#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 6abp s LEU 3 N 0.00 4.46 -0.11 0.00 2.96 -1.26 -4.93 118.68 119.79 6abp s LEU 3 Ca 0.00 2.08 0.00 0.00 -0.22 0.00 0.00 54.13 56.00 6abp s LEU 3 Cb 0.00 -3.60 -0.02 0.00 0.50 0.00 0.00 46.19 43.07 6abp s LEU 3 CO 0.00 -0.29 -0.12 -0.54 -1.32 0.00 0.00 176.35 174.08 6abp s LYS 4 N -0.04 3.21 0.02 1.98 1.02 -1.26 -0.94 119.74 123.72 6abp s LYS 4 Ca 0.52 -0.66 0.05 0.00 0.02 0.00 0.00 55.97 55.89 6abp s LYS 4 Cb -0.30 -2.61 -0.02 0.00 -0.52 0.00 0.00 37.83 34.39 6abp s LYS 4 CO 0.34 0.33 -0.14 -0.51 -0.92 0.00 0.00 175.35 174.45 6abp s LEU 5 N 0.07 2.11 0.42 3.17 1.43 0.10 -2.19 118.68 123.78 6abp s LEU 5 Ca -0.04 -0.36 -0.06 0.00 -1.03 0.00 0.00 54.13 52.63 6abp s LEU 5 Cb -0.14 -0.64 -0.05 0.00 0.03 0.00 0.00 46.19 45.39 6abp s LEU 5 CO 0.04 0.09 0.72 -0.83 0.23 0.00 0.00 176.35 176.61 6abp s GLY 6 N -0.77 1.67 -0.28 -3.19 0.00 0.21 -0.34 107.32 104.62 6abp s GLY 6 Ca 0.03 -0.46 -0.04 0.00 0.00 0.00 0.00 44.72 44.26 6abp s GLY 6 CO 0.00 -0.31 0.15 -0.12 0.00 0.00 0.00 173.10 172.83 6abp s PHE 7 N -2.49 0.20 -0.21 1.90 2.19 -0.35 -0.76 117.98 118.47 6abp s PHE 7 Ca 0.47 -0.74 -0.07 0.00 0.33 0.00 0.00 56.93 56.92 6abp s PHE 7 Cb -0.10 -0.82 -0.03 0.00 -1.31 0.00 0.00 43.02 40.75 6abp s PHE 7 CO 0.38 -0.82 0.05 -0.51 1.83 0.00 0.00 175.22 176.15 6abp s LEU 8 N 2.14 3.56 0.05 6.12 1.02 0.22 -2.36 118.68 129.42 6abp s LEU 8 Ca 0.09 -0.08 0.06 0.00 0.02 0.00 0.00 54.13 54.22 6abp s LEU 8 Cb -0.16 -1.92 -0.02 0.00 0.02 0.00 0.00 46.19 44.11 6abp s LEU 8 CO -0.35 0.08 -0.17 0.68 0.02 0.00 0.00 176.35 176.61 6abp s VAL 9 N 0.94 1.40 0.27 -1.59 -7.23 -0.63 -0.52 120.40 113.04 6abp s VAL 9 Ca 0.03 -1.13 0.13 0.00 -1.81 0.00 0.00 61.98 59.20 6abp s VAL 9 Cb -0.14 -1.24 0.04 0.00 0.56 0.00 0.00 36.38 35.60 6abp s VAL 9 CO 0.03 0.08 1.69 0.07 -0.31 0.00 0.00 175.10 176.66 6abp h LYS 10 N 4.82 0.00 -2.69 4.82 2.10 -1.34 0.65 116.57 124.93 6abp h LYS 10 Ca -0.41 0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 57.64 6abp h LYS 10 Cb 1.17 0.00 -0.39 0.00 -0.90 0.00 0.00 32.23 32.11 6abp h LYS 10 CO 0.43 0.51 -0.82 -0.65 -2.00 0.00 0.00 179.45 176.92 6abp s GLN 11 N -3.74 1.30 0.35 0.07 -0.21 -1.26 -3.82 119.66 112.35 6abp s GLN 11 Ca -0.01 -2.27 0.26 0.00 0.02 0.00 0.00 55.36 53.35 6abp s GLN 11 Cb 0.13 -2.05 1.24 0.00 1.00 0.00 0.00 33.01 33.32 6abp s GLN 11 CO 0.73 -1.29 1.78 -1.00 -2.12 0.00 0.00 175.29 173.39 6abp h PRO 12 N 5.98 0.00 0.00 2.91 0.13 -1.97 -1.42 132.00 137.63 6abp h PRO 12 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 6abp h PRO 12 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 6abp h PRO 12 CO 0.46 0.00 -0.07 -0.85 -0.23 0.00 0.00 178.00 177.31 6abp n GLU 13 N -2.40 0.18 -2.84 0.86 0.00 -1.26 -4.51 120.64 110.67 6abp n GLU 13 Ca -0.00 0.14 -0.40 0.00 0.00 0.00 0.00 57.16 56.89 6abp n GLU 13 Cb 0.13 -1.70 -0.05 0.00 0.00 0.00 0.00 31.44 29.83 6abp n GLU 13 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 6abp s GLU 14 N -3.07 4.62 0.43 3.44 2.02 -0.54 -4.90 118.70 120.70 6abp s GLU 14 Ca 0.11 1.29 0.15 0.00 0.02 0.00 0.00 54.97 56.54 6abp s GLU 14 Cb 0.14 -3.36 1.05 0.00 0.10 0.00 0.00 34.13 32.06 6abp s GLU 14 CO 0.59 0.28 1.95 -1.35 0.02 0.00 0.00 175.26 176.75 6abp h PRO 15 N 5.47 0.39 -0.59 0.39 0.11 -1.87 -1.42 132.00 134.48 6abp h PRO 15 Ca -0.44 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.73 6abp h PRO 15 Cb 1.21 -0.09 -0.10 0.00 0.11 0.00 0.00 31.00 32.13 6abp h PRO 15 CO 0.71 0.26 -0.46 2.35 -0.21 0.00 0.00 178.00 180.64 6abp h TRP 16 N 0.40 -1.38 -0.05 0.65 2.91 -1.90 0.12 115.95 116.70 6abp h TRP 16 Ca 0.32 0.09 -0.15 0.00 1.13 0.00 0.00 58.89 60.27 6abp h TRP 16 Cb 0.70 0.68 -0.01 0.00 -0.51 0.00 0.00 29.16 30.02 6abp h TRP 16 CO -0.00 -0.43 -0.66 0.74 -1.03 0.00 0.00 178.44 177.06 6abp h PHE 17 N -0.23 0.25 -0.93 2.65 -1.00 -1.54 -2.38 116.94 113.76 6abp h PHE 17 Ca 0.17 -0.10 0.09 0.00 2.81 0.00 0.00 57.97 60.93 6abp h PHE 17 Cb 0.56 -0.04 -0.07 0.00 3.61 0.00 0.00 35.95 40.01 6abp h PHE 17 CO -0.74 0.79 0.60 1.96 -1.61 0.00 0.00 178.31 179.31 6abp h GLN 18 N 0.13 0.95 -0.19 1.51 4.20 -0.79 -0.94 115.11 119.99 6abp h GLN 18 Ca -0.01 -0.06 -0.16 0.00 0.06 0.00 0.00 58.65 58.48 6abp h GLN 18 Cb 1.18 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.74 6abp h GLN 18 CO 0.10 0.63 -0.53 1.15 -0.67 0.00 0.00 178.83 179.51 6abp h THR 19 N 0.98 1.32 -0.36 -0.54 2.02 -0.59 -0.32 112.91 115.42 6abp h THR 19 Ca 0.42 -1.77 0.00 0.00 0.77 0.00 0.00 66.41 65.83 6abp h THR 19 Cb 0.33 1.75 -0.02 0.00 -1.74 0.00 0.00 68.15 68.47 6abp h THR 19 CO -0.18 0.55 0.23 -0.33 0.37 0.00 0.00 175.52 176.16 6abp h GLU 20 N 0.43 0.48 -0.45 6.66 5.08 -0.87 -1.79 114.58 124.13 6abp h GLU 20 Ca 0.01 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.38 6abp h GLU 20 Cb 1.07 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.17 6abp h GLU 20 CO 0.10 0.34 0.19 -1.49 -1.00 0.00 0.00 179.01 177.15 6abp h TRP 21 N 0.49 0.35 -0.90 4.33 6.55 -1.00 -0.55 115.95 125.23 6abp h TRP 21 Ca 0.13 0.02 -0.02 0.00 0.95 0.00 0.00 58.89 59.98 6abp h TRP 21 Cb -0.04 -0.09 -0.04 0.00 -0.86 0.00 0.00 29.16 28.13 6abp h TRP 21 CO -0.05 0.16 0.50 -0.22 -1.05 0.00 0.00 178.44 177.78 6abp h LYS 22 N 0.39 1.24 0.00 0.49 3.64 -0.68 -1.88 116.57 119.78 6abp h LYS 22 Ca 0.20 -0.14 -0.12 0.00 -1.27 0.00 0.00 60.65 59.32 6abp h LYS 22 Cb 0.15 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 6abp h LYS 22 CO -0.17 0.90 -0.56 0.74 -2.27 0.00 0.00 179.45 178.09 6abp h PHE 23 N 1.25 0.00 -0.42 1.91 -1.00 -0.98 -2.48 116.94 115.21 6abp h PHE 23 Ca 0.32 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 61.06 6abp h PHE 23 Cb 0.01 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.56 6abp h PHE 23 CO 0.01 0.56 0.13 0.00 -1.61 0.00 0.00 178.31 177.40 6abp h ALA 24 N 1.44 0.55 -0.71 2.45 0.00 -0.79 -1.70 119.26 120.50 6abp h ALA 24 Ca -0.01 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.81 6abp h ALA 24 Cb 1.22 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 6abp h ALA 24 CO 0.07 0.20 0.37 -0.44 0.00 0.00 0.00 179.25 179.46 6abp h ASP 25 N 0.54 0.51 -0.85 0.00 3.32 -1.26 0.37 116.42 119.05 6abp h ASP 25 Ca 0.14 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 6abp h ASP 25 Cb 0.26 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 6abp h ASP 25 CO -0.00 0.31 0.50 0.11 -1.72 0.00 0.00 179.24 178.43 6abp h LYS 26 N 0.65 1.17 -0.81 3.56 1.57 -0.97 -0.53 116.57 121.20 6abp h LYS 26 Ca 0.34 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.97 6abp h LYS 26 Cb 0.31 -0.24 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 6abp h LYS 26 CO -0.24 0.84 0.38 0.00 -0.57 0.00 0.00 179.45 179.86 6abp h ALA 27 N 1.27 1.05 -0.31 3.86 0.00 -0.45 -0.24 119.26 124.43 6abp h ALA 27 Ca 0.30 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 6abp h ALA 27 Cb -0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 6abp h ALA 27 CO -0.05 0.63 0.14 0.78 0.00 0.00 0.00 179.25 180.74 6abp h GLY 28 N 1.16 0.49 0.99 0.00 0.00 -0.30 0.36 103.07 105.78 6abp h GLY 28 Ca 0.28 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.36 6abp h GLY 28 CO -0.03 0.24 0.18 0.50 0.00 0.00 0.00 176.54 177.43 6abp h LYS 29 N 0.36 0.38 -0.36 4.80 1.57 -0.74 0.65 116.57 123.23 6abp h LYS 29 Ca 0.11 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 6abp h LYS 29 Cb 0.15 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 6abp h LYS 29 CO -0.01 0.26 0.03 -0.44 -0.57 0.00 0.00 179.45 178.72 6abp h ASP 30 N 0.37 0.60 0.26 0.86 3.45 -0.75 -3.32 116.42 117.90 6abp h ASP 30 Ca 0.10 -0.28 0.00 0.00 0.43 0.00 0.00 57.03 57.28 6abp h ASP 30 Cb -0.03 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 38.58 6abp h ASP 30 CO -0.02 0.73 -1.05 0.18 -1.57 0.00 0.00 179.24 177.51 6abp n LEU 31 N -4.53 0.66 -0.88 1.55 4.77 0.09 -5.03 117.00 113.62 6abp n LEU 31 Ca -0.01 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 6abp n LEU 31 Cb 0.25 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 6abp n LEU 31 CO 0.39 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 6abp n GLY 32 N 1.41 0.88 3.31 -0.72 0.00 0.13 -5.05 105.19 105.15 6abp n GLY 32 Ca 0.02 -0.48 -0.10 0.00 0.00 0.00 0.00 46.02 45.46 6abp n GLY 32 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 6abp s PHE 33 N -2.58 -0.18 -0.12 1.61 -0.12 -0.65 -4.42 117.98 111.52 6abp s PHE 33 Ca 0.00 -0.15 -0.05 0.00 -0.05 0.00 0.00 56.93 56.67 6abp s PHE 33 Cb 0.00 0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 42.59 6abp s PHE 33 CO 0.00 -0.69 0.08 -2.00 -0.05 0.00 0.00 175.22 172.56 6abp s GLU 34 N -3.81 3.41 -0.26 1.99 2.12 -0.12 -4.22 118.70 117.82 6abp s GLU 34 Ca 0.03 -0.26 -0.08 0.00 0.36 0.00 0.00 54.97 55.01 6abp s GLU 34 Cb 0.02 -3.07 -0.04 0.00 0.26 0.00 0.00 34.13 31.30 6abp s GLU 34 CO -0.12 0.65 0.11 0.08 -0.54 0.00 0.00 175.26 175.43 6abp s VAL 35 N -0.68 4.63 -0.33 3.70 1.01 -1.26 0.01 120.40 127.48 6abp s VAL 35 Ca 0.12 -0.06 -0.20 0.00 0.00 0.00 0.00 61.98 61.84 6abp s VAL 35 Cb -0.12 -3.18 -0.00 0.00 0.00 0.00 0.00 36.38 33.08 6abp s VAL 35 CO 0.02 0.31 0.63 -0.63 0.00 0.00 0.00 175.10 175.43 6abp s ILE 36 N 1.64 4.92 -0.34 2.22 1.01 0.53 -4.94 121.20 126.25 6abp s ILE 36 Ca 0.07 0.72 -0.18 0.00 0.00 0.00 0.00 60.65 61.26 6abp s ILE 36 Cb -0.15 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.28 6abp s ILE 36 CO 0.06 -0.21 0.49 -0.54 0.00 0.00 0.00 174.94 174.74 6abp s LYS 37 N 2.64 3.64 -0.03 2.79 1.02 -1.26 -1.21 119.74 127.33 6abp s LYS 37 Ca 0.25 -0.16 0.04 0.00 0.02 0.00 0.00 55.97 56.11 6abp s LYS 37 Cb -0.15 -3.80 -0.00 0.00 -0.52 0.00 0.00 37.83 33.36 6abp s LYS 37 CO 0.13 -0.61 -0.14 0.42 -0.92 0.00 0.00 175.35 174.24 6abp s ILE 38 N 2.34 1.13 -0.11 2.17 1.01 -0.99 -5.00 121.20 121.74 6abp s ILE 38 Ca 0.18 -0.56 -0.24 0.00 0.00 0.00 0.00 60.65 60.03 6abp s ILE 38 Cb -0.16 -0.97 -0.03 0.00 0.01 0.00 0.00 42.46 41.31 6abp s ILE 38 CO 0.13 0.33 0.76 0.00 0.00 0.00 0.00 174.94 176.16 6abp s ALA 39 N 0.02 3.41 -0.53 9.38 0.00 -1.26 -1.60 121.76 131.18 6abp s ALA 39 Ca -0.02 0.08 0.07 0.00 0.00 0.00 0.00 51.96 52.09 6abp s ALA 39 Cb -0.09 -3.08 0.25 0.00 0.00 0.00 0.00 23.12 20.19 6abp s ALA 39 CO 0.01 -0.36 0.64 1.33 0.00 0.00 0.00 175.76 177.38 6abp n VAL 40 N 4.24 1.00 0.62 0.00 0.24 0.22 -4.88 118.33 119.77 6abp n VAL 40 Ca 0.01 -4.68 0.09 0.00 -2.04 0.00 0.00 64.34 57.73 6abp n VAL 40 Cb 0.50 -2.03 0.39 0.00 -1.47 0.00 0.00 33.84 31.23 6abp n VAL 40 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 6abp n PRO 