#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h0g s LEU 3 N 0.00 4.16 0.32 -1.84 1.43 -1.26 -5.07 118.68 116.42 2h0g s LEU 3 Ca 0.00 0.27 -0.29 0.00 -1.03 0.00 0.00 54.13 53.08 2h0g s LEU 3 Cb 0.00 -3.10 -0.10 0.00 0.03 0.00 0.00 46.19 43.02 2h0g s LEU 3 CO 0.00 -0.19 1.35 -2.84 0.23 0.00 0.00 176.35 174.91 2h0g s PRO 4 N -4.14 4.31 0.26 1.29 0.02 -1.26 -4.80 135.00 130.67 2h0g s PRO 4 Ca 0.37 2.27 -0.07 0.00 0.02 0.00 0.00 61.00 63.59 2h0g s PRO 4 Cb -0.09 -3.07 0.46 0.00 0.02 0.00 0.00 34.50 31.81 2h0g s PRO 4 CO 0.33 -0.28 1.59 0.00 -0.33 0.00 0.00 177.00 178.31 2h0g h ALA 5 N 3.72 0.72 -0.01 -1.55 0.00 -1.95 -0.53 119.26 119.66 2h0g h ALA 5 Ca -0.48 0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 2h0g h ALA 5 Cb 1.23 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 2h0g h ALA 5 CO 0.68 -0.43 -0.28 -1.00 0.00 0.00 0.00 179.25 178.21 2h0g h PRO 6 N 0.03 0.02 -0.16 0.00 0.13 -1.84 -2.08 132.00 128.09 2h0g h PRO 6 Ca 0.45 -0.01 -0.19 0.00 -0.87 0.00 0.00 66.00 65.38 2h0g h PRO 6 Cb 0.76 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.89 2h0g h PRO 6 CO -0.84 0.30 -0.67 0.28 -0.23 0.00 0.00 178.00 176.84 2h0g h VAL 7 N 0.02 1.32 -0.82 1.56 2.07 -1.49 -3.02 116.25 115.89 2h0g h VAL 7 Ca 0.00 -1.94 -0.03 0.00 0.82 0.00 0.00 66.70 65.55 2h0g h VAL 7 Cb 0.51 1.91 -0.04 0.00 -1.52 0.00 0.00 31.29 32.15 2h0g h VAL 7 CO 0.04 0.60 0.40 0.50 0.02 0.00 0.00 177.57 179.13 2h0g h LYS 8 N 0.45 1.17 -0.31 1.57 3.64 -0.98 -1.97 116.57 120.13 2h0g h LYS 8 Ca -0.02 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.16 2h0g h LYS 8 Cb 1.25 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 2h0g h LYS 8 CO 0.13 0.89 0.05 0.00 -2.27 0.00 0.00 179.45 178.25 2h0g h ALA 9 N 1.27 1.51 0.00 5.00 0.00 -1.28 -1.51 119.26 124.25 2h0g h ALA 9 Ca 0.28 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 2h0g h ALA 9 Cb 0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2h0g h ALA 9 CO -0.04 0.36 -0.70 0.82 0.00 0.00 0.00 179.25 179.70 2h0g h ILE 10 N 0.45 1.34 -0.48 0.00 2.04 -1.30 -3.12 117.51 116.45 2h0g h ILE 10 Ca 0.11 -2.52 -0.03 0.00 1.00 0.00 0.00 64.86 63.42 2h0g h ILE 10 Cb 0.22 2.42 -0.02 0.00 -0.74 0.00 0.00 36.82 38.70 2h0g h ILE 10 CO 0.00 0.68 0.18 -0.08 0.00 0.00 0.00 178.15 178.93 2h0g h GLU 11 N 0.00 0.72 0.00 2.37 4.81 -0.58 -1.80 114.58 120.10 2h0g h GLU 11 Ca -0.01 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2h0g h GLU 11 Cb 1.36 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2h0g h GLU 11 CO 0.09 0.66 0.00 1.63 -0.73 0.00 0.00 179.01 180.66 2h0g n LYS 12 N -4.56 0.05 -0.33 1.92 4.01 -0.80 -1.44 118.16 117.02 2h0g n LYS 12 Ca 0.01 0.44 0.03 0.00 -0.51 0.00 0.00 58.31 58.29 2h0g n LYS 12 Cb 0.16 -1.63 0.16 0.00 -0.51 0.00 0.00 35.03 33.22 2h0g n LYS 12 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 2h0g n GLN 13 N -1.73 2.42 -0.72 1.97 1.13 -0.68 -4.85 117.38 114.93 2h0g n GLN 13 Ca 0.01 -1.27 0.00 0.00 -1.94 0.00 0.00 57.00 53.80 2h0g n GLN 13 Cb 0.08 -1.69 0.00 0.00 0.11 0.00 0.00 30.24 28.75 2h0g n GLN 13 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2h0g n GLY 14 N 0.43 1.02 3.59 1.08 0.00 -0.52 -5.09 105.19 105.71 2h0g n GLY 14 Ca 0.11 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 2h0g n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h0g s ILE 15 N -2.00 3.82 -0.18 -0.61 1.01 -0.77 -4.51 121.20 117.95 2h0g s ILE 15 Ca 0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 60.65 60.20 2h0g s ILE 15 Cb 0.00 -2.58 -0.01 0.00 0.01 0.00 0.00 42.46 39.89 2h0g s ILE 15 CO 0.00 0.59 -0.09 -0.89 0.00 0.00 0.00 174.94 174.56 2h0g s THR 16 N -0.73 3.17 0.11 2.92 2.01 -0.06 -4.60 115.64 118.47 2h0g s THR 16 Ca 0.11 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.23 2h0g s THR 16 Cb -0.11 -2.40 -0.06 0.00 0.01 0.00 0.00 72.50 69.94 2h0g s THR 16 CO 0.02 0.47 1.08 -0.63 -0.69 0.00 0.00 174.62 174.87 2h0g s ILE 17 N 1.02 4.17 -0.25 1.82 1.09 -1.26 -1.00 121.20 126.79 2h0g s ILE 17 Ca -0.00 1.72 -0.05 0.00 -1.10 0.00 0.00 60.65 61.22 2h0g s ILE 17 Cb -0.15 -4.10 -0.16 0.00 -1.06 0.00 0.00 42.46 36.99 2h0g s ILE 17 CO -0.01 0.22 -0.21 -0.38 -0.10 0.00 0.00 174.94 174.46 2h0g n ILE 18 N 3.07 1.53 -3.66 2.92 5.41 0.06 -4.97 119.36 123.72 2h0g n ILE 18 Ca 0.05 -0.49 0.03 0.00 1.00 0.00 0.00 62.75 63.34 2h0g n ILE 18 Cb 0.47 -1.62 0.00 0.00 -0.71 0.00 0.00 39.64 37.78 2h0g n ILE 18 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 2h0g s LYS 19 N -2.51 0.17 0.26 0.38 -2.85 -1.17 -5.03 119.74 108.98 2h0g s LYS 19 Ca -0.35 -0.10 0.06 0.00 -1.00 0.00 0.00 55.97 54.58 2h0g s LYS 19 Cb 0.11 0.06 -0.03 0.00 -2.06 0.00 0.00 37.83 35.90 2h0g s LYS 19 CO 0.57 -0.08 0.30 0.95 0.10 0.00 0.00 175.35 177.20 2h0g s THR 20 N -2.15 4.79 0.10 3.79 -4.23 -1.26 -0.53 115.64 116.15 2h0g s THR 20 Ca 0.18 -1.16 -0.13 0.00 -1.18 0.00 0.00 61.69 59.39 2h0g s THR 20 Cb 0.05 -3.62 0.02 0.00 1.34 0.00 0.00 72.50 70.29 2h0g s THR 20 CO -0.05 -0.32 0.32 0.72 -0.54 0.00 0.00 174.62 174.75 2h0g s PHE 21 N -2.07 -0.07 0.03 3.99 -0.12 -0.24 -4.88 117.98 114.63 2h0g s PHE 21 Ca 0.35 -0.27 -0.30 0.00 -0.05 0.00 0.00 56.93 56.65 2h0g s PHE 21 Cb -0.08 0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.39 2h0g s PHE 21 CO 0.27 -0.62 1.06 -0.51 -0.05 0.00 0.00 175.22 175.37 2h0g s ASP 22 N -2.74 7.27 0.39 1.98 1.01 -1.26 -0.93 116.67 122.38 2h0g s ASP 22 Ca 0.03 1.79 0.08 0.00 0.71 0.00 0.00 52.55 55.16 2h0g s ASP 22 Cb 0.03 -2.57 -0.06 0.00 1.01 0.00 0.00 42.92 41.32 2h0g s ASP 22 CO -0.11 -0.33 0.06 0.00 0.21 0.00 0.00 175.17 175.00 2h0g s ALA 23 N 0.99 3.29 0.89 5.23 0.00 -1.16 -4.81 121.76 126.19 2h0g s ALA 23 Ca 0.54 -2.14 -0.12 0.00 0.00 0.00 0.00 51.96 50.24 2h0g s ALA 23 Cb -0.24 -0.17 0.12 0.00 0.00 0.00 0.00 23.12 22.84 2h0g s ALA 23 CO 0.29 -0.07 1.12 -2.14 0.00 0.00 0.00 175.76 174.95 2h0g s PRO 24 N -3.77 1.32 -1.52 0.00 0.02 -1.26 -4.26 135.00 125.53 2h0g s PRO 24 Ca 0.37 0.47 -0.07 0.00 0.02 0.00 0.00 61.00 61.78 2h0g s PRO 24 Cb 0.05 -1.84 0.06 0.00 0.02 0.00 0.00 34.50 32.78 2h0g s PRO 24 CO 0.20 -2.11 0.57 0.41 -0.33 0.00 0.00 177.00 175.74 2h0g n GLY 25 N -1.93 -0.31 2.35 0.52 0.00 -1.26 -2.06 105.19 102.49 2h0g n GLY 25 Ca 0.06 0.15 -0.02 0.00 0.00 0.00 0.00 46.02 46.21 2h0g n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h0g n GLY 26 N -1.78 0.51 3.93 -0.02 0.00 -1.26 -4.85 105.19 101.72 2h0g n GLY 26 Ca -0.16 -0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 2h0g n GLY 26 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2h0g s MET 27 N -1.35 3.48 -0.17 1.61 1.00 -0.88 -4.45 119.30 118.56 2h0g s MET 27 Ca 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 55.69 55.23 2h0g s MET 27 Cb 0.00 -2.93 -0.02 0.00 0.00 0.00 0.00 34.83 31.88 2h0g s MET 27 CO 0.00 0.50 -0.06 0.21 0.00 0.00 0.00 175.02 175.67 2h0g s LYS 28 N -3.04 3.51 0.13 2.03 2.20 -1.12 -2.99 119.74 120.47 2h0g s LYS 28 Ca 0.37 -0.59 -0.05 0.00 -0.36 0.00 0.00 55.97 55.33 2h0g s LYS 28 Cb -0.12 -2.87 -0.06 0.00 -1.51 0.00 0.00 37.83 33.28 2h0g s LYS 28 CO 0.28 0.11 0.37 0.20 -0.36 0.00 0.00 175.35 175.95 2h0g s GLY 29 N 0.69 2.24 -0.12 5.54 0.00 -0.11 -0.48 107.32 115.09 2h0g s GLY 29 Ca -0.03 -0.55 -0.00 0.00 0.00 0.00 0.00 44.72 44.14 2h0g s GLY 29 CO 0.02 -0.45 -0.08 -0.19 0.00 0.00 0.00 173.10 172.40 2h0g s TYR 30 N -1.62 1.55 0.01 1.90 1.51 0.17 -1.08 117.35 119.79 2h0g s TYR 30 Ca 0.40 -0.78 -0.15 0.00 -1.01 0.00 0.00 57.07 55.53 2h0g s TYR 30 Cb -0.12 -1.27 -0.06 0.00 -0.11 0.00 0.00 41.96 40.40 2h0g s TYR 30 CO 0.24 -0.52 0.42 -1.17 -1.11 0.00 0.00 175.55 173.41 2h0g s LEU 31 N 1.66 4.48 0.00 -1.29 2.96 0.32 -0.28 118.68 126.52 2h0g s LEU 31 Ca 0.05 0.99 0.00 0.00 -0.22 0.00 0.00 54.13 54.94 2h0g s LEU 31 Cb -0.13 -2.63 0.00 0.00 0.50 0.00 0.00 46.19 43.93 2h0g s LEU 31 CO -0.08 0.32 0.00 