#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oat s PRO 37 N 0.00 4.41 0.36 1.61 0.04 -1.26 -4.98 135.00 135.18 2oat s PRO 37 Ca 0.00 1.79 -0.28 0.00 0.04 0.00 0.00 61.00 62.55 2oat s PRO 37 Cb 0.00 -2.95 -0.11 0.00 0.04 0.00 0.00 34.50 31.48 2oat s PRO 37 CO 0.00 0.00 1.48 -2.30 0.04 0.00 0.00 177.00 176.22 2oat n PRO 38 N 0.69 2.62 -1.98 0.56 -0.02 -1.26 -5.01 135.00 130.59 2oat n PRO 38 Ca 0.01 0.92 -0.29 0.00 -2.02 0.00 0.00 63.50 62.12 2oat n PRO 38 Cb 0.46 -2.64 0.07 0.00 -0.02 0.00 0.00 33.50 31.37 2oat n PRO 38 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2oat s THR 39 N -0.97 2.62 0.20 3.45 -1.32 -1.26 -4.84 115.64 113.52 2oat s THR 39 Ca 0.55 0.10 -0.10 0.00 -1.21 0.00 0.00 61.69 61.03 2oat s THR 39 Cb -0.49 -3.18 0.12 0.00 -1.51 0.00 0.00 72.50 67.45 2oat s THR 39 CO 0.62 -0.22 1.78 0.28 -2.21 0.00 0.00 174.62 174.86 2oat h SER 40 N -0.80 0.38 -0.23 8.08 0.02 -1.93 -0.81 113.55 118.27 2oat h SER 40 Ca -0.45 0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.51 2oat h SER 40 Cb 1.30 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 2oat h SER 40 CO 0.64 0.24 0.05 0.44 -1.14 0.00 0.00 176.83 177.06 2oat h ASP 41 N 0.53 0.42 -0.44 3.07 5.19 -2.00 -1.64 116.42 121.55 2oat h ASP 41 Ca 0.28 -0.06 -0.14 0.00 -0.62 0.00 0.00 57.03 56.49 2oat h ASP 41 Cb 0.25 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.64 2oat h ASP 41 CO -0.22 0.45 -0.28 0.44 -3.12 0.00 0.00 179.24 176.51 2oat h ASP 42 N 0.45 1.02 -0.63 6.45 3.32 -1.61 -2.34 116.42 123.08 2oat h ASP 42 Ca 0.11 -0.42 0.05 0.00 0.02 0.00 0.00 57.03 56.78 2oat h ASP 42 Cb 0.22 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.44 2oat h ASP 42 CO 0.00 1.22 0.35 0.40 -1.72 0.00 0.00 179.24 179.49 2oat h ILE 43 N 0.82 0.98 -0.21 0.35 2.04 -0.30 0.27 117.51 121.46 2oat h ILE 43 Ca 0.09 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2oat h ILE 43 Cb 0.87 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2oat h ILE 43 CO 0.08 0.12 0.04 -0.26 0.00 0.00 0.00 178.15 178.13 2oat h PHE 44 N 0.65 0.36 -0.72 1.37 0.04 -1.28 -2.83 116.94 114.52 2oat h PHE 44 Ca 0.28 -0.05 0.03 0.00 2.80 0.00 0.00 57.97 61.04 2oat h PHE 44 Cb 0.16 -0.10 -0.05 0.00 2.20 0.00 0.00 35.95 38.16 2oat h PHE 44 CO -0.08 0.46 0.45 1.49 -0.60 0.00 0.00 178.31 180.03 2oat h GLU 45 N 0.15 0.84 -0.41 1.51 4.81 -0.99 -0.97 114.58 119.52 2oat h GLU 45 Ca 0.06 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2oat h GLU 45 Cb 0.29 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 2oat h GLU 45 CO 0.00 0.56 0.19 -0.09 -0.73 0.00 0.00 179.01 178.94 2oat h ARG 46 N 0.87 0.61 -0.49 1.92 2.43 -0.90 -2.03 114.38 116.78 2oat h ARG 46 Ca 0.29 -0.10 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 2oat h ARG 46 Cb 0.04 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.47 2oat h ARG 46 CO -0.12 0.54 0.04 0.93 -1.51 0.00 0.00 179.97 179.86 2oat h GLU 47 N 0.53 0.79 -0.99 0.20 5.08 -1.35 -1.70 114.58 117.15 2oat h GLU 47 Ca 0.14 -0.19 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2oat h GLU 47 Cb 0.15 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.25 2oat h GLU 47 CO -0.02 0.77 0.64 -0.92 -1.00 0.00 0.00 179.01 178.48 2oat h TYR 48 N 0.74 1.26 -0.03 4.33 3.20 -0.81 0.31 116.97 125.97 2oat h TYR 48 Ca 0.15 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.93 2oat h TYR 48 Cb 0.39 -0.42 0.01 0.00 1.54 0.00 0.00 36.73 38.25 2oat h TYR 48 CO 0.02 0.80 -0.41 -0.22 -1.64 0.00 0.00 178.16 176.71 2oat h LYS 49 N 1.34 0.32 -0.01 1.82 3.64 -0.90 -3.40 116.57 119.39 2oat h LYS 49 Ca 0.36 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2oat h LYS 49 Cb -0.13 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2oat h LYS 49 CO -0.08 0.99 -0.45 0.66 -2.27 0.00 0.00 179.45 178.30 2oat n TYR 50 N -4.36 0.00 -4.35 1.91 4.01 -0.68 -5.00 117.16 108.69 2oat n TYR 50 Ca -0.09 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.38 2oat n TYR 50 Cb 0.57 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.49 2oat n TYR 50 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2oat s GLY 51 N -2.04 1.72 0.76 2.72 0.00 0.09 -5.05 107.32 105.52 2oat s GLY 51 Ca 0.11 -1.54 -0.15 0.00 0.00 0.00 0.00 44.72 43.13 2oat s GLY 51 CO 0.47 -1.56 0.85 0.00 0.00 0.00 0.00 173.10 172.85 2oat n ALA 52 N 0.18 -0.76 -1.43 3.20 0.00 -1.26 -4.75 120.51 115.68 2oat n ALA 52 Ca -0.12 -0.27 -0.34 0.00 0.00 0.00 0.00 53.44 52.71 2oat n ALA 52 Cb 0.56 -2.04 0.06 0.00 0.00 0.00 0.00 19.45 18.02 2oat n ALA 52 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2oat n HIS 53 N -2.76 2.89 1.84 0.00 8.25 -1.26 -4.60 115.22 119.58 2oat n HIS 53 Ca 0.12 -2.68 0.14 0.00 -0.26 0.00 0.00 57.72 55.03 2oat n HIS 53 Cb 0.50 -1.33 0.74 0.00 1.12 0.00 0.00 29.99 31.02 2oat n HIS 53 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2oat n ASN 54 N -0.58 0.43 -4.06 0.41 6.94 -1.26 -4.85 115.26 112.29 2oat n ASN 54 Ca 0.56 -1.24 -0.07 0.00 -0.02 0.00 0.00 54.58 53.81 2oat n ASN 54 Cb 0.54 -0.01 -0.10 0.00 -2.36 0.00 0.00 39.78 37.85 2oat n ASN 54 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2oat s TYR 55 N -1.98 0.46 -0.50 -2.53 2.02 -1.26 -5.09 117.35 108.47 2oat s TYR 55 Ca 0.41 -0.97 0.04 0.00 -0.37 0.00 0.00 57.07 56.17 2oat s TYR 55 Cb 0.20 -0.34 0.17 0.00 -0.40 0.00 0.00 41.96 41.58 2oat s TYR 55 CO 0.32 -0.38 0.39 -1.58 -1.57 0.00 0.00 175.55 172.73 2oat s HIS 56 N -3.70 1.84 0.73 2.71 5.65 -1.26 -5.12 115.29 116.14 2oat s HIS 56 Ca 0.05 -2.63 -0.11 0.00 0.25 0.00 0.00 55.06 52.61 2oat s HIS 56 Cb 0.06 -1.46 0.03 0.00 -1.18 0.00 0.00 32.58 30.03 2oat s HIS 56 CO -0.09 -0.74 1.07 -2.14 -0.65 0.00 0.00 174.74 172.19 2oat s PRO 57 N -0.40 2.68 0.20 2.88 0.02 -1.26 -4.99 135.00 134.13 2oat s PRO 57 Ca 0.30 0.85 -0.31 0.00 0.02 0.00 0.00 61.00 61.87 2oat s PRO 57 Cb 0.01 -1.97 -0.10 0.00 0.02 0.00 0.00 34.50 32.47 2oat s PRO 57 CO -0.19 -1.26 1.45 -1.17 -0.33 0.00 0.00 177.00 175.51 2oat s LEU 58 N -5.62 4.38 -0.90 -5.54 2.96 -1.26 -4.87 118.68 107.84 2oat s LEU 58 Ca 0.59 2.58 -0.25 0.00 -0.22 0.00 0.00 54.13 56.84 2oat s LEU 58 Cb -0.14 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 2oat s LEU 58 CO 0.55 -0.71 1.89 -2.16 -1.32 0.00 0.00 176.35 174.60 2oat s PRO 59 N 0.24 2.66 -0.19 0.98 0.04 -1.26 -4.84 135.00 132.63 2oat s PRO 59 Ca 0.63 -0.32 -0.10 0.00 0.04 0.00 0.00 61.00 61.24 2oat s PRO 59 Cb -0.41 -5.05 0.06 0.00 0.04 0.00 0.00 34.50 29.15 2oat s PRO 59 CO 0.38 -3.22 0.47 0.14 0.04 0.00 0.00 177.00 174.80 2oat s VAL 60 N 9.51 -0.05 -0.32 -0.36 -7.23 -1.26 -5.13 120.40 115.56 2oat s VAL 60 Ca 0.67 0.08 -0.04 0.00 -1.81 0.00 0.00 61.98 60.88 2oat s VAL 60 Cb -0.06 -0.69 0.05 0.00 0.56 0.00 0.00 36.38 36.23 2oat s VAL 60 CO -0.00 0.03 0.06 0.00 -0.31 0.00 0.00 175.10 174.88 2oat s ALA 61 N 1.50 2.95 0.09 1.32 0.00 -1.26 -5.09 121.76 121.27 2oat s ALA 61 Ca -0.09 -1.77 -0.11 0.00 0.00 0.00 0.00 51.96 49.99 2oat s ALA 61 Cb -0.08 -2.13 -0.06 0.00 0.00 0.00 0.00 23.12 20.85 2oat s ALA 61 CO -0.14 -1.32 0.43 -0.51 0.00 0.00 0.00 175.76 174.21 2oat s LEU 62 N 1.33 4.35 0.00 0.00 2.01 -1.26 -1.63 118.68 123.48 2oat s LEU 62 Ca -0.03 0.85 0.00 0.00 0.01 0.00 0.00 54.13 54.96 2oat s LEU 62 Cb -0.20 -3.01 0.00 0.00 0.01 0.00 0.00 46.19 43.00 2oat s LEU 62 CO 0.01 0.17 0.00 -1.84 1.01 0.00 0.00 176.35 175.70 2oat n GLU 63 N 0.94 3.11 -3.84 1.70 0.28 -0.40 -4.88 120.64 117.55 2oat n GLU 63 Ca -0.08 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.80 2oat n GLU 63 Cb 0.52 -0.28 -0.10 0.00 1.43 0.00 0.00 31.44 33.00 2oat n GLU 63 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 2oat s ARG 64 N -0.50 0.44 -0.12 3.44 3.52 -1.15 -5.02 118.95 119.55 2oat s ARG 64 Ca 0.00 -0.17 -0.07 0.00 -0.13 0.00 0.00 55.73 55.35 2oat s ARG 64 Cb 0.00 0.19 0.04 0.00 -1.56 0.00 0.00 34.95 33.62 2oat s ARG 64 CO 0.00 -0.10 0.29 0.20 -0.81 0.00 0.00 175.30 174.88 2oat s GLY 65 N -0.93 -0.20 -0.15 8.12 0.00 -1.26 -0.64 107.32 112.25 2oat s GLY 65 Ca -0.10 1.05 -0.05 0.00 0.00 0.00 0.00 44.72 45.62 2oat s GLY 65 CO 0.02 1.17 0.29 1.25 0.00 0.00 0.00 173.10 175.83 2oat s LYS 66 N 0.96 0.19 7.85 2.90 2.47 -0.18 -4.38 119.74 129.55 2oat s LYS 66 Ca -0.07 0.74 0.00 0.00 -1.56 0.00 0.00 55.97 55.08 2oat s LYS 66 Cb -0.07 -0.09 0.00 0.00 -1.46 0.00 0.00 37.83 36.20 2oat s LYS 66 CO -0.07 -0.33 0.00 0.41 0.16 0.00 0.00 175.35 175.53 2oat n GLY 67 N 5.36 3.59 0.02 5.54 0.00 -0.33 -1.76 105.19 117.60 2oat n GLY 67 Ca -0.06 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.03 2oat n GLY 67 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2oat n ILE 68 N 0.00 0.00 -4.22 -0.61 -5.35 -1.26 -1.25 119.36 106.66 2oat n ILE 68 Ca 0.00 -0.01 -0.23 0.00 -0.27 0.00 0.00 62.75 62.24 2oat n ILE 68 Cb 0.00 -0.25 -0.06 0.00 -1.74 0.00 0.00 39.64 37.59 2oat n ILE 68 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2oat s TYR 69 N -2.86 2.86 0.00 4.28 2.02 -0.72 -0.37 117.35 122.57 2oat s TYR 69 Ca 0.18 -0.17 0.00 0.00 -0.37 0.00 0.00 57.07 56.71 2oat s TYR 69 Cb 0.19 -1.29 -0.00 0.00 -0.40 0.00 0.00 41.96 40.46 2oat s TYR 69 CO 0.55 0.58 -0.01 -0.51 -1.57 0.00 0.00 175.55 174.59 2oat s LEU 70 N -3.66 2.03 -0.03 -1.29 1.43 -0.81 -1.01 118.68 115.35 2oat s LEU 70 Ca 0.32 -0.07 0.07 0.00 -1.03 0.00 0.00 54.13 53.42 2oat s LEU 70 Cb -0.07 -0.02 -0.02 0.00 0.03 0.00 0.00 46.19 46.11 2oat s LEU 70 CO 0.22 -0.03 -0.24 0.26 0.23 0.00 0.00 176.35 176.79 2oat s TRP 71 N -0.17 2.16 0.75 0.29 0.51 0.18 -0.07 118.94 122.59 2oat s TRP 71 Ca -0.01 -0.45 -0.04 0.00 -2.12 0.00 0.00 56.10 53.48 2oat s TRP 71 Cb -0.01 -1.40 0.13 0.00 -0.81 0.00 0.00 33.47 31.38 2oat s TRP 71 CO -0.00 -0.07 1.04 0.16 -0.51 0.00 0.00 176.95 177.57 2oat s ASP 72 N -0.47 4.19 0.14 2.95 1.47 -0.56 -1.28 116.67 123.12 2oat s ASP 72 Ca 0.07 -0.21 0.22 0.00 1.18 0.00 0.00 52.55 53.81 2oat s ASP 72 Cb -0.10 -0.15 0.87 0.00 -0.34 0.00 0.00 42.92 43.21 2oat s ASP 72 CO -0.00 -1.97 1.67 1.33 0.68 0.00 0.00 175.17 176.88 2oat n VAL 73 N -2.98 0.74 1.25 2.11 0.24 -0.65 -1.31 118.33 117.74 2oat n VAL 73 Ca 0.14 0.13 0.12 0.00 -2.04 0.00 0.00 64.34 62.69 2oat n VAL 73 Cb 0.60 -0.94 0.40 0.00 -1.47 0.00 0.00 33.84 32.44 2oat n VAL 73 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2oat n GLU 74 N -1.92 1.79 0.00 7.34 4.71 -1.26 -4.94 120.64 126.36 2oat n GLU 74 Ca 0.04 -1.17 0.00 0.00 -0.01 0.00 0.00 57.16 56.02 2oat n GLU 74 Cb 0.26 -1.44 0.00 0.00 -1.01 0.00 0.00 31.44 29.25 2oat n GLU 74 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2oat n GLY 75 N 1.18 1.59 3.71 0.62 0.00 -0.42 -5.05 105.19 106.82 2oat n GLY 75 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2oat n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oat n ARG 76 N -2.00 1.92 -4.20 1.61 1.74 -1.26 -4.68 116.66 109.79 2oat n ARG 76 Ca 0.00 0.68 -0.35 0.00 -0.77 0.00 0.00 57.85 57.41 2oat n ARG 76 Cb 0.00 -2.41 -0.09 0.00 -1.02 0.00 0.00 32.46 28.94 2oat n ARG 76 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2oat s LYS 77 N -2.28 3.34 0.04 5.56 2.20 -1.26 -1.49 119.74 125.85 2oat s LYS 77 Ca 0.62 -0.35 0.03 0.00 -0.36 0.00 0.00 55.97 55.90 2oat s LYS 77 Cb -0.49 -2.97 -0.02 0.00 -1.51 0.00 0.00 37.83 32.84 2oat s LYS 77 CO 0.57 0.59 -0.09 0.71 -0.36 0.00 0.00 175.35 176.78 2oat s TYR 78 N -0.54 0.73 0.04 4.03 1.51 0.90 -4.70 117.35 119.33 2oat s TYR 78 Ca 0.10 -0.45 -0.28 0.00 -1.01 0.00 0.00 57.07 55.43 2oat s TYR 78 Cb -0.12 -0.44 -0.05 0.00 -0.11 0.00 0.00 41.96 41.25 2oat s TYR 78 CO 0.02 -0.06 0.89 -0.06 -1.11 0.00 0.00 175.55 175.23 2oat s PHE 79 N -1.23 3.73 -0.45 2.71 0.08 0.09 -1.93 117.98 120.98 2oat s PHE 79 Ca -0.08 1.63 -0.22 0.00 0.12 0.00 0.00 56.93 58.38 2oat s PHE 79 Cb -0.09 -2.99 0.03 0.00 -0.57 0.00 0.00 43.02 39.40 2oat s PHE 79 CO 0.01 0.15 0.73 0.34 -0.10 0.00 0.00 175.22 176.35 2oat s ASP 80 N 0.35 6.38 -0.42 1.36 2.15 0.51 -0.28 116.67 126.71 2oat s ASP 80 Ca 0.45 -0.20 0.05 0.00 0.43 0.00 0.00 52.55 53.28 2oat s ASP 80 Cb -0.21 -2.36 0.52 0.00 -0.30 0.00 0.00 42.92 40.56 2oat s ASP 80 CO 0.26 -0.87 1.66 0.49 -0.17 0.00 0.00 175.17 176.54 2oat n PHE 81 N 6.55 2.35 0.00 -5.34 3.01 -0.00 -3.99 117.46 120.03 2oat n PHE 81 Ca 0.01 -2.14 0.00 0.00 1.01 0.00 0.00 57.45 56.32 2oat n PHE 81 Cb 0.48 -0.81 0.00 0.00 -0.01 0.00 0.00 39.48 39.14 2oat n PHE 81 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 2oat n LEU 82 N -1.00 0.35 -3.27 4.37 7.94 -1.13 -1.32 117.00 122.93 2oat n LEU 82 Ca 0.48 0.00 -0.23 0.00 -1.11 0.00 0.00 56.01 55.15 2oat n LEU 82 Cb 1.06 0.00 0.01 0.00 0.53 0.00 0.00 43.42 45.02 2oat n LEU 82 CO 0.47 0.06 -0.01 -1.20 -1.11 0.00 0.00 177.39 175.60 2oat n SER 83 N -1.51 -4.68 -3.97 1.96 7.64 -1.16 -2.37 113.62 109.54 2oat n SER 83 Ca 0.00 -0.37 -0.26 0.00 1.01 0.00 0.00 58.87 59.24 2oat n SER 83 Cb 0.29 -3.82 -0.02 0.00 -1.01 0.00 0.00 64.21 59.65 2oat n SER 83 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2oat n SER 84 N -2.41 -0.50 -2.60 6.43 7.64 -1.26 -1.34 113.62 119.58 2oat n SER 84 Ca -0.05 -1.03 -0.19 0.00 1.01 0.00 0.00 58.87 58.61 2oat n SER 84 Cb 0.57 -2.95 0.00 0.00 -1.01 0.00 0.00 64.21 60.82 2oat n SER 84 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2oat n TYR 85 N -4.41 -1.36 -0.01 1.43 4.01 -1.00 -0.81 117.16 115.01 2oat n TYR 85 Ca -0.30 0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 2oat n TYR 85 Cb 0.68 -3.64 0.00 0.00 -0.31 0.00 0.00 39.34 36.07 2oat n TYR 85 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2oat n SER 86 N -2.07 0.00 0.09 7.72 7.64 -0.45 -4.73 113.62 121.81 2oat n SER 86 Ca -0.18 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.74 2oat n SER 86 Cb 0.64 0.00 0.45 0.00 -1.01 0.00 0.00 64.21 64.29 2oat n SER 86 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2oat h ALA 87 N 0.00 1.68 -1.28 -0.43 0.00 -0.55 -2.41 119.26 116.27 2oat h ALA 87 