#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1otu n ARG 18 N 0.00 0.05 -0.08 -0.14 0.63 -1.26 -0.47 116.66 115.39 1otu n ARG 18 Ca 0.00 0.44 -0.05 0.00 -0.92 0.00 0.00 57.85 57.33 1otu n ARG 18 Cb 0.00 -1.99 0.16 0.00 0.45 0.00 0.00 32.46 31.08 1otu n ARG 18 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1otu h ARG 19 N 0.00 0.72 0.29 -0.14 2.43 -2.06 -2.91 114.38 112.71 1otu h ARG 19 Ca 0.00 -0.22 -0.01 0.00 -0.81 0.00 0.00 59.98 58.94 1otu h ARG 19 Cb 0.66 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1otu h ARG 19 CO 0.00 0.79 -0.14 0.37 -1.51 0.00 0.00 179.97 179.48 1otu h GLN 20 N 0.66 -0.38 -0.78 0.20 4.15 -1.22 -3.31 115.11 114.44 1otu h GLN 20 Ca 0.12 0.03 0.11 0.00 0.77 0.00 0.00 58.65 59.67 1otu h GLN 20 Cb 0.53 0.09 -0.12 0.00 0.21 0.00 0.00 27.48 28.18 1otu h GLN 20 CO 0.03 -0.13 -0.45 1.25 -1.93 0.00 0.00 178.83 177.60 1otu h LEU 21 N -1.04 -1.60 -1.74 -2.39 6.46 -1.65 1.13 115.31 114.47 1otu h LEU 21 Ca -0.04 0.28 0.23 0.00 -0.12 0.00 0.00 57.88 58.23 1otu h LEU 21 Cb 0.42 0.76 -0.03 0.00 -0.73 0.00 0.00 40.66 41.07 1otu h LEU 21 CO 0.07 -0.30 0.77 0.40 -0.62 0.00 0.00 178.44 178.76 1otu h ILE 22 N -0.12 0.27 0.00 4.05 2.04 -1.63 1.18 117.51 123.30 1otu h ILE 22 Ca 0.22 0.00 -0.30 0.00 1.00 0.00 0.00 64.86 65.79 1otu h ILE 22 Cb 0.54 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 1otu h ILE 22 CO -0.82 0.00 -1.77 0.54 0.00 0.00 0.00 178.15 176.10 1otu n ARG 23 N -3.71 0.64 -0.08 2.37 1.74 0.36 -3.77 116.66 114.20 1otu n ARG 23 Ca 0.17 0.27 -0.12 0.00 -0.77 0.00 0.00 57.85 57.40 1otu n ARG 23 Cb 1.05 -1.77 -0.00 0.00 -1.02 0.00 0.00 32.46 30.71 1otu n ARG 23 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1otu h GLN 24 N 0.00 0.85 0.82 5.56 4.20 0.42 -2.90 115.11 124.06 1otu h GLN 24 Ca -0.31 -0.47 -0.04 0.00 0.06 0.00 0.00 58.65 57.89 1otu h GLN 24 Cb 2.03 0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.84 1otu h GLN 24 CO 0.08 1.11 -0.45 -0.07 -0.67 0.00 0.00 178.83 178.83 1otu h LEU 25 N 0.68 -1.10 0.00 1.46 3.38 -0.44 -1.95 115.31 117.35 1otu h LEU 25 Ca 0.04 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1otu h LEU 25 Cb 1.03 0.30 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1otu h LEU 25 CO 0.10 -0.72 0.00 0.18 0.09 0.00 0.00 178.44 178.09 1otu n LEU 26 N -5.60 0.00 -1.00 1.67 4.77 -1.23 -1.03 117.00 114.58 1otu n LEU 26 Ca -0.15 0.04 0.02 0.00 -0.03 0.00 0.00 56.01 55.89 1otu n LEU 26 Cb 0.48 -0.04 0.15 0.00 -2.33 0.00 0.00 43.42 41.68 1otu n LEU 26 CO 0.37 -0.04 0.28 1.21 -1.33 0.00 0.00 177.39 177.88 1otu n GLU 27 N -1.04 1.58 -2.31 3.23 4.07 -0.74 -5.07 120.64 120.36 1otu n GLU 27 Ca 0.00 -3.20 -0.26 0.00 -0.06 0.00 0.00 57.16 53.64 1otu n GLU 27 Cb 0.00 -1.43 0.05 0.00 -0.06 0.00 0.00 31.44 30.00 1otu n GLU 27 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1otu s ARG 28 N -2.75 2.51 -1.06 5.31 0.52 -0.20 -4.39 118.95 118.87 1otu s ARG 28 Ca 0.39 -0.19 -0.11 0.00 -0.52 0.00 0.00 55.73 55.29 1otu s ARG 28 Cb 0.38 -2.23 0.11 0.00 0.52 0.00 0.00 34.95 33.72 1otu s ARG 28 CO -0.07 -0.99 0.35 -3.47 0.02 0.00 0.00 175.30 171.14 1otu n ASP 29 N -2.75 -2.14 -4.18 0.23 4.64 -1.26 -4.89 116.55 106.20 1otu n ASP 29 Ca 0.07 -0.39 -0.40 0.00 -1.38 0.00 0.00 54.79 52.69 1otu n ASP 29 Cb 0.59 -1.86 -0.09 0.00 -1.04 0.00 0.00 41.12 38.73 1otu n ASP 29 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1otu s LYS 30 N -6.09 2.46 -0.20 -0.67 1.02 -1.26 -5.04 119.74 109.96 1otu s LYS 30 Ca 0.41 -1.94 -0.04 0.00 0.02 0.00 0.00 55.97 54.43 1otu s LYS 30 Cb -0.24 -3.86 -0.01 0.00 -0.52 0.00 0.00 37.83 33.20 1otu s LYS 30 CO 0.51 -1.17 -0.05 0.99 -0.92 0.00 0.00 175.35 174.71 1otu s THR 31 N 1.02 3.47 -0.09 2.17 2.01 -1.26 -5.07 115.64 117.89 1otu s THR 31 Ca 0.09 -0.47 -0.40 0.00 0.31 0.00 0.00 61.69 61.22 1otu s THR 31 Cb -0.24 -2.56 -0.18 0.00 0.01 0.00 0.00 72.50 69.53 1otu s THR 31 CO -0.02 0.44 1.34 -2.65 -0.69 0.00 0.00 174.62 173.04 1otu n PRO 32 N 4.45 0.57 -0.22 4.92 -0.02 -1.26 -4.76 135.00 138.68 1otu n PRO 32 Ca -0.18 0.21 0.23 0.00 -2.02 0.00 0.00 63.50 61.73 1otu n PRO 32 Cb 0.51 -1.78 0.59 0.00 -0.02 0.00 0.00 33.50 32.81 1otu n PRO 32 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1otu h LEU 33 N 4.46 0.25 -0.78 2.45 6.46 -2.00 0.29 115.31 126.45 1otu h LEU 33 Ca -0.48 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.29 1otu h LEU 33 Cb 1.37 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 41.25 1otu h LEU 33 CO 0.79 0.09 0.42 0.00 -0.62 0.00 0.00 178.44 179.12 1otu h ALA 34 N 1.60 0.99 0.64 1.25 0.00 -2.00 -1.64 119.26 120.11 1otu h ALA 34 Ca 0.45 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1otu h ALA 34 Cb 1.38 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 18.87 1otu h ALA 34 CO -0.12 0.51 -0.31 0.82 0.00 0.00 0.00 179.25 180.15 1otu h ILE 35 N 1.08 0.00 -0.84 0.00 2.04 -0.78 -2.75 117.51 116.26 1otu h ILE 35 Ca 0.27 -0.27 0.16 0.00 1.00 0.00 0.00 64.86 66.02 1otu h ILE 35 Cb 0.04 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 35.96 1otu h ILE 35 CO -0.04 0.00 -0.24 -0.07 0.00 0.00 0.00 178.15 177.80 1otu h LEU 36 N -1.14 -0.88 -1.24 1.44 3.38 -1.41 0.23 115.31 115.70 1otu h LEU 36 Ca -0.09 0.26 0.05 0.00 0.09 0.00 0.00 57.88 58.19 1otu h LEU 36 Cb 0.66 0.55 -0.05 0.00 0.09 0.00 0.00 40.66 41.91 1otu h LEU 36 CO 0.15 -0.28 0.54 0.15 0.09 0.00 0.00 178.44 179.08 1otu h PHE 37 N -0.01 0.94 -0.17 1.13 3.57 -1.33 -2.57 116.94 118.49 1otu h PHE 37 Ca 0.39 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.75 1otu h PHE 37 Cb 0.61 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.05 1otu h PHE 37 CO -0.68 0.51 -0.50 0.52 -2.23 0.00 0.00 178.31 175.93 1otu h MET 38 N 0.94 0.64 -0.61 1.11 2.86 -0.29 -2.69 114.93 116.90 1otu h MET 38 Ca 0.34 -0.46 0.18 0.00 -2.06 0.00 0.00 59.70 57.70 1otu h MET 38 Cb 0.15 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 1otu h MET 38 CO -0.11 1.08 0.47 0.00 1.06 0.00 0.00 176.91 179.40 1otu h ALA 39 N 0.56 2.52 0.07 6.32 0.00 -0.78 0.21 119.26 128.16 1otu h ALA 39 Ca -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1otu h ALA 39 Cb 1.12 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1otu h ALA 39 CO 0.11 -0.78 -0.03 0.00 0.00 0.00 0.00 179.25 178.55 1otu h ALA 40 N 1.64 -0.09 -0.69 0.00 0.00 -1.22 0.24 119.26 119.14 1otu h ALA 40 Ca 0.29 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 55.01 1otu h ALA 40 Cb 1.22 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 1otu h ALA 40 CO -0.00 -0.28 0.39 0.28 0.00 0.00 0.00 179.25 179.63 1otu h VAL 41 N -0.63 0.96 0.36 0.00 2.07 -0.65 -0.62 116.25 117.73 1otu h VAL 41 Ca -0.01 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1otu h VAL 41 Cb 0.53 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1otu h VAL 41 CO 0.01 0.13 -0.17 0.58 0.02 0.00 0.00 177.57 178.14 1otu h VAL 42 N 0.70 0.00 -1.00 2.57 2.07 -0.63 -1.14 116.25 118.83 1otu h VAL 42 Ca 0.31 -0.01 0.21 0.00 0.82 0.00 0.00 66.70 68.03 1otu h VAL 42 Cb 0.21 0.00 -0.19 0.00 -1.52 0.00 0.00 31.29 29.79 1otu h VAL 42 CO -0.19 0.00 -0.20 1.23 0.02 0.00 0.00 177.57 178.43 1otu h GLY 43 N -0.49 0.82 0.05 2.17 0.00 -0.37 0.38 103.07 105.63 1otu h GLY 43 Ca -0.05 0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.58 1otu h GLY 43 CO 0.08 -0.41 -0.06 -0.84 0.00 0.00 0.00 176.54 175.31 1otu h THR 44 N 0.00 0.00 -0.92 4.70 2.02 -0.98 -2.23 112.91 115.49 1otu h THR 44 Ca 0.50 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.83 1otu h THR 44 Cb 0.83 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 67.08 1otu h THR 44 CO -1.01 0.00 -0.36 -0.07 0.37 0.00 0.00 175.52 174.44 1otu h LEU 45 N -0.11 -1.33 -0.69 2.58 4.07 0.30 0.20 115.31 120.32 1otu h LEU 45 Ca -0.01 0.29 0.13 0.00 0.08 0.00 0.00 57.88 58.37 1otu h LEU 45 Cb 0.10 0.71 -0.13 0.00 1.08 0.00 0.00 40.66 42.42 1otu h LEU 45 CO -0.01 -0.29 -0.29 0.58 -1.08 0.00 0.00 178.44 177.34 1otu h VAL 46 N -0.03 0.17 0.00 1.22 2.07 -0.83 -1.13 116.25 117.72 1otu h VAL 46 Ca 0.34 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.86 1otu h VAL 46 Cb 0.60 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1otu h VAL 46 CO -0.94 0.00 0.00 0.61 0.02 0.00 0.00 177.57 177.26 1otu n GLY 47 N -1.46 -2.78 0.28 2.17 0.00 0.66 0.24 105.19 104.30 1otu n GLY 47 Ca 0.07 0.26 0.22 0.00 0.00 0.00 0.00 46.02 46.57 1otu n GLY 47 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1otu n LEU 48 N -2.28 0.16 0.20 0.99 7.99 -0.97 -0.47 117.00 122.62 1otu n LEU 48 Ca 0.00 1.42 -0.08 0.00 -0.01 0.00 0.00 56.01 57.34 1otu n LEU 48 Cb 0.00 -0.63 -0.04 0.00 -0.11 0.00 0.00 43.42 42.64 1otu n LEU 48 CO 0.00 -1.54 0.37 0.00 -1.51 0.00 0.00 177.39 174.71 1otu h ALA 49 N 1.70 -0.85 -1.46 -1.18 0.00 -0.32 -1.94 119.26 115.21 1otu h ALA 49 Ca 0.65 -0.11 0.46 0.00 0.00 0.00 0.00 54.91 55.90 1otu h ALA 49 Cb 1.62 0.20 -0.11 0.00 0.00 0.00 0.00 17.79 19.51 1otu h ALA 49 CO -0.70 -0.82 0.98 0.00 0.00 0.00 0.00 179.25 178.71 1otu h ALA 50 N -1.61 3.03 0.20 0.00 0.00 0.25 -0.57 119.26 120.56 1otu h ALA 50 Ca -0.05 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1otu h ALA 50 Cb 0.40 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1otu h ALA 50 CO 0.09 -1.61 -0.10 0.28 0.00 0.00 0.00 179.25 177.91 1otu h VAL 51 N 0.07 0.00 -1.12 0.00 2.07 -0.84 -2.57 116.25 113.85 1otu h VAL 51 Ca 0.82 -0.14 0.32 0.00 0.82 0.00 0.00 66.70 68.51 1otu h VAL 51 Cb 2.81 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 32.47 1otu h VAL 51 CO -0.28 0.00 0.72 0.00 0.02 0.00 0.00 177.57 178.03 1otu h ALA 52 N -1.73 2.40 0.15 1.67 0.00 -0.34 0.46 119.26 121.87 1otu h ALA 52 Ca -0.03 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1otu h ALA 52 Cb 0.21 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1otu h ALA 52 CO 0.05 -0.86 -0.07 0.35 0.00 0.00 0.00 179.25 178.71 1otu h PHE 53 N 0.29 -0.19 -0.98 0.00 3.57 -1.31 0.40 116.94 118.73 1otu h PHE 53 Ca 0.66 -0.00 0.32 0.00 3.53 0.00 0.00 57.97 62.47 1otu h PHE 53 Cb 1.83 0.06 -0.16 0.00 2.79 0.00 0.00 35.95 40.47 1otu h PHE 53 CO -0.00 -0.12 0.46 0.22 -2.23 0.00 0.00 178.31 176.65 1otu h ASP 54 N -0.23 0.31 0.72 0.41 3.58 -0.77 0.24 116.42 120.69 1otu h ASP 54 Ca -0.02 0.21 -0.04 0.00 0.42 0.00 0.00 57.03 57.61 1otu h ASP 54 Cb 0.15 0.21 0.01 0.00 1.72 0.00 0.00 39.33 41.42 1otu h ASP 54 CO 0.03 -0.22 -0.35 0.11 -2.88 0.00 0.00 179.24 175.94 1otu h LYS 55 N 0.22 -0.93 -0.65 0.28 1.79 -0.00 -2.83 116.57 114.44 1otu h LYS 55 Ca 0.72 0.06 0.12 0.00 -2.18 0.00 0.00 60.65 59.37 1otu h LYS 55 Cb 1.66 0.21 -0.09 0.00 -1.58 0.00 0.00 32.23 32.43 1otu h LYS 55 CO -0.67 -0.60 0.19 0.78 -1.08 0.00 0.00 179.45 178.07 1otu h GLY 56 N -1.20 0.90 -0.05 3.86 0.00 0.21 -2.07 103.07 104.72 1otu h GLY 56 Ca -0.10 -0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.18 1otu h GLY 56 CO 0.16 -0.11 -0.42 -2.08 0.00 0.00 0.00 176.54 174.09 1otu h VAL 57 N 0.33 0.00 -0.19 4.60 2.07 -0.63 -2.51 116.25 119.91 1otu h VAL 57 Ca 0.35 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.92 1otu h VAL 57 Cb 0.52 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.22 1otu h VAL 57 CO -0.40 0.00 -0.39 0.00 0.02 0.00 0.00 177.57 176.79 1otu h ALA 58 N -0.61 -0.49 -1.03 1.67 0.00 -1.20 -1.40 119.26 116.20 1otu h ALA 58 Ca 0.02 0.02 0.40 0.00 0.00 0.00 0.00 54.91 55.34 1otu h ALA 58 Cb 0.55 0.76 -0.15 0.00 0.00 0.00 0.00 17.79 18.95 1otu h ALA 58 CO -0.31 -0.87 0.60 1.87 0.00 0.00 0.00 179.25 180.54 1otu n TRP 59 N -5.43 0.92 -0.04 0.00 -0.00 -0.82 -0.13 117.44 111.94 1otu n TRP 59 Ca -0.03 0.92 -0.10 0.00 -0.00 0.00 0.00 57.50 58.29 1otu n TRP 59 Cb 0.35 -1.34 -0.09 0.00 -0.00 0.00 0.00 31.31 30.24 1otu n TRP 59 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 1otu h LEU 60 N 0.00 -0.03 -1.08 5.87 3.38 -0.85 -2.17 115.31 120.42 1otu h LEU 60 Ca 0.78 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1otu h LEU 60 Cb 2.23 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.99 1otu h LEU 60 CO -0.60 0.75 0.30 1.56 0.09 0.00 0.00 178.44 180.53 1otu h GLN 61 N -0.95 0.00 0.00 1.13 4.20 -0.23 0.18 115.11 119.44 1otu h GLN 61 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1otu h GLN 61 Cb 0.65 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.43 1otu h GLN 61 CO 0.01 0.00 -0.00 -0.97 -0.67 0.00 0.00 178.83 177.19 1otu h ASN 62 N 0.00 0.00 -1.00 1.46 -0.00 -0.46 -3.34 115.58 112.25 1otu h ASN 62 Ca 0.00 0.00 0.35 0.00 -0.00 0.00 0.00 56.30 56.65 1otu h ASN 62 Cb 0.60 0.00 -0.18 0.00 -0.00 0.00 0.00 38.32 38.74 1otu h ASN 62 CO 0.00 0.21 0.28 0.00 -0.00 0.00 0.00 177.43 177.91 1otu n GLN 63 N -3.16 -0.07 0.00 6.67 3.00 0.44 0.24 117.38 124.50 1otu n GLN 63 Ca -0.00 1.44 0.00 0.00 -0.01 0.00 0.00 57.00 58.43 1otu n GLN 63 Cb 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 30.24 27.82 1otu n GLN 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1otu n ARG 64 N -5.38 0.25 0.00 -1.09 1.74 -0.07 -1.01 116.66 111.10 1otu n ARG 64 Ca 0.31 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.39 1otu n ARG 64 Cb 1.02 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 31.39 1otu n ARG 64 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 1otu n MET 65 N 0.05 0.00 0.00 5.56 1.56 0.66 -4.13 117.12 120.83 1otu n MET 65 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1otu n MET 65 Cb 0.04 -0.66 0.00 0.00 2.15 0.00 0.00 33.22 34.75 1otu n MET 65 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1otu n GLY 66 N 3.04 0.54 0.77 -5.12 0.00 -0.18 -1.56 105.19 102.67 1otu n GLY 66 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1otu n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1otu n ALA 67 N 0.06 2.31 -0.04 4.61 0.00 -0.87 -4.48 120.51 122.09 1otu n ALA 67 Ca 0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 53.44 53.21 1otu n ALA 67 Cb 0.11 0.04 -0.09 0.00 0.00 0.00 0.00 19.45 19.51 1otu n ALA 67 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1otu h LEU 68 N -0.05 -1.64 -1.56 0.00 3.38 -1.63 -1.06 115.31 112.75 1otu h LEU 68 Ca 0.00 0.20 0.21 0.00 0.09 0.00 0.00 57.88 58.38 1otu h LEU 68 Cb 0.05 0.65 -0.06 0.00 0.09 0.00 0.00 40.66 41.38 1otu h LEU 68 CO 0.00 -0.43 0.60 1.62 0.09 0.00 0.00 178.44 180.32 1otu h VAL 69 N -0.50 0.66 -0.33 1.22 3.04 -1.60 0.65 116.25 119.40 1otu h VAL 69 Ca 0.04 -0.12 -0.05 0.00 -1.01 0.00 0.00 66.70 65.55 1otu h VAL 69 Cb 0.61 0.27 -0.02 0.00 -2.01 0.00 0.00 31.29 30.15 1otu h VAL 69 CO -0.44 0.07 -0.02 -0.74 -1.01 0.00 0.00 177.57 175.42 1otu h HIS 70 N 0.36 0.53 -0.74 3.17 -0.00 -1.40 -2.85 115.15 114.21 1otu h HIS 70 Ca 0.46 -0.06 -0.54 0.00 -0.00 0.00 0.00 60.37 60.24 1otu h HIS 70 Cb 1.23 -0.15 -0.39 0.00 -0.00 0.00 0.00 27.41 28.10 1otu h HIS 70 CO -0.00 0.54 -0.55 0.25 -0.00 0.00 0.00 177.93 178.16 1otu n THR 71 N -4.27 2.67 1.61 6.26 -2.24 0.19 -4.74 114.28 113.76 1otu n THR 71 Ca 0.01 -3.96 0.15 0.00 -2.27 0.00 0.00 64.05 57.98 1otu n THR 71 Cb 0.26 -1.09 0.79 0.00 -2.10 0.00 0.00 70.33 68.20 1otu n THR 71 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1otu n ALA 72 N -0.77 2.59 -0.05 6.98 0.00 0.84 -3.85 120.51 126.25 1otu n ALA 72 Ca 0.45 -0.19 -0.01 0.00 0.00 0.00 0.00 53.44 53.70 1otu n ALA 72 Cb 