#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 -1.15 -0.22 0.00 -0.58 -1.26 -5.00 120.64 112.44 1sro n GLU 2 Ca 0.00 0.76 0.00 0.00 -0.42 0.00 0.00 57.16 57.50 1sro n GLU 2 Cb 0.00 -1.40 0.00 0.00 -0.57 0.00 0.00 31.44 29.47 1sro n GLU 2 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1sro n ILE 3 N -2.38 0.00 -3.93 -3.67 -0.00 -1.26 -5.14 119.36 102.98 1sro n ILE 3 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 62.75 62.47 1sro n ILE 3 Cb 0.26 0.00 -0.16 0.00 -0.00 0.00 0.00 39.64 39.74 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 0.68 1.68 1.03 6.28 2.12 -1.26 -5.12 118.70 124.11 1sro s GLU 4 Ca 0.00 -0.54 -0.16 0.00 0.36 0.00 0.00 54.97 54.64 1sro s GLU 4 Cb 0.00 -2.02 0.07 0.00 0.26 0.00 0.00 34.13 32.44 1sro s GLU 4 CO 0.00 -0.37 0.20 0.28 -0.54 0.00 0.00 175.26 174.82 1sro n VAL 5 N 4.84 0.00 -0.38 3.70 0.31 -1.26 -2.85 118.33 122.70 1sro n VAL 5 Ca -0.13 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 63.95 1sro n VAL 5 Cb 0.48 -0.60 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 1sro n VAL 5 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1sro n GLY 6 N 1.78 1.52 3.94 2.92 0.00 -1.26 -5.02 105.19 109.07 1sro n GLY 6 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 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 3.51 0.31 1.61 3.52 -1.13 -4.91 118.95 121.59 1sro s ARG 7 Ca 0.00 -0.35 -0.07 0.00 -0.13 0.00 0.00 55.73 55.18 1sro s ARG 7 Cb 0.00 -2.74 -0.06 0.00 -1.56 0.00 0.00 34.95 30.59 1sro s ARG 7 CO 0.00 0.26 0.61 0.08 -0.81 0.00 0.00 175.30 175.44 1sro s VAL 8 N -2.12 4.95 0.06 7.11 1.01 -1.26 -2.50 120.40 127.65 1sro s VAL 8 Ca 0.39 0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.65 1sro s VAL 8 Cb -0.10 -3.71 -0.00 0.00 0.00 0.00 0.00 36.38 32.56 1sro s VAL 8 CO 0.32 -0.33 0.03 -1.22 0.00 0.00 0.00 175.10 173.90 1sro n TYR 9 N -0.90 -0.03 -3.65 5.22 4.02 -0.65 -4.91 117.16 116.26 1sro n TYR 9 Ca -0.00 -0.44 -0.02 0.00 -0.01 0.00 0.00 57.90 57.43 1sro n TYR 9 Cb 0.54 0.02 -0.05 0.00 -0.02 0.00 0.00 39.34 39.83 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 -1.94 -0.92 0.21 -0.72 2.01 -1.26 -1.47 115.64 111.54 1sro s THR 10 Ca 0.04 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.09 1sro s THR 10 Cb 0.00 -0.97 -0.05 0.00 0.01 0.00 0.00 72.50 71.49 1sro s THR 10 CO 0.03 0.01 -0.02 -0.83 -0.69 0.00 0.00 174.62 173.12 1sro s GLY 11 N 2.82 1.42 0.39 4.40 0.00 -0.57 -4.59 107.32 111.19 1sro s GLY 11 Ca -0.06 -1.69 0.08 0.00 0.00 0.00 0.00 44.72 43.04 1sro s GLY 11 CO -0.18 -1.63 0.49 0.54 0.00 0.00 0.00 173.10 172.31 1sro s LYS 12 N -3.86 2.84 -0.68 2.90 1.02 0.47 -1.22 119.74 121.22 1sro s LYS 12 Ca 0.26 -1.24 -0.22 0.00 0.02 0.00 0.00 