#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h9c s GLU 2 N 0.00 2.55 0.08 2.12 2.12 -1.26 -5.08 118.70 119.23 1h9c s GLU 2 Ca 0.00 -1.43 0.04 0.00 0.36 0.00 0.00 54.97 53.94 1h9c s GLU 2 Cb 0.00 -3.68 -0.03 0.00 0.26 0.00 0.00 34.13 30.68 1h9c s GLU 2 CO 0.00 -0.90 -0.11 0.15 -0.54 0.00 0.00 175.26 173.86 1h9c s LYS 3 N 1.39 0.80 0.04 4.30 1.02 -1.26 -4.86 119.74 121.17 1h9c s LYS 3 Ca 0.02 -1.04 0.00 0.00 0.02 0.00 0.00 55.97 54.98 1h9c s LYS 3 Cb -0.22 -0.61 -0.04 0.00 -0.52 0.00 0.00 37.83 36.44 1h9c s LYS 3 CO 0.02 0.11 0.13 0.15 -0.92 0.00 0.00 175.35 174.84 1h9c s LYS 4 N -2.26 3.17 -0.23 1.68 3.01 -1.03 -5.00 119.74 119.08 1h9c s LYS 4 Ca 0.01 -0.51 -0.06 0.00 -1.01 0.00 0.00 55.97 54.40 1h9c s LYS 4 Cb -0.06 -2.91 -0.02 0.00 -1.01 0.00 0.00 37.83 33.83 1h9c s LYS 4 CO 0.01 0.62 0.03 -1.01 0.51 0.00 0.00 175.35 175.51 1h9c s HIS 5 N -1.36 3.04 -0.27 3.18 3.76 -1.26 -1.15 115.29 121.24 1h9c s HIS 5 Ca 0.29 -0.58 0.03 0.00 -0.15 0.00 0.00 55.06 54.65 1h9c s HIS 5 Cb -0.12 -2.18 0.06 0.00 1.11 0.00 0.00 32.58 31.45 1h9c s HIS 5 CO 0.21 -0.40 -0.09 0.42 -0.85 0.00 0.00 174.74 174.03 1h9c s ILE 6 N 1.50 2.10 -0.16 0.60 1.01 -0.45 -1.22 121.20 124.57 1h9c s ILE 6 Ca 0.06 -1.66 -0.01 0.00 0.00 0.00 0.00 60.65 59.04 1h9c s ILE 6 Cb -0.15 -2.26 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 1h9c s ILE 6 CO 0.01 -0.10 -0.13 -0.31 0.00 0.00 0.00 174.94 174.42 1h9c s TYR 7 N 1.12 2.83 -0.22 3.97 2.02 -1.03 -2.41 117.35 123.63 1h9c s TYR 7 Ca -0.06 -0.91 -0.10 0.00 -0.37 0.00 0.00 57.07 55.63 1h9c s TYR 7 Cb -0.20 -1.92 -0.05 0.00 -0.40 0.00 0.00 41.96 39.40 1h9c s TYR 7 CO -0.06 -0.41 0.14 -0.51 -1.57 0.00 0.00 175.55 173.14 1h9c s LEU 8 N 0.80 4.12 0.10 -1.29 1.02 -0.17 -1.02 118.68 122.25 1h9c s LEU 8 Ca -0.05 0.16 0.08 0.00 0.02 0.00 0.00 54.13 54.34 1h9c s LEU 8 Cb -0.15 -2.09 -0.03 0.00 0.02 0.00 0.00 46.19 43.94 1h9c s LEU 8 CO 0.01 0.12 -0.21 -0.36 0.02 0.00 0.00 176.35 175.93 1h9c s PHE 9 N 0.71 1.82 -0.04 0.29 0.08 -0.14 -1.57 117.98 119.12 1h9c s PHE 9 Ca 0.07 -0.41 -0.25 0.00 0.12 0.00 0.00 56.93 56.46 1h9c s PHE 9 Cb -0.12 -1.00 -0.22 0.00 -0.57 0.00 0.00 43.02 41.11 1h9c s PHE 9 CO 0.01 0.21 1.11 0.77 -0.10 0.00 0.00 175.22 177.22 1h9c h SER 11 N 4.11 0.13 0.00 1.36 0.02 -1.95 -2.71 113.55 114.51 1h9c h SER 11 Ca -0.46 -0.67 0.00 0.00 -0.84 0.00 0.00 61.79 59.82 1h9c h SER 11 Cb 1.18 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.68 1h9c h SER 11 CO 0.40 0.78 -0.77 0.00 -1.14 0.00 0.00 176.83 176.09 1h9c n ALA 12 N -2.47 2.45 -3.02 3.77 0.00 -1.26 -4.19 120.51 115.80 1h9c n ALA 12 Ca -0.09 -0.14 -0.12 0.00 0.00 0.00 0.00 53.44 53.08 1h9c n ALA 12 Cb 0.39 -0.20 0.05 0.00 0.00 0.00 0.00 19.45 19.70 1h9c n ALA 12 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h9c n GLY 13 N 1.67 -0.01 0.67 0.00 0.00 -1.26 -4.47 105.19 101.80 1h9c n GLY 13 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1h9c n GLY 13 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1h9c n MET 14 N -3.08 0.00 0.26 1.61 2.81 -1.26 -4.68 117.12 112.78 1h9c n MET 14 Ca -0.09 0.00 0.17 0.00 -1.81 0.00 0.00 57.70 55.97 1h9c n MET 14 Cb 0.57 -0.11 0.78 0.00 -0.71 0.00 0.00 33.22 33.76 1h9c n MET 14 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1h9c h SER 15 N 0.00 0.00 0.02 7.83 4.64 -2.05 -1.95 113.55 122.05 1h9c h SER 15 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h9c h SER 15 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1h9c h SER 15 CO 0.00 0.00 -0.01 0.71 -0.87 0.00 0.00 176.83 176.66 1h9c h THR 16 N 0.00 0.91 -0.46 