#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 1.13 -0.46 0.00 1.02 -1.26 -5.02 120.64 116.06 1sro n GLU 2 Ca 0.00 -0.28 0.00 0.00 -0.02 0.00 0.00 57.16 56.86 1sro n GLU 2 Cb 0.00 -0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1sro n GLU 2 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 1sro n ILE 3 N -0.93 -2.20 -4.38 -3.67 0.00 -1.26 -5.04 119.36 101.88 1sro n ILE 3 Ca 0.01 0.67 -0.22 0.00 0.00 0.00 0.00 62.75 63.20 1sro n ILE 3 Cb 0.05 -1.32 -0.11 0.00 0.00 0.00 0.00 39.64 38.26 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 -4.31 1.42 1.07 9.51 2.12 -1.26 -5.12 118.70 122.13 1sro s GLU 4 Ca 0.00 -1.56 -0.12 0.00 0.36 0.00 0.00 54.97 53.65 1sro s GLU 4 Cb 0.00 -1.45 0.23 0.00 0.26 0.00 0.00 34.13 33.17 1sro s GLU 4 CO 0.00 0.28 1.06 0.08 -0.54 0.00 0.00 175.26 176.14 1sro s VAL 5 N -2.35 2.11 0.00 3.70 1.01 -1.26 -2.97 120.40 120.64 1sro s VAL 5 Ca 0.22 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.23 1sro s VAL 5 Cb -0.05 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.09 1sro s VAL 5 CO 0.09 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.75 1sro n GLY 6 N 0.08 0.63 2.72 4.51 0.00 -1.07 -4.99 105.19 107.07 1sro n GLY 6 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.89 1sro n GLY 6 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1sro n ARG 7 N -1.98 -0.18 -3.65 1.61 0.63 -1.16 -4.75 116.66 107.19 1sro n ARG 7 Ca 0.00 -1.78 -0.38 0.00 -0.92 0.00 0.00 57.85 54.78 1sro n ARG 7 Cb 0.04 -0.60 -0.12 0.00 0.45 0.00 0.00 32.46 32.23 1sro n ARG 7 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1sro s VAL 8 N -2.36 4.90 -0.18 5.15 1.01 -1.26 -0.97 120.40 126.69 1sro s VAL 8 Ca 0.48 -0.01 -0.07 0.00 0.00 0.00 0.00 61.98 62.39 1sro s VAL 8 Cb -0.02 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1sro s VAL 8 CO 0.33 0.26 0.04 -0.31 0.00 0.00 0.00 175.10 175.42 1sro s TYR 9 N 1.70 3.21 -0.73 5.22 1.51 0.93 -4.85 117.35 124.34 1sro s TYR 9 Ca 0.07 -0.01 -0.26 0.00 -1.01 0.00 0.00 57.07 55.86 1sro s TYR 9 Cb -0.16 -2.06 0.00 0.00 -0.11 0.00 0.00 41.96 39.63 1sro s TYR 9 CO 0.08 0.11 1.62 0.99 -1.11 0.00 0.00 175.55 177.24 1sro s THR 10 N 0.39 3.55 -0.19 -0.71 2.01 -1.26 -1.11 115.64 118.32 1sro s THR 10 Ca 0.02 0.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.86 1sro s THR 10 Cb -0.13 -4.41 -0.00 0.00 0.01 0.00 0.00 72.50 67.97 1sro s THR 10 CO 0.01 -1.36 1.14 -0.83 -0.69 0.00 0.00 174.62 172.89 1sro s GLY 11 N 6.20 1.72 0.21 4.40 0.00 0.55 -4.66 107.32 115.73 1sro s GLY 11 Ca 0.54 0.33 -0.08 0.00 0.00 0.00 0.00 44.72 45.51 1sro s GLY 11 CO 0.14 2.31 0.50 0.54 0.00 0.00 0.00 173.10 176.59 1sro s LYS 12 N 3.24 3.73 -0.52 2.90 -0.14 -0.49 -1.54 119.74 126.91 1sro s LYS 12 Ca 