#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oru s LYS 3 N 0.00 4.08 0.48 -0.99 -2.85 -0.71 -4.88 119.74 114.86 1oru s LYS 3 Ca 0.00 -0.27 0.04 0.00 -1.00 0.00 0.00 55.97 54.74 1oru s LYS 3 Cb 0.00 -3.51 0.02 0.00 -2.06 0.00 0.00 37.83 32.28 1oru s LYS 3 CO 0.00 0.10 0.67 1.03 0.10 0.00 0.00 175.35 177.25 1oru s ARG 4 N 0.93 2.76 -0.01 1.78 0.52 -1.26 -0.86 118.95 122.80 1oru s ARG 4 Ca 0.07 -0.90 0.01 0.00 -0.52 0.00 0.00 55.73 54.40 1oru s ARG 4 Cb -0.13 -2.61 0.01 0.00 0.52 0.00 0.00 34.95 32.73 1oru s ARG 4 CO 0.03 -0.44 -0.04 0.99 0.02 0.00 0.00 175.30 175.86 1oru s THR 6 N -2.55 0.35 0.00 0.02 2.01 -1.26 -4.99 115.64 109.21 1oru s THR 6 Ca 0.54 -0.13 0.00 0.00 0.31 0.00 0.00 61.69 62.41 1oru s THR 6 Cb -0.10 -0.33 0.00 0.00 0.01 0.00 0.00 72.50 72.08 1oru s THR 6 CO 0.36 0.13 0.00 0.00 -0.69 0.00 0.00 174.62 174.42 1oru n ALA 7 N 3.32 0.00 -2.97 7.40 0.00 -0.13 -4.97 120.51 123.15 1oru n ALA 7 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.15 1oru n ALA 7 Cb 0.56 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.88 1oru n ALA 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1oru s LYS 8 N -1.29 0.17 -0.63 0.00 2.20 -0.91 -0.22 119.74 119.07 1oru s LYS 8 Ca 0.00 -0.08 -0.20 0.00 -0.36 0.00 0.00 55.97 55.33 1oru s LYS 8 Cb 0.00 0.07 0.10 0.00 -1.51 0.00 0.00 37.83 36.49 1oru s LYS 8 CO 0.00 -0.03 0.79 0.00 -0.36 0.00 0.00 175.35 175.75 1oru s ALA 9 N -0.40 3.34 0.18 3.13 0.00 0.12 -0.59 121.76 127.55 1oru s ALA 9 Ca -0.05 -2.17 -0.04 0.00 0.00 0.00 0.00 51.96 49.70 1oru s ALA 9 Cb -0.03 -3.64 0.09 0.00 0.00 0.00 0.00 23.12 19.54 1oru s ALA 9 CO 0.00 -2.49 1.50 0.93 0.00 0.00 0.00 175.76 175.70 1oru h GLU 10 N 9.25 0.61 -3.28 0.00 4.39 -0.77 0.12 114.58 124.90 1oru h GLU 10 Ca -0.27 -0.37 -0.12 0.00 0.34 0.00 0.00 59.36 58.94 1oru h GLU 10 Cb 1.08 0.04 -0.20 0.00 -0.10 0.00 0.00 28.75 29.57 1oru h GLU 10 CO 1.12 0.99 -0.36 0.20 -1.16 0.00 0.00 179.01 179.79 1oru s GLY 11 N -4.09 -0.06 0.01 -3.84 0.00 -0.80 -4.32 107.32 94.23 1oru s GLY 11 Ca -0.08 0.07 0.07 0.00 0.00 0.00 0.00 44.72 44.77 1oru s GLY 11 CO 0.85 -0.12 -0.20 1.08 0.00 0.00 0.00 173.10 174.71 1oru s LEU 12 N -1.50 2.09 0.03 0.66 1.43 -1.26 -0.82 118.68 119.30 1oru s LEU 12 Ca -0.12 -0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 52.47 1oru s LEU 12 Cb -0.05 -1.00 0.00 0.00 0.03 0.00 0.00 46.19 45.17 1oru s LEU 12 CO 0.02 0.21 0.18 -0.31 0.23 0.00 0.00 176.35 176.68 1oru s TYR 13 N -0.59 0.04 0.05 0.29 2.02 0.36 -4.28 117.35 115.24 1oru s TYR 13 Ca 0.07 -0.21 0.04 0.00 -0.37 0.00 0.00 57.07 56.61 1oru s TYR 13 Cb -0.08 -0.03 -0.03 0.00 -0.40 0.00 0.00 41.96 41.42 1oru s TYR 13 CO 0.00 -0.38 -0.12 -1.50 -1.57 0.00 0.00 175.55 171.98 1oru s ILE 14 N -2.15 0.93 -0.74 2.71 2.07 -0.48 -4.39 121.20 119.15 1oru s ILE 14 Ca -0.08 -1.13 -0.09 0.00 -1.41 0.00 0.00 60.65 57.94 1oru s ILE 14 Cb -0.03 -0.90 0.19 0.00 0.13 0.00 0.00 42.46 41.85 1oru s ILE 14 CO -0.02 -0.20 0.62 0.00 -1.91 0.00 0.00 174.94 173.44 1oru s ALA 15 N -1.15 3.86 -2.32 1.50 0.00 -1.26 -1.05 121.76 121.34 1oru s ALA 15 Ca -0.03 -3.30 0.29 0.00 0.00 0.00 0.00 51.96 48.92 1oru s ALA 15 Cb -0.09 -3.14 1.28 0.00 0.00 0.00 0.00 23.12 21.17 1oru s ALA 15 CO 0.01 -2.20 1.88 -0.40 0.00 0.00 0.00 175.76 175.05 1oru n ASP 16 N 3.75 1.05 -1.05 0.00 5.75 -1.26 0.07 116.55 124.86 1oru n ASP 16 Ca 0.11 -1.32 0.00 0.00 -0.01 0.00 0.00 54.79 53.57 1oru n ASP 16 Cb 0.43 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.52 1oru n ASP 16 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1oru n THR 17 N -0.20 0.00 0.34 2.12 -2.24 -1.26 -4.94 114.28 108.10 1oru n THR 17 Ca 0.20 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.12 1oru n THR 17 Cb 0.29 0.00 0.48 0.00 -2.10 0.00 0.00 70.33 69.00 1oru n THR 17 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1oru h LYS 18 N 0.00 0.00 -6.86 -0.78 6.56 -1.99 -3.43 116.57 110.07 1oru h LYS 18 Ca 0.00 0.00 -0.51 0.00 -1.06 0.00 0.00 60.65 59.08 1oru h LYS 18 Cb 0.00 0.00 0.04 0.00 -0.57 0.00 0.00 32.23 31.70 1oru h LYS 18 CO 0.00 0.00 0.52 0.45 -2.06 0.00 0.00 179.45 178.36 1oru s SER 19 N -5.35 6.96 0.00 0.86 0.15 -1.26 -4.94 113.70 110.12 1oru s SER 19 Ca 0.05 2.37 0.27 0.00 0.70 0.00 0.00 55.95 59.33 1oru s SER 19 Cb 0.09 -2.63 0.86 0.00 -1.71 0.00 0.00 66.02 62.63 1oru s SER 19 CO 0.55 -0.37 1.64 2.22 1.20 0.00 0.00 173.24 178.48 1oru n PHE 20 N 0.77 0.00 -2.46 3.44 1.16 -1.26 -4.74 117.46 114.38 1oru n PHE 20 Ca 0.01 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.16 1oru n PHE 20 Cb 0.45 -0.22 -0.02 0.00 -1.61 0.00 0.00 39.48 38.07 1oru n PHE 20 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1oru s VAL 21 N -2.71 4.26 0.67 1.97 1.01 -1.26 -3.84 120.40 120.49 1oru s VAL 21 Ca 0.20 1.48 -0.09 0.00 0.00 0.00 0.00 61.98 63.57 1oru s VAL 21 Cb 0.19 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.47 1oru s VAL 21 CO 0.57 -0.32 1.02 0.42 0.00 0.00 0.00 175.10 176.78 1oru s THR 22 N 3.90 3.29 -0.03 3.92 -4.23 -1.07 -4.82 115.64 116.59 1oru s THR 22 Ca 0.54 0.16 0.05 0.00 -1.18 0.00 0.00 61.69 61.26 1oru s THR 22 Cb -0.18 -3.37 -0.01 0.00 1.34 0.00 0.00 72.50 70.28 1oru s THR 22 CO 0.18 -0.44 -0.19 -1.59 -0.54 0.00 0.00 174.62 172.04 1oru s LYS 23 N -5.22 1.77 1.25 3.99 -2.85 -0.22 -4.74 119.74 113.72 1oru s LYS 23 Ca 0.57 -0.68 -0.17 0.00 -1.00 0.00 0.00 55.97 54.69 1oru s LYS 23 Cb -0.11 -1.60 0.31 0.00 -2.06 0.00 0.00 37.83 34.37 1oru s LYS 23 CO 0.48 0.34 1.00 -1.14 0.10 0.00 0.00 175.35 176.13 1oru s GLN 24 N -0.21 -1.59 -0.00 1.78 0.74 -1.26 -1.38 119.66 117.74 1oru s GLN 24 Ca 0.01 0.47 0.03 0.00 0.05 0.00 0.00 55.36 55.92 1oru s GLN 24 Cb -0.10 -1.51 -0.04 0.00 1.10 0.00 0.00 33.01 32.46 1oru s GLN 24 CO 0.01 -4.07 0.06 -0.25 -0.55 0.00 0.00 175.29 170.49 1oru n ASP 26 N -5.11 4.41 -3.73 6.67 8.00 -1.26 -4.90 116.55 120.62 1oru n ASP 26 Ca 0.07 -0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.45 1oru n ASP 26 Cb 0.57 1.12 -0.07 0.00 -0.02 0.00 0.00 41.12 42.72 1oru n ASP 26 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1oru s LYS 27 N -2.18 0.81 0.01 -1.24 2.20 -1.26 -2.01 119.74 116.07 1oru s LYS 27 Ca -0.01 -0.42 -0.01 0.00 -0.36 0.00 0.00 55.97 55.17 1oru s LYS 27 Cb 0.02 0.36 -0.01 0.00 -1.51 0.00 0.00 37.83 36.68 1oru s LYS 27 CO 0.11 -0.26 0.01 -0.51 -0.36 0.00 0.00 175.35 174.33 1oru s LEU 28 N -1.92 2.06 -0.20 5.43 1.43 -0.52 -5.00 118.68 119.96 1oru s LEU 28 Ca -0.07 -0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 52.67 1oru s LEU 28 Cb -0.02 0.16 -0.04 0.00 0.03 0.00 0.00 46.19 46.33 1oru s LEU 28 CO -0.02 -0.22 0.05 -1.81 0.23 0.00 0.00 176.35 174.59 1oru s ASP 29 N -1.00 5.43 -0.17 2.29 1.01 -1.26 -0.97 116.67 121.98 1oru s ASP 29 Ca -0.11 -0.01 -0.07 0.00 0.71 0.00 0.00 52.55 53.07 1oru s ASP 29 Cb -0.07 -1.94 -0.04 0.00 1.01 0.00 0.00 42.92 41.89 1oru s ASP 29 CO -0.00 0.12 0.05 -0.36 0.21 0.00 0.00 175.17 175.19 1oru s PHE 30 N 0.67 3.24 0.18 4.23 0.08 -0.27 -4.00 117.98 122.12 1oru s PHE 30 Ca 0.03 0.07 -0.04 0.00 0.12 0.00 0.00 56.93 57.11 1oru s PHE 30 Cb -0.13 -2.05 -0.03 0.00 -0.57 0.00 0.00 43.02 40.24 1oru s PHE 30 CO 0.02 0.18 0.18 0.34 -0.10 0.00 0.00 175.22 175.84 1oru s ASP 31 N 0.24 0.14 0.09 1.36 -1.08 -0.04 -1.12 116.67 116.26 1oru s ASP 31 Ca 0.03 -1.20 -0.33 0.00 -0.52 0.00 0.00 52.55 50.54 1oru s ASP 31 Cb -0.12 0.39 -0.12 0.00 -1.46 0.00 0.00 42.92 41.61 1oru s ASP 31 CO 0.01 -0.86 1.73 -1.22 0.52 0.00 0.00 175.17 175.35 1oru n TYR 32 N -0.23 2.41 0.00 -5.34 4.01 -1.26 -0.49 117.16 116.26 1oru n TYR 32 Ca -0.02 0.07 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1oru n TYR 32 Cb 0.64 -2.63 0.00 0.00 -0.31 0.00 0.00 39.34 37.04 1oru n TYR 32 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1oru n GLY 33 N 3.92 2.71 0.00 2.72 0.00 -1.26 -4.82 105.19 108.46 1oru n GLY 33 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1oru n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oru n GLY 34 N -1.17 0.10 3.51 -0.02 0.00 0.36 -0.94 105.19 107.04 1oru n GLY 34 Ca 0.00 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.81 1oru n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oru s ILE 35 N -0.60 5.17 0.19 -0.61 1.01 -1.26 -0.86 121.20 124.24 1oru s ILE 35 Ca 0.00 -0.20 -0.33 0.00 0.00 0.00 0.00 60.65 60.12 1oru s ILE 35 Cb 0.00 -3.89 -0.14 0.00 0.01 0.00 0.00 42.46 38.44 1oru s ILE 35 CO 0.00 -0.21 1.39 -2.65 0.00 0.00 0.00 174.94 173.46 1oru n PRO 36 N 5.39 1.78 -0.14 2.79 -0.02 -1.26 -0.52 135.00 143.02 1oru n PRO 36 Ca -0.09 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1oru n PRO 36 Cb 0.48 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1oru n PRO 36 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oru n GLY 37 N 2.45 1.69 3.86 -1.23 0.00 -1.26 -4.98 105.19 105.72 1oru n GLY 37 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1oru n GLY 37 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1oru s ASP 38 N -3.23 6.59 0.51 1.61 2.15 0.32 -4.40 116.67 120.21 1oru s ASP 38 Ca 0.00 1.34 0.18 0.00 0.43 0.00 0.00 52.55 54.50 1oru s ASP 38 Cb 0.00 -2.41 1.27 0.00 -0.30 0.00 0.00 42.92 41.48 1oru s ASP 38 CO 0.00 -0.47 2.10 0.25 -0.17 0.00 0.00 175.17 176.88 1oru h LEU 39 N 1.18 0.04 -3.40 -1.34 5.85 -0.62 -2.55 115.31 114.46 1oru h LEU 39 Ca -0.47 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 1oru h LEU 39 Cb 1.19 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 1oru h LEU 39 CO 0.63 0.03 0.02 1.41 -0.34 0.00 0.00 178.44 180.18 1oru n HIS 40 N -4.49 1.44 -2.71 1.25 8.25 -1.26 -5.00 115.22 112.69 1oru n HIS 40 Ca 0.01 -0.89 -0.39 0.00 -0.26 0.00 0.00 57.72 56.20 1oru n HIS 40 Cb 0.24 -0.42 -0.06 0.00 1.12 0.00 0.00 29.99 30.87 1oru n HIS 40 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1oru s PHE 41 N -2.85 3.81 0.00 4.41 5.36 -0.96 -4.62 117.98 123.13 1oru s PHE 41 Ca 0.47 1.84 0.00 0.00 -0.96 0.00 0.00 56.93 58.28 1oru s PHE 41 Cb 0.38 -3.01 0.00 0.00 -0.34 0.00 0.00 43.02 40.05 1oru s PHE 41 CO 0.11 0.20 0.00 0.41 -1.46 0.00 0.00 175.22 174.48 1oru n GLY 42 N 1.12 4.36 0.19 13.12 0.00 -0.11 -4.91 105.19 118.96 1oru n GLY 42 Ca -0.00 -1.51 -0.08 0.00 0.00 0.00 0.00 46.02 44.43 1oru n GLY 42 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1oru h LEU 43 N 0.00 0.47 -9.40 0.99 5.85 -1.90 -3.42 115.31 107.91 1oru h LEU 43 Ca 0.00 -0.27 -0.53 0.00 0.84 0.00 0.00 57.88 57.92 1oru h LEU 43 Cb 0.00 -0.14 -0.14 0.00 0.37 0.00 0.00 40.66 40.76 1oru h LEU 43 CO 0.00 0.98 -0.59 0.42 -0.34 0.00 0.00 178.44 178.90 1oru s THR 44 N -3.81 1.36 0.22 1.05 -4.23 -1.26 -0.37 115.64 108.59 1oru s THR 44 Ca -0.06 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.31 1oru s THR 44 Cb 0.11 -2.79 0.01 0.00 1.34 0.00 0.00 72.50 71.18 1oru s THR 44 CO 0.83 0.00 0.48 -1.59 -0.54 0.00 0.00 174.62 173.80 1oru s LYS 45 N -3.83 1.44 -0.09 3.99 -2.85 0.40 -4.54 119.74 114.27 1oru s LYS 45 Ca 0.34 -1.08 -0.15 0.00 -1.00 0.00 0.00 55.97 54.08 1oru s LYS 45 Cb 0.08 0.48 -0.05 0.00 -2.06 0.00 0.00 37.83 36.29 1oru s LYS 45 CO 0.15 -0.60 0.37 0.15 0.10 0.00 0.00 175.35 175.53 1oru s LYS 46 N -3.95 4.10 0.51 1.78 1.02 -1.26 -0.88 119.74 121.06 1oru s LYS 46 Ca 0.16 0.29 -0.22 0.00 0.02 0.00 0.00 55.97 56.22 1oru s LYS 46 Cb -0.01 -3.34 -0.06 0.00 -0.52 0.00 0.00 37.83 33.91 1oru s LYS 46 CO 0.03 0.42 1.26 0.00 -0.92 0.00 0.00 175.35 176.14 1oru s ALA 47 N -0.16 2.87 0.00 5.17 0.00 0.45 -4.77 121.76 125.31 1oru s ALA 47 Ca 0.21 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.31 1oru s ALA 47 Cb -0.15 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1oru s ALA 47 CO 0.09 -1.05 0.00 0.41 0.00 0.00 0.00 175.76 175.21 1oru n