#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t1g s ALA 2 N 0.00 3.61 0.42 0.00 0.00 -1.26 -4.97 121.76 119.56 1t1g s ALA 2 Ca 0.00 0.83 -0.26 0.00 0.00 0.00 0.00 51.96 52.53 1t1g s ALA 2 Cb 0.00 -3.65 -0.09 0.00 0.00 0.00 0.00 23.12 19.38 1t1g s ALA 2 CO 0.00 -1.13 1.36 -2.14 0.00 0.00 0.00 175.76 173.85 1t1g s PRO 3 N 3.17 3.87 0.34 0.00 0.02 -1.26 -5.01 135.00 136.13 1t1g s PRO 3 Ca 0.66 2.28 0.06 0.00 0.02 0.00 0.00 61.00 64.02 1t1g s PRO 3 Cb -0.30 -2.73 -0.02 0.00 0.02 0.00 0.00 34.50 31.46 1t1g s PRO 3 CO 0.25 -0.61 0.22 0.25 -0.33 0.00 0.00 177.00 176.78 1t1g n THR 4 N 0.03 0.00 -3.48 0.99 -2.24 0.23 -5.02 114.28 104.79 1t1g n THR 4 Ca 0.04 -2.29 -0.13 0.00 -2.27 0.00 0.00 64.05 59.40 1t1g n THR 4 Cb 0.43 1.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.66 1t1g n THR 4 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t1g s ALA 5 N -3.20 -1.51 0.14 6.98 0.00 -1.26 -2.97 121.76 119.93 1t1g s ALA 5 Ca 0.32 0.57 0.05 0.00 0.00 0.00 0.00 51.96 52.89 1t1g s ALA 5 Cb 0.02 0.67 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 1t1g s ALA 5 CO 0.22 -0.66 -0.11 0.71 0.00 0.00 0.00 175.76 175.92 1t1g s TYR 6 N -3.21 1.29 0.45 0.00 1.51 0.12 -4.91 117.35 112.61 1t1g s TYR 6 Ca -0.01 -0.69 -0.03 0.00 -1.01 0.00 0.00 57.07 55.32 1t1g s TYR 6 Cb -0.00 -0.66 -0.03 0.00 -0.11 0.00 0.00 41.96 41.16 1t1g s TYR 6 CO -0.08 0.10 0.72 0.95 -1.11 0.00 0.00 175.55 176.14 1t1g s THR 7 N -2.97 4.78 0.38 -0.71 -4.23 -1.26 0.10 115.64 111.72 1t1g s THR 7 Ca 0.14 -0.06 0.09 0.00 -1.18 0.00 0.00 61.69 60.69 1t1g s THR 7 Cb 0.00 -3.80 0.31 0.00 1.34 0.00 0.00 72.50 70.36 1t1g s THR 7 CO 0.01 -0.70 1.94 -0.65 -0.54 0.00 0.00 174.62 174.69 1t1g h PRO 8 N 0.35 0.61 -0.30 3.99 0.11 -1.95 -1.76 132.00 133.04 1t1g h PRO 8 Ca -0.47 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1t1g h PRO 8 Cb 1.22 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1t1g h PRO 8 CO 0.61 0.40 0.03 -0.07 -0.21 0.00 0.00 178.00 178.77 1t1g h LEU 9 N 0.62 0.41 -0.40 2.35 -0.00 -1.93 -1.38 115.31 114.99 1t1g h LEU 9 Ca 0.34 -0.06 -0.07 0.00 -0.00 0.00 0.00 57.88 58.09 1t1g h LEU 9 Cb 0.48 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.02 1t1g h LEU 9 CO -0.12 0.45 -0.01 0.44 -0.00 0.00 0.00 178.44 179.21 1t1g h ASP 10 N 0.44 0.70 -0.44 -0.43 3.45 -1.70 -1.39 116.42 117.05 1t1g h ASP 10 Ca 0.10 -0.31 -0.12 0.00 0.43 0.00 0.00 57.03 57.13 1t1g h ASP 10 Cb 0.24 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.81 1t1g h ASP 10 CO 0.00 0.84 -0.20 0.58 -1.57 0.00 0.00 179.24 178.90 1t1g h VAL 11 N 0.53 1.27 -0.74 -1.35 2.07 -1.38 -1.49 116.25 115.17 1t1g h VAL 11 Ca 0.11 -1.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 1t1g h VAL 11 Cb 0.49 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 1t1g h VAL 11 CO 0.02 0.46 0.41 0.00 0.02 0.00 0.00 177.57 178.48 1t1g h ALA 12 N 0.84 1.33 -0.48 1.67 0.00 -1.19 -1.33 119.26 120.10 1t1g h ALA 12 Ca 0.10 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1t1g h ALA 12 Cb 0.76 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1t1g h ALA 12 CO 0.06 0.55 -0.04 0.37 0.00 0.00 0.00 179.25 180.20 1t1g h GLN 13 N 1.03 0.88 -0.66 0.00 5.75 -1.02 -1.30 115.11 119.79 1t1g h GLN 13 Ca 0.26 -0.30 -0.03 0.00 -0.15 0.00 0.00 58.65 58.44 1t1g h GLN 13 Cb 0.01 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.46 1t1g h GLN 13 CO -0.04 0.94 0.30 0.00 -2.65 0.00 0.00 178.83 177.37 1t1g h ALA 14 N 0.91 1.30 -0.34 3.38 0.00 -0.67 -1.74 119.26 122.09 1t1g h ALA 14 Ca 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1t1g h ALA 14 Cb 0.56 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1t1g h ALA 14 CO 0.03 0.54 0.00 0.66 0.00 0.00 0.00 179.25 180.48 1t1g n TYR 15 N -4.33 0.51 -3.79 0.00 0.53 -0.56 -4.83 117.16 104.69 1t1g n TYR 15 Ca 0.06 -0.24 -0.24 0.00 -1.02 0.00 0.00 57.90 56.46 1t1g n TYR 15 Cb 0.14 -0.02 0.01 0.00 -1.03 0.00 0.00 39.34 38.44 1t1g n TYR 15 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 1t1g n GLN 16 N 0.50 -3.62 -1.79 -0.72 6.02 -0.66 -0.53 117.38 116.58 1t1g n GLN 16 Ca 0.12 0.51 -0.39 0.00 -0.01 0.00 0.00 57.00 57.23 1t1g n GLN 16 Cb 0.32 -4.77 0.03 0.00 1.02 0.00 0.00 30.24 26.85 1t1g n GLN 16 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1t1g s PHE 17 N -3.75 2.35 0.19 1.08 0.40 -0.58 -0.66 117.98 117.02 1t1g s PHE 17 Ca 0.09 1.33 -0.31 0.00 -0.60 0.00 0.00 56.93 57.44 1t1g s PHE 17 Cb -0.03 -3.85 -0.10 0.00 0.51 0.00 0.00 43.02 39.55 1t1g s PHE 17 CO 0.85 -2.91 1.57 -1.25 0.70 0.00 0.00 175.22 174.18 1t1g s PRO 18 N -2.73 4.21 0.64 0.24 0.04 -1.26 -4.72 135.00 131.41 1t1g s PRO 18 Ca 0.67 2.39 -0.11 0.00 0.04 0.00 0.00 61.00 64.00 1t1g s PRO 18 Cb -0.42 -3.13 -0.02 0.00 0.04 0.00 0.00 34.50 30.97 1t1g s PRO 18 CO 0.51 -0.60 1.03 -1.21 0.04 0.00 0.00 177.00 176.77 1t1g s GLU 19 N 0.84 3.37 0.00 4.56 0.41 -1.26 -4.13 118.70 122.50 1t1g s GLU 19 Ca 0.69 0.63 0.00 0.00 -0.41 0.00 0.00 54.97 55.87 1t1g s GLU 19 Cb -0.44 -2.08 0.00 0.00 -1.78 0.00 0.00 34.13 29.82 1t1g s GLU 19 CO 0.34 -0.69 0.00 0.41 -0.49 0.00 0.00 175.26 174.83 1t1g n GLY 20 N -2.79 0.36 3.16 -1.39 0.00 -1.26 -4.99 105.19 98.26 1t1g n GLY 20 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1t1g n GLY 20 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t1g s LEU 21 N 0.00 1.93 0.00 0.99 1.43 -1.26 -5.03 118.68 116.75 1t1g s LEU 21 Ca 0.00 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 1t1g s LEU 21 Cb 0.00 -1.08 0.00 0.00 0.03 0.00 0.00 46.19 45.14 1t1g s LEU 21 CO 0.00 0.16 0.74 -0.90 0.23 0.00 0.00 176.35 176.57 1t1g n ASP 22 N 3.23 0.96 0.00 2.29 5.75 -1.26 -4.91 116.55 122.60 1t1g n ASP 22 Ca -0.19 -1.48 0.00 0.00 -0.01 0.00 0.00 54.79 53.12 1t1g n ASP 22 Cb 0.53 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.62 1t1g n ASP 22 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1t1g n GLY 23 N -0.24 0.69 3.65 6.12 0.00 -1.26 -0.48 105.19 113.67 1t1g n GLY 23 Ca 0.00 -0.22 -0.47 0.00 0.00 0.00 0.00 46.02 45.33 1t1g n GLY 23 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1t1g n GLN 24 N -2.58 1.93 -0.53 1.61 -0.06 -1.25 -1.25 117.38 115.25 1t1g n GLN 24 Ca 0.00 0.69 0.00 0.00 -2.00 0.00 0.00 57.00 55.69 1t1g n GLN 24 Cb 0.00 -2.40 0.00 0.00 -4.06 0.00 0.00 30.24 23.78 1t1g n GLN 24 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1t1g n GLY 25 N 2.86 1.06 3.77 1.69 0.00 -1.26 -4.75 105.19 108.56 1t1g n GLY 25 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 1t1g n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1t1g s GLN 26 N -0.34 2.72 -0.06 1.61 -1.52 -0.38 -5.03 119.66 116.67 1t1g s GLN 26 Ca 0.00 -1.17 0.00 0.00 -1.95 0.00 0.00 55.36 52.24 1t1g s GLN 26 Cb 0.00 -2.44 0.02 0.00 -0.22 0.00 0.00 33.01 30.38 1t1g s GLN 26 CO 0.00 0.39 -0.04 0.00 -0.25 0.00 0.00 175.29 175.39 1t1g s ILE 28 N 1.32 4.31 -0.11 0.00 1.01 0.07 -1.45 121.20 126.35 1t1g s ILE 28 Ca -0.04 -0.19 -0.11 0.00 0.00 0.00 0.00 60.65 60.30 1t1g s ILE 28 Cb -0.14 -2.96 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 1t1g s ILE 28 CO -0.02 0.42 0.25 0.00 0.00 0.00 0.00 174.94 175.58 1t1g s ALA 29 N 0.93 3.73 -0.09 9.38 0.00 0.52 -1.54 121.76 134.69 1t1g s ALA 29 Ca 0.03 -0.48 0.04 0.00 0.00 0.00 0.00 51.96 51.55 1t1g s ALA 29 Cb -0.14 -2.21 -0.00 0.00 0.00 0.00 0.00 23.12 20.76 1t1g s ALA 29 CO 0.02 0.39 -0.23 0.42 0.00 0.00 0.00 175.76 176.36 1t1g s ILE 30 N -0.50 1.99 -0.13 0.00 1.01 -0.27 -0.55 121.20 122.75 1t1g s ILE 30 Ca 0.17 -0.99 -0.13 0.00 0.00 0.00 0.00 60.65 59.69 1t1g s ILE 30 Cb -0.13 -1.71 -0.05 0.00 0.01 0.00 0.00 42.46 40.58 1t1g s ILE 30 CO 0.06 0.55 0.30 -0.63 0.00 0.00 0.00 174.94 175.22 1t1g s ILE 31 N 0.25 5.28 -0.06 2.92 1.09 -1.08 -0.73 121.20 128.86 1t1g s ILE 31 Ca -0.15 0.58 -0.00 0.00 -1.10 0.00 0.00 60.65 59.98 1t1g s ILE 31 Cb -0.17 -3.63 0.02 0.00 -1.06 0.00 0.00 42.46 37.63 1t1g s ILE 31 CO 0.07 0.44 -0.03 0.00 -0.10 0.00 0.00 174.94 175.32 1t1g s ALA 32 N 0.09 0.76 -1.58 9.38 0.00 -0.50 -4.64 121.76 125.26 1t1g s ALA 32 Ca 0.18 -0.14 0.19 0.00 0.00 0.00 0.00 51.96 52.18 1t1g s ALA 32 Cb -0.14 -0.62 0.55 0.00 0.00 0.00 0.00 23.12 22.92 1t1g s ALA 32 CO 0.06 -0.26 1.46 1.28 0.00 0.00 0.00 175.76 178.30 1t1g n LEU 33 N 4.64 3.73 -3.63 0.00 4.77 -1.26 -1.96 117.00 123.28 1t1g n LEU 33 Ca -0.15 -2.05 0.01 0.00 -0.03 0.00 0.00 56.01 53.79 1t1g n LEU 33 Cb 0.50 -0.42 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 1t1g n LEU 33 CO 0.17 0.90 1.03 -0.83 -1.33 0.00 0.00 177.39 177.33 1t1g s GLY 34 N -1.01 -0.39 0.00 -0.72 0.00 -1.26 -3.89 107.32 100.04 1t1g s GLY 34 Ca 0.42 0.69 0.00 0.00 0.00 0.00 0.00 44.72 45.82 1t1g s GLY 34 CO 0.27 0.13 0.00 0.61 0.00 0.00 0.00 173.10 174.11 1t1g n GLY 35 N -0.47 0.84 0.00 0.20 0.00 -1.26 -4.81 105.19 99.69 1t1g n GLY 35 Ca -0.08 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1t1g n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t1g n GLY 36 N 0.00 0.65 3.11 -0.02 0.00 -1.23 -2.76 105.19 104.94 1t1g n GLY 36 Ca 0.00 -0.77 -0.12 0.00 0.00 0.00 0.00 46.02 45.13 1t1g n GLY 36 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1t1g s TYR 37 N -2.56 0.77 -0.03 1.61 -0.85 -1.26 -4.50 117.35 110.53 1t1g s TYR 37 Ca 0.00 -0.70 0.06 0.00 -0.52 0.00 0.00 57.07 55.91 1t1g s TYR 37 Cb 0.00 -0.45 -0.02 0.00 0.38 0.00 0.00 41.96 41.86 1t1g s TYR 37 CO 0.00 -0.12 -0.21 0.16 -1.52 0.00 0.00 175.55 173.86 1t1g s ASP 38 N -2.28 3.47 0.47 -0.18 -4.77 -1.26 -4.68 116.67 107.45 1t1g s ASP 38 Ca 0.00 -0.36 0.13 0.00 -3.30 0.00 0.00 52.55 49.03 1t1g s ASP 38 Cb -0.03 -0.55 1.09 0.00 -1.09 0.00 0.00 42.92 42.34 1t1g s ASP 38 CO -0.02 0.33 2.09 -0.33 0.70 0.00 0.00 175.17 177.93 1t1g h GLU 39 N 5.39 0.15 0.08 2.11 3.07 -2.01 -2.98 114.58 120.39 1t1g h GLU 39 Ca -0.45 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.40 1t1g h GLU 39 Cb 1.13 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 1t1g h GLU 39 CO 0.48 0.14 -0.04 1.15 -1.40 0.00 0.00 179.01 179.35 1t1g h THR 40 N 0.15 0.94 -0.57 1.13 2.02 -1.99 -0.98 112.91 113.62 1t1g h THR 40 Ca 0.04 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1t1g h THR 40 Cb 0.07 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 1t1g h THR 40 CO -0.00 0.02 0.37 0.28 0.37 0.00 0.00 175.52 176.56 1t1g h SER 41 N -0.14 0.65 -0.21 4.18 0.02 -1.88 -1.76 113.55 114.41 1t1g h SER 41 Ca -0.01 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1t1g h SER 41 Cb 0.11 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 1t1g h SER 41 CO 0.02 0.48 0.06 -0.07 -1.14 0.00 0.00 176.83 176.18 1t1g h LEU 42 N 0.77 0.30 -0.40 5.07 3.38 -1.43 -1.50 115.31 121.50 1t1g h LEU 42 Ca 0.21 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1t1g h LEU 42 Cb -0.