0.49 0.13 -0.22 0.00 -1.36 0.00 0.00 55.97 55.01 1sro s LYS 12 Cb -0.18 -2.71 0.05 0.00 -1.68 0.00 0.00 37.83 33.30 1sro s LYS 12 CO 0.11 0.35 0.81 0.08 -0.76 0.00 0.00 175.35 175.94 1sro s VAL 13 N -1.80 4.60 0.00 3.17 1.01 -0.85 -1.30 120.40 125.23 1sro s VAL 13 Ca 0.45 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.44 1sro s VAL 13 Cb -0.11 -4.43 0.00 0.00 0.00 0.00 0.00 36.38 31.84 1sro s VAL 13 CO 0.23 -0.96 0.64 0.35 0.00 0.00 0.00 175.10 175.36 1sro n THR 14 N 5.97 0.30 -3.59 3.92 -2.24 -1.26 -2.59 114.28 114.79 1sro n THR 14 Ca -0.01 -0.63 -0.06 0.00 -2.27 0.00 0.00 64.05 61.07 1sro n THR 14 Cb 0.47 0.87 -0.04 0.00 -2.10 0.00 0.00 70.33 69.53 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 -0.30 0.38 0.05 -0.78 3.00 -1.22 -4.96 118.95 115.13 1sro s ARG 15 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 55.73 55.71 1sro s ARG 15 Cb 0.00 0.18 -0.03 0.00 0.00 0.00 0.00 34.95 35.09 1sro s ARG 15 CO 0.00 -0.14 -0.00 0.42 0.00 0.00 0.00 175.30 175.58 1sro s ILE 16 N -1.59 0.21 0.04 1.52 1.01 -1.26 -0.41 121.20 120.71 1sro s ILE 16 Ca 0.05 -1.71 -0.00 0.00 0.00 0.00 0.00 60.65 58.98 1sro s ILE 16 Cb -0.01 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.96 1sro s ILE 16 CO -0.04 -0.95 -0.03 0.68 0.00 0.00 0.00 174.94 174.60 1sro s VAL 17 N -3.85 0.21 0.19 2.92 -7.23 -0.27 -4.66 120.40 107.70 1sro s VAL 17 Ca 0.06 -1.42 -0.13 0.00 -1.81 0.00 0.00 61.98 58.68 1sro s VAL 17 Cb 0.07 -0.98 0.09 0.00 0.56 0.00 0.00 36.38 36.12 1sro s VAL 17 CO -0.10 -0.77 1.83 -0.78 -0.31 0.00 0.00 175.10 174.98 1sro h ASP 18 N 3.80 0.60 -0.40 4.85 3.58 -2.01 -1.57 116.42 125.27 1sro h ASP 18 Ca -0.33 -0.00 -0.13 0.00 0.42 0.00 0.00 57.03 56.99 1sro h ASP 18 Cb 1.17 -0.13 -0.07 0.00 1.72 0.00 0.00 39.33 42.01 1sro h ASP 18 CO 0.55 0.42 0.16 2.22 -2.88 0.00 0.00 179.24 179.71 1sro n PHE 19 N -4.73 1.33 -0.84 0.28 1.16 -1.26 -4.74 117.46 108.66 1sro n PHE 19 Ca 0.05 -0.76 0.00 0.00 -1.87 0.00 0.00 57.45 54.87 1sro n PHE 19 Cb 0.06 -0.46 0.00 0.00 -1.61 0.00 0.00 39.48 37.48 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 0.01 -0.39 3.29 4.97 0.00 -0.59 -2.84 105.19 109.64 1sro n GLY 20 Ca 0.22 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.97 0.22 4.61 0.00 0.18 -1.12 121.76 123.68 1sro s ALA 21 Ca 0.00 0.70 0.07 0.00 0.00 0.00 0.00 51.96 52.72 1sro s ALA 21 Cb 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 1sro s ALA 21 CO 0.00 -0.25 0.15 -0.06 0.00 0.00 0.00 175.76 175.59 1sro s PHE 22 N -0.83 3.07 0.04 0.00 0.40 0.45 0.12 117.98 121.23 1sro s PHE 22 Ca -0.09 -0.09 -0.15 0.00 -0.60 0.00 0.00 56.93 56.00 1sro s PHE 22 Cb -0.04 -1.42 0.02 0.00 0.51 0.00 0.00 43.02 42.10 1sro s PHE 22 CO 0.04 0.53 0.33 0.08 0.70 0.00 