0.61 -1.32 0.00 0.00 176.35 175.87 2h0g n GLY 32 N 1.77 2.41 2.93 7.98 0.00 0.06 -0.76 105.19 119.58 2h0g n GLY 32 Ca -0.13 -1.07 -0.10 0.00 0.00 0.00 0.00 46.02 44.71 2h0g n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h0g s LYS 33 N -1.64 0.17 -0.28 1.61 1.02 -0.17 -0.36 119.74 120.09 2h0g s LYS 33 Ca 0.00 -0.31 -0.02 0.00 0.02 0.00 0.00 55.97 55.66 2h0g s LYS 33 Cb 0.00 0.06 0.09 0.00 -0.52 0.00 0.00 37.83 37.46 2h0g s LYS 33 CO 0.00 -0.03 0.09 -0.47 -0.92 0.00 0.00 175.35 174.03 2h0g s TYR 34 N -0.76 1.16 -1.12 3.18 5.04 -0.23 -0.88 117.35 123.73 2h0g s TYR 34 Ca -0.08 -1.29 -0.04 0.00 -2.44 0.00 0.00 57.07 53.22 2h0g s TYR 34 Cb -0.05 -1.33 0.00 0.00 0.35 0.00 0.00 41.96 40.94 2h0g s TYR 34 CO -0.00 -0.80 0.96 1.04 -1.34 0.00 0.00 175.55 175.40 2h0g n GLN 35 N 5.01 -6.41 -0.85 4.97 6.02 -1.26 -2.36 117.38 122.50 2h0g n GLN 35 Ca -0.05 0.74 0.00 0.00 -0.01 0.00 0.00 57.00 57.69 2h0g n GLN 35 Cb 0.43 -5.49 0.00 0.00 1.02 0.00 0.00 30.24 26.20 2h0g n GLN 35 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2h0g n ASP 36 N -2.71 -1.30 -4.58 1.08 2.03 -1.26 -4.98 116.55 104.83 2h0g n ASP 36 Ca -0.14 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 54.82 2h0g n ASP 36 Cb 0.61 -1.32 -0.11 0.00 -0.72 0.00 0.00 41.12 39.58 2h0g n ASP 36 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2h0g s MET 37 N -0.57 3.88 0.29 -0.67 -1.94 -0.99 -5.05 119.30 114.24 2h0g s MET 37 Ca 0.00 -0.38 -0.30 0.00 -1.71 0.00 0.00 55.69 53.30 2h0g s MET 37 Cb 0.00 -3.29 -0.11 0.00 2.01 0.00 0.00 34.83 33.44 2h0g s MET 37 CO 0.00 0.09 1.53 0.20 -0.01 0.00 0.00 175.02 176.83 2h0g s GLY 38 N 0.87 2.28 0.12 -0.03 0.00 -1.26 -1.07 107.32 108.24 2h0g s GLY 38 Ca 0.04 1.49 0.06 0.00 0.00 0.00 0.00 44.72 46.31 2h0g s GLY 38 CO 0.03 2.42 -0.14 -1.34 0.00 0.00 0.00 173.10 174.07 2h0g s VAL 39 N -0.15 1.35 -0.08 1.40 -7.23 0.51 -4.89 120.40 111.31 2h0g s VAL 39 Ca 0.61 -1.72 0.04 0.00 -1.81 0.00 0.00 61.98 59.09 2h0g s VAL 39 Cb -0.46 -1.54 0.00 0.00 0.56 0.00 0.00 36.38 34.95 2h0g s VAL 39 CO 0.48 -0.40 -0.20 0.42 -0.31 0.00 0.00 175.10 175.09 2h0g s THR 40 N -2.11 1.73 -0.06 5.32 -4.23 -1.26 -0.76 115.64 114.28 2h0g s THR 40 Ca 0.09 -0.84 0.06 0.00 -1.18 0.00 0.00 61.69 59.82 2h0g s THR 40 Cb -0.05 -1.51 -0.01 0.00 1.34 0.00 0.00 72.50 72.26 2h0g s THR 40 CO 0.03 0.49 -0.25 -0.63 -0.54 0.00 0.00 174.62 173.72 2h0g s ILE 41 N 0.39 2.11 -0.19 2.99 1.01 0.61 -2.02 121.20 126.09 2h0g s ILE 41 Ca -0.16 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.45 2h0g s ILE 41 Cb -0.17 -1.76 0.02 0.00 0.01 0.00 0.00 42.46 40.57 2h0g s ILE 41 CO 0.07 0.57 -0.18 -0.31 0.00 0.00 0.00 174.94 175.09 2h0g s TYR 42 N -0.19 2.86 -0.02 3.97 1.51 0.34 0.43 117.35 126.26 2h0g s TYR 42 Ca -0.03 -1.70 -0.27 0.00 -1.01 0.00 0.00 57.07 54.06 2h0g s TYR 42 Cb -0.14 -1.93 -0.04 0.00 -0.11 0.00 0.00 41.96 39.74 2h0g s TYR 42 CO 0.03 -0.80 0.84 -1.17 -1.11 0.00 0.00 175.55 173.33 2h0g s LEU 43 N 1.27 4.36 1.16 -1.29 2.96 0.37 -0.07 118.68 127.45 2h0g s LEU 43 Ca 0.03 1.44 -0.16 0.00 -0.22 0.00 0.00 54.13 55.22 2h0g s LEU 43 Cb -0.14 -3.32 0.27 0.00 0.50 0.00 0.00 46.19 43.49 2h0g s LEU 43 CO -0.11 -0.16 1.07 0.42 -1.32 0.00 0.00 176.35 176.25 2h0g s THR 44 N 0.75 1.76 -0.58 3.68 -4.23 0.21 -2.80 115.64 114.42 2h0g s THR 44 Ca 0.44 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 61.04 2h0g s THR 44 Cb -0.20 -2.37 0.09 0.00 1.34 0.00 0.00 72.50 71.36 2h0g s THR 44 CO 0.23 0.00 1.25 -2.65 -0.54 0.00 0.00 174.62 172.91 2h0g n PRO 45 N -4.71 0.06 -0.06 3.99 -0.02 -1.26 -2.39 135.00 130.60 2h0g n PRO 45 Ca 0.08 0.54 -0.03 0.00 -2.02 0.00 0.00 63.50 62.07 2h0g n PRO 45 Cb 0.58 -1.74 -0.14 0.00 -0.02 0.00 0.00 33.50 32.18 2h0g n PRO 45 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2h0g n ASP 46 N -1.80 0.64 0.00 2.55 5.68 -1.26 -4.96 116.55 117.39 2h0g n ASP 46 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.28 2h0g n ASP 46 Cb 0.06 1.23 0.00 0.00 -1.14 0.00 0.00 41.12 41.27 2h0g n ASP 46 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h0g n GLY 47 N 1.76 0.75 0.01 6.12 0.00 -1.00 -4.93 105.19 107.89 2h0g n GLY 47 Ca -0.21 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.92 2h0g n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h0g n LYS 48 N -2.29 0.48 -4.16 1.61 5.02 -1.26 -4.67 118.16 112.90 2h0g n LYS 48 Ca 0.00 -0.14 -0.13 0.00 -2.02 0.00 0.00 58.31 56.02 2h0g n LYS 48 Cb 0.00 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.40 2h0g n LYS 48 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2h0g s HIS 49 N -3.33 0.96 0.02 2.13 3.76 -1.26 -4.64 115.29 112.92 2h0g s HIS 49 Ca -0.03 -0.70 0.00 0.00 -0.15 0.00 0.00 55.06 54.19 2h0g s HIS 49 Cb 0.14 -0.54 -0.01 0.00 1.11 0.00 0.00 32.58 33.28 2h0g s HIS 49 CO 0.88 -0.05 -0.03 0.00 -0.85 0.00 0.00 174.74 174.70 2h0g s ALA 50 N -2.59 0.17 -0.15 -1.40 0.00 -1.26 -0.62 121.76 115.91 2h0g s ALA 50 Ca 0.05 -0.44 0.02 0.00 0.00 0.00 0.00 51.96 51.59 2h0g s ALA 50 Cb -0.02 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.19 2h0g s ALA 50 CO -0.01 -0.08 -0.20 0.42 0.00 0.00 0.00 175.76 175.88 2h0g s ILE 51 N -0.99 2.16 -0.37 0.00 1.01 0.90 -4.93 121.20 118.98 2h0g s ILE 51 Ca -0.10 -0.94 -0.17 0.00 0.00 0.00 0.00 60.65 59.44 2h0g s ILE 51 Cb -0.07 -1.88 -0.00 0.00 0.01 0.00 0.00 42.46 40.52 2h0g s ILE 51 CO -0.01 0.54 0.45 -0.55 0.00 0.00 0.00 174.94 175.38 2h0g s SER 52 N 0.96 6.25 0.00 3.58 0.15 -1.26 -0.50 113.70 122.87 2h0g s SER 52 Ca -0.03 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.38 2h0g s SER 52 Cb -0.15 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2h0g s SER 52 CO -0.05 -0.47 0.00 0.61 1.20 0.00 0.00 173.24 174.54 2h0g n GLY 53 N 4.92 -0.63 3.29 9.45 0.00 -0.86 -5.04 105.19 116.32 2h0g n GLY 53 Ca -0.07 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 2h0g n GLY 53 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2h0g s TYR 54 N -3.51 2.54 -0.19 1.61 1.51 -1.26 -4.23 117.35 113.82 2h0g s TYR 54 Ca 0.00 -0.73 -0.08 0.00 -1.01 0.00 0.00 57.07 55.25 2h0g s TYR 54 Cb 0.00 -1.66 -0.04 0.00 -0.11 0.00 0.00 41.96 40.15 2h0g s TYR 54 CO 0.00 -0.22 0.09 1.41 -1.11 0.00 0.00 175.55 175.72 2h0g s MET 55 N -0.04 4.06 0.10 -0.62 1.75 -1.26 -4.98 119.30 118.31 2h0g s MET 55 Ca -0.06 -0.29 0.08 0.00 -1.25 0.00 0.00 55.69 54.17 2h0g s MET 55 Cb -0.15 -3.29 -0.04 0.00 2.84 0.00 0.00 34.83 34.19 2h0g s MET 55 CO 0.05 0.29 -0.17 0.71 -0.65 0.00 0.00 175.02 175.24 2h0g s TYR 56 N 0.35 2.56 0.52 4.11 1.51 -1.26 -0.27 117.35 124.88 2h0g s TYR 56 Ca 0.05 -0.25 0.09 0.00 -1.01 0.00 0.00 57.07 55.95 2h0g s TYR 56 Cb -0.12 -1.38 0.09 0.00 -0.11 0.00 0.00 41.96 40.44 2h0g s TYR 56 CO -0.01 0.37 0.72 0.27 -1.11 0.00 0.00 175.55 175.79 2h0g n ASN 57 N 0.92 1.88 0.20 2.29 0.23 -0.81 -4.92 115.26 115.05 2h0g n ASN 57 Ca -0.15 -2.37 0.06 0.00 -0.53 0.00 0.00 54.58 51.59 2h0g n ASN 57 Cb 0.53 -0.38 0.55 0.00 -2.08 0.00 0.00 39.78 38.40 2h0g n ASN 57 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2h0g h GLU 58 N 0.00 0.09 -0.03 -3.83 5.08 -2.01 -1.88 114.58 112.00 2h0g h GLU 58 Ca -0.24 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2h0g h GLU 58 Cb 1.12 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2h0g h GLU 58 CO 0.35 0.13 0.00 1.63 -1.00 0.00 0.00 179.01 180.11 2h0g n LYS 59 N -4.45 1.14 -0.66 2.33 5.02 -1.26 -4.88 118.16 115.39 2h0g n LYS 59 Ca -0.02 -0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 2h0g n LYS 59 Cb 0.14 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 2h0g n LYS 59 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2h0g n GLY 60 N 0.83 0.74 3.72 0.72 0.00 -0.71 -5.04 105.19 105.45 2h0g n GLY 60 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2h0g n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2h0g s GLU 61 N -0.34 4.53 -1.12 1.61 2.12 -1.26 -4.81 118.70 119.43 2h0g s GLU 61 Ca 0.00 1.58 -0.21 0.00 0.36 0.00 0.00 54.97 56.70 2h0g s GLU 61 Cb 0.00 -3.39 0.06 0.00 0.26 0.00 0.00 34.13 31.06 2h0g s GLU 61 CO 0.00 -0.08 1.55 1.21 -0.54 0.00 0.00 175.26 177.40 2h0g s ASN 62 N 0.80 6.64 0.36 -1.70 3.84 -1.26 -1.92 114.94 121.69 2h0g s ASN 62 Ca 0.54 -1.87 0.12 0.00 0.21 0.00 0.00 52.86 51.86 2h0g s ASN 62 Cb -0.25 -2.57 0.93 0.00 -0.55 0.00 0.00 41.25 38.81 2h0g s ASN 62 CO 0.29 -1.36 1.79 -0.07 -2.79 0.00 0.00 177.10 174.97 2h0g h LEU 63 N 12.59 0.60 -0.38 3.21 3.38 -0.99 -0.95 115.31 132.77 2h0g h LEU 63 Ca 0.29 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.35 2h0g h LEU 63 Cb 0.96 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2h0g h LEU 63 CO 1.43 0.19 0.23 0.28 0.09 0.00 0.00 178.44 180.66 2h0g h SER 64 N 0.57 0.45 -0.02 -0.43 0.02 -1.87 -0.79 113.55 111.48 2h0g h SER 64 Ca 0.56 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.48 2h0g h SER 64 Cb 1.14 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 2h0g h SER 64 CO -0.32 0.36 -0.03 0.78 -1.14 0.00 0.00 176.83 176.48 2h0g h ASN 65 N 0.50 -0.09 -0.40 3.07 2.35 -1.51 -0.35 115.58 119.15 2h0g h ASN 65 Ca 0.14 0.02 0.07 0.00 -0.55 0.00 0.00 56.30 55.97 2h0g h ASN 65 Cb -0.01 0.04 -0.06 0.00 0.05 0.00 0.00 38.32 38.34 2h0g h ASN 65 CO -0.03 -0.04 0.05 0.74 -1.65 0.00 0.00 177.43 176.51 2h0g h THR 66 N -0.04 0.76 -0.18 2.81 2.02 -1.18 0.43 112.91 117.53 2h0g h THR 66 Ca 0.02 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 2h0g h THR 66 Cb 0.07 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2h0g h THR 66 CO -0.05 0.03 0.08 0.25 0.37 0.00 0.00 175.52 176.21 2h0g h LEU 67 N 0.17 0.24 -1.30 2.58 5.85 -0.96 -0.72 115.31 121.17 2h0g h LEU 67 Ca 0.20 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2h0g h LEU 67 Cb 0.26 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 2h0g h LEU 67 CO -0.28 0.30 0.31 0.40 -0.34 0.00 0.00 178.44 178.82 2h0g h ILE 68 N 0.15 1.18 0.05 4.05 2.04 -0.55 0.23 117.51 124.66 2h0g h ILE 68 Ca 0.06 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 2h0g h ILE 68 Cb 0.13 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2h0g h ILE 68 CO -0.01 0.20 -0.02 -0.33 0.00 0.00 0.00 178.15 177.99 2h0g h GLU 69 N 0.80 -0.06 -0.48 2.37 5.08 0.14 -1.60 114.58 120.82 2h0g h GLU 69 Ca 0.20 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.48 2h0g h GLU 69 Cb 0.03 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2h0g h GLU 69 CO -0.03 0.41 -0.06 -0.22 -1.00 0.00 0.00 179.01 178.12 2h0g h LYS 70 N -0.56 0.89 0.17 2.33 3.64 -0.95 1.49 116.57 123.57 2h0g h LYS 70 Ca -0.01 -0.31 -0.31 0.00 -1.27 0.00 0.00 60.65 58.75 2h0g h LYS 70 Cb 0.50 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.27 2h0g h LYS 70 CO 0.01 0.95 -1.44 0.93 -2.27 0.00 0.00 179.45 177.63 2h0g h GLU 71 N 0.74 0.36 0.00 1.90 4.39 -0.64 -3.36 114.58 117.96 2h0g h GLU 71 Ca 0.13 -0.61 -0.39 0.00 0.34 0.00 0.00 59.36 58.83 2h0g h GLU 71 Cb 0.59 0.23 -0.06 0.00 -0.10 0.00 0.00 28.75 29.40 2h0g h GLU 71 CO 0.04 1.27 -2.39 -0.89 -1.16 0.00 0.00 179.01 175.88 2h0g n ILE 72 N -3.57 1.38 -0.09 3.13 5.41 -0.62 -4.82 119.36 120.19 2h0g n ILE 72 Ca -0.15 -0.43 -0.23 0.00 1.00 0.00 0.00 62.75 62.94 2h0g n ILE 72 Cb 1.06 -1.60 -0.12 0.00 -0.71 0.00 0.00 39.64 38.27 2h0g n ILE 72 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2h0g n TYR 73 N -3.68 0.73 -0.14 1.39 0.53 -0.77 -4.67 117.16 110.54 2h0g n TYR 73 Ca -0.46 0.25 -0.10 0.00 -1.02 0.00 0.00 57.90 56.56 2h0g n TYR 73 Cb 0.90 -1.08 -0.05 0.00 -1.03 0.00 0.00 39.34 38.08 2h0g n TYR 73 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2h0g h ALA 74 N -0.41 -0.44 -0.78 -0.72 0.00 0.19 -3.08 119.26 114.01 2h0g h ALA 74 Ca -0.48 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2h0g h ALA 74 Cb 1.63 0.92 0.00 0.00 0.00 0.00 0.00 17.79 20.34 2h0g h ALA 74 CO -0.17 -0.87 0.00 -2.30 0.00 0.00 0.00 179.25 175.90 2h0g n PRO 75 N -5.41 0.00 0.17 0.00 -0.02 -1.26 0.17 135.00 128.65 2h0g n PRO 75 Ca -0.00 0.66 0.18 0.00 -2.02 0.00 0.00 63.50 62.31 2h0g n PRO 75 Cb 0.35 -1.06 0.80 0.00 -0.02 0.00 0.00 33.50 33.57 2h0g n PRO 75 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2h0g h ALA 76 N -1.05 1.93 0.59 3.55 0.00 -1.87 -2.18 119.26 120.22 2h0g h ALA 76 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2h0g h ALA 76 Cb 0.00 0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2h0g h ALA 76 CO 0.00 -0.39 -0.28 0.78 0.00 0.00 0.00 179.25 179.35 2h0g h GLY 77 N 0.00 -0.83 0.70 0.00 0.00 -0.18 -0.36 103.07 102.39 2h0g h GLY 77 Ca 0.12 0.31 0.14 0.00 0.00 0.00 0.00 47.33 47.90 2h0g h GLY 77 CO -0.00 -0.30 0.51 3.21 0.00 0.00 0.00 176.54 179.96 2h0g h ARG 78 N -0.89 0.46 0.39 4.80 3.08 -0.91 -1.26 114.38 120.05 2h0g h ARG 78 Ca -0.08 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 2h0g h ARG 78 Cb 0.61 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2h0g h ARG 78 CO 0.13 0.30 -0.19 1.49 -1.07 0.00 0.00 179.97 180.63 2h0g h GLU 79 N 0.47 -0.51 -0.64 0.04 4.57 -1.20 -2.02 114.58 115.28 2h0g h GLU 79 Ca 0.37 0.04 0.11 0.00 -1.18 0.00 0.00 59.36 58.70 2h0g h GLU 79 Cb 0.78 0.12 -0.08 0.00 -0.16 0.00 0.00 28.75 29.41 2h0g h GLU 79 CO -0.13 -0.34 0.21 0.52 -1.18 0.00 0.00 179.01 178.09 2h0g h MET 80 N -0.53 0.35 -0.07 1.92 2.86 -0.84 -0.94 114.93 117.67 2h0g h MET 80 Ca -0.05 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.59 2h0g h MET 80 Cb 0.41 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 2h0g h MET 80 CO 0.09 0.23 0.09 2.35 1.06 0.00 0.00 176.91 180.73 2h0g h TRP 81 N 0.36 0.00 0.00 -0.22 2.91 -1.18 -0.14 115.95 117.68 2h0g h TRP 81 Ca 0.34 0.00 -0.17 0.00 1.13 0.00 0.00 58.89 60.19 2h0g h TRP 81 Cb 0.47 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 29.10 2h0g h TRP 81 CO -0.20 0.00 -1.41 0.94 -1.03 0.00 0.00 178.44 176.74 2h0g n GLN 82 N -3.73 0.62 -0.07 2.65 -0.06 -0.43 -3.13 117.38 113.23 2h0g n GLN 82 Ca -0.01 0.23 -0.12 0.00 -2.00 0.00 0.00 57.00 55.09 2h0g n GLN 82 Cb 0.19 -1.81 -0.05 0.00 -4.06 0.00 0.00 30.24 24.50 2h0g n GLN 82 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2h0g h ARG 83 N 0.00 0.41 0.00 3.69 2.47 -0.31 -1.50 114.38 119.14 2h0g h ARG 83 Ca -0.16 -0.17 -0.01 0.00 -1.26 0.00 0.00 59.98 58.37 2h0g h ARG 83 Cb 1.59 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 29.89 2h0g h ARG 83 CO 0.05 0.68 -0.07 0.52 0.56 0.00 0.00 179.97 181.70 2h0g h MET 84 N 0.12 0.00 0.00 0.04 2.86 -1.43 0.30 114.93 116.83 2h0g h MET 84 Ca 0.05 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.65 2h0g h MET 84 Cb 0.54 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 2h0g h MET 84 CO 0.02 0.07 -0.21 1.49 1.06 0.00 0.00 176.91 179.34 2h0g h GLU 85 N 0.00 0.00 0.00 1.72 4.22 -1.44 -3.16 114.58 115.91 2h0g h GLU 85 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2h0g h GLU 85 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2h0g h GLU 85 CO 0.01 0.21 -0.96 1.04 -2.18 0.00 0.00 179.01 177.13 2h0g n GLN 86 N -3.17 0.48 -2.63 1.92 6.02 0.79 -4.92 117.38 115.88 2h0g n GLN 86 Ca 0.03 0.08 -0.31 0.00 -0.01 0.00 0.00 57.00 56.79 2h0g n GLN 86 Cb 0.59 -1.74 -0.03 0.00 1.02 0.00 0.00 30.24 30.07 2h0g n GLN 86 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2h0g s SER 87 N -4.83 6.56 -0.89 1.08 0.01 0.40 -4.96 113.70 111.07 2h0g s SER 87 Ca 0.01 1.34 -0.25 0.00 1.31 0.00 0.00 55.95 58.37 2h0g s SER 87 Cb 0.11 -2.41 -0.04 0.00 0.21 0.00 0.00 66.02 63.89 2h0g s SER 87 CO 0.78 -0.49 1.91 -1.00 0.41 0.00 0.00 173.24 174.85 2h0g s HIS 88 N -2.50 1.84 0.26 2.43 3.76 -1.26 -4.96 115.29 114.87 2h0g s HIS 88 Ca 0.55 0.55 0.05 0.00 -0.15 0.00 0.00 55.06 56.07 2h0g s HIS 88 Cb -0.10 -4.09 -0.02 0.00 1.11 0.00 0.00 32.58 29.48 2h0g s HIS 88 CO 0.32 -1.79 0.38 1.67 -0.85 0.00 0.00 174.74 174.47 