#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o8b h GLN 3 N 0.00 1.05 -0.23 -0.78 4.15 -2.02 -1.11 115.11 116.17 1o8b h GLN 3 Ca 0.00 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.30 1o8b h GLN 3 Cb 0.00 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 27.44 1o8b h GLN 3 CO 0.00 0.70 -0.12 0.22 -1.93 0.00 0.00 178.83 177.69 1o8b h ASP 4 N 1.08 0.36 0.58 -0.69 3.58 -2.01 -1.16 116.42 118.17 1o8b h ASP 4 Ca 0.40 -0.08 -0.13 0.00 0.42 0.00 0.00 57.03 57.64 1o8b h ASP 4 Cb 0.17 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 1o8b h ASP 4 CO -0.15 0.52 -0.60 -0.33 -2.88 0.00 0.00 179.24 175.80 1o8b h GLU 5 N 0.36 0.02 -0.59 0.28 5.08 -1.67 0.02 114.58 118.07 1o8b h GLU 5 Ca 0.07 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1o8b h GLU 5 Cb 0.44 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1o8b h GLU 5 CO 0.02 0.61 0.10 -0.07 -1.00 0.00 0.00 179.01 178.68 1o8b h LEU 6 N 0.01 0.94 -0.63 1.33 3.38 -0.86 -0.97 115.31 118.50 1o8b h LEU 6 Ca -0.01 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 1o8b h LEU 6 Cb 1.07 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1o8b h LEU 6 CO 0.08 0.95 0.26 0.11 0.09 0.00 0.00 178.44 179.94 1o8b h LYS 7 N 0.88 0.93 -0.65 1.13 1.57 -0.86 -2.52 116.57 117.05 1o8b h LYS 7 Ca 0.18 -0.16 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1o8b h LYS 7 Cb 0.41 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 1o8b h LYS 7 CO 0.01 0.78 0.35 -0.22 -0.57 0.00 0.00 179.45 179.79 1o8b h LYS 8 N 0.88 0.91 -0.60 3.15 3.64 -0.83 -0.57 116.57 123.15 1o8b h LYS 8 Ca 0.21 -0.11 0.05 0.00 -1.27 0.00 0.00 60.65 59.52 1o8b h LYS 8 Cb 0.19 -0.18 -0.05 0.00 -0.41 0.00 0.00 32.23 31.78 1o8b h LYS 8 CO -0.02 0.70 0.34 0.00 -2.27 0.00 0.00 179.45 178.19 1o8b h ALA 9 N 1.16 0.79 0.04 5.00 0.00 -0.96 -1.33 119.26 123.97 1o8b h ALA 9 Ca 0.23 0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.92 1o8b h ALA 9 Cb 0.06 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1o8b h ALA 9 CO -0.03 0.02 -1.02 -0.39 0.00 0.00 0.00 179.25 177.83 1o8b h VAL 10 N 0.64 1.47 -0.80 0.00 -1.51 -1.21 -0.47 116.25 114.37 1o8b h VAL 10 Ca 0.26 -2.72 -0.01 0.00 -1.23 0.00 0.00 66.70 63.00 1o8b h VAL 10 Cb 0.13 2.61 -0.04 0.00 -2.13 0.00 0.00 31.29 31.86 1o8b h VAL 10 CO -0.15 0.80 0.45 1.23 -1.23 0.00 0.00 177.57 178.66 1o8b h GLY 11 N 1.57 1.18 1.65 5.19 0.00 -0.83 -2.15 103.07 109.67 1o8b h GLY 11 Ca -0.08 -0.52 -0.22 0.00 0.00 0.00 0.00 47.33 46.50 1o8b h GLY 11 CO 0.17 0.50 -0.96 1.49 0.00 0.00 0.00 176.54 177.73 1o8b h TRP 12 N 1.10 0.47 0.00 5.60 4.06 -1.21 -3.17 115.95 122.80 1o8b h TRP 12 Ca 0.28 -0.27 -0.01 0.00 2.06 0.00 0.00 58.89 60.95 1o8b h TRP 12 Cb 0.01 -0.05 -0.00 0.00 -1.00 0.00 0.00 29.16 28.12 1o8b h TRP 12 CO -0.00 1.10 -0.04 0.00 -3.56 0.00 0.00 178.44 175.94 1o8b h ALA 13 N 0.81 1.70 0.00 1.49 0.00 -0.78 -1.81 119.26 120.67 1o8b h ALA 13 Ca -0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1o8b h ALA 13 Cb 1.61 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1o8b h ALA 13 CO 0.16 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.46 1o8b h ALA 14 N 1.96 1.00 0.00 0.00 0.00 -1.36 -2.44 119.26 118.42 1o8b h ALA 14 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1o8b h ALA 14 Cb 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1o8b h ALA 14 CO 0.01 0.00 -0.04 -0.07 0.00 0.00 0.00 179.25 179.14 1o8b h LEU 15 N 0.00 0.00 -1.99 0.00 3.38 -1.48 -0.38 115.31 114.83 1o8b h LEU 15 Ca 0.00 0.00 0.26 0.00 0.09 0.00 0.00 57.88 58.23 1o8b h LEU 15 Cb 0.24 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1o8b h LEU 15 CO 0.00 0.04 0.65 -0.61 0.09 0.00 0.00 178.44 178.62 1o8b h GLN 16 N 0.00 0.00 -5.95 1.13 4.15 -1.63 -3.53 115.11 109.28 1o8b h GLN 16 Ca -0.00 0.00 -0.57 0.00 0.77 0.00 0.00 58.65 58.85 1o8b h GLN 16 Cb 0.09 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.72 1o8b h GLN 16 CO 0.01 0.00 -0.00 0.71 -1.93 0.00 0.00 178.83 177.62 1o8b s TYR 17 N -4.94 3.58 0.00 3.99 1.51 -0.16 -5.22 117.35 116.10 1o8b s TYR 17 Ca -0.05 1.13 0.00 0.00 -1.01 0.00 0.00 57.07 57.14 1o8b s TYR 17 Cb 0.21 -2.69 0.00 0.00 -0.11 0.00 0.00 41.96 39.37 1o8b s TYR 17 CO 0.76 0.16 0.00 0.25 -1.11 0.00 0.00 175.55 175.61 1o8b n THR 22 N 3.56 0.00 -3.75 -0.71 -2.24 -1.26 -5.01 114.28 104.86 1o8b n THR 22 Ca -0.04 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.37 1o8b n THR 22 Cb 0.51 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.62 1o8b n THR 22 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1o8b s ILE 23 N -1.47 4.21 -0.13 2.28 1.01 -1.26 -1.10 121.20 124.75 1o8b s ILE 23 Ca 0.00 -0.33 -0.15 0.00 0.00 0.00 0.00 60.65 60.17 1o8b s ILE 23 Cb 0.00 -3.03 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 1o8b s ILE 23 CO 0.00 0.26 0.35 -0.69 0.00 0.00 0.00 174.94 174.86 1o8b s VAL 24 N 1.58 5.25 -0.03 2.92 1.01 -0.54 -4.40 120.40 126.19 1o8b s VAL 24 Ca 0.05 0.68 -0.30 0.00 0.00 0.00 0.00 61.98 62.42 1o8b s VAL 24 Cb -0.16 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1o8b s VAL 24 CO 0.03 0.40 1.21 -0.83 0.00 0.00 0.00 175.10 175.92 1o8b s GLY 25 N 0.26 2.15 -0.11 4.51 0.00 0.26 -1.39 107.32 113.00 1o8b s GLY 25 Ca 0.20 0.68 0.03 0.00 0.00 0.00 0.00 44.72 45.62 1o8b s GLY 25 CO 0.07 2.20 -0.21 0.14 0.00 0.00 0.00 173.10 175.30 1o8b s VAL 26 N 2.02 1.86 0.00 1.40 1.01 0.35 -1.33 120.40 125.71 1o8b s VAL 26 Ca 0.57 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.67 1o8b s VAL 26 Cb -0.26 -1.64 0.00 0.00 0.00 0.00 0.00 36.38 34.48 1o8b s VAL 26 CO 0.24 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.46 1o8b n GLY 27 N 3.84 0.17 3.13 4.51 0.00 0.72 -1.64 105.19 115.93 1o8b n GLY 27 Ca -0.20 -1.70 -0.09 0.00 0.00 0.00 0.00 46.02 44.03 1o8b n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1o8b s THR 28 N 0.55 0.15 0.00 2.61 2.01 -1.26 -4.52 115.64 115.18 1o8b s THR 28 Ca 0.00 -1.24 0.00 0.00 0.31 0.00 0.00 61.69 60.76 1o8b s THR 28 Cb 0.00 -1.10 0.00 0.00 0.01 0.00 0.00 72.50 71.41 1o8b s THR 28 CO 0.00 -0.68 0.00 0.61 -0.69 0.00 0.00 174.62 173.86 1o8b n GLY 29 N 0.47 0.87 0.22 4.40 0.00 -1.26 -4.33 105.19 105.57 1o8b n GLY 29 Ca -0.17 -2.21 0.09 0.00 0.00 0.00 0.00 46.02 43.72 1o8b n GLY 29 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1o8b h SER 30 N 0.00 0.00 0.10 1.61 4.64 -2.00 -0.84 113.55 117.06 1o8b h SER 30 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1o8b h SER 30 Cb 0.00 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.11 1o8b h SER 30 CO 0.00 0.25 -0.63 0.74 -0.87 0.00 0.00 176.83 176.32 1o8b h THR 31 N 0.00 1.57 -0.18 2.95 2.02 -1.91 -3.26 112.91 114.09 1o8b h THR 31 Ca -0.00 -2.49 0.05 0.00 0.77 0.00 0.00 66.41 64.74 1o8b h THR 31 Cb 0.64 3.24 -0.01 0.00 -1.74 0.00 0.00 68.15 70.27 1o8b h THR 31 CO 0.03 0.69 0.13 0.00 0.37 0.00 0.00 175.52 176.74 1o8b h ALA 32 N 0.05 2.15 -0.78 6.16 0.00 -1.73 -1.34 119.26 123.78 1o8b h ALA 32 Ca -0.11 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1o8b h ALA 32 Cb 