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1t1g h LEU 42 CO -0.04 0.43 0.24 0.00 0.09 0.00 0.00 178.44 179.16 1t1g h ALA 43 N 0.88 0.51 -0.21 1.53 0.00 -1.11 -1.42 119.26 119.45 1t1g h ALA 43 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1t1g h ALA 43 Cb 0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1t1g h ALA 43 CO -0.00 0.01 0.14 0.37 0.00 0.00 0.00 179.25 179.77 1t1g h GLN 44 N 0.53 0.28 0.14 0.00 4.15 -1.26 -2.05 115.11 116.89 1t1g h GLN 44 Ca 0.14 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 1t1g h GLN 44 Cb 0.01 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.64 1t1g h GLN 44 CO -0.03 0.19 -0.07 -0.92 -1.93 0.00 0.00 178.83 176.07 1t1g h TYR 45 N 0.28 -0.17 -0.52 3.99 5.03 -1.08 -0.60 116.97 123.89 1t1g h TYR 45 Ca 0.08 -0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.32 1t1g h TYR 45 Cb -0.03 0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.29 1t1g h TYR 45 CO -0.06 -0.07 0.07 0.74 -1.32 0.00 0.00 178.16 177.51 1t1g h PHE 46 N -0.22 0.87 -0.27 -3.82 0.04 -1.26 -2.21 116.94 110.07 1t1g h PHE 46 Ca -0.02 -0.10 -0.03 0.00 2.80 0.00 0.00 57.97 60.62 1t1g h PHE 46 Cb 0.18 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 1t1g h PHE 46 CO -0.06 0.77 0.07 0.00 -0.60 0.00 0.00 178.31 178.49 1t1g h ALA 47 N 1.28 0.35 -0.56 2.45 0.00 -1.27 -2.34 119.26 119.18 1t1g h ALA 47 Ca 0.16 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.01 1t1g h ALA 47 Cb 0.38 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1t1g h ALA 47 CO 0.01 0.00 0.38 0.66 0.00 0.00 0.00 179.25 180.30 1t1g h SER 48 N 0.26 0.30 0.14 0.00 4.64 -0.71 0.25 113.55 118.43 1t1g h SER 48 Ca 0.08 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1t1g h SER 48 Cb 0.28 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1t1g h SER 48 CO 0.00 0.18 -0.10 0.18 -0.87 0.00 0.00 176.83 176.22 1t1g n LEU 49 N -4.46 1.03 -0.93 5.97 4.77 -0.87 -4.95 117.00 117.56 1t1g n LEU 49 Ca 0.09 -0.28 -0.09 0.00 -0.03 0.00 0.00 56.01 55.69 1t1g n LEU 49 Cb 0.38 -0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 1t1g n LEU 49 CO 0.34 0.18 -0.11 0.61 -1.33 0.00 0.00 177.39 177.09 1t1g n GLY 50 N 1.23 0.34 3.58 -0.72 0.00 0.08 -5.04 105.19 104.66 1t1g n GLY 50 Ca 0.16 -0.54 -0.29 0.00 0.00 0.00 0.00 46.02 45.35 1t1g n GLY 50 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1t1g s VAL 51 N -2.42 3.33 -0.09 1.61 -7.23 -0.92 -5.05 120.40 109.63 1t1g s VAL 51 Ca 0.00 -1.38 -0.30 0.00 -1.81 0.00 0.00 61.98 58.49 1t1g s VAL 51 Cb 0.00 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 1t1g s VAL 51 CO 0.00 0.04 1.37 -0.55 -0.31 0.00 0.00 175.10 175.65 1t1g s SER 52 N -2.41 6.88 0.04 4.85 0.15 -1.26 -4.40 113.70 117.56 1t1g s SER 52 Ca 0.22 1.92 -0.34 0.00 0.70 0.00 0.00 55.95 58.46 1t1g s SER 52 Cb -0.10 -2.55 -0.12 0.00 -1.71 0.00 0.00 66.02 61.54 1t1g s SER 52 CO 0.14 -0.76 1.76 0.00 1.20 0.00 0.00 173.24 175.58 1t1g n ALA 53 N 6.21 1.27 -1.52 5.45 0.00 -1.26 -4.78 120.51 125.88 1t1g n ALA 53 Ca 0.14 0.35 -0.32 0.00 0.00 0.00 0.00 53.44 53.61 1t1g n ALA 53 Cb 0.44 -2.46 0.04 0.00 0.00 0.00 0.00 19.45 17.48 1t1g n ALA 53 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1t1g s PRO 54 N 2.64 2.89 0.08 0.00 0.04 -1.25 -4.97 135.00 134.43 1t1g s PRO 54 Ca 0.86 1.20 -0.31 0.00 0.04 0.00 0.00 61.00 62.79 1t1g s PRO 54 Cb -0.65 -1.97 -0.06 0.00 0.04 0.00 0.00 34.50 31.85 1t1g s PRO 54 CO 0.44 -1.15 1.27 -0.65 0.04 0.00 0.00 177.00 176.94 1t1g s GLN 55 N -4.43 4.39 -0.11 4.56 -0.21 -1.26 -4.91 119.66 117.71 1t1g s GLN 55 Ca 0.63 1.88 0.02 0.00 0.02 0.00 0.00 55.36 57.91 1t1g s GLN 55 Cb -0.17 -3.31 0.01 0.00 1.00 0.00 0.00 33.01 30.54 1t1g s GLN 55 CO 0.45 -0.32 -0.17 0.08 -2.12 0.00 0.00 175.29 173.22 1t1g s VAL 56 N 1.05 1.60 0.10 1.09 1.01 -1.26 -0.23 120.40 123.75 1t1g s VAL 56 Ca 0.61 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 61.93 1t1g s VAL 56 Cb -0.32 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 1t1g s VAL 56 CO 0.30 0.46 -0.15 0.68 0.00 0.00 0.00 175.10 176.39 1t1g s VAL 57 N 0.83 1.25 -0.05 2.92 -7.23 0.07 -4.99 120.40 113.20 1t1g s VAL 57 Ca -0.09 -1.51 -0.02 0.00 -1.81 0.00 0.00 61.98 58.54 1t1g s VAL 57 Cb -0.16 -1.32 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 1t1g s VAL 57 CO 0.01 -0.30 0.05 -0.44 -0.31 0.00 0.00 175.10 174.11 1t1g s SER 58 N -2.08 5.58 -0.10 4.85 0.01 -1.26 -0.39 113.70 120.31 1t1g s SER 58 Ca 0.04 0.18 0.02 0.00 1.31 0.00 0.00 55.95 57.50 1t1g s SER 58 Cb -0.08 -1.62 0.01 0.00 0.21 0.00 0.00 66.02 64.55 1t1g s SER 58 CO 0.03 0.33 -0.15 -0.69 0.41 0.00 0.00 173.24 173.16 1t1g s VAL 59 N -1.05 1.47 -0.15 3.43 1.01 0.36 -4.90 120.40 120.56 1t1g s VAL 59 Ca 0.18 -0.64 -0.21 0.00 0.00 0.00 0.00 61.98 61.30 1t1g s VAL 59 Cb -0.12 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 1t1g s VAL 59 CO 0.08 0.43 0.63 -0.55 0.00 0.00 0.00 175.10 175.69 1t1g s SER 60 N 0.83 6.76 -0.12 3.32 0.15 -1.26 -1.57 113.70 121.81 1t1g s SER 60 Ca -0.10 0.92 0.03 0.00 0.70 0.00 0.00 55.95 57.49 1t1g s SER 60 Cb -0.16 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 1t1g s SER 60 CO 0.01 -0.20 -0.21 -0.69 1.20 0.00 0.00 173.24 173.35 1t1g s VAL 61 N 1.46 2.24 -1.50 4.45 1.01 -0.22 -4.70 120.40 123.14 1t1g s VAL 61 Ca 0.30 -0.94 -0.13 0.00 0.00 0.00 0.00 61.98 61.22 1t1g s VAL 61 Cb -0.16 -1.89 0.09 0.00 0.00 0.00 0.00 36.38 34.42 1t1g s VAL 61 CO 0.12 0.55 0.81 0.47 0.00 0.00 0.00 175.10 177.05 1t1g n ASP 62 N 3.74 -4.47 0.00 3.32 10.43 -1.26 -1.73 116.55 126.58 1t1g n ASP 62 Ca -0.19 -0.67 0.00 0.00 2.57 0.00 0.00 54.79 56.49 1t1g n ASP 62 Cb 0.52 -3.61 0.00 0.00 1.84 0.00 0.00 41.12 39.88 1t1g n ASP 62 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1t1g n GLY 63 N -1.51 2.49 3.79 0.44 0.00 -1.26 -4.75 105.19 104.39 1t1g n GLY 63 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1t1g n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t1g s ALA 64 N -2.72 2.96 0.26 4.61 0.00 -0.71 -5.05 121.76 121.11 1t1g s ALA 64 Ca 0.00 0.67 0.02 0.00 0.00 0.00 0.00 51.96 52.65 1t1g s ALA 64 Cb 0.00 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 1t1g s ALA 64 CO 0.00 -0.30 0.22 0.95 0.00 0.00 0.00 175.76 176.62 1t1g s THR 65 N -1.82 0.00 -0.47 0.00 -4.23 -1.26 -3.48 115.64 104.37 1t1g s THR 65 Ca 0.63 -1.97 -0.28 0.00 -1.18 0.00 0.00 61.69 58.90 1t1g s THR 65 Cb -0.19 -2.50 -0.02 0.00 1.34 0.00 0.00 72.50 71.13 1t1g s THR 65 CO 0.24 0.00 1.79 0.21 -0.54 0.00 0.00 174.62 176.32 1t1g s ASN 66 N -3.25 5.64 -0.49 3.99 2.47 -1.26 -4.92 114.94 117.11 1t1g s ASN 66 Ca 0.39 0.81 0.04 0.00 0.42 0.00 0.00 52.86 54.52 1t1g s ASN 66 Cb 0.04 -2.53 0.17 0.00 -1.45 0.00 0.00 41.25 37.48 1t1g s ASN 66 CO 0.19 -2.00 0.37 -1.10 -3.72 0.00 0.00 177.10 170.84 1t1g s GLN 67 N 6.24 1.35 0.40 0.43 -1.52 -1.11 -4.89 119.66 120.56 1t1g s GLN 67 Ca 0.72 -2.40 -0.26 0.00 -1.95 0.00 0.00 55.36 51.47 1t1g s GLN 67 Cb -0.17 -2.04 -0.09 0.00 -0.22 0.00 0.00 33.01 30.49 1t1g s GLN 67 CO 0.28 -1.33 1.36 -1.25 -0.25 0.00 0.00 175.29 174.10 1t1g s PRO 68 N -0.28 3.97 0.21 2.91 0.04 -1.26 -3.52 135.00 137.08 1t1g s PRO 68 Ca 0.29 2.29 0.23 0.00 0.04 0.00 0.00 61.00 63.85 1t1g s PRO 68 Cb -0.02 -2.81 0.10 0.00 0.04 0.00 0.00 34.50 31.81 1t1g s PRO 68 CO -0.16 -0.54 1.16 1.79 0.04 0.00 0.00 177.00 179.29 1t1g h THR 69 N 2.58 0.00 0.00 1.26 1.35 -1.89 -3.46 112.91 112.75 1t1g h THR 69 Ca -0.50 -0.90 0.00 0.00 -0.55 0.00 0.00 66.41 64.46 1t1g h THR 69 Cb 1.25 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 1t1g h THR 69 CO 0.63 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.51 1t1g n GLY 70 N 1.20 1.15 3.56 5.82 0.00 -1.26 -5.03 105.19 110.62 1t1g n GLY 70 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1t1g n GLY 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1t1g s ASP 71 N -2.56 6.43 0.39 1.61 3.68 -1.26 -4.91 116.67 120.05 1t1g s ASP 71 Ca 0.00 0.02 0.27 0.00 2.13 0.00 0.00 52.55 54.97 1t1g s ASP 71 Cb 0.00 -2.35 1.41 0.00 -1.45 0.00 0.00 42.92 40.52 1t1g s ASP 71 CO 0.00 -0.74 1.82 1.55 0.13 0.00 0.00 175.17 177.93 1t1g h PRO 72 N 8.68 0.00 -0.20 4.34 0.13 -1.91 -0.47 132.00 142.58 1t1g h PRO 72 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1t1g h PRO 72 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1t1g h PRO 72 CO 0.89 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.75 1t1g n ASN 73 N -2.46 2.84 -0.45 1.44 5.03 -1.26 -4.38 115.26 116.02 1t1g n ASN 73 Ca -0.01 -1.90 0.00 0.00 0.87 0.00 0.00 54.58 53.53 1t1g n ASN 73 Cb 0.08 -0.12 0.00 0.00 -1.02 0.00 0.00 39.78 38.72 1t1g n ASN 73 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1t1g n GLY 74 N 1.37 1.83 0.32 7.41 0.00 -0.19 -4.94 105.19 110.98 1t1g n GLY 74 Ca 0.17 -2.04 0.19 0.00 0.00 0.00 0.00 46.02 44.33 1t1g n GLY 74 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t1g h PRO 75 N 0.00 0.00 -0.38 1.61 0.13 -1.93 -1.56 132.00 129.87 1t1g h PRO 75 Ca 0.00 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.19 1t1g h PRO 75 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1t1g h PRO 75 CO 0.00 0.00 0.26 -0.44 -0.23 0.00 0.00 178.00 177.59 1t1g h ASP 76 N 0.00 0.24 -0.92 1.44 3.45 -1.81 -0.48 116.42 118.34 1t1g h ASP 76 Ca 0.01 -0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.48 1t1g h ASP 76 Cb 0.08 -0.05 -0.05 0.00 -0.56 0.00 0.00 39.33 38.75 1t1g h ASP 76 CO -0.00 0.16 0.61 1.23 -1.57 0.00 0.00 179.24 179.67 1t1g h GLY 77 N 0.27 1.30 0.57 2.75 0.00 -1.48 -0.46 103.07 106.02 1t1g h GLY 77 Ca 0.17 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1t1g h GLY 77 CO -0.03 0.47 -0.07 -2.09 0.00 0.00 0.00 176.54 174.82 1t1g h GLU 78 N 1.25 -0.19 -0.18 4.80 4.57 -1.26 -1.98 114.58 121.58 1t1g h GLU 78 Ca 0.34 0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.56 1t1g h GLU 78 Cb -0.15 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.46 1t1g h GLU 78 CO -0.07 0.19 0.01 0.28 -1.18 0.00 0.00 179.01 178.24 1t1g h VAL 79 N -0.64 0.89 -0.12 0.32 2.07 -1.23 -1.77 116.25 115.77 1t1g h VAL 79 Ca -0.02 -0.02 -0.15 0.00 0.82 0.00 0.00 66.70 67.33 1t1g h VAL 79 Cb 0.48 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1t1g h VAL 79 CO 0.03 0.01 -0.55 -0.33 0.02 0.00 0.00 177.57 176.75 1t1g h GLU 80 N 0.07 0.36 -0.34 1.57 5.08 -1.19 -2.54 114.58 117.59 1t1g h GLU 80 Ca 0.08 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1t1g h GLU 80 Cb 0.10 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 1t1g h GLU 80 CO -0.13 0.82 0.22 1.25 -1.00 0.00 0.00 179.01 180.17 1t1g h LEU 81 N 0.28 0.40 -0.19 1.33 5.85 -1.16 -0.30 115.31 121.51 1t1g h LEU 81 Ca 0.00 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.72 1t1g h LEU 81 Cb 1.06 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 1t1g h LEU 81 CO 0.09 0.30 0.08 0.44 -0.34 0.00 0.00 178.44 179.01 1t1g h ASP 82 N 0.46 0.10 -0.36 1.25 3.45 -1.18 -0.91 116.42 119.24 1t1g h ASP 82 Ca 0.13 0.01 -0.07 0.00 0.43 0.00 0.00 57.03 57.53 1t1g h ASP 82 Cb -0.04 -0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.72 1t1g h ASP 82 CO -0.03 0.09 -0.05 0.40 -1.57 0.00 0.00 179.24 178.08 1t1g h ILE 83 N 0.17 1.27 -0.54 0.35 2.04 -1.34 -2.28 117.51 117.19 1t1g h ILE 83 Ca 0.08 -1.08 -0.08 0.00 1.00 0.00 0.00 64.86 64.78 1t1g h ILE 83 Cb 0.04 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1t1g h ILE 83 CO -0.07 0.36 0.01 -0.33 0.00 0.00 0.00 178.15 178.12 1t1g h GLU 84 N 0.47 0.94 0.01 2.37 5.08 -0.95 0.21 114.58 122.71 1t1g h GLU 84 Ca 0.10 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1t1g h GLU 84 Cb 0.54 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1t1g h GLU 84 CO 0.03 0.95 -0.01 0.28 -1.00 0.00 0.00 179.01 179.26 1t1g h VAL 85 N 0.82 1.31 -0.29 3.13 2.07 -1.19 -1.78 116.25 120.32 1t1g h VAL 85 Ca 0.15 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.65 1t1g h VAL 85 Cb 0.52 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1t1g h VAL 85 CO 0.03 0.25 0.01 0.00 0.02 0.00 0.00 177.57 177.88 1t1g h ALA 86 N 0.54 0.39 -0.20 1.67 0.00 -1.43 -3.06 119.26 117.16 1t1g h ALA 86 Ca -0.00 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 1t1g h ALA 86 Cb 0.43 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1t1g h ALA 86 CO 0.00 0.12 -0.30 0.78 0.00 0.00 0.00 179.25 179.86 1t1g h GLY 87 N 0.30 0.42 2.00 0.00 0.00 -0.66 -0.63 103.07 104.51 1t1g h GLY 87 Ca 0.08 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 46.96 1t1g h GLY 87 CO 0.01 0.32 -0.45 0.00 0.00 0.00 0.00 176.54 176.43 1t1g h ALA 88 N 1.35 1.05 0.00 3.60 0.00 -1.34 -1.89 119.26 122.03 1t1g h ALA 88 Ca 0.05 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1t1g h ALA 88 Cb 0.70 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1t1g h ALA 88 CO 0.05 0.56 -1.58 1.28 0.00 0.00 0.00 179.25 179.56 1t1g n LEU 89 N -3.70 0.34 -2.93 0.00 4.77 -1.10 -4.45 117.00 109.94 1t1g n LEU 89 Ca -0.01 0.02 -0.17 0.00 -0.03 0.00 0.00 56.01 55.81 1t1g n LEU 89 Cb 0.52 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1t1g n LEU 89 CO 0.39 -0.01 -0.10 0.00 -1.33 0.00 0.00 177.39 176.33 1t1g n ALA 90 N -2.12 3.09 0.26 -1.18 0.00 -0.26 -4.85 120.51 115.46 1t1g n ALA 90 Ca -0.02 -3.59 0.18 0.00 0.00 0.00 0.00 53.44 50.01 1t1g n ALA 90 Cb 0.53 -0.87 0.95 0.00 0.00 0.00 0.00 19.45 20.05 1t1g n ALA 90 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1t1g h PRO 91 N 2.96 0.00 0.00 0.00 0.13 -1.26 -1.33 132.00 132.50 1t1g h PRO 91 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1t1g h PRO 91 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1t1g h PRO 91 CO 0.58 0.00 -0.18 0.41 -0.23 0.00 0.00 178.00 178.58 1t1g n GLY 92 N -1.15 -1.56 3.90 1.56 0.00 0.37 -3.82 105.19 104.49 1t1g n GLY 92 Ca -0.02 -0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 1t1g n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t1g s ALA 93 N -3.08 3.29 -0.09 4.61 0.00 -0.50 -3.83 121.76 122.16 1t1g s ALA 93 Ca 0.10 -0.42 -0.11 0.00 0.00 0.00 0.00 51.96 51.53 1t1g s ALA 93 Cb 0.14 -2.73 -0.05 0.00 0.00 0.00 0.00 23.12 20.48 1t1g s ALA 93 CO 0.62 -0.52 0.27 0.15 0.00 0.00 0.00 175.76 176.28 1t1g s LYS 94 N -4.91 3.81 -0.18 0.00 1.02 -0.24 -4.15 119.74 115.10 1t1g s LYS 94 Ca 0.51 0.12 -0.05 0.00 0.02 0.00 0.00 55.97 56.57 1t1g s LYS 94 Cb -0.11 -3.26 -0.03 0.00 -0.52 0.00 0.00 37.83 33.92 1t1g s LYS 94 CO 0.48 0.62 -0.00 0.42 -0.92 0.00 0.00 175.35 175.94 1t1g s ILE 95 N -0.69 4.05 -0.16 2.17 -1.09 0.67 -0.75 121.20 125.41 1t1g s ILE 95 Ca 0.18 -0.29 0.01 0.00 -2.23 0.00 0.00 60.65 58.33 1t1g s ILE 95 Cb -0.14 -2.81 0.02 0.00 -1.58 0.00 0.00 42.46 37.95 1t1g s ILE 95 CO 0.07 0.45 -0.19 0.00 -1.23 0.00 0.00 174.94 174.05 1t1g s ALA 96 N 0.69 2.19 -0.26 9.38 0.00 -0.59 -0.75 121.76 132.41 1t1g s ALA 96 Ca -0.00 -1.10 -0.08 0.00 0.00 0.00 0.00 51.96 50.77 1t1g s ALA 96 Cb -0.14 -1.