#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 -0.29 -0.33 0.00 2.13 -1.26 -4.95 120.64 115.95 1sro n GLU 2 Ca 0.00 0.19 0.00 0.00 0.66 0.00 0.00 57.16 58.01 1sro n GLU 2 Cb 0.00 -0.35 0.00 0.00 0.27 0.00 0.00 31.44 31.36 1sro n GLU 2 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 1sro n ILE 3 N -1.44 0.00 -4.19 6.31 -0.00 -1.26 -5.16 119.36 113.61 1sro n ILE 3 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 62.75 62.57 1sro n ILE 3 Cb 0.06 0.00 -0.15 0.00 -0.00 0.00 0.00 39.64 39.55 1sro n ILE 3 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 1sro s GLU 4 N 0.51 0.63 0.75 6.28 2.12 -1.26 -5.14 118.70 122.59 1sro s GLU 4 Ca 0.00 -0.17 -0.13 0.00 0.36 0.00 0.00 54.97 55.03 1sro s GLU 4 Cb 0.00 -0.63 0.05 0.00 0.26 0.00 0.00 34.13 33.81 1sro s GLU 4 CO 0.00 0.05 1.12 0.08 -0.54 0.00 0.00 175.26 175.97 1sro s VAL 5 N 0.30 2.95 0.00 3.70 1.01 -1.26 -2.88 120.40 124.22 1sro s VAL 5 Ca -0.04 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1sro s VAL 5 Cb -0.08 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.49 1sro s VAL 5 CO -0.00 -0.34 0.00 0.61 0.00 0.00 0.00 175.10 175.37 1sro n GLY 6 N -0.52 1.64 3.89 4.51 0.00 -1.21 -5.02 105.19 108.48 1sro n GLY 6 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.26 3.59 0.00 1.61 3.52 -1.14 -4.74 118.95 121.53 1sro s ARG 7 Ca 0.00 0.39 -0.16 0.00 -0.13 0.00 0.00 55.73 55.83 1sro s ARG 7 Cb 0.00 -2.29 -0.06 0.00 -1.56 0.00 0.00 34.95 31.04 1sro s ARG 7 CO 0.00 -0.29 0.46 0.08 -0.81 0.00 0.00 175.30 174.74 1sro s VAL 8 N -2.83 4.97 0.38 7.11 1.01 -1.26 -1.79 120.40 128.00 1sro s VAL 8 Ca 0.50 0.95 0.00 0.00 0.00 0.00 0.00 61.98 63.43 1sro s VAL 8 Cb -0.10 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1sro s VAL 8 CO 0.46 0.54 0.01 -1.22 0.00 0.00 0.00 175.10 174.89 1sro n TYR 9 N 2.03 0.81 -3.55 5.22 4.02 -0.45 -4.92 117.16 120.31 1sro n TYR 9 Ca -0.12 -1.88 -0.20 0.00 -0.01 0.00 0.00 57.90 55.69 1sro n TYR 9 Cb 0.52 -0.26 -0.14 0.00 -0.02 0.00 0.00 39.34 39.44 1sro n TYR 9 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1sro s THR 10 N -2.37 -0.26 0.14 -0.72 2.01 -1.26 -1.33 115.64 111.86 1sro s THR 10 Ca 0.01 -0.04 0.08 0.00 0.31 0.00 0.00 61.69 62.05 1sro s THR 10 Cb -0.00 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.89 1sro s THR 10 CO 0.01 -0.16 -0.19 -0.83 -0.69 0.00 0.00 174.62 172.76 1sro s GLY 11 N 2.27 1.34 0.43 4.40 0.00 -0.60 -4.66 107.32 110.51 1sro s GLY 11 Ca 0.05 -1.40 0.03 0.00 0.00 0.00 0.00 44.72 43.40 1sro s GLY 11 CO -0.10 -1.43 0.62 0.54 0.00 0.00 0.00 173.10 172.72 1sro s LYS 12 N -2.48 2.98 -0.55 2.90 1.02 0.25 -1.51 119.74 122.35 1sro s LYS 12 Ca 0.12 -0.76 -0.23 0.00 0.02 0.00 0.00 55.97 55.12 1sro s LYS 12 Cb -0.07 -2.65 