1.48 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.24 1o8b h ALA 32 CO 0.11 -0.20 0.52 0.00 0.00 0.00 0.00 179.25 179.68 1o8b h ALA 33 N 1.91 1.46 -0.48 0.00 0.00 -1.19 -0.81 119.26 120.15 1o8b h ALA 33 Ca 0.09 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1o8b h ALA 33 Cb 0.32 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1o8b h ALA 33 CO -0.00 0.50 -0.16 0.45 0.00 0.00 0.00 179.25 180.04 1o8b h HIS 34 N 1.04 1.03 -0.80 0.00 3.86 -1.34 -2.24 115.15 116.71 1o8b h HIS 34 Ca 0.29 -0.22 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 1o8b h HIS 34 Cb -0.10 -0.25 -0.04 0.00 1.06 0.00 0.00 27.41 28.08 1o8b h HIS 34 CO -0.00 1.00 0.47 0.35 0.86 0.00 0.00 177.93 180.62 1o8b h PHE 35 N 0.81 1.05 -0.68 2.45 3.57 -1.14 -1.61 116.94 121.39 1o8b h PHE 35 Ca 0.12 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 1o8b h PHE 35 Cb 0.70 -0.34 -0.03 0.00 2.79 0.00 0.00 35.95 39.07 1o8b h PHE 35 CO 0.04 0.70 0.23 0.82 -2.23 0.00 0.00 178.31 177.87 1o8b h ILE 36 N 1.10 1.25 -0.43 1.41 2.04 -0.90 0.20 117.51 122.17 1o8b h ILE 36 Ca 0.29 -0.85 0.05 0.00 1.00 0.00 0.00 64.86 65.35 1o8b h ILE 36 Cb -0.04 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 36.52 1o8b h ILE 36 CO -0.05 0.33 0.16 0.44 0.00 0.00 0.00 178.15 179.03 1o8b h ASP 37 N 0.98 0.19 -0.26 1.72 3.32 -0.86 -0.59 116.42 120.91 1o8b h ASP 37 Ca 0.22 0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.33 1o8b h ASP 37 Cb 0.28 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 1o8b h ASP 37 CO -0.01 0.14 0.12 0.00 -1.72 0.00 0.00 179.24 177.77 1o8b h ALA 38 N 1.28 0.31 -0.56 3.45 0.00 -0.80 -2.18 119.26 120.76 1o8b h ALA 38 Ca 0.20 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1o8b h ALA 38 Cb 0.18 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1o8b h ALA 38 CO -0.19 -0.27 0.37 1.25 0.00 0.00 0.00 179.25 180.40 1o8b h LEU 39 N 0.26 0.52 -1.86 0.00 5.85 -0.02 -1.17 115.31 118.89 1o8b h LEU 39 Ca 0.11 -0.00 0.19 0.00 0.84 0.00 0.00 57.88 59.02 1o8b h LEU 39 Cb 0.04 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 1o8b h LEU 39 CO -0.08 0.35 0.51 1.23 -0.34 0.00 0.00 178.44 180.11 1o8b h GLY 40 N 0.60 0.25 -3.68 3.75 0.00 -0.45 -3.14 103.07 100.40 1o8b h GLY 40 Ca 0.23 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1o8b h GLY 40 CO -0.06 0.01 0.01 -1.30 0.00 0.00 0.00 176.54 175.20 1o8b n THR 41 N -4.38 0.95 0.00 4.70 -2.24 -0.45 -4.80 114.28 108.06 1o8b n THR 41 Ca 0.14 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1o8b n THR 41 Cb 0.71 -1.29 0.00 0.00 -2.10 0.00 0.00 70.33 67.65 1o8b n THR 41 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1o8b n LYS 43 N 1.90 0.00 -0.09 -0.78 4.81 -1.19 -4.94 118.16 117.87 1o8b n LYS 43 Ca 0.02 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.58 1o8b n LYS 43 Cb 0.25 0.00 0.29 0.00 0.02 0.00 0.00 35.03 35.59 1o8b n LYS 43 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1o8b n GLY 44 N 0.00 0.86 0.00 3.14 0.00 -1.26 -4.36 105.19 103.57 1o8b n GLY 44 Ca 0.00 -0.58 0.04 0.00 0.00 0.00 0.00 46.02 45.48 1o8b n GLY 44 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1o8b n GLN 45 N 0.90 0.72 -4.04 1.61 6.02 -1.26 -5.03 117.38 116.31 1o8b n GLN 45 Ca 0.17 -0.07 -0.22 0.00 -0.01 0.00 0.00 57.00 56.87 1o8b n GLN 45 Cb 0.48 -1.17 -0.05 0.00 1.02 0.00 0.00 30.24 30.52 1o8b n GLN 45 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1o8b s ILE 46 N -2.51 3.74 0.06 5.09 -4.36 -1.26 -4.34 121.20 117.62 1o8b s ILE 46 Ca -0.02 -1.52 -0.08 0.00 -0.26 0.00 0.00 60.65 58.77 1o8b s ILE 46 Cb 0.06 -3.17 -0.31 0.00 1.25 0.00 0.00 42.46 40.29 1o8b s ILE 46 CO 0.36 -0.27 1.08 -0.08 0.24 0.00 0.00 174.94 176.28 1o8b h GLU 47 N 1.48 0.36 0.00 0.37 4.81 -1.49 -3.45 114.58 116.66 1o8b h GLU 47 Ca -0.46 -0.61 0.00 0.00 -0.13 0.00 0.00 59.36 58.16 1o8b h GLU 47 Cb 1.25 0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.85 1o8b h GLU 47 CO 0.60 1.29 0.00 0.41 -0.73 0.00 0.00 179.01 180.58 1o8b n GLY 48 N 1.60 -0.52 3.41 1.92 0.00 -1.14 -4.54 105.19 105.92 1o8b n GLY 48 Ca -0.11 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 1o8b n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o8b s ALA 49 N -1.00 -0.56 -0.12 4.61 0.00 0.45 -1.47 121.76 123.68 1o8b s ALA 49 Ca 0.00 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.52 1o8b s ALA 49 Cb 0.00 0.81 -0.00 0.00 0.00 0.00 0.00 23.12 23.93 1o8b s ALA 49 CO 0.00 -0.71 -0.19 0.08 0.00 0.00 0.00 175.76 174.94 1o8b s VAL 50 N -3.90 2.45 -0.06 0.00 1.01 -0.48 -0.31 120.40 119.11 1o8b s VAL 50 Ca 0.11 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.24 1o8b s VAL 50 Cb 0.01 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 1o8b s VAL 50 CO -0.03 0.54 -0.10 -0.55 0.00 0.00 0.00 175.10 174.95 1o8b s SER 51 N 0.44 4.35 0.00 3.32 0.15 -1.26 -0.50 113.70 120.20 1o8b s SER 51 Ca -0.14 -0.10 0.28 0.00 0.70 0.00 0.00 55.95 56.69 1o8b s SER 51 Cb -0.17 -1.02 1.09 0.00 -1.71 0.00 0.00 66.02 64.22 1o8b s SER 51 CO 0.06 0.35 1.77 -1.54 1.20 0.00 0.00 173.24 175.08 1o8b n SER 52 N 2.27 1.06 -3.49 5.45 3.41 -0.65 -4.92 113.62 116.75 1o8b n SER 52 Ca -0.18 -1.15 -0.14 0.00 -0.26 0.00 0.00 58.87 57.15 1o8b n SER 52 Cb 0.53 0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.46 1o8b n SER 52 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1o8b s SER 53 N -2.20 -0.54 0.41 4.04 1.04 -1.26 -4.48 113.70 110.71 1o8b s SER 53 Ca 0.34 0.19 0.09 0.00 0.48 0.00 0.00 55.95 57.05 1o8b s SER 53 Cb 0.21 0.55 0.86 0.00 0.10 0.00 0.00 66.02 67.74 1o8b s SER 53 CO 0.41 -0.82 2.01 0.44 0.98 0.00 0.00 173.24 176.26 1o8b h ASP 54 N 2.45 0.35 -0.37 7.02 3.32 -1.99 -0.20 116.42 126.99 1o8b h ASP 54 Ca -0.32 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 1o8b h ASP 54 Cb 1.24 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 1o8b h ASP 54 CO 0.40 0.33 0.03 0.00 -1.72 0.00 0.00 179.24 178.28 1o8b h ALA 55 N 1.72 0.49 -0.58 3.45 0.00 -1.99 -0.75 119.26 121.60 1o8b h ALA 55 Ca 0.10 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1o8b h ALA 55 Cb 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1o8b h ALA 55 CO -0.01 0.23 0.08 0.77 0.00 0.00 0.00 179.25 180.32 1o8b h SER 56 N 0.46 0.91 -0.38 0.00 0.02 -1.78 -2.30 113.55 110.49 1o8b h SER 56 Ca 0.11 -0.21 0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1o8b h SER 56 Cb 0.41 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 1o8b h SER 56 CO 0.01 0.92 0.22 0.74 -1.14 0.00 0.00 176.83 177.58 1o8b h THR 57 N 0.90 1.03 -0.59 -2.27 2.02 -0.73 -0.60 112.91 112.68 1o8b h THR 57 Ca 0.18 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.18 1o8b h THR 57 Cb 0.42 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 1o8b h THR 57 CO 0.01 0.08 0.26 -0.08 0.37 0.00 0.00 175.52 176.17 1o8b h GLU 58 N 0.44 0.86 -0.58 6.66 4.81 -0.96 0.27 114.58 126.08 1o8b h GLU 58 Ca 0.15 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 1o8b h GLU 58 Cb 0.01 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 