#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 1.29 -0.19 1.61 0.15 -1.26 -5.01 113.70 110.30 2yuu s SER 2 Ca 0.00 1.35 -0.05 0.00 0.70 0.00 0.00 55.95 57.95 2yuu s SER 2 Cb 0.00 -2.11 -0.10 0.00 -1.71 0.00 0.00 66.02 62.10 2yuu s SER 2 CO 0.00 -3.98 -0.21 -1.54 1.20 0.00 0.00 173.24 168.70 2yuu n SER 3 N -4.76 1.86 -3.61 5.45 3.41 -1.26 -5.10 113.62 109.62 2yuu n SER 3 Ca 0.03 0.10 -0.03 0.00 -0.26 0.00 0.00 58.87 58.71 2yuu n SER 3 Cb 0.55 -0.46 -0.02 0.00 -0.26 0.00 0.00 64.21 64.03 2yuu n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2yuu s GLY 4 N -5.52 -0.28 -0.07 5.00 0.00 -1.26 -5.16 107.32 100.03 2yuu s GLY 4 Ca -0.26 1.61 -0.02 0.00 0.00 0.00 0.00 44.72 46.05 2yuu s GLY 4 CO 0.37 0.53 0.04 -0.56 0.00 0.00 0.00 173.10 173.48 2yuu s SER 5 N -2.21 5.50 -0.24 1.64 0.01 -1.26 -5.08 113.70 112.06 2yuu s SER 5 Ca 0.10 0.19 -0.24 0.00 1.31 0.00 0.00 55.95 57.32 2yuu s SER 5 Cb -0.00 -1.60 -0.01 0.00 0.21 0.00 0.00 66.02 64.62 2yuu s SER 5 CO -0.04 0.36 0.79 -0.94 0.41 0.00 0.00 173.24 173.82 2yuu s SER 6 N -1.09 6.78 0.14 2.44 1.04 -1.26 -5.05 113.70 116.71 2yuu s SER 6 Ca 0.15 0.97 0.05 0.00 0.48 0.00 0.00 55.95 57.60 2yuu s SER 6 Cb -0.12 -2.41 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 2yuu s SER 6 CO 0.05 -0.48 0.11 -0.83 0.98 0.00 0.00 173.24 173.06 2yuu s GLY 7 N 1.36 1.79 -0.65 7.32 0.00 -1.26 -5.07 107.32 110.81 2yuu s GLY 7 Ca 0.33 -1.18 -0.19 0.00 0.00 0.00 0.00 44.72 43.68 2yuu s GLY 7 CO 0.08 -1.18 0.78 0.54 0.00 0.00 0.00 173.10 173.32 2yuu s LYS 8 N -2.89 3.14 -0.06 2.90 1.02 -1.26 -5.03 119.74 117.56 2yuu s LYS 8 Ca 0.30 -1.38 0.04 0.00 0.02 0.00 0.00 55.97 54.95 2yuu s LYS 8 Cb -0.11 -4.34 -0.02 0.00 -0.52 0.00 0.00 37.83 32.85 2yuu s LYS 8 CO 0.22 -1.59 -0.16 1.14 -0.92 0.00 0.00 175.35 174.04 2yuu s GLN 9 N 2.71 2.62 0.18 1.68 -2.07 -1.26 -5.11 119.66 118.41 2yuu s GLN 9 Ca 0.15 -0.74 -0.24 0.00 -1.82 0.00 0.00 55.36 52.72 2yuu s GLN 9 Cb -0.20 -2.37 0.06 0.00 -1.09 0.00 0.00 33.01 29.41 2yuu s GLN 9 CO 0.04 0.52 0.96 0.00 -1.32 0.00 0.00 175.29 175.49 2yuu s ALA 10 N -0.48 -1.56 -0.09 2.60 0.00 -1.26 -5.16 121.76 115.80 2yuu s ALA 10 Ca 0.06 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 51.99 2yuu s ALA 10 Cb -0.12 0.68 0.01 0.00 0.00 0.00 0.00 23.12 23.69 2yuu s ALA 10 CO 0.02 -1.05 -0.19 0.21 0.00 0.00 0.00 175.76 174.75 2yuu s LYS 11 N -2.98 2.52 0.02 0.00 2.20 -1.26 -5.13 119.74 115.10 2yuu s LYS 11 Ca 