41 N 1.15 0.01 -4.09 7.34 -0.04 -1.25 -4.22 135.00 133.90 6abp n PRO 41 Ca 0.26 0.20 -0.12 0.00 -0.04 0.00 0.00 63.50 63.80 6abp n PRO 41 Cb 0.46 -1.52 -0.06 0.00 -0.04 0.00 0.00 33.50 32.34 6abp n PRO 41 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 6abp s ASP 42 N -3.06 0.40 0.29 3.54 3.84 -1.26 -4.83 116.67 115.58 6abp s ASP 42 Ca 0.09 -1.27 -0.01 0.00 -0.00 0.00 0.00 52.55 51.35 6abp s ASP 42 Cb 0.12 0.57 0.44 0.00 -1.38 0.00 0.00 42.92 42.66 6abp s ASP 42 CO 0.34 -1.12 1.91 1.23 -0.00 0.00 0.00 175.17 177.52 6abp h GLY 43 N 2.28 1.03 0.76 2.12 0.00 -1.94 -2.13 103.07 105.18 6abp h GLY 43 Ca -0.29 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.55 6abp h GLY 43 CO 0.41 0.45 -0.01 -2.09 0.00 0.00 0.00 176.54 175.30 6abp h GLU 44 N 0.97 0.22 -0.86 4.80 4.81 -1.98 -0.78 114.58 121.75 6abp h GLU 44 Ca 0.24 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 6abp h GLU 44 Cb 0.05 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 6abp h GLU 44 CO -0.04 0.48 0.46 0.87 -0.73 0.00 0.00 179.01 180.05 6abp h LYS 45 N -0.07 1.21 0.07 1.92 1.57 -1.94 -0.94 116.57 118.39 6abp h LYS 45 Ca 0.03 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.68 6abp h LYS 45 Cb 0.39 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 6abp h LYS 45 CO 0.01 0.90 -0.14 1.15 -0.57 0.00 0.00 179.45 180.80 6abp h THR 46 N 1.22 0.68 -0.41 -0.16 2.02 -1.03 0.11 112.91 115.34 6abp h THR 46 Ca 0.30 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.34 6abp h THR 46 Cb 0.05 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 6abp h THR 46 CO -0.05 0.00 -0.30 -0.07 0.37 0.00 0.00 175.52 175.47 6abp h LEU 47 N -0.26 0.94 -1.12 2.58 3.38 -0.82 -2.40 115.31 117.60 6abp h LEU 47 Ca 0.03 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 6abp h LEU 47 Cb 0.29 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 6abp h LEU 47 CO -0.09 1.16 0.27 0.78 0.09 0.00 0.00 178.44 180.65 6abp h ASN 48 N 0.76 0.81 -0.83 -0.43 2.35 -1.11 -2.28 115.58 114.85 6abp h ASN 48 Ca 0.08 -0.09 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 6abp h ASN 48 Cb 0.87 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 39.00 6abp h ASN 48 CO 0.08 0.71 0.38 0.00 -1.65 0.00 0.00 177.43 176.94 6abp h ALA 49 N 1.42 1.09 -0.50 -0.83 0.00 -0.49 -0.51 119.26 119.44 6abp h ALA 49 Ca 0.21 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 6abp h ALA 49 Cb 0.14 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 6abp h ALA 49 CO -0.02 0.67 0.22 0.82 0.00 0.00 0.00 179.25 180.94 6abp h ILE 50 N 1.20 1.20 -0.77 0.00 2.04 -0.92 0.22 117.51 120.47 6abp h ILE 50 Ca 0.28 -0.60 0.07 0.00 1.00 0.00 0.00 64.86 65.61 6abp h ILE 50 Cb 0.15 0.67 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 6abp h ILE 50 CO -0.03 0.23 0.45 0.44 0.00 0.00 0.00 178.15 179.24 6abp h ASP 51 N 0.66 0.69 -0.67 1.72 3.32 -1.06 -1.27 116.42 119.81 6abp h ASP 51 Ca 0.17 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 6abp h ASP 51 Cb 0.15 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 6abp h ASP 51 CO -0.02 0.44 0.40 -1.28 -1.72 0.00 0.00 179.24 177.06 6abp h SER 52 N 0.82 0.81 -0.90 6.45 0.87 -0.36 -2.10 113.55 119.15 6abp h SER 52 Ca 0.35 -0.06 0.04 0.00 -1.23 0.00 0.00 61.79 60.88 6abp h SER 52 Cb 0.20 -0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 61.91 6abp h SER 52 CO -0.19 0.64 0.59 -0.07 -0.53 0.00 0.00 176.83 177.28 6abp h LEU 53 N 0.92 0.97 -0.57 2.23 3.38 0.09 -1.98 115.31 120.34 6abp h LEU 53 Ca 0.24 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 6abp h LEU 53 Cb -0.02 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 6abp h LEU 53 CO -0.04 0.66 0.28 0.00 0.09 0.00 0.00 178.44 179.42 6abp h ALA 54 N 1.47 0.74 -0.43 1.53 0.00 -0.74 -1.30 119.26 120.53 6abp h ALA 54 Ca 0.36 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 6abp h ALA 54 Cb 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 6abp h ALA 54 CO -0.11 0.30 0.20 0.00 0.00 0.00 0.00 179.25 179.63 6abp h ALA 55 N 1.11 1.54 0.00 0.00 0.00 -0.86 -1.01 119.26 120.05 6abp h ALA 55 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 6abp h ALA 55 Cb 0.12 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.73 6abp h ALA 55 CO -0.02 0.37 0.00 0.77 0.00 0.00 0.00 179.25 180.36 6abp h SER 56 N 0.60 0.00 0.00 0.00 0.02 -1.02 -3.47 113.55 109.68 6abp h SER 56 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 6abp h SER 56 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 6abp h SER 56 CO -0.02 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.28 6abp n GLY 57 N 1.00 0.71 3.77 -3.77 0.00 -0.38 -5.00 105.19 101.51 6abp n GLY 57 Ca 0.04 -0.43 -0.39 0.00 0.00 0.00 0.00 46.02 45.25 6abp n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 6abp s ALA 58 N -2.00 3.22 -1.09 4.61 0.00 -0.57 -4.64 121.76 121.28 6abp s ALA 58 Ca 0.00 1.04 0.24 0.00 0.00 0.00 0.00 51.96 53.24 6abp s ALA 58 Cb 0.00 -3.41 0.30 0.00 0.00 0.00 0.00 23.12 20.01 6abp s ALA 58 CO 0.00 -0.58 1.27 1.63 0.00 0.00 0.00 175.76 178.08 6abp n LYS 59 N 0.21 0.10 0.00 0.00 4.76 -0.93 -4.72 118.16 117.59 6abp n LYS 59 Ca 0.03 -0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 6abp n LYS 59 Cb 0.45 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 6abp n LYS 59 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 6abp n GLY 60 N 1.49 -0.31 3.47 0.72 0.00 -1.26 -2.04 105.19 107.25 6abp n GLY 60 Ca 0.06 -1.03 -0.16 0.00 0.00 0.00 0.00 46.02 44.88 6abp n GLY 60 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 6abp s PHE 61 N -2.00 -0.57 -0.00 1.61 -0.71 -0.47 -0.62 117.98 115.22 6abp s PHE 61 Ca 0.00 0.88 -0.13 0.00 -1.04 0.00 0.00 56.93 56.64 6abp s PHE 61 Cb 0.00 0.39 -0.05 0.00 -1.21 0.00 0.00 43.02 42.14 6abp s PHE 61 CO 0.00 -0.62 0.37 0.08 -1.34 0.00 0.00 175.22 173.71 6abp s VAL 62 N -1.62 5.10 -0.07 -2.49 1.01 0.06 -2.01 120.40 120.38 6abp s VAL 62 Ca -0.09 0.68 -0.06 0.00 0.00 0.00 0.00 61.98 62.51 6abp s VAL 62 Cb -0.01 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.73 6abp s VAL 62 CO 0.06 0.53 0.17 -0.51 0.00 0.00 0.00 175.10 175.35 6abp s ILE 63 N -1.13 -0.00 -0.49 2.22 2.07 -0.29 -0.61 121.20 122.97 6abp s ILE 63 Ca 0.24 0.01 -0.00 0.00 -1.41 0.00 0.00 60.65 59.50 6abp s ILE 63 Cb -0.16 -0.25 0.13 0.00 0.13 0.00 0.00 42.46 42.31 6abp s ILE 63 CO 0.13 0.01 0.26 0.00 -1.91 0.00 0.00 174.94 173.43 6abp s THR 65 N 0.41 2.64 -0.66 0.00 -1.32 -1.26 -1.22 115.64 114.22 6abp s THR 65 Ca 0.13 0.47 0.26 0.00 -1.21 0.00 0.00 61.69 61.34 6abp s THR 65 Cb -0.22 -3.23 0.28 0.00 -1.51 0.00 0.00 72.50 67.82 6abp s THR 65 CO -0.04 -0.02 1.76 -0.81 -2.21 0.00 0.00 174.62 173.31 6abp n PRO 66 N -0.85 0.25 -3.54 7.08 -0.04 -1.26 -4.65 135.00 131.99 6abp n PRO 66 Ca 0.09 0.27 -0.11 0.00 -0.04 0.00 0.00 63.50 63.72 6abp n PRO 66 Cb 0.47 -1.83 -0.10 0.00 -0.04 0.00 0.00 33.50 32.00 6abp n PRO 66 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 6abp s ASP 67 N -4.47 0.21 0.46 3.54 2.15 -1.26 -4.99 116.67 112.31 6abp s ASP 67 Ca 0.09 0.53 0.12 0.00 0.43 0.00 0.00 52.55 53.72 6abp s ASP 67 Cb 0.12 1.02 1.05 0.00 -0.30 0.00 0.00 42.92 44.81 6abp s ASP 67 CO 0.54 -0.26 2.07 -0.65 -0.17 0.00 0.00 175.17 176.70 6abp h PRO 68 N 8.22 0.31 0.00 4.34 0.11 -1.82 -1.41 132.00 141.74 6abp h PRO 68 Ca -0.17 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.92 6abp h PRO 68 Cb 1.13 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.17 6abp h PRO 68 CO 0.19 0.21 0.00 1.63 -0.21 0.00 0.00 178.00 179.82 6abp n LYS 69 N -4.49 0.10 0.00 1.05 5.02 -1.26 -1.94 118.16 116.63 6abp n LYS 69 Ca 0.03 0.19 0.15 0.00 -2.02 0.00 0.00 58.31 56.65 6abp n LYS 69 Cb 0.15 -1.50 0.84 0.00 -0.02 0.00 0.00 35.03 34.49 6abp n LYS 69 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 6abp n LEU 70 N -1.41 0.00 -0.24 -0.35 4.77 -0.53 -4.32 117.00 114.93 6abp n LEU 70 Ca 0.05 0.09 -0.01 0.00 -0.03 0.00 0.00 56.01 56.12 6abp n LEU 70 Cb 0.16 -0.09 0.06 0.00 -2.33 0.00 0.00 43.42 41.22 6abp n LEU 70 CO 0.13 -0.01 0.69 1.23 -1.33 0.00 0.00 177.39 178.11 6abp h GLY 71 N 4.70 0.36 0.81 -0.72 0.00 -1.62 0.28 103.07 106.87 6abp h GLY 71 Ca 0.00 0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.65 6abp h GLY 71 CO 0.00 -0.26 0.18 1.76 0.00 0.00 0.00 176.54 178.22 6abp h SER 72 N -0.04 0.25 -0.66 0.19 0.02 -1.78 -1.25 113.55 110.27 6abp h SER 72 Ca 0.32 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.23 6abp h SER 72 Cb 0.53 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.02 6abp h SER 72 CO -0.73 0.19 0.19 0.00 -1.14 0.00 0.00 176.83 175.34 6abp h ALA 73 N 1.20 1.06 -0.21 3.77 0.00 -1.40 -1.06 119.26 122.61 6abp h ALA 73 Ca 0.16 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 6abp h ALA 73 Cb 0.07 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 6abp h ALA 73 CO -0.12 0.63 0.05 0.82 0.00 0.00 0.00 179.25 180.64 6abp h ILE 74 N 1.02 1.21 -0.27 0.00 2.04 -0.62 -1.24 117.51 119.63 6abp h ILE 74 Ca 0.22 -0.66 0.05 0.00 1.00 0.00 0.00 64.86 65.46 6abp h ILE 74 Cb 0.31 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 6abp h ILE 74 CO -0.00 0.21 0.00 0.58 0.00 0.00 0.00 178.15 178.94 6abp h VAL 75 N 0.15 0.81 -0.28 1.67 2.07 -1.15 0.63 116.25 120.15 6abp h VAL 75 Ca 0.07 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.59 6abp h VAL 75 Cb 0.27 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 6abp h VAL 75 CO 0.00 0.02 0.08 0.00 0.02 0.00 0.00 177.57 177.69 6abp h ALA 76 N 1.23 0.31 -0.37 1.67 0.00 -0.98 0.51 119.26 121.63 6abp h ALA 76 Ca 0.13 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 6abp h ALA 76 Cb 0.17 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 6abp h ALA 76 CO -0.21 -0.32 -0.23 0.87 0.00 0.00 0.00 179.25 179.35 6abp h LYS 77 N 0.20 0.80 -0.80 0.00 1.57 -1.08 -1.83 116.57 115.44 6abp h LYS 77 Ca 0.13 -0.37 -0.03 0.00 -1.87 0.00 0.00 60.65 58.50 6abp h LYS 77 Cb 0.11 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.37 6abp h LYS 77 CO -0.14 1.00 0.37 0.00 -0.57 0.00 0.00 179.45 180.11 6abp h ALA 78 N 0.78 1.04 -0.43 3.86 0.00 -0.61 -2.46 119.26 121.44 6abp h ALA 78 Ca 0.08 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 6abp h ALA 78 Cb 0.79 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 6abp h ALA 78 CO 0.06 0.62 0.26 0.00 0.00 0.00 0.00 179.25 180.19 6abp h ARG 79 N 1.15 0.59 -0.93 0.00 3.08 -0.69 -0.52 114.38 117.06 6abp h ARG 79 Ca 0.27 -0.05 0.27 0.00 0.07 0.00 0.00 59.98 60.54 6abp h ARG 79 Cb 0.15 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 6abp h ARG 79 CO -0.03 0.44 