#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3non s VAL 3 N 0.00 3.78 -0.24 0.00 1.01 -0.80 -4.85 120.40 119.30 3non s VAL 3 Ca 0.00 0.94 -0.25 0.00 0.00 0.00 0.00 61.98 62.67 3non s VAL 3 Cb 0.00 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 3non s VAL 3 CO 0.00 -0.13 0.83 -1.10 0.00 0.00 0.00 175.10 174.70 3non s GLN 4 N 4.04 4.19 -0.12 2.72 -1.52 -1.26 -1.16 119.66 126.54 3non s GLN 4 Ca 0.68 0.95 0.02 0.00 -1.95 0.00 0.00 55.36 55.06 3non s GLN 4 Cb -0.29 -3.64 0.01 0.00 -0.22 0.00 0.00 33.01 28.88 3non s GLN 4 CO 0.26 -0.51 -0.17 0.42 -0.25 0.00 0.00 175.29 175.03 3non s ILE 5 N 2.82 1.67 -0.09 1.08 1.01 0.02 -0.89 121.20 126.83 3non s ILE 5 Ca 0.35 -0.74 0.03 0.00 0.00 0.00 0.00 60.65 60.28 3non s ILE 5 Cb -0.15 -1.52 0.01 0.00 0.01 0.00 0.00 42.46 40.81 3non s ILE 5 CO 0.07 0.48 -0.16 -0.83 0.00 0.00 0.00 174.94 174.50 3non s GLY 6 N 0.98 1.01 -0.16 6.18 0.00 -0.05 -0.37 107.32 114.91 3non s GLY 6 Ca -0.06 -0.65 -0.07 0.00 0.00 0.00 0.00 44.72 43.94 3non s GLY 6 CO -0.03 0.03 0.10 -1.36 0.00 0.00 0.00 173.10 171.84 3non s PHE 7 N 0.67 3.38 -0.15 1.90 0.08 -0.30 -0.37 117.98 123.20 3non s PHE 7 Ca -0.14 0.29 -0.29 0.00 0.12 0.00 0.00 56.93 56.91 3non s PHE 7 Cb -0.16 -2.03 -0.01 0.00 -0.57 0.00 0.00 43.02 40.25 3non s PHE 7 CO 0.04 0.39 1.18 -1.17 -0.10 0.00 0.00 175.22 175.56 3non s LEU 8 N -0.17 4.19 -0.35 -0.37 2.96 -0.67 -0.62 118.68 123.65 3non s LEU 8 Ca 0.09 1.65 -0.05 0.00 -0.22 0.00 0.00 54.13 55.59 3non s LEU 8 Cb -0.12 -3.54 0.06 0.00 0.50 0.00 0.00 46.19 43.08 3non s LEU 8 CO 0.01 -0.68 0.12 -0.22 -1.32 0.00 0.00 176.35 174.26 3non s LEU 9 N 3.02 4.47 0.16 -0.68 2.96 -0.04 -4.37 118.68 124.20 3non s LEU 9 Ca 0.52 -1.34 0.08 0.00 -0.22 0.00 0.00 54.13 53.17 3non s LEU 9 Cb -0.21 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 3non s LEU 9 CO 0.15 -0.37 -0.18 0.72 -1.32 0.00 0.00 176.35 175.35 3non s PHE 10 N 1.34 1.76 0.26 5.38 -0.12 -1.26 -4.38 117.98 120.96 3non s PHE 10 Ca -0.00 -0.48 -0.30 0.00 -0.05 0.00 0.00 56.93 56.09 3non s PHE 10 Cb -0.20 -0.88 -0.13 0.00 -0.63 0.00 0.00 43.02 41.17 3non s PHE 10 CO 0.01 0.30 1.32 -2.30 -0.05 0.00 0.00 175.22 174.50 3non n PRO 11 N 0.33 1.91 -1.61 1.99 -0.02 -1.26 -1.82 135.00 134.52 3non n PRO 11 Ca -0.13 0.68 -0.10 0.00 -2.02 0.00 0.00 63.50 61.92 3non n PRO 11 Cb 0.57 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 3non n PRO 11 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3non n GLU 12 N 1.54 -0.74 -1.81 -0.52 -0.58 -0.32 -4.15 120.64 114.05 3non n GLU 12 Ca 0.10 0.73 -0.37 0.00 -0.42 0.00 0.00 57.16 57.20 3non n GLU 12 Cb 0.32 -4.70 0.05 0.00 -0.57 0.00 0.00 31.44 26.54 3non n GLU 12 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3non s VAL 13 N -2.42 2.16 -0.69 2.62 0.11 -0.76 -1.15 120.40 120.28 3non s VAL 13 Ca 0.00 0.11 -0.26 0.00 -2.93 0.00 0.00 61.98 58.90 3non s VAL 13 Cb 0.00 -3.05 0.04 0.00 -1.53 0.00 0.00 36.38 31.84 3non s VAL 13 CO 0.00 -0.02 1.17 -1.58 -3.33 0.00 0.00 175.10 171.34 3non s GLN 14 N -3.21 3.23 0.37 1.54 2.00 0.16 -0.52 119.66 123.22 3non s GLN 14 Ca 0.78 -0.31 0.05 0.00 -2.00 0.00 0.00 55.36 53.88 3non s GLN 14 Cb -0.37 -4.16 0.71 0.00 0.80 0.00 0.00 33.01 29.99 3non s GLN 14 CO 0.41 -1.96 1.99 -0.56 -0.50 0.00 0.00 175.29 174.67 3non h GLN 15 N 9.80 0.64 0.00 1.67 -0.00 -1.92 -1.09 115.11 124.21 3non h GLN 15 Ca -0.28 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.65 58.29 3non h GLN 15 Cb 1.06 -0.13 -0.00 0.00 -0.00 0.00 0.00 27.48 28.40 3non h GLN 15 CO 1.23 0.48 -0.09 1.25 -0.00 0.00 0.00 178.83 181.70 3non h LEU 16 N 0.65 0.00 -1.93 0.06 5.85 -1.96 0.12 115.31 118.09 3non h LEU 16 Ca 0.17 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.92 3non h LEU 16 Cb 0.03 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3non h LEU 16 CO -0.03 0.09 0.13 0.44 -0.34 0.00 0.00 178.44 178.73 3non h ASP 17 N 0.00 0.08 0.00 1.25 5.19 -1.43 -1.77 116.42 119.73 3non h ASP 17 Ca -0.00 -0.00 -0.28 0.00 -0.62 0.00 0.00 57.03 56.13 3non h ASP 17 Cb 0.29 -0.02 -0.04 0.00 0.18 0.00 0.00 39.33 39.75 3non h ASP 17 CO 0.01 0.05 -1.66 -0.11 -3.12 0.00 0.00 179.24 174.41 3non n LEU 18 N -4.50 1.90 0.17 1.55 0.00 -0.16 -4.41 117.00 111.55 3non n LEU 18 Ca 0.01 0.40 0.02 0.00 0.00 0.00 0.00 56.01 56.44 3non n LEU 18 Cb 0.20 -0.88 0.28 0.00 0.00 0.00 0.00 43.42 43.03 3non n LEU 18 CO 0.35 0.26 0.62 0.71 0.00 0.00 0.00 177.39 179.33 3non h THR 19 N -1.00 1.20 0.85 1.96 1.35 -0.82 0.27 112.91 116.72 3non h THR 19 Ca -0.42 -1.69 -0.04 0.00 -0.55 0.00 0.00 66.41 63.71 3non h THR 19 Cb 1.31 1.95 0.01 0.00 -1.73 0.00 0.00 68.15 69.69 3non h THR 19 CO -0.25 0.46 -0.41 1.23 -0.25 0.00 0.00 175.52 176.30 3non h GLY 20 N 1.71 -1.19 1.16 5.82 0.00 -1.55 -2.16 103.07 106.86 3non h GLY 20 Ca -0.00 0.44 0.06 0.00 0.00 0.00 0.00 47.33 47.82 3non h GLY 20 CO 0.06 -0.43 0.42 -2.55 0.00 0.00 0.00 176.54 174.04 3non h PRO 21 N -1.27 0.64 -0.36 4.80 0.11 -1.73 -2.52 132.00 131.68 3non h PRO 21 Ca -0.12 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.95 3non h PRO 21 Cb 0.87 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.82 3non h PRO 21 CO 0.19 0.42 0.21 1.25 -0.21 0.00 0.00 178.00 179.87 3non h HIS 22 N 0.66 0.48 0.00 0.65 2.76 -0.84 0.46 115.15 119.31 3non h HIS 22 Ca 0.27 -0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.36 3non h HIS 22 Cb 0.23 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 3non h HIS 22 CO -0.00 0.35 -0.37 0.22 -1.30 0.00 0.00 177.93 176.84 3non h ASP 23 N 0.46 0.00 0.32 3.26 3.58 -1.09 0.82 116.42 123.77 3non h ASP 23 Ca 0.13 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.56 3non h ASP 23 Cb 0.02 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.08 3non h ASP 23 CO -0.02 0.37 -0.15 0.58 -2.88 0.00 0.00 179.24 177.13 3non h VAL 24 N 0.00 0.69 -0.04 2.25 2.07 -1.02 -3.28 116.25 116.91 3non h VAL 24 Ca -0.00 -0.53 -0.21 0.00 0.82 0.00 0.00 66.70 66.78 3non h VAL 24 Cb 0.90 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3non h VAL 24 CO 0.05 0.10 -0.85 -0.07 0.02 0.00 0.00 177.57 176.82 3non h LEU 25 N -0.73 0.55 -1.34 2.57 3.38 -0.75 -2.88 115.31 116.12 3non h LEU 25 Ca -0.04 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3non h LEU 25 Cb 0.49 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3non h LEU 25 CO 0.07 1.18 0.00 0.00 0.09 0.00 0.00 178.44 179.78 3non h ALA 26 N 0.80 1.00 0.00 1.53 0.00 -0.98 -1.99 119.26 119.62 3non h ALA 26 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3non h ALA 26 Cb 1.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3non h ALA 26 CO 0.15 0.00 0.00 0.43 0.00 0.00 0.00 179.25 179.83 3non n SER 27 N -2.47 0.39 -4.81 0.00 7.64 -1.09 -4.89 113.62 108.40 3non n SER 27 Ca 0.00 0.56 -0.36 0.00 1.01 0.00 0.00 58.87 60.08 3non n SER 27 Cb 0.15 -0.66 -0.06 0.00 -1.01 0.00 0.00 64.21 62.63 3non n SER 27 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3non s LEU 28 N -3.79 4.31 0.33 -3.43 1.43 -0.75 -5.00 118.68 111.78 3non s LEU 28 Ca 0.09 1.51 -0.28 0.00 -1.03 0.00 0.00 54.13 54.42 3non s LEU 28 Cb 0.13 -3.74 -0.09 0.00 0.03 0.00 0.00 46.19 42.51 3non s LEU 28 CO 0.45 -0.02 1.16 -2.16 0.23 0.00 0.00 176.35 176.01 3non s PRO 29 N -2.10 4.39 -1.47 1.29 0.04 -1.26 -3.53 135.00 132.34 3non s PRO 29 Ca 0.46 1.88 -0.02 0.00 0.04 0.00 0.00 61.00 63.36 3non s PRO 29 Cb -0.16 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.40 3non s PRO 29 CO 0.21 -0.04 0.31 -0.25 0.04 0.00 0.00 177.00 177.27 3non n ASP 30 N 0.71 -5.53 -4.60 6.66 8.00 -1.26 -4.90 116.55 115.63 3non n ASP 30 Ca 0.01 -0.16 -0.34 0.00 0.71 0.00 0.00 54.79 55.01 3non n ASP 30 Cb 0.45 -4.46 -0.10 0.00 -0.02 0.00 0.00 41.12 36.99 3non n ASP 30 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3non