41 -0.52 -4.99 119.36 114.80 2yuu n ILE 63 Ca -0.16 -0.50 -0.24 0.00 1.00 0.00 0.00 62.75 62.84 2yuu n ILE 63 Cb 0.79 -0.51 -0.16 0.00 -0.71 0.00 0.00 39.64 39.05 2yuu n ILE 63 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2yuu s ILE 64 N -1.50 -0.15 0.00 1.39 1.01 -1.26 -5.06 121.20 115.63 2yuu s ILE 64 Ca 0.63 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 61.04 2yuu s ILE 64 Cb -0.60 -0.66 0.00 0.00 0.01 0.00 0.00 42.46 41.22 2yuu s ILE 64 CO 0.58 -0.33 0.00 0.61 0.00 0.00 0.00 174.94 175.81 2yuu n GLY 65 N 5.29 0.51 3.47 6.18 0.00 -1.26 -5.12 105.19 114.25 2yuu n GLY 65 Ca -0.06 -1.20 -0.11 0.00 0.00 0.00 0.00 46.02 44.65 2yuu n GLY 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yuu s ARG 66 N -1.28 1.51 0.16 1.61 0.52 -1.26 -4.81 118.95 115.40 2yuu s ARG 66 Ca 0.00 -1.44 -0.20 0.00 -0.52 0.00 0.00 55.73 53.58 2yuu s ARG 66 Cb 0.00 0.41 -0.08 0.00 0.52 0.00 0.00 34.95 35.81 2yuu s ARG 66 CO 0.00 -0.60 0.67 0.00 0.02 0.00 0.00 175.30 175.39 2yuu h THR 68 N 3.07 1.34 0.00 0.00 1.03 -1.96 -3.49 112.91 112.90 2yuu h THR 68 Ca -0.48 -2.60 0.00 0.00 -0.01 0.00 0.00 66.41 63.32 2yuu h THR 68 Cb 1.20 2.73 0.00 0.00 -1.07 0.00 0.00 68.15 71.01 2yuu h THR 68 CO 0.65 0.78 0.00 0.61 -0.01 0.00 0.00 175.52 177.55 2yuu n GLY 69 N 1.36 1.50 3.35 2.99 0.00 -1.26 -5.02 105.19 108.11 2yuu n GLY 69 Ca -0.12 -0.83 -0.21 0.00 0.00 0.00 0.00 46.02 44.86 2yuu n GLY 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yuu s THR 70 N 0.00 1.87 -0.62 2.61 -4.23 -1.26 -2.70 115.64 111.31 2yuu s THR 70 Ca 0.00 -2.05 -0.01 0.00 -1.18 0.00 0.00 61.69 58.45 2yuu s THR 70 Cb 0.00 -1.95 0.45 0.00 1.34 0.00 0.00 72.50 72.34 2yuu s THR 70 CO 0.00 -0.40 1.92 0.00 -0.54 0.00 0.00 174.62 175.60 2yuu n ALA 71 N 0.01 6.17 -3.52 3.99 0.00 -1.26 -4.95 120.51 120.95 2yuu n ALA 71 Ca -0.11 -3.56 -0.11 0.00 0.00 0.00 0.00 53.44 49.66 2yuu n ALA 71 Cb 0.58 -1.58 -0.02 0.00 0.00 0.00 0.00 19.45 18.43 2yuu n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yuu s ALA 72 N -3.81 -1.51 -0.53 0.00 0.00 -1.26 -5.10 121.76 109.55 2yuu s ALA 72 Ca 0.62 0.30 -0.34 0.00 0.00 0.00 0.00 51.96 52.55 2yuu s ALA 72 Cb 0.49 0.88 -0.14 0.00 0.00 0.00 0.00 23.12 24.35 2yuu s ALA 72 CO -0.03 -0.83 2.33 -1.71 0.00 0.00 0.00 175.76 175.52 2yuu n ASN 73 N -0.40 1.60 -4.23 0.00 5.15 -1.26 -4.90 115.26 111.22 2yuu n ASN 73 Ca -0.14 0.24 -0.13 0.00 -0.60 0.00 0.00 54.58 53.95 2yuu n ASN 73 Cb 0.64 -1.20 -0.10 0.00 -0.53 0.00 0.00 39.78 38.59 2yuu n