#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 0.00 -0.41 0.00 1.02 -1.26 -4.95 120.64 115.05 1sro n GLU 2 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 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 0.00 -1.31 -4.22 -3.67 0.00 -1.26 -5.08 119.36 103.83 1sro n ILE 3 Ca 0.00 0.48 -0.17 0.00 0.00 0.00 0.00 62.75 63.07 1sro n ILE 3 Cb 0.00 -0.73 -0.08 0.00 0.00 0.00 0.00 39.64 38.84 1sro n ILE 3 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1sro s GLU 4 N -4.78 1.66 0.80 9.51 -1.05 -1.26 -5.16 118.70 118.43 1sro s GLU 4 Ca 0.00 -1.86 -0.12 0.00 -0.15 0.00 0.00 54.97 52.84 1sro s GLU 4 Cb 0.00 0.34 0.07 0.00 -0.44 0.00 0.00 34.13 34.11 1sro s GLU 4 CO 0.00 -0.62 1.17 0.08 0.95 0.00 0.00 175.26 176.84 1sro s VAL 5 N -3.54 2.13 -0.46 1.83 1.01 -1.26 -3.91 120.40 116.19 1sro s VAL 5 Ca 0.38 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.40 1sro s VAL 5 Cb 0.03 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1sro s VAL 5 CO 0.22 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1sro n GLY 6 N -3.29 0.71 3.51 4.51 0.00 -1.26 -5.01 105.19 104.37 1sro n GLY 6 Ca 0.08 -0.53 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.94 1.86 -0.09 1.61 6.06 -1.25 -4.95 118.95 120.25 1sro s ARG 7 Ca 0.00 -1.28 -0.21 0.00 -2.50 0.00 0.00 55.73 51.74 1sro s ARG 7 Cb 0.00 -2.09 -0.04 0.00 0.06 0.00 0.00 34.95 32.89 1sro s ARG 7 CO 0.00 0.45 0.61 0.08 -2.50 0.00 0.00 175.30 173.94 1sro s VAL 8 N -1.49 5.10 0.54 7.11 1.01 -1.26 -2.13 120.40 129.29 1sro s VAL 8 Ca 0.21 1.25 0.06 0.00 0.00 0.00 0.00 61.98 63.51 1sro s VAL 8 Cb -0.09 -3.95 0.06 0.00 0.00 0.00 0.00 36.38 32.40 1sro s VAL 8 CO 0.12 0.28 0.53 -1.22 0.00 0.00 0.00 175.10 174.81 1sro n TYR 9 N 3.75 -1.18 -3.84 5.22 4.02 0.02 -4.91 117.16 120.23 1sro n TYR 9 Ca -0.03 -2.19 -0.30 0.00 -0.01 0.00 0.00 57.90 55.37 1sro n TYR 9 Cb 0.51 -0.47 -0.15 0.00 -0.02 0.00 0.00 39.34 39.21 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 -2.59 1.18 -0.14 -0.72 2.01 -1.26 -0.91 115.64 113.21 1sro s THR 10 Ca 0.40 -1.27 -0.04 0.00 0.31 0.00 0.00 61.69 61.10 1sro s THR 10 Cb -0.03 -1.69 -0.03 0.00 0.01 0.00 0.00 72.50 70.76 1sro s THR 10 CO 0.25 -0.37 -0.02 -0.83 -0.69 0.00 0.00 174.62 172.96 1sro s GLY 11 N 1.51 1.76 0.38 4.40 0.00 -0.31 -4.58 107.32 110.49 1sro s GLY 11 Ca 0.02 -0.81 -0.03 0.00 0.00 0.00 0.00 44.72 43.90 1sro s GLY 11 CO -0.13 -0.17 0.63 0.54 0.00 0.00 0.00 173.10 173.97 1sro s LYS 12 N 0.08 3.54 -0.75 2.90 1.02 0.07 -1.62 119.74 124.99 1sro s LYS 12 Ca 0.01 -0.07 -0.22 0.00 0.02 0.00 0.00 55.97 55.71 1sro s LYS 12 Cb -0.13 -2.56 0.08 0.00 -0.52 0.00 0.00 37.83 34.70 1sro s LYS 12 CO 0.02 0.04 1.04 0.08 -0.92 0.00 0.00 175.35 175.61 