1o8b h GLU 58 CO -0.08 0.72 0.09 -0.22 -0.73 0.00 0.00 179.01 178.79 1o8b h LYS 59 N 0.81 0.97 -0.05 1.92 3.64 -1.22 -0.71 116.57 121.93 1o8b h LYS 59 Ca 0.20 -0.26 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1o8b h LYS 59 Cb 0.15 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1o8b h LYS 59 CO -0.02 0.92 0.03 -0.07 -2.27 0.00 0.00 179.45 178.04 1o8b h LEU 60 N 0.87 0.06 -1.12 5.20 3.38 -0.76 -2.59 115.31 120.36 1o8b h LEU 60 Ca 0.18 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1o8b h LEU 60 Cb 0.42 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.11 1o8b h LEU 60 CO 0.01 0.09 0.60 0.11 0.09 0.00 0.00 178.44 179.34 1o8b h LYS 61 N 0.03 1.14 0.00 1.13 1.57 -0.71 -1.67 116.57 118.06 1o8b h LYS 61 Ca 0.02 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1o8b h LYS 61 Cb 0.04 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 1o8b h LYS 61 CO -0.00 0.75 -0.10 0.66 -0.57 0.00 0.00 179.45 180.19 1o8b h SER 62 N 1.17 0.00 -0.54 0.86 4.64 -0.76 -1.59 113.55 117.33 1o8b h SER 62 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 1o8b h SER 62 Cb -0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1o8b h SER 62 CO -0.10 0.10 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 1o8b n LEU 63 N -4.08 3.83 -0.43 5.97 4.77 -0.70 -4.93 117.00 121.44 1o8b n LEU 63 Ca -0.02 -1.93 -0.05 0.00 -0.03 0.00 0.00 56.01 53.98 1o8b n LEU 63 Cb 0.18 -0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.76 1o8b n LEU 63 CO 0.32 0.69 -0.05 0.61 -1.33 0.00 0.00 177.39 177.63 1o8b n GLY 64 N 1.04 0.58 3.61 -0.72 0.00 -0.60 -4.79 105.19 104.32 1o8b n GLY 64 Ca 0.21 -0.80 -0.37 0.00 0.00 0.00 0.00 46.02 45.06 1o8b n GLY 64 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o8b s ILE 65 N -2.20 5.21 0.20 -0.61 1.01 -0.76 -4.93 121.20 119.12 1o8b s ILE 65 Ca 0.00 0.13 -0.30 0.00 0.00 0.00 0.00 60.65 60.48 1o8b s ILE 65 Cb 0.00 -3.44 -0.09 0.00 0.01 0.00 0.00 42.46 38.94 1o8b s ILE 65 CO 0.00 0.32 1.37 -2.28 0.00 0.00 0.00 174.94 174.35 1o8b s HIS 66 N 1.31 3.18 -0.26 3.97 5.65 -1.26 -3.81 115.29 124.07 1o8b s HIS 66 Ca 0.07 1.11 -0.05 0.00 0.25 0.00 0.00 55.06 56.43 1o8b s HIS 66 Cb -0.14 -3.69 -0.00 0.00 -1.18 0.00 0.00 32.58 27.57 1o8b s HIS 66 CO 0.06 -2.23 0.02 0.08 -0.65 0.00 0.00 174.74 172.03 1o8b s VAL 67 N 0.25 3.72 0.25 0.89 1.01 -1.26 -0.41 120.40 124.85 1o8b s VAL 67 Ca 0.59 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.93 1o8b s VAL 67 Cb -0.38 -2.81 -0.06 0.00 0.00 0.00 0.00 36.38 33.13 1o8b s VAL 67 CO 0.38 0.26 0.54 -0.36 0.00 0.00 0.00 175.10 175.92 1o8b s PHE 68 N 1.50 3.45 0.47 5.22 0.08 0.57 -4.96 117.98 124.31 1o8b s PHE 68 Ca 0.04 0.76 -0.19 0.00 0.12 0.00 0.00 56.93 57.66 1o8b s PHE 68 Cb -0.16 -2.18 -0.09 0.00 -0.57 0.00 0.00 43.02 40.02 1o8b s PHE 68 CO 0.00 0.24 0.98 -0.51 -0.10 0.00 0.00 175.22 175.83 1o8b s ASP 69 N -2.67 6.69 0.46 1.36 1.01 -1.26 -4.39 116.67 117.87 1o8b s ASP 69 Ca 0.46 1.71 0.15 0.00 0.71 0.00 0.00 52.55 55.58 1o8b s ASP 69 Cb -0.11 -2.54 1.10 0.00 1.01 0.00 0.00 42.92 42.38 1o8b s ASP 69 CO 0.25 -0.53 2.01 0.25 0.21 0.00 0.00 175.17 177.35 1o8b h LEU 70 N 1.52 0.28 0.00 1.23 5.85 -1.94 -0.72 115.31 121.53 1o8b h LEU 70 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1o8b h LEU 70 Cb 1.19 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1o8b h LEU 70 CO 0.61 0.17 0.00 -0.46 -0.34 0.00 0.00 178.44 178.42 1o8b n ASN 71 N -4.46 0.00 -0.29 1.25 0.23 -1.26 -2.05 115.26 108.67 1o8b n ASN 71 Ca 0.08 -0.06 0.13 0.00 -0.53 0.00 0.00 54.58 54.19 1o8b n ASN 71 Cb 0.35 -0.20 0.30 0.00 -2.08 0.00 0.00 39.78 38.15 1o8b n ASN 71 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1o8b n GLU 72 N -1.20 0.90 -4.27 -3.83 1.02 -0.28 -4.88 120.64 108.10 1o8b n GLU 72 Ca 0.08 -0.58 -0.21 0.00 -0.02 0.00 0.00 57.16 56.42 1o8b n GLU 72 Cb 0.09 -1.49 -0.12 0.00 -0.02 0.00 0.00 31.44 29.90 1o8b n GLU 72 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1o8b s VAL 73 N -2.50 1.56 -0.50 2.62 -7.23 -0.87 -5.01 120.40 108.46 1o8b s VAL 73 Ca 0.23 -1.60 0.11 0.00 -1.81 0.00 0.00 61.98 58.91 1o8b s VAL 73 Cb 0.19 -1.52 0.32 0.00 0.56 0.00 0.00 36.38 35.93 1o8b s VAL 73 CO 0.53 -0.20 1.25 -0.90 -0.31 0.00 0.00 175.10 175.48 1o8b n ASP 74 N 0.88 2.99 -3.56 4.85 5.68 -1.26 -4.98 116.55 121.15 1o8b n ASP 74 Ca -0.18 -2.38 -0.09 0.00 -0.50 0.00 0.00 54.79 51.65 1o8b n ASP 74 Cb 0.55 -0.30 -0.04 0.00 -1.14 0.00 0.00 41.12 40.19 1o8b n ASP 74 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1o8b s SER 75 N -1.42 -0.33 -0.05 -1.12 0.15 -1.26 -5.11 113.70 104.57 1o8b s SER 75 Ca 0.25 0.21 -0.02 0.00 0.70 0.00 0.00 55.95 57.10 1o8b s SER 75 Cb 0.18 0.30 0.03 0.00 -1.71 0.00 0.00 66.02 64.82 1o8b s SER 75 CO 0.10 -0.41 0.10 -0.76 1.20 0.00 0.00 173.24 173.48 1o8b s LEU 76 N -1.67 0.96 0.01 3.45 1.43 -1.23 -5.00 118.68 116.63 1o8b s LEU 76 Ca 0.02 0.20 -0.24 0.00 -1.03 0.00 0.00 54.13 53.09 1o8b s LEU 76 Cb -0.01 0.22 -0.17 0.00 0.03 0.00 0.00 46.19 46.26 1o8b s LEU 76 CO -0.03 -0.13 1.35 1.23 0.23 0.00 0.00 176.35 179.00 1o8b h GLY 77 N 7.10 0.15 -3.54 -3.19 0.00 -1.90 0.81 103.07 102.49 1o8b h GLY 77 Ca -0.42 -0.14 -0.17 0.00 0.00 0.00 0.00 47.33 46.61 1o8b h GLY 77 CO 0.45 0.12 -0.69 -0.26 0.00 0.00 0.00 176.54 176.16 1o8b s ILE 78 N -4.49 0.36 -0.06 2.60 -4.36 -1.26 -1.58 121.20 112.42 1o8b s ILE 78 Ca -0.15 -1.66 -0.01 0.00 -0.26 0.00 0.00 60.65 58.57 1o8b s ILE 78 Cb 0.03 -1.32 0.03 0.00 1.25 0.00 0.00 42.46 42.46 1o8b s ILE 78 CO 0.70 -0.85 0.01 -0.47 0.24 0.00 0.00 174.94 174.58 1o8b s TYR 79 N -3.30 0.48 -0.20 1.37 5.04 0.08 -0.58 117.35 120.24 1o8b s TYR 79 Ca 0.04 -0.04 -0.03 0.00 -2.44 0.00 0.00 57.07 54.60 1o8b s TYR 79 Cb 0.03 -0.66 -0.01 0.00 0.35 0.00 0.00 41.96 41.67 1o8b s TYR 79 CO -0.07 -0.26 -0.07 0.08 -1.34 0.00 0.00 175.55 173.89 1o8b s VAL 80 N 1.84 3.20 0.14 3.14 1.01 -0.44 -0.58 120.40 128.70 1o8b s VAL 80 Ca 0.02 -0.56 -0.19 0.00 0.00 0.00 0.00 61.98 61.25 1o8b s VAL 80 Cb -0.12 -2.43 0.05 0.00 0.00 0.00 0.00 36.38 33.88 1o8b s VAL 80 CO -0.04 0.45 0.49 -0.62 0.00 0.00 0.00 175.10 175.39 1o8b s ASP 81 N 1.25 -0.38 0.69 3.32 2.15 -0.69 -0.20 116.67 122.81 1o8b s ASP 81 Ca 0.03 -0.19 0.00 0.00 0.43 0.00 0.00 52.55 52.81 1o8b s ASP 81 Cb -0.14 0.53 0.00 0.00 -0.30 0.00 0.00 42.92 43.01 1o8b s ASP 81 CO -0.03 -0.91 0.00 0.61 -0.17 0.00 0.00 175.17 174.67 1o8b n GLY 82 N -0.30 -0.28 3.40 2.66 0.00 -1.26 -1.12 105.19 108.30 1o8b n GLY 82 Ca -0.16 -1.79 -0.12 0.00 0.00 0.00 0.00 46.02 43.95 1o8b n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o8b s ALA 83 N -3.45 -1.47 0.05 4.61 0.00 -1.26 -4.82 121.76 115.42 1o8b s ALA 83 Ca 0.00 0.41 -0.02 0.00 0.00 0.00 0.00 51.96 52.35 1o8b s ALA 83 Cb 0.00 0.83 -0.27 0.00 0.00 0.00 0.00 23.12 23.68 1o8b s ALA 83 CO 0.00 -0.73 1.05 -0.44 0.00 0.00 0.00 175.76 175.63 1o8b h ASP 84 N 2.10 0.34 -4.91 0.00 3.32 -1.16 -3.47 116.42 112.64 1o8b h ASP 84 Ca -0.34 -0.40 -0.13 0.00 0.02 0.00 0.00 57.03 56.19 1o8b h ASP 84 Cb 1.29 -0.11 -0.21 