0.05 0.00 -0.52 0.00 0.00 37.83 34.64 1sro s LYS 12 CO 0.06 -0.24 0.86 0.08 -0.92 0.00 0.00 175.35 175.19 1sro s VAL 13 N -2.45 4.51 -0.29 3.17 1.01 -0.71 -1.59 120.40 124.04 1sro s VAL 13 Ca 0.49 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.53 1sro s VAL 13 Cb -0.10 -4.49 0.06 0.00 0.00 0.00 0.00 36.38 31.85 1sro s VAL 13 CO 0.35 -1.06 0.89 0.35 0.00 0.00 0.00 175.10 175.63 1sro n THR 14 N 6.03 0.63 -3.59 3.92 -2.24 -1.26 -1.33 114.28 116.44 1sro n THR 14 Ca -0.01 -0.81 -0.10 0.00 -2.27 0.00 0.00 64.05 60.86 1sro n THR 14 Cb 0.47 0.71 -0.05 0.00 -2.10 0.00 0.00 70.33 69.35 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 -0.72 0.54 0.11 -0.78 3.00 -1.25 -4.98 118.95 114.88 1sro s ARG 15 Ca 0.05 0.16 -0.03 0.00 0.00 0.00 0.00 55.73 55.91 1sro s ARG 15 Cb 0.03 0.25 -0.03 0.00 0.00 0.00 0.00 34.95 35.20 1sro s ARG 15 CO 0.04 -0.16 0.09 0.42 0.00 0.00 0.00 175.30 175.69 1sro s ILE 16 N -1.00 0.13 0.03 1.52 1.01 -1.26 -0.51 121.20 121.12 1sro s ILE 16 Ca -0.00 -1.72 -0.05 0.00 0.00 0.00 0.00 60.65 58.87 1sro s ILE 16 Cb -0.01 -1.81 -0.01 0.00 0.01 0.00 0.00 42.46 40.64 1sro s ILE 16 CO 0.00 -0.59 0.09 0.68 0.00 0.00 0.00 174.94 175.12 1sro s VAL 17 N -3.98 0.12 0.22 2.92 -7.23 -0.24 -4.66 120.40 107.54 1sro s VAL 17 Ca 0.17 -1.01 -0.08 0.00 -1.81 0.00 0.00 61.98 59.25 1sro s VAL 17 Cb 0.07 -0.74 0.17 0.00 0.56 0.00 0.00 36.38 36.43 1sro s VAL 17 CO -0.03 -0.55 1.85 -0.78 -0.31 0.00 0.00 175.10 175.28 1sro h ASP 18 N 3.88 0.77 -0.52 4.85 1.82 -2.01 -1.15 116.42 124.06 1sro h ASP 18 Ca -0.32 0.00 -0.26 0.00 -0.39 0.00 0.00 57.03 56.06 1sro h ASP 18 Cb 1.19 -0.16 -0.15 0.00 0.68 0.00 0.00 39.33 40.88 1sro h ASP 18 CO 0.48 0.52 0.33 2.22 -1.61 0.00 0.00 179.24 181.18 1sro n PHE 19 N -4.64 1.60 -0.44 0.28 1.16 -1.26 -4.78 117.46 109.38 1sro n PHE 19 Ca 0.09 -1.17 0.00 0.00 -1.87 0.00 0.00 57.45 54.50 1sro n PHE 19 Cb 0.11 -0.60 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 -0.33 0.12 3.33 4.97 0.00 -0.43 -3.37 105.19 109.47 1sro n GLY 20 Ca 0.31 -1.23 -0.15 0.00 0.00 0.00 0.00 46.02 44.95 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 -1.09 0.32 4.61 0.00 0.16 -1.08 121.76 123.67 1sro s ALA 21 Ca 0.00 0.71 0.08 0.00 0.00 0.00 0.00 51.96 52.75 1sro s ALA 21 Cb 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.05 1sro s ALA 21 CO 0.00 -0.29 0.22 -0.06 0.00 0.00 0.00 175.76 175.64 1sro s PHE 22 N -1.11 2.88 0.18 0.00 0.40 0.34 0.13 117.98 120.80 1sro s PHE 22 Ca -0.11 -0.28 -0.11 0.00 -0.60 0.00 0.00 56.93 55.83 1sro s PHE 22 Cb -0.04 -1.65 -0.00 0.00 0.51 0.00 0.00 43.02 41.84 1sro s PHE 22 CO 0.05 0.31 0.35 0.08 0.70 0.00 0.00 175.22 176.71 1sro s VAL 23 N -2.30 0.05 0.00 -0.44 1.01 -0.12 -3.79 120.40 114.82 1sro s VAL 