#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y9a s LYS 2 N 0.00 3.41 0.05 3.17 -2.85 -1.26 -0.87 119.74 121.40 1y9a s LYS 2 Ca 0.00 -0.47 -0.20 0.00 -1.00 0.00 0.00 55.97 54.30 1y9a s LYS 2 Cb 0.00 -3.02 0.05 0.00 -2.06 0.00 0.00 37.83 32.80 1y9a s LYS 2 CO 0.00 0.60 0.47 0.20 0.10 0.00 0.00 175.35 176.72 1y9a s GLY 3 N -2.57 -0.36 -0.22 0.59 0.00 -0.73 -2.27 107.32 101.76 1y9a s GLY 3 Ca 0.35 0.44 -0.13 0.00 0.00 0.00 0.00 44.72 45.38 1y9a s GLY 3 CO 0.28 0.16 0.26 -2.27 0.00 0.00 0.00 173.10 171.53 1y9a s LEU 4 N -2.06 4.14 0.12 0.66 2.96 -0.35 -1.24 118.68 122.91 1y9a s LEU 4 Ca -0.05 0.30 0.07 0.00 -0.22 0.00 0.00 54.13 54.23 1y9a s LEU 4 Cb -0.01 -2.28 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 1y9a s LEU 4 CO -0.03 0.02 -0.16 0.00 -1.32 0.00 0.00 176.35 174.86 1y9a s ALA 5 N 1.08 1.62 -0.06 5.97 0.00 0.01 -0.62 121.76 129.77 1y9a s ALA 5 Ca 0.13 -1.30 -0.30 0.00 0.00 0.00 0.00 51.96 50.49 1y9a s ALA 5 Cb -0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 1y9a s ALA 5 CO 0.05 0.18 1.05 1.41 0.00 0.00 0.00 175.76 178.45 1y9a s MET 6 N -2.47 4.44 -0.73 0.00 1.75 -0.06 -1.48 119.30 120.76 1y9a s MET 6 Ca 0.09 1.47 0.02 0.00 -1.25 0.00 0.00 55.69 56.02 1y9a s MET 6 Cb -0.06 -3.51 0.35 0.00 2.84 0.00 0.00 34.83 34.44 1y9a s MET 6 CO 0.04 -0.27 1.40 1.28 -0.65 0.00 0.00 175.02 176.82 1y9a n LEU 7 N 4.71 5.85 0.00 4.11 4.77 0.14 -0.42 117.00 136.16 1y9a n LEU 7 Ca 0.08 -5.38 0.00 0.00 -0.03 0.00 0.00 56.01 50.68 1y9a n LEU 7 Cb 0.49 -0.80 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 1y9a n LEU 7 CO 0.53 2.16 0.00 0.61 -1.33 0.00 0.00 177.39 179.35 1y9a n GLY 8 N -0.28 -1.72 3.66 -0.72 0.00 0.08 -4.58 105.19 101.63 1y9a n GLY 8 Ca 0.41 -1.54 -0.48 0.00 0.00 0.00 0.00 46.02 44.41 1y9a n GLY 8 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1y9a n ILE 9 N -1.45 0.09 -0.61 -0.61 2.08 -1.26 -1.92 119.36 115.67 1y9a n ILE 9 Ca 0.00 -0.02 0.00 0.00 0.56 0.00 0.00 62.75 63.29 1y9a n ILE 9 Cb 0.00 -1.44 0.00 0.00 -0.75 0.00 0.00 39.64 37.45 1y9a n ILE 9 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1y9a n GLY 10 N 3.41 0.74 2.97 7.39 0.00 0.17 -4.99 105.19 114.88 1y9a n GLY 10 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 1y9a n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1y9a s ARG 11 N -0.39 0.12 0.20 1.61 3.00 -0.81 -4.97 118.95 117.71 1y9a s ARG 11 Ca 0.00 0.25 0.09 0.00 0.00 0.00 0.00 55.73 56.07 1y9a s ARG 11 Cb 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 34.95 34.87 1y9a s ARG 11 CO 0.00 -0.08 -0.18 0.96 0.00 0.00 0.00 175.30 176.00 1y9a s ILE 12 N 0.52 1.98 -0.00 1.52 -4.36 -1.26 0.23 121.20 119.82 1y9a s ILE 12 Ca -0.04 -2.08 -0.30 0.00 -0.26 0.00 0.00 60.65 57.97 1y9a s ILE 12 Cb -0.05 -2.00 0.11 0.00 1.25 0.00 0.00 42.46 41.77 1y9a s ILE 12 CO -0.02 -0.37 1.17 -0.83 0.24 0.00 0.00 174.94 175.12 1y9a s GLY 13 N -2.96 -0.35 0.19 6.27 0.00 -0.55 -4.88 107.32 105.04 1y9a s GLY 13 Ca 0.20 0.72 -0.26 0.00 0.00 0.00 0.00 44.72 45.39 1y9a s GLY 13 CO 0.08 0.17 0.81 -0.98 0.00 0.00 0.00 173.10 173.19 1y9a s TRP 14 N -2.68 3.90 0.13 1.90 0.52 -1.26 -0.81 118.94 120.63 1y9a s TRP 14 Ca 0.12 1.68 -0.01 0.00 0.02 0.00 0.00 56.10 57.92 1y9a s TRP 14 Cb 0.02 -2.81 -0.04 0.00 -1.15 0.00 0.00 33.47 29.49 1y9a s TRP 14 CO -0.03 0.48 0.04 0.96 0.02 0.00 0.00 176.95 178.42 1y9a s ILE 15 N -1.20 0.17 -0.12 2.03 -4.36 -0.38 -4.96 121.20 112.38 1y9a s ILE 15 Ca 0.38 -1.91 -0.04 0.00 -0.26 0.00 0.00 60.65 58.82 1y9a s ILE 15 Cb -0.23 -2.01 -0.04 0.00 1.25 0.00 0.00 42.46 41.44 1y9a s ILE 15 CO 0.27 -0.51 0.03 -1.61 0.24 0.00 0.00 174.94 173.36 1y9a s GLU 16 N -4.03 3.38 0.05 0.37 0.41 -1.26 -1.77 118.70 115.85 1y9a s GLU 16 Ca 0.23 -0.37 -0.01 0.00 -0.41 0.00 0.00 54.97 54.41 1y9a s GLU 16 Cb 0.07 -2.97 -0.04 0.00 -1.78 0.00 0.00 34.13 29.42 1y9a s GLU 16 CO 0.01 0.55 -0.03 0.15 -0.49 0.00 0.00 175.26 175.45 1y9a s LYS 17 N -0.44 0.56 0.58 1.61 1.02 -0.05 -4.94 119.74 118.08 1y9a s LYS 17 Ca 0.09 -1.09 -0.20 0.00 0.02 0.00 0.00 55.97 54.79 1y9a s LYS 17 Cb -0.12 0.15 -0.04 0.00 -0.52 0.00 0.00 37.83 37.30 1y9a s LYS 17 CO 0.02 -0.09 1.26 0.15 -0.92 0.00 0.00 175.35 175.77 1y9a s LYS 18 N -3.35 2.98 0.18 1.68 1.02 -1.26 -0.21 119.74 120.78 1y9a s LYS 18 Ca 0.02 1.98 -0.31 0.00 0.02 0.00 0.00 55.97 57.68 1y9a s LYS 18 Cb 0.04 -2.03 -0.09 0.00 -0.52 0.00 0.00 37.83 35.23 1y9a s LYS 18 CO -0.08 -1.24 1.45 0.42 -0.92 0.00 0.00 175.35 174.98 1y9a s ILE 19 N -1.47 2.90 0.79 2.17 1.01 -1.26 -4.79 121.20 120.56 1y9a s ILE 19 Ca 0.76 0.69 -0.11 0.00 0.00 0.00 0.00 60.65 61.99 1y9a s ILE 19 Cb -0.34 -3.44 0.07 0.00 0.01 0.00 0.00 42.46 38.76 1y9a s ILE 19 CO 0.38 0.08 1.12 -2.16 0.00 0.00 0.00 174.94 174.36 1y9a s PRO 20 N 0.54 1.99 0.38 2.79 0.04 -1.26 -4.98 135.00 134.50 1y9a s PRO 20 Ca 0.64 1.35 -0.24 0.00 0.04 0.00 0.00 61.00 62.79 1y9a s PRO 20 Cb -0.40 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 1y9a s PRO 20 CO 0.35 -1.87 1.01 -1.21 0.04 0.00 0.00 177.00 175.32 1y9a s GLU 21 N -4.65 4.27 -0.34 4.56 0.41 -1.26 -5.04 118.70 116.66 1y9a s GLU 21 Ca 0.64 1.42 -0.04 0.00 -0.41 0.00 0.00 54.97 56.59 1y9a s GLU 21 Cb -0.20 -2.56 0.06 0.00 -1.78 0.00 0.00 34.13 29.64 1y9a s GLU 21 CO 0.54 -0.03 0.08 0.00 -0.49 0.00 0.00 175.26 175.36 1y9a s GLY 23 N 1.44 1.71 0.45 0.00 0.00 -1.26 -4.83 107.32 104.82 1y9a s GLY 23 Ca -0.01 -1.08 0.12 0.00 0.00 0.00 0.00 44.72 43.75 1y9a s GLY 23 CO -0.00 -0.30 2.05 -0.56 0.00 0.00 0.00 173.10 174.29 1y9a h PRO 24 N -1.86 0.35 -0.13 2.90 0.13 -1.96 -2.42 132.00 129.01 1y9a h PRO 24 Ca -0.45 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1y9a h PRO 24 Cb 1.26 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1y9a h PRO 24 CO 0.39 0.23 0.00 1.28 -0.23 0.00 0.00 178.00 179.67 1y9a n LEU 25 N -4.48 2.95 -4.97 1.56 4.77 -1.26 -0.02 117.00 115.55 1y9a n LEU 25 Ca 0.04 -1.16 -0.22 0.00 -0.03 0.00 0.00 56.01 54.65 1y9a n LEU 25 Cb 0.20 -0.07 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1y9a n LEU 25 CO 0.35 0.55 0.32 -1.81 -1.33 0.00 0.00 177.39 175.46 1y9a s ASP 26 N -1.67 5.52 0.03 -1.43 1.01 -0.91 -0.77 116.67 118.46 1y9a s ASP 26 Ca 0.28 0.08 0.02 0.00 0.71 0.00 0.00 52.55 53.64 1y9a s ASP 26 Cb 0.19 -1.13 -0.02 0.00 1.01 0.00 0.00 42.92 42.97 1y9a s ASP 26 CO 0.27 -0.94 -0.07 0.00 0.21 0.00 0.00 175.17 174.65 1y9a s ALA 27 N -2.65 0.48 -0.11 5.23 0.00 -0.31 -1.50 121.76 122.90 1y9a s ALA 27 Ca 0.53 -0.64 -0.05 0.00 0.00 0.00 0.00 51.96 51.80 1y9a s ALA 27 Cb -0.10 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 1y9a s ALA 27 CO 0.38 -0.02 0.07 -0.51 0.00 0.00 0.00 175.76 175.68 1y9a s LEU 28 N -1.31 3.97 0.01 0.00 1.43 -0.21 -0.94 118.68 121.64 1y9a s LEU 28 Ca -0.09 0.28 0.03 0.00 -1.03 0.00 0.00 54.13 53.32 1y9a s LEU 28 Cb -0.09 -1.95 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 1y9a s LEU 28 CO 0.00 0.37 -0.08 -0.69 0.23 0.00 0.00 176.35 176.18 1y9a s VAL 29 N -0.80 0.62 -0.05 -1.59 1.01 -0.32 -0.79 120.40 118.48 1y9a s VAL 29 Ca 0.13 -0.60 -0.00 0.00 0.00 0.00 0.00 61.98 61.51 1y9a s VAL 29 Cb -0.12 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.66 1y9a s VAL 29 CO 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 175.10 175.11 1y9a s ARG 30 N -0.67 2.87 0.08 2.72 1.70 0.43 -0.70 118.95 125.38 1y9a s ARG 30 Ca -0.01 -0.50 -0.31 0.00 -0.47 0.00 0.00 55.73 54.45 1y9a s ARG 30 Cb -0.05 -2.71 -0.06 0.00 -0.57 0.00 0.00 34.95 31.55 1y9a s ARG 30 CO 0.00 0.67 1.21 -1.25 -1.08 0.00 0.00 175.30 174.85 1y9a s PRO 31 N -1.10 4.44 -0.23 3.89 0.04 -1.26 -0.63 135.00 140.15 1y9a s PRO 31 Ca 0.15 1.80 0.08 0.00 0.04 0.00 0.00 61.00 63.07 1y9a s PRO 31 Cb -0.11 -3.33 -0.20 0.00 0.04 0.00 0.00 34.50 30.89 1y9a s PRO 31 CO 0.05 -0.24 -0.10 1.28 0.04 0.00 0.00 177.00 178.02 1y9a n LEU 32 N 3.76 1.76 -3.78 -3.56 4.77 0.32 -4.66 117.00 115.60 1y9a n LEU 32 Ca 0.08 -0.08 -0.13 0.00 -0.03 0.00 0.00 56.01 55.86 1y9a n LEU 32 Cb 0.46 -0.33 -0.12 0.00 -2.33 0.00 0.00 43.42 41.09 1y9a n LEU 32 CO 0.56 0.76 -0.12 0.00 -1.33 0.00 0.00 177.39 177.26 1y9a s ALA 33 N -2.51 -0.56 0.06 -1.18 0.00 -0.60 -1.07 121.76 115.90 1y9a s ALA 33 Ca -0.25 0.70 0.02 0.00 0.00 0.00 0.00 51.96 52.44 1y9a s ALA 33 Cb 0.08 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.75 1y9a s ALA 33 CO 0.69 -0.12 -0.08 -0.51 0.00 0.00 0.00 175.76 175.74 1y9a s LEU 34 N 0.32 2.31 0.02 0.00 1.43 0.09 -1.28 118.68 121.57 1y9a s LEU 34 Ca -0.02 -0.65 0.00 0.00 -1.03 0.00 0.00 54.13 52.44 1y9a s LEU 34 Cb -0.03 -0.17 -0.01 0.00 0.03 0.00 0.00 46.19 46.00 1y9a s LEU 34 CO -0.01 -0.25 -0.03 0.00 0.23 0.00 0.00 176.35 176.29 1y9a s ALA 35 N -1.84 0.16 0.45 4.21 0.00 -0.90 -0.74 121.76 123.10 1y9a s ALA 35 Ca -0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 51.96 51.48 1y9a s ALA 35 Cb -0.07 0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 1y9a s ALA 35 CO -0.00 -0.08 0.70 -1.25 0.00 0.00 0.00 175.76 175.13 1y9a s PRO 36 N -0.95 3.31 0.00 0.00 0.04 -1.26 -4.24 135.00 131.90 1y9a s PRO 36 Ca -0.09 -0.18 0.02 0.00 0.04 0.00 0.00 61.00 60.79 1y9a s PRO 36 Cb -0.06 -2.50 -0.01 0.00 0.04 0.00 0.00 34.50 31.97 1y9a s PRO 36 CO -0.00 -0.18 -0.08 0.00 0.04 0.00 0.00 177.00 176.77 1y9a h THR 38 N 4.90 0.51 -0.64 0.00 1.35 -1.97 -1.56 112.91 115.49 1y9a h THR 38 Ca -0.30 0.00 0.12 0.00 -0.55 0.00 0.00 66.41 65.67 1y9a h THR 38 Cb 1.19 0.98 -0.09 0.00 -1.73 0.00 0.00 68.15 68.50 1y9a h THR 38 CO 0.49 0.00 0.19 0.28 -0.25 0.00 0.00 175.52 176.22 1y9a h SER 39 N 0.00 0.11 0.18 5.36 0.02 -1.97 -1.64 113.55 115.61 1y9a h SER 39 Ca 0.01 0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1y9a h SER 39 Cb 0.07 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1y9a h SER 39 CO -0.00 0.05 -0.17 0.44 -1.14 0.00 0.00 176.83 176.02 1y9a h ASP 40 N 0.33 0.00 -0.46 3.07 3.32 -1.66 -1.13 116.42 119.88 1y9a h ASP 40 Ca 0.34 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.40 1y9a h ASP 40 Cb 0.49 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.02 1y9a h ASP 40 CO -0.39 0.17 0.29 0.74 -1.72 0.00 0.00 179.24 178.33 1y9a h THR 41 N 0.00 1.09 -0.29 0.35 2.02 -1.36 0.12 112.91 114.84 1y9a h THR 41 Ca -0.00 -0.20 -0.17 0.00 0.77 0.00 0.00 66.41 66.80 1y9a h THR 41 Cb 0.30 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 67.15 1y9a h THR 41 CO 0.02 0.11 -0.50 0.45 0.37 0.00 0.00 175.52 175.97 1y9a h HIS 42 N 0.60 1.00 0.27 3.16 3.86 -0.69 -2.14 115.15 121.22 1y9a h HIS 42 Ca 0.18 -0.34 -0.01 0.00 -1.16 0.00 0.00 60.37 59.04 1y9a h HIS 42 Cb -0.04 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.24 1y9a h HIS 42 CO -0.05 1.14 -0.13 1.15 0.86 0.00 0.00 177.93 180.89 1y9a h THR 43 N 0.63 0.76 0.59 2.45 2.02 -1.05 -1.64 112.91 116.67 1y9a h THR 43 Ca 0.03 -0.58 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 1y9a h THR 43 Cb 1.08 1.07 0.01 0.00 -1.74 0.00 0.00 68.15 68.57 1y9a h THR 43 CO 0.11 0.12 -0.28 0.58 0.37 0.00 0.00 175.52 176.41 1y9a h VAL 44 N -0.69 0.00 0.00 3.16 2.07 -0.83 -2.89 116.25 117.06 1y9a h VAL 44 Ca -0.04 -0.08 -0.07 0.00 0.82 0.00 0.00 66.70 67.33 1y9a h VAL 44 Cb 0.48 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 1y9a h VAL 44 CO 0.06 0.00 -0.99 -0.50 0.02 0.00 0.00 177.57 176.16 1y9a h TRP 45 N -0.87 0.00 0.00 1.57 6.55 -1.50 0.50 115.95 122.20 1y9a h TRP 45 Ca -0.08 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.76 1y9a h TRP 45 Cb 0.61 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.91 1y9a h TRP 45 CO 0.07 0.27 -0.97 0.00 -1.05 0.00 0.00 178.44 176.76 1y9a n ALA 46 N -2.26 4.47 -3.39 1.49 0.00 -0.67 -4.64 120.51 115.51 1y9a n ALA 46 Ca -0.03 -0.55 -0.24 0.00 0.00 0.00 0.00 53.44 52.62 1y9a n ALA 46 Cb 0.68 -0.71 0.05 0.00 0.00 0.00 0.00 19.45 19.47 1y9a n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y9a n GLY 47 N 1.46 -0.53 0.23 0.00 0.00 -0.90 -4.90 105.19 100.54 1y9a n GLY 47 Ca 0.03 0.19 0.06 0.00 0.00 0.00 0.00 46.02 46.31 1y9a n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y9a h ALA 48 N 1.01 1.68 0.00 4.61 0.00 -1.56 -2.68 119.26 122.31 1y9a h ALA 48 Ca -0.55 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.20 1y9a h ALA 48 Cb 1.37 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 1y9a h ALA 48 CO 0.58 0.21 -0.34 0.44 0.00 0.00 0.00 179.25 180.14 1y9a n ILE 49 N -4.28 1.96 0.00 0.00 -5.35 -1.26 -4.95 119.36 105.48 1y9a n ILE 49 Ca -0.02 -2.73 0.00 0.00 -0.27 0.00 0.00 62.75 59.72 1y9a n ILE 49 Cb 0.24 -0.18 0.00 0.00 -1.74 0.00 0.00 39.64 37.96 1y9a n ILE 49 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1y9a n GLY 50 N -1.15 0.22 3.82 3.28 0.00 -1.01 -5.01 105.19 105.35 1y9a n GLY 50 Ca 0.17 -1.93 -0.33 0.00 0.00 0.00 0.00 46.02 43.93 1y9a n GLY 50 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1y9a s ASP 51 N -0.82 6.62 -0.02 1.61 2.15 -1.26 -4.84 116.67 120.12 1y9a s ASP 51 Ca 0.00 1.73 -0.08 0.00 0.43 0.00 0.00 52.55 54.63 1y9a s ASP 51 Cb 0.00 -2.54 0.01 0.00 -0.30 0.00 0.00 42.92 40.09 1y9a s ASP 51 CO 0.00 -0.58 0.18 -0.13 -0.17 0.00 0.00 175.17 174.46 1y9a s ARG 52 N -3.49 0.43 -0.05 4.34 1.81 -1.26 -5.05 118.95 115.68 1y9a s ARG 52 Ca 0.63 -0.18 0.02 0.00 -1.72 0.00 0.00 55.73 54.48 1y9a s ARG 52 Cb -0.12 0.19 0.01 0.00 -0.45 0.00 0.00 34.95 34.58 1y9a s ARG 52 CO 0.21 -0.10 -0.09 -1.01 -0.68 0.00 0.00 175.30 173.63 1y9a s HIS 53 N -0.94 1.13 -1.80 -0.53 3.76 -1.26 -0.74 115.29 114.90 1y9a s HIS 53 Ca -0.10 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.45 1y9a s HIS 53 Cb -0.05 -0.85 0.00 0.00 1.11 0.00 0.00 32.58 32.78 1y9a s HIS 53 CO 0.02 -0.20 0.00 -0.25 -0.85 0.00 0.00 174.74 173.45 1y9a n ASP 54 N 3.74 -5.72 -4.63 1.40 8.00 0.44 -4.94 116.55 114.85 1y9a n ASP 54 Ca -0.23 0.07 -0.40 0.00 0.71 0.00 0.00 54.79 54.95 1y9a n ASP 54 Cb 0.52 -4.78 -0.07 0.00 -0.02 0.00 0.00 41.12 36.76 1y9a n ASP 54 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1y9a s MET 55 N -4.79 4.10 0.30 -1.24 1.75 -1.18 -4.90 119.30 113.33 1y9a s MET 55 Ca 0.00 0.32 -0.29 0.00 -1.25 0.00 0.00 55.69 54.47 1y9a s MET 55 Cb 0.00 -3.63 -0.10 0.00 2.84 0.00 0.00 34.83 33.94 1y9a s MET 55 CO 0.00 -0.29 1.35 0.42 -0.65 0.00 0.00 175.02 175.85 1y9a s ILE 56 N 2.10 2.72 0.65 10.11 1.01 -1.26 -0.88 121.20 135.65 1y9a s ILE 56 Ca 0.21 0.67 -0.02 0.00 0.00 0.00 0.00 60.65 61.52 1y9a s ILE 56 Cb -0.16 -3.43 0.08 0.00 0.01 0.00 0.00 42.46 38.96 1y9a s ILE 56 CO 0.09 0.14 0.92 -0.76 0.00 0.00 0.00 174.94 175.33 1y9a s LEU 57 N -1.24 3.06 0.00 2.97 1.43 0.21 0.35 118.68 125.45 1y9a s LEU 57 Ca 0.53 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.61 1y9a s LEU 57 Cb -0.40 -2.61 0.00 0.00 0.03 0.00 0.00 46.19 43.21 1y9a s LEU 57 CO 0.49 -1.53 0.00 0.61 0.23 0.00 0.00 176.35 176.15 1y9a n GLY 58 N -2.68 0.86 1.28 -3.19 0.00 -1.26 -0.97 105.19 99.23 1y9a n GLY 58 Ca 0.11 -1.49 -0.01 0.00 0.00 0.00 0.00 46.02 44.63 1y9a n GLY 58 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1y9a n HIS 59 N 1.24 0.00 -3.75 1.61 1.44 -1.26 -1.80 115.22 112.70 1y9a n HIS 59 Ca 0.00 -0.50 -0.28 0.00 -2.01 0.00 0.00 57.72 54.94 1y9a n HIS 59 Cb 0.00 0.13 -0.16 0.00 0.12 0.00 0.00 29.99 30.07 1y9a n HIS 59 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1y9a s GLU 60 N 0.00 0.73 -0.13 -1.40 2.02 -1.26 -3.71 118.70 114.95 1y9a s GLU 60 Ca 0.19 -0.45 -0.13 0.00 0.02 0.00 0.00 54.97 54.60 1y9a s GLU 60 Cb 0.22 -2.12 0.04 0.00 0.10 0.00 0.00 34.13 32.36 1y9a s GLU 60 CO -0.10 -0.63 0.38 0.00 0.02 0.00 0.00 175.26 174.93 1y9a s ALA 61 N 1.83 -0.93 -0.13 5.21 0.00 -1.26 -2.12 121.76 124.35 1y9a s ALA 61 Ca -0.01 1.02 -0.06 0.00 0.00 0.00 0.00 51.96 52.91 1y9a s ALA 61 Cb -0.17 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.34 1y9a s ALA 61 CO -0.08 -0.19 0.08 0.08 0.00 0.00 0.00 175.76 175.66 1y9a s VAL 62 N 0.08 5.01 0.34 0.00 1.01 -0.40 -2.00 120.40 124.43 1y9a s VAL 62 Ca -0.01 0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.05 1y9a s VAL 62 Cb -0.03 -3.