2h0g s TRP 89 N 9.73 3.35 -0.14 1.40 1.48 -1.26 -4.71 118.94 128.79 2h0g s TRP 89 Ca 0.68 -0.07 -0.05 0.00 -1.06 0.00 0.00 56.10 55.60 2h0g s TRP 89 Cb -0.07 -1.68 -0.04 0.00 -1.16 0.00 0.00 33.47 30.53 2h0g s TRP 89 CO -0.00 0.33 0.05 -0.51 -4.06 0.00 0.00 176.95 172.75 2h0g s LEU 90 N -4.03 3.80 0.34 -4.66 1.43 -0.72 -4.85 118.68 109.99 2h0g s LEU 90 Ca 0.37 0.15 -0.24 0.00 -1.03 0.00 0.00 54.13 53.38 2h0g s LEU 90 Cb -0.09 -1.92 -0.10 0.00 0.03 0.00 0.00 46.19 44.10 2h0g s LEU 90 CO 0.29 0.27 0.93 -0.22 0.23 0.00 0.00 176.35 177.85 2h0g s LEU 91 N -0.24 4.25 -0.36 1.79 2.96 -1.26 -1.73 118.68 124.09 2h0g s LEU 91 Ca 0.08 1.76 0.01 0.00 -0.22 0.00 0.00 54.13 55.76 2h0g s LEU 91 Cb -0.12 -4.09 0.14 0.00 0.50 0.00 0.00 46.19 42.62 2h0g s LEU 91 CO 0.02 -0.12 0.23 -0.62 -1.32 0.00 0.00 176.35 174.54 2h0g s ASP 92 N -1.75 2.69 0.00 3.68 -1.08 -0.45 -4.84 116.67 114.92 2h0g s ASP 92 Ca 0.52 -2.31 0.00 0.00 -0.52 0.00 0.00 52.55 50.24 2h0g s ASP 92 Cb -0.16 -0.38 0.00 0.00 -1.46 0.00 0.00 42.92 40.91 2h0g s ASP 92 CO 0.21 -0.29 0.00 0.61 0.52 0.00 0.00 175.17 176.22 2h0g n GLY 93 N 3.86 0.57 3.76 2.66 0.00 -1.26 -2.35 105.19 112.43 2h0g n GLY 93 Ca 0.15 -2.24 -0.38 0.00 0.00 0.00 0.00 46.02 43.54 2h0g n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h0g s LYS 94 N -0.62 3.68 0.00 1.61 -0.14 -1.26 -4.91 119.74 118.10 2h0g s LYS 94 Ca 0.00 2.00 0.22 0.00 -1.36 0.00 0.00 55.97 56.82 2h0g s LYS 94 Cb 0.00 -2.48 0.84 0.00 -1.68 0.00 0.00 37.83 34.51 2h0g s LYS 94 CO 0.00 -0.68 1.60 1.17 -0.76 0.00 0.00 175.35 176.68 2h0g n LYS 95 N -0.42 1.65 -0.36 1.68 4.81 -1.26 -3.25 118.16 121.02 2h0g n LYS 95 Ca 0.07 -0.97 0.07 0.00 -0.87 0.00 0.00 58.31 56.62 2h0g n LYS 95 Cb 0.46 -1.40 0.23 0.00 0.02 0.00 0.00 35.03 34.34 2h0g n LYS 95 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2h0g n ASP 96 N 0.19 3.60 -4.71 3.14 5.75 -1.26 -4.98 116.55 118.27 2h0g n ASP 96 Ca 0.16 -2.52 -0.42 0.00 -0.01 0.00 0.00 54.79 52.00 2h0g n ASP 96 Cb 0.31 -0.42 -0.03 0.00 -1.03 0.00 0.00 41.12 39.95 2h0g n ASP 96 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2h0g s ALA 97 N -1.94 3.53 0.29 2.12 0.00 -1.20 -4.94 121.76 119.62 2h0g s ALA 97 Ca 0.35 1.02 -0.01 0.00 0.00 0.00 0.00 51.96 53.32 2h0g s ALA 97 Cb 0.25 -3.51 0.47 0.00 0.00 0.00 0.00 23.12 20.33 2h0g s ALA 97 CO 0.14 -0.58 1.91 -1.00 0.00 0.00 0.00 175.76 176.23 2h0g h PRO 98 N 6.87 1.07 -5.61 0.00 0.13 -1.78 -3.42 132.00 129.26 2h0g h PRO 98 Ca -0.42 -0.06 -0.60 0.00 -0.87 0.00 0.00 66.00 64.05 2h0g h PRO 98 Cb 1.21 -0.24 -0.10 0.00 0.13 0.00 0.00 31.00 32.00 2h0g h PRO 98 CO 0.85 0.71 0.14 0.08 -0.23 0.00 0.00 178.00 179.54 2h0g s VAL 99 N -5.95 5.01 -0.13 1.56 1.01 -1.03 -5.05 120.40 115.82 2h0g s VAL 99 Ca -0.12 1.17 -0.02 0.00 0.00 0.00 0.00 61.98 63.01 2h0g s VAL 99 Cb 0.20 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 2h0g s VAL 99 CO 0.80 0.08 -0.05 -0.63 0.00 0.00 0.00 175.10 175.31 2h0g s ILE 100 N 2.12 3.81 -0.00 2.22 1.01 -1.26 -1.96 121.20 127.13 2h0g s ILE 100 Ca 0.28 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.53 2h0g s ILE 100 Cb -0.16 -2.64 0.00 0.00 0.01 0.00 0.00 42.46 39.68 2h0g s ILE 100 CO 0.10 0.52 -0.02 -0.69 0.00 0.00 0.00 174.94 174.85 2h0g s VAL 101 N 0.04 0.17 -0.05 2.92 1.01 -0.97 -4.58 120.40 118.93 2h0g s VAL 101 Ca -0.00 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 61.94 2h0g s VAL 101 Cb -0.13 -0.16 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 2h0g s VAL 101 CO 0.03 0.06 -0.14 -0.31 0.00 0.00 0.00 175.10 174.73 2h0g s TYR 102 N 0.05 2.70 -0.00 5.22 1.51 -0.21 0.16 117.35 126.78 2h0g s TYR 102 Ca -0.00 -0.16 0.02 0.00 -1.01 0.00 0.00 57.07 55.92 2h0g s TYR 102 Cb -0.02 -1.63 -0.01 0.00 -0.11 0.00 0.00 41.96 40.19 2h0g s TYR 102 CO -0.00 0.19 -0.06 0.14 -1.11 0.00 0.00 175.55 174.71 2h0g s VAL 103 N -0.73 0.45 -0.19 0.71 -7.23 -0.59 0.39 120.40 113.21 2h0g s VAL 103 Ca 0.11 -0.29 -0.12 0.00 -1.81 0.00 0.00 61.98 59.87 2h0g s VAL 103 Cb -0.11 -0.39 -0.05 0.00 0.56 0.00 0.00 36.38 36.40 2h0g s VAL 103 CO 0.00 0.10 0.24 -0.36 -0.31 0.00 0.00 175.10 174.77 2h0g s PHE 104 N -0.20 3.42 0.05 2.82 0.40 -0.89 -0.51 117.98 123.07 2h0g s PHE 104 Ca 0.01 0.47 -0.01 0.00 -0.60 0.00 0.00 56.93 56.80 2h0g s PHE 104 Cb -0.03 -2.30 -0.04 0.00 0.51 0.00 0.00 43.02 41.17 2h0g s PHE 104 CO -0.00 0.20 -0.03 0.00 0.70 0.00 0.00 175.22 176.09 2h0g s ALA 105 N 0.60 0.52 0.02 5.36 0.00 -1.23 -3.08 121.76 123.94 2h0g s ALA 105 Ca 0.13 -1.21 0.02 0.00 0.00 0.00 0.00 51.96 50.90 2h0g s ALA 105 Cb -0.13 0.27 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 2h0g s ALA 105 CO 0.03 -0.37 -0.08 0.34 0.00 0.00 0.00 175.76 175.68 2h0g s ASP 106 N -2.92 0.92 0.39 0.00 -1.08 -1.26 -1.93 116.67 110.79 2h0g s ASP 106 Ca 0.07 -0.29 0.24 0.00 -0.52 0.00 0.00 52.55 52.05 2h0g s ASP 106 Cb 0.08 -0.05 1.36 0.00 -1.46 0.00 0.00 42.92 42.85 2h0g s ASP 106 CO -0.10 -0.01 1.60 -0.65 0.52 0.00 0.00 175.17 176.53 2h0g h PRO 107 N 5.39 0.06 -1.87 4.34 0.11 -1.85 -2.20 132.00 135.98 2h0g h PRO 107 Ca -0.32 -0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.13 2h0g h PRO 107 Cb 1.19 -0.01 -0.37 0.00 0.11 0.00 0.00 31.00 31.92 2h0g h PRO 107 CO 0.46 0.04 -0.13 1.19 -0.21 0.00 0.00 178.00 179.35 2h0g n PHE 108 N -5.01 3.40 -4.01 0.65 3.01 -1.26 -4.90 117.46 109.33 2h0g n PHE 108 Ca 0.38 -3.08 -0.31 0.00 1.01 0.00 0.00 57.45 55.45 2h0g n PHE 108 Cb 1.34 -0.53 -0.15 0.00 -0.01 0.00 0.00 39.48 40.13 2h0g n PHE 108 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2h0g h PRO 110 N 7.68 0.63 0.00 0.00 0.11 -1.91 -1.43 132.00 137.08 2h0g h PRO 110 Ca -0.08 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.97 2h0g h PRO 110 Cb 1.02 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 2h0g h PRO 110 CO 0.50 0.42 -0.13 1.88 -0.21 0.00 0.00 178.00 180.46 2h0g h TYR 111 N 0.65 0.00 -0.33 0.65 0.05 -1.95 -2.66 116.97 113.38 2h0g h TYR 111 Ca 0.48 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 59.22 2h0g h TYR 111 Cb 0.70 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.42 2h0g h TYR 111 CO -0.08 0.13 0.03 0.00 -1.05 0.00 0.00 178.16 177.19 2h0g h LYS 113 N 0.38 1.05 -0.20 0.00 1.57 -1.41 -1.00 116.57 116.96 2h0g h LYS 113 Ca 0.10 -0.29 -0.10 0.00 -1.87 0.00 0.00 60.65 58.49 2h0g h LYS 113 Cb 0.39 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2h0g h LYS 113 CO 0.01 0.99 -0.30 1.96 -0.57 0.00 0.00 179.45 181.53 2h0g h GLN 114 N 0.96 0.40 -0.13 3.15 4.20 -1.37 -2.05 115.11 120.26 2h0g h GLN 114 Ca 0.19 -0.16 -0.19 0.00 0.06 0.00 0.00 58.65 58.55 2h0g h GLN 114 Cb 0.46 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 2h0g h GLN 114 CO 0.02 0.67 -0.68 0.35 -0.67 0.00 0.00 178.83 178.51 2h0g h PHE 115 N 0.35 0.73 -0.85 2.96 3.57 -0.94 -2.04 116.94 120.72 2h0g h PHE 115 Ca 0.05 -0.30 0.07 0.00 3.53 0.00 0.00 57.97 61.31 2h0g h PHE 115 Cb 0.71 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.28 2h0g h PHE 115 CO 0.02 1.07 0.55 2.35 -2.23 0.00 0.00 178.31 180.07 2h0g h TRP 116 N 0.39 0.95 -0.24 0.41 7.01 -0.87 -1.94 115.95 121.66 2h0g h TRP 116 Ca -0.02 0.02 -0.19 0.00 2.11 0.00 0.00 58.89 60.81 2h0g h TRP 116 Cb 1.26 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 28.01 2h0g h TRP 116 CO 0.06 0.50 -0.59 0.37 -2.79 0.00 0.00 178.44 175.98 2h0g h GLN 117 N 0.93 0.80 -0.40 2.65 5.75 -1.08 -3.17 115.11 120.59 2h0g h GLN 117 Ca 0.37 -0.54 -0.00 0.00 -0.15 0.00 0.00 58.65 58.33 2h0g h GLN 117 Cb 0.23 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 2h0g h GLN 117 CO -0.13 1.16 0.24 1.96 -2.65 0.00 0.00 178.83 179.41 2h0g h GLN 118 N 0.60 0.54 0.00 1.69 4.20 -0.64 -2.72 115.11 118.78 2h0g h GLN 118 Ca 0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 2h0g h GLN 118 Cb 1.20 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.86 2h0g h