s VAL 31 N -3.03 4.33 -0.18 2.53 -7.23 -1.23 -1.91 120.40 113.68 3non s VAL 31 Ca 0.16 -0.21 -0.05 0.00 -1.81 0.00 0.00 61.98 60.07 3non s VAL 31 Cb -0.07 -2.89 -0.03 0.00 0.56 0.00 0.00 36.38 33.95 3non s VAL 31 CO 0.19 0.52 -0.00 -1.58 -0.31 0.00 0.00 175.10 173.92 3non s GLN 32 N -0.03 3.71 -0.12 4.82 0.74 -0.31 -4.94 119.66 123.53 3non s GLN 32 Ca 0.04 -0.48 0.01 0.00 0.05 0.00 0.00 55.36 54.97 3non s GLN 32 Cb -0.13 -3.03 -0.01 0.00 1.10 0.00 0.00 33.01 30.94 3non s GLN 32 CO 0.02 0.17 -0.17 0.08 -0.55 0.00 0.00 175.29 174.83 3non s VAL 33 N 0.59 2.68 -0.03 1.34 1.01 -1.26 -0.80 120.40 123.92 3non s VAL 33 Ca -0.01 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.21 3non s VAL 33 Cb -0.14 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 3non s VAL 33 CO 0.02 0.54 -0.13 -1.00 0.00 0.00 0.00 175.10 174.53 3non s HIS 34 N 0.33 2.75 -0.24 5.22 0.09 0.50 -4.99 115.29 118.95 3non s HIS 34 Ca -0.14 -0.12 -0.05 0.00 -0.00 0.00 0.00 55.06 54.75 3non s HIS 34 Cb -0.17 -1.62 -0.01 0.00 -0.00 0.00 0.00 32.58 30.79 3non s HIS 34 CO 0.07 0.24 0.00 -0.51 -0.00 0.00 0.00 174.74 174.55 3non s LEU 35 N -0.93 3.19 -0.15 0.89 1.02 -1.26 -1.15 118.68 120.29 3non s LEU 35 Ca 0.13 -0.41 -0.02 0.00 0.02 0.00 0.00 54.13 53.85 3non s LEU 35 Cb -0.11 -1.80 -0.02 0.00 0.02 0.00 0.00 46.19 44.28 3non s LEU 35 CO 0.02 -0.05 -0.09 -0.63 0.02 0.00 0.00 176.35 175.62 3non s ILE 36 N 1.51 3.38 0.00 -0.59 1.01 0.21 -0.12 121.20 126.60 3non s ILE 36 Ca 0.05 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.16 3non s ILE 36 Cb -0.15 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.86 3non s ILE 36 CO -0.01 0.50 0.00 1.87 0.00 0.00 0.00 174.94 177.31 3non n TRP 37 N 3.67 -0.19 0.21 3.97 -0.00 -0.75 -0.86 117.44 123.48 3non n TRP 37 Ca -0.18 0.00 0.07 0.00 -0.00 0.00 0.00 57.50 57.39 3non n TRP 37 Cb 0.52 0.00 0.46 0.00 -0.00 0.00 0.00 31.31 32.29 3non n TRP 37 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 177.69 178.56 3non h LYS 38 N 0.00 0.00 -3.62 5.87 1.57 -1.89 -2.02 116.57 116.48 3non h LYS 38 Ca 0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 3non h LYS 38 Cb 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.12 3non h LYS 38 CO 0.00 0.29 -0.47 -1.83 -0.57 0.00 0.00 179.45 176.87 3non s GLU 39 N -3.97 0.58 0.76 3.15 -1.05 -1.26 -4.32 118.70 112.59 3non s GLU 39 Ca -0.02 -0.59 -0.13 0.00 -0.15 0.00 0.00 54.97 54.08 3non s GLU 39 Cb 0.13 0.24 0.05 0.00 -0.44 0.00 0.00 34.13 34.11 3non s GLU 39 CO 0.67 -0.15 1.15 -1.25 0.95 0.00 0.00 175.26 176.63 3non s PRO 40 N -2.15 2.09 0.00 -4.83 0.04 -1.26 -4.63 135.00 124.25 3non s PRO 40 Ca -0.09 1.52 0.00 0.00 0.04 0.00 0.00 61.00 62.48 3non s PRO 40 Cb -0.03 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.65 3non s PRO 40 CO -0.02 -1.83 0.00 0.41 0.04 0.00 0.00 177.00 175.60 3non n GLY 41 N -0.15 0.77 3.77 0.56 0.00 -0.51 -4.92 105.19 104.71 3non n GLY 41 Ca 0.12 -2.15 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 3non n GLY 41 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3non s PRO 42 N -0.94 4.43 -0.06 1.61 0.04 -1.26 -0.75 135.00 138.07 3non s PRO 42 Ca 0.00 2.10 0.00 0.00 0.04 0.00 0.00 61.00 63.14 3non s PRO 42 Cb 0.00 -3.11 0.02 0.00 0.04 0.00 0.00 34.50 31.46 3non s PRO 42 CO 0.00 -0.09 -0.03 0.08 0.04 0.00 0.00 177.00 177.00 3non s VAL 43 N -1.09 0.51 -0.21 -0.36 1.01 0.23 -4.88 120.40 115.59 3non s VAL 43 Ca 0.48 -0.04 -0.13 0.00 0.00 0.00 0.00 61.98 62.28 3non s VAL 43 Cb -0.38 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 3non s VAL 43 CO 0.49 0.24 0.29 -0.69 0.00 0.00 0.00 175.10 175.43 3non s VAL 44 N 1.33 5.28 0.87 2.92 1.01 -1.26 -0.75 120.40 129.80 3non s VAL 44 Ca -0.04 0.47 -0.12 0.00 0.00 0.00 0.00 61.98 62.29 3non s VAL 44 Cb -0.13 -3.62 0.11 0.00 0.00 0.00 0.00 36.38 32.74 3non s VAL 44 CO -0.02 0.31 1.13 0.00 0.00 0.00 0.00 175.10 176.51 3non s ALA 45 N 1.08 1.99 0.54 5.51 0.00 -0.10 -1.18 121.76 129.60 3non s ALA 45 Ca 0.14 -0.44 0.28 0.00 0.00 0.00 0.00 51.96 51.94 3non s ALA 45 Cb -0.14 -3.05 1.68 0.00 0.00 0.00 0.00 23.12 21.61 3non s ALA 45 CO 0.06 -2.07 2.20 0.66 0.00 0.00 0.00 175.76 176.61 3non h SER 46 N -1.34 0.00 0.58 0.00 4.64 -0.97 -0.45 113.55 116.02 3non h SER 46 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3non h SER 46 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3non h SER 46 CO 0.62 0.04 -0.11 -1.54 -0.87 0.00 0.00 176.83 174.97 3non n SER 47 N -3.86 0.25 0.00 4.97 3.41 -1.26 -4.91 113.62 112.21 3non n SER 47 Ca -0.03 -0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 3non n SER 47 Cb 0.12 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 3non n SER 47 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3non n GLY 48 N 1.36 1.10 3.74 5.00 0.00 -0.18 -5.05 105.19 111.17 3non n GLY 48 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3non n GLY 48 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3non s LEU 49 N 0.00 4.37 -0.21 0.99 2.96 -1.26 -4.74 118.68 120.79 3non s LEU 49 Ca 0.00 2.78 -0.13 0.00 -0.22 0.00 0.00 54.13 56.56 3non s LEU 49 Cb 0.00 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.02 3non s LEU 49 CO 0.00 -0.82 0.28 -0.69 -1.32 0.00 0.00 176.35 173.80 3non s VAL 50 N 0.28 5.29 0.46 1.68 1.01 -1.26 -0.92 120.40 126.94 3non s VAL 50 Ca 0.64 0.46 0.06 0.00 0.00 0.00 0.00 61.98 63.14 3non s VAL 50 Cb -0.45 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.30 3non s VAL 50 CO 0.42 0.32 0.29 -0.76 0.00 0.00 0.00 175.10 175.37 3non s LEU 51 N 1.04 2.99 -0.16 3.92 1.43 0.07 -4.96 118.68 123.01 3non s LEU 51 Ca 0.14 -1.09 -0.02 0.00 -1.03 0.00 0.00 54.13 52.13 3non s LEU 51 Cb -0.14 -1.45 0.05 0.00 0.03 0.00 0.00 46.19 44.68 3non s LEU 51 CO 0.05 -0.78 -0.01 -1.58 0.23 0.00 0.00 176.35 174.27 3non s GLN 52 N -4.08 0.96 0.21 1.70 2.00 -1.26 -0.60 119.66 118.58 3non s GLN 52 Ca 0.38 -0.36 -0.30 0.00 -2.00 0.00 0.00 55.36 53.08 3non s GLN 52 Cb 0.00 -1.85 -0.09 0.00 0.80 0.00 0.00 33.01 31.87 3non s GLN 52 CO 0.22 -0.49 1.33 0.00 -0.50 0.00 0.00 175.29 175.85 3non s ALA 53 N 1.79 3.54 -0.46 1.58 0.00 0.07 -4.81 121.76 123.47 3non s ALA 53 Ca 0.01 1.15 0.23 0.00 0.00 0.00 0.00 51.96 53.34 3non s ALA 53 Cb -0.15 -3.50 -0.01 0.00 0.00 0.00 0.00 23.12 19.46 3non s ALA 53 CO -0.07 -0.57 0.96 0.25 0.00 0.00 0.00 175.76 176.33 3non n THR 54 N 2.60 0.24 -3.67 0.00 -2.24 0.83 -1.42 114.28 110.62 3non n THR 54 Ca 0.06 -0.34 -0.15 0.00 -2.27 0.00 0.00 64.05 61.36 3non n THR 54 Cb 0.42 0.06 -0.08 0.00 -2.10 0.00 0.00 70.33 68.64 3non n THR 54 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3non s THR 55 N -3.27 0.02 0.90 4.28 -1.32 -1.05 -4.84 115.64 110.35 3non s THR 55 Ca 0.01 -0.16 -0.12 0.00 -1.21 0.00 0.00 61.69 60.21 3non s THR 55 Cb 0.13 -0.77 0.13 0.00 -1.51 0.00 0.00 72.50 70.49 3non s THR 55 CO 0.81 -0.09 1.10 -0.94 -2.21 0.00 0.00 174.62 173.29 3non s SER 56 N -0.71 3.51 0.20 8.08 1.04 -1.25 -1.81 113.70 122.76 3non s SER 56 Ca -0.08 1.33 -0.11 0.00 0.48 0.00 0.00 55.95 57.57 3non s SER 56 Cb -0.03 -2.00 0.27 0.00 0.10 0.00 0.00 66.02 64.35 3non s SER 56 CO 0.05 -2.59 1.70 -0.26 0.98 0.00 0.00 173.24 173.11 3non h PHE 57 N -1.52 0.13 -0.70 5.02 0.04 -1.55 -2.53 116.94 115.83 3non h PHE 57 Ca -0.50 0.04 -0.03 0.00 2.80 0.00 0.00 57.97 60.27 3non h PHE 57 Cb 1.30 0.03 -0.03 0.00 2.20 0.00 0.00 35.95 39.44 3non h PHE 57 CO 0.39 -0.06 0.30 0.00 -0.60 0.00 0.00 178.31 178.34 3non h ALA 58 N 1.47 0.91 -0.00 2.45 0.00 -1.90 -2.43 119.26 119.75 3non h ALA 58 Ca 0.30 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3non h ALA 58 Cb 0.45 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3non h ALA 58 CO -0.41 0.51 -0.08 -0.25 0.00 0.00 0.00 179.25 179.01 