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 1y9a s VAL 62 CO 0.01 0.56 0.34 0.61 0.00 0.00 0.00 175.10 176.62 1y9a n GLY 63 N 2.52 2.71 2.97 4.51 0.00 0.11 -0.53 105.19 117.48 1y9a n GLY 63 Ca -0.18 -1.84 -0.21 0.00 0.00 0.00 0.00 46.02 43.79 1y9a n GLY 63 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1y9a s GLN 64 N -3.26 0.99 0.11 1.61 0.74 0.20 -0.30 119.66 119.75 1y9a s GLN 64 Ca 0.38 -0.26 -0.31 0.00 0.05 0.00 0.00 55.36 55.23 1y9a s GLN 64 Cb 0.01 -0.92 -0.07 0.00 1.10 0.00 0.00 33.01 33.13 1y9a s GLN 64 CO 0.27 0.05 1.32 0.42 -0.55 0.00 0.00 175.29 176.80 1y9a s ILE 65 N 0.44 3.52 -0.13 -2.34 -1.09 0.20 -0.43 121.20 121.37 1y9a s ILE 65 Ca -0.07 1.11 0.10 0.00 -2.23 0.00 0.00 60.65 59.55 1y9a s ILE 65 Cb -0.11 -3.71 -0.14 0.00 -1.58 0.00 0.00 42.46 36.93 1y9a s ILE 65 CO 0.01 0.09 0.26 1.33 -1.23 0.00 0.00 174.94 175.41 1y9a n VAL 66 N 3.81 0.00 -3.63 2.92 0.24 0.03 -0.86 118.33 120.85 1y9a n VAL 66 Ca 0.10 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.34 62.02 1y9a n VAL 66 Cb 0.44 0.48 -0.07 0.00 -1.47 0.00 0.00 33.84 33.21 1y9a n VAL 66 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1y9a s LYS 67 N -2.45 0.83 0.11 7.34 2.20 -1.13 -4.93 119.74 121.70 1y9a s LYS 67 Ca -0.02 0.70 0.07 0.00 -0.36 0.00 0.00 55.97 56.36 1y9a s LYS 67 Cb 0.06 0.40 -0.04 0.00 -1.51 0.00 0.00 37.83 36.75 1y9a s LYS 67 CO 0.40 -0.15 -0.18 0.14 -0.36 0.00 0.00 175.35 175.19 1y9a s VAL 68 N -0.10 1.55 0.80 4.02 -7.23 -1.26 -1.04 120.40 117.14 1y9a s VAL 68 Ca -0.03 -1.57 -0.12 0.00 -1.81 0.00 0.00 61.98 58.45 1y9a s VAL 68 Cb -0.03 -1.49 0.07 0.00 0.56 0.00 0.00 36.38 35.48 1y9a s VAL 68 CO 0.03 -0.18 1.11 -0.83 -0.31 0.00 0.00 175.10 174.92 1y9a s GLY 69 N -2.05 1.62 0.54 2.32 0.00 -0.56 -4.94 107.32 104.24 1y9a s GLY 69 Ca 0.06 -0.30 0.36 0.00 0.00 0.00 0.00 44.72 44.84 1y9a s GLY 69 CO 0.04 0.14 2.08 1.48 0.00 0.00 0.00 173.10 176.84 1y9a h SER 70 N -1.07 0.00 -0.36 1.64 4.64 -1.76 -1.62 113.55 115.02 1y9a h SER 70 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1y9a h SER 70 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1y9a h SER 70 CO 0.61 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.75 1y9a n LEU 71 N -2.89 3.04 -4.68 5.97 4.77 0.97 -4.94 117.00 119.24 1y9a n LEU 71 Ca -0.01 -1.71 -0.43 0.00 -0.03 0.00 0.00 56.01 53.84 1y9a n LEU 71 Cb 0.16 -0.23 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 1y9a n LEU 71 CO 0.21 0.71 0.83 -0.69 -1.33 0.00 0.00 177.39 177.12 1y9a s VAL 72 N -1.10 4.72 -0.02 4.08 1.01 -0.61 -4.87 120.40 123.61 1y9a s VAL 72 Ca 0.29 2.01 0.08 0.00 0.00 0.00 0.00 61.98 64.36 1y9a s VAL 72 Cb 0.16 -4.29 -0.13 0.00 0.00 0.00 0.00 36.38 32.13 1y9a s VAL 72 CO 0.22 -0.04 0.18 0.29 0.00 0.00 0.00 175.10 175.75 1y9a n LYS 73 N 5.32 0.35 0.00 2.72 4.76 -1.26 -4.71 118.16 125.34 1y9a n LYS 73 Ca 0.10 -0.07 0.08 0.00 -2.87 0.00 0.00 58.31 55.54 1y9a n LYS 73 Cb 0.48 -1.19 -0.04 0.00 -1.84 0.00 0.00 35.03 32.44 1y9a n LYS 73 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1y9a n ARG 74 N -1.77 1.64 -4.22 1.97 1.74 -1.26 -4.99 116.66 109.78 1y9a n ARG 74 Ca -0.01 -0.45 -0.18 0.00 -0.77 0.00 0.00 57.85 56.44 1y9a n ARG 74 Cb 0.21 -1.28 -0.11 0.00 -1.02 0.00 0.00 32.46 30.25 1y9a n ARG 74 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1y9a s LEU 75 N -2.41 2.37 0.08 0.55 1.43 -1.26 -5.09 118.68 114.35 1y9a s LEU 75 Ca 0.10 -0.77 -0.05 0.00 -1.03 0.00 0.00 54.13 52.39 1y9a s LEU 75 Cb 0.13 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.82 1y9a s LEU 75 CO 0.54 -0.15 0.09 -1.59 0.23 0.00 0.00 176.35 175.47 1y9a s LYS 76 N -2.48 0.76 0.16 1.70 -2.85 -1.26 -4.99 119.74 110.78 1y9a s LYS 76 Ca 0.06 -1.12 -0.34 0.00 -1.00 0.00 0.00 55.97 53.57 1y9a s LYS 76 Cb -0.06 0.28 -0.16 0.00 -2.06 0.00 0.00 37.83 35.83 1y9a s LYS 76 CO 0.02 -0.20 1.24 0.28 0.10 0.00 0.00 175.35 176.79 1y9a n VAL 77 N 0.00 0.65 0.00 1.79 0.31 -1.26 -1.69 118.33 118.13 1y9a n VAL 77 Ca -0.13 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1y9a n VAL 77 Cb 0.62 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 32.63 1y9a n VAL 77 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1y9a n GLY 78 N 2.20 2.88 3.66 2.92 0.00 -0.04 -4.33 105.19 112.49 1y9a n GLY 78 Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 1y9a n GLY 78 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1y9a n ASP 79 N 0.00 2.40 -4.80 1.61 8.00 -0.68 -4.61 116.55 118.47 1y9a n ASP 79 Ca 0.00 1.18 -0.36 0.00 0.71 0.00 0.00 54.79 56.32 1y9a n ASP 79 Cb 0.00 -1.41 -0.07 0.00 -0.02 0.00 0.00 41.12 39.61 1y9a n ASP 79 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1y9a s LYS 80 N -1.25 3.72 0.04 -1.24 1.02 -1.26 -0.63 119.74 120.14 1y9a s LYS 80 Ca 0.61 -0.20 0.02 0.00 0.02 0.00 0.00 55.97 56.43 1y9a s LYS 80 Cb -0.64 -3.25 -0.02 0.00 -0.52 0.00 0.00 37.83 33.40 1y9a s LYS 80 CO 0.57 0.57 -0.08 0.14 -0.92 0.00 0.00 175.35 175.63 1y9a s VAL 81 N -0.42 0.59 -0.25 3.17 -7.23 0.59 -1.20 120.40 115.65 1y9a s VAL 81 Ca 0.11 -1.09 -0.18 0.00 -1.81 0.00 0.00 61.98 59.02 1y9a s VAL 81 Cb -0.12 -0.64 -0.03 0.00 0.56 0.00 0.00 36.38 36.15 1y9a s VAL 81 CO 0.01 -0.36 0.50 -0.63 -0.31 0.00 0.00 175.10 174.31 1y9a s ILE 82 N -1.36 5.09 -0.34 -0.62 1.01 0.14 -0.72 121.20 124.40 1y9a s ILE 82 Ca -0.09 0.86 -0.15 0.00 0.00 0.00 0.00 60.65 61.27 1y9a s ILE 82 Cb -0.10 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.54 1y9a s ILE 82 CO 0.01 0.11 0.36 -0.69 0.00 0.00 0.00 174.94 174.73 1y9a s VAL 83 N 2.13 5.17 0.47 2.92 1.01 -0.85 -2.75 120.40 128.50 1y9a s VAL 83 Ca 0.21 0.06 -0.22 0.00 0.00 0.00 0.00 61.98 62.02 1y9a s VAL 83 Cb -0.16 -3.82 -0.07 0.00 0.00 0.00 0.00 36.38 32.33 1y9a s VAL 83 CO 0.09 -0.08 1.14 -2.16 0.00 0.00 0.00 175.10 174.08 1y9a s PRO 84 N 2.01 3.74 0.36 2.72 0.04 -1.26 -4.20 135.00 138.41 1y9a s PRO 84 Ca 0.12 1.69 0.04 0.00 0.04 0.00 0.00 61.00 62.89 1y9a s PRO 84 Cb -0.17 -2.33 0.67 0.00 0.04 0.00 0.00 34.50 32.71 1y9a s PRO 84 CO 0.12 -0.55 1.95 0.00 0.04 0.00 0.00 177.00 178.56 1y9a h ALA 85 N 1.93 1.49 -3.10 8.56 0.00 -1.34 -3.40 119.26 123.40 1y9a h ALA 85 Ca -0.49 -0.12 -0.62 0.00 0.00 0.00 0.00 54.91 53.68 1y9a h ALA 85 Cb 1.24 -0.18 -0.15 0.00 0.00 0.00 0.00 17.79 18.71 1y9a h ALA 85 CO 0.60 0.39 -0.51 0.42 0.00 0.00 0.00 179.25 180.15 1y9a s ILE 86 N -5.29 5.27 -0.56 0.00 1.09 -1.26 -4.28 121.20 116.18 1y9a s ILE 86 Ca -0.08 0.15 0.05 0.00 -1.10 0.00 0.00 60.65 59.66 1y9a s ILE 86 Cb 0.16 -3.45 0.19 0.00 -1.06 0.00 0.00 42.46 38.30 1y9a s ILE 86 CO 0.76 0.35 0.46 0.35 -0.10 0.00 0.00 174.94 176.77 1y9a n THR 87 N 4.25 0.39 -0.89 2.92 -2.24 0.06 -2.14 114.28 116.64 1y9a n THR 87 Ca -0.15 -4.27 -0.31 0.00 -2.27 0.00 0.00 64.05 57.05 1y9a n THR 87 Cb 0.52 -1.95 0.14 