0.71 0.78 -1.07 0.00 0.00 179.97 180.80 6abp h GLY 80 N 0.57 0.00 -1.55 0.04 0.00 -0.96 0.15 103.07 101.32 6abp h GLY 80 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 6abp h GLY 80 CO -0.03 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.79 6abp n TYR 81 N -4.12 0.58 -3.66 5.60 0.53 -0.31 -4.94 117.16 110.85 6abp n TYR 81 Ca 0.19 -0.52 -0.25 0.00 -1.02 0.00 0.00 57.90 56.31 6abp n TYR 81 Cb 1.03 -0.04 0.07 0.00 -1.03 0.00 0.00 39.34 39.37 6abp n TYR 81 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 6abp n ASP 82 N 0.66 -5.40 -4.65 7.72 10.43 0.52 -5.00 116.55 120.84 6abp n ASP 82 Ca 0.14 -0.61 -0.35 0.00 2.57 0.00 0.00 54.79 56.54 6abp n ASP 82 Cb 0.48 -4.76 -0.10 0.00 1.84 0.00 0.00 41.12 38.59 6abp n ASP 82 CO 0.00 0.00 0.00 -0.04 -1.07 0.00 0.00 177.20 176.09 6abp s MET 83 N -6.27 3.03 0.25 -1.24 -1.94 -0.58 -4.86 119.30 107.67 6abp s MET 83 Ca 0.52 -0.43 -0.15 0.00 -1.71 0.00 0.00 55.69 53.92 6abp s MET 83 Cb -0.24 -2.78 -0.08 0.00 2.01 0.00 0.00 34.83 33.74 6abp s MET 83 CO 0.76 0.65 0.65 0.15 -0.01 0.00 0.00 175.02 177.22 6abp s LYS 84 N -0.74 4.01 -0.01 2.03 -0.14 -0.86 -4.47 119.74 119.54 6abp s LYS 84 Ca 0.12 0.59 0.05 0.00 -1.36 0.00 0.00 55.97 55.36 6abp s LYS 84 Cb -0.11 -2.67 -0.01 0.00 -1.68 0.00 0.00 37.83 33.35 6abp s LYS 84 CO 0.02 0.31 -0.17 0.08 -0.76 0.00 0.00 175.35 174.83 6abp s VAL 85 N -1.75 1.31 -0.03 3.17 1.01 -1.26 -1.36 120.40 121.49 6abp s VAL 85 Ca 0.47 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.77 6abp s VAL 85 Cb -0.13 -1.09 -0.00 0.00 0.00 0.00 0.00 36.38 35.16 6abp s VAL 85 CO 0.19 0.36 -0.11 -0.63 0.00 0.00 0.00 175.10 174.91 6abp s ILE 86 N -0.40 0.97 -0.14 2.22 1.01 -0.85 -4.43 121.20 119.58 6abp s ILE 86 Ca 0.06 -0.47 -0.09 0.00 0.00 0.00 0.00 60.65 60.16 6abp s ILE 86 Cb -0.06 -0.85 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 6abp s ILE 86 CO -0.01 0.29 0.15 0.00 0.00 0.00 0.00 174.94 175.38 6abp s ALA 87 N 0.09 3.80 0.07 9.38 0.00 -0.17 -1.13 121.76 133.79 6abp s ALA 87 Ca -0.02 -0.63 0.08 0.00 0.00 0.00 0.00 51.96 51.39 6abp s ALA 87 Cb -0.09 -2.07 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 6abp s ALA 87 CO 0.01 0.43 -0.20 0.54 0.00 0.00 0.00 175.76 176.54 6abp s VAL 88 N -0.49 2.66 0.00 0.00 0.11 -0.22 -1.31 120.40 121.15 6abp s VAL 88 Ca 0.13 -1.33 0.00 0.00 -2.93 0.00 0.00 61.98 57.85 6abp s VAL 88 Cb -0.12 -2.13 0.00 0.00 -1.53 0.00 0.00 36.38 32.60 6abp s VAL 88 CO 0.02 0.27 0.00 0.47 -3.33 0.00 0.00 175.10 172.53 6abp n ASP 89 N 1.37 0.00 -4.34 3.54 10.43 -0.09 -4.15 116.55 123.32 6abp n ASP 89 Ca -0.16 0.00 -0.37 0.00 2.57 0.00 0.00 54.79 56.83 6abp n ASP 89 Cb 0.52 0.00 -0.13 0.00 1.84 0.00 0.00 41.12 43.36 6abp n ASP 89 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 6abp s ASP 90 N 0.00 5.03 0.25 -2.24 -0.00 -1.26 -4.84 116.67 113.61 6abp s ASP 90 Ca 0.00 -0.65 -0.30 0.00 -0.00 0.00 0.00 52.55 51.60 6abp s ASP 90 Cb 0.00 -1.86 -0.09 0.00 -0.00 0.00 0.00 42.92 40.97 6abp s ASP 90 CO 0.00 -0.16 1.10 -1.58 -0.00 0.00 0.00 175.17 174.53 6abp s GLN 91 N 1.50 4.63 0.43 8.23 0.74 -1.26 -4.63 119.66 129.29 6abp s GLN 91 Ca 0.03 1.78 -0.24 0.00 0.05 0.00 0.00 55.36 56.97 6abp s GLN 91 Cb -0.17 -3.22 -0.08 0.00 1.10 0.00 0.00 33.01 30.65 6abp s GLN 91 CO 0.02 0.17 1.21 -0.06 -0.55 0.00 0.00 175.29 176.09 6abp s PHE 92 N -0.89 2.89 0.06 1.67 0.40 -1.26 -4.64 117.98 116.21 6abp s PHE 92 Ca 0.46 1.50 0.02 0.00 -0.60 0.00 0.00 56.93 58.31 6abp s PHE 92 Cb -0.31 -3.48 -0.03 0.00 0.51 0.00 0.00 43.02 39.70 6abp s PHE 92 CO 0.39 -1.68 -0.07 0.14 0.70 0.00 0.00 175.22 174.70 6abp s VAL 93 N -1.41 0.56 0.34 -0.44 -7.23 -0.82 -0.06 120.40 111.35 6abp s VAL 93 Ca 0.60 -1.40 -0.06 0.00 -1.81 0.00 0.00 61.98 59.31 6abp s VAL 93 Cb -0.32 -1.01 0.08 0.00 0.56 0.00 0.00 36.38 35.69 6abp s VAL 93 CO 0.40 -0.58 0.42 -0.46 -0.31 0.00 0.00 175.10 174.57 6abp n ASN 94 N 0.88 -0.33 -0.29 4.85 0.23 0.22 -4.28 115.26 116.54 6abp n ASN 94 Ca -0.19 -1.04 -0.00 0.00 -0.53 0.00 0.00 54.58 52.82 6abp n ASN 94 Cb 0.57 -0.33 0.12 0.00 -2.08 0.00 0.00 39.78 38.06 6abp n ASN 94 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 6abp h ALA 95 N -2.01 1.09 0.00 -2.53 0.00 -1.88 -0.63 119.26 113.30 6abp h ALA 95 Ca -0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.76 6abp h ALA 95 Cb 0.40 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.96 6abp h ALA 95 CO 0.10 0.24 0.00 0.87 0.00 0.00 0.00 179.25 180.46 6abp h LYS 96 N 0.92 0.00 0.00 0.00 1.57 -2.01 -3.46 116.57 113.59 6abp h LYS 96 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 6abp h LYS 96 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 6abp h LYS 96 CO -0.16 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.13 6abp n GLY 97 N 0.08 0.85 3.77 3.86 0.00 -0.24 -5.07 105.19 108.44 6abp n GLY 97 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 6abp n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 6abp s LYS 98 N -0.89 4.65 0.36 1.61 -0.14 -1.26 -4.70 119.74 119.37 6abp s LYS 98 Ca 0.00 1.25 -0.28 0.00 -1.36 0.00 0.00 55.97 55.58 6abp s LYS 98 Cb 0.00 -3.27 -0.12 0.00 -1.68 0.00 0.00 37.83 32.77 6abp s LYS 98 CO 0.00 0.56 1.32 -2.30 -0.76 0.00 0.00 175.35 174.17 6abp n PRO 99 N 1.57 2.20 -2.99 -1.68 -0.02 -1.26 0.70 135.00 133.51 6abp n PRO 99 Ca -0.05 0.77 -0.44 0.00 -2.02 0.00 0.00 63.50 61.76 6abp n PRO 99 Cb 0.48 -2.40 -0.01 0.00 -0.02 0.00 0.00 33.50 31.56 6abp n PRO 99 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 6abp s MET 100 N -1.97 3.94 0.47 -0.52 -1.94 0.91 -4.75 119.30 115.44 6abp s MET 100 Ca 0.56 -2.41 0.32 0.00 -1.71 0.00 0.00 55.69 52.45 6abp s MET 100 Cb -0.54 -4.95 1.62 0.00 2.01 0.00 0.00 34.83 32.97 6abp s MET 100 CO 0.62 -1.70 1.97 -0.44 -0.01 0.00 0.00 175.02 175.46 6abp h ASP 101 N 7.60 0.00 1.63 3.03 3.32 -1.92 -2.94 116.42 127.15 6abp h ASP 101 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 6abp h ASP 101 Cb 0.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.47 6abp h ASP 101 CO 1.16 0.00 0.00 0.71 -1.72 0.00 0.00 179.24 179.39 6abp h THR 102 N 0.00 0.00 -3.34 0.35 1.35 -1.94 -3.43 112.91 105.89 6abp h THR 102 Ca 0.00 -0.73 -0.58 0.00 -0.55 0.00 0.00 66.41 64.55 6abp h THR 102 Cb 0.13 1.71 -0.07 0.00 -1.73 0.00 0.00 68.15 68.19 6abp h THR 102 CO 0.00 0.00 0.28 -0.69 -0.25 0.00 0.00 175.52 174.86 6abp s VAL 103 N -3.25 4.94 0.43 6.82 1.01 -1.11 -5.03 120.40 124.21 6abp s VAL 103 Ca 0.07 1.49 -0.24 0.00 0.00 0.00 0.00 61.98 63.30 6abp s VAL 103 Cb 0.08 -4.08 -0.10 0.00 0.00 0.00 0.00 36.38 32.29 6abp s VAL 103 CO 0.61 0.08 1.14 -2.65 0.00 0.00 0.00 175.10 174.28 6abp n PRO 104 N 5.01 1.60 -4.23 2.72 -0.02 -1.26 -4.83 135.00 133.99 6abp n PRO 104 Ca 0.02 0.57 -0.17 0.00 -2.02 0.00 0.00 63.50 61.91 6abp n PRO 104 Cb 0.49 -2.22 -0.15 0.00 -0.02 0.00 0.00 33.50 31.60 6abp n PRO 104 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 6abp s LEU 105 N -1.25 1.96 -0.14 2.45 2.96 -0.25 -1.00 118.68 123.41 6abp s LEU 105 Ca 0.63 -0.12 0.02 0.00 -0.22 0.00 0.00 54.13 54.44 6abp s LEU 105 Cb -0.52 -0.35 0.00 0.00 0.50 0.00 0.00 46.19 45.82 6abp s LEU 105 CO 0.57 0.07 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.78 6abp s VAL 106 N -0.07 2.29 0.27 1.68 1.01 -0.43 -1.04 120.40 124.12 6abp s VAL 106 Ca 0.01 -0.90 -0.16 0.00 0.00 0.00 0.00 61.98 60.93 6abp s VAL 106 Cb -0.04 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.42 6abp s VAL 106 CO -0.00 0.54 0.59 0.00 0.00 0.00 0.00 175.10 176.23 6abp s MET 107 N 0.77 1.70 0.68 2.72 0.23 0.09 -0.91 119.30 124.59 6abp s MET 107 Ca -0.07 -1.18 -0.10 0.00 -1.03 0.00 0.00 55.69 53.30 6abp s MET 107 Cb -0.16 0.54 0.02 0.00 -1.53 0.00 0.00 34.83 33.69 6abp s MET 107 CO -0.00 -0.75 1.05 -0.48 -2.03 0.00 0.00 175.02 172.81 6abp s LEU 108 N -2.99 2.97 -1.11 0.18 0.05 -1.26 -0.64 118.68 115.87 6abp s LEU 108 Ca 0.18 1.01 -0.22 0.00 0.05 0.00 0.00 54.13 55.15 6abp s LEU 108 Cb -0.03 -3.81 0.03 0.00 -2.05 0.00 0.00 46.19 40.33 6abp s LEU 108 CO 0.09 -1.29 1.66 0.00 -0.55 0.00 0.00 176.35 176.25 6abp s ALA 109 N -3.28 2.65 0.12 1.48 0.00 -0.80 -4.65 121.76 117.28 6abp s ALA 109 Ca 0.57 -2.34 -0.21 0.00 0.00 0.00 0.00 51.96 49.97 6abp s ALA 109 Cb -0.11 -4.59 -0.06 0.00 0.00 0.00 0.00 23.12 18.36 6abp s ALA 109 CO 0.50 -3.86 1.71 0.00 0.00 0.00 0.00 175.76 174.11 6abp h ALA 110 N 9.32 0.05 -0.07 0.00 0.00 -1.92 -0.10 119.26 126.54 6abp h ALA 110 Ca 0.26 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 6abp h ALA 110 Cb 0.96 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 6abp h ALA 110 CO 1.39 -0.51 0.04 1.15 0.00 0.00 0.00 179.25 181.32 6abp h THR 111 N -0.04 1.09 -0.57 0.00 2.02 -1.90 -0.69 112.91 112.82 6abp h THR 111 Ca 0.07 -0.26 -0.06 0.00 0.77 0.00 0.00 66.41 66.93 6abp h THR 111 Cb 0.14 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 6abp h THR 111 CO -0.15 0.08 0.13 0.11 0.37 0.00 0.00 175.52 176.06 6abp h LYS 112 N 0.01 0.89 0.00 6.66 1.79 -1.89 0.18 116.57 124.21 6abp h LYS 112 Ca 0.02 -0.19 -0.18 0.00 -2.18 0.00 0.00 60.65 58.12 6abp h LYS 112 Cb 0.09 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.60 6abp h LYS 112 CO -0.00 0.80 -0.84 0.82 -1.08 0.00 0.00 179.45 179.15 6abp h ILE 113 N 0.85 1.55 0.04 1.86 2.04 -0.93 -1.76 117.51 121.16 6abp h ILE 113 Ca 0.18 -2.72 -0.00 0.00 1.00 0.00 0.00 64.86 63.32 6abp h ILE 113 Cb 0.32 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 38.89 6abp h ILE 113 CO 0.00 0.78 -0.02 1.23 0.00 0.00 0.00 178.15 180.14 6abp h GLY 114 N 2.20 -0.06 0.25 5.37 0.00 -0.73 -0.84 103.07 109.26 6abp h GLY 114 Ca -0.02 0.02 0.19 0.00 0.00 0.00 0.00 47.33 47.52 6abp h GLY 114 CO 0.12 -0.02 0.61 0.83 0.00 0.00 0.00 176.54 178.07 6abp h GLU 115 N -0.16 0.60 -0.15 4.80 5.08 -0.91 -1.08 114.58 122.75 6abp h GLU 115 Ca -0.01 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.16 6abp h GLU 115 Cb 0.14 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 6abp h GLU 115 CO 0.01 0.40 -0.58 -0.09 -1.00 0.00 0.00 179.01 177.75 6abp h ARG 116 N 0.62 0.49 -0.24 2.33 9.65 -0.90 -0.10 114.38 126.24 6abp h ARG 116 Ca 0.52 -0.32 0.04 0.00 -1.10 0.00 0.00 59.98 59.11 6abp h ARG 116 Cb 0.99 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.58 6abp h ARG 116 CO -0.27 0.93 0.02 0.37 2.80 0.00 0.00 179.97 183.82 6abp h GLN 117 N 0.37 0.10 -0.28 0.20 4.15 0.06 0.94 115.11 120.65 6abp h GLN 117 Ca 0.00 -0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.30 6abp h GLN 117 Cb 1.12 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.77 6abp h GLN 117 CO 0.10 0.06 -0.30 