3non n ASP 59 N -4.39 0.39 -4.70 0.00 8.00 -1.12 -4.85 116.55 109.87 3non n ASP 59 Ca 0.05 -0.56 -0.42 0.00 0.71 0.00 0.00 54.79 54.57 3non n ASP 59 Cb 0.16 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.13 3non n ASP 59 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3non n PRO 61 N 4.58 -0.92 -1.76 0.00 -0.02 -1.26 -4.92 135.00 130.71 3non n PRO 61 Ca 0.13 -0.21 -0.42 0.00 -2.02 0.00 0.00 63.50 60.98 3non n PRO 61 Cb 0.42 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.57 3non n PRO 61 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3non s PRO 62 N -4.52 4.15 0.01 0.52 0.04 -1.26 -4.93 135.00 129.00 3non s PRO 62 Ca 0.67 2.54 -0.17 0.00 0.04 0.00 0.00 61.00 64.07 3non s PRO 62 Cb -0.23 -3.58 -0.06 0.00 0.04 0.00 0.00 34.50 30.67 3non s PRO 62 CO 0.60 -0.82 0.49 -0.51 0.04 0.00 0.00 177.00 176.80 3non s LEU 63 N 2.68 4.46 0.20 -3.56 1.43 -1.26 -4.76 118.68 117.86 3non s LEU 63 Ca 0.79 1.06 0.14 0.00 -1.03 0.00 0.00 54.13 55.09 3non s LEU 63 Cb -0.45 -2.74 -0.03 0.00 0.03 0.00 0.00 46.19 43.01 3non s LEU 63 CO 0.35 0.24 1.28 0.44 0.23 0.00 0.00 176.35 178.89 3non h ASP 64 N 5.05 0.00 -3.44 2.29 3.32 -1.37 -3.37 116.42 118.90 3non h ASP 64 Ca -0.49 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.21 3non h ASP 64 Cb 1.21 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.41 3non h ASP 64 CO 0.65 0.62 -0.75 -0.69 -1.72 0.00 0.00 179.24 177.35 3non s VAL 65 N -2.90 0.12 -0.14 -1.35 1.01 -0.56 -1.52 120.40 115.06 3non s VAL 65 Ca 0.02 0.17 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 3non s VAL 65 Cb 0.08 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 36.19 3non s VAL 65 CO 0.77 0.16 -0.11 -0.51 0.00 0.00 0.00 175.10 175.41 3non s ILE 66 N 1.34 3.21 -0.12 2.22 1.10 -0.85 -0.87 121.20 127.23 3non s ILE 66 Ca -0.05 -0.60 0.01 0.00 -0.51 0.00 0.00 60.65 59.49 3non s ILE 66 Cb -0.13 -2.36 0.02 0.00 0.15 0.00 0.00 42.46 40.14 3non s ILE 66 CO -0.03 0.52 -0.12 0.00 -2.11 0.00 0.00 174.94 173.20 3non s ILE 68 N 1.36 5.13 0.94 0.00 -1.09 -0.39 -1.68 121.20 125.47 3non s ILE 68 Ca 0.00 -0.56 -0.14 0.00 -2.23 0.00 0.00 60.65 57.72 3non s ILE 68 Cb -0.14 -3.79 0.16 0.00 -1.58 0.00 0.00 42.46 37.12 3non s ILE 68 CO -0.06 -0.20 1.19 -2.16 -1.23 0.00 0.00 174.94 172.48 3non s PRO 69 N 1.67 0.87 0.00 2.79 0.04 -1.26 -1.49 135.00 137.62 3non s PRO 69 Ca 0.05 0.01 0.00 0.00 0.04 0.00 0.00 61.00 61.10 3non s PRO 69 Cb -0.18 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.52 3non s PRO 69 CO 0.09 -2.32 0.00 0.41 0.04 0.00 0.00 177.00 175.22 3non n GLY 70 N -2.72 3.55 0.00 0.56 0.00 -1.05 -3.41 105.19 102.12 3non n GLY 70 Ca 0.10 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 44.02 3non n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3non n GLY 71 N 5.00 0.95 0.34 -0.02 0.00 -1.26 -0.67 105.19 109.53 3non n GLY 71 Ca 0.00 -2.12 0.17 0.00 0.00 0.00 0.00 46.02 44.06 3non n GLY 71 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3non h THR 72 N 0.00 0.52 0.00 2.61 2.02 -1.83 -1.14 112.91 115.09 3non h THR 72 Ca 0.00 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.99 3non h THR 72 Cb 0.00 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.34 3non h THR 72 CO 0.00 0.10 0.00 0.61 0.37 0.00 0.00 175.52 176.60 3non n GLY 73 N -1.32 -0.82 0.37 2.16 0.00 -0.30 -2.93 105.19 102.35 3non n GLY 73 Ca 0.26 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.28 3non n GLY 73 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3non h VAL 74 N 0.00 1.06 -0.63 1.61 2.07 -1.47 -3.02 116.25 115.87 3non h VAL 74 Ca 0.00 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.19 3non h VAL 74 Cb 0.17 -0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 29.79 3non h VAL 74 CO 0.00 0.20 0.38 1.23 0.02 0.00 0.00 177.57 179.39 3non h GLY 75 N 1.07 0.90 0.96 2.17 0.00 -1.76 -1.26 103.07 105.16 3non h GLY 75 Ca 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 3non h GLY 75 CO -0.16 0.22 0.22 0.00 0.00 0.00 0.00 176.54 176.81 3non h ALA 76 N 1.29 0.59 -0.35 3.60 0.00 -1.78 -2.93 119.26 119.67 3non h ALA 76 Ca 0.26 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3non h ALA 76 Cb 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3non h ALA 76 CO -0.12 0.16 0.18 -0.07 0.00 0.00 0.00 179.25 179.39 3non h LEU 77 N 0.60 0.42 -0.99 0.00 3.38 -1.18 -2.04 115.31 115.50 3non h LEU 77 Ca 0.16 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3non h LEU 77 Cb 0.12 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3non h LEU 77 CO -0.02 0.36 0.00 0.23 0.09 0.00 0.00 178.44 179.10 3non n MET 78 N -4.43 0.16 -0.94 1.13 2.81 -0.57 -1.82 117.12 113.46 3non n MET 78 Ca 0.02 0.52 0.05 0.00 -1.81 0.00 0.00 57.70 56.48 3non n MET 78 Cb 0.11 -1.89 0.14 0.00 -0.71 0.00 0.00 33.22 30.87 3non n MET 78 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3non n GLU 79 N -2.21 1.04 -3.59 0.03 1.02 -0.79 -4.80 120.64 111.35 3non n GLU 79 Ca 0.00 -2.85 -0.40 0.00 -0.02 0.00 0.00 57.16 53.89 3non n GLU 79 Cb 0.13 -1.05 -0.09 0.00 -0.02 0.00 0.00 31.44 30.42 3non n GLU 79 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3non s ASP 80 N -2.80 5.65 0.47 1.62 -1.08 -0.75 -4.98 116.67 114.79 3non s ASP 80 Ca 0.37 -2.08 0.12 0.00 -0.52 0.00 0.00 52.55 50.44 3non s ASP 80 Cb 0.38 -1.98 1.08 0.00 -1.46 0.00 0.00 42.92 40.94 3non s ASP 80 CO -0.10 -0.63 2.09 -0.65 0.52 0.00 0.00 175.17 176.40 3non h PRO 81 N 8.20 0.26 0.07 4.34 0.11 -1.93 -1.17 132.00 141.89 3non h PRO 81 Ca -0.16 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.93 3non h PRO 81 Cb 1.05 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.11 3non h PRO 81 CO 0.82 0.17 -0.03 1.96 -0.21 0.00 0.00 178.00 180.71 3non h GLN 82 N 0.27 -0.09 -0.54 1.05 4.20 -1.96 -0.63 115.11 117.42 3non h GLN 82 Ca 0.09 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.84 3non h GLN 82 Cb 0.05 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 3non h GLN 82 CO -0.02 0.22 0.30 0.00 -0.67 0.00 0.00 178.83 178.66 3non h ALA 83 N 0.51 0.69 -0.61 3.87 0.00 -1.80 0.08 119.26 122.00 3non h ALA 83 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3non h ALA 83 Cb 0.35 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3non h ALA 83 CO 0.01 -0.01 0.13 -0.07 0.00 0.00 0.00 179.25 179.32 3non h LEU 84 N 0.59 0.94 -0.77 0.00 3.38 -1.20 -0.87 115.31 117.38 3non h LEU 84 Ca 0.23 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 3non h LEU 84 Cb 0.08 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3non h LEU 84 CO -0.13 0.94 -0.31 0.00 0.09 0.00 0.00 178.44 179.03 3non h ALA 85 N 1.03 0.95 -0.28 1.53 0.00 -0.84 -1.01 119.26 120.63 3non h ALA 85 Ca 0.19 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3non h ALA 85 Cb 0.38 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3non h ALA 85 CO 0.01 0.61 0.13 0.35 0.00 0.00 0.00 179.25 180.34 3non h PHE 86 N 0.49 0.41 -0.55 0.00 3.57 -0.72 0.32 116.94 120.47 3non h PHE 86 Ca 0.06 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.55 3non h PHE 86 Cb 0.79 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 3non h PHE 86 CO 0.03 0.39 0.36 0.82 -2.23 0.00 0.00 178.31 177.68 3non h ILE 87 N 0.32 1.12 -0.91 1.41 2.04 -0.92 -1.44 117.51 119.12 3non h ILE 87 Ca 0.10 -0.25 0.01 0.00 1.00 0.00 0.00 64.86 65.72 3non h ILE 87 Cb 0.14 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.51 3non h ILE 87 CO -0.01 0.13 0.60 0.03 0.00 0.00 0.00 178.15 178.90 3non h ARG 88 N 0.72 1.21 -0.17 2.37 3.08 -1.00 0.94 114.38 121.52 3non h ARG 88 Ca 0.21 -0.07 0.02 0.00 0.07 0.00 0.00 59.98 60.21 3non h ARG 88 Cb -0.06 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.70 3non h ARG 88 CO -0.06 0.80 0.02 0.37 -1.07 0.00 0.00 179.97 180.04 