0.00 175.22 176.89 1sro s VAL 23 N -1.99 0.08 -0.03 -0.44 1.01 -0.14 -3.42 120.40 115.46 1sro s VAL 23 Ca 0.32 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 61.74 1sro s VAL 23 Cb -0.09 -0.93 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 1sro s VAL 23 CO 0.24 -0.35 -0.23 0.00 0.00 0.00 0.00 175.10 174.76 1sro s ALA 24 N -2.49 1.96 0.13 5.51 0.00 -0.42 0.15 121.76 126.61 1sro s ALA 24 Ca -0.05 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 50.93 1sro s ALA 24 Cb -0.01 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.57 1sro s ALA 24 CO -0.03 0.44 0.05 0.44 0.00 0.00 0.00 175.76 176.67 1sro n ILE 25 N 2.69 0.00 -2.56 0.00 -5.35 -0.33 -1.39 119.36 112.42 1sro n ILE 25 Ca -0.16 -0.57 -0.24 0.00 -0.27 0.00 0.00 62.75 61.51 1sro n ILE 25 Cb 0.52 -0.15 0.12 0.00 -1.74 0.00 0.00 39.64 38.38 1sro n ILE 25 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1sro s GLY 26 N -1.96 1.76 0.00 3.28 0.00 -1.26 -4.25 107.32 104.88 1sro s GLY 26 Ca 0.04 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 43.01 1sro s GLY 26 CO 0.03 -1.15 0.00 0.61 0.00 0.00 0.00 173.10 172.59 1sro n GLY 27 N -2.91 2.77 0.00 0.20 0.00 -1.26 -3.54 105.19 100.46 1sro n GLY 27 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1sro n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sro n GLY 28 N -2.00 1.14 3.57 -0.02 0.00 -1.26 -5.10 105.19 101.52 1sro n GLY 28 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.59 2.03 -0.01 1.61 1.02 -1.23 -5.05 119.74 117.52 1sro s LYS 29 Ca 0.00 -1.56 0.08 0.00 0.02 0.00 0.00 55.97 54.50 1sro s LYS 29 Cb 0.00 -2.00 -0.02 0.00 -0.52 0.00 0.00 37.83 35.29 1sro s LYS 29 CO 0.00 0.35 -0.25 -1.21 -0.92 0.00 0.00 175.35 173.32 1sro s GLU 30 N -3.60 2.08 0.59 1.68 0.41 -1.26 -1.19 118.70 117.41 1sro s GLU 30 Ca 0.31 -0.95 -0.01 0.00 -0.41 0.00 0.00 54.97 53.91 1sro s GLU 30 Cb -0.06 -2.07 0.12 0.00 -1.78 0.00 0.00 34.13 30.34 1sro s GLU 30 CO 0.18 0.56 0.80 0.41 -0.49 0.00 0.00 175.26 176.72 1sro n GLY 31 N 2.25 0.59 3.16 -1.39 0.00 0.40 -4.75 105.19 105.45 1sro n GLY 31 Ca -0.16 -2.00 -0.11 0.00 0.00 0.00 0.00 46.02 43.75 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 -0.49 -1.24 0.99 2.96 -1.26 -0.97 118.68 118.66 1sro s LEU 32 Ca 0.53 0.82 -0.04 0.00 -0.22 0.00 0.00 54.13 55.22 1sro s LEU 32 Cb -0.03 1.08 0.17 0.00 0.50 0.00 0.00 46.19 47.91 1sro s LEU 32 CO 0.35 -0.23 2.23 0.52 -1.32 0.00 0.00 176.35 177.90 1sro n VAL 33 N 5.36 5.48 -1.07 1.68 0.31 0.32 -4.47 118.33 125.94 1sro n VAL 33 Ca -0.08 -4.77 -0.35 0.00 -0.01 0.00 0.00 64.34 59.13 1sro n VAL 33 Cb 0.50 -1.94 0.08 0.00 -0.91 0.00 0.00 33.84 31.57 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 1.26 -1.94 -0.21 3.52 -0.00 -1.02 0.48 