#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuo n SER 2 N 0.00 0.79 -4.42 1.61 3.41 -1.26 -5.00 113.62 108.75 2yuo n SER 2 Ca 0.00 0.13 -0.51 0.00 -0.26 0.00 0.00 58.87 58.23 2yuo n SER 2 Cb 0.00 -0.22 -0.08 0.00 -0.26 0.00 0.00 64.21 63.65 2yuo n SER 2 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2yuo n SER 3 N -3.37 1.87 0.00 4.04 2.88 -1.26 -4.90 113.62 112.88 2yuo n SER 3 Ca 0.00 0.41 0.00 0.00 -1.33 0.00 0.00 58.87 57.95 2yuo n SER 3 Cb 0.11 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 62.36 2yuo n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yuo n GLY 4 N 6.67 0.66 3.11 0.46 0.00 -1.26 -4.91 105.19 109.93 2yuo n GLY 4 Ca 0.44 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.09 2yuo n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yuo n SER 5 N 0.00 -4.95 -0.12 1.61 7.64 -1.26 -4.94 113.62 111.60 2yuo n SER 5 Ca 0.00 0.34 -0.19 0.00 1.01 0.00 0.00 58.87 60.03 2yuo n SER 5 Cb 0.00 -0.83 -0.12 0.00 -1.01 0.00 0.00 64.21 62.25 2yuo n SER 5 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2yuo n SER 6 N 2.81 1.99 -0.42 6.43 3.41 -1.26 -5.11 113.62 121.47 2yuo n SER 6 Ca 0.02 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2yuo n SER 6 Cb 0.53 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 2yuo n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yuo n GLY 7 N 2.15 -3.68 2.41 5.00 0.00 -1.26 -5.11 105.19 104.69 2yuo n GLY 7 Ca -0.45 -0.83 -0.16 0.00 0.00 0.00 0.00 46.02 44.58 2yuo n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuo n ARG 8 N -0.14 0.42 -3.73 1.61 1.74 -1.26 -5.03 116.66 110.27 2yuo n ARG 8 Ca 0.00 -2.49 -0.12 0.00 -0.77 0.00 0.00 57.85 54.46 2yuo n ARG 8 Cb 0.00 1.81 -0.11 0.00 -1.02 0.00 0.00 32.46 33.14 2yuo n ARG 8 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2yuo s ARG 9 N -3.05 0.40 0.05 5.56 0.52 -1.26 -2.01 118.95 119.16 2yuo s ARG 9 Ca 0.25 0.58 0.06 0.00 -0.52 0.00 0.00 55.73 56.09 2yuo s ARG 9 Cb 0.01 0.12 -0.04 0.00 0.52 0.00 0.00 34.95 35.56 2yuo s ARG 9 CO 0.17 -0.09 -0.10 0.00 0.02 0.00 0.00 175.30 175.30 2yuo s ALA 10 N 0.61 2.90 -0.19 2.13 0.00 -0.12 -2.61 121.76 124.48 2yuo s ALA 10 Ca -0.03 -1.14 -0.06 0.00 0.00 0.00 0.00 51.96 50.73 2yuo s ALA 10 Cb -0.05 -0.96 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 2yuo s ALA 10 CO -0.04 0.62 0.02 0.21 0.00 0.00 0.00 175.76 176.57 2yuo s LYS 11 N -1.73 3.74 -0.26 0.00 2.36 0.76 -0.69 119.74 123.92 2yuo s LYS 11 Ca 0.18 -0.46 -0.29 0.00 -2.55 0.00 0.00 55.97 52.85 2yuo s LYS 11 Cb -0.11 -3.12 -0.01 0.00 -1.05 0.00 0.00 37.83 33.54 2yuo s LYS 11 CO 0.09 0.11 1.49 0.00 1.55 0.00 0.00 175.35 178.59 2yuo s ALA 12 N 0.76 3.29 -0.19 3.13 0.00 -0.19 0.57 121.76 129.14 2yuo s ALA 12 Ca 0.01 0.29 0.29 0.00 0.00 0.00 0.00 51.96 52.55 2yuo s ALA 12 Cb -0.14 -3.83 1.02 0.00 0.00 0.00 0.00 23.12 20.17 2yuo s ALA 12 CO 0.02 -1.92 1.84 -0.07 0.00 0.00 0.00 175.76 175.63 2yuo h LEU 13 N 11.44 0.00 0.00 0.00 3.38 -1.73 0.22 115.31 128.62 2yuo h LEU 13 Ca -0.30 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.56 2yuo h LEU 13 Cb 1.13 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 2yuo h LEU 13 CO 1.02 0.00 0.03 0.00 0.09 0.00 0.00 178.44 179.58 2yuo n LEU 14 N -2.89 0.00 -4.86 1.67 -0.00 -1.25 -4.69 117.00 104.99 2yuo n LEU 14 Ca 0.02 -1.75 -0.32 0.00 -0.00 0.00 0.00 56.01 53.96 2yuo n LEU 14 Cb 0.36 2.02 -0.06 0.00 -0.00 0.00 0.00 43.42 45.73 2yuo n LEU 14 CO 0.28 -0.48 0.35 1.51 -0.00 0.00 0.00 177.39 179.04 2yuo s ASP 15 N -2.36 6.71 -0.17 1.45 -4.77 -1.26 -3.11 116.67 113.16 2yuo s ASP 15 Ca 0.15 1.14 -0.07 0.00 -3.30 0.00 0.00 52.55 50.47 2yuo s ASP 15 Cb -0.02 -2.32 0.07 0.00 -1.09 0.00 0.00 42.92 39.57 2yuo s ASP 15 CO 0.11 -0.17 0.37 0.12 0.70 0.00 0.00 175.17 176.30 2yuo s PHE 16 N -1.94 -0.62 -0.55 2.11 5.36 0.95 -4.91 117.98 118.38 2yuo s PHE 16 Ca 0.52 1.28 -0.10 0.00 -0.96 0.00 0.00 56.93 57.66 2yuo s PHE 16 Cb -0.11 0.21 0.14 0.00 -0.34 0.00 0.00 43.02 42.92 2yuo s PHE 16 CO 0.19 -0.39 0.44 -1.83 -1.46 0.00 0.00 175.22 172.18 2yuo s GLU 17 N 2.03 2.73 0.97 10.12 -1.05 -1.26 -0.93 118.70 131.32 2yuo s GLU 17 Ca -0.05 -1.94 -0.15 0.00 -0.15 0.00 0.00 54.97 52.69 2yuo s GLU 17 Cb -0.11 -4.04 -0.04 0.00 -0.44 0.00 0.00 34.13 29.50 2yuo s GLU 17 CO -0.12 -1.23 -0.13 2.89 0.95 0.00 0.00 175.26 177.62 2yuo n ARG 18 N 4.68 -0.19 -0.01 -4.83 0.00 -1.26 -4.98 116.66 110.07 2yuo n ARG 18 Ca -0.04 -0.03 -0.05 0.00 -0.00 0.00 0.00 57.85 57.73 2yuo n ARG 18 Cb 0.41 -1.48 -0.02 0.00 -0.00 0.00 0.00 32.46 31.37 2yuo n ARG 18 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 2yuo n HIS 19 N -3.15 0.00 -3.06 2.89 8.25 -1.26 -4.96 115.22 113.93 2yuo n HIS 19 Ca 0.03 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.09 2yuo n HIS 19 Cb 0.55 -0.18 -0.05 0.00 1.12 0.00 0.00 29.99 31.43 2yuo n HIS 19 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2yuo s ASP 20 N -5.68 6.93 0.54 0.41 -1.08 -1.26 -4.91 116.67 111.63 2yuo s ASP 20 Ca -0.08 1.13 0.32 0.00 -0.52 0.00 0.00 52.55 53.40 2yuo s ASP 20 Cb 0.02 -2.40 1.09 0.00 -1.46 0.00 0.00 42.92 