0.15 -0.69 0.08 0.00 -0.36 0.00 0.00 55.97 55.14 2yuu s LYS 11 Cb -0.02 -1.96 -0.03 0.00 -1.51 0.00 0.00 37.83 34.31 2yuu s LYS 11 CO 0.04 0.10 -0.22 0.42 -0.36 0.00 0.00 175.35 175.32 2yuu s ILE 12 N 0.53 2.42 -0.48 5.43 1.01 -1.26 -4.35 121.20 124.50 2yuu s ILE 12 Ca -0.16 -1.17 -0.13 0.00 0.00 0.00 0.00 60.65 59.19 2yuu s ILE 12 Cb -0.17 -1.94 0.10 0.00 0.01 0.00 0.00 42.46 40.46 2yuu s ILE 12 CO 0.06 0.44 0.38 -1.00 0.00 0.00 0.00 174.94 174.82 2yuu s HIS 13 N -0.78 3.31 -0.61 3.97 3.76 -0.95 -4.97 115.29 119.01 2yuu s HIS 13 Ca 0.12 -1.37 -0.06 0.00 -0.15 0.00 0.00 55.06 53.59 2yuu s HIS 13 Cb -0.10 -3.37 -0.15 0.00 1.11 0.00 0.00 32.58 30.07 2yuu s HIS 13 CO 0.02 -0.91 2.84 0.66 -0.85 0.00 0.00 174.74 176.50 2yuu n TYR 14 N 5.09 0.91 -3.33 1.40 4.01 -1.25 -3.42 117.16 120.57 2yuu n TYR 14 Ca -0.11 -1.87 -0.38 0.00 -0.16 0.00 0.00 57.90 55.37 2yuu n TYR 14 Cb 0.42 -1.73 -0.06 0.00 -0.31 0.00 0.00 39.34 37.65 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 1.98 4.89 -0.61 -0.72 1.09 -1.24 -4.06 121.20 122.52 2yuu s ILE 15 Ca 0.56 1.09 0.00 0.00 -1.10 0.00 0.00 60.65 61.19 2yuu s ILE 15 Cb 0.21 -3.84 0.00 0.00 -1.06 0.00 0.00 42.46 37.77 2yuu s ILE 15 CO -0.02 0.52 0.00 0.29 -0.10 0.00 0.00 174.94 175.63 2yuu n LYS 16 N 2.07 -2.25 -2.52 2.79 4.76 -1.26 0.14 118.16 121.88 2yuu n LYS 16 Ca -0.11 0.35 -0.09 0.00 -2.87 0.00 0.00 58.31 55.59 2yuu n LYS 16 Cb 0.51 -4.80 0.01 0.00 -1.84 0.00 0.00 35.03 28.91 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 -1.24 -3.37 -4.83 4.39 4.05 -1.26 -2.41 115.26 110.59 2yuu n ASN 17 Ca -0.08 -0.11 -0.28 0.00 0.45 0.00 0.00 54.58 54.57 2yuu n ASN 17 Cb 0.48 -2.33 -0.04 0.00 1.23 0.00 0.00 39.78 39.12 2yuu n ASN 17 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 2yuu s HIS 18 N -2.75 1.88 -0.15 1.20 3.76 0.37 -3.69 115.29 115.91 2yuu s HIS 18 Ca 0.11 -0.83 0.15 0.00 -0.15 0.00 0.00 55.06 54.34 2yuu s HIS 18 Cb -0.05 -1.83 0.41 0.00 1.11 0.00 0.00 32.58 32.23 2yuu s HIS 18 CO 0.14 -0.13 1.20 0.39 -0.85 0.00 0.00 174.74 175.49 2yuu n GLU 19 N -1.51 1.16 -1.30 1.40 1.02 -1.25 -3.66 120.64 116.50 2yuu n GLU 19 Ca -0.07 -2.93 -0.57 0.00 -0.02 0.00 0.00 57.16 53.57 2yuu n GLU 19 Cb 0.65 -1.19 -0.11 0.00 -0.02 0.00 0.00 31.44 30.77 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 -0.70 1.19 -4.05 -0.32 3.72 -1.22 -3.83 117.46 112.24 2yuu n PHE 20 Ca 0.15 0.67 -0.35 0.00 -0.05 0.00 0.00 57.45 57.87 2yuu n PHE 20 