Ca 0.00 -0.09 -0.73 0.00 0.00 0.00 0.00 54.91 54.09 2oat h ALA 87 Cb 0.00 -0.11 -0.31 0.00 0.00 0.00 0.00 17.79 17.37 2oat h ALA 87 CO 0.00 0.26 0.55 1.33 0.00 0.00 0.00 179.25 181.38 2oat n VAL 88 N -4.41 3.88 -0.19 0.00 0.24 -0.75 -2.04 118.33 115.05 2oat n VAL 88 Ca 0.01 -4.93 0.06 0.00 -2.04 0.00 0.00 64.34 57.44 2oat n VAL 88 Cb 0.14 -1.33 0.34 0.00 -1.47 0.00 0.00 33.84 31.52 2oat n VAL 88 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 2oat h ASN 89 N 3.19 0.68 0.00 -1.34 2.35 -1.67 -0.15 115.58 118.64 2oat h ASN 89 Ca 0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.22 2oat h ASN 89 Cb 0.31 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2oat h ASN 89 CO 1.21 0.45 0.00 0.00 -1.65 0.00 0.00 177.43 177.43 2oat n GLN 90 N -4.48 0.97 0.00 0.81 3.00 -1.26 -0.25 117.38 116.18 2oat n GLN 90 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2oat n GLN 90 Cb 0.21 -1.32 0.00 0.00 0.00 0.00 0.00 30.24 29.13 2oat n GLN 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2oat n GLY 91 N 0.78 -2.11 3.76 1.08 0.00 -0.07 -4.61 105.19 104.01 2oat n GLY 91 Ca 0.15 -1.45 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 2oat n GLY 91 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2oat s HIS 92 N -3.24 2.80 -1.36 1.61 0.09 -0.38 -3.56 115.29 111.23 2oat s HIS 92 Ca 0.00 1.08 -0.04 0.00 -0.00 0.00 0.00 55.06 56.10 2oat s HIS 92 Cb 0.00 -3.94 0.00 0.00 -0.00 0.00 0.00 32.58 28.64 2oat s HIS 92 CO 0.00 -2.89 0.47 0.00 -0.00 0.00 0.00 174.74 172.32 2oat n HIS 94 N -4.40 2.56 -0.35 0.00 -0.00 -1.23 -4.83 115.22 106.97 2oat n HIS 94 Ca -0.27 -0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.57 2oat n HIS 94 Cb 0.67 -2.67 0.32 0.00 -0.00 0.00 0.00 29.99 28.31 2oat n HIS 94 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2oat h PRO 95 N 7.59 0.76 -0.48 1.57 0.13 -1.95 -0.53 132.00 139.08 2oat h PRO 95 Ca -0.45 -0.05 -0.12 0.00 -0.87 0.00 0.00 66.00 64.51 2oat h PRO 95 Cb 1.23 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 2oat h PRO 95 CO 0.94 0.50 -0.19 -0.22 -0.23 0.00 0.00 178.00 178.80 2oat h LYS 96 N 0.78 0.97 -0.20 0.86 3.64 -1.97 -1.26 116.57 119.38 2oat h LYS 96 Ca 0.56 -0.39 -0.14 0.00 -1.27 0.00 0.00 60.65 59.41 2oat h LYS 96 Cb 0.86 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 2oat h LYS 96 CO -0.35 1.06 -0.42 0.82 -2.27 0.00 0.00 179.45 178.29 2oat h ILE 97 N 0.84 1.32 -0.31 2.00 2.04 -1.62 -1.64 117.51 120.15 2oat h ILE 97 Ca 0.12 -1.65 0.05 0.00 1.00 0.00 0.00 64.86 64.38 2oat h ILE 97 Cb 0.75 1.86 -0.05 0.00 -0.74 0.00 0.00 36.82 38.64 2oat h ILE 97 CO 0.06 0.51 -0.01 0.58 0.00 0.00 0.00 178.15 179.29 2oat h VAL 98 N 0.33 0.76 -0.56 1.67 2.07 -1.11 0.16 116.25 119.57 2oat h VAL 98 Ca 0.00 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2oat h VAL 98 Cb 1.03 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2oat h VAL 98 CO 0.09 0.01 0.25 0.78 0.02 0.00 0.00 177.57 178.73 2oat h ASN 99 N 0.08 0.72 -0.47 0.57 2.35 -1.16 0.17 115.58 117.83 2oat h ASN 99 Ca 0.15 -0.08 -0.10 0.00 -0.55 0.00 0.00 56.30 55.72 2oat h ASN 99 Cb 0.20 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 2oat h ASN 99 CO -0.26 0.63 -0.09 0.00 -1.65 0.00 0.00 177.43 176.06 2oat h ALA 100 N 1.49 0.64 0.54 -0.83 0.00 -0.27 -0.52 119.26 120.30 2oat h ALA 100 Ca 0.19 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2oat h ALA 100 Cb 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2oat h ALA 100 CO -0.02 0.53 -0.34 1.25 0.00 0.00 0.00 179.25 180.67 2oat h LEU 101 N 0.74 -0.86 -1.01 0.00 5.85 0.07 -2.25 115.31 117.85 2oat h LEU 101 Ca 0.12 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.96 2oat h LEU 101 Cb 0.64 0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.85 2oat h LEU 101 CO 0.04 -0.53 0.65 0.11 -0.34 0.00 0.00 178.44 178.37 2oat h LYS 102 N -0.83 1.15 -0.31 1.25 1.57 -0.68 -1.94 116.57 116.78 2oat h LYS 102 Ca -0.06 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 2oat h LYS 102 Cb 0.68 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 2oat h LYS 102 CO 0.06 0.76 0.15 1.03 -0.57 0.00 0.00 179.45 180.88 2oat h SER 103 N 1.19 0.41 0.59 0.86 0.87 -0.91 -3.25 113.55 113.31 2oat h SER 103 Ca 0.43 -0.12 -0.17 0.00 -1.23 0.00 0.00 61.79 60.70 2oat h SER 103 Cb 0.15 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 2oat h SER 103 CO -0.17 0.41 -0.78 -0.61 -0.53 0.00 0.00 176.83 175.16 2oat h GLN 104 N 0.37 0.14 0.00 2.24 5.75 -1.10 -3.26 115.11 119.25 2oat h GLN 104 Ca 0.11 -0.13 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 2oat h GLN 104 Cb 0.11 0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.69 2oat h GLN 104 CO -0.01 0.84 0.00 0.28 -2.65 0.00 0.00 178.83 177.29 2oat h VAL 105 N 0.08 0.00 0.00 2.39 2.07 -1.39 -0.36 116.25 119.05 2oat h VAL 105 Ca -0.02 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2oat h VAL 105 Cb 1.36 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2oat h VAL 105 CO 0.11 0.00 -0.68 0.44 0.02 0.00 0.00 177.57 177.46 2oat h ASP 106 N 0.00 0.00 0.00 0.57 3.32 -1.65 -3.41 116.42 115.25 2oat h ASP 106 Ca 0.00 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.93 2oat h ASP 106 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2oat h ASP 106 CO 0.00 0.06 -0.67 0.29 -1.72 0.00 0.00 179.24 177.20 2oat n LYS 107 N -2.37 0.43 -3.64 3.56 5.02 -0.20 -5.08 118.16 115.87 2oat n LYS 107 Ca 0.02 0.32 -0.05 0.00 -2.02 0.00 0.00 58.31 56.58 2oat n LYS 107 Cb 0.48 -1.42 -0.07 0.00 -0.02 0.00 0.00 35.03 34.00 2oat n LYS 107 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2oat s LEU 108 N -7.60 -0.54 -0.03 -0.35 0.20 -0.84 -5.09 118.68 104.43 2oat s LEU 108 Ca -0.19 0.91 0.03 0.00 0.69 0.00 0.00 54.13 55.56 2oat s LEU 108 Cb 0.03 1.86 -0.04 0.00 -0.43 0.00 0.00 46.19 47.61 2oat s LEU 108 CO 0.29 -0.15 0.01 0.35 -0.29 0.00 0.00 176.35 176.56 2oat n THR 109 N 3.27 0.21 -3.40 3.68 -2.24 -1.26 -4.29 114.28 110.25 2oat n THR 109 Ca -0.17 -0.13 -0.01 0.00 -2.27 0.00 0.00 64.05 61.48 2oat n THR 109 Cb 0.57 -0.89 -0.04 0.00 -2.10 0.00 0.00 70.33 67.87 2oat n THR 109 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2oat s LEU 110 N -4.33 -1.12 -0.06 3.22 2.96 -1.26 -3.71 118.68 114.39 2oat s LEU 110 Ca -0.02 1.04 0.19 0.00 -0.22 0.00 0.00 54.13 55.12 2oat s LEU 110 Cb 0.01 1.97 -0.29 0.00 0.50 0.00 0.00 46.19 48.38 2oat s LEU 110 CO 0.12 -0.25 0.36 0.35 -1.32 0.00 0.00 176.35 175.62 2oat n THR 111 N 5.42 0.25 0.00 3.68 -2.24 -1.26 -5.08 114.28 115.06 2oat n THR 111 Ca -0.06 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 2oat n THR 111 Cb 0.50 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2oat n THR 111 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2oat n SER 112 N -2.29 0.00 -0.20 3.42 3.41 -1.26 -4.57 113.62 112.13 2oat n SER 112 Ca -0.09 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.59 2oat n SER 112 Cb 0.64 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.91 2oat n SER 112 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2oat n ARG 113 N -1.67 1.26 0.24 4.33 5.12 -1.26 -3.40 116.66 121.28 2oat n ARG 113 Ca 0.00 -0.39 0.13 0.00 -1.93 0.00 0.00 57.85 55.66 2oat n ARG 113 Cb 0.00 -1.24 0.55 0.00 -1.16 0.00 0.00 32.46 30.61 2oat n ARG 113 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2oat h ALA 114 N 3.54 1.03 -4.85 7.54 0.00 -1.98 -3.45 119.26 121.09 2oat h ALA 114 Ca 0.00 -0.12 -0.51 0.00 0.00 0.00 0.00 54.91 54.28 2oat h ALA 114 Cb 0.16 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 17.81 2oat h ALA 114 CO 0.00 0.17 -0.44 1.19 0.00 0.00 0.00 179.25 180.17 2oat n PHE 115 N -3.29 -0.10 -4.03 0.00 3.72 -1.22 -5.16 117.46 107.37 2oat n PHE 115 Ca 0.00 -2.54 -0.26 0.00 -0.05 0.00 0.00 57.45 54.60 2oat n PHE 115 Cb 0.38 0.07 -0.05 0.00 -0.94 0.00 0.00 39.48 38.94 2oat n PHE 115 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2oat s TYR 116 N -3.09 3.27 0.15 1.38 1.51 -1.26 -4.83 117.35 114.48 2oat s TYR 116 Ca 0.25 0.03 0.11 0.00 -1.01 0.00 0.00 57.07 56.45 2oat s TYR 116 Cb 0.01 -1.57 -0.04 0.00 -0.11 0.00 0.00 41.96 40.25 2oat s TYR 116 CO 0.17 0.52 -0.26 0.54 -1.11 0.00 0.00 175.55 175.41 2oat s ASN 117 N -3.14 3.34 0.44 2.29 2.20 -1.26 -5.02 114.94 113.79 2oat s ASN 117 Ca 0.32 -0.78 0.27 0.00 -0.94 0.00 0.00 52.86 51.73 2oat s ASN 117 Cb -0.10 -0.23 0.74 0.00 -2.00 0.00 0.00 41.25 39.66 2oat s ASN 117 CO 0.25 0.16 1.75 -0.55 -2.94 0.00 0.00 177.10 175.77 2oat h ASN 118 N 3.71 0.00 0.31 3.54 -0.00 -2.00 -3.35 115.58 117.79 2oat h ASN 118 Ca -0.50 0.00 -0.33 0.00 -0.00 0.00 0.00 56.30 55.47 2oat h ASN 118 Cb 1.18 0.00 0.03 0.00 -0.00 0.00 0.00 38.32 39.53 2oat h ASN 118 CO 0.41 0.00 -1.45 0.58 -0.00 0.00 0.00 177.43 176.97 2oat h VAL 119 N 0.00 1.31 -0.46 6.14 2.07 -1.96 -3.40 116.25 119.95 2oat h VAL 119 Ca 0.00 -2.74 0.08 0.00 0.82 0.00 0.00 66.70 64.86 2oat h VAL 119 Cb 0.79 3.03 -0.07 0.00 -1.52 0.00 0.00 31.29 33.52 2oat h VAL 119 CO 0.00 0.82 0.02 0.25 0.02 0.00 0.00 177.57 178.68 2oat h LEU 120 N 0.14 -0.14 -1.47 2.57 5.85 -1.82 -2.17 115.31 118.28 2oat h LEU 120 Ca -0.24 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.62 2oat h LEU 120 Cb 2.14 0.17 -0.03 0.00 0.37 0.00 0.00 40.66 43.31 2oat h LEU 120 CO 0.27 -0.04 0.40 1.23 -0.34 0.00 0.00 178.44 179.96 2oat h GLY 121 N 0.14 0.80 1.11 3.75 0.00 -1.82 0.69 103.07 107.73 2oat h GLY 121 Ca 0.23 -0.27 -0.13 0.00 0.00 0.00 0.00 47.33 47.15 2oat h GLY 121 CO -0.36 0.23 -0.23 -2.09 0.00 0.00 0.00 176.54 174.10 2oat h GLU 122 N 0.69 0.99 -0.34 4.80 4.81 -1.61 -0.88 114.58 123.03 2oat h GLU 122 Ca 0.25 -0.43 -0.17 0.00 -0.13 0.00 0.00 59.36 58.87 2oat h GLU 122 Cb 0.12 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 2oat h GLU 122 CO -0.07 1.11 -0.45 -0.92 -0.73 0.00 0.00 179.01 177.95 2oat h TYR 123 N 0.85 1.09 -0.17 0.92 3.20 -0.97 -2.30 116.97 119.59 2oat h TYR 123 Ca 0.11 -0.35 -0.00 0.00 3.14 0.00 0.00 58.73 61.63 2oat h TYR 123 Cb 0.81 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 2oat h TYR 123 CO 0.05 1.18 0.11 0.93 -1.64 0.00 0.00 178.16 178.79 2oat h GLU 124 N 0.72 0.24 -0.66 1.82 5.08 -0.74 0.69 114.58 121.73 2oat h GLU 124 Ca 0.04 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2oat h GLU 124 Cb 1.04 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.21 2oat h GLU 124 CO 0.10 0.19 0.27 1.49 -1.00 0.00 0.00 179.01 180.07 2oat h GLU 125 N 0.21 0.96 0.62 2.33 4.81 -1.15 -1.58 114.58 120.77 2oat h GLU 125 Ca 0.06 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 2oat h GLU 125 Cb 0.02 -0.17 0.01 0.00 0.63 0.00 0.00 28.75 29.24 2oat h GLU 125 CO -0.01 0.77 -0.30 -0.92 -0.73 0.00 0.00 179.01 177.83 2oat h TYR 126 N 0.94 -0.77 -0.43 0.92 3.20 -0.99 -2.27 116.97 117.58 2oat h TYR 126 Ca 0.22 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.99 2oat h TYR 126 Cb 0.17 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 2oat h TYR 126 CO 0.01 -0.43 -0.07 0.97 -1.64 0.00 0.00 178.16 177.00 2oat h ILE 127 N -1.08 1.25 -0.38 1.81 2.10 -0.86 -1.18 117.51 119.17 2oat h ILE 127 Ca -0.08 -1.08 -0.12 0.00 1.08 0.00 0.00 64.86 64.65 2oat h ILE 127 Cb 0.68 0.99 -0.01 0.00 -1.09 0.00 0.00 36.82 37.39 2oat h ILE 127 CO 0.14 0.37 -0.25 0.71 -1.08 0.00 0.00 178.15 178.04 2oat h THR 128 N 0.68 1.27 -0.22 2.19 1.35 -1.35 -1.85 112.91 114.98 2oat h THR 128 Ca 0.12 -1.38 -0.16 0.00 -0.55 0.00 0.00 66.41 64.45 2oat h THR 128 Cb 0.52 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 68.19 2oat h THR 128 CO 0.03 0.46 -0.51 0.11 -0.25 0.00 0.00 175.52 175.36 2oat h LYS 129 N 0.67 0.62 -0.11 4.72 1.57 -1.18 0.63 116.57 123.51 2oat h LYS 129 Ca 0.09 -0.37 0.04 0.00 -1.87 0.00 0.00 60.65 58.53 2oat h LYS 129 Cb 0.78 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.07 2oat h LYS 129 CO 0.06 0.98 -0.16 1.25 -0.57 0.00 0.00 179.45 181.02 2oat h LEU 130 N 0.49 -0.49 -1.53 2.94 6.46 -0.92 -3.03 115.31 119.22 2oat h LEU 130 Ca 0.02 0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 2oat h LEU 130 Cb 1.05 0.23 0.00 0.00 -0.73 0.00 0.00 40.66 41.21 2oat h LEU 130 CO 0.10 -0.21 0.00 0.49 -0.62 0.00 0.00 178.44 178.20 2oat n PHE 131 N -5.30 0.08 -3.41 1.25 3.72 -0.72 -5.00 117.46 108.08 2oat n PHE 131 Ca -0.03 -0.04 -0.18 0.00 -0.05 0.00 0.00 57.45 57.15 2oat n PHE 131 Cb 0.22 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.83 2oat n PHE 131 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2oat n ASN 132 N 0.82 -4.54 -4.17 4.37 4.05 0.19 -5.05 115.26 110.93 2oat n ASN 132 Ca 0.17 -0.73 -0.18 0.00 0.45 0.00 0.00 54.58 54.28 2oat n ASN 132 Cb 0.48 -4.84 -0.12 0.00 1.23 0.00 0.00 39.78 36.53 2oat n ASN 132 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 2oat s TYR 133 N -3.43 1.21 0.11 1.20 2.02 -1.06 -5.04 117.35 112.37 2oat s TYR 133 Ca 0.28 -0.46 -0.22 0.00 -0.37 0.00 0.00 57.07 56.30 2oat s TYR 133 Cb -0.05 -0.68 -0.07 0.00 -0.40 0.00 0.00 41.96 40.76 2oat s TYR 133 CO 0.76 0.05 1.71 0.45 -1.57 0.00 0.00 175.55 176.95 2oat h HIS 134 N 4.31 -0.14 -4.17 2.71 3.86 -1.87 -3.42 115.15 116.43 2oat h HIS 134 Ca -0.41 0.01 -0.26 0.00 -1.16 0.00 0.00 60.37 58.56 2oat h HIS 134 Cb 1.19 0.08 -0.15 0.00 1.06 0.00 0.00 27.41 29.59 2oat h HIS 134 CO 0.63 -0.10 -0.64 0.15 0.86 0.00 0.00 177.93 178.84 2oat s LYS 135 N -6.18 1.13 0.06 2.45 1.02 -0.84 -4.95 119.74 112.43 2oat s LYS 135 Ca -0.14 -1.57 0.05 0.00 0.02 0.00 0.00 55.97 54.34 2oat s LYS 135 Cb 0.09 0.02 -0.03 0.00 -0.52 0.00 0.00 37.83 37.39 2oat s LYS 135 CO 0.67 -0.26 -0.15 0.54 -0.92 0.00 0.00 175.35 175.23 2oat s VAL 136 N -3.92 1.21 -0.22 3.17 0.11 -1.26 -2.54 120.40 116.96 2oat s VAL 136 Ca 0.30 -1.20 0.02 0.00 -2.93 0.00 0.00 61.98 58.16 2oat s VAL 136 Cb 0.07 -1.12 0.05 0.00 -1.53 0.00 0.00 36.38 33.85 2oat s VAL 136 CO 0.07 -0.09 -0.12 -0.22 -3.33 0.00 0.00 175.10 171.41 2oat s LEU 137 N -1.49 2.69 -0.01 2.54 