40.17 2yuo s ASP 20 CO 0.10 -0.15 1.27 0.47 0.52 0.00 0.00 175.17 177.38 2yuo n ASP 21 N 4.03 0.00 -0.02 -0.34 9.92 -1.26 0.20 116.55 129.08 2yuo n ASP 21 Ca -0.01 0.77 -0.16 0.00 -0.53 0.00 0.00 54.79 54.86 2yuo n ASP 21 Cb 0.51 -0.31 -0.10 0.00 -0.64 0.00 0.00 41.12 40.57 2yuo n ASP 21 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 2yuo h ASP 22 N 0.00 0.36 -3.56 -2.24 3.32 -1.95 -3.46 116.42 108.89 2yuo h ASP 22 Ca 0.59 -0.71 -0.54 0.00 0.02 0.00 0.00 57.03 56.39 2yuo h ASP 22 Cb 2.97 -0.11 0.20 0.00 0.22 0.00 0.00 39.33 42.61 2yuo h ASP 22 CO -0.01 1.02 -0.30 -0.62 -1.72 0.00 0.00 179.24 177.61 2yuo n GLU 23 N -4.42 -0.06 -4.08 3.56 1.02 0.54 -3.81 120.64 113.39 2yuo n GLU 23 Ca -0.09 0.04 -0.33 0.00 -0.02 0.00 0.00 57.16 56.76 2yuo n GLU 23 Cb 0.53 -1.99 -0.16 0.00 -0.02 0.00 0.00 31.44 29.80 2yuo n GLU 23 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2yuo s LEU 24 N -2.09 2.63 0.58 -4.62 2.96 -0.68 -4.78 118.68 112.68 2yuo s LEU 24 Ca 0.63 -0.88 0.02 0.00 -0.22 0.00 0.00 54.13 53.68 2yuo s LEU 24 Cb -0.26 -1.52 0.06 0.00 0.50 0.00 0.00 46.19 44.96 2yuo s LEU 24 CO 0.61 -0.07 0.81 -0.83 -1.32 0.00 0.00 176.35 175.56 2yuo s GLY 25 N 1.24 1.81 0.10 7.98 0.00 -1.26 -4.73 107.32 112.47 2yuo s GLY 25 Ca 0.01 -1.53 -0.26 0.00 0.00 0.00 0.00 44.72 42.94 2yuo s GLY 25 CO -0.10 -1.17 1.11 -0.11 0.00 0.00 0.00 173.10 172.83 2yuo s PHE 26 N -2.81 -0.02 0.41 1.90 -0.71 -0.10 -4.92 117.98 111.73 2yuo s PHE 26 Ca 0.60 -0.25 0.07 0.00 -1.04 0.00 0.00 56.93 56.31 2yuo s PHE 26 Cb -0.09 0.63 -0.06 0.00 -1.21 0.00 0.00 43.02 42.30 2yuo s PHE 26 CO 0.39 -0.66 0.15 1.03 -1.34 0.00 0.00 175.22 174.79 2yuo s ARG 27 N -2.53 2.18 0.43 1.99 1.81 -1.26 -0.03 118.95 121.54 2yuo s ARG 27 Ca 0.18 -1.88 -0.26 0.00 -1.72 0.00 0.00 55.73 52.05 2yuo s ARG 27 Cb -0.00 -1.93 -0.09 0.00 -0.45 0.00 0.00 34.95 32.47 2yuo s ARG 27 CO 0.02 -0.10 1.41 1.17 -0.68 0.00 0.00 175.30 177.12 2yuo n LYS 28 N -1.19 2.29 -3.49 3.54 4.81 -1.18 -2.79 118.16 120.15 2yuo n LYS 28 Ca -0.02 0.81 -0.19 0.00 -0.87 0.00 0.00 58.31 58.04 2yuo n LYS 28 Cb 0.65 -2.59 0.08 0.00 0.02 0.00 0.00 35.03 33.20 2yuo n LYS 28 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2yuo n ASN 29 N 0.06 -3.30 -4.22 3.14 3.02 0.77 -4.96 115.26 109.77 2yuo n ASN 29 Ca 0.05 -0.60 -0.33 0.00 -0.03 0.00 0.00 54.58 53.66 2yuo n ASN 29 Cb 0.40 -5.06 -0.16 0.00 -0.61 0.00 0.00 39.78 34.35 2yuo n ASN 29 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2yuo s ASP 30 N -4.05 3.36 -0.30 6.41 1.11 -1.12 -4.89 