Cb 0.81 -2.33 -0.13 0.00 -0.94 0.00 0.00 39.48 36.89 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 6.44 3.96 -0.34 4.37 1.01 -0.22 -2.25 121.20 134.17 2yuu s ILE 21 Ca 1.19 -0.31 -0.44 0.00 0.00 0.00 0.00 60.65 61.09 2yuu s ILE 21 Cb -1.38 -2.79 -0.19 0.00 0.01 0.00 0.00 42.46 38.10 2yuu s ILE 21 CO 0.62 0.42 1.48 0.00 0.00 0.00 0.00 174.94 177.46 2yuu n ALA 22 N 4.29 -1.77 -3.16 9.38 0.00 -1.26 -3.40 120.51 124.59 2yuu n ALA 22 Ca -0.17 0.51 -0.12 0.00 0.00 0.00 0.00 53.44 53.66 2yuu n ALA 22 Cb 0.52 -1.92 -0.10 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 2.25 0.05 -0.28 0.00 -1.32 -1.23 -4.95 115.64 110.16 2yuu s THR 23 Ca 1.00 -0.40 -0.12 0.00 -1.21 0.00 0.00 61.69 60.96 2yuu s THR 23 Cb -1.38 -0.48 -0.04 0.00 -1.51 0.00 0.00 72.50 69.09 2yuu s THR 23 CO 0.73 -0.22 0.25 0.12 -2.21 0.00 0.00 174.62 173.29 2yuu s PHE 24 N -0.89 3.23 -0.99 9.09 5.36 -1.26 -2.69 117.98 129.83 2yuu s PHE 24 Ca -0.10 0.21 -0.12 0.00 -0.96 0.00 0.00 56.93 55.96 2yuu s PHE 24 Cb -0.05 -2.45 0.24 0.00 -0.34 0.00 0.00 43.02 40.42 2yuu s PHE 24 CO 0.02 -0.19 0.98 -0.06 -1.46 0.00 0.00 175.22 174.51 2yuu s PHE 25 N 1.86 3.97 0.65 10.12 0.40 -1.26 -4.88 117.98 128.84 2yuu s PHE 25 Ca 0.10 -2.31 0.19 0.00 -0.60 0.00 0.00 56.93 54.31 2yuu s PHE 25 Cb -0.16 -3.88 0.98 0.00 0.51 0.00 0.00 43.02 40.47 2yuu s PHE 25 CO 0.11 -1.02 1.53 0.78 0.70 0.00 0.00 175.22 177.32 2yuu h GLY 26 N 7.47 0.00 -3.59 4.36 0.00 -1.95 -3.39 103.07 105.96 2yuu h GLY 26 Ca 0.16 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.83 2yuu h GLY 26 CO 0.92 0.00 -0.78 -0.86 0.00 0.00 0.00 176.54 175.82 2yuu s GLN 27 N -4.19 1.80 -1.16 4.80 -2.07 -1.26 -5.04 119.66 112.53 2yuu s GLN 27 Ca -0.02 -1.32 -0.23 0.00 -1.82 0.00 0.00 55.36 51.97 2yuu s GLN 27 Cb 0.08 -2.05 -0.08 0.00 -1.09 0.00 0.00 33.01 29.86 2yuu s GLN 27 CO 0.25 0.44 1.94 -1.25 -1.32 0.00 0.00 175.29 175.35 2yuu s PRO 28 N -2.54 2.50 0.92 9.60 0.04 -1.26 -4.83 135.00 139.43 2yuu s PRO 28 Ca 0.21 -1.10 -0.11 0.00 0.04 0.00 0.00 61.00 60.04 2yuu s PRO 28 Cb -0.09 -5.23 0.14 0.00 0.04 0.00 0.00 34.50 29.36 2yuu s PRO 28 CO 0.12 -3.94 1.10 0.99 0.04 0.00 0.00 177.00 175.31 2yuu s THR 29 N 10.95 2.55 -0.47 1.26 2.01 -1.25 -4.39 115.64 126.31 2yuu s THR 29 Ca 0.68 0.18 -0.22 0.00 0.31 0.00 0.00 61.69 62.65 2yuu s THR 29 Cb -0.01 -2.49 0.03 0.00 0.01 0.00 0.00 72.50 70.04 2yuu s THR 29 CO 0.12 -0.23 0.74 0.12 -0.69 0.00 0.00 174.62 174.68 2yuu