GLY 48 N 0.59 4.90 0.28 0.00 0.00 -1.26 -0.93 105.19 108.76 1oru n GLY 48 Ca 0.09 -1.04 0.14 0.00 0.00 0.00 0.00 46.02 45.22 1oru n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oru h ALA 49 N 1.24 1.42 0.00 4.61 0.00 -1.97 -1.89 119.26 122.68 1oru h ALA 49 Ca 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1oru h ALA 49 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1oru h ALA 49 CO 0.00 0.06 -0.20 0.00 0.00 0.00 0.00 179.25 179.11 1oru h ARG 50 N 0.00 0.00 -2.18 0.00 3.08 -1.98 -3.31 114.38 109.99 1oru h ARG 50 Ca -0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 1oru h ARG 50 Cb 0.14 0.00 -0.42 0.00 0.08 0.00 0.00 29.97 29.77 1oru h ARG 50 CO 0.01 0.20 -0.68 0.39 -1.07 0.00 0.00 179.97 178.82 1oru n GLU 51 N -3.21 2.38 -0.07 0.04 4.71 -0.71 -5.12 120.64 118.67 1oru n GLU 51 Ca 0.02 -4.50 -0.01 0.00 -0.01 0.00 0.00 57.16 52.66 1oru n GLU 51 Cb 0.53 -2.11 -0.01 0.00 -1.01 0.00 0.00 31.44 28.84 1oru n GLU 51 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 1oru n PRO 52 N 0.73 0.16 0.00 3.49 -0.04 -1.23 -4.42 135.00 133.70 1oru n PRO 52 Ca 0.29 -0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1oru n PRO 52 Cb 0.43 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 1oru n PRO 52 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1oru n PHE 54 N 3.73 0.00 -2.27 0.54 3.72 -1.26 -5.00 117.46 116.92 1oru n PHE 54 Ca 0.03 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.03 1oru n PHE 54 Cb 0.04 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.55 1oru n PHE 54 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1oru s SER 55 N 0.00 6.98 0.13 4.37 0.01 -1.26 -4.88 113.70 119.04 1oru s SER 55 Ca 0.00 2.42 -0.35 0.00 1.31 0.00 0.00 55.95 59.33 1oru s SER 55 Cb 0.00 -2.62 -0.16 0.00 0.21 0.00 0.00 66.02 63.45 1oru s SER 55 CO 0.00 -0.42 1.36 -1.14 0.41 0.00 0.00 173.24 173.46 1oru n ARG 56 N 1.80 1.42 -0.01 12.44 0.63 -1.26 -1.16 116.66 130.51 1oru n ARG 56 Ca 0.03 0.51 0.00 0.00 -0.92 0.00 0.00 57.85 57.47 1oru n ARG 56 Cb 0.43 -2.16 0.00 0.00 0.45 0.00 0.00 32.46 31.19 1oru n ARG 56 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1oru n GLY 57 N 2.60 1.19 3.74 5.14 0.00 -0.11 -4.93 105.19 112.82 1oru n GLY 57 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1oru n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oru s THR 58 N -2.41 2.47 -0.11 2.61 2.01 -0.31 -4.46 115.64 115.42 1oru s THR 58 Ca 0.00 0.38 -0.30 0.00 0.31 0.00 0.00 61.69 62.08 1oru s THR 58 Cb 0.00 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.25 1oru s THR 58 CO 0.00 0.05 1.17 -0.70 -0.69 0.00 0.00 174.62 174.45 1oru s GLU 59 N -0.05 4.32 0.24 4.92 2.12 -1.26 -0.41 118.70 128.57 1oru s GLU 59 Ca 0.63 1.58 0.01 0.00 0.36 0.00 0.00 54.97 57.55 1oru s GLU 59 Cb -0.44 -3.62 -0.05 0.00 0.26 0.00 0.00 34.13 30.28 1oru s GLU 59 CO 0.42 -0.52 0.10 0.96 -0.54 0.00 0.00 175.26 175.67 1oru s ILE 60 N 2.65 0.44 0.43 -3.70 -4.36 -0.06 -4.96 121.20 111.62 1oru s ILE 60 Ca 0.53 -2.00 -0.26 0.00 -0.26 0.00 0.00 60.65 58.66 1oru s ILE 60 Cb -0.22 -2.56 -0.09 0.00 1.25 0.00 0.00 42.46 40.85 1oru s ILE 60 CO 0.17 -0.05 1.41 0.12 0.24 0.00 0.00 174.94 176.84 1oru s PHE 61 N -3.84 2.56 -0.82 1.37 5.36 -1.26 -0.45 117.98 120.90 1oru s PHE 61 Ca 0.37 1.28 -0.21 0.00 -0.96 0.00 0.00 56.93 57.41 1oru s PHE 61 Cb 0.08 -3.88 0.09 0.00 -0.34 0.00 0.00 43.02 38.96 1oru s PHE 61 CO 0.12 -2.76 1.10 1.21 -1.46 0.00 0.00 175.22 173.44 1oru s ASN 62 N -0.49 6.41 0.19 6.13 2.47 0.50 -4.53 114.94 125.61 1oru s ASN 62 Ca 0.59 -1.48 0.12 0.00 0.42 0.00 0.00 52.86 52.51 1oru s ASN 62 Cb -0.43 -2.43 -0.07 0.00 -1.45 0.00 0.00 41.25 36.87 1oru s ASN 62 CO 0.56 -1.30 1.28 -0.09 -3.72 0.00 0.00 177.10 173.83 1oru h ARG 63 N 9.30 0.00 -2.89 0.43 2.43 -1.91 -3.38 114.38 118.36 1oru h ARG 63 Ca -0.04 0.00 -0.80 0.00 -0.81 0.00 0.00 59.98 58.33 1oru h ARG 63 Cb 1.04 0.00 -0.26 0.00 -0.42 0.00 0.00 29.97 30.34 1oru h ARG 63 CO 1.18 0.65 1.05 0.54 -1.51 0.00 0.00 179.97 181.88 1oru n ARG 64 N -3.22 4.52 0.13 0.20 1.74 -1.26 -4.26 116.66 114.50 1oru n ARG 64 Ca -0.01 -4.40 -0.21 0.00 -0.77 0.00 0.00 57.85 52.46 1oru n ARG 64 Cb 0.83 -2.57 -0.15 0.00 -1.02 0.00 0.00 32.46 29.56 1oru n ARG 64 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1oru h GLN 65 N 5.27 0.46 -4.42 5.56 4.20 -1.63 -3.46 115.11 121.08 1oru h GLN 65 Ca 0.29 -0.76 -0.43 0.00 0.06 0.00 0.00 58.65 57.81 1oru h GLN 65 Cb 0.56 0.28 -0.32 0.00 0.30 0.00 0.00 27.48 28.30 1oru h GLN 65 CO 1.36 1.36 -0.79 0.42 -0.67 0.00 0.00 178.83 180.52 1oru s ILE 66 N -2.66 0.75 -0.15 2.54 -1.09 -0.26 -4.55 121.20 115.77 1oru s ILE 66 Ca -0.07 -0.31 -0.04 0.00 -2.23 0.00 0.00 60.65 58.00 1oru s ILE 66 Cb 0.05 -0.69 -0.03 0.00 -1.58 0.00 0.00 42.46 40.21 1oru s ILE 66 CO 0.92 0.25 -0.02 -0.55 -1.23 0.00 0.00 174.94 174.32 1oru s SER 67 N 0.43 4.99 -0.02 3.58 0.15 -1.26 -0.22 113.70 121.35 1oru s SER 67 Ca -0.07 -0.06 0.05 0.00 0.70 0.00 0.00 55.95 56.57 1oru s SER 67 Cb -0.11 -1.78 -0.01 0.00 -1.71 0.00 0.00 66.02 62.41 1oru s SER 67 CO 0.01 0.19 -0.18 -0.63 1.20 0.00 0.00 173.24 173.83 1oru s ILE 68 N 0.25 1.40 0.10 6.45 1.01 -0.16 -0.70 121.20 129.53 1oru s ILE 68 Ca -0.01 -0.75 0.03 0.00 0.00 0.00 0.00 60.65 59.92 1oru s ILE 68 Cb -0.14 -1.17 -0.04 0.00 0.01 0.00 0.00 42.46 41.13 1oru s ILE 68 CO 0.02 0.40 -0.09 0.68 0.00 0.00 0.00 174.94 175.95 1oru s VAL 69 N -0.33 0.84 0.00 2.92 -7.23 -0.63 -1.47 120.40 114.50 1oru s VAL 69 Ca 0.05 -1.72 0.02 0.00 -1.81 0.00 0.00 61.98 58.52 1oru s VAL 69 Cb -0.08 -1.43 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 1oru s VAL 69 CO -0.00 -0.66 -0.02 -0.94 -0.31 0.00 0.00 175.10 173.17 1oru s SER 70 N -2.62 4.97 0.24 4.85 1.04 -1.26 -0.65 113.70 120.28 1oru s SER 70 Ca 0.07 -0.05 -0.06 0.00 0.48 0.00 0.00 55.95 56.39 1oru s SER 70 Cb -0.01 -1.26 0.32 0.00 0.10 0.00 0.00 66.02 65.18 1oru s SER 70 CO -0.01 0.28 1.86 0.40 0.98 0.00 0.00 173.24 176.74 1oru h ILE 71 N 3.59 1.06 -0.29 -1.02 1.08 -0.75 -1.35 117.51 119.83 1oru h ILE 71 Ca -0.49 -0.34 0.02 0.00 -0.39 0.00 0.00 64.86 63.65 1oru h ILE 71 Cb 1.17 -0.