#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sro n GLU 2 N 0.00 2.43 -0.83 0.00 4.07 -1.26 -5.07 120.64 119.98 1sro n GLU 2 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1sro n GLU 2 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1sro n GLU 2 CO 0.00 0.00 0.00 0.44 -0.06 0.00 0.00 177.13 177.51 1sro n ILE 3 N 0.00 0.00 -3.77 6.31 -6.64 -1.26 -5.13 119.36 108.86 1sro n ILE 3 Ca 0.00 0.00 -0.12 0.00 -1.77 0.00 0.00 62.75 60.86 1sro n ILE 3 Cb 0.00 0.00 -0.08 0.00 -1.44 0.00 0.00 39.64 38.12 1sro n ILE 3 CO 0.00 0.00 0.00 -0.70 -1.77 0.00 0.00 176.55 174.08 1sro s GLU 4 N -0.42 0.71 1.14 6.28 2.12 -1.26 -5.14 118.70 122.14 1sro s GLU 4 Ca 0.00 -0.36 -0.12 0.00 0.36 0.00 0.00 54.97 54.84 1sro s GLU 4 Cb 0.00 0.31 0.27 0.00 0.26 0.00 0.00 34.13 34.97 1sro s GLU 4 CO 0.00 -0.21 1.04 0.08 -0.54 0.00 0.00 175.26 175.63 1sro s VAL 5 N -1.89 2.03 -0.03 3.70 1.01 -1.26 -2.87 120.40 121.08 1sro s VAL 5 Ca -0.10 0.01 0.00 0.00 0.00 0.00 0.00 61.98 61.89 1sro s VAL 5 Cb -0.03 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1sro s VAL 5 CO 0.01 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.71 1sro n GLY 6 N 0.72 0.30 3.88 4.51 0.00 -1.25 -4.98 105.19 108.37 1sro n GLY 6 Ca 0.04 -0.02 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 1sro n GLY 6 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sro s ARG 7 N -0.99 2.30 -0.21 1.61 3.52 -1.14 -4.87 118.95 119.17 1sro s ARG 7 Ca 0.00 -1.92 -0.19 0.00 -0.13 0.00 0.00 55.73 53.49 1sro s ARG 7 Cb 0.00 -2.12 -0.03 0.00 -1.56 0.00 0.00 34.95 31.23 1sro s ARG 7 CO 0.00 -0.49 0.54 0.08 -0.81 0.00 0.00 175.30 174.62 1sro s VAL 8 N -2.70 5.09 -0.14 7.11 1.01 -1.26 -1.69 120.40 127.81 1sro s VAL 8 Ca 0.37 0.98 -0.02 0.00 0.00 0.00 0.00 61.98 63.31 1sro s VAL 8 Cb -0.02 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1sro s VAL 8 CO 0.22 0.16 -0.07 -0.31 0.00 0.00 0.00 175.10 175.10 1sro s TYR 9 N 1.76 2.95 -0.72 5.22 1.51 0.07 -4.88 117.35 123.25 1sro s TYR 9 Ca 0.24 -0.39 -0.27 0.00 -1.01 0.00 0.00 57.07 55.64 1sro s TYR 9 Cb -0.15 -1.90 0.03 0.00 -0.11 0.00 0.00 41.96 39.83 1sro s TYR 9 CO 0.10 -0.07 1.26 0.99 -1.11 0.00 0.00 175.55 176.71 1sro s THR 10 N 0.27 3.78 -0.09 -0.71 2.01 -1.26 -0.42 115.64 119.22 1sro s THR 10 Ca -0.05 0.41 -0.30 0.00 0.31 0.00 0.00 61.69 62.06 1sro s THR 10 Cb -0.15 -4.89 -0.02 0.00 0.01 0.00 0.00 72.50 67.46 1sro s THR 10 CO 0.04 -1.80 1.03 -0.83 -0.69 0.00 0.00 174.62 172.37 1sro s GLY 11 N 3.67 2.40 0.21 4.40 0.00 0.14 -4.79 107.32 113.36 1sro s GLY 11 Ca 0.35 0.43 -0.12 0.00 0.00 0.00 0.00 44.72 45.37 1sro s GLY 11 CO 0.16 1.92 0.58 0.54 0.00 0.00 0.00 173.10 176.30 1sro s LYS 12 N 1.90 3.91 -0.41 2.90 1.02 -0.38 -1.66 119.74 127.01 1sro s LYS 12 Ca 0.50 0.42 -0.23 0.00 0.02 0.00 0.00 55.97 56.68 1sro s LYS 12 Cb -0.19 -2.72 0.02 0.00 -0.52 0.00 