55.97 54.79 1sro s LYS 12 Cb 0.05 -2.68 0.07 0.00 -0.52 0.00 0.00 37.83 34.75 1sro s LYS 12 CO 0.07 -0.14 0.98 0.08 -0.92 0.00 0.00 175.35 175.42 1sro s VAL 13 N -2.32 4.34 -1.76 3.17 1.01 -0.69 -1.56 120.40 122.59 1sro s VAL 13 Ca 0.50 -0.43 0.17 0.00 0.00 0.00 0.00 61.98 62.22 1sro s VAL 13 Cb -0.08 -4.70 0.04 0.00 0.00 0.00 0.00 36.38 31.64 1sro s VAL 13 CO 0.31 -1.47 0.94 0.35 0.00 0.00 0.00 175.10 175.23 1sro n THR 14 N 5.91 0.00 -3.52 3.92 -2.24 -1.26 -2.90 114.28 114.19 1sro n THR 14 Ca -0.02 -0.39 -0.11 0.00 -2.27 0.00 0.00 64.05 61.27 1sro n THR 14 Cb 0.46 1.25 -0.04 0.00 -2.10 0.00 0.00 70.33 69.91 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 -1.79 0.84 0.06 -0.78 3.00 -1.22 -4.97 118.95 114.09 1sro s ARG 15 Ca 0.16 -0.10 -0.06 0.00 0.00 0.00 0.00 55.73 55.73 1sro s ARG 15 Cb 0.14 0.39 -0.01 0.00 0.00 0.00 0.00 34.95 35.47 1sro s ARG 15 CO 0.35 -0.32 0.11 0.42 0.00 0.00 0.00 175.30 175.86 1sro s ILE 16 N -2.28 0.15 0.04 1.52 1.01 -1.26 -0.45 121.20 119.92 1sro s ILE 16 Ca 0.00 -1.26 -0.01 0.00 0.00 0.00 0.00 60.65 59.38 1sro s ILE 16 Cb -0.01 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 1sro s ILE 16 CO -0.03 -0.70 -0.03 0.68 0.00 0.00 0.00 174.94 174.86 1sro s VAL 17 N -3.36 0.17 0.22 2.92 -7.23 -0.37 -4.67 120.40 108.08 1sro s VAL 17 Ca 0.01 -1.43 -0.08 0.00 -1.81 0.00 0.00 61.98 58.67 1sro s VAL 17 Cb 0.03 -1.00 0.19 0.00 0.56 0.00 0.00 36.38 36.17 1sro s VAL 17 CO -0.08 -0.79 1.87 -0.78 -0.31 0.00 0.00 175.10 175.01 1sro h ASP 18 N 3.77 1.01 -0.38 4.85 3.58 -2.01 -1.38 116.42 125.86 1sro h ASP 18 Ca -0.33 -0.06 -0.12 0.00 0.42 0.00 0.00 57.03 56.94 1sro h ASP 18 Cb 1.17 -0.25 -0.07 0.00 1.72 0.00 0.00 39.33 41.90 1sro h ASP 18 CO 0.56 0.77 0.15 2.22 -2.88 0.00 0.00 179.24 180.05 1sro n PHE 19 N -4.44 1.24 0.00 0.28 1.16 -1.26 -4.77 117.46 109.67 1sro n PHE 19 Ca 0.09 -0.72 0.00 0.00 -1.87 0.00 0.00 57.45 54.94 1sro n PHE 19 Cb 0.05 -0.44 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 0.03 -0.18 3.39 4.97 0.00 -0.52 -3.02 105.19 109.87 1sro n GLY 20 Ca 0.21 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 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 0.27 4.61 0.00 0.17 -1.24 121.76 123.27 1sro s ALA 21 Ca 0.00 0.97 0.08 0.00 0.00 0.00 0.00 51.96 53.01 1sro s ALA 21 Cb 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 1sro s ALA 21 CO 0.00 -0.30 0.13 -0.06 0.00 0.00 0.00 175.76 175.53 1sro s PHE 22 N -0.96 2.92 0.18 0.00 0.40 0.40 0.12 117.98 121.04 1sro s PHE 22 Ca -0.10 -0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 55.92 1sro s PHE 22 Cb -0.03 -1.39 0.01 0.00 0.51 0.00 0.00 43.02 42.12 1sro s PHE 22 CO 0.06 0.51 0.38 0.08 0.70 0.00 0.00 175.22 176.95 1sro