1sro s VAL 13 N -2.41 4.39 -1.72 3.17 1.01 -0.65 -1.59 120.40 122.60 1sro s VAL 13 Ca 0.43 -0.66 0.21 0.00 0.00 0.00 0.00 61.98 61.96 1sro s VAL 13 Cb -0.10 -4.73 -0.05 0.00 0.00 0.00 0.00 36.38 31.50 1sro s VAL 13 CO 0.38 -1.51 0.99 0.35 0.00 0.00 0.00 175.10 175.31 1sro n THR 14 N 5.88 0.00 -3.52 3.92 -2.24 -1.25 -2.99 114.28 114.07 1sro n THR 14 Ca 0.05 -0.23 -0.12 0.00 -2.27 0.00 0.00 64.05 61.48 1sro n THR 14 Cb 0.47 1.20 -0.04 0.00 -2.10 0.00 0.00 70.33 69.85 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 -2.44 0.86 0.03 -0.78 3.00 -1.13 -5.01 118.95 113.47 1sro s ARG 15 Ca 0.15 -0.01 -0.03 0.00 0.00 0.00 0.00 55.73 55.85 1sro s ARG 15 Cb 0.16 0.40 -0.02 0.00 0.00 0.00 0.00 34.95 35.50 1sro s ARG 15 CO 0.59 -0.31 0.02 0.42 0.00 0.00 0.00 175.30 176.02 1sro s ILE 16 N -1.95 0.13 0.07 1.52 1.01 -1.26 -0.42 121.20 120.30 1sro s ILE 16 Ca -0.02 -1.08 0.04 0.00 0.00 0.00 0.00 60.65 59.59 1sro s ILE 16 Cb -0.01 -0.66 -0.03 0.00 0.01 0.00 0.00 42.46 41.78 1sro s ILE 16 CO -0.00 -0.59 -0.12 0.68 0.00 0.00 0.00 174.94 174.90 1sro s VAL 17 N -2.16 0.95 0.29 2.92 -7.23 -0.38 -4.70 120.40 110.09 1sro s VAL 17 Ca -0.09 -1.34 -0.01 0.00 -1.81 0.00 0.00 61.98 58.73 1sro s VAL 17 Cb -0.04 -1.04 0.27 0.00 0.56 0.00 0.00 36.38 36.13 1sro s VAL 17 CO -0.03 -0.34 1.93 0.44 -0.31 0.00 0.00 175.10 176.79 1sro h ASP 18 N 4.16 0.96 -0.63 4.85 5.19 -2.01 -0.62 116.42 128.32 1sro h ASP 18 Ca -0.39 -0.01 -0.33 0.00 -0.62 0.00 0.00 57.03 55.69 1sro h ASP 18 Cb 1.19 -0.22 -0.19 0.00 0.18 0.00 0.00 39.33 40.29 1sro h ASP 18 CO 0.43 0.65 0.42 2.22 -3.12 0.00 0.00 179.24 179.84 1sro n PHE 19 N -4.46 1.94 -0.19 4.55 1.16 -1.26 -4.80 117.46 114.41 1sro n PHE 19 Ca 0.12 -1.36 0.00 0.00 -1.87 0.00 0.00 57.45 54.34 1sro n PHE 19 Cb 0.13 -0.70 0.00 0.00 -1.61 0.00 0.00 39.48 37.30 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 -0.53 0.16 3.33 4.97 0.00 -0.24 -3.18 105.19 109.71 1sro n GLY 20 Ca 0.38 -1.23 -0.14 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.05 4.61 0.00 0.19 -1.25 121.76 123.17 1sro s ALA 21 Ca 0.00 0.95 -0.01 0.00 0.00 0.00 0.00 51.96 52.90 1sro s ALA 21 Cb 0.00 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 1sro s ALA 21 CO 0.00 -0.25 0.02 -0.06 0.00 0.00 0.00 175.76 175.47 1sro s PHE 22 N -0.51 3.19 0.17 0.00 0.40 0.43 0.12 117.98 121.79 1sro s PHE 22 Ca -0.06 0.18 0.03 0.00 -0.60 0.00 0.00 56.93 56.48 1sro s PHE 22 Cb -0.03 -1.75 -0.05 0.00 0.51 0.00 0.00 43.02 41.70 1sro s PHE 22 CO 0.03 0.50 -0.04 0.08 0.70 0.00 0.00 175.22 176.49 1sro s VAL 23 N -1.01 0.93 0.10 -0.44 1.01 -0.13 -2.84 120.40 118.02 1sro s VAL 23 Ca 0.17 -2.02 0.05 0.00 0.00 0.00 0.00 61.98 60.19 1sro s VAL 23 Cb -0.12 