0.00 37.83 34.41 1sro s LYS 12 CO 0.20 0.35 0.79 0.08 -0.92 0.00 0.00 175.35 175.84 1sro s VAL 13 N -1.71 4.69 0.00 3.17 1.01 -0.84 -1.54 120.40 125.18 1sro s VAL 13 Ca 0.45 0.66 0.00 0.00 0.00 0.00 0.00 61.98 63.09 1sro s VAL 13 Cb -0.12 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.99 1sro s VAL 13 CO 0.20 -0.58 0.17 0.35 0.00 0.00 0.00 175.10 175.24 1sro n THR 14 N 5.98 0.00 -3.52 3.92 -2.24 -1.26 -2.28 114.28 114.88 1sro n THR 14 Ca 0.03 -0.43 -0.12 0.00 -2.27 0.00 0.00 64.05 61.25 1sro n THR 14 Cb 0.48 1.05 -0.04 0.00 -2.10 0.00 0.00 70.33 69.72 1sro n THR 14 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1sro s ARG 15 N -0.52 0.87 0.08 -0.78 3.00 -1.24 -4.99 118.95 115.37 1sro s ARG 15 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 55.73 55.70 1sro s ARG 15 Cb 0.00 0.41 -0.03 0.00 0.00 0.00 0.00 34.95 35.32 1sro s ARG 15 CO 0.00 -0.32 0.03 0.42 0.00 0.00 0.00 175.30 175.43 1sro s ILE 16 N -1.95 0.18 0.03 1.52 1.01 -1.26 -0.40 121.20 120.33 1sro s ILE 16 Ca -0.03 -1.75 -0.01 0.00 0.00 0.00 0.00 60.65 58.87 1sro s ILE 16 Cb -0.01 -1.65 -0.03 0.00 0.01 0.00 0.00 42.46 40.79 1sro s ILE 16 CO -0.00 -0.80 -0.03 0.68 0.00 0.00 0.00 174.94 174.79 1sro s VAL 17 N -3.95 0.15 0.23 2.92 -7.23 -0.34 -4.66 120.40 107.52 1sro s VAL 17 Ca 0.12 -1.21 -0.07 0.00 -1.81 0.00 0.00 61.98 59.00 1sro s VAL 17 Cb 0.07 -0.70 0.20 0.00 0.56 0.00 0.00 36.38 36.52 1sro s VAL 17 CO -0.07 -0.67 1.87 -0.78 -0.31 0.00 0.00 175.10 175.15 1sro h ASP 18 N 4.12 0.89 -0.50 4.85 1.82 -2.01 -0.93 116.42 124.66 1sro h ASP 18 Ca -0.33 -0.00 -0.25 0.00 -0.39 0.00 0.00 57.03 56.06 1sro h ASP 18 Cb 1.19 -0.19 -0.15 0.00 0.68 0.00 0.00 39.33 40.85 1sro h ASP 18 CO 0.50 0.60 0.32 2.22 -1.61 0.00 0.00 179.24 181.27 1sro n PHE 19 N -4.57 1.55 0.00 0.28 1.16 -1.26 -4.77 117.46 109.85 1sro n PHE 19 Ca 0.11 -1.14 0.00 0.00 -1.87 0.00 0.00 57.45 54.55 1sro n PHE 19 Cb 0.10 -0.59 0.00 0.00 -1.61 0.00 0.00 39.48 37.38 1sro n PHE 19 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1sro n GLY 20 N -0.30 0.12 3.39 4.97 0.00 -0.35 -3.13 105.19 109.88 1sro n GLY 20 Ca 0.30 -1.16 -0.15 0.00 0.00 0.00 0.00 46.02 45.01 1sro n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sro s ALA 21 N -1.00 -1.30 0.29 4.61 0.00 0.19 -1.20 121.76 123.35 1sro s ALA 21 Ca 0.00 0.92 0.07 0.00 0.00 0.00 0.00 51.96 52.95 1sro s ALA 21 Cb 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 1sro s ALA 21 CO 0.00 -0.31 0.22 -0.06 0.00 0.00 0.00 175.76 175.61 1sro s PHE 22 N -1.08 2.96 0.11 0.00 0.40 0.47 0.12 117.98 120.96 1sro s PHE 22 Ca -0.11 -0.22 -0.11 0.00 -0.60 0.00 0.00 56.93 55.90 1sro s PHE 22 Cb -0.03 -1.57 0.01 0.00 0.51 0.00 0.00 43.02 41.94 1sro s PHE 22 CO 0.06 0.38 0.27 0.08 0.70 0.00 0.00 175.22 176.71 1sro s VAL 23 N -2.24 0.11 -0.02 -0.44 1.01 -0.08 -3.66 120.40 115.07 1sro s VAL 23 