23 Ca 0.38 -1.27 0.03 0.00 0.00 0.00 0.00 61.98 61.13 1sro s VAL 23 Cb -0.05 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 1sro s VAL 23 CO 0.25 -0.24 -0.10 0.00 0.00 0.00 0.00 175.10 175.01 1sro s ALA 24 N -3.95 0.84 0.00 5.51 0.00 -0.62 0.64 121.76 124.18 1sro s ALA 24 Ca 0.16 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1sro s ALA 24 Cb 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.96 1sro s ALA 24 CO 0.00 0.19 0.00 0.44 0.00 0.00 0.00 175.76 176.39 1sro n ILE 25 N 2.62 0.00 -0.17 0.00 -5.35 -0.59 -0.58 119.36 115.29 1sro n ILE 25 Ca -0.15 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.33 1sro n ILE 25 Cb 0.56 -0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.30 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 4.23 -2.17 0.13 3.28 0.00 -1.07 -4.82 105.19 104.77 1sro n GLY 26 Ca 0.00 -1.43 0.04 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.16 0.00 0.00 -0.02 0.00 -2.03 -3.35 103.07 97.51 1sro h GLY 27 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1sro h GLY 27 CO 0.00 0.00 -0.64 0.61 0.00 0.00 0.00 176.54 176.51 1sro n GLY 28 N 1.26 0.21 3.75 4.60 0.00 -1.26 -5.00 105.19 108.75 1sro n GLY 28 Ca -0.02 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 1sro n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sro s LYS 29 N -1.84 3.06 0.05 1.61 1.02 -1.26 -5.07 119.74 117.32 1sro s LYS 29 Ca 0.00 -0.42 0.04 0.00 0.02 0.00 0.00 55.97 55.61 1sro s LYS 29 Cb 0.04 -2.87 -0.03 0.00 -0.52 0.00 0.00 37.83 34.46 1sro s LYS 29 CO 0.22 0.68 -0.11 -1.83 -0.92 0.00 0.00 175.35 173.39 1sro s GLU 30 N -1.32 0.69 0.17 1.68 4.04 -1.26 -1.54 118.70 121.15 1sro s GLU 30 Ca 0.18 -0.83 0.02 0.00 0.04 0.00 0.00 54.97 54.38 1sro s GLU 30 Cb -0.12 -0.59 0.03 0.00 0.02 0.00 0.00 34.13 33.48 1sro s GLU 30 CO 0.08 0.13 0.24 0.41 -1.84 0.00 0.00 175.26 174.27 1sro n GLY 31 N 1.45 1.63 3.18 -3.83 0.00 0.21 -4.73 105.19 103.10 1sro n GLY 31 Ca -0.21 -2.11 -0.10 0.00 0.00 0.00 0.00 46.02 43.60 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 -0.55 -1.17 0.99 2.96 -1.26 -0.94 118.68 118.71 1sro s LEU 32 Ca 0.17 0.86 -0.03 0.00 -0.22 0.00 0.00 54.13 54.91 1sro s LEU 32 Cb -0.01 1.16 0.23 0.00 0.50 0.00 0.00 46.19 48.07 1sro s LEU 32 CO 0.11 -0.24 2.03 0.52 -1.32 0.00 0.00 176.35 177.46 1sro n VAL 33 N 5.38 5.62 -0.84 1.68 0.31 0.34 -4.45 118.33 126.37 1sro n VAL 33 Ca -0.08 -5.23 -0.34 0.00 -0.01 0.00 0.00 64.34 58.69 1sro n VAL 33 Cb 0.49 -1.84 0.10 0.00 -0.91 0.00 0.00 33.84 31.68 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 0.98 -2.38 -0.33 3.52 -0.00 -0.84 0.37 115.22 116.54 1sro n HIS 34 Ca 0.51 0.17 0.08 0.00 0.46 0.00 0.00 57.72 58.94 1sro n HIS 34 Cb 0.26 -1.68 0.24 0.00 -0.12 0.00 0.00 29.99 