0.92 -1.47 -0.00 0.00 0.00 0.00 0.00 19.45 18.89 1otu n ALA 72 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1otu h ASP 73 N 0.13 0.00 -1.92 0.00 -0.00 -1.85 -3.42 116.42 109.36 1otu h ASP 73 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 57.03 56.51 1otu h ASP 73 Cb 0.21 0.00 -0.07 0.00 -0.00 0.00 0.00 39.33 39.47 1otu h ASP 73 CO 0.00 0.52 1.18 0.21 -0.00 0.00 0.00 179.24 181.15 1otu s ASN 74 N -5.42 5.95 0.11 4.15 3.84 -1.25 -4.92 114.94 117.40 1otu s ASN 74 Ca -0.03 -0.48 -0.30 0.00 0.21 0.00 0.00 52.86 52.26 1otu s ASN 74 Cb 0.00 -2.56 -0.11 0.00 -0.55 0.00 0.00 41.25 38.04 1otu s ASN 74 CO 0.05 -1.97 1.49 0.22 -2.79 0.00 0.00 177.10 174.10 1otu h TYR 75 N 11.15 -1.46 -0.35 0.43 3.20 -1.83 0.10 116.97 128.21 1otu h TYR 75 Ca -0.16 0.06 0.10 0.00 3.14 0.00 0.00 58.73 61.87 1otu h TYR 75 Cb 1.06 0.66 -0.01 0.00 1.54 0.00 0.00 36.73 39.98 1otu h TYR 75 CO 1.15 -0.47 0.33 -1.35 -1.64 0.00 0.00 178.16 176.18 1otu h PRO 76 N -0.46 0.00 0.00 1.82 0.11 -1.94 0.36 132.00 131.89 1otu h PRO 76 Ca 0.04 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.06 1otu h PRO 76 Cb 0.58 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 1otu h PRO 76 CO -0.43 0.00 -0.43 1.25 -0.21 0.00 0.00 178.00 178.18 1otu h LEU 77 N 0.00 0.00 0.00 2.35 5.85 -1.14 -1.69 115.31 120.68 1otu h LEU 77 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1otu h LEU 77 Cb 0.82 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.85 1otu h LEU 77 CO -0.00 0.43 0.00 0.18 -0.34 0.00 0.00 178.44 178.70 1otu n LEU 78 N -3.91 1.16 0.25 2.25 4.77 0.12 -1.93 117.00 119.70 1otu n LEU 78 Ca -0.01 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1otu n LEU 78 Cb 0.47 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1otu n LEU 78 CO 0.39 -0.09 0.80 0.18 -1.33 0.00 0.00 177.39 177.34 1otu n LEU 79 N -0.77 0.00 -0.03 2.23 7.99 -0.89 0.75 117.00 126.28 1otu n LEU 79 Ca 0.00 0.38 -0.01 0.00 -0.01 0.00 0.00 56.01 56.38 1otu n LEU 79 Cb 0.00 0.00 -0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1otu n LEU 79 CO 0.00 -0.38 -0.05 0.74 -1.51 0.00 0.00 177.39 176.18 1otu h THR 80 N 0.00 0.00 0.00 -5.08 2.02 -1.28 -3.33 112.91 105.23 1otu h THR 80 Ca 0.00 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.59 1otu h THR 80 Cb 1.60 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1otu h THR 80 CO 0.00 0.00 0.00 1.33 0.37 0.00 0.00 175.52 177.22 1otu n VAL 81 N -3.64 1.26 0.68 3.16 0.24 0.23 -0.96 118.33 119.30 1otu n VAL 81 Ca -0.01 0.33 0.05 0.00 -2.04 0.00 0.00 64.34 62.68 1otu n VAL 81 Cb 0.04 -1.17 0.17 0.00 -1.47 0.00 0.00 33.84 31.41 1otu n VAL 81 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1otu n ALA 82 N -1.53 2.58 0.01 2.33 0.00 0.12 -3.20 120.51 120.82 1otu n ALA 82 Ca 0.02 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1otu n ALA 82 Cb 0.12 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1otu n ALA 82 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1otu n PHE 83 N 0.53 -0.14 -0.19 0.00 -0.00 -0.13 -0.29 117.46 117.23 1otu n PHE 83 Ca 0.13 0.02 0.00 0.00 -0.00 0.00 0.00 57.45 57.60 1otu n PHE 83 Cb 0.39 0.23 0.10 0.00 -0.00 0.00 0.00 39.48 40.20 1otu n PHE 83 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1otu h LEU 84 N 0.00 -0.07 0.55 -2.13 3.38 -1.41 0.54 115.31 116.18 1otu h LEU 84 Ca 0.00 0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1otu h LEU 84 Cb 0.49 0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.42 1otu h LEU 84 CO 0.00 -0.02 -0.27 0.00 0.09 0.00 0.00 178.44 178.24 1otu n SER 86 N -5.41 0.00 -0.12 0.00 7.64 -1.05 -1.44 113.62 113.25 1otu n SER 86 Ca -0.12 0.45 -0.22 0.00 1.01 0.00 0.00 58.87 59.98 1otu n SER 86 Cb 0.31 -0.47 -0.09 0.00 -1.01 0.00 0.00 64.21 62.95 1otu n SER 86 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1otu n ALA 87 N -1.47 0.94 -0.36 -0.43 0.00 0.15 -2.08 120.51 117.26 1otu n ALA 87 Ca 0.02 -0.78 0.06 0.00 0.00 0.00 0.00 53.44 52.74 1otu n ALA 87 Cb 0.09 -0.14 0.23 0.00 0.00 0.00 0.00 19.45 19.62 1otu n ALA 87 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1otu h VAL 88 N -1.00 0.95 0.25 0.00 2.07 0.19 -1.39 116.25 117.32 1otu h VAL 88 Ca -0.43 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 1otu h VAL 88 Cb 1.33 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1otu h VAL 88 CO -0.26 0.19 -0.12 -0.07 0.02 0.00 0.00 177.57 177.32 1otu h LEU 89 N 1.03 -0.29 -1.00 2.57 3.38 -1.44 -2.45 115.31 117.12 1otu h LEU 89 Ca 0.49 -0.01 0.23 0.00 0.09 0.00 0.00 57.88 58.68 1otu h LEU 89 Cb 0.43 0.07 -0.19 0.00 0.09 0.00 0.00 40.66 41.06 1otu h LEU 89 CO -0.25 0.18 -0.13 0.00 0.09 0.00 0.00 178.44 178.32 1otu h ALA 90 N -1.06 0.88 0.31 1.53 0.00 -1.44 0.48 119.26 119.96 1otu h ALA 90 Ca -0.03 0.37 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1otu h ALA 90 Cb 0.28 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1otu h ALA 90 CO 0.06 -0.46 -0.26 0.52 0.00 0.00 0.00 179.25 179.10 1otu h MET 91 N 0.00 -0.53 -1.48 0.00 2.86 -1.33 0.22 114.93 114.67 1otu h MET 91 Ca 0.53 0.04 0.48 0.00 -2.06 0.00 0.00 59.70 58.69 1otu h MET 91 Cb 0.95 0.12 -0.11 0.00 0.06 0.00 0.00 31.60 32.62 1otu h MET 91 CO -0.99 -0.36 0.99 0.34 1.06 0.00 0.00 176.91 177.96 1otu n PHE 92 N -3.93 0.45 0.00 -0.22 -0.00 0.13 -0.02 117.46 113.88 1otu n PHE 92 Ca -0.07 0.45 0.00 0.00 -0.00 0.00 0.00 57.45 57.84 1otu n PHE 92 Cb 0.25 -0.89 0.00 0.00 -0.00 0.00 0.00 39.48 38.83 1otu n PHE 92 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1otu n GLY 93 N -1.61 -1.91 0.32 7.13 0.00 0.85 -2.27 105.19 107.70 1otu n GLY 93 Ca 0.39 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.60 1otu n GLY 93 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1otu h TYR 94 N 0.00 0.46 0.04 1.61 -1.99 0.83 -1.18 116.97 116.74 1otu h TYR 94 Ca 0.00 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.78 1otu h TYR 94 Cb 0.00 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 38.68 1otu h TYR 94 CO 0.16 -0.31 -0.07 0.35 -0.00 0.00 0.00 178.16 178.29 1otu h PHE 95 N 0.14 -0.21 0.00 4.88 -0.00 -0.89 0.03 116.94 120.88 1otu h PHE 95 Ca 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.63 1otu h PHE 95 Cb 1.46 0.09 0.00 0.00 -0.00 0.00 0.00 35.95 37.50 1otu h PHE 95 CO -0.22 -0.09 0.00 1.28 -0.00 0.00 0.00 178.31 179.28 1otu n LEU 96 N -2.81 0.00 -0.03 0.59 7.99 -0.46 -1.70 117.00 120.58 1otu n LEU 96 Ca -0.01 0.00 -0.08 0.00 -0.01 0.00 0.00 56.01 55.91 1otu n LEU 96 Cb 0.06 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.35 1otu n LEU 96 CO 0.03 0.00 -0.55 0.52 -1.51 0.00 0.00 177.39 175.87 1otu n VAL 97 N -0.71 1.06 0.24 4.08 0.31 -0.50 -4.14 118.33 118.69 1otu n VAL 97 Ca 0.00 0.10 0.09 0.00 -0.01 0.00 0.00 64.34 64.52 1otu n VAL 97 Cb 0.00 -1.81 0.63 0.00 -0.91 0.00 0.00 33.84 31.74 1otu n VAL 97 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1otu h ARG 98 N -0.43 0.00 -0.02 5.55 2.47 -0.20 0.30 114.38 122.05 1otu h ARG 98 Ca -0.13 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.59 1otu h ARG 98 Cb 0.78 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.10 1otu h ARG 98 CO -0.08 0.15 -0.12 1.17 0.56 0.00 0.00 179.97 181.65 1otu n LYS 99 N -3.97 1.59 0.00 0.04 3.00 -0.69 -4.71 118.16 113.42 1otu n LYS 99 Ca -0.02 -1.37 0.00 0.00 -0.00 0.00 0.00 58.31 56.92 1otu n LYS 99 Cb 0.24 -1.35 0.00 0.00 0.00 0.00 0.00 35.03 33.92 1otu n LYS 99 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1otu n TYR 100 N 0.68 0.00 -2.71 5.64 4.02 -1.05 -5.03 117.16 118.71 1otu n TYR 100 Ca 0.10 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.94 1otu n TYR 100 Cb 0.44 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.80 1otu n TYR 100 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1otu n ALA 101 N 0.00 -2.76 0.21 -0.72 0.00 0.99 -4.76 120.51 113.48 1otu n ALA 101 Ca 0.00 -0.61 0.18 0.00 0.00 0.00 0.00 53.44 53.01 1otu n ALA 101 Cb 0.00 -2.42 0.81 0.00 0.00 0.00 0.00 19.45 17.84 1otu n ALA 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1otu h PRO 102 N 4.08 0.00 0.00 0.00 0.11 -1.70 0.21 132.00 134.70 1otu h PRO 102 Ca -0.08 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.97 1otu h PRO 102 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1otu h PRO 102 CO -0.00 0.00 -0.30 1.05 -0.21 0.00 0.00 178.00 178.54 1otu h GLU 103 N 0.00 0.00 0.18 1.05 4.11 -1.94 -3.30 114.58 114.67 1otu h GLU 103 Ca 0.10 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.52 1otu h GLU 103 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1otu h GLU 103 CO -0.00 0.30 -0.08 0.00 0.07 0.00 0.00 179.01 179.29 1otu h ALA 104 N 1.70 -0.96 -0.00 1.06 0.00 -1.29 -3.46 119.26 116.31 1otu h ALA 104 Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1otu h ALA 104 Cb 0.68 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1otu h ALA 104 CO 0.04 -0.94 -0.00 0.41 0.00 0.00 0.00 179.25 178.76 1otu n GLY 105 N -0.80 -0.00 2.76 0.00 0.00 -1.24 -4.36 105.19 101.54 1otu n GLY 105 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1otu n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1otu n GLY 106 N 0.00 -1.83 0.00 -0.02 0.00 -0.61 -4.67 105.19 98.06 1otu n GLY 106 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1otu n GLY 106 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1otu n SER 107 N 0.35 0.00 0.00 1.61 2.88 -1.13 -2.75 113.62 114.59 1otu n SER 107 Ca 0.00 0.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.06 1otu n SER 107 Cb 0.00 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.44 1otu n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1otu n GLY 108 N -0.82 1.20 0.11 0.46 0.00 -1.26 -3.69 105.19 101.19 1otu n GLY 108 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1otu n GLY 108 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1otu h ILE 109 N 0.00 1.49 -0.88 -0.61 2.04 -1.91 -3.00 117.51 114.63 1otu h ILE 109 Ca 0.00 -2.99 0.10 0.00 1.00 0.00 0.00 64.86 62.97 1otu h ILE 109 Cb 0.00 2.89 -0.06 0.00 -0.74 0.00 0.00 36.82 38.91 1otu h ILE 109 CO 0.00 0.87 0.57 -0.65 0.00 0.00 0.00 178.15 178.94 1otu h PRO 110 N 0.09 0.83 0.30 2.37 0.11 -1.94 0.23 132.00 134.00 1otu h PRO 110 Ca -0.13 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.92 1otu h PRO 110 Cb 1.93 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.85 1otu h PRO 110 CO 0.20 0.55 -0.15 0.93 -0.21 0.00 0.00 178.00 179.33 1otu h GLU 111 N 0.86 -0.39 -0.86 1.05 4.39 -1.92 -1.74 114.58 115.96 1otu h GLU 111 Ca 0.41 0.03 0.23 0.00 0.34 0.00 0.00 59.36 60.36 1otu h GLU 111 Cb 0.42 0.09 -0.14 0.00 -0.10 0.00 0.00 28.75 29.02 1otu h GLU 111 CO -0.17 -0.26 0.20 0.82 -1.16 0.00 0.00 179.01 178.43 1otu h ILE 112 N -0.58 0.31 0.00 3.13 1.08 -1.36 1.29 117.51 121.39 1otu h ILE 112 Ca -0.04 -0.07 -0.01 0.00 -0.39 0.00 0.00 64.86 64.35 1otu h ILE 112 Cb 0.31 0.11 -0.00 0.00 -3.07 0.00 0.00 36.82 34.17 1otu h ILE 112 CO 0.07 0.03 -0.06 -0.08 -0.69 0.00 0.00 178.15 177.43 1otu h GLU 113 N 0.19 0.00 0.07 2.37 4.81 -0.56 -1.78 114.58 119.67 1otu h GLU 113 Ca 0.53 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.54 1otu h GLU 113 Cb 1.05 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 1otu h GLU 113 CO -0.66 0.06 -1.18 0.78 -0.73 0.00 0.00 179.01 177.27 1otu h GLY 114 N 0.20 0.16 1.51 1.92 0.00 0.21 -3.29 103.07 103.77 1otu h GLY 114 Ca -0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1otu h GLY 114 CO 0.01 0.37 0.16 0.00 0.00 0.00 0.00 176.54 177.08 1otu n ALA 115 N -3.04 0.77 -0.04 3.60 0.00 0.36 -0.41 120.51 121.75 1otu n ALA 115 Ca -0.25 0.10 -0.13 0.00 0.00 0.00 0.00 53.44 53.16 1otu n ALA 115 Cb 0.78 -0.91 -0.11 0.00 0.00 0.00 0.00 19.45 19.21 1otu n ALA 115 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1otu h LEU 116 N 0.00 -0.00 0.00 0.00 3.38 -1.40 -3.04 115.31 114.24 1otu h LEU 116 Ca 0.00 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.23 1otu h LEU 116 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1otu h LEU 116 CO 0.00 0.74 0.00 -0.62 0.09 0.00 0.00 178.44 178.65 1otu n GLU 117 N -4.73 0.63 -3.03 1.13 1.02 0.45 -4.85 120.64 111.25 1otu n GLU 117 Ca -0.09 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 56.93 1otu n GLU 117 Cb 0.36 -1.40 0.04 0.00 -0.02 0.00 0.00 31.44 30.42 1otu n GLU 117 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1otu n ASP 118 N -0.90 -3.98 -0.34 1.62 8.00 -0.95 -4.95 116.55 115.04 1otu n ASP 118 Ca 0.12 -0.29 0.04 0.00 0.71 0.00 0.00 54.79 55.37 1otu n ASP 118 Cb 0.06 -2.88 0.04 0.00 -0.02 0.00 0.00 41.12 38.31 1otu n ASP 118 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1otu n GLN 119 N -2.83 0.29 -3.75 -1.24 1.13 -1.11 -5.00 117.38 104.88 1otu n GLN 119 Ca -0.02 -1.04 -0.13 0.00 -1.94 0.00 0.00 57.00 53.87 1otu n GLN 119 Cb 0.54 -1.16 -0.09 0.00 0.11 0.00 0.00 30.24 29.64 1otu n GLN 119 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1otu s ARG 120 N -0.71 0.64 0.69 -1.09 1.81 -1.26 -4.90 118.95 114.13 1otu s ARG 120 Ca 0.10 -0.04 -0.07 0.00 -1.72 0.00 0.00 55.73 54.00 1otu s ARG 120 Cb 0.07 0.29 0.05 0.00 -0.45 0.00 0.00 34.95 34.92 1otu s ARG 120 CO 0.10 -0.17 1.01 -2.14 -0.68 0.00 0.00 175.30 173.42 1otu s PRO 121 N -1.04 2.30 -0.68 3.54 0.02 -1.26 -4.26 135.00 133.62 1otu s PRO 121 Ca -0.11 -0.19 0.05 0.00 0.02 0.00 0.00 61.00 60.77 1otu s PRO 121 Cb -0.04 -2.17 0.24 0.00 0.02 0.00 0.00 34.50 32.55 1otu s PRO 121 CO 0.04 -1.17 0.77 0.28 -0.33 0.00 0.00 177.00 176.58 1otu n VAL 122 N -2.89 2.49 -0.82 3.83 0.31 -1.26 -4.92 118.33 115.07 1otu n VAL 122 Ca 0.08 -5.23 -0.28 0.00 -0.01 0.00 0.00 64.34 58.89 1otu n VAL 122 Cb 0.60 -2.11 -0.03 0.00 -0.91 0.00 0.00 33.84 31.39 1otu n VAL 122 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1otu n ARG 123 N 1.01 1.69 -0.21 5.55 1.74 -1.26 -4.67 116.66 120.52 1otu n ARG 123 Ca 0.29 -1.51 -0.01 0.00 -0.77 0.00 0.00 57.85 55.85 1otu n ARG 123 Cb 0.40 -2.58 0.10 0.00 -1.02 0.00 0.00 32.46 29.36 1otu n ARG 123 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 1otu h TRP 124 N 7.06 0.52 0.00 -1.55 5.08 -1.93 0.24 115.95 125.37 1otu h TRP 124 Ca 0.43 0.03 0.00 0.00 1.08 0.00 0.00 58.89 60.43 1otu h TRP 124 Cb 0.33 -0.14 0.00 0.00 -3.00 0.00 0.00 29.16 26.35 1otu h TRP 124 CO 1.70 0.20 0.09 -2.67 -1.28 0.00 0.00 178.44 176.48 1otu n TRP 125 N -4.90 0.00 0.01 0.12 2.14 -1.26 -1.96 117.44 111.58 1otu n TRP 125 Ca 0.08 0.00 -0.01 0.00 2.07 0.00 0.00 57.50 59.65 1otu n TRP 125 Cb 0.23 -0.23 -0.00 0.00 -0.81 0.00 0.00 31.31 30.50 1otu n TRP 125 CO 0.00 0.00 0.00 0.54 2.07 0.00 0.00 177.69 180.30 1otu n ARG 126 N -1.17 0.04 -0.29 -2.67 1.74 0.53 -4.78 116.66 110.05 1otu n ARG 126 Ca 0.00 0.02 -0.09 0.00 -0.77 0.00 0.00 57.85 57.01 1otu n ARG 126 Cb 0.09 -0.32 -0.05 0.00 -1.02 0.00 0.00 32.46 31.16 1otu n ARG 126 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1otu h VAL 127 N -0.08 0.03 0.00 1.55 2.07 -0.54 -1.29 116.25 118.00 1otu h VAL 127 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1otu h VAL 127 Cb 0.08 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.88 1otu h VAL 127 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 1otu n LEU 128 N -5.37 0.00 -0.34 2.57 4.77 -0.83 0.19 117.00 118.00 1otu n LEU 