1.98 0.16 -4.97 118.68 119.58 2oat s LEU 137 Ca 0.01 -1.05 -0.26 0.00 -2.89 0.00 0.00 54.13 49.94 2oat s LEU 137 Cb -0.09 -1.38 -0.04 0.00 0.66 0.00 0.00 46.19 45.34 2oat s LEU 137 CO 0.02 -0.14 0.81 -2.16 -1.89 0.00 0.00 176.35 172.98 2oat s PRO 138 N 1.28 4.50 0.08 0.98 0.04 -1.26 -1.70 135.00 138.91 2oat s PRO 138 Ca -0.03 1.11 0.01 0.00 0.04 0.00 0.00 61.00 62.13 2oat s PRO 138 Cb -0.17 -3.42 -0.00 0.00 0.04 0.00 0.00 34.50 30.94 2oat s PRO 138 CO -0.08 0.10 0.04 -1.33 0.04 0.00 0.00 177.00 175.77 2oat n MET 139 N 3.49 0.60 -0.04 4.56 2.81 -0.53 -4.26 117.12 123.74 2oat n MET 139 Ca 0.01 -0.68 -0.10 0.00 -1.81 0.00 0.00 57.70 55.12 2oat n MET 139 Cb 0.51 0.43 -0.03 0.00 -0.71 0.00 0.00 33.22 33.42 2oat n MET 139 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2oat n ASN 140 N -2.22 1.03 -4.94 7.83 3.02 -1.26 -1.84 115.26 116.88 2oat n ASN 140 Ca -0.00 0.17 -0.20 0.00 -0.03 0.00 0.00 54.58 54.52 2oat n ASN 140 Cb 0.12 -0.40 -0.02 0.00 -0.61 0.00 0.00 39.78 38.88 2oat n ASN 140 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2oat s THR 141 N -2.27 3.84 0.20 3.41 -4.23 -1.26 -1.70 115.64 113.63 2oat s THR 141 Ca -0.15 -1.13 -0.12 0.00 -1.18 0.00 0.00 61.69 59.12 2oat s THR 141 Cb 0.05 -3.32 0.12 0.00 1.34 0.00 0.00 72.50 70.70 2oat s THR 141 CO 0.20 -0.16 1.87 1.23 -0.54 0.00 0.00 174.62 177.22 2oat h GLY 142 N 1.01 0.95 1.75 3.99 0.00 -1.91 -2.52 103.07 106.34 2oat h GLY 142 Ca -0.45 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 46.47 2oat h GLY 142 CO 0.54 0.34 -0.15 -0.24 0.00 0.00 0.00 176.54 177.04 2oat h VAL 143 N 0.91 1.20 -0.56 4.60 3.04 -1.96 -1.91 116.25 121.57 2oat h VAL 143 Ca 0.25 -0.91 -0.05 0.00 -1.01 0.00 0.00 66.70 64.98 2oat h VAL 143 Cb -0.10 1.23 -0.03 0.00 -2.01 0.00 0.00 31.29 30.39 2oat h VAL 143 CO -0.06 0.29 0.16 -0.33 -1.01 0.00 0.00 177.57 176.62 2oat h GLU 144 N 0.29 0.85 -0.31 4.17 5.08 -1.79 0.93 114.58 123.80 2oat h GLU 144 Ca 0.06 -0.16 -0.13 0.00 -1.00 0.00 0.00 59.36 58.12 2oat h GLU 144 Cb 0.44 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2oat h GLU 144 CO 0.03 0.75 -0.32 0.00 -1.00 0.00 0.00 179.01 178.46 2oat h ALA 145 N 1.35 0.84 -0.57 3.43 0.00 -0.96 -0.80 119.26 122.55 2oat h ALA 145 Ca 0.19 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2oat h ALA 145 Cb 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2oat h ALA 145 CO -0.01 0.64 0.28 0.78 0.00 0.00 0.00 179.25 180.94 2oat h GLY 146 N 0.98 0.87 1.00 0.00 0.00 -0.76 0.04 103.07 105.20 2oat h GLY 146 Ca 0.06 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 2oat h GLY 146 CO 0.07 0.41 0.33 0.83 0.00 0.00 0.00 176.54 178.18 2oat h GLU 147 N 0.77 0.74 -0.58 4.80 4.39 -0.71 -0.29 114.58 123.69 2oat h GLU 147 Ca 0.20 -0.06 0.03 0.00 0.34 0.00 0.00 59.36 59.86 2oat h GLU 147 Cb 0.11 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.57 2oat h GLU 147 CO -0.03 0.53 0.35 1.15 -1.16 0.00 0.00 179.01 179.86 2oat h THR 148 N 0.73 1.07 -0.43 1.13 2.02 -0.88 -1.18 112.91 115.38 2oat h THR 148 Ca 0.20 -0.24 -0.08 0.00 0.77 0.00 0.00 66.41 67.05 2oat h THR 148 Cb -0.03 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 66.67 2oat h THR 148 CO -0.04 0.13 -0.08 0.00 0.37 0.00 0.00 175.52 175.90 2oat h ALA 149 N 1.25 1.06 -0.63 6.16 0.00 -0.34 0.14 119.26 126.91 2oat h ALA 149 Ca 0.23 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2oat h ALA 149 Cb 0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2oat h ALA 149 CO -0.10 0.58 0.16 0.00 0.00 0.00 0.00 179.25 179.89 2oat h LYS 151 N 0.94 0.70 -0.47 0.00 1.57 -0.77 -0.89 116.57 117.66 2oat h LYS 151 Ca 0.20 -0.39 -0.03 0.00 -1.87 0.00 0.00 60.65 58.56 2oat h LYS 151 Cb 0.33 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 2oat h LYS 151 CO -0.00 1.01 0.16 -0.07 -0.57 0.00 0.00 179.45 179.98 2oat h LEU 152 N 0.56 0.68 -0.61 2.94 -0.00 -0.45 -0.56 115.31 117.87 2oat h LEU 152 Ca 0.03 -0.20 -0.05 0.00 -0.00 0.00 0.00 57.88 57.67 2oat h LEU 152 Cb 1.01 -0.18 -0.03 0.00 -0.00 0.00 0.00 40.66 41.46 2oat h LEU 152 CO 0.09 0.69 0.19 0.00 -0.00 0.00 0.00 178.44 179.42 2oat h ALA 153 N 1.01 0.79 0.03 1.53 0.00 -0.80 0.54 119.26 122.37 2oat h ALA 153 Ca 0.15 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2oat h ALA 153 Cb 0.25 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2oat h ALA 153 CO -0.01 0.46 -0.01 0.00 0.00 0.00 0.00 179.25 179.69 2oat h ARG 154 N 0.86 -0.03 -0.61 0.00 3.08 -1.03 0.13 114.38 116.78 2oat h ARG 154 Ca 0.20 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.29 2oat h ARG 154 Cb 0.28 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 2oat h ARG 154 CO -0.01 0.14 0.34 -0.22 -1.07 0.00 0.00 179.97 179.15 2oat h LYS 155 N -0.20 0.63 -0.63 0.04 1.63 -1.02 0.57 116.57 117.59 2oat h LYS 155 Ca -0.00 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.75 2oat h LYS 155 Cb 0.19 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.65 2oat h LYS 155 CO 0.01 0.42 0.37 2.35 -3.45 0.00 0.00 179.45 179.14 2oat h TRP 156 N 0.65 0.84 -0.38 1.91 7.01 -0.82 0.82 115.95 125.98 2oat h TRP 156 Ca 0.26 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.31 2oat h TRP 156 Cb 0.13 -0.27 -0.05 0.00 -2.10 0.00 0.00 29.16 26.86 2oat h TRP 156 CO -0.08 0.58 0.09 0.78 -2.79 0.00 0.00 178.44 177.02 2oat h GLY 157 N 0.85 0.45 0.29 2.65 0.00 0.40 0.52 103.07 108.24 2oat h GLY 157 Ca 0.22 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.49 2oat h GLY 157 CO -0.04 -0.02 -0.10 -0.97 0.00 0.00 0.00 176.54 175.41 2oat h TYR 158 N 0.22 0.10 0.00 5.60 0.05 -0.75 -0.34 116.97 121.85 2oat h TYR 158 Ca 0.18 -0.05 -0.14 0.00 0.05 0.00 0.00 58.73 58.76 2oat h TYR 158 Cb 0.20 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 37.91 2oat h TYR 158 CO -0.18 0.86 -0.77 1.79 -1.05 0.00 0.00 178.16 178.81 2oat h THR 159 N -0.70 1.00 0.00 -2.88 1.35 -0.76 -3.23 112.91 107.69 2oat h THR 159 Ca -0.01 -2.47 -0.15 0.00 -0.55 0.00 0.00 66.41 63.23 2oat h THR 159 Cb 0.89 2.46 -0.02 0.00 -1.73 0.00 0.00 68.15 69.75 2oat h THR 159 CO 0.02 0.57 -1.36 0.52 -0.25 0.00 0.00 175.52 175.02 2oat n VAL 160 N -3.20 0.83 0.20 6.82 0.31 0.17 -4.67 118.33 118.79 2oat n VAL 160 Ca -0.01 -0.05 0.05 0.00 -0.01 0.00 0.00 64.34 64.32 2oat n VAL 160 Cb 0.80 -1.72 0.44 0.00 -0.91 0.00 0.00 33.84 32.44 2oat n VAL 160 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2oat h LYS 161 N -0.43 0.00 0.00 5.55 3.64 -1.11 -3.47 116.57 120.76 2oat h LYS 161 Ca -0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 2oat h LYS 161 Cb 1.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 2oat h LYS 161 CO -0.14 0.30 0.00 0.41 -2.27 0.00 0.00 179.45 177.75 2oat n GLY 162 N -0.59 0.93 3.77 5.01 0.00 -0.36 -5.00 105.19 108.96 2oat n GLY 162 Ca -0.02 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 2oat n GLY 162 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oat s ILE 163 N -2.00 2.49 0.21 -0.61 1.01 -0.28 -4.96 121.20 117.06 2oat s ILE 163 Ca 0.00 0.49 -0.30 0.00 0.00 0.00 0.00 60.65 60.84 2oat s ILE 163 Cb 0.00 -3.31 -0.09 0.00 0.01 0.00 0.00 42.46 39.08 2oat s ILE 163 CO 0.00 0.11 1.24 -1.58 0.00 0.00 0.00 174.94 174.71 2oat s GLN 164 N -1.93 4.46 0.10 2.79 0.74 -1.26 -4.39 119.66 120.16 2oat s GLN 164 Ca 0.51 1.96 -0.31 0.00 0.05 0.00 0.00 55.36 57.56 2oat s GLN 164 Cb -0.42 -3.21 -0.07 0.00 1.10 0.00 0.00 33.01 30.41 2oat s GLN 164 CO 0.56 -0.13 1.35 0.15 -0.55 0.00 0.00 175.29 176.67 2oat s LYS 165 N -0.41 4.34 -0.65 1.67 1.02 -1.26 0.07 119.74 124.52 2oat s LYS 165 Ca 0.53 2.00 0.05 0.00 0.02 0.00 0.00 55.97 58.58 2oat s LYS 165 Cb -0.34 -3.28 0.27 0.00 -0.52 0.00 0.00 37.83 33.95 2oat s LYS 165 CO 0.39 -0.40 0.82 0.66 -0.92 0.00 0.00 175.35 175.89 2oat n TYR 166 N 4.00 3.68 0.30 3.18 4.01 -1.26 -5.06 117.16 126.01 2oat n TYR 166 Ca 0.11 -4.06 0.10 0.00 -0.16 0.00 0.00 57.90 53.89 2oat n TYR 166 Cb 0.43 -0.58 0.26 0.00 -0.31 0.00 0.00 39.34 39.15 2oat n TYR 166 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2oat n LYS 167 N 0.66 2.32 -2.21 -0.72 5.02 0.11 -4.98 118.16 118.36 2oat n LYS 167 Ca 0.30 -2.04 -0.41 0.00 -2.02 0.00 0.00 58.31 54.15 2oat n LYS 167 Cb 0.40 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.92 2oat n LYS 167 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2oat s ALA 168 N -1.34 3.48 0.13 7.82 0.00 -1.26 -4.81 121.76 125.78 2oat s ALA 168 Ca 0.38 1.16 0.08 0.00 0.00 0.00 0.00 51.96 53.59 2oat s ALA 168 Cb 0.21 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 2oat s ALA 168 CO 0.28 -0.51 -0.12 0.15 0.00 0.00 0.00 175.76 175.56 2oat s LYS 169 N -1.64 2.03 -0.08 0.00 -0.14 0.28 -4.74 119.74 115.46 2oat s LYS 169 Ca 0.48 -1.13 0.03 0.00 -1.36 0.00 0.00 55.97 53.99 2oat s LYS 169 Cb -0.38 -2.22 0.01 0.00 -1.68 0.00 0.00 37.83 33.56 2oat s LYS 169 CO 0.49 0.48 -0.16 0.42 -0.76 0.00 0.00 175.35 175.82 2oat s ILE 170 N -1.33 1.45 -0.05 2.17 1.01 -0.07 -0.03 121.20 124.36 2oat s ILE 170 Ca 0.22 -0.66 -0.06 0.00 0.00 0.00 0.00 60.65 60.14 2oat s ILE 170 Cb -0.10 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 2oat s ILE 170 CO 0.13 0.43 0.20 -0.69 0.00 0.00 0.00 174.94 175.01 2oat s VAL 171 N 0.58 5.41 0.18 2.92 1.01 0.13 -0.82 120.40 129.81 2oat s VAL 171 Ca -0.16 0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.01 2oat s VAL 171 Cb -0.16 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2oat s VAL 171 CO 0.05 0.48 -0.08 -0.36 0.00 0.00 0.00 175.10 175.19 2oat s PHE 172 N -1.18 1.43 -0.16 5.22 0.40 0.24 -1.01 117.98 122.93 2oat s PHE 172 Ca 0.22 -0.78 -0.10 0.00 -0.60 0.00 0.00 56.93 55.67 2oat s PHE 172 Cb -0.13 -0.75 -0.05 0.00 0.51 0.00 0.00 43.02 42.60 2oat s PHE 172 CO 0.11 0.10 0.17 0.00 0.70 0.00 0.00 175.22 176.30 2oat s ALA 173 N -3.29 3.74 0.33 5.36 0.00 -1.25 -1.40 121.76 125.24 2oat s ALA 173 Ca 0.21 -0.61 -0.27 0.00 0.00 0.00 0.00 51.96 51.29 2oat s ALA 173 Cb 0.03 -2.15 -0.13 0.00 0.00 0.00 0.00 23.12 20.87 2oat s ALA 173 CO 0.04 0.31 1.03 0.00 0.00 0.00 0.00 175.76 177.15 2oat n ALA 174 N 2.95 0.04 -0.18 0.00 0.00 0.15 -0.75 120.51 122.71 2oat n ALA 174 Ca -0.17 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2oat n ALA 174 Cb 0.53 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.92 2oat n ALA 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oat n GLY 175 N 1.16 1.36 3.72 0.00 0.00 -1.26 -4.18 105.19 105.99 2oat n GLY 175 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 2oat n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oat s ASN 176 N -3.06 4.16 -0.09 1.61 2.20 0.07 -4.21 114.94 115.61 2oat s ASN 176 Ca 0.00 2.41 -0.04 0.00 -0.94 0.00 0.00 52.86 54.29 2oat s ASN 176 Cb 0.00 -2.59 0.05 0.00 -2.00 0.00 0.00 41.25 36.70 2oat s ASN 176 CO 0.00 -2.29 0.19 0.12 -2.94 0.00 0.00 177.10 172.18 2oat s PHE 177 N -1.91 -0.26 0.00 1.54 2.19 -1.26 -4.67 117.98 113.61 2oat s PHE 177 Ca 0.76 0.70 0.00 0.00 0.33 0.00 0.00 56.93 58.71 2oat s PHE 177 Cb -0.31 -0.12 0.00 0.00 -1.31 0.00 0.00 43.02 41.28 2oat s PHE 177 CO 0.45 -0.26 0.91 -2.67 1.83 0.00 0.00 175.22 175.48 2oat n TRP 178 N 4.91 0.00 0.00 10.12 4.27 -1.26 -4.94 117.44 130.54 2oat n TRP 178 Ca -0.13 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.48 2oat n TRP 178 Cb 0.51 -0.04 0.00 0.00 -1.36 0.00 0.00 31.31 30.42 2oat n TRP 178 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2oat n GLY 179 N 0.00 0.61 0.00 -1.67 0.00 -1.26 -3.79 105.19 99.09 2oat n GLY 179 Ca 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.89 2oat n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oat n ARG 180 N -0.16 2.21 -0.92 1.61 5.12 -1.26 -4.34 116.66 118.91 2oat n ARG 180 Ca 0.00 -1.27 -0.29 0.00 -1.93 0.00 0.00 57.85 54.35 2oat n ARG 180 Cb 0.00 -0.96 0.19 0.00 -1.16 0.00 0.00 32.46 30.53 2oat n ARG 180 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2oat s THR 181 N -0.78 2.24 0.29 0.55 -4.23 -1.26 -4.77 115.64 107.67 2oat s THR 181 Ca 0.00 0.08 -0.02 0.00 -1.18 0.00 0.00 61.69 60.57 2oat s THR 181 Cb 0.00 -2.37 0.27 0.00 1.34 0.00 0.00 72.50 71.74 2oat s THR 181 CO 0.00 -0.10 1.93 -0.07 -0.54 0.00 0.00 174.62 175.84 2oat h LEU 182 N -2.04 0.98 -0.32 4.79 4.07 -1.96 -1.72 115.31 119.11 2oat h LEU 182 Ca -0.54 -0.01 -0.09 0.00 0.08 0.00 0.00 57.88 57.32 2oat h LEU 182 Cb 1.31 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.82 2oat h LEU 182 CO 0.53 0.67 -0.15 0.28 -1.08 0.00 0.00 178.44 178.69 2oat h SER 183 N 1.14 0.70 -0.72 -0.43 0.02 -1.98 -2.67 113.55 109.60 2oat h SER 183 Ca 0.37 -0.40 -0.06 0.00 -0.84 0.00 0.00 61.79 60.86 2oat h SER 183 Cb 0.03 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 2oat h SER 183 CO -0.11 0.95 0.23 0.00 -1.14 0.00 0.00 176.83 176.75 2oat h ALA 184 N 0.77 0.94 0.00 3.77 0.00 -1.70 -2.49 119.26 120.55 2oat h ALA 184 Ca 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2oat h ALA 184 Cb 0.68 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2oat h ALA 184 CO 0.05 0.62 0.00 -0.84 0.00 0.00 0.00 179.25 179.07 2oat h ILE 185 N 1.06 0.00 0.00 0.00 3.07 -1.38 -2.85 117.51 117.40 2oat h ILE 185 Ca 0.23 -0.54 -0.03 0.00 1.55 0.00 0.00 64.86 66.07 2oat h ILE 185 Cb 0.30 1.48 -0.00 0.00 -0.27 0.00 0.00 36.82 38.32 2oat h ILE 185 CO -0.01 0.00 -0.12 0.28 -1.05 0.00 0.00 178.15 177.25 2oat h SER 186 N 0.00 0.00 0.01 2.16 0.02 -1.08 -2.87 113.55 111.80 2oat h SER 186 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2oat h SER 186 Cb 0.66 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.20 2oat h SER 186 CO 0.00 0.12 -0.35 -1.54 -1.14 0.00 0.00 176.83 173.92 2oat n SER 187 N -3.36 2.06 -4.79 3.07 3.41 -1.08 -4.88 113.62 108.05 2oat n SER 187 Ca -0.01 -1.52 -0.35 0.00 -0.26 0.00 0.00 58.87 56.73 2oat n SER 187 Cb 0.32 0.34 -0.04 0.00 -0.26 0.00 0.00 64.21 64.57 2oat n SER 187 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2oat s SER 188 N -2.38 6.48 -0.02 4.04 0.15 -1.08 -4.81 113.70 116.08 2oat s SER 188 Ca 0.22 1.98 0.15 0.00 0.70 0.00 0.00 55.95 59.00 2oat s SER 188 Cb 0.19 -2.57 0.45 0.00 -1.71 0.00 0.00 66.02 62.37 2oat s SER 188 CO 0.51 -0.68 1.37 0.35 1.20 0.00 0.00 173.24 175.99 2oat n THR 189 N -0.63 1.11 -3.35 6.45 -2.24 -1.26 -4.90 114.28 109.45 2oat n THR 189 Ca 0.08 -1.05 -0.43 0.00 -2.27 0.00 0.00 64.05 60.38 2oat n THR 189 Cb 0.51 0.44 -0.09 0.00 -2.10 0.00 0.00 70.33 69.10 2oat n THR 189 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2oat s ASP 190 N -1.04 6.18 0.42 3.42 -1.08 -1.26 -4.95 116.67 118.37 2oat s ASP 190 Ca 0.34 -0.63 0.20 0.00 -0.52 0.00 0.00 52.55 51.94 2oat s ASP 190 Cb 0.19 -2.21 1.15 0.00 -1.46 0.00 0.00 42.92 40.59 2oat s ASP 190 CO 0.21 -0.53 1.81 -0.65 0.52 0.00 0.00 175.17 176.54 2oat h PRO 191 N 8.67 0.34 0.00 4.34 0.11 -1.99 0.60 132.00 144.08 2oat h PRO 191 Ca -0.27 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 2oat h PRO 191 Cb 1.12 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 2oat h PRO 191 CO 0.77 0.22 -0.16 1.15 -0.21 0.00 0.00 178.00 179.77 2oat h THR 192 N 0.35 1.08 -0.04 -1.15 2.02 -1.93 0.19 112.91 113.43 2oat h THR 192 Ca 0.53 -0.56 -0.20 0.00 0.77 0.00 0.00 66.41 66.95 2oat h THR 192 Cb 1.45 1.31 0.01 0.00 -1.74 0.00 0.00 68.15 69.18 2oat h THR 192 CO -0.21 0.16 -0.77 0.28 0.37 0.00 0.00 175.52 175.35 2oat h SER 193 N 0.00 0.74 0.00 4.18 0.02 -1.27 -3.40 113.55 113.82 2oat h SER 193 Ca -0.00 -0.72 -0.08 0.00 -0.84 0.00 0.00 61.79 60.15 2oat h SER 193 Cb 0.29 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 2oat h SER 193 CO 0.02 1.36 -1.76 0.00 -1.14 0.00 0.00 176.83 175.30 2oat n TYR 194 N -4.05 0.00 -1.74 3.45 0.18 -1.10 -4.86 117.16 109.04 2oat n TYR 194 Ca -0.10 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.26 2oat n TYR 194 Cb 0.75 -0.45 -0.03 0.00 -0.38 0.00 0.00 39.34 39.23 2oat n TYR 194 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2oat s ASP 195 N -4.02 6.41 0.00 9.48 -1.08 0.65 -1.82 116.67 126.29 2oat s ASP 195 Ca -0.06 2.81 0.00 0.00 -0.52 0.00 0.00 52.55 54.79 2oat s ASP 195 Cb 0.08 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.95 2oat s ASP 195 CO 0.60 -0.97 0.00 0.61 0.52 0.00 0.00 175.17 175.93 2oat n GLY 196 N 4.05 0.67 0.00 2.66 0.00 -1.26 -4.91 105.19 106.41 2oat n GLY 196 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2oat n GLY 196 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2oat n PHE 197 N -2.63 0.00 -2.12 1.61 3.72 -0.76 -5.06 117.46 112.23 2oat n PHE 197 Ca 0.00 -0.36 -0.28 0.00 -0.05 0.00 0.00 57.45 56.75 2oat n PHE 197 Cb 0.00 -0.04 0.17 0.00 -0.94 0.00 0.00 39.48 38.68 2oat n PHE 197 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2oat s GLY 198 N -0.73 1.79 0.78 1.37 0.00 -1.26 -4.85 107.32 104.41 2oat s GLY 198 Ca 0.00 -1.39 -0.12 0.00 0.00 0.00 0.00 44.72 43.21 2oat s GLY 198 CO 0.00 -0.66 1.13 2.56 0.00 0.00 0.00 173.10 176.14 2oat s PRO 199 N -5.71 2.03 0.25 2.90 0.04 -1.26 -5.17 135.00 128.07 2oat s PRO 199 Ca 0.73 1.43 0.07 0.00 0.04 0.00 0.00 61.00 63.26 2oat s PRO 199 Cb -0.04 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 2oat s PRO 199 CO 0.51 -1.85 0.23 -0.06 0.04 0.00 0.00 177.00 175.87 2oat s PHE 200 N -2.54 3.18 0.07 0.56 0.08 -1.26 -5.05 117.98 113.01 2oat s PHE 200 Ca 0.66 -0.09 -0.31 0.00 0.12 0.00 0.00 56.93 57.32 2oat s PHE 200 Cb -0.22 -1.43 -0.09 0.00 -0.57 0.00 0.00 43.02 40.71 2oat s PHE 200 CO 0.51 0.51 1.72 1.41 -0.10 0.00 0.00 175.22 179.27 2oat s MET 201 N -3.87 4.18 0.81 0.44 -2.45 -1.26 -5.00 119.30 112.14 2oat s MET 201 Ca 0.33 2.41 -0.12 0.00 -1.25 0.00 0.00 55.69 57.06 2oat s MET 201 Cb -0.08 -3.68 0.07 0.00 1.25 0.00 0.00 34.83 32.39 2oat s MET 201 CO 0.26 -0.79 1.10 -1.25 1.05 0.00 0.00 175.02 175.39 2oat s PRO 202 N 2.95 2.01 0.00 4.11 0.04 -1.26 -4.22 135.00 138.64 2oat s PRO 202 Ca 0.77 0.60 0.00 0.00 0.04 0.00 0.00 61.00 62.41 2oat s PRO 202 Cb -0.41 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.22 2oat s PRO 202 CO 0.34 -1.66 0.00 0.41 0.04 0.00 0.00 177.00 176.13 2oat n GLY 203 N -2.14 0.64 3.18 0.56 0.00 -1.26 -5.01 105.19 101.17 2oat n GLY 203 Ca 0.07 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2oat n GLY 203 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oat s PHE 204 N -2.00 3.03 0.13 1.61 0.40 -1.26 -0.89 117.98 119.00 2oat s PHE 204 Ca 0.00 -1.60 0.06 0.00 -0.60 0.00 0.00 56.93 54.80 2oat s PHE 204 Cb 0.00 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.46 2oat s PHE 204 CO 0.00 -0.74 -0.03 -0.51 0.70 0.00 0.00 175.22 174.64 2oat s ASP 205 N 1.31 4.75 -0.03 1.36 1.01 -0.00 -4.97 116.67 120.09 2oat s ASP 205 Ca 0.01 -0.32 0.05 0.00 0.71 0.00 0.00 52.55 52.99 2oat s ASP 205 Cb -0.16 -1.02 -0.01 0.00 1.01 0.00 0.00 42.92 42.74 2oat s ASP 205 CO -0.06 0.14 -0.17 -0.63 0.21 0.00 0.00 175.17 174.66 2oat s ILE 206 N -1.45 1.41 0.17 0.77 1.01 -1.26 -0.59 121.20 121.27 2oat s ILE 206 Ca 0.25 -0.72 0.06 0.00 0.00 0.00 0.00 60.65 60.24 2oat s ILE 206 Cb -0.11 -1.20 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 2oat s ILE 206 CO 0.17 0.41 -0.13 0.27 0.00 0.00 0.00 174.94 175.65 2oat s ILE 207 N -0.08 1.51 0.76 2.92 -4.36 -0.50 -4.93 121.20 116.52 2oat s ILE 207 Ca -0.01 -2.08 -0.15 0.00 -0.26 0.00 0.00 60.65 58.15 2oat s ILE 207 Cb -0.10 -1.90 0.04 0.00 1.25 0.00 0.00 42.46 41.76 2oat s ILE 207 CO 0.01 -0.60 1.15 -2.65 0.24 0.00 0.00 174.94 173.09 2oat n PRO 208 N -0.16 0.45 -1.78 0.37 -0.02 -1.26 0.30 135.00 132.90 2oat n PRO 208 Ca -0.10 0.22 -0.31 0.00 -2.02 0.00 0.00 63.50 61.29 2oat n PRO 208 Cb 0.60 -2.40 0.03 0.00 -0.02 0.00 0.00 33.50 31.71 2oat n PRO 208 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2oat s TYR 209 N -1.90 3.40 -1.53 6.00 5.04 -1.26 -4.21 117.35 122.90 2oat s TYR 209 Ca 0.75 1.27 -0.10 0.00 -2.44 0.00 0.00 57.07 56.55 2oat s TYR 209 Cb -0.32 -2.85 0.08 0.00 0.35 0.00 0.00 41.96 39.22 2oat s TYR 209 CO 0.49 -0.98 0.75 -1.71 -1.34 0.00 0.00 175.55 172.76 2oat n ASN 210 N -2.93 -2.76 -3.49 4.32 5.15 -1.26 -4.93 115.26 109.36 2oat n ASN 210 Ca 0.07 -0.92 -0.27 0.00 -0.60 0.00 0.00 54.58 52.86 2oat n ASN 210 Cb 0.55 -3.34 -0.13 0.00 -0.53 0.00 0.00 39.78 36.33 2oat n ASN 210 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2oat s ASP 211 N -3.70 3.02 0.10 1.20 -1.08 -1.26 -4.90 116.67 110.06 2oat s ASP 211 Ca 0.44 -1.60 -0.14 0.00 -0.52 0.00 0.00 52.55 50.73 2oat s ASP 211 Cb -0.23 -0.24 -0.10 0.00 -1.46 0.00 0.00 42.92 40.89 2oat s ASP 211 CO 0.87 -0.38 1.39 -0.07 0.52 0.00 0.00 175.17 177.51 2oat h LEU 212 N 7.79 0.83 -1.01 -1.34 4.07 -1.93 -2.48 115.31 121.24 2oat h LEU 212 Ca -0.08 -0.51 0.04 0.00 0.08 0.00 0.00 57.88 57.40 2oat h LEU 212 Cb 1.00 -0.24 -0.06 0.00 1.08 0.00 0.00 40.66 42.45 2oat h LEU 212 CO 0.35 1.19 0.66 -0.65 -1.08 0.00 0.00 178.44 178.90 2oat h PRO 213 N 0.51 1.24 -0.49 1.13 0.11 -1.99 0.45 132.00 132.96 2oat h PRO 213 Ca 0.03 -0.07 -0.13 0.00 0.11 0.00 0.00 66.00 65.93 2oat h PRO 213 Cb 1.01 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 31.83 2oat h PRO 213 CO 0.10 0.82 -0.21 0.00 -0.21 0.00 0.00 178.00 178.50 2oat h ALA 214 N 1.41 0.70 -0.15 -0.75 0.00 -1.93 -1.68 119.26 116.86 2oat h ALA 214 Ca 0.40 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2oat h ALA 214 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2oat h ALA 214 CO -0.12 0.68 0.04 1.25 0.00 0.00 0.00 179.25 181.09 2oat h LEU 215 N 0.87 0.23 -0.89 0.00 6.46 -0.96 -1.31 115.31 119.71 2oat h LEU 215 Ca 0.11 -0.22 0.11 0.00 -0.12 0.00 0.00 57.88 57.76 2oat h LEU 215 Cb 0.79 -0.06 -0.08 0.00 -0.73 0.00 0.00 40.66 40.58 2oat h LEU 215 CO 0.07 0.40 0.52 -0.08 -0.62 0.00 0.00 178.44 178.72 2oat h GLU 216 N 0.06 0.81 -0.46 1.25 4.81 -0.87 0.17 114.58 120.35 2oat h GLU 216 Ca 0.05 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2oat h GLU 216 Cb 0.25 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2oat h GLU 216 CO 0.00 0.54 0.06 -0.09 -0.73 0.00 0.00 179.01 178.78 2oat h ARG 217 N 0.84 0.77 -0.46 1.92 2.43 -1.08 -3.13 114.38 115.66 2oat h ARG 217 Ca 0.44 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 59.31 2oat h ARG 217 Cb 0.44 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 2oat h ARG 217 CO -0.27 0.80 -0.05 0.00 -1.51 0.00 0.00 179.97 178.94 2oat h ALA 218 N 0.94 1.05 0.00 2.80 0.00 -0.24 -3.05 119.26 120.76 2oat h ALA 218 Ca 0.14 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2oat h ALA 218 Cb 0.41 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2oat h ALA 218 CO 0.01 0.59 0.00 1.28 0.00 0.00 0.00 179.25 181.13 2oat n LEU 219 N -4.19 0.00 0.27 0.00 4.77 -0.05 -2.87 117.00 114.94 2oat n LEU 219 Ca 0.02 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.17 2oat n LEU 219 Cb 0.33 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 42.11 2oat n LEU 219 CO 0.42 0.00 0.99 1.56 -1.33 0.00 0.00 177.39 179.03 2oat h GLN 220 N 0.00 0.00 -5.88 3.23 1.08 -1.56 -3.42 115.11 108.56 2oat h GLN 220 Ca 0.00 0.00 -0.60 0.00 -1.45 0.00 0.00 58.65 56.60 2oat h GLN 220 Cb 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.34 2oat h GLN 220 CO 0.00 0.00 0.51 0.34 -0.95 0.00 0.00 178.83 178.73 2oat s ASP 221 N -5.58 6.77 0.01 1.46 -1.08 -1.14 -4.91 116.67 112.20 2oat s ASP 221 Ca 0.01 0.86 0.13 0.00 -0.52 0.00 0.00 52.55 53.02 2oat s ASP 221 Cb 0.09 -2.44 0.54 0.00 -1.46 0.00 0.00 42.92 39.65 2oat s ASP 221 CO 0.53 -0.64 1.41 -0.81 0.52 0.00 0.00 175.17 176.18 2oat n PRO 222 N 6.28 0.01 0.00 4.34 -0.04 -1.26 -1.67 135.00 142.65 2oat n PRO 222 Ca 0.06 0.29 0.15 0.00 -0.04 0.00 0.00 63.50 63.96 2oat n PRO 222 Cb 0.48 -1.51 0.76 0.00 -0.04 0.00 0.00 33.50 33.18 2oat n PRO 222 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2oat n ASN 223 N -1.52 0.06 -4.69 3.54 3.02 -1.26 -4.75 115.26 109.65 2oat n ASN 223 Ca 0.03 -0.27 -0.42 0.00 -0.03 0.00 0.00 54.58 53.89 2oat n ASN 223 Cb 0.15 -0.23 -0.03 0.00 -0.61 0.00 0.00 39.78 39.06 2oat n ASN 223 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2oat s VAL 224 N -2.51 4.13 -0.16 2.41 1.01 -0.67 -0.55 120.40 124.05 2oat s VAL 224 Ca 0.30 1.48 0.15 0.00 0.00 0.00 0.00 61.98 63.91 2oat s VAL 224 Cb 0.20 -3.95 -0.24 0.00 0.00 0.00 0.00 36.38 32.39 2oat s VAL 224 CO 0.46 0.02 0.22 0.00 0.00 0.00 0.00 175.10 175.80 2oat n ALA 225 N 4.96 1.48 -3.45 5.51 0.00 0.96 -4.80 120.51 125.17 2oat n ALA 225 Ca 0.11 -1.15 -0.10 0.00 0.00 0.00 0.00 53.44 52.30 2oat n ALA 225 Cb 0.46 -0.37 -0.03 0.00 0.00 0.00 0.00 19.45 19.51 2oat n ALA 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oat s ALA 226 N -2.52 -1.29 -0.12 0.00 0.00 -1.22 -0.96 121.76 115.65 2oat s ALA 226 Ca -0.11 0.09 0.01 0.00 0.00 0.00 0.00 51.96 51.95 2oat s ALA 226 Cb 0.07 0.86 0.02 0.00 0.00 0.00 0.00 23.12 24.07 2oat s ALA 226 CO 0.81 -0.83 -0.12 0.12 0.00 0.00 0.00 175.76 175.74 2oat s PHE 227 N -3.82 1.83 -0.12 0.00 5.36 -0.04 -0.69 117.98 120.50 2oat s PHE 227 Ca 0.05 -0.93 -0.03 0.00 -0.96 0.00 0.00 56.93 55.07 2oat s PHE 227 Cb -0.02 -1.39 -0.03 0.00 -0.34 0.00 0.00 43.02 41.24 2oat s PHE 227 CO -0.06 -0.54 -0.01 1.41 -1.46 0.00 0.00 175.22 174.56 2oat s MET 228 N 1.36 3.31 -0.04 10.12 -2.45 -0.18 -0.92 119.30 130.50 2oat s MET 228 Ca 0.00 -0.45 -0.28 0.00 -1.25 0.00 0.00 55.69 53.71 2oat s MET 228 Cb -0.13 -2.86 0.06 0.00 1.25 0.00 0.00 34.83 33.14 2oat s MET 228 CO -0.06 0.49 0.60 0.54 1.05 0.00 0.00 175.02 177.64 2oat s VAL 229 N -0.30 0.01 -0.09 10.11 0.11 -0.32 -3.91 120.40 126.02 2oat s VAL 229 Ca 0.06 -0.10 -0.17 0.00 -2.93 0.00 0.00 61.98 58.84 2oat s VAL 229 Cb -0.12 -0.93 -0.05 0.00 -1.53 0.00 0.00 36.38 33.75 2oat s VAL 229 CO 0.02 -0.05 0.45 -1.61 -3.33 0.00 0.00 175.10 170.58 2oat s GLU 230 N -1.27 4.24 0.55 1.54 2.02 -1.26 -1.08 118.70 123.45 2oat s GLU 230 Ca -0.11 0.43 0.23 0.00 0.02 0.00 0.00 54.97 55.54 2oat s GLU 230 Cb -0.01 -3.38 1.53 0.00 0.10 0.00 0.00 34.13 32.37 2oat s GLU 230 CO 0.08 0.30 2.18 -1.35 0.02 0.00 0.00 175.26 176.49 2oat h PRO 231 N 6.18 0.00 -3.07 0.39 0.11 -1.96 -3.37 132.00 130.29 2oat h PRO 231 Ca -0.44 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.41 2oat h PRO 231 Cb 1.19 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 31.96 2oat h PRO 231 CO 0.72 0.00 -0.60 0.42 -0.21 0.00 0.00 178.00 178.33 2oat s ILE 232 N -4.86 -0.24 -0.16 4.15 1.01 -1.26 -4.43 121.20 115.42 2oat s ILE 232 Ca -0.05 0.29 -0.29 0.00 0.00 0.00 0.00 60.65 60.60 2oat s ILE 232 Cb 0.16 -0.32 -0.01 0.00 0.01 0.00 0.00 42.46 42.30 2oat s ILE 232 CO 0.61 0.12 1.15 -1.10 0.00 0.00 0.00 174.94 175.73 2oat s GLN 233 N 2.04 4.29 0.00 2.79 -0.21 -0.58 -4.85 119.66 123.14 2oat s GLN 233 Ca -0.01 1.54 0.00 0.00 0.02 0.00 0.00 55.36 56.91 2oat s GLN 233 Cb -0.12 -3.66 0.00 0.00 1.00 0.00 0.00 33.01 30.23 2oat s GLN 233 CO -0.07 -0.58 0.20 0.41 -2.12 0.00 0.00 175.29 173.13 2oat n GLY 234 N 3.41 -0.54 0.30 3.09 0.00 -1.26 -1.12 105.19 109.08 2oat n GLY 234 Ca 0.12 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.28 2oat n GLY 234 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2oat h GLU 235 N 0.00 0.00 0.00 1.61 4.39 -1.92 0.39 114.58 119.05 2oat h GLU 235 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2oat h GLU 235 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2oat h GLU 235 CO 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.85 2oat n ALA 236 N -2.39 1.64 0.00 3.43 0.00 -1.26 -4.82 120.51 117.12 2oat n ALA 236 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2oat n ALA 236 Cb 0.16 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.39 2oat n ALA 236 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oat n GLY 237 N -0.10 1.29 3.44 0.00 0.00 0.05 -4.76 105.19 105.10 2oat n GLY 237 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 2oat n GLY 237 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2oat n