Ca 0.36 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1sro s VAL 23 Cb -0.06 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.95 1sro s VAL 23 CO 0.25 -0.50 -0.07 0.00 0.00 0.00 0.00 175.10 174.78 1sro s ALA 24 N -3.86 0.69 0.00 5.51 0.00 -0.59 0.61 121.76 124.12 1sro s ALA 24 Ca 0.06 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1sro s ALA 24 Cb 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.88 1sro s ALA 24 CO -0.10 0.10 0.00 0.44 0.00 0.00 0.00 175.76 176.21 1sro n ILE 25 N 3.33 0.00 0.00 0.00 -5.35 -0.48 -1.25 119.36 115.61 1sro n ILE 25 Ca -0.18 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.30 1sro n ILE 25 Cb 0.55 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.37 1sro n ILE 25 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1sro n GLY 26 N 4.29 0.43 0.49 3.28 0.00 -1.10 -4.86 105.19 107.73 1sro n GLY 26 Ca 0.00 0.15 0.36 0.00 0.00 0.00 0.00 46.02 46.53 1sro n GLY 26 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1sro h GLY 27 N 0.00 0.96 0.00 -0.02 0.00 -1.99 -3.33 103.07 98.69 1sro h GLY 27 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1sro h GLY 27 CO 0.00 -0.25 0.00 0.61 0.00 0.00 0.00 176.54 176.90 1sro n GLY 28 N -1.59 0.07 0.00 4.60 0.00 -1.26 -4.91 105.19 102.09 1sro n GLY 28 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1sro n GLY 28 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1sro n LYS 29 N -2.52 0.00 -4.24 1.61 5.02 -1.25 -5.08 118.16 111.70 1sro n LYS 29 Ca 0.00 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.08 1sro n LYS 29 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 34.89 1sro n LYS 29 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1sro s GLU 30 N 1.77 1.02 0.18 1.97 2.02 -1.26 -1.38 118.70 123.01 1sro s GLU 30 Ca 0.00 -1.12 0.03 0.00 0.02 0.00 0.00 54.97 53.90 1sro s GLU 30 Cb 0.00 -1.14 0.03 0.00 0.10 0.00 0.00 34.13 33.12 1sro s GLU 30 CO 0.00 0.25 0.22 0.41 0.02 0.00 0.00 175.26 176.16 1sro n GLY 31 N 1.04 2.18 3.17 -1.39 0.00 0.20 -4.08 105.19 106.32 1sro n GLY 31 Ca -0.19 -2.17 -0.10 0.00 0.00 0.00 0.00 46.02 43.55 1sro n GLY 31 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1sro s LEU 32 N 0.00 -0.41 -1.17 0.99 2.96 -1.26 -0.91 118.68 118.88 1sro s LEU 32 Ca 0.16 0.83 -0.04 0.00 -0.22 0.00 0.00 54.13 54.87 1sro s LEU 32 Cb -0.01 1.12 0.23 0.00 0.50 0.00 0.00 46.19 48.02 1sro s LEU 32 CO 0.10 -0.23 2.04 0.52 -1.32 0.00 0.00 176.35 177.47 1sro n VAL 33 N 5.17 5.60 -0.97 1.68 0.31 0.33 -4.69 118.33 125.76 1sro n VAL 33 Ca -0.11 -5.20 -0.35 0.00 -0.01 0.00 0.00 64.34 58.68 1sro n VAL 33 Cb 0.50 -1.86 0.09 0.00 -0.91 0.00 0.00 33.84 31.67 1sro n VAL 33 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1sro n HIS 34 N 1.02 -2.20 -0.21 3.52 -0.00 -0.91 0.54 115.22 116.97 1sro n HIS 34 Ca 0.51 0.21 -0.01 0.00 0.46 0.00 0.00 