28.70 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 -1.45 0.79 -0.08 3.57 6.09 -1.80 0.27 117.51 124.91 1sro h ILE 35 Ca -0.44 -0.27 -0.04 0.00 -1.37 0.00 0.00 64.86 62.74 1sro h ILE 35 Cb 1.29 -0.05 -0.02 0.00 0.47 0.00 0.00 36.82 38.51 1sro h ILE 35 CO 0.31 0.14 0.05 -1.20 -3.07 0.00 0.00 178.15 174.39 1sro n SER 36 N -4.77 3.13 -2.98 2.19 7.64 -1.26 -4.23 113.62 113.35 1sro n SER 36 Ca 0.19 -2.14 -0.15 0.00 1.01 0.00 0.00 58.87 57.77 1sro n SER 36 Cb 0.43 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 1sro n SER 36 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sro n GLN 37 N 0.40 0.86 0.00 1.43 6.02 0.08 -5.06 117.38 121.11 1sro n GLN 37 Ca 0.05 -2.62 0.00 0.00 -0.01 0.00 0.00 57.00 54.42 1sro n GLN 37 Cb 0.59 -1.36 0.00 0.00 1.02 0.00 0.00 30.24 30.49 1sro n GLN 37 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1sro n ILE 38 N 0.96 0.00 -0.40 5.09 -0.00 -1.26 -4.10 119.36 119.65 1sro n ILE 38 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.91 1sro n ILE 38 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.26 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 0.00 -0.28 -1.39 0.00 -1.26 -4.70 120.51 109.88 1sro n ALA 39 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1sro n ALA 39 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 1sro n ALA 39 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1sro h ASP 40 N 0.00 -0.99 0.00 0.00 1.82 -1.96 -3.44 116.42 111.85 1sro h ASP 40 Ca 0.00 0.25 0.00 0.00 -0.39 0.00 0.00 57.03 56.89 1sro h ASP 40 Cb 0.00 0.57 0.00 0.00 0.68 0.00 0.00 39.33 40.58 1sro h ASP 40 CO 0.00 -0.28 0.00 0.29 -1.61 0.00 0.00 179.24 177.64 1sro n LYS 41 N -5.49 0.00 -2.20 0.28 5.02 -1.26 -5.06 118.16 109.45 1sro n LYS 41 Ca 0.09 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.98 1sro n LYS 41 Cb 0.39 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.39 1sro n LYS 41 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1sro n ARG 42 N 0.00 2.67 -2.64 1.97 5.12 -1.26 -4.59 116.66 117.93 1sro n ARG 42 Ca 0.00 -2.87 -0.11 0.00 -1.93 0.00 0.00 57.85 52.94 1sro n ARG 42 Cb 0.00 -3.46 0.03 0.00 -1.16 0.00 0.00 32.46 27.87 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 6.39 1.17 -0.46 1.55 0.31 -1.26 -4.91 118.33 121.13 1sro n VAL 43 Ca 0.49 -3.28 0.41 0.00 -0.01 0.00 0.00 64.34 61.94 1sro n VAL 43 Cb 0.44 0.44 0.75 0.00 -0.91 0.00 0.00 33.84 34.57 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 2.94 0.03 -4.86 5.55 3.07 -1.94 -3.30 114.58 116.08 1sro h GLU 44 Ca -0.05 -0.00 -0.67 0.00 -0.50 0.00 0.00 59.36 58.13 1sro h GLU 44 Cb 1.15 -0.01 -0.29 0.00 -0.84 0.00 0.00 28.75 28.76 1sro h GLU 44 CO 0.54 0.02 -0.69 0.15 -1.40 0.00 0.00 179.01 177.63 1sro s LYS 