115.22 117.31 1sro n HIS 34 Ca 0.58 0.25 0.00 0.00 0.46 0.00 0.00 57.72 59.02 1sro n HIS 34 Cb 0.25 -1.77 0.09 0.00 -0.12 0.00 0.00 29.99 28.44 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 -0.83 0.43 -0.07 3.57 6.09 -1.77 -0.07 117.51 124.87 1sro h ILE 35 Ca -0.44 -0.02 -0.06 0.00 -1.37 0.00 0.00 64.86 62.97 1sro h ILE 35 Cb 1.33 0.37 -0.02 0.00 0.47 0.00 0.00 36.82 38.96 1sro h ILE 35 CO 0.36 0.01 0.02 -1.20 -3.07 0.00 0.00 178.15 174.28 1sro n SER 36 N -5.35 5.49 -2.73 2.19 7.64 -1.26 -4.08 113.62 115.52 1sro n SER 36 Ca 0.09 -2.50 -0.09 0.00 1.01 0.00 0.00 58.87 57.37 1sro n SER 36 Cb 0.35 -1.15 0.07 0.00 -1.01 0.00 0.00 64.21 62.47 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 1.44 1.14 0.00 1.43 6.02 -0.04 -4.93 117.38 122.44 1sro n GLN 37 Ca 0.08 -2.49 0.00 0.00 -0.01 0.00 0.00 57.00 54.58 1sro n GLN 37 Cb 0.54 -0.71 0.00 0.00 1.02 0.00 0.00 30.24 31.09 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 -0.24 0.00 -2.64 5.09 -0.00 -1.26 -4.36 119.36 115.95 1sro n ILE 38 Ca 0.05 0.00 -0.39 0.00 -0.00 0.00 0.00 62.75 62.41 1sro n ILE 38 Cb 0.81 0.00 0.01 0.00 -0.00 0.00 0.00 39.64 40.46 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 5.88 0.00 -1.39 0.00 -1.26 -4.68 120.51 116.06 1sro n ALA 39 Ca 0.00 -4.60 0.00 0.00 0.00 0.00 0.00 53.44 48.84 1sro n ALA 39 Cb 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.51 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 -0.12 0.00 0.00 0.00 -0.08 -1.26 -3.44 116.55 111.65 1sro n ASP 40 Ca 0.45 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.73 1sro n ASP 40 Cb 0.28 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.74 1sro n ASP 40 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1sro n LYS 41 N 0.00 0.00 -2.26 -0.67 5.02 -1.26 -4.88 118.16 114.11 1sro n LYS 41 Ca 0.00 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.95 1sro n LYS 41 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.97 1sro n LYS 41 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1sro s ARG 42 N 0.00 3.05 -0.40 1.97 0.52 -1.22 -4.76 118.95 118.10 1sro s ARG 42 Ca 0.00 -1.44 0.03 0.00 -0.52 0.00 0.00 55.73 53.80 1sro s ARG 42 Cb 0.00 -5.35 0.16 0.00 0.52 0.00 0.00 34.95 30.29 1sro s ARG 42 CO 0.00 -3.32 0.32 0.08 0.02 0.00 0.00 175.30 172.40 1sro s VAL 43 N 8.46 0.27 0.56 3.52 1.01 -1.26 -4.73 120.40 128.23 1sro s VAL 43 Ca 0.63 -2.42 0.46 0.00 0.00 0.00 0.00 61.98 60.65 1sro s VAL 43 Cb 0.01 -1.20 0.67 0.00 0.00 0.00 0.00 36.38 35.86 1sro s VAL 43 CO 0.11 -1.17 1.60 -0.08 0.00 0.00 0.00 175.10 175.56 1sro h GLU 44 N 5.92 0.00 -2.85 2.72 4.81 -2.00 -3.38 114.58 119.80 1sro h GLU 44 Ca 0.22 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.32 1sro h GLU 44 Cb 0.93 