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 1t1g s ALA 96 CO 0.02 -0.26 0.10 0.08 0.00 0.00 0.00 175.76 175.71 1t1g s VAL 97 N 1.19 4.55 -0.40 0.00 1.01 0.48 -1.11 120.40 126.11 1t1g s VAL 97 Ca 0.01 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.71 1t1g s VAL 97 Cb -0.14 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.10 1t1g s VAL 97 CO -0.09 0.29 0.36 -0.31 0.00 0.00 0.00 175.10 175.35 1t1g s TYR 98 N 1.65 3.21 -0.15 5.22 1.51 0.09 -0.49 117.35 128.39 1t1g s TYR 98 Ca 0.06 -0.42 -0.15 0.00 -1.01 0.00 0.00 57.07 55.55 1t1g s TYR 98 Cb -0.15 -2.71 -0.04 0.00 -0.11 0.00 0.00 41.96 38.94 1t1g s TYR 98 CO 0.05 -0.60 0.36 -0.06 -1.11 0.00 0.00 175.55 174.19 1t1g s PHE 99 N 1.90 3.47 0.12 2.71 0.40 -0.61 -1.41 117.98 124.56 1t1g s PHE 99 Ca 0.09 0.68 -0.02 0.00 -0.60 0.00 0.00 56.93 57.08 1t1g s PHE 99 Cb -0.18 -2.42 -0.04 0.00 0.51 0.00 0.00 43.02 40.89 1t1g s PHE 99 CO 0.12 0.20 0.06 0.00 0.70 0.00 0.00 175.22 176.30 1t1g s ALA 100 N 0.58 0.74 0.69 5.36 0.00 -0.83 -1.06 121.76 127.25 1t1g s ALA 100 Ca 0.19 -1.38 -0.16 0.00 0.00 0.00 0.00 51.96 50.62 1t1g s ALA 100 Cb -0.14 0.78 0.02 0.00 0.00 0.00 0.00 23.12 23.79 1t1g s ALA 100 CO 0.06 -0.48 1.19 -2.14 0.00 0.00 0.00 175.76 174.39 1t1g s PRO 101 N -4.02 2.39 -1.40 0.00 0.02 -1.26 -4.39 135.00 126.33 1t1g s PRO 101 Ca 0.21 1.71 -0.11 0.00 0.02 0.00 0.00 61.00 62.83 1t1g s PRO 101 Cb 0.07 -1.87 0.08 0.00 0.02 0.00 0.00 34.50 32.80 1t1g s PRO 101 CO -0.00 -1.63 2.22 -1.71 -0.33 0.00 0.00 177.00 175.55 1t1g n ASN 102 N -2.48 5.35 -4.20 2.53 5.15 -1.25 -4.09 115.26 116.28 1t1g n ASN 102 Ca 0.13 -2.93 -0.12 0.00 -0.60 0.00 0.00 54.58 51.06 1t1g n ASN 102 Cb 0.50 -1.55 -0.10 0.00 -0.53 0.00 0.00 39.78 38.10 1t1g n ASN 102 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1t1g s THR 103 N 1.63 0.29 0.19 -0.44 -4.23 -1.26 -5.03 115.64 106.78 1t1g s THR 103 Ca 0.48 -1.95 -0.13 0.00 -1.18 0.00 0.00 61.69 58.91 1t1g s THR 103 Cb 0.13 -2.17 0.09 0.00 1.34 0.00 0.00 72.50 71.89 1t1g s THR 103 CO -0.05 -0.37 1.85 0.44 -0.54 0.00 0.00 174.62 175.95 1t1g h ASP 104 N 2.75 0.67 -0.29 3.99 5.19 -2.00 -1.35 116.42 125.37 1t1g h ASP 104 Ca -0.36 -0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 55.94 1t1g h ASP 104 Cb 1.21 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.54 1t1g h ASP 104 CO 0.59 0.48 -0.15 0.00 -3.12 0.00 0.00 179.24 177.05 1t1g h ALA 105 N 1.23 0.99 -0.45 3.45 0.00 -1.97 -2.00 119.26 120.51 1t1g h ALA 105 Ca 0.22 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1t1g h ALA 105 Cb -0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1t1g h ALA 105 CO -0.06 0.60 0.08 0.78 0.00 0.00 0.00 179.25 180.65 1t1g h GLY 106 N 0.98 0.80 1.00 0.00 0.00 -1.66 0.68 103.07 104.86 1t1g h GLY 106 Ca 0.11 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.90 1t1g h GLY 106 CO 0.04 0.49 -0.04 -2.75 0.00 0.00 0.00 176.54 174.28 1t1g h PHE 107 N 0.61 -0.10 -0.03 5.60 -0.00 -1.11 -0.73 116.94 121.17 1t1g h PHE 107 Ca 0.14 -0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.11 1t1g h PHE 107 Cb 0.38 0.03 -0.00 0.00 -0.00 0.00 0.00 35.95 36.36 1t1g h PHE 107 CO 0.03 -0.06 0.01 1.25 -0.00 0.00 0.00 178.31 179.53 1t1g h LEU 108 N -0.11 0.00 -1.41 0.59 5.85 -1.26 -2.65 115.31 116.33 1t1g h LEU 108 Ca -0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1t1g h LEU 108 Cb 0.09 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1t1g h LEU 108 CO 0.02 0.01 0.29 0.78 -0.34 0.00 0.00 178.44 179.19 1t1g h ASN 109 N 0.02 0.61 -0.48 1.25 -0.26 -0.70 -1.44 115.58 114.58 1t1g h ASN 109 Ca 0.01 -0.04 -0.06 0.00 -0.56 0.00 0.00 56.30 55.66 1t1g h ASN 109 Cb 0.01 -0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 37.10 1t1g h ASN 109 CO -0.02 0.48 0.08 0.00 -1.06 0.00 0.00 177.43 176.92 1t1g h ALA 110 N 1.62 0.63 0.02 -0.83 0.00 -0.97 -0.75 119.26 118.98 1t1g h ALA 110 Ca 0.18 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1t1g h ALA 110 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1t1g h ALA 110 CO -0.03 0.36 -0.01 0.82 0.00 0.00 0.00 179.25 180.39 1t1g h ILE 111 N 0.66 1.13 -0.29 0.00 2.04 -1.05 -2.10 117.51 117.91 1t1g h ILE 111 Ca 0.14 -0.45 -0.09 0.00 1.00 0.00 0.00 64.86 65.47 1t1g h ILE 111 Cb 0.39 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1t1g h ILE 111 CO 0.01 0.12 -0.19 0.71 0.00 0.00 0.00 178.15 178.79 1t1g h THR 112 N -0.22 1.25 -0.36 -0.27 1.35 -1.27 -1.02 112.91 112.38 1t1g h THR 112 Ca -0.00 -1.18 -0.03 0.00 -0.55 0.00 0.00 66.41 64.65 1t1g h THR 112 Cb 0.21 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 67.86 1t1g h THR 112 CO 0.00 0.38 0.09 0.74 -0.25 0.00 0.00 175.52 176.48 1t1g h THR 113 N 0.47 1.22 -0.02 6.82 2.02 -1.08 -1.99 112.91 120.35 1t1g h THR 113 Ca 0.08 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 1t1g h THR 113 Cb 0.60 1.03 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1t1g h THR 113 CO 0.04 0.26 0.01 0.00 0.37 0.00 0.00 175.52 176.19 1t1g h ALA 114 N 0.93 0.03 -0.91 6.16 0.00 -1.20 -1.76 119.26 122.51 1t1g h ALA 114 Ca 0.11 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.02 1t1g h ALA 114 Cb 0.29 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 1t1g h ALA 114 CO 0.00 -0.39 0.56 0.28 0.00 0.00 0.00 179.25 179.70 1t1g h VAL 115 N -0.13 0.99 -0.64 0.00 2.07 -1.11 -2.92 116.25 114.51 1t1g h VAL 115 Ca 0.01 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1t1g h VAL 115 Cb 0.17 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 1t1g h VAL 115 CO -0.00 0.18 0.00 1.41 0.02 0.00 0.00 177.57 179.18 1t1g n HIS 116 N -4.63 0.84 -1.60 1.57 8.25 -0.76 -4.85 115.22 114.05 1t1g n HIS 116 Ca 0.15 -0.43 -0.41 0.00 -0.26 0.00 0.00 57.72 56.77 1t1g n HIS 116 Cb 0.24 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.32 1t1g n HIS 116 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1t1g s ASP 117 N -1.13 5.12 0.00 0.41 3.68 -0.67 -4.88 116.67 119.21 1t1g s ASP 117 Ca 0.46 1.61 0.26 0.00 2.13 0.00 0.00 52.55 57.00 1t1g s ASP 117 Cb 0.25 -2.51 1.17 0.00 -1.45 0.00 0.00 42.92 40.38 1t1g s ASP 117 CO 0.33 -2.26 1.85 -0.81 0.13 0.00 0.00 175.17 174.40 1t1g n PRO 118 N 8.85 0.11 -0.10 4.34 -0.04 -1.26 -0.40 135.00 146.49 1t1g n PRO 118 Ca 0.32 0.05 -0.24 0.00 -0.04 0.00 0.00 63.50 63.59 1t1g n PRO 118 Cb 0.48 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 1t1g n PRO 118 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1t1g n THR 119 N -1.44 1.58 -0.00 0.52 -1.04 -1.26 -4.59 114.28 108.05 1t1g n THR 119 Ca 0.08 -0.32 -0.01 0.00 -2.04 0.00 0.00 64.05 61.77 1t1g n THR 119 Cb 0.28 -1.86 -0.11 0.00 -1.82 0.00 0.00 70.33 66.82 1t1g n THR 119 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1t1g n HIS 120 N -4.06 0.67 -3.97 -1.42 8.25 -1.25 -5.02 115.22 108.42 1t1g n HIS 120 Ca -0.40 0.22 -0.40 0.00 -0.26 0.00 0.00 57.72 56.88 1t1g n HIS 120 Cb 0.85 -1.00 0.02 0.00 1.12 0.00 0.00 29.99 30.98 1t1g n HIS 120 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1t1g n LYS 121 N -2.78 -0.76 -2.10 -0.41 5.02 0.46 -4.82 118.16 112.76 1t1g n LYS 121 Ca -0.14 0.21 -0.37 0.00 -2.02 0.00 0.00 58.31 55.99 1t1g n LYS 121 Cb 0.87 -3.19 0.01 0.00 -0.02 0.00 0.00 35.03 32.70 1t1g n LYS 121 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1t1g s PRO 122 N -6.96 3.38 -0.00 1.97 0.04 -1.26 -4.63 135.00 127.55 1t1g s PRO 122 Ca 0.42 1.86 0.12 0.00 0.04 0.00 0.00 61.00 63.45 1t1g s PRO 122 Cb -0.21 -2.20 -0.14 0.00 0.04 0.00 0.00 34.50 31.99 1t1g s PRO 122 CO 0.94 -0.88 0.52 -1.13 0.04 0.00 0.00 177.00 176.49 1t1g n SER 123 N -0.98 0.60 -3.87 6.66 3.41 -0.53 -4.92 113.62 114.00 1t1g n SER 123 Ca 0.10 -0.78 -0.12 0.00 -0.26 0.00 0.00 58.87 57.81 1t1g n SER 123 Cb 0.48 1.01 -0.13 0.00 -0.26 0.00 0.00 64.21 65.31 1t1g n SER 123 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1t1g s ILE 124 N -2.18 0.02 -0.09 -1.33 1.01 -1.18 -1.54 121.20 115.91 1t1g s ILE 124 Ca 0.05 -0.13 0.01 0.00 0.00 0.00 0.00 60.65 60.58 1t1g s ILE 124 Cb 0.09 -0.10 0.02 0.00 0.01 0.00 0.00 42.46 42.48 1t1g s ILE 124 CO 0.51 -0.07 -0.11 -0.69 0.00 0.00 0.00 174.94 174.58 1t1g s VAL 125 N -0.20 1.13 -0.16 2.92 1.01 0.59 -0.36 120.40 125.34 1t1g s VAL 125 Ca -0.02 -0.43 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 1t1g s VAL 125 Cb -0.02 -1.07 -0.02 0.00 0.00 0.00 0.00 36.38 35.28 1t1g s VAL 125 CO -0.00 0.37 -0.08 -0.55 0.00 0.00 0.00 175.10 174.83 1t1g s SER 126 N 1.04 4.30 -0.13 3.32 0.15 0.28 -0.93 113.70 121.73 1t1g s SER 126 Ca -0.07 -0.29 0.02 0.00 0.70 0.00 0.00 55.95 56.31 1t1g s SER 126 Cb -0.15 -1.69 0.02 0.00 -1.71 0.00 0.00 66.02 62.49 1t1g s SER 126 CO -0.01 0.13 -0.17 -0.63 1.20 0.00 0.00 173.24 173.76 1t1g s ILE 127 N 0.60 1.71 -0.15 6.45 1.01 0.19 -2.65 121.20 128.36 1t1g s ILE 127 Ca -0.05 -0.75 0.16 0.00 0.00 0.00 0.00 60.65 60.00 1t1g s ILE 127 Cb -0.15 -1.55 0.32 0.00 0.01 0.00 0.00 42.46 41.09 1t1g s ILE 127 CO 0.03 0.48 1.17 -1.20 0.00 0.00 0.00 174.94 175.42 1t1g n SER 128 N 4.35 2.00 -4.33 3.58 7.64 -1.26 -1.81 113.62 123.78 1t1g n SER 128 Ca -0.19 -3.28 -0.27 0.00 1.01 0.00 0.00 58.87 56.14 1t1g n SER 128 Cb 0.51 -0.45 -0.13 0.00 -1.01 0.00 0.00 64.21 63.13 1t1g n SER 128 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1t1g s TRP 129 N -2.79 2.05 -0.03 1.43 0.52 -1.26 -4.83 118.94 114.03 1t1g s TRP 129 Ca 0.33 -0.40 -0.12 0.00 0.02 0.00 0.00 56.10 55.93 1t1g s TRP 129 Cb 0.30 -1.13 0.04 0.00 -1.15 0.00 0.00 33.47 31.53 1t1g s TRP 129 CO -0.01 0.25 0.54 0.41 0.02 0.00 0.00 176.95 178.16 1t1g n GLY 130 N 1.12 0.36 3.55 0.98 0.00 -1.26 -4.51 105.19 105.43 1t1g n GLY 130 Ca -0.18 -0.90 -0.07 0.00 0.00 0.00 0.00 46.02 44.86 1t1g n GLY 130 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1t1g s GLY 131 N -3.29 -0.42 0.01 -0.02 0.00 -0.26 -4.97 107.32 98.38 1t1g s GLY 131 Ca 0.13 0.80 -0.38 0.00 0.00 0.00 0.00 44.72 45.27 1t1g s GLY 131 CO -0.01 0.26 1.35 -1.05 0.00 0.00 0.00 173.10 173.65 1t1g n PRO 132 N -0.30 0.93 -0.14 2.90 -0.02 -1.26 -0.59 135.00 136.52 1t1g n PRO 132 Ca -0.08 0.34 0.11 0.00 -2.02 0.00 0.00 63.50 61.84 1t1g n PRO 132 Cb 0.62 -1.96 0.45 0.00 -0.02 0.00 0.00 33.50 32.59 1t1g n PRO 132 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1t1g h GLU 133 N 4.64 0.52 -0.12 -0.52 4.11 -1.27 -1.06 114.58 120.87 1t1g h GLU 133 Ca -0.48 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.92 1t1g h GLU 133 Cb 1.35 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1t1g h GLU 133 CO 0.78 0.34 0.00 -0.40 0.07 0.00 0.00 179.01 179.80 1t1g n ASP 134 N -4.48 0.89 -0.20 3.06 3.85 -1.26 -3.16 116.55 115.24 1t1g n ASP 134 Ca 0.12 -1.71 0.07 0.00 -0.71 0.00 0.00 54.79 52.55 1t1g n ASP 134 Cb 0.37 -0.08 -0.04 0.00 -1.35 0.00 0.00 41.12 40.03 1t1g n ASP 134 