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1sro s VAL 23 CO 0.07 -0.55 -0.14 0.00 0.00 0.00 0.00 175.10 174.48 1sro s ALA 24 N -3.49 1.36 0.00 5.51 0.00 -0.62 0.58 121.76 125.10 1sro s ALA 24 Ca 0.22 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.99 1sro s ALA 24 Cb 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1sro s ALA 24 CO 0.03 0.11 0.00 0.44 0.00 0.00 0.00 175.76 176.34 1sro n ILE 25 N 0.77 0.00 -2.23 0.00 -5.35 -0.58 -0.75 119.36 111.22 1sro n ILE 25 Ca -0.17 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.02 1sro n ILE 25 Cb 0.56 0.00 0.01 0.00 -1.74 0.00 0.00 39.64 38.47 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 0.00 1.59 -0.41 3.28 0.00 -1.19 -4.84 107.32 105.74 1sro s GLY 26 Ca 0.00 -0.37 -0.32 0.00 0.00 0.00 0.00 44.72 44.03 1sro s GLY 26 CO 0.00 -0.12 2.28 0.61 0.00 0.00 0.00 173.10 175.87 1sro n GLY 27 N -2.58 0.42 0.00 0.20 0.00 -1.26 -1.05 105.19 100.93 1sro n GLY 27 Ca 0.04 0.89 0.00 0.00 0.00 0.00 0.00 46.02 46.95 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 6.36 3.36 3.81 -0.02 0.00 -1.26 -5.06 105.19 112.38 1sro n GLY 28 Ca 0.41 -0.95 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 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 4.26 0.04 1.61 -0.14 -0.21 -5.02 119.74 120.28 1sro s LYS 29 Ca 0.00 0.83 0.02 0.00 -1.36 0.00 0.00 55.97 55.46 1sro s LYS 29 Cb 0.00 -3.05 -0.02 0.00 -1.68 0.00 0.00 37.83 33.07 1sro s LYS 29 CO 0.00 0.51 -0.07 -1.21 -0.76 0.00 0.00 175.35 173.82 1sro s GLU 30 N -1.59 0.51 0.43 1.68 2.02 -1.26 -1.52 118.70 118.96 1sro s GLU 30 Ca 0.37 -0.77 0.06 0.00 0.02 0.00 0.00 54.97 54.65 1sro s GLU 30 Cb -0.18 -0.20 0.06 0.00 0.10 0.00 0.00 34.13 33.91 1sro s GLU 30 CO 0.21 0.02 0.53 0.41 0.02 0.00 0.00 175.26 176.45 1sro n GLY 31 N 1.38 2.16 3.05 -1.39 0.00 0.20 -4.74 105.19 105.84 1sro n GLY 31 Ca -0.22 -2.22 -0.11 0.00 0.00 0.00 0.00 46.02 43.47 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 -0.48 -1.30 0.99 2.96 -1.26 -0.95 118.68 118.64 1sro s LEU 32 Ca 0.40 0.57 -0.05 0.00 -0.22 0.00 0.00 54.13 54.83 1sro s LEU 32 Cb -0.03 0.99 0.13 0.00 0.50 0.00 0.00 46.19 47.78 1sro s LEU 32 CO 0.25 -0.26 2.35 0.52 -1.32 0.00 0.00 176.35 177.90 1sro n VAL 33 N 5.36 5.29 -1.02 1.68 0.31 0.33 -4.71 118.33 125.58 1sro n VAL 33 Ca -0.06 -4.42 -0.35 0.00 -0.01 0.00 0.00 64.34 59.50 1sro n VAL 33 Cb 0.50 -2.04 0.08 0.00 -0.91 0.00 0.00 33.84 31.47 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 1.60 -2.09 -0.24 3.52 -0.00 -1.04 0.55 115.22 117.51 1sro n HIS 34 Ca 0.62 0.23 0.04 0.00 0.46 0.00 0.00 57.72 59.07 1sro n HIS 34 Cb 0.25 -1.75 0.14 0.00 -0.12 0.00 0.00 29.99 28.51 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 -0.95 