116.67 117.19 2yuo s ASP 30 Ca 0.18 -0.53 -0.23 0.00 0.18 0.00 0.00 52.55 52.14 2yuo s ASP 30 Cb -0.08 -1.49 -0.00 0.00 1.07 0.00 0.00 42.92 42.42 2yuo s ASP 30 CO 0.73 0.10 0.76 -0.63 1.18 0.00 0.00 175.17 177.31 2yuo s ILE 31 N 0.74 4.82 -0.14 0.77 -1.09 -1.26 -1.02 121.20 124.01 2yuo s ILE 31 Ca -0.08 1.17 0.00 0.00 -2.23 0.00 0.00 60.65 59.52 2yuo s ILE 31 Cb -0.16 -4.12 -0.01 0.00 -1.58 0.00 0.00 42.46 36.60 2yuo s ILE 31 CO 0.00 -0.21 -0.15 -0.63 -1.23 0.00 0.00 174.94 172.72 2yuo s ILE 32 N 2.88 2.71 -0.06 2.92 1.01 0.13 -4.96 121.20 125.84 2yuo s ILE 32 Ca 0.31 -0.76 -0.30 0.00 0.00 0.00 0.00 60.65 59.90 2yuo s ILE 32 Cb -0.14 -2.14 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 2yuo s ILE 32 CO 0.12 0.52 1.36 -0.89 0.00 0.00 0.00 174.94 176.05 2yuo s THR 33 N 0.65 3.95 -0.21 2.92 2.01 -1.10 -0.95 115.64 122.91 2yuo s THR 33 Ca -0.08 1.25 -0.27 0.00 0.31 0.00 0.00 61.69 62.91 2yuo s THR 33 Cb -0.16 -3.81 -0.00 0.00 0.01 0.00 0.00 72.50 68.54 2yuo s THR 33 CO 0.02 -0.04 0.92 -0.63 -0.69 0.00 0.00 174.62 174.20 2yuo s ILE 34 N 2.85 4.79 -0.19 1.82 1.01 -0.85 0.12 121.20 130.74 2yuo s ILE 34 Ca 0.61 1.79 -0.15 0.00 0.00 0.00 0.00 60.65 62.90 2yuo s ILE 34 Cb -0.28 -4.21 -0.08 0.00 0.01 0.00 0.00 42.46 37.90 2yuo s ILE 34 CO 0.23 -0.08 -0.20 -0.38 0.00 0.00 0.00 174.94 174.51 2yuo n ILE 35 N 5.10 1.48 -4.16 2.92 2.08 0.14 -4.05 119.36 122.88 2yuo n ILE 35 Ca 0.08 0.04 -0.14 0.00 0.56 0.00 0.00 62.75 63.29 2yuo n ILE 35 Cb 0.47 -2.23 -0.08 0.00 -0.75 0.00 0.00 39.64 37.06 2yuo n ILE 35 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 2yuo s SER 36 N -6.30 0.61 -0.38 4.38 0.15 -0.77 -5.02 113.70 106.36 2yuo s SER 36 Ca -0.26 -1.41 0.01 0.00 0.70 0.00 0.00 55.95 54.98 2yuo s SER 36 Cb 0.06 0.52 0.13 0.00 -1.71 0.00 0.00 66.02 65.01 2yuo s SER 36 CO 0.40 -1.04 0.20 -1.10 1.20 0.00 0.00 173.24 172.90 2yuo s GLN 37 N -3.74 0.92 0.23 5.44 -0.21 -1.26 0.67 119.66 121.70 2yuo s GLN 37 Ca 0.35 -1.58 -0.08 0.00 0.02 0.00 0.00 55.36 54.06 2yuo s GLN 37 Cb 0.03 -1.91 0.22 0.00 1.00 0.00 0.00 33.01 32.35 2yuo s GLN 37 CO 0.17 -1.14 1.88 0.87 -2.12 0.00 0.00 175.29 174.95 2yuo h LYS 38 N 7.11 1.05 -3.75 2.91 1.57 -1.86 -3.44 116.57 120.16 2yuo h LYS 38 Ca -0.02 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.52 2yuo h LYS 38 Cb 0.96 -0.24 -0.23 0.00 0.08 0.00 0.00 32.23 32.81 2yuo h LYS 38 CO 0.41 0.69 -0.63 -0.51 -0.57 0.00 0.00 179.45 178.84 2yuo s ASP 39 N -5.90 0.10 0.39 0.86 1.01 0.82 -4.99 116.67 108.97 2yuo s ASP 39 Ca -0.13 -0.26 0.18 