45 N -4.99 2.93 0.45 2.33 1.02 -1.26 -4.94 119.74 115.27 1sro s LYS 45 Ca -0.06 -0.94 0.25 0.00 0.02 0.00 0.00 55.97 55.25 1sro s LYS 45 Cb 0.25 -3.16 0.86 0.00 -0.52 0.00 0.00 37.83 35.25 1sro s LYS 45 CO 0.84 -0.43 1.79 -0.39 -0.92 0.00 0.00 175.35 176.24 1sro h VAL 46 N 6.03 0.39 0.00 3.17 -1.51 -1.84 -2.36 116.25 120.14 1sro h VAL 46 Ca -0.31 -1.08 0.00 0.00 -1.23 0.00 0.00 66.70 64.07 1sro h VAL 46 Cb 1.11 1.81 0.00 0.00 -2.13 0.00 0.00 31.29 32.08 1sro h VAL 46 CO 0.58 0.17 0.00 0.35 -1.23 0.00 0.00 177.57 177.45 1sro n THR 47 N -3.27 0.00 -0.08 7.19 -2.24 -1.26 -1.35 114.28 113.27 1sro n THR 47 Ca 0.01 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.71 1sro n THR 47 Cb 0.45 -0.35 -0.13 0.00 -2.10 0.00 0.00 70.33 68.20 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 -0.78 0.98 -0.07 3.42 9.92 -0.89 -4.52 116.55 124.61 1sro n ASP 48 Ca 0.12 0.00 -0.10 0.00 -0.53 0.00 0.00 54.79 54.28 1sro n ASP 48 Cb 0.05 0.91 -0.15 0.00 -0.64 0.00 0.00 41.12 41.29 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 -2.60 0.36 -4.09 1.24 4.02 -1.14 -4.89 117.16 110.06 1sro n TYR 49 Ca -0.26 0.13 -0.35 0.00 -0.01 0.00 0.00 57.90 57.41 1sro n TYR 49 Cb 1.02 -1.07 -0.09 0.00 -0.02 0.00 0.00 39.34 39.19 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 -5.71 3.83 -0.06 7.72 2.01 -0.46 -5.09 118.68 120.93 1sro s LEU 50 Ca -0.08 0.15 -0.01 0.00 0.01 0.00 0.00 54.13 54.20 1sro s LEU 50 Cb 0.07 -1.94 0.03 0.00 0.01 0.00 0.00 46.19 44.35 1sro s LEU 50 CO 0.83 0.26 -0.00 -1.10 1.01 0.00 0.00 176.35 177.35 1sro s GLN 51 N -0.16 0.52 -0.33 1.70 -0.21 -1.26 -4.58 119.66 115.34 1sro s GLN 51 Ca 0.07 0.09 -0.34 0.00 0.02 0.00 0.00 55.36 55.20 1sro s GLN 51 Cb -0.12 -0.81 -0.10 0.00 1.00 0.00 0.00 33.01 32.98 1sro s GLN 51 CO 0.01 -0.24 2.20 -1.33 -2.12 0.00 0.00 175.29 173.81 1sro n MET 52 N 4.78 1.22 0.00 2.91 2.81 -1.26 -1.31 117.12 126.28 1sro n MET 52 Ca -0.13 0.33 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 1sro n MET 52 Cb 0.50 -2.59 0.00 0.00 -0.71 0.00 0.00 33.22 30.42 1sro n MET 52 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1sro n GLY 53 N 6.43 1.36 3.93 3.03 0.00 -0.44 -4.98 105.19 114.53 1sro n GLY 53 Ca 0.39 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 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 1.10 -0.10 1.61 -0.21 -0.43 -4.78 119.66 116.84 1sro s GLN 54 Ca 0.00 -0.32 -0.03 0.00 0.02 0.00 0.00 55.36 55.03 1sro s GLN 54 Cb 0.00 -1.92 0.05 0.00 1.00 0.00 0.00 33.01 32.15 1sro s GLN 54 CO 0.00 -2.10 0.14 -1.21 -2.12 0.00 0.00 175.29 170.00 1sro s GLU 55 N -5.74 0.04 0.02 2.91 2.02 -1.26 -1.74 118.70 114.94 1sro s GLU 55 Ca 0.70 0.42 0.02 0.00 0.02 0.00 0.00 54.97 56.13 1sro s GLU 55 Cb -0.06 -0.59 -0.01 