0.78 -1.93 0.00 0.00 178.83 177.55 6abp h GLY 118 N 0.10 0.61 0.91 2.39 0.00 -0.89 0.16 103.07 106.35 6abp h GLY 118 Ca 0.11 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 6abp h GLY 118 CO -0.17 0.49 0.09 1.46 0.00 0.00 0.00 176.54 178.41 6abp h GLN 119 N 0.49 0.52 -0.25 4.80 4.20 -0.58 -1.80 115.11 122.49 6abp h GLN 119 Ca 0.06 -0.12 -0.11 0.00 0.06 0.00 0.00 58.65 58.54 6abp h GLN 119 Cb 0.76 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 6abp h GLN 119 CO 0.06 0.57 -0.32 0.93 -0.67 0.00 0.00 178.83 179.40 6abp h GLU 120 N 0.38 0.51 -0.15 1.46 4.39 -0.52 -1.40 114.58 119.25 6abp h GLU 120 Ca 0.10 -0.22 0.04 0.00 0.34 0.00 0.00 59.36 59.62 6abp h GLU 120 Cb 0.27 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 6abp h GLU 120 CO -0.00 0.77 -0.11 -0.07 -1.16 0.00 0.00 179.01 178.44 6abp h LEU 121 N 0.44 -0.36 -0.54 1.33 3.38 -0.85 -1.00 115.31 117.72 6abp h LEU 121 Ca 0.05 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.10 6abp h LEU 121 Cb 0.77 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 6abp h LEU 121 CO 0.06 -0.15 0.35 0.22 0.09 0.00 0.00 178.44 179.01 6abp h TYR 122 N -0.12 0.68 -0.22 1.13 3.20 -1.22 -0.08 116.97 120.34 6abp h TYR 122 Ca 0.09 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 6abp h TYR 122 Cb 0.26 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 6abp h TYR 122 CO -0.25 0.44 0.12 0.87 -1.64 0.00 0.00 178.16 177.71 6abp h LYS 123 N 0.72 0.30 -0.31 1.82 1.57 -1.08 -0.81 116.57 118.78 6abp h LYS 123 Ca 0.20 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.86 6abp h LYS 123 Cb -0.06 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 6abp h LYS 123 CO -0.04 0.27 -0.17 1.49 -0.57 0.00 0.00 179.45 180.43 6abp h GLU 124 N 0.25 0.55 -0.61 3.15 4.57 -0.86 -1.25 114.58 120.40 6abp h GLU 124 Ca 0.08 -0.18 0.01 0.00 -1.18 0.00 0.00 59.36 58.08 6abp h GLU 124 Cb 0.05 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 6abp h GLU 124 CO -0.01 0.70 0.40 1.98 -1.18 0.00 0.00 179.01 180.90 6abp h MET 125 N 0.50 0.79 -0.52 1.92 4.05 -0.63 -2.10 114.93 118.94 6abp h MET 125 Ca 0.08 -0.05 -0.03 0.00 -0.28 0.00 0.00 59.70 59.43 6abp h MET 125 Cb 0.58 -0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 31.18 6abp h MET 125 CO 0.04 0.52 0.20 1.96 0.23 0.00 0.00 176.91 179.86 6abp h GLN 126 N 0.81 0.79 -0.99 0.39 4.20 -0.85 -2.54 115.11 116.92 6abp h GLN 126 Ca 0.23 -0.15 0.14 0.00 0.06 0.00 0.00 58.65 58.93 6abp h GLN 126 Cb -0.08 -0.13 -0.09 0.00 0.30 0.00 0.00 27.48 27.49 6abp h GLN 126 CO -0.06 0.70 0.61 -0.22 -0.67 0.00 0.00 178.83 179.19 6abp h LYS 127 N 0.71 0.88 0.00 1.46 3.64 -0.80 -1.80 116.57 120.66 6abp h LYS 127 Ca 0.17 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 6abp h LYS 127 Cb 0.21 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 6abp h LYS 127 CO -0.01 0.58 -0.02 0.00 -2.27 0.00 0.00 179.45 177.73 6abp h ARG 128 N 0.91 0.00 -0.15 1.90 3.08 -1.11 -3.48 114.38 115.54 6abp h ARG 128 Ca 0.51 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.50 6abp h ARG 128 Cb 0.60 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 6abp h ARG 128 CO -0.30 0.00 -0.06 0.41 -1.07 0.00 0.00 179.97 178.95 6abp n GLY 129 N 1.29 0.62 3.72 0.04 0.00 -0.68 -5.00 105.19 105.18 6abp n GLY 129 Ca 0.05 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.72 6abp n GLY 129 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 6abp n TRP 130 N -2.91 2.41 -2.61 1.61 8.01 -1.19 -4.93 117.44 117.83 6abp n TRP 130 Ca -0.03 0.50 -0.43 0.00 -1.31 0.00 0.00 57.50 56.23 6abp n TRP 130 Cb 0.10 -2.43 -0.02 0.00 -2.01 0.00 0.00 31.31 26.95 6abp n TRP 130 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 6abp s ASP 131 N -0.37 7.07 0.56 -0.99 3.68 -1.26 -4.87 116.67 120.50 6abp s ASP 131 Ca 0.58 1.45 0.26 0.00 2.13 0.00 0.00 52.55 56.97 6abp s ASP 131 Cb -0.51 -2.54 1.49 0.00 -1.45 0.00 0.00 42.92 39.91 6abp s ASP 131 CO 0.61 -0.68 2.03 1.62 0.13 0.00 0.00 175.17 178.88 6abp h VAL 132 N 5.44 0.60 0.00 1.11 3.04 -1.94 0.04 116.25 124.54 6abp h VAL 132 Ca -0.21 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.43 6abp h VAL 132 Cb 1.07 0.77 -0.01 0.00 -2.01 0.00 0.00 31.29 31.12 6abp h VAL 132 CO 0.97 0.00 -0.22 0.11 -1.01 0.00 0.00 177.57 177.42 6abp h LYS 133 N 0.00 0.00 -0.33 4.17 1.57 -2.03 -2.38 116.57 117.57 6abp h LYS 133 Ca 0.17 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 6abp h LYS 133 Cb 0.78 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 6abp h LYS 133 CO -0.00 0.22 0.01 -0.85 -0.57 0.00 0.00 179.45 178.26 6abp n GLU 134 N -3.96 3.19 -4.14 3.15 0.28 -0.01 -4.98 120.64 114.17 6abp n GLU 134 Ca -0.02 -2.93 -0.22 0.00 -0.16 0.00 0.00 57.16 53.83 6abp n GLU 134 Cb 0.30 -1.93 -0.05 0.00 1.43 0.00 0.00 31.44 31.20 6abp n GLU 134 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 6abp s SER 135 N -1.77 5.37 0.15 -1.84 0.01 -0.90 -0.95 113.70 113.78 6abp s SER 135 Ca 0.45 -0.32 -0.17 0.00 1.31 0.00 0.00 55.95 57.22 6abp s SER 135 Cb 0.36 -1.31 0.04 0.00 0.21 0.00 0.00 66.02 65.32 6abp s SER 135 CO 0.10 -0.04 0.46 0.00 0.41 0.00 0.00 173.24 174.17 6abp s ALA 136 N -2.17 -0.99 -0.18 1.44 0.00 -0.58 -4.95 121.76 114.33 6abp s ALA 136 Ca 0.33 -0.06 -0.05 0.00 0.00 0.00 0.00 51.96 52.18 6abp s ALA 136 Cb -0.08 0.77 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 6abp s ALA 136 CO 0.24 -0.71 -0.01 0.08 0.00 0.00 0.00 175.76 175.36 6abp s VAL 137 N -3.82 4.01 -0.33 0.00 1.01 -0.83 -1.27 120.40 119.17 6abp s VAL 137 Ca 0.05 -0.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.62 6abp s VAL 137 Cb 0.01 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.58 6abp s VAL 137 CO -0.09 0.45 0.20 -0.32 0.00 0.00 0.00 175.10 175.34 6abp s MET 138 N 0.74 3.40 -0.29 2.72 1.75 0.13 -1.11 119.30 126.64 6abp s MET 138 Ca -0.00 -0.69 -0.08 0.00 -1.25 0.00 0.00 55.69 53.66 6abp s MET 138 Cb -0.14 -3.69 -0.01 0.00 2.84 0.00 0.00 34.83 33.83 6abp s MET 138 CO 0.02 -0.44 0.11 0.00 -0.65 0.00 0.00 175.02 174.06 6abp s ALA 139 N 1.66 3.19 -0.40 4.11 0.00 0.22 -0.18 121.76 130.37 6abp s ALA 139 Ca 0.05 -1.31 -0.16 0.00 0.00 0.00 0.00 51.96 50.54 6abp s ALA 139 Cb -0.17 -2.22 0.01 0.00 0.00 0.00 0.00 23.12 20.74 6abp s ALA 139 CO 0.08 -0.76 0.39 0.42 0.00 0.00 0.00 175.76 175.90 6abp s ILE 140 N 1.59 5.14 0.22 0.00 1.01 0.39 -0.58 121.20 128.97 6abp s ILE 140 Ca 0.05 -0.33 0.07 0.00 0.00 0.00 0.00 60.65 60.43 6abp s ILE 140 Cb -0.16 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 6abp s ILE 140 CO 0.04 -0.33 0.13 0.42 0.00 0.00 0.00 174.94 175.21 6abp s THR 141 N 2.02 4.26 -0.46 2.92 -4.23 0.18 -4.39 115.64 115.93 6abp s THR 141 Ca 0.10 -1.37 0.09 0.00 -1.18 0.00 0.00 61.69 59.33 6abp s THR 141 Cb -0.17 -3.24 0.30 0.00 1.34 0.00 0.00 72.50 70.73 6abp s THR 141 CO 0.12 -0.25 0.72 0.00 -0.54 0.00 0.00 174.62 174.67 6abp n ALA 142 N -0.78 2.97 0.25 3.99 0.00 -1.26 -0.62 120.51 125.06 6abp n ALA 142 Ca -0.08 -3.87 0.07 0.00 0.00 0.00 0.00 53.44 49.56 6abp n ALA 142 Cb 0.57 -0.85 0.33 0.00 0.00 0.00 0.00 19.45 19.50 6abp n ALA 142 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 6abp n ASN 143 N 0.58 0.29 0.10 0.00 3.02 -1.26 -1.77 115.26 116.23 6abp n ASN 143 Ca 0.26 0.60 0.13 0.00 -0.03 0.00 0.00 54.58 55.54 6abp n ASN 143 Cb 0.53 -0.65 0.45 0.00 -0.61 0.00 0.00 39.78 39.49 6abp n ASN 143 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 6abp n GLU 144 N -1.86 0.21 -3.68 3.52 4.71 -1.26 -4.46 120.64 117.82 6abp n GLU 144 Ca 0.01 0.26 -0.39 0.00 -0.01 0.00 0.00 57.16 57.03 6abp n GLU 144 Cb 0.10 -1.78 -0.12 0.00 -1.01 0.00 0.00 31.44 28.63 6abp n GLU 144 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 6abp s LEU 145 N -4.31 4.25 0.16 -4.62 2.96 -0.73 -4.99 118.68 111.41 6abp s LEU 145 Ca 0.09 -0.80 -0.22 0.00 -0.22 0.00 0.00 54.13 52.98 6abp s LEU 145 Cb 0.12 -1.96 0.05 0.00 0.50 0.00 0.00 46.19 44.91 6abp s LEU 145 CO 0.52 -0.27 1.62 -0.78 -1.32 0.00 0.00 176.35 176.12 6abp h ASP 146 N 8.33 -0.85 -0.57 3.68 3.58 -1.84 0.20 116.42 128.95 6abp h ASP 146 Ca -0.29 0.16 0.02 0.00 0.42 0.00 0.00 57.03 57.34 6abp h ASP 146 Cb 1.12 0.41 -0.03 0.00 1.72 0.00 0.00 39.33 42.55 6abp h ASP 146 CO 0.63 -0.28 0.38 0.00 -2.88 0.00 0.00 179.24 177.08 6abp h THR 147 N -0.23 1.10 -0.04 2.25 1.03 -1.94 0.16 112.91 115.24 6abp h THR 147 Ca 0.16 -0.24 -0.01 0.00 -0.01 0.00 0.00 66.41 66.30 6abp h THR 147 Cb 0.48 0.33 -0.00 0.00 -1.07 0.00 0.00 68.15 67.89 6abp h THR 147 CO -0.45 0.13 -0.03 0.00 -0.01 0.00 0.00 175.52 175.16 6abp h ALA 148 N 1.66 0.06 -0.55 0.00 0.00 -1.55 -3.05 119.26 115.82 6abp h ALA 148 Ca 0.22 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 6abp h ALA 148 Cb 0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 6abp h ALA 148 CO -0.06 -0.18 0.34 -0.09 0.00 0.00 0.00 179.25 179.27 6abp h ARG 149 N -0.34 0.75 -0.39 0.00 2.43 -0.29 -0.94 114.38 115.60 6abp h ARG 149 Ca 0.01 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.04 6abp h ARG 149 Cb 0.50 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 6abp h ARG 149 CO 0.01 0.53 -0.06 0.00 -1.51 0.00 0.00 179.97 178.94 6abp h ARG 150 N 0.75 0.66 0.30 0.20 3.08 -1.05 -0.26 114.38 118.06 6abp h ARG 150 Ca 0.20 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 6abp h ARG 150 Cb -0.03 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.95 6abp h ARG 150 CO -0.04 0.73 -0.14 0.00 -1.07 0.00 0.00 179.97 179.44 6abp h ARG 151 N 0.61 -0.39 -0.20 0.04 3.08 -1.34 0.72 114.38 116.91 6abp h ARG 151 Ca 0.12 0.03 -0.13 0.00 0.07 0.00 0.00 59.98 60.06 6abp h ARG 151 Cb 0.48 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 6abp h ARG 151 CO 0.03 -0.08 -0.42 1.79 -1.07 0.00 0.00 179.97 180.22 6abp h THR 152 N -0.73 1.31 -0.45 2.04 1.35 -1.06 -0.38 112.91 114.98 6abp h THR 152 Ca -0.04 -1.59 -0.04 0.00 -0.55 0.00 0.00 66.41 64.19 6abp h THR 152 Cb 0.49 1.62 -0.02 0.00 -1.73 0.00 0.00 68.15 68.51 6abp h THR 152 CO 0.07 0.49 0.12 0.74 -0.25 0.00 0.00 175.52 176.69 6abp h THR 153 N 0.39 1.23 -0.33 6.82 2.02 -1.07 -1.28 112.91 120.69 6abp h THR 153 Ca 0.03 -0.79 0.05 0.00 0.77 0.00 0.00 66.41 66.47 6abp h THR 153 Cb 0.90 0.90 -0.05 0.00 -1.74 0.00 0.00 68.15 68.16 6abp h THR 153 CO 0.08 0.28 0.03 1.23 0.37 0.00 0.00 175.52 177.51 6abp h GLY 154 N 0.59 0.35 0.98 2.16 0.00 -0.48 0.20 103.07 106.86 6abp h GLY 154 Ca 0.14 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.48 6abp h GLY 154 CO 0.00 -0.05 0.09 0.23 0.00 0.00 0.00 176.54 176.81 6abp h SER 155 N 0.13 0.18 -0.81 0.19 0.87 -0.88 -1.49 113.55 111.73 6abp h SER 155 