128 Ca 0.03 0.76 0.08 0.00 -0.03 0.00 0.00 56.01 56.85 1otu n LEU 128 Cb 0.33 -0.26 0.25 0.00 -2.33 0.00 0.00 43.42 41.41 1otu n LEU 128 CO -0.08 -0.26 1.18 1.55 -1.33 0.00 0.00 177.39 178.45 1otu h PRO 129 N 0.00 0.80 0.75 3.23 0.13 -1.76 0.14 132.00 135.30 1otu h PRO 129 Ca 0.00 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.05 1otu h PRO 129 Cb 0.00 -0.18 0.01 0.00 0.13 0.00 0.00 31.00 30.96 1otu h PRO 129 CO 0.00 0.53 -0.36 0.28 -0.23 0.00 0.00 178.00 178.21 1otu h VAL 130 N 0.82 0.00 -0.78 1.56 2.07 0.10 -2.12 116.25 117.91 1otu h VAL 130 Ca 0.50 0.00 0.03 0.00 0.82 0.00 0.00 66.70 68.05 1otu h VAL 130 Cb 0.62 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 1otu h VAL 130 CO -0.32 0.00 0.49 0.50 0.02 0.00 0.00 177.57 178.27 1otu h LYS 131 N -1.01 0.94 0.00 1.57 1.63 0.24 0.40 116.57 120.33 1otu h LYS 131 Ca -0.10 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.64 1otu h LYS 131 Cb 0.78 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.20 1otu h LYS 131 CO 0.17 0.62 0.00 0.34 -3.45 0.00 0.00 179.45 177.13 1otu n PHE 132 N -4.61 0.00 -0.32 1.91 -0.00 0.48 -1.40 117.46 113.52 1otu n PHE 132 Ca 0.09 0.00 0.24 0.00 -0.00 0.00 0.00 57.45 57.78 1otu n PHE 132 Cb 0.09 0.00 0.45 0.00 -0.00 0.00 0.00 39.48 40.02 1otu n PHE 132 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.76 177.50 1otu h PHE 133 N 0.00 0.60 0.00 -5.13 0.04 -1.48 -1.18 116.94 109.79 1otu h PHE 133 Ca 0.00 0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1otu h PHE 133 Cb 0.00 -0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.05 1otu h PHE 133 CO 0.00 -0.36 -0.00 0.78 -0.60 0.00 0.00 178.31 178.13 1otu h GLY 134 N 0.11 -1.23 2.00 -1.45 0.00 -0.21 -1.93 103.07 100.36 1otu h GLY 134 Ca 0.73 0.53 0.00 0.00 0.00 0.00 0.00 47.33 48.58 1otu h GLY 134 CO -0.74 -0.47 0.00 -1.33 0.00 0.00 0.00 176.54 174.00 1otu h GLY 135 N -0.00 0.00 1.39 4.60 0.00 -0.63 0.18 103.07 108.61 1otu h GLY 135 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.34 1otu h GLY 135 CO -0.00 0.00 0.40 1.41 0.00 0.00 0.00 176.54 178.35 1otu h LEU 136 N 0.00 0.69 0.01 3.11 4.07 -0.44 0.26 115.31 123.00 1otu h LEU 136 Ca 0.00 -0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.94 1otu h LEU 136 Cb 0.04 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.61 1otu h LEU 136 CO 0.00 0.50 -0.00 1.23 -1.08 0.00 0.00 178.44 179.08 1otu h GLY 137 N 0.81 -0.01 0.52 0.83 0.00 -0.37 0.21 103.07 105.07 1otu h GLY 137 Ca 0.23 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.61 1otu h GLY 137 CO -0.05 -0.00 -0.01 -0.91 0.00 0.00 0.00 176.54 175.56 1otu h THR 138 N -0.98 0.77 0.02 4.70 1.35 -1.31 -0.81 112.91 116.66 1otu h THR 138 Ca -0.00 -0.03 -0.00 0.00 -0.55 0.00 0.00 66.41 65.83 1otu h THR 138 Cb 0.74 0.69 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1otu h THR 138 CO 0.00 0.01 -0.01 -0.07 -0.25 0.00 0.00 175.52 175.21 1otu h LEU 139 N 0.07 -0.02 0.00 3.87 3.38 -0.64 -2.70 115.31 119.28 1otu h LEU 139 Ca 0.14 -0.71 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1otu h LEU 139 Cb 0.19 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1otu h LEU 139 CO -0.25 0.73 0.00 0.61 0.09 0.00 0.00 178.44 179.62 1otu n GLY 140 N 1.02 -0.12 0.13 0.83 0.00 0.75 -1.56 105.19 106.24 1otu n GLY 140 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 1otu n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1otu n GLY 141 N -1.11 -0.48 0.00 -0.02 0.00 -0.32 -3.10 105.19 100.16 1otu n GLY 141 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1otu n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1otu n GLY 142 N 1.43 -0.33 3.79 -0.02 0.00 -0.60 -4.63 105.19 104.82 1otu n GLY 142 Ca -0.51 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 1otu n GLY 142 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1otu s MET 143 N 0.00 2.50 -0.06 1.61 -1.94 -1.03 -2.07 119.30 118.32 1otu s MET 143 Ca 0.00 1.09 -0.06 0.00 -1.71 0.00 0.00 55.69 55.01 1otu s MET 143 Cb 0.00 -1.93 -0.24 0.00 2.01 0.00 0.00 34.83 34.67 1otu s MET 143 CO 0.00 -1.45 3.54 0.28 -0.01 0.00 0.00 175.02 177.38 1otu n VAL 144 N -3.38 3.04 -4.53 -6.03 0.31 -1.26 -4.06 118.33 102.41 1otu n VAL 144 Ca 0.08 -1.66 -0.24 0.00 -0.01 0.00 0.00 64.34 62.51 1otu n VAL 144 Cb 0.53 -1.96 -0.14 0.00 -0.91 0.00 0.00 33.84 31.36 1otu n VAL 144 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1otu s LEU 145 N -0.22 2.19 0.00 7.52 1.43 -1.26 -4.64 118.68 123.70 1otu s LEU 145 Ca 0.66 -0.54 -0.02 0.00 -1.03 0.00 0.00 54.13 53.20 1otu s LEU 145 Cb 0.33 -0.90 0.02 0.00 0.03 0.00 0.00 46.19 45.67 1otu s LEU 145 CO -0.02 0.12 0.13 0.61 0.23 0.00 0.00 176.35 177.41 1otu n GLY 146 N 1.72 -1.43 0.00 -3.19 0.00 0.11 -4.59 105.19 97.81 1otu n GLY 146 Ca -0.18 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1otu n GLY 146 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1otu n ARG 147 N -1.39 1.18 0.00 1.61 1.85 -1.26 -3.25 116.66 115.40 1otu n ARG 147 Ca 0.02 -0.12 0.00 0.00 -1.00 0.00 0.00 57.85 56.75 1otu n ARG 147 Cb 0.06 -0.48 0.00 0.00 -1.05 0.00 0.00 32.46 30.98 1otu n ARG 147 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1otu n GLN 148 N -0.20 0.00 -0.04 2.89 1.13 -1.26 -2.35 117.38 117.55 1otu n GLN 148 Ca 0.00 0.20 -0.01 0.00 -1.94 0.00 0.00 57.00 55.25 1otu n GLN 148 Cb 0.08 -1.08 -0.01 0.00 0.11 0.00 0.00 30.24 29.34 1otu n GLN 148 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1otu n GLY 149 N 0.03 -1.62 0.46 1.08 0.00 -1.26 0.27 105.19 104.16 1otu n GLY 149 Ca 0.00 0.37 0.39 0.00 0.00 0.00 0.00 46.02 46.78 1otu n GLY 149 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1otu n PRO 150 N -2.88 -0.03 -0.03 1.61 -0.02 -1.24 0.28 135.00 132.68 1otu n PRO 150 Ca 0.00 1.17 -0.14 0.00 -2.02 0.00 0.00 63.50 62.51 1otu n PRO 150 Cb 0.02 -2.33 -0.10 0.00 -0.02 0.00 0.00 33.50 31.06 1otu n PRO 150 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1otu h THR 151 N 0.00 1.49 -0.99 3.45 2.02 0.42 -0.82 112.91 118.50 1otu h THR 151 Ca 0.84 -1.60 0.21 0.00 0.77 0.00 0.00 66.41 66.63 1otu h THR 151 Cb 2.75 2.50 -0.19 0.00 -1.74 0.00 0.00 68.15 71.47 1otu h THR 151 CO -0.41 0.43 -0.20 0.52 0.37 0.00 0.00 175.52 176.24 1otu n VAL 152 N -4.67 -0.41 0.05 3.16 0.31 0.14 0.19 118.33 117.11 1otu n VAL 152 Ca -0.09 2.24 -0.13 0.00 -0.01 0.00 0.00 64.34 66.36 1otu n VAL 152 Cb 0.38 -3.13 -0.09 0.00 -0.91 0.00 0.00 33.84 30.09 1otu n VAL 152 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1otu h GLN 153 N 0.00 -0.13 -0.75 5.55 4.15 -1.49 -1.88 115.11 120.55 1otu h GLN 153 Ca 0.50 0.01 0.20 0.00 0.77 0.00 0.00 58.65 60.12 1otu h GLN 153 Cb 0.81 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.50 1otu h GLN 153 CO -1.00 0.19 0.53 0.82 -1.93 0.00 0.00 178.83 177.44 1otu h ILE 154 N -0.47 0.67 0.43 2.39 2.04 0.18 -2.35 117.51 120.39 1otu h ILE 154 Ca -0.01 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 1otu h ILE 154 Cb 0.39 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1otu h ILE 154 CO 0.02 0.02 -0.20 1.23 0.00 0.00 0.00 178.15 179.22 1otu h GLY 155 N 0.12 -0.60 -0.59 5.37 0.00 0.26 -2.63 103.07 105.00 1otu h GLY 155 Ca 0.36 0.22 0.18 0.00 0.00 0.00 0.00 47.33 48.09 1otu h GLY 155 CO -0.05 -0.22 -0.12 -1.33 0.00 0.00 0.00 176.54 174.82 1otu h GLY 156 N -0.72 0.72 0.32 4.60 0.00 -0.86 0.63 103.07 107.76 1otu h GLY 156 Ca -0.06 0.21 0.10 0.00 0.00 0.00 0.00 47.33 47.59 1otu h GLY 156 CO 0.10 -0.32 0.23 3.43 0.00 0.00 0.00 176.54 179.97 1otu h ASN 157 N 0.03 0.20 -0.51 0.19 4.21 -1.49 0.40 115.58 118.61 1otu h ASN 157 Ca 0.42 0.09 0.08 0.00 1.21 0.00 0.00 56.30 58.09 1otu h ASN 157 Cb 0.70 0.08 -0.06 0.00 -1.12 0.00 0.00 38.32 37.91 1otu h ASN 157 CO -0.80 0.11 0.15 0.40 -1.29 0.00 0.00 177.43 176.01 1otu h ILE 158 N 0.40 0.78 -0.29 2.81 1.08 0.60 0.50 117.51 123.39 1otu h ILE 158 Ca 0.33 -0.11 0.05 0.00 -0.39 0.00 0.00 64.86 64.74 1otu h ILE 158 Cb 0.43 0.44 -0.04 0.00 -3.07 0.00 0.00 36.82 34.58 1otu h ILE 158 CO -0.34 0.06 0.03 1.23 -0.69 0.00 0.00 178.15 178.44 1otu h GLY 159 N 0.31 0.31 0.60 5.37 0.00 0.86 -2.67 103.07 107.86 1otu h GLY 159 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1otu h GLY 159 CO -0.28 -0.04 -0.35 -0.09 0.00 0.00 0.00 176.54 175.78 1otu h ARG 160 N 0.13 -0.68 -0.97 4.80 9.65 0.16 -2.03 114.38 125.43 1otu h ARG 160 Ca 0.14 0.05 0.29 0.00 -1.10 0.00 0.00 59.98 59.35 1otu h ARG 160 Cb 0.16 0.16 -0.18 0.00 -1.39 0.00 0.00 29.97 28.72 1otu h ARG 160 CO -0.20 -0.46 0.15 1.98 2.80 0.00 0.00 179.97 184.24 1otu h MET 161 N -0.71 0.04 -0.08 0.20 4.05 0.23 0.46 114.93 119.11 1otu h MET 161 Ca -0.02 -0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.37 1otu h MET 161 Cb 0.65 -0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.44 1otu h MET 161 CO -0.08 0.02 -0.07 -0.39 0.23 0.00 0.00 176.91 176.63 1otu h VAL 162 N 0.04 1.35 -0.86 -5.77 -1.51 -1.17 0.59 116.25 108.92 1otu h VAL 162 Ca 0.64 -1.18 0.22 0.00 -1.23 0.00 0.00 66.70 65.15 1otu h VAL 162 Cb 1.39 1.96 -0.14 0.00 -2.13 0.00 0.00 31.29 32.37 1otu h VAL 162 CO -0.85 0.33 0.20 0.25 -1.23 0.00 0.00 177.57 176.26 1otu h LEU 163 N -0.22 -0.06 -0.03 4.19 5.85 0.51 0.26 115.31 125.82 1otu h LEU 163 Ca 0.01 0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.89 1otu h LEU 163 Cb 0.56 0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.87 1otu h LEU 163 CO 0.02 -0.16 -0.14 0.44 -0.34 0.00 0.00 178.44 178.26 1otu h ASP 164 N 0.19 0.16 0.32 1.25 3.45 -0.76 0.10 116.42 121.14 1otu h ASP 164 Ca 0.53 -0.67 0.00 0.00 0.43 0.00 0.00 57.03 57.31 1otu h ASP 164 Cb 1.04 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.76 1otu h ASP 164 CO -0.66 0.81 0.00 0.40 -1.57 0.00 0.00 179.24 178.23 1otu h ILE 165 N -0.47 0.00 0.00 0.35 2.04 0.53 -2.29 117.51 117.67 1otu h ILE 165 Ca -0.01 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1otu h ILE 165 Cb 0.81 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1otu h ILE 165 CO 0.03 0.00 0.00 0.49 0.00 0.00 0.00 178.15 178.67 1otu n PHE 166 N -2.36 0.00 -1.82 1.37 3.72 0.78 -5.00 117.46 114.15 1otu n PHE 166 Ca -0.00 -0.30 -0.06 0.00 -0.05 0.00 0.00 57.45 57.03 1otu n PHE 166 Cb 0.12 -0.03 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 1otu n PHE 166 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1otu n ARG 167 N -0.30 -1.43 -2.19 -1.08 0.00 0.02 -4.81 116.66 106.86 1otu n ARG 167 Ca 0.00 0.02 -0.42 0.00 -0.00 0.00 0.00 57.85 57.45 1otu n ARG 167 Cb 0.19 -1.78 -0.03 0.00 -0.00 0.00 0.00 32.46 30.84 1otu n ARG 167 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 1otu s LEU 168 N -2.51 4.33 0.28 2.89 0.05 -1.21 -4.97 118.68 117.54 1otu s LEU 168 Ca 0.13 2.19 0.07 0.00 0.05 0.00 0.00 54.13 56.57 1otu s LEU 168 Cb -0.07 -3.57 -0.03 0.00 -2.05 0.00 0.00 46.19 40.47 1otu s LEU 168 CO 0.15 -0.71 0.24 -0.75 -0.55 0.00 0.00 176.35 174.73 1otu s LYS 169 N 2.10 2.88 0.00 1.48 2.20 -1.26 -4.91 119.74 122.23 1otu s LYS 169 Ca 0.65 -1.12 0.00 0.00 -0.36 0.00 0.00 55.97 55.14 1otu s LYS 169 Cb -0.33 -2.56 0.00 0.00 -1.51 0.00 0.00 37.83 33.43 1otu s LYS 169 CO 0.28 0.29 0.00 0.41 -0.36 0.00 0.00 175.35 175.97 1otu n GLY 170 N -1.27 2.88 0.10 5.54 0.00 -1.26 -4.79 105.19 106.39 1otu n GLY 170 Ca -0.06 -0.92 -0.02 0.00 0.00 0.00 0.00 46.02 45.03 1otu n GLY 170 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1otu n ASP 171 N 0.00 -0.22 -0.33 1.61 9.92 -1.26 0.88 116.55 127.15 1otu n ASP 171 Ca 0.00 0.42 -0.02 0.00 -0.53 0.00 0.00 54.79 54.66 1otu n ASP 171 Cb 0.00 -0.07 0.04 0.00 -0.64 0.00 0.00 41.12 40.45 1otu n ASP 171 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 1otu h GLU 172 N 0.00 -0.04 0.00 -1.24 4.81 -1.92 0.61 114.58 116.79 1otu h GLU 172 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1otu h GLU 172 Cb 0.11 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1otu h GLU 172 CO -0.23 -0.03 0.00 0.00 -0.73 0.00 0.00 179.01 178.02 1otu n ALA 173 N -3.38 2.35 -0.05 2.92 0.00 0.25 0.07 120.51 122.68 1otu n ALA 173 Ca 0.09 -0.06 -0.05 0.00 0.00 0.00 0.00 53.44 53.42 1otu n ALA 173 Cb 0.39 -1.15 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 1otu n ALA 173 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1otu n ARG 174 N -0.68 1.76 0.03 0.00 0.63 0.19 -3.85 116.66 114.75 1otu n ARG 174 Ca 0.07 0.02 -0.02 0.00 -0.92 0.00 0.00 57.85 57.00 1otu n ARG 174 Cb 0.03 -1.21 -0.09 0.00 0.45 0.00 0.00 32.46 31.64 1otu n ARG 174 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1otu h HIS 175 N 0.00 0.00 0.09 -0.14 3.86 -0.84 -3.07 115.15 115.04 1otu h HIS 175 Ca -0.23 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.98 1otu h HIS 175 Cb 1.45 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.92 1otu h HIS 175 CO 0.00 0.68 -0.04 1.15 0.86 0.00 0.00 177.93 180.58 1otu h THR 176 N 0.00 0.00 -0.15 2.45 2.02 -0.55 -1.73 112.91 114.96 1otu h THR 176 Ca -0.17 -0.58 0.04 0.00 0.77 0.00 0.00 66.41 66.47 1otu h THR 176 Cb 1.67 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1otu h THR 176 CO 0.06 0.00 0.34 -0.07 0.37 0.00 0.00 175.52 176.22 1otu h LEU 177 N -0.70 0.00 0.07 2.58 3.38 -1.74 0.65 115.31 119.55 1otu h LEU 177 Ca -0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 1otu h LEU 177 Cb 0.09 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.85 1otu h LEU 177 CO 0.02 0.00 -0.42 0.25 0.09 0.00 0.00 178.44 178.38 1otu h LEU 178 N 0.00 0.25 0.07 1.67 5.85 -1.58 -3.04 115.31 118.53 1otu h LEU 178 Ca 0.07 -0.96 -0.00 0.00 0.84 0.00 0.00 57.88 57.83 1otu h LEU 178 Cb 0.76 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1otu h LEU 178 CO -0.00 1.19 -0.03 0.00 -0.34 0.00 0.00 178.44 179.25 1otu h ALA 179 N 0.06 -0.10 -0.82 1.25 0.00 0.01 -2.72 119.26 116.94 1otu h ALA 179 Ca -0.07 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1otu h ALA 179 Cb 1.32 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 1otu h ALA 179 CO 0.08 -0.48 0.51 1.79 0.00 0.00 0.00 179.25 181.14 1otu h THR 180 N -0.24 1.04 -0.87 0.00 1.35 -1.22 0.31 112.91 113.28 1otu h THR 180 Ca -0.01 -0.32 0.17 0.00 -0.55 0.00 0.00 66.41 65.70 1otu h THR 180 Cb 0.20 0.03 -0.10 0.00 -1.73 0.00 0.00 68.15 66.55 1otu h THR 180 CO 0.02 0.17 0.44 1.23 -0.25 0.00 0.00 175.52 177.12 1otu h GLY 181 N 0.93 1.45 0.41 5.82 0.00 -1.39 0.48 103.07 110.77 1otu h GLY 181 Ca 0.36 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.43 1otu h GLY 181 CO -0.17 -0.10 -0.19 0.00 0.00 0.00 0.00 176.54 176.07 1otu h ALA 182 N 1.61 -1.00 -0.41 3.60 0.00 -0.68 -1.78 119.26 120.59 1otu h ALA 182 Ca 0.50 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.33 1otu h ALA 182 Cb 0.79 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 1otu h ALA 182 CO -0.41 -0.96 -0.38 0.00 0.00 0.00 0.00 179.25 177.50 1otu h ALA 183 N -1.68 -0.53 -0.92 0.00 0.00 -0.56 0.32 119.26 115.88 1otu h ALA 183 Ca -0.06 0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1otu h ALA 183 Cb 0.42 1.08 -0.13 0.00 0.00 0.00 0.00 17.79 19.16 1otu h ALA 183 CO 0.09 -0.74 -0.45 0.00 0.00 0.00 0.00 179.25 178.15 1otu n ALA 184 N -3.03 -0.35 0.01 0.00 0.00 0.16 -0.01 120.51 117.29 1otu n ALA 184 Ca -0.01 0.85 -0.10 0.00 0.00 0.00 0.00 53.44 54.18 1otu n ALA 184 Cb 0.20 -0.27 -0.06 0.00 0.00 0.00 0.00 19.45 19.32 1otu n ALA 184 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1otu h GLY 185 N 0.00 -1.25 -0.06 0.00 0.00 0.28 -0.83 103.07 101.21 1otu h GLY 185 Ca 0.23 0.67 0.24 0.00 0.00 0.00 0.00 47.33 48.47 1otu h GLY 185 CO -0.89 -0.34 0.62 -2.00 0.00 0.00 0.00 176.54 173.93 1otu h LEU 186 N -0.40 0.64 0.00 3.11 5.85 0.21 -1.98 115.31 122.75 1otu h LEU 186 Ca 0.02 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1otu h LEU 186 Cb 0.45 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1otu h LEU 186 CO -0.26 0.15 0.00 0.00 -0.34 0.00 0.00 178.44 177.98 1otu n ALA 187 N -2.36 -0.35 0.09 1.25 0.00 0.99 -2.79 120.51 117.34 1otu n ALA 187 Ca 0.25 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.84 1otu n ALA 187 Cb 0.73 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.54 1otu n ALA 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1otu h ALA 188 N -2.00 2.31 0.42 0.00 0.00 -1.00 0.68 119.26 119.67 1otu h ALA 188 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1otu h ALA 188 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1otu h ALA 188 CO 0.00 -1.17 -0.20 0.00 0.00 0.00 0.00 179.25 177.88 1otu h ALA 189 N 0.54 -0.70 -0.50 0.00 0.00 -1.18 -3.31 119.26 114.11 1otu h ALA 189 Ca 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1otu h ALA 189 Cb 2.09 0.22 0.00 0.00 0.00 0.00 0.00 17.79 20.10 1otu h ALA 189 CO -0.00 -0.66 0.00 1.19 0.00 0.00 0.00 179.25 179.78 1otu n PHE 190 N -4.45 1.38 -4.08 0.00 3.01 0.49 -4.88 117.46 108.93 1otu n PHE 190 Ca -0.07 -0.52 -0.33 0.00 1.01 0.00 0.00 57.45 57.54 1otu n PHE 190 Cb 0.22 -0.29 -0.00 0.00 -0.01 0.00 0.00 39.48 39.40 1otu n PHE 190 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1otu n ASN 191 N 0.73 -3.77 -3.73 4.37 5.15 0.21 -4.90 115.26 113.32 1otu n ASN 191 Ca 0.21 -0.92 -0.30 0.00 -0.60 0.00 0.00 54.58 52.98 1otu n ASN 191 Cb 0.84 -3.24 -0.14 0.00 -0.53 0.00 0.00 39.78 36.71 1otu n ASN 191 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1otu s ALA 192 N -3.33 1.89 0.01 5.20 0.00 -0.98 -4.96 121.76 119.60 1otu s ALA 192 Ca 0.67 -2.15 -0.26 0.00 0.00 0.00 0.00 51.96 50.22 1otu s ALA 192 Cb -0.35 -1.77 -0.15 0.00 0.00 0.00 0.00 23.12 20.84 1otu s ALA 192 CO 0.89 -1.86 1.17 -1.00 0.00 0.00 0.00 175.76 174.96 1otu h PRO 193 N 7.41 -0.74 -1.01 0.00 0.13 -1.91 -2.70 132.00 133.18 1otu h PRO 193 Ca -0.07 0.05 0.33 0.00 -0.87 0.00 0.00 66.00 65.44 1otu h PRO 193 Cb 0.97 0.17 -0.15 0.00 0.13 0.00 0.00 31.00 32.12 1otu h PRO 193 CO 0.47 -0.43 0.58 -0.07 -0.23 0.00 0.00 178.00 178.32 1otu h LEU 194 N -1.07 0.51 -0.18 1.56 3.38 -1.96 0.22 115.31 117.77 1otu h LEU 194 Ca -0.08 0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1otu h LEU 194 Cb 0.65 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1otu h LEU 194 CO 0.13 -0.14 -0.00 0.00 0.09 0.00 0.00 178.44 178.51 1otu h ALA 195 N 1.85 0.24 0.00 1.53 0.00 -1.84 -2.14 119.26 118.89 1otu h ALA 195 Ca 0.74 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1otu h ALA 195 Cb 1.71 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1otu h ALA 195 CO -0.60 -0.04 0.29 0.78 0.00 0.00 0.00 179.25 179.68 1otu h GLY 196 N 0.07 0.00 0.00 0.00 0.00 -0.23 0.54 103.07 103.45 1otu h GLY 196 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1otu h GLY 196 CO 0.01 0.00 -0.34 1.39 0.00 0.00 0.00 176.54 177.60 1otu n ILE 197 N -2.83 0.66 -0.66 2.60 5.41 -1.05 -3.70 119.36 119.79 1otu n ILE 197 Ca -0.02 0.35 0.50 0.00 1.00 0.00 0.00 62.75 64.59 1otu n ILE 197 Cb 0.33 -1.89 0.79 0.00 -0.71 0.00 0.00 39.64 38.16 1otu n ILE 197 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1otu n LEU 198 N -3.36 0.05 0.10 1.39 7.99 -0.83 -0.73 117.00 121.62 1otu n LEU 198 Ca -0.05 1.08 -0.04 0.00 -0.01 0.00 0.00 56.01 56.99 1otu n LEU 198 Cb 0.18 -0.54 -0.02 0.00 -0.11 0.00 0.00 43.42 42.93 1otu n LEU 198 CO 0.07 -1.11 0.33 0.15 -1.51 0.00 0.00 177.39 175.32 1otu h PHE 199 N 0.00 -0.25 -1.02 -1.77 3.57 -1.06 -2.72 116.94 113.69 1otu h PHE 199 Ca 0.93 -0.01 0.33 0.00 3.53 0.00 0.00 57.97 62.75 1otu h PHE 199 Cb 3.57 0.08 -0.15 0.00 2.79 0.00 0.00 35.95 42.24 1otu h PHE 199 CO -0.00 -0.16 0.59 0.82 -2.23 0.00 0.00 178.31 177.33 1otu h ILE 200 N -0.38 0.29 -0.93 1.41 5.03 -1.01 0.72 117.51 122.64 1otu h ILE 200 Ca -0.03 -0.10 -0.52 0.00 -0.12 0.00 0.00 64.86 64.09 1otu h ILE 200 Cb 0.21 -0.04 -0.28 0.00 -3.03 0.00 0.00 36.82 33.67 1otu h ILE 200 CO 0.05 0.06 0.66 2.30 -0.68 0.00 0.00 178.15 180.53 1otu n ILE 201 N -5.02 3.16 -0.14 -0.67 -5.35 -0.80 -0.93 119.36 109.60 1otu n ILE 201 Ca 0.32 -2.00 0.00 0.00 -0.27 0.00 0.00 62.75 60.80 1otu n ILE 201 Cb 1.02 -0.65 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 1otu n ILE 201 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1otu n GLU 202 N -0.98 2.24 0.00 6.28 2.13 0.07 -4.97 120.64 125.41 1otu n GLU 202 Ca 0.56 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.38 1otu n GLU 202 Cb 1.40 -0.19 0.00 0.00 0.27 0.00 0.00 31.44 32.92 1otu n GLU 202 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1otu n GLU 203 N 0.00 0.00 -0.35 5.31 4.07 -0.17 -4.94 120.64 124.56 1otu n GLU 203 Ca 0.00 0.00 0.02 0.00 -0.06 0.00 0.00 57.16 57.12 1otu n GLU 203 Cb 0.00 0.00 0.09 0.00 -0.06 0.00 0.00 31.44 31.47 1otu n GLU 203 CO 0.00 0.00 0.00 0.52 -0.06 0.00 0.00 177.13 177.59 1otu h MET 204 N 0.00 -0.01 -6.03 5.31 2.86 -1.67 -3.43 114.93 111.97 1otu h MET 204 Ca 0.00 0.00 -0.77 0.00 -2.06 0.00 0.00 59.70 56.87 1otu h MET 204 Cb 0.00 0.00 0.05 0.00 0.06 0.00 0.00 31.60 31.72 1otu h MET 204 CO 0.00 -0.01 0.07 -2.13 1.06 0.00 0.00 176.91 175.91 1otu n ARG 205 N -5.55 0.12 -1.49 1.72 0.63 -0.11 -4.69 116.66 107.29 1otu n ARG 205 Ca 0.13 0.04 -0.54 0.00 -0.92 0.00 0.00 57.85 56.56 1otu n ARG 205 Cb 0.45 -1.53 -0.08 0.00 0.45 0.00 0.00 32.46 31.74 1otu n ARG 205 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1otu n PRO 206 N 1.58 0.93 0.07 -0.14 -0.04 -1.26 -4.79 135.00 131.35 1otu n PRO 206 Ca 0.20 0.28 0.08 0.00 -0.04 0.00 0.00 63.50 64.02 1otu n PRO 206 Cb 0.10 -2.21 0.36 0.00 -0.04 0.00 0.00 33.50 31.71 1otu n PRO 206 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1otu n GLN 207 N 7.32 0.09 0.00 0.54 -0.06 -1.26 -4.01 117.38 119.99 1otu n GLN 207 Ca 0.39 0.43 0.00 0.00 -2.00 0.00 0.00 57.00 55.82 1otu n GLN 207 Cb 0.16 -1.70 0.00 0.00 -4.06 0.00 0.00 30.24 24.64 1otu n GLN 207 CO 0.00 0.00 0.00 1.19 -0.20 0.00 0.00 177.06 178.05 1otu n PHE 208 N -1.87 0.00 -3.71 3.69 3.01 -1.26 -5.05 117.46 112.26 1otu n PHE 208 Ca 0.01 -0.07 -0.11 0.00 1.01 0.00 0.00 57.45 58.29 1otu n PHE 208 Cb 0.13 -0.01 -0.12 0.00 -0.01 0.00 0.00 39.48 39.47 1otu n PHE 208 CO 0.00 0.00 0.00 -0.98 1.01 0.00 0.00 176.76 176.79 1otu s ARG 209 N -0.15 0.32 0.28 -1.08 1.70 -1.26 -5.13 118.95 113.64 1otu s ARG 209 Ca 0.00 0.65 -0.18 0.00 -0.47 0.00 0.00 55.73 55.73 1otu s ARG 209 Cb 0.00 -0.04 -0.13 0.00 -0.57 0.00 0.00 34.95 34.21 1otu s ARG 209 CO 0.00 -0.15 0.15 0.98 -1.08 0.00 0.00 175.30 175.20 1otu n TYR 210 N 4.11 -1.37 -4.23 5.89 9.36 -1.26 -4.88 117.16 124.77 1otu n TYR 210 Ca -0.23 0.57 -0.13 0.00 3.32 0.00 0.00 57.90 61.42 1otu n TYR 210 Cb 0.55 -1.46 -0.10 0.00 -0.63 0.00 0.00 39.34 37.70 1otu n TYR 210 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1otu s THR 211 N -1.21 0.72 -0.39 2.97 2.01 -1.26 -5.05 115.64 113.42 1otu s THR 211 Ca 0.48 -1.98 0.00 0.00 0.31 0.00 0.00 61.69 60.50 1otu s THR 211 Cb -0.57 -2.05 0.34 0.00 0.01 0.00 0.00 72.50 70.24 1otu s THR 211 CO 0.49 -0.55 1.88 0.18 -0.69 0.00 0.00 174.62 175.94 1otu n LEU 212 N -0.22 6.42 -4.58 4.42 4.32 -1.26 -4.90 117.00 121.20 1otu n LEU 212 Ca -0.07 -3.39 -0.41 0.00 -0.02 0.00 0.00 56.01 52.11 1otu n LEU 212 Cb 0.63 -0.93 -0.07 0.00 -1.62 0.00 0.00 43.42 41.43 1otu n LEU 212 CO 0.33 1.16 0.31 -0.63 -1.22 0.00 0.00 177.39 177.34 1otu s ILE 213 N -2.84 4.98 -0.65 -0.08 1.01 -1.26 -4.33 121.20 118.03 1otu s ILE 213 Ca 0.41 0.63 -0.28 0.00 0.00 0.00 0.00 60.65 61.42 1otu s ILE 213 Cb 0.33 -3.97 0.03 0.00 0.01 0.00 0.00 42.46 38.85 1otu s ILE 213 CO 0.02 -0.16 1.30 -0.55 0.00 0.00 0.00 174.94 175.54 1otu s SER 214 N 1.70 6.22 0.01 3.58 0.15 -1.26 -4.93 113.70 119.16 1otu s SER 214 Ca 0.22 -0.11 -0.01 0.00 0.70 0.00 0.00 55.95 56.75 1otu s SER 214 Cb -0.15 -2.55 -0.00 0.00 -1.71 0.00 0.00 66.02 61.60 1otu s SER 214 CO 0.12 -1.72 1.02 0.40 1.20 0.00 0.00 173.24 174.27 1otu h ILE 215 N 6.16 0.00 -1.28 6.45 1.08 -1.99 0.18 117.51 128.11 1otu h ILE 215 Ca -0.27 0.00 0.45 0.00 -0.39 0.00 0.00 64.86 64.65 1otu h ILE 215 Cb 1.06 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.67 1otu h ILE 215 CO 1.23 0.00 0.80 0.50 -0.69 0.00 0.00 178.15 179.99 1otu h LYS 216 N -0.00 0.04 -0.35 2.37 3.64 -2.00 0.72 116.57 120.99 1otu h LYS 216 Ca 0.01 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1otu h LYS 216 Cb 0.02 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 1otu h LYS 216 CO -0.04 0.03 0.21 0.00 -2.27 0.00 0.00 179.45 177.38 1otu h ALA 217 N 1.68 0.44 0.59 5.00 0.00 -1.05 -2.80 119.26 123.13 1otu h ALA 217 Ca 0.85 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.73 1otu h ALA 217 Cb 2.61 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 20.29 1otu h ALA 217 CO -0.51 -0.14 -0.47 0.28 0.00 0.00 0.00 179.25 178.41 1otu h VAL 218 N 0.42 0.00 -0.19 0.00 2.07 0.87 -2.72 116.25 116.70 1otu h VAL 218 Ca 0.14 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.67 1otu h VAL 218 Cb -0.00 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.74 1otu h VAL 218 CO -0.06 0.00 -0.11 0.49 0.02 0.00 0.00 177.57 177.90 1otu n PHE 219 N -5.33 -0.09 -0.32 1.57 3.01 -1.02 0.16 117.46 115.44 1otu n PHE 219 Ca -0.12 0.24 0.21 0.00 1.01 0.00 0.00 57.45 58.79 1otu n PHE 219 Cb 0.45 -0.45 0.42 0.00 -0.01 0.00 0.00 39.48 39.89 1otu n PHE 219 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1otu h ILE 220 N 0.00 0.21 0.84 4.37 2.04 -1.49 0.18 117.51 123.67 1otu h ILE 220 Ca 0.03 -0.07 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 1otu h ILE 220 Cb 0.08 0.00 0.01 0.00 -0.74 0.00 0.00 36.82 36.17 1otu h ILE 220 CO -0.18 0.04 -0.40 1.23 0.00 0.00 0.00 178.15 178.83 1otu h GLY 221 N 0.19 -1.18 -0.33 5.37 0.00 0.18 -1.20 103.07 106.10 1otu h GLY 221 Ca 0.69 0.44 0.03 0.00 0.00 0.00 0.00 47.33 48.49 1otu h GLY 221 CO -0.69 -0.43 -0.29 -2.08 0.00 0.00 0.00 176.54 173.06 1otu h VAL 222 N -1.25 0.00 -0.03 4.60 2.07 0.16 -2.41 116.25 119.39 1otu h VAL 222 Ca -0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1otu h VAL 222 Cb 0.87 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1otu h VAL 222 CO 0.19 0.00 -0.02 0.40 0.02 0.00 0.00 177.57 178.16 1otu h ILE 223 N -0.11 0.00 -1.21 4.57 2.04 -0.76 -0.06 117.51 121.98 1otu h ILE 223 Ca 0.06 0.00 0.41 0.00 1.00 0.00 0.00 64.86 66.32 1otu h ILE 223 Cb 0.26 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.23 1otu h ILE 223 CO -0.37 0.00 0.79 0.23 0.00 0.00 0.00 178.15 178.80 1otu n MET 224 N -3.02 -0.03 -0.07 2.37 2.81 -0.46 0.04 117.12 118.77 1otu n MET 224 Ca 0.00 1.02 -0.12 0.00 -1.81 0.00 0.00 57.70 56.80 1otu n MET 224 Cb 0.01 -2.05 -0.10 0.00 -0.71 0.00 0.00 33.22 30.37 1otu n MET 224 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1otu h SER 225 N 0.00 0.00 -0.99 7.83 4.64 -0.58 -2.70 113.55 121.75 1otu h SER 225 Ca 0.74 -0.75 0.25 0.00 -0.47 0.00 0.00 61.79 61.55 1otu h SER 225 Cb 2.45 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 64.41 1otu h SER 225 CO -0.34 0.93 0.57 0.74 -0.87 0.00 0.00 176.83 177.86 1otu h THR 226 N -1.00 0.51 0.15 2.95 2.02 0.54 0.89 112.91 118.97 1otu h THR 226 Ca -0.02 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 1otu h THR 226 Cb 0.81 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 1otu h THR 226 CO -0.01 0.10 -0.07 0.40 0.37 0.00 0.00 175.52 176.30 1otu h ILE 227 N 0.54 0.92 -0.84 3.11 5.03 -1.12 0.12 117.51 125.27 1otu h ILE 227 Ca 0.64 -0.26 0.15 0.00 -0.12 0.00 0.00 64.86 65.27 1otu h ILE 227 Cb 1.24 1.08 -0.06 0.00 -3.03 0.00 0.00 36.82 36.05 1otu h ILE 227 CO -0.49 0.06 0.55 0.24 -0.68 0.00 0.00 178.15 177.82 1otu h MET 228 N -0.32 0.56 -0.13 2.37 2.86 0.81 -0.04 114.93 121.04 1otu h MET 228 Ca -0.02 -0.03 -0.20 0.00 -2.06 0.00 0.00 59.70 57.38 1otu h MET 228 Cb 0.25 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 31.80 1otu h MET 228 CO 0.03 0.37 -0.71 -0.92 1.06 0.00 0.00 176.91 176.75 1otu h TYR 229 N 0.58 0.97 0.00 -0.22 3.20 0.68 -3.13 116.97 119.04 1otu h TYR 229 Ca 0.42 -0.43 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 1otu h TYR 229 Cb 0.78 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.89 1otu h TYR 229 CO -0.00 1.25 -0.16 0.00 -1.64 0.00 0.00 178.16 177.61 1otu h ARG 230 N 0.41 0.00 0.00 1.82 2.47 0.61 -0.48 114.38 119.20 1otu h ARG 230 Ca -0.05 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.65 1otu h ARG 230 Cb 1.35 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.66 1otu h ARG 230 CO 0.15 0.16 -0.08 0.82 0.56 0.00 0.00 179.97 181.58 1otu h ILE 231 N 0.00 0.94 -0.01 2.04 1.08 -1.01 -2.72 117.51 117.84 1otu h ILE 231 Ca -0.00 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 64.17 1otu h ILE 231 Cb 0.37 1.17 0.00 0.00 -3.07 0.00 0.00 36.82 35.28 1otu h ILE 231 CO 0.02 0.08 0.00 0.49 -0.69 0.00 0.00 178.15 178.05 1otu n PHE 232 N -4.26 0.01 -1.58 1.37 3.01 -0.85 -4.74 117.46 110.42 1otu n PHE 232 Ca -0.03 -0.09 0.03 0.00 1.01 0.00 0.00 57.45 58.38 1otu n PHE 232 Cb 0.16 -0.01 0.05 0.00 -0.01 0.00 0.00 39.48 39.67 1otu n PHE 232 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1otu n ASN 233 N -0.02 0.85 -3.22 4.37 3.02 -0.25 -5.10 115.26 114.91 1otu n ASN 233 Ca 0.01 -2.32 -0.20 0.00 -0.03 0.00 0.00 54.58 52.04 1otu n ASN 233 Cb 0.07 -0.26 0.19 0.00 -0.61 0.00 0.00 39.78 39.16 1otu n ASN 233 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1otu n HIS 234 N -0.50 -3.01 -0.30 3.10 1.44 -1.03 -3.77 115.22 111.14 1otu n HIS 234 Ca 0.05 -0.45 0.00 0.00 -2.01 0.00 0.00 57.72 55.31 1otu n HIS 234 Cb 0.66 -0.95 0.00 0.00 0.12 0.00 0.00 29.99 29.82 1otu n HIS 234 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1otu n GLU 235 N -3.85 -1.62 -3.67 -1.40 1.02 -1.26 -4.86 120.64 104.99 1otu n GLU 235 Ca 0.09 0.14 -0.08 0.00 -0.02 0.00 0.00 57.16 57.28 1otu n GLU 235 Cb 0.39 -3.12 -0.09 0.00 -0.02 0.00 0.00 31.44 28.60 1otu n GLU 235 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1otu s VAL 236 N -0.34 -0.09 0.73 2.62 1.01 -1.25 -5.17 120.40 117.92 1otu s VAL 236 Ca 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 1otu s VAL 236 Cb 0.00 -0.80 0.12 0.00 0.00 0.00 0.00 36.38 35.70 1otu s VAL 236 CO 0.00 0.02 1.01 0.00 0.00 0.00 0.00 175.10 176.13 1otu s ALA 237 N 1.63 3.54 -0.17 5.51 0.00 -1.26 -5.00 121.76 126.01 1otu s ALA 237 Ca -0.09 -1.59 0.19 0.00 0.00 0.00 0.00 51.96 50.47 1otu s ALA 237 Cb -0.07 -2.13 -0.07 0.00 0.00 0.00 0.00 23.12 20.85 1otu s ALA 237 CO -0.16 -1.48 0.94 -0.07 0.00 0.00 0.00 175.76 174.98 1otu h LEU 238 N -0.59 0.00 -8.11 0.00 3.38 -1.94 -3.46 115.31 104.59 1otu h LEU 238 Ca -0.38 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.48 1otu h LEU 238 Cb 1.27 