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.87 1oru h ILE 71 CO 0.56 0.18 0.15 -0.33 -0.69 0.00 0.00 178.15 178.02 1oru h GLU 72 N 1.00 0.30 -0.19 2.37 3.07 -1.95 -1.32 114.58 117.87 1oru h GLU 72 Ca 0.37 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 59.10 1oru h GLU 72 Cb 0.13 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 1oru h GLU 72 CO -0.16 0.20 -0.38 0.93 -1.40 0.00 0.00 179.01 178.20 1oru h GLU 73 N 0.31 0.41 -0.62 2.33 5.08 -1.72 -1.83 114.58 118.55 1oru h GLU 73 Ca 0.12 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 1oru h GLU 73 Cb 0.02 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1oru h GLU 73 CO -0.07 0.73 0.14 0.00 -1.00 0.00 0.00 179.01 178.81 1oru h ASN 75 N 0.92 0.59 -0.50 0.00 -0.26 -0.99 -1.29 115.58 114.05 1oru h ASN 75 Ca 0.20 -0.18 -0.04 0.00 -0.56 0.00 0.00 56.30 55.72 1oru h ASN 75 Cb 0.34 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.42 1oru h ASN 75 CO 0.00 0.77 0.15 -0.08 -1.06 0.00 0.00 177.43 177.21 1oru h GLU 76 N 0.55 0.79 -0.31 0.81 4.81 -0.43 -1.38 114.58 119.42 1oru h GLU 76 Ca 0.09 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1oru h GLU 76 Cb 0.58 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1oru h GLU 76 CO 0.04 0.74 0.15 0.82 -0.73 0.00 0.00 179.01 180.03 1oru h ILE 77 N 0.69 1.15 -0.38 2.32 2.04 -0.67 -2.00 117.51 120.66 1oru h ILE 77 Ca 0.16 -0.42 0.07 0.00 1.00 0.00 0.00 64.86 65.68 1oru h ILE 77 Cb 0.28 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 37.15 1oru h ILE 77 CO -0.00 0.15 -0.07 0.00 0.00 0.00 0.00 178.15 178.23 1oru h ALA 78 N 1.01 0.27 -0.28 1.87 0.00 -0.90 -2.20 119.26 119.04 1oru h ALA 78 Ca 0.11 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1oru h ALA 78 Cb 0.10 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1oru h ALA 78 CO -0.01 -0.44 0.17 -0.07 0.00 0.00 0.00 179.25 178.89 1oru h LEU 79 N 0.02 0.28 -1.85 0.00 4.07 -1.07 -0.02 115.31 116.75 1oru h LEU 79 Ca 0.18 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.14 1oru h LEU 79 Cb 0.28 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1oru h LEU 79 CO -0.37 0.20 0.00 0.29 -1.08 0.00 0.00 178.44 177.48 1oru n LYS 80 N -4.92 0.16 -0.64 1.13 5.02 -0.77 -4.64 118.16 113.49 1oru n LYS 80 Ca -0.01 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.25 1oru n LYS 80 Cb 0.04 -1.37 -0.03 0.00 -0.02 0.00 0.00 35.03 33.65 1oru n LYS 80 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1oru n GLY 82 N 0.84 0.24 3.52 0.72 0.00 -0.11 -5.02 105.19 105.39 1oru n GLY 82 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1oru n GLY 82 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1oru s VAL 83 N 0.00 2.99 0.39 1.61 -7.23 -0.64 -5.05 120.40 112.47 1oru s VAL 83 Ca 0.00 -1.53 0.06 0.00 -1.81 0.00 0.00 61.98 58.70 1oru s VAL 83 Cb 0.00 -2.41 0.27 0.00 0.56 0.00 0.00 36.38 34.80 1oru s VAL 83 CO 0.00 0.04 2.03 1.55 -0.31 0.00 0.00 175.10 178.40 1oru h PRO 84 N 3.47 0.64 -2.41 4.82 0.13 -2.00 -3.38 132.00 133.26 1oru h PRO 84 Ca -0.49 -0.04 0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1oru h PRO 84 Cb 1.18 -0.14 -0.16 0.00 0.13 0.00 0.00 31.00 32.01 1oru h PRO 84 CO 0.49 0.42 0.30 -0.98 -0.23 0.00 0.00 178.00 178.00 1oru s ARG 85 N -5.58 1.05 -0.18 0.86 1.70 -1.26 -4.98 118.95 110.56 1oru s ARG 85 Ca -0.09 -0.16 -0.01 0.00 -0.47 0.00 0.00 55.73 55.00 1oru s ARG 85 Cb 0.18 0.49 0.05 0.00 -0.57 0.00 0.00 34.95 35.09 1oru s ARG 85 CO 0.75 -0.41 -0.03 0.42 -1.08 0.00 0.00 175.30 174.95 1oru s ILE 86 N -2.60 0.99 0.07 4.99 -1.09 -1.26 -4.96 121.20 117.35 1oru s ILE 86 Ca -0.02 -0.65 -0.21 0.00 -2.23 0.00 0.00 60.65 57.54 1oru s ILE 86 Cb -0.01 -1.25 -0.07 0.00 -1.58 0.00 0.00 42.46 39.56 1oru s ILE 86 CO -0.04 0.03 0.63 -0.76 -1.23 0.00 0.00 174.94 173.57 1oru s LEU 87 N 1.67 4.51 0.43 2.97 1.43 -1.26 -4.80 118.68 123.63 1oru s LEU 87 Ca -0.00 1.33 0.17 0.00 -1.03 0.00 0.00 54.13 54.60 1oru s LEU 87 Cb -0.16 -3.01 1.08 0.00 0.03 0.00 0.00 46.19 44.13 1oru s LEU 87 CO -0.07 0.21 1.89 -0.65 0.23 0.00 0.00 176.35 177.95 1oru h PRO 88 N 4.80 0.39 -0.91 1.29 0.11 -1.99 -1.24 132.00 134.46 1oru h PRO 88 Ca -0.48 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.67 1oru h PRO 88 Cb 1.21 -0.09 -0.06 0.00 0.11 0.00 0.00 31.00 32.17 1oru h PRO 88 CO 0.66 0.26 0.57 0.93 -0.21 0.00 0.00 178.00 180.21 1oru h GLU 89 N 0.40 1.02 0.00 1.05 3.07 -1.85 -1.20 114.58 117.08 1oru h GLU 89 Ca 0.42 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 59.19 1oru h GLU 89 Cb 1.02 -0.23 -0.00 0.00 -0.84 0.00 0.00 28.75 28.70 1oru h GLU 89 CO -0.14 0.68 -0.12 -1.49 -1.40 0.00 0.00 179.01 176.53 1oru h TRP 90 N 1.05 0.00 -0.22 4.33 6.55 -1.54 -1.10 115.95 125.03 1oru h TRP 90 Ca 0.39 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.23 1oru h TRP 90 Cb 0.15 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.45 1oru h TRP 90 CO -0.02 0.12 0.00 1.28 -1.05 0.00 0.00 178.44 178.77 1oru n LEU 91 N -3.99 2.27 -1.32 -4.49 4.77 -0.51 -4.73 117.00 109.00 1oru n LEU 91 Ca -0.02 -0.94 -0.13 0.00 -0.03 0.00 0.00 56.01 54.89 1oru n LEU 91 Cb 0.21 -0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 41.14 1oru n LEU 91 CO 0.32 0.47 -0.15 0.61 -1.33 0.00 0.00 177.39 177.31 1oru n GLY 92 N 1.26 0.35 3.79 -0.72 0.00 -0.44 -4.99 105.19 104.44 1oru n GLY 92 Ca 0.17 -0.36 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1oru n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oru s ALA 93 N -2.60 2.82 -0.12 4.61 0.00 -0.84 -4.81 121.76 120.82 1oru s ALA 93 Ca 0.00 0.68 0.18 0.00 0.00 