s VAL 23 N -2.24 0.05 0.10 -0.44 1.01 -0.18 -3.41 120.40 115.29 1sro s VAL 23 Ca 0.33 -1.17 0.07 0.00 0.00 0.00 0.00 61.98 61.22 1sro s VAL 23 Cb -0.07 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1sro s VAL 23 CO 0.23 -0.21 -0.18 0.00 0.00 0.00 0.00 175.10 174.93 1sro s ALA 24 N -3.94 1.60 -0.22 5.51 0.00 -0.60 0.76 121.76 124.87 1sro s ALA 24 Ca 0.14 -1.18 0.14 0.00 0.00 0.00 0.00 51.96 51.06 1sro s ALA 24 Cb 0.01 -0.19 0.48 0.00 0.00 0.00 0.00 23.12 23.43 1sro s ALA 24 CO -0.00 0.28 1.40 0.44 0.00 0.00 0.00 175.76 177.87 1sro n ILE 25 N 1.09 2.34 0.00 0.00 -5.35 -0.64 -0.39 119.36 116.40 1sro n ILE 25 Ca -0.20 -2.32 0.00 0.00 -0.27 0.00 0.00 62.75 59.96 1sro n ILE 25 Cb 0.54 -0.28 0.00 0.00 -1.74 0.00 0.00 39.64 38.16 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 -0.91 0.64 3.42 3.28 0.00 -1.24 -4.83 105.19 105.55 1sro n GLY 26 Ca 0.25 -2.12 -0.45 0.00 0.00 0.00 0.00 46.02 43.70 1sro n GLY 26 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sro s GLY 27 N 0.00 2.15 0.00 -0.02 0.00 -1.26 -4.27 107.32 103.92 1sro s GLY 27 Ca 0.00 -2.95 0.00 0.00 0.00 0.00 0.00 44.72 41.77 1sro s GLY 27 CO 0.00 1.82 0.00 0.61 0.00 0.00 0.00 173.10 175.53 1sro n GLY 28 N 5.02 0.52 3.43 0.20 0.00 -1.26 -5.13 105.19 107.97 1sro n GLY 28 Ca 0.22 0.12 -0.27 0.00 0.00 0.00 0.00 46.02 46.09 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 0.00 1.53 0.09 1.61 -0.14 -1.26 -5.08 119.74 116.49 1sro s LYS 29 Ca 0.00 -1.49 0.06 0.00 -1.36 0.00 0.00 55.97 53.18 1sro s LYS 29 Cb 0.00 -1.87 -0.03 0.00 -1.68 0.00 0.00 37.83 34.25 1sro s LYS 29 CO 0.00 0.41 -0.15 -1.83 -0.76 0.00 0.00 175.35 173.02 1sro s GLU 30 N -2.60 0.93 0.28 1.68 -1.05 -1.26 -1.62 118.70 115.05 1sro s GLU 30 Ca 0.20 -1.09 0.04 0.00 -0.15 0.00 0.00 54.97 53.97 1sro s GLU 30 Cb -0.08 -0.90 0.05 0.00 -0.44 0.00 0.00 34.13 32.75 1sro s GLU 30 CO 0.10 0.19 0.39 0.41 0.95 0.00 0.00 175.26 177.29 1sro n GLY 31 N 0.95 1.81 3.18 -3.83 0.00 0.23 -4.58 105.19 102.95 1sro n GLY 31 Ca -0.19 -2.16 -0.10 0.00 0.00 0.00 0.00 46.02 43.57 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 -0.42 -1.19 0.99 2.96 -1.26 -1.01 118.68 118.75 1sro s LEU 32 Ca 0.29 0.84 -0.04 0.00 -0.22 0.00 0.00 54.13 54.99 1sro s LEU 32 Cb -0.02 1.13 0.21 0.00 0.50 0.00 0.00 46.19 48.01 1sro s LEU 32 CO 0.18 -0.23 2.04 0.52 -1.32 0.00 0.00 176.35 177.55 1sro n VAL 33 N 5.17 5.44 -1.16 1.68 0.31 0.32 -4.36 118.33 125.74 1sro n VAL 33 Ca -0.11 -5.06 -0.36 0.00 -0.01 0.00 0.00 64.34 58.81 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 1.35 -1.24 -0.23 3.52 -0.00 -1.03 0.45 115.22 118.05 1sro n HIS 34 Ca 0.51 0.31 0.00 0.00 0.46 0.00 0.00 57.72 59.00 1sro n HIS 34 Cb 0.27 -1.86 0.07 0.00 -0.12 0.00 0.00 29.99 28.36 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 -0.62 0.33 -0.09 3.57 6.09 -1.78 0.58 117.51 125.59 1sro h ILE 35 Ca -0.45 -0.00 -0.08 0.00 -1.37 0.00 0.00 64.86 62.96 1sro h ILE 35 Cb 1.34 0.33 -0.03 0.00 0.47 0.00 0.00 36.82 38.92 1sro h ILE 35 CO 0.40 0.00 0.00 -1.20 -3.07 0.00 0.00 178.15 174.28 1sro n SER 36 N -5.45 5.51 -2.72 2.19 7.64 -1.26 -4.09 113.62 115.44 1sro n SER 36 Ca 0.09 -2.53 -0.09 0.00 1.01 0.00 0.00 58.87 57.35 1sro n SER 36 Cb 0.35 -1.17 0.07 0.00 -1.01 0.00 0.00 64.21 62.45 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 1.49 1.15 0.00 1.43 6.02 0.19 -4.95 117.38 122.71 1sro n GLN 37 Ca 0.12 -2.53 0.00 0.00 -0.01 0.00 0.00 57.00 54.58 1sro n GLN 37 Cb 0.58 -0.72 0.00 0.00 1.02 0.00 0.00 30.24 31.11 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 -2.15 5.09 -0.00 -1.26 -4.17 119.36 116.63 1sro n ILE 38 Ca 0.05 0.00 -0.40 0.00 -0.00 0.00 0.00 62.75 62.39 1sro n ILE 38 Cb 0.81 0.00 0.03 0.00 -0.00 0.00 0.00 39.64 40.49 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 6.38 0.00 -1.39 0.00 -1.26 -4.81 120.51 116.43 1sro n ALA 39 Ca 0.00 -4.27 0.00 0.00 0.00 0.00 0.00 53.44 49.17 1sro n ALA 39 Cb 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.40 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 -0.39 0.00 0.00 0.00 -0.08 -1.26 -3.58 116.55 111.24 1sro n ASP 40 Ca 0.52 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.80 1sro n ASP 40 Cb 0.24 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.70 1sro n ASP 40 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1sro n LYS 41 N 0.00 0.00 -2.27 -0.67 4.81 -1.26 -4.89 118.16 113.88 1sro n LYS 41 Ca 0.00 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.06 1sro n LYS 41 Cb 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.03 1sro n LYS 41 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1sro n ARG 42 N 0.00 2.60 -3.09 1.64 5.12 -1.24 -4.66 116.66 117.04 1sro n ARG 42 Ca 0.00 -2.90 -0.19 0.00 -1.93 0.00 0.00 57.85 52.83 1sro n ARG 42 Cb 0.00 -3.52 -0.03 0.00 -1.16 0.00 0.00 32.46 27.75 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 6.68 -0.42 -0.17 1.55 0.31 -1.26 -4.74 118.33 120.28 1sro n VAL 43 Ca 0.48 -3.56 0.29 0.00 -0.01 0.00 0.00 64.34 61.54 1sro n VAL 43 Cb 0.45 -0.77 0.61 0.00 -0.91 0.00 0.00 33.84 33.22 1sro n VAL 43 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1sro h GLU 44 N 3.70 0.00 -4.40 5.55 4.81 -1.98 -3.36 114.58 118.91 1sro h GLU 44 Ca 0.03 0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.80 1sro h GLU 44 Cb 0.94 0.00 -0.33 0.00 0.63 0.00 0.00 28.75 29.99 1sro h GLU 44 CO 0.43 0.00 -0.79 0.15 -0.73 0.00 0.00 179.01 178.06 1sro s LYS 45 N -4.59 