2.95 1.35 -2.01 -3.22 112.91 112.43 1h9c h THR 16 Ca 0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 1h9c h THR 16 Cb 0.32 1.03 -0.02 0.00 -1.73 0.00 0.00 68.15 67.74 1h9c h THR 16 CO 0.00 0.01 0.30 0.77 -0.25 0.00 0.00 175.52 176.35 1h9c h SER 17 N 0.00 0.53 -0.24 5.36 4.64 -1.62 -0.71 113.55 121.51 1h9c h SER 17 Ca -0.00 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 1h9c h SER 17 Cb 0.03 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.98 1h9c h SER 17 CO 0.00 0.39 0.01 0.25 -0.87 0.00 0.00 176.83 176.62 1h9c h LEU 18 N 0.62 0.40 -0.58 5.97 5.85 -1.77 0.20 115.31 126.01 1h9c h LEU 18 Ca 0.17 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1h9c h LEU 18 Cb -0.06 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 1h9c h LEU 18 CO -0.04 0.60 0.28 0.25 -0.34 0.00 0.00 178.44 179.20 1h9c h LEU 19 N 0.20 0.75 -0.57 2.25 5.85 -1.55 -1.77 115.31 120.47 1h9c h LEU 19 Ca 0.07 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1h9c h LEU 19 Cb 0.38 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1h9c h LEU 19 CO 0.01 0.66 0.30 0.58 -0.34 0.00 0.00 178.44 179.65 1h9c h VAL 20 N 0.78 1.19 -0.52 1.05 2.07 -1.05 0.77 116.25 120.55 1h9c h VAL 20 Ca 0.20 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1h9c h VAL 20 Cb 0.11 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1h9c h VAL 20 CO -0.03 0.21 0.33 -1.28 0.02 0.00 0.00 177.57 176.82 1h9c h SER 21 N 0.76 0.61 -0.54 0.57 0.87 -0.68 0.76 113.55 115.91 1h9c h SER 21 Ca 0.20 -0.04 -0.10 0.00 -1.23 0.00 0.00 61.79 60.62 1h9c h SER 21 Cb 0.07 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 1h9c h SER 21 CO -0.03 0.47 -0.03 0.11 -0.53 0.00 0.00 176.83 176.82 1h9c h LYS 22 N 0.70 1.00 -0.67 2.24 1.57 -0.91 -0.80 116.57 119.70 1h9c h LYS 22 Ca 0.19 -0.32 -0.07 0.00 -1.87 0.00 0.00 60.65 58.58 1h9c h LYS 22 Cb -0.04 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 1h9c h LYS 22 CO -0.04 0.99 0.15 0.52 -0.57 0.00 0.00 179.45 180.51 1h9c h MET 23 N 0.91 1.08 -0.43 3.15 2.86 -0.55 -1.69 114.93 120.25 1h9c h MET 23 Ca 0.16 -0.27 -0.10 0.00 -2.06 0.00 0.00 59.70 57.43 1h9c h MET 23 Cb 0.56 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 1h9c h MET 23 CO 0.03 0.97 -0.12 0.00 1.06 0.00 0.00 176.91 178.85 1h9c h ARG 24 N 1.00 0.84 -0.58 1.72 3.08 -0.69 -0.42 114.38 119.33 1h9c h ARG 24 Ca 0.21 -0.33 -0.09 0.00 0.07 0.00 0.00 59.98 59.84 1h9c h ARG 24 Cb 0.38 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 1h9c h ARG 24 CO 0.00 0.96 -0.00 0.00 -1.07 0.00 0.00 179.97 179.86 1h9c h ALA 25 N 0.86 0.89 0.00 0.04 0.00 -1.04 -0.08 119.26 119.94 1h9c h ALA 25 Ca 0.11 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 54.54 1h9c h ALA 25 Cb 0.66 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1h9c h ALA 25 CO 0.05 0.65 -0.81 1.96 0.00 0.00 0.00 179.25 181.10 1h9c h GLN 26 N 0.93 0.00 -0.29 0.00 1.08 -1.33 -2.16 115.11 113.34 1h9c h GLN 26 Ca 0.17 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.29 1h9c h GLN 26 Cb 0.54 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.96 1h9c h GLN 26 CO 0.03 0.81 -0.15 0.00 -0.95 0.00 0.00 178.83 178.56 1h9c h ALA 27 N 1.19 1.20 -0.20 3.87 0.00 -0.55 -0.14 119.26 124.63 1h9c h ALA 27 Ca -0.01 -0.29 -0.18 0.00 0.00 0.00 0.00 54.91 54.43 1h9c h ALA 27 Cb 1.49 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1h9c h ALA 27 CO 0.10 0.51 -0.58 0.93 0.00 0.00 0.00 179.25 180.22 1h9c h GLU 28 N 0.46 0.75 0.13 0.00 5.08 -0.96 0.93 114.58 120.97 1h9c h GLU 28 Ca 0.08 -0.54 -0.01 0.00 -1.00 0.00 0.00 59.36 57.90 1h9c h GLU 28 