GLN 118 CO 0.13 0.38 0.00 0.00 -0.67 0.00 0.00 178.83 178.66 2h0g h ALA 119 N 1.72 1.00 -0.82 3.87 0.00 -1.43 -3.38 119.26 120.22 2h0g h ALA 119 Ca 0.15 0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.24 2h0g h ALA 119 Cb -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.62 2h0g h ALA 119 CO -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 179.25 179.15 2h0g h ARG 120 N 0.00 0.04 -0.84 0.00 2.47 -1.53 -0.51 114.38 114.01 2h0g h ARG 120 Ca 0.00 -0.00 0.14 0.00 -1.26 0.00 0.00 59.98 58.86 2h0g h ARG 120 Cb 0.70 -0.01 -0.09 0.00 -1.65 0.00 0.00 29.97 28.92 2h0g h ARG 120 CO 0.00 0.03 0.43 -1.35 0.56 0.00 0.00 179.97 179.64 2h0g h PRO 121 N 0.05 0.60 0.12 0.04 0.11 -1.82 -0.37 132.00 130.72 2h0g h PRO 121 Ca 0.44 -0.04 -0.30 0.00 0.11 0.00 0.00 66.00 66.22 2h0g h PRO 121 Cb 0.77 -0.13 0.03 0.00 0.11 0.00 0.00 31.00 31.77 2h0g h PRO 121 CO -0.78 0.39 -1.24 -1.49 -0.21 0.00 0.00 178.00 174.67 2h0g h TRP 122 N 0.61 0.94 -0.03 0.65 6.55 -1.45 -3.18 115.95 120.04 2h0g h TRP 122 Ca 0.46 -0.60 -0.15 0.00 0.95 0.00 0.00 58.89 59.55 2h0g h TRP 122 Cb 0.64 -0.07 -0.01 0.00 -0.86 0.00 0.00 29.16 28.86 2h0g h TRP 122 CO -0.10 1.44 -0.66 0.28 -1.05 0.00 0.00 178.44 178.36 2h0g h VAL 123 N 0.25 1.43 -0.01 1.49 2.07 -0.94 -1.40 116.25 119.14 2h0g h VAL 123 Ca -0.18 -2.17 0.00 0.00 0.82 0.00 0.00 66.70 65.17 2h0g h VAL 123 Cb 1.92 2.14 0.00 0.00 -1.52 0.00 0.00 31.29 33.83 2h0g h VAL 123 CO 0.23 0.63 -0.03 0.47 0.02 0.00 0.00 177.57 178.89 2h0g n ASP 124 N -3.80 1.03 -0.30 0.57 8.00 -0.17 -3.31 116.55 118.57 2h0g n ASP 124 Ca -0.02 -1.24 0.03 0.00 0.71 0.00 0.00 54.79 54.26 2h0g n ASP 124 Cb 0.65 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.82 2h0g n ASP 124 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2h0g n SER 125 N -0.26 2.28 0.00 -2.24 3.41 -1.20 -4.98 113.62 110.63 2h0g n SER 125 Ca 0.19 -1.87 0.00 0.00 -0.26 0.00 0.00 58.87 56.93 2h0g n SER 125 Cb 0.29 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 2h0g n SER 125 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2h0g n GLY 126 N 0.05 0.58 0.16 5.00 0.00 -1.19 -4.92 105.19 104.88 2h0g n GLY 126 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 2h0g n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h0g h LYS 127 N 1.52 0.52 -5.26 1.61 1.57 -1.55 -3.40 116.57 111.58 2h0g h LYS 127 Ca 0.00 -0.66 -0.39 0.00 -1.87 0.00 0.00 60.65 57.73 2h0g h LYS 127 Cb 0.11 0.21 -0.20 0.00 0.08 0.00 0.00 32.23 32.43 2h0g h LYS 127 CO 0.00 1.27 -0.77 0.08 -0.57 0.00 0.00 179.45 179.47 2h0g s VAL 128 N -3.05 1.09 -0.09 0.50 1.01 -0.82 -2.45 120.40 116.59 2h0g s VAL 128 Ca -0.08 -1.40 -0.00 0.00 0.00 0.00 0.00 61.98 60.50 2h0g s VAL 128 Cb 0.07 -1.16 0.02 0.00 0.00 0.00 0.00 36.38 35.32 2h0g s VAL 128 CO 0.91 -0.31 -0.04 0.00 0.00 0.00 0.00 175.10 175.65 2h0g s GLN 129 N -2.02 1.09 0.10 2.72 -2.07 -0.83 -3.98 119.66 114.68 2h0g s GLN 129 Ca 0.00 -0.10 -0.14 0.00 -1.82 0.00 0.00 55.36 53.30 2h0g s GLN 129 Cb -0.08 -1.25 -0.06 0.00 -1.09 0.00 0.00 33.01 30.53 2h0g s GLN 129 CO 0.02 -0.24 0.49 -0.51 -1.32 0.00 0.00 175.29 173.73 2h0g s LEU 130 N 1.66 4.38 -0.24 2.60 1.43 -0.99 -2.30 118.68 125.22 2h0g s LEU 130 Ca 0.02 1.01 0.01 0.00 -1.03 0.00 0.00 54.13 54.14 2h0g s LEU 130 Cb -0.13 -3.06 0.06 0.00 0.03 0.00 0.00 46.19 43.10 2h0g s LEU 130 CO -0.05 0.17 -0.05 -0.13 0.23 0.00 0.00 176.35 176.52 2h0g s ARG 131 N -1.73 1.66 -0.18 1.70 0.52 0.12 -1.35 118.95 119.71 2h0g s ARG 131 Ca 0.34 -1.07 -0.21 0.00 -0.52 0.00 0.00 55.73 54.26 2h0g s ARG 131 Cb -0.15 -2.63 -0.03 0.00 0.52 0.00 0.00 34.95 32.66 2h0g s ARG 131 CO 0.18 -0.62 0.65 0.99 0.02 0.00 0.00 175.30 176.51 2h0g s THR 132 N 1.35 5.02 -0.81 0.02 2.01 -0.70 -1.55 115.64 120.97 2h0g s THR 132 Ca -0.05 1.24 -0.13 0.00 0.31 0.00 0.00 61.69 63.06 2h0g s THR 132 Cb -0.19 -3.96 0.21 0.00 0.01 0.00 0.00 72.50 68.57 2h0g s THR 132 CO -0.07 0.13 0.74 -0.76 -0.69 0.00 0.00 174.62 173.98 2h0g s LEU 133 N 1.73 6.62 0.47 4.42 1.43 0.33 -1.75 118.68 131.93 2h0g s LEU 133 Ca 0.30 -2.72 -0.24 0.00 -1.03 0.00 0.00 54.13 50.44 2h0g s LEU 133 Cb -0.16 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.81 2h0g s LEU 133 CO 0.11 -0.55 1.32 -0.76 0.23 0.00 0.00 176.35 176.70 2h0g s LEU 134 N 0.12 4.05 0.31 1.79 1.43 -1.26 -3.54 118.68 121.57 2h0g s LEU 134 Ca 0.18 2.67 0.05 0.00 -1.03 0.00 0.00 54.13 56.00 2h0g s LEU 134 Cb -0.11 -4.08 -0.03 0.00 0.03 0.00 0.00 46.19 42.00 2h0g s LEU 134 CO -0.08 -1.14 0.28 0.68 0.23 0.00 0.00 176.35 176.32 2h0g s VAL 135 N -1.32 0.00 -0.44 -1.59 -7.23 -0.81 -4.66 120.40 104.35 2h0g s VAL 135 Ca 0.63 -1.95 0.07 0.00 -1.81 0.00 0.00 61.98 58.92 2h0g s VAL 135 Cb -0.38 -2.51 0.25 0.00 0.56 0.00 0.00 36.38 34.30 2h0g s VAL 135 CO 0.47 0.00 0.71 0.61 -0.31 0.00 0.00 175.10 176.58 2h0g n GLY 136 N -0.56 1.45 0.11 2.32 0.00 -1.26 -4.36 105.19 102.90 2h0g n GLY 136 Ca 0.06 -0.71 -0.08 0.00 0.00 0.00 0.00 46.02 45.29 2h0g n GLY 136 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2h0g n VAL 137 N 1.50 0.60 -0.15 1.61 0.24 -1.26 -3.89 118.33 116.97 2h0g n VAL 137 Ca 0.15 -0.22 -0.04 0.00 -2.04 0.00 0.00 64.34 62.19 2h0g n VAL 137 Cb 0.58 -0.94 0.02 0.00 -1.47 0.00 0.00 33.84 32.03 2h0g n VAL 137 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2h0g h ILE 138 N -0.04 0.41 -2.05 1.34 1.08 -1.95 -3.45 117.51 112.85 2h0g h ILE 138 Ca -0.24 0.00 -0.58 0.00 -0.39 0.00 0.00 64.86 63.65 2h0g h ILE 138 Cb 1.35 0.41 -0.13 0.00 -3.07 0.00 0.00 36.82 35.37 2h0g h ILE 138 CO -0.05 0.00 -0.62 -0.54 -0.69 0.00 0.00 178.15 176.25 2h0g s LYS 139 N -6.16 1.84 0.07 2.37 -0.14 -1.26 -5.05 119.74 111.41 2h0g s LYS 139 Ca -0.14 -2.02 -0.20 0.00 -1.36 0.00 0.00 55.97 52.24 2h0g s LYS 139 Cb 0.16 -1.43 -0.11 0.00 -1.68 0.00 0.00 37.83 34.77 2h0g s LYS 139 CO 0.71 -0.05 1.52 -1.35 -0.76 0.00 0.00 175.35 175.42 2h0g h PRO 140 N 1.92 0.29 0.00 -1.68 0.11 -1.95 -2.73 132.00 127.97 2h0g h PRO 140 Ca -0.43 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2h0g h PRO 140 Cb 1.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2h0g h PRO 140 CO 0.76 0.48 0.00 0.39 -0.21 0.00 0.00 178.00 179.42 2h0g n GLU 141 N -4.76 0.54 -0.17 1.05 4.71 -1.26 -3.93 120.64 116.83 2h0g n GLU 141 Ca -0.05 0.02 0.02 0.00 -0.01 0.00 0.00 57.16 57.15 2h0g n GLU 141 Cb 0.20 -1.50 0.30 0.00 -1.01 0.00 0.00 31.44 29.43 2h0g n GLU 141 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 2h0g h SER 142 N 0.00 0.75 -0.09 1.62 0.02 -1.80 -0.34 113.55 113.71 2h0g h SER 142 Ca 0.00 -0.01 -0.20 0.00 -0.84 0.00 0.00 61.79 60.74 2h0g h SER 142 Cb 0.18 -0.18 0.01 0.00 0.14 0.00 0.00 62.40 62.55 2h0g h SER 142 CO 0.00 0.53 -0.71 -0.65 -1.14 0.00 0.00 176.83 174.86 2h0g h PRO 143 N 0.87 0.64 -0.14 3.45 0.11 -1.68 -1.64 132.00 133.61 2h0g h PRO 143 Ca 0.26 -0.57 -0.11 0.00 0.11 0.00 0.00 66.00 65.69 2h0g h PRO 143 Cb -0.03 0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 2h0g h PRO 143 CO -0.06 1.18 -0.41 0.00 -0.21 0.00 0.00 178.00 178.50 2h0g h ALA 144 N 0.46 1.05 -0.04 -0.75 0.00 -1.79 -0.60 119.26 117.60 2h0g h ALA 144 Ca -0.06 -0.42 -0.23 0.00 0.00 0.00 0.00 54.91 54.20 2h0g h ALA 144 Cb 1.36 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.06 2h0g h ALA 144 CO 0.14 0.60 -0.91 1.15 0.00 0.00 0.00 179.25 180.23 2h0g h THR 145 N 0.26 1.34 -0.08 0.00 2.02 -1.06 0.86 112.91 116.25 2h0g h THR 145 Ca 0.02 -2.27 -0.17 0.00 0.77 0.00 0.00 66.41 64.77 2h0g h THR 145 Cb 0.83 2.29 -0.01 0.00 -1.74 0.00 0.00 68.15 69.53 2h0g h THR 145 CO 0.07 0.69 -0.69 0.00 0.37 0.00 0.00 175.52 175.96 2h0g h ALA 146 N 0.64 0.67 -0.42 6.16 0.00 -1.23 -2.53 119.26 122.56 2h0g h ALA 146 Ca -0.08 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.22 2h0g h ALA 146 Cb 1.54 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 2h0g h ALA 146 CO 0.17 0.76 0.19 0.00 0.00 0.00 0.00 179.25 180.37 2h0g h ALA 147 N 1.02 0.54 -0.41 0.00 0.00 -0.98 -1.32 119.26 118.10 2h0g h ALA 147 Ca -0.02 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2h0g h ALA 147 Cb 1.24 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2h0g h ALA 147 CO 0.11 0.11 0.04 0.00 0.00 0.00 0.00 179.25 179.52 2h0g h ALA 148 N 1.04 1.31 0.00 0.00 0.00 -0.76 0.20 119.26 121.04 2h0g h ALA 148 Ca 0.14 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2h0g h ALA 148 Cb 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2h0g h ALA 148 CO -0.02 0.48 -0.40 0.82 0.00 0.00 0.00 179.25 180.13 2h0g h ILE 149 N 0.61 0.92 0.07 0.00 2.04 -1.10 -2.54 117.51 117.51 2h0g h ILE 149 Ca 0.13 -1.61 -0.29 0.00 1.00 0.00 0.00 64.86 64.09 2h0g h ILE 149 Cb 0.32 1.