s PHE 30 N -2.79 2.99 0.91 4.92 5.36 -1.26 -1.95 117.98 126.17 2yuu s PHE 30 Ca 0.64 -0.04 -0.11 0.00 -0.96 0.00 0.00 56.93 56.47 2yuu s PHE 30 Cb -0.20 -3.61 0.14 0.00 -0.34 0.00 0.00 43.02 39.02 2yuu s PHE 30 CO 0.58 -1.01 1.11 0.00 -1.46 0.00 0.00 175.22 174.44 2yuu n SER 32 N -4.11 2.19 0.00 0.00 2.88 -1.18 -3.51 113.62 109.88 2yuu n SER 32 Ca 0.09 -0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 2yuu n SER 32 Cb 0.53 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 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 -3.30 0.00 -0.02 2.46 0.31 -1.26 -4.28 118.33 112.24 2yuu n VAL 33 Ca -0.40 1.27 -0.09 0.00 -0.01 0.00 0.00 64.34 65.11 2yuu n VAL 33 Cb 0.90 -2.26 -0.14 0.00 -0.91 0.00 0.00 33.84 31.43 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 -3.08 -3.74 -5.02 0.00 5.02 -1.23 -5.01 118.16 105.10 2yuu n LYS 35 Ca -0.17 0.54 -0.28 0.00 -2.02 0.00 0.00 58.31 56.37 2yuu n LYS 35 Cb 1.05 -4.56 -0.16 0.00 -0.02 0.00 0.00 35.03 31.34 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 -3.76 2.51 -0.69 4.39 1.11 -1.26 -4.73 116.67 114.25 2yuu s ASP 36 Ca 0.05 -0.40 -0.22 0.00 0.18 0.00 0.00 52.55 52.15 2yuu s ASP 36 Cb -0.01 -0.53 -0.15 0.00 1.07 0.00 0.00 42.92 43.30 2yuu s ASP 36 CO 0.46 0.22 1.87 0.49 1.18 0.00 0.00 175.17 179.39 2yuu n PHE 37 N 2.86 0.40 -2.18 4.23 3.72 -1.26 -4.24 117.46 121.00 2yuu n PHE 37 Ca -0.17 0.27 -0.33 0.00 -0.05 0.00 0.00 57.45 57.17 2yuu n PHE 37 Cb 0.53 -1.66 -0.04 0.00 -0.94 0.00 0.00 39.48 37.37 2yuu n PHE 37 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2yuu n VAL 38 N 5.21 2.55 -3.61 -4.37 0.31 -0.82 -4.83 118.33 112.77 2yuu n VAL 38 Ca 0.46 -2.63 -0.15 0.00 -0.01 0.00 0.00 64.34 62.01 2yuu n VAL 38 Cb 0.02 -2.24 -0.07 0.00 -0.91 0.00 0.00 33.84 30.64 2yuu n VAL 38 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 2yuu s TRP 39 N 8.65 -0.72 0.00 3.52 -0.11 -1.26 -3.77 118.94 125.25 2yuu s TRP 39 Ca 0.63 1.64 0.00 0.00 1.22 0.00 0.00 56.10 59.59 2yuu s TRP 39 Cb 0.02 0.30 0.00 0.00 -1.50 0.00 0.00 33.47 32.28 2yuu s TRP 39 CO 0.12 -0.43 0.00 0.41 -4.62 0.00 0.00 176.95 172.42 2yuu n GLY 40 N 2.20 2.82 3.57 5.86 0.00 -1.26 -5.05 105.19 113.33 2yuu n GLY 40 Ca -0.15 -0.75 -0.39 0.00 0.00 0.00 0.00 46.02 44.72 2yuu n GLY 40 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2yuu s LEU 41 N 0.00 3.39 0.10 0.99 2.96 -1.26 -4.87 118.68 119.99 2yuu s LEU 41 Ca 0.00 0.93 -0.19 0.00 -0.22 0.00 