0.00 -2.10 0.00 0.00 70.33 66.94 1y9a n THR 87 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 1y9a s PRO 88 N -0.96 1.39 -0.73 -0.78 0.02 -1.26 -4.84 135.00 127.84 1y9a s PRO 88 Ca 0.31 1.49 -0.21 0.00 0.02 0.00 0.00 61.00 62.60 1y9a s PRO 88 Cb 0.03 -1.77 0.09 0.00 0.02 0.00 0.00 34.50 32.87 1y9a s PRO 88 CO -0.16 -2.35 0.99 -0.51 -0.33 0.00 0.00 177.00 174.64 1y9a s ASP 89 N -2.77 6.30 0.56 2.53 1.01 -1.26 -4.83 116.67 118.21 1y9a s ASP 89 Ca 0.66 -1.32 0.35 0.00 0.71 0.00 0.00 52.55 52.95 1y9a s ASP 89 Cb -0.22 -2.40 1.51 0.00 1.01 0.00 0.00 42.92 42.81 1y9a s ASP 89 CO 0.56 -1.31 2.03 -0.50 0.21 0.00 0.00 175.17 176.17 1y9a h TRP 90 N 9.34 0.00 -0.02 4.23 4.06 -1.93 -2.66 115.95 128.97 1y9a h TRP 90 Ca -0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.79 1y9a h TRP 90 Cb 1.06 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.22 1y9a h TRP 90 CO 1.01 0.00 -0.11 0.41 -3.56 0.00 0.00 178.44 176.19 1y9a n GLY 91 N -0.11 0.35 3.73 1.49 0.00 -1.26 -4.42 105.19 104.98 1y9a n GLY 91 Ca 0.00 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 1y9a n GLY 91 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y9a s GLU 92 N -2.14 1.92 0.23 1.61 0.41 -1.00 -4.79 118.70 114.93 1y9a s GLU 92 Ca 0.29 1.38 -0.10 0.00 -0.41 0.00 0.00 54.97 56.13 1y9a s GLU 92 Cb 0.20 -1.84 0.34 0.00 -1.78 0.00 0.00 34.13 31.04 1y9a s GLU 92 CO 0.38 -1.93 1.63 1.49 -0.49 0.00 0.00 175.26 176.35 1y9a h GLU 93 N -1.13 0.06 -0.41 1.61 4.81 -1.93 -1.74 114.58 115.84 1y9a h GLU 93 Ca -0.44 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.73 1y9a h GLU 93 Cb 1.25 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 1y9a h GLU 93 CO 0.48 0.04 0.02 0.93 -0.73 0.00 0.00 179.01 179.75 1y9a h GLU 94 N 0.07 0.66 -0.41 1.92 3.07 -1.85 -1.22 114.58 116.81 1y9a h GLU 94 Ca 0.36 -0.15 -0.07 0.00 -0.50 0.00 0.00 59.36 59.00 1y9a h GLU 94 Cb 0.59 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 1y9a h GLU 94 CO -0.64 0.66 -0.02 0.77 -1.40 0.00 0.00 179.01 178.38 1y9a h SER 95 N 0.62 0.72 0.45 1.42 0.02 -1.46 0.13 113.55 115.46 1y9a h SER 95 Ca 0.13 -0.32 -0.03 0.00 -0.84 0.00 0.00 61.79 60.73 1y9a h SER 95 Cb 0.37 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 1y9a h SER 95 CO 0.01 0.87 -0.13 1.56 -1.14 0.00 0.00 176.83 178.00 1y9a h GLN 96 N 0.56 0.00 -0.57 3.45 4.20 -0.63 -2.14 115.11 119.97 1y9a h GLN 96 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1y9a h GLN 96 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1y9a h GLN 96 CO 0.02 0.13 0.00 2.89 -0.67 0.00 0.00 178.83 181.21 1y9a n ARG 97 N -3.58 3.86 -0.19 1.46 1.85 -0.61 -4.94 116.66 114.50 1y9a n ARG 97 Ca -0.01 -2.90 0.00 0.00 -1.00 0.00 0.00 57.85 53.93 1y9a n ARG 97 Cb 0.26 -1.93 0.00 0.00 -1.05 0.00 0.00 32.46 29.74 1y9a n ARG 97 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1y9a n GLY 98 N 0.80 0.89 2.39 2.89 0.00 -0.81 -5.02 105.19 106.34 1y9a n GLY 98 Ca 0.25 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1y9a n GLY 98 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1y9a n TYR 99 N -2.19 1.49 0.28 1.61 4.02 0.42 -4.94 117.16 117.85 1y9a n TYR 99 Ca 0.00 -3.85 0.16 0.00 -0.01 0.00 0.00 57.90 54.20 1y9a n TYR 99 Cb 0.00 -0.44 0.82 0.00 -0.02 0.00 0.00 39.34 39.70 1y9a n TYR 99 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1y9a h PRO 100 N 3.52 0.00 0.00 -0.72 0.13 -1.80 -0.97 132.00 132.16 1y9a h PRO 100 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1y9a h PRO 100 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1y9a h PRO 100 CO 0.62 0.07 0.00 0.00 -0.23 0.00 0.00 178.00 178.46 1y9a n MET 101 N -3.42 0.14 -0.72 0.86 0.00 -1.26 -1.70 117.12 111.02 1y9a n MET 101 Ca -0.02 0.48 -0.01 0.00 0.00 0.00 0.00 57.70 58.15 1y9a n MET 101 Cb 0.21 -1.83 0.22 0.00 0.00 0.00 0.00 33.22 31.83 1y9a n MET 101 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 1y9a n HIS 102 N -2.11 1.25 -1.65 3.17 8.25 -0.37 -0.58 115.22 123.18 1y9a n HIS 102 Ca 0.01 -1.35 -0.43 0.00 -0.26 0.00 0.00 57.72 55.69 1y9a n HIS 102 Cb 0.14 -0.47 -0.03 0.00 1.12 0.00 0.00 29.99 30.75 1y9a n HIS 102 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1y9a n SER 103 N -0.87 3.92 0.00 0.41 3.41 -0.69 -1.36 113.62 118.45 1y9a n SER 103 Ca 0.31 0.80 0.00 0.00 -0.26 0.00 0.00 58.87 59.73 1y9a n SER 103 Cb 1.05 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 1y9a n SER 103 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y9a n GLY 104 N 4.74 0.81 0.00 5.00 0.00 -1.26 -3.78 105.19 110.69 1y9a n GLY 104 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1y9a n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y9a n GLY 105 N -2.12 2.57 3.69 -0.02 0.00 -0.46 -4.93 105.19 103.91 1y9a n GLY 105 Ca 0.00 -1.80 -0.44 0.00 0.00 0.00 0.00 46.02 43.77 1y9a n GLY 105 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1y9a n MET 106 N -1.98 2.34 -1.44 1.61 1.56 -1.26 -0.48 117.12 117.47 1y9a n MET 106 Ca 0.00 0.84 -0.16 0.00 -0.27 0.00 0.00 57.70 58.12 1y9a n MET 106 Cb 0.00 -2.62 -0.07 0.00 2.15 0.00 0.00 33.22 32.69 1y9a n MET 106 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 1y9a n LEU 107 N 3.25 -0.96 0.26 -0.89 4.77 -1.26 -4.92 117.00 117.25 1y9a n LEU 107 Ca 0.15 0.39 0.15 0.00 -0.03 0.00 0.00 56.01 56.67 1y9a n LEU 107 Cb 0.31 -2.60 0.54 0.00 -2.33 0.00 0.00 43.42 39.34 1y9a n LEU 107 CO 0.63 -0.99 0.92 1.23 -1.33 0.00 0.00 177.39 177.86 1y9a h GLY 108 N 0.00 0.00 2.00 -0.72 0.00 -0.71 -1.51 103.07 102.13 1y9a h GLY 108 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1y9a h GLY 108 CO 0.47 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.68 1y9a h GLY 109 N 2.47 0.00 -7.31 4.60 0.00 -0.94 -3.40 103.07 98.49 1y9a h GLY 109 Ca -0.00 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.68 1y9a h GLY 109 CO 0.01 0.00 0.71 0.86 0.00 0.00 0.00 176.54 178.11 1y9a s TRP 110 N -3.14 2.82 -0.20 5.60 -0.00 -0.57 -0.76 118.94 122.69 1y9a s TRP 110 Ca 0.09 -0.86 -0.16 0.00 -0.00 0.00 0.00 56.10 55.18 1y9a s TRP 110 Cb 0.10 -4.32 -0.08 0.00 -0.00 0.00 0.00 33.47 29.17 1y9a s TRP 110 CO 0.61 -1.62 -0.26 1.63 -0.00 0.00 0.00 176.95 177.32 1y9a n LYS 111 N 7.39 0.53 -1.64 5.86 5.02 -1.26 -4.51 118.16 129.56 1y9a n LYS 111 Ca 0.08 0.32 -0.45 0.00 -2.02 0.00 0.00 58.31 56.24 1y9a n LYS 111 Cb 0.47 -1.53 -0.04 0.00 -0.02 0.00 0.00 35.03 33.91 1y9a n LYS 111 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1y9a n PHE 112 N -4.43 2.28 -0.85 2.13 3.72 -1.26 -0.99 117.46 118.06 1y9a n PHE 112 Ca -0.26 -0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.00 1y9a n PHE 112 Cb 0.59 -2.72 0.00 0.00 -0.94 0.00 0.00 39.48 36.41 1y9a n PHE 112 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1y9a n SER 113 N 8.10 -2.77 -0.03 4.37 3.41 0.21 -4.60 113.62 122.31 1y9a n SER 113 Ca 0.24 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.83 1y9a n SER 113 Cb 0.36 -2.13 -0.01 0.00 -0.26 0.00 0.00 64.21 62.17 1y9a n SER 113 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1y9a n ASN 114 N -0.37 0.69 0.00 4.04 5.15 -0.16 -4.89 115.26 119.72 1y9a n ASN 114 Ca 0.00 0.37 0.00 0.00 -0.60 0.00 0.00 54.58 54.35 1y9a n ASN 114 Cb 0.18 -0.64 0.00 0.00 -0.53 0.00 0.00 39.78 38.80 1y9a n ASN 114 CO 0.00 0.00 0.00 2.22 1.40 0.00 0.00 177.26 180.88 1y9a n PHE 115 N -3.17 0.00 -4.94 1.20 1.16 -0.79 -5.05 117.46 105.88 1y9a n PHE 115 Ca -0.03 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.24 1y9a n PHE 115 Cb 0.11 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 37.84 1y9a n PHE 115 CO 0.00 0.00 0.00 0.21 -1.87 0.00 0.00 176.76 175.10 1y9a s LYS 116 N -0.13 2.19 -0.09 3.97 2.20 -0.33 -5.04 119.74 122.51 1y9a s LYS 116 Ca 0.00 -0.89 -0.39 0.00 -0.36 0.00 0.00 55.97 54.33 1y9a s LYS 116 Cb 0.00 -2.19 -0.16 0.00 -1.51 0.00 0.00 37.83 33.97 1y9a s LYS 116 CO 0.00 0.57 1.52 -0.25 -0.36 0.00 0.00 175.35 176.83 1y9a n ASP 117 N 2.05 1.94 -2.51 1.43 8.00 -1.26 -0.62 116.55 125.58 1y9a n ASP 117 Ca -0.16 1.10 0.00 0.00 0.71 0.00 0.00 54.79 56.44 1y9a n ASP 117 Cb 0.52 -1.16 0.00 0.00 -0.02 0.00 0.00 41.12 40.46 1y9a n ASP 117 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1y9a n GLY 118 N 3.29 0.02 0.43 0.44 0.00 0.15 -4.63 105.19 104.89 1y9a n GLY 118 Ca 0.22 -1.66 0.12 0.00 0.00 0.00 0.00 46.02 44.70 1y9a n GLY 118 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1y9a n VAL 119 N 0.00 0.00 -1.23 1.61 0.24 -0.74 -4.51 118.33 113.70 1y9a n VAL 119 Ca 0.00 -0.22 -0.30 0.00 -2.04 0.00 0.00 64.34 61.78 1y9a n VAL 119 Cb 0.00 1.01 -0.07 0.00 -1.47 0.00 0.00 33.84 33.31 1y9a n VAL 119 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1y9a n PHE 120 N -0.20 1.63 -3.84 6.34 3.72 -0.15 -4.81 117.46 120.17 1y9a n PHE 120 Ca 0.10 -2.57 -0.10 0.00 -0.05 0.00 0.00 57.45 54.84 1y9a n PHE 120 Cb 0.43 -2.18 -0.05 0.00 -0.94 0.00 0.00 39.48 36.74 1y9a n PHE 120 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1y9a s SER 121 N 2.06 -0.11 0.40 4.37 1.04 -1.26 -1.21 113.70 118.99 1y9a s SER 121 Ca 0.69 -0.65 0.11 0.00 0.48 0.00 0.00 55.95 56.58 1y9a s SER 121 Cb 0.23 0.50 0.84 0.00 0.10 0.00 0.00 66.02 67.69 1y9a s SER 121 CO -0.04 -0.96 1.93 -0.33 0.98 0.00 0.00 173.24 174.81 1y9a h GLU 122 N 2.37 0.13 -4.08 4.02 5.08 -1.77 -3.41 114.58 116.92 1y9a h GLU 122 Ca -0.30 -0.03 -0.26 0.00 -1.00 0.00 0.00 59.36 57.76 1y9a h GLU 122 Cb 1.24 -0.02 -0.27 0.00 0.50 0.00 0.00 28.75 30.21 1y9a h GLU 122 CO 0.43 0.31 -0.73 0.08 -1.00 0.00 0.00 179.01 178.10 1y9a s VAL 123 N -4.62 0.23 0.25 3.13 1.01 -1.26 -4.26 120.40 114.87 1y9a s VAL 123 Ca -0.05 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.63 1y9a s VAL 123 Cb 0.15 -0.24 -0.05 0.00 0.00 0.00 0.00 36.38 36.25 1y9a s VAL 123 CO 0.72 -0.06 0.11 0.72 0.00 0.00 0.00 175.10 176.60 1y9a s PHE 124 N -0.37 1.43 -0.11 5.22 -0.12 0.12 -4.89 117.98 119.26 1y9a s PHE 124 Ca -0.02 -1.26 -0.01 0.00 -0.05 0.00 0.00 56.93 55.59 1y9a s PHE 124 Cb -0.03 -0.79 -0.03 0.00 -0.63 0.00 0.00 43.02 41.54 1y9a s PHE 124 CO -0.00 -0.45 -0.07 -1.58 -0.05 0.00 0.00 175.22 173.07 1y9a s HIS 125 N -3.86 2.95 -0.17 3.49 5.65 -1.26 -1.17 115.29 120.92 1y9a s HIS 125 Ca 0.38 -0.20 0.01 0.00 0.25 0.00 0.00 55.06 55.50 1y9a s HIS 125 Cb 0.07 -1.82 0.02 0.00 -1.18 0.00 0.00 32.58 29.67 1y9a s HIS 125 CO 0.14 0.11 -0.21 0.08 -0.65 0.00 0.00 174.74 174.21 1y9a s VAL 126 N -0.18 2.07 0.41 0.89 1.01 -0.12 -5.01 120.40 119.47 1y9a s VAL 126 Ca 0.02 -0.95 -0.23 0.00 0.00 0.00 0.00 61.98 60.83 1y9a s VAL 126 Cb -0.13 -1.85 -0.10 0.00 0.00 0.00 0.00 36.38 34.30 1y9a s VAL 126 CO 0.03 0.54 0.99 0.54 0.00 0.00 0.00 175.10 177.20 1y9a s ASN 127 N 1.14 6.87 -1.18 3.32 4.22 -1.26 -1.17 114.94 126.87 1y9a s ASN 127 Ca 0.01 1.86 -0.22 0.00 -2.14 0.00 0.00 52.86 52.37 1y9a s ASN 127 Cb -0.14 -2.56 0.00 0.00 1.28 0.00 0.00 41.25 39.83 1y9a s ASN 127 CO -0.09 -0.41 0.73 -0.62 -2.04 0.00 0.00 177.10 174.67 1y9a n GLU 128 N -0.29 -1.21 -0.23 3.55 1.02 -1.15 -4.63 120.64 117.70 1y9a n GLU 128 Ca 0.06 0.37 -0.05 0.00 -0.02 0.00 0.00 57.16 57.51 1y9a n GLU 128 Cb 0.52 -3.82 0.05 0.00 -0.02 0.00 0.00 31.44 28.17 1y9a n GLU 128 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1y9a h ALA 129 N 1.00 0.83 -1.00 0.62 0.00 -1.12 -0.14 119.26 119.45 1y9a h ALA 129 Ca -0.67 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.27 1y9a h ALA 129 Cb 1.37 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 1y9a h ALA 129 CO 0.51 0.24 0.64 -0.44 0.00 0.00 0.00 179.25 180.20 1y9a h ASP 130 N 0.87 1.02 0.52 0.00 3.32 -1.89 -1.27 116.42 118.99 1y9a h ASP 130 Ca 0.24 0.01 -0.19 0.00 0.02 0.00 0.00 57.03 57.12 1y9a h ASP 130 Cb -0.08 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 1y9a h ASP 130 CO -0.06 0.64 -0.83 0.00 -1.72 0.00 0.00 179.24 177.26 1y9a h ALA 131 N 1.46 0.56 -0.01 3.45 0.00 -1.70 -3.39 119.26 119.64 1y9a h ALA 131 Ca 0.44 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1y9a h ALA 131 Cb 0.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1y9a h ALA 131 CO -0.19 0.87 -0.70 0.09 0.00 0.00 0.00 179.25 179.32 1y9a n ASN 132 N -3.70 1.43 -4.18 0.00 3.02 -0.14 -1.18 115.26 110.51 1y9a n ASN 132 Ca -0.04 -1.22 -0.33 0.00 -0.03 0.00 0.00 54.58 52.97 1y9a n ASN 132 Cb 0.78 0.75 -0.16 0.00 -0.61 0.00 0.00 39.78 40.53 1y9a n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1y9a s LEU 133 N -2.68 2.21 -0.05 3.41 1.43 -0.52 -3.89 118.68 118.59 1y9a s LEU 133 Ca 0.12 -0.59 -0.10 0.00 -1.03 0.00 0.00 54.13 52.53 1y9a s LEU 133 Cb 0.16 -1.49 -0.05 0.00 0.03 0.00 0.00 46.19 44.84 1y9a s LEU 133 CO 0.68 0.05 0.27 0.00 0.23 0.00 0.00 176.35 177.59 1y9a s ALA 134 N 0.99 3.80 0.33 4.21 0.00 -1.11 -4.76 121.76 125.22 1y9a s ALA 134 Ca -0.02 -0.46 -0.29 0.00 0.00 0.00 0.00 51.96 51.19 1y9a s ALA 134 Cb -0.15 -2.16 -0.10 0.00 0.00 0.00 0.00 23.12 20.71 1y9a s ALA 134 CO -0.05 0.57 1.34 -0.51 0.00 0.00 0.00 175.76 177.11 1y9a s LEU 135 N -1.18 4.41 -0.18 0.00 1.43 -1.26 0.26 118.68 122.15 1y9a s LEU 135 Ca 0.21 2.73 -0.29 0.00 -1.03 0.00 0.00 54.13 55.75 1y9a s LEU 135 Cb -0.14 -3.65 -0.03 0.00 0.03 0.00 0.00 46.19 42.40 1y9a s LEU 135 CO 0.10 -0.60 1.52 -0.22 0.23 0.00 0.00 176.35 177.38 1y9a s LEU 136 N -1.66 4.04 0.35 1.79 2.96 -0.34 -4.61 118.68 121.21 1y9a s LEU 136 Ca 0.51 1.72 -0.28 0.00 -0.22 0.00 0.00 54.13 55.85 1y9a s LEU 136 Cb -0.41 -3.53 -0.11 0.00 0.50 0.00 0.00 46.19 42.64 1y9a s LEU 136 CO 0.53 -1.07 1.47 -2.84 -1.32 0.00 0.00 176.35 173.13 1y9a s PRO 137 N 4.25 4.15 0.59 0.98 0.02 -1.26 -4.88 135.00 138.85 1y9a s PRO 137 Ca 0.67 2.52 0.36 0.00 0.02 0.00 0.00 61.00 64.56 1y9a s PRO 137 Cb -0.25 -2.99 1.85 0.00 0.02 0.00 0.00 34.50 33.13 1y9a s PRO 137 CO 0.26 -0.50 2.19 0.00 -0.33 0.00 0.00 177.00 178.62 1y9a h ARG 138 N 3.37 0.00 -0.32 5.54 3.08 -2.01 -2.61 114.38 121.43 1y9a h ARG 138 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1y9a h ARG 138 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 1y9a h ARG 138 CO 0.67 0.04 0.00 -0.40 -1.07 0.00 0.00 179.97 179.20 1y9a n ASP 139 N -3.33 1.71 -4.20 7.04 5.68 -1.26 -4.83 116.55 117.37 1y9a n ASP 139 Ca -0.02 -2.00 -0.32 0.00 -0.50 0.00 0.00 54.79 51.95 1y9a n ASP 139 Cb 0.17 -0.21 -0.17 0.00 -1.14 0.00 0.00 41.12 39.77 1y9a n ASP 139 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1y9a s ILE 140 N -1.58 1.99 0.36 2.12 1.01 -0.99 -4.90 121.20 119.22 1y9a s ILE 140 Ca 0.21 -0.97 -0.27 0.00 0.00 0.00 0.00 60.65 59.62 1y9a s ILE 140 Cb 0.11 -1.74 -0.09 0.00 0.01 0.00 0.00 42.46 40.75 1y9a s ILE 140 CO 0.14 0.54 1.25 -0.54 0.00 0.00 0.00 174.94 176.34 1y9a s LYS 141 N 0.46 4.23 0.34 2.79 1.02 -1.26 -4.85 119.74 122.48 1y9a s LYS 141 Ca -0.16 2.08 0.09 0.00 0.02 0.00 0.00 55.97 58.00 1y9a s LYS 141 Cb -0.17 -2.93 0.82 0.00 -0.52 0.00 0.00 37.83 35.04 1y9a s LYS 141 CO 0.06 -0.24 1.82 -1.35 -0.92 0.00 0.00 175.35 174.72 1y9a h PRO 142 N 3.10 0.67 -0.24 -1.68 0.11 -1.98 -0.47 132.00 131.50 1y9a h PRO 142 Ca -0.49 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.49 1y9a h PRO 142 Cb 1.23 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1y9a h PRO 142 CO 0.64 0.44 -0.23 0.93 -0.21 0.00 0.00 178.00 179.58 1y9a h