Cb 0.53 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1h9c h GLU 28 CO 0.03 1.16 -0.06 -0.22 -1.00 0.00 0.00 179.01 178.92 1h9c h LYS 29 N 0.48 -0.17 -0.85 2.33 3.64 -1.16 -3.03 116.57 117.80 1h9c h LYS 29 Ca -0.01 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1h9c h LYS 29 Cb 1.20 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.00 1h9c h LYS 29 CO 0.12 0.04 0.11 0.66 -2.27 0.00 0.00 179.45 178.11 1h9c n TYR 30 N -5.08 1.29 -3.65 1.91 4.01 -0.09 -4.95 117.16 110.60 1h9c n TYR 30 Ca -0.09 -0.65 -0.19 0.00 -0.16 0.00 0.00 57.90 56.81 1h9c n TYR 30 Cb 0.17 -0.42 0.01 0.00 -0.31 0.00 0.00 39.34 38.78 1h9c n TYR 30 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 1h9c n GLU 31 N 0.11 -0.68 -3.53 -0.72 0.28 -0.93 -4.93 120.64 110.24 1h9c n GLU 31 Ca 0.20 -0.07 -0.42 0.00 -0.16 0.00 0.00 57.16 56.72 1h9c n GLU 31 Cb 0.88 -0.75 -0.10 0.00 1.43 0.00 0.00 31.44 32.90 1h9c n GLU 31 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1h9c s VAL 32 N -3.72 4.84 -0.98 3.84 1.01 0.28 -5.02 120.40 120.64 1h9c s VAL 32 Ca 0.16 -0.89 -0.24 0.00 0.00 0.00 0.00 61.98 61.01 1h9c s VAL 32 Cb -0.09 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.54 1h9c s VAL 32 CO 0.44 -0.34 1.69 -2.16 0.00 0.00 0.00 175.10 174.74 1h9c s PRO 33 N 1.59 3.11 0.01 2.72 0.04 -1.26 -4.72 135.00 136.48 1h9c s PRO 33 Ca 0.03 -0.78 -0.08 0.00 0.04 0.00 0.00 61.00 60.22 1h9c s PRO 33 Cb -0.20 -5.23 0.00 0.00 0.04 0.00 0.00 34.50 29.11 1h9c s PRO 33 CO 0.07 -2.78 0.14 0.14 0.04 0.00 0.00 177.00 174.62 1h9c s VAL 34 N 7.40 0.09 -0.36 -0.36 -7.23 -1.26 -2.45 120.40 116.22 1h9c s VAL 34 Ca 0.58 -0.71 -0.05 0.00 -1.81 0.00 0.00 61.98 59.99 1h9c s VAL 34 Cb -0.03 -0.47 0.07 0.00 0.56 0.00 0.00 36.38 36.51 1h9c s VAL 34 CO -0.05 -0.39 0.14 -0.63 -0.31 0.00 0.00 175.10 173.87 1h9c s ILE 35 N -1.47 3.62 -0.30 -0.62 1.01 -0.30 -4.95 121.20 118.18 1h9c s ILE 35 Ca -0.14 -1.45 -0.05 0.00 0.00 0.00 0.00 60.65 59.02 1h9c s ILE 35 Cb -0.07 -3.19 0.03 0.00 0.01 0.00 0.00 42.46 39.24 1h9c s ILE 35 CO 0.01 -0.35 0.04 -0.63 0.00 0.00 0.00 174.94 174.01 1h9c s ILE 36 N 1.32 3.48 0.06 2.92 1.01 -1.26 -1.34 121.20 127.39 1h9c s ILE 36 Ca 0.01 -1.05 0.03 0.00 0.00 0.00 0.00 60.65 59.64 1h9c s ILE 36 Cb -0.21 -2.89 -0.03 0.00 0.01 0.00 0.00 42.46 39.34 1h9c s ILE 36 CO 0.00 -0.02 -0.09 -1.61 0.00 0.00 0.00 174.94 173.22 1h9c s GLU 37 N 1.38 0.66 -0.04 2.79 2.02 -1.01 -4.94 118.70 119.56 1h9c s GLU 37 Ca -0.01 -0.92 0.06 0.00 0.02 0.00 0.00 54.97 54.13 1h9c s GLU 37 Cb -0.18 -0.41 -0.02 0.00 0.10 0.00 0.00 34.13 33.62 1h9c s GLU 37 CO 0.00 0.07 -0.24 0.00 0.02 0.00 0.00 175.26 175.12 1h9c s ALA 38 N -1.77 2.23 0.03 5.21 0.00 -1.26 -1.00 121.76 125.21 1h9c s ALA 38 Ca -0.04 -1.06 -0.06 0.00 0.00 0.00 0.00 51.96 50.80 1h9c s ALA 38 Cb -0.07 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 1h9c s ALA 38 CO 0.00 0.47 0.11 -0.06 0.00 0.00 0.00 175.76 176.29 1h9c s PHE 39 N -0.38 0.17 0.69 0.00 0.08 -0.61 -4.98 117.98 112.94 1h9c s PHE 39 Ca 0.03 -0.44 -0.16 0.00 0.12 0.00 0.00 56.93 56.48 1h9c s PHE 39 Cb -0.12 -0.12 0.01 0.00 -0.57 0.00 0.00 43.02 42.23 1h9c s PHE 39 CO 0.02 -0.37 1.23 -1.25 -0.10 0.00 0.00 175.22 174.75 1h9c s PRO 40 N -2.49 2.38 0.63 0.24 0.04 -1.26 -4.24 135.00 130.31 1h9c s PRO 40 Ca -0.06 1.86 0.34 0.00 0.04 0.00 0.00 61.00 63.19 1h9c s PRO 40 Cb -0.02 -1.85 1.93 0.00 0.04 0.00 0.00 34.50 34.60 1h9c s PRO 40 CO -0.04 -1.68 2.18 1.05 0.04 0.00 0.00 177.00 178.55 1h9c h GLU 41 N 0.13 0.00 -0.16 4.56 9.09 -1.92 -1.98 114.58 124.30 1h9c h GLU 41 Ca -0.49 0.00 0.05 0.00 