0.00 54.13 54.65 2yuu s LEU 41 Cb 0.00 -2.84 -0.04 0.00 0.50 0.00 0.00 46.19 43.81 2yuu s LEU 41 CO 0.00 -2.35 1.13 -3.20 -1.32 0.00 0.00 176.35 170.61 2yuu n ASN 42 N 13.09 -0.65 -4.40 3.68 2.85 -1.26 -4.31 115.26 124.25 2yuu n ASN 42 Ca 0.27 1.28 -0.61 0.00 -0.11 0.00 0.00 54.58 55.41 2yuu n ASN 42 Cb 0.51 -0.23 -0.11 0.00 1.24 0.00 0.00 39.78 41.19 2yuu n ASN 42 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 2yuu n LYS 43 N -4.50 0.18 -0.82 1.20 4.81 -1.26 -4.85 118.16 112.93 2yuu n LYS 43 Ca 0.01 0.06 -0.35 0.00 -0.87 0.00 0.00 58.31 57.16 2yuu n LYS 43 Cb 0.16 -1.64 0.10 0.00 0.02 0.00 0.00 35.03 33.68 2yuu n LYS 43 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2yuu n GLN 44 N 6.72 -0.88 0.00 1.64 10.64 -1.26 -4.97 117.38 129.26 2yuu n GLN 44 Ca 0.47 -0.25 0.00 0.00 -1.83 0.00 0.00 57.00 55.39 2yuu n GLN 44 Cb -0.01 -1.36 0.00 0.00 -0.86 0.00 0.00 30.24 28.02 2yuu n GLN 44 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2yuu n GLY 45 N 2.74 2.82 2.95 2.61 0.00 -1.10 -4.73 105.19 110.49 2yuu n GLY 45 Ca -0.01 -1.80 -0.15 0.00 0.00 0.00 0.00 46.02 44.07 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 3.63 0.39 -0.12 1.61 2.02 -0.73 -3.48 117.35 120.67 2yuu s TYR 46 Ca 0.00 -0.12 -0.05 0.00 -0.37 0.00 0.00 57.07 56.54 2yuu s TYR 46 Cb 0.00 -0.25 0.06 0.00 -0.40 0.00 0.00 41.96 41.37 2yuu s TYR 46 CO 0.00 -0.02 0.24 0.21 -1.57 0.00 0.00 175.55 174.41 2yuu s LYS 47 N -0.26 0.14 -0.13 -0.62 2.20 -1.22 -0.09 119.74 119.76 2yuu s LYS 47 Ca 0.00 0.68 -0.29 0.00 -0.36 0.00 0.00 55.97 55.99 2yuu s LYS 47 Cb -0.03 -0.09 -0.03 0.00 -1.51 0.00 0.00 37.83 36.18 2yuu s LYS 47 CO -0.00 -0.26 1.46 0.00 -0.36 0.00 0.00 175.35 176.18 2yuu n ARG 49 N 6.95 1.08 -0.04 0.00 1.85 -1.25 -0.29 116.66 124.95 2yuu n ARG 49 Ca 0.16 -0.08 -0.10 0.00 -1.00 0.00 0.00 57.85 56.82 2yuu n ARG 49 Cb 0.44 -1.25 -0.03 0.00 -1.05 0.00 0.00 32.46 30.57 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 -0.23 0.23 -0.00 2.89 1.13 -1.26 -4.79 117.38 115.34 2yuu n GLN 50 Ca 0.01 0.10 0.07 0.00 -1.94 0.00 0.00 57.00 55.23 2yuu n GLN 50 Cb 0.14 -0.88 -0.09 0.00 0.11 0.00 0.00 30.24 29.51 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 -1.60 -2.75 -4.14 0.00 3.02 0.60 -4.99 115.26 105.40 2yuu n ASN 52 Ca 0.00 -0.21 -0.37 0.00 -0.03 0.00 0.00 54.58 53.97 2yuu n ASN 52 Cb 0.28 -2.00 -0.10 0.00 -0.61 0.00 0.00 39.78 37.35 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 -3.12 3.29 -0.11 5.41 0.00 -1.22 -4.85 121.76 121.16 2yuu s ALA 53 Ca 0.07 -2.67 -0.25 0.00 0.00 0.00 0.00 51.96 49.11 2yuu s ALA 53 Cb -0.01 -2.56 -0.02 0.00 0.00 0.00 0.00 23.12 20.53 2yuu s ALA 53 CO 0.24 -1.88 0.81 0.00 0.00 0.00 0.00 175.76 174.92 2yuu s ALA 54 N 0.97 3.40 0.31 0.00 0.00 -1.26 -2.56 121.76 122.62 2yuu s ALA 54 Ca 0.09 0.15 0.05 0.00 0.00 0.00 0.00 51.96 52.25 2yuu s ALA 54 Cb -0.23 -3.15 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 2yuu s ALA 54 CO -0.03 -0.39 0.29 0.96 0.00 0.00 0.00 175.76 176.58 2yuu s ILE 55 N 1.50 0.00 0.41 0.00 -4.36 0.87 -3.12 121.20 116.50 2yuu s ILE 55 Ca 0.40 -1.93 -0.12 0.00 -0.26 0.00 0.00 60.65 58.74 2yuu s ILE 55 Cb -0.18 -2.52 -0.07 0.00 1.25 0.00 0.00 42.46 40.95 2yuu s ILE 55 CO 0.17 0.00 0.80 -1.00 0.24 0.00 0.00 174.94 175.15 2yuu s HIS 56 N -3.50 3.45 0.61 1.37 3.76 -1.26 -1.77 115.29 117.95 2yuu s HIS 56 Ca 0.39 1.13 0.30 0.00 -0.15 0.00 0.00 55.06 56.74 2yuu s HIS 56 Cb 0.03 -2.51 1.72 0.00 1.11 0.00 0.00 32.58 32.92 2yuu s HIS 56 CO 0.24 -0.12 2.09 -0.22 -0.85 0.00 0.00 174.74 175.88 2yuu h LYS 57 N 1.33 0.00 0.00 1.40 3.64 -1.89 -0.32 116.57 120.74 2yuu h LYS 57 Ca -0.47 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 58.59 2yuu h LYS 57 Cb 1.19 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.95 2yuu h LYS 57 CO 0.64 0.00 -1.96 0.36 -2.27 0.00 0.00 179.45 176.21 2yuu n LYS 58 N -3.62 0.65 0.19 1.90 2.85 -1.26 -4.03 118.16 114.84 2yuu n LYS 58 Ca 0.01 0.17 0.14 0.00 -1.05 0.00 0.00 58.31 57.59 2yuu n LYS 58 Cb 0.33 -1.69 0.63 0.00 -0.65 0.00 0.00 35.03 33.65 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 1.17 -0.07 0.00 2.10 -1.57 -0.00 117.51 119.14 2yuu h ILE 60 Ca 0.00 -0.47 0.00 0.00 1.08 0.00 0.00 64.86 65.47 2yuu h ILE 60 Cb 0.30 0.52 0.00 0.00 -1.09 0.00 0.00 36.82 36.55 2yuu h ILE 60 CO 0.00 0.19 0.00 0.47 -1.08 0.00 0.00 178.15 177.73 2yuu n ASP 61 N -4.38 0.79 -0.06 2.19 8.00 -1.03 -3.58 116.55 118.48 2yuu n ASP 61 Ca 0.04 -1.52 -0.06 0.00 0.71 0.00 0.00 54.79 53.95 2yuu n ASP 61 Cb 0.12 -0.04 -0.08 0.00 -0.02 0.00 0.00 41.12 41.09 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 -0.28 1.87 -0.96 -1.24 4.76 -0.16 -5.03 118.16 117.12 2yuu n LYS 62 Ca 0.16 0.01 -0.33 0.00 -2.87 0.00 0.00 58.31 55.28 2yuu n LYS 62 Cb 0.20 -1.29 -0.02 0.00 -1.84 0.00 0.00 35.03 32.08 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 -2.50 1.37 -4.00 -0.18 5.41 -0.35 -4.94 