GLU 143 N 0.69 0.45 -0.09 1.05 5.08 -1.95 -0.87 114.58 118.93 1y9a h GLU 143 Ca 0.52 -0.16 -0.19 0.00 -1.00 0.00 0.00 59.36 58.53 1y9a h GLU 143 Cb 0.89 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1y9a h GLU 143 CO -0.28 0.65 -0.73 -0.44 -1.00 0.00 0.00 179.01 177.21 1y9a h ASP 144 N 0.40 0.55 0.77 1.42 3.32 -1.56 -3.30 116.42 118.02 1y9a h ASP 144 Ca 0.06 -0.36 -0.13 0.00 0.02 0.00 0.00 57.03 56.62 1y9a h ASP 144 Cb 0.62 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 1y9a h ASP 144 CO 0.04 1.10 -0.63 0.00 -1.72 0.00 0.00 179.24 178.04 1y9a h ALA 145 N 0.89 0.86 0.00 3.45 0.00 -0.78 -2.87 119.26 120.80 1y9a h ALA 145 Ca -0.03 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.31 1y9a h ALA 145 Cb 1.32 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1y9a h ALA 145 CO 0.13 0.78 -0.01 -0.24 0.00 0.00 0.00 179.25 179.92 1y9a h VAL 146 N 0.00 0.05 0.00 0.00 3.04 -1.24 -0.47 116.25 117.63 1y9a h VAL 146 Ca -0.01 -0.12 -0.03 0.00 -1.01 0.00 0.00 66.70 65.53 1y9a h VAL 146 Cb 1.18 1.11 -0.00 0.00 -2.01 0.00 0.00 31.29 31.57 1y9a h VAL 146 CO 0.08 0.01 -0.15 0.24 -1.01 0.00 0.00 177.57 176.73 1y9a h MET 147 N 0.00 0.00 -0.10 4.17 2.86 -1.65 -3.09 114.93 117.12 1y9a h MET 147 Ca -0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 1y9a h MET 147 Cb 0.11 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1y9a h MET 147 CO 0.00 0.15 -0.34 -0.07 1.06 0.00 0.00 176.91 177.72 1y9a h LEU 148 N 0.00 0.19 -1.49 1.22 3.38 -1.22 -0.15 115.31 117.24 1y9a h LEU 148 Ca -0.00 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.94 1y9a h LEU 148 Cb 0.59 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1y9a h LEU 148 CO 0.02 0.53 0.39 0.28 0.09 0.00 0.00 178.44 179.75 1y9a h SER 149 N 0.17 0.57 0.00 -0.43 0.02 -1.64 -3.30 113.55 108.94 1y9a h SER 149 Ca 0.02 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1y9a h SER 149 Cb 0.69 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1y9a h SER 149 CO 0.05 0.38 0.00 -0.67 -1.14 0.00 0.00 176.83 175.46 1y9a n ASP 150 N -4.47 0.00 0.10 3.07 2.03 -1.25 -1.48 116.55 114.55 1y9a n ASP 150 Ca 0.07 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.26 1y9a n ASP 150 Cb 0.17 0.08 -0.08 0.00 -0.72 0.00 0.00 41.12 40.57 1y9a n ASP 150 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 1y9a h MET 151 N 0.00 -0.27 0.12 -0.67 2.86 -1.58 0.16 114.93 115.55 1y9a h MET 151 Ca 0.00 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1y9a h MET 151 Cb 0.00 0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.72 1y9a h MET 151 CO 0.00 0.09 -0.06 0.28 1.06 0.00 0.00 176.91 178.28 1y9a h VAL 152 N -0.69 0.97 -0.69 -2.22 2.07 -1.25 -1.28 116.25 113.16 1y9a h VAL 152 Ca -0.03 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 1y9a h VAL 152 Cb 0.48 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1y9a h VAL 152 CO 0.05 0.09 0.24 0.00 0.02 0.00 0.00 177.57 177.97 1y9a h THR 153 N -0.33 1.25 -0.11 2.57 1.03 -1.63 0.63 112.91 116.33 1y9a h THR 153 Ca -0.02 -0.82 -0.04 0.00 -0.01 0.00 0.00 66.41 65.52 1y9a h THR 153 Cb 0.27 0.49 -0.00 0.00 -1.07 0.00 0.00 68.15 67.84 1y9a h THR 153 CO 0.03 0.32 -0.08 0.74 -0.01 0.00 0.00 175.52 176.52 1y9a h THR 154 N 0.99 1.34 -0.71 0.00 2.02 -0.70 -0.43 112.91 115.42 1y9a h THR 154 Ca 0.23 -1.17 -0.06 0.00 0.77 0.00 0.00 66.41 66.18 1y9a h THR 154 Cb 0.26 1.88 -0.03 0.00 -1.74 0.00 0.00 68.15 68.52 1y9a h THR 154 CO -0.01 0.33 0.23 1.23 0.37 0.00 0.00 175.52 177.67 1y9a h GLY 155 N -0.14 1.18 1.31 2.16 0.00 -1.12 -1.71 103.07 104.75 1y9a h GLY 155 Ca 0.02 -0.70 -0.04 0.00 0.00 0.00 0.00 47.33 46.61 1y9a h GLY 155 CO 0.02 0.65 0.19 0.74 0.00 0.00 0.00 176.54 178.14 1y9a h PHE 156 N 1.04 0.89 -0.32 5.60 -1.00 -0.88 -2.71 116.94 119.57 1y9a h PHE 156 Ca 0.23 -0.07 -0.05 0.00 2.81 0.00 0.00 57.97 60.90 1y9a h PHE 156 Cb 0.30 -0.27 -0.02 0.00 3.61 0.00 0.00 35.95 39.57 1y9a h PHE 156 CO 0.02 0.71 -0.00 1.25 -1.61 0.00 0.00 178.31 178.68 1y9a h HIS 157 N 0.85 0.51 -0.48 -0.55 2.76 -0.30 0.13 115.15 118.06 1y9a h HIS 157 Ca 0.20 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 1y9a h HIS 157 Cb 0.23 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.02 1y9a h HIS 157 CO 0.02 0.50 0.32 0.78 -1.30 0.00 0.00 177.93 178.25 1y9a h GLY 158 N 0.81 0.68 1.09 5.26 0.00 -1.01 0.87 103.07 110.76 1y9a h GLY 158 Ca 0.10 -0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 1y9a h GLY 158 CO 0.01 0.25 0.30 0.00 0.00 0.00 0.00 176.54 177.10 1y9a h ALA 159 N 1.18 1.07 -0.39 3.60 0.00 -1.27 -0.99 119.26 122.45 1y9a h ALA 159 Ca 0.18 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1y9a h ALA 159 Cb -0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 1y9a h ALA 159 CO -0.04 0.66 0.10 0.93 0.00 0.00 0.00 179.25 180.90 1y9a h GLU 160 N 1.13 0.62 -0.20 0.00 5.08 -0.49 -2.90 114.58 117.83 1y9a h GLU 160 Ca 0.26 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 1y9a h GLU 160 Cb 0.22 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1y9a h GLU 160 CO -0.02 0.64 -0.16 -0.07 -1.00 0.00 0.00 179.01 178.41 1y9a h LEU 161 N 0.49 0.32 0.00 1.33 3.38 -0.63 -1.57 115.31 118.63 1y9a h LEU 161 Ca 0.12 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1y9a h LEU 161 Cb 0.29 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1y9a h LEU 161 CO -0.00 0.50 0.00 0.00 0.09 0.00 0.00 178.44 179.03 1y9a n ALA 162 N -2.48 2.24 -3.63 1.53 0.00 -0.39 -4.40 120.51 113.38 1y9a n ALA 162 Ca -0.00 -0.12 -0.23 0.00 0.00 0.00 0.00 53.44 53.08 1y9a n ALA 162 Cb 0.31 -1.36 0.07 0.00 0.00 0.00 0.00 19.45 18.47 1y9a n ALA 162 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1y9a n ASN 163 N -1.11 -4.92 -4.73 0.00 5.15 -0.59 -4.53 115.26 104.53 1y9a n ASN 163 Ca 0.14 -0.61 -0.42 0.00 -0.60 0.00 0.00 54.58 53.09 1y9a n ASN 163 Cb 0.11 -4.80 -0.03 0.00 -0.53 0.00 0.00 39.78 34.53 1y9a n ASN 163 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1y9a s ILE 164 N -3.35 3.31 0.29 -1.44 1.01 -1.24 -5.00 121.20 114.80 1y9a s ILE 164 Ca 0.45 1.02 0.10 0.00 0.00 0.00 0.00 60.65 62.21 1y9a s ILE 164 Cb -0.20 -3.65 -0.05 0.00 0.01 0.00 0.00 42.46 38.57 1y9a s ILE 164 CO 0.75 0.12 -0.02 -0.54 0.00 0.00 0.00 174.94 175.26 1y9a s LYS 165 N 0.36 2.15 0.02 2.79 -0.14 -1.26 -4.89 119.74 118.77 1y9a s LYS 165 Ca 0.59 -1.57 -0.34 0.00 -1.36 0.00 0.00 55.97 53.29 1y9a s LYS 165 Cb -0.36 -2.04 -0.13 0.00 -1.68 0.00 0.00 37.83 33.62 1y9a s LYS 165 CO 0.35 0.28 1.75 1.28 -0.76 0.00 0.00 175.35 178.24 1y9a n LEU 166 N -0.89 3.29 0.00 3.17 4.77 -1.26 -1.67 117.00 124.41 1y9a n LEU 166 Ca -0.05 1.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 1y9a n LEU 166 Cb 0.60 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.30 1y9a n LEU 166 CO 0.41 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 1y9a n GLY 167 N 3.97 1.15 3.74 -0.72 0.00 0.94 -4.96 105.19 109.31 1y9a n GLY 167 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 1y9a n GLY 167 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1y9a s ASP 168 N -3.10 5.02 -0.17 1.61 1.01 -0.67 -4.18 116.67 116.20 1y9a s ASP 168 Ca 0.00 2.69 -0.17 0.00 0.71 0.00 0.00 52.55 55.78 1y9a s ASP 168 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 1y9a s ASP 168 CO 0.00 -1.73 0.44 -0.89 0.21 0.00 0.00 175.17 173.20 1y9a s THR 169 N -1.36 5.18 0.02 -1.27 2.01 -1.26 -1.62 115.64 117.35 1y9a s THR 169 Ca 0.76 0.83 0.07 0.00 0.31 0.00 0.00 61.69 63.66 1y9a s THR 169 Cb -0.39 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.33 1y9a s THR 169 CO 0.44 0.27 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.73 1y9a s VAL 170 N 1.08 1.78 -0.15 3.82 1.01 -0.62 -0.93 120.40 126.39 1y9a s VAL 170 Ca 0.22 -1.