0.05 0.00 0.00 59.36 58.97 1h9c h GLU 41 Cb 1.31 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.40 1h9c h GLU 41 CO 0.51 0.00 0.11 1.79 0.05 0.00 0.00 179.01 181.48 1h9c h THR 42 N 0.00 0.91 -0.60 -1.06 1.35 -1.91 -2.17 112.91 109.43 1h9c h THR 42 Ca 0.03 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.86 1h9c h THR 42 Cb 0.30 0.92 -0.02 0.00 -1.73 0.00 0.00 68.15 67.62 1h9c h THR 42 CO -0.00 0.00 0.04 0.18 -0.25 0.00 0.00 175.52 175.49 1h9c n LEU 43 N -4.48 5.80 -0.05 3.87 4.77 -0.74 -4.40 117.00 121.76 1h9c n LEU 43 Ca 0.01 -2.95 -0.14 0.00 -0.03 0.00 0.00 56.01 52.90 1h9c n LEU 43 Cb 0.24 -0.70 -0.07 0.00 -2.33 0.00 0.00 43.42 40.56 1h9c n LEU 43 CO 0.35 0.65 0.54 0.00 -1.33 0.00 0.00 177.39 177.60 1h9c h ALA 44 N 3.80 0.23 0.00 -1.18 0.00 -1.56 -0.98 119.26 119.57 1h9c h ALA 44 Ca 0.04 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1h9c h ALA 44 Cb 2.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.79 1h9c h ALA 44 CO 0.53 0.20 0.00 0.78 0.00 0.00 0.00 179.25 180.76 1h9c h GLY 45 N 0.04 0.00 0.00 0.00 0.00 -1.82 -2.08 103.07 99.21 1h9c h GLY 45 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.26 1h9c h GLY 45 CO 0.05 0.00 -1.14 -2.21 0.00 0.00 0.00 176.54 173.25 1h9c n GLU 46 N -2.44 0.52 0.05 4.80 2.13 -1.15 -4.47 120.64 120.09 1h9c n GLU 46 Ca 0.02 0.31 -0.03 0.00 0.66 0.00 0.00 57.16 58.13 1h9c n GLU 46 Cb 0.29 -1.52 -0.08 0.00 0.27 0.00 0.00 31.44 30.40 1h9c n GLU 46 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1h9c h LYS 47 N -1.00 0.00 0.00 5.31 1.57 -1.32 -3.27 116.57 117.87 1h9c h LYS 47 Ca -0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1h9c h LYS 47 Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1h9c h LYS 47 CO -0.08 0.56 0.00 0.78 -0.57 0.00 0.00 179.45 180.14 1h9c h GLY 48 N 3.44 0.00 2.00 3.86 0.00 -1.48 -2.28 103.07 108.61 1h9c h GLY 48 Ca -0.12 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 1h9c h GLY 48 CO 0.08 0.00 -0.02 1.46 0.00 0.00 0.00 176.54 178.06 1h9c h GLN 49 N 0.00 0.00 -0.10 4.80 1.08 -1.75 -2.46 115.11 116.69 1h9c h GLN 49 Ca 0.00 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.17 1h9c h GLN 49 Cb 0.12 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.53 1h9c h GLN 49 CO 0.00 0.02 -0.15 0.09 -0.95 0.00 0.00 178.83 177.84 1h9c n ASN 50 N -4.08 2.44 -4.83 1.46 3.02 -0.86 -5.01 115.26 107.40 1h9c n ASN 50 Ca -0.03 -3.42 -0.38 0.00 -0.03 0.00 0.00 54.58 50.72 1h9c n ASN 50 Cb 0.10 -0.51 -0.06 0.00 -0.61 0.00 0.00 39.78 38.70 1h9c n ASN 50 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h9c s ALA 51 N -3.03 3.72 -0.19 5.41 0.00 -0.93 -4.68 121.76 122.06 1h9c s ALA 51 Ca 0.37 -0.34 0.19 0.00 0.00 0.00 0.00 51.96 52.18 1h9c s ALA 51 Cb 0.34 -2.30 -0.02 0.00 0.00 0.00 0.00 23.12 21.13 1h9c s ALA 51 CO 0.01 0.45 1.05 -0.44 0.00 0.00 0.00 175.76 176.82 1h9c h ASP 52 N 5.09 0.00 -3.45 0.00 3.32 -1.49 -3.46 116.42 116.43 1h9c h ASP 52 Ca -0.51 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.45 1h9c h ASP 52 Cb 1.21 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.52 1h9c h ASP 52 CO 0.63 0.32 -0.19 0.54 -1.72 0.00 0.00 179.24 178.82 1h9c s VAL 53 N -3.10 -0.01 -0.29 -1.35 0.11 -1.06 -4.59 120.40 110.10 1h9c s VAL 53 Ca -0.00 0.04 -0.13 0.00 -2.93 0.00 0.00 61.98 58.96 1h9c s VAL 53 Cb 0.09 -0.70 -0.04 0.00 -1.53 0.00 0.00 36.38 34.20 1h9c s VAL 53 CO 0.78 0.02 0.30 -0.69 -3.33 0.00 0.00 175.10 172.18 1h9c s VAL 54 N 1.01 5.23 -0.13 2.04 1.01 -0.55 -2.45 120.40 126.55 1h9c s VAL 54 Ca -0.06 0.30 -0.04 0.00 0.00 0.00 0.00 61.98 62.19 1h9c s VAL 