3non h GLN 89 N 1.24 0.09 -0.06 0.04 4.15 -0.33 -2.10 115.11 118.14 3non h GLN 89 Ca 0.33 -0.01 -0.21 0.00 0.77 0.00 0.00 58.65 59.54 3non h GLN 89 Cb -0.14 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.53 3non h GLN 89 CO -0.07 0.06 -0.83 1.96 -1.93 0.00 0.00 178.83 178.01 3non h GLN 90 N 0.09 0.51 0.00 1.69 1.08 -1.08 -3.24 115.11 114.16 3non h GLN 90 Ca 0.08 -0.47 -0.04 0.00 -1.45 0.00 0.00 58.65 56.77 3non h GLN 90 Cb 0.08 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.62 3non h GLN 90 CO -0.12 1.10 -0.17 0.00 -0.95 0.00 0.00 178.83 178.69 3non h ALA 91 N 0.75 1.15 -0.90 3.87 0.00 -0.65 -2.36 119.26 121.12 3non h ALA 91 Ca -0.06 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 54.84 3non h ALA 91 Cb 1.45 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 19.12 3non h ALA 91 CO 0.15 0.22 0.50 0.00 0.00 0.00 0.00 179.25 180.12 3non h ALA 92 N 1.83 1.37 0.00 0.00 0.00 -1.40 -3.18 119.26 117.87 3non h ALA 92 Ca -0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3non h ALA 92 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3non h ALA 92 CO 0.02 -0.01 0.00 0.54 0.00 0.00 0.00 179.25 179.80 3non n ARG 93 N -4.80 -0.73 -1.80 0.00 5.12 -1.18 -5.05 116.66 108.22 3non n ARG 93 Ca 0.18 -0.41 -0.40 0.00 -1.93 0.00 0.00 57.85 55.29 3non n ARG 93 Cb 0.43 -0.91 0.01 0.00 -1.16 0.00 0.00 32.46 30.83 3non n ARG 93 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3non s ALA 94 N -0.01 3.37 0.24 7.54 0.00 -0.89 -4.90 121.76 127.11 3non s ALA 94 Ca 0.00 1.50 -0.05 0.00 0.00 0.00 0.00 51.96 53.41 3non s ALA 94 Cb 0.00 -3.60 0.26 0.00 0.00 0.00 0.00 23.12 19.78 3non s ALA 94 CO 0.00 -1.14 1.82 -0.09 0.00 0.00 0.00 175.76 176.35 3non h ARG 95 N 2.59 1.09 -3.89 0.00 2.43 -1.54 -3.42 114.38 111.64 3non h ARG 95 Ca -0.51 -0.18 -0.40 0.00 -0.81 0.00 0.00 59.98 58.08 3non h ARG 95 Cb 1.26 -0.18 -0.35 0.00 -0.42 0.00 0.00 29.97 30.27 3non h ARG 95 CO 0.62 0.88 -0.76 0.71 -1.51 0.00 0.00 179.97 179.91 3non s TYR 96 N -5.51 0.62 -0.24 2.20 2.02 -0.58 -4.75 117.35 111.11 3non s TYR 96 Ca -0.12 -0.15 -0.06 0.00 -0.37 0.00 0.00 57.07 56.38 3non s TYR 96 Cb 0.16 -0.62 -0.02 0.00 -0.40 0.00 0.00 41.96 41.08 3non s TYR 96 CO 0.82 -0.20 0.02 0.08 -1.57 0.00 0.00 175.55 174.71 3non s VAL 97 N 1.12 3.87 0.09 0.71 1.01 -0.21 -2.01 120.40 124.98 3non s VAL 97 Ca -0.08 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 3non s VAL 97 Cb -0.14 -2.82 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 3non s VAL 97 CO -0.01 0.34 0.06 0.42 0.00 0.00 0.00 175.10 175.91 3non s THR 98 N 1.54 0.16 0.16 3.92 -4.23 0.00 -1.43 115.64 115.77 3non s THR 98 Ca 0.06 -1.67 -0.20 0.00 -1.18 0.00 0.00 61.69 58.69 3non s THR 98 Cb -0.15 -1.64 0.05 0.00 1.34 0.00 0.00 72.50 72.11 3non s THR 98 CO 0.01 -0.74 0.54 -0.94 -0.54 0.00 0.00 174.62 172.95 3non s SER 99 N -2.94 -0.43 -0.15 3.99 1.04 -1.05 -1.26 113.70 112.89 3non s SER 99 Ca 0.11 -0.16 0.14 0.00 0.48 0.00 0.00 55.95 56.53 3non s SER 99 Cb 0.07 0.57 0.37 0.00 0.10 0.00 0.00 66.02 67.13 3non s SER 99 CO -0.07 -0.96 1.19 0.52 0.98 0.00 0.00 173.24 174.90 3non n VAL 100 N -0.34 1.73 0.00 5.02 0.31 -0.56 -0.89 118.33 123.60 3non n VAL 100 Ca -0.15 -2.57 0.00 0.00 -0.01 0.00 0.00 64.34 61.60 3non n VAL 100 Cb 0.64 -0.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.54 3non n VAL 100 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3non n THR 102 N -0.91 0.00 0.21 2.52 -2.24 -1.26 -2.53 114.28 110.07 3non n THR 102 Ca 0.16 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 62.09 3non n THR 102 Cb 0.74 -0.30 0.79 0.00 -2.10 0.00 0.00 70.33 69.47 3non n THR 102 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3non h GLY 103 N 0.00 0.00 2.00 3.38 0.00 -1.71 -0.60 103.07 106.14 3non h GLY 103 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3non h GLY 103 CO 0.00 0.00 -0.15 1.48 0.00 0.00 0.00 176.54 177.87 3non h SER 104 N 0.00 0.00 0.38 0.19 4.64 -1.79 -1.52 113.55 115.44 3non h SER 104 Ca 0.07 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.32 3non h SER 104 Cb 0.35 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 3non h SER 104 CO -0.00 0.15 -0.36 -0.07 -0.87 0.00 0.00 176.83 175.68 3non h LEU 105 N 0.00 0.00 -0.12 5.97 3.38 -1.45 0.74 115.31 123.83 3non h LEU 105 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3non h LEU 105 Cb 0.48 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 3non h LEU 105 CO 0.02 0.36 -0.12 0.58 0.09 0.00 0.00 178.44 179.37 3non h VAL 106 N 0.00 1.36 -0.89 1.22 2.07 -1.34 -0.27 116.25 118.39 3non h VAL 106 Ca -0.00 -1.28 0.11 0.00 0.82 0.00 0.00 66.70 66.35 3non h VAL 106 Cb 0.65 1.94 -0.08 0.00 -1.52 0.00 0.00 31.29 32.28 3non h VAL 106 CO 0.05 0.37 0.53 -0.07 0.02 0.00 0.00 177.57 178.46 3non h LEU 107 N -0.11 0.76 0.02 2.57 3.38 -1.19 -0.62 115.31 120.12 3non h LEU 107 Ca 0.02 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3non h LEU 107 Cb 0.64 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 3non h LEU 107 CO 0.03 0.41 -0.02 1.23 0.09 0.00 0.00 178.44 180.18 3non h GLY 108 N 0.86 -0.04 1.98 0.83 0.00 -0.68 -1.27 103.07 104.75 3non h GLY 108 Ca 0.44 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.79 3non h GLY 108 CO -0.26 -0.03 -0.03 0.00 0.00 0.00 0.00 176.54 176.22 3non h ALA 109 N 0.92 1.91 0.00 3.60 0.00 -0.50 -0.88 119.26 124.32 3non h ALA 109 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3non h ALA 109 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3non h ALA 109 CO -0.01 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.31 3non n ALA 110 N -2.53 2.18 -0.58 0.00 0.00 -0.29 -4.90 120.51 114.40 3non n ALA 110 Ca -0.03 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.31 3non n ALA 110 Cb 0.13 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3non n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3non n GLY 111 N 0.78 0.73 0.54 0.00 0.00 -0.34 -4.92 105.19 102.00 3non n GLY 111 Ca 0.10 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.26 3non n GLY 111 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3non n LEU 112 N 0.00 1.70 -0.73 0.99 4.77 -0.51 -3.72 117.00 119.49 3non n LEU 112 Ca 0.00 -0.57 0.07 0.00 -0.03 0.00 0.00 56.01 55.48 3non n LEU 112 Cb 0.00 -0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.24 3non n LEU 112 CO 0.00 0.28 0.60 0.18 -1.33 0.00 0.00 177.39 177.13 3non n LEU 113 N 0.33 2.86 -4.64 2.23 4.77 -1.25 -4.90 117.00 116.39 3non n LEU 113 Ca 0.18 -1.69 -0.43 0.00 -0.03 0.00 0.00 56.01 54.05 3non n LEU 113 Cb 0.39 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 3non n LEU 113 CO 0.16 0.67 1.45 -1.10 -1.33 0.00 0.00 177.39 177.24 3non s GLN 114 N -1.06 3.91 -0.23 3.23 -0.21 -1.24 -1.23 119.66 122.83 3non s GLN 114 Ca 0.25 2.00 0.00 0.00 0.02 0.00 0.00 55.36 57.64 3non s GLN 114 Cb 0.14 -4.07 0.00 0.00 1.00 0.00 0.00 33.01 30.09 3non s GLN 114 CO 0.19 -1.17 0.00 0.41 -2.12 0.00 0.00 175.29 172.60 3non n GLY 115 N 4.56 0.52 3.75 3.09 0.00 0.08 -4.96 105.19 112.23 3non n GLY 115 Ca 0.19 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 3non n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3non s LYS 116 N -1.26 3.19 0.26 1.61 -0.14 -0.36 -4.76 119.74 118.28 3non s LYS 116 Ca 0.00 -0.30 -0.30 0.00 -1.36 0.00 0.00 55.97 54.01 3non s LYS 116 Cb 0.00 -2.96 -0.10 0.00 -1.68 0.00 0.00 37.83 33.10 3non s LYS 116 CO 0.00 0.71 1.39 1.03 -0.76 0.00 0.00 175.35 177.72 3non s ARG 117 N -0.87 4.30 0.14 1.68 0.52 -1.26 -0.38 118.95 123.08 3non s ARG 117 Ca 0.13 2.25 -0.24 0.00 -0.52 0.00 0.00 55.73 57.35 3non s ARG 117 Cb -0.12 -3.11 0.07 0.00 0.52 0.00 0.00 34.95 32.31 3non s ARG 117 CO 0.03 -0.35 0.61 0.00 0.02 0.00 0.00 175.30 175.60 3non s ALA 118 N -0.21 -1.61 