0.00 0.10 0.00 0.00 34.13 33.56 1sro s GLU 55 CO 0.51 -0.39 -0.07 0.14 0.02 0.00 0.00 175.26 175.47 1sro s VAL 56 N 2.26 0.49 0.48 2.63 -7.23 -0.57 -4.98 120.40 113.48 1sro s VAL 56 Ca 0.04 -0.69 -0.13 0.00 -1.81 0.00 0.00 61.98 59.39 1sro s VAL 56 Cb -0.13 -0.49 -0.07 0.00 0.56 0.00 0.00 36.38 36.25 1sro s VAL 56 CO -0.06 -0.15 0.89 -2.16 -0.31 0.00 0.00 175.10 173.30 1sro s PRO 57 N -0.91 3.81 0.14 4.82 0.04 -1.26 -1.55 135.00 140.08 1sro s PRO 57 Ca -0.04 0.68 -0.02 0.00 0.04 0.00 0.00 61.00 61.66 1sro s PRO 57 Cb -0.06 -2.25 0.01 0.00 0.04 0.00 0.00 34.50 32.24 1sro s PRO 57 CO 0.00 -0.21 0.21 1.33 0.04 0.00 0.00 177.00 178.37 1sro n VAL 58 N -1.66 0.00 -4.91 -0.36 0.24 -0.44 -1.59 118.33 109.61 1sro n VAL 58 Ca 0.04 -0.64 -0.29 0.00 -2.04 0.00 0.00 64.34 61.41 1sro n VAL 58 Cb 0.54 0.42 -0.17 0.00 -1.47 0.00 0.00 33.84 33.16 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 -2.26 2.55 -0.75 7.34 1.02 -0.43 -1.35 119.74 125.87 1sro s LYS 59 Ca 0.10 -0.70 -0.26 0.00 0.02 0.00 0.00 55.97 55.13 1sro s LYS 59 Cb -0.01 -2.00 -0.14 0.00 -0.52 0.00 0.00 37.83 35.17 1sro s LYS 59 CO 0.08 0.10 2.41 0.28 -0.92 0.00 0.00 175.35 177.30 1sro n VAL 60 N 3.71 -0.01 0.28 3.17 0.31 -0.74 -1.45 118.33 123.60 1sro n VAL 60 Ca -0.20 -0.54 0.19 0.00 -0.01 0.00 0.00 64.34 63.77 1sro n VAL 60 Cb 0.52 -2.06 1.02 0.00 -0.91 0.00 0.00 33.84 32.41 1sro n VAL 60 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1sro h LEU 61 N 21.89 0.00 0.00 7.52 5.85 -0.38 -3.19 115.31 147.00 1sro h LEU 61 Ca -0.04 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1sro h LEU 61 Cb 1.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.08 1sro h LEU 61 CO 1.04 0.00 0.00 -1.84 -0.34 0.00 0.00 178.44 177.30 1sro n GLU 62 N -2.81 0.00 -3.66 1.25 0.28 -1.12 -4.94 120.64 109.64 1sro n GLU 62 Ca -0.02 0.00 -0.20 0.00 -0.16 0.00 0.00 57.16 56.78 1sro n GLU 62 Cb 0.06 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 32.76 1sro n GLU 62 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1sro s VAL 63 N 0.00 -0.14 0.00 3.84 1.01 -1.26 -0.94 120.40 122.91 1sro s VAL 63 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.35 1sro s VAL 63 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.17 1sro s VAL 63 CO 0.00 0.14 0.00 -0.90 0.00 0.00 0.00 175.10 174.34 1sro n ASP 64 N 5.30 0.00 0.00 3.32 5.75 -1.26 -5.00 116.55 124.66 1sro n ASP 64 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.74 1sro n ASP 64 Cb 0.50 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 1sro n ASP 64 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1sro n ARG 65 N 0.00 0.00 -3.79 0.11 1.74 -1.26 -4.24 116.66 109.22 1sro n ARG 65 Ca 0.00 0.62 -0.36 0.00 -0.77 0.00 0.00 57.85 57.34 1sro