54 Cb -0.06 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1h9c s VAL 54 CO -0.09 0.15 -0.00 -0.76 0.00 0.00 0.00 175.10 174.40 1h9c s LEU 55 N 1.93 3.50 -0.05 3.92 1.43 -0.19 -1.17 118.68 128.05 1h9c s LEU 55 Ca 0.11 0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.26 1h9c s LEU 55 Cb -0.16 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 1h9c s LEU 55 CO 0.11 0.26 -0.11 -0.76 0.23 0.00 0.00 176.35 176.07 1h9c s LEU 56 N -0.16 2.93 0.47 1.79 1.43 -0.44 -0.97 118.68 123.72 1h9c s LEU 56 Ca 0.05 -0.13 -0.24 0.00 -1.03 0.00 0.00 54.13 52.78 1h9c s LEU 56 Cb -0.13 -1.62 -0.07 0.00 0.03 0.00 0.00 46.19 44.40 1h9c s LEU 56 CO 0.02 0.35 1.31 -0.83 0.23 0.00 0.00 176.35 177.43 1h9c s GLY 57 N -0.80 2.88 0.57 -3.19 0.00 -1.02 -1.28 107.32 104.48 1h9c s GLY 57 Ca 0.12 1.24 0.26 0.00 0.00 0.00 0.00 44.72 46.34 1h9c s GLY 57 CO 0.01 1.79 2.19 -0.56 0.00 0.00 0.00 173.10 176.53 1h9c h PRO 58 N 2.13 0.00 0.00 2.90 0.13 -1.94 -0.99 132.00 134.23 1h9c h PRO 58 Ca -0.50 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 1h9c h PRO 58 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1h9c h PRO 58 CO 0.60 0.00 -0.20 -0.56 -0.23 0.00 0.00 178.00 177.61 1h9c h GLN 59 N 0.00 0.00 -0.27 0.86 -0.00 -1.96 -2.64 115.11 111.11 1h9c h GLN 59 Ca 0.03 0.00 -0.14 0.00 -0.00 0.00 0.00 58.65 58.54 1h9c h GLN 59 Cb 0.15 0.00 -0.08 0.00 -0.00 0.00 0.00 27.48 27.54 1h9c h GLN 59 CO -0.00 0.20 -0.19 0.44 -0.00 0.00 0.00 178.83 179.28 1h9c n ILE 60 N -4.10 2.48 0.16 1.86 -5.35 -0.40 -4.65 119.36 109.36 1h9c n ILE 60 Ca -0.02 -2.91 0.02 0.00 -0.27 0.00 0.00 62.75 59.57 1h9c n ILE 60 Cb 0.27 -0.31 0.27 0.00 -1.74 0.00 0.00 39.64 38.13 1h9c n ILE 60 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1h9c h ALA 61 N 1.01 1.08 0.00 -1.28 0.00 -1.22 -2.19 119.26 116.66 1h9c h ALA 61 Ca 0.17 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1h9c h ALA 61 Cb 1.50 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1h9c h ALA 61 CO 0.30 0.62 -0.05 0.10 0.00 0.00 0.00 179.25 180.21 1h9c h TYR 62 N 0.00 0.00 -0.13 0.00 -0.00 -1.82 -2.09 116.97 112.92 1h9c h TYR 62 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1h9c h TYR 62 Cb 0.93 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.66 1h9c h TYR 62 CO 0.00 0.05 0.00 -1.33 -0.00 0.00 0.00 178.16 176.88 1h9c n MET 63 N -3.40 1.42 0.02 0.10 2.81 -0.82 -4.27 117.12 112.98 1h9c n MET 63 Ca -0.02 -0.64 -0.10 0.00 -1.81 0.00 0.00 57.70 55.13 1h9c n MET 63 Cb 0.19 -1.27 -0.04 0.00 -0.71 0.00 0.00 33.22 31.38 1h9c n MET 63 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1h9c h LEU 64 N 1.19 -0.33 -1.98 4.03 5.85 -1.48 -0.22 115.31 122.37 1h9c h LEU 64 Ca 0.00 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1h9c h LEU 64 Cb 0.27 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.45 1h9c h LEU 64 CO 0.00 -0.15 -0.08 1.55 -0.34 0.00 0.00 178.44 179.42 1h9c h PRO 65 N -0.15 0.00 0.20 5.25 0.13 -1.84 0.10 132.00 135.70 1h9c h PRO 65 Ca 0.07 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.88 1h9c h PRO 65 Cb 0.24 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.40 1h9c h PRO 65 CO -0.16 0.08 -1.39 1.49 -0.23 0.00 0.00 178.00 177.78 1h9c h GLU 66 N 0.00 0.42 0.00 0.86 4.81 -1.69 -1.52 114.58 117.46 1h9c h GLU 66 Ca -0.00 -0.72 -0.20 0.00 -0.13 0.00 0.00 59.36 58.30 1h9c h GLU 66 Cb 0.16 0.27 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1h9c h GLU 66 CO 0.01 1.34 -0.96 0.82 -0.73 0.00 0.00 179.01 179.49 1h9c h ILE 67 N 0.12 1.67 -0.20 2.32 2.04 -0.75 -2.56 117.51 120.14 1h9c h ILE 67 Ca -0.21 -3.32 -0.11 0.00 1.00 0.00 0.00 64.86 62.22 1h9c h ILE 67 Cb 2.09 2.80 -0.01 0.00 -0.74 0.00 0.00 36.82 40.96 1h9c h ILE 67 CO 0.24 0.94 -0.34 -0.61 0.00 0.00 0.00 178.15 178.39 1h9c h GLN 68 N 0.00 0.42 -0.60 2.37 4.15 -0.82 0.12 115.11 120.76 1h9c h GLN 68 Ca -0.01 -0.18 -0.01 0.00 0.77 0.00 0.00 58.65 59.21 1h9c h GLN 68 Cb 1.73 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 29.38 1h9c h GLN 68 CO 0.12 0.71 0.32 -0.09 -1.93 0.00 0.00 178.83 177.96 1h9c h ARG 69 N 0.36 0.84 -0.47 1.69 1.12 -1.17 -1.58 114.38 115.17 1h9c h ARG 69 Ca 0.04 -0.10 -0.08 0.00 -1.11 0.00 0.00 59.98 58.73 1h9c h ARG 69 Cb 0.77 -0.16 -0.02 0.00 -0.01 0.00 0.00 29.97 30.55 1h9c h ARG 69 CO 0.06 0.65 -0.01 -0.07 -3.11 0.00 0.00 179.97 177.48 1h9c h LEU 70 N 0.81 0.83 -6.67 3.80 3.38 -1.10 -3.38 115.31 112.97 1h9c h LEU 70 Ca 0.21 -0.31 -0.61 0.00 0.09 0.00 0.00 57.88 57.26 1h9c h LEU 70 Cb 0.06 -0.22 -0.41 0.00 0.09 0.00 0.00 40.66 40.18 1h9c h LEU 70 CO -0.03 0.94 -0.67 0.18 0.09 0.00 0.00 178.44 178.95 1h9c n LEU 71 N -4.34 2.56 0.02 1.67 4.77 0.39 -4.94 117.00 117.13 1h9c n LEU 71 Ca 0.00 -5.13 0.13 0.00 -0.03 0.00 0.00 56.01 50.99 1h9c n LEU 71 Cb 0.32 -0.46 0.48 0.00 -2.33 0.00 0.00 43.42 41.43 1h9c n LEU 71 CO 0.42 1.87 0.81 -0.81 -1.33 0.00 0.00 177.39 178.35 1h9c n PRO 72 N 1.74 0.07 -0.49 3.23 -0.04 -0.61 -3.42 135.00 135.48 1h9c n PRO 72 Ca 0.24 0.05 0.08 0.00 -0.04 0.00 0.00 63.50 63.83 1h9c n PRO 72 Cb 0.40 -1.57 0.29 0.00 -0.04 0.00 0.00 33.50 32.57 1h9c n PRO 72 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1h9c n ASN 73 N -1.69 4.18 -4.13 3.54 3.02 -1.26 -4.93 115.26 113.99 1h9c n ASN 73 Ca 0.06 -2.54 -0.24 0.00 -0.03 0.00 0.00 54.58 51.83 1h9c n ASN 73 Cb 0.36 -0.50 -0.16 0.00 -0.61 0.00 0.00 39.78 38.88 1h9c n ASN 73 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1h9c s LYS 74 N -1.99 1.46 -0.16 3.52 -0.14 -1.22 -5.11 119.74 116.11 1h9c s LYS 74 Ca 0.43 -0.57 -0.29 0.00 -1.36 0.00 0.00 55.97 54.17 1h9c s LYS 74 Cb 0.29 -1.35 -0.03 0.00 -1.68 0.00 0.00 37.83 35.06 1h9c s LYS 74 CO 0.18 0.29 1.52 -1.25 -0.76 0.00 0.00 175.35 175.33 1h9c s PRO 75 N -0.18 4.03 -0.25 -1.68 0.04 -1.26 -4.97 135.00 130.73 1h9c s PRO 75 Ca 0.02 1.80 0.03 0.00 0.04 0.00 0.00 61.00 62.88 1h9c s PRO 75 Cb -0.08 -3.95 0.06 0.00 0.04 0.00 0.00 34.50 30.57 1h9c s PRO 75 CO 0.00 -1.00 -0.11 0.08 0.04 0.00 0.00 177.00 176.01 1h9c s VAL 76 N 4.38 2.08 0.05 -0.36 1.01 -1.26 -1.48 120.40 124.82 1h9c s VAL 76 Ca 0.67 -1.54 0.06 0.00 0.00 0.00 0.00 61.98 61.17 1h9c s VAL 76 Cb -0.26 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 1h9c s VAL 76 CO 0.25 0.00 -0.17 -0.70 0.00 0.00 0.00 175.10 174.49 1h9c s GLU 77 N 1.15 1.05 -0.04 2.72 2.56 -0.32 -5.01 118.70 120.82 1h9c s GLU 77 Ca -0.08 -0.89 -0.16 0.00 0.00 0.00 0.00 54.97 53.84 1h9c s GLU 77 Cb -0.19 -1.12 -0.05 0.00 2.00 0.00 0.00 34.13 34.76 1h9c s GLU 77 CO -0.06 0.27 0.44 0.08 -0.56 0.00 0.00 175.26 175.43 1h9c s VAL 78 N -0.95 5.06 0.18 3.70 1.01 -1.26 -1.33 120.40 126.81 1h9c s VAL 78 Ca 0.03 0.89 -0.30 0.00 0.00 0.00 0.00 61.98 62.60 1h9c s VAL 78 Cb -0.09 -3.76 -0.08 0.00 0.00 0.00 0.00 36.38 32.45 1h9c s VAL 78 CO 0.02 0.49 1.29 -0.63 0.00 0.00 0.00 175.10 176.27 1h9c s ILE 79 N -0.50 3.35 0.16 2.22 1.01 -0.40 -4.89 121.20 122.14 1h9c s ILE 79 Ca 0.24 1.09 -0.32 0.00 0.00 0.00 0.00 60.65 61.66 1h9c s ILE 79 Cb -0.16 -3.69 -0.12 0.00 0.01 0.00 0.00 42.46 38.50 1h9c s ILE 79 CO 0.12 0.15 1.77 -0.67 0.00 0.00 0.00 174.94 176.32 1h9c n ASP 80 N 2.85 3.94 -0.19 3.58 2.03 -1.26 -4.35 116.55 123.14 1h9c n ASP 