0.00 -0.24 0.00 0.63 0.00 0.00 28.75 30.07 1sro h GLU 44 CO 0.34 0.00 -0.27 0.15 -0.73 0.00 0.00 179.01 178.50 1sro s LYS 45 N -4.84 0.49 0.35 1.92 -0.14 -1.26 -5.02 119.74 111.24 1sro s LYS 45 Ca -0.05 0.40 0.18 0.00 -1.36 0.00 0.00 55.97 55.14 1sro s LYS 45 Cb 0.25 0.23 0.53 0.00 -1.68 0.00 0.00 37.83 37.16 1sro s LYS 45 CO 0.84 -0.08 1.66 0.28 -0.76 0.00 0.00 175.35 177.29 1sro h VAL 46 N 4.41 0.88 0.00 3.17 2.07 -1.84 -2.35 116.25 122.59 1sro h VAL 46 Ca -0.27 -1.70 0.00 0.00 0.82 0.00 0.00 66.70 65.54 1sro h VAL 46 Cb 1.18 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 1sro h VAL 46 CO 0.29 0.40 0.00 0.35 0.02 0.00 0.00 177.57 178.64 1sro n THR 47 N -3.45 0.00 -0.09 2.57 -2.24 -1.26 -1.16 114.28 108.66 1sro n THR 47 Ca 0.00 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 1sro n THR 47 Cb 0.57 -0.38 -0.15 0.00 -2.10 0.00 0.00 70.33 68.27 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 -0.84 0.45 -0.06 3.42 9.92 -0.89 -4.47 116.55 124.08 1sro n ASP 48 Ca 0.15 0.00 -0.05 0.00 -0.53 0.00 0.00 54.79 54.37 1sro n ASP 48 Cb 0.07 1.01 -0.15 0.00 -0.64 0.00 0.00 41.12 41.41 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 -2.65 0.17 -4.21 1.24 4.02 -1.15 -4.91 117.16 109.67 1sro n TYR 49 Ca -0.28 0.06 -0.35 0.00 -0.01 0.00 0.00 57.90 57.32 1sro n TYR 49 Cb 1.07 -0.92 -0.08 0.00 -0.02 0.00 0.00 39.34 39.38 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 -5.36 3.82 -0.03 7.72 2.01 -0.31 -5.10 118.68 121.43 1sro s LEU 50 Ca -0.08 0.22 0.01 0.00 0.01 0.00 0.00 54.13 54.28 1sro s LEU 50 Cb 0.08 -1.96 0.02 0.00 0.01 0.00 0.00 46.19 44.34 1sro s LEU 50 CO 0.84 0.37 -0.02 -1.58 1.01 0.00 0.00 176.35 176.97 1sro s GLN 51 N -1.08 0.48 -0.23 1.70 0.74 -1.26 -4.56 119.66 115.44 1sro s GLN 51 Ca 0.15 -0.04 -0.29 0.00 0.05 0.00 0.00 55.36 55.24 1sro s GLN 51 Cb -0.12 -0.55 -0.04 0.00 1.10 0.00 0.00 33.01 33.40 1sro s GLN 51 CO 0.05 -0.06 1.90 -1.64 -0.55 0.00 0.00 175.29 174.99 1sro s MET 52 N 0.70 3.46 0.00 1.67 -1.94 -1.26 -1.62 119.30 120.31 1sro s MET 52 Ca -0.08 1.78 0.00 0.00 -1.71 0.00 0.00 55.69 55.68 1sro s MET 52 Cb -0.11 -4.21 0.00 0.00 2.01 0.00 0.00 34.83 32.52 1sro s MET 52 CO -0.01 -1.71 0.00 0.41 -0.01 0.00 0.00 175.02 173.70 1sro n GLY 53 N 5.26 2.19 3.88 -0.03 0.00 -1.07 -5.04 105.19 110.39 1sro n GLY 53 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.22 2.27 0.04 1.61 -1.52 -0.64 -4.83 119.66 116.38 1sro s GLN 54 Ca 0.00 0.29 0.03 0.00 -1.95 0.00 0.00 55.36 53.74 1sro s GLN 54 Cb 0.00 -1.97 -0.02 0.00 -0.22 0.00 0.00 33.01 30.80 1sro s GLN 54 CO 0.00 -1.42 -0.10 -1.21 -0.25 0.00 0.00 175.29 172.31 1sro s GLU 55 N -5.45 0.68 -0.06 2.91 8.01 -1.26 -2.01 118.70 121.52 1sro s GLU 55 Ca 0.61 -0.72 -0.06 0.00 