Ca 0.16 -0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.66 6abp h SER 155 Cb 0.20 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.08 6abp h SER 155 CO -0.24 0.15 0.38 0.24 -0.53 0.00 0.00 176.83 176.83 6abp h MET 156 N 0.18 1.18 -0.72 2.24 2.86 -1.00 -1.11 114.93 118.55 6abp h MET 156 Ca 0.05 -0.18 -0.04 0.00 -2.06 0.00 0.00 59.70 57.48 6abp h MET 156 Cb 0.01 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.42 6abp h MET 156 CO -0.01 0.91 0.30 -0.44 1.06 0.00 0.00 176.91 178.73 6abp h ASP 157 N 1.16 0.99 -0.43 1.22 3.32 -0.53 0.81 116.42 122.97 6abp h ASP 157 Ca 0.28 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 6abp h ASP 157 Cb 0.13 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 6abp h ASP 157 CO -0.03 0.88 0.04 0.00 -1.72 0.00 0.00 179.24 178.41 6abp h ALA 158 N 1.15 0.58 -0.33 3.45 0.00 -1.03 0.17 119.26 123.24 6abp h ALA 158 Ca 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 6abp h ALA 158 Cb 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 6abp h ALA 158 CO -0.02 0.32 0.13 -0.07 0.00 0.00 0.00 179.25 179.61 6abp h LEU 159 N 0.58 0.46 -0.64 0.00 3.38 -0.55 -0.29 115.31 118.25 6abp h LEU 159 Ca 0.13 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 57.97 6abp h LEU 159 Cb 0.42 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 6abp h LEU 159 CO 0.01 0.51 0.37 0.11 0.09 0.00 0.00 178.44 179.53 6abp h LYS 160 N 0.39 0.68 -0.71 1.13 1.57 -0.73 -0.69 116.57 118.20 6abp h LYS 160 Ca 0.11 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 6abp h LYS 160 Cb 0.20 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 6abp h LYS 160 CO -0.01 0.45 0.36 0.00 -0.57 0.00 0.00 179.45 179.68 6abp h ALA 161 N 1.31 1.29 0.00 3.86 0.00 -0.40 -2.19 119.26 123.13 6abp h ALA 161 Ca 0.28 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.05 6abp h ALA 161 Cb 0.12 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.62 6abp h ALA 161 CO -0.15 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.66 6abp n ALA 162 N -2.43 1.97 0.00 0.00 0.00 -0.14 -4.87 120.51 115.03 6abp n ALA 162 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 6abp n ALA 162 Cb 0.12 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.17 6abp n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 6abp n GLY 163 N 0.66 1.22 3.72 0.00 0.00 -0.82 -5.09 105.19 104.88 6abp n GLY 163 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 6abp n GLY 163 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 6abp s PHE 164 N -2.00 3.38 0.11 1.61 2.19 -0.31 -4.90 117.98 118.06 6abp s PHE 164 Ca 0.00 1.24 -0.32 0.00 0.33 0.00 0.00 56.93 58.19 6abp s PHE 164 Cb 0.00 -3.49 -0.11 0.00 -1.31 0.00 0.00 43.02 38.11 6abp s PHE 164 CO 0.00 -1.54 1.83 -2.30 1.83 0.00 0.00 175.22 175.04 6abp n PRO 165 N 3.56 2.72 -0.08 10.12 -0.01 -1.26 -4.34 135.00 145.71 6abp n PRO 165 Ca 0.08 0.99 0.14 0.00 -0.01 0.00 0.00 63.50 64.71 6abp n PRO 165 Cb 0.45 -2.88 0.54 0.00 -0.01 0.00 0.00 33.50 31.60 6abp n PRO 165 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 175.50 176.42 6abp h GLU 166 N 8.52 0.32 0.00 -0.52 5.08 -1.94 -1.02 114.58 125.02 6abp h GLU 166 Ca -0.47 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 6abp h GLU 166 Cb 1.23 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.41 6abp h GLU 166 CO 0.94 0.21 0.00 0.36 -1.00 0.00 0.00 179.01 179.52 6abp n LYS 167 N -4.46 0.04 -0.94 2.33 2.85 -1.26 -2.65 118.16 114.07 6abp n LYS 167 Ca 0.11 0.18 -0.07 0.00 -1.05 0.00 0.00 58.31 57.47 6abp n LYS 167 Cb 0.45 -1.56 0.26 0.00 -0.65 0.00 0.00 35.03 33.53 6abp n LYS 167 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 6abp n GLN 168 N -1.63 2.97 -3.77 -1.58 6.02 -0.39 -4.86 117.38 114.14 6abp n GLN 168 Ca 0.05 -3.06 -0.37 0.00 -0.01 0.00 0.00 57.00 53.60 6abp n GLN 168 Cb 0.26 -2.08 -0.13 0.00 1.02 0.00 0.00 30.24 29.31 6abp n GLN 168 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 6abp s ILE 169 N -3.08 3.82 -0.09 5.09 1.01 -1.09 -1.96 121.20 124.90 6abp s ILE 169 Ca 0.52 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 60.29 6abp s ILE 169 Cb 0.43 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.83 6abp s ILE 169 CO 0.10 -0.02 -0.13 -0.31 0.00 0.00 0.00 174.94 174.59 6abp s TYR 170 N 1.45 2.78 0.01 3.97 1.51 -0.27 -4.99 117.35 121.82 6abp s TYR 170 Ca 0.01 -0.34 0.05 0.00 -1.01 0.00 0.00 57.07 55.77 6abp s TYR 170 Cb -0.18 -1.74 -0.03 0.00 -0.11 0.00 0.00 41.96 39.90 6abp s TYR 170 CO 0.02 0.03 -0.11 -0.65 -1.11 0.00 0.00 175.55 173.73 6abp s GLN 171 N -0.25 2.37 -0.12 -0.62 -0.21 -1.26 0.70 119.66 120.27 6abp s GLN 171 Ca 0.02 -0.82 -0.08 0.00 0.02 0.00 0.00 55.36 54.50 6abp s GLN 171 Cb -0.13 -2.38 0.04 0.00 1.00 0.00 0.00 33.01 31.54 6abp s GLN 171 CO 0.03 0.58 0.29 0.54 -2.12 0.00 0.00 175.29 174.61 6abp s VAL 172 N -0.95 -0.02 0.32 1.09 0.11 0.26 -4.92 120.40 116.28 6abp s VAL 172 Ca 0.16 0.08 -0.25 0.00 -2.93 0.00 0.00 61.98 59.04 6abp s VAL 172 Cb -0.11 -0.43 -0.10 0.00 -1.53 0.00 0.00 36.38 34.22 6abp s VAL 172 CO 0.06 0.03 0.91 -2.16 -3.33 0.00 0.00 175.10 170.62 6abp s PRO 173 N 0.83 4.51 0.01 1.54 0.04 -1.26 -0.65 135.00 140.02 6abp s PRO 173 Ca -0.06 1.24 0.04 0.00 0.04 0.00 0.00 61.00 62.27 6abp s PRO 173 Cb -0.07 -2.76 -0.03 0.00 0.04 0.00 0.00 34.50 31.68 6abp s PRO 173 CO -0.06 0.27 -0.10 -0.08 0.04 0.00 0.00 177.00 177.08 6abp s THR 174 N -1.65 3.42 -0.66 1.26 -1.32 0.21 -4.78 115.64 112.12 6abp s THR 174 Ca 0.50 -0.85 0.25 0.00 -1.21 0.00 0.00 61.69 60.38 6abp s THR 174 Cb -0.17 -2.47 0.22 0.00 -1.51 0.00 0.00 72.50 68.57 6abp s THR 174 CO 0.22 0.40 1.61 0.11 -2.21 0.00 0.00 174.62 174.76 6abp h LYS 175 N 4.61 0.00 -3.50 7.08 1.57 -1.89 -3.45 116.57 120.99 6abp h LYS 175 Ca -0.48 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.17 6abp h LYS 175 Cb 1.16 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.28 6abp h LYS 175 CO 0.52 0.00 -0.46 -1.54 -0.57 0.00 0.00 179.45 177.40 6abp s SER 176 N -4.65 0.02 -1.25 0.86 1.04 -1.26 -5.06 113.70 103.39 6abp s SER 176 Ca 0.09 -0.24 -0.08 0.00 0.48 0.00 0.00 55.95 56.20 6abp s SER 176 Cb 0.12 0.23 0.18 0.00 0.10 0.00 0.00 66.02 66.65 6abp s SER 176 CO 0.64 -0.42 1.91 0.59 0.98 0.00 0.00 173.24 176.94 6abp n ASN 177 N 1.23 5.90 -2.72 7.02 3.02 -1.26 -4.18 115.26 124.27 6abp n ASN 177 Ca -0.22 -3.18 -0.11 0.00 -0.03 0.00 0.00 54.58 51.05 6abp n ASN 177 Cb 0.56 -1.42 0.00 0.00 -0.61 0.00 0.00 39.78 38.32 6abp n ASN 177 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 6abp n ASP 178 N 2.96 -1.71 0.02 6.41 3.85 -1.26 -4.83 116.55 121.99 6abp n ASP 178 Ca 0.42 -2.58 -0.13 0.00 -0.71 0.00 0.00 54.79 51.79 6abp n ASP 178 Cb 0.33 2.96 -0.09 0.00 -1.35 0.00 0.00 41.12 42.98 6abp n ASP 178 CO 0.00 0.00 0.00 0.40 -1.01 0.00 0.00 177.20 176.59 6abp h ILE 179 N 1.91 1.19 -0.58 2.12 2.04 -1.90 -1.75 117.51 120.55 6abp h ILE 179 Ca -0.28 -0.63 0.05 0.00 1.00 0.00 0.00 64.86 64.99 6abp h ILE 179 Cb 1.11 1.62 -0.05 0.00 -0.74 0.00 0.00 36.82 38.76 6abp h ILE 179 CO 0.36 0.16 0.31 -0.65 0.00 0.00 0.00 178.15 178.34 6abp h PRO 180 N -0.29 0.57 -0.45 2.37 0.11 -1.94 0.29 132.00 132.66 6abp h PRO 180 Ca -0.00 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 6abp h PRO 180 Cb 0.28 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.25 6abp h PRO 180 CO 0.00 0.38 0.03 0.78 -0.21 0.00 0.00 178.00 178.98 6abp h GLY 181 N 0.59 0.84 1.70 -0.55 0.00 -1.75 -2.44 103.07 101.46 6abp h GLY 181 Ca 0.25 -0.60 -0.14 0.00 0.00 0.00 0.00 47.33 46.84 6abp h GLY 181 CO -0.16 0.55 -0.56 0.00 0.00 0.00 0.00 176.54 176.37 6abp h ALA 182 N 0.93 0.86 0.42 3.60 0.00 -1.00 -2.07 119.26 122.00 6abp h ALA 182 Ca 0.13 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 6abp h ALA 182 Cb 0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 6abp h ALA 182 CO 0.02 0.70 -0.34 0.35 0.00 0.00 0.00 179.25 179.97 6abp h PHE 183 N 0.24 -0.92 -0.21 0.00 3.57 -0.90 0.22 116.94 118.94 6abp h PHE 183 Ca 0.00 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 6abp h PHE 183 Cb 1.05 0.35 -0.05 0.00 2.79 0.00 0.00 35.95 40.09 6abp h PHE 183 CO 0.03 -0.50 -0.14 -0.44 -2.23 0.00 0.00 178.31 175.03 6abp h ASP 184 N -0.76 -0.45 0.18 0.41 3.45 -1.34 0.92 116.42 118.83 6abp h ASP 184 Ca -0.04 0.10 0.01 0.00 0.43 0.00 0.00 57.03 57.53 6abp h ASP 184 Cb 0.66 0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 39.64 6abp h ASP 184 CO -0.02 -0.18 -0.28 0.00 -1.57 0.00 0.00 179.24 177.19 6abp h ALA 185 N 1.02 -0.53 -0.63 3.45 0.00 -1.25 -2.41 119.26 118.91 6abp h ALA 185 Ca 0.12 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.98 6abp h ALA 185 Cb 0.31 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 6abp h ALA 185 CO -0.29 -0.84 0.41 0.00 0.00 0.00 0.00 179.25 178.53 6abp h ALA 186 N 0.12 0.81 -0.62 0.00 0.00 -0.35 -2.64 119.26 116.58 6abp h ALA 186 Ca 0.01 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.95 6abp h ALA 186 Cb 0.54 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 6abp h ALA 186 CO -0.12 0.21 0.32 -0.97 0.00 0.00 0.00 179.25 178.69 6abp h ASN 187 N 0.83 0.46 0.03 0.00 -1.24 -0.69 0.85 115.58 115.83 6abp h ASN 187 Ca 0.24 0.04 -0.07 0.00 0.71 0.00 0.00 56.30 57.21 6abp h ASN 187 Cb -0.06 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 38.92 6abp h ASN 187 CO -0.07 0.30 -0.21 0.77 -1.29 0.00 0.00 177.43 176.93 6abp h SER 188 N 0.60 0.31 -0.07 1.15 4.64 -1.10 -2.56 113.55 116.52 6abp h SER 188 Ca 0.28 -0.09 -0.25 0.00 -0.47 0.00 0.00 61.79 61.27 6abp h SER 188 Cb 0.20 -0.08 0.02 0.00 -0.31 0.00 0.00 62.40 62.22 6abp h SER 188 CO -0.19 0.54 -0.92 -0.03 -0.87 0.00 0.00 176.83 175.36 6abp h MET 189 N 0.29 0.75 -0.78 4.77 1.85 -1.04 -3.32 114.93 117.46 6abp h MET 189 Ca 0.05 -0.71 0.04 0.00 -0.61 0.00 0.00 59.70 58.47 6abp h MET 189 Cb 0.54 0.18 -0.05 0.00 0.43 0.00 0.00 31.60 32.70 6abp h MET 189 CO 0.04 1.30 0.49 -0.07 -0.40 0.00 0.00 176.91 178.26 6abp h LEU 190 N 0.47 0.80 -0.35 3.39 3.38 -0.44 -1.81 115.31 120.75 6abp h LEU 190 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 6abp h LEU 190 Cb 1.56 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.14 6abp h LEU 190 CO 0.18 0.54 0.00 1.33 0.09 0.00 0.00 178.44 180.58 6abp n VAL 191 N -4.63 0.75 0.73 1.22 0.24 -1.15 -2.40 118.33 113.09 6abp n VAL 191 Ca 0.10 0.12 0.12 0.00 -2.04 0.00 0.00 64.34 62.64 6abp n VAL 191 Cb 0.11 -0.96 0.28 0.00 -1.47 0.00 0.00 33.84 31.80 6abp n VAL 191 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 6abp n GLN 192 N -2.01 0.19 -3.16 7.34 6.02 -0.69 -4.48 117.38 120.59 6abp n GLN 192 Ca 