0.00 0.22 0.00 0.00 39.33 40.53 1o8b h ASP 84 CO 0.40 1.32 -0.33 -1.61 -1.72 0.00 0.00 179.24 177.30 1o8b s GLU 85 N -2.65 0.61 -0.02 3.56 2.02 -1.03 -4.72 118.70 116.47 1o8b s GLU 85 Ca -0.05 -0.20 0.00 0.00 0.02 0.00 0.00 54.97 54.75 1o8b s GLU 85 Cb 0.07 0.27 0.02 0.00 0.10 0.00 0.00 34.13 34.59 1o8b s GLU 85 CO 0.86 -0.16 0.01 -1.50 0.02 0.00 0.00 175.26 174.49 1o8b s ILE 86 N -1.24 0.06 0.54 -1.63 2.07 0.02 -1.56 121.20 119.45 1o8b s ILE 86 Ca -0.13 0.09 0.07 0.00 -1.41 0.00 0.00 60.65 59.27 1o8b s ILE 86 Cb -0.06 -0.13 0.09 0.00 0.13 0.00 0.00 42.46 42.50 1o8b s ILE 86 CO 0.03 0.08 0.74 -0.46 -1.91 0.00 0.00 174.94 173.43 1o8b n ASN 87 N 3.76 1.78 0.16 4.50 0.23 -0.40 -1.49 115.26 123.80 1o8b n ASN 87 Ca -0.22 -2.32 0.13 0.00 -0.53 0.00 0.00 54.58 51.64 1o8b n ASN 87 Cb 0.54 -0.41 0.53 0.00 -2.08 0.00 0.00 39.78 38.36 1o8b n ASN 87 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1o8b h GLY 88 N -0.00 0.00 0.00 4.83 0.00 -1.81 -3.37 103.07 102.71 1o8b h GLY 88 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.08 1o8b h GLY 88 CO 0.34 0.00 -0.38 1.42 0.00 0.00 0.00 176.54 177.92 1o8b n HIS 89 N -2.41 0.30 0.00 5.60 8.25 -1.26 -5.18 115.22 120.51 1o8b n HIS 89 Ca 0.02 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1o8b n HIS 89 Cb 0.25 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 30.94 1o8b n HIS 89 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1o8b n GLN 91 N -3.53 -1.94 -4.82 -0.41 6.02 -1.26 -4.88 117.38 106.55 1o8b n GLN 91 Ca -0.05 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.67 1o8b n GLN 91 Cb 0.20 0.00 -0.17 0.00 1.02 0.00 0.00 30.24 31.29 1o8b n GLN 91 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1o8b s ILE 93 N -1.60 1.46 0.20 5.09 1.01 -0.60 -1.27 121.20 125.49 1o8b s ILE 93 Ca 0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 60.65 59.97 1o8b s ILE 93 Cb 0.00 -1.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.13 1o8b s ILE 93 CO 0.00 0.43 0.09 -0.54 0.00 0.00 0.00 174.94 174.91 1o8b s LYS 94 N 0.45 1.18 0.00 2.79 1.02 -0.02 -0.49 119.74 124.66 1o8b s LYS 94 Ca -0.14 -1.61 0.00 0.00 0.02 0.00 0.00 55.97 54.25 1o8b s LYS 94 Cb -0.16 0.05 0.00 0.00 -0.52 0.00 0.00 37.83 37.20 1o8b s LYS 94 CO 0.05 -0.30 0.00 0.41 -0.92 0.00 0.00 175.35 174.59 1o8b n GLY 95 N -0.28 0.55 0.39 -3.33 0.00 -1.26 -4.35 105.19 96.92 1o8b n GLY 95 Ca -0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.18 1o8b n GLY 95 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1o8b h GLY 96 N 0.00 0.64 0.00 -0.02 0.00 -1.91 -3.43 103.07 98.34 1o8b h GLY 96 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1o8b h GLY 96 CO 0.00 0.04 -0.58 0.61 0.00 0.00 0.00 176.54 176.60 1o8b n GLY 97 N -1.54 -0.67 0.00 4.60 0.00 -1.26 -5.13 105.19 101.18 1o8b n GLY 97 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1o8b n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o8b n ALA 99 N -3.66 0.00 -0.23 4.61 0.00 -1.26 -5.13 120.51 114.84 1o8b n ALA 99 Ca -0.08 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.37 1o8b n ALA 99 Cb 0.30 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.84 1o8b n ALA 99 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1o8b h LEU 100 N 0.00 -0.54 -0.21 0.00 5.85 -1.93 -1.92 115.31 116.55 1o8b h LEU 100 Ca 0.00 0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 1o8b h LEU 100 Cb 0.00 0.39 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1o8b h LEU 100 CO 0.00 -0.20 0.00 0.74 -0.34 0.00 0.00 178.44 178.64 1o8b h THR 101 N 0.03 1.25 -0.58 1.05 2.02 -1.97 -2.07 112.91 112.63 1o8b h THR 101 Ca 0.33 -0.87 -0.01 0.00 0.77 0.00 0.00 66.41 66.63 1o8b h THR 101 Cb 0.53 1.41 -0.03 0.00 -1.74 0.00 0.00 68.15 68.32 1o8b h THR 101 CO -0.67 0.27 0.33 -0.09 0.37 0.00 0.00 175.52 175.73 1o8b h ARG 102 N 0.14 0.81 -0.65 6.66 2.43 -1.80 -0.83 114.38 121.14 1o8b h ARG 102 Ca 0.06 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1o8b h ARG 102 Cb 0.39 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1o8b h ARG 102 CO 0.01 0.60 0.38 0.93 -1.51 0.00 0.00 179.97 180.38 1o8b h GLU 103 N 0.79 0.89 -0.12 0.20 5.08 -1.29 -0.76 114.58 119.37 1o8b h GLU 103 Ca 0.21 -0.09 -0.16 0.00 -1.00 0.00 0.00 59.36 58.32 1o8b h GLU 103 Cb 0.02 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1o8b h GLU 103 CO -0.04 0.65 -0.59 -0.22 -1.00 0.00 0.00 179.01 177.81 1o8b h LYS 104 N 0.88 0.38 -0.19 2.33 3.64 -0.96 -1.22 116.57 121.44 1o8b h LYS 104 Ca 0.23 -0.26 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1o8b h LYS 104 Cb -0.00 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1o8b h LYS 104 CO -0.04 0.86 -0.05 0.82 -2.27 0.00 0.00 179.45 178.77 1o8b h ILE 105 N 0.29 1.29 -0.71 2.00 2.04 -0.92 -2.01 117.51 119.48 1o8b h ILE 105 Ca -0.00 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 64.80 1o8b h ILE 105 Cb 1.12 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.75 1o8b h ILE 105 CO 0.10 0.31 0.36 0.40 0.00 0.00 0.00 178.15 179.32 1o8b h ILE 106 N 0.08 1.23 -0.06 -0.67 2.04 -1.04 -2.24 117.51 116.84 1o8b h ILE 106 Ca 0.05 -0.62 0.02 0.00 1.00 0.00 0.00 64.86 65.31 1o8b h ILE 106 Cb 0.50 0.32 -0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1o8b h ILE 106 CO 0.02 0.26 0.05 0.00 0.00 0.00 0.00 178.15 178.48 1o8b h ALA 107 N 1.18 1.93 0.00 1.87 0.00 -1.15 -1.12 119.26 121.97 1o8b h ALA 107 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1o8b h ALA 107 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1o8b h ALA 107 CO -0.03 -0.08 0.00 0.66 0.00 0.00 0.00 179.25 179.79 1o8b h SER 108 N 0.00 0.00 0.25 0.00 4.64 -0.74 -3.15 113.55 114.56 1o8b h SER 108 Ca 0.03 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.02 1o8b h SER 108 Cb 0.13 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.16 1o8b h SER 108 CO -0.00 0.00 -2.03 0.52 -0.87 0.00 0.00 176.83 174.45 1o8b n VAL 109 N -3.06 1.51 -2.39 0.95 0.31 -0.48 -4.95 118.33 110.22 1o8b n VAL 109 Ca 0.02 -0.82 -0.41 0.00 -0.01 0.00 0.00 64.34 63.12 1o8b n VAL 109 Cb 0.37 -0.81 -0.04 0.00 -0.91 0.00 0.00 33.84 32.45 1o8b n VAL 109 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1o8b s ALA 110 N -2.55 3.43 0.08 3.52 0.00 -0.84 -3.54 121.76 121.87 1o8b s ALA 110 Ca -0.08 0.97 -0.16 0.00 0.00 0.00 0.00 51.96 52.69 1o8b s ALA 110 Cb 0.07 -3.37 -0.11 0.00 0.00 0.00 0.00 23.12 19.71 1o8b s ALA 110 CO 0.82 -0.29 1.38 0.93 0.00 0.00 0.00 175.76 178.60 1o8b h GLU 111 N 4.18 0.64 -4.74 0.00 4.39 -0.79 -3.44 114.58 114.82 1o8b h GLU 111 Ca -0.46 -0.37 -0.63 0.00 0.34 0.00 0.00 59.36 58.24 1o8b h GLU 111 Cb 1.21 0.03 -0.36 0.00 -0.10 0.00 0.00 28.75 29.53 1o8b h GLU 111 CO 0.69 0.98 -0.83 0.21 -1.16 0.00 0.00 179.01 178.90 1o8b s LYS 112 N -4.22 2.33 -0.31 2.33 2.20 -0.61 -5.01 119.74 116.45 1o8b s LYS 112 Ca -0.13 -0.84 -0.16 0.00 -0.36 0.00 0.00 55.97 54.48 1o8b s LYS 112 Cb 0.08 -2.44 -0.02 0.00 -1.51 0.00 0.00 37.83 33.94 1o8b s LYS 112 CO 0.82 -0.35 0.44 0.12 -0.36 0.00 0.00 175.35 176.02 1o8b s PHE 113 