1.21 0.24 1.92 1.02 -1.26 -5.00 119.74 113.27 1sro s LYS 45 Ca -0.04 -0.28 0.13 0.00 0.02 0.00 0.00 55.97 55.80 1sro s LYS 45 Cb 0.17 -1.08 -0.00 0.00 -0.52 0.00 0.00 37.83 36.40 1sro s LYS 45 CO 0.57 0.02 1.40 0.28 -0.92 0.00 0.00 175.35 176.71 1sro h VAL 46 N 5.86 1.06 -0.01 3.17 2.07 -1.83 -2.90 116.25 123.67 1sro h VAL 46 Ca -0.34 -2.51 0.00 0.00 0.82 0.00 0.00 66.70 64.67 1sro h VAL 46 Cb 1.17 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 33.47 1sro h VAL 46 CO 0.48 0.61 0.00 0.35 0.02 0.00 0.00 177.57 179.03 1sro n THR 47 N -3.25 0.01 -0.04 2.57 -2.24 -1.26 -1.56 114.28 108.51 1sro n THR 47 Ca 0.01 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1sro n THR 47 Cb 0.78 -0.15 -0.12 0.00 -2.10 0.00 0.00 70.33 68.74 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 -0.63 1.33 -0.09 3.42 9.92 -1.10 -4.51 116.55 124.89 1sro n ASP 48 Ca 0.08 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.21 1sro n ASP 48 Cb 0.05 1.30 -0.14 0.00 -0.64 0.00 0.00 41.12 41.68 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 -2.31 0.27 -4.14 1.24 4.02 -1.13 -4.92 117.16 110.20 1sro n TYR 49 Ca -0.14 0.08 -0.34 0.00 -0.01 0.00 0.00 57.90 57.49 1sro n TYR 49 Cb 0.70 -1.04 -0.08 0.00 -0.02 0.00 0.00 39.34 38.90 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 -6.00 3.89 -0.03 7.72 1.43 -0.60 -5.10 118.68 119.99 1sro s LEU 50 Ca -0.17 0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.15 1sro s LEU 50 Cb 0.07 -2.12 0.01 0.00 0.03 0.00 0.00 46.19 44.18 1sro s LEU 50 CO 0.76 0.32 -0.07 -1.58 0.23 0.00 0.00 176.35 176.02 1sro s GLN 51 N -1.39 0.78 -0.53 1.70 -0.44 -1.26 -4.59 119.66 113.92 1sro s GLN 51 Ca 0.19 -0.21 -0.28 0.00 -2.50 0.00 0.00 55.36 52.55 1sro s GLN 51 Cb -0.12 -0.75 -0.10 0.00 -1.64 0.00 0.00 33.01 30.40 1sro s GLN 51 CO 0.09 0.05 2.42 -1.33 0.50 0.00 0.00 175.29 177.02 1sro n MET 52 N 3.44 0.95 0.00 1.67 2.81 -1.26 -1.11 117.12 123.62 1sro n MET 52 Ca -0.19 0.10 0.00 0.00 -1.81 0.00 0.00 57.70 55.79 1sro n MET 52 Cb 0.54 -2.93 0.00 0.00 -0.71 0.00 0.00 33.22 30.12 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 6.15 3.10 3.71 3.03 0.00 -1.14 -4.98 105.19 115.06 1sro n GLY 53 Ca 0.42 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 1sro n GLY 53 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1sro n GLN 54 N 0.00 2.75 -4.42 1.61 1.13 -0.27 -4.50 117.38 113.68 1sro n GLN 54 Ca 0.00 0.99 -0.34 0.00 -1.94 0.00 0.00 57.00 55.72 1sro n GLN 54 Cb 0.00 -2.85 -0.12 0.00 0.11 0.00 0.00 30.24 27.39 1sro n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1sro s GLU 55 N 1.50 3.52 0.05 -1.09 2.02 -1.26 -1.70 118.70 121.74 1sro s GLU 55 Ca 0.77 -0.51 0.01 0.00 0.02 0.00 0.00 54.97 55.26 