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.87 1otu h LEU 238 CO 0.42 0.33 -0.59 -0.63 0.09 0.00 0.00 178.44 178.06 1otu s ILE 239 N -3.11 0.19 -0.47 1.22 1.01 -1.26 -4.85 121.20 113.93 1otu s ILE 239 Ca -0.02 -1.60 0.06 0.00 0.00 0.00 0.00 60.65 59.09 1otu s ILE 239 Cb 0.09 -1.43 0.29 0.00 0.01 0.00 0.00 42.46 41.41 1otu s ILE 239 CO 0.80 -0.89 1.02 -0.67 0.00 0.00 0.00 174.94 175.20 1otu n ASP 240 N 0.11 -2.56 0.26 3.58 -0.08 -1.26 -4.96 116.55 111.64 1otu n ASP 240 Ca -0.15 -3.53 0.17 0.00 -1.51 0.00 0.00 54.79 49.77 1otu n ASP 240 Cb 0.61 1.87 0.72 0.00 2.34 0.00 0.00 41.12 46.67 1otu n ASP 240 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1otu h VAL 241 N 2.99 0.00 -1.68 5.18 2.07 -1.89 -3.49 116.25 119.42 1otu h VAL 241 Ca -0.12 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.01 1otu h VAL 241 Cb 1.07 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1otu h VAL 241 CO 0.22 0.00 -0.44 0.61 0.02 0.00 0.00 177.57 177.98 1otu n GLY 242 N -0.14 -3.37 3.47 2.17 0.00 -1.26 -4.71 105.19 101.35 1otu n GLY 242 Ca 0.00 -1.10 -0.52 0.00 0.00 0.00 0.00 46.02 44.40 1otu n GLY 242 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1otu n LYS 243 N -2.01 1.03 -2.03 1.61 3.00 -1.26 -4.92 118.16 113.58 1otu n LYS 243 Ca -0.00 0.30 -0.29 0.00 -0.00 0.00 0.00 58.31 58.32 1otu n LYS 243 Cb 0.22 -2.33 0.18 0.00 0.00 0.00 0.00 35.03 33.10 1otu n LYS 243 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1otu s LEU 244 N 6.54 2.76 0.00 3.14 1.43 -1.26 -5.06 118.68 126.22 1otu s LEU 244 Ca 1.08 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 54.35 1otu s LEU 244 Cb -0.94 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.03 1otu s LEU 244 CO 0.53 -2.61 0.00 -1.54 0.23 0.00 0.00 176.35 172.96 1otu n SER 245 N -3.63 -0.45 -3.43 2.29 3.41 -1.26 -5.07 113.62 105.47 1otu n SER 245 Ca 0.15 -0.15 -0.14 0.00 -0.26 0.00 0.00 58.87 58.48 1otu n SER 245 Cb 0.60 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.54 1otu n SER 245 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1otu n ASP 246 N -1.11 2.02 -3.63 4.04 9.92 -1.26 -4.90 116.55 121.63 1otu n ASP 246 Ca 0.00 -1.99 -0.24 0.00 -0.53 0.00 0.00 54.79 52.03 1otu n ASP 246 Cb 0.00 0.01 -0.17 0.00 -0.64 0.00 0.00 41.12 40.32 1otu n ASP 246 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1otu s ALA 247 N -2.41 0.36 0.47 2.24 0.00 -1.26 -4.97 121.76 116.20 1otu s ALA 247 Ca 0.13 -0.14 -0.23 0.00 0.00 0.00 0.00 51.96 51.73 1otu s ALA 247 Cb -0.01 -0.89 -0.07 0.00 0.00 0.00 0.00 23.12 22.15 1otu s ALA 247 CO 0.08 -0.94 1.17 -1.25 0.00 0.00 0.00 175.76 174.83 1otu s PRO 248 N 2.15 3.69 0.63 0.00 0.04 -1.26 -4.92 135.00 135.32 1otu s PRO 248 Ca 0.03 1.78 0.29 0.00 0.04 0.00 0.00 61.00 63.15 1otu s PRO 248 Cb -0.15 -2.36 1.57 0.00 0.04 0.00 0.00 34.50 33.61 1otu s PRO 248 CO -0.07 -0.61 1.93 -0.07 0.04 0.00 0.00 177.00 178.22 1otu h LEU 249 N 1.94 0.00 -0.18 -3.56 3.38 -2.01 0.73 115.31 115.61 1otu h LEU 249 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1otu h LEU 249 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1otu h LEU 249 CO 0.60 0.00 0.00 -0.46 0.09 0.00 0.00 178.44 178.67 1otu n ASN 250 N -3.33 0.27 -0.03 -0.43 6.94 -1.26 -2.64 115.26 114.78 1otu n ASN 250 Ca 0.03 -1.36 0.02 0.00 -0.02 0.00 0.00 54.58 53.24 1otu n ASN 250 Cb 0.49 -0.01 0.03 0.00 -2.36 0.00 0.00 39.78 37.92 1otu n ASN 250 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1otu n THR 251 N -0.66 1.03 0.07 5.53 -2.24 0.25 -4.75 114.28 113.50 1otu n THR 251 Ca 0.17 -1.10 -0.13 0.00 -2.27 0.00 0.00 64.05 60.72 1otu n THR 251 Cb 0.12 0.42 -0.09 0.00 -2.10 0.00 0.00 70.33 68.68 1otu n THR 251 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1otu h LEU 252 N 0.00 -0.16 -1.66 3.22 3.38 -1.53 -3.11 115.31 115.45 1otu h LEU 252 Ca 0.00 -0.31 0.34 0.00 0.09 0.00 0.00 57.88 58.00 1otu h LEU 252 Cb 0.66 0.04 -0.08 0.00 0.09 0.00 0.00 40.66 41.38 1otu h LEU 252 CO 0.00 0.24 0.81 4.11 0.09 0.00 0.00 178.44 183.69 1otu h TRP 253 N -0.60 0.33 -0.80 1.13 5.08 -1.85 0.32 115.95 119.57 1otu h TRP 253 Ca -0.02 0.01 0.05 0.00 1.08 0.00 0.00 58.89 60.02 1otu h TRP 253 Cb 0.46 -0.09 -0.05 0.00 -3.00 0.00 0.00 29.16 26.47 1otu h TRP 253 CO 0.05 -0.01 0.52 -0.07 -1.28 0.00 0.00 178.44 177.66 1otu h LEU 254 N 0.17 0.79 -0.98 0.11 3.38 -1.89 -0.46 115.31 116.43 1otu h LEU 254 Ca 0.63 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.55 1otu h LEU 254 Cb 2.09 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.66 1otu h LEU 254 CO -0.18 0.52 -0.23 1.88 0.09 0.00 0.00 178.44 180.52 1otu h TYR 255 N 0.90 0.00 0.28 1.13 -1.99 -0.48 -2.26 116.97 114.55 1otu h TYR 255 Ca 0.34 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.05 1otu h TYR 255 Cb 0.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.90 1otu h TYR 255 CO -0.00 0.23 -0.13 1.25 -0.00 0.00 0.00 178.16 179.50 1otu h LEU 256 N 0.00 -0.31 -0.35 3.88 5.85 -1.08 -1.01 115.31 122.28 1otu h LEU 256 Ca -0.00 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1otu h LEU 256 Cb 0.80 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.84 1otu h LEU 256 CO 0.03 0.10 -0.56 0.40 -0.34 0.00 0.00 178.44 178.07 1otu h ILE 257 N -0.79 0.00 -1.00 4.05 1.08 -1.16 0.63 117.51 120.32 1otu h ILE 257 Ca -0.04 0.00 0.24 0.00 -0.39 0.00 0.00 64.86 64.67 1otu h ILE 257 Cb 0.51 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.17 1otu h ILE 257 CO 0.06 0.00 0.64 0.25 -0.69 0.00 0.00 178.15 178.41 1otu h LEU 258 N -0.43 0.48 -0.02 1.44 5.85 -1.43 0.69 115.31 121.89 1otu h LEU 258 Ca 0.06 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1otu h LEU 258 Cb 0.61 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 1otu h LEU 258 CO -0.56 0.14 0.01 1.23 -0.34 0.00 0.00 178.44 178.91 1otu h GLY 259 N 0.45 0.04 0.76 3.75 0.00 0.15 -1.98 103.07 106.23 1otu h GLY 259 Ca 0.56 -0.02 0.05 0.00 0.00 0.00 0.00 47.33 47.92 1otu h GLY 259 CO -0.27 0.02 0.50 -2.22 0.00 0.00 0.00 176.54 174.56 1otu h ILE 260 N -0.08 1.05 -0.77 2.60 2.04 0.16 0.19 117.51 122.70 1otu h ILE 260 Ca 0.01 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1otu h ILE 260 Cb 0.12 0.05 -0.04 0.00 -0.74 0.00 0.00 36.82 36.21 1otu h ILE 260 CO -0.00 0.17 0.49 0.40 0.00 0.00 0.00 178.15 179.21 1otu h ILE 261 N 0.92 1.21 -0.51 -0.67 2.04 -1.02 0.41 117.51 119.88 1otu h ILE 261 Ca 0.34 -0.40 -0.05 0.00 1.00 0.00 0.00 64.86 65.75 1otu h ILE 261 Cb 0.13 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 1otu h ILE 261 CO -0.16 0.20 0.12 -0.26 0.00 0.00 0.00 178.15 178.05 1otu h PHE 262 N 1.04 0.80 -0.20 1.37 -1.00 -0.46 -2.15 116.94 116.34 1otu h PHE 262 Ca 0.28 -0.07 -0.01 0.00 2.81 0.00 0.00 57.97 60.98 1otu h PHE 262 Cb -0.09 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.23 1otu h PHE 262 CO -0.01 0.68 0.10 0.78 -1.61 0.00 0.00 178.31 178.24 1otu h GLY 263 N 0.94 0.29 0.87 -1.45 0.00 0.14 0.57 103.07 104.43 1otu h GLY 263 Ca 0.17 -0.12 -0.34 0.00 0.00 0.00 0.00 47.33 47.04 1otu h GLY 263 CO -0.00 0.11 -1.80 0.16 0.00 0.00 0.00 176.54 175.01 1otu h ILE 264 N 0.27 0.84 0.00 2.60 3.07 -0.99 -2.39 117.51 120.90 1otu h ILE 264 Ca 0.07 -2.53 0.00 0.00 1.55 0.00 0.00 64.86 63.95 1otu h ILE 264 Cb 0.03 2.60 0.00 0.00 -0.27 0.00 0.00 36.82 39.18 1otu h ILE 264 CO -0.01 0.81 0.00 0.33 -1.05 0.00 0.00 178.15 178.23 1otu n PHE 265 N -3.43 0.73 0.15 0.16 7.35 -0.83 -3.77 117.46 117.82 1otu n PHE 265 Ca -0.25 0.22 -0.14 0.00 -0.76 0.00 0.00 57.45 56.52 1otu n PHE 265 Cb 1.05 -0.86 -0.08 0.00 0.35 0.00 0.00 39.48 39.94 1otu n PHE 265 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1otu h GLY 266 N 4.35 -0.37 1.42 7.13 0.00 0.03 -1.96 103.07 113.68 1otu h GLY 266 Ca 0.00 0.14 -0.13 0.00 0.00 0.00 0.00 47.33 47.34 1otu h GLY 266 CO 0.00 -0.13 -0.34 -0.56 0.00 0.00 0.00 176.54 175.51 1otu h PRO 267 N -0.51 0.65 0.28 4.80 0.13 -1.75 -2.90 132.00 132.70 1otu h PRO 267 Ca -0.04 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1otu h PRO 267 Cb 0.38 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.48 1otu h PRO 267 CO 0.06 0.90 -0.28 0.82 -0.23 0.00 0.00 178.00 179.26 1otu h ILE 268 N 0.55 0.40 -0.42 -3.56 2.04 -1.64 0.19 117.51 115.07 1otu h ILE 268 Ca 0.06 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.04 1otu h ILE 268 Cb 0.84 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 1otu h ILE 268 CO 0.07 0.00 0.42 0.15 0.00 0.00 0.00 178.15 178.79 1otu h PHE 269 N -0.60 0.00 -0.11 1.37 3.57 -1.34 0.21 116.94 120.04 1otu h PHE 269 Ca -0.01 0.00 -0.23 0.00 3.53 0.00 0.00 57.97 61.27 1otu h PHE 269 Cb 0.55 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.30 1otu h PHE 269 CO -0.18 0.00 -0.82 -0.91 -2.23 0.00 0.00 178.31 174.16 1otu h ASN 270 N 0.00 0.86 0.78 0.41 -0.26 -0.53 -1.52 115.58 115.33 1otu h ASN 270 Ca 0.20 -0.59 -0.04 0.00 -0.56 0.00 0.00 56.30 55.31 1otu h ASN 270 Cb 1.03 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 38.03 1otu h ASN 270 CO -0.00 1.38 -0.42 0.11 -1.06 0.00 0.00 177.43 177.44 1otu h LYS 271 N 0.47 -1.07 -0.05 0.81 1.57 0.16 -1.73 116.57 116.73 1otu h LYS 271 Ca -0.06 0.07 0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1otu h LYS 271 Cb 1.45 0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.99 1otu h LYS 271 CO 0.16 -0.71 -0.09 -1.49 -0.57 0.00 0.00 179.45 176.74 1otu h TRP 272 N -1.11 -0.29 -0.98 -1.35 4.06 -1.44 0.46 115.95 115.30 1otu h TRP 272 Ca -0.10 0.01 0.23 0.00 2.06 0.00 0.00 58.89 61.09 1otu h TRP 272 Cb 0.87 0.13 -0.18 0.00 -1.00 0.00 0.00 29.16 28.98 1otu h TRP 272 CO -0.06 -0.09 -0.13 -0.24 -3.56 0.00 0.00 178.44 174.37 1otu h VAL 273 N -0.08 0.02 0.00 1.49 3.04 -1.30 0.76 116.25 120.18 1otu h VAL 273 Ca 0.01 -0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.70 1otu h VAL 273 Cb 0.11 0.02 0.00 0.00 -2.01 0.00 0.00 31.29 29.41 1otu h VAL 273 CO -0.09 0.00 0.00 -0.11 -1.01 0.00 0.00 177.57 176.36 1otu n LEU 274 N -5.56 0.26 -0.23 3.16 7.94 -0.52 -2.31 117.00 119.73 1otu n LEU 274 Ca 0.19 0.58 0.02 0.00 -1.11 0.00 0.00 56.01 55.69 1otu n LEU 274 Cb 0.60 -0.14 0.12 0.00 0.53 0.00 0.00 43.42 44.53 1otu n LEU 274 CO -0.09 -0.14 0.81 1.23 -1.11 0.00 0.00 177.39 178.08 1otu h GLY 275 N 0.00 0.69 0.22 -3.96 0.00 0.20 0.46 103.07 100.69 1otu h GLY 275 Ca 0.00 0.12 0.25 0.00 0.00 0.00 0.00 47.33 47.70 1otu h GLY 275 CO 0.00 -0.25 0.63 1.98 0.00 0.00 0.00 176.54 178.90 1otu h MET 276 N 0.08 0.11 0.00 4.80 1.85 0.43 1.16 114.93 123.36 1otu h MET 276 Ca 0.36 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.44 1otu h MET 276 Cb 0.60 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.60 1otu h MET 276 CO -0.62 0.07 0.00 0.00 -0.40 0.00 0.00 176.91 175.96 1otu n GLN 277 N -4.34 0.06 -0.08 0.39 10.64 0.16 -1.95 117.38 122.26 1otu n GLN 277 Ca 0.19 0.13 -0.09 0.00 -1.83 0.00 0.00 57.00 55.40 1otu n GLN 277 Cb 0.89 -1.58 -0.04 0.00 -0.86 0.00 0.00 30.24 28.65 1otu n GLN 277 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 1otu h ASP 278 N 0.00 0.00 0.00 2.61 3.32 0.14 -3.28 116.42 119.21 1otu h ASP 278 Ca 0.00 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1otu h ASP 278 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1otu h ASP 278 CO 0.00 0.94 0.19 -0.11 -1.72 0.00 0.00 179.24 178.54 1otu n LEU 279 N -4.57 0.29 -0.44 1.55 0.00 -0.09 0.28 117.00 114.02 1otu n LEU 279 Ca -0.13 0.55 0.11 0.00 0.00 0.00 0.00 56.01 56.53 1otu n LEU 279 Cb 0.37 -0.53 0.03 0.00 0.00 0.00 0.00 43.42 43.28 1otu n LEU 279 CO 0.13 -0.65 0.32 0.18 0.00 0.00 0.00 177.39 177.37 1otu n LEU 280 N -1.90 1.86 0.07 -1.96 4.77 -0.82 -4.15 117.00 114.86 1otu n LEU 280 Ca -0.01 -0.69 -0.18 0.00 -0.03 0.00 0.00 56.01 55.11 1otu n LEU 280 Cb 0.21 -0.01 -0.14 0.00 -2.33 0.00 0.00 43.42 41.14 1otu n LEU 280 CO 0.05 0.35 -0.34 -0.74 -1.33 0.00 0.00 177.39 175.38 1otu h HIS 281 N 2.15 0.52 -0.07 -1.77 2.76 0.39 -3.35 115.15 115.78 1otu h HIS 281 Ca 0.00 -0.38 0.03 0.00 -2.20 0.00 0.00 60.37 57.82 1otu h HIS 281 Cb 0.71 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.62 1otu h HIS 281 CO 0.00 1.43 -0.14 0.00 -1.30 0.00 0.00 177.93 177.91 1otu h ARG 282 N 0.08 -0.20 -1.32 5.26 3.08 -1.68 0.52 114.38 120.13 1otu h ARG 282 Ca -0.25 0.01 0.38 0.00 0.07 0.00 0.00 59.98 60.19 1otu h ARG 282 Cb 2.03 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 32.08 1otu h ARG 282 CO 0.17 -0.13 1.11 0.28 -1.07 0.00 0.00 179.97 180.33 1otu h VAL 283 N -0.20 0.15 0.00 2.04 2.07 -1.77 -1.98 116.25 116.56 1otu h VAL 283 Ca 0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1otu h VAL 283 Cb 0.31 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1otu h VAL 283 CO -0.19 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.39 1otu n HIS 284 N -3.76 0.00 0.00 1.57 1.44 -0.86 -4.90 115.22 108.71 1otu n HIS 284 Ca 0.29 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.00 1otu n HIS 284 Cb 1.52 0.00 0.00 0.00 0.12 0.00 0.00 29.99 31.63 1otu n HIS 284 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1otu n GLY 285 N 0.75 0.28 0.00 -1.39 0.00 0.18 0.31 105.19 105.31 1otu n GLY 285 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1otu n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1otu n GLY 286 N -0.53 -0.42 3.68 -0.02 0.00 -1.26 -4.98 105.19 101.67 1otu n GLY 286 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1otu n GLY 286 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1otu s ASN 287 N -0.31 7.08 0.29 1.61 2.47 0.15 -4.94 114.94 121.29 1otu s ASN 287 Ca 0.00 1.70 0.04 0.00 0.42 0.00 0.00 52.86 55.02 1otu s ASN 287 Cb 0.00 -2.55 0.71 0.00 -1.45 0.00 0.00 41.25 37.95 1otu s ASN 287 CO 0.00 -0.59 1.73 -0.29 -3.72 0.00 0.00 177.10 174.23 1otu h ILE 288 N 5.14 0.59 0.00 -5.21 2.10 -1.96 -1.55 117.51 116.62 1otu h ILE 288 Ca -0.31 -0.19 -0.02 0.00 1.08 0.00 0.00 64.86 65.43 1otu h ILE 288 Cb 1.14 -0.01 -0.00 0.00 -1.09 0.00 0.00 36.82 36.86 1otu h ILE 288 CO 0.90 0.10 -0.50 0.74 -1.08 0.00 0.00 178.15 178.31 1otu h THR 289 N 0.55 0.09 0.00 2.19 2.02 -1.94 -0.27 112.91 115.55 1otu h THR 289 Ca 0.55 -1.14 0.00 0.00 0.77 0.00 0.00 66.41 66.59 1otu h THR 289 Cb 0.96 1.84 0.00 0.00 -1.74 0.00 0.00 68.15 69.21 1otu h THR 289 CO -0.45 0.05 -0.01 0.29 0.37 0.00 0.00 175.52 175.77 1otu n LYS 290 N -2.93 0.16 -0.00 6.66 5.02 -0.67 -2.17 118.16 124.23 1otu n LYS 290 Ca 0.02 0.13 -0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1otu n LYS 290 Cb 0.57 -1.69 -0.00 0.00 -0.02 0.00 0.00 35.03 33.89 1otu n LYS 290 CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75 1otu n TRP 291 N -1.97 0.02 -0.42 2.13 -0.00 -0.71 -3.19 117.44 113.30 1otu n TRP 291 Ca 0.06 0.01 0.37 0.00 -0.00 0.00 0.00 57.50 57.94 1otu n TRP 291 Cb 0.40 -0.19 0.64 0.00 -0.00 0.00 0.00 31.31 32.16 1otu n TRP 291 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1otu n VAL 292 N -2.38 -0.30 0.03 5.87 0.31 -0.12 0.27 118.33 122.01 1otu n VAL 292 Ca -0.00 1.85 -0.15 0.00 -0.01 0.00 0.00 64.34 66.03 1otu n VAL 292 Cb 0.01 -3.03 -0.05 0.00 -0.91 0.00 0.00 33.84 29.86 1otu n VAL 292 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1otu h LEU 293 N 0.00 0.73 -0.74 7.52 3.38 -1.63 -2.45 115.31 122.12 1otu h LEU 293 Ca 0.86 -0.53 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1otu