0.38 -0.06 3.57 6.09 -1.79 0.14 117.51 124.89 1sro h ILE 35 Ca -0.44 -0.04 -0.04 0.00 -1.37 0.00 0.00 64.86 62.97 1sro h ILE 35 Cb 1.32 0.26 -0.02 0.00 0.47 0.00 0.00 36.82 38.85 1sro h ILE 35 CO 0.35 0.02 0.05 -1.54 -3.07 0.00 0.00 178.15 173.96 1sro n SER 36 N -5.33 5.35 -2.77 2.19 3.41 -1.26 -4.13 113.62 111.08 1sro n SER 36 Ca 0.12 -2.47 -0.10 0.00 -0.26 0.00 0.00 58.87 56.17 1sro n SER 36 Cb 0.44 -1.09 0.06 0.00 -0.26 0.00 0.00 64.21 63.37 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 1.30 1.11 0.00 4.33 6.02 0.48 -4.89 117.38 125.73 1sro n GLN 37 Ca 0.04 -2.54 0.00 0.00 -0.01 0.00 0.00 57.00 54.49 1sro n GLN 37 Cb 0.51 -0.86 0.00 0.00 1.02 0.00 0.00 30.24 30.91 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 -0.12 0.00 -2.11 5.09 -0.00 -1.26 -3.94 119.36 117.03 1sro n ILE 38 Ca 0.07 0.00 -0.38 0.00 -0.00 0.00 0.00 62.75 62.44 1sro n ILE 38 Cb 0.78 0.00 0.01 0.00 -0.00 0.00 0.00 39.64 40.44 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 6.40 0.00 -1.39 0.00 -1.26 -4.69 120.51 116.58 1sro n ALA 39 Ca 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 53.44 49.32 1sro n ALA 39 Cb 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.26 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 0.13 0.00 0.00 0.00 -0.08 -1.26 -3.44 116.55 111.90 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 0.29 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.75 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 -2.16 -0.67 0.00 -1.26 -4.84 118.16 109.23 1sro n LYS 41 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 58.31 57.91 1sro n LYS 41 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.01 1sro n LYS 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1sro n ARG 42 N 0.00 2.65 -3.22 1.64 1.74 -1.22 -4.71 116.66 113.54 1sro n ARG 42 Ca 0.00 -2.84 -0.23 0.00 -0.77 0.00 0.00 57.85 54.01 1sro n ARG 42 Cb 0.00 -3.44 -0.07 0.00 -1.02 0.00 0.00 32.46 27.93 1sro n ARG 42 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1sro n VAL 43 N 6.35 -0.84 -0.48 1.55 0.31 -1.26 -4.73 118.33 119.24 1sro n VAL 43 Ca 0.49 -3.43 0.42 0.00 -0.01 0.00 0.00 64.34 61.81 1sro n VAL 43 Cb 0.44 -1.44 0.67 0.00 -0.91 0.00 0.00 33.84 32.61 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 4.74 0.00 -3.48 5.55 5.08 -1.98 -3.37 114.58 121.12 1sro h GLU 44 Ca 0.14 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.29 1sro h GLU 44 Cb 0.92 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 29.89 1sro h GLU 44 CO 0.39 0.00 -0.61 0.15 -1.00 0.00 0.00 179.01 177.94 1sro s LYS 45 N -4.70 0.10 0.22 2.33 3.01 -1.26 -5.02 119.74 114.42 1sro s LYS 45 Ca -0.04 0.16 0.13 0.00 -1.01 0.00 0.00 55.97 55.21 1sro s