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 1t1g n SER 135 N -0.14 1.20 -4.84 -1.12 3.41 -0.40 -4.98 113.62 106.75 1t1g n SER 135 Ca 0.12 -1.10 -0.33 0.00 -0.26 0.00 0.00 58.87 57.30 1t1g n SER 135 Cb 0.18 0.69 -0.06 0.00 -0.26 0.00 0.00 64.21 64.76 1t1g n SER 135 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1t1g s TRP 136 N -2.05 3.39 0.12 7.33 0.52 -1.19 -5.03 118.94 122.03 1t1g s TRP 136 Ca 0.10 1.30 -0.31 0.00 0.02 0.00 0.00 56.10 57.21 1t1g s TRP 136 Cb 0.12 -2.59 -0.08 0.00 -1.15 0.00 0.00 33.47 29.77 1t1g s TRP 136 CO 0.47 0.08 1.36 0.00 0.02 0.00 0.00 176.95 178.89 1t1g s ALA 137 N -1.97 3.56 0.34 0.98 0.00 -1.26 -4.90 121.76 118.51 1t1g s ALA 137 Ca 0.54 1.09 0.11 0.00 0.00 0.00 0.00 51.96 53.71 1t1g s ALA 137 Cb -0.11 -3.52 0.90 0.00 0.00 0.00 0.00 23.12 20.39 1t1g s ALA 137 CO 0.17 -0.58 1.78 -1.35 0.00 0.00 0.00 175.76 175.77 1t1g h PRO 138 N 6.57 0.58 -0.39 0.00 0.11 -1.96 0.18 132.00 137.09 1t1g h PRO 138 Ca -0.42 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 1t1g h PRO 138 Cb 1.21 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1t1g h PRO 138 CO 0.84 0.38 0.06 0.00 -0.21 0.00 0.00 178.00 179.08 1t1g h ALA 139 N 1.65 1.38 -0.24 -0.75 0.00 -2.00 -1.36 119.26 117.95 1t1g h ALA 139 Ca 0.58 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 55.17 1t1g h ALA 139 Cb 1.14 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1t1g h ALA 139 CO -0.35 0.44 -0.43 0.77 0.00 0.00 0.00 179.25 179.68 1t1g h SER 140 N 0.57 0.79 -0.64 0.00 0.02 -1.37 -1.97 113.55 110.95 1t1g h SER 140 Ca 0.13 -0.53 0.01 0.00 -0.84 0.00 0.00 61.79 60.56 1t1g h SER 140 Cb 0.27 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 1t1g h SER 140 CO 0.00 1.17 0.42 0.40 -1.14 0.00 0.00 176.83 177.68 1t1g h ILE 141 N 0.43 1.14 -0.38 3.27 1.08 -1.05 -0.72 117.51 121.27 1t1g h ILE 141 Ca 0.01 -0.29 -0.03 0.00 -0.39 0.00 0.00 64.86 64.17 1t1g h ILE 141 Cb 1.03 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 34.98 1t1g h ILE 141 CO 0.10 0.15 0.14 0.00 -0.69 0.00 0.00 178.15 177.85 1t1g h ALA 142 N 1.25 0.50 -0.42 1.87 0.00 -1.18 -0.47 119.26 120.80 1t1g h ALA 142 Ca 0.24 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1t1g h ALA 142 Cb -0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1t1g h ALA 142 CO -0.07 0.12 0.05 0.00 0.00 0.00 0.00 179.25 179.36 1t1g h ALA 143 N 0.99 0.56 -0.13 0.00 0.00 -1.12 -1.87 119.26 117.70 1t1g h ALA 143 Ca 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1t1g h ALA 143 Cb 0.21 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1t1g h ALA 143 CO -0.01 0.29 0.06 0.52 0.00 0.00 0.00 179.25 180.11 1t1g h MET 144 N 0.56 0.19 -1.01 0.00 2.07 -1.08 -1.76 114.93 113.90 1t1g h MET 144 Ca 0.13 -0.03 0.02 0.00 -2.07 0.00 0.00 59.70 57.75 1t1g h MET 144 Cb 0.40 -0.03 -0.05 0.00 -1.87 0.00 0.00 31.60 30.04 1t1g h MET 144 CO 0.01 0.27 0.66 -0.97 1.07 0.00 0.00 176.91 177.96 1t1g h ASN 145 N 0.07 1.13 0.14 1.22 -0.00 -1.01 -1.11 115.58 116.03 1t1g h ASN 145 Ca 0.04 -0.02 -0.10 0.00 -0.00 0.00 0.00 56.30 56.22 1t1g h ASN 145 Cb 0.15 -0.27 -0.01 0.00 -0.00 0.00 0.00 38.32 38.19 1t1g h ASN 145 CO -0.00 0.80 -0.36 -0.09 -0.00 0.00 0.00 177.43 177.77 1t1g h ARG 146 N 1.33 0.31 -0.63 6.67 9.65 -1.16 -0.13 114.38 130.41 1t1g h ARG 146 Ca 0.38 -0.14 -0.07 0.00 -1.10 0.00 0.00 59.98 59.06 1t1g h ARG 146 Cb -0.09 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.45 1t1g h ARG 146 CO -0.10 0.64 0.12 0.00 2.80 0.00 0.00 179.97 183.43 1t1g h ALA 147 N 1.36 1.02 -0.22 2.80 0.00 -0.35 0.07 119.26 123.94 1t1g h ALA 147 Ca 0.03 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 1t1g h ALA 147 Cb 0.77 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1t1g h ALA 147 CO 0.06 0.63 -0.42 0.74 0.00 0.00 0.00 179.25 180.26 1t1g h PHE 148 N 0.96 0.63 -0.65 0.00 0.04 -0.68 -1.84 116.94 115.40 1t1g h PHE 148 Ca 0.20 -0.19 -0.07 0.00 2.80 0.00 0.00 57.97 60.71 1t1g h PHE 148 Cb 0.39 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 1t1g h PHE 148 CO 0.03 0.87 0.14 1.25 -0.60 0.00 0.00 178.31 180.00 1t1g h LEU 149 N 0.43 1.00 -0.81 1.54 6.46 -0.48 -1.97 115.31 121.49 1t1g h LEU 149 Ca 0.03 -0.24 -0.05 0.00 -0.12 0.00 0.00 57.88 57.51 1t1g h LEU 149 Cb 0.92 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 40.55 1t1g h LEU 149 CO 0.08 0.99 0.32 0.44 -0.62 0.00 0.00 178.44 179.64 1t1g h ASP 150 N 0.98 1.11 -0.49 1.25 3.45 -0.76 -1.81 116.42 120.13 1t1g h ASP 150 Ca 0.20 -0.17 -0.00 0.00 0.43 0.00 0.00 57.03 57.48 1t1g h ASP 150 Cb 0.39 -0.29 -0.02 0.00 -0.56 0.00 0.00 39.33 38.84 1t1g h ASP 150 CO 0.01 0.98 0.29 0.00 -1.57 0.00 0.00 179.24 178.94 1t1g h ALA 151 N 1.17 0.63 -0.91 3.45 0.00 -1.04 -1.27 119.26 121.30 1t1g h ALA 151 Ca 0.27 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1t1g h ALA 151 Cb 0.22 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1t1g h ALA 151 CO -0.02 0.12 0.60 0.00 0.00 0.00 0.00 179.25 179.95 1t1g h ALA 152 N 1.13 1.16 -0.00 0.00 0.00 -1.00 -1.17 119.26 119.39 1t1g h ALA 152 Ca 0.17 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1t1g h ALA 152 Cb 0.01 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1t1g h ALA 152 CO -0.03 0.52 -0.29 0.00 0.00 0.00 0.00 179.25 179.45 1t1g h ALA 153 N 1.34 1.52 -0.01 0.00 0.00 -0.78 -2.62 119.26 118.72 1t1g h ALA 153 Ca 0.34 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1t1g h ALA 153 Cb -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1t1g h ALA 153 CO -0.09 0.36 -0.08 1.28 0.00 0.00 0.00 179.25 180.73 1t1g n LEU 154 N -4.20 1.25 -0.12 0.00 4.77 -0.53 -4.95 117.00 113.23 1t1g n LEU 154 Ca -0.02 -0.38 -0.00 0.00 -0.03 0.00 0.00 56.01 55.57 1t1g n LEU 154 Cb 0.34 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1t1g n LEU 154 CO 0.38 0.21 -0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1t1g n GLY 155 N 1.22 0.43 3.41 -0.72 0.00 -0.69 -5.06 105.19 103.78 1t1g n GLY 155 Ca 0.17 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 45.01 1t1g n GLY 155 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t1g s VAL 156 N -2.15 3.50 0.17 1.61 1.01 -0.54 -3.67 120.40 120.32 1t1g s VAL 156 Ca 0.00 -0.48 -0.26 0.00 0.00 0.00 0.00 61.98 61.23 1t1g s VAL 156 Cb -0.00 -2.53 -0.08 0.00 0.00 0.00 0.00 36.38 33.77 1t1g s VAL 156 CO 0.00 0.48 0.82 -0.89 0.00 0.00 0.00 175.10 175.51 1t1g s THR 157 N 0.68 4.35 -0.12 3.92 2.01 -0.59 -4.08 115.64 121.81 1t1g s THR 157 Ca -0.03 1.79 0.01 0.00 0.31 0.00 0.00 61.69 63.77 1t1g s THR 157 Cb -0.15 -4.18 0.02 0.00 0.01 0.00 0.00 72.50 68.20 1t1g s THR 157 CO 0.02 0.49 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.63 1t1g s VAL 158 N -1.00 1.39 0.04 3.82 1.01 -1.26 -0.30 120.40 124.11 1t1g s VAL 158 Ca 0.38 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.88 1t1g s VAL 158 Cb -0.23 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1t1g s VAL 158 CO 0.27 0.42 -0.17 -0.76 0.00 0.00 0.00 175.10 174.87 1t1g s LEU 159 N 1.30 2.68 -0.07 3.92 1.02 -0.11 -1.10 118.68 126.32 1t1g s LEU 159 Ca -0.00 -0.41 -0.06 0.00 0.02 0.00 0.00 54.13 53.67 1t1g s LEU 159 Cb -0.14 -1.56 0.02 0.00 0.02 0.00 0.00 46.19 44.54 1t1g s LEU 159 CO -0.06 0.25 0.19 0.00 0.02 0.00 0.00 176.35 176.75 1t1g s ALA 160 N -0.96 -0.47 0.34 4.21 0.00 -0.77 -0.64 121.76 123.47 1t1g s ALA 160 Ca 0.15 0.58 -0.29 0.00 0.00 0.00 0.00 51.96 52.40 1t1g s ALA 160 Cb -0.11 -0.34 -0.11 0.00 0.00 0.00 0.00 23.12 22.57 1t1g s ALA 160 CO 0.06 -0.10 1.38 0.00 0.00 0.00 0.00 175.76 177.10 1t1g s ALA 161 N 0.22 3.54 -0.65 0.00 0.00 -0.75 -0.64 121.76 123.47 1t1g s ALA 161 Ca -0.01 1.37 0.25 0.00 0.00 0.00 0.00 51.96 53.57 1t1g s ALA 161 Cb -0.02 -3.53 0.62 0.00 0.00 0.00 0.00 23.12 20.18 1t1g s ALA 161 CO -0.01 -0.79 1.63 0.00 0.00 0.00 0.00 175.76 176.60 1t1g h ALA 162 N 3.44 0.90 0.00 0.00 0.00 -1.23 -3.41 119.26 118.96 1t1g h ALA 162 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1t1g h ALA 162 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1t1g h ALA 162 CO 0.66 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.32 1t1g n GLY 163 N 1.28 3.60 0.11 0.00 0.00 -1.26 -4.17 105.19 104.75 1t1g n GLY 163 Ca 0.05 -1.78 0.02 0.00 0.00 0.00 0.00 46.02 44.31 1t1g n GLY 163 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1t1g n ASP 164 N 0.00 2.21 -2.08 1.61 10.43 -1.25 -1.10 116.55 126.36 1t1g n ASP 164 Ca 0.00 -2.16 -0.24 0.00 2.57 0.00 0.00 54.79 54.96 1t1g n ASP 164 Cb 0.00 -0.10 0.02 0.00 1.84 0.00 0.00 41.12 42.88 1t1g n ASP 164 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1t1g n SER 165 N -0.48 4.84 -0.11 -2.24 7.64 -0.94 -1.73 113.62 120.60 1t1g n SER 165 Ca 0.04 -3.72 0.00 0.00 1.01 0.00 0.00 58.87 56.20 1t1g n SER 165 Cb 0.34 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1t1g n SER 165 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t1g n GLY 166 N -0.68 0.65 0.15 0.23 0.00 -0.05 -2.00 105.19 103.49 1t1g n GLY 166 Ca 0.43 -0.84 0.12 0.00 0.00 0.00 0.00 46.02 45.73 1t1g n GLY 166 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1t1g h SER 167 N 0.00 0.00 0.10 1.61 4.64 -1.19 -2.56 113.55 116.15 1t1g h SER 167 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1t1g h SER 167 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1t1g h SER 167 CO 0.00 0.00 -0.73 0.35 -0.87 0.00 0.00 176.83 175.58 1t1g n THR 168 N -2.31 0.00 -3.37 2.95 -2.24 -1.24 -0.58 114.28 107.48 1t1g n THR 168 Ca 0.01 -0.07 -0.23 0.00 -2.27 0.00 0.00 64.05 61.49 1t1g n THR 168 Cb 0.19 0.88 -0.01 0.00 -2.10 0.00 0.00 70.33 69.29 1t1g n THR 168 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1t1g n ASP 169 N -1.07 -3.44 0.00 3.42 4.64 -0.85 -1.40 116.55 117.85 1t1g n ASP 169 Ca 0.06 -0.38 0.00 0.00 -1.38 0.00 0.00 54.79 53.09 1t1g n ASP 169 Cb 0.37 -2.87 0.00 0.00 -1.04 0.00 0.00 41.12 37.58 1t1g n ASP 169 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1t1g n GLY 170 N -1.12 0.84 3.90 0.27 0.00 -1.23 -4.72 105.19 103.12 1t1g n GLY 170 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1t1g n GLY 170 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1t1g s GLU 171 N -0.19 3.45 -0.59 1.61 2.02 -0.49 -5.03 118.70 119.49 1t1g s GLU 171 Ca 0.00 -0.25 0.05 0.00 0.02 0.00 0.00 54.97 54.79 1t1g s GLU 171 Cb 0.00 -3.12 0.34 0.00 0.10 0.00 0.00 34.13 31.45 1t1g s GLU 171 CO 0.00 0.70 0.97 0.00 0.02 0.00 0.00 175.26 176.95 1t1g n GLN 172 N 1.22 3.30 -0.20 1.61 10.64 -1.26 -4.74 117.38 127.95 1t1g n GLN 172 Ca -0.13 -4.87 0.09 0.00 -1.83 0.00 0.00 57.00 50.26 1t1g n GLN 172 Cb 0.53 -2.25 0.18 0.00 -0.86 0.00 0.00 30.24 27.84 1t1g n GLN 172 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 1t1g n ASP 173 N -0.25 2.88 -0.77 2.61 5.75 -1.26 -4.96 116.55 120.56 1t1g n ASP 173 Ca 0.31 -3.00 -0.10 0.00 -0.01 0.00 0.00 54.79 51.99 1t1g n ASP 173 Cb 0.39 -0.45 -0.04 0.00 -1.03 0.00 0.00 41.12 39.99 1t1g n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1t1g n GLY 174 N -1.04 1.15 3.23 6.12 0.00 -1.26 -5.01 105.19 108.38 1t1g n GLY 174 Ca 0.17 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 1t1g n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t1g s LEU 175 N -2.28 2.29 0.09 0.99 1.43 -1.26 -5.02 118.68 114.92 1t1g s LEU 175 Ca 0.00 -1.10 -0.09 0.00 -1.03 0.00 0.00 54.13 51.91 1t1g s LEU 175 Cb 0.00 -0.12 -0.06 0.00 0.03 0.00 0.00 46.19 46.04 1t1g s LEU 175 CO 0.00 -0.50 0.39 -0.31 0.23 0.00 0.00 176.35 176.16 1t1g s TYR 176 N -3.58 3.56 0.00 0.29 1.51 -1.26 -4.74 117.35 113.14 1t1g s TYR 176 Ca 0.20 0.75 -0.03 0.00 -1.01 0.00 0.00 57.07 56.97 1t1g s TYR 176 Cb 0.05 -2.13 -0.01 0.00 -0.11 0.00 0.00 41.96 39.77 1t1g s TYR 176 CO 0.01 0.51 0.05 -1.01 -1.11 0.00 0.00 175.55 174.00 1t1g s HIS 177 N -1.43 0.11 0.20 2.71 3.76 0.25 -4.96 115.29 115.92 1t1g s HIS 177 Ca 0.34 -0.23 0.07 0.00 -0.15 0.00 0.00 55.06 55.10 1t1g s HIS 177 Cb -0.14 -0.09 -0.04 0.00 1.11 0.00 0.00 32.58 33.42 1t1g s HIS 177 CO 0.19 -0.18 0.06 0.14 -0.85 0.00 0.00 174.74 174.10 1t1g s VAL 178 N -1.07 3.96 0.27 -0.90 -7.23 -1.26 -4.00 120.40 110.18 1t1g s VAL 178 Ca -0.12 -1.44 -0.08 0.00 -1.81 0.00 0.00 61.98 58.53 1t1g