0.01 0.00 0.00 54.97 54.80 1sro s GLU 55 Cb -0.11 -0.59 0.01 0.00 -4.31 0.00 0.00 34.13 29.13 1sro s GLU 55 CO 0.51 0.13 0.17 0.14 0.01 0.00 0.00 175.26 176.22 1sro s VAL 56 N -1.06 0.01 -0.07 2.63 -7.23 -0.59 -5.01 120.40 109.09 1sro s VAL 56 Ca -0.04 -0.08 -0.30 0.00 -1.81 0.00 0.00 61.98 59.75 1sro s VAL 56 Cb -0.08 -0.27 -0.02 0.00 0.56 0.00 0.00 36.38 36.57 1sro s VAL 56 CO 0.01 -0.05 1.06 -2.16 -0.31 0.00 0.00 175.10 173.65 1sro s PRO 57 N -0.09 4.43 0.04 4.82 0.04 -1.26 -0.33 135.00 142.65 1sro s PRO 57 Ca -0.02 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.51 1sro s PRO 57 Cb -0.02 -3.52 -0.00 0.00 0.04 0.00 0.00 34.50 31.00 1sro s PRO 57 CO 0.00 -0.30 0.02 1.33 0.04 0.00 0.00 177.00 178.09 1sro n VAL 58 N 4.42 0.00 -4.06 -0.36 0.24 -0.27 -1.38 118.33 116.93 1sro n VAL 58 Ca 0.09 -0.24 -0.21 0.00 -2.04 0.00 0.00 64.34 61.93 1sro n VAL 58 Cb 0.48 0.09 -0.17 0.00 -1.47 0.00 0.00 33.84 32.78 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 -2.16 0.81 -0.86 7.34 1.02 0.29 -0.05 119.74 126.14 1sro s LYS 59 Ca 0.02 -0.06 -0.20 0.00 0.02 0.00 0.00 55.97 55.75 1sro s LYS 59 Cb 0.00 -0.90 -0.21 0.00 -0.52 0.00 0.00 37.83 36.21 1sro s LYS 59 CO 0.02 -0.14 2.33 0.28 -0.92 0.00 0.00 175.35 176.91 1sro n VAL 60 N 4.33 0.00 0.33 3.17 0.31 -0.14 -1.02 118.33 125.30 1sro n VAL 60 Ca -0.20 -0.50 0.21 0.00 -0.01 0.00 0.00 64.34 63.84 1sro n VAL 60 Cb 0.51 -1.34 1.10 0.00 -0.91 0.00 0.00 33.84 33.20 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 18.84 0.00 0.00 7.52 5.85 -0.10 -2.84 115.31 144.58 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 1.21 0.00 0.00 -1.84 -0.34 0.00 0.00 178.44 177.47 1sro n GLU 62 N -2.98 0.00 -3.90 1.25 0.28 -1.05 -4.91 120.64 109.33 1sro n GLU 62 Ca -0.03 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.87 1sro n GLU 62 Cb 0.13 0.00 -0.11 0.00 1.43 0.00 0.00 31.44 32.89 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 0.07 0.00 3.84 1.01 -1.26 -1.34 120.40 122.72 1sro s VAL 63 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1sro s VAL 63 Cb 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 36.08 1sro s VAL 63 CO 0.00 -0.33 0.00 -0.90 0.00 0.00 0.00 175.10 173.87 1sro n ASP 64 N 1.88 0.16 0.06 3.32 5.75 -1.26 -5.03 116.55 121.43 1sro n ASP 64 Ca -0.21 0.00 -0.13 0.00 -0.01 0.00 0.00 54.79 54.44 1sro n ASP 64 Cb 0.56 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.59 1sro n ASP 64 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1sro h ARG 65 N 0.00 -0.55 -5.19 0.11 3.08 -2.07 -3.39 114.38 106.37 1sro h ARG 65 Ca 0.00 0.04 -0.67 0.00 0.07 0.00 0.00 59.98 59.42 1sro h ARG 65 Cb 0.00 0.13 -0.33 0.00 0.08 0.00 0.00 29.97 29.84 1sro h ARG 65 CO 0.00 -0.37 -0.85 -0.65 -1.07 