N 1.36 3.22 -0.36 4.03 2.19 -1.26 -0.74 117.98 126.41 1o8b s PHE 113 Ca 0.01 0.27 -0.09 0.00 0.33 0.00 0.00 56.93 57.45 1o8b s PHE 113 Cb -0.15 -2.74 0.04 0.00 -1.31 0.00 0.00 43.02 38.86 1o8b s PHE 113 CO -0.09 -0.39 0.16 0.42 1.83 0.00 0.00 175.22 177.15 1o8b s ILE 114 N 2.21 4.17 -0.19 3.12 1.01 0.25 -0.57 121.20 131.19 1o8b s ILE 114 Ca 0.16 -1.03 -0.26 0.00 0.00 0.00 0.00 60.65 59.53 1o8b s ILE 114 Cb -0.16 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.94 1o8b s ILE 114 CO 0.11 -0.23 0.85 0.00 0.00 0.00 0.00 174.94 175.68 1o8b s ILE 116 N 2.38 3.89 -0.09 0.00 -4.36 -0.28 -0.38 121.20 122.36 1o8b s ILE 116 Ca 0.38 -0.34 -0.29 0.00 -0.26 0.00 0.00 60.65 60.14 1o8b s ILE 116 Cb -0.16 -2.74 0.07 0.00 1.25 0.00 0.00 42.46 40.87 1o8b s ILE 116 CO 0.11 0.44 0.66 0.00 0.24 0.00 0.00 174.94 176.40 1o8b s ALA 117 N 0.88 -1.71 0.82 2.27 0.00 -0.69 -4.06 121.76 119.27 1o8b s ALA 117 Ca 0.00 1.38 -0.12 0.00 0.00 0.00 0.00 51.96 53.23 1o8b s ALA 117 Cb -0.14 -0.20 0.08 0.00 0.00 0.00 0.00 23.12 22.86 1o8b s ALA 117 CO 0.02 -0.36 1.11 0.16 0.00 0.00 0.00 175.76 176.69 1o8b s ASP 118 N -0.92 4.30 0.60 0.00 1.47 -1.26 -0.78 116.67 120.08 1o8b s ASP 118 Ca -0.09 1.21 0.32 0.00 1.18 0.00 0.00 52.55 55.16 1o8b s ASP 118 Cb -0.01 -1.91 1.87 0.00 -0.34 0.00 0.00 42.92 42.54 1o8b s ASP 118 CO 0.08 -2.08 2.24 0.00 0.68 0.00 0.00 175.17 176.09 1o8b h ALA 119 N -1.17 1.51 0.00 2.11 0.00 -1.55 -1.97 119.26 118.20 1o8b h ALA 119 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1o8b h ALA 119 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1o8b h ALA 119 CO 0.60 -0.07 0.00 0.66 0.00 0.00 0.00 179.25 180.44 1o8b h SER 120 N 0.00 0.00 1.33 0.00 4.64 -1.92 -2.77 113.55 114.83 1o8b h SER 120 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1o8b h SER 120 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1o8b h SER 120 CO -0.00 0.00 -0.04 0.29 -0.87 0.00 0.00 176.83 176.21 1o8b n LYS 121 N -2.73 0.20 -2.61 4.77 4.76 -0.74 -4.82 118.16 116.99 1o8b n LYS 121 Ca -0.01 0.16 -0.42 0.00 -2.87 0.00 0.00 58.31 55.17 1o8b n LYS 121 Cb 0.14 -1.73 -0.03 0.00 -1.84 0.00 0.00 35.03 31.57 1o8b n LYS 121 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1o8b s GLN 122 N -3.08 4.47 0.08 1.97 -0.21 -1.05 -0.80 119.66 121.04 1o8b s GLN 122 Ca 0.11 1.52 0.02 0.00 0.02 0.00 0.00 55.36 57.03 1o8b s GLN 122 Cb 0.14 -3.48 -0.03 0.00 1.00 0.00 0.00 33.01 30.64 1o8b s GLN 122 CO 0.59 -0.22 -0.07 0.14 -2.12 0.00 0.00 175.29 173.61 1o8b s VAL 123 N 1.47 0.67 -0.03 1.09 -7.23 -0.56 -4.93 120.40 110.88 1o8b s VAL 123 Ca 0.53 -1.58 -0.20 0.00 -1.81 0.00 0.00 61.98 58.92 1o8b s VAL 123 Cb -0.22 -1.24 -0.33 0.00 0.56 0.00 0.00 36.38 35.15 1o8b s VAL 123 CO 0.25 -0.65 0.91 0.44 -0.31 0.00 0.00 175.10 175.73 1o8b h ASP 124 N 3.61 0.59 -3.29 4.85 3.32 -1.96 -3.32 116.42 120.22 1o8b h ASP 124 Ca -0.36 -0.94 -0.64 0.00 0.02 0.00 0.00 57.03 55.11 1o8b h ASP 124 Cb 1.18 -0.19 -0.34 0.00 0.22 0.00 0.00 39.33 40.20 1o8b h ASP 124 CO 0.54 1.51 -0.86 -0.63 -1.72 0.00 0.00 179.24 178.08 1o8b s ILE 125 N -2.49 1.84 0.53 0.35 1.01 -1.26 -4.59 121.20 116.59 1o8b s ILE 125 Ca -0.12 -0.87 -0.20 0.00 0.00 0.00 0.00 60.65 59.46 1o8b s ILE 125 Cb 0.02 -1.63 -0.06 0.00 0.01 0.00 0.00 42.46 40.80 1o8b s ILE 125 CO 0.87 0.51 1.13 -0.76 0.00 0.00 0.00 174.94 176.68 1o8b s LEU 126 N 0.67 3.80 0.00 2.97 1.43 -1.26 -4.49 118.68 121.80 1o8b s LEU 126 Ca -0.12 2.18 0.00 0.00 -1.03 0.00 0.00 54.13 55.16 1o8b s LEU 126 Cb -0.16 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.53 1o8b s LEU 126 CO 0.03 -1.14 0.00 0.61 0.23 0.00 0.00 176.35 176.07 1o8b n GLY 127 N 0.18 1.29 0.19 -3.19 0.00 -1.26 -1.24 105.19 101.16 1o8b n GLY 127 Ca 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 1o8b n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1o8b h LYS 128 N 0.00 0.59 -6.34 1.61 1.79 -1.97 -3.38 116.57 108.88 1o8b h LYS 128 Ca 0.00 -0.10 -0.55 0.00 -2.18 0.00 0.00 60.65 57.82 1o8b h LYS 128 Cb 0.00 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.54 1o8b h LYS 128 CO 0.00 0.55 0.82 0.12 -1.08 0.00 0.00 179.45 179.86 1o8b s PHE 129 N -5.59 2.89 0.36 -1.35 2.19 -1.26 -4.85 117.98 110.37 1o8b s PHE 129 Ca -0.13 0.89 -0.28 0.00 0.33 0.00 0.00 56.93 57.74 1o8b s PHE 129 Cb 0.10 -3.61 -0.11 0.00 -1.31 0.00 0.00 43.02 38.09 1o8b s PHE 129 CO 0.75 -2.20 1.52 -2.14 1.83 0.00 0.00 175.22 174.98 1o8b s PRO 130 N 2.52 4.09 -0.22 10.12 0.02 -1.26 -4.93 135.00 145.34 1o8b s PRO 130 Ca 0.62 2.60 -0.26 0.00 0.02 0.00 0.00 61.00 63.98 1o8b s PRO 130 Cb -0.29 -2.97 -0.00 0.00 0.02 0.00 0.00 34.50 31.25 1o8b s PRO 130 CO 0.25 -0.58 0.90 -1.17 -0.33 0.00 0.00 177.00 176.07 1o8b s LEU 131 N -1.79 4.11 0.23 -5.54 2.96 -0.34 -4.63 118.68 113.68 1o8b s LEU 131 Ca 0.55 1.18 -0.30 0.00 -0.22 0.00 0.00 54.13 55.34 1o8b s LEU 131 Cb -0.47 -3.31 -0.09 0.00 0.50 0.00 0.00 46.19 42.82 1o8b s LEU 131 CO 0.61 -0.54 1.10 -2.84 -1.32 0.00 0.00 176.35 173.35 1o8b s PRO 132 N 2.81 4.62 -0.12 0.98 0.02 -1.26 -0.42 135.00 141.64 1o8b s PRO 132 Ca 0.39 1.76 -0.01 0.00 0.02 0.00 0.00 61.00 63.16 1o8b s PRO 132 Cb -0.15 -3.23 0.03 0.00 0.02 0.00 0.00 34.50 31.17 1o8b s PRO 132 CO 0.08 0.16 -0.03 0.08 -0.33 0.00 0.00 177.00 176.95 1o8b s VAL 133 N -0.75 0.77 -0.06 3.83 1.01 0.12 -0.73 120.40 124.59 1o8b s VAL 133 Ca 0.47 -0.24 -0.24 0.00 0.00 0.00 0.00 61.98 61.96 1o8b s VAL 133 Cb -0.31 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 1o8b s VAL 133 CO 0.38 0.23 0.74 -0.70 0.00 0.00 0.00 175.10 175.75 1o8b s GLU 134 N 1.80 4.45 -0.01 2.72 2.12 0.19 -0.81 118.70 129.16 1o8b s GLU 134 Ca 0.04 0.96 0.03 0.00 0.36 0.00 0.00 54.97 56.36 1o8b s GLU 134 Cb -0.13 -3.45 -0.01 0.00 0.26 0.00 0.00 34.13 30.80 1o8b s GLU 134 CO -0.07 0.04 -0.10 0.08 -0.54 0.00 0.00 175.26 174.67 1o8b s VAL 135 N 0.86 0.82 0.24 3.70 1.01 0.37 -0.40 120.40 127.00 1o8b s VAL 135 Ca 0.40 -0.44 -0.31 0.00 0.00 0.00 0.00 61.98 61.63 1o8b s VAL 135 Cb -0.18 -0.69 -0.12 0.00 0.00 0.00 0.00 36.38 35.39 1o8b s VAL 135 CO 0.19 0.24 1.68 -0.63 0.00 0.00 0.00 175.10 176.58 1o8b s ILE 136 N -0.19 2.03 0.00 2.22 -1.09 0.19 -1.78 121.20 122.58 1o8b s ILE 136 Ca 0.03 0.03 0.00 0.00 -2.23 0.00 0.00 60.65 58.48 1o8b s ILE 136 Cb -0.05 -3.02 0.00 0.00 -1.58 0.00 0.00 42.46 37.82 1o8b s ILE 136 CO -0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 174.94 171.06 1o8b n PRO 137 N 3.33 0.00 0.00 2.79 -0.02 -1.26 -3.23 135.00 136.60 1o8b n PRO 137 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1o8b n PRO 137 Cb 0.36 -1.17 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 1o8b n PRO 137 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1o8b n ALA 139 N 1.30 0.00 -0.03 3.55 0.00 -1.26 -4.73 120.51 119.34 1o8b n ALA 139 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1o8b n ALA 139 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1o8b n ALA 139 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1o8b h ARG 140 N 0.00 -0.37 -0.58 0.00 2.43 -1.90 0.52 