80 Ca 0.07 1.02 0.09 0.00 0.52 0.00 0.00 54.79 56.49 1h9c n ASP 80 Cb 0.43 -1.54 0.39 0.00 -0.72 0.00 0.00 41.12 39.68 1h9c n ASP 80 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1h9c h SER 81 N 7.64 0.60 0.45 1.67 0.02 -1.99 -1.87 113.55 120.08 1h9c h SER 81 Ca -0.45 0.02 -0.28 0.00 -0.84 0.00 0.00 61.79 60.24 1h9c h SER 81 Cb 1.22 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 63.66 1h9c h SER 81 CO 0.95 0.36 -1.21 0.25 -1.14 0.00 0.00 176.83 176.03 1h9c h LEU 82 N 0.67 0.57 -1.42 5.07 5.85 -1.99 -1.89 115.31 122.17 1h9c h LEU 82 Ca 0.35 -0.56 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 1h9c h LEU 82 Cb 0.47 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1h9c h LEU 82 CO -0.13 1.41 0.33 -0.07 -0.34 0.00 0.00 178.44 179.64 1h9c h LEU 83 N 0.15 0.63 -0.55 2.25 3.38 -1.87 -0.21 115.31 119.09 1h9c h LEU 83 Ca -0.15 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.67 1h9c h LEU 83 Cb 1.91 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.49 1h9c h LEU 83 CO 0.21 0.48 -0.19 0.22 0.09 0.00 0.00 178.44 179.25 1h9c h TYR 84 N 0.73 1.10 -0.16 1.13 5.03 -1.30 -1.01 116.97 122.49 1h9c h TYR 84 Ca 0.19 -0.25 -0.02 0.00 2.58 0.00 0.00 58.73 61.24 1h9c h TYR 84 Cb -0.04 -0.26 -0.01 0.00 1.55 0.00 0.00 36.73 37.97 1h9c h TYR 84 CO 0.00 1.06 0.04 0.78 -1.32 0.00 0.00 178.16 178.72 1h9c h GLY 85 N 0.91 0.28 2.00 1.82 0.00 -0.80 -2.73 103.07 104.55 1h9c h GLY 85 Ca 0.12 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 1h9c h GLY 85 CO 0.06 0.16 -0.13 0.50 0.00 0.00 0.00 176.54 177.13 1h9c h LYS 86 N 0.07 0.00 -5.91 4.80 1.57 -1.05 -3.47 116.57 112.58 1h9c h LYS 86 Ca 0.05 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.51 1h9c h LYS 86 Cb 0.26 0.00 0.10 0.00 0.08 0.00 0.00 32.23 32.67 1h9c h LYS 86 CO 0.00 0.13 -0.79 0.28 -0.57 0.00 0.00 179.45 178.50 1h9c n VAL 87 N -4.18 -7.32 -3.35 0.50 0.31 -0.45 -4.96 118.33 98.89 1h9c n VAL 87 Ca -0.02 -0.90 -0.46 0.00 -0.01 0.00 0.00 64.34 62.94 1h9c n VAL 87 Cb 0.21 -5.28 -0.03 0.00 -0.91 0.00 0.00 33.84 27.82 1h9c n VAL 87 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1h9c s ASP 88 N -3.34 6.55 0.30 4.52 2.15 -0.82 -4.92 116.67 121.13 1h9c s ASP 88 Ca 0.37 -2.50 -0.01 0.00 0.43 0.00 0.00 52.55 50.83 1h9c s ASP 88 Cb -0.10 -2.19 0.47 0.00 -0.30 0.00 0.00 42.92 40.80 1h9c s ASP 88 CO 0.81 -0.62 1.97 1.23 -0.17 0.00 0.00 175.17 178.38 1h9c h GLY 89 N 7.98 1.16 1.11 2.66 0.00 -1.87 -1.77 103.07 112.35 1h9c h GLY 89 Ca 0.01 -0.42 -0.19 0.00 0.00 0.00 0.00 47.33 46.73 1h9c h GLY 89 CO 0.81 0.40 -0.57 -2.00 0.00 0.00 0.00 176.54 175.19 1h9c h LEU 90 N 1.09 0.93 -0.45 3.11 5.85 -1.91 -1.01 115.31 122.91 1h9c h LEU 90 Ca 0.31 -0.56 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 1h9c h LEU 90 Cb -0.09 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.65 1h9c h LEU 90 CO -0.07 1.31 0.28 1.23 -0.34 0.00 0.00 178.44 180.85 1h9c h GLY 91 N 0.58 0.65 1.78 3.75 0.00 -1.92 -1.45 103.07 106.45 1h9c h GLY 91 Ca -0.00 -0.26 -0.16 0.00 0.00 0.00 0.00 47.33 46.91 1h9c h GLY 91 CO 0.12 0.26 -0.68 -2.08 0.00 0.00 0.00 176.54 174.16 1h9c h VAL 92 N 0.60 1.42 -0.45 4.60 2.07 -1.34 -1.83 116.25 121.32 1h9c h VAL 92 Ca 0.16 -2.17 -0.02 0.00 0.82 0.00 0.00 66.70 65.49 1h9c h VAL 92 Cb -0.02 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1h9c h VAL 92 CO -0.03 0.64 0.21 0.25 0.02 0.00 0.00 177.57 178.65 1h9c h LEU 93 N 0.15 0.59 -1.04 2.57 6.46 -0.95 0.04 115.31 123.12 1h9c h LEU 93 Ca -0.02 -0.14 -0.09 0.00 -0.12 0.00 0.00 57.88 57.52 1h9c h LEU 93 Cb 1.22 