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 1y9a s VAL 170 Cb -0.15 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 1y9a s VAL 170 CO 0.09 0.33 -0.12 0.00 0.00 0.00 0.00 175.10 175.40 1y9a s VAL 172 N 0.66 4.41 -0.32 0.00 1.01 0.03 -0.67 120.40 125.52 1y9a s VAL 172 Ca -0.06 -0.26 -0.13 0.00 0.00 0.00 0.00 61.98 61.52 1y9a s VAL 172 Cb -0.15 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 1y9a s VAL 172 CO 0.02 0.24 0.26 -0.63 0.00 0.00 0.00 175.10 175.00 1y9a s ILE 173 N 1.61 5.26 0.00 2.22 1.01 -0.39 -0.92 121.20 129.99 1y9a s ILE 173 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.70 1y9a s ILE 173 Cb -0.16 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.62 1y9a s ILE 173 CO 0.05 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.65 1y9a n GLY 174 N 5.03 0.14 2.26 6.18 0.00 -0.83 -0.31 105.19 117.66 1y9a n GLY 174 Ca -0.12 -1.02 -0.21 0.00 0.00 0.00 0.00 46.02 44.67 1y9a n GLY 174 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1y9a n ILE 175 N 2.35 2.26 -0.55 -0.61 2.08 -1.25 -3.92 119.36 119.73 1y9a n ILE 175 Ca 0.00 -4.18 -0.00 0.00 0.56 0.00 0.00 62.75 59.13 1y9a n ILE 175 Cb 0.00 -0.78 0.00 0.00 -0.75 0.00 0.00 39.64 38.11 1y9a n ILE 175 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1y9a n GLY 176 N -0.61 -2.30 0.36 7.39 0.00 -1.26 -4.53 105.19 104.23 1y9a n GLY 176 Ca 0.37 -1.47 0.01 0.00 0.00 0.00 0.00 46.02 44.93 1y9a n GLY 176 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1y9a h PRO 177 N 0.00 1.02 -0.23 1.61 0.13 -1.94 0.10 132.00 132.69 1y9a h PRO 177 Ca -0.00 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 1y9a h PRO 177 Cb 0.00 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 30.89 1y9a h PRO 177 CO 0.00 0.68 0.11 0.28 -0.23 0.00 0.00 178.00 178.84 1y9a h VAL 178 N 1.05 1.14 -0.65 1.56 2.07 -1.89 -2.33 116.25 117.21 1y9a h VAL 178 Ca 0.31 -0.40 0.06 0.00 0.82 0.00 0.00 66.70 67.49 1y9a h VAL 178 Cb -0.04 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 1y9a h VAL 178 CO -0.08 0.14 0.36 1.23 0.02 0.00 0.00 177.57 179.23 1y9a h GLY 179 N 0.25 0.95 1.08 2.17 0.00 -1.47 0.18 103.07 106.22 1y9a h GLY 179 Ca 0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1y9a h GLY 179 CO -0.01 0.14 0.51 1.41 0.00 0.00 0.00 176.54 178.60 1y9a h LEU 180 N 0.66 1.08 -1.09 3.11 3.38 -0.93 -0.08 115.31 121.44 1y9a h LEU 180 Ca 0.29 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 1y9a h LEU 180 Cb 0.19 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1y9a h LEU 180 CO -0.19 0.85 -0.38 0.24 0.09 0.00 0.00 178.44 179.05 1y9a h MET 181 N 1.23 0.00 -0.20 1.13 2.86 -0.78 -0.98 114.93 118.20 1y9a h MET 181 Ca 0.32 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.83 1y9a h MET 181 Cb -0.02 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1y9a h MET 181 CO -0.06 0.38 -0.42 0.77 1.06 0.00 0.00 176.91 178.65 1y9a h SER 182 N 0.00 0.49 -0.23 1.22 0.02 0.36 0.21 113.55 115.62 1y9a h SER 182 Ca -0.00 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 60.70 1y9a h SER 182 Cb 0.81 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1y9a h SER 182 CO 0.05 0.85 0.05 0.58 -1.14 0.00 0.00 176.83 177.22 1y9a h VAL 183 N 0.38 1.22 -0.59 2.27 2.07 -0.79 0.17 116.25 120.99 1y9a h VAL 183 Ca 0.03 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.80 1y9a h VAL 183 Cb 0.90 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 1y9a h VAL 183 CO 0.08 0.23 0.24 0.00 0.02 0.00 0.00 177.57 178.13 1y9a h ALA 184 N 0.86 0.76 -0.40 1.67 0.00 -1.03 -0.29 119.26 120.82 1y9a h ALA 184 Ca 0.07 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1y9a h ALA 184 Cb 0.30 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1y9a h ALA 184 CO 0.00 0.38 0.09 0.78 0.00 0.00 0.00 179.25 180.50 1y9a h GLY 185 N 0.81 0.70 0.68 0.00 0.00 -0.49 0.33 103.07 105.11 1y9a h GLY 185 Ca 0.20 -0.45 0.06 0.00 0.00 0.00 0.00 47.33 47.14 1y9a h GLY 185 CO -0.02 0.41 0.37 0.00 0.00 0.00 0.00 176.54 177.31 1y9a h ALA 186 N 0.95 0.90 -0.90 3.60 0.00 -0.71 0.12 119.26 123.21 1y9a h ALA 186 Ca 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1y9a h ALA 186 Cb 0.32 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1y9a h ALA 186 CO 0.00 0.05 0.52 -0.97 0.00 0.00 0.00 179.25 178.85 1y9a h ASN 187 N 0.68 1.10 0.59 0.00 -0.00 -0.75 -1.53 115.58 115.68 1y9a h ASN 187 Ca 0.30 -0.08 0.00 0.00 -0.00 0.00 0.00 56.30 56.52 1y9a h ASN 187 Cb 0.19 -0.28 0.00 0.00 -0.00 0.00 0.00 38.32 38.23 1y9a h ASN 187 CO -0.18 0.86 0.00 1.41 -0.00 0.00 0.00 177.43 179.52 1y9a n HIS 188 N -4.37 0.00 0.58 0.67 8.25 0.08 -2.23 115.22 118.20 1y9a n HIS 188 Ca 0.10 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.66 1y9a n HIS 188 Cb 0.07 -0.32 0.13 0.00 1.12 0.00 0.00 29.99 30.99 1y9a n HIS 188 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1y9a n LEU 189 N -1.32 2.89 0.00 2.41 4.77 -0.04 -4.99 117.00 120.71 1y9a n LEU 189 Ca 0.12 -1.22 0.00 0.00 -0.03 0.00 0.00 56.01 54.88 1y9a n LEU 189 Cb 0.24 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1y9a n LEU 189 CO 0.22 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 1y9a n GLY 190 N 1.17 1.01 3.76 -0.72 0.00 -0.87 -4.04 105.19 105.50 1y9a n GLY 190 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1y9a n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y9a s ALA 191 N -2.00 2.98 0.00 4.61 0.00 -0.64 -0.04 121.76 126.67 1y9a s ALA 191 Ca 0.00 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.15 1y9a s ALA 191 Cb 0.00 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1y9a s ALA 191 CO 0.00 -1.01 0.00 0.41 0.00 0.00 0.00 175.76 175.16 1y9a n GLY 192 N 0.61 1.05 3.75 0.00 0.00 -0.64 -4.72 105.19 105.24 1y9a n GLY 192 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1y9a n GLY 192 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y9a s ARG 193 N 0.35 4.42 -0.11 1.61 3.52 -1.25 -4.83 118.95 122.66 1y9a s ARG 193 Ca 0.00 2.06 -0.03 0.00 -0.13 0.00 0.00 55.73 57.63 1y9a s ARG 193 Cb 0.00 -3.16 0.04 0.00 -1.56 0.00 0.00 34.95 30.27 1y9a s ARG 193 CO 0.00 -0.17 0.06 0.42 -0.81 0.00 0.00 175.30 174.80 1y9a s ILE 194 N -0.37 0.07 -0.08 4.11 1.01 -1.26 -1.58 121.20 123.10 1y9a s ILE 194 Ca 0.53 0.05 -0.23 0.00 0.00 0.00 0.00 60.65 61.00 1y9a s ILE 194 Cb -0.37 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 1y9a s ILE 194 CO 0.42 -0.01 0.68 -0.36 0.00 0.00 0.00 174.94 175.67 1y9a s PHE 195 N 2.08 3.56 -0.18 3.97 0.40 0.21 -0.85 117.98 127.18 1y9a s PHE 195 Ca 0.03 1.20 -0.01 0.00 -0.60 0.00 0.00 56.93 57.56 1y9a s PHE 195 Cb -0.14 -2.78 0.00 0.00 0.51 0.00 0.00 43.02 40.61 1y9a s PHE 195 CO -0.06 0.08 -0.13 0.00 0.70 0.00 0.00 175.22 175.81 1y9a s ALA 196 N 0.83 2.56 -0.30 5.36 0.00 0.02 -0.79 121.76 129.44 1y9a s ALA 196 Ca 0.36 -1.10 -0.09 0.00 0.00 0.00 0.00 51.96 51.12 1y9a s ALA 196 Cb -0.17 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.59 1y9a s ALA 196 CO 0.17 -0.19 0.14 0.08 0.00 0.00 0.00 175.76 175.96 1y9a s VAL 197 N 1.07 4.58 0.09 0.00 1.01 -0.10 -0.99 120.40 126.07 1y9a s VAL 197 Ca -0.00 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 61.50 1y9a s VAL 197 Cb -0.15 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 32.96 1y9a s VAL 197 CO -0.03 0.10 0.46 0.61 0.00 0.00 0.00 175.10 176.24 1y9a n GLY 198 N 4.98 1.02 0.00 4.51 0.00 -0.88 -1.96 105.19 112.86 1y9a n GLY 198 Ca -0.14 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1y9a