114.38 114.48 1o8b h ARG 140 Ca 0.00 0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1o8b h ARG 140 Cb 0.00 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1o8b h ARG 140 CO 0.00 -0.25 -0.03 0.77 -1.51 0.00 0.00 179.97 178.95 1o8b h SER 141 N -0.38 1.01 -0.36 -3.80 0.02 -1.94 -1.07 113.55 107.03 1o8b h SER 141 Ca 0.11 -0.30 -0.02 0.00 -0.84 0.00 0.00 61.79 60.74 1o8b h SER 141 Cb 0.56 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 1o8b h SER 141 CO -0.41 1.08 0.15 0.00 -1.14 0.00 0.00 176.83 176.51 1o8b h ALA 142 N 1.02 0.47 -0.37 3.77 0.00 -1.80 -1.10 119.26 121.24 1o8b h ALA 142 Ca 0.16 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1o8b h ALA 142 Cb 0.58 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1o8b h ALA 142 CO 0.03 0.06 -0.18 0.28 0.00 0.00 0.00 179.25 179.45 1o8b h VAL 143 N 0.44 1.26 -0.71 0.00 2.07 -0.74 -2.63 116.25 115.94 1o8b h VAL 143 Ca 0.12 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.38 1o8b h VAL 143 Cb 0.17 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1o8b h VAL 143 CO -0.01 0.41 0.37 0.00 0.02 0.00 0.00 177.57 178.36 1o8b h ALA 144 N 1.18 0.92 -0.97 1.67 0.00 -0.90 0.05 119.26 121.21 1o8b h ALA 144 Ca 0.10 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1o8b h ALA 144 Cb 0.65 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1o8b h ALA 144 CO 0.05 0.45 0.64 0.00 0.00 0.00 0.00 179.25 180.39 1o8b h ARG 145 N 0.99 1.26 -0.24 0.00 3.08 -0.91 -0.82 114.38 117.74 1o8b h ARG 145 Ca 0.25 -0.08 -0.14 0.00 0.07 0.00 0.00 59.98 60.08 1o8b h ARG 145 Cb 0.07 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 29.83 1o8b h ARG 145 CO -0.04 0.84 -0.43 0.37 -1.07 0.00 0.00 179.97 179.63 1o8b h GLN 146 N 1.30 0.59 -0.33 0.04 5.75 -1.02 -2.41 115.11 119.03 1o8b h GLN 146 Ca 0.36 -0.32 -0.08 0.00 -0.15 0.00 0.00 58.65 58.46 1o8b h GLN 146 Cb -0.13 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.41 1o8b h GLN 146 CO -0.08 0.91 -0.14 -0.07 -2.65 0.00 0.00 178.83 176.80 1o8b h LEU 147 N 0.48 0.57 -0.52 -2.39 3.38 -0.44 -1.64 115.31 114.75 1o8b h LEU 147 Ca 0.03 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.87 1o8b h LEU 147 Cb 0.95 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 1o8b h LEU 147 CO 0.09 0.74 0.31 0.58 0.09 0.00 0.00 178.44 180.25 1o8b h VAL 148 N 0.53 1.05 -0.09 1.22 2.07 -1.00 -1.14 116.25 118.90 1o8b h VAL 148 Ca 0.09 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1o8b h VAL 148 Cb 0.56 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1o8b h VAL 148 CO 0.04 0.11 0.02 0.11 0.02 0.00 0.00 177.57 177.86 1o8b h LYS 149 N 0.62 0.12 -0.00 1.57 1.57 -0.88 0.06 116.57 119.63 1o8b h LYS 149 Ca 0.21 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1o8b h LYS 149 Cb 0.03 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1o8b h LYS 149 CO -0.10 0.12 0.00 1.28 -0.57 0.00 0.00 179.45 180.18 1o8b n LEU 150 N -4.48 0.14 0.00 2.94 4.77 -0.68 -4.90 117.00 114.79 1o8b n LEU 150 Ca -0.02 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1o8b n LEU 150 Cb 0.12 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1o8b n LEU 150 CO 0.35 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1o8b n GLY 151 N 0.98 1.01 3.86 -0.72 0.00 0.01 -5.08 105.19 105.24 1o8b n GLY 151 Ca 0.22 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.02 1o8b n GLY 151 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o8b s GLY 152 N -2.00 2.18 -0.38 -0.02 0.00 -0.46 -4.91 107.32 101.72 1o8b s GLY 152 Ca 0.00 -1.90 0.04 0.00 0.00 0.00 0.00 44.72 42.86 1o8b s GLY 152 CO 0.00 -1.74 0.10 -1.60 0.00 0.00 0.00 173.10 169.86 1o8b s ARG 153 N -4.10 1.60 0.13 2.90 3.52 0.36 -3.92 118.95 119.43 1o8b s ARG 153 Ca 0.47 -2.05 -0.30 0.00 -0.13 0.00 0.00 55.73 53.71 1o8b s ARG 153 Cb -0.02 -3.24 -0.07 0.00 -1.56 0.00 0.00 34.95 30.06 1o8b s ARG 153 CO 0.27 -0.98 1.21 -1.25 -0.81 0.00 0.00 175.30 173.74 1o8b s PRO 154 N 0.63 4.45 -0.16 5.12 0.04 -1.26 -0.84 135.00 142.99 1o8b s PRO 154 Ca 0.12 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.02 1o8b s PRO 154 Cb -0.21 -3.28 0.03 0.00 0.04 0.00 0.00 34.50 31.08 1o8b s PRO 154 CO -0.06 -0.18 -0.13 -2.00 0.04 0.00 0.00 177.00 174.67 1o8b s GLU 155 N 0.40 2.19 0.14 4.56 2.12 0.54 -4.94 118.70 123.71 1o8b s GLU 155 Ca 0.56 -0.60 -0.31 0.00 0.36 0.00 0.00 54.97 54.98 1o8b s GLU 155 Cb -0.32 -2.15 -0.11 0.00 0.26 0.00 0.00 34.13 31.82 1o8b s GLU 155 CO 0.33 -0.28 1.80 -0.47 -0.54 0.00 0.00 175.26 176.10 1o8b s TYR 156 N 1.48 2.33 -0.93 5.30 5.04 -1.26 -0.86 117.35 128.45 1o8b s TYR 156 Ca 0.04 0.07 -0.24 0.00 -2.44 0.00 0.00 57.07 54.50 1o8b s TYR 156 Cb -0.14 -4.16 0.03 0.00 0.35 0.00 0.00 41.96 38.04 1o8b s TYR 156 CO -0.10 -4.71 1.51 0.50 -1.34 0.00 0.00 175.55 171.41 1o8b s ARG 157 N 2.38 3.31 0.26 4.97 3.52 -0.09 -4.91 118.95 128.38 1o8b s ARG 157 Ca 0.79 -0.74 -0.31 0.00 -0.13 0.00 0.00 55.73 55.35 1o8b s ARG 157 Cb -0.47 -5.04 -0.11 0.00 -1.56 0.00 0.00 34.95 27.77 1o8b s ARG 157 CO 0.35 -2.40 1.64 -0.65 -0.81 0.00 0.00 175.30 173.43 1o8b s GLN 158 N 5.54 4.13 -0.23 5.12 -1.52 -1.26 -3.03 119.66 128.40 1o8b s GLN 158 Ca 0.49 2.58 0.00 0.00 -1.95 0.00 0.00 55.36 56.48 1o8b s GLN 158 Cb -0.03 -3.05 0.00 0.00 -0.22 0.00 0.00 33.01 29.71 1o8b s GLN 158 CO -0.02 -0.67 0.00 0.41 -0.25 0.00 0.00 175.29 174.75 1o8b n GLY 159 N 2.86 0.56 3.28 3.09 0.00 -1.26 -5.01 105.19 108.70 1o8b n GLY 159 Ca 0.11 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 1o8b n GLY 159 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o8b s VAL 160 N -1.96 1.87 0.05 1.61 1.01 -1.17 -5.13 120.40 116.68 1o8b s VAL 160 Ca 0.00 -1.14 0.05 0.00 0.00 0.00 0.00 61.98 60.90 1o8b s VAL 160 Cb 0.00 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 1o8b s VAL 160 CO 0.00 0.41 -0.15 0.54 0.00 0.00 0.00 175.10 175.90 1o8b s VAL 161 N -0.67 1.18 0.81 2.92 0.11 -1.26 -4.60 120.40 118.89 1o8b s VAL 161 Ca 0.09 -1.14 -0.11 0.00 -2.93 0.00 0.00 61.98 57.89 1o8b s VAL 161 Cb -0.09 -1.09 0.09 0.00 -1.53 0.00 0.00 36.38 33.77 1o8b s VAL 161 CO 0.00 -0.06 1.16 0.42 -3.33 0.00 0.00 175.10 173.29 1o8b s THR 162 N -1.00 2.06 0.64 5.04 -4.23 0.02 -4.91 115.64 113.26 1o8b s THR 162 Ca 0.01 -0.07 0.37 0.00 -1.18 0.00 0.00 61.69 60.81 1o8b s THR 162 Cb -0.09 -2.99 0.39 0.00 1.34 0.00 0.00 72.50 71.16 1o8b s THR 162 CO 0.02 0.00 2.25 -2.24 -0.54 0.00 0.00 174.62 174.11 1o8b h ASP 163 N -1.03 0.00 -0.22 3.99 2.03 -2.01 0.11 116.42 119.28 1o8b h ASP 163 Ca -0.45 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.85 1o8b h ASP 163 Cb 1.31 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.81 1o8b h ASP 163 CO 0.60 0.00 0.00 0.59 -1.03 0.00 0.00 179.24 179.40 1o8b n ASN 164 N -3.36 2.00 0.00 4.15 3.02 -1.26 -4.94 115.26 114.88 1o8b n ASN 164 Ca -0.02 -1.79 0.00 0.00 -0.03 0.00 0.00 54.58 52.74 1o8b n ASN 164 Cb 0.15 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 1o8b n ASN 164 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1o8b n GLY 165 N 1.19 0.49 