0.00 0.71 0.00 0.00 52.55 53.05 2yuo s ASP 39 Cb 0.16 0.13 1.11 0.00 1.01 0.00 0.00 42.92 45.33 2yuo s ASP 39 CO 0.79 -0.24 1.75 -0.08 0.21 0.00 0.00 175.17 177.59 2yuo h GLU 40 N 4.92 0.37 0.04 8.23 4.57 -2.02 0.82 114.58 131.51 2yuo h GLU 40 Ca -0.30 -0.02 -0.30 0.00 -1.18 0.00 0.00 59.36 57.56 2yuo h GLU 40 Cb 1.20 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 29.67 2yuo h GLU 40 CO 0.43 0.25 -1.71 0.45 -1.18 0.00 0.00 179.01 177.24 2yuo h HIS 41 N 0.39 0.15 -3.62 0.92 3.86 -1.95 -3.45 115.15 111.44 2yuo h HIS 41 Ca 0.63 -0.11 -0.68 0.00 -1.16 0.00 0.00 60.37 59.04 2yuo h HIS 41 Cb 1.57 -0.01 -0.25 0.00 1.06 0.00 0.00 27.41 29.79 2yuo h HIS 41 CO -0.00 1.21 -0.59 0.00 0.86 0.00 0.00 177.93 179.41 2yuo s TRP 43 N 1.53 2.67 -0.11 0.00 0.51 0.61 -0.13 118.94 124.03 2yuo s TRP 43 Ca 0.03 -0.51 0.01 0.00 -2.12 0.00 0.00 56.10 53.50 2yuo s TRP 43 Cb -0.18 -2.14 0.02 0.00 -0.81 0.00 0.00 33.47 30.37 2yuo s TRP 43 CO 0.04 -0.08 -0.11 0.08 -0.51 0.00 0.00 176.95 176.37 2yuo s VAL 44 N -2.50 1.23 0.00 4.03 1.01 0.21 0.13 120.40 124.51 2yuo s VAL 44 Ca 0.47 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 62.00 2yuo s VAL 44 Cb -0.02 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.18 2yuo s VAL 44 CO 0.27 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.37 2yuo n GLY 45 N 4.57 6.98 3.00 4.51 0.00 -1.03 0.25 105.19 123.48 2yuo n GLY 45 Ca -0.16 -1.84 -0.14 0.00 0.00 0.00 0.00 46.02 43.88 2yuo n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yuo s GLU 46 N 0.95 0.15 -0.13 1.61 2.12 0.32 -3.42 118.70 120.30 2yuo s GLU 46 Ca 0.00 0.64 -0.20 0.00 0.36 0.00 0.00 54.97 55.77 2yuo s GLU 46 Cb 0.00 -0.10 0.05 0.00 0.26 0.00 0.00 34.13 34.34 2yuo s GLU 46 CO 0.00 -0.24 0.50 -1.17 -0.54 0.00 0.00 175.26 173.81 2yuo s LEU 47 N 1.97 0.07 -1.66 2.70 2.96 -0.36 -2.71 118.68 121.65 2yuo s LEU 47 Ca -0.02 0.79 0.00 0.00 -0.22 0.00 0.00 54.13 54.68 2yuo s LEU 47 Cb -0.11 1.81 0.00 0.00 0.50 0.00 0.00 46.19 48.38 2yuo s LEU 47 CO -0.08 -0.31 0.00 0.59 -1.32 0.00 0.00 176.35 175.23 2yuo n ASN 48 N 2.15 -5.43 -0.60 3.68 3.02 -1.26 -0.71 115.26 116.11 2yuo n ASN 48 Ca -0.16 0.07 -0.08 0.00 -0.03 0.00 0.00 54.58 54.39 2yuo n ASN 48 Cb 0.56 -4.56 -0.03 0.00 -0.61 0.00 0.00 39.78 35.14 2yuo n ASN 48 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2yuo n GLY 49 N -0.91 0.94 3.37 7.41 0.00 -1.26 -5.02 105.19 109.72 2yuo n GLY 49 Ca -0.22 -0.69 -0.27 0.00 0.00 0.00 0.00 46.02 44.83 2yuo n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yuo s LEU 50 