0.04 0.08 -0.25 0.00 -0.01 0.00 0.00 57.00 56.86 6abp n GLN 192 Cb 0.26 -1.64 -0.05 0.00 1.02 0.00 0.00 30.24 29.83 6abp n GLN 192 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 6abp n HIS 193 N -1.93 2.56 0.33 1.08 8.25 -1.01 -4.91 115.22 119.59 6abp n HIS 193 Ca 0.05 -3.95 0.21 0.00 -0.26 0.00 0.00 57.72 53.77 6abp n HIS 193 Cb 0.40 -0.48 1.13 0.00 1.12 0.00 0.00 29.99 32.17 6abp n HIS 193 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 6abp h PRO 194 N 3.45 0.00 0.00 -0.41 0.13 -1.79 -2.24 132.00 131.15 6abp h PRO 194 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 6abp h PRO 194 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 6abp h PRO 194 CO 0.71 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.53 6abp h GLU 195 N 0.00 0.00 -6.22 0.86 9.09 -1.94 -3.44 114.58 112.94 6abp h GLU 195 Ca 0.00 0.00 -0.55 0.00 0.05 0.00 0.00 59.36 58.86 6abp h GLU 195 Cb 0.04 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.10 6abp h GLU 195 CO -0.00 0.00 0.21 0.08 0.05 0.00 0.00 179.01 179.35 6abp s VAL 196 N -3.32 4.94 -0.09 -1.06 1.01 -0.85 -4.91 120.40 116.12 6abp s VAL 196 Ca 0.05 1.72 0.21 0.00 0.00 0.00 0.00 61.98 63.96 6abp s VAL 196 Cb 0.10 -4.16 -0.28 0.00 0.00 0.00 0.00 36.38 32.03 6abp s VAL 196 CO 0.50 0.23 0.44 0.29 0.00 0.00 0.00 175.10 176.56 6abp n LYS 197 N 3.72 0.66 -3.80 2.72 4.76 -0.12 -4.97 118.16 121.12 6abp n LYS 197 Ca 0.02 -0.11 -0.13 0.00 -2.87 0.00 0.00 58.31 55.22 6abp n LYS 197 Cb 0.51 -1.56 -0.15 0.00 -1.84 0.00 0.00 35.03 32.00 6abp n LYS 197 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 6abp s HIS 198 N -3.22 -0.05 -0.05 2.13 3.76 -1.07 -4.87 115.29 111.92 6abp s HIS 198 Ca -0.08 0.20 0.05 0.00 -0.15 0.00 0.00 55.06 55.09 6abp s HIS 198 Cb 0.11 -0.09 -0.01 0.00 1.11 0.00 0.00 32.58 33.71 6abp s HIS 198 CO 0.88 -0.08 -0.21 -1.58 -0.85 0.00 0.00 174.74 172.90 6abp s TRP 199 N 0.61 2.05 -0.21 1.40 0.52 -0.44 -1.52 118.94 121.35 6abp s TRP 199 Ca -0.05 -0.60 -0.14 0.00 0.02 0.00 0.00 56.10 55.33 6abp s TRP 199 Cb -0.07 -1.36 -0.04 0.00 -1.15 0.00 0.00 33.47 30.85 6abp s TRP 199 CO -0.02 -0.19 0.29 -0.51 0.02 0.00 0.00 176.95 176.54 6abp s LEU 200 N -0.05 4.16 -0.25 2.99 1.43 -0.40 -1.11 118.68 125.45 6abp s LEU 200 Ca -0.04 0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 53.38 6abp s LEU 200 Cb -0.13 -2.34 -0.01 0.00 0.03 0.00 0.00 46.19 43.74 6abp s LEU 200 CO 0.03 0.01 0.02 -0.63 0.23 0.00 0.00 176.35 176.00 6abp s ILE 201 N 1.06 3.76 -0.13 -0.59 1.01 0.44 0.20 121.20 126.95 6abp s ILE 201 Ca 0.14 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.29 6abp s ILE 201 Cb -0.14 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 6abp s ILE 201 CO 0.06 0.31 0.05 -0.69 0.00 0.00 0.00 174.94 174.67 6abp s VAL 202 N 1.52 4.72 0.13 2.92 1.01 0.75 -4.18 120.40 127.26 6abp s VAL 202 Ca 0.05 -0.08 -0.24 0.00 0.00 0.00 0.00 61.98 61.71 6abp s VAL 202 Cb -0.15 -3.06 0.08 0.00 0.00 0.00 0.00 36.38 33.25 6abp s VAL 202 CO -0.00 0.55 0.67 -0.83 0.00 0.00 0.00 175.10 175.49 6abp s GLY 203 N -0.43 -0.56 0.49 4.51 0.00 -1.26 -0.47 107.32 109.60 6abp s GLY 203 Ca 0.09 0.57 0.29 0.00 0.00 0.00 0.00 44.72 45.67 6abp s GLY 203 CO 0.02 0.19 1.81 0.00 0.00 0.00 0.00 173.10 175.12 6abp h MET 204 N 2.00 0.00 -3.92 2.90 -0.00 -1.85 -3.44 114.93 110.62 6abp h MET 204 Ca -0.31 0.00 -0.16 0.00 -0.00 0.00 0.00 59.70 59.23 6abp h MET 204 Cb 1.29 0.00 -0.09 0.00 -0.00 0.00 0.00 31.60 32.80 6abp h MET 204 CO 0.36 0.00 -0.19 0.54 -0.00 0.00 0.00 176.91 177.62 6abp s ASN 205 N -5.85 0.32 0.19 -0.10 2.20 -1.26 -4.49 114.94 105.95 6abp s ASN 205 Ca 0.04 -1.20 -0.13 0.00 -0.94 0.00 0.00 52.86 50.63 6abp s ASN 205 Cb 0.07 0.60 0.20 0.00 -2.00 0.00 0.00 41.25 40.12 6abp s ASN 205 CO 0.60 -1.19 1.71 0.44 -2.94 0.00 0.00 177.10 175.72 6abp h ASP 206 N 2.23 -0.00 -0.26 3.54 3.32 -1.22 -2.23 116.42 121.81 6abp h ASP 206 Ca -0.28 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 56.82 6abp h ASP 206 Cb 1.25 0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.90 6abp h ASP 206 CO 0.39 0.03 0.04 0.28 -1.72 0.00 0.00 179.24 178.26 6abp h SER 207 N 0.24 0.49 -0.44 6.45 0.02 -1.91 0.27 113.55 118.66 6abp h SER 207 Ca 0.25 -0.08 -0.14 0.00 -0.84 0.00 0.00 61.79 60.98 6abp h SER 207 Cb 0.34 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 6abp h SER 207 CO -0.33 0.53 -0.29 0.74 -1.14 0.00 0.00 176.83 176.34 6abp h THR 208 N 0.51 1.27 -0.23 -2.27 2.02 -1.66 -1.25 112.91 111.31 6abp h THR 208 Ca 0.12 -1.46 -0.12 0.00 0.77 0.00 0.00 66.41 65.71 6abp h THR 208 Cb 0.27 1.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.90 6abp h THR 208 CO 0.00 0.50 -0.34 0.58 0.37 0.00 0.00 175.52 176.63 6abp h VAL 209 N 0.83 1.32 -0.93 3.16 2.07 -1.04 -2.38 116.25 119.27 6abp h VAL 209 Ca 0.09 -1.55 0.00 0.00 0.82 0.00 0.00 66.70 66.07 6abp h VAL 209 Cb 0.87 1.76 -0.05 0.00 -1.52 0.00 0.00 31.29 32.36 6abp h VAL 209 CO 0.08 0.48 0.59 -0.07 0.02 0.00 0.00 177.57 178.68 6abp h LEU 210 N 0.34 1.09 -0.84 2.57 3.38 -0.20 0.11 115.31 121.76 6abp h LEU 210 Ca 0.02 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 6abp h LEU 210 Cb 0.93 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 6abp h LEU 210 CO 0.08 0.81 0.11 1.23 0.09 0.00 0.00 178.44 180.76 6abp h GLY 211 N 1.28 1.05 0.76 0.83 0.00 -1.01 0.38 103.07 106.36 6abp h GLY 211 Ca 0.34 -0.66 0.03 0.00 0.00 0.00 0.00 47.33 47.03 6abp h GLY 211 CO -0.07 0.62 -0.00 -1.33 0.00 0.00 0.00 176.54 175.75 6abp h GLY 212 N 1.03 0.14 0.89 4.60 0.00 -0.98 -1.75 103.07 107.00 6abp h GLY 212 Ca 0.19 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 6abp h GLY 212 CO 0.01 -0.03 0.08 -2.08 0.00 0.00 0.00 176.54 174.51 6abp h VAL 213 N 0.05 1.21 -0.95 4.60 2.07 -0.31 -2.02 116.25 120.89 6abp h VAL 213 Ca 0.07 -0.67 0.10 0.00 0.82 0.00 0.00 66.70 67.03 6abp h VAL 213 Cb 0.09 1.13 -0.08 0.00 -1.52 0.00 0.00 31.29 30.91 6abp h VAL 213 CO -0.12 0.22 0.59 0.03 0.02 0.00 0.00 177.57 178.30 6abp h ARG 214 N 0.28 0.93 -0.60 1.57 2.47 -0.80 -2.03 114.38 116.20 6abp h ARG 214 Ca 0.09 -0.06 -0.06 0.00 -1.26 0.00 0.00 59.98 58.69 6abp h ARG 214 Cb 0.26 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.35 6abp h ARG 214 CO -0.00 0.62 0.12 0.00 0.56 0.00 0.00 179.97 181.27 6abp h ALA 215 N 1.50 0.80 -0.50 0.04 0.00 -1.11 -2.67 119.26 117.32 6abp h ALA 215 Ca 0.46 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 6abp h ALA 215 Cb 0.40 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 6abp h ALA 215 CO -0.25 0.53 0.14 1.79 0.00 0.00 0.00 179.25 181.46 6abp h THR 216 N 0.89 1.21 -0.74 0.00 1.35 -0.69 -1.88 112.91 113.04 6abp h THR 216 Ca 0.19 -0.73 -0.02 0.00 -0.55 0.00 0.00 66.41 65.30 6abp h THR 216 Cb 0.39 0.68 -0.03 0.00 -1.73 0.00 0.00 68.15 67.45 6abp h THR 216 CO 0.01 0.27 0.39 -0.33 -0.25 0.00 0.00 175.52 175.60 6abp h GLU 217 N 0.72 1.05 0.00 4.72 5.08 -1.20 -1.99 114.58 122.97 6abp h GLU 217 Ca 0.16 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 6abp h GLU 217 Cb 0.25 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.30 6abp h GLU 217 CO -0.01 0.80 0.00 0.41 -1.00 0.00 0.00 179.01 179.21 6abp n GLY 218 N -1.04 -1.35 1.71 -3.84 0.00 -0.75 -2.17 105.19 97.75 6abp n GLY 218 Ca 0.06 0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.18 6abp n GLY 218 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 6abp n GLN 219 N -2.11 4.40 -0.94 1.61 1.13 -0.85 -4.97 117.38 115.65 6abp n GLN 219 Ca 0.03 -3.11 0.00 0.00 -1.94 0.00 0.00 57.00 51.99 6abp n GLN 219 Cb 0.27 -2.18 0.00 0.00 0.11 0.00 0.00 30.24 28.44 6abp n GLN 219 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 6abp n GLY 220 N 0.31 0.48 3.82 1.08 0.00 -0.92 -5.05 105.19 104.90 6abp n GLY 220 Ca 0.28 -0.47 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 6abp n GLY 220 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 6abp s PHE 221 N -2.00 3.71 0.45 1.61 0.08 -0.81 -5.04 117.98 115.99 6abp s PHE 221 Ca 0.00 1.02 0.00 0.00 0.12 0.00 0.00 56.93 58.07 6abp s PHE 221 Cb 0.00 -2.35 -0.01 0.00 -0.57 0.00 0.00 43.02 40.09 6abp s PHE 221 CO 0.00 0.58 0.67 -1.59 -0.10 0.00 0.00 175.22 174.78 6abp s LYS 222 N -0.88 3.11 0.37 0.44 -2.85 -1.26 -4.32 119.74 114.35 6abp s LYS 222 Ca 0.25 -0.45 0.13 0.00 -1.00 0.00 0.00 55.97 54.90 6abp s LYS 222 Cb -0.17 -2.56 0.96 0.00 -2.06 0.00 0.00 37.83 34.01 6abp s LYS 222 CO 0.14 -0.24 1.80 0.00 0.10 0.00 0.00 175.35 177.14 6abp h ALA 223 N 0.41 2.01 0.00 0.59 0.00 -1.89 -0.87 119.26 119.51 6abp h ALA 223 Ca -0.46 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 6abp h ALA 223 Cb 1.25 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 6abp h ALA 223 CO 0.58 -0.37 -0.04 0.00 0.00 0.00 0.00 179.25 179.41 6abp h ALA 224 N 1.63 1.19 -0.58 0.00 0.00 -1.94 -2.44 119.26 117.11 6abp h ALA 224 Ca 0.55 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.43 6abp h ALA 224 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 6abp h ALA 224 CO -0.30 0.05 0.00 -0.25 0.00 0.00 0.00 179.25 178.76 6abp n ASP 225 N -3.41 4.55 -3.91 0.00 10.43 -0.33 -4.89 116.55 118.99 6abp n ASP 225 Ca -0.02 -2.48 -0.19 0.00 2.57 0.00 0.00 54.79 54.67 6abp n ASP 225 Cb 0.17 -0.57 -0.16 0.00 1.84 0.00 0.00 41.12 42.39 6abp n ASP 225 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 6abp s ILE 226 N -1.95 0.51 -0.14 0.53 -1.09 -0.92 -1.32 121.20 116.82 6abp s ILE 226 Ca 0.47 -0.15 -0.01 0.00 -2.23 0.00 0.00 60.65 58.74 6abp s ILE 226 Cb 0.31 -0.51 0.03 0.00 -1.58 0.00 0.00 42.46 40.72 6abp s ILE 226 CO 0.21 0.20 -0.06 -0.63 -1.23 0.00 0.00 174.94 173.43 6abp s ILE 227 N 0.63 1.01 -0.07 2.92 1.01 -0.27 -4.59 121.20 121.84 6abp s ILE 227 Ca -0.08 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.17 6abp s ILE 227 Cb -0.11 -1.12 0.01 0.00 0.01 0.00 0.00 42.46 41.25 6abp s ILE 227 CO 0.00 0.25 -0.13 -0.83 0.00 0.00 0.00 174.94 174.23 6abp s GLY 228 N 1.70 0.85 -0.22 6.18 0.00 -0.33 -0.42 107.32 115.07 6abp s GLY 228 Ca 0.03 -0.48 0.02 0.00 0.00 0.00 0.00 44.72 44.29 6abp s GLY 228 CO -0.08 0.11 -0.16 -0.42 0.00 0.00 0.00 173.10 172.56 6abp s ILE 229 N 0.69 2.11 0.58 0.90 1.01 -1.26 -0.35 121.20 124.88 6abp s ILE 229 Ca -0.14 -1.26 -0.09 0.00 0.00 0.00 0.00 60.65 59.16 6abp s ILE 229 Cb -0.16 -2.05 0.13 0.00 0.01 0.00 0.00 42.46 40.39 6abp s ILE 229 CO 0.03 0.28 0.79 0.61 0.00 0.00 0.00 174.94 176.65 6abp n GLY 230 N 4.53 -1.08 2.99 6.18 0.00 -0.06 -4.77 105.19 112.98 6abp n GLY 230 Ca -0.18 -1.74 -0.22 0.00 0.00 0.00 0.00 46.02 43.89 6abp n GLY 230 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 