n ARG 65 Cb 0.00 -1.23 -0.11 0.00 -1.02 0.00 0.00 32.46 30.10 1sro n ARG 65 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 1sro s GLN 66 N -1.92 3.88 0.00 5.56 -2.07 -1.26 -4.97 119.66 118.88 1sro s GLN 66 Ca 0.00 -0.37 0.00 0.00 -1.82 0.00 0.00 55.36 53.17 1sro s GLN 66 Cb 0.00 -3.39 0.00 0.00 -1.09 0.00 0.00 33.01 28.53 1sro s GLN 66 CO 0.00 -0.00 0.00 0.41 -1.32 0.00 0.00 175.29 174.38 1sro n GLY 67 N 4.41 1.63 3.68 2.60 0.00 -1.26 -5.11 105.19 111.14 1sro n GLY 67 Ca -0.16 0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.21 4.28 -0.21 1.61 1.70 -1.26 -4.26 118.95 120.60 1sro s ARG 68 Ca 0.00 0.69 -0.12 0.00 -0.47 0.00 0.00 55.73 55.83 1sro s ARG 68 Cb 0.00 -3.54 0.02 0.00 -0.57 0.00 0.00 34.95 30.86 1sro s ARG 68 CO 0.00 -0.15 0.23 -0.89 -1.08 0.00 0.00 175.30 173.41 1sro n ILE 69 N 4.41 -5.00 -2.93 4.99 5.41 -1.26 -4.79 119.36 120.19 1sro n ILE 69 Ca -0.01 0.65 -0.44 0.00 1.00 0.00 0.00 62.75 63.95 1sro n ILE 69 Cb 0.50 -4.19 -0.02 0.00 -0.71 0.00 0.00 39.64 35.22 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 -1.64 3.69 0.08 0.38 6.06 -0.12 -4.30 118.95 123.10 1sro s ARG 70 Ca 0.13 -1.91 -0.18 0.00 -2.50 0.00 0.00 55.73 51.27 1sro s ARG 70 Cb -0.02 -4.95 -0.07 0.00 0.06 0.00 0.00 34.95 29.98 1sro s ARG 70 CO 0.44 -1.77 0.55 -0.51 -2.50 0.00 0.00 175.30 171.50 1sro s LEU 71 N 2.49 4.49 -0.30 -0.88 1.43 -1.26 0.39 118.68 125.05 1sro s LEU 71 Ca 0.35 1.20 -0.01 0.00 -1.03 0.00 0.00 54.13 54.64 1sro s LEU 71 Cb -0.04 -2.92 0.05 0.00 0.03 0.00 0.00 46.19 43.31 1sro s LEU 71 CO -0.08 0.26 -0.02 -0.44 0.23 0.00 0.00 176.35 176.30 1sro s SER 72 N -1.20 4.81 -0.14 2.29 0.01 -0.53 -4.31 113.70 114.63 1sro s SER 72 Ca 0.30 -1.33 -0.41 0.00 1.31 0.00 0.00 55.95 55.82 1sro s SER 72 Cb -0.18 -1.68 -0.19 0.00 0.21 0.00 0.00 66.02 64.17 1sro s SER 72 CO 0.18 -0.25 1.33 -0.38 0.41 0.00 0.00 173.24 174.53 1sro n ILE 73 N 4.58 0.03 0.00 1.44 5.41 -1.26 -1.31 119.36 128.26 1sro n ILE 73 Ca -0.13 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.62 1sro n ILE 73 Cb 0.43 -0.42 0.00 0.00 -0.71 0.00 0.00 39.64 38.94 1sro n ILE 73 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 1sro n LYS 74 N 2.77 1.18 -1.82 0.38 2.85 -0.62 -4.79 118.16 118.11 1sro n LYS 74 Ca 0.23 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 57.12 1sro n LYS 74 Cb 0.07 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.50 1sro n LYS 74 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1sro n GLU 75 N 0.00 2.80 0.00 -1.58 4.07 -1.26 -4.80 120.64 119.86 1sro n GLU 75 Ca 0.00 -3.54 0.05 0.00 -0.06 0.00 0.00 57.16 53.61 1sro n GLU 75 Cb 0.00 -2.27 0.04 0.00 -0.06 0.00 0.00 31.44 29.15 1sro n GLU 75 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07