s VAL 178 Cb -0.07 -3.05 -0.06 0.00 0.56 0.00 0.00 36.38 33.76 1t1g s VAL 178 CO 0.00 -0.20 0.58 -0.62 -0.31 0.00 0.00 175.10 174.55 1t1g s ASP 179 N -3.27 6.55 0.07 4.85 -1.08 -1.26 -0.86 116.67 121.67 1t1g s ASP 179 Ca 0.30 0.88 0.08 0.00 -0.52 0.00 0.00 52.55 53.29 1t1g s ASP 179 Cb -0.09 -2.21 -0.03 0.00 -1.46 0.00 0.00 42.92 39.13 1t1g s ASP 179 CO 0.21 -0.15 -0.22 0.12 0.52 0.00 0.00 175.17 175.64 1t1g s PHE 180 N -1.97 1.95 -1.56 -5.34 5.36 0.24 -0.88 117.98 115.78 1t1g s PHE 180 Ca 0.47 -0.39 0.12 0.00 -0.96 0.00 0.00 56.93 56.17 1t1g s PHE 180 Cb -0.11 -1.13 0.63 0.00 -0.34 0.00 0.00 43.02 42.08 1t1g s PHE 180 CO 0.25 0.15 1.26 -0.35 -1.46 0.00 0.00 175.22 175.07 1t1g n PRO 181 N 1.54 0.22 -0.23 10.12 -0.04 -1.26 -1.10 135.00 144.25 1t1g n PRO 181 Ca -0.18 0.13 0.13 0.00 -0.04 0.00 0.00 63.50 63.55 1t1g n PRO 181 Cb 0.53 -1.50 0.43 0.00 -0.04 0.00 0.00 33.50 32.92 1t1g n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1t1g h ALA 182 N 2.61 1.94 0.00 0.55 0.00 -1.78 -1.74 119.26 120.84 1t1g h ALA 182 Ca 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1t1g h ALA 182 Cb 0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1t1g h ALA 182 CO 0.00 -0.17 -0.10 0.00 0.00 0.00 0.00 179.25 178.98 1t1g h ALA 183 N 1.61 1.14 -2.57 0.00 0.00 -1.36 -3.41 119.26 114.67 1t1g h ALA 183 Ca 0.42 -0.09 -0.56 0.00 0.00 0.00 0.00 54.91 54.68 1t1g h ALA 183 Cb 0.77 -0.02 0.09 0.00 0.00 0.00 0.00 17.79 18.63 1t1g h ALA 183 CO -0.17 0.13 0.73 0.45 0.00 0.00 0.00 179.25 180.38 1t1g n SER 184 N -3.41 3.29 0.08 0.00 2.88 -0.66 -4.86 113.62 110.94 1t1g n SER 184 Ca -0.01 1.16 0.10 0.00 -1.33 0.00 0.00 58.87 58.79 1t1g n SER 184 Cb 0.27 -1.52 0.43 0.00 -0.75 0.00 0.00 64.21 62.64 1t1g n SER 184 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1t1g n PRO 185 N 1.85 0.13 -0.11 -1.46 -0.04 -1.26 -2.55 135.00 131.56 1t1g n PRO 185 Ca 0.09 0.36 0.11 0.00 -0.04 0.00 0.00 63.50 64.02 1t1g n PRO 185 Cb 0.35 -1.74 0.30 0.00 -0.04 0.00 0.00 33.50 32.36 1t1g n PRO 185 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1t1g n TYR 186 N -1.98 0.28 -4.53 0.54 4.02 -1.26 -4.90 117.16 109.33 1t1g n TYR 186 Ca 0.03 -0.14 -0.32 0.00 -0.01 0.00 0.00 57.90 57.46 1t1g n TYR 186 Cb 0.21 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.42 1t1g n TYR 186 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1t1g s VAL 187 N -1.72 3.41 -0.60 -0.72 1.01 -1.06 -4.67 120.40 116.05 1t1g s VAL 187 Ca 0.35 -0.86 -0.23 0.00 0.00 0.00 0.00 61.98 61.23 1t1g s VAL 187 Cb 0.20 -2.46 0.06 0.00 0.00 0.00 0.00 36.38 34.17 1t1g s VAL 187 CO 0.29 0.39 0.94 -0.22 0.00 0.00 0.00 175.10 176.50 1t1g s LEU 188 N -1.37 4.27 -0.05 3.92 2.96 -0.26 -4.90 118.68 123.25 1t1g s LEU 188 Ca 0.16 -0.68 -0.30 0.00 -0.22 0.00 0.00 54.13 53.09 1t1g s LEU 188 Cb -0.11 -2.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.94 1t1g s LEU 188 CO 0.06 -1.32 1.14 0.00 -1.32 0.00 0.00 176.35 174.92 1t1g s ALA 189 N 3.95 3.44 -0.33 5.97 0.00 -1.26 -1.84 121.76 131.69 1t1g s ALA 189 Ca 0.26 0.58 -0.07 0.00 0.00 0.00 0.00 51.96 52.73 1t1g s ALA 189 Cb -0.15 -3.48 0.03 0.00 0.00 0.00 0.00 23.12 19.52 1t1g s ALA 189 CO 0.14 -0.66 0.11 0.00 0.00 0.00 0.00 175.76 175.35 1t1g n GLY 191 N 4.85 0.24 3.17 0.00 0.00 0.68 -0.76 105.19 113.36 1t1g n GLY 191 Ca -0.13 -1.96 -0.22 0.00 0.00 0.00 0.00 46.02 43.72 1t1g n GLY 191 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1t1g s GLY 192 N -4.89 0.88 0.33 -0.02 0.00 -1.26 -2.02 107.32 100.33 1t1g s GLY 192 Ca 0.59 -0.88 0.03 0.00 0.00 0.00 0.00 44.72 44.46 1t1g s GLY 192 CO 0.39 -0.84 0.08 -0.51 0.00 0.00 0.00 173.10 172.23 1t1g s THR 193 N -0.81 0.90 -0.31 0.90 -4.23 -0.58 -2.32 115.64 109.19 1t1g s THR 193 Ca 0.03 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.48 1t1g s THR 193 Cb -0.08 -2.65 0.02 0.00 1.34 0.00 0.00 72.50 71.13 1t1g s THR 193 CO 0.01 0.00 0.09 -0.60 -0.54 0.00 0.00 174.62 173.58 1t1g s ARG 194 N -3.88 2.97 -0.20 3.99 3.52 0.37 -0.92 118.95 124.81 1t1g s ARG 194 Ca 0.34 -0.94 -0.07 0.00 -0.13 0.00 0.00 55.73 54.93 1t1g s ARG 194 Cb 0.07 -3.40 -0.04 0.00 -1.56 0.00 0.00 34.95 30.02 1t1g s ARG 194 CO 0.15 -0.50 0.06 -1.17 -0.81 0.00 0.00 175.30 173.03 1t1g s LEU 195 N 1.48 3.71 -0.31 -0.88 2.96 -1.26 -2.05 118.68 122.33 1t1g s LEU 195 Ca 0.02 0.01 0.01 0.00 -0.22 0.00 0.00 54.13 53.94 1t1g s LEU 195 Cb -0.18 -1.95 0.07 0.00 0.50 0.00 0.00 46.19 44.63 1t1g s LEU 195 CO 0.03 0.12 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.49 1t1g s VAL 196 N 0.68 2.57 0.13 1.68 1.01 0.24 -4.92 120.40 121.79 1t1g s VAL 196 Ca 0.03 -1.78 -0.09 0.00 0.00 0.00 0.00 61.98 60.14 1t1g s VAL 196 Cb -0.13 -2.62 -0.00 0.00 0.00 0.00 0.00 36.38 33.62 1t1g s VAL 196 CO 0.02 -0.27 0.24 0.00 0.00 0.00 0.00 175.10 175.09 1t1g s ALA 197 N 1.10 -0.11 0.42 5.51 0.00 -1.26 -0.60 121.76 126.83 1t1g s ALA 197 Ca -0.01 -0.76 0.04 0.00 0.00 0.00 0.00 51.96 51.23 1t1g s ALA 197 Cb -0.20 0.70 -0.02 0.00 0.00 0.00 0.00 23.12 23.60 1t1g s ALA 197 CO -0.04 -0.59 0.13 -1.54 0.00 0.00 0.00 175.76 173.72 1t1g s SER 198 N -2.92 2.91 0.26 0.00 1.04 -0.18 -4.94 113.70 109.86 1t1g s SER 198 Ca 0.12 -1.69 -0.01 0.00 0.48 0.00 0.00 55.95 54.84 1t1g s SER 198 Cb 0.04 0.54 0.52 0.00 0.10 0.00 0.00 66.02 67.21 1t1g s SER 198 CO -0.05 -0.95 1.77 0.00 0.98 0.00 0.00 173.24 174.99 1t1g h ALA 199 N 1.74 1.26 0.00 5.32 0.00 -1.95 -3.05 119.26 122.58 1t1g h ALA 199 Ca -0.35 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1t1g h ALA 199 Cb 1.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1t1g h ALA 199 CO 0.57 -0.07 -0.78 0.41 0.00 0.00 0.00 179.25 179.37 1t1g n GLY 200 N -1.32 -1.14 3.55 0.00 0.00 -1.26 -4.60 105.19 100.42 1t1g n GLY 200 Ca 0.17 -0.46 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 1t1g n GLY 200 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1t1g s ARG 201 N -3.03 1.31 -0.34 1.61 1.70 -1.15 -5.12 118.95 113.94 1t1g s ARG 201 Ca 0.09 -0.57 -0.11 0.00 -0.47 0.00 0.00 55.73 54.67 1t1g s ARG 201 Cb 0.16 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 35.10 1t1g s ARG 201 CO 0.79 -0.58 0.19 0.42 -1.08 0.00 0.00 175.30 175.03 1t1g s ILE 202 N -3.66 4.74 0.15 4.99 1.01 -1.26 -1.02 121.20 126.16 1t1g s ILE 202 Ca 0.05 -0.54 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 1t1g s ILE 202 Cb -0.02 -3.50 -0.15 0.00 0.01 0.00 0.00 42.46 38.80 1t1g s ILE 202 CO -0.07 -0.06 1.36 -0.33 0.00 0.00 0.00 174.94 175.84 1t1g h GLU 203 N 8.42 0.36 -1.71 2.79 3.07 -1.22 -3.47 114.58 122.82 1t1g h GLU 203 Ca -0.30 -0.36 0.03 0.00 -0.50 0.00 0.00 59.36 58.24 1t1g h GLU 203 Cb 1.13 0.09 -0.24 0.00 -0.84 0.00 0.00 28.75 28.90 1t1g h GLU 203 CO 0.64 1.03 0.38 0.50 -1.40 0.00 0.00 179.01 180.15 1t1g s ARG 204 N -3.37 0.63 -0.15 2.33 3.52 -0.82 -5.02 118.95 116.07 1t1g s ARG 204 Ca -0.05 0.61 -0.04 0.00 -0.13 0.00 0.00 55.73 56.12 1t1g s ARG 204 Cb 0.10 0.30 0.07 0.00 -1.56 0.00 0.00 34.95 33.86 1t1g s ARG 204 CO 0.85 -0.10 0.25 -2.00 -0.81 0.00 0.00 175.30 173.49 1t1g s GLU 205 N 0.00 0.16 0.37 5.12 2.12 -1.26 -0.59 118.70 124.62 1t1g s GLU 205 Ca 0.01 0.60 0.03 0.00 0.36 0.00 0.00 54.97 55.98 1t1g s GLU 205 Cb -0.04 -0.34 -0.04 0.00 0.26 0.00 0.00 34.13 33.97 1t1g s GLU 205 CO -0.03 -0.39 0.10 0.95 -0.54 0.00 0.00 175.26 175.35 1t1g s THR 206 N 2.40 0.84 0.27 -1.70 -4.23 -0.87 -4.64 115.64 107.70 1t1g s THR 206 Ca 0.03 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.25 1t1g s THR 206 Cb -0.13 -2.53 -0.10 0.00 1.34 0.00 0.00 72.50 71.08 1t1g s THR 206 CO -0.10 0.00 1.41 -0.69 -0.54 0.00 0.00 174.62 174.70 1t1g s VAL 207 N -3.27 2.69 -0.27 2.29 1.01 -0.55 -0.48 120.40 121.81 1t1g s VAL 207 Ca 0.29 0.60 -0.29 0.00 0.00 0.00 0.00 61.98 62.58 1t1g s VAL 207 Cb 0.05 -3.38 -0.00 0.00 0.00 0.00 0.00 36.38 33.05 1t1g s VAL 207 CO 0.14 0.11 1.32 0.86 0.00 0.00 0.00 175.10 177.53 1t1g s TRP 208 N -0.26 2.66 -0.28 5.22 -0.00 -0.98 -4.48 118.94 120.82 1t1g s TRP 208 Ca 0.57 0.86 0.01 0.00 -0.00 0.00 0.00 56.10 57.54 1t1g s TRP 208 Cb -0.41 -3.84 0.16 0.00 -0.00 0.00 0.00 33.47 29.38 1t1g s TRP 208 CO 0.46 -1.83 0.45 1.21 -0.00 0.00 0.00 176.95 177.24 1t1g s ASN 209 N 2.77 -0.14 -0.27 5.86 3.84 -1.26 -2.24 114.94 123.51 1t1g s ASN 209 Ca 0.57 0.01 0.11 0.00 0.21 0.00 0.00 52.86 53.77 1t1g s ASN 209 Cb -0.18 1.36 0.53 0.00 -0.55 0.00 0.00 41.25 42.41 1t1g s ASN 209 CO 0.22 -0.32 1.49 0.47 -2.79 0.00 0.00 177.10 176.17 1t1g n ASP 210 N 5.37 3.09 -0.43 -4.21 10.43 0.38 -5.01 116.55 126.18 1t1g n ASP 210 Ca -0.00 -3.49 0.05 0.00 2.57 0.00 0.00 54.79 53.92 1t1g n ASP 210 Cb 0.50 -0.62 -0.01 0.00 1.84 0.00 0.00 41.12 42.83 1t1g n ASP 210 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1t1g n GLY 211 N -0.90 -2.08 0.36 0.44 0.00 -1.25 -2.05 105.19 99.70 1t1g n GLY 211 Ca 0.31 -1.40 0.09 0.00 0.00 0.00 0.00 46.02 45.03 1t1g n GLY 211 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1t1g h PRO 212 N 0.00 0.87 -0.02 1.61 0.11 -1.90 -1.27 132.00 131.40 1t1g h PRO 212 Ca 0.01 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 65.88 1t1g h PRO 212 Cb 0.34 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 1t1g h PRO 212 CO 0.00 0.57 -0.81 -0.44 -0.21 0.00 0.00 178.00 177.11 1t1g h ASP 213 N 0.89 0.28 -0.01 -2.05 3.45 -1.95 -3.35 116.42 113.69 1t1g h ASP 213 Ca 0.49 -0.21 0.00 0.00 0.43 0.00 0.00 57.03 57.74 1t1g h ASP 213 Cb 0.59 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.28 1t1g h ASP 213 CO -0.26 0.98 -0.70 0.61 -1.57 0.00 0.00 179.24 178.30 1t1g n GLY 214 N 0.73 -0.46 0.00 2.75 0.00 -0.87 -5.11 105.19 102.24 1t1g n GLY 214 Ca -0.03 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1t1g n GLY 214 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t1g n GLY 215 N 1.38 -0.44 3.45 -0.02 0.00 -0.51 -4.66 105.19 104.39 1t1g n GLY 215 Ca 0.05 -1.69 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 1t1g n GLY 215 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t1g s SER 216 N -2.47 -0.55 0.47 1.61 0.15 -0.70 -0.47 113.70 111.74 1t1g s SER 216 Ca 0.00 0.32 -0.24 0.00 0.70 0.00 0.00 55.95 56.73 1t1g s SER 216 Cb 0.00 0.54 -0.07 0.00 -1.71 0.00 0.00 66.02 64.78 1t1g s SER 216 CO 0.00 -0.75 1.35 0.28 1.20 0.00 0.00 173.24 175.32 1t1g s THR 217 N -2.35 2.30 0.67 6.45 -1.32 -0.95 -0.87 115.64 119.57 1t1g s THR 217 Ca -0.06 0.25 -0.11 0.00 -1.21 0.00 0.00 61.69 60.57 1t1g s THR 217 Cb -0.01 -3.14 -0.01 0.00 -1.51 0.00 0.00 72.50 67.84 1t1g s THR 217 CO -0.01 0.02 1.05 -0.83 -2.21 0.00 0.00 174.62 172.64 1t1g s GLY 218 N -0.80 1.66 0.00 6.08 0.00 -0.26 -3.54 107.32 110.46 1t1g s GLY 218 Ca 0.64 0.02 0.00 0.00 0.00 0.00 0.00 44.72 45.37 1t1g s GLY 218 CO 0.49 0.31 0.00 0.61 0.00 0.00 0.00 173.10 174.51 1t1g n GLY 219 N -2.29 2.91 0.00 0.20 0.00 -1.26 -4.61 105.19 100.14 1t1g n GLY 219 Ca 0.07 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1t1g n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t1g n GLY 220 N -0.74 -0.50 3.03 -0.02 0.00 -0.27 -4.47 105.19 102.21 1t1g n GLY 220 Ca 0.00 -0.69 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 1t1g n GLY 220 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t1g s VAL 221 N -4.00 1.40 0.50 1.61 1.01 -1.26 -1.09 120.40 118.56 1t1g s VAL 221 Ca 0.00 -0.58 -0.23 0.00 0.00 0.00 0.00 61.98 61.18 1t1g s VAL 221 Cb 0.00 -1.30 -0.06 0.00 0.00 0.00 0.00 36.38 35.02 1t1g s VAL 221 CO 0.00 0.42 1.28 -0.55 0.00 0.00 0.00 175.10 176.25 1t1g s SER 222 N 1.09 5.72 0.00 3.32 0.15 -0.04 -4.74 113.70 119.19 1t1g s SER 222 Ca -0.05 2.57 0.13 0.00 0.70 0.00 0.00 55.95 59.30 1t1g s SER 222 Cb -0.14 -2.62 0.17 0.00 -1.71 0.00 0.00 66.02 61.71 1t1g s SER 222 CO -0.03 -1.25 1.01 -1.14 1.20 0.00 0.00 173.24 173.04 1t1g n ARG 223 N -0.71 1.32 -0.07 5.44 0.63 -1.26 -4.22 116.66 117.79 1t1g n ARG 223 Ca 0.09 -1.50 -0.14 0.00 -0.92 0.00 0.00 57.85 55.38 1t1g n ARG 223 Cb 0.46 -1.27 -0.05 0.00 0.45 0.00 0.00 32.46 32.05 1t1g n ARG 223 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1t1g n ILE 224 N 0.74 0.78 -3.73 5.15 2.08 -1.26 -5.01 119.36 118.11 1t1g n ILE 224 Ca 0.09 -0.23 -0.35 0.00 0.56 