57.72 58.89 1sro n HIS 34 Cb 0.27 -1.73 0.05 0.00 -0.12 0.00 0.00 29.99 28.46 1sro n HIS 34 CO 0.00 0.00 0.00 0.97 0.46 0.00 0.00 176.34 177.77 1sro h ILE 35 N -1.10 0.30 -0.14 3.57 6.09 -1.78 0.97 117.51 125.41 1sro h ILE 35 Ca -0.44 0.00 -0.15 0.00 -1.37 0.00 0.00 64.86 62.90 1sro h ILE 35 Cb 1.31 0.30 -0.06 0.00 0.47 0.00 0.00 36.82 38.84 1sro h ILE 35 CO 0.34 0.00 -0.06 -1.54 -3.07 0.00 0.00 178.15 173.82 1sro n SER 36 N -5.44 5.53 -1.90 2.19 3.41 -1.26 -3.93 113.62 112.22 1sro n SER 36 Ca 0.07 -2.58 0.01 0.00 -0.26 0.00 0.00 58.87 56.11 1sro n SER 36 Cb 0.34 -1.24 0.02 0.00 -0.26 0.00 0.00 64.21 63.08 1sro n SER 36 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sro n GLN 37 N 1.68 0.60 0.00 4.33 1.13 0.34 -4.92 117.38 120.53 1sro n GLN 37 Ca 0.23 -2.23 0.00 0.00 -1.94 0.00 0.00 57.00 53.06 1sro n GLN 37 Cb 0.67 -0.36 0.00 0.00 0.11 0.00 0.00 30.24 30.66 1sro n GLN 37 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1sro n ILE 38 N -0.04 0.00 -1.31 5.09 -0.00 -1.25 -4.08 119.36 117.77 1sro n ILE 38 Ca -0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 62.75 62.43 1sro n ILE 38 Cb 0.97 0.00 0.07 0.00 -0.00 0.00 0.00 39.64 40.67 1sro n ILE 38 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1sro n ALA 39 N -3.00 6.17 0.00 -1.39 0.00 -1.26 -3.80 120.51 117.23 1sro n ALA 39 Ca 0.00 -3.23 0.00 0.00 0.00 0.00 0.00 53.44 50.21 1sro n ALA 39 Cb 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1sro n ALA 39 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1sro n ASP 40 N -0.63 0.00 0.00 0.00 2.03 -1.26 -3.49 116.55 113.19 1sro n ASP 40 Ca 0.56 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.87 1sro n ASP 40 Cb 0.61 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.01 1sro n ASP 40 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1sro n LYS 41 N 0.00 0.00 -0.07 -0.67 2.85 -1.26 -4.73 118.16 114.28 1sro n LYS 41 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1sro n LYS 41 Cb 0.00 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.41 1sro n LYS 41 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1sro n ARG 42 N 0.00 1.28 -2.95 -1.58 5.12 -1.23 -4.41 116.66 112.89 1sro n ARG 42 Ca 0.00 -0.23 -0.41 0.00 -1.93 0.00 0.00 57.85 55.28 1sro n ARG 42 Cb 0.14 -1.54 0.00 0.00 -1.16 0.00 0.00 32.46 29.90 1sro n ARG 42 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1sro n VAL 43 N 0.06 5.20 0.00 1.55 0.31 -1.26 -4.80 118.33 119.39 1sro n VAL 43 Ca 0.02 -5.88 0.21 0.00 -0.01 0.00 0.00 64.34 58.68 1sro n VAL 43 Cb 0.33 -1.93 0.53 0.00 -0.91 0.00 0.00 33.84 31.86 1sro n VAL 43 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1sro h GLU 44 N 4.96 0.00 -3.83 5.55 5.08 -1.98 -3.34 114.58 121.02 1sro h GLU 44 Ca 0.27 0.00 -0.43 0.00 -1.00 0.00 0.00 59.36 58.21 1sro h GLU 44 Cb 0.55 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 