0.44 2.13 0.00 -0.85 -4.60 121.76 117.05 3non s ALA 118 Ca 0.57 0.58 0.03 0.00 0.00 0.00 0.00 51.96 53.14 3non s ALA 118 Cb -0.41 0.78 -0.03 0.00 0.00 0.00 0.00 23.12 23.47 3non s ALA 118 CO 0.44 -0.72 0.07 -0.08 0.00 0.00 0.00 175.76 175.47 3non s THR 119 N -3.45 0.98 0.17 0.00 -1.32 -1.26 -1.14 115.64 109.61 3non s THR 119 Ca -0.00 -2.00 -0.08 0.00 -1.21 0.00 0.00 61.69 58.40 3non s THR 119 Cb -0.01 -2.38 0.03 0.00 -1.51 0.00 0.00 72.50 68.63 3non s THR 119 CO -0.10 0.00 0.42 1.07 -2.21 0.00 0.00 174.62 173.80 3non n THR 120 N -1.02 0.00 -1.68 5.08 5.66 -1.26 -4.71 114.28 116.34 3non n THR 120 Ca -0.10 -0.43 -0.44 0.00 -3.05 0.00 0.00 64.05 60.03 3non n THR 120 Cb 0.66 0.46 -0.02 0.00 -1.55 0.00 0.00 70.33 69.88 3non n THR 120 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 3non n HIS 121 N -0.29 2.25 -0.20 1.09 -0.00 -1.26 -3.89 115.22 112.92 3non n HIS 121 Ca -0.03 0.46 0.17 0.00 -0.00 0.00 0.00 57.72 58.31 3non n HIS 121 Cb 0.29 -2.45 0.51 0.00 -0.00 0.00 0.00 29.99 28.33 3non n HIS 121 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.34 176.45 3non h TRP 122 N 3.69 0.51 0.00 1.57 5.08 -1.96 -0.96 115.95 123.88 3non h TRP 122 Ca -0.45 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.53 3non h TRP 122 Cb 1.27 -0.16 0.00 0.00 -3.00 0.00 0.00 29.16 27.28 3non h TRP 122 CO 0.55 0.17 0.00 0.00 -1.28 0.00 0.00 178.44 177.87 3non h ALA 123 N 1.63 1.00 -0.05 0.11 0.00 -2.02 -3.10 119.26 116.83 3non h ALA 123 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3non h ALA 123 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3non h ALA 123 CO -0.14 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.77 3non n TYR 124 N -2.38 0.07 0.19 0.00 4.01 -0.40 -4.79 117.16 113.85 3non n TYR 124 Ca 0.03 -0.31 0.08 0.00 -0.16 0.00 0.00 57.90 57.55 3non n TYR 124 Cb 0.33 -0.03 0.60 0.00 -0.31 0.00 0.00 39.34 39.93 3non n TYR 124 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3non h HIS 125 N 0.50 0.11 0.00 -0.72 2.76 -1.37 -0.21 115.15 116.21 3non h HIS 125 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3non h HIS 125 Cb 0.38 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.30 3non h HIS 125 CO 0.03 0.07 0.00 -0.85 -1.30 0.00 0.00 177.93 175.88 3non n GLU 126 N -4.52 0.14 0.00 5.26 0.28 -1.26 -2.08 120.64 118.47 3non n GLU 126 Ca -0.01 0.57 0.13 0.00 -0.16 0.00 0.00 57.16 57.70 3non n GLU 126 Cb 0.11 -1.90 0.45 0.00 1.43 0.00 0.00 31.44 31.53 3non n GLU 126 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3non n LEU 127 N -2.19 0.42 -0.01 -1.84 4.77 -0.09 -4.12 117.00 113.93 3non n LEU 127 Ca -0.00 0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 55.95 3non n LEU 127 Cb 0.08 -0.28 -0.09 0.00 -2.33 0.00 0.00 43.42 40.80 3non n LEU 127 CO 0.11 0.09 0.67 -0.07 -1.33 0.00 0.00 177.39 176.87 3non h LEU 128 N 0.27 0.06 -0.50 2.23 3.38 -1.60 -3.27 115.31 115.89 3non h LEU 128 Ca 0.00 -0.41 0.04 0.00 0.09 0.00 0.00 57.88 57.60 3non h LEU 128 Cb 0.46 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 3non h LEU 128 CO 0.00 0.46 0.26 0.00 0.09 0.00 0.00 178.44 179.25 3non h ALA 129 N 0.60 0.64 0.00 1.53 0.00 -1.72 -1.32 119.26 119.00 3non h ALA 129 Ca 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3non h ALA 129 Cb 0.44 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3non h ALA 129 CO 0.00 -0.07 -0.01 -1.00 0.00 0.00 0.00 179.25 178.17 3non h PRO 130 N 0.52 0.00 -0.12 0.00 0.13 -1.78 0.04 132.00 130.78 3non h PRO 130 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 3non h PRO 130 Cb 0.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.24 3non h PRO 130 CO -0.14 0.01 0.00 1.28 -0.23 0.00 0.00 178.00 178.92 3non n LEU 131 N -3.39 1.34 0.00 1.56 4.77 -0.54 -4.73 117.00 116.01 3non n LEU 131 Ca -0.03 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 3non n LEU 131 Cb 0.11 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3non n LEU 131 CO 0.24 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 3non n GLY 132 N 1.07 0.31 3.81 -0.72 0.00 -0.00 -4.35 105.19 105.31 3non n GLY 132 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 3non n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3non s ALA 133 N -2.00 2.79 -0.57 4.61 0.00 -0.94 -0.74 121.76 124.90 3non s ALA 133 Ca 0.00 0.35 -0.22 0.00 0.00 0.00 0.00 51.96 52.08 3non s ALA 133 Cb 0.00 -3.21 0.05 0.00 0.00 0.00 0.00 23.12 19.96 3non s ALA 133 CO 0.00 -0.74 0.87 0.42 0.00 0.00 0.00 175.76 176.31 3non s ILE 134 N -2.50 4.49 0.31 0.00 1.01 0.49 -4.08 121.20 120.92 3non s ILE 134 Ca 0.63 -0.09 -0.29 0.00 0.00 0.00 0.00 60.65 60.90 3non s ILE 134 Cb -0.15 -4.52 -0.10 0.00 0.01 0.00 0.00 42.46 37.70 3non s ILE 134 CO 0.37 -1.13 1.38 -2.16 0.00 0.00 0.00 174.94 173.39 3non s PRO 135 N 3.65 4.29 -0.08 2.79 0.04 -1.26 -2.00 135.00 142.43 3non s PRO 135 Ca 0.24 2.29 0.01 0.00 0.04 0.00 0.00 61.00 63.59 3non s PRO 135 Cb -0.15 -3.07 0.02 0.00 0.04 0.00 0.00 34.50 31.33 3non s PRO 135 CO 0.15 -0.31 -0.09 0.08 0.04 0.00 0.00 177.00 176.86 3non s VAL 136 N -0.76 1.00 -1.21 -0.36 1.01 -0.29 -4.85 120.40 114.93 3non s VAL 136 Ca 0.53 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 62.09 3non s VAL 136 Cb -0.41 -0.96 0.21 0.00 0.00 0.00 0.00 36.38 35.21 3non s VAL 136 CO 0.51 0.34 1.89 1.41 0.00 0.00 0.00 175.10 179.25 3non n HIS 137 N 4.24 2.65 -4.34 5.22 8.25 -1.26 -4.26 115.22 125.72 3non n HIS 137 Ca -0.19 -2.71 -0.17 0.00 -0.26 0.00 0.00 57.72 54.38 3non n HIS 137 Cb 0.51 -1.66 -0.10 0.00 1.12 0.00 0.00 29.99 29.85 3non n HIS 137 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3non s GLU 138 N -1.29 1.33 0.14 -0.41 2.02 -1.26 -5.08 118.70 114.15 3non s GLU 138 Ca 0.41 -1.65 0.01 0.00 0.02 0.00 0.00 54.97 53.75 3non s GLU 138 Cb 0.12 -0.75 -0.08 0.00 0.10 0.00 0.00 34.13 33.52 3non s GLU 138 CO -0.01 -0.03 1.32 -0.09 0.02 0.00 0.00 175.26 176.48 3non h ARG 139 N 2.49 0.21 -3.69 1.61 2.43 -1.93 -3.42 114.38 112.07 3non h ARG 139 Ca -0.38 -0.26 -0.38 0.00 -0.81 0.00 0.00 59.98 58.15 3non h ARG 139 Cb 1.22 0.08 -0.36 0.00 -0.42 0.00 0.00 29.97 30.49 3non h ARG 139 CO 0.65 1.01 -0.75 0.08 -1.51 0.00 0.00 179.97 179.45 3non s VAL 140 N -3.08 0.23 -0.11 0.20 1.01 -1.26 -0.47 120.40 116.92 3non s VAL 140 Ca -0.03 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.08 3non s VAL 140 Cb 0.09 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 36.14 3non s VAL 140 CO 0.84 0.19 -0.13 -0.69 0.00 0.00 0.00 175.10 175.30 3non s VAL 141 N 1.40 1.38 -0.10 2.92 1.01 0.05 -4.99 120.40 122.07 3non s VAL 141 Ca -0.04 -0.56 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3non s VAL 141 Cb -0.13 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 3non s VAL 141 CO -0.03 0.42 -0.05 -0.60 0.00 0.00 0.00 175.10 174.84 3non s ARG 142 N 1.12 3.13 -0.30 2.72 6.06 -1.26 -1.10 118.95 129.33 3non s ARG 142 Ca -0.04 -0.53 -0.02 0.00 -2.50 0.00 0.00 55.73 52.63 3non s ARG 142 Cb -0.14 -2.73 0.12 0.00 0.06 0.00 0.00 34.95 32.25 3non s ARG 142 CO -0.03 0.50 0.19 0.34 -2.50 0.00 0.00 175.30 173.80 3non s ASP 143 N -0.35 2.91 1.99 -2.12 -1.08 0.09 -4.94 116.67 113.17 3non s ASP 143 Ca 0.05 -1.23 0.00 0.00 -0.52 0.00 0.00 52.55 50.85 3non s ASP 143 Cb -0.12 -0.09 0.00 0.00 -1.46 0.00 0.00 42.92 41.25 3non s ASP 143 CO 0.02 -0.41 0.00 0.61 0.52 0.00 0.00 175.17 175.91 3non n GLY 144 N 5.13 3.99 1.33 2.66 0.00 -1.26 -1.33 105.19 115.71 3non n GLY 144 Ca -0.03 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3non n GLY 144 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3non n ASN 145 N 7.05 3.90 -4.74 1.61 6.94 -1.26 -4.83 115.26 123.92 3non n ASN 145 Ca 0.00 -2.30 -0.38 0.00 -0.02 0.00 0.00 54.58 51.88 3non n ASN 145 Cb 0.00 -0.50 -0.06 0.00 -2.36 0.00 0.00 