119.36 114.17 2yuu n ILE 63 Ca -0.19 -0.34 -0.31 0.00 1.00 0.00 0.00 62.75 62.91 2yuu n ILE 63 Cb 0.85 0.00 -0.16 0.00 -0.71 0.00 0.00 39.64 39.62 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 -0.68 1.68 0.00 1.39 1.09 -1.26 -5.06 121.20 118.35 2yuu s ILE 64 Ca 0.44 -1.02 0.00 0.00 -1.10 0.00 0.00 60.65 58.97 2yuu s ILE 64 Cb -0.64 -1.74 0.00 0.00 -1.06 0.00 0.00 42.46 39.02 2yuu s ILE 64 CO 0.38 0.19 0.00 0.61 -0.10 0.00 0.00 174.94 176.02 2yuu n GLY 65 N 4.67 1.13 4.01 6.18 0.00 -1.26 -5.08 105.19 114.84 2yuu n GLY 65 Ca -0.15 -2.19 -0.22 0.00 0.00 0.00 0.00 46.02 43.46 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 -1.33 1.90 0.43 1.61 3.00 -1.26 -4.81 118.95 118.49 2yuu s ARG 66 Ca 0.00 -1.37 -0.19 0.00 0.00 0.00 0.00 55.73 54.17 2yuu s ARG 66 Cb 0.00 -2.46 -0.10 0.00 0.00 0.00 0.00 34.95 32.39 2yuu s ARG 66 CO 0.00 -1.24 0.92 0.00 0.00 0.00 0.00 175.30 174.99 2yuu n THR 68 N -0.79 1.63 -2.45 0.00 5.66 -1.26 -4.80 114.28 112.26 2yuu n THR 68 Ca 0.06 -2.46 -0.27 0.00 -3.05 0.00 0.00 64.05 58.33 2yuu n THR 68 Cb 0.54 0.02 0.00 0.00 -1.55 0.00 0.00 70.33 69.34 2yuu n THR 68 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2yuu n GLY 69 N -0.84 6.00 3.33 1.09 0.00 -1.26 -4.91 105.19 108.59 2yuu n GLY 69 Ca 0.15 -2.76 -0.11 0.00 0.00 0.00 0.00 46.02 43.30 2yuu n GLY 69 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2yuu s THR 70 N -5.51 0.06 -0.17 2.61 -1.32 -1.26 -4.47 115.64 105.57 2yuu s THR 70 Ca 0.48 -0.50 -0.06 0.00 -1.21 0.00 0.00 61.69 60.40 2yuu s THR 70 Cb 0.40 -1.10 -0.24 0.00 -1.51 0.00 0.00 72.50 70.06 2yuu s THR 70 CO -0.20 -0.27 3.44 0.00 -2.21 0.00 0.00 174.62 175.38 2yuu n ALA 71 N -0.02 6.30 -0.09 11.08 0.00 -1.26 -4.57 120.51 131.94 2yuu n ALA 71 Ca -0.17 -1.94 -0.06 0.00 0.00 0.00 0.00 53.44 51.27 2yuu n ALA 71 Cb 0.63 -2.43 0.01 0.00 0.00 0.00 0.00 19.45 17.66 2yuu n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yuu h ALA 72 N 3.33 0.33 -1.41 0.00 0.00 -1.95 -3.42 119.26 116.14 2yuu h ALA 72 Ca 0.25 0.07 -0.50 0.00 0.00 0.00 0.00 54.91 54.73 2yuu h ALA 72 Cb 1.33 0.09 0.25 0.00 0.00 0.00 0.00 17.79 19.46 2yuu h ALA 72 CO 0.40 -0.35 -2.08 0.27 0.00 0.00 0.00 179.25 177.49 2yuu n ASN 73 N -5.10 -3.37 -0.27 0.00 2.04 -1.26 -4.70 115.26 102.60 2yuu n ASN 73 Ca 0.01 0.03 0.02 0.00 -0.44 0.00 0.00 54.58 54.19 2yuu n ASN 73 Cb 0.15 -0.69 0.07 0.00 -2.53 0.00 0.00 39.78 36.77 2yuu n ASN 73 CO 0.00 0.00 0.00 -0.24 -0.44 