3.99 7.41 0.00 0.37 -5.05 105.19 113.60 1o8b n GLY 165 Ca 0.16 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.43 1o8b n GLY 165 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1o8b s ASN 166 N -2.52 5.32 0.38 1.61 0.01 -1.26 -4.76 114.94 113.73 1o8b s ASN 166 Ca 0.00 -0.67 0.08 0.00 -0.71 0.00 0.00 52.86 51.56 1o8b s ASN 166 Cb 0.00 -0.24 -0.02 0.00 0.41 0.00 0.00 41.25 41.39 1o8b s ASN 166 CO 0.00 -0.97 0.34 0.68 -1.51 0.00 0.00 177.10 175.64 1o8b s VAL 167 N -2.50 3.00 -0.11 1.60 -7.23 -0.73 -0.80 120.40 113.62 1o8b s VAL 167 Ca 0.55 -1.36 0.03 0.00 -1.81 0.00 0.00 61.98 59.39 1o8b s VAL 167 Cb -0.07 -3.07 -0.00 0.00 0.56 0.00 0.00 36.38 33.80 1o8b s VAL 167 CO 0.34 -0.07 -0.21 -0.63 -0.31 0.00 0.00 175.10 174.22 1o8b s ILE 168 N -2.41 2.34 -0.23 -0.62 1.01 -1.26 -0.48 121.20 119.54 1o8b s ILE 168 Ca 0.45 -0.92 -0.08 0.00 0.00 0.00 0.00 60.65 60.10 1o8b s ILE 168 Cb -0.04 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.47 1o8b s ILE 168 CO 0.27 0.55 0.09 -0.76 0.00 0.00 0.00 174.94 175.09 1o8b s LEU 169 N 0.31 3.64 -0.21 2.97 1.43 0.01 -0.91 118.68 125.92 1o8b s LEU 169 Ca -0.16 -0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 52.70 1o8b s LEU 169 Cb -0.17 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 1o8b s LEU 169 CO 0.08 0.03 0.37 -1.81 0.23 0.00 0.00 176.35 175.25 1o8b s ASP 170 N 1.26 6.40 -0.33 2.29 1.01 -0.04 -0.70 116.67 126.56 1o8b s ASP 170 Ca 0.05 0.46 -0.11 0.00 0.71 0.00 0.00 52.55 53.66 1o8b s ASP 170 Cb -0.14 -2.22 -0.01 0.00 1.01 0.00 0.00 42.92 41.55 1o8b s ASP 170 CO 0.04 -0.07 0.20 -0.69 0.21 0.00 0.00 175.17 174.86 1o8b s VAL 171 N 1.33 4.97 0.26 -1.27 1.01 0.44 -0.34 120.40 126.80 1o8b s VAL 171 Ca 0.18 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.87 1o8b s VAL 171 Cb -0.15 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 1o8b s VAL 171 CO 0.08 0.03 0.41 -1.00 0.00 0.00 0.00 175.10 174.62 1o8b s HIS 172 N 1.67 3.47 0.00 5.22 3.76 -0.02 -1.20 115.29 128.20 1o8b s HIS 172 Ca 0.05 0.16 0.00 0.00 -0.15 0.00 0.00 55.06 55.12 1o8b s HIS 172 Cb -0.17 -1.72 0.00 0.00 1.11 0.00 0.00 32.58 31.80 1o8b s HIS 172 CO 0.09 0.35 0.00 0.41 -0.85 0.00 0.00 174.74 174.73 1o8b n GLY 173 N -1.32 -0.79 3.07 -2.22 0.00 -1.26 -0.49 105.19 102.18 1o8b n GLY 173 Ca -0.07 -0.20 -0.00 0.00 0.00 0.00 0.00 46.02 45.75 1o8b n GLY 173 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o8b s GLU 175 N -0.86 0.51 -0.88 1.61 2.02 -1.26 -4.90 118.70 114.94 1o8b s GLU 175 Ca 0.00 0.48 -0.19 0.00 0.02 0.00 0.00 54.97 55.28 1o8b s GLU 175 Cb 0.00 0.09 0.12 0.00 0.10 0.00 0.00 34.13 34.44 1o8b s GLU 175 CO 0.00 -0.97 1.09 0.42 0.02 0.00 0.00 175.26 175.82 1o8b s ILE 176 N 2.74 4.67 -0.12 -1.63 1.01 -0.37 -4.79 121.20 122.70 1o8b s ILE 176 Ca 0.11 -1.39 0.18 0.00 0.00 0.00 0.00 60.65 59.56 1o8b s ILE 176 Cb -0.12 -4.76 0.14 0.00 0.01 0.00 0.00 42.46 37.74 1o8b s ILE 176 CO -0.26 -1.49 1.56 -0.07 0.00 0.00 0.00 174.94 174.68 1o8b h LEU 177 N 10.54 0.00 -6.56 2.97 3.38 -1.98 -3.36 115.31 120.30 1o8b h LEU 177 Ca 0.08 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.45 1o8b h LEU 177 Cb 1.03 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.39 1o8b h LEU 177 CO 1.12 0.37 -0.87 -0.62 0.09 0.00 0.00 178.44 178.52 1o8b s ASP 178 N -6.36 2.36 0.30 -0.43 -1.08 -1.26 -5.01 116.67 105.19 1o8b s ASP 178 Ca 0.04 -3.13 0.02 0.00 -0.52 0.00 0.00 52.55 48.96 1o8b s ASP 178 Cb 0.08 -0.71 0.58 0.00 -1.46 0.00 0.00 42.92 41.41 1o8b s ASP 178 CO 0.71 -0.17 1.88 -0.65 0.52 0.00 0.00 175.17 177.46 1o8b h PRO 179 N 5.77 0.94 -0.37 4.34 0.11 -1.99 -2.05 132.00 138.75 1o8b h PRO 179 Ca 0.21 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.26 1o8b h PRO 179 Cb 0.88 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.76 1o8b h PRO 179 CO 0.44 0.62 0.22 0.82 -0.21 0.00 0.00 178.00 179.89 1o8b h ILE 180 N 0.97 1.13 0.00 4.15 2.04 -1.95 0.12 117.51 123.97 1o8b h ILE 180 Ca 0.44 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.99 1o8b h ILE 180 Cb 0.38 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1o8b h ILE 180 CO -0.20 0.13 0.00 0.00 0.00 0.00 0.00 178.15 178.08 1o8b n ALA 181 N -2.23 1.21 0.00 1.87 0.00 -0.77 -1.11 120.51 119.48 1o8b n ALA 181 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1o8b n ALA 181 Cb 0.06 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1o8b n ALA 181 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1o8b n GLU 183 N 0.67 0.00 -0.19 0.00 2.13 0.43 -1.22 120.64 122.45 1o8b n GLU 183 Ca 0.00 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.75 1o8b n GLU 183 Cb 0.01 0.00 0.07 0.00 0.27 0.00 0.00 31.44 31.79 1o8b n GLU 183 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1o8b h ASN 184 N 0.00 0.98 -0.45 4.31 2.35 -1.36 0.20 115.58 121.61 1o8b h ASN 184 Ca 0.00 -0.25 -0.11 0.00 -0.55 0.00 0.00 56.30 55.39 1o8b h ASN 184 Cb 0.00 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 1o8b h ASN 184 CO 0.00 1.01 -0.12 0.00 -1.65 0.00 0.00 177.43 176.67 1o8b h ALA 185 N 1.10 0.86 0.06 -0.83 0.00 -1.41 -2.14 119.26 116.90 1o8b h ALA 185 Ca 0.18 -0.34 -0.27 0.00 0.00 0.00 0.00 54.91 54.48 1o8b h ALA 185 Cb 0.49 -0.19 0.02 0.00 0.00 0.00 0.00 17.79 18.11 1o8b h ALA 185 CO 0.02 0.64 -1.12 0.82 0.00 0.00 0.00 179.25 179.62 1o8b h ILE 186 N 0.82 1.34 0.00 0.00 2.04 -1.77 -3.03 117.51 116.91 1o8b h ILE 186 Ca 0.13 -2.48 0.00 0.00 1.00 0.00 0.00 64.86 63.51 1o8b h ILE 186 Cb 0.65 2.57 0.00 0.00 -0.74 0.00 0.00 36.82 39.30 1o8b h ILE 186 CO 0.05 0.75 0.00 0.78 0.00 0.00 0.00 178.15 179.72 1o8b h ASN 187 N 0.27 0.00 1.31 1.72 2.35 -0.81 -2.12 115.58 118.30 1o8b h ASN 187 Ca -0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 1o8b h ASN 187 Cb 1.78 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.15 1o8b h ASN 187 CO 0.21 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.99 1o8b h ALA 188 N 2.02 1.00 -2.11 -0.83 0.00 -1.26 -3.45 119.26 114.63 1o8b h ALA 188 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 1o8b h ALA 188 Cb 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 1o8b h ALA 188 CO 0.00 0.00 0.73 0.42 0.00 0.00 0.00 179.25 180.40 1o8b s ILE 189 N -3.28 4.69 0.29 0.00 1.01 -0.80 -4.99 121.20 118.12 1o8b s ILE 189 Ca 0.07 1.89 -0.30 0.00 0.00 0.00 0.00 60.65 62.30 1o8b s ILE 189 Cb 0.09 -4.28 -0.12 0.00 0.01 0.00 0.00 42.46 38.17 1o8b s ILE 189 CO 0.55 -0.19 1.56 -2.65 0.00 0.00 0.00 174.94 174.20 1o8b n PRO 190 N 6.32 2.60 0.00 2.79 -0.02 -1.26 -1.70 135.00 143.73 1o8b n PRO 190 Ca 0.11 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 1o8b n PRO 190 Cb 0.46 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 1o8b n PRO 190 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1o8b n GLY 191 N 2.06 3.40 3.70 -1.23 0.00 -1.26 -4.78 105.19 107.09 1o8b n GLY 191 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1o8b n GLY 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o8b s VAL 192 N -2.99 4.13 -0.16 1.61 1.01 -0.69 -0.64 120.40 122.68 