1sro s GLU 55 Cb -0.51 -2.87 -0.03 0.00 0.10 0.00 0.00 34.13 30.82 1sro s GLU 55 CO 0.34 0.33 -0.06 0.14 0.02 0.00 0.00 175.26 176.03 1sro s VAL 56 N 0.12 0.44 0.55 2.63 -7.23 -0.35 -4.96 120.40 111.58 1sro s VAL 56 Ca -0.01 -1.32 -0.15 0.00 -1.81 0.00 0.00 61.98 58.69 1sro s VAL 56 Cb -0.14 -0.88 -0.07 0.00 0.56 0.00 0.00 36.38 35.86 1sro s VAL 56 CO 0.03 -0.59 1.00 -2.16 -0.31 0.00 0.00 175.10 173.06 1sro s PRO 57 N -2.34 3.82 0.17 4.82 0.04 -1.26 -1.51 135.00 138.74 1sro s PRO 57 Ca -0.04 0.92 -0.01 0.00 0.04 0.00 0.00 61.00 61.91 1sro s PRO 57 Cb -0.04 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.38 1sro s PRO 57 CO -0.02 -0.38 0.23 1.33 0.04 0.00 0.00 177.00 178.20 1sro n VAL 58 N -1.91 0.00 -3.75 -0.36 0.24 -0.54 -1.57 118.33 110.45 1sro n VAL 58 Ca 0.07 -0.90 -0.22 0.00 -2.04 0.00 0.00 64.34 61.24 1sro n VAL 58 Cb 0.54 0.54 -0.18 0.00 -1.47 0.00 0.00 33.84 33.28 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 0.48 -0.84 7.34 1.02 0.17 -1.63 119.74 123.86 1sro s LYS 59 Ca 0.15 0.16 -0.23 0.00 0.02 0.00 0.00 55.97 56.07 1sro s LYS 59 Cb -0.00 -0.89 -0.20 0.00 -0.52 0.00 0.00 37.83 36.22 1sro s LYS 59 CO 0.11 -0.31 2.44 0.28 -0.92 0.00 0.00 175.35 176.94 1sro n VAL 60 N 5.18 -0.02 0.15 3.17 0.31 -1.04 -1.21 118.33 124.87 1sro n VAL 60 Ca -0.06 -0.41 0.02 0.00 -0.01 0.00 0.00 64.34 63.87 1sro n VAL 60 Cb 0.50 -1.19 0.19 0.00 -0.91 0.00 0.00 33.84 32.44 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 15.54 0.00 0.00 7.52 5.85 -1.28 -3.35 115.31 139.59 1sro h LEU 61 Ca -0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1sro h LEU 61 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1sro h LEU 61 CO 1.33 0.53 0.00 1.21 -0.34 0.00 0.00 178.44 181.16 1sro n GLU 62 N -3.52 0.00 -3.15 1.25 4.07 -1.11 -5.00 120.64 113.18 1sro n GLU 62 Ca -0.00 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.71 1sro n GLU 62 Cb 0.62 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.95 1sro n GLU 62 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1sro s VAL 63 N -2.15 5.10 0.77 6.31 1.01 -1.26 -0.63 120.40 129.54 1sro s VAL 63 Ca 0.00 1.25 -0.13 0.00 0.00 0.00 0.00 61.98 63.10 1sro s VAL 63 Cb 0.00 -3.95 0.19 0.00 0.00 0.00 0.00 36.38 32.62 1sro s VAL 63 CO 0.00 0.27 0.67 -0.90 0.00 0.00 0.00 175.10 175.14 1sro n ASP 64 N 3.84 -1.76 0.00 3.32 5.75 -0.75 -4.86 116.55 122.08 1sro n ASP 64 Ca -0.03 -0.90 0.10 0.00 -0.01 0.00 0.00 54.79 53.95 1sro n ASP 64 Cb 0.51 -0.62 0.55 0.00 -1.03 0.00 0.00 41.12 40.53 1sro n ASP 64 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1sro n ARG 65 N -3.61 0.38 -0.17 0.11 0.63 -1.26 -2.45 116.66 110.28 1sro n ARG 65 Ca 0.09 0.07 0.07 0.00 -0.92 0.00 0.00 57.85 57.16 