0.00 0.00 62.75 62.82 1t1g n ILE 224 Cb 0.36 -1.51 -0.08 0.00 -0.75 0.00 0.00 39.64 37.66 1t1g n ILE 224 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1t1g s PHE 225 N -2.26 3.38 0.88 1.39 0.40 -1.26 -5.07 117.98 115.44 1t1g s PHE 225 Ca -0.20 0.30 -0.10 0.00 -0.60 0.00 0.00 56.93 56.32 1t1g s PHE 225 Cb 0.07 -2.18 0.12 0.00 0.51 0.00 0.00 43.02 41.54 1t1g s PHE 225 CO 0.27 0.24 1.12 -2.14 0.70 0.00 0.00 175.22 175.40 1t1g s PRO 226 N 0.50 1.33 -0.03 0.24 0.02 -1.26 -0.97 135.00 134.83 1t1g s PRO 226 Ca 0.08 1.33 -0.30 0.00 0.02 0.00 0.00 61.00 62.13 1t1g s PRO 226 Cb -0.12 -1.78 -0.07 0.00 0.02 0.00 0.00 34.50 32.55 1t1g s PRO 226 CO -0.01 -2.34 1.86 -1.17 -0.33 0.00 0.00 177.00 175.01 1t1g s LEU 227 N -6.39 4.29 0.55 -5.54 2.96 -1.26 -3.50 118.68 109.79 1t1g s LEU 227 Ca 0.65 2.40 -0.21 0.00 -0.22 0.00 0.00 54.13 56.75 1t1g s LEU 227 Cb -0.21 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 42.91 1t1g s LEU 227 CO 0.58 -1.09 1.25 -2.84 -1.32 0.00 0.00 176.35 172.93 1t1g s PRO 228 N 4.48 3.19 0.26 0.98 0.02 -1.26 -4.89 135.00 137.77 1t1g s PRO 228 Ca 0.83 1.97 -0.03 0.00 0.02 0.00 0.00 61.00 63.80 1t1g s PRO 228 Cb -0.38 -2.15 0.45 0.00 0.02 0.00 0.00 34.50 32.44 1t1g s PRO 228 CO 0.36 -1.07 1.81 0.66 -0.33 0.00 0.00 177.00 178.44 1t1g h SER 229 N 1.34 0.72 0.35 2.53 4.64 -2.02 0.16 113.55 121.28 1t1g h SER 229 Ca -0.50 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1t1g h SER 229 Cb 1.29 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1t1g h SER 229 CO 0.57 0.39 0.00 -2.67 -0.87 0.00 0.00 176.83 174.25 1t1g n TRP 230 N -4.73 0.00 0.13 4.77 4.27 -1.26 -2.73 117.44 117.89 1t1g n TRP 230 Ca 0.15 0.00 0.04 0.00 -3.89 0.00 0.00 57.50 53.81 1t1g n TRP 230 Cb 0.31 -0.29 0.08 0.00 -1.36 0.00 0.00 31.31 30.05 1t1g n TRP 230 CO 0.00 0.00 0.00 0.94 -2.29 0.00 0.00 177.69 176.34 1t1g n GLN 231 N -1.29 1.46 0.12 -2.67 7.27 0.02 -4.65 117.38 117.64 1t1g n GLN 231 Ca 0.09 -1.44 0.11 0.00 0.07 0.00 0.00 57.00 55.83 1t1g n GLN 231 Cb 0.15 -1.19 0.49 0.00 2.41 0.00 0.00 30.24 32.10 1t1g n GLN 231 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1t1g n GLU 232 N 0.40 0.17 -0.26 3.69 1.02 -1.06 -2.42 120.64 122.19 1t1g n GLU 232 Ca 0.07 0.44 0.09 0.00 -0.02 0.00 0.00 57.16 57.74 1t1g n GLU 232 Cb 0.30 -1.86 0.23 0.00 -0.02 0.00 0.00 31.44 30.09 1t1g n GLU 232 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1t1g n ARG 233 N -2.18 2.72 0.00 3.49 1.74 -1.26 -4.38 116.66 116.78 1t1g n ARG 233 Ca 0.02 -2.30 0.13 0.00 -0.77 0.00 0.00 57.85 54.92 1t1g n ARG 233 Cb 0.20 -1.41 0.42 0.00 -1.02 0.00 0.00 32.46 30.64 1t1g n ARG 233 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1t1g n ALA 234 N 1.07 3.08 -3.23 7.54 0.00 -1.01 -4.96 120.51 122.99 1t1g n ALA 234 Ca 0.17 -0.31 -0.16 0.00 0.00 0.00 0.00 53.44 53.14 1t1g n ALA 234 Cb 0.52 -1.22 0.07 0.00 0.00 0.00 0.00 19.45 18.82 1t1g n ALA 234 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1t1g n ASN 235 N -1.13 -3.41 -4.72 0.00 5.03 -1.26 -4.20 115.26 105.58 1t1g n ASN 235 Ca 0.10 -0.47 -0.42 0.00 0.87 0.00 0.00 54.58 54.66 1t1g n ASN 235 Cb 0.33 -4.13 -0.03 0.00 -1.02 0.00 0.00 39.78 34.92 1t1g n ASN 235 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1t1g s VAL 236 N -3.27 3.19 0.83 2.41 1.01 -1.26 -4.95 120.40 118.36 1t1g s VAL 236 Ca 0.19 0.87 -0.12 0.00 0.00 0.00 0.00 61.98 62.91 1t1g s VAL 236 Cb -0.08 -3.56 0.10 0.00 0.00 0.00 0.00 36.38 32.84 1t1g s VAL 236 CO 0.58 0.07 1.19 -2.16 0.00 0.00 0.00 175.10 174.78 1t1g s PRO 237 N 0.96 1.76 0.68 2.72 0.04 -1.26 -5.02 135.00 134.88 1t1g s PRO 237 Ca 0.64 0.09 -0.11 0.00 0.04 0.00 0.00 61.00 61.66 1t1g s PRO 237 Cb -0.38 -1.93 -0.00 0.00 0.04 0.00 0.00 34.50 32.23 1t1g s PRO 237 CO 0.31 -1.73 1.06 -1.25 0.04 0.00 0.00 177.00 175.43 1t1g s PRO 238 N -5.57 3.10 0.63 0.56 0.04 -1.26 -4.78 135.00 127.71 1t1g s PRO 238 Ca 0.63 0.82 -0.18 0.00 0.04 0.00 0.00 61.00 62.31 1t1g s PRO 238 Cb -0.11 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 1t1g s PRO 238 CO 0.50 -0.95 1.07 0.45 0.04 0.00 0.00 177.00 178.11 1t1g n SER 239 N -3.01 1.17 0.03 6.66 2.88 -0.23 -4.88 113.62 116.25 1t1g n SER 239 Ca 0.07 0.80 0.13 0.00 -1.33 0.00 0.00 58.87 58.54 1t1g n SER 239 Cb 0.54 -1.45 0.49 0.00 -0.75 0.00 0.00 64.21 63.05 1t1g n SER 239 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1t1g n ALA 240 N -1.88 2.49 -2.01 -1.46 0.00 -1.26 -4.35 120.51 112.04 1t1g n ALA 240 Ca 0.15 -0.12 -0.41 0.00 0.00 0.00 0.00 53.44 53.06 1t1g n ALA 240 Cb 0.48 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.49 1t1g n ALA 240 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1t1g s ASN 241 N -3.49 7.02 0.13 0.00 0.02 -1.26 -4.89 114.94 112.46 1t1g s ASN 241 Ca 0.12 2.31 -0.34 0.00 -1.02 0.00 0.00 52.86 53.93 1t1g s ASN 241 Cb 0.17 -2.61 -0.17 0.00 0.02 0.00 0.00 41.25 38.66 1t1g s ASN 241 CO 0.58 -0.42 1.08 -2.65 0.02 0.00 0.00 177.10 175.71 1t1g n PRO 242 N 2.41 0.74 0.00 -0.60 -0.02 -1.26 -0.40 135.00 135.86 1t1g n PRO 242 Ca 0.04 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1t1g n PRO 242 Cb 0.44 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 1t1g n PRO 242 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1t1g n GLY 243 N 1.95 1.27 7.00 -1.23 0.00 -1.26 -5.00 105.19 107.92 1t1g n GLY 243 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1t1g n GLY 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t1g n ALA 244 N -1.44 0.00 0.00 4.61 0.00 0.46 -4.99 120.51 119.16 1t1g n ALA 244 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1t1g n ALA 244 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1t1g n ALA 244 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t1g n GLY 245 N 0.00 3.98 3.84 0.00 0.00 -1.26 -4.57 105.19 107.18 1t1g n GLY 245 Ca 0.00 -1.28 -0.34 0.00 0.00 0.00 0.00 46.02 44.41 1t1g n GLY 245 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t1g s SER 246 N 0.00 6.85 0.06 1.61 0.15 -1.26 -1.06 113.70 120.05 1t1g s SER 246 Ca 0.00 1.25 -0.28 0.00 0.70 0.00 0.00 55.95 57.63 1t1g s SER 246 Cb 0.00 -2.36 0.09 0.00 -1.71 0.00 0.00 66.02 62.05 1t1g s SER 246 CO 0.00 -0.07 1.13 -0.83 1.20 0.00 0.00 173.24 174.67 1t1g s GLY 247 N -2.01 -0.33 0.13 9.45 0.00 -1.26 -4.64 107.32 108.66 1t1g s GLY 247 Ca 0.48 0.45 -0.33 0.00 0.00 0.00 0.00 44.72 45.32 1t1g s GLY 247 CO 0.19 0.08 1.73 -2.13 0.00 0.00 0.00 173.10 172.97 1t1g n ARG 248 N -0.47 2.51 -3.13 2.90 0.00 -0.15 -4.28 116.66 114.05 1t1g n ARG 248 Ca -0.07 0.91 -0.39 0.00 -0.00 0.00 0.00 57.85 58.30 1t1g n ARG 248 Cb 0.62 -2.75 -0.06 0.00 0.00 0.00 0.00 32.46 30.27 1t1g n ARG 248 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1t1g s GLY 249 N 1.90 2.77 -0.03 5.14 0.00 -1.26 -0.86 107.32 114.97 1t1g s GLY 249 Ca 0.80 0.18 0.07 0.00 0.00 0.00 0.00 44.72 45.77 1t1g s GLY 249 CO 0.38 0.71 -0.24 0.14 0.00 0.00 0.00 173.10 174.09 1t1g s VAL 250 N -0.89 1.91 0.20 1.40 1.01 -0.25 -4.63 120.40 119.15 1t1g s VAL 250 Ca 0.33 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1t1g s VAL 250 Cb -0.21 -1.60 0.04 0.00 0.00 0.00 0.00 36.38 34.62 1t1g s VAL 250 CO 0.22 0.54 0.28 -0.81 0.00 0.00 0.00 175.10 175.32 1t1g n PRO 251 N 2.67 0.48 -0.10 2.72 -0.04 -1.26 -1.12 135.00 138.36 1t1g n PRO 251 Ca -0.16 -0.80 -0.20 0.00 -0.04 0.00 0.00 63.50 62.29 1t1g n PRO 251 Cb 0.52 -0.17 -0.12 0.00 -0.04 0.00 0.00 33.50 33.68 1t1g n PRO 251 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1t1g n ASP 252 N -2.95 2.01 -3.84 3.54 8.00 -0.36 -3.83 116.55 119.12 1t1g n ASP 252 Ca 0.05 -0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.40 1t1g n ASP 252 Cb 0.17 -0.57 -0.09 0.00 -0.02 0.00 0.00 41.12 40.62 1t1g n ASP 252 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1t1g s VAL 253 N -2.52 0.00 0.05 2.53 -7.23 -0.92 -1.04 120.40 111.27 1t1g s VAL 253 Ca -0.32 -1.92 -0.14 0.00 -1.81 0.00 0.00 61.98 57.79 1t1g s VAL 253 Cb 0.09 -2.49 0.02 0.00 0.56 0.00 0.00 36.38 34.56 1t1g s VAL 253 CO 0.63 0.00 0.32 0.00 -0.31 0.00 0.00 175.10 175.74 1t1g s ALA 254 N -3.84 -0.72 0.24 1.32 0.00 -0.57 -0.23 121.76 117.97 1t1g s ALA 254 Ca 0.37 0.02 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 1t1g s ALA 254 Cb 0.04 0.35 -0.00 0.00 0.00 0.00 0.00 23.12 23.51 1t1g s ALA 254 CO 0.17 -0.43 0.49 0.20 0.00 0.00 0.00 175.76 176.19 1t1g s GLY 255 N -2.12 0.46 -0.10 0.00 0.00 -0.86 -3.39 107.32 101.31 1t1g s GLY 255 Ca -0.04 -0.81 -0.39 0.00 0.00 0.00 0.00 44.72 43.48 1t1g s GLY 255 CO -0.04 -0.58 1.55 -2.01 0.00 0.00 0.00 173.10 172.01 1t1g n ASN 256 N -0.38 2.00 0.00 1.64 5.15 -1.26 -1.53 115.26 120.89 1t1g n ASN 256 Ca -0.02 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 55.05 1t1g n ASN 256 Cb 0.62 -1.16 0.00 0.00 -0.53 0.00 0.00 39.78 38.71 1t1g n ASN 256 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1t1g n ALA 257 N 3.98 0.00 -1.87 5.20 0.00 -0.10 -4.65 120.51 123.06 1t1g n ALA 257 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.24 1t1g n ALA 257 Cb 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.58 1t1g n ALA 257 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1t1g s ASP 258 N 0.00 6.53 0.57 0.00 3.68 -0.82 0.74 116.67 127.37 1t1g s ASP 258 Ca 0.00 2.35 0.26 0.00 2.13 0.00 0.00 52.55 57.29 1t1g s ASP 258 Cb 0.00 -2.53 1.57 0.00 -1.45 0.00 0.00 42.92 40.51 1t1g s ASP 258 CO 0.00 -1.03 2.11 -0.65 0.13 0.00 0.00 175.17 175.73 1t1g h PRO 259 N 10.20 0.00 0.00 4.34 0.11 -1.90 0.17 132.00 144.91 1t1g h PRO 259 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1t1g h PRO 259 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1t1g h PRO 259 CO 0.95 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.74 1t1g n ALA 260 N -2.41 1.67 -2.79 -0.75 0.00 -1.26 -2.00 120.51 112.98 1t1g n ALA 260 Ca 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 53.44 53.39 1t1g n ALA 260 Cb 0.30 -1.23 0.06 0.00 0.00 0.00 0.00 19.45 18.59 1t1g n ALA 260 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1t1g n THR 261 N -1.46 1.01 -0.53 0.00 -2.24 0.41 -0.60 114.28 110.86 1t1g n THR 261 Ca 0.04 -2.62 0.00 0.00 -2.27 0.00 0.00 64.05 59.20 1t1g n THR 261 Cb 0.16 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 1t1g n THR 261 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t1g n GLY 262 N -0.66 -1.75 3.72 3.38 0.00 -0.19 -4.59 105.19 105.09 1t1g n GLY 262 Ca 0.03 -1.54 -0.35 0.00 0.00 0.00 0.00 46.02 44.17 1t1g n GLY 262 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1t1g s TYR 263 N -0.73 3.39 -0.17 1.61 2.02 -0.01 0.12 117.35 123.58 1t1g s TYR 263 Ca 0.00 0.29 -0.29 0.00 -0.37 0.00 0.00 57.07 56.70 1t1g s TYR 263 Cb 0.00 -2.14 -0.00 0.00 -0.40 0.00 0.00 41.96 39.42 1t1g s TYR 263 CO 0.00 0.28 1.02 -2.00 -1.57 0.00 0.00 175.55 173.27 1t1g s GLU 264 N 0.34 4.34 0.19 -0.62 -6.30 0.11 -1.56 118.70 115.20 1t1g s GLU 264 Ca 0.07 1.37 -0.04 0.00 -2.50 0.00 0.00 54.97 53.87 1t1g s GLU 264 Cb -0.11 -3.59 -0.03 0.00 0.00 0.00 0.00 34.13 30.40 1t1g s GLU 264 CO -0.02 -0.46 0.18 0.14 0.02 0.00 0.00 175.26 175.13 1t1g s VAL 265 N 2.57 0.02 -0.28 3.70 -7.23 -0.46 -4.65 120.40 114.08 1t1g s VAL 265 Ca 0.46 -1.84 0.01 0.00 -1.81 0.00 0.00 61.98 58.80 1t1g s VAL 265 Cb -0.17 -2.32 0.06 0.00 0.56 0.00 0.00 36.38 34.51 1t1g s VAL 265 CO 0.12 -0.11 -0.05 -0.69 -0.31 0.00 0.00 175.10 174.07 1t1g s VAL 266 N -4.10 2.60 -0.21 1.32 1.01 -1.26 -0.70 120.40 119.06 1t1g s VAL 266 Ca 0.32 -1.53 -0.02 0.00 0.00 0.00 0.00 61.98 60.75 1t1g s VAL 266 Cb 0.06 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.92 1t1g s VAL 266 CO 0.09 -0.09 -0.09 -0.63 0.00 0.00 0.00 175.10 174.38 1t1g s ILE 267 N 1.17 2.93 -1.48 2.22 1.09 0.31 -4.66 121.20 122.79 1t1g s ILE 267 Ca -0.07 -0.66 -0.07 0.00 -1.10 0.00 0.00 60.65 58.76 1t1g s ILE 267 Cb -0.20 -2.31 0.05 0.00 -1.06 0.00 0.00 42.46 38.94 1t1g s ILE 267 CO -0.03 0.45 0.69 0.47 -0.10 0.00 0.00 174.94 176.42 1t1g n ASP 268 N 4.74 -2.20 0.00 3.58 10.43 -1.26 -1.08 116.55 130.76 1t1g n ASP 268 Ca -0.19 -0.92 0.00 0.00 2.57 0.00 0.00 54.79 56.25 1t1g n ASP 268 Cb 0.50 -3.39 0.00 0.00 1.84 0.00 0.00 41.12 40.07 