1o8b s VAL 192 Ca 0.00 1.51 -0.12 0.00 0.00 0.00 0.00 61.98 63.37 1o8b s VAL 192 Cb 0.00 -3.97 -0.07 0.00 0.00 0.00 0.00 36.38 32.34 1o8b s VAL 192 CO 0.00 0.07 -0.08 0.52 0.00 0.00 0.00 175.10 175.61 1o8b n VAL 193 N 4.20 1.45 -3.80 2.92 0.31 0.46 -4.93 118.33 118.94 1o8b n VAL 193 Ca 0.10 0.15 -0.12 0.00 -0.01 0.00 0.00 64.34 64.45 1o8b n VAL 193 Cb 0.46 -2.30 -0.11 0.00 -0.91 0.00 0.00 33.84 30.98 1o8b n VAL 193 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1o8b s THR 194 N -2.28 0.01 -0.09 2.52 2.01 -1.19 -5.01 115.64 111.62 1o8b s THR 194 Ca -0.19 -0.12 0.01 0.00 0.31 0.00 0.00 61.69 61.70 1o8b s THR 194 Cb 0.03 -0.35 -0.03 0.00 0.01 0.00 0.00 72.50 72.17 1o8b s THR 194 CO 0.32 -0.07 -0.10 0.54 -0.69 0.00 0.00 174.62 174.62 1o8b s VAL 195 N -0.17 3.41 -0.02 3.82 0.11 -1.26 -0.64 120.40 125.66 1o8b s VAL 195 Ca -0.03 -0.57 0.00 0.00 -2.93 0.00 0.00 61.98 58.45 1o8b s VAL 195 Cb -0.03 -2.40 0.00 0.00 -1.53 0.00 0.00 36.38 32.42 1o8b s VAL 195 CO 0.01 0.57 0.86 0.61 -3.33 0.00 0.00 175.10 173.81 1o8b n GLY 196 N 2.71 1.73 3.59 6.54 0.00 0.09 -4.69 105.19 115.15 1o8b n GLY 196 Ca -0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 1o8b n GLY 196 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1o8b s LEU 197 N 0.00 4.04 -0.89 0.99 1.43 -1.26 -0.84 118.68 122.14 1o8b s LEU 197 Ca 0.00 0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.03 1o8b s LEU 197 Cb 0.00 -2.15 0.23 0.00 0.03 0.00 0.00 46.19 44.30 1o8b s LEU 197 CO 0.00 -0.07 0.82 -0.36 0.23 0.00 0.00 176.35 176.97 1o8b s PHE 198 N 1.79 3.88 0.00 0.29 0.40 -1.26 -4.78 117.98 118.31 1o8b s PHE 198 Ca 0.08 -2.55 0.00 0.00 -0.60 0.00 0.00 56.93 53.85 1o8b s PHE 198 Cb -0.16 -3.59 0.00 0.00 0.51 0.00 0.00 43.02 39.78 1o8b s PHE 198 CO 0.11 -0.90 0.00 0.00 0.70 0.00 0.00 175.22 175.13 1o8b n ALA 199 N 3.14 2.58 0.07 5.36 0.00 -1.26 -4.06 120.51 126.34 1o8b n ALA 199 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1o8b n ALA 199 Cb 0.41 0.41 0.32 0.00 0.00 0.00 0.00 19.45 20.59 1o8b n ALA 199 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1o8b h ASN 200 N 0.00 0.34 -3.36 0.00 2.35 -1.90 -3.37 115.58 109.64 1o8b h ASN 200 Ca 0.00 -0.08 -0.61 0.00 -0.55 0.00 0.00 56.30 55.06 1o8b h ASN 200 Cb 0.82 -0.09 -0.40 0.00 0.05 0.00 0.00 38.32 38.70 1o8b h ASN 200 CO 0.00 0.51 -0.74 -0.60 -1.65 0.00 0.00 177.43 174.95 1o8b s ARG 201 N -4.68 1.01 0.00 0.81 3.00 -1.26 -5.11 118.95 112.71 1o8b s ARG 201 Ca -0.06 -1.39 0.00 0.00 -1.00 0.00 0.00 55.73 53.28 1o8b s ARG 201 Cb 0.15 -2.45 0.00 0.00 0.00 0.00 0.00 34.95 32.65 1o8b s ARG 201 CO 0.75 -0.97 0.00 0.41 0.00 0.00 0.00 175.30 175.49 1o8b n GLY 202 N 4.61 3.12 3.81 8.12 0.00 -1.26 -4.66 105.19 118.94 1o8b n GLY 202 Ca 0.00 -2.00 -0.36 0.00 0.00 0.00 0.00 46.02 43.67 1o8b n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o8b s ALA 203 N -2.18 3.31 -0.12 4.61 0.00 -1.26 -4.74 121.76 121.38 1o8b s ALA 203 Ca 0.00 0.26 0.12 0.00 0.00 0.00 0.00 51.96 52.34 1o8b s ALA 203 Cb 0.00 -2.94 -0.24 0.00 0.00 0.00 0.00 23.12 19.94 1o8b s ALA 203 CO 0.00 0.27 0.36 -0.25 0.00 0.00 0.00 175.76 176.14 1o8b n ASP 204 N 0.40 0.75 -3.95 0.00 8.00 0.26 -4.91 116.55 117.10 1o8b n ASP 204 Ca 0.01 0.21 -0.15 0.00 0.71 0.00 0.00 54.79 55.56 1o8b n ASP 204 Cb 0.51 0.22 -0.14 0.00 -0.02 0.00 0.00 41.12 41.69 1o8b n ASP 204 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1o8b s VAL 205 N -2.55 0.36 -0.07 2.53 1.01 -0.86 -4.55 120.40 116.26 1o8b s VAL 205 Ca -0.10 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 61.68 1o8b s VAL 205 Cb 0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 36.38 36.13 1o8b s VAL 205 CO 0.81 0.07 -0.23 0.00 0.00 0.00 0.00 175.10 175.74 1o8b s ALA 206 N -0.19 2.03 -0.30 5.51 0.00 0.45 -0.83 121.76 128.44 1o8b s ALA 206 Ca 0.01 -0.93 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 1o8b s ALA 206 Cb -0.02 -0.70 0.03 0.00 0.00 0.00 0.00 23.12 22.42 1o8b s ALA 206 CO -0.00 0.33 0.05 -0.51 0.00 0.00 0.00 175.76 175.63 1o8b s LEU 207 N 0.13 3.88 -0.21 0.00 1.43 0.49 -0.93 118.68 123.47 1o8b s LEU 207 Ca -0.11 -0.94 -0.05 0.00 -1.03 0.00 0.00 54.13 52.00 1o8b s LEU 207 Cb -0.15 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 44.23 1o8b s LEU 207 CO 0.06 -0.23 -0.01 -0.63 0.23 0.00 0.00 176.35 175.77 1o8b s ILE 208 N 1.41 3.81 -0.26 -0.59 -1.09 0.24 -1.71 121.20 123.02 1o8b s ILE 208 Ca -0.00 -0.36 -0.25 0.00 -2.23 0.00 0.00 60.65 57.81 1o8b s ILE 208 Cb -0.18 -2.73 -0.00 0.00 -1.58 0.00 0.00 42.46 37.97 1o8b s ILE 208 CO 0.01 0.42 0.87 -0.83 -1.23 0.00 0.00 174.94 174.18 1o8b s GLY 209 N 1.16 1.72 0.22 6.18 0.00 0.04 -0.58 107.32 116.06 1o8b s GLY 209 Ca 0.03 -0.13 0.04 0.00 0.00 0.00 0.00 44.72 44.66 1o8b s GLY 209 CO 0.01 1.89 -0.03 -0.51 0.00 0.00 0.00 173.10 174.46 1o8b s THR 210 N 2.98 1.13 0.60 0.90 -4.23 -0.84 -1.34 115.64 114.83 1o8b s THR 210 Ca 0.37 -2.05 0.30 0.00 -1.18 0.00 0.00 61.69 59.12 1o8b s THR 210 Cb -0.15 -2.27 0.36 0.00 1.34 0.00 0.00 72.50 71.78 1o8b s THR 210 CO 0.08 -0.39 2.16 -0.65 -0.54 0.00 0.00 174.62 175.28 1o8b h PRO 211 N 2.50 0.00 -0.02 3.99 0.11 -2.01 -0.51 132.00 136.06 1o8b h PRO 211 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1o8b h PRO 211 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1o8b h PRO 211 CO 0.65 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.19 1o8b n ASP 212 N -3.76 1.45 0.00 -2.05 8.00 -1.26 -5.04 116.55 113.89 1o8b n ASP 212 Ca -0.00 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.01 1o8b n ASP 212 Cb 0.23 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 1o8b n ASP 212 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1o8b n GLY 213 N 1.17 0.69 3.70 0.44 0.00 -0.20 -5.01 105.19 105.97 1o8b n GLY 213 Ca 0.19 -2.29 -0.41 0.00 0.00 0.00 0.00 46.02 43.52 1o8b n GLY 213 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o8b s VAL 214 N -0.72 4.97 -0.19 1.61 1.01 -1.26 -1.99 120.40 123.83 1o8b s VAL 214 Ca 0.00 1.56 -0.12 0.00 0.00 0.00 0.00 61.98 63.43 1o8b s VAL 214 Cb 0.00 -4.10 -0.05 0.00 0.00 0.00 0.00 36.38 32.23 1o8b s VAL 214 CO 0.00 0.16 0.21 -0.75 0.00 0.00 0.00 175.10 174.72 1o8b s LYS 215 N 1.31 4.21 -0.23 2.72 2.20 0.25 -4.91 119.74 125.30 1o8b s LYS 215 Ca 0.39 -0.08 -0.09 0.00 -0.36 0.00 0.00 55.97 55.83 1o8b s LYS 215 Cb -0.18 -3.43 -0.04 0.00 -1.51 0.00 0.00 37.83 32.67 1o8b s LYS 215 CO 0.17 0.25 0.11 0.99 -0.36 0.00 0.00 175.35 176.51 1o8b s THR 216 N 0.47 4.87 -0.12 3.43 2.01 -1.26 -0.59 115.64 124.45 1o8b s THR 216 Ca 0.12 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.16 1o8b s THR 216 Cb -0.12 -3.26 0.00 0.00 0.01 0.00 0.00 72.50 69.14 1o8b s THR 216 CO 0.01 0.37 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.46 1o8b s ILE 217 N 1.06 2.16 -0.90 1.82 1.01 -0.11 -4.98 121.20 121.26 1o8b s ILE 217 Ca 0.05 -0.97 0.07 0.00 0.00 0.00 0.00 60.65 59.81 1o8b s ILE 217 Cb -0.14 -1.85 0.06 0.00 0.01 0.00 0.00 42.46 40.54 1o8b s ILE 217 CO 0.04 0.55 0.73 1.33 0.00 0.00 0.00 174.94 177.59