1sro n ARG 65 Cb 0.37 -1.50 0.20 0.00 0.45 0.00 0.00 32.46 31.98 1sro n ARG 65 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 1sro n GLN 66 N -1.22 1.86 -0.92 -0.14 -0.06 -1.26 -4.86 117.38 110.78 1sro n GLN 66 Ca 0.11 -1.33 0.00 0.00 -2.00 0.00 0.00 57.00 53.78 1sro n GLN 66 Cb 0.15 -1.31 0.00 0.00 -4.06 0.00 0.00 30.24 25.01 1sro n GLN 66 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1sro n GLY 67 N 1.11 0.34 3.89 1.69 0.00 -1.03 -4.98 105.19 106.22 1sro n GLY 67 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.82 3.70 -0.21 1.61 0.52 -1.26 -4.91 118.95 117.58 1sro s ARG 68 Ca 0.00 0.10 -0.26 0.00 -0.52 0.00 0.00 55.73 55.05 1sro s ARG 68 Cb 0.00 -2.68 -0.00 0.00 0.52 0.00 0.00 34.95 32.79 1sro s ARG 68 CO 0.00 0.29 0.89 0.42 0.02 0.00 0.00 175.30 176.93 1sro s ILE 69 N -1.91 4.80 -0.72 1.52 1.09 -1.26 -1.81 121.20 122.91 1sro s ILE 69 Ca 0.45 1.73 -0.21 0.00 -1.10 0.00 0.00 60.65 61.52 1sro s ILE 69 Cb -0.11 -4.18 0.09 0.00 -1.06 0.00 0.00 42.46 37.20 1sro s ILE 69 CO 0.26 -0.07 0.96 -0.60 -0.10 0.00 0.00 174.94 175.38 1sro s ARG 70 N 2.73 3.22 0.13 2.79 6.06 0.19 -4.20 118.95 129.88 1sro s ARG 70 Ca 0.39 -1.17 -0.16 0.00 -2.50 0.00 0.00 55.73 52.28 1sro s ARG 70 Cb -0.16 -4.41 -0.07 0.00 0.06 0.00 0.00 34.95 30.37 1sro s ARG 70 CO 0.09 -1.75 0.57 -0.51 -2.50 0.00 0.00 175.30 171.19 1sro s LEU 71 N 3.43 4.39 -0.25 -0.88 1.43 -1.26 -0.79 118.68 124.75 1sro s LEU 71 Ca 0.23 1.16 -0.10 0.00 -1.03 0.00 0.00 54.13 54.38 1sro s LEU 71 Cb -0.15 -3.19 -0.05 0.00 0.03 0.00 0.00 46.19 42.83 1sro s LEU 71 CO 0.04 0.15 0.16 -0.44 0.23 0.00 0.00 176.35 176.49 1sro s SER 72 N -1.54 6.03 0.06 2.29 0.01 -0.35 -4.67 113.70 115.53 1sro s SER 72 Ca 0.36 0.06 -0.31 0.00 1.31 0.00 0.00 55.95 57.37 1sro s SER 72 Cb -0.16 -2.10 -0.09 0.00 0.21 0.00 0.00 66.02 63.88 1sro s SER 72 CO 0.19 0.03 1.75 -0.63 0.41 0.00 0.00 173.24 174.99 1sro s ILE 73 N 1.26 2.98 1.29 1.44 1.01 -1.26 -0.66 121.20 127.27 1sro s ILE 73 Ca 0.07 0.34 -0.21 0.00 0.00 0.00 0.00 60.65 60.85 1sro s ILE 73 Cb -0.14 -3.22 0.32 0.00 0.01 0.00 0.00 42.46 39.43 1sro s ILE 73 CO 0.06 -0.01 1.05 -0.75 0.00 0.00 0.00 174.94 175.30 1sro s LYS 74 N 3.13 -1.92 -0.28 2.79 2.20 -0.60 -4.86 119.74 120.20 1sro s LYS 74 Ca 0.78 -0.06 -0.02 0.00 -0.36 0.00 0.00 55.97 56.31 1sro s LYS 74 Cb -0.41 -1.51 0.12 0.00 -1.51 0.00 0.00 37.83 34.52 1sro s LYS 74 CO 0.34 -4.18 2.26 -1.91 -0.36 0.00 0.00 175.35 171.51 1sro n GLU 75 N -5.09 1.81 0.00 4.03 2.13 -1.26 -5.00 120.64 117.26 1sro n GLU 75 Ca 0.14 -1.44 0.03 0.00 0.66 0.00 0.00 57.16 56.54 1sro n GLU 75 Cb 0.60 -1.65 0.16 0.00 0.27 0.00 0.00 31.44 30.82 1sro n GLU 75 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72