N -1.76 2.33 -0.17 0.99 1.43 0.11 -5.13 118.68 116.48 2yuo s LEU 50 Ca 0.00 -0.75 -0.02 0.00 -1.03 0.00 0.00 54.13 52.33 2yuo s LEU 50 Cb 0.00 -1.13 0.05 0.00 0.03 0.00 0.00 46.19 45.14 2yuo s LEU 50 CO 0.00 0.14 0.01 -0.60 0.23 0.00 0.00 176.35 176.13 2yuo s ARG 51 N -2.13 0.85 0.00 1.70 3.52 -1.26 -1.22 118.95 120.42 2yuo s ARG 51 Ca 0.13 -0.40 0.00 0.00 -0.13 0.00 0.00 55.73 55.33 2yuo s ARG 51 Cb -0.10 -1.96 0.00 0.00 -1.56 0.00 0.00 34.95 31.33 2yuo s ARG 51 CO 0.06 -0.55 0.00 0.41 -0.81 0.00 0.00 175.30 174.41 2yuo n GLY 52 N 5.00 2.97 3.98 8.12 0.00 -1.22 -4.97 105.19 119.06 2yuo n GLY 52 Ca -0.09 -1.26 -0.21 0.00 0.00 0.00 0.00 46.02 44.46 2yuo n GLY 52 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2yuo s TRP 53 N -5.62 3.14 -0.22 1.61 1.48 -1.25 -2.45 118.94 115.63 2yuo s TRP 53 Ca 0.00 -0.04 -0.31 0.00 -1.06 0.00 0.00 56.10 54.69 2yuo s TRP 53 Cb 0.00 -2.16 0.16 0.00 -1.16 0.00 0.00 33.47 30.31 2yuo s TRP 53 CO 0.00 -0.19 1.20 -0.59 -4.06 0.00 0.00 176.95 173.31 2yuo s PHE 54 N -2.35 -0.17 -0.14 1.66 -0.12 0.12 -1.69 117.98 115.29 2yuo s PHE 54 Ca 0.47 0.25 -0.29 0.00 -0.05 0.00 0.00 56.93 57.31 2yuo s PHE 54 Cb -0.10 0.49 -0.04 0.00 -0.63 0.00 0.00 43.02 42.74 2yuo s PHE 54 CO 0.34 -0.18 1.56 -1.25 -0.05 0.00 0.00 175.22 175.64 2yuo s PRO 55 N -1.39 4.05 0.51 1.99 0.04 -1.26 -0.28 135.00 138.66 2yuo s PRO 55 Ca 0.05 1.89 0.17 0.00 0.04 0.00 0.00 61.00 63.15 2yuo s PRO 55 Cb -0.01 -3.96 1.26 0.00 0.04 0.00 0.00 34.50 31.83 2yuo s PRO 55 CO -0.04 -0.98 2.12 0.00 0.04 0.00 0.00 177.00 178.15 2yuo h ALA 56 N 9.68 2.04 -0.29 8.56 0.00 -1.63 -1.12 119.26 136.50 2yuo h ALA 56 Ca -0.35 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.64 2yuo h ALA 56 Cb 1.15 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2yuo h ALA 56 CO 0.97 -0.06 0.25 1.57 0.00 0.00 0.00 179.25 181.98 2yuo h LYS 57 N 0.04 0.00 0.00 0.00 5.09 -1.90 0.34 116.57 120.14 2yuo h LYS 57 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.78 2yuo h LYS 57 Cb 0.12 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.45 2yuo h LYS 57 CO -0.00 0.00 0.00 0.74 -2.09 0.00 0.00 179.45 178.10 2yuo h PHE 58 N 0.00 0.00 -1.25 0.07 -1.00 -1.60 -3.46 116.94 109.70 2yuo h PHE 58 Ca 0.14 0.00 -0.63 0.00 2.81 0.00 0.00 57.97 60.28 2yuo h PHE 58 Cb 0.64 0.00 -0.13 0.00 3.61 0.00 0.00 35.95 40.07 2yuo h PHE 58 CO 0.00 0.00 -0.55 0.14 -1.61 0.00 0.00 178.31 176.29 2yuo s VAL 59 N -3.24 1.36 -0.04 -0.55 -7.23 0.12 -2.03 120.40 108.79 2yuo s VAL 59 Ca 0.07 