0.00 0.00 51.96 52.82 1oru s ALA 93 Cb 0.00 -3.29 -0.26 0.00 0.00 0.00 0.00 23.12 19.57 1oru s ALA 93 CO 0.00 -0.46 0.22 0.09 0.00 0.00 0.00 175.76 175.61 1oru n ASN 94 N -1.04 0.50 -3.80 0.00 3.02 0.12 -4.46 115.26 109.60 1oru n ASN 94 Ca 0.10 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.50 1oru n ASN 94 Cb 0.52 1.35 -0.16 0.00 -0.61 0.00 0.00 39.78 40.88 1oru n ASN 94 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1oru s VAL 95 N -2.83 0.02 -0.22 2.41 1.01 -0.95 -0.49 120.40 119.36 1oru s VAL 95 Ca -0.08 0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 1oru s VAL 95 Cb 0.08 -0.13 0.01 0.00 0.00 0.00 0.00 36.38 36.34 1oru s VAL 95 CO 0.78 0.10 -0.09 0.00 0.00 0.00 0.00 175.10 175.88 1oru s ALA 96 N 0.90 2.64 0.22 5.51 0.00 0.00 -1.60 121.76 129.44 1oru s ALA 96 Ca -0.08 -1.27 0.07 0.00 0.00 0.00 0.00 51.96 50.67 1oru s ALA 96 Cb -0.11 -1.55 -0.04 0.00 0.00 0.00 0.00 23.12 21.42 1oru s ALA 96 CO -0.02 -0.53 0.15 0.14 0.00 0.00 0.00 175.76 175.50 1oru s VAL 97 N 1.38 4.33 0.15 0.00 -7.23 0.18 -0.04 120.40 119.17 1oru s VAL 97 Ca 0.04 -1.36 0.08 0.00 -1.81 0.00 0.00 61.98 58.93 1oru s VAL 97 Cb -0.15 -3.29 -0.04 0.00 0.56 0.00 0.00 36.38 33.46 1oru s VAL 97 CO -0.06 -0.27 -0.18 -0.94 -0.31 0.00 0.00 175.10 173.33 1oru s SER 98 N -3.58 2.57 0.00 4.85 1.04 0.24 0.01 113.70 118.84 1oru s SER 98 Ca 0.32 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.91 1oru s SER 98 Cb -0.08 -0.14 0.00 0.00 0.10 0.00 0.00 66.02 65.89 1oru s SER 98 CO 0.24 -0.04 0.00 0.61 0.98 0.00 0.00 173.24 175.03 1oru n GLY 99 N 0.41 0.83 0.00 7.32 0.00 -1.26 -2.14 105.19 110.34 1oru n GLY 99 Ca -0.14 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1oru n GLY 99 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1oru n PRO 101 N -0.78 0.00 -1.34 1.61 -0.04 -1.26 -4.87 135.00 128.32 1oru n PRO 101 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1oru n PRO 101 Cb 0.27 0.00 0.11 0.00 -0.04 0.00 0.00 33.50 33.84 1oru n PRO 101 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1oru n ASP 102 N 0.00 2.47 -0.27 3.54 8.00 -1.26 -4.61 116.55 124.42 1oru n ASP 102 Ca 0.00 -3.39 0.08 0.00 0.71 0.00 0.00 54.79 52.19 1oru n ASP 102 Cb 0.00 -0.44 0.22 0.00 -0.02 0.00 0.00 41.12 40.88 1oru n ASP 102 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1oru h LEU 103 N 1.47 0.18 -2.31 0.64 5.85 -1.96 -1.08 115.31 118.10 1oru h LEU 103 Ca 0.05 0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.95 1oru h LEU 103 Cb 1.32 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.49 1oru h LEU 103 CO 0.24 0.02 0.18 0.74 -0.34 0.00 0.00 178.44 179.28 1oru h THR 104 N 0.36 0.36 -0.00 1.05 2.02 -1.84 -0.24 112.91 114.62 1oru h THR 104 Ca 0.46 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.64 1oru h THR 104 Cb 0.78 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1oru h THR 104 CO -0.48 0.00 -0.16 -1.20 0.37 0.00 0.00 175.52 174.05 1oru n SER 105 N -3.61 0.39 -4.68 4.18 7.64 -0.41 -4.56 113.62 112.57 1oru n SER 105 Ca 0.00 -0.31 -0.48 0.00 1.01 0.00 0.00 58.87 59.10 1oru n SER 105 Cb 0.29 -0.10 -0.05 0.00 -1.01 0.00 0.00 64.21 63.34 1oru n SER 105 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1oru n LEU 106 N -1.15 3.53 -4.77 -3.43 7.94 -0.10 -4.90 117.00 114.11 1oru n LEU 106 Ca 0.11 0.97 -0.35 0.00 -1.11 0.00 0.00 56.01 55.63 1oru n LEU 106 Cb 0.30 -1.39 0.00 0.00 0.53 0.00 0.00 43.42 42.87 1oru n LEU 106 CO 0.26 -0.02 0.78 -0.54 -1.11 0.00 0.00 177.39 176.76 1oru s LYS 107 N 4.11 3.34 0.37 1.96 1.02 -1.26 -4.69 119.74 124.58 1oru s LYS 107 Ca 0.92 1.60 -0.28 0.00 0.02 0.00 0.00 55.97 58.23 1oru s LYS 107 Cb -0.67 -2.00 -0.11 0.00 -0.52 0.00 0.00 37.83 34.53 1oru s LYS 107 CO 0.51 -0.86 1.41 0.39 -0.92 0.00 0.00 175.35 175.88 1oru n GLU 108 N -1.34 2.43 0.00 1.68 4.71 -1.26 -1.89 120.64 124.97 1oru n GLU 108 Ca 0.12 0.85 0.00 0.00 -0.01 0.00 0.00 57.16 58.12 1oru n GLU 108 Cb 0.51 -2.54 0.00 0.00 -1.01 0.00 0.00 31.44 28.40 1oru n GLU 108 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1oru n GLY 109 N 0.58 2.32 3.79 0.62 0.00 -0.93 -4.87 105.19 106.71 1oru n GLY 109 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1oru n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oru s SER 110 N -1.40 5.16 0.06 1.61 0.01 -0.79 -4.72 113.70 113.61 1oru s SER 110 Ca 0.00 1.84 0.07 0.00 1.31 0.00 0.00 55.95 59.17 1oru s SER 110 Cb 0.00 -2.53 -0.03 0.00 0.21 0.00 0.00 66.02 63.67 1oru s SER 110 CO 0.00 -1.60 -0.21 -0.13 0.41 0.00 0.00 173.24 171.72 1oru s ARG 111 N -4.48 1.32 -0.20 12.44 3.00 -0.27 -0.88 118.95 129.88 1oru s ARG 111 Ca 0.63 -0.98 0.01 0.00 0.00 0.00 0.00 55.73 55.39 1oru s ARG 111 Cb -0.17 -1.46 0.04 0.00 0.00 0.00 0.00 34.95 33.35 1oru s ARG 111 CO 0.47 0.37 -0.12 0.42 0.00 0.00 0.00 175.30 176.44 1oru s ILE 112 N -0.88 1.73 -0.09 1.52 1.01 -0.57 0.07 121.20 124.00 1oru s ILE 112 Ca 0.07 -1.03 0.02 0.00 0.00 0.00 0.00 60.65 59.71 1oru s ILE 112 Cb -0.09 -1.77 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 1oru s ILE 112 CO 0.02 0.21 -0.14 -0.63 0.00 0.00 0.00 174.94 174.40 1oru s ILE 113 N 1.36 2.99 0.37 2.92 1.01 -0.01 -0.74 121.20 129.10 1oru s ILE 113 Ca -0.01 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.96 1oru s ILE 113 Cb -0.16 -2.20 -0.01 0.00 0.01 0.00 0.00 42.46 40.10 1oru s ILE 113 CO -0.09 0.56 0.54 -0.36 0.00 0.00 0.00 174.94 175.59 1oru s PHE 114 N -0.21 3.22 0.51 3.97 0.08 0.04 -0.99 117.98 124.60 1oru s PHE 114 Ca 0.00 0.02 0.22 0.00 0.12 0.00 0.00 56.93 57.29 1oru s PHE 114 Cb -0.13 -2.06 1.31 0.00 -0.57 0.00 0.00 43.02 41.57 1oru s PHE 114 CO 0.03 -0.08 2.00 -1.35 -0.10 0.00 0.00 175.22 175.72 1oru h PRO 115 N 0.72 0.08 0.00 0.24 0.11 -1.88 -0.48 132.00 130.79 1oru h PRO 115 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1oru h PRO 115 Cb 1.25 