h LEU 293 Cb 2.63 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 43.16 1otu h LEU 293 CO -0.55 1.32 0.00 -0.03 0.09 0.00 0.00 178.44 179.26 1otu h MET 294 N 0.37 0.00 0.01 1.13 4.05 0.38 -2.97 114.93 117.90 1otu h MET 294 Ca -0.07 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1otu h MET 294 Cb 1.50 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.30 1otu h MET 294 CO 0.16 0.00 -0.00 0.78 0.23 0.00 0.00 176.91 178.08 1otu h GLY 295 N 2.99 -0.01 1.52 1.39 0.00 0.23 -2.50 103.07 106.68 1otu h GLY 295 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1otu h GLY 295 CO 0.00 -0.00 0.05 0.61 0.00 0.00 0.00 176.54 177.20 1otu n GLY 296 N 0.15 -0.33 0.12 4.60 0.00 -0.96 -0.29 105.19 108.49 1otu n GLY 296 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1otu n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1otu h ALA 297 N 1.72 -0.19 -0.15 4.61 0.00 -1.35 0.11 119.26 124.01 1otu h ALA 297 Ca 0.00 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 1otu h ALA 297 Cb 0.11 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1otu h ALA 297 CO 0.00 -0.20 -0.53 0.82 0.00 0.00 0.00 179.25 179.33 1otu h ILE 298 N -1.01 1.34 0.68 0.00 2.04 -0.85 -1.77 117.51 117.94 1otu h ILE 298 Ca -0.02 -1.79 -0.03 0.00 1.00 0.00 0.00 64.86 64.02 1otu h ILE 298 Cb 0.34 1.81 -0.00 0.00 -0.74 0.00 0.00 36.82 38.23 1otu h ILE 298 CO 0.03 0.55 -0.40 1.23 0.00 0.00 0.00 178.15 179.56 1otu h GLY 299 N 1.20 -1.16 0.34 5.37 0.00 -0.73 -0.13 103.07 107.96 1otu h GLY 299 Ca 0.01 0.47 0.15 0.00 0.00 0.00 0.00 47.33 47.95 1otu h GLY 299 CO 0.09 -0.40 0.62 -1.33 0.00 0.00 0.00 176.54 175.53 1otu h GLY 300 N -1.01 1.70 0.39 4.60 0.00 -0.20 -0.39 103.07 108.15 1otu h GLY 300 Ca -0.09 -0.40 0.07 0.00 0.00 0.00 0.00 47.33 46.91 1otu h GLY 300 CO 0.10 0.08 0.00 -2.00 0.00 0.00 0.00 176.54 174.72 1otu h LEU 301 N 0.91 -0.16 0.67 3.11 5.85 -0.88 -2.10 115.31 122.71 1otu h LEU 301 Ca 0.53 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 59.31 1otu h LEU 301 Cb 0.64 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.83 1otu h LEU 301 CO -0.31 -0.04 -0.38 0.00 -0.34 0.00 0.00 178.44 177.37 1otu h GLY 303 N -0.98 0.00 0.18 0.00 0.00 -1.00 0.36 103.07 101.63 1otu h GLY 303 Ca -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 1otu h GLY 303 CO 0.11 0.00 -0.02 -2.00 0.00 0.00 0.00 176.54 174.64 1otu h LEU 304 N 0.00 -0.04 -2.62 3.11 5.85 0.03 -3.15 115.31 118.49 1otu h LEU 304 Ca 0.59 -0.66 0.01 0.00 0.84 0.00 0.00 57.88 58.65 1otu h LEU 304 Cb 2.51 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 43.55 1otu h LEU 304 CO -0.01 0.72 0.05 -0.07 -0.34 0.00 0.00 178.44 178.79 1otu h LEU 305 N -0.87 0.00 -4.57 2.25 3.38 0.42 -2.45 115.31 113.47 1otu h LEU 305 Ca -0.00 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.51 1otu h LEU 305 Cb 0.70 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.34 1otu h LEU 305 CO 0.01 0.00 0.85 0.61 0.09 0.00 0.00 178.44 180.00 1otu n GLY 306 N -1.23 4.01 0.00 0.83 0.00 0.64 -1.42 105.19 108.02 1otu n GLY 306 Ca -0.02 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1otu n GLY 306 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1otu n PHE 307 N 1.88 0.00 -0.66 1.61 7.35 -0.92 -4.84 117.46 121.87 1otu n PHE 307 Ca 0.53 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.22 1otu n PHE 307 Cb 0.59 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.42 1otu n PHE 307 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33 1otu n VAL 308 N 0.00 0.00 0.00 -2.13 0.24 -1.13 -4.99 118.33 110.32 1otu n VAL 308 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1otu n VAL 308 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1otu n VAL 308 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1otu n ALA 309 N 0.00 0.00 -0.26 2.33 0.00 -0.51 -5.05 120.51 117.02 1otu n ALA 309 Ca 0.00 0.00 0.33 0.00 0.00 0.00 0.00 53.44 53.77 1otu n ALA 309 Cb 0.00 0.00 0.74 0.00 0.00 0.00 0.00 19.45 20.19 1otu n ALA 309 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1otu h PRO 310 N 0.00 0.00 0.00 0.00 0.11 -1.76 -1.18 132.00 129.17 1otu h PRO 310 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1otu h PRO 310 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1otu h PRO 310 CO 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.79 1otu n ALA 311 N -2.72 1.43 -0.03 -0.75 0.00 -1.26 -0.37 120.51 116.80 1otu n ALA 311 Ca 0.23 -0.02 0.04 0.00 0.00 0.00 0.00 53.44 53.69 1otu n ALA 311 Cb 1.15 -1.07 -0.15 0.00 0.00 0.00 0.00 19.45 19.39 1otu n ALA 311 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1otu n THR 312 N -1.23 0.39 -3.54 0.00 -2.24 -0.44 -4.77 114.28 102.45 1otu n THR 312 Ca 0.02 -0.56 -0.10 0.00 -2.27 0.00 0.00 64.05 61.14 1otu n THR 312 Cb 0.03 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 1otu n THR 312 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1otu n SER 313 N -2.35 1.53 -1.02 3.42 2.88 0.50 -4.50 113.62 114.07 1otu n SER 313 Ca -0.12 -1.71 0.12 0.00 -1.33 0.00 0.00 58.87 55.83 1otu n SER 313 Cb 0.70 -0.04 -0.03 0.00 -0.75 0.00 0.00 64.21 64.09 1otu n SER 313 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1otu n GLY 314 N 2.39 -1.28 0.33 0.46 0.00 -0.88 -4.19 105.19 102.03 1otu n GLY 314 Ca 0.00 -0.82 0.16 0.00 0.00 0.00 0.00 46.02 45.37 1otu n GLY 314 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1otu h GLY 315 N -0.85 1.41 0.00 -0.02 0.00 -1.81 -3.41 103.07 98.38 1otu h GLY 315 Ca 0.02 0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1otu h GLY 315 CO 0.01 -0.51 0.00 0.61 0.00 0.00 0.00 176.54 176.64 1otu n GLY 316 N -1.43 2.76 0.00 4.60 0.00 -1.26 -4.18 105.19 105.68 1otu n GLY 316 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1otu n GLY 316 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1otu n PHE 317 N -2.00 0.00 -0.48 1.61 0.99 -1.26 -2.33 117.46 114.00 1otu n PHE 317 Ca 0.00 0.00 0.36 0.00 -0.00 0.00 0.00 57.45 57.81 1otu n PHE 317 Cb 0.00 -0.42 0.56 0.00 -1.00 0.00 0.00 39.48 38.62 1otu n PHE 317 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.76 177.03 1otu n ASN 318 N -2.39 0.01 -0.45 4.37 2.04 -1.26 0.13 115.26 117.72 1otu n ASN 318 Ca 0.00 0.69 0.14 0.00 -0.44 0.00 0.00 54.58 54.97 1otu n ASN 318 Cb 0.00 -0.34 0.52 0.00 -2.53 0.00 0.00 39.78 37.42 1otu n ASN 318 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1otu n LEU 319 N -3.34 1.42 0.02 -4.53 -0.00 -0.98 -4.10 117.00 105.49 1otu n LEU 319 Ca 0.30 -0.46 -0.12 0.00 -0.00 0.00 0.00 56.01 55.72 1otu n LEU 319 Cb 1.36 -0.01 -0.09 0.00 -0.00 0.00 0.00 43.42 44.67 1otu n LEU 319 CO 0.30 0.24 0.54 0.40 -0.00 0.00 0.00 177.39 178.87 1otu h ILE 320 N 2.19 1.20 -0.22 1.47 2.04 0.10 -0.27 117.51 124.02 1otu h ILE 320 Ca 0.00 -1.18 0.04 0.00 1.00 0.00 0.00 64.86 64.72 1otu h ILE 320 Cb 0.49 1.95 -0.04 0.00 -0.74 0.00 0.00 36.82 38.48 1otu h ILE 320 CO 0.00 0.28 -0.06 -0.65 0.00 0.00 0.00 178.15 177.72 1otu h PRO 321 N -0.66 -0.01 -0.70 2.37 0.11 -1.74 0.67 132.00 132.05 1otu h PRO 321 Ca -0.01 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.16 1otu h PRO 321 Cb 0.54 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.60 1otu h PRO 321 CO 0.02 -0.01 0.39 0.82 -0.21 0.00 0.00 178.00 179.01 1otu h ILE 322 N -0.01 0.96 0.13 4.15 2.04 -1.72 -1.95 117.51 121.12 1otu h ILE 322 Ca 0.11 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1otu h ILE 322 Cb 0.17 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 1otu h ILE 322 CO -0.23 0.13 -0.06 0.00 0.00 0.00 0.00 178.15 177.99 1otu h ALA 323 N 1.36 -0.18 -0.83 1.87 0.00 -0.20 -2.99 119.26 118.29 1otu h ALA 323 Ca 0.32 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.22 1otu h ALA 323 Cb 0.21 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1otu h ALA 323 CO -0.19 -0.52 0.54 1.15 0.00 0.00 0.00 179.25 180.23 1otu h THR 324 N -0.33 0.94 -0.45 0.00 2.02 -0.62 -2.01 112.91 112.47 1otu h THR 324 Ca -0.02 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 1otu h THR 324 Cb 0.27 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.76 1otu h THR 324 CO 0.03 0.14 0.24 0.00 0.37 0.00 0.00 175.52 176.30 1otu h ALA 325 N 1.59 0.58 0.00 6.16 0.00 -1.29 -3.24 119.26 123.06 1otu h ALA 325 Ca 0.39 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1otu h ALA 325 Cb 0.46 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1otu h ALA 325 CO -0.16 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.61 1otu n GLY 326 N -0.99 1.77 0.21 0.00 0.00 -0.75 -4.81 105.19 100.61 1otu n GLY 326 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1otu n GLY 326 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1otu h ASN 327 N 0.00 0.00 -3.17 1.61 -0.26 -1.73 -3.44 115.58 108.59 1otu h ASN 327 Ca 0.00 0.00 -0.58 0.00 -0.56 0.00 0.00 56.30 55.16 1otu h ASN 327 Cb 0.00 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.21 1otu h ASN 327 CO 0.00 0.05 -0.11 -0.36 -1.06 0.00 0.00 177.43 175.96 1otu s PHE 328 N -3.18 3.74 0.49 1.19 0.08 -1.26 -5.07 117.98 113.97 1otu s PHE 328 Ca 0.07 1.13 -0.09 0.00 0.12 0.00 0.00 56.93 58.16 1otu s PHE 328 Cb 0.05 -2.40 -0.05 0.00 -0.57 0.00 0.00 43.02 40.06 1otu s PHE 328 CO 0.68 0.58 0.84 -1.54 -0.10 0.00 0.00 175.22 175.68 1otu s SER 329 N -1.22 6.35 0.49 1.36 1.04 -1.26 -4.82 113.70 115.63 1otu s SER 329 Ca 0.29 1.12 0.30 0.00 0.48 0.00 0.00 55.95 58.14 1otu s SER 329 Cb -0.18 -2.33 1.39 0.00 0.10 0.00 0.00 66.02 65.01 1otu s SER 329 CO 0.17 -0.58 1.78 -0.03 0.98 0.00 0.00 173.24 175.56 1otu h MET 330 N 0.46 0.14 0.16 4.02 4.05 -1.97 0.11 114.93 121.90 1otu h MET 330 Ca -0.46 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 58.94 1otu h MET 330 Cb 1.20 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.97 1otu h MET 330 CO 0.62 0.09 -0.08 0.78 0.23 0.00 0.00 176.91 178.56 1otu h GLY 331 N 0.14 -0.22 0.18 1.39 0.00 -2.01 -2.98 103.07 99.57 1otu h GLY 331 Ca 0.60 0.08 0.23 0.00 0.00 0.00 0.00 47.33 48.24 1otu h GLY 331 CO -0.14 -0.08 0.69 1.98 0.00 0.00 0.00 176.54 178.99 1otu h MET 332 N -0.29 0.00 0.09 4.80 -1.53 -1.57 -2.02 114.93 114.41 1otu h MET 332 Ca -0.02 0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.23 1otu h MET 332 Cb 0.16 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.21 1otu h MET 332 CO 0.04 0.00 -0.04 -0.07 0.14 0.00 0.00 176.91 176.97 1otu h LEU 333 N 0.00 -0.10 -0.88 3.39 3.38 -0.84 -1.65 115.31 118.60 1otu h LEU 333 Ca 0.38 0.00 0.24 0.00 0.09 0.00 0.00 57.88 58.59 1otu h LEU 333 Cb 1.75 0.03 -0.15 0.00 0.09 0.00 0.00 40.66 42.38 1otu h LEU 333 CO -0.00 -0.06 0.16 0.58 0.09 0.00 0.00 178.44 179.21 1otu h VAL 334 N -0.16 0.25 0.22 1.22 2.07 -1.28 0.52 116.25 119.09 1otu h VAL 334 Ca -0.01 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1otu h VAL 334 Cb 0.09 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.94 1otu h VAL 334 CO 0.02 0.03 -0.22 0.15 0.02 0.00 0.00 177.57 177.57 1otu h PHE 335 N 0.14 -0.57 -0.61 1.57 3.04 -1.43 -1.76 116.94 117.32 1otu h PHE 335 Ca 0.54 0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.53 1otu h PHE 335 Cb 1.10 0.22 -0.03 0.00 2.56 0.00 0.00 35.95 39.79 1otu h PHE 335 CO -0.34 -0.32 0.40 0.82 -2.02 0.00 0.00 178.31 176.86 1otu h ILE 336 N -0.47 1.08 0.00 1.41 2.04 0.74 0.22 117.51 122.53 1otu h ILE 336 Ca -0.00 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1otu h ILE 336 Cb 0.44 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1otu h ILE 336 CO -0.05 0.13 0.00 0.33 0.00 0.00 0.00 178.15 178.56 1otu n PHE 337 N -4.46 0.00 -0.34 1.37 7.35 0.14 -2.10 117.46 119.42 1otu n PHE 337 Ca 0.07 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.70 1otu n PHE 337 Cb 0.14 -0.31 -0.03 0.00 0.35 0.00 0.00 39.48 39.63 1otu n PHE 337 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1otu h VAL 338 N 0.00 0.03 -0.84 -2.13 2.07 -1.21 0.66 116.25 114.82 1otu h VAL 338 Ca 0.00 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.73 1otu h VAL 338 Cb 0.00 0.03 -0.13 0.00 -1.52 0.00 0.00 31.29 29.67 1otu h VAL 338 CO 0.00 0.00 0.23 0.00 0.02 0.00 0.00 177.57 177.82 1otu h ALA 339 N 0.87 1.19 -0.00 1.67 0.00 -1.02 0.60 119.26 122.57 1otu h ALA 339 Ca 0.24 0.20 -0.23 0.00 0.00 0.00 0.00 54.91 55.12 1otu h ALA 339 Cb 0.53 0.28 0.02 0.00 0.00 0.00 0.00 17.79 18.62 1otu h ALA 339 CO -0.88 -0.41 -0.90 0.00 0.00 0.00 0.00 179.25 177.06 1otu h ARG 340 N 0.24 0.61 -0.53 0.00 3.08 -0.24 -0.10 114.38 117.45 1otu h ARG 340 Ca 0.51 -0.65 0.15 0.00 0.07 0.00 0.00 59.98 60.06 1otu h ARG 340 Cb 0.99 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.20 1otu h ARG 340 CO -0.61 1.26 0.61 0.28 -1.07 0.00 0.00 179.97 180.44 1otu h VAL 341 N 0.23 0.27 0.00 2.04 2.07 0.23 0.23 116.25 121.32 1otu h VAL 341 Ca -0.11 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1otu h VAL 341 Cb 1.57 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1otu h VAL 341 CO 0.18 0.00 -0.56 -0.38 0.02 0.00 0.00 177.57 176.83 1otu n ILE 342 N -3.56 1.21 -0.29 4.57 5.41 -0.13 -3.84 119.36 122.73 1otu n ILE 342 Ca 0.10 0.24 0.25 0.00 1.00 0.00 0.00 62.75 64.35 1otu n ILE 342 Cb 0.81 -2.24 0.59 0.00 -0.71 0.00 0.00 39.64 38.09 1otu n ILE 342 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1otu h THR 343 N -0.84 0.53 0.60 1.39 1.35 -0.64 -0.83 112.91 114.47 1otu h THR 343 Ca 0.00 -0.09 -0.03 0.00 -0.55 0.00 0.00 66.41 65.74 1otu h THR 343 Cb 0.56 0.24 0.01 0.00 -1.73 0.00 0.00 68.15 67.22 1otu h THR 343 CO 0.00 0.05 -0.29 0.74 -0.25 0.00 0.00 175.52 175.77 1otu h THR 344 N 0.27 0.00 -0.03 6.82 2.02 -0.76 -1.90 112.91 119.33 1otu h THR 344 Ca 0.55 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.59 1otu h THR 344 Cb 1.63 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1otu h THR 344 CO -0.18 0.00 -0.07 -0.07 0.37 0.00 0.00 175.52 175.57 1otu h LEU 345 N -0.95 -0.22 -0.82 2.58 3.38 -1.43 0.54 115.31 118.39 1otu h LEU 345 Ca -0.08 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.02 1otu h LEU 345 Cb 0.62 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1otu h LEU 345 CO 0.14 -0.06 0.91 0.25 0.09 0.00 0.00 178.44 179.76 1otu h LEU 346 N -0.07 0.00 0.02 1.67 5.85 -1.28 0.21 115.31 121.70 1otu h LEU 346 Ca 0.01 0.00 -0.39 0.00 0.84 0.00 0.00 57.88 58.33 1otu h LEU 346 Cb 0.08 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.05 1otu h LEU 346 CO -0.06 0.00 -2.40 0.00 -0.34 0.00 0.00 178.44 175.64 1otu h PHE 348 N -0.14 -0.10 0.00 0.00 3.57 0.21 -3.28 116.94 117.20 1otu h PHE 348 Ca -0.57 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 60.93 1otu h PHE 348 Cb 1.87 0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.64 1otu h PHE 348 CO 0.02 0.05 0.57 0.77 -2.23 0.00 0.00 178.31 177.50 1otu h SER 349 N -1.02 0.00 -0.12 0.41 0.02 -0.83 0.14 113.55 112.16 1otu h SER 349 Ca -0.01 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1otu h SER 349 Cb 0.19 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1otu h SER 349 CO 0.02 0.00 0.02 -1.54 -1.14 0.00 0.00 176.83 174.19 1otu n SER 350 N -2.66 2.06 -1.58 3.07 3.41 -1.24 -4.29 113.62 112.40 1otu n SER 350 Ca -0.01 -2.19 -0.11 0.00 -0.26 0.00 0.00 58.87 56.30 1otu n SER 350 Cb 0.60 -0.54 -0.04 0.00 -0.26 0.00 0.00 64.21 