39.78 36.86 3non n ASN 145 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3non s LEU 146 N -1.50 4.31 -0.15 -4.53 2.96 -0.44 -1.05 118.68 118.29 3non s LEU 146 Ca 0.42 0.84 -0.04 0.00 -0.22 0.00 0.00 54.13 55.13 3non s LEU 146 Cb 0.26 -2.67 0.05 0.00 0.50 0.00 0.00 46.19 44.34 3non s LEU 146 CO 0.22 0.06 0.07 -0.22 -1.32 0.00 0.00 176.35 175.16 3non s LEU 147 N 0.31 0.45 -0.06 -0.68 2.96 -0.51 -0.73 118.68 120.42 3non s LEU 147 Ca 0.25 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.71 3non s LEU 147 Cb -0.15 -0.29 -0.02 0.00 0.50 0.00 0.00 46.19 46.22 3non s LEU 147 CO 0.11 -0.32 -0.15 0.42 -1.32 0.00 0.00 176.35 175.09 3non s THR 148 N 2.09 2.96 0.18 3.68 -4.23 -0.26 -2.53 115.64 117.54 3non s THR 148 Ca 0.02 -0.75 0.05 0.00 -1.18 0.00 0.00 61.69 59.83 3non s THR 148 Cb -0.15 -2.16 -0.04 0.00 1.34 0.00 0.00 72.50 71.49 3non s THR 148 CO -0.08 0.58 0.15 -0.83 -0.54 0.00 0.00 174.62 173.91 3non s GLY 149 N -0.58 1.66 0.00 3.99 0.00 -0.07 -0.77 107.32 111.55 3non s GLY 149 Ca 0.08 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.56 3non s GLY 149 CO 0.01 -1.26 0.00 0.61 0.00 0.00 0.00 173.10 172.46 3non n GLY 150 N -0.50 -1.40 3.76 0.20 0.00 0.38 -4.24 105.19 103.40 3non n GLY 150 Ca -0.08 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.10 3non n GLY 150 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3non s GLY 151 N -0.90 2.65 0.00 -0.02 0.00 -1.25 -4.47 107.32 103.33 3non s GLY 151 Ca 0.00 0.92 0.00 0.00 0.00 0.00 0.00 44.72 45.64 3non s GLY 151 CO 0.00 1.30 0.00 1.39 0.00 0.00 0.00 173.10 175.79 3non n ILE 152 N -1.63 0.00 0.29 0.90 5.41 -1.26 -0.13 119.36 122.93 3non n ILE 152 Ca 0.13 0.00 0.10 0.00 1.00 0.00 0.00 62.75 63.98 3non n ILE 152 Cb 0.50 0.00 0.46 0.00 -0.71 0.00 0.00 39.64 39.90 3non n ILE 152 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3non n THR 153 N 0.00 1.03 0.25 1.39 -2.24 -1.26 -1.52 114.28 111.93 3non n THR 153 Ca 0.00 0.44 0.18 0.00 -2.27 0.00 0.00 64.05 62.40 3non n THR 153 Cb 0.00 -1.38 0.89 0.00 -2.10 0.00 0.00 70.33 67.74 3non n THR 153 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3non h ALA 154 N 2.17 1.61 -0.95 6.98 0.00 -0.75 -2.13 119.26 126.19 3non h ALA 154 Ca 0.00 -0.00 0.25 0.00 0.00 0.00 0.00 54.91 55.16 3non h ALA 154 Cb 0.19 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 3non h ALA 154 CO 0.00 -0.24 0.66 0.78 0.00 0.00 0.00 179.25 180.45 3non h GLY 155 N 0.00 0.44 0.78 0.00 0.00 -1.49 0.19 103.07 103.00 3non h GLY 155 Ca 0.06 -0.09 -0.08 0.00 0.00 0.00 0.00 47.33 47.22 3non h GLY 155 CO -0.00 -0.02 -0.22 -2.22 0.00 0.00 0.00 176.54 174.08 3non h ILE 156 N 0.18 1.35 -0.19 2.60 2.04 -1.64 -0.11 117.51 121.74 3non h ILE 156 Ca 0.48 -1.43 -0.00 0.00 1.00 0.00 0.00 64.86 64.91 3non h ILE 156 Cb 1.58 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 39.56 3non h ILE 156 CO -0.10 0.43 0.11 0.44 0.00 0.00 0.00 178.15 179.02 3non h ASP 157 N 0.05 0.24 -0.57 1.72 3.32 -1.55 -1.89 116.42 117.74 3non h ASP 157 Ca 0.02 -0.07 0.07 0.00 0.02 0.00 0.00 57.03 57.07 3non h ASP 157 Cb 0.78 -0.06 -0.10 0.00 0.22 0.00 0.00 39.33 40.17 3non h ASP 157 CO 0.05 0.24 -0.52 0.15 -1.72 0.00 0.00 179.24 177.44 3non h PHE 158 N 0.22 -1.57 -0.22 4.55 3.57 -0.97 -1.75 116.94 120.76 3non h PHE 158 Ca 0.07 0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.56 3non h PHE 158 Cb 0.05 0.76 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 3non h PHE 158 CO -0.04 -0.45 -0.28 0.00 -2.23 0.00 0.00 178.31 175.31 3non h ALA 159 N 0.31 1.13 -0.14 2.41 0.00 -0.66 0.09 119.26 122.40 3non h ALA 159 Ca 0.13 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 3non h ALA 159 Cb 0.56 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3non h ALA 159 CO -0.69 0.55 -0.50 -0.07 0.00 0.00 0.00 179.25 178.54 3non h LEU 160 N 0.37 0.41 -0.01 0.00 3.38 -1.17 0.54 115.31 118.83 3non h LEU 160 Ca 0.05 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 3non h LEU 160 Cb 0.68 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 3non h LEU 160 CO 0.05 0.84 0.00 0.74 0.09 0.00 0.00 178.44 180.17 3non h THR 161 N 0.30 1.06 -0.81 0.22 2.02 -0.35 -2.19 112.91 113.16 3non h THR 161 Ca 0.01 -0.18 0.04 0.00 0.77 0.00 0.00 66.41 67.05 3non h THR 161 Cb 0.99 1.17 -0.05 0.00 -1.74 0.00 0.00 68.15 68.52 3non h THR 161 CO 0.09 0.05 0.51 0.25 0.37 0.00 0.00 175.52 176.79 3non h LEU 162 N -0.07 0.84 -0.89 2.58 5.85 -0.84 -1.72 115.31 121.06 3non h LEU 162 Ca 0.00 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.75 3non h LEU 162 Cb 0.08 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 3non h LEU 162 CO -0.00 0.57 0.58 0.00 -0.34 0.00 0.00 178.44 179.25 3non h ALA 163 N 1.35 1.17 -0.32 1.25 0.00 -0.63 0.54 119.26 122.61 3non h ALA 163 Ca 0.33 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 3non h ALA 163 Cb 0.05 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3non h ALA 163 CO -0.13 0.45 -0.15 0.00 0.00 0.00 0.00 179.25 179.42 3non h ALA 164 N 1.36 1.13 -0.44 0.00 0.00 -0.83 -0.82 119.26 119.66 3non h ALA 164 Ca 0.35 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3non h ALA 164 Cb -0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3non h ALA 164 CO -0.11 0.54 -0.02 1.49 0.00 0.00 0.00 179.25 181.15 3non h GLU 165 N 0.52 0.74 0.12 0.00 4.57 -0.32 -2.61 114.58 117.60 3non h GLU 165 Ca 0.09 -0.20 -0.30 0.00 -1.18 0.00 0.00 59.36 57.77 3non h GLU 165 Cb 0.57 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 29.07 3non h GLU 165 CO 0.04 0.77 -1.46 -0.07 -1.18 0.00 0.00 179.01 177.11 3non h LEU 166 N 0.69 0.39 0.00 1.64 3.38 -0.81 -3.46 115.31 117.15 3non h LEU 166 Ca 0.13 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3non h LEU 166 Cb 0.46 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3non h LEU 166 CO 0.02 1.42 0.00 0.49 0.09 0.00 0.00 178.44 180.46 3non n PHE 167 N -3.47 0.00 -3.77 1.13 3.72 -0.33 -5.10 117.46 109.64 3non n PHE 167 Ca -0.14 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.23 3non n PHE 167 Cb 1.04 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.57 3non n PHE 167 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 3non s ASP 168 N 0.73 -0.12 0.20 4.37 1.47 -0.99 -4.96 116.67 117.37 3non s ASP 168 Ca 0.00 -0.46 -0.11 0.00 1.18 0.00 0.00 52.55 53.16 3non s ASP 168 Cb 0.00 0.47 0.23 0.00 -0.34 0.00 0.00 42.92 43.28 3non s ASP 168 CO 0.00 -0.89 1.75 0.00 0.68 0.00 0.00 175.17 176.71 3non h ALA 169 N 2.00 0.72 -0.56 2.11 0.00 -1.91 -2.22 119.26 119.40 3non h ALA 169 Ca -0.25 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3non h ALA 169 Cb 1.23 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 3non h ALA 169 CO 0.28 -0.18 0.24 0.00 0.00 0.00 0.00 179.25 179.60 3non h ALA 170 N 1.37 1.37 -0.17 0.00 0.00 -1.96 0.98 119.26 120.86 3non h ALA 170 Ca 0.28 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3non h ALA 170 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3non h ALA 170 CO -0.26 0.48 -0.00 1.15 0.00 0.00 0.00 179.25 180.62 3non h THR 171 N 0.80 1.25 -0.76 0.00 2.02 -1.84 -0.17 112.91 114.21 3non h THR 171 Ca 0.19 -0.85 0.02 0.00 0.77 0.00 0.00 66.41 66.54 3non h THR 171 Cb 0.13 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 67.99 3non h THR 171 CO -0.02 0.25 0.50 0.00 0.37 0.00 0.00 175.52 176.62 3non h ALA 172 N 0.77 0.98 -0.84 6.16 0.00 -0.82 -2.17 119.26 123.33 3non h ALA 172 Ca 0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3non h ALA 172 Cb 0.38 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3non h ALA 172 CO 0.01 0.35 0.43 1.96 0.00 0.00 0.00 179.25 181.99 3non h GLN 173 N 1.00 1.19 -0.43 0.00 4.20 -0.59 0.14 115.11 120.62 3non h GLN 173 Ca 0.29 -0.16 0.03 0.00 0.06 0.00 0.00 58.65 58.87 3non h