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1oru h PRO 115 CO 0.56 0.05 0.00 0.66 -0.21 0.00 0.00 178.00 179.06 1oru h SER 116 N 0.08 0.00 0.00 -2.05 4.64 -1.95 -3.46 113.55 110.80 1oru h SER 116 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1oru h SER 116 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1oru h SER 116 CO -0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.55 1oru n GLY 117 N 0.51 1.72 3.67 -0.77 0.00 -0.19 -4.88 105.19 105.25 1oru n GLY 117 Ca 0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 1oru n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oru n ALA 118 N -0.98 0.89 -2.80 4.61 0.00 -1.26 -4.69 120.51 116.28 1oru n ALA 118 Ca 0.00 0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.68 1oru n ALA 118 Cb 0.00 -2.21 -0.14 0.00 0.00 0.00 0.00 19.45 17.10 1oru n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oru s ALA 119 N -0.71 0.30 -0.08 0.00 0.00 -0.35 -0.78 121.76 120.13 1oru s ALA 119 Ca 0.61 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.42 1oru s ALA 119 Cb -0.63 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 22.39 1oru s ALA 119 CO 0.57 0.07 -0.10 -0.51 0.00 0.00 0.00 175.76 175.80 1oru s LEU 120 N -0.08 2.97 -0.26 0.00 1.43 0.08 -0.50 118.68 122.32 1oru s LEU 120 Ca 0.01 -0.14 -0.10 0.00 -1.03 0.00 0.00 54.13 52.87 1oru s LEU 120 Cb -0.01 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.51 1oru s LEU 120 CO -0.00 0.30 0.17 -0.22 0.23 0.00 0.00 176.35 176.83 1oru s LEU 121 N -0.45 4.03 -0.00 1.79 2.96 0.16 -1.52 118.68 125.65 1oru s LEU 121 Ca 0.06 0.04 -0.30 0.00 -0.22 0.00 0.00 54.13 53.71 1oru s LEU 121 Cb -0.12 -2.10 -0.06 0.00 0.50 0.00 0.00 46.19 44.41 1oru s LEU 121 CO 0.02 0.01 1.46 0.00 -1.32 0.00 0.00 176.35 176.52 1oru n GLU 123 N 5.64 2.45 0.00 0.00 -0.58 0.41 -2.19 120.64 126.37 1oru n GLU 123 Ca 0.14 -3.04 0.00 0.00 -0.42 0.00 0.00 57.16 53.84 1oru n GLU 123 Cb 0.43 -1.91 0.00 0.00 -0.57 0.00 0.00 31.44 29.39 1oru n GLU 123 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1oru n GLY 124 N -0.82 -2.65 3.77 0.62 0.00 -1.24 -4.74 105.19 100.13 1oru n GLY 124 Ca 0.33 -1.74 -0.40 0.00 0.00 0.00 0.00 46.02 44.21 1oru n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oru s GLU 125 N -0.60 3.78 -0.42 1.61 2.02 -1.26 -1.64 118.70 122.19 1oru s GLU 125 Ca 0.00 2.39 -0.16 0.00 0.02 0.00 0.00 54.97 57.21 1oru s GLU 125 Cb 0.00 -2.71 0.02 0.00 0.10 0.00 0.00 34.13 31.54 1oru s GLU 125 CO 0.00 -0.73 0.39 1.21 0.02 0.00 0.00 175.26 176.15 1oru s ASN 126 N -0.51 6.16 0.07 -0.19 2.47 -0.24 -4.72 114.94 117.98 1oru s ASN 126 Ca 0.59 -0.80 -0.31 0.00 0.42 0.00 0.00 52.86 52.77 1oru s ASN 126 Cb -0.43 -2.20 -0.07 0.00 -1.45 0.00 0.00 41.25 37.10 1oru s ASN 126 CO 0.56 -0.54 1.40 -1.81 -3.72 0.00 0.00 177.10 172.99 1oru s ASP 127 N 1.81 6.83 0.14 -4.21 1.01 -1.26 -4.61 116.67 116.38 1oru s ASP 127 Ca 0.09 2.25 -0.31 0.00 0.71 0.00 0.00 52.55 55.29 1oru s ASP 127 Cb -0.18 -2.58 -0.08 0.00 1.01 0.00 0.00 42.92 41.09 1oru s ASP 127 CO 0.12 -0.68 1.33 -2.16 0.21 0.00 0.00 175.17 173.98 1oru s PRO 128 N 1.66 4.37 0.50 8.23 0.04 -1.26 -5.04 135.00 143.50 1oru s PRO 128 Ca 0.65 2.02 0.04 0.00 0.04 0.00 0.00 61.00 63.74 1oru s PRO 128 Cb -0.35 -3.24 -0.00 0.00 0.04 0.00 0.00 34.50 30.95 1oru s PRO 128 CO 0.29 -0.33 0.16 0.00 0.04 0.00 0.00 177.00 177.16 1oru h ILE 130 N 1.18 1.33 -0.25 0.00 6.09 -1.96 -3.37 117.51 120.54 1oru h ILE 130 Ca -0.41 -1.66 0.05 0.00 -1.37 0.00 0.00 64.86 61.47 1oru h ILE 130 Cb 1.30 1.75 -0.07 0.00 0.47 0.00 0.00 36.82 40.26 1oru h ILE 130 CO 0.68 0.50 -0.48 1.56 -3.07 0.00 0.00 178.15 177.34 1oru h GLN 131 N 0.24 -0.45 -0.34 2.19 7.50 -1.97 -0.13 115.11 122.16 1oru h GLN 131 Ca 0.02 0.03 0.03 0.00 0.50 0.00 0.00 58.65 59.23 1oru h GLN 131 Cb 0.91 0.10 -0.02 0.00 0.05 0.00 0.00 27.48 28.53 1oru h GLN 131 CO 0.08 -0.30 0.23 -1.35 -1.50 0.00 0.00 178.83 175.98 1oru h PRO 132 N -0.46 0.30 -0.70 1.46 0.11 -1.85 -0.63 132.00 130.23 1oru h PRO 132 Ca 0.08 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.13 1oru h PRO 132 Cb 0.63 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.64 1oru h PRO 132 CO -0.49 0.20 0.26 0.78 -0.21 0.00 0.00 178.00 178.54 1oru h GLY 133 N 0.31 1.12 2.00 -0.55 0.00 -1.24 -0.18 103.07 104.53 1oru h GLY 133 Ca 0.14 -0.61 -0.10 0.00 0.00 0.00 0.00 47.33 46.77 1oru h GLY 133 CO -0.03 0.57 -0.46 0.83 0.00 0.00 0.00 176.54 177.46 1oru h GLU 134 N 1.02 0.00 -0.12 4.80 5.08 0.33 -0.83 114.58 124.87 1oru h GLU 134 Ca 0.23 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.54 1oru h GLU 134 Cb 0.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1oru h GLU 134 CO -0.02 0.46 -0.12 0.28 -1.00 0.00 0.00 179.01 178.61 1oru h VAL 135 N 0.00 1.36 -0.88 3.13 2.07 -0.58 -2.46 116.25 118.90 1oru h VAL 135 Ca -0.00 -1.29 0.01 0.00 0.82 0.00 0.00 66.70 66.23 1oru h VAL 135 Cb 0.86 1.95 -0.04 0.00 -1.52 0.00 0.00 31.29 32.54 1oru h VAL 135 CO 0.06 0.37 0.58 0.40 0.02 0.00 0.00 177.57 179.00 1oru h ILE 136 N -0.11 1.22 -0.87 4.57 2.04 -0.81 -1.81 117.51 121.74 1oru h ILE 136 Ca 0.02 -0.41 0.03 0.00 1.00 0.00 0.00 64.86 65.50 1oru h ILE 136 Cb 0.65 -0.07 -0.05 0.00 -0.74 0.00 0.00 36.82 36.61 1oru h ILE 136 CO 0.03 0.22 0.57 -0.61 0.00 0.00 0.00 178.15 178.35 1oru h GLN 137 N 1.19 1.07 0.00 2.37 5.75 -1.02 -1.85 115.11 122.62 1oru h GLN 137 Ca 0.32 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.75 1oru h GLN 137 Cb -0.13 -0.24 -0.00 0.00 1.07 0.00 0.00 27.48 28.17 1oru h GLN 137 CO -0.07 0.71 -0.03 0.66 -2.65 0.00 0.00 178.83 177.45 1oru h SER 138 N 1.10 0.00 0.74 -0.69 4.64 -0.84 -0.90 113.55 117.60 1oru h SER 138 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 1oru h SER 138 Cb -0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1oru h SER 138 CO -0.11 0.03 -0.59 -1.22 -0.87 0.00 0.00 176.83 