LYS 45 Cb 0.21 0.02 -0.02 0.00 -1.01 0.00 0.00 37.83 37.03 1sro s LYS 45 CO 0.72 -0.04 1.36 -0.39 0.51 0.00 0.00 175.35 177.51 1sro h VAL 46 N 5.17 1.08 0.00 3.17 -1.51 -1.83 -2.99 116.25 119.33 1sro h VAL 46 Ca -0.28 -2.54 0.00 0.00 -1.23 0.00 0.00 66.70 62.65 1sro h VAL 46 Cb 1.19 2.52 0.00 0.00 -2.13 0.00 0.00 31.29 32.88 1sro h VAL 46 CO 0.45 0.61 0.00 0.35 -1.23 0.00 0.00 177.57 177.75 1sro n THR 47 N -3.24 0.00 -0.08 7.19 -2.24 -1.26 -1.55 114.28 113.10 1sro n THR 47 Ca 0.01 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 1sro n THR 47 Cb 0.80 -0.28 -0.12 0.00 -2.10 0.00 0.00 70.33 68.63 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 -0.74 1.22 -0.01 3.42 9.92 -1.13 -4.50 116.55 124.72 1sro n ASP 48 Ca 0.11 -0.01 -0.14 0.00 -0.53 0.00 0.00 54.79 54.22 1sro n ASP 48 Cb 0.05 0.80 -0.14 0.00 -0.64 0.00 0.00 41.12 41.19 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 -2.62 1.10 -4.12 1.24 4.02 -1.13 -4.90 117.16 110.75 1sro n TYR 49 Ca -0.26 0.32 -0.29 0.00 -0.01 0.00 0.00 57.90 57.66 1sro n TYR 49 Cb 1.00 -1.18 -0.07 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 -6.47 3.55 -0.01 7.72 1.43 -0.60 -5.12 118.68 119.19 1sro s LEU 50 Ca -0.12 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.81 1sro s LEU 50 Cb 0.07 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1sro s LEU 50 CO 0.80 0.14 -0.04 -1.58 0.23 0.00 0.00 176.35 175.91 1sro s GLN 51 N -2.59 0.34 -0.78 1.70 -0.44 -1.26 -4.56 119.66 112.07 1sro s GLN 51 Ca 0.28 -0.12 -0.26 0.00 -2.50 0.00 0.00 55.36 52.76 1sro s GLN 51 Cb -0.11 -0.35 -0.11 0.00 -1.64 0.00 0.00 33.01 30.80 1sro s GLN 51 CO 0.20 0.06 2.29 -1.64 0.50 0.00 0.00 175.29 176.70 1sro s MET 52 N 0.06 1.89 0.00 1.67 -1.94 -1.26 -1.56 119.30 118.16 1sro s MET 52 Ca -0.00 0.42 0.00 0.00 -1.71 0.00 0.00 55.69 54.39 1sro s MET 52 Cb -0.03 -4.81 0.00 0.00 2.01 0.00 0.00 34.83 32.00 1sro s MET 52 CO -0.00 -4.05 0.00 0.41 -0.01 0.00 0.00 175.02 171.37 1sro n GLY 53 N 6.70 1.21 3.78 -0.03 0.00 -1.16 -5.03 105.19 110.67 1sro n GLY 53 Ca 0.43 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.09 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 4.35 -0.16 1.61 -1.52 -0.60 -4.78 119.66 118.57 1sro s GLN 54 Ca 0.00 1.43 -0.01 0.00 -1.95 0.00 0.00 55.36 54.83 1sro s GLN 54 Cb 0.00 -2.65 -0.01 0.00 -0.22 0.00 0.00 33.01 30.12 1sro s GLN 54 CO 0.00 0.04 -0.10 -1.21 -0.25 0.00 0.00 175.29 173.77 1sro s GLU 55 N -2.31 3.41 0.01 2.91 8.01 -1.26 -1.63 118.70 127.83 1sro s GLU 55 Ca 0.54 -0.66 0.03 0.00 0.01 0.00 0.00 54.97 54.90 1sro s GLU 55 Cb -0.20 -2.75 -0.01 0.00 -4.31 0.00 0.00 34.13 26.85 1sro s GLU 55 CO 0.26 0.11 -0.10 0.14 0.01 0.00 0.00 175.26 175.67 1sro s VAL 56 N 