1t1g n ASP 268 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1t1g n GLY 269 N -1.71 2.51 3.68 0.44 0.00 -1.26 -4.91 105.19 103.93 1t1g n GLY 269 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 1t1g n GLY 269 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1t1g s GLU 270 N -0.09 4.10 -0.14 1.61 2.12 -0.24 -5.06 118.70 120.99 1t1g s GLU 270 Ca 0.00 -0.27 -0.26 0.00 0.36 0.00 0.00 54.97 54.80 1t1g s GLU 270 Cb 0.00 -3.41 -0.02 0.00 0.26 0.00 0.00 34.13 30.96 1t1g s GLU 270 CO 0.00 0.21 0.87 0.99 -0.54 0.00 0.00 175.26 176.79 1t1g s THR 271 N 0.61 4.87 0.15 -1.70 2.01 -1.26 -0.53 115.64 119.79 1t1g s THR 271 Ca 0.07 1.73 -0.02 0.00 0.31 0.00 0.00 61.69 63.78 1t1g s THR 271 Cb -0.12 -4.18 0.01 0.00 0.01 0.00 0.00 72.50 68.22 1t1g s THR 271 CO 0.01 0.04 0.24 1.07 -0.69 0.00 0.00 174.62 175.29 1t1g n THR 272 N 4.59 0.00 -5.01 -0.82 5.66 0.12 -4.99 114.28 113.83 1t1g n THR 272 Ca 0.05 -0.63 -0.31 0.00 -3.05 0.00 0.00 64.05 60.10 1t1g n THR 272 Cb 0.49 0.44 -0.17 0.00 -1.55 0.00 0.00 70.33 69.54 1t1g n THR 272 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1t1g s VAL 273 N -2.61 1.97 0.05 1.08 1.01 -1.26 -1.35 120.40 119.29 1t1g s VAL 273 Ca 0.10 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.17 1t1g s VAL 273 Cb -0.01 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 1t1g s VAL 273 CO 0.07 0.54 -0.11 -0.63 0.00 0.00 0.00 175.10 174.97 1t1g s ILE 274 N 0.50 0.86 0.00 2.22 -1.09 -0.60 -4.91 121.20 118.19 1t1g s ILE 274 Ca -0.15 -1.09 0.00 0.00 -2.23 0.00 0.00 60.65 57.18 1t1g s ILE 274 Cb -0.17 -0.85 0.00 0.00 -1.58 0.00 0.00 42.46 39.86 1t1g s ILE 274 CO 0.06 -0.21 0.00 0.61 -1.23 0.00 0.00 174.94 174.17 1t1g n GLY 275 N 1.58 5.47 0.00 6.18 0.00 -1.26 -0.83 105.19 116.33 1t1g n GLY 275 Ca -0.21 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.64 1t1g n GLY 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t1g n GLY 276 N 0.97 0.02 0.13 -0.02 0.00 0.23 -4.50 105.19 102.01 1t1g n GLY 276 Ca 0.00 -1.71 0.11 0.00 0.00 0.00 0.00 46.02 44.41 1t1g n GLY 276 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1t1g n THR 277 N 0.16 0.97 0.20 2.61 -2.24 -1.26 -2.39 114.28 112.34 1t1g n THR 277 Ca 0.00 0.42 0.14 0.00 -2.27 0.00 0.00 64.05 62.34 1t1g n THR 277 Cb 0.00 -1.36 0.75 0.00 -2.10 0.00 0.00 70.33 67.62 1t1g n THR 277 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1t1g h SER 278 N 0.00 0.00 1.51 3.42 0.87 -1.88 -1.41 113.55 116.07 1t1g h SER 278 Ca 0.00 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.49 1t1g h SER 278 Cb 0.22 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 1t1g h SER 278 CO 0.00 0.00 -0.50 0.00 -0.53 0.00 0.00 176.83 175.80 1t1g h ALA 279 N 1.89 0.75 -0.18 6.23 0.00 -1.70 -3.37 119.26 122.88 1t1g h ALA 279 Ca 0.07 -0.32 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 1t1g h ALA 279 Cb 0.33 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1t1g h ALA 279 CO -0.00 0.42 -0.63 0.28 0.00 0.00 0.00 179.25 179.31 1t1g h VAL 280 N 0.00 1.31 -0.04 0.00 2.07 -1.42 -2.64 116.25 115.53 1t1g h VAL 280 Ca -0.02 -1.89 -0.00 0.00 0.82 0.00 0.00 66.70 65.61 1t1g h VAL 280 Cb 1.26 1.86 -0.00 0.00 -1.52 0.00 0.00 31.29 32.88 1t1g h VAL 280 CO 0.04 0.59 0.02 0.00 0.02 0.00 0.00 177.57 178.24 1t1g h ALA 281 N 0.82 0.05 -0.05 1.67 0.00 -1.72 -1.75 119.26 118.29 1t1g h ALA 281 Ca -0.01 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1t1g h ALA 281 Cb 1.21 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1t1g h ALA 281 CO 0.12 -0.40 -0.33 -1.00 0.00 0.00 0.00 179.25 177.64 1t1g h PRO 282 N -0.04 0.09 0.03 0.00 0.13 -1.75 -0.00 132.00 130.46 1t1g h PRO 282 Ca 0.01 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1t1g h PRO 282 Cb 0.10 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.22 1t1g h PRO 282 CO -0.00 0.42 -0.04 1.25 -0.23 0.00 0.00 178.00 179.40 1t1g h LEU 283 N 0.08 -0.10 -0.29 1.56 5.85 -1.23 -2.00 115.31 119.20 1t1g h LEU 283 Ca 0.01 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1t1g h LEU 283 Cb 0.64 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1t1g h LEU 283 CO 0.05 -0.06 0.00 -0.26 -0.34 0.00 0.00 178.44 177.83 1t1g h PHE 284 N -0.08 0.00 -0.52 1.25 0.04 -1.14 -2.99 116.94 113.50 1t1g h PHE 284 Ca 0.00 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.67 1t1g h PHE 284 Cb 0.08 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 1t1g h PHE 284 CO -0.09 0.00 -0.10 0.00 -0.60 0.00 0.00 178.31 177.52 1t1g h ALA 285 N 2.15 0.85 -0.69 2.45 0.00 -0.54 -1.40 119.26 122.07 1t1g h ALA 285 Ca 0.00 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.50 1t1g h ALA 285 Cb 0.81 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1t1g h ALA 285 CO 0.00 0.65 0.16 0.00 0.00 0.00 0.00 179.25 180.06 1t1g h ALA 286 N 1.02 0.91 -0.29 0.00 0.00 -1.24 -1.20 119.26 118.46 1t1g h ALA 286 Ca 0.14 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1t1g h ALA 286 Cb 0.64 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1t1g h ALA 286 CO 0.04 0.64 0.19 1.25 0.00 0.00 0.00 179.25 181.38 1t1g h LEU 287 N 1.04 0.34 -1.20 0.00 5.85 -1.35 -2.00 115.31 117.98 1t1g h LEU 287 Ca 0.21 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 1t1g h LEU 287 Cb 0.39 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1t1g h LEU 287 CO 0.00 0.24 0.16 0.58 -0.34 0.00 0.00 178.44 179.09 1t1g h VAL 288 N 0.40 1.20 -0.73 1.05 2.07 -1.03 -1.87 116.25 117.33 1t1g h VAL 288 Ca 0.11 -0.66 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 1t1g h VAL 288 Cb -0.05 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1t1g h VAL 288 CO -0.02 0.25 0.30 0.00 0.02 0.00 0.00 177.57 178.12 1t1g h ALA 289 N 1.47 1.16 -0.24 1.67 0.00 -0.63 -0.11 119.26 122.59 1t1g h ALA 289 Ca 0.17 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1t1g h ALA 289 Cb 0.20 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1t1g h ALA 289 CO -0.01 0.61 -0.09 0.00 0.00 0.00 0.00 179.25 179.76 1t1g h ARG 290 N 1.05 0.49 -0.29 0.00 3.08 -0.93 -2.21 114.38 115.57 1t1g h ARG 290 Ca 0.25 -0.20 0.01 0.00 0.07 0.00 0.00 59.98 60.11 1t1g h ARG 290 Cb 0.18 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1t1g h ARG 290 CO -0.02 0.73 0.17 0.82 -1.07 0.00 0.00 179.97 180.60 1t1g h ILE 291 N 0.22 1.03 -0.82 2.04 5.03 -1.05 -2.36 117.51 121.60 1t1g h ILE 291 Ca 0.06 -0.12 0.06 0.00 -0.12 0.00 0.00 64.86 64.73 1t1g h ILE 291 Cb 0.57 0.65 -0.06 0.00 -3.03 0.00 0.00 36.82 34.96 1t1g h ILE 291 CO 0.03 0.06 0.51 0.78 -0.68 0.00 0.00 178.15 178.85 1t1g h ASN 292 N 0.35 0.80 -0.48 1.72 2.35 -0.98 -0.47 115.58 118.86 1t1g h ASN 292 Ca 0.11 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.89 1t1g h ASN 292 Cb -0.00 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 1t1g h ASN 292 CO -0.05 0.52 0.31 -0.61 -1.65 0.00 0.00 177.43 175.94 1t1g h GLN 293 N 0.94 0.60 -0.15 0.81 4.15 -1.08 -0.26 115.11 120.12 1t1g h GLN 293 Ca 0.35 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.71 1t1g h GLN 293 Cb 0.14 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 27.69 1t1g h GLN 293 CO -0.16 0.40 -0.01 -0.22 -1.93 0.00 0.00 178.83 176.90 1t1g h LYS 294 N 0.62 0.26 0.00 1.69 1.63 -0.90 -3.17 116.57 116.71 1t1g h LYS 294 Ca 0.18 -0.09 -0.05 0.00 -0.85 0.00 0.00 60.65 59.84 1t1g h LYS 294 Cb -0.04 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.57 1t1g h LYS 294 CO -0.06 0.51 -0.24 -0.07 -3.45 0.00 0.00 179.45 176.14 1t1g h LEU 295 N -0.01 0.00 0.00 5.20 3.38 -0.97 -3.46 115.31 119.44 1t1g h LEU 295 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1t1g h LEU 295 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1t1g h LEU 295 CO 0.01 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.39 1t1g n GLY 296 N -0.43 1.95 2.99 0.83 0.00 -0.12 -4.98 105.19 105.43 1t1g n GLY 296 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1t1g n GLY 296 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t1g s LYS 297 N -0.13 0.16 0.34 1.61 0.00 -1.23 -5.04 119.74 115.45 1t1g s LYS 297 Ca 0.00 0.06 -0.29 0.00 0.00 0.00 0.00 55.97 55.74 1t1g s LYS 297 Cb 0.00 0.07 -0.10 0.00 0.00 0.00 0.00 37.83 37.80 1t1g s LYS 297 CO 0.00 -0.02 1.33 -1.25 0.00 0.00 0.00 175.35 175.40 1t1g s PRO 298 N -0.15 4.32 0.46 1.78 0.04 -1.26 -4.70 135.00 135.49 1t1g s PRO 298 Ca -0.02 2.26 0.26 0.00 0.04 0.00 0.00 61.00 63.54 1t1g s PRO 298 Cb -0.02 -3.06 0.72 0.00 0.04 0.00 0.00 34.50 32.18 1t1g s PRO 298 CO 0.00 -0.23 1.74 -0.39 0.04 0.00 0.00 177.00 178.16 1t1g h VAL 299 N 3.03 0.16 0.00 -0.36 -1.51 -1.92 -3.48 116.25 112.17 1t1g h VAL 299 Ca -0.49 -0.99 0.00 0.00 -1.23 0.00 0.00 66.70 63.99 1t1g h VAL 299 Cb 1.23 1.86 0.00 0.00 -2.13 0.00 0.00 31.29 32.25 1t1g h VAL 299 CO 0.65 0.08 0.00 0.61 -1.23 0.00 0.00 177.57 177.68 1t1g n GLY 300 N 0.65 3.03 3.63 5.19 0.00 -1.24 -4.44 105.19 112.01 1t1g n GLY 300 Ca 0.02 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1t1g n GLY 300 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1t1g s TYR 301 N 0.00 1.73 -0.09 1.61 6.04 -1.26 -4.02 117.35 121.35 1t1g s TYR 301 Ca 0.00 0.36 0.19 0.00 0.04 0.00 0.00 57.07 57.66 1t1g s TYR 301 Cb 0.00 -4.03 -0.29 0.00 -1.04 0.00 0.00 41.96 36.60 1t1g s TYR 301 CO 0.00 -3.68 0.30 1.28 -1.54 0.00 0.00 175.55 171.91 1t1g n LEU 302 N 9.12 0.00 -0.24 6.97 4.77 -1.26 -4.74 117.00 131.62 1t1g n LEU 302 Ca 0.22 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.15 1t1g n LEU 302 Cb 0.44 0.18 0.01 0.00 -2.33 0.00 0.00 43.42 41.72 1t1g n LEU 302 CO 0.66 0.18 0.61 0.78 -1.33 0.00 0.00 177.39 178.29 1t1g h ASN 303 N 0.00 -1.26 -0.60 -1.43 -0.26 -1.92 -0.93 115.58 109.18 1t1g h ASN 303 Ca -0.20 0.25 0.08 0.00 -0.56 0.00 0.00 56.30 55.87 1t1g h ASN 303 Cb 1.41 0.63 -0.07 0.00 -1.06 0.00 0.00 38.32 39.23 1t1g h ASN 303 CO 0.01 -0.30 0.25 -0.65 -1.06 0.00 0.00 177.43 175.68 1t1g h PRO 304 N -0.13 0.44 -0.21 0.81 0.11 -1.93 -2.55 132.00 128.53 1t1g h PRO 304 Ca 0.25 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.32 1t1g h PRO 304 Cb 0.56 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 1t1g h PRO 304 CO -0.75 0.29 0.09 1.15 -0.21 0.00 0.00 178.00 178.58 1t1g h THR 305 N 0.45 1.15 -0.80 -1.15 2.02 -1.64 -3.15 112.91 109.79 1t1g h THR 305 Ca 0.29 -0.45 0.11 0.00 0.77 0.00 0.00 66.41 67.14 1t1g h THR 305 Cb 0.32 1.06 -0.08 0.00 -1.74 0.00 0.00 68.15 67.70 1t1g h THR 305 CO -0.27 0.15 0.42 -0.07 0.37 0.00 0.00 175.52 176.13 1t1g h LEU 306 N 0.20 0.55 0.00 2.58 3.38 -0.81 -1.68 115.31 119.53 1t1g h LEU 306 Ca 0.07 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1t1g h LEU 306 Cb 0.15 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1t1g h LEU 306 CO -0.01 0.29 0.00 -1.22 0.09 0.00 0.00 178.44 177.59 1t1g n TYR 307 N -4.83 0.00 0.09 1.13 4.02 -1.02 -2.70 117.16 113.86 1t1g n TYR 307 Ca 0.14 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 58.06 1t1g n TYR 307 Cb 0.33 -0.28 0.06 0.00 -0.02 0.00 0.00 39.34 39.43 1t1g n TYR 307 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1t1g n GLN 308 N -1.28 1.36 -2.34 -0.72 -0.00 -0.66 -5.00 117.38 108.74 1t1g n GLN 308 Ca 0.10 -1.34 -0.32 0.00 -0.00 0.00 0.00 57.00 55.44 1t1g n GLN 308 Cb 0.17 -1.14 -0.02 0.00 -0.00 0.00 0.00 30.24 29.24 1t1g n GLN 308 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1t1g s LEU 309 N -0.77 3.56 0.37 2.61 1.43 -1.06 -5.00 118.68 119.82 1t1g s LEU 309 Ca 0.11 1.49 -0.28 0.00 -1.03 0.00 0.00 54.13 54.42 1t1g s LEU 309 Cb 0.06 -4.45 -0.10 0.00 0.03 0.00 0.00 46.19 41.74 1t1g s LEU 309 CO 0.09 -0.63 1.39 -2.16 0.23 0.00 0.00 176.35 175.27 1t1g s PRO 310 N -4.29 4.16 0.50 1.29 0.04 -1.26 -4.87 135.00 130.58 1t1g s PRO 310 Ca 0.57 2.38 0.26 0.00 0.04 0.00 0.00 61.00 64.24 1t1g s PRO 310 Cb -0.10 -2.97 1.39 0.00 0.04 0.00 0.00 34.50 32.87 1t1g s PRO 310 CO 0.36 -0.41 1.75 -1.00 0.04 0.00 0.00 177.00 177.75 1t1g h PRO 311 N 3.07 0.00 0.00 0.56 0.13 -1.95 -1.84 132.00 131.97 1t1g h PRO 311 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1t1g h PRO 311 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1t1g h PRO 311 CO 0.64 