174.06 1oru n TYR 139 N -3.28 0.37 -3.00 4.77 4.01 -0.71 -4.20 117.16 115.11 1oru n TYR 139 Ca -0.02 0.11 -0.16 0.00 -0.16 0.00 0.00 57.90 57.67 1oru n TYR 139 Cb 0.16 -0.53 -0.01 0.00 -0.31 0.00 0.00 39.34 38.65 1oru n TYR 139 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1oru n TYR 140 N -1.91 0.72 0.31 -0.72 4.01 -0.45 -4.96 117.16 114.15 1oru n TYR 140 Ca 0.04 -3.49 0.18 0.00 -0.16 0.00 0.00 57.90 54.47 1oru n TYR 140 Cb 0.41 -0.40 0.97 0.00 -0.31 0.00 0.00 39.34 40.01 1oru n TYR 140 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1oru h PRO 141 N 2.99 0.00 -0.15 -0.72 0.13 -1.44 -1.35 132.00 131.47 1oru h PRO 141 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1oru h PRO 141 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1oru h PRO 141 CO 0.52 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.89 1oru n ASP 142 N -2.86 1.32 -4.23 1.44 5.75 -1.26 -4.75 116.55 111.96 1oru n ASP 142 Ca -0.02 -1.69 -0.33 0.00 -0.01 0.00 0.00 54.79 52.73 1oru n ASP 142 Cb 0.17 -0.09 -0.15 0.00 -1.03 0.00 0.00 41.12 40.02 1oru n ASP 142 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1oru s GLN 143 N -1.81 3.18 0.53 0.11 -0.21 -0.51 -5.12 119.66 115.83 1oru s GLN 143 Ca 0.30 -0.75 -0.20 0.00 0.02 0.00 0.00 55.36 54.72 1oru s GLN 143 Cb 0.16 -2.66 -0.06 0.00 1.00 0.00 0.00 33.01 31.45 1oru s GLN 143 CO 0.24 -0.07 1.16 -1.25 -2.12 0.00 0.00 175.29 173.25 1oru s PRO 144 N 1.02 3.37 -1.69 2.91 0.04 -1.26 -4.27 135.00 135.12 1oru s PRO 144 Ca -0.01 1.71 -0.12 0.00 0.04 0.00 0.00 61.00 62.61 1oru s PRO 144 Cb -0.15 -2.09 0.12 0.00 0.04 0.00 0.00 34.50 32.42 1oru s PRO 144 CO -0.04 -0.85 0.37 1.63 0.04 0.00 0.00 177.00 178.15 1oru n LYS 145 N -1.16 -1.32 0.11 4.56 5.02 -1.26 -4.87 118.16 119.25 1oru n LYS 145 Ca 0.11 0.17 -0.03 0.00 -2.02 0.00 0.00 58.31 56.54 1oru n LYS 145 Cb 0.50 -4.30 0.08 0.00 -0.02 0.00 0.00 35.03 31.29 1oru n LYS 145 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1oru h LEU 146 N -1.39 0.00 0.05 -0.35 3.38 -1.91 -2.56 115.31 112.53 1oru h LEU 146 Ca -0.63 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.34 1oru h LEU 146 Cb 1.39 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.14 1oru h LEU 146 CO 0.79 0.73 -0.03 0.00 0.09 0.00 0.00 178.44 180.02 1oru h ALA 147 N 1.27 -0.08 0.00 1.53 0.00 -1.90 0.10 119.26 120.19 1oru h ALA 147 Ca -0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1oru h ALA 147 Cb 1.30 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 1oru h ALA 147 CO 0.09 -0.55 -0.46 0.66 0.00 0.00 0.00 179.25 179.00 1oru h SER 148 N -0.08 0.00 -0.49 0.00 4.64 -1.90 -2.67 113.55 113.04 1oru h SER 148 Ca -0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.25 1oru h SER 148 Cb 0.07 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 1oru h SER 148 CO 0.01 0.46 0.09 0.00 -0.87 0.00 0.00 176.83 176.52 1oru h ALA 149 N 1.54 1.13 0.08 5.18 0.00 -0.94 -2.20 119.26 124.04 1oru h ALA 149 Ca -0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1oru h ALA 149 Cb 0.82 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1oru h ALA 149 CO 0.06 0.57 -0.04 0.35 0.00 0.00 0.00 179.25 180.20 1oru h PHE 150 N 0.83 -0.09 -0.91 0.00 3.57 -0.48 -0.02 116.94 119.83 1oru h PHE 150 Ca 0.17 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.80 1oru h PHE 150 Cb 0.36 0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.06 1oru h PHE 150 CO 0.02 0.14 0.58 0.28 -2.23 0.00 0.00 178.31 177.11 1oru h VAL 151 N -0.33 0.86 0.07 1.41 2.07 -1.33 0.24 116.25 119.25 1oru h VAL 151 Ca -0.01 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 1oru h VAL 151 Cb 0.28 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1oru h VAL 151 CO 0.02 0.14 -0.03 -0.09 0.02 0.00 0.00 177.57 177.62 1oru h ARG 152 N 0.76 -0.08 0.00 1.57 2.43 -1.23 -3.33 114.38 114.51 1oru h ARG 152 Ca 0.45 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.63 1oru h ARG 152 Cb 0.64 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1oru h ARG 152 CO -0.21 0.50 -0.11 0.45 -1.51 0.00 0.00 179.97 179.09 1oru h HIS 153 N -0.84 0.00 0.00 2.20 3.86 -0.76 -3.29 115.15 116.32 1oru h HIS 153 Ca -0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1oru h HIS 153 Cb 0.62 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.09 1oru h HIS 153 CO 0.14 0.00 -0.53 0.00 0.86 0.00 0.00 177.93 178.40 1oru h ALA 154 N 2.48 0.70 -2.22 2.45 0.00 -0.68 -3.45 119.26 118.54 1oru h ALA 154 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.32 1oru h ALA 154 Cb 0.76 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.59 1oru h ALA 154 CO 0.00 0.00 0.95 -0.11 0.00 0.00 0.00 179.25 180.09 1oru n LEU 155 N -2.50 3.35 0.00 0.00 7.94 -1.24 -1.05 117.00 123.50 1oru n LEU 155 Ca 0.03 1.03 0.00 0.00 -1.11 0.00 0.00 56.01 55.96 1oru n LEU 155 Cb 0.49 -1.42 0.00 0.00 0.53 0.00 0.00 43.42 43.02 1oru n LEU 155 CO 0.36 -0.14 0.00 0.61 -1.11 0.00 0.00 177.39 177.11 1oru n GLY 156 N 3.88 1.46 1.39 -3.96 0.00 -1.26 -4.81 105.19 101.88 1oru n GLY 156 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.23 1oru n GLY 156 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1oru n ILE 157 N -2.00 0.00 0.18 -0.61 -5.35 -0.22 -4.71 119.36 106.65 1oru n ILE 157 Ca 0.00 -0.80 0.12 0.00 -0.27 0.00 0.00 62.75 61.80 1oru n ILE 157 Cb 0.00 0.90 0.23 0.00 -1.74 0.00 0.00 39.64 39.03 1oru n ILE 157 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 1oru n ARG 158 N 0.40 2.54 0.00 6.28 0.63 -0.84 -4.63 116.66 121.03 1oru n ARG 158 Ca -0.00 -2.35 0.00 0.00 -0.92 0.00 0.00 57.85 54.57 1oru n ARG 158 Cb 1.06 -1.52 0.00 0.00 0.45 0.00 0.00 32.46 32.45 1oru n ARG 158 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1oru n GLY 159 N 1.51 -1.94 3.40 5.14 0.00 -1.26 -4.78 105.19 107.25 1oru n GLY 159 Ca 0.20 -1.94 -0.20 0.00 0.00 0.00 0.00 46.02 44.08 1oru