6abp s ILE 231 N -2.65 0.85 0.00 -0.61 1.01 -1.26 -0.29 121.20 118.26 6abp s ILE 231 Ca 0.45 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.75 6abp s ILE 231 Cb -0.01 -0.78 0.00 0.00 0.01 0.00 0.00 42.46 41.67 6abp s ILE 231 CO 0.32 0.28 0.00 0.59 0.00 0.00 0.00 174.94 176.12 6abp n ASN 232 N 3.58 0.00 0.00 3.58 3.02 -0.47 -0.68 115.26 124.29 6abp n ASN 232 Ca -0.21 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.34 6abp n ASN 232 Cb 0.53 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 6abp n ASN 232 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 6abp n GLY 233 N 0.00 2.17 0.32 7.41 0.00 -1.17 -4.26 105.19 109.67 6abp n GLY 233 Ca 0.00 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.12 6abp n GLY 233 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 6abp h VAL 234 N 0.00 0.91 0.00 1.61 -1.51 -1.95 -1.57 116.25 113.73 6abp h VAL 234 Ca 0.00 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.41 6abp h VAL 234 Cb 0.00 0.72 0.00 0.00 -2.13 0.00 0.00 31.29 29.88 6abp h VAL 234 CO 0.00 0.03 0.00 0.47 -1.23 0.00 0.00 177.57 176.84 6abp n ASP 235 N -4.47 0.00 -1.27 4.19 8.00 -1.26 -3.52 116.55 118.22 6abp n ASP 235 Ca 0.05 0.50 0.11 0.00 0.71 0.00 0.00 54.79 56.15 6abp n ASP 235 Cb 0.31 -0.50 0.30 0.00 -0.02 0.00 0.00 41.12 41.21 6abp n ASP 235 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 6abp n ALA 236 N -1.50 2.37 -0.12 2.24 0.00 -0.59 -4.59 120.51 118.32 6abp n ALA 236 Ca 0.06 -1.29 -0.09 0.00 0.00 0.00 0.00 53.44 52.12 6abp n ALA 236 Cb 0.29 -0.86 0.05 0.00 0.00 0.00 0.00 19.45 18.93 6abp n ALA 236 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 6abp h VAL 237 N 4.00 1.27 0.00 0.00 2.07 -1.66 -1.05 116.25 120.88 6abp h VAL 237 Ca 0.00 -1.35 -0.07 0.00 0.82 0.00 0.00 66.70 66.10 6abp h VAL 237 Cb 0.97 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 6abp h VAL 237 CO 0.01 0.46 -0.34 0.77 0.02 0.00 0.00 177.57 178.48 6abp h SER 238 N 0.75 0.00 -0.16 0.57 4.64 -1.87 -1.63 113.55 115.85 6abp h SER 238 Ca 0.10 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.31 6abp h SER 238 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 6abp h SER 238 CO 0.06 0.34 -0.34 -0.08 -0.87 0.00 0.00 176.83 175.94 6abp h GLU 239 N 0.00 0.51 0.00 4.77 4.57 -1.71 -3.15 114.58 119.57 6abp h GLU 239 Ca -0.00 -0.34 -0.03 0.00 -1.18 0.00 0.00 59.36 57.81 6abp h GLU 239 Cb 0.63 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.27 6abp h GLU 239 CO 0.04 0.95 -0.13 -0.07 -1.18 0.00 0.00 179.01 178.62 6abp h LEU 240 N 0.14 0.00 0.00 1.64 3.38 -0.80 -2.85 115.31 116.82 6abp h LEU 240 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 6abp h LEU 240 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 6abp h LEU 240 CO 0.08 0.13 -0.06 0.28 0.09 0.00 0.00 178.44 178.95 6abp h SER 241 N 0.00 0.00 -3.90 -0.43 0.02 -1.30 -3.44 113.55 104.49 6abp h SER 241 Ca -0.00 -0.02 -0.54 0.00 -0.84 0.00 0.00 61.79 60.39 6abp h SER 241 Cb 0.53 0.00 0.19 0.00 0.14 0.00 0.00 62.40 63.26 6abp h SER 241 CO 0.02 0.01 0.07 0.29 -1.14 0.00 0.00 176.83 176.07 6abp n LYS 242 N -2.39 0.12 -0.09 3.45 5.02 -1.08 -4.93 118.16 118.27 6abp n LYS 242 Ca 0.05 0.11 -0.11 0.00 -2.02 0.00 0.00 58.31 56.34 6abp n LYS 242 Cb 0.45 -2.24 -0.04 0.00 -0.02 0.00 0.00 35.03 33.18 6abp n LYS 242 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 6abp h ALA 243 N -0.92 0.37 -2.73 7.82 0.00 -1.91 -3.44 119.26 118.45 6abp h ALA 243 Ca -0.46 -0.24 -0.63 0.00 0.00 0.00 0.00 54.91 53.58 6abp h ALA 243 Cb 1.31 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 6abp h ALA 243 CO 0.43 0.14 -0.40 -0.65 0.00 0.00 0.00 179.25 178.77 6abp s GLN 244 N -4.90 3.56 0.56 0.00 -0.21 -1.26 -5.07 119.66 112.33 6abp s GLN 244 Ca -0.13 -0.10 -0.19 0.00 0.02 0.00 0.00 55.36 54.96 6abp s GLN 244 Cb 0.08 -3.09 -0.05 0.00 1.00 0.00 0.00 33.01 30.95 6abp s GLN 244 CO 0.76 0.66 1.12 0.00 -2.12 0.00 0.00 175.29 175.71 6abp s ALA 245 N -1.29 2.67 0.20 6.09 0.00 -1.26 -5.04 121.76 123.13 6abp s ALA 245 Ca 0.27 0.77 0.01 0.00 0.00 0.00 0.00 51.96 53.01 6abp s ALA 245 Cb -0.13 -3.35 -0.00 0.00 0.00 0.00 0.00 23.12 19.64 6abp s ALA 245 CO 0.16 -0.83 0.04 0.25 0.00 0.00 0.00 175.76 175.38 6abp n THR 246 N -1.47 0.00 0.64 0.00 -2.24 -1.26 -4.88 114.28 105.07 6abp n THR 246 Ca 0.11 -1.09 0.10 0.00 -2.27 0.00 0.00 64.05 60.90 6abp n THR 246 Cb 0.51 0.33 0.42 0.00 -2.10 0.00 0.00 70.33 69.49 6abp n THR 246 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 6abp n GLY 247 N 1.39 -1.20 3.51 3.38 0.00 -1.26 -4.38 105.19 106.63 6abp n GLY 247 Ca -0.05 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 6abp n GLY 247 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 6abp s PHE 248 N -3.03 2.57 0.06 1.61 5.36 -1.26 -1.19 117.98 122.09 6abp s PHE 248 Ca 0.09 -0.16 -0.04 0.00 -0.96 0.00 0.00 56.93 55.86 6abp s PHE 248 Cb 0.12 -4.38 -0.28 0.00 -0.34 0.00 0.00 43.02 38.14 6abp s PHE 248 CO 0.37 -1.71 1.09 -0.92 -1.46 0.00 0.00 175.22 172.58 6abp h TYR 249 N 9.65 0.48 -1.95 10.12 3.20 -0.89 -3.47 116.97 134.10 6abp h TYR 249 Ca -0.28 -0.35 0.21 0.00 3.14 0.00 0.00 58.73 61.45 6abp h TYR 249 Cb 1.06 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 39.28 6abp h TYR 249 CO 1.01 1.30 0.57 0.41 -1.64 0.00 0.00 178.16 179.81 6abp n GLY 250 N 1.56 0.47 3.07 1.82 0.00 -1.23 -4.25 105.19 106.62 6abp n GLY 250 Ca -0.10 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 44.80 6abp n GLY 250 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 6abp s SER 251 N -2.89 0.03 -0.39 1.61 0.15 0.83 -0.88 113.70 112.16 6abp s SER 251 Ca 0.20 -0.15 -0.22 0.00 0.70 0.00 0.00 55.95 56.48 6abp s SER 251 Cb -0.01 0.20 0.01 0.00 -1.71 0.00 0.00 66.02 64.51 6abp s SER 251 CO 0.01 -0.29 0.70 -0.76 1.20 0.00 0.00 173.24 174.09 6abp s LEU 252 N -1.09 4.26 -0.53 3.45 1.43 0.61 -0.51 118.68 126.30 6abp s LEU 252 Ca -0.12 0.08 -0.23 0.00 -1.03 0.00 0.00 54.13 52.83 6abp s LEU 252 Cb -0.07 -2.86 0.04 0.00 0.03 0.00 0.00 46.19 43.33 6abp s LEU 252 CO 0.01 -0.71 0.84 -0.22 0.23 0.00 0.00 176.35 176.50 6abp s LEU 253 N 2.91 4.34 0.00 1.79 2.96 0.45 -1.37 118.68 129.76 6abp s LEU 253 Ca 0.27 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 6abp s LEU 253 Cb -0.14 -2.75 0.00 0.00 0.50 0.00 0.00 46.19 43.80 6abp s LEU 253 CO 0.17 -1.10 0.00 -0.81 -1.32 0.00 0.00 176.35 173.29 6abp n PRO 254 N 7.03 2.61 -3.37 0.98 -0.05 -1.26 -1.86 135.00 139.09 6abp n PRO 254 Ca -0.00 0.00 -0.26 0.00 -0.05 0.00 0.00 63.50 63.19 6abp n PRO 254 Cb 0.47 0.00 -0.08 0.00 -0.05 0.00 0.00 33.50 33.84 6abp n PRO 254 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 175.50 175.88 6abp n SER 255 N 0.00 2.21 0.00 3.54 7.64 -1.26 -4.89 113.62 120.87 6abp n SER 255 Ca 0.00 -3.11 0.08 0.00 1.01 0.00 0.00 58.87 56.85 6abp n SER 255 Cb 0.00 -0.66 0.49 0.00 -1.01 0.00 0.00 64.21 63.03 6abp n SER 255 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 6abp h PRO 256 N 4.26 0.41 -0.18 1.43 0.13 -1.91 -1.44 132.00 134.69 6abp h PRO 256 Ca 0.15 -0.02 0.03 0.00 -0.87 0.00 0.00 66.00 65.29 6abp h PRO 256 Cb 0.76 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 31.77 6abp h PRO 256 CO 0.67 0.27 0.00 0.38 -0.23 0.00 0.00 178.00 179.09 6abp h ASP 257 N 0.42 -0.07 -0.28 1.44 2.03 -1.90 -0.90 116.42 117.16 6abp h ASP 257 Ca 0.18 0.04 0.03 0.00 -0.73 0.00 0.00 57.03 56.55 6abp h ASP 257 Cb 0.19 0.07 -0.03 0.00 -0.83 0.00 0.00 39.33 38.73 6abp h ASP 257 CO -0.04 -0.01 0.10 0.58 -1.03 0.00 0.00 179.24 178.84 6abp h VAL 258 N 0.06 0.94 -0.34 4.15 2.07 -1.73 -1.48 116.25 119.92 6abp h VAL 258 Ca 0.08 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.56 6abp h VAL 258 Cb 0.10 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 6abp h VAL 258 CO -0.14 0.04 0.12 0.45 0.02 0.00 0.00 177.57 178.06 6abp h HIS 259 N 0.23 0.21 -0.18 1.57 3.86 -1.15 0.49 115.15 120.19 6abp h HIS 259 Ca 0.12 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.32 6abp h HIS 259 Cb 0.08 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 6abp h HIS 259 CO -0.13 0.09 -0.01 0.78 0.86 0.00 0.00 177.93 179.52 6abp h GLY 260 N 0.26 0.34 0.66 2.45 0.00 -1.04 -2.19 103.07 103.55 6abp h GLY 260 Ca 0.16 -0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.17 6abp h GLY 260 CO -0.16 0.24 -0.15 -1.82 0.00 0.00 0.00 176.54 174.64 6abp h TYR 261 N 0.06 0.33 -0.35 5.60 5.03 -1.21 -3.15 116.97 123.29 6abp h TYR 261 Ca 0.05 -0.12 -0.12 0.00 2.58 0.00 0.00 58.73 61.12 6abp h TYR 261 Cb 0.41 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.61 6abp h TYR 261 CO 0.04 0.75 -0.26 -0.22 -1.32 0.00 0.00 178.16 177.15 6abp h LYS 262 N -0.18 0.80 -0.50 1.82 3.64 -1.01 0.26 116.57 121.39 6abp h LYS 262 Ca 0.01 -0.39 -0.03 0.00 -1.27 0.00 0.00 60.65 58.97 6abp h LYS 262 Cb 0.72 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.52 6abp h LYS 262 CO 0.04 1.02 0.20 0.66 -2.27 0.00 0.00 179.45 179.09 6abp h SER 263 N 0.58 0.70 -0.11 4.20 4.64 -1.51 -1.63 113.55 120.42 6abp h SER 263 Ca 0.07 -0.17 0.02 0.00 -0.47 0.00 0.00 61.79 61.23 6abp h SER 263 Cb 0.83 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.72 6abp h SER 263 CO 0.07 0.68 -0.03 0.28 -0.87 0.00 0.00 176.83 176.96 6abp h SER 264 N 0.67 -0.12 -0.71 4.97 0.02 -1.48 -1.43 113.55 115.48 6abp h SER 264 Ca 0.17 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.17 6abp h SER 264 Cb 0.21 0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 6abp h SER 264 CO -0.01 -0.05 0.46 -0.08 -1.14 0.00 0.00 176.83 176.01 6abp h GLU 265 N -0.01 0.89 -0.54 3.45 4.81 -0.35 -1.42 114.58 121.40 6abp h GLU 265 Ca 0.05 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 6abp h GLU 265 Cb 0.09 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 6abp h GLU 265 CO -0.12 0.59 0.22 0.52 -0.73 0.00 0.00 179.01 179.49 6abp h MET 266 N 0.91 0.80 -0.20 1.92 2.86 -1.27 -0.96 114.93 119.00 6abp h MET 266 Ca 0.27 -0.14 0.03 0.00 -2.06 0.00 0.00 59.70 57.80 6abp h MET 266 Cb -0.04 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 6abp h MET 266 CO -0.08 0.69 0.04 1.25 1.06 0.00 0.00 176.91 179.87 6abp h LEU 267 N 0.73 0.01 0.07 1.22 5.85 -0.98 -2.05 115.31 120.15 6abp h LEU 267 Ca 0.18 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.94 6abp h LEU 267 Cb 0.19 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 6abp h LEU 267 CO -0.02 0.03 -0.10 0.22 -0.34 0.00 0.00 178.44 178.23 6abp h TYR 268 N 0.11 -0.27 -0.57 1.25 5.03 -1.14 0.12 116.97 121.51 6abp h TYR 268 Ca 0.09 0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.48 6abp h TYR 268 