63.97 1otu n SER 350 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1otu n GLY 351 N 0.13 0.70 3.79 5.00 0.00 0.50 -4.92 105.19 110.38 1otu n GLY 351 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 1otu n GLY 351 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1otu s ALA 352 N -2.08 3.06 -0.41 4.61 0.00 -1.25 -3.13 121.76 122.56 1otu s ALA 352 Ca 0.00 0.67 -0.28 0.00 0.00 0.00 0.00 51.96 52.35 1otu s ALA 352 Cb 0.00 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.84 1otu s ALA 352 CO 0.00 -0.20 1.85 -1.25 0.00 0.00 0.00 175.76 176.16 1otu s PRO 353 N -2.61 3.10 0.00 0.00 0.04 -1.26 -1.57 135.00 132.69 1otu s PRO 353 Ca 0.59 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.86 1otu s PRO 353 Cb -0.21 -4.27 0.00 0.00 0.04 0.00 0.00 34.50 30.07 1otu s PRO 353 CO 0.26 -2.15 0.00 0.41 0.04 0.00 0.00 177.00 175.56 1otu n GLY 354 N 5.52 2.27 3.97 0.56 0.00 -1.11 -4.37 105.19 112.04 1otu n GLY 354 Ca 0.23 -0.56 -0.23 0.00 0.00 0.00 0.00 46.02 45.46 1otu n GLY 354 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1otu s GLY 355 N 0.00 2.05 -0.05 -0.02 0.00 -1.20 -2.82 107.32 105.27 1otu s GLY 355 Ca 0.00 -1.70 0.08 0.00 0.00 0.00 0.00 44.72 43.09 1otu s GLY 355 CO 0.00 -1.82 1.04 4.51 0.00 0.00 0.00 173.10 176.83 1otu n ILE 356 N -2.01 1.27 0.21 0.90 3.06 -1.26 0.04 119.36 121.57 1otu n ILE 356 Ca 0.07 -1.43 -0.09 0.00 -2.50 0.00 0.00 62.75 58.81 1otu n ILE 356 Cb 0.63 0.22 -0.04 0.00 0.54 0.00 0.00 39.64 40.99 1otu n ILE 356 CO 0.00 0.00 0.00 0.15 -2.50 0.00 0.00 176.55 174.20 1otu h PHE 357 N 0.00 -0.54 0.35 9.51 3.57 -1.95 -2.86 116.94 125.02 1otu h PHE 357 Ca 0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 1otu h PHE 357 Cb 0.77 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.67 1otu h PHE 357 CO 0.00 -0.34 -0.33 0.00 -2.23 0.00 0.00 178.31 175.42 1otu h ALA 358 N -1.35 -1.03 -0.18 2.41 0.00 -1.94 -2.43 119.26 114.73 1otu h ALA 358 Ca -0.06 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1otu h ALA 358 Cb 0.45 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1otu h ALA 358 CO 0.10 -1.04 0.53 -1.00 0.00 0.00 0.00 179.25 177.83 1otu h PRO 359 N -0.67 0.00 -0.15 0.00 0.13 -1.73 0.38 132.00 129.97 1otu h PRO 359 Ca -0.04 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.97 1otu h PRO 359 Cb 0.57 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 1otu h PRO 359 CO -0.03 0.00 -0.41 0.52 -0.23 0.00 0.00 178.00 177.85 1otu h MET 360 N 0.00 0.33 0.12 0.86 2.86 -1.19 -2.66 114.93 115.26 1otu h MET 360 Ca 0.09 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1otu h MET 360 Cb 1.14 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.80 1otu h MET 360 CO -0.00 0.69 -0.06 -0.07 1.06 0.00 0.00 176.91 178.54 1otu h LEU 361 N 0.28 -0.13 -0.32 1.22 3.38 -0.23 -0.08 115.31 119.43 1otu h LEU 361 Ca 0.02 -0.10 0.07 0.00 0.09 0.00 0.00 57.88 57.96 1otu h LEU 361 Cb 0.85 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.55 1otu h LEU 361 CO 0.07 0.02 -0.38 0.00 0.09 0.00 0.00 178.44 178.24 1otu h ALA 362 N 0.58 -0.36 -0.63 1.53 0.00 -1.47 0.52 119.26 119.42 1otu h ALA 362 Ca -0.02 0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.04 1otu h ALA 362 Cb 0.23 0.77 -0.07 0.00 0.00 0.00 0.00 17.79 18.72 1otu h ALA 362 CO 0.03 -0.82 0.28 -0.07 0.00 0.00 0.00 179.25 178.67 1otu h LEU 363 N -0.34 0.33 0.21 0.00 3.38 -1.21 0.11 115.31 117.79 1otu h LEU 363 Ca 0.13 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.18 1otu h LEU 363 Cb 0.57 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1otu h LEU 363 CO -0.50 0.20 -0.34 1.23 0.09 0.00 0.00 178.44 179.11 1otu h GLY 364 N 0.49 -0.72 0.02 0.83 0.00 0.11 0.28 103.07 104.09 1otu h GLY 364 Ca 0.31 0.40 0.02 0.00 0.00 0.00 0.00 47.33 48.06 1otu h GLY 364 CO -0.27 -0.27 -0.48 -0.84 0.00 0.00 0.00 176.54 174.68 1otu h THR 365 N -0.63 0.00 -0.71 4.70 2.02 0.82 0.25 112.91 119.37 1otu h THR 365 Ca 0.01 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.30 1otu h THR 365 Cb 0.62 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.94 1otu h THR 365 CO -0.15 0.00 0.31 0.58 0.37 0.00 0.00 175.52 176.63 1otu h VAL 366 N -0.62 0.75 -0.44 3.16 2.07 -0.60 0.62 116.25 121.19 1otu h VAL 366 Ca 0.01 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 1otu h VAL 366 Cb 0.65 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1otu h VAL 366 CO -0.31 0.09 0.04 0.25 0.02 0.00 0.00 177.57 177.66 1otu h LEU 367 N 0.49 0.73 0.18 2.57 5.85 0.18 -3.00 115.31 122.31 1otu h LEU 367 Ca 0.37 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1otu h LEU 367 Cb 0.49 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1otu h LEU 367 CO -0.34 0.83 -0.15 1.23 -0.34 0.00 0.00 178.44 179.68 1otu h GLY 368 N 0.60 -0.33 -0.34 3.75 0.00 0.64 -2.59 103.07 104.81 1otu h GLY 368 Ca 0.13 0.16 0.04 0.00 0.00 0.00 0.00 47.33 47.66 1otu h GLY 368 CO 0.02 -0.15 -0.32 -0.84 0.00 0.00 0.00 176.54 175.24 1otu h THR 369 N -0.34 0.00 -0.84 4.70 2.02 -0.92 -0.01 112.91 117.52 1otu h THR 369 Ca -0.01 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.33 1otu h THR 369 Cb 0.31 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.56 1otu h THR 369 CO -0.01 0.00 -0.26 0.00 0.37 0.00 0.00 175.52 175.62 1otu h ALA 370 N -0.44 0.42 -0.88 6.16 0.00 -1.45 1.83 119.26 124.90 1otu h ALA 370 Ca 0.06 0.30 0.15 0.00 0.00 0.00 0.00 54.91 55.42 1otu h ALA 370 Cb 0.31 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.75 1otu h ALA 370 CO -0.40 -0.47 0.57 0.35 0.00 0.00 0.00 179.25 179.29 1otu h PHE 371 N -0.02 0.77 0.06 0.00 3.57 -0.72 -1.65 116.94 118.95 1otu h PHE 371 Ca 0.38 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.90 1otu h PHE 371 Cb 0.61 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.11 1otu h PHE 371 CO -0.70 0.28 -0.03 0.78 -2.23 0.00 0.00 178.31 176.41 1otu h GLY 372 N 0.65 -0.12 -0.96 2.40 0.00 0.46 -1.50 103.07 103.99 1otu h GLY 372 Ca 0.44 0.05 0.31 0.00 0.00 0.00 0.00 47.33 48.13 1otu h GLY 372 CO -0.20 -0.05 0.18 1.03 0.00 0.00 0.00 176.54 177.51 1otu n MET 373 N -2.25 -0.07 0.10 4.80 2.81 -0.62 0.22 117.12 122.11 1otu n MET 373 Ca -0.01 1.41 -0.13 0.00 -1.81 0.00 0.00 57.70 57.16 1otu n MET 373 Cb 0.03 -2.33 -0.07 0.00 -0.71 0.00 0.00 33.22 30.14 1otu n MET 373 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1otu h VAL 374 N 0.00 0.88 0.15 2.03 2.07 -1.24 -2.87 116.25 117.27 1otu h VAL 374 Ca 0.66 0.00 0.02 0.00 0.82 0.00 0.00 66.70 68.20 1otu h VAL 374 Cb 1.52 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 1otu h VAL 374 CO -0.85 0.00 -0.33 0.00 0.02 0.00 0.00 177.57 176.40 1otu h ALA 375 N 0.73 -0.60 -0.66 1.67 0.00 0.37 0.26 119.26 121.04 1otu h ALA 375 Ca -0.01 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.89 1otu h ALA 375 Cb 0.12 0.54 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 1otu h ALA 375 CO 0.02 -0.89 -0.39 0.28 0.00 0.00 0.00 179.25 178.28 1otu n VAL 376 N -5.43 -0.45 -0.05 0.00 0.31 0.98 -0.71 118.33 112.98 1otu n VAL 376 Ca -0.07 2.01 -0.05 0.00 -0.01 0.00 0.00 64.34 66.22 1otu n VAL 376 Cb 0.34 -2.52 0.16 0.00 -0.91 0.00 0.00 33.84 30.91 1otu n VAL 376 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1otu h GLU 377 N 0.00 0.66 -0.48 5.55 4.11 -1.40 -3.10 114.58 119.93 1otu h GLU 377 Ca 0.11 -0.22 0.08 0.00 0.07 0.00 0.00 59.36 59.39 1otu h GLU 377 Cb 0.27 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.40 1otu h GLU 377 CO -0.62 0.78 0.11 -0.07 0.07 0.00 0.00 179.01 179.28 1otu h LEU 378 N 0.60 0.03 -7.17 3.06 3.38 0.13 -3.37 115.31 111.97 1otu h LEU 378 Ca 0.10 0.08 -0.53 0.00 0.09 0.00 0.00 57.88 57.62 1otu h LEU 378 Cb 0.60 0.10 -0.40 0.00 0.09 0.00 0.00 40.66 41.05 1otu h LEU 378 CO 0.04 0.05 -0.76 -0.36 0.09 0.00 0.00 178.44 177.49 1otu s PHE 379 N -6.14 1.00 -1.08 1.13 0.40 -0.32 -4.97 117.98 108.00 1otu s PHE 379 Ca -0.13 -0.99 0.27 0.00 -0.60 0.00 0.00 56.93 55.48 1otu s PHE 379 Cb 0.15 -1.12 0.84 0.00 0.51 0.00 0.00 43.02 43.40 1otu s PHE 379 CO 0.72 -0.68 1.64 -0.35 0.70 0.00 0.00 175.22 177.25 1otu n PRO 380 N 5.05 0.08 0.00 0.24 -0.04 -1.18 -3.58 135.00 135.57 1otu n PRO 380 Ca -0.07 -0.03 0.15 0.00 -0.04 0.00 0.00 63.50 63.51 1otu n PRO 380 Cb 0.46 -1.50 0.80 0.00 -0.04 0.00 0.00 33.50 33.21 1otu n PRO 380 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1otu n GLN 381 N -1.43 0.67 0.00 0.54 0.00 -1.26 -2.29 117.38 113.60 1otu n GLN 381 Ca 0.07 -0.05 0.12 0.00 0.00 0.00 0.00 57.00 57.14 1otu n GLN 381 Cb 0.33 -1.50 0.22 0.00 0.00 0.00 0.00 30.24 29.29 1otu n GLN 381 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1otu n TYR 382 N -1.13 0.00 -4.14 2.61 0.53 -1.24 -4.96 117.16 108.85 1otu n TYR 382 Ca 0.17 0.00 -0.29 0.00 -1.02 0.00 0.00 57.90 56.77 1otu n TYR 382 Cb 0.21 -0.04 -0.06 0.00 -1.03 0.00 0.00 39.34 38.42 1otu n TYR 382 CO 0.00 0.00 0.00 0.72 -1.02 0.00 0.00 176.86 176.56 1otu n HIS 383 N -0.00 -1.45 -1.39 -0.72 8.25 -0.97 -4.92 115.22 114.02 1otu n HIS 383 Ca 0.12 0.66 -0.29 0.00 -0.26 0.00 0.00 57.72 57.96 1otu n HIS 383 Cb 0.43 -3.25 0.16 0.00 1.12 0.00 0.00 29.99 28.45 1otu n HIS 383 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1otu s LEU 384 N -7.18 1.78 -0.28 2.41 1.43 -1.26 -5.05 118.68 110.53 1otu s LEU 384 Ca 0.01 0.98 -0.02 0.00 -1.03 0.00 0.00 54.13 54.08 1otu s LEU 384 Cb -0.01 -3.20 0.12 0.00 0.03 0.00 0.00 46.19 43.13 1otu s LEU 384 CO 0.95 -2.88 0.24 -0.70 0.23 0.00 0.00 176.35 174.19 1otu s GLU 385 N -5.20 0.28 0.23 1.70 2.12 -1.26 -4.96 118.70 111.61 1otu s GLU 385 Ca 0.65 -0.22 0.13 0.00 0.36 0.00 0.00 54.97 55.90 1otu s GLU 385 Cb -0.15 -0.84 0.86 0.00 0.26 0.00 0.00 34.13 34.25 1otu s GLU 385 CO 0.55 -0.99 1.00 0.00 -0.54 0.00 0.00 175.26 175.27 1otu n ALA 386 N 5.30 0.66 -0.32 6.30 0.00 -1.26 -0.34 120.51 130.84 1otu n ALA 386 Ca -0.03 0.64 0.23 0.00 0.00 0.00 0.00 53.44 54.28 1otu n ALA 386 Cb 0.45 -0.65 0.45 0.00 0.00 0.00 0.00 19.45 19.70 1otu n ALA 386 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1otu h GLY 387 N 0.00 1.90 0.91 0.00 0.00 -1.87 0.13 103.07 104.15 1otu h GLY 387 Ca 0.54 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.71 1otu h GLY 387 CO -0.48 -0.53 0.10 -0.91 0.00 0.00 0.00 176.54 174.71 1otu h THR 388 N 0.21 1.16 -0.28 4.70 1.35 -1.01 -2.29 112.91 116.74 1otu h THR 388 Ca 0.71 -0.47 -0.03 0.00 -0.55 0.00 0.00 66.41 66.07 1otu h THR 388 Cb 1.64 1.03 -0.02 0.00 -1.73 0.00 0.00 68.15 69.08 1otu h THR 388 CO -0.68 0.16 0.02 -0.26 -0.25 0.00 0.00 175.52 174.52 1otu h PHE 389 N 0.24 0.42 0.00 4.73 -1.00 -0.98 0.23 116.94 120.58 1otu h PHE 389 Ca 0.08 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.83 1otu h PHE 389 Cb 0.15 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 39.59 1otu h PHE 389 CO -0.01 0.41 0.00 0.00 -1.61 0.00 0.00 178.31 177.10 1otu n ALA 390 N -2.48 1.72 -0.04 2.45 0.00 -0.10 -2.66 120.51 119.40 1otu n ALA 390 Ca 0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 53.44 53.35 1otu n ALA 390 Cb 0.20 -1.18 -0.05 0.00 0.00 0.00 0.00 19.45 18.42 1otu n ALA 390 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1otu n ILE 391 N -1.23 0.49 0.30 0.00 5.41 0.67 -3.60 119.36 121.40 1otu n ILE 391 Ca 0.06 -0.27 0.19 0.00 1.00 0.00 0.00 62.75 63.73 1otu n ILE 391 Cb 0.08 -0.81 0.92 0.00 -0.71 0.00 0.00 39.64 39.11 1otu n ILE 391 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1otu h ALA 392 N 0.24 1.00 -0.09 -1.39 0.00 -1.00 -2.19 119.26 115.83 1otu h ALA 392 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1otu h ALA 392 Cb 1.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1otu h ALA 392 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1otu n GLY 393 N -0.70 0.54 0.29 0.00 0.00 -1.09 -4.37 105.19 99.86 1otu n GLY 393 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1otu n GLY 393 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1otu h MET 394 N 1.45 0.58 -0.17 1.61 -1.53 -1.45 -3.01 114.93 112.41 1otu h MET 394 Ca 0.00 -0.10 0.00 0.00 -3.44 0.00 0.00 59.70 56.16 1otu h MET 394 Cb 0.44 -0.10 0.00 0.00 -0.55 0.00 0.00 31.60 31.39 1otu h MET 394 CO 0.00 0.54 0.00 0.41 0.14 0.00 0.00 176.91 178.00 1otu n GLY 395 N -1.02 3.02 0.21 1.39 0.00 -1.26 -4.21 105.19 103.32 1otu n GLY 395 Ca 0.02 -0.27 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 1otu n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1otu h ALA 396 N 1.01 0.75 0.00 4.61 0.00 -1.73 -1.78 119.26 122.12 1otu h ALA 396 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1otu h ALA 396 Cb 0.67 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1otu h ALA 396 CO 0.01 0.68 0.00 -0.11 0.00 0.00 0.00 179.25 179.83 1otu n LEU 397 N -3.97 0.79 -0.01 0.00 -0.00 -1.26 -0.04 117.00 112.51 1otu n LEU 397 Ca -0.03 -0.40 -0.02 0.00 -0.00 0.00 0.00 56.01 55.57 1otu n LEU 397 Cb 0.58 -0.40 -0.02 0.00 -0.00 0.00 0.00 43.42 43.59 1otu n LEU 397 CO 0.46 0.20 -0.60 0.18 -0.00 0.00 0.00 177.39 177.63 1otu n LEU 398 N 0.09 1.11 -1.45 -1.96 4.77 -0.71 -3.95 117.00 114.91 1otu n LEU 398 Ca 0.00 -0.01 -0.08 0.00 -0.03 0.00 0.00 56.01 55.89 1otu n LEU 398 Cb 0.20 -0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.33 1otu n LEU 398 CO 0.00 0.25 0.82 0.00 -1.33 0.00 0.00 177.39 177.13 1otu n ALA 399 N -2.28 3.69 0.00 -1.18 0.00 0.94 0.39 120.51 122.06 1otu n ALA 399 Ca -0.05 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.48 1otu n ALA 399 Cb 0.58 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1otu n ALA 399 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1otu n ALA 400 N 0.16 0.55 -0.05 0.00 0.00 -1.16 -1.11 120.51 118.90 1otu n ALA 400 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.62 1otu n ALA 400 Cb 0.79 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.24 1otu n ALA 400 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1otu h SER 401 N 0.00 0.00 0.17 0.00 0.02 -1.68 -3.38 113.55 108.68 1otu h SER 401 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1otu h SER 401 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1otu h SER 401 CO 0.00 0.49 -0.18 0.00 -1.14 0.00 0.00 176.83 176.00 1otu n ILE 402 N -4.52 0.00 -4.27 3.27 3.06 -0.99 -0.84 119.36 115.06 1otu n ILE 402 Ca -0.01 -0.16 -0.33 0.00 -2.50 0.00 0.00 62.75 59.76 1otu n ILE 402 Cb 0.03 0.39 -0.08 0.00 0.54 0.00 0.00 39.64 40.53 1otu n ILE 402 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1otu n ARG 403 N -0.44 -0.98 -2.78 9.51 1.74 0.16 -4.66 116.66 119.20 1otu n ARG 403 Ca 0.14 0.10 -0.21 0.00 -0.77 0.00 0.00 57.85 57.12 1otu n ARG 403 Cb 0.34 -3.51 -0.01 0.00 -1.02 0.00 0.00 32.46 28.27 1otu n ARG 403 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1otu n ALA 404 N -4.64 3.93 -0.10 7.54 0.00 -1.07 -4.94 120.51 121.23 1otu n ALA 404 Ca -0.30 -3.93 -0.03 0.00 0.00 0.00 0.00 53.44 49.18 1otu n ALA 404 Cb 0.68 -0.77 -0.02 0.00 0.00 0.00 0.00 19.45 19.34 1otu n ALA 404 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1otu n PRO 405 N -0.16 -0.10 -0.33 0.00 -0.02 -1.26 -0.98 135.00 132.14 1otu n PRO 405 Ca 0.27 1.10 0.20 0.00 -2.02 0.00 0.00 63.50 63.05 1otu n PRO 405 Cb 0.63 -1.64 0.41 0.00 -0.02 0.00 0.00 33.50 32.88 1otu n PRO 405 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1otu