ASN 73 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2yuu s SER 74 N 8.35 1.42 -0.22 1.20 0.15 -1.26 -5.14 113.70 118.19 2yuu s SER 74 Ca 1.15 -1.07 -0.03 0.00 0.70 0.00 0.00 55.95 56.70 2yuu s SER 74 Cb -0.91 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 63.47 2yuu s SER 74 CO 0.47 -0.46 -0.06 -0.60 1.20 0.00 0.00 173.24 173.79 2yuu s ARG 75 N -3.83 3.23 0.12 5.44 3.00 -1.26 -5.10 118.95 120.55 2yuu s ARG 75 Ca 0.18 -0.71 -0.20 0.00 -1.00 0.00 0.00 55.73 53.99 2yuu s ARG 75 Cb 0.05 -2.96 -0.07 0.00 0.00 0.00 0.00 34.95 31.97 2yuu s ARG 75 CO 0.00 -0.24 0.63 0.16 0.00 0.00 0.00 175.30 175.85 2yuu s ASP 76 N 1.43 7.10 0.00 -2.12 -4.77 -1.26 -4.96 116.67 112.09 2yuu s ASP 76 Ca 0.05 1.34 0.00 0.00 -3.30 0.00 0.00 52.55 50.64 2yuu s ASP 76 Cb -0.15 -2.39 0.00 0.00 -1.09 0.00 0.00 42.92 39.30 2yuu s ASP 76 CO -0.05 0.21 0.00 1.07 0.70 0.00 0.00 175.17 177.10 2yuu n THR 77 N 1.45 0.00 -1.68 2.11 5.66 -1.26 -5.03 114.28 115.53 2yuu n THR 77 Ca -0.08 0.00 -0.44 0.00 -3.05 0.00 0.00 64.05 60.48 2yuu n THR 77 Cb 0.50 0.34 -0.04 0.00 -1.55 0.00 0.00 70.33 69.59 2yuu n THR 77 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2yuu n SER 78 N -1.50 3.82 -2.78 1.09 7.64 -1.26 -4.92 113.62 115.72 2yuu n SER 78 Ca 0.00 0.99 -0.01 0.00 1.01 0.00 0.00 58.87 60.85 2yuu n SER 78 Cb 0.05 -1.50 0.02 0.00 -1.01 0.00 0.00 64.21 61.77 2yuu n SER 78 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yuu s GLY 79 N 2.90 -1.62 1.21 0.23 0.00 -1.26 -5.17 107.32 103.61 2yuu s GLY 79 Ca 0.84 0.56 -0.19 0.00 0.00 0.00 0.00 44.72 45.93 2yuu s GLY 79 CO 0.40 4.11 1.11 2.56 0.00 0.00 0.00 173.10 181.29 2yuu s PRO 80 N 1.35 -1.29 -0.28 2.90 0.04 -1.26 -5.09 135.00 131.36 2yuu s PRO 80 Ca 0.21 -0.09 -0.16 0.00 0.04 0.00 0.00 61.00 61.00 2yuu s PRO 80 Cb 0.06 -1.59 0.08 0.00 0.04 0.00 0.00 34.50 33.09 2yuu s PRO 80 CO -0.10 -3.75 0.70 -1.12 0.04 0.00 0.00 177.00 172.76 2yuu s SER 81 N -3.91 -0.93 -0.06 6.66 0.01 -1.26 -5.17 113.70 109.04 2yuu s SER 81 Ca 0.71 1.49 -0.29 0.00 1.31 0.00 0.00 55.95 59.17 2yuu s SER 81 Cb -0.09 1.38 0.11 0.00 0.21 0.00 0.00 66.02 67.63 2yuu s SER 81 CO 0.56 -0.24 0.92 -0.94 0.41 0.00 0.00 173.24 173.96 2yuu s SER 82 N 1.60 -0.37 0.00 2.44 1.04 -1.26 -5.38 113.70 111.77 2yuu s SER 82 Ca -0.10 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2yuu s SER 82 Cb -0.05 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2yuu s SER 82 CO -0.19 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.11