VAL 238 N -0.04 -7.41 -2.98 1.61 0.31 -0.48 -4.88 118.33 104.45 2oat n VAL 238 Ca 0.00 -1.06 -0.43 0.00 -0.01 0.00 0.00 64.34 62.84 2oat n VAL 238 Cb 0.00 -5.46 -0.05 0.00 -0.91 0.00 0.00 33.84 27.41 2oat n VAL 238 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2oat s VAL 239 N -3.44 4.69 -0.22 2.52 1.01 -0.27 -4.62 120.40 120.06 2oat s VAL 239 Ca 0.36 0.52 -0.18 0.00 0.00 0.00 0.00 61.98 62.69 2oat s VAL 239 Cb -0.08 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2oat s VAL 239 CO 0.78 -0.63 0.49 -0.69 0.00 0.00 0.00 175.10 175.05 2oat s VAL 240 N 3.20 5.12 0.81 2.92 1.01 -1.26 -1.52 120.40 130.67 2oat s VAL 240 Ca 0.30 0.88 -0.12 0.00 0.00 0.00 0.00 61.98 63.04 2oat s VAL 240 Cb -0.13 -3.81 0.08 0.00 0.00 0.00 0.00 36.38 32.52 2oat s VAL 240 CO 0.21 0.17 1.11 -2.16 0.00 0.00 0.00 175.10 174.43 2oat s PRO 241 N 1.76 1.99 0.59 2.72 0.04 -1.26 -5.00 135.00 135.83 2oat s PRO 241 Ca 0.22 0.49 -0.17 0.00 0.04 0.00 0.00 61.00 61.58 2oat s PRO 241 Cb -0.15 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 2oat s PRO 241 CO 0.09 -1.65 1.09 -0.51 0.04 0.00 0.00 177.00 176.06 2oat s ASP 242 N -4.06 5.62 0.20 6.66 1.01 -1.26 -4.91 116.67 119.92 2oat s ASP 242 Ca 0.61 2.00 -0.32 0.00 0.71 0.00 0.00 52.55 55.55 2oat s ASP 242 Cb -0.14 -2.56 -0.15 0.00 1.01 0.00 0.00 42.92 41.09 2oat s ASP 242 CO 0.53 -1.28 1.31 -2.65 0.21 0.00 0.00 175.17 173.29 2oat n PRO 243 N -1.79 1.63 0.00 8.23 -0.02 -1.26 -1.21 135.00 140.58 2oat n PRO 243 Ca 0.10 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2oat n PRO 243 Cb 0.52 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2oat n PRO 243 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oat n GLY 244 N 2.18 2.98 0.18 -1.23 0.00 -1.26 -4.94 105.19 103.10 2oat n GLY 244 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 2oat n GLY 244 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2oat h TYR 245 N 0.00 -0.34 -0.54 1.61 3.20 -1.51 -1.11 116.97 118.28 2oat h TYR 245 Ca 0.00 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.90 2oat h TYR 245 Cb 0.00 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 2oat h TYR 245 CO 0.00 -0.20 0.34 -0.07 -1.64 0.00 0.00 178.16 176.59 2oat h LEU 246 N -0.23 0.56 -0.53 2.82 3.38 -1.92 0.11 115.31 119.50 2oat h LEU 246 Ca 0.05 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2oat h LEU 246 Cb 0.28 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2oat h LEU 246 CO -0.13 0.40 0.35 -0.03 0.09 0.00 0.00 178.44 179.11 2oat h MET 247 N 0.67 0.68 -0.70 1.13 4.05 -1.86 -0.21 114.93 118.69 2oat h MET 247 Ca 0.21 -0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.54 2oat h MET 247 Cb -0.01 -0.15 -0.03 0.00 -0.80 0.00 0.00 31.60 30.60 2oat h MET 247 CO -0.08 0.45 0.23 0.78 0.23 0.00 0.00 176.91 178.52 2oat h GLY 248 N 0.70 1.16 0.95 1.39 0.00 -0.65 -0.08 103.07 106.54 2oat h GLY 248 Ca 0.20 -0.67 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2oat h GLY 248 CO -0.05 0.63 0.14 -2.08 0.00 0.00 0.00 176.54 175.17 2oat h VAL 249 N 1.04 1.12 -0.22 4.60 2.07 -0.35 -1.02 116.25 123.50 2oat h VAL 249 Ca 0.23 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.45 2oat h VAL 249 Cb 0.28 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2oat h VAL 249 CO -0.01 0.12 0.10 -0.09 0.02 0.00 0.00 177.57 177.70 2oat h ARG 250 N 0.30 0.21 -0.02 1.57 9.65 -0.81 -0.74 114.38 124.54 2oat h ARG 250 Ca 0.09 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 2oat h ARG 250 Cb 0.06 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 28.60 2oat h ARG 250 CO -0.01 0.14 0.00 1.49 2.80 0.00 0.00 179.97 184.39 2oat h GLU 251 N 0.21 0.01 -0.60 0.20 4.81 -0.85 -1.61 114.58 116.75 2oat h GLU 251 Ca 0.09 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2oat h GLU 251 Cb 0.03 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 2oat h GLU 251 CO -0.07 0.01 0.29 -0.07 -0.73 0.00 0.00 179.01 178.44 2oat h LEU 252 N 0.01 0.79 -0.43 1.64 4.07 -1.04 -0.84 115.31 119.50 2oat h LEU 252 Ca 0.01 -0.13 -0.01 0.00 0.08 0.00 0.00 57.88 57.83 2oat h LEU 252 Cb 0.00 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.52 2oat h LEU 252 CO -0.01 0.69 0.23 0.00 -1.08 0.00 0.00 178.44 178.27 2oat h THR 254 N 0.56 1.22 -0.68 0.00 2.02 -1.18 -0.19 112.91 114.66 2oat h THR 254 Ca 0.15 -0.74 0.04 0.00 0.77 0.00 0.00 66.41 66.63 2oat h THR 254 Cb 0.06 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.30 2oat h THR 254 CO -0.02 0.27 0.41 -0.09 0.37 0.00 0.00 175.52 176.45 2oat h ARG 255 N 0.57 0.77 -0.64 6.66 2.43 -0.98 -2.82 114.38 120.38 2oat h ARG 255 Ca 0.14 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2oat h ARG 255 Cb 0.27 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2oat h ARG 255 CO -0.00 0.51 0.00 0.72 -1.51 0.00 0.00 179.97 179.68 2oat n HIS 256 N -4.71 1.63 -3.59 2.20 8.25 -0.66 -4.96 115.22 113.38 2oat n HIS 256 Ca 0.08 -0.61 -0.21 0.00 -0.26 0.00 0.00 57.72 56.71 2oat n HIS 256 Cb 0.11 -0.33 0.05 0.00 1.12 0.00 0.00 29.99 30.94 2oat n HIS 256 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2oat n GLN 257 N 0.91 -4.11 -4.82 -0.41 7.27 -0.77 -5.01 117.38 110.43 2oat n GLN 257 Ca 0.25 0.66 -0.27 0.00 0.07 0.00 0.00 57.00 57.72 2oat n GLN 257 Cb 0.96 -5.20 -0.15 0.00 2.41 0.00 0.00 30.24 28.26 2oat n GLN 257 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2oat s VAL 258 N -3.56 1.75 0.10 1.69 1.01 -0.15 -4.90 120.40 116.35 2oat s VAL 258 Ca 0.15 -1.14 -0.29 0.00 0.00 0.00 0.00 61.98 60.70 2oat s VAL 258 Cb -0.04 -1.50 -0.06 0.00 0.00 0.00 0.00 36.38 34.79 2oat s VAL 258 CO 0.80 0.32 0.93 -0.76 0.00 0.00 0.00 175.10 176.39 2oat s LEU 259 N -0.97 4.50 -0.41 3.92 1.43 -0.13 -4.35 118.68 122.67 2oat s LEU 259 Ca 0.08 1.75 -0.17 0.00 -1.03 0.00 0.00 54.13 54.76 2oat s LEU 259 Cb -0.09 -3.54 0.02 0.00 0.03 0.00 0.00 46.19 42.61 2oat s LEU 259 CO 0.01 -0.05 0.43 0.12 0.23 0.00 0.00 176.35 177.09 2oat s PHE 260 N -0.04 3.18 -0.32 0.29 5.36 -1.26 -0.86 117.98 124.33 2oat s PHE 260 Ca 0.46 -0.31 -0.11 0.00 -0.96 0.00 0.00 56.93 56.00 2oat s PHE 260 Cb -0.23 -2.86 -0.02 0.00 -0.34 0.00 0.00 43.02 39.58 2oat s PHE 260 CO 0.29 -0.66 0.20 0.42 -1.46 0.00 0.00 175.22 174.02 2oat s ILE 261 N 2.12 5.05 -0.29 3.12 1.01 -0.10 -0.49 121.20 131.62 2oat s ILE 261 Ca 0.12 -0.23 -0.10 0.00 0.00 0.00 0.00 60.65 60.44 2oat s ILE 261 Cb -0.17 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.72 2oat s ILE 261 CO 0.13 0.05 0.15 0.00 0.00 0.00 0.00 174.94 175.28 2oat s ALA 262 N 1.69 3.33 -0.72 9.38 0.00 0.09 -1.17 121.76 134.35 2oat s ALA 262 Ca 0.06 -1.27 -0.22 0.00 0.00 0.00 0.00 51.96 50.53 2oat s ALA 262 Cb -0.17 -2.36 0.08 0.00 0.00 0.00 0.00 23.12 20.67 2oat s ALA 262 CO 0.09 -0.74 1.03 0.34 0.00 0.00 0.00 175.76 176.48 2oat s ASP 263 N 1.66 6.26 -0.32 0.00 -1.08 -0.24 -1.67 116.67 121.28 2oat s ASP 263 Ca 0.06 -1.17 0.09 0.00 -0.52 0.00 0.00 52.55 51.01 2oat s ASP 263 Cb -0.16 -2.43 0.60 0.00 -1.46 0.00 0.00 42.92 39.46 2oat s ASP 263 CO 0.07 -1.40 1.63 -0.62 0.52 0.00 0.00 175.17 175.37 2oat n GLU 264 N 7.64 2.47 -0.10 4.34 -0.58 -0.62 -4.25 120.64 129.55 2oat n GLU 264 Ca 0.03 -3.07 0.00 0.00 -0.42 0.00 0.00 57.16 53.69 2oat n GLU 264 Cb 0.46 -1.99 0.28 0.00 -0.57 0.00 0.00 31.44 29.63 2oat n GLU 264 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2oat h ILE 265 N 1.45 1.19 0.02 -3.67 2.04 -1.86 0.18 117.51 116.85 2oat h ILE 265 Ca 0.29 -0.55 -0.38 0.00 1.00 0.00 0.00 64.86 65.22 2oat h ILE 265 Cb 2.05 0.54 -0.06 0.00 -0.74 0.00 0.00 36.82 38.61 2oat h ILE 265 CO 0.60 0.22 -2.40 0.00 0.00 0.00 0.00 178.15 176.57 2oat n GLN 266 N -4.36 0.67 0.16 2.37 6.02 -1.26 -4.26 117.38 116.72 2oat n GLN 266 Ca 0.04 0.15 0.12 0.00 -0.01 0.00 0.00 57.00 57.31 2oat n GLN 266 Cb 0.14 -1.55 0.15 0.00 1.02 0.00 0.00 30.24 30.01 2oat n GLN 266 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 2oat h THR 267 N 0.01 0.00 -2.62 5.09 1.35 -1.84 -3.46 112.91 111.45 2oat h THR 267 Ca -0.55 -0.89 -0.18 0.00 -0.55 0.00 0.00 66.41 64.24 2oat h THR 267 Cb 1.94 1.71 0.08 0.00 -1.73 0.00 0.00 68.15 70.16 2oat h THR 267 CO -0.06 0.00 0.14 0.61 -0.25 0.00 0.00 175.52 175.96 2oat n GLY 268 N 1.17 -1.71 3.69 5.82 0.00 0.62 -3.72 105.19 111.06 2oat n GLY 268 Ca 0.03 -1.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.15 2oat n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oat n LEU 269 N 0.00 -2.73 0.00 0.99 4.77 0.45 -3.15 117.00 117.32 2oat n LEU 269 Ca 0.07 -0.94 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 2oat n LEU 269 Cb 0.25 -2.24 0.00 0.00 -2.33 0.00 0.00 43.42 39.10 2oat n LEU 269 CO 0.18 0.32 0.00 0.00 -1.33 0.00 0.00 177.39 176.56 2oat n ALA 270 N -3.74 0.00 -0.32 -1.18 0.00 -0.84 -4.89 120.51 109.54 2oat n ALA 270 Ca -0.13 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.37 2oat n ALA 270 Cb 0.60 -0.20 0.25 0.00 0.00 0.00 0.00 19.45 20.10 2oat n ALA 270 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2oat h ARG 271 N 0.87 0.96 -0.01 0.00 9.65 -1.72 -1.49 114.38 122.65 2oat h ARG 271 Ca 0.00 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 2oat h ARG 271 Cb 0.00 -0.22 0.00 0.00 -1.39 0.00 0.00 29.97 28.36 2oat h ARG 271 CO 0.00 0.64 -0.10 0.25 2.80 0.00 0.00 179.97 183.56 2oat n THR 272 N -4.54 0.00 0.00 0.20 -2.24 -1.24 -0.87 114.28 105.59 2oat n THR 272 Ca 0.16 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 2oat n THR 272 Cb 0.28 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 2oat n THR 272 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oat n GLY 273 N 1.24 0.99 3.39 3.38 0.00 -0.56 -1.82 105.19 111.81 2oat n GLY 273 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 2oat n GLY 273 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2oat s ARG 274 N -0.52 1.28 0.20 1.61 1.81 -1.26 -4.45 118.95 117.63 2oat s ARG 274 Ca 0.00 -1.29 -0.11 0.00 -1.72 0.00 0.00 55.73 52.61 2oat s ARG 274 Cb 0.00 0.38 0.15 0.00 -0.45 0.00 0.00 34.95 35.03 2oat s ARG 274 CO 0.00 -0.48 1.86 -1.49 -0.68 0.00 0.00 175.30 174.51 2oat h TRP 275 N 2.47 0.86 -4.04 -0.53 4.06 -1.95 -2.24 115.95 114.59 2oat h TRP 275 Ca -0.31 0.02 -0.46 0.00 2.06 0.00 0.00 58.89 60.20 2oat h TRP 275 Cb 1.24 -0.29 -0.24 0.00 -1.00 0.00 0.00 29.16 28.86 2oat h TRP 275 CO 0.39 0.53 -0.80 -0.51 -3.56 0.00 0.00 178.44 174.49 2oat s LEU 276 N -10.15 2.18 0.46 -4.49 1.43 -1.26 -0.42 118.68 106.43 2oat s LEU 276 Ca -0.13 -0.49 0.15 0.00 -1.03 0.00 0.00 54.13 52.64 2oat s LEU 276 Cb 0.15 -0.65 1.06 0.00 0.03 0.00 0.00 46.19 46.78 2oat s LEU 276 CO 0.77 0.04 2.01 0.00 0.23 0.00 0.00 176.35 179.40 2oat h ALA 277 N 4.84 1.71 0.00 4.21 0.00 -1.82 -0.14 119.26 128.06 2oat h ALA 277 Ca -0.39 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2oat h ALA 277 Cb 1.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2oat h ALA 277 CO 0.43 0.20 0.00 1.33 0.00 0.00 0.00 179.25 181.21 2oat n VAL 278 N -4.31 1.09 0.25 0.00 0.24 -1.26 -2.61 118.33 111.74 2oat n VAL 278 Ca -0.02 0.36 0.13 0.00 -2.04 0.00 0.00 64.34 62.76 2oat n VAL 278 Cb 0.23 -1.25 0.60 0.00 -1.47 0.00 0.00 33.84 31.95 2oat n VAL 278 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2oat h ASP 279 N 0.00 0.00 0.06 -1.34 3.32 -1.27 -2.40 116.42 114.79 2oat h ASP 279 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2oat h ASP 279 Cb 0.22 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 2oat h ASP 279 CO 0.00 0.12 -0.01 1.88 -1.72 0.00 0.00 179.24 179.51 2oat h TYR 280 N 0.00 0.00 -0.06 4.55 0.05 -1.68 -1.88 116.97 117.95 2oat h TYR 280 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2oat h TYR 280 Cb 0.58 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.32 2oat h TYR 280 CO 0.00 0.01 0.00 0.39 -1.05 0.00 0.00 178.16 177.51 2oat n GLU 281 N -3.59 2.95 -3.28 4.88 1.02 -0.93 -4.99 120.64 116.71 2oat n GLU 281 Ca -0.03 -1.61 -0.24 0.00 -0.02 0.00 0.00 57.16 55.27 2oat n GLU 281 Cb 0.10 -1.05 0.05 0.00 -0.02 0.00 0.00 31.44 30.51 2oat n GLU 281 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2oat n ASN 282 N -0.35 -5.99 -4.77 1.62 3.02 -0.71 -4.83 115.26 103.24 2oat n ASN 282 Ca 0.02 -0.40 -0.36 0.00 -0.03 0.00 0.00 54.58 53.81 2oat n ASN 282 Cb 0.29 -4.80 -0.07 0.00 -0.61 0.00 0.00 39.78 34.59 2oat n ASN 282 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2oat s VAL 283 N -3.22 5.42 -0.47 2.41 1.01 -1.05 -5.04 120.40 119.46 2oat s VAL 283 Ca 0.42 0.25 -0.05 0.00 0.00 0.00 0.00 61.98 62.60 2oat s VAL 283 Cb -0.19 -3.47 0.12 0.00 0.00 0.00 0.00 36.38 32.84 2oat s VAL 283 CO 0.52 0.49 0.30 -0.60 0.00 0.00 0.00 175.10 175.81 2oat s ARG 284 N -0.06 2.29 0.98 2.72 3.52 -1.26 -4.61 118.95 122.52 2oat s ARG 284 Ca 0.11 -1.91 -0.11 0.00 -0.13 0.00 0.00 55.73 53.69 2oat s ARG 284 Cb -0.12 -3.75 0.18 0.00 -1.56 0.00 0.00 34.95 29.70 2oat s ARG 284 CO 0.01 -1.14 1.09 -2.14 -0.81 0.00 0.00 175.30 172.31 2oat s PRO 285 N 1.04 0.56 0.08 5.12 0.02 -1.26 -4.97 135.00 135.60 2oat s PRO 285 Ca 0.09 1.16 -0.07 0.00 0.02 0.00 0.00 61.00 62.19 2oat s PRO 285 Cb -0.23 -1.70 -0.24 0.00 0.02 0.00 0.00 34.50 32.34 2oat s PRO 285 CO -0.03 -2.82 1.16 -0.44 -0.33 0.00 0.00 177.00 174.54 2oat h ASP 286 N -1.98 0.57 -3.43 2.53 3.32 -1.16 -3.44 116.42 112.82 2oat h ASP 286 Ca -0.50 -0.55 -0.48 0.00 0.02 0.00 0.00 57.03 55.52 2oat h ASP 286 Cb 1.29 -0.18 -0.34 0.00 0.22 0.00 0.00 39.33 40.32 2oat h ASP 286 CO 0.48 1.40 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.97 2oat s ILE 287 N -2.85 0.91 -0.11 0.35 1.01 -0.82 -4.36 121.20 115.33 2oat s ILE 287 Ca -0.06 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.27 2oat s ILE 287 Cb 0.07 -0.86 -0.01 0.00 0.01 0.00 0.00 42.46 41.67 2oat s ILE 287 CO 0.89 0.31 -0.16 -0.69 0.00 0.00 0.00 174.94 175.29 2oat s VAL 288 N 0.79 2.81 -0.12 2.92 1.01 -0.05 -0.73 120.40 127.03 2oat s VAL 288 Ca -0.13 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 