0.00 0.00 177.26 176.58 2yuu n SER 74 N 2.05 -0.36 -3.85 0.53 2.88 -1.26 -4.51 113.62 109.09 2yuu n SER 74 Ca -0.01 1.25 -0.37 0.00 -1.33 0.00 0.00 58.87 58.41 2yuu n SER 74 Cb 0.68 -0.33 -0.00 0.00 -0.75 0.00 0.00 64.21 63.80 2yuu n SER 74 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2yuu n ARG 75 N -5.12 0.00 -3.92 -1.46 5.12 -1.26 -1.33 116.66 108.69 2yuu n ARG 75 Ca 0.10 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.72 2yuu n ARG 75 Cb 0.33 -0.90 0.02 0.00 -1.16 0.00 0.00 32.46 30.75 2yuu n ARG 75 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2yuu n ASP 76 N 2.11 -4.00 -3.39 0.55 2.03 -1.26 -4.69 116.55 107.90 2yuu n ASP 76 Ca 0.10 -0.82 -0.31 0.00 0.52 0.00 0.00 54.79 54.28 2yuu n ASP 76 Cb 0.36 -3.77 0.01 0.00 -0.72 0.00 0.00 41.12 37.01 2yuu n ASP 76 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2yuu n THR 77 N -4.60 0.00 -3.57 5.18 -2.24 -0.44 -4.99 114.28 103.62 2yuu n THR 77 Ca -0.02 -0.41 -0.10 0.00 -2.27 0.00 0.00 64.05 61.26 2yuu n THR 77 Cb 0.55 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.76 2yuu n THR 77 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2yuu s SER 78 N -0.81 -0.46 -0.46 3.42 0.15 -1.26 -5.11 113.70 109.17 2yuu s SER 78 Ca 0.43 -0.21 0.07 0.00 0.70 0.00 0.00 55.95 56.94 2yuu s SER 78 Cb -0.34 0.64 0.29 0.00 -1.71 0.00 0.00 66.02 64.90 2yuu s SER 78 CO 0.57 -1.09 0.99 0.61 1.20 0.00 0.00 173.24 175.52 2yuu n GLY 79 N -0.41 0.75 3.72 9.45 0.00 -1.26 -5.15 105.19 112.29 2yuu n GLY 79 Ca -0.12 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 2yuu n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yuu s PRO 80 N 0.14 1.24 -0.69 1.61 0.04 -1.26 -4.84 135.00 131.24 2yuu s PRO 80 Ca 0.27 0.82 -0.25 0.00 0.04 0.00 0.00 61.00 61.88 2yuu s PRO 80 Cb 0.27 -1.81 -0.13 0.00 0.04 0.00 0.00 34.50 32.87 2yuu s PRO 80 CO -0.12 -2.25 2.43 0.45 0.04 0.00 0.00 177.00 177.55 2yuu n SER 81 N -3.89 1.64 -4.85 6.66 2.88 -1.26 -4.90 113.62 109.91 2yuu n SER 81 Ca 0.07 -0.78 -0.27 0.00 -1.33 0.00 0.00 58.87 56.56 2yuu n SER 81 Cb 0.55 -1.47 -0.03 0.00 -0.75 0.00 0.00 64.21 62.52 2yuu n SER 81 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yuu s SER 82 N 10.55 4.54 0.00 -3.46 0.01 -1.26 -5.36 113.70 118.72 2yuu s SER 82 Ca 1.03 -1.26 0.12 0.00 1.31 0.00 0.00 55.95 57.15 2yuu s SER 82 Cb -0.32 0.23 0.10 0.00 0.21 0.00 0.00 66.02 66.23 2yuu s SER 82 CO 0.25 -0.94 0.89 0.61 0.41 0.00 0.00 173.24 174.45