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.99 1h9c h LEU 93 CO 0.10 0.56 -0.24 0.11 -0.62 0.00 0.00 178.44 178.36 1h9c h LYS 94 N 0.58 0.40 -0.09 1.25 1.57 -1.14 -0.93 116.57 118.21 1h9c h LYS 94 Ca 0.15 -0.14 -0.17 0.00 -1.87 0.00 0.00 60.65 58.62 1h9c h LYS 94 Cb 0.14 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1h9c h LYS 94 CO -0.02 0.61 -0.67 0.00 -0.57 0.00 0.00 179.45 178.81 1h9c h ALA 95 N 1.40 0.69 -0.25 3.86 0.00 -1.02 -0.48 119.26 123.47 1h9c h ALA 95 Ca 0.06 -0.58 -0.12 0.00 0.00 0.00 0.00 54.91 54.27 1h9c h ALA 95 Cb 0.61 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1h9c h ALA 95 CO 0.04 0.75 -0.30 0.00 0.00 0.00 0.00 179.25 179.74 1h9c h ALA 96 N 1.03 0.37 -0.45 0.00 0.00 -0.76 -1.40 119.26 118.05 1h9c h ALA 96 Ca -0.02 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 1h9c h ALA 96 Cb 1.21 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1h9c h ALA 96 CO 0.11 0.40 -0.01 0.28 0.00 0.00 0.00 179.25 180.02 1h9c h VAL 97 N 0.36 1.24 -0.37 0.00 2.07 -1.17 -1.89 116.25 116.48 1h9c h VAL 97 Ca 0.03 -0.99 -0.08 0.00 0.82 0.00 0.00 66.70 66.48 1h9c h VAL 97 Cb 0.87 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 1h9c h VAL 97 CO 0.07 0.35 -0.10 0.00 0.02 0.00 0.00 177.57 177.91 1h9c h ALA 98 N 1.29 1.14 -0.15 1.67 0.00 -0.85 0.00 119.26 122.37 1h9c h ALA 98 Ca 0.14 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 1h9c h ALA 98 Cb 0.45 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1h9c h ALA 98 CO 0.02 0.54 -0.51 0.00 0.00 0.00 0.00 179.25 179.30 1h9c h ALA 99 N 1.31 0.85 -0.22 0.00 0.00 -0.73 -0.05 119.26 120.42 1h9c h ALA 99 Ca 0.11 -0.49 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 1h9c h ALA 99 Cb 0.51 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1h9c h ALA 99 CO 0.03 0.67 -0.27 0.82 0.00 0.00 0.00 179.25 180.50 1h9c h ILE 100 N 0.32 1.32 -0.82 0.00 2.04 -1.11 -1.51 117.51 117.74 1h9c h ILE 100 Ca 0.01 -1.45 0.00 0.00 1.00 0.00 0.00 64.86 64.42 1h9c h ILE 100 Cb 1.01 1.74 -0.04 0.00 -0.74 0.00 0.00 36.82 38.79 1h9c h ILE 100 CO 0.09 0.45 0.52 0.11 0.00 0.00 0.00 178.15 179.32 1h9c h LYS 101 N 0.27 1.10 -0.49 2.37 1.57 -0.86 -0.76 116.57 119.78 1h9c h LYS 101 Ca 0.03 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1h9c h LYS 101 Cb 0.84 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 1h9c h LYS 101 CO 0.06 0.75 -0.01 -0.22 -0.57 0.00 0.00 179.45 179.46 1h9c h LYS 102 N 1.12 0.87 -0.73 3.15 3.64 -0.90 0.13 116.57 123.84 1h9c h LYS 102 Ca 0.30 -0.28 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 1h9c h LYS 102 Cb -0.09 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 1h9c h LYS 102 CO -0.06 0.91 0.33 0.00 -2.27 0.00 0.00 179.45 178.36 1h9c h ALA 103 N 0.92 0.95 -0.38 5.00 0.00 -1.13 -2.87 119.26 121.75 1h9c h ALA 103 Ca 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1h9c h ALA 103 Cb 0.53 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1h9c h ALA 103 CO 0.03 0.53 0.18 0.00 0.00 0.00 0.00 179.25 179.98 1h9c h ALA 104 N 1.16 0.50 0.00 0.00 0.00 -0.83 -3.48 119.26 116.61 1h9c h ALA 104 Ca 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1h9c h ALA 104 Cb 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1h9c h ALA 104 CO -0.03 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.29 1h9c n ALA 105 N -2.28 0.00 -1.51 0.00 0.00 0.00 -5.10 120.51 111.63 1h9c n ALA 105 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1h9c n ALA 105 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.57 1h9c n ALA 105 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59