Cb 0.08 0.11 -0.03 0.00 1.55 0.00 0.00 36.73 38.44 6abp h TYR 268 CO -0.14 -0.16 0.38 -0.91 -1.32 0.00 0.00 178.16 176.01 6abp h ASN 269 N -0.21 0.43 -0.13 -2.11 2.35 -1.10 0.21 115.58 115.03 6abp h ASN 269 Ca 0.02 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.69 6abp h ASN 269 Cb 0.22 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.51 6abp h ASN 269 CO -0.06 0.27 -0.24 -0.25 -1.65 0.00 0.00 177.43 175.50 6abp h TRP 270 N 0.49 0.49 -0.08 1.19 7.01 -0.94 0.46 115.95 124.57 6abp h TRP 270 Ca 0.26 -0.18 -0.04 0.00 2.11 0.00 0.00 58.89 61.04 6abp h TRP 270 Cb 0.38 -0.09 -0.00 0.00 -2.10 0.00 0.00 29.16 27.34 6abp h TRP 270 CO -0.00 0.86 -0.12 0.28 -2.79 0.00 0.00 178.44 176.67 6abp h VAL 271 N -0.01 1.39 0.00 2.65 2.07 -0.31 -0.66 116.25 121.37 6abp h VAL 271 Ca 0.01 -1.36 -0.16 0.00 0.82 0.00 0.00 66.70 66.01 6abp h VAL 271 Cb 0.83 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 6abp h VAL 271 CO 0.05 0.38 -0.77 0.00 0.02 0.00 0.00 177.57 177.25 6abp h ALA 272 N 0.53 0.50 0.00 1.67 0.00 -0.68 -3.39 119.26 117.89 6abp h ALA 272 Ca 0.01 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.22 6abp h ALA 272 Cb 0.67 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.34 6abp h ALA 272 CO 0.03 0.96 -0.06 1.63 0.00 0.00 0.00 179.25 181.81 6abp n LYS 273 N -3.29 0.66 -2.80 0.00 5.02 0.10 -4.99 118.16 112.87 6abp n LYS 273 Ca 0.01 -0.85 -0.17 0.00 -2.02 0.00 0.00 58.31 55.28 6abp n LYS 273 Cb 0.84 -0.64 -0.00 0.00 -0.02 0.00 0.00 35.03 35.21 6abp n LYS 273 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 6abp n ASP 274 N -0.16 -4.05 -4.59 4.39 2.03 -0.25 -4.89 116.55 109.04 6abp n ASP 274 Ca 0.01 -0.04 -0.43 0.00 0.52 0.00 0.00 54.79 54.85 6abp n ASP 274 Cb 0.48 -3.39 -0.04 0.00 -0.72 0.00 0.00 41.12 37.45 6abp n ASP 274 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 6abp s VAL 275 N -2.77 4.59 -0.08 5.18 1.01 -0.90 -4.94 120.40 122.49 6abp s VAL 275 Ca 0.16 0.98 -0.30 0.00 0.00 0.00 0.00 61.98 62.82 6abp s VAL 275 Cb -0.08 -4.33 -0.02 0.00 0.00 0.00 0.00 36.38 31.95 6abp s VAL 275 CO 0.20 -0.59 1.00 -0.70 0.00 0.00 0.00 175.10 175.01 6abp s GLU 276 N 3.45 4.45 0.67 2.72 2.56 -1.26 -2.88 118.70 128.40 6abp s GLU 276 Ca 0.36 1.40 -0.13 0.00 0.00 0.00 0.00 54.97 56.60 6abp s GLU 276 Cb -0.12 -3.52 -0.00 0.00 2.00 0.00 0.00 34.13 32.49 6abp s GLU 276 CO 0.20 -0.26 1.07 -1.25 -0.56 0.00 0.00 175.26 174.46 6abp s PRO 277 N 1.80 2.94 0.64 4.30 0.04 -1.26 -4.99 135.00 138.47 6abp s PRO 277 Ca 0.49 1.15 -0.17 0.00 0.04 0.00 0.00 61.00 62.50 6abp s PRO 277 Cb -0.19 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 6abp s PRO 277 CO 0.20 -1.11 0.81 -0.35 0.04 0.00 0.00 177.00 176.59 6abp n PRO 278 N -2.69 0.64 0.11 0.56 -0.04 -1.26 -4.89 135.00 127.43 6abp n PRO 278 Ca 0.09 0.26 -0.02 0.00 -0.04 0.00 0.00 63.50 63.78 6abp n PRO 278 Cb 0.53 -2.03 0.03 0.00 -0.04 0.00 0.00 33.50 31.99 6abp n PRO 278 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 6abp h LYS 279 N 0.14 0.00 -3.25 0.54 1.79 -1.92 -3.41 116.57 110.46 6abp h LYS 279 Ca -0.47 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 57.70 6abp h LYS 279 Cb 1.36 0.00 -0.35 0.00 -1.58 0.00 0.00 32.23 31.66 6abp h LYS 279 CO 0.48 0.73 -0.66 0.12 -1.08 0.00 0.00 179.45 179.04 6abp s PHE 280 N -3.06 -0.09 -0.27 -1.35 2.19 -1.26 -1.09 117.98 113.06 6abp s PHE 280 Ca 0.01 0.42 0.02 0.00 0.33 0.00 0.00 56.93 57.71 6abp s PHE 280 Cb 0.10 -0.26 0.07 0.00 -1.31 0.00 0.00 43.02 41.62 6abp s PHE 280 CO 0.77 -0.20 -0.05 0.99 1.83 0.00 0.00 175.22 178.57 6abp s THR 281 N 1.77 1.87 -0.26 0.12 2.01 -0.21 -4.98 115.64 115.97 6abp s THR 281 Ca -0.02 -1.59 -0.08 0.00 0.31 0.00 0.00 61.69 60.31 6abp s THR 281 Cb -0.12 -2.13 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 6abp s THR 281 CO -0.05 -0.19 0.10 -0.70 -0.69 0.00 0.00 174.62 173.09 6abp s GLU 282 N 1.21 3.71 -0.21 4.92 2.12 -1.26 -0.73 118.70 128.46 6abp s GLU 282 Ca -0.03 -0.45 -0.15 0.00 0.36 0.00 0.00 54.97 54.71 6abp s GLU 282 Cb -0.19 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.75 6abp s GLU 282 CO -0.07 -0.19 0.34 0.08 -0.54 0.00 0.00 175.26 174.88 6abp s VAL 283 N 1.65 5.24 -1.36 3.70 1.01 0.18 -4.89 120.40 125.93 6abp s VAL 283 Ca 0.06 0.58 0.21 0.00 0.00 0.00 0.00 61.98 62.84 6abp s VAL 283 Cb -0.15 -3.67 -0.14 0.00 0.00 0.00 0.00 36.38 32.41 6abp s VAL 283 CO 0.05 0.27 0.95 0.35 0.00 0.00 0.00 175.10 176.72 6abp n THR 284 N 4.34 0.00 -1.61 3.92 -2.24 -1.26 -1.90 114.28 115.53 6abp n THR 284 Ca -0.10 -0.11 -0.46 0.00 -2.27 0.00 0.00 64.05 61.11 6abp n THR 284 Cb 0.51 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.81 6abp n THR 284 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 6abp n ASP 285 N -0.94 1.79 -3.60 3.42 8.00 -1.26 -4.93 116.55 119.03 6abp n ASP 285 Ca 0.06 1.15 -0.13 0.00 0.71 0.00 0.00 54.79 56.58 6abp n ASP 285 Cb 0.37 -1.30 -0.07 0.00 -0.02 0.00 0.00 41.12 40.10 6abp n ASP 285 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 6abp s VAL 286 N -0.38 0.00 -0.02 2.53 0.11 -1.26 -4.35 120.40 117.03 6abp s VAL 286 Ca 0.68 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.70 6abp s VAL 286 Cb -0.75 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.10 6abp s VAL 286 CO 0.54 0.00 0.07 0.54 -3.33 0.00 0.00 175.10 172.92 6abp s VAL 287 N -0.17 0.04 -0.15 2.04 0.11 -0.78 -4.96 120.40 116.53 6abp s VAL 287 Ca -0.02 -0.29 -0.25 0.00 -2.93 0.00 0.00 61.98 58.50 6abp s VAL 287 Cb -0.03 -0.20 -0.02 0.00 -1.53 0.00 0.00 36.38 34.59 6abp s VAL 287 CO 0.01 -0.16 0.80 -0.22 -3.33 0.00 0.00 175.10 172.20 6abp s LEU 288 N -0.49 4.20 -0.08 2.54 2.96 -1.26 -0.41 118.68 126.14 6abp s LEU 288 Ca -0.06 1.17 0.00 0.00 -0.22 0.00 0.00 54.13 55.03 6abp s LEU 288 Cb -0.04 -3.19 -0.03 0.00 0.50 0.00 0.00 46.19 43.43 6abp s LEU 288 CO 0.00 -0.33 -0.07 0.27 -1.32 0.00 0.00 176.35 174.90 6abp s ILE 289 N 1.85 3.72 0.33 6.68 -4.36 0.33 -4.97 121.20 124.79 6abp s ILE 289 Ca 0.38 -0.46 0.04 0.00 -0.26 0.00 0.00 60.65 60.35 6abp s ILE 289 Cb -0.17 -2.54 -0.02 0.00 1.25 0.00 0.00 42.46 40.99 6abp s ILE 289 CO 0.14 0.58 0.15 0.35 0.24 0.00 0.00 174.94 176.41 6abp n THR 290 N 2.41 0.00 -0.29 8.37 -2.24 -1.26 -0.12 114.28 121.15 6abp n THR 290 Ca -0.18 -2.01 0.11 0.00 -2.27 0.00 0.00 64.05 59.70 6abp n THR 290 Cb 0.53 0.80 0.34 0.00 -2.10 0.00 0.00 70.33 69.90 6abp n THR 290 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 6abp h ARG 291 N 0.00 0.74 -0.17 -0.78 3.08 -1.86 -1.10 114.38 114.30 6abp h ARG 291 Ca -0.25 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 59.62 6abp h ARG 291 Cb 1.02 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 6abp h ARG 291 CO 0.39 0.49 -0.46 -0.44 -1.07 0.00 0.00 179.97 178.88 6abp h ASP 292 N 0.77 0.45 0.00 7.04 3.32 -1.95 -3.39 116.42 122.67 6abp h ASP 292 Ca 0.46 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.29 6abp h ASP 292 Cb 0.65 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.07 6abp h ASP 292 CO -0.22 0.85 0.00 -0.46 -1.72 0.00 0.00 179.24 177.69 6abp n ASN 293 N -3.99 0.97 -0.37 6.45 0.23 -0.85 -4.81 115.26 112.89 6abp n ASN 293 Ca -0.02 -1.22 0.05 0.00 -0.53 0.00 0.00 54.58 52.86 6abp n ASN 293 Cb 0.54 0.00 0.20 0.00 -2.08 0.00 0.00 39.78 38.44 6abp n ASN 293 CO 0.00 0.00 0.00 2.19 -0.93 0.00 0.00 177.26 178.52 6abp h PHE 294 N 0.00 1.18 -0.30 -2.53 -0.00 -1.42 -1.69 116.94 112.18 6abp h PHE 294 Ca 0.00 0.03 -0.05 0.00 -0.00 0.00 0.00 57.97 57.95 6abp h PHE 294 Cb 0.27 -0.38 -0.01 0.00 -0.00 0.00 0.00 35.95 35.83 6abp h PHE 294 CO 0.00 0.55 0.00 0.87 -0.00 0.00 0.00 178.31 179.73 6abp h LYS 295 N 1.10 0.53 -0.13 6.09 1.57 -1.87 -0.61 116.57 123.25 6abp h LYS 295 Ca 0.46 -0.17 0.04 0.00 -1.87 0.00 0.00 60.65 59.12 6abp h LYS 295 Cb 0.31 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.52 6abp h LYS 295 CO -0.21 0.67 -0.17 0.93 -0.57 0.00 0.00 179.45 180.10 6abp h GLU 296 N 0.32 -0.20 -0.57 3.15 5.08 -1.83 -1.64 114.58 118.89 6abp h GLU 296 Ca 0.09 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 6abp h GLU 296 Cb 0.43 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 6abp h GLU 296 CO 0.02 -0.13 0.17 0.93 -1.00 0.00 0.00 179.01 178.99 6abp h GLU 297 N -0.21 0.89 -0.31 2.33 4.39 -1.23 0.22 114.58 120.66 6abp h GLU 297 Ca 0.10 -0.20 -0.12 0.00 0.34 0.00 0.00 59.36 59.48 6abp h GLU 297 Cb 0.35 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 6abp h GLU 297 CO -0.26 0.81 -0.30 -0.07 -1.16 0.00 0.00 179.01 178.04 6abp h LEU 298 N 0.80 0.66 -0.37 1.33 3.38 -0.96 -1.80 115.31 118.36 6abp h LEU 298 Ca 0.18 -0.26 -0.16 0.00 0.09 0.00 0.00 57.88 57.73 6abp h LEU 298 Cb 0.30 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 6abp h LEU 298 CO -0.00 0.93 -0.39 -0.33 0.09 0.00 0.00 178.44 178.73 6abp h GLU 299 N 0.55 0.93 0.00 1.13 3.07 -1.05 0.26 114.58 119.46 6abp h GLU 299 Ca 0.07 -0.49 -0.00 0.00 -0.50 0.00 0.00 59.36 58.43 6abp h GLU 299 Cb 0.79 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.72 6abp h GLU 299 CO 0.06 1.15 -0.01 -0.22 -1.40 0.00 0.00 179.01 178.59 6abp h LYS 300 N 0.74 0.00 -0.52 2.33 3.64 -0.23 0.16 116.57 122.69 6abp h LYS 300 Ca 0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 6abp h LYS 300 Cb 0.99 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 6abp h LYS 300 CO 0.10 0.01 0.00 1.17 -2.27 0.00 0.00 179.45 178.46 6abp n LYS 301 N -3.19 3.18 -1.05 1.90 4.81 -0.71 -4.96 118.16 118.14 6abp n LYS 301 Ca -0.02 -2.59 -0.02 0.00 -0.87 0.00 0.00 58.31 54.82 6abp n LYS 301 Cb 0.14 -1.63 -0.01 0.00 0.02 0.00 0.00 35.03 33.55 6abp n LYS 301 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 6abp n GLY 302 N 0.82 0.39 2.25 3.14 0.00 0.56 -4.85 105.19 107.50 6abp n GLY 302 Ca 0.21 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 6abp n GLY 302 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 6abp n LEU 303 N -0.18 7.23 -2.80 0.99 4.77 0.85 -5.00 117.00 122.86 6abp n LEU 303 Ca -0.02 -4.21 -0.30 0.00 -0.03 0.00 0.00 56.01 51.45 6abp n LEU 303 Cb 0.26 -0.89 -0.02 0.00 -2.33 0.00 0.00 43.42 40.44 6abp n LEU 303 CO 0.02 1.45 -0.04 0.61 -1.33 0.00 0.00 177.39 178.11 6abp n GLY 304 N -0.94 -1.18 0.00 -0.72 0.00 -1.22 -4.75 105.19 96.38 6abp n GLY 304 Ca 0.60 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.81 6abp n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 6abp n GLY 305 N 1.30 2.31 0.00 -0.02 0.00 -1.26 -5.03 105.19 102.49 6abp n GLY 305 Ca 0.11 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.62 6abp n GLY 305 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49