GLN 173 Cb -0.07 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.45 3non h GLN 173 CO -0.08 0.90 0.22 -0.09 -0.67 0.00 0.00 178.83 179.11 3non h ARG 174 N 1.18 0.44 -0.54 1.46 2.43 -0.64 -0.78 114.38 117.93 3non h ARG 174 Ca 0.29 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.33 3non h ARG 174 Cb 0.08 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 3non h ARG 174 CO -0.04 0.29 -0.09 0.28 -1.51 0.00 0.00 179.97 178.90 3non h VAL 175 N 0.45 1.27 -0.87 0.20 2.07 -1.07 -1.75 116.25 116.55 3non h VAL 175 Ca 0.18 -1.24 0.04 0.00 0.82 0.00 0.00 66.70 66.51 3non h VAL 175 Cb 0.07 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 30.73 3non h VAL 175 CO -0.12 0.44 0.55 -0.61 0.02 0.00 0.00 177.57 177.85 3non h GLN 176 N 0.90 1.02 -0.40 1.57 4.15 -0.53 -1.23 115.11 120.60 3non h GLN 176 Ca 0.14 -0.06 -0.14 0.00 0.77 0.00 0.00 58.65 59.36 3non h GLN 176 Cb 0.65 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 3non h GLN 176 CO 0.04 0.68 -0.31 1.25 -1.93 0.00 0.00 178.83 178.57 3non h LEU 177 N 1.05 0.96 -1.34 -2.39 5.85 -0.88 -1.00 115.31 117.56 3non h LEU 177 Ca 0.36 -0.44 -0.07 0.00 0.84 0.00 0.00 57.88 58.57 3non h LEU 177 Cb 0.06 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 3non h LEU 177 CO -0.14 1.20 -0.32 -0.61 -0.34 0.00 0.00 178.44 178.22 3non h GLN 178 N 0.72 0.00 -0.01 1.25 5.75 -0.83 -1.18 115.11 120.82 3non h GLN 178 Ca 0.07 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 3non h GLN 178 Cb 0.89 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.44 3non h GLN 178 CO 0.08 0.32 -0.04 1.28 -2.65 0.00 0.00 178.83 177.83 3non n LEU 179 N -4.01 0.83 -4.21 -2.39 4.77 -0.51 -4.93 117.00 106.56 3non n LEU 179 Ca -0.02 -0.24 -0.31 0.00 -0.03 0.00 0.00 56.01 55.41 3non n LEU 179 Cb 0.38 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.37 3non n LEU 179 CO 0.37 0.14 -0.29 1.21 -1.33 0.00 0.00 177.39 177.50 3non n GLU 180 N -0.44 -2.07 -2.60 3.23 2.13 -0.45 -4.81 120.64 115.64 3non n GLU 180 Ca 0.19 0.25 -0.43 0.00 0.66 0.00 0.00 57.16 57.83 3non n GLU 180 Cb 0.27 -4.28 0.00 0.00 0.27 0.00 0.00 31.44 27.70 3non n GLU 180 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 3non n TYR 181 N -4.43 4.23 -3.58 4.31 9.36 -0.48 -4.68 117.16 121.89 3non n TYR 181 Ca -0.21 -3.07 -0.27 0.00 3.32 0.00 0.00 57.90 57.67 3non n TYR 181 Cb 0.63 -2.24 -0.10 0.00 -0.63 0.00 0.00 39.34 37.00 3non n TYR 181 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3non n ALA 182 N 5.71 3.56 -1.76 2.98 0.00 -1.26 -4.97 120.51 124.77 3non n ALA 182 Ca 0.41 -4.41 -0.38 0.00 0.00 0.00 0.00 53.44 49.07 3non n ALA 182 Cb 0.41 -0.93 0.02 0.00 0.00 0.00 0.00 19.45 18.95 3non n ALA 182 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3non s PRO 183 N -1.75 3.35 -0.41 0.00 0.04 -1.26 -4.97 135.00 130.00 3non s PRO 183 Ca 0.33 2.02 0.06 0.00 0.04 0.00 0.00 61.00 63.45 3non s PRO 183 Cb 0.07 -2.27 0.21 0.00 0.04 0.00 0.00 34.50 32.55 3non s PRO 183 CO -0.10 -0.96 0.46 0.00 0.04 0.00 0.00 177.00 176.44 3non n ALA 184 N -0.89 2.34 -1.78 8.56 0.00 -1.26 -5.12 120.51 122.35 3non n ALA 184 Ca 0.10 -3.12 -0.41 0.00 0.00 0.00 0.00 53.44 50.01 3non n ALA 184 Cb 0.47 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 19.08 3non n ALA 184 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3non s PRO 185 N -0.50 4.17 0.00 0.00 0.02 -1.26 -4.88 135.00 132.55 3non s PRO 185 Ca 0.34 2.48 0.22 0.00 0.02 0.00 0.00 61.00 64.06 3non s PRO 185 Cb 0.11 -3.01 0.96 0.00 0.02 0.00 0.00 34.50 32.58 3non s PRO 185 CO -0.15 -0.47 1.70 -0.35 -0.33 0.00 0.00 177.00 177.40 3non n PRO 186 N 0.90 0.04 -4.25 5.54 -0.04 -1.26 -4.80 135.00 131.14 3non n PRO 186 Ca 0.02 0.12 -0.14 0.00 -0.04 0.00 0.00 63.50 63.46 3non n PRO 186 Cb 0.40 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.25 3non n PRO 186 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3non s PHE 187 N -2.95 1.32 -0.48 0.54 0.08 -1.26 -5.07 117.98 110.16 3non s PHE 187 Ca 0.12 -1.31 0.03 0.00 0.12 0.00 0.00 56.93 55.89 3non s PHE 187 Cb 0.14 -0.69 0.45 0.00 -0.57 0.00 0.00 43.02 42.35 3non s PHE 187 CO 0.39 -0.53 1.57 -1.71 -0.10 0.00 0.00 175.22 174.84 3non n ASN 188 N -0.37 6.17 -1.19 1.36 5.15 -1.26 -4.72 115.26 120.39 3non n ASN 188 Ca 0.01 -3.77 -0.04 0.00 -0.60 0.00 0.00 54.58 50.19 3non n ASN 188 Cb 0.66 -0.64 0.21 0.00 -0.53 0.00 0.00 39.78 39.48 3non n ASN 188 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3non n ALA 189 N -0.78 4.19 0.83 5.20 0.00 -1.26 -3.54 120.51 125.15 3non n ALA 189 Ca 0.52 -3.00 0.13 0.00 0.00 0.00 0.00 53.44 51.09 3non n ALA 189 Cb 0.80 -0.78 0.53 0.00 0.00 0.00 0.00 19.45 20.00 3non n ALA 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3non n GLY 190 N -1.03 -1.52 3.07 0.00 0.00 -1.26 -4.66 105.19 99.78 3non n GLY 190 Ca 0.33 -0.07 -0.16 0.00 0.00 0.00 0.00 46.02 46.13 3non n GLY 190 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3non s SER 191 N -3.50 1.05 0.46 1.61 0.15 -1.26 -5.02 113.70 107.18 3non s SER 191 Ca 0.12 -0.44 0.31 0.00 0.70 0.00 0.00 55.95 56.65 3non s SER 191 Cb 0.16 -0.03 1.51 0.00 -1.71 0.00 0.00 66.02 65.95 3non s SER 191 CO 0.53 -0.08 1.94 1.55 1.20 0.00 0.00 173.24 178.38 3non h PRO 192 N 4.90 0.00 -0.60 5.44 0.13 -1.93 -0.60 132.00 139.34 3non h PRO 192 Ca -0.35 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.74 3non h PRO 192 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 3non h PRO 192 CO 0.43 0.00 0.21 -0.44 -0.23 0.00 0.00 178.00 177.98 3non h ASP 193 N 0.00 0.81 0.00 1.44 3.32 -1.98 -3.37 116.42 116.65 3non h ASP 193 Ca 0.00 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 3non h ASP 193 Cb 0.22 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 3non h ASP 193 CO 0.00 0.75 -1.17 0.35 -1.72 0.00 0.00 179.24 177.45 3non n THR 194 N -4.30 0.09 -1.86 0.35 -2.24 -0.74 -5.04 114.28 100.54 3non n THR 194 Ca 0.05 -0.09 -0.36 0.00 -2.27 0.00 0.00 64.05 61.38 3non n THR 194 Cb 0.19 -0.16 0.05 0.00 -2.10 0.00 0.00 70.33 68.31 3non n THR 194 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3non s ALA 195 N -2.15 2.44 0.56 6.98 0.00 -0.31 -4.72 121.76 124.56 3non s ALA 195 Ca -0.01 1.04 -0.20 0.00 0.00 0.00 0.00 51.96 52.79 3non s ALA 195 Cb 0.02 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 3non s ALA 195 CO 0.13 -1.37 1.11 -2.30 0.00 0.00 0.00 175.76 173.33 3non n PRO 196 N -1.83 1.22 -0.24 0.00 -0.02 -1.26 -4.77 135.00 128.10 3non n PRO 196 Ca 0.14 0.46 0.08 0.00 -2.02 0.00 0.00 63.50 62.16 3non n PRO 196 Cb 0.49 -2.30 0.34 0.00 -0.02 0.00 0.00 33.50 32.02 3non n PRO 196 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3non h ALA 197 N 0.94 1.72 -0.54 3.55 0.00 -1.95 -1.10 119.26 121.90 3non h ALA 197 Ca -0.49 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 3non h ALA 197 Cb 1.34 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 3non h ALA 197 CO 0.54 0.11 0.09 0.66 0.00 0.00 0.00 179.25 180.64 3non h SER 198 N 0.78 0.79 -0.35 0.00 4.64 -2.00 -1.27 113.55 116.14 3non h SER 198 Ca 0.39 -0.16 -0.10 0.00 -0.47 0.00 0.00 61.79 61.45 3non h SER 198 Cb 0.45 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 3non h SER 198 CO -0.16 0.80 -0.15 0.58 -0.87 0.00 0.00 176.83 177.03 3non h VAL 199 N 0.80 1.28 -0.56 0.95 2.07 -1.59 -1.29 116.25 117.91 3non h VAL 199 Ca 0.17 -1.27 0.01 0.00 0.82 0.00 0.00 66.70 66.43 3non h VAL 199 Cb 0.35 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 3non h VAL 199 CO 0.01 0.42 0.37 0.58 0.02 0.00 0.00 177.57 178.96 3non h VAL 200 N 0.52 1.13 -0.57 2.57 2.07 -1.09 -0.64 116.25 120.24 3non h VAL 200 Ca 0.08 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 3non h VAL 200 Cb 0.69 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3non h VAL 