0.00 0.00 179.97 177.03 1sro s GLN 66 N -5.90 3.07 0.00 0.04 -0.21 -1.26 -5.01 119.66 110.38 1sro s GLN 66 Ca -0.16 -0.82 0.00 0.00 0.02 0.00 0.00 55.36 54.40 1sro s GLN 66 Cb 0.08 -2.49 0.00 0.00 1.00 0.00 0.00 33.01 31.60 1sro s GLN 66 CO 0.64 -0.02 0.00 0.41 -2.12 0.00 0.00 175.29 174.20 1sro n GLY 67 N 4.10 2.43 3.64 3.09 0.00 -1.26 -5.09 105.19 112.09 1sro n GLY 67 Ca -0.20 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 1sro n GLY 67 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sro s ARG 68 N -0.43 4.15 -0.27 1.61 0.52 -1.26 -4.14 118.95 119.13 1sro s ARG 68 Ca 0.00 0.63 -0.21 0.00 -0.52 0.00 0.00 55.73 55.63 1sro s ARG 68 Cb 0.00 -3.63 0.03 0.00 0.52 0.00 0.00 34.95 31.87 1sro s ARG 68 CO 0.00 -0.38 0.37 -0.89 0.02 0.00 0.00 175.30 174.42 1sro n ILE 69 N 5.06 -4.24 -3.04 1.52 5.41 -1.26 -4.83 119.36 117.98 1sro n ILE 69 Ca 0.00 0.41 -0.43 0.00 1.00 0.00 0.00 62.75 63.73 1sro n ILE 69 Cb 0.49 -3.83 -0.06 0.00 -0.71 0.00 0.00 39.64 35.53 1sro n ILE 69 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1sro s ARG 70 N -1.87 3.45 0.06 0.38 1.81 -0.45 -4.29 118.95 118.04 1sro s ARG 70 Ca 0.21 -0.12 0.00 0.00 -1.72 0.00 0.00 55.73 54.10 1sro s ARG 70 Cb -0.02 -3.91 -0.04 0.00 -0.45 0.00 0.00 34.95 30.53 1sro s ARG 70 CO 0.54 -0.98 0.20 -0.51 -0.68 0.00 0.00 175.30 173.87 1sro s LEU 71 N 3.01 4.34 -0.33 2.53 1.43 -1.26 0.63 118.68 129.02 1sro s LEU 71 Ca 0.27 0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 53.61 1sro s LEU 71 Cb -0.13 -2.93 0.07 0.00 0.03 0.00 0.00 46.19 43.22 1sro s LEU 71 CO 0.19 0.17 0.06 -0.44 0.23 0.00 0.00 176.35 176.56 1sro s SER 72 N -2.50 4.98 0.25 2.29 0.01 -0.19 -4.75 113.70 113.79 1sro s SER 72 Ca 0.35 -1.53 -0.30 0.00 1.31 0.00 0.00 55.95 55.78 1sro s SER 72 Cb -0.13 -1.74 -0.10 0.00 0.21 0.00 0.00 66.02 64.26 1sro s SER 72 CO 0.28 -0.34 1.42 -0.63 0.41 0.00 0.00 173.24 174.37 1sro s ILE 73 N 1.20 2.72 0.00 1.44 1.01 -1.26 -0.54 121.20 125.76 1sro s ILE 73 Ca -0.01 0.61 0.00 0.00 0.00 0.00 0.00 60.65 61.25 1sro s ILE 73 Cb -0.20 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 38.88 1sro s ILE 73 CO -0.02 0.10 0.00 1.17 0.00 0.00 0.00 174.94 176.19 1sro n LYS 74 N 2.27 3.02 -0.15 2.79 3.00 -0.48 -4.89 118.16 123.72 1sro n LYS 74 Ca 0.06 0.00 -0.09 0.00 -0.00 0.00 0.00 58.31 58.28 1sro n LYS 74 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.43 1sro n LYS 74 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1sro h GLU 75 N 0.00 0.67 0.00 1.64 3.07 -1.91 -3.46 114.58 114.59 1sro h GLU 75 Ca 0.00 -0.16 0.00 0.00 -0.50 0.00 0.00 59.36 58.70 1sro h GLU 75 Cb 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 1sro h GLU 75 CO 0.00 0.68 0.00 0.00 -1.40 0.00 0.00 179.01 178.29