29.43 1sro h GLU 44 CO 1.24 0.00 -0.77 0.15 -1.00 0.00 0.00 179.01 178.63 1sro s LYS 45 N -4.41 0.71 0.42 2.33 -0.14 -1.26 -5.00 119.74 112.39 1sro s LYS 45 Ca -0.03 0.02 0.23 0.00 -1.36 0.00 0.00 55.97 54.83 1sro s LYS 45 Cb 0.12 -0.93 0.75 0.00 -1.68 0.00 0.00 37.83 36.09 1sro s LYS 45 CO 0.42 -0.22 1.75 0.28 -0.76 0.00 0.00 175.35 176.82 1sro h VAL 46 N 6.25 0.52 0.00 3.17 2.07 -1.84 -2.34 116.25 124.08 1sro h VAL 46 Ca -0.27 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 65.98 1sro h VAL 46 Cb 1.13 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1sro h VAL 46 CO 0.35 0.23 0.00 0.35 0.02 0.00 0.00 177.57 178.52 1sro n THR 47 N -3.31 0.00 -0.10 2.57 -2.24 -1.26 -1.24 114.28 108.69 1sro n THR 47 Ca 0.01 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.66 1sro n THR 47 Cb 0.48 -0.55 -0.12 0.00 -2.10 0.00 0.00 70.33 68.05 1sro n THR 47 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1sro n ASP 48 N -0.93 1.47 -0.01 3.42 9.92 -0.88 -4.49 116.55 125.04 1sro n ASP 48 Ca 0.16 -0.07 -0.06 0.00 -0.53 0.00 0.00 54.79 54.29 1sro n ASP 48 Cb 0.07 0.21 -0.13 0.00 -0.64 0.00 0.00 41.12 40.64 1sro n ASP 48 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1sro n TYR 49 N -2.95 0.93 -4.54 1.24 4.02 -1.16 -4.87 117.16 109.83 1sro n TYR 49 Ca -0.36 0.33 -0.34 0.00 -0.01 0.00 0.00 57.90 57.52 1sro n TYR 49 Cb 1.00 -1.14 -0.11 0.00 -0.02 0.00 0.00 39.34 39.07 1sro n TYR 49 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1sro s LEU 50 N -5.95 3.26 -0.16 7.72 2.01 -0.37 -5.11 118.68 120.08 1sro s LEU 50 Ca -0.04 -0.01 -0.09 0.00 0.01 0.00 0.00 54.13 53.99 1sro s LEU 50 Cb 0.08 -1.75 0.05 0.00 0.01 0.00 0.00 46.19 44.58 1sro s LEU 50 CO 0.82 0.35 0.38 -1.10 1.01 0.00 0.00 176.35 177.81 1sro s GLN 51 N -0.96 0.38 -0.31 1.70 1.11 -1.26 -4.46 119.66 115.85 1sro s GLN 51 Ca 0.14 0.70 -0.28 0.00 0.01 0.00 0.00 55.36 55.93 1sro s GLN 51 Cb -0.11 0.01 -0.05 0.00 -1.01 0.00 0.00 33.01 31.85 1sro s GLN 51 CO 0.03 -0.14 2.17 -1.64 0.01 0.00 0.00 175.29 175.72 1sro s MET 52 N 1.15 2.93 0.00 2.91 -1.94 -1.26 -2.16 119.30 120.93 1sro s MET 52 Ca -0.08 1.74 0.00 0.00 -1.71 0.00 0.00 55.69 55.65 1sro s MET 52 Cb -0.08 -4.39 0.00 0.00 2.01 0.00 0.00 34.83 32.38 1sro s MET 52 CO -0.10 -2.33 0.00 0.41 -0.01 0.00 0.00 175.02 172.99 1sro n GLY 53 N 5.76 1.68 3.88 -0.03 0.00 -0.96 -5.00 105.19 110.51 1sro n GLY 53 Ca 0.30 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1sro n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sro s GLN 54 N 0.00 3.23 -0.02 1.61 -0.21 -0.92 -4.84 119.66 118.51 1sro s GLN 54 Ca 0.00 0.58 0.05 0.00 0.02 0.00 0.00 55.36 56.02 1sro s GLN 54 Cb 0.00 -2.06 -0.01 0.00 1.00 0.00 0.00 33.01 31.94 1sro s GLN 54 CO 0.00 -0.79 -0.19 -1.21 -2.12 0.00 0.00 175.29 170.98 1sro s GLU 55 N -5.25 1.64 0.00 2.91 2.02 -1.26 -1.98 118.70 116.79 1sro s GLU 55 Ca 0.56 -0.67 -0.01 0.00 0.02 0.00 0.00 54.97 54.87 1sro s GLU 55 Cb -0.11 -1.54 -0.01 0.00 0.10 0.00 0.00 34.13 32.58 1sro s GLU 55 CO 0.53 0.37 0.01 0.14 0.02 0.00 0.00 175.26 176.32 1sro s VAL 56 N -0.32 0.04 0.36 2.63 -7.23 -0.67 -5.01 120.40 110.21 1sro s VAL 56 Ca 0.04 -0.35 -0.25 0.00 -1.81 0.00 0.00 61.98 59.62 1sro s VAL 56 Cb -0.09 -0.13 -0.10 0.00 0.56 0.00 0.00 36.38 36.62 1sro s VAL 56 CO 0.00 -0.19 0.97 -2.16 -0.31 0.00 0.00 175.10 173.41 1sro s PRO 57 N -0.56 4.42 0.18 4.82 0.04 -1.26 0.29 135.00 142.92 1sro s PRO 57 Ca -0.06 1.32 -0.01 0.00 0.04 0.00 0.00 61.00 62.29 1sro s PRO 57 Cb -0.04 -2.61 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1sro s PRO 57 CO -0.00 0.13 0.24 1.33 0.04 0.00 0.00 177.00 178.74 1sro n VAL 58 N 0.17 0.00 -5.02 -0.36 0.24 0.44 -1.33 118.33 112.48 1sro n VAL 58 Ca 0.04 -0.91 -0.28 0.00 -2.04 0.00 0.00 64.34 61.14 1sro n VAL 58 Cb 0.51 0.56 -0.16 0.00 -1.47 0.00 0.00 33.84 33.27 1sro n VAL 58 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1sro s LYS 59 N -2.41 2.07 -0.82 7.34 1.02 -0.32 -0.75 119.74 125.86 1sro s LYS 59 Ca 0.15 -0.73 -0.25 0.00 0.02 0.00 0.00 55.97 55.15 1sro s LYS 59 Cb -0.00 -1.79 -0.07 0.00 -0.52 0.00 0.00 37.83 35.45 1sro s LYS 59 CO 0.11 0.31 2.07 0.08 -0.92 0.00 0.00 175.35 176.99 1sro s VAL 60 N -0.08 3.31 -0.04 3.17 1.01 -0.68 -1.10 120.40 125.99 1sro s VAL 60 Ca -0.03 -0.20 0.30 0.00 0.00 0.00 0.00 61.98 62.05 1sro s VAL 60 Cb -0.12 -3.72 0.31 0.00 0.00 0.00 0.00 36.38 32.85 1sro s VAL 60 CO 0.03 -0.68 1.90 0.25 0.00 0.00 0.00 175.10 176.59 1sro h LEU 61 N 18.87 0.00 0.00 3.92 5.85 -0.56 -3.31 115.31 140.08 1sro h LEU 61 Ca 0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1sro h LEU 61 Cb 1.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1sro h LEU 61 CO 1.16 0.00 0.00 -0.62 -0.34 0.00 0.00 178.44 178.64 1sro n GLU 62 N -2.60 0.00 -4.80 1.25 1.02 -1.11 -4.90 120.64 109.49 1sro n GLU 62 Ca -0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.81 1sro n GLU 62 Cb 0.16 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.43 1sro n GLU 62 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1sro s VAL 63 N -0.68 2.97 -0.00 2.62 1.01 -1.26 -0.57 120.40 124.48 1sro s VAL 63 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1sro s VAL 63 Cb 0.00 -2.24 -0.00 0.00 0.00 0.00 0.00 36.38 34.14 1sro s VAL 63 CO 0.00 0.53 0.00 -0.90 0.00 0.00 0.00 175.10 174.73 1sro n ASP 64 N 3.54 4.94 0.00 3.32 5.68 -1.26 -4.87 116.55 127.90 1sro n ASP 64 Ca -0.18 -0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.11 1sro n ASP 64 Cb 0.53 0.51 0.00 0.00 -1.14 0.00 0.00 41.12 41.01 1sro n ASP 64 CO 0.00 0.00 0.00 -1.14 -1.33 0.00 0.00 177.20 174.73 1sro n ARG 65 N -2.01 0.00 0.00 0.11 0.00 -1.26 -4.95 116.66 108.55 1sro n ARG 65 Ca -0.00 0.02 0.00 