0.65 0.81 -0.02 2.63 -7.23 -0.64 -4.99 120.40 111.62 1sro s VAL 56 Ca -0.06 -0.61 -0.30 0.00 -1.81 0.00 0.00 61.98 59.21 1sro s VAL 56 Cb -0.15 -0.71 -0.03 0.00 0.56 0.00 0.00 36.38 36.05 1sro s VAL 56 CO 0.02 0.10 0.97 -2.16 -0.31 0.00 0.00 175.10 173.73 1sro s PRO 57 N -0.58 4.54 0.03 4.82 0.04 -1.26 -1.16 135.00 141.43 1sro s PRO 57 Ca 0.02 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.45 1sro s PRO 57 Cb -0.05 -3.47 -0.00 0.00 0.04 0.00 0.00 34.50 31.02 1sro s PRO 57 CO 0.00 -0.08 0.00 1.33 0.04 0.00 0.00 177.00 178.29 1sro n VAL 58 N 3.98 0.00 -4.38 -0.36 0.24 -0.08 -1.50 118.33 116.22 1sro n VAL 58 Ca 0.06 -0.13 -0.19 0.00 -2.04 0.00 0.00 64.34 62.04 1sro n VAL 58 Cb 0.51 0.03 -0.14 0.00 -1.47 0.00 0.00 33.84 32.76 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 -2.10 0.81 -0.95 7.34 1.02 -0.19 -0.80 119.74 124.87 1sro s LYS 59 Ca 0.00 -0.46 -0.24 0.00 0.02 0.00 0.00 55.97 55.28 1sro s LYS 59 Cb 0.00 -0.78 -0.07 0.00 -0.52 0.00 0.00 37.83 36.46 1sro s LYS 59 CO 0.00 0.21 1.99 0.08 -0.92 0.00 0.00 175.35 176.70 1sro s VAL 60 N -0.43 3.42 0.53 3.17 1.01 -0.91 -1.25 120.40 125.95 1sro s VAL 60 Ca 0.02 -0.44 0.23 0.00 0.00 0.00 0.00 61.98 61.79 1sro s VAL 60 Cb -0.05 -4.04 0.35 0.00 0.00 0.00 0.00 36.38 32.65 1sro s VAL 60 CO -0.00 -0.86 2.05 0.25 0.00 0.00 0.00 175.10 176.55 1sro h LEU 61 N 18.34 0.00 0.00 3.92 6.46 -0.37 -3.36 115.31 140.31 1sro h LEU 61 Ca 0.11 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 1sro h LEU 61 Cb 0.99 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.92 1sro h LEU 61 CO 1.19 0.00 0.00 -0.62 -0.62 0.00 0.00 178.44 178.39 1sro n GLU 62 N -4.35 0.00 0.00 1.25 1.02 -1.08 -5.01 120.64 112.47 1sro n GLU 62 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1sro n GLU 62 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.84 1sro n GLU 62 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1sro n VAL 63 N -0.95 0.00 -0.18 2.62 0.31 -1.25 -1.11 118.33 117.76 1sro n VAL 63 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 1sro n VAL 63 Cb 0.00 -0.22 -0.09 0.00 -0.91 0.00 0.00 33.84 32.62 1sro n VAL 63 CO 0.00 0.00 0.00 -2.24 -1.32 0.00 0.00 176.83 173.27 1sro h ASP 64 N 0.00 -1.70 0.25 4.52 2.03 -1.98 -0.87 116.42 118.67 1sro h ASP 64 Ca 0.00 0.23 -0.01 0.00 -0.73 0.00 0.00 57.03 56.52 1sro h ASP 64 Cb 0.00 0.71 -0.00 0.00 -0.83 0.00 0.00 39.33 39.21 1sro h ASP 64 CO 0.00 -0.32 -0.15 -0.09 -1.03 0.00 0.00 179.24 177.66 1sro h ARG 65 N -0.26 -0.37 -4.58 4.15 1.12 -2.00 -3.37 114.38 109.08 1sro h ARG 65 Ca 0.08 0.03 -0.70 0.00 -1.11 0.00 0.00 59.98 58.27 1sro h ARG 65 Cb 0.48 0.08 -0.29 0.00 -0.01 0.00 0.00 29.97 30.24 1sro h ARG 65 CO -0.60 -0.24 -0.55 -0.65 -3.11 0.00 0.00 179.97 174.82 1sro s GLN 66 N -6.13 2.58 0.00 0.20 1.11 -0.42 -4.93 119.66 112.07 1sro s GLN 66 Ca -0.15 -1.32 0.15 0.00 0.01 0.00 0.00 55.36 54.05 1sro s GLN 66 Cb 0.05 -3.60 0.91 0.00 -1.01 0.00 0.00 33.01 29.36 1sro s GLN 66 CO 0.65 -0.80 1.40 0.41 0.01 0.00 0.00 175.29 176.96 1sro n GLY 67 N 4.84 -0.73 1.99 3.09 0.00 -0.68 -3.67 105.19 110.04 1sro n GLY 67 Ca -0.11 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.63 1sro n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1sro n ARG 68 N -0.83 1.91 -3.04 1.61 1.85 -1.26 -4.91 116.66 111.99 1sro n ARG 68 Ca 0.11 -1.69 0.00 0.00 -1.00 0.00 0.00 57.85 55.28 1sro n ARG 68 Cb 0.05 -1.71 0.00 0.00 -1.05 0.00 0.00 32.46 29.75 1sro n ARG 68 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1sro n ILE 69 N 0.46 -1.48 -2.92 8.89 5.41 -1.24 -4.75 119.36 123.73 1sro n ILE 69 Ca 0.33 0.25 -0.44 0.00 1.00 0.00 0.00 62.75 63.90 1sro n ILE 69 Cb 0.58 -2.67 0.00 0.00 -0.71 0.00 0.00 39.64 36.84 1sro n ILE 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1sro n ARG 70 N 1.85 3.38 -3.42 0.38 5.12 -0.27 -4.57 116.66 119.13 1sro n ARG 70 Ca 0.00 -3.84 -0.34 0.00 -1.93 0.00 0.00 57.85 51.74 1sro n ARG 70 Cb 0.25 -3.03 -0.06 0.00 -1.16 0.00 0.00 32.46 28.47 1sro n ARG 70 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1sro s LEU 71 N 1.46 4.26 -0.11 0.55 1.43 -1.26 0.40 118.68 125.40 1sro s LEU 71 Ca 0.43 0.96 -0.02 0.00 -1.03 0.00 0.00 54.13 54.47 1sro s LEU 71 Cb -0.02 -3.42 0.04 0.00 0.03 0.00 0.00 46.19 42.81 1sro s LEU 71 CO 0.00 0.03 -0.00 -0.44 0.23 0.00 0.00 176.35 176.17 1sro s SER 72 N -2.03 2.08 0.08 2.29 0.01 -0.38 -4.51 113.70 111.24 1sro s SER 72 Ca 0.42 -0.34 -0.36 0.00 1.31 0.00 0.00 55.95 56.98 1sro s SER 72 Cb -0.13 -0.56 -0.18 0.00 0.21 0.00 0.00 66.02 65.36 1sro s SER 72 CO 0.20 -0.21 1.11 -0.38 0.41 0.00 0.00 173.24 174.37 1sro n ILE 73 N 5.08 0.38 -1.26 1.44 5.41 -1.25 -1.02 119.36 128.14 1sro n ILE 73 Ca -0.09 -0.09 -0.30 0.00 1.00 0.00 0.00 62.75 63.27 1sro n ILE 73 Cb 0.49 -0.41 0.22 0.00 -0.71 0.00 0.00 39.64 39.24 1sro n ILE 73 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1sro s LYS 74 N -0.04 -0.75 0.26 0.38 2.20 -0.56 -4.76 119.74 116.47 1sro s LYS 74 Ca 0.83 -0.10 -0.01 0.00 -0.36 0.00 0.00 55.97 56.33 1sro s LYS 74 Cb -1.06 -1.65 0.56 0.00 -1.51 0.00 0.00 37.83 34.17 1sro s LYS 74 CO 0.53 -3.39 1.71 1.49 -0.36 0.00 0.00 175.35 175.33 1sro h GLU 75 N -2.35 0.40 0.00 4.03 4.57 -1.90 -3.48 114.58 115.86 1sro h GLU 75 Ca -0.45 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 1sro h GLU 75 Cb 1.29 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1sro h GLU 75 CO 0.37 0.27 0.00 0.00 -1.18 0.00 0.00 179.01 178.46