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 2h0g h ILE 149 CO 0.01 0.39 -1.50 -0.07 0.00 0.00 0.00 178.15 176.98 2h0g h LEU 150 N 0.00 0.22 -0.66 1.44 3.38 -0.58 -3.25 115.31 115.85 2h0g h LEU 150 Ca -0.00 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2h0g h LEU 150 Cb 0.95 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2h0g h LEU 150 CO 0.05 1.27 0.00 0.00 0.09 0.00 0.00 178.44 179.86 2h0g n ALA 151 N -2.60 1.68 -0.34 1.53 0.00 0.63 -4.80 120.51 116.62 2h0g n ALA 151 Ca -0.14 0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 2h0g n ALA 151 Cb 1.03 -1.39 0.27 0.00 0.00 0.00 0.00 19.45 19.36 2h0g n ALA 151 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2h0g n SER 152 N -2.23 -3.35 0.03 0.00 3.41 -0.97 -4.98 113.62 105.53 2h0g n SER 152 Ca 0.02 -0.61 -0.22 0.00 -0.26 0.00 0.00 58.87 57.81 2h0g n SER 152 Cb 0.24 -1.05 -0.14 0.00 -0.26 0.00 0.00 64.21 62.99 2h0g n SER 152 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2h0g h LYS 153 N -3.25 0.29 -2.67 4.33 3.64 -1.89 -3.38 116.57 113.64 2h0g h LYS 153 Ca -0.46 -0.49 -0.60 0.00 -1.27 0.00 0.00 60.65 57.82 2h0g h LYS 153 Cb 1.29 0.18 -0.41 0.00 -0.41 0.00 0.00 32.23 32.88 2h0g h LYS 153 CO 0.32 1.23 -0.73 -3.47 -2.27 0.00 0.00 179.45 174.53 2h0g n ASP 154 N -3.89 1.92 -0.33 4.20 -0.08 -1.26 -4.97 116.55 112.13 2h0g n ASP 154 Ca -0.23 -2.97 0.21 0.00 -1.51 0.00 0.00 54.79 50.30 2h0g n ASP 154 Cb 0.92 -0.68 0.44 0.00 2.34 0.00 0.00 41.12 44.14 2h0g n ASP 154 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2h0g h PRO 155 N 5.17 0.31 -0.65 -0.67 0.11 -1.77 0.36 132.00 134.86 2h0g h PRO 155 Ca 0.18 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 2h0g h PRO 155 Cb 0.79 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.80 2h0g h PRO 155 CO 0.62 0.21 0.32 0.00 -0.21 0.00 0.00 178.00 178.93 2h0g h ALA 156 N 1.83 0.84 -0.02 -0.75 0.00 -1.89 0.13 119.26 119.41 2h0g h ALA 156 Ca 0.70 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 55.32 2h0g h ALA 156 Cb 1.54 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2h0g h ALA 156 CO -0.61 0.40 -0.69 -0.22 0.00 0.00 0.00 179.25 178.13 2h0g h LYS 157 N 0.90 0.09 -0.56 0.00 3.64 -1.33 -1.88 116.57 117.44 2h0g h LYS 157 Ca 0.22 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 2h0g h LYS 157 Cb 0.11 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 2h0g h LYS 157 CO -0.03 0.74 0.01 1.15 -2.27 0.00 0.00 179.45 179.06 2h0g h THR 158 N 0.06 1.26 -0.54 1.00 2.02 -0.56 -0.47 112.91 115.69 2h0g h THR 158 Ca -0.01 -1.10 -0.11 0.00 0.77 0.00 0.00 66.41 65.96 2h0g h THR 158 Cb 1.23 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 2h0g h THR 158 CO 0.10 0.39 -0.09 -0.25 0.37 0.00 0.00 175.52 176.04 2h0g h TRP 159 N 0.86 1.10 -0.75 3.16 2.91 -0.64 0.27 115.95 122.86 2h0g h TRP 159 Ca 0.16 -0.22 -0.05 0.00 1.13 0.00 0.00 58.89 59.91 2h0g h TRP 159 Cb 0.52 -0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 28.86 2h0g h TRP 159 CO 0.04 1.02 0.26 1.96 -1.03 0.00 0.00 178.44 180.68 2h0g h GLN 160 N 0.89 1.15 -0.23 2.65 1.08 -1.06 0.60 115.11 120.18 2h0g h GLN 160 Ca 0.14 -0.23 -0.12 0.00 -1.45 0.00 0.00 58.65 57.00 2h0g h GLN 160 Cb 0.64 -0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 27.89 2h0g h GLN 160 CO 0.04 0.96 -0.31 1.96 -0.95 0.00 0.00 178.83 180.54 2h0g h GLN 161 N 1.11 0.62 -0.28 1.46 4.20 -0.78 -1.36 115.11 120.09 2h0g h GLN 161 Ca 0.25 -0.36 0.01 0.00 0.06 0.00 0.00 58.65 58.61 2h0g h GLN 161 Cb 0.27 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 2h0g h GLN 161 CO -0.01 0.96 0.17 -0.92 -0.67 0.00 0.00 178.83 178.36 2h0g h TYR 162 N 0.32 0.33 -0.12 2.96 3.20 -0.19 -1.30 116.97 122.17 2h0g h TYR 162 Ca 0.03 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 2h0g h TYR 162 Cb 0.88 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 2h0g h TYR 162 CO 0.08 0.20 0.05 0.93 -1.64 0.00 0.00 178.16 177.78 2h0g h GLU 163 N 0.36 0.18 0.00 1.82 4.39 -0.86 -1.68 114.58 118.78 2h0g h GLU 163 Ca 0.10 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.75 2h0g h GLU 163 Cb -0.03 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.59 2h0g h GLU 163 CO -0.03 0.28 -0.09 0.00 -1.16 0.00 0.00 179.01 178.01 2h0g h ALA 164 N 0.89 1.12 -0.01 3.43 0.00 -1.11 -2.60 119.26 120.99 2h0g h ALA 164 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2h0g h ALA 164 Cb 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2h0g h ALA 164 CO -0.00 0.11 -0.19 -1.13 0.00 0.00 0.00 179.25 178.03 2h0g n SER 165 N -3.37 1.15 -0.58 0.00 3.41 -0.50 -4.93 113.62 108.80 2h0g n SER 165 Ca -0.01 -1.05 -0.06 0.00 -0.26 0.00 0.00 58.87 57.49 2h0g n SER 165 Cb 0.26 0.10 -0.02 0.00 -0.26 0.00 0.00 64.21 64.29 2h0g n SER 165 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2h0g n GLY 166 N 1.30 0.58 1.77 5.00 0.00 -0.98 -2.76 105.19 110.10 2h0g n GLY 166 Ca 0.14 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2h0g n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h0g n GLY 167 N -1.74 0.93 0.07 -0.02 0.00 -0.65 -4.91 105.19 98.87 2h0g n GLY 167 Ca -0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.07 2h0g n GLY 167 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h0g n LYS 168 N -2.00 0.15 -1.69 1.61 5.02 -1.11 -4.79 118.16 115.35 2h0g n LYS 168 Ca 0.00 0.22 -0.43 0.00 -2.02 0.00 0.00 58.31 56.08 2h0g n LYS 168 Cb 0.00 -1.71 -0.03 0.00 -0.02 0.00 0.00 35.03 33.26 2h0g n LYS 168 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2h0g n LEU 169 N -1.99 3.94 -4.76 -0.35 7.94 -1.26 -4.92 117.00 115.59 2h0g n LEU 169 Ca 0.05 1.00 -0.39 0.00 -1.11 0.00 0.00 56.01 55.56 2h0g n LEU 169 Cb 0.33 -1.53 -0.05 0.00 0.53 0.00 0.00 43.42 42.70 2h0g n LEU 169 CO 0.25 0.13 0.71 -0.54 -1.11 0.00 0.00 177.39 176.83 2h0g s LYS 170 N 2.55 4.62 0.28 1.96 1.02 -1.26 -4.99 119.74 123.93 2h0g s LYS 170 Ca 0.82 1.56 0.12 0.00 0.02 0.00 0.00 55.97 58.49 2h0g s LYS 170 Cb -0.51 -3.04 -0.05 0.00 -0.52 0.00 0.00 37.83 33.71 2h0g s LYS 170 CO 0.38 0.26 -0.17 -0.51 -0.92 0.00 0.00 175.35 174.39 2h0g s LEU 171 N -1.68 2.66 -0.65 3.17 1.43 -1.26 -5.08 118.68 117.27 2h0g s LEU 171 Ca 0.47 -1.00 -0.14 0.00 -1.03 0.00 0.00 54.13 52.42 2h0g s LEU 171 Cb -0.26 -1.16 0.16 0.00 0.03 0.00 0.00 46.19 44.97 2h0g s LEU 171 CO 0.33 0.02 0.59 0.21 0.23 0.00 0.00 176.35 177.72 2h0g s ASN 172 N -3.53 6.34 0.17 2.29 3.84 -1.26 -5.05 114.94 117.73 2h0g s ASN 172 Ca 0.30 -2.18 -0.31 0.00 0.21 0.00 0.00 52.86 50.88 2h0g s ASN 172 Cb -0.05 -2.18 -0.09 0.00 -0.55 0.00 0.00 41.25 38.38 2h0g s ASN 172 CO 0.16 -0.72 1.46 0.68 -2.79 0.00 0.00 177.10 175.89 2h0g s VAL 173 N 0.97 2.89 0.43 -5.21 -7.23 -1.26 -4.92 120.40 106.07 2h0g s VAL 173 Ca 0.09 0.67 -0.11 0.00 -1.81 0.00 0.00 61.98 60.83 2h0g s VAL 173 Cb -0.22 -3.43 -0.06 0.00 0.56 0.00 0.00 36.38 33.23 2h0g s VAL 173 CO -0.02 0.07 0.80 -2.84 -0.31 0.00 0.00 175.10 172.80 2h0g s PRO 174 N 0.65 3.77 0.49 4.82 0.02 -1.26 -4.97 135.00 138.51 2h0g s PRO 174 Ca 0.65 0.49 0.20 0.00 0.02 0.00 0.00 61.00 62.36 2h0g s PRO 174 Cb -0.40 -2.36 1.24 0.00 