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.28 2yuo s VAL 59 Cb 0.07 -2.50 -0.00 0.00 0.56 0.00 0.00 36.38 34.51 2yuo s VAL 59 CO 0.63 0.00 -0.14 -0.70 -0.31 0.00 0.00 175.10 174.58 2yuo s GLU 60 N -3.81 1.49 0.43 4.82 2.56 0.19 -4.82 118.70 119.56 2yuo s GLU 60 Ca 0.20 -0.50 -0.24 0.00 0.00 0.00 0.00 54.97 54.43 2yuo s GLU 60 Cb 0.05 -1.32 -0.08 0.00 2.00 0.00 0.00 34.13 34.78 2yuo s GLU 60 CO 0.10 0.20 1.11 0.08 -0.56 0.00 0.00 175.26 176.20 2yuo s VAL 61 N 0.08 3.39 -0.08 3.70 1.01 -1.26 -0.17 120.40 127.07 2yuo s VAL 61 Ca -0.03 1.07 0.01 0.00 0.00 0.00 0.00 61.98 63.02 2yuo s VAL 61 Cb -0.10 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 32.75 2yuo s VAL 61 CO 0.01 0.01 -0.08 -0.76 0.00 0.00 0.00 175.10 174.28 2yuo s LEU 62 N -2.79 1.35 0.05 3.92 1.43 -1.07 -4.88 118.68 116.68 2yuo s LEU 62 Ca 0.60 -0.26 -0.17 0.00 -1.03 0.00 0.00 54.13 53.28 2yuo s LEU 62 Cb -0.26 -0.74 -0.06 0.00 0.03 0.00 0.00 46.19 45.16 2yuo s LEU 62 CO 0.32 -0.05 0.49 1.51 0.23 0.00 0.00 176.35 178.85 2yuo s ASP 63 N 1.18 6.92 -0.60 2.29 1.47 -1.26 -4.40 116.67 122.27 2yuo s ASP 63 Ca -0.05 1.11 0.04 0.00 1.18 0.00 0.00 52.55 54.82 2yuo s ASP 63 Cb -0.14 -2.30 0.15 0.00 -0.34 0.00 0.00 42.92 40.29 2yuo s ASP 63 CO -0.02 0.28 0.37 -1.61 0.68 0.00 0.00 175.17 174.87 2yuo s GLU 64 N -1.18 2.22 0.18 2.11 0.41 -1.26 -5.09 118.70 116.09 2yuo s GLU 64 Ca 0.27 -2.93 -0.22 0.00 -0.41 0.00 0.00 54.97 51.68 2yuo s GLU 64 Cb -0.18 -3.39 -0.08 0.00 -1.78 0.00 0.00 34.13 28.71 2yuo s GLU 64 CO 0.17 -1.18 0.73 1.03 -0.49 0.00 0.00 175.26 175.51 2yuo s ARG 65 N -0.78 4.40 -0.30 1.61 1.81 -1.26 -5.05 118.95 119.38 2yuo s ARG 65 Ca 0.20 0.99 -0.16 0.00 -1.72 0.00 0.00 55.73 55.05 2yuo s ARG 65 Cb -0.17 -3.09 0.18 0.00 -0.45 0.00 0.00 34.95 31.42 2yuo s ARG 65 CO -0.07 0.50 1.11 0.45 -0.68 0.00 0.00 175.30 176.61 2yuo s SER 66 N -1.36 -0.37 0.08 0.23 0.15 -1.26 -5.18 113.70 105.99 2yuo s SER 66 Ca 0.38 0.39 -0.11 0.00 0.70 0.00 0.00 55.95 57.31 2yuo s SER 66 Cb -0.20 1.38 0.01 0.00 -1.71 0.00 0.00 66.02 65.50 2yuo s SER 66 CO 0.23 -0.07 0.25 -0.75 1.20 0.00 0.00 173.24 174.10 2yuo s LYS 67 N 2.53 0.86 0.00 5.44 2.20 -1.26 -5.04 119.74 124.47 2yuo s LYS 67 Ca -0.01 -0.77 -0.04 0.00 -0.36 0.00 0.00 55.97 54.78 2yuo s LYS 67 Cb -0.06 0.36 -0.19 0.00 -1.51 0.00 0.00 37.83 36.43 2yuo s LYS 67 CO -0.14 -0.28 3.11 0.39 -0.36 0.00 0.00 175.35 178.06 2yuo n GLU 68 N 0.14 1.68 -3.57 4.03 -0.58 -1.26 -4.67 120.64 116.41 2yuo n GLU 68 Ca -0.16 -0.72 -0.26 0.00 -0.42 0.00 0.00 57.16 55.60 2yuo n GLU 68 Cb 0.62 -1.73 -0.16 0.00 -0.57 0.00 0.00 31.44 29.59 2yuo n GLU 68 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2yuo s TYR 69 N 0.81 0.19 0.03 -0.32 1.51 -1.26 -5.14 117.35 113.16 2yuo s TYR 69 Ca 0.48 -0.47 -0.04 0.00 -1.01 0.00 0.00 57.07 56.02 2yuo s TYR 69 Cb 0.23 -0.74 -0.05 0.00 -0.11 0.00 0.00 41.96 41.30 2yuo s TYR 69 CO 0.00 -0.64 0.25 0.45 -1.11 0.00 0.00 175.55 174.50 2yuo s SER 70 N 2.14 6.44 0.37 2.29 0.15 -1.26 -5.04 113.70 118.80 2yuo s SER 70 Ca 0.05 0.47 -0.21 0.00 0.70 0.00 0.00 55.95 56.96 2yuo s SER 70 Cb -0.16 -2.05 -0.15 0.00 -1.71 0.00 0.00 66.02 61.95 2yuo s SER 70 CO -0.20 0.22 0.12 2.30 1.20 0.00 0.00 173.24 176.89 2yuo n ILE 71 N 0.85 0.75 -4.66 6.45 -0.00 -1.26 -4.97 119.36 116.52 2yuo n ILE 71 Ca -0.09 -0.48 -0.30 0.00 -0.00 0.00 0.00 62.75 61.87 2yuo n ILE 71 Cb 0.52 0.00 -0.13 0.00 -0.00 0.00 0.00 39.64 40.03 2yuo n ILE 71 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2yuo s ALA 72 N -1.56 2.44 0.27 -1.28 0.00 -1.26 -5.09 121.76 115.28 2yuo s ALA 72 Ca 0.58 -1.29 -0.29 0.00 0.00 0.00 0.00 51.96 50.96 2yuo s ALA 72 Cb -0.64 -0.57 -0.14 0.00 0.00 0.00 0.00 23.12 21.77 2yuo s ALA 72 CO 0.60 0.56 1.09 -1.13 0.00 0.00 0.00 175.76 176.88 2yuo n SER 73 N 1.43 1.55 0.00 0.00 3.41 -1.26 -4.42 113.62 114.33 2yuo n SER 73 Ca -0.17 1.17 0.00 0.00 -0.26 0.00 0.00 58.87 59.62 2yuo n SER 73 Cb 0.52 -1.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 2yuo n SER 73 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yuo n GLY 74 N 1.39 -0.12 0.18 5.00 0.00 -1.26 -4.92 105.19 105.47 2yuo n GLY 74 Ca 0.10 0.08 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 2yuo n GLY 74 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuo h PRO 75 N 0.00 0.19 -5.46 1.61 0.13 -2.05 -3.42 132.00 123.00 2yuo h PRO 75 Ca 0.00 -0.10 -0.61 0.00 -0.87 0.00 0.00 66.00 64.42 2yuo h PRO 75 Cb 0.00 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.02 2yuo h PRO 75 CO 0.00 0.62 -0.02 -1.54 -0.23 0.00 0.00 178.00 176.83 2yuo s SER 76 N -6.88 6.51 -0.26 1.44 1.04 -1.26 -5.03 113.70 109.25 2yuo s SER 76 Ca -0.04 0.61 -0.26 0.00 0.48 0.00 0.00 55.95 56.74 2yuo s SER 76 Cb 0.13 -2.29 0.15 0.00 0.10 0.00 0.00 66.02 64.11 2yuo s SER 76 CO 0.77 -0.23 1.17 -0.94 0.98 0.00 0.00 173.24 174.99 2yuo s SER 77 N 1.32 -0.29 0.00 7.02 1.04 -1.26 -4.88 113.70 116.65 2yuo s SER 77 Ca 0.23 0.50 0.27 0.00 0.48 0.00 0.00 55.95 57.43 2yuo s SER 77 Cb -0.15 0.49 0.76 0.00 0.10 0.00 0.00 66.02 67.22 2yuo s SER 77 CO 0.09 -0.14 1.58 0.61 0.98 0.00 0.00 173.24 176.37