2oat s VAL 288 Cb -0.15 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 2oat s VAL 288 CO 0.02 0.54 0.02 -0.76 0.00 0.00 0.00 175.10 174.92 2oat s LEU 289 N 0.16 3.63 0.13 3.92 1.43 -0.67 -0.97 118.68 126.31 2oat s LEU 289 Ca -0.09 0.10 0.05 0.00 -1.03 0.00 0.00 54.13 53.16 2oat s LEU 289 Cb -0.15 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 2oat s LEU 289 CO 0.05 0.29 -0.11 -0.76 0.23 0.00 0.00 176.35 176.05 2oat s LEU 290 N -0.37 2.46 0.00 1.79 1.43 -0.19 -1.58 118.68 122.22 2oat s LEU 290 Ca 0.08 -0.90 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 2oat s LEU 290 Cb -0.12 -0.40 0.00 0.00 0.03 0.00 0.00 46.19 45.70 2oat s LEU 290 CO 0.02 -0.26 0.00 0.61 0.23 0.00 0.00 176.35 176.95 2oat n GLY 291 N 0.20 2.06 6.27 -3.19 0.00 -1.26 -0.61 105.19 108.66 2oat n GLY 291 Ca -0.13 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2oat n GLY 291 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oat n LYS 292 N 0.00 0.00 0.12 1.61 5.02 -1.25 -1.09 118.16 122.56 2oat n LYS 292 Ca 0.00 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 2oat n LYS 292 Cb 0.00 0.00 0.45 0.00 -0.02 0.00 0.00 35.03 35.46 2oat n LYS 292 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2oat n ALA 293 N 5.93 1.24 0.33 7.82 0.00 -1.20 -2.44 120.51 132.20 2oat n ALA 293 Ca 0.00 0.12 0.18 0.00 0.00 0.00 0.00 53.44 53.74 2oat n ALA 293 Cb 0.00 -1.28 0.95 0.00 0.00 0.00 0.00 19.45 19.12 2oat n ALA 293 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2oat h LEU 294 N 0.00 0.00 -0.68 0.00 5.85 -1.40 -1.50 115.31 117.58 2oat h LEU 294 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2oat h LEU 294 Cb 0.11 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.14 2oat h LEU 294 CO 0.00 0.00 -0.01 -1.54 -0.34 0.00 0.00 178.44 176.55 2oat n SER 295 N -2.99 0.70 -0.78 1.25 3.41 -1.02 -4.18 113.62 110.00 2oat n SER 295 Ca -0.02 -0.85 -0.10 0.00 -0.26 0.00 0.00 58.87 57.64 2oat n SER 295 Cb 0.28 0.33 -0.04 0.00 -0.26 0.00 0.00 64.21 64.51 2oat n SER 295 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2oat n GLY 296 N 0.35 1.14 2.00 5.00 0.00 -0.56 -2.49 105.19 110.62 2oat n GLY 296 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2oat n GLY 296 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oat n GLY 297 N -1.41 0.81 0.03 -0.02 0.00 -0.87 -4.55 105.19 99.19 2oat n GLY 297 Ca -0.10 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.03 2oat n GLY 297 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oat n LEU 298 N 0.00 0.66 -3.64 0.99 4.32 -1.04 -4.94 117.00 113.35 2oat n LEU 298 Ca 0.00 -0.12 -0.07 0.00 -0.02 0.00 0.00 56.01 55.79 2oat n LEU 298 Cb 0.00 -0.19 -0.07 0.00 -1.62 0.00 0.00 43.42 41.54 2oat n LEU 298 CO 0.00 0.16 0.84 -0.47 -1.22 0.00 0.00 177.39 176.70 2oat s TYR 299 N -2.95 -0.37 -0.50 -1.77 6.14 -1.26 -5.10 117.35 111.53 2oat s TYR 299 Ca 0.12 0.90 -0.28 0.00 0.64 0.00 0.00 57.07 58.45 2oat s TYR 299 Cb 0.17 0.39 -0.00 0.00 0.42 0.00 0.00 41.96 42.94 2oat s TYR 299 CO 0.71 -0.18 1.60 -2.14 0.64 0.00 0.00 175.55 176.18 2oat s PRO 300 N 0.22 3.20 -0.06 4.97 0.02 -1.26 -4.62 135.00 137.47 2oat s PRO 300 Ca 0.04 0.77 0.02 0.00 0.02 0.00 0.00 61.00 61.85 2oat s PRO 300 Cb -0.05 -4.18 0.02 0.00 0.02 0.00 0.00 34.50 30.30 2oat s PRO 300 CO -0.09 -2.04 -0.10 0.08 -0.33 0.00 0.00 177.00 174.52 2oat s VAL 301 N 6.81 0.95 0.06 3.83 1.01 -0.69 -4.53 120.40 127.85 2oat s VAL 301 Ca 0.63 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.24 2oat s VAL 301 Cb -0.14 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 2oat s VAL 301 CO 0.27 0.31 -0.05 -0.94 0.00 0.00 0.00 175.10 174.70 2oat s SER 302 N 0.71 0.70 0.01 3.32 1.04 -0.76 -3.86 113.70 114.85 2oat s SER 302 Ca -0.13 -0.90 -0.03 0.00 0.48 0.00 0.00 55.95 55.36 2oat s SER 302 Cb -0.15 0.14 -0.01 0.00 0.10 0.00 0.00 66.02 66.10 2oat s SER 302 CO 0.03 -0.49 0.05 0.00 0.98 0.00 0.00 173.24 173.81 2oat s ALA 303 N -3.32 -0.09 -0.22 5.32 0.00 0.22 -1.45 121.76 122.23 2oat s ALA 303 Ca 0.04 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 51.72 2oat s ALA 303 Cb 0.03 0.09 0.05 0.00 0.00 0.00 0.00 23.12 23.30 2oat s ALA 303 CO -0.06 -0.16 -0.12 0.08 0.00 0.00 0.00 175.76 175.50 2oat s VAL 304 N -1.20 1.87 -0.12 0.00 1.01 -0.69 -1.02 120.40 120.25 2oat s VAL 304 Ca -0.13 -1.23 -0.02 0.00 0.00 0.00 0.00 61.98 60.60 2oat s VAL 304 Cb -0.08 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 2oat s VAL 304 CO 0.00 0.14 -0.03 -0.76 0.00 0.00 0.00 175.10 174.45 2oat s LEU 305 N 1.28 3.32 0.08 3.92 1.43 -0.14 -0.67 118.68 127.91 2oat s LEU 305 Ca -0.03 -0.03 -0.27 0.00 -1.03 0.00 0.00 54.13 52.77 2oat s LEU 305 Cb -0.17 -1.77 0.08 0.00 0.03 0.00 0.00 46.19 44.36 2oat s LEU 305 CO -0.08 0.27 1.02 0.00 0.23 0.00 0.00 176.35 177.79 2oat s ASP 307 N -2.84 4.94 0.29 0.00 1.01 -1.26 -1.98 116.67 116.83 2oat s ASP 307 Ca 0.11 0.93 0.02 0.00 0.71 0.00 0.00 52.55 54.33 2oat s ASP 307 Cb -0.00 -1.57 0.60 0.00 1.01 0.00 0.00 42.92 42.96 2oat s ASP 307 CO -0.01 -1.64 1.82 0.44 0.21 0.00 0.00 175.17 175.98 2oat h ASP 308 N -0.86 0.87 0.04 0.27 3.32 -1.96 -0.67 116.42 117.43 2oat h ASP 308 Ca -0.45 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 56.66 2oat h ASP 308 Cb 1.29 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 2oat h ASP 308 CO 0.65 0.42 -0.00 -2.24 -1.72 0.00 0.00 179.24 176.35 2oat h ASP 309 N 0.91 0.00 0.00 6.45 2.03 -1.98 -1.99 116.42 121.84 2oat h ASP 309 Ca 0.52 0.00 -0.28 0.00 -0.73 0.00 0.00 57.03 56.54 2oat h ASP 309 Cb 0.61 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.07 2oat h ASP 309 CO -0.30 0.00 -1.92 -0.38 -1.03 0.00 0.00 179.24 175.61 2oat n ILE 310 N -3.22 1.47 -0.22 4.15 5.41 -0.79 -4.55 119.36 121.61 2oat n ILE 310 Ca -0.03 -0.18 0.01 0.00 1.00 0.00 0.00 62.75 63.55 2oat n ILE 310 Cb 0.08 -2.03 0.12 0.00 -0.71 0.00 0.00 39.64 37.10 2oat n ILE 310 CO 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 176.55 176.52 2oat h MET 311 N -0.95 0.49 0.00 0.38 4.05 -1.09 -1.78 114.93 116.01 2oat h MET 311 Ca -0.42 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 58.97 2oat h MET 311 Cb 1.35 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 32.04 2oat h MET 311 CO -0.26 0.32 0.00 1.28 0.23 0.00 0.00 176.91 178.48 2oat n LEU 312 N -4.93 0.00 0.24 3.39 4.77 -0.75 -2.85 117.00 116.87 2oat n LEU 312 Ca 0.10 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.23 2oat n LEU 312 Cb 0.27 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 41.83 2oat n LEU 312 CO 0.24 0.00 0.91 0.71 -1.33 0.00 0.00 177.39 177.92 2oat h THR 313 N 0.00 0.00 -3.62 -5.08 1.35 -1.55 -3.41 112.91 100.60 2oat h THR 313 Ca 0.00 -0.69 -0.62 0.00 -0.55 0.00 0.00 66.41 64.55 2oat h THR 313 Cb 0.00 1.68 -0.14 0.00 -1.73 0.00 0.00 68.15 67.96 2oat h THR 313 CO 0.00 0.00 -0.32 -0.63 -0.25 0.00 0.00 175.52 174.32 2oat s ILE 314 N -3.46 5.25 0.49 6.82 1.01 -1.13 -4.92 121.20 125.25 2oat s ILE 314 Ca 0.04 0.47 0.06 0.00 0.00 0.00 0.00 60.65 61.22 2oat s ILE 314 Cb 0.07 -3.64 0.03 0.00 0.01 0.00 0.00 42.46 38.94 2oat s ILE 314 CO 0.59 0.25 0.67 -0.54 0.00 0.00 0.00 174.94 175.91 2oat s LYS 315 N 1.51 2.63 0.23 2.79 -0.14 -1.26 -5.00 119.74 120.51 2oat s LYS 315 Ca 0.14 -1.20 -0.32 0.00 -1.36 0.00 0.00 55.97 53.23 2oat s LYS 315 Cb -0.15 -2.66 -0.13 0.00 -1.68 0.00 0.00 37.83 33.21 2oat s LYS 315 CO 0.08 -0.52 1.53 -2.30 -0.76 0.00 0.00 175.35 173.38 2oat n PRO 316 N -2.06 2.32 -0.74 -1.68 -0.02 -1.26 -1.79 135.00 129.76 2oat n PRO 316 Ca 0.10 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 2oat n PRO 316 Cb 0.60 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 2oat n PRO 316 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oat n GLY 317 N 2.62 0.83 0.77 -1.23 0.00 -1.26 -4.93 105.19 101.99 2oat n GLY 317 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.27 2oat n GLY 317 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2oat n GLU 318 N -2.12 1.94 -3.61 1.61 1.02 -0.74 -4.96 120.64 113.78 2oat n GLU 318 Ca 0.00 -1.54 -0.07 0.00 -0.02 0.00 0.00 57.16 55.53 2oat n GLU 318 Cb 0.00 -1.47 -0.05 0.00 -0.02 0.00 0.00 31.44 29.90 2oat n GLU 318 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2oat s HIS 319 N -2.12 -0.25 -1.27 -0.32 5.04 -1.26 -4.95 115.29 110.15 2oat s HIS 319 Ca 0.27 0.46 0.00 0.00 -1.54 0.00 0.00 55.06 54.25 2oat s HIS 319 Cb 0.20 0.46 0.00 0.00 0.04 0.00 0.00 32.58 33.28 2oat s HIS 319 CO 0.37 -0.21 0.00 0.41 -2.34 0.00 0.00 174.74 172.97 2oat n GLY 320 N 0.84 -0.56 3.65 1.59 0.00 -1.26 -5.07 105.19 104.37 2oat n GLY 320 Ca -0.07 -0.69 -0.03 0.00 0.00 0.00 0.00 46.02 45.23 2oat n GLY 320 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2oat s SER 321 N -4.00 -0.16 0.10 1.61 0.15 -1.26 -5.02 113.70 105.12 2oat s SER 321 Ca 0.00 0.30 -0.25 0.00 0.70 0.00 0.00 55.95 56.70 2oat s SER 321 Cb 0.00 0.48 -0.10 0.00 -1.71 0.00 0.00 66.02 64.69 2oat s SER 321 CO 0.00 -0.05 1.68 0.74 1.20 0.00 0.00 173.24 176.81 2oat h THR 322 N 3.62 0.66 -0.00 6.45 2.02 -2.01 -2.95 112.91 120.70 2oat h THR 322 Ca -0.27 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.91 2oat h THR 322 Cb 1.19 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 68.26 2oat h THR 322 CO 0.18 0.00 -0.16 -1.22 0.37 0.00 0.00 175.52 174.68 2oat n TYR 323 N -5.27 0.00 -1.85 3.16 4.02 -1.26 -4.54 117.16 111.42 2oat n TYR 323 Ca -0.07 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.40 2oat n TYR 323 Cb 0.19 -0.22 -0.03 0.00 -0.02 0.00 0.00 39.34 39.26 2oat n TYR 323 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2oat s GLY 324 N -2.60 1.48 -0.39 2.72 0.00 -1.12 -2.21 107.32 105.20 2oat s GLY 324 Ca 0.24 1.27 0.00 0.00 0.00 0.00 0.00 44.72 46.24 2oat s GLY 324 CO 0.51 3.01 0.00 0.61 0.00 0.00 0.00 173.10 177.23 2oat n GLY 325 N 4.11 0.66 3.73 0.20 0.00 -1.26 -4.85 105.19 107.78 2oat n GLY 325 Ca 0.17 -0.63 -0.36 0.00 0.00 0.00 0.00 46.02 45.19 2oat n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oat s ASN 326 N -2.71 4.48 0.43 1.61 2.20 -0.94 -4.61 114.94 115.41 2oat s ASN 326 Ca 0.00 2.51 0.11 0.00 -0.94 0.00 0.00 52.86 54.55 2oat s ASN 326 Cb 0.00 -2.61 0.95 0.00 -2.00 0.00 0.00 41.25 37.59 2oat s ASN 326 CO 0.00 -2.08 2.01 1.55 -2.94 0.00 0.00 177.10 175.64 2oat h PRO 327 N 0.27 0.20 -0.23 3.55 0.13 -1.87 -2.46 132.00 131.59 2oat h PRO 327 Ca -0.50 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 64.52 2oat h PRO 327 Cb 1.32 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2oat h PRO 327 CO 0.52 0.25 -0.19 1.25 -0.23 0.00 0.00 178.00 179.60 2oat h LEU 328 N 0.20 0.55 -0.90 1.56 5.85 -1.75 -2.08 115.31 118.75 2oat h LEU 328 Ca 0.05 -0.46 -0.10 0.00 0.84 0.00 0.00 57.88 58.21 2oat h LEU 328 Cb 0.19 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2oat h LEU 328 CO 0.01 0.89 -0.32 1.23 -0.34 0.00 0.00 178.44 179.91 2oat h GLY 329 N 0.22 0.46 0.85 3.75 0.00 -1.83 -2.55 103.07 103.97 2oat h GLY 329 Ca 0.04 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 2oat h GLY 329 CO 0.05 0.37 0.01 0.00 0.00 0.00 0.00 176.54 176.97 2oat h ARG 331 N 0.21 0.14 -0.17 0.00 2.47 -1.33 0.71 114.38 116.41 2oat h ARG 331 Ca 0.07 -0.01 -0.08 0.00 -1.26 0.00 0.00 59.98 58.70 2oat h ARG 331 Cb 0.39 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.67 2oat h ARG 331 CO 0.01 0.09 -0.25 -0.39 0.56 0.00 0.00 179.97 179.99 2oat h VAL 332 N 0.14 1.25 -0.32 2.04 -1.51 -1.31 -2.50 116.25 114.04 2oat h VAL 332 Ca 0.15 -1.15 -0.13 0.00 -1.23 0.00 0.00 66.70 64.34 2oat h VAL 332 Cb 0.19 1.40 -0.00 0.00 -2.13 0.00 0.00 31.29 30.74 2oat h VAL 332 CO -0.22 0.35 -0.32 0.00 -1.23 0.00 0.00 177.57 176.15 2oat h ALA 333 N 1.47 0.47 -0.44 5.19 0.00 -0.38 -0.20 119.26 125.38 2oat h ALA 333 Ca 0.04 -0.42 0.05 0.00 0.00 0.00 0.00 54.91 54.58 2oat h ALA 333 Cb 0.59 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2oat h ALA 333 CO 0.04 0.51 0.19 0.82 0.00 0.00 0.00 179.25 180.81 2oat h ILE 334 N 0.55 0.92 -0.55 0.00 2.04 -0.66 -1.30 117.51 118.50 2oat h ILE 334 Ca 0.05 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.72 2oat h ILE 334 Cb 0.90 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 2oat h ILE 334 CO 0.08 0.07 0.11 0.00 0.00 0.00 0.00 178.15 178.41 2oat h ALA 335 N 1.26 0.73 -0.80 1.87 0.00 -1.32 -1.63 119.26 119.37 2oat h ALA 335 Ca 0.20 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2oat h ALA 335 Cb 0.15 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2oat h ALA 335 CO -0.17 0.46 0.52 0.00 0.00 0.00 0.00 179.25 180.06 2oat h ALA 336 N 1.00 1.03 -0.38 0.00 0.00 -0.53 -1.00 119.26 119.39 2oat h ALA 336 Ca 0.17 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 2oat h ALA 336 Cb 0.38 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2oat h ALA 336 CO 0.01 0.38 -0.26 -0.07 0.00 0.00 0.00 179.25 179.30 2oat h LEU 337 N 1.04 0.88 -1.12 0.00 3.38 -1.15 -2.85 115.31 115.50 2oat h LEU 337 Ca 0.30 -0.43 0.05 0.00 0.09 0.00 0.00 57.88 57.89 2oat h LEU 337 Cb -0.06 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.39 2oat h LEU 337 CO -0.09 1.13 0.60 -0.33 0.09 0.00 0.00 178.44 179.84 2oat h GLU 338 N 0.64 1.08 -0.40 1.13 5.08 -0.73 -1.85 114.58 119.54 2oat h GLU 338 Ca 0.07 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 2oat h GLU 338 Cb 0.83 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 2oat h GLU 338 CO 0.07 0.71 0.09 0.28 -1.00 0.00 0.00 179.01 179.16 2oat h VAL 339 N 1.11 1.23 -0.44 3.13 2.07 -1.08 0.13 116.25 122.40 2oat h VAL 339 Ca 0.38 -0.81 0.04 0.00 0.82 0.00 0.00 66.70 67.13 2oat h VAL 339 Cb 0.09 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 2oat h VAL 339 CO -0.13 0.28 0.20 -0.07 0.02 0.00 0.00 177.57 177.88 2oat h LEU 340 N 0.50 0.27 0.52 2.57 3.38 -1.18 -1.01 115.31 120.36 2oat h LEU 340 Ca 0.12 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 2oat h LEU 340 Cb 0.33 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.07 2oat h LEU 340 CO 0.00 0.20 -0.25 -0.08 0.09 0.00 0.00 178.44 178.40 2oat h GLU 341 N 0.41 -0.68 -0.70 1.13 4.81 -1.19 -2.75 114.58 115.61 2oat h GLU 341 Ca 0.20 0.05 0.14 0.00 -0.13 0.00 0.00 59.36 59.61 2oat h GLU 341 Cb 0.13 0.15 -0.10 0.00 0.63 0.00 0.00 28.75 29.57 2oat h GLU 341 CO -0.16 -0.45 0.20 0.93 -0.73 0.00 0.00 179.01 178.80 2oat h GLU 342 N -1.16 0.31 -0.27 1.92 5.08 -0.75 -1.56 114.58 118.15 2oat h GLU 342 Ca -0.07 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2oat h GLU 342 Cb 0.54 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2oat h GLU 342 CO 0.12 0.20 0.00 0.39 -1.00 0.00 0.00 179.01 178.72 2oat n GLU 343 N -5.10 1.71 -4.19 2.33 1.02 -0.39 -4.94 120.64 111.09 2oat n GLU 343 Ca 0.13 -1.10 -0.29 0.00 -0.02 0.00 0.00 57.16 55.87 2oat n GLU 343 Cb 0.40 -1.29 -0.07 0.00 -0.02 0.00 0.00 31.44 30.46 2oat n GLU 343 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2oat n ASN 344 N 0.37 0.44 0.21 1.62 3.02 -0.59 -4.84 115.26 115.49 2oat n ASN 344 Ca 0.12 -1.18 0.04 0.00 -0.03 0.00 0.00 54.58 53.54 2oat n ASN 344 Cb 0.28 -2.13 0.46 0.00 -0.61 0.00 0.00 39.78 37.78 2oat n ASN 344 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2oat h LEU 345 N -1.79 0.00 -0.35 3.41 3.38 -1.76 -2.76 115.31 115.44 2oat h LEU 345 Ca -0.65 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.29 2oat h LEU 345 Cb 1.