0.02 0.00 0.00 34.50 32.99 2h0g s PRO 174 CO 0.34 -0.09 2.00 0.00 -0.33 0.00 0.00 177.00 178.93 2h0g h ALA 175 N 1.09 2.26 -2.93 -1.55 0.00 -2.03 -3.44 119.26 112.66 2h0g h ALA 175 Ca -0.47 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 2h0g h ALA 175 Cb 1.19 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.85 2h0g h ALA 175 CO 0.63 -0.40 0.12 0.54 0.00 0.00 0.00 179.25 180.15 2h0g s ASN 176 N -6.29 -0.43 -0.25 0.00 4.22 -1.26 -5.13 114.94 105.80 2h0g s ASN 176 Ca -0.06 -0.18 -0.27 0.00 -2.14 0.00 0.00 52.86 50.20 2h0g s ASN 176 Cb 0.19 0.58 0.01 0.00 1.28 0.00 0.00 41.25 43.31 2h0g s ASN 176 CO 0.73 -0.98 0.97 -0.69 -2.04 0.00 0.00 177.10 175.09 2h0g s VAL 177 N -3.79 4.71 0.25 3.54 1.01 -1.26 -5.00 120.40 119.85 2h0g s VAL 177 Ca 0.03 1.82 -0.30 0.00 0.00 0.00 0.00 61.98 63.54 2h0g s VAL 177 Cb -0.01 -4.26 -0.10 0.00 0.00 0.00 0.00 36.38 32.02 2h0g s VAL 177 CO -0.10 -0.19 1.38 -0.44 0.00 0.00 0.00 175.10 175.75 2h0g s SER 178 N 1.31 6.75 0.52 3.32 0.01 -1.26 -4.71 113.70 119.65 2h0g s SER 178 Ca 0.41 2.59 0.27 0.00 1.31 0.00 0.00 55.95 60.53 2h0g s SER 178 Cb -0.15 -2.62 1.40 0.00 0.21 0.00 0.00 66.02 64.86 2h0g s SER 178 CO 0.08 -0.62 1.95 0.71 0.41 0.00 0.00 173.24 175.77 2h0g h THR 179 N 3.52 0.67 -0.83 1.44 1.35 -1.97 2.81 112.91 119.91 2h0g h THR 179 Ca -0.46 -0.01 -0.03 0.00 -0.55 0.00 0.00 66.41 65.35 2h0g h THR 179 Cb 1.22 0.63 -0.04 0.00 -1.73 0.00 0.00 68.15 68.23 2h0g h THR 179 CO 0.76 0.01 0.39 1.05 -0.25 0.00 0.00 175.52 177.48 2h0g h GLU 180 N 0.04 1.20 0.06 4.72 4.11 -2.00 -0.81 114.58 121.89 2h0g h GLU 180 Ca 0.33 -0.18 -0.26 0.00 0.07 0.00 0.00 59.36 59.31 2h0g h GLU 180 Cb 1.26 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 2h0g h GLU 180 CO -0.02 0.93 -1.30 1.96 0.07 0.00 0.00 179.01 180.65 2h0g h GLN 181 N 1.18 0.13 -0.24 1.06 4.20 0.36 -3.28 115.11 118.53 2h0g h GLN 181 Ca 0.28 -0.22 -0.13 0.00 0.06 0.00 0.00 58.65 58.64 2h0g h GLN 181 Cb 0.13 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 2h0g h GLN 181 CO -0.03 1.01 -0.38 1.98 -0.67 0.00 0.00 178.83 180.73 2h0g h MET 182 N 0.04 0.55 -0.64 1.46 4.05 0.35 -2.45 114.93 118.27 2h0g h MET 182 Ca -0.14 -0.27 -0.08 0.00 -0.28 0.00 0.00 59.70 58.93 2h0g h MET 182 Cb 1.92 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 32.69 2h0g h MET 182 CO 0.15 0.84 0.08 -0.22 0.23 0.00 0.00 176.91 177.99 2h0g h LYS 183 N 0.46 1.08 -0.48 0.39 3.64 -1.27 -1.82 116.57 118.56 2h0g h LYS 183 Ca 0.04 -0.30 -0.01 0.00 -1.27 0.00 0.00 60.65 59.12 2h0g h LYS 183 Cb 0.87 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 2h0g h LYS 183 CO 0.07 1.00 0.27 0.28 -2.27 0.00 0.00 179.45 178.80 2h0g h VAL 184 N 1.00 1.17 -0.08 2.00 2.07 -1.58 -0.57 116.25 120.26 2h0g h VAL 184 Ca 0.19 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 2h0g h VAL 184 Cb 0.46 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 2h0g h VAL 184 CO 0.02 0.18 0.04 -0.07 0.02 0.00 0.00 177.57 177.76 2h0g h LEU 185 N 0.64 0.11 -0.23 2.57 3.38 -1.16 -2.43 115.31 118.19 2h0g h LEU 185 Ca 0.17 -0.10 -0.21 0.00 0.09 0.00 0.00 57.88 57.83 2h0g h LEU 185 Cb 0.05 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.78 2h0g h LEU 185 CO -0.03 0.17 -0.78 -1.28 0.09 0.00 0.00 178.44 176.62 2h0g h SER 186 N 0.03 0.80 -0.72 -0.43 0.87 -1.28 -0.26 113.55 112.56 2h0g h SER 186 Ca 0.03 -0.53 0.07 0.00 -1.23 0.00 0.00 61.79 60.13 2h0g h SER 186 Cb 0.09 -0.24 -0.06 0.00 -0.44 0.00 0.00 62.40 61.76 2h0g h SER 186 CO -0.00 1.31 0.40 0.44 -0.53 0.00 0.00 176.83 178.45 2h0g h ASP 187 N 0.45 0.58 -0.24 6.23 5.19 -1.14 -0.95 116.42 126.54 2h0g h ASP 187 Ca -0.05 0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 56.37 2h0g h ASP 187 Cb 1.40 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 40.82 2h0g h ASP 187 CO 0.15 0.36 0.06 0.78 -3.12 0.00 0.00 179.24 177.48 2h0g h ASN 188 N 0.71 0.37 -0.02 6.45 2.35 -1.23 -2.93 115.58 121.28 2h0g h ASN 188 Ca 0.33 -0.22 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2h0g h ASN 188 Cb 0.25 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.52 2h0g h ASN 188 CO -0.21 0.50 0.00 -0.33 -1.65 0.00 0.00 177.43 175.74 2h0g h GLU 189 N 0.22 0.06 0.06 0.81 5.08 -0.35 -2.28 114.58 118.18 2h0g h GLU 189 Ca 0.08 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2h0g h GLU 189 Cb 0.27 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2h0g h GLU 189 CO 0.00 0.06 -0.03 0.87 -1.00 0.00 0.00 179.01 178.91 2h0g h LYS 190 N 0.06 -0.08 0.00 2.33 1.57 -1.11 -1.91 116.57 117.42 2h0g h LYS 190 Ca 0.01 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2h0g h LYS 190 Cb 0.03 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2h0g h LYS 190 CO -0.00 0.51 0.21 1.25 -0.57 0.00 0.00 179.45 180.84 2h0g h LEU 191 N -0.81 0.00 0.17 2.94 6.46 -1.36 0.40 115.31 123.10 2h0g h LEU 191 Ca -0.01 0.00 -0.32 0.00 -0.12 0.00 0.00 57.88 57.43 2h0g h LEU 191 Cb 0.63 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.57 2h0g h LEU 191 CO 0.01 0.00 -1.56 -0.03 -0.62 0.00 0.00 178.44 176.24 2h0g h MET 192 N 0.00 0.36 -0.12 1.25 4.05 -1.14 -3.00 114.93 116.34 2h0g h MET 192 Ca 0.00 -0.62 -0.21 0.00 -0.28 0.00 0.00 59.70 58.59 2h0g h MET 192 Cb 0.41 0.23 0.00 0.00 -0.80 0.00 0.00 31.60 31.45 2h0g h MET 192 CO 0.00 1.26 -0.77 -0.44 0.23 0.00 0.00 176.91 177.19 2h0g h ASP 193 N 0.10 0.76 0.17 1.39 3.32 0.45 -2.96 116.42 119.64 2h0g h ASP 193 Ca -0.27 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.28 2h0g h ASP 193 Cb 2.07 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 41.37 2h0g h ASP 193 CO 0.20 1.28 -0.37 0.44 -1.72 0.00 0.00 179.24 179.06 2h0g h ASP 194 N 0.43 -1.10 0.05 6.45 3.32 -0.80 -0.65 116.42 124.12 2h0g h ASP 194 Ca -0.05 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2h0g h ASP 194 Cb 1.38 0.39 0.00 0.00 0.22 0.00 0.00 39.33 41.33 2h0g h ASP 194 CO 0.15 -0.42 0.00 0.18 -1.72 0.00 0.00 179.24 177.43 2h0g n LEU 195 N -4.60 0.00 0.00 1.55 4.77 -1.13 -4.86 117.00 112.73 2h0g n LEU 195 Ca -0.07 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2h0g n LEU 195 Cb 0.30 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2h0g n LEU 195 CO 0.13 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.70 2h0g n GLY 196 N -0.67 0.19 3.64 -0.72 0.00 -0.25 -4.99 105.19 102.38 2h0g n GLY 196 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 2h0g n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h0g s ALA 197 N -1.45 3.58 -0.30 4.61 0.00 -1.24 -4.93 121.76 122.04 2h0g s ALA 197 Ca 0.00 -0.91 0.22 0.00 0.00 0.00 0.00 51.96 51.27 2h0g s ALA 197 Cb 0.00 -2.40 -0.25 0.00 0.00 0.00 0.00 23.12 20.47 2h0g s ALA 197 CO 0.00 -0.31 0.66 0.09 0.00 0.00 0.00 175.76 176.20 2h0g n ASN 198 N 4.54 0.32 -4.85 0.00 5.03 -1.26 -4.76 115.26 114.28 2h0g n ASN 198 Ca -0.14 -0.20 -0.38 0.00 0.87 0.00 0.00 54.58 54.74 2h0g n ASN 198 Cb 0.52 1.56 -0.06 0.00 -1.02 0.00 0.00 39.78 40.78 2h0g n ASN 198 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2h0g s VAL 199 N -3.37 5.16 0.29 2.41 0.11 -1.26 -5.03 120.40 118.70 2h0g s VAL 199 Ca -0.03 0.65 0.10 0.00 -2.93 0.00 0.00 61.98 59.77 2h0g s VAL 199 Cb 0.14 -3.63 -0.05 0.00 -1.53 0.00 0.00 36.38 31.32 2h0g s VAL 199 CO 0.88 0.58 -0.08 -0.04 -3.33 0.00 0.00 175.10 173.11 2h0g s MET 200 N -1.11 2.00 0.33 1.54 -1.94 -1.26 -4.01 119.30 114.85 2h0g s MET 200 Ca 0.22 -1.63 -0.26 0.00 -1.71 0.00 0.00 55.69 52.31 2h0g s MET 200 Cb -0.15 -1.95 -0.09 0.00 2.01 0.00 0.00 34.83 34.64 2h0g s MET 200 CO 0.11 0.31 1.02 -1.25 -0.01 0.00 0.00 175.02 175.20 2h0g s PRO 201 N -3.61 4.46 -0.54 2.03 0.04 -1.26 -4.28 135.00 131.84 2h0g s PRO 201 Ca 0.31 1.53 -0.11 0.00 0.04 0.00 0.00 61.00 62.78 2h0g s PRO 201 Cb -0.05 -2.84 0.14 0.00 0.04 0.00 0.00 34.50 31.79 2h0g s PRO 201 CO 0.18 0.13 0.43 0.00 0.04 0.00 0.00 177.00 177.77 2h0g s ALA 202 N -1.48 3.53 0.16 8.56 0.00 -1.18 -0.81 121.76 130.54 2h0g s ALA 202 Ca 0.51 -2.68 -0.15 0.00 0.00 0.00 0.00 51.96 49.64 2h0g s ALA 202 Cb -0.24 -2.98 -0.07 0.00 0.00 0.00 0.00 23.12 19.83 2h0g s ALA 202 CO 0.30 -1.98 0.57 0.42 0.00 0.00 0.00 175.76 175.07 2h0g s ILE 203 N 1.17 4.82 -0.03 0.00 1.01 0.40 -2.09 121.20 126.49 2h0g s ILE 203 Ca 0.07 0.88 0.01 0.00 0.00 0.00 0.00 60.65 61.61 2h0g s ILE 203 Cb -0.25 -3.75 0.02 0.00 0.01 0.00 0.00 42.46 38.50 2h0g s ILE 203 CO -0.01 0.23 -0.03 -0.31 0.00 0.00 0.00 174.94 174.82 2h0g s TYR 204 N -1.48 0.54 0.27 3.97 1.51 0.16 -2.05 117.35 120.27 2h0g s TYR 204 Ca 0.39 -0.11 -0.01 0.00 -1.01 0.00 0.00 57.07 56.33 2h0g s TYR 204 Cb -0.15 -0.51 -0.02 0.00 -0.11 0.00 0.00 41.96 41.16 2h0g s TYR 204 CO 0.19 -0.14 0.28 1.52 -1.11 0.00 0.00 175.55 176.29 2h0g s TYR 205 N 0.81 1.19 -0.07 2.71 -0.85 -0.97 -1.05 117.35 119.12 2h0g s TYR 205 Ca -0.10 -1.35 0.01 0.00 -0.52 0.00 0.00 57.07 55.12 2h0g s TYR 205 Cb -0.13 -0.41 -0.03 0.00 0.38 0.00 0.00 41.96 41.77 2h0g s TYR 205 CO -0.00 -0.84 -0.09 -1.64 -1.52 0.00 0.00 175.55 171.45 2h0g s MET 206 N -3.75 2.79 0.96 -3.49 -1.94 -1.26 -0.52 119.30 112.09 2h0g s MET 206 Ca 0.36 -0.60 -0.15 0.00 -1.71 0.00 0.00 55.69 53.59 2h0g s MET 206 Cb 0.03 -2.55 0.18 0.00 2.01 0.00 0.00 34.83 34.50 2h0g s MET 206 CO 0.17 0.59 1.22 -1.54 -0.01 0.00 0.00 175.02 175.45 2h0g s SER 207 N -0.61 3.09 0.51 3.03 1.04 -0.52 -4.92 113.70 115.32 2h0g s SER 207 Ca 0.09 0.58 0.29 0.00 0.48 0.00 0.00 55.95 57.39 2h0g s SER 207 Cb -0.11 -0.85 1.20 0.00 0.10 0.00 0.00 66.02 66.36 2h0g s SER 207 CO 0.02 -2.77 1.93 0.11 0.98 0.00 0.00 173.24 173.50 2h0g h LYS 208 N -1.66 0.00 -1.00 4.02 1.79 -2.00 -2.67 116.57 115.05 2h0g h LYS 208 Ca -0.46 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.50 2h0g h LYS 208 Cb 1.28 0.00 -0.29 0.00 -1.58 0.00 0.00 32.23 31.64 2h0g h LYS 208 CO 0.48 0.10 0.64 0.39 -1.08 0.00 0.00 179.45 179.99 2h0g n GLU 209 N -3.26 2.22 -3.73 3.15 4.71 -1.26 -4.92 120.64 117.56 2h0g n GLU 209 Ca 0.00 -2.88 -0.28 0.00 -0.01 0.00 0.00 57.16 53.98 2h0g n GLU 209 Cb 0.35 -2.13 0.01 0.00 -1.01 0.00 0.00 31.44 28.66 2h0g n GLU 209 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2h0g n ASN 210 N -1.05 -4.53 -4.46 1.62 5.03 -1.01 -4.83 115.26 106.04 2h0g n ASN 210 Ca 0.57 -0.66 -0.33 0.00 0.87 0.00 0.00 54.58 55.04 2h0g n ASN 210 Cb 1.54 -3.65 -0.13 0.00 -1.02 0.00 0.00 39.78 36.52 2h0g n ASN 210 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2h0g s THR 211 N -3.19 3.03 -0.49 3.41 -4.23 -1.26 -4.32 115.64 108.60 2h0g s THR 211 Ca 0.58 -0.73 -0.27 0.00 -1.18 0.00 0.00 61.69 60.09 2h0g s THR 211 Cb -0.29 -2.19 -0.02 0.00 1.34 0.00 0.00 72.50 71.33 2h0g s THR 211 CO 0.71 0.58 1.85 -0.22 -0.54 0.00 0.00 174.62 177.01 2h0g s LEU 212 N -0.62 3.39 0.24 4.79 2.96 -1.26 -1.44 118.68 126.73 2h0g s LEU 212 Ca 0.09 0.76 -0.06 0.00 -0.22 0.00 0.00 54.13 54.70 2h0g s LEU 212 Cb -0.11 -2.93 -0.06 0.00 0.50 0.00 0.00 46.19 43.59 2h0g s LEU 212 CO 0.01 -2.13 0.51 -1.10 -1.32 0.00 0.00 176.35 172.33 2h0g s GLN 213 N 6.53 3.67 0.05 1.98 -1.52 0.33 -4.98 119.66 125.71 2h0g s GLN 213 Ca 0.73 0.04 0.03 0.00 -1.95 0.00 0.00 55.36 54.22 2h0g s GLN 213 Cb -0.17 -2.69 -0.03 0.00 -0.22 0.00 0.00 33.01 29.91 2h0g s GLN 213 CO 0.26 0.29 -0.10 -1.14 -0.25 0.00 0.00 175.29 174.36 2h0g s GLN 214 N -3.20 0.61 -0.08 2.91 0.74 -1.26 -2.30 119.66 117.08 2h0g s GLN 214 Ca 0.44 -0.81 -0.06 0.00 0.05 0.00 0.00 55.36 54.98 2h0g s GLN 214 Cb -0.11 -0.44 0.03 0.00 1.10 0.00 0.00 33.01 33.58 2h0g s GLN 214 CO 0.27 0.09 0.21 0.00 -0.55 0.00 0.00 175.29 175.31 2h0g s ALA 215 N -1.35 -0.50 -0.06 1.58 0.00 -0.87 -5.02 121.76 115.55 2h0g s ALA 215 Ca -0.08 0.69 0.03 0.00 0.00 0.00 0.00 51.96 52.61 2h0g s ALA 215 Cb -0.10 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.60 2h0g s ALA 215 CO 0.01 -0.13 -0.15 0.08 0.00 0.00 0.00 175.76 175.57 2h0g s VAL 216 N 0.48 1.30 0.00 0.00 1.01 -1.26 -0.45 120.40 121.48 2h0g s VAL 216 Ca -0.03 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.35 2h0g s VAL 216 Cb -0.05 -1.15 0.00 0.00 0.00 0.00 0.00 36.38 35.18 2h0g s VAL 216 CO -0.02 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2h0g n GLY 217 N 3.56 -0.46 3.61 4.51 0.00 0.00 -4.72 105.19 111.69 2h0g n GLY 217 Ca -0.21 -1.24 -0.41 0.00 0.00 0.00 0.00 46.02 44.17 2h0g n GLY 217 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2h0g s LEU 218 N 0.00 4.12 0.34 0.99 2.96 -1.26 -4.41 118.68 121.41 2h0g s LEU 218 Ca 0.00 0.51 -0.23 0.00 -0.22 0.00 0.00 54.13 54.19 2h0g s LEU 218 Cb 0.00 -2.81 -0.10 0.00 0.50 0.00 0.00 46.19 43.78 2h0g s LEU 218 CO 0.00 -0.43 0.91 -2.16 -1.32 0.00 0.00 176.35 173.34 2h0g s PRO 219 N 2.56 4.40 1.06 0.98 0.04 -1.26 -5.07 135.00 137.71 2h0g s PRO 219 Ca 0.25 1.17 -0.18 0.00 0.04 0.00 0.00 61.00 62.28 2h0g s PRO 219 Cb -0.15 -2.60 0.24 0.00 0.04 0.00 0.00 34.50 32.03 2h0g s PRO 219 CO 0.11 0.19 1.27 0.16 0.04 0.00 0.00 177.00 178.77 2h0g s ASP 220 N -1.84 2.24 0.25 6.66 1.47 -1.26 -4.66 116.67 119.54 2h0g s ASP 220 Ca 0.53 0.31 -0.03 0.00 1.18 0.00 0.00 52.55 54.55 2h0g s ASP 220 Cb -0.15 -0.36 0.44 0.00 -0.34 0.00 0.00 42.92 42.51 2h0g s ASP 220 CO 0.20 -3.28 1.81 -0.61 0.68 0.00 0.00 175.17 173.97 2h0g h GLN 221 N -2.02 0.80 -0.01 2.11 5.75 -1.99 -0.66 115.11 119.09 2h0g h GLN 221 Ca -0.44 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.01 2h0g h GLN 221 Cb 1.24 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 29.61 2h0g h GLN 221 CO 0.33 0.53 -0.00 -0.22 -2.65 0.00 0.00 178.83 176.82 2h0g h LYS 222 N 0.82 0.03 -0.61 1.69 3.64 -2.00 -2.40 116.57 117.74 2h0g h LYS 222 Ca 0.42 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.75 2h0g h LYS 222 Cb 0.41 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 2h0g h LYS 222 CO -0.26 0.33 0.21 1.15 -2.27 0.00 0.00 179.45 178.61 2h0g h THR 223 N -0.28 1.23 -0.05 1.00 2.02 -1.87 -2.38 112.91 112.58 2h0g h THR 223 Ca 0.00 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.44 2h0g h THR 223 Cb 0.32 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 67.26 2h0g h THR 223 CO 0.00 0.29 0.03 0.25 0.37 0.00 0.00 175.52 176.47 2h0g h LEU 224 N 0.89 0.06 -1.42 2.58 5.85 -1.07 -0.84 115.31 121.36 2h0g h LEU 224 Ca 0.20 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 2h0g h LEU 224 Cb 0.22 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 2h0g h LEU 224 CO -0.01 0.06 0.10 0.78 -0.34 0.00 0.00 178.44 179.02 2h0g h ASN 225 N 0.06 0.44 0.17 1.25 -0.26 -1.27 -1.04 115.58 114.92 2h0g h ASN 225 Ca 0.02 -0.05 -0.20 0.00 -0.56 0.00 0.00 56.30 55.51 2h0g h ASN 225 Cb 0.01 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.16 2h0g h ASN 225 CO -0.00 0.44 -0.78 0.40 -1.06 0.00 0.00 177.43 176.42 2h0g h ILE 226 N 0.48 1.36 -0.14 2.81 2.04 -1.19 0.37 117.51 123.25 2h0g h ILE 226 Ca 0.12 -2.16 -0.09 0.00 1.00 0.00 0.00 64.86 63.73 2h0g h ILE 226 Cb 0.16 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 2h0g h ILE 226 CO -0.01 0.66 -0.30 0.40 0.00 0.00 0.00 178.15 178.90 2h0g h ILE 227 N 0.33 1.26 -0.30 -0.67 2.04 -0.58 -2.42 117.51 117.18 2h0g h ILE 227 Ca -0.05 -1.24 -0.00 0.00 1.00 0.00 0.00 64.86 64.57 2h0g h ILE 227 Cb 1.38 1.49 -0.00 0.00 -0.74 0.00 0.00 36.82 38.95 2h0g h ILE 227 CO 0.14 0.38 0.00 0.23 0.00 0.00 0.00 178.15 178.90 2h0g n MET 228 N -4.12 3.01 -1.45 2.37 2.81 -0.45 -4.87 117.12 114.43 2h0g n MET 228 Ca -0.01 -1.63 -0.11 0.00 -1.81 0.00 0.00 57.70 54.15 2h0g n MET 228 Cb 0.40 -1.90 -0.04 0.00 -0.71 0.00 0.00 33.22 30.97 2h0g n MET 228 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2h0g n GLY 229 N 0.32 0.83 0.28 3.03 0.00 -0.91 -4.93 105.19 103.81 2h0g n GLY 229 Ca 0.14 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.31 2h0g n GLY 229 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31