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.46 1t1g h GLU 312 N 0.00 0.00 0.00 0.86 -0.00 -2.02 -2.34 114.58 111.08 1t1g h GLU 312 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.35 1t1g h GLU 312 Cb 0.41 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.16 1t1g h GLU 312 CO 0.00 0.00 -0.04 0.28 -0.00 0.00 0.00 179.01 179.25 1t1g h VAL 313 N 0.00 0.11 -3.16 -1.06 2.07 -1.69 -3.45 116.25 109.06 1t1g h VAL 313 Ca 0.00 -0.64 -0.64 0.00 0.82 0.00 0.00 66.70 66.24 1t1g h VAL 313 Cb 0.25 1.57 -0.18 0.00 -1.52 0.00 0.00 31.29 31.40 1t1g h VAL 313 CO 0.00 0.04 -0.82 -0.36 0.02 0.00 0.00 177.57 176.45 1t1g s PHE 314 N -3.66 2.25 -0.42 1.57 0.40 -0.88 -1.06 117.98 116.18 1t1g s PHE 314 Ca 0.01 -0.37 -0.17 0.00 -0.60 0.00 0.00 56.93 55.81 1t1g s PHE 314 Cb 0.09 -1.11 0.02 0.00 0.51 0.00 0.00 43.02 42.53 1t1g s PHE 314 CO 0.56 0.49 0.40 -1.58 0.70 0.00 0.00 175.22 175.79 1t1g s HIS 315 N -1.74 3.19 -0.05 0.36 5.65 0.89 -4.93 115.29 118.65 1t1g s HIS 315 Ca 0.21 -0.43 -0.30 0.00 0.25 0.00 0.00 55.06 54.78 1t1g s HIS 315 Cb -0.08 -2.81 -0.04 0.00 -1.18 0.00 0.00 32.58 28.47 1t1g s HIS 315 CO 0.10 -0.67 1.37 0.34 -0.65 0.00 0.00 174.74 175.23 1t1g s ASP 316 N 1.77 6.88 -0.20 9.88 2.15 -1.26 -1.87 116.67 134.02 1t1g s ASP 316 Ca 0.10 1.99 -0.15 0.00 0.43 0.00 0.00 52.55 54.93 1t1g s ASP 316 Cb -0.18 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 39.85 1t1g s ASP 316 CO 0.13 -0.73 0.35 -0.63 -0.17 0.00 0.00 175.17 174.11 1t1g s ILE 317 N 2.80 5.24 0.00 4.11 1.09 -1.26 -4.96 121.20 128.22 1t1g s ILE 317 Ca 0.62 0.61 0.00 0.00 -1.10 0.00 0.00 60.65 60.78 1t1g s ILE 317 Cb -0.29 -3.68 0.00 0.00 -1.06 0.00 0.00 42.46 37.43 1t1g s ILE 317 CO 0.24 0.28 0.16 0.35 -0.10 0.00 0.00 174.94 175.87 1t1g n THR 318 N 4.22 0.00 -4.91 2.92 -2.24 -1.26 -4.02 114.28 108.99 1t1g n THR 318 Ca -0.10 -0.44 -0.33 0.00 -2.27 0.00 0.00 64.05 60.91 1t1g n THR 318 Cb 0.51 1.04 -0.14 0.00 -2.10 0.00 0.00 70.33 69.64 1t1g n THR 318 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1t1g s GLU 319 N -0.56 2.99 0.00 -0.78 2.12 -1.26 -3.45 118.70 117.75 1t1g s GLU 319 Ca 0.00 -0.73 0.00 0.00 0.36 0.00 0.00 54.97 54.60 1t1g s GLU 319 Cb 0.00 -2.47 0.00 0.00 0.26 0.00 0.00 34.13 31.92 1t1g s GLU 319 CO 0.00 0.36 0.00 0.41 -0.54 0.00 0.00 175.26 175.49 1t1g n GLY 320 N 3.09 1.47 3.28 -1.50 0.00 -1.26 -1.49 105.19 108.77 1t1g n GLY 320 Ca -0.18 -2.16 -0.09 0.00 0.00 0.00 0.00 46.02 43.59 1t1g n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t1g s ASN 321 N 0.00 0.08 -0.34 1.61 2.20 -1.26 -0.88 114.94 116.35 1t1g s ASN 321 Ca 0.00 -0.79 0.07 0.00 -0.94 0.00 0.00 52.86 51.20 1t1g s ASN 321 Cb 0.00 0.39 0.49 0.00 -2.00 0.00 0.00 41.25 40.14 1t1g s ASN 321 CO 0.00 -0.82 1.48 -0.46 -2.94 0.00 0.00 177.10 174.35 1t1g n ASN 322 N -0.15 3.63 -4.61 3.54 6.94 -0.51 -4.63 115.26 119.47 1t1g n ASN 322 Ca -0.10 -3.79 -0.40 0.00 -0.02 0.00 0.00 54.58 50.27 1t1g n ASN 322 Cb 0.63 -0.62 -0.08 0.00 -2.36 0.00 0.00 39.78 37.35 1t1g n ASN 322 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1t1g s ASP 323 N -2.69 6.39 -0.04 0.53 3.68 -1.24 -0.90 116.67 122.40 1t1g s ASP 323 Ca 0.49 0.41 0.06 0.00 2.13 0.00 0.00 52.55 55.64 1t1g s ASP 323 Cb 0.42 -2.27 0.10 0.00 -1.45 0.00 0.00 42.92 39.72 1t1g s ASP 323 CO 0.00 -0.30 1.00 2.30 0.13 0.00 0.00 175.17 178.30 1t1g n ILE 324 N 5.19 1.12 -0.05 4.11 -5.35 -1.26 -4.77 119.36 118.35 1t1g n ILE 324 Ca -0.05 -1.25 -0.05 0.00 -0.27 0.00 0.00 62.75 61.14 1t1g n ILE 324 Cb 0.50 0.31 -0.08 0.00 -1.74 0.00 0.00 39.64 38.63 1t1g n ILE 324 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1t1g n ALA 325 N -0.72 1.76 -3.00 -1.28 0.00 -1.26 -4.20 120.51 111.81 1t1g n ALA 325 Ca 0.05 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1t1g n ALA 325 Cb 0.44 0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1t1g n ALA 325 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1t1g n ASN 326 N -2.36 0.00 -1.08 0.00 2.04 -1.26 -5.06 115.26 107.53 1t1g n ASN 326 Ca -0.16 -0.88 0.11 0.00 -0.44 0.00 0.00 54.58 53.21 1t1g n ASN 326 Cb 0.81 0.00 0.27 0.00 -2.53 0.00 0.00 39.78 38.33 1t1g n ASN 326 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1t1g n ARG 327 N 0.00 2.38 0.00 -3.83 5.12 -1.26 -4.50 116.66 114.58 1t1g n ARG 327 Ca 0.00 -2.13 0.12 0.00 -1.93 0.00 0.00 57.85 53.92 1t1g n ARG 327 Cb 0.00 -1.48 0.56 0.00 -1.16 0.00 0.00 32.46 30.38 1t1g n ARG 327 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1t1g n ALA 328 N 1.27 2.19 -3.70 7.54 0.00 -1.26 -4.94 120.51 121.61 1t1g n ALA 328 Ca 0.20 -0.09 -0.24 0.00 0.00 0.00 0.00 53.44 53.31 1t1g n ALA 328 Cb 0.53 -1.42 0.05 0.00 0.00 0.00 0.00 19.45 18.61 1t1g n ALA 328 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1t1g n ARG 329 N -1.47 -5.97 -3.77 0.00 1.74 -1.26 -4.99 116.66 100.94 1t1g n ARG 329 Ca 0.07 0.69 -0.37 0.00 -0.77 0.00 0.00 57.85 57.48 1t1g n ARG 329 Cb 0.29 -5.52 -0.13 0.00 -1.02 0.00 0.00 32.46 26.08 1t1g n ARG 329 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1t1g s ILE 330 N -3.45 4.10 0.27 0.55 -1.09 -1.26 -3.29 121.20 117.04 1t1g s ILE 330 Ca 0.30 -0.42 0.07 0.00 -2.23 0.00 0.00 60.65 58.37 1t1g s ILE 330 Cb -0.14 -3.00 -0.03 0.00 -1.58 0.00 0.00 42.46 37.71 1t1g s ILE 330 CO 0.79 0.23 0.28 -0.31 -1.23 0.00 0.00 174.94 174.70 1t1g s TYR 331 N 1.56 3.14 0.08 3.97 1.51 -1.26 -3.63 117.35 122.72 1t1g s TYR 331 Ca 0.05 -0.14 0.06 0.00 -1.01 0.00 0.00 57.07 56.03 1t1g s TYR 331 Cb -0.16 -1.58 -0.04 0.00 -0.11 0.00 0.00 41.96 40.08 1t1g s TYR 331 CO 0.03 0.38 -0.09 -1.14 -1.11 0.00 0.00 175.55 173.62 1t1g s GLN 332 N -3.94 2.23 0.58 -0.62 0.74 -1.21 -1.43 119.66 116.02 1t1g s GLN 332 Ca 0.36 -0.96 -0.09 0.00 0.05 0.00 0.00 55.36 54.73 1t1g s GLN 332 Cb -0.08 -2.35 -0.03 0.00 1.10 0.00 0.00 33.01 31.66 1t1g s GLN 332 CO 0.27 0.53 0.94 0.00 -0.55 0.00 0.00 175.29 176.48 1t1g s ALA 333 N -1.17 3.20 0.03 1.58 0.00 -0.06 -4.48 121.76 120.86 1t1g s ALA 333 Ca 0.21 -0.32 -0.11 0.00 0.00 0.00 0.00 51.96 51.73 1t1g s ALA 333 Cb -0.11 -2.86 0.04 0.00 0.00 0.00 0.00 23.12 20.19 1t1g s ALA 333 CO 0.13 -0.64 0.49 0.41 0.00 0.00 0.00 175.76 176.15 1t1g n GLY 334 N -2.60 0.71 3.78 0.00 0.00 -1.22 -4.67 105.19 101.18 1t1g n GLY 334 Ca 0.04 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 1t1g n GLY 334 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1t1g s PRO 335 N -2.01 4.14 1.90 1.61 0.04 -1.26 -4.40 135.00 135.00 1t1g s PRO 335 Ca 0.11 2.49 0.00 0.00 0.04 0.00 0.00 61.00 63.64 1t1g s PRO 335 Cb -0.01 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.56 1t1g s PRO 335 CO 0.01 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 176.98 1t1g n GLY 336 N 0.53 -1.38 3.77 0.56 0.00 -1.26 -4.83 105.19 102.58 1t1g n GLY 336 Ca 0.01 -1.28 -0.40 0.00 0.00 0.00 0.00 46.02 44.35 1t1g n GLY 336 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1t1g s TRP 337 N 0.00 2.81 0.10 1.61 -0.00 -1.26 -4.83 118.94 117.38 1t1g s TRP 337 Ca 0.00 1.34 -0.06 0.00 -0.00 0.00 0.00 56.10 57.39 1t1g s TRP 337 Cb 0.00 -3.78 -0.02 0.00 -0.00 0.00 0.00 33.47 29.67 1t1g s TRP 337 CO 0.00 -2.29 0.13 0.16 -0.00 0.00 0.00 176.95 174.95 1t1g s ASP 338 N -0.49 0.22 0.00 5.86 1.47 -1.13 -4.87 116.67 117.73 1t1g s ASP 338 Ca 0.53 -0.89 0.00 0.00 1.18 0.00 0.00 52.55 53.38 1t1g s ASP 338 Cb -0.41 0.32 0.00 0.00 -0.34 0.00 0.00 42.92 42.49 1t1g s ASP 338 CO 0.54 -0.74 0.50 -2.65 0.68 0.00 0.00 175.17 173.51 1t1g n PRO 339 N -0.06 0.90 -0.01 2.11 -0.02 -1.26 -1.00 135.00 135.66 1t1g n PRO 339 Ca -0.11 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.35 1t1g n PRO 339 Cb 0.62 -1.40 -0.01 0.00 -0.02 0.00 0.00 33.50 32.69 1t1g n PRO 339 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1t1g n THR 341 N -2.61 0.15 -1.55 0.00 -2.24 -1.21 -4.34 114.28 102.48 1t1g n THR 341 Ca -0.04 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1t1g n THR 341 Cb 0.54 1.29 0.00 0.00 -2.10 0.00 0.00 70.33 70.06 1t1g n THR 341 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t1g n GLY 342 N -0.08 3.38 0.00 3.38 0.00 -0.17 -1.60 105.19 110.11 1t1g n GLY 342 Ca 0.00 -0.18 0.10 0.00 0.00 0.00 0.00 46.02 45.94 1t1g n GLY 342 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1t1g n LEU 343 N 0.00 0.00 0.00 0.99 4.77 -0.20 -2.84 117.00 119.72 1t1g n LEU 343 Ca 0.00 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 1t1g n LEU 343 Cb 0.00 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 1t1g n LEU 343 CO 0.00 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.53 1t1g n GLY 344 N 0.60 -1.21 3.78 -0.72 0.00 -0.63 -4.46 105.19 102.56 1t1g n GLY 344 Ca 0.05 -2.11 -0.39 0.00 0.00 0.00 0.00 46.02 43.58 1t1g n GLY 344 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1t1g s SER 345 N -4.00 6.96 0.47 1.61 1.04 -0.78 -1.51 113.70 117.48 1t1g s SER 345 Ca 0.00 1.14 -0.21 0.00 0.48 0.00 0.00 55.95 57.36 1t1g s SER 345 Cb 0.00 -2.35 -0.08 0.00 0.10 0.00 0.00 66.02 63.69 1t1g s SER 345 CO 0.00 0.16 1.06 -2.16 0.98 0.00 0.00 173.24 173.28 1t1g s PRO 346 N -0.45 3.84 -0.56 4.02 0.04 -1.26 -0.08 135.00 140.55 1t1g s PRO 346 Ca 0.29 1.45 -0.14 0.00 0.04 0.00 0.00 61.00 62.65 1t1g s PRO 346 Cb -0.18 -2.22 0.14 0.00 0.04 0.00 0.00 34.50 32.28 1t1g s PRO 346 CO 0.17 -0.41 0.50 0.42 0.04 0.00 0.00 177.00 177.71 1t1g s ILE 347 N -1.85 5.03 0.22 0.56 -1.09 -0.23 -4.78 121.20 119.06 1t1g s ILE 347 Ca 0.65 -1.69 -0.19 0.00 -2.23 0.00 0.00 60.65 57.19 1t1g s ILE 347 Cb -0.19 -4.23 0.19 0.00 -1.58 0.00 0.00 42.46 36.65 1t1g s ILE 347 CO 0.23 -0.87 1.53 0.61 -1.23 0.00 0.00 174.94 175.21 1t1g n GLY 348 N 5.01 -2.11 0.22 6.18 0.00 0.31 -1.23 105.19 113.56 1t1g n GLY 348 Ca -0.09 1.12 -0.01 0.00 0.00 0.00 0.00 46.02 47.03 1t1g n GLY 348 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1t1g h ILE 349 N 0.00 1.27 -0.08 -0.61 6.09 -1.14 -1.67 117.51 121.36 1t1g h ILE 349 Ca 0.31 -1.27 -0.17 0.00 -1.37 0.00 0.00 64.86 62.36 1t1g h ILE 349 Cb 0.56 1.50 -0.01 0.00 0.47 0.00 0.00 36.82 39.34 1t1g h ILE 349 CO -0.97 0.39 -0.69 0.03 -3.07 0.00 0.00 178.15 173.83 1t1g h ARG 350 N 0.25 0.38 -0.25 2.19 3.08 -1.57 -1.68 114.38 116.77 1t1g h ARG 350 Ca 0.03 -0.29 -0.05 0.00 0.07 0.00 0.00 59.98 59.74 1t1g h ARG 350 Cb 0.67 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 1t1g h ARG 350 CO 0.05 0.93 -0.03 1.25 -1.07 0.00 0.00 179.97 181.10 1t1g h LEU 351 N 0.26 0.45 -0.40 3.04 5.85 -0.87 -1.40 115.31 122.26 1t1g h LEU 351 Ca -0.02 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1t1g h LEU 351 Cb 1.25 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 1t1g h LEU 351 CO 0.12 0.69 0.22 0.25 -0.34 0.00 0.00 178.44 179.37 1t1g h LEU 352 N 0.21 0.50 -0.70 2.25 5.85 -1.27 -1.78 115.31 120.37 1t1g h LEU 352 Ca 0.07 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.72 1t1g h LEU 352 Cb 0.47 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1t1g h LEU 352 CO 0.02 0.44 0.45 1.56 -0.34 0.00 0.00 178.44 180.57 1t1g h GLN 353 N 0.51 0.87 0.00 1.25 4.20 -1.24 -1.65 115.11 119.05 1t1g h GLN 353 Ca 0.14 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 1t1g h GLN 353 Cb 0.06 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.64 1t1g h GLN 353 CO -0.02 0.58 -0.11 0.00 -0.67 0.00 0.00 178.83 178.60 1t1g h ALA 354 N 1.28 1.11 -0.00 3.87 0.00 -0.95 -2.80 119.26 121.77 1t1g h ALA 354 Ca 0.27 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1t1g h ALA 354 Cb -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1t1g h ALA 354 CO -0.09 0.14 -0.47 1.28 0.00 0.00 0.00 179.25 180.11 1t1g n LEU 355 N -3.37 0.95 -4.73 0.00 4.77 -0.68 -4.91 117.00 109.02 1t1g n LEU 355 Ca -0.01 -0.26 -0.41 0.00 -0.03 0.00 0.00 56.01 55.30 1t1g n LEU 355 Cb 0.29 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1t1g n LEU 355 CO 0.29 0.20 0.89 -0.76 -1.33 0.00 0.00 177.39 176.68 1t1g s LEU 356 N -2.75 4.44 0.00 2.23 1.43 -0.86 -5.08 118.68 118.09 1t1g s LEU 356 Ca 0.17 2.22 0.19 0.00 -1.03 0.00 0.00 54.13 55.67 1t1g s LEU 356 Cb 0.18 -3.60 1.11 0.00 0.03 0.00 0.00 46.19 43.91 1t1g s LEU 356 CO 0.64 -0.40 1.51 -0.81 0.23 0.00 0.00 176.35 177.52