200 CO 0.05 0.14 0.27 -0.61 0.02 0.00 0.00 177.57 177.43 3non h GLN 201 N 0.75 0.83 -0.71 1.57 5.75 -1.07 0.71 115.11 122.95 3non h GLN 201 Ca 0.21 -0.13 -0.03 0.00 -0.15 0.00 0.00 58.65 58.55 3non h GLN 201 Cb -0.08 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.30 3non h GLN 201 CO -0.05 0.69 0.33 1.96 -2.65 0.00 0.00 178.83 179.10 3non h GLN 202 N 0.78 1.03 -0.42 1.69 1.08 -0.85 -0.03 115.11 118.39 3non h GLN 202 Ca 0.20 -0.16 -0.08 0.00 -1.45 0.00 0.00 58.65 57.15 3non h GLN 202 Cb 0.14 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 3non h GLN 202 CO -0.02 0.82 -0.06 0.00 -0.95 0.00 0.00 178.83 178.62 3non h ALA 203 N 1.16 0.58 -0.92 3.87 0.00 -0.79 -2.36 119.26 120.80 3non h ALA 203 Ca 0.24 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3non h ALA 203 Cb 0.14 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3non h ALA 203 CO -0.03 0.42 0.54 0.00 0.00 0.00 0.00 179.25 180.19 3non h ARG 204 N 0.62 1.25 -0.31 0.00 3.08 -0.58 -1.76 114.38 116.67 3non h ARG 204 Ca 0.11 -0.12 0.03 0.00 0.07 0.00 0.00 59.98 60.08 3non h ARG 204 Cb 0.57 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 3non h ARG 204 CO 0.03 0.88 0.12 0.37 -1.07 0.00 0.00 179.97 180.30 3non h GLN 205 N 1.27 0.25 -0.16 0.04 5.75 -0.86 -1.67 115.11 119.73 3non h GLN 205 Ca 0.33 -0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 58.75 3non h GLN 205 Cb -0.04 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 3non h GLN 205 CO -0.06 0.17 -0.17 0.00 -2.65 0.00 0.00 178.83 176.12 3non h ARG 206 N 0.26 0.26 -0.00 1.69 3.08 -1.06 -2.62 114.38 115.99 3non h ARG 206 Ca 0.14 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.12 3non h ARG 206 Cb 0.10 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.12 3non h ARG 206 CO -0.13 0.44 -0.17 0.00 -1.07 0.00 0.00 179.97 179.03 3non n ALA 207 N -2.49 2.82 -0.09 0.04 0.00 -0.69 -4.44 120.51 115.66 3non n ALA 207 Ca -0.01 -0.24 -0.10 0.00 0.00 0.00 0.00 53.44 53.09 3non n ALA 207 Cb 0.31 -1.32 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 3non n ALA 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3non h ALA 208 N 3.30 0.36 -0.06 0.00 0.00 -0.92 0.54 119.26 122.48 3non h ALA 208 Ca 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.78 3non h ALA 208 Cb 0.43 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3non h ALA 208 CO 0.00 -0.01 -0.02 0.22 0.00 0.00 0.00 179.25 179.43 3non h ASP 209 N 0.29 -0.08 -0.51 0.00 3.58 -1.78 -0.61 116.42 117.31 3non h ASP 209 Ca 0.09 0.02 0.02 0.00 0.42 0.00 0.00 57.03 57.59 3non h ASP 209 Cb 0.22 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.29 3non h ASP 209 CO -0.00 -0.03 0.31 -1.28 -2.88 0.00 0.00 179.24 175.35 3non h SER 210 N -0.01 0.50 -0.76 2.28 0.87 -1.75 -1.11 113.55 113.56 3non h SER 210 Ca 0.03 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 3non h SER 210 Cb 0.06 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 61.88 3non h SER 210 CO -0.07 0.35 0.39 0.25 -0.53 0.00 0.00 176.83 177.23 3non h LEU 211 N 0.61 0.97 -0.34 2.23 5.85 -0.67 0.50 115.31 124.47 3non h LEU 211 Ca 0.21 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3non h LEU 211 Cb 0.02 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 3non h LEU 211 CO -0.09 0.81 0.07 -0.74 -0.34 0.00 0.00 178.44 178.15 3non h HIS 212 N 1.06 0.12 -0.19 1.25 2.76 -0.47 0.11 115.15 119.79 3non h HIS 212 Ca 0.26 0.02 -0.17 0.00 -2.20 0.00 0.00 60.37 58.28 3non h HIS 212 Cb 0.07 -0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.02 3non h HIS 212 CO 0.00 0.03 -0.58 0.87 -1.30 0.00 0.00 177.93 176.95 3non h LYS 213 N 0.19 0.60 0.00 5.26 1.57 -0.81 -3.04 116.57 120.34 3non h LYS 213 Ca 0.16 -0.39 -0.06 0.00 -1.87 0.00 0.00 60.65 58.48 3non h LYS 213 Cb 0.17 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3non h LYS 213 CO -0.20 1.01 -0.30 0.00 -0.57 0.00 0.00 179.45 179.39 3non h ARG 214 N 0.45 0.00 -0.32 3.15 2.47 0.50 -2.16 114.38 118.47 3non h ARG 214 Ca 0.00 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.70 3non h ARG 214 Cb 1.14 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.44 3non h ARG 214 CO 0.11 0.30 0.10 0.00 0.56 0.00 0.00 179.97 181.04 3non h ARG 215 N 0.00 0.51 -0.37 0.04 3.08 -0.73 -0.66 114.38 116.24 3non h ARG 215 Ca -0.00 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 3non h ARG 215 Cb 0.84 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 3non h ARG 215 CO 0.04 0.55 0.16 0.93 -1.07 0.00 0.00 179.97 180.57 3non h GLU 216 N 0.37 0.55 -0.57 0.04 5.08 -1.39 -1.87 114.58 116.79 3non h GLU 216 Ca 0.10 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3non h GLU 216 Cb 0.25 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 3non h GLU 216 CO -0.00 0.52 0.37 0.82 -1.00 0.00 0.00 179.01 179.72 3non h ILE 217 N 0.46 1.16 -0.69 3.13 2.04 -1.36 -2.50 117.51 119.74 3non h ILE 217 Ca 0.12 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.67 3non h ILE 217 Cb 0.17 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 3non h ILE 217 CO -0.01 0.16 0.44 0.74 0.00 0.00 0.00 178.15 179.47 3non h THR 218 N 0.78 1.19 -0.11 -0.27 2.02 -0.81 0.44 112.91 116.15 3non h THR 218 Ca 0.21 -0.39 -0.12 0.00 0.77 0.00 0.00 66.41 66.88 3non h THR 218 Cb -0.06 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.54 3non h THR 218 CO -0.04 0.19 -0.46 -0.07 0.37 0.00 0.00 175.52 175.51 3non h LEU 219 N 0.94 0.28 -0.39 2.58 3.38 -1.13 0.81 115.31 121.78 3non h LEU 219 Ca 0.25 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 3non h LEU 219 Cb -0.07 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3non h LEU 219 CO -0.05 0.70 0.03 0.03 0.09 0.00 0.00 178.44 179.24 3non h ARG 220 N 0.21 0.67 -0.68 1.13 3.08 -0.98 -1.30 114.38 116.50 3non h ARG 220 Ca 0.01 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 3non h ARG 220 Cb 0.90 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.85 3non h ARG 220 CO 0.07 0.74 0.34 0.00 -1.07 0.00 0.00 179.97 180.05 3non h ALA 221 N 0.90 0.88 -0.77 0.04 0.00 -0.54 -2.09 119.26 117.68 3non h ALA 221 Ca 0.11 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3non h ALA 221 Cb 0.42 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3non h ALA 221 CO 0.01 0.44 0.28 0.00 0.00 0.00 0.00 179.25 179.98 3non h ALA 222 N 1.16 1.02 -0.20 0.00 0.00 -0.80 -2.57 119.26 117.87 3non h ALA 222 Ca 0.24 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3non h ALA 222 Cb 0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3non h ALA 222 CO -0.03 0.67 -0.09 0.00 0.00 0.00 0.00 179.25 179.80 3non h ALA 223 N 1.15 1.48 -0.49 0.00 0.00 -0.91 -1.59 119.26 118.89 3non h ALA 223 Ca 0.25 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3non h ALA 223 Cb 0.26 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3non h ALA 223 CO -0.01 0.37 -0.16 0.00 0.00 0.00 0.00 179.25 179.44 3non h ARG 224 N 0.30 0.98 -0.70 0.00 3.08 -1.04 -1.17 114.38 115.83 3non h ARG 224 Ca 0.06 -0.39 -0.05 0.00 0.07 0.00 0.00 59.98 59.67 3non h ARG 224 Cb 0.35 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 3non h ARG 224 CO 0.02 1.07 0.26 -0.07 -1.07 0.00 0.00 179.97 180.17 3non h LEU 225 N 0.83 0.98 -1.17 3.04 3.38 -1.05 -2.74 115.31 118.59 3non h LEU 225 Ca 0.12 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 3non h LEU 225 Cb 0.73 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3non h LEU 225 CO 0.06 0.90 -0.33 0.00 0.09 0.00 0.00 178.44 179.16 3non h ALA 226 N 1.12 1.31 -0.02 1.53 0.00 -1.09 -3.52 119.26 118.59 3non h ALA 226 Ca 0.23 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3non h ALA 226 Cb 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3non h ALA 226 CO -0.02 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.72