0.00 -0.00 0.00 0.00 57.85 57.87 1sro n ARG 65 Cb 0.51 -0.89 0.00 0.00 0.00 0.00 0.00 32.46 32.07 1sro n ARG 65 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 1sro n GLN 66 N -0.56 0.00 -0.69 -0.14 7.27 -1.26 -4.98 117.38 117.02 1sro n GLN 66 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 57.00 57.04 1sro n GLN 66 Cb 0.00 -0.09 -0.03 0.00 2.41 0.00 0.00 30.24 32.53 1sro n GLN 66 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1sro n GLY 67 N -0.17 0.63 3.40 1.69 0.00 -1.26 -5.08 105.19 104.40 1sro n GLY 67 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1sro n GLY 67 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1sro s ARG 68 N 0.00 3.00 -0.27 1.61 1.04 -1.26 -5.02 118.95 118.05 1sro s ARG 68 Ca 0.00 -1.25 -0.40 0.00 -1.04 0.00 0.00 55.73 53.04 1sro s ARG 68 Cb 0.00 -4.11 -0.16 0.00 -2.04 0.00 0.00 34.95 28.64 1sro s ARG 68 CO 0.00 -1.04 1.72 -0.89 -0.04 0.00 0.00 175.30 175.06 1sro n ILE 69 N 5.27 0.28 -3.09 4.99 5.41 -1.26 -4.58 119.36 126.38 1sro n ILE 69 Ca -0.11 -0.05 -0.45 0.00 1.00 0.00 0.00 62.75 63.14 1sro n ILE 69 Cb 0.44 -1.18 -0.03 0.00 -0.71 0.00 0.00 39.64 38.17 1sro n ILE 69 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1sro s ARG 70 N 3.40 3.51 0.26 0.38 6.06 0.26 -4.36 118.95 128.45 1sro s ARG 70 Ca 0.98 -1.91 -0.11 0.00 -2.50 0.00 0.00 55.73 52.20 1sro s ARG 70 Cb -1.09 -4.64 -0.08 0.00 0.06 0.00 0.00 34.95 29.21 1sro s ARG 70 CO 0.66 -1.58 0.60 -0.51 -2.50 0.00 0.00 175.30 171.97 1sro s LEU 71 N 1.88 4.13 -0.26 -0.88 1.43 -1.26 0.20 118.68 123.92 1sro s LEU 71 Ca 0.24 1.01 0.02 0.00 -1.03 0.00 0.00 54.13 54.37 1sro s LEU 71 Cb -0.10 -3.79 0.07 0.00 0.03 0.00 0.00 46.19 42.40 1sro s LEU 71 CO -0.06 -0.11 -0.05 -0.44 0.23 0.00 0.00 176.35 175.91 1sro s SER 72 N -2.37 4.20 0.30 2.29 0.01 -0.26 -4.60 113.70 113.27 1sro s SER 72 Ca 0.49 -1.42 -0.27 0.00 1.31 0.00 0.00 55.95 56.06 1sro s SER 72 Cb -0.11 -1.35 -0.14 0.00 0.21 0.00 0.00 66.02 64.63 1sro s SER 72 CO 0.21 -0.25 0.90 -0.38 0.41 0.00 0.00 173.24 174.13 1sro n ILE 73 N 4.54 2.01 -1.34 1.44 5.41 -1.26 -1.18 119.36 128.99 1sro n ILE 73 Ca -0.10 -0.50 -0.38 0.00 1.00 0.00 0.00 62.75 62.77 1sro n ILE 73 Cb 0.43 -0.84 0.04 0.00 -0.71 0.00 0.00 39.64 38.56 1sro n ILE 73 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1sro n LYS 74 N 0.69 0.32 -3.48 0.38 4.76 -0.44 -3.20 118.16 117.19 1sro n LYS 74 Ca 0.11 0.13 -0.21 0.00 -2.87 0.00 0.00 58.31 55.46 1sro n LYS 74 Cb 0.32 -1.55 0.01 0.00 -1.84 0.00 0.00 35.03 31.98 1sro n LYS 74 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1sro n GLU 75 N 0.24 -1.68 0.00 1.97 -0.58 -1.26 -4.88 120.64 114.44 1sro n GLU 75 Ca 0.10 1.21 0.00 0.00 -0.42 0.00 0.00 57.16 58.05 1sro n GLU 75 Cb 0.48 -3.29 0.00 0.00 -0.57 0.00 0.00 31.44 28.07 1sro n GLU 75 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65