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 2oat h LEU 345 CO 0.68 0.25 0.11 0.00 0.09 0.00 0.00 178.44 179.56 2oat h ALA 346 N 1.75 0.45 -0.52 1.53 0.00 -1.80 0.28 119.26 120.96 2oat h ALA 346 Ca -0.00 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.76 2oat h ALA 346 Cb 0.44 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2oat h ALA 346 CO 0.03 0.09 0.33 0.93 0.00 0.00 0.00 179.25 180.64 2oat h GLU 347 N 0.41 0.65 -0.72 0.00 4.39 -1.73 -1.05 114.58 116.53 2oat h GLU 347 Ca 0.11 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 2oat h GLU 347 Cb 0.25 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 2oat h GLU 347 CO -0.00 0.43 0.32 -0.97 -1.16 0.00 0.00 179.01 177.63 2oat h ASN 348 N 0.67 0.97 -0.36 1.42 -1.24 -1.26 -0.68 115.58 115.10 2oat h ASN 348 Ca 0.20 -0.15 -0.08 0.00 0.71 0.00 0.00 56.30 56.98 2oat h ASN 348 Cb -0.03 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 38.74 2oat h ASN 348 CO -0.07 0.86 -0.04 0.00 -1.29 0.00 0.00 177.43 176.89 2oat h ALA 349 N 1.15 1.09 0.47 1.57 0.00 -0.53 0.90 119.26 123.92 2oat h ALA 349 Ca 0.24 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2oat h ALA 349 Cb 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2oat h ALA 349 CO -0.03 0.57 -0.22 0.22 0.00 0.00 0.00 179.25 179.79 2oat h ASP 350 N 0.71 -0.53 -0.06 0.00 3.58 -0.85 0.21 116.42 119.48 2oat h ASP 350 Ca 0.13 -0.06 0.02 0.00 0.42 0.00 0.00 57.03 57.54 2oat h ASP 350 Cb 0.49 0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 2oat h ASP 350 CO 0.02 -0.25 -0.05 0.11 -2.88 0.00 0.00 179.24 176.19 2oat h LYS 351 N -0.81 -0.06 -0.00 0.28 1.57 -0.99 -2.31 116.57 114.24 2oat h LYS 351 Ca -0.06 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 2oat h LYS 351 Cb 0.56 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 2oat h LYS 351 CO 0.11 -0.04 -0.59 -0.07 -0.57 0.00 0.00 179.45 178.29 2oat h LEU 352 N -0.07 0.00 -0.86 2.94 3.38 -0.87 -3.00 115.31 116.83 2oat h LEU 352 Ca 0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2oat h LEU 352 Cb 0.13 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2oat h LEU 352 CO -0.10 0.59 0.50 1.23 0.09 0.00 0.00 178.44 180.75 2oat h GLY 353 N 1.76 1.27 0.59 0.83 0.00 -0.24 0.13 103.07 107.40 2oat h GLY 353 Ca -0.01 -0.55 0.05 0.00 0.00 0.00 0.00 47.33 46.82 2oat h GLY 353 CO 0.08 0.53 0.04 -2.22 0.00 0.00 0.00 176.54 174.97 2oat h ILE 354 N 1.19 0.82 -0.17 2.60 1.08 -1.28 -0.91 117.51 120.84 2oat h ILE 354 Ca 0.31 -0.05 0.01 0.00 -0.39 0.00 0.00 64.86 64.74 2oat h ILE 354 Cb -0.01 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 34.38 2oat h ILE 354 CO -0.05 0.03 0.06 0.40 -0.69 0.00 0.00 178.15 177.90 2oat h ILE 355 N 0.15 0.97 -0.19 -0.67 2.04 -1.39 -0.36 117.51 118.06 2oat h ILE 355 Ca 0.15 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.99 2oat h ILE 355 Cb 0.18 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 2oat h ILE 355 CO -0.22 0.03 -0.03 0.25 0.00 0.00 0.00 178.15 178.19 2oat h LEU 356 N 0.15 -0.13 -0.53 1.44 6.46 -0.17 -0.71 115.31 121.81 2oat h LEU 356 Ca 0.07 0.05 -0.10 0.00 -0.12 0.00 0.00 57.88 57.78 2oat h LEU 356 Cb 0.03 0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.04 2oat h LEU 356 CO -0.06 -0.04 -0.06 0.03 -0.62 0.00 0.00 178.44 177.69 2oat h ARG 357 N 0.03 0.98 -0.62 1.25 3.08 -1.05 -1.59 114.38 116.45 2oat h ARG 357 Ca 0.09 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.80 2oat h ARG 357 Cb 0.13 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 2oat h ARG 357 CO -0.18 1.01 0.39 -0.91 -1.07 0.00 0.00 179.97 179.21 2oat h ASN 358 N 0.85 0.73 -0.46 7.04 2.35 -0.80 -1.28 115.58 124.02 2oat h ASN 358 Ca 0.14 -0.04 -0.14 0.00 -0.55 0.00 0.00 56.30 55.71 2oat h ASN 358 Cb 0.61 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 2oat h ASN 358 CO 0.04 0.56 -0.26 -0.33 -1.65 0.00 0.00 177.43 175.79 2oat h GLU 359 N 0.84 0.98 -0.42 0.81 4.39 -1.06 -3.05 114.58 117.08 2oat h GLU 359 Ca 0.23 -0.45 -0.02 0.00 0.34 0.00 0.00 59.36 59.46 2oat h GLU 359 Cb -0.05 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 2oat h GLU 359 CO -0.04 1.12 0.18 -0.07 -1.16 0.00 0.00 179.01 179.03 2oat h LEU 360 N 0.83 0.53 -0.22 1.33 3.38 -0.95 -2.23 115.31 117.97 2oat h LEU 360 Ca 0.10 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2oat h LEU 360 Cb 0.85 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2oat h LEU 360 CO 0.07 0.47 0.00 0.23 0.09 0.00 0.00 178.44 179.31 2oat n MET 361 N -4.38 0.06 0.10 1.13 2.81 -0.51 -2.02 117.12 114.30 2oat n MET 361 Ca 0.03 0.32 0.13 0.00 -1.81 0.00 0.00 57.70 56.37 2oat n MET 361 Cb 0.14 -1.61 0.43 0.00 -0.71 0.00 0.00 33.22 31.47 2oat n MET 361 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2oat n LYS 362 N -1.72 0.23 -2.06 0.03 5.02 -0.84 -4.81 118.16 114.01 2oat n LYS 362 Ca 0.03 0.22 -0.34 0.00 -2.02 0.00 0.00 58.31 56.20 2oat n LYS 362 Cb 0.18 -1.78 0.02 0.00 -0.02 0.00 0.00 35.03 33.42 2oat n LYS 362 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2oat s LEU 363 N -4.37 3.62 0.28 -0.35 1.43 -0.86 -4.92 118.68 113.51 2oat s LEU 363 Ca 0.10 2.14 -0.30 0.00 -1.03 0.00 0.00 54.13 55.04 2oat s LEU 363 Cb 0.12 -4.57 -0.12 0.00 0.03 0.00 0.00 46.19 41.65 2oat s LEU 363 CO 0.56 -1.41 1.54 -2.65 0.23 0.00 0.00 176.35 174.62 2oat n PRO 364 N -1.71 2.50 0.10 1.29 -0.02 -1.26 -4.83 135.00 131.06 2oat n PRO 364 Ca 0.11 0.89 0.10 0.00 -2.02 0.00 0.00 63.50 62.58 2oat n PRO 364 Cb 0.51 -2.63 0.44 0.00 -0.02 0.00 0.00 33.50 31.80 2oat n PRO 364 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2oat n SER 365 N 2.17 0.48 -0.39 2.55 7.64 -1.26 -0.69 113.62 124.11 2oat n SER 365 Ca 0.09 0.64 0.13 0.00 1.01 0.00 0.00 58.87 60.74 2oat n SER 365 Cb 0.35 -0.73 0.29 0.00 -1.01 0.00 0.00 64.21 63.11 2oat n SER 365 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2oat n ASP 366 N -2.05 1.47 -0.02 6.43 5.75 -1.26 -4.18 116.55 122.70 2oat n ASP 366 Ca 0.02 -1.21 -0.05 0.00 -0.01 0.00 0.00 54.79 53.54 2oat n ASP 366 Cb 0.17 0.19 -0.02 0.00 -1.03 0.00 0.00 41.12 40.44 2oat n ASP 366 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 2oat n VAL 367 N -0.25 0.44 -3.66 2.12 0.31 -0.68 -4.70 118.33 111.92 2oat n VAL 367 Ca 0.13 -0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 64.06 2oat n VAL 367 Cb 0.40 -1.60 -0.10 0.00 -0.91 0.00 0.00 33.84 31.62 2oat n VAL 367 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2oat s VAL 368 N -2.11 3.92 0.18 2.52 1.01 0.13 -0.42 120.40 125.63 2oat s VAL 368 Ca -0.07 -1.56 0.13 0.00 0.00 0.00 0.00 61.98 60.48 2oat s VAL 368 Cb 0.02 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.95 2oat s VAL 368 CO 0.09 -0.53 1.59 0.74 0.00 0.00 0.00 175.10 176.99 2oat h THR 369 N 6.18 1.26 -2.23 3.92 2.02 -0.67 -3.36 112.91 120.02 2oat h THR 369 Ca -0.21 -2.14 -0.06 0.00 0.77 0.00 0.00 66.41 64.77 2oat h THR 369 Cb 1.07 2.21 -0.18 0.00 -1.74 0.00 0.00 68.15 69.50 2oat h THR 369 CO 0.73 0.58 0.13 0.00 0.37 0.00 0.00 175.52 177.33 2oat s ALA 370 N -3.42 -1.62 -0.11 6.16 0.00 -1.13 -4.97 121.76 116.67 2oat s ALA 370 Ca -0.00 1.10 0.02 0.00 0.00 0.00 0.00 51.96 53.08 2oat s ALA 370 Cb 0.11 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.35 2oat s ALA 370 CO 0.75 -0.40 -0.15 0.08 0.00 0.00 0.00 175.76 176.04 2oat s VAL 371 N -1.48 1.51 0.12 0.00 1.01 -1.26 -0.87 120.40 119.43 2oat s VAL 371 Ca -0.10 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.19 2oat s VAL 371 Cb -0.01 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 2oat s VAL 371 CO 0.07 0.44 0.14 0.00 0.00 0.00 0.00 175.10 175.75 2oat s ARG 372 N 1.05 0.92 0.00 2.72 1.70 0.10 -5.01 118.95 120.43 2oat s ARG 372 Ca -0.05 -1.22 0.00 0.00 -0.47 0.00 0.00 55.73 53.99 2oat s ARG 372 Cb -0.15 0.30 0.00 0.00 -0.57 0.00 0.00 34.95 34.53 2oat s ARG 372 CO -0.03 -0.28 0.00 0.41 -1.08 0.00 0.00 175.30 174.32 2oat n GLY 373 N -0.09 1.04 2.96 3.88 0.00 -1.26 -1.02 105.19 110.70 2oat n GLY 373 Ca -0.10 -1.95 -0.11 0.00 0.00 0.00 0.00 46.02 43.87 2oat n GLY 373 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oat s LYS 374 N -1.00 0.26 2.71 1.61 1.02 -0.91 -4.99 119.74 118.44 2oat s LYS 374 Ca 0.00 -0.43 0.00 0.00 0.02 0.00 0.00 55.97 55.56 2oat s LYS 374 Cb 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 37.83 37.31 2oat s LYS 374 CO 0.00 -0.01 0.00 0.41 -0.92 0.00 0.00 175.35 174.83 2oat n GLY 375 N 2.07 2.39 1.75 -3.33 0.00 -0.76 -1.44 105.19 105.88 2oat n GLY 375 Ca -0.20 -0.19 0.03 0.00 0.00 0.00 0.00 46.02 45.66 2oat n GLY 375 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oat n LEU 376 N 0.00 5.23 -4.25 0.99 4.32 -0.04 -4.16 117.00 119.08 2oat n LEU 376 Ca 0.00 -2.67 -0.43 0.00 -0.02 0.00 0.00 56.01 52.88 2oat n LEU 376 Cb 0.00 -0.68 -0.06 0.00 -1.62 0.00 0.00 43.42 41.06 2oat n LEU 376 CO 0.00 0.62 0.10 -0.22 -1.22 0.00 0.00 177.39 176.67 2oat s LEU 377 N -2.43 5.99 0.27 2.23 2.96 -0.52 -4.23 118.68 122.93 2oat s LEU 377 Ca 0.47 -2.05 0.02 0.00 -0.22 0.00 0.00 54.13 52.35 2oat s LEU 377 Cb 0.37 -2.10 -0.05 0.00 0.50 0.00 0.00 46.19 44.91 2oat s LEU 377 CO 0.13 -0.71 0.09 0.20 -1.32 0.00 0.00 176.35 174.74 2oat s ASN 378 N 2.78 1.35 0.13 3.68 0.01 -0.93 -2.14 114.94 119.82 2oat s ASN 378 Ca 0.07 -1.38 -0.22 0.00 -0.71 0.00 0.00 52.86 50.62 2oat s ASN 378 Cb -0.25 0.13 0.06 0.00 0.41 0.00 0.00 41.25 41.60 2oat s ASN 378 CO -0.01 -0.71 0.57 0.00 -1.51 0.00 0.00 177.10 175.44 2oat s ALA 379 N -3.69 -1.50 0.12 0.60 0.00 -0.19 -0.39 121.76 116.72 2oat s ALA 379 Ca 0.38 0.47 0.09 0.00 0.00 0.00 0.00 51.96 52.90 2oat s ALA 379 Cb 0.08 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 23.93 2oat s ALA 379 CO 0.14 -0.71 -0.23 0.96 0.00 0.00 0.00 175.76 175.92 2oat s ILE 380 N -3.50 1.94 -0.15 0.00 -4.36 -0.08 -0.73 121.20 114.32 2oat s ILE 380 Ca 0.00 -1.68 -0.02 0.00 -0.26 0.00 0.00 60.65 58.70 2oat s ILE 380 Cb -0.00 -1.76 -0.02 0.00 1.25 0.00 0.00 42.46 41.92 2oat s ILE 380 CO -0.11 -0.03 -0.09 -0.69 0.24 0.00 0.00 174.94 174.26 2oat s VAL 381 N -1.23 3.35 0.27 8.37 1.01 -0.05 -1.75 120.40 130.37 2oat s VAL 381 Ca 0.11 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 61.62 2oat s VAL 381 Cb -0.10 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 2oat s VAL 381 CO 0.05 0.50 0.18 0.27 0.00 0.00 0.00 175.10 176.11 2oat s ILE 382 N 0.50 4.09 -1.26 2.22 -4.36 -0.09 -0.10 121.20 122.20 2oat s ILE 382 Ca -0.07 -1.49 -0.17 0.00 -0.26 0.00 0.00 60.65 58.67 2oat s ILE 382 Cb -0.15 -3.27 0.10 0.00 1.25 0.00 0.00 42.46 40.39 2oat s ILE 382 CO 0.04 -0.32 1.64 -0.75 0.24 0.00 0.00 174.94 175.79 2oat s LYS 383 N -3.84 3.99 0.34 0.37 2.20 0.44 -4.77 119.74 118.47 2oat s LYS 383 Ca 0.34 -2.10 -0.29 0.00 -0.36 0.00 0.00 55.97 53.56 2oat s LYS 383 Cb -0.07 -5.40 -0.11 0.00 -1.51 0.00 0.00 37.83 30.74 2oat s LYS 383 CO 0.24 -2.13 1.45 -2.00 -0.36 0.00 0.00 175.35 172.56 2oat s GLU 384 N 3.58 4.20 0.48 4.03 2.12 -1.26 -4.99 118.70 126.85 2oat s GLU 384 Ca 0.51 2.45 0.01 0.00 0.36 0.00 0.00 54.97 58.29 2oat s GLU 384 Cb 0.02 -3.02 -0.00 0.00 0.26 0.00 0.00 34.13 31.38 2oat s GLU 384 CO 0.05 -0.44 0.05 0.25 -0.54 0.00 0.00 175.26 174.62 2oat n THR 385 N 1.05 0.00 0.22 -1.70 -2.24 -0.52 -5.00 114.28 106.09 2oat n THR 385 Ca 0.03 -2.38 0.06 0.00 -2.27 0.00 0.00 64.05 59.49 2oat n THR 385 Cb 0.40 0.59 0.50 0.00 -2.10 0.00 0.00 70.33 69.72 2oat n THR 385 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2oat h LYS 386 N 0.00 0.00 -0.01 -0.78 6.56 -2.02 -3.11 116.57 117.21 2oat h LYS 386 Ca -0.39 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.20 2oat h LYS 386 Cb 1.25 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.91 2oat h LYS 386 CO 0.64 0.25 -0.59 -0.25 -2.06 0.00 0.00 179.45 177.44 2oat n ASP 387 N -3.95 1.36 -3.83 0.86 8.00 -1.26 -4.91 116.55 112.82 2oat n ASP 387 Ca -0.02 -1.18 -0.23 0.00 0.71 0.00 0.00 54.79 54.07 2oat n ASP 387 Cb 0.33 0.71 -0.17 0.00 -0.02 0.00 0.00 41.12 41.97 2oat n ASP 387 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 2oat s TRP 388 N -2.37 0.90 0.28 1.24 -0.00 -1.18 -5.07 118.94 112.73 2oat s TRP 388 Ca 0.11 -0.32 -0.02 0.00 -0.00 0.00 0.00 56.10 55.87 2oat s TRP 388 Cb 0.14 -0.89 -0.02 0.00 -0.00 0.00 0.00 33.47 32.71 2oat s TRP 388 CO 0.58 -0.35 0.33 0.16 -0.00 0.00 0.00 176.95 177.68 2oat s ASP 389 N 1.69 0.61 0.28 5.86 1.47 -1.26 -1.45 116.67 123.87 2oat s ASP 389 Ca 0.02 -1.39 -0.03 0.00 1.18 0.00 0.00 52.55 52.32 2oat s ASP 389 Cb -0.13 0.54 0.39 0.00 -0.34 0.00 0.00 42.92 43.38 2oat s ASP 389 CO -0.05 -1.08 1.94 0.00 0.68 0.00 0.00 175.17 176.66 2oat h ALA 390 N 2.30 1.38 -0.13 2.11 0.00 -1.54 -1.50 119.26 121.89 2oat h ALA 390 Ca -0.30 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.57 2oat h ALA 390 Cb 1.24 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2oat h ALA 390 CO 0.42 0.55 0.05 2.35 0.00 0.00 0.00 179.25 182.62 2oat h TRP 391 N 1.20 0.09 -0.94 0.00 2.91 -1.84 -0.31 115.95 117.05 2oat h TRP 391 Ca 0.35 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.38 2oat h TRP 391 Cb -0.07 -0.02 -0.05 0.00 -0.51 0.00 0.00 29.16 28.52 2oat h TRP 391 CO -0.00 0.05 0.60 0.87 -1.03 0.00 0.00 178.44 178.93 2oat h LYS 392 N 0.12 1.26 -0.71 2.65 1.57 -1.80 -0.63 116.57 119.03 2oat h LYS 392 Ca 0.05 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2oat h LYS 392 Cb 0.02 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 32.03 2oat h LYS 392 CO -0.05 0.86 0.36 0.28 -0.57 0.00 0.00 179.45 180.33 2oat h VAL 393 N 1.29 1.23 0.00 0.50 2.07 -1.06 -2.61 116.25 117.68 2oat h VAL 393 Ca 0.34 -0.62 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 2oat h VAL 393 Cb -0.10 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 2oat h VAL 393 CO -0.07 0.26 -0.45 0.00 0.02 0.00 0.00 177.57 177.33 2oat h LEU 395 N 0.00 0.61 -0.61 0.00 3.38 -0.91 -1.90 115.31 115.87 2oat h LEU 395 Ca -0.00 -0.27 -0.13 0.00 0.09 0.00 0.00 57.88 57.57 2oat h LEU 395 Cb 0.82 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2oat h LEU 395 CO 0.06 0.73 -0.31 -0.09 0.09 0.00 0.00 178.44 178.92 2oat h ARG 396 N 0.48 0.76 -0.16 1.13 2.43 -1.26 -1.10 114.38 116.66 2oat h ARG 396 Ca 0.12 -0.35 0.04 0.00 -0.81 0.00 0.00 59.98 58.97 2oat h ARG 396 Cb 0.38 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 2oat h ARG 396 CO 0.01 0.97 -0.07 -0.07 -1.51 0.00 0.00 179.97 179.29 2oat h LEU 397 N 0.64 -0.24 -0.61 3.80 4.07 -1.03 0.44 115.31 122.38 2oat h LEU 397 Ca 0.07 0.06 0.06 0.00 0.08 0.00 0.00 57.88 58.15 2oat h LEU 397 Cb 0.84 0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.66 2oat h LEU 397 CO 0.07 -0.09 0.33 -0.09 -1.08 0.00 0.00 178.44 177.57 2oat h ARG 398 N -0.05 0.60 -0.28 1.13 2.43 -0.77 0.33 114.38 117.76 2oat h ARG 398 Ca 0.09 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.26 2oat h ARG 398 Cb 0.18 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2oat h ARG 398 CO -0.19 0.39 0.19 -0.44 -1.51 0.00 0.00 179.97 178.41 2oat h ASP 399 N 0.61 0.17 -0.57 -3.80 3.32 -0.23 -1.63 116.42 114.29 2oat h ASP 399 Ca 0.27 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 2oat h ASP 399 Cb 0.17 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.68 2oat h ASP 399 CO -0.18 0.12 0.00 0.59 -1.72 0.00 0.00 179.24 178.05 2oat n ASN 400 N -4.49 4.79 0.00 6.45 5.03 0.05 -4.94 115.26 122.16 2oat n ASN 400 Ca 0.03 -2.59 0.00 0.00 0.87 0.00 0.00 54.58 52.89 2oat n ASN 400 Cb 0.21 -0.60 0.00 0.00 -1.02 0.00 0.00 39.78 38.37 2oat n ASN 400 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2oat n GLY 401 N 0.87 0.46 2.97 7.41 0.00 -0.61 -4.96 105.19 111.32 2oat n GLY 401 Ca 0.24 -0.94 -0.21 0.00 0.00 0.00 0.00 46.02 45.11 2oat n GLY 401 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2oat s LEU 402 N 0.00 1.63 -0.19 0.99 0.20 0.10 -0.73 118.68 120.69 2oat s LEU 402 Ca 0.00 -0.18 -0.07 0.00 0.69 0.00 0.00 54.13 54.57 2oat s LEU 402 Cb 0.00 -0.54 -0.04 0.00 -0.43 0.00 0.00 46.19 45.18 2oat s LEU 402 CO 0.00 0.02 0.05 -0.76 -0.29 0.00 0.00 176.35 175.37 2oat s LEU 403 N 0.47 3.69 0.13 -0.68 1.43 0.61 -2.09 118.68 122.25 2oat s LEU 403 Ca -0.07 0.01 -0.02 0.00 -1.03 0.00 0.00 54.13 53.02 2oat s LEU 403 Cb -0.11 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 2oat s LEU 403 CO 0.01 0.15 0.10 0.00 0.23 0.00 0.00 176.35 176.83 2oat s ALA 404 N 0.52 0.70 -0.20 4.21 0.00 -1.26 -0.82 121.76 124.91 2oat s ALA 404 Ca 0.02 -1.36 -0.02 0.00 0.00 0.00 0.00 51.96 50.61 2oat s ALA 404 Cb -0.13 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.85 2oat s ALA 404 CO 0.01 -0.51 -0.11 0.21 0.00 0.00 0.00 175.76 175.35 2oat s LYS 405 N -4.03 3.21 0.33 0.00 2.47 -1.26 -4.94 119.74 115.52 2oat s LYS 405 Ca 0.23 -0.72 -0.27 0.00 -1.56 0.00 0.00 55.97 53.65 2oat s LYS 405 Cb 0.07 -2.80 -0.09 0.00 -1.46 0.00 0.00 37.83 33.54 2oat s LYS 405 CO 0.01 -0.18 1.04 -1.25 0.16 0.00 0.00 175.35 175.14 2oat s PRO 406 N 1.34 4.45 -0.42 4.03 0.04 -1.26 -2.77 135.00 140.40 2oat s PRO 406 Ca 0.04 1.59 0.09 0.00 0.04 0.00 0.00 61.00 62.77 2oat s PRO 406 Cb -0.14 -2.87 0.42 0.00 0.04 0.00 0.00 34.50 31.95 2oat s PRO 406 CO -0.07 0.10 1.02 -2.37 0.04 0.00 0.00 177.00 175.72 2oat n THR 407 N 0.60 1.89 0.00 1.26 5.66 0.74 -4.98 114.28 119.44 2oat n THR 407 Ca 0.02 -4.44 0.00 0.00 -3.05 0.00 0.00 64.05 56.58 2oat n THR 407 Cb 0.48 -0.65 0.00 0.00 -1.55 0.00 0.00 70.33 68.60 2oat n THR 407 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2oat n HIS 408 N -0.28 0.00 1.19 1.09 8.25 -1.26 -4.66 115.22 119.55 2oat n HIS 408 Ca 0.28 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.87 2oat n HIS 408 Cb 0.68 0.00 0.41 0.00 1.12 0.00 0.00 29.99 32.19 2oat n HIS 408 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2oat n GLY 409 N 0.00 -0.92 0.00 -1.41 0.00 -1.26 -4.40 105.19 97.20 2oat n GLY 409 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2oat n GLY 409 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2oat n ASP 410 N -1.01 0.35 -4.31 1.61 5.75 -1.26 -1.56 116.55 116.12 2oat n ASP 410 Ca 0.10 -1.17 -0.31 0.00 -0.01 0.00 0.00 54.79 53.40 2oat n ASP 410 Cb 0.33 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.26 2oat n ASP 410 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2oat s ILE 411 N -0.17 2.19 -0.09 2.12 1.01 -1.26 -0.91 121.20 124.09 2oat s ILE 411 Ca 0.00 -1.03 0.01 0.00 0.00 0.00 0.00 60.65 59.63 2oat s ILE 411 Cb 0.00 -1.79 0.02 0.00 0.01 0.00 0.00 42.46 40.70 2oat s ILE 411 CO 0.00 0.57 -0.10 -0.63 0.00 0.00 0.00 174.94 174.79 2oat s ILE 412 N -0.36 1.07 0.08 2.92 1.09 -0.72 -0.19 121.20 125.08 2oat s ILE 412 Ca 0.02 -0.37 -0.21 0.00 -1.10 0.00 0.00 60.65 59.00 2oat s ILE 412 Cb -0.12 -1.03 -0.07 0.00 -1.06 0.00 0.00 42.46 40.18 2oat s ILE 412 CO 0.02 0.36 0.62 -0.60 -0.10 0.00 0.00 174.94 175.23 2oat s ARG 413 N 1.23 4.29 -0.29 2.79 3.52 -1.12 -0.90 118.95 128.47 2oat s ARG 413 Ca -0.04 0.82 0.02 0.00 -0.13 0.00 0.00 55.73 56.40 2oat s ARG 413 Cb -0.14 -3.26 0.08 0.00 -1.56 0.00 0.00 34.95 30.07 2oat s ARG 413 CO -0.03 0.57 0.01 -0.06 -0.81 0.00 0.00 175.30 174.98 2oat s PHE 414 N -0.93 2.83 -0.46 5.12 0.08 0.48 -4.34 117.98 120.76 2oat s PHE 414 Ca 0.31 -2.26 0.05 0.00 0.12 0.00 0.00 56.93 55.15 2oat s PHE 414 Cb -0.20 -2.13 0.18 0.00 -0.57 0.00 0.00 43.02 40.31 2oat s PHE 414 CO 0.20 -0.87 0.52 0.00 -0.10 0.00 0.00 175.22 174.97 2oat n ALA 415 N 4.53 0.78 -1.72 5.36 0.00 -0.44 -2.20 120.51 126.83 2oat n ALA 415 Ca -0.04 -2.21 -0.31 0.00 0.00 0.00 0.00 53.44 50.88 2oat n ALA 415 Cb 0.43 -1.07 0.04 0.00 0.00 0.00 0.00 19.45 18.84 2oat n ALA 415 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2oat s PRO 416 N 0.36 3.08 0.51 0.00 0.04 -1.26 -2.85 135.00 134.89 2oat s PRO 416 Ca 0.32 0.78 -0.21 0.00 0.04 0.00 0.00 61.00 61.92 2oat s PRO 416 Cb 0.03 -2.02 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 2oat s PRO 416 CO -0.14 -0.95 0.92 -2.30 0.04 0.00 0.00 177.00 174.57 2oat n PRO 417 N -3.01 1.06 0.00 0.56 -0.02 -1.26 -4.86 135.00 127.47 2oat n PRO 417 Ca 0.07 0.39 0.12 0.00 -2.02 0.00 0.00 63.50 62.06 2oat n PRO 417 Cb 0.54 -2.04 0.66 0.00 -0.02 0.00 0.00 33.50 32.64 2oat n PRO 417 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2oat n LEU 418 N 0.03 0.00 -0.26 2.45 4.77 0.66 -2.39 117.00 122.25 2oat n LEU 418 Ca 0.11 0.11 0.14 0.00 -0.03 0.00 0.00 56.01 56.34 2oat n LEU 418 Cb 0.43 -0.11 0.50 0.00 -2.33 0.00 0.00 43.42 41.92 2oat n LEU 418 CO 0.53 -0.03 0.79 1.33 -1.33 0.00 0.00 177.39 178.68 2oat n VAL 419 N -1.11 0.00 -1.80 4.08 0.24 -1.24 -4.66 118.33 113.84 2oat n VAL 419 Ca 0.15 -0.14 -0.37 0.00 -2.04 0.00 0.00 64.34 61.95 2oat n VAL 419 Cb 0.12 0.26 0.06 0.00 -1.47 0.00 0.00 33.84 32.81 2oat n VAL 419 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 2oat s ILE 420 N -2.34 2.17 0.27 1.34 2.07 -1.00 -4.99 121.20 118.70 2oat s ILE 420 Ca 0.30 0.10 0.07 0.00 -1.41 0.00 0.00 60.65 59.71 2oat s ILE 420 Cb 0.20 -3.04 -0.03 0.00 0.13 0.00 0.00 42.46 39.72 2oat s ILE 420 CO 0.45 -0.02 0.27 -0.54 -1.91 0.00 0.00 174.94 173.19 2oat s LYS 421 N -3.37 3.04 0.23 3.50 1.02 -1.26 -4.98 119.74 117.92 2oat s LYS 421 Ca 0.81 -1.01 -0.07 0.00 0.02 0.00 0.00 55.97 55.72 2oat s LYS 421 Cb -0.36 -2.65 0.26 0.00 -0.52 0.00 0.00 37.83 34.56 2oat s LYS 421 CO 0.38 0.35 1.87 1.49 -0.92 0.00 0.00 175.35 178.52 2oat h GLU 422 N 1.34 1.01 -0.43 1.68 4.81 -1.99 0.21 114.58 121.23 2oat h GLU 422 Ca -0.49 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 58.66 2oat h GLU 422 Cb 1.24 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 2oat h GLU 422 CO 0.60 0.67 0.18 0.38 -0.73 0.00 0.00 179.01 180.11 2oat h ASP 423 N 1.04 0.58 -0.71 1.04 2.03 -1.99 0.82 116.42 119.23 2oat h ASP 423 Ca 0.34 -0.15 -0.00 0.00 -0.73 0.00 0.00 57.03 56.48 2oat h ASP 423 Cb 0.02 -0.15 -0.03 0.00 -0.83 0.00 0.00 39.33 38.33 2oat h ASP 423 CO -0.12 0.57 0.44 -0.33 -1.03 0.00 0.00 179.24 178.77 2oat h GLU 424 N 0.55 0.96 -0.19 4.15 5.08 -1.87 0.96 114.58 124.22 2oat h GLU 424 Ca 0.14 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2oat h GLU 424 Cb 0.17 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2oat h GLU 424 CO -0.01 0.68 0.11 1.25 -1.00 0.00 0.00 179.01 180.03 2oat h LEU 425 N 0.97 0.17 -1.02 1.33 5.85 -0.54 0.50 115.31 122.58 2oat h LEU 425 Ca 0.26 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.95 2oat h LEU 425 Cb -0.04 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 2oat h LEU 425 CO -0.05 0.13 0.34 0.03 -0.34 0.00 0.00 178.44 178.55 2oat h ARG 426 N 0.22 1.04 -0.57 1.25 3.08 -0.39 0.13 114.38 119.14 2oat h ARG 426 Ca 0.07 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 2oat h ARG 426 Cb -0.00 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.83 2oat h ARG 426 CO -0.04 0.81 0.32 1.49 -1.07 0.00 0.00 179.97 181.49 2oat h GLU 427 N 1.04 0.79 -0.63 0.04 4.81 -0.12 -1.54 114.58 118.96 2oat h GLU 427 Ca 0.25 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.34 2oat h GLU 427 Cb 0.12 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 2oat h GLU 427 CO -0.03 0.59 0.18 0.77 -0.73 0.00 0.00 179.01 179.79 2oat h SER 428 N 0.77 0.90 -0.87 1.04 0.02 0.16 -2.24 113.55 113.33 2oat h SER 428 Ca 0.20 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2oat h SER 428 Cb 0.02 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.29 2oat h SER 428 CO -0.03 0.85 0.50 0.40 -1.14 0.00 0.00 176.83 177.41 2oat h ILE 429 N 0.93 1.25 -0.41 3.27 2.04 -0.23 0.18 117.51 124.55 2oat h ILE 429 Ca 0.20 -0.58 -0.08 0.00 1.00 0.00 0.00 64.86 65.41 2oat h ILE 429 Cb 0.29 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 2oat h ILE 429 CO -0.01 0.27 -0.07 -0.33 0.00 0.00 0.00 178.15 178.01 2oat h GLU 430 N 1.21 0.70 -0.71 2.37 4.39 -0.82 0.46 114.58 122.18 2oat h GLU 430 Ca 0.31 -0.21 -0.05 0.00 0.34 0.00 0.00 59.36 59.75 2oat h GLU 430 Cb -0.01 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 2oat h GLU 430 CO -0.05 0.76 0.25 0.82 -1.16 0.00 0.00 179.01 179.62 2oat h ILE 431 N 0.64 1.26 -0.22 3.13 2.04 -0.66 0.22 117.51 123.91 2oat h ILE 431 Ca 0.12 -0.85 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 2oat h ILE 431 Cb 0.51 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 2oat h ILE 431 CO 0.03 0.34 0.08 0.40 0.00 0.00 0.00 178.15 178.99 2oat h ILE 432 N 1.04 1.18 0.02 -0.67 2.04 0.41 -0.44 117.51 121.10 2oat h ILE 432 Ca 0.23 -0.56 0.02 0.00 1.00 0.00 0.00 64.86 65.55 2oat h ILE 432 Cb 0.27 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 2oat h ILE 432 CO -0.01 0.18 -0.16 0.78 0.00 0.00 0.00 178.15 178.94 2oat h ASN 433 N 0.20 -0.47 -0.50 1.72 2.35 0.22 0.68 115.58 119.77 2oat h ASN 433 Ca 0.07 0.07 0.10 0.00 -0.55 0.00 0.00 56.30 55.99 2oat h ASN 433 Cb 0.21 0.19 -0.10 0.00 0.05 0.00 0.00 38.32 38.68 2oat h ASN 433 CO -0.00 -0.23 -0.12 0.50 -1.65 0.00 0.00 177.43 175.93 2oat h LYS 434 N -0.28 0.01 0.20 0.81 3.64 -0.44 0.72 116.57 121.22 2oat h LYS 434 Ca 0.05 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 2oat h LYS 434 Cb 0.34 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2oat h LYS 434 CO -0.14 0.00 -0.10 1.15 -2.27 0.00 0.00 179.45 178.10 2oat h THR 435 N 0.01 0.87 -0.07 1.00 2.02 -0.58 -1.48 112.91 114.66 2oat h THR 435 Ca 0.24 -0.37 0.01 0.00 0.77 0.00 0.00 66.41 67.07 2oat h THR 435 Cb 0.37 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 2oat h THR 435 CO -0.51 0.08 -0.02 0.40 0.37 0.00 0.00 175.52 175.84 2oat h ILE 436 N -0.45 0.93 0.00 3.11 1.08 -0.53 -2.68 117.51 118.97 2oat h ILE 436 Ca -0.03 -0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.41 2oat h ILE 436 Cb 0.35 0.93 -0.00 0.00 -3.07 0.00 0.00 36.82 35.02 2oat h ILE 436 CO 0.05 0.00 -0.16 -0.07 -0.69 0.00 0.00 178.15 177.28 2oat h LEU 437 N 0.00 0.00 0.00 1.44 3.38 -0.89 -3.07 115.31 116.17 2oat h LEU 437 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2oat h LEU 437 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2oat h LEU 437 CO -0.07 0.16 0.00 -1.54 0.09 0.00 0.00 178.44 177.08 2oat n SER 438 N -3.98 0.00 -0.57 -0.43 3.41 -0.56 -5.08 113.62 106.40 2oat n SER 438 Ca -0.02 0.29 0.14 0.00 -0.26 0.00 0.00 58.87 59.01 2oat n SER 438 Cb 0.24 -0.36 0.44 0.00 -0.26 0.00 0.00 64.21 64.27 2oat n SER 438 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37