n GLY 159 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1oru s ILE 160 N -0.08 0.86 0.12 -0.61 -4.36 -0.54 -1.08 121.20 115.50 1oru s ILE 160 Ca 0.00 -2.00 0.10 0.00 -0.26 0.00 0.00 60.65 58.49 1oru s ILE 160 Cb 0.00 -2.69 -0.04 0.00 1.25 0.00 0.00 42.46 40.98 1oru s ILE 160 CO 0.00 0.00 -0.24 0.68 0.24 0.00 0.00 174.94 175.62 1oru s VAL 161 N -3.49 2.02 0.12 8.37 -7.23 -0.65 -0.99 120.40 118.54 1oru s VAL 161 Ca 0.36 -1.69 -0.01 0.00 -1.81 0.00 0.00 61.98 58.83 1oru s VAL 161 Cb 0.08 -1.82 -0.04 0.00 0.56 0.00 0.00 36.38 35.16 1oru s VAL 161 CO 0.15 0.00 0.03 0.00 -0.31 0.00 0.00 175.10 174.97 1oru s ILE 163 N -3.97 3.86 -0.33 0.00 1.01 -0.56 -1.10 121.20 120.11 1oru s ILE 163 Ca 0.20 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.58 1oru s ILE 163 Cb 0.07 -2.81 0.02 0.00 0.01 0.00 0.00 42.46 39.75 1oru s ILE 163 CO -0.01 0.17 1.07 -0.69 0.00 0.00 0.00 174.94 175.48 1oru s VAL 164 N -1.24 4.49 -0.04 2.92 1.01 -1.26 -0.66 120.40 125.62 1oru s VAL 164 Ca 0.23 1.67 0.12 0.00 0.00 0.00 0.00 61.98 64.00 1oru s VAL 164 Cb -0.11 -4.42 -0.23 0.00 0.00 0.00 0.00 36.38 31.61 1oru s VAL 164 CO 0.15 -0.52 0.68 -0.08 0.00 0.00 0.00 175.10 175.34 1oru h GLU 165 N 8.19 0.01 -3.04 2.72 4.81 -1.12 -3.44 114.58 122.71 1oru h GLU 165 Ca -0.21 -0.02 -0.21 0.00 -0.13 0.00 0.00 59.36 58.79 1oru h GLU 165 Cb 1.06 0.01 -0.31 0.00 0.63 0.00 0.00 28.75 30.14 1oru h GLU 165 CO 1.04 0.54 -0.52 0.50 -0.73 0.00 0.00 179.01 179.83 1oru s ARG 166 N -2.60 0.17 0.76 1.92 3.52 -0.94 -4.93 118.95 116.84 1oru s ARG 166 Ca -0.05 0.54 -0.13 0.00 -0.13 0.00 0.00 55.73 55.97 1oru s ARG 166 Cb 0.08 -0.13 0.05 0.00 -1.56 0.00 0.00 34.95 33.40 1oru s ARG 166 CO 0.82 -0.19 1.15 -2.14 -0.81 0.00 0.00 175.30 174.13 1oru s PRO 167 N 1.51 2.12 0.00 5.12 0.02 -1.26 -1.21 135.00 141.30 1oru s PRO 167 Ca -0.07 1.50 0.00 0.00 0.02 0.00 0.00 61.00 62.45 1oru s PRO 167 Cb -0.11 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1oru s PRO 167 CO -0.08 -1.80 0.00 0.41 -0.33 0.00 0.00 177.00 175.20 1oru n GLY 168 N -0.21 2.84 3.85 0.52 0.00 -0.27 -4.01 105.19 107.91 1oru n GLY 168 Ca 0.11 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 1oru n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oru s ALA 169 N -2.00 3.51 0.04 4.61 0.00 -1.26 -1.11 121.76 125.54 1oru s ALA 169 Ca 0.00 -0.10 0.06 0.00 0.00 0.00 0.00 51.96 51.92 1oru s ALA 169 Cb 0.00 -2.58 -0.02 0.00 0.00 0.00 0.00 23.12 20.52 1oru s ALA 169 CO 0.00 0.43 -0.18 0.14 0.00 0.00 0.00 175.76 176.15 1oru s VAL 170 N -1.66 1.47 0.10 0.00 -7.23 -0.15 -4.45 120.40 108.49 1oru s VAL 170 Ca 0.44 -1.08 0.07 0.00 -1.81 0.00 0.00 61.98 59.60 1oru s VAL 170 Cb -0.13 -1.28 -0.03 0.00 0.56 0.00 0.00 36.38 35.49 1oru s VAL 170 CO 0.20 0.17 -0.18 -0.31 -0.31 0.00 0.00 175.10 174.67 1oru s TYR 171 N -0.76 1.61 0.19 2.82 2.02 -1.26 -1.44 117.35 120.52 1oru s TYR 171 Ca 0.06 -0.45 -0.33 0.00 -0.37 0.00 0.00 57.07 55.98 1oru s TYR 171 Cb -0.08 -0.87 -0.14 0.00 -0.40 0.00 0.00 41.96 40.47 1oru s TYR 171 CO 0.01 0.18 1.48 2.41 -1.57 0.00 0.00 175.55 178.06 1oru n THR 172 N 0.98 0.43 -0.68 -0.71 -1.04 -0.85 -1.68 114.28 110.74 1oru n THR 172 Ca -0.19 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 61.71 1oru n THR 172 Cb 0.54 -1.45 0.00 0.00 -1.82 0.00 0.00 70.33 67.61 1oru n THR 172 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1oru n GLY 173 N 2.77 1.05 3.66 3.41 0.00 0.41 -5.01 105.19 111.47 1oru n GLY 173 Ca 0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.72 1oru n GLY 173 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oru n ASP 174 N 0.00 2.41 -4.73 1.61 8.00 -0.67 -4.62 116.55 118.55 1oru n ASP 174 Ca 0.00 1.17 -0.40 0.00 0.71 0.00 0.00 54.79 56.27 1oru n ASP 174 Cb 0.00 -1.41 -0.04 0.00 -0.02 0.00 0.00 41.12 39.65 1oru n ASP 174 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1oru s GLU 175 N -1.05 4.50 0.16 -1.24 2.12 -1.26 -0.70 118.70 121.22 1oru s GLU 175 Ca 0.63 1.10 0.08 0.00 0.36 0.00 0.00 54.97 57.14 1oru s GLU 175 Cb -0.65 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.29 1oru s GLU 175 CO 0.55 0.14 -0.10 0.96 -0.54 0.00 0.00 175.26 176.28 1oru s ILE 176 N 0.43 3.25 -0.27 -3.70 -4.36 0.69 -4.19 121.20 113.04 1oru s ILE 176 Ca 0.41 -1.53 -0.07 0.00 -0.26 0.00 0.00 60.65 59.21 1oru s ILE 176 Cb -0.20 -2.58 -0.00 0.00 1.25 0.00 0.00 42.46 40.93 1oru s ILE 176 CO 0.23 -0.04 0.06 -0.70 0.24 0.00 0.00 174.94 174.73 1oru s GLU 177 N -2.63 3.27 -0.22 0.37 2.56 -0.16 -0.96 118.70 120.93 1oru s GLU 177 Ca 0.24 -0.73 -0.09 0.00 0.00 0.00 0.00 54.97 54.38 1oru s GLU 177 Cb -0.10 -3.31 -0.04 0.00 2.00 0.00 0.00 34.13 32.68 1oru s GLU 177 CO 0.15 -0.35 0.12 0.08 -0.56 0.00 0.00 175.26 174.70 1oru s VAL 178 N 1.53 5.07 -0.54 3.70 1.01 -1.26 -0.83 120.40 129.07 1oru s VAL 178 Ca 0.04 0.08 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 1oru s VAL 178 Cb -0.16 -3.35 0.14 0.00 0.00 0.00 0.00 36.38 33.01 1oru s VAL 178 CO 0.02 0.38 0.41 -1.00 0.00 0.00 0.00 175.10 174.91 1oru s HIS 179 N 0.93 3.48 -0.27 5.22 3.76 0.11 -4.19 115.29 124.33 1oru s HIS 179 Ca 0.06 -2.08 -0.28 0.00 -0.15 0.00 0.00 55.06 52.62 1oru s HIS 179 Cb -0.13 -3.47 0.01 0.00 1.11 0.00 0.00 32.58 30.09 1oru s HIS 179 CO 0.03 -0.96 1.00 0.45 -0.85 0.00 0.00 174.74 174.40 1oru s SER 180 N 2.20 6.97 0.30 1.40 0.15 -0.04 -1.11 113.70 123.57 1oru s SER 180 Ca 0.10 1.16 -0.29 0.00 0.70 0.00 0.00 55.95 57.62 1oru s SER 180 Cb -0.23 -2.51 -0.10 0.00 -1.71 0.00 0.00 66.02 61.47 1oru s SER 180 CO -0.02 -0.71 1.24 -0.47 1.20 0.00 0.00 173.24 174.48 1oru s TYR 181 N 3.26 3.23 0.00 3.44 5.04 -1.26 -1.74 117.35 129.32 1oru s TYR 181 Ca 0.42 1.49 0.00 0.00 -2.44 0.00 0.00 57.07 56.54 1oru s TYR 181 Cb -0.14 -3.55 0.00 0.00 0.35 0.00 0.00 41.96 38.62 1oru s TYR 181 CO 0.10 -1.45 0.48 1.04 -1.34 0.00 0.00 175.55 174.37