h LEU 406 N 0.00 0.44 -0.74 2.45 5.85 -1.96 0.63 115.31 121.99 1otu h LEU 406 Ca 0.04 0.18 -0.12 0.00 0.84 0.00 0.00 57.88 58.81 1otu h LEU 406 Cb 0.10 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1otu h LEU 406 CO -0.22 -0.08 -0.38 0.74 -0.34 0.00 0.00 178.44 178.15 1otu h THR 407 N 0.36 1.30 0.00 1.05 2.02 -1.34 -2.80 112.91 113.50 1otu h THR 407 Ca 0.67 -1.53 0.00 0.00 0.77 0.00 0.00 66.41 66.33 1otu h THR 407 Cb 1.45 1.54 0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1otu h THR 407 CO -0.59 0.48 0.00 0.61 0.37 0.00 0.00 175.52 176.39 1otu n GLY 408 N -0.08 -1.03 0.09 2.16 0.00 0.20 -0.76 105.19 105.76 1otu n GLY 408 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.00 1otu n GLY 408 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1otu n ILE 409 N -1.39 -0.13 0.04 -0.61 2.08 0.19 0.32 119.36 119.87 1otu n ILE 409 Ca 0.00 0.57 -0.07 0.00 0.56 0.00 0.00 62.75 63.80 1otu n ILE 409 Cb 0.00 -0.75 0.09 0.00 -0.75 0.00 0.00 39.64 38.23 1otu n ILE 409 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 1otu h ILE 410 N 0.00 1.34 -0.72 1.39 2.04 -1.56 -2.20 117.51 117.80 1otu h ILE 410 Ca 0.08 -1.85 -0.07 0.00 1.00 0.00 0.00 64.86 64.02 1otu h ILE 410 Cb 0.15 1.86 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 1otu h ILE 410 CO -0.24 0.56 0.18 0.25 0.00 0.00 0.00 178.15 178.91 1otu h LEU 411 N 0.32 1.09 0.07 1.44 5.85 0.73 0.33 115.31 125.13 1otu h LEU 411 Ca 0.00 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 1otu h LEU 411 Cb 1.09 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1otu h LEU 411 CO 0.10 1.04 -0.04 0.58 -0.34 0.00 0.00 178.44 179.78 1otu h VAL 412 N 1.09 0.00 -0.77 1.05 2.07 -0.89 -2.75 116.25 116.04 1otu h VAL 412 Ca 0.23 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.88 1otu h VAL 412 Cb 0.37 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.00 1otu h VAL 412 CO 0.00 0.00 -0.36 0.25 0.02 0.00 0.00 177.57 177.48 1otu h LEU 413 N -0.10 -1.28 -1.29 2.57 6.46 -1.38 0.51 115.31 120.81 1otu h LEU 413 Ca -0.01 0.26 0.44 0.00 -0.12 0.00 0.00 57.88 58.46 1otu h LEU 413 Cb 0.08 0.66 -0.12 0.00 -0.73 0.00 0.00 40.66 40.54 1otu h LEU 413 CO 0.01 -0.30 0.83 -0.62 -0.62 0.00 0.00 178.44 177.75 1otu n GLU 414 N -5.45 -0.03 -0.21 1.25 -0.58 0.11 -1.79 120.64 113.94 1otu n GLU 414 Ca 0.07 1.13 0.04 0.00 -0.42 0.00 0.00 57.16 57.98 1otu n GLU 414 Cb 0.38 -2.25 0.05 0.00 -0.57 0.00 0.00 31.44 29.05 1otu n GLU 414 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1otu n MET 415 N -4.48 0.84 0.00 3.49 0.00 0.14 -4.72 117.12 112.39 1otu n MET 415 Ca 0.37 -1.56 0.00 0.00 0.00 0.00 0.00 57.70 56.51 1otu n MET 415 Cb 1.45 -0.92 0.00 0.00 0.00 0.00 0.00 33.22 33.75 1otu n MET 415 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1otu n THR 416 N -0.58 0.00 -2.70 3.17 -2.24 0.66 -4.65 114.28 107.94 1otu n THR 416 Ca 0.06 -0.15 -0.14 0.00 -2.27 0.00 0.00 64.05 61.55 1otu n THR 416 Cb 0.59 0.63 -0.00 0.00 -2.10 0.00 0.00 70.33 69.45 1otu n THR 416 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1otu n ASP 417 N -1.22 -3.53 -2.76 3.42 4.64 -0.74 -4.69 116.55 111.66 1otu n ASP 417 Ca 0.00 0.07 -0.31 0.00 -1.38 0.00 0.00 54.79 53.17 1otu n ASP 417 Cb 0.00 -3.00 0.01 0.00 -1.04 0.00 0.00 41.12 37.09 1otu n ASP 417 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 1otu n ASN 418 N -1.91 5.61 -0.04 1.67 5.03 -1.26 -4.84 115.26 119.52 1otu n ASN 418 Ca -0.09 -3.74 0.22 0.00 0.87 0.00 0.00 54.58 51.84 1otu n ASN 418 Cb 0.58 -0.69 0.49 0.00 -1.02 0.00 0.00 39.78 39.14 1otu n ASN 418 CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.26 175.65 1otu h TYR 419 N 2.89 0.00 0.00 3.10 3.20 -1.92 0.79 116.97 125.02 1otu h TYR 419 Ca 0.36 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.23 1otu h TYR 419 Cb 0.57 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.84 1otu h TYR 419 CO 0.96 0.00 0.05 -0.56 -1.64 0.00 0.00 178.16 176.96 1otu h GLN 420 N 0.00 0.00 -0.56 1.82 -0.00 -1.94 0.12 115.11 114.55 1otu h GLN 420 Ca 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.98 1otu h GLN 420 Cb 2.23 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.71 1otu h GLN 420 CO -0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.11 1otu n LEU 421 N -2.57 3.66 -0.21 0.06 4.77 0.27 -4.57 117.00 118.42 1otu n LEU 421 Ca -0.02 -1.79 -0.01 0.00 -0.03 0.00 0.00 56.01 54.16 1otu n LEU 421 Cb 0.09 -0.37 0.10 0.00 -2.33 0.00 0.00 43.42 40.92 1otu n LEU 421 CO 0.13 0.87 1.04 -0.29 -1.33 0.00 0.00 177.39 177.81 1otu h ILE 422 N 4.16 0.87 -0.21 -0.08 6.09 -0.89 0.21 117.51 127.65 1otu h ILE 422 Ca 0.00 -0.19 0.03 0.00 -1.37 0.00 0.00 64.86 63.34 1otu h ILE 422 Cb 0.96 0.28 -0.03 0.00 0.47 0.00 0.00 36.82 38.50 1otu h ILE 422 CO 0.00 0.10 0.01 0.25 -3.07 0.00 0.00 178.15 175.44 1otu h LEU 423 N 0.54 -0.06 0.14 2.19 5.85 -1.80 -2.34 115.31 119.83 1otu h LEU 423 Ca 0.30 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.06 1otu h LEU 423 Cb 0.29 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1otu h LEU 423 CO -0.24 -0.00 -0.07 -0.65 -0.34 0.00 0.00 178.44 177.14 1otu h PRO 424 N 0.08 -0.18 -1.12 5.25 0.11 -1.69 -2.46 132.00 131.98 1otu h PRO 424 Ca 0.10 0.01 0.31 0.00 0.11 0.00 0.00 66.00 66.53 1otu h PRO 424 Cb 0.11 0.04 -0.08 0.00 0.11 0.00 0.00 31.00 31.19 1otu h PRO 424 CO -0.15 0.07 0.76 0.52 -0.21 0.00 0.00 178.00 178.99 1otu h MET 425 N -0.42 0.19 0.15 1.05 2.86 -0.50 -0.97 114.93 117.30 1otu h MET 425 Ca -0.02 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1otu h MET 425 Cb 0.33 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.95 1otu h MET 425 CO 0.03 0.13 -0.07 0.82 1.06 0.00 0.00 176.91 178.88 1otu h ILE 426 N 0.20 0.00 -0.05 -1.22 2.04 -1.33 -2.85 117.51 114.30 1otu h ILE 426 Ca 0.60 -0.81 0.01 0.00 1.00 0.00 0.00 64.86 65.66 1otu h ILE 426 Cb 1.92 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 1otu h ILE 426 CO -0.18 0.00 0.64 0.40 0.00 0.00 0.00 178.15 179.01 1otu h ILE 427 N -1.01 0.01 0.00 -0.67 2.04 -0.85 0.22 117.51 117.25 1otu h ILE 427 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1otu h ILE 427 Cb 0.15 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1otu h ILE 427 CO 0.03 0.00 -0.11 0.74 0.00 0.00 0.00 178.15 178.81 1otu h THR 428 N 0.00 0.00 -1.21 -0.27 2.02 -1.27 -3.02 112.91 109.16 1otu h THR 428 Ca 0.02 -0.35 0.35 0.00 0.77 0.00 0.00 66.41 67.20 1otu h THR 428 Cb 1.31 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.66 1otu h THR 428 CO -0.00 0.00 0.85 1.23 0.37 0.00 0.00 175.52 177.97 1otu h GLY 429 N -0.35 0.24 0.35 2.16 0.00 -1.00 0.92 103.07 105.39 1otu h GLY 429 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 1otu h GLY 429 CO 0.00 -0.04 -0.17 -2.00 0.00 0.00 0.00 176.54 174.33 1otu h LEU 430 N 0.06 -0.40 -1.96 3.11 5.85 -0.79 -2.67 115.31 118.51 1otu h LEU 430 Ca 0.60 0.01 0.36 0.00 0.84 0.00 0.00 57.88 59.69 1otu h LEU 430 Cb 2.23 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 43.31 1otu h LEU 430 CO -0.07 -0.02 0.90 1.23 -0.34 0.00 0.00 178.44 180.14 1otu h GLY 431 N -1.01 0.08 0.16 3.75 0.00 -0.58 0.61 103.07 106.09 1otu h GLY 431 Ca -0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 1otu h GLY 431 CO 0.08 -0.01 -0.08 0.00 0.00 0.00 0.00 176.54 176.53 1otu h ALA 432 N 1.38 -1.05 -0.28 3.60 0.00 0.97 -2.95 119.26 120.93 1otu h ALA 432 Ca 0.60 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.55 1otu h ALA 432 Cb 2.37 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 20.24 1otu h ALA 432 CO -0.03 -1.04 0.22 1.79 0.00 0.00 0.00 179.25 180.20 1otu h THR 433 N -0.22 0.72 0.00 0.00 1.35 0.00 0.52 112.91 115.29 1otu h THR 433 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 1otu h THR 433 Cb 0.16 0.84 0.00 0.00 -1.73 0.00 0.00 68.15 67.42 1otu h THR 433 CO 0.04 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.49 1otu n LEU 434 N -4.24 0.44 -0.00 3.87 7.99 0.10 -0.89 117.00 124.27 1otu n LEU 434 Ca 0.04 0.64 0.01 0.00 -0.01 0.00 0.00 56.01 56.68 1otu n LEU 434 Cb 0.38 -0.62 -0.02 0.00 -0.11 0.00 0.00 43.42 43.05 1otu n LEU 434 CO 0.33 -0.60 -0.54 0.18 -1.51 0.00 0.00 177.39 175.25 1otu n LEU 435 N -2.02 0.00 0.09 2.23 7.99 -0.02 -3.73 117.00 121.54 1otu n LEU 435 Ca 0.01 0.00 0.11 0.00 -0.01 0.00 0.00 56.01 56.13 1otu n LEU 435 Cb 0.14 0.02 0.45 0.00 -0.11 0.00 0.00 43.42 43.92 1otu n LEU 435 CO 0.14 0.02 0.85 0.00 -1.51 0.00 0.00 177.39 176.88 1otu n ALA 436 N -1.73 1.89 -0.00 -1.18 0.00 -0.11 -2.93 120.51 116.44 1otu n ALA 436 Ca -0.01 0.01 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1otu n ALA 436 Cb 0.21 -1.39 -0.00 0.00 0.00 0.00 0.00 19.45 18.27 1otu n ALA 436 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1otu n GLN 437 N -2.03 0.02 0.00 0.00 7.27 -0.07 -4.11 117.38 118.47 1otu n GLN 437 Ca 0.04 0.20 0.00 0.00 0.07 0.00 0.00 57.00 57.30 1otu n GLN 437 Cb 0.28 -0.73 0.00 0.00 2.41 0.00 0.00 30.24 32.20 1otu n GLN 437 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1otu n PHE 438 N -2.43 0.00 -2.69 3.69 3.72 -1.24 -2.52 117.46 115.99 1otu n PHE 438 Ca -0.00 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.31 1otu n PHE 438 Cb 0.02 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.63 1otu n PHE 438 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1otu n THR 439 N 0.12 0.45 0.00 4.37 -2.24 -1.15 -5.02 114.28 110.81 1otu n THR 439 Ca 0.00 -2.26 0.00 0.00 -2.27 0.00 0.00 64.05 59.52 1otu n THR 439 Cb 0.00 0.84 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 1otu n THR 439 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1otu n GLY 440 N -0.32 1.62 0.41 3.38 0.00 -1.05 -4.91 105.19 104.32 1otu n GLY 440 Ca 0.03 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1otu n GLY 440 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1otu n GLY 441 N 0.00 0.00 3.62 -0.02 0.00 -1.26 -4.60 105.19 102.93 1otu n GLY 441 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1otu n GLY 441 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1otu s LYS 442 N -2.79 1.53 -0.72 1.61 1.02 -1.26 -4.82 119.74 114.31 1otu s LYS 442 Ca 0.00 -0.99 -0.29 0.00 0.02 0.00 0.00 55.97 54.71 1otu s LYS 442 Cb 0.00 0.53 -0.15 0.00 -0.52 0.00 0.00 37.83 37.70 1otu s LYS 442 CO 0.00 -0.66 2.53 -2.30 -0.92 0.00 0.00 175.35 174.00 1otu n PRO 443 N -0.38 0.54 0.29 -1.68 -0.02 -1.26 -4.71 135.00 127.78 1otu n PRO 443 Ca -0.06 0.02 0.08 0.00 -2.02 0.00 0.00 63.50 61.52 1otu n PRO 443 Cb 0.61 -2.41 0.44 0.00 -0.02 0.00 0.00 33.50 32.12 1otu n PRO 443 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1otu h LEU 444 N 15.24 0.00 0.07 2.45 7.12 -1.26 0.96 115.31 139.89 1otu h LEU 444 Ca -0.15 0.00 -0.30 0.00 0.13 0.00 0.00 57.88 57.56 1otu h LEU 444 Cb 1.30 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.40 1otu h LEU 444 CO 1.25 0.00 -1.63 1.88 -0.13 0.00 0.00 178.44 179.82 1otu h TYR 445 N 0.00 0.26 0.11 1.25 -1.99 -1.84 -3.18 116.97 111.58 1otu h TYR 445 Ca 0.00 -0.19 -0.01 0.00 2.00 0.00 0.00 58.73 60.54 1otu h TYR 445 Cb 1.11 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.83 1otu h TYR 445 CO 0.00 1.29 -0.05 0.77 -0.00 0.00 0.00 178.16 180.16 1otu h SER 446 N 0.04 -0.13 -0.84 3.88 0.02 0.47 -3.04 113.55 113.95 1otu h SER 446 Ca -0.27 -0.39 0.18 0.00 -0.84 0.00 0.00 61.79 60.48 1otu h SER 446 Cb 2.00 0.03 -0.16 0.00 0.14 0.00 0.00 62.40 64.41 1otu h SER 446 CO 0.12 0.49 -0.12 0.00 -1.14 0.00 0.00 176.83 176.18 1otu h ALA 447 N -0.43 0.70 -0.50 3.77 0.00 -0.98 0.32 119.26 122.15 1otu h ALA 447 Ca -0.02 0.31 0.06 0.00 0.00 0.00 0.00 54.91 55.26 1otu h ALA 447 Cb 0.51 0.58 -0.05 0.00 0.00 0.00 0.00 17.79 18.82 1otu h ALA 447 CO 0.03 -0.43 0.20 0.82 0.00 0.00 0.00 179.25 179.87 1otu h ILE 448 N 0.03 0.87 0.91 0.00 2.04 -1.61 0.35 117.51 120.10 1otu h ILE 448 Ca 0.43 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 66.11 1otu h ILE 448 Cb 0.73 0.44 0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1otu h ILE 448 CO -0.82 0.07 -0.45 0.25 0.00 0.00 0.00 178.15 177.19 1otu h LEU 449 N 0.40 -1.09 -0.81 1.44 5.85 -0.34 0.18 115.31 120.94 1otu h LEU 449 Ca 0.23 0.04 0.08 0.00 0.84 0.00 0.00 57.88 59.07 1otu h LEU 449 Cb 0.22 0.29 -0.10 0.00 0.37 0.00 0.00 40.66 41.43 1otu h LEU 449 CO -0.21 -0.76 -0.55 0.00 -0.34 0.00 0.00 178.44 176.57 1otu h ALA 450 N -1.16 -0.58 0.04 1.25 0.00 -0.63 1.13 119.26 119.30 1otu h ALA 450 Ca -0.12 0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1otu h ALA 450 Cb 0.96 1.30 -0.05 0.00 0.00 0.00 0.00 17.79 20.00 1otu h ALA 450 CO 0.20 -0.95 -0.37 0.00 0.00 0.00 0.00 179.25 178.13 1otu h ARG 451 N -0.10 -0.53 0.00 0.00 2.47 -0.85 0.89 114.38 116.26 1otu h ARG 451 Ca 0.13 0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.89 1otu h ARG 451 Cb 0.44 0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.88 1otu h ARG 451 CO -0.81 -0.35 0.00 2.41 0.56 0.00 0.00 179.97 181.78 1otu n THR 452 N -5.44 0.21 -0.10 2.04 -1.04 0.04 0.35 114.28 110.34 1otu n THR 452 Ca -0.06 0.05 -0.12 0.00 -2.04 0.00 0.00 64.05 61.88 1otu n THR 452 Cb 0.35 -0.87 -0.10 0.00 -1.82 0.00 0.00 70.33 67.89 1otu n THR 452 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1otu n LEU 453 N -1.08 2.26 0.09 -4.42 7.94 0.37 -3.79 117.00 118.38 1otu n LEU 453 Ca 0.08 -0.08 -0.15 0.00 -1.11 0.00 0.00 56.01 54.75 1otu n LEU 453 Cb 0.05 -0.44 -0.11 0.00 0.53 0.00 0.00 43.42 43.46 1otu n LEU 453 CO 0.07 0.73 0.03 0.00 -1.11 0.00 0.00 177.39 177.12 1otu h ALA 454 N 0.19 0.20 0.00 1.96 0.00 0.14 -2.98 119.26 118.77 1otu h ALA 454 Ca -0.44 -0.83 -0.01 0.00 0.00 0.00 0.00 54.91 53.63 1otu h ALA 454 Cb 1.76 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.54 1otu h ALA 454 CO -0.05 0.93 -0.05 -0.22 0.00 0.00 0.00 179.25 179.86 1otu h LYS 455 N 0.11 0.00 0.06 0.00 3.64 -0.31 -2.62 116.57 117.46 1otu h LYS 455 Ca -0.11 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1otu h LYS 455 Cb 1.84 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.66 1otu h LYS 455 CO 0.19 0.05 -0.03 0.37 -2.27 0.00 0.00 179.45 177.76 1otu h GLN 456 N 0.00 -0.08 0.00 1.90 4.15 -1.62 -3.41 115.11 116.06 1otu h GLN 456 Ca -0.00 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1otu h GLN 456 Cb 0.68 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.38 1otu h GLN 456 CO 0.01 0.00 0.00 -0.85 -1.93 0.00 0.00 178.83 176.06 1otu n GLU 457 N -5.10 3.08 -1.21 1.69 0.28 -0.99 -4.44 120.64 113.97 1otu n GLU 457 Ca -0.08 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.82 1otu n GLU 457 Cb 0.08 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 32.91 1otu n GLU 457 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1otu n ALA 458 N -3.00 -0.16 -2.81 -1.84 0.00 -1.22 -4.70 120.51 106.78 1otu n ALA 458 Ca 0.00 0.17 -0.11 0.00 0.00 0.00 0.00 53.44 53.50 1otu n ALA 458 Cb 0.00 -1.34 0.05 0.00 0.00 0.00 0.00 19.45 18.16 1otu n ALA 458 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1otu n GLU 459 N -1.23 1.09 0.00 0.00 2.13 -1.26 -4.98 120.64 116.40 1otu n GLU 459 Ca -0.10 -2.75 0.00 0.00 0.66 0.00 0.00 57.16 54.96 1otu n GLU 459 Cb 0.42 -1.04 0.00 0.00 0.27 0.00 0.00 31.44 31.09 1otu n GLU 459 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72