n GLY 198 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y9a n SER 199 N -0.93 3.97 -4.72 1.61 3.41 -1.26 -3.95 113.62 111.76 1y9a n SER 199 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.17 1y9a n SER 199 Cb 0.27 0.28 -0.01 0.00 -0.26 0.00 0.00 64.21 64.48 1y9a n SER 199 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1y9a n ARG 200 N -1.98 2.32 0.12 4.33 1.74 -1.26 -4.96 116.66 116.97 1y9a n ARG 200 Ca 0.00 0.82 -0.23 0.00 -0.77 0.00 0.00 57.85 57.66 1y9a n ARG 200 Cb 0.43 -2.47 -0.15 0.00 -1.02 0.00 0.00 32.46 29.25 1y9a n ARG 200 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1y9a h LYS 201 N 3.12 0.47 -0.03 5.56 1.79 -1.94 -2.65 116.57 122.89 1y9a h LYS 201 Ca -0.47 -0.81 -0.17 0.00 -2.18 0.00 0.00 60.65 57.02 1y9a h LYS 201 Cb 1.27 0.30 -0.01 0.00 -1.58 0.00 0.00 32.23 32.20 1y9a h LYS 201 CO 0.66 1.38 -0.75 0.45 -1.08 0.00 0.00 179.45 180.12 1y9a h HIS 202 N 0.13 0.26 -0.26 -1.35 3.86 -1.93 -2.53 115.15 113.34 1y9a h HIS 202 Ca -0.26 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 58.82 1y9a h HIS 202 Cb 2.13 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 30.55 1y9a h HIS 202 CO 0.11 0.86 0.17 0.00 0.86 0.00 0.00 177.93 179.94 1y9a n ASP 205 N 1.94 0.00 -0.01 0.00 8.00 -0.87 -4.83 116.55 120.79 1y9a n ASP 205 Ca 0.14 0.00 -0.00 0.00 0.71 0.00 0.00 54.79 55.63 1y9a n ASP 205 Cb 0.56 0.00 0.29 0.00 -0.02 0.00 0.00 41.12 41.95 1y9a n ASP 205 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1y9a h ILE 206 N 0.00 1.20 -0.88 0.53 2.04 -1.13 -2.27 117.51 116.99 1y9a h ILE 206 Ca 0.00 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.07 1y9a h ILE 206 Cb 0.00 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1y9a h ILE 206 CO 0.00 0.27 0.47 0.00 0.00 0.00 0.00 178.15 178.88 1y9a h ALA 207 N 1.49 1.17 -0.58 1.87 0.00 -1.23 -1.34 119.26 120.64 1y9a h ALA 207 Ca 0.12 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1y9a h ALA 207 Cb 0.31 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1y9a h ALA 207 CO 0.01 0.66 0.21 -0.07 0.00 0.00 0.00 179.25 180.05 1y9a h LEU 208 N 1.24 0.78 -1.43 0.00 3.38 -1.64 0.31 115.31 117.95 1y9a h LEU 208 Ca 0.31 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 1y9a h LEU 208 Cb 0.05 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1y9a h LEU 208 CO -0.05 0.72 -0.24 -0.33 0.09 0.00 0.00 178.44 178.63 1y9a h GLU 209 N 0.84 0.00 -0.08 1.13 5.08 -0.77 -2.25 114.58 118.53 1y9a h GLU 209 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1y9a h GLU 209 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1y9a h GLU 209 CO -0.01 0.24 0.00 0.66 -1.00 0.00 0.00 179.01 178.90 1y9a n TYR 210 N -3.68 0.09 0.00 4.33 4.01 -0.60 -4.93 117.16 116.38 1y9a n TYR 210 Ca -0.01 -0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 1y9a n TYR 210 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.39 1y9a n TYR 210 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1y9a n GLY 211 N 1.13 0.95 3.76 2.72 0.00 -0.84 -3.85 105.19 109.05 1y9a n GLY 211 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1y9a n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y9a s ALA 212 N -2.00 2.79 -0.03 4.61 0.00 0.06 -4.55 121.76 122.65 1y9a s ALA 212 Ca 0.00 1.16 0.06 0.00 0.00 0.00 0.00 51.96 53.18 1y9a s ALA 212 Cb 0.00 -3.49 -0.09 0.00 0.00 0.00 0.00 23.12 19.53 1y9a s ALA 212 CO 0.00 -1.14 0.10 0.25 0.00 0.00 0.00 175.76 174.97 1y9a n THR 213 N -1.02 0.15 -3.77 0.00 -2.24 -0.03 -4.41 114.28 102.96 1y9a n THR 213 Ca 0.10 -0.19 -0.15 0.00 -2.27 0.00 0.00 64.05 61.55 1y9a n THR 213 Cb 0.47 -0.07 -0.16 0.00 -2.10 0.00 0.00 70.33 68.47 1y9a n THR 213 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1y9a s ASP 214 N -3.11 0.03 -0.14 3.42 1.11 -0.83 -4.96 116.67 112.20 1y9a s ASP 214 Ca -0.03 0.09 -0.03 0.00 0.18 0.00 0.00 52.55 52.77 1y9a s ASP 214 Cb 0.03 -0.01 -0.03 0.00 1.07 0.00 0.00 42.92 43.98 1y9a s ASP 214 CO 0.26 -0.13 -0.05 -0.63 1.18 0.00 0.00 175.17 175.80 1y9a s ILE 215 N 1.06 3.78 -0.23 0.77 -1.09 -1.26 -0.80 121.20 123.43 1y9a s ILE 215 Ca -0.09 -0.41 0.02 0.00 -2.23 0.00 0.00 60.65 57.95 1y9a s ILE 215 Cb -0.12 -2.63 0.05 0.00 -1.58 0.00 0.00 42.46 38.17 1y9a s ILE 215 CO -0.03 0.52 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.43 1y9a s ILE 216 N 0.14 2.02 -0.21 2.92 -1.09 -0.16 -4.94 121.20 119.89 1y9a s ILE 216 Ca -0.02 -1.32 -0.05 0.00 -2.23 0.00 0.00 60.65 57.02 1y9a s ILE 216 Cb -0.14 -2.05 -0.03 0.00 -1.58 0.00 0.00 42.46 38.67 1y9a s ILE 216 CO 0.03 0.16 0.01 0.21 -1.23 0.00 0.00 174.94 174.12 1y9a s ASN 217 N 1.21 4.90 0.62 3.58 3.84 -1.25 -2.08 114.94 125.77 1y9a s ASN 217 Ca -0.04 -0.19 0.35 0.00 0.21 0.00 0.00 52.86 53.19 1y9a s ASN 217 Cb -0.17 -1.84 2.00 0.00 -0.55 0.00 0.00 41.25 40.69 1y9a s ASN 217 CO -0.08 0.06 2.25 0.10 -2.79 0.00 0.00 177.10 176.64 1y9a h TYR 218 N 7.55 0.00 0.00 0.43 -0.00 -1.77 -1.45 116.97 121.74 1y9a h TYR 218 Ca -0.36 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.36 1y9a h TYR 218 Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.91 1y9a h TYR 218 CO 0.60 0.00 -0.02 0.87 -0.00 0.00 0.00 178.16 179.61 1y9a h LYS 219 N 0.00 0.00 -0.21 0.10 1.57 -1.94 0.92 116.57 117.01 1y9a h LYS 219 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1y9a h LYS 219 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1y9a h LYS 219 CO -0.00 0.02 0.00 0.09 -0.57 0.00 0.00 179.45 178.99 1y9a n ASN 220 N -3.16 1.20 0.00 0.86 4.13 -0.55 -5.02 115.26 112.72 1y9a n ASN 220 Ca -0.01 -1.94 0.00 0.00 1.68 0.00 0.00 54.58 54.31 1y9a n ASN 220 Cb 0.19 -0.14 0.00 0.00 -1.54 0.00 0.00 39.78 38.29 1y9a n ASN 220 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1y9a n GLY 221 N 0.89 1.46 3.70 7.41 0.00 0.32 -5.01 105.19 113.95 1y9a n GLY 221 Ca 0.09 -2.17 -0.64 0.00 0.00 0.00 0.00 46.02 43.30 1y9a n GLY 221 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1y9a n ASP 222 N 0.00 1.19 0.17 1.61 -0.08 -1.26 -4.39 116.55 113.79 1y9a n ASP 222 Ca 0.00 1.17 0.02 0.00 -1.51 0.00 0.00 54.79 54.47 1y9a n ASP 222 Cb 0.00 -0.93 0.36 0.00 2.34 0.00 0.00 41.12 42.89 1y9a n ASP 222 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 1y9a h ILE 223 N 4.64 1.25 0.06 5.18 3.07 -1.92 -1.78 117.51 128.02 1y9a h ILE 223 Ca -0.46 -1.20 -0.00 0.00 1.55 0.00 0.00 64.86 64.75 1y9a h ILE 223 Cb 1.37 1.61 0.00 0.00 -0.27 0.00 0.00 36.82 39.54 1y9a h ILE 223 CO 0.92 0.35 -0.03 0.58 -1.05 0.00 0.00 178.15 178.91 1y9a h VAL 224 N 0.04 1.05 -0.96 0.16 2.07 -1.91 -1.43 116.25 115.27 1y9a h VAL 224 Ca 0.00 -0.36 0.05 0.00 0.82 0.00 0.00 66.70 67.22 1y9a h VAL 224 Cb 0.62 1.29 -0.06 0.00 -1.52 0.00 0.00 31.29 31.61 1y9a h VAL 224 CO 0.05 0.09 0.62 -0.33 0.02 0.00 0.00 177.57 178.02 1y9a h GLU 225 N -0.24 1.12 -0.15 1.57 5.08 -1.87 0.19 114.58 120.28 1y9a h GLU 225 Ca -0.01 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1y9a h GLU 225 Cb 0.21 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1y9a h GLU 225 CO 0.01 0.74 0.10 1.96 -1.00 0.00 0.00 179.01 180.82 1y9a h GLN 226 N 1.15 0.19 -0.43 2.33 4.20 -1.20 -0.70 115.11 120.66 1y9a h GLN 226 Ca 0.40 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 59.02 1y9a h GLN 226 Cb 0.11 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 1y9a h GLN 226 CO -0.15 0.13 -0.03 0.82 -0.67 0.00 0.00 178.83 178.93 1y9a h ILE 227 N 0.20 1.27 -0.76 2.54 1.08 -0.75 -1.13 117.51 119.95 1y9a h ILE 227 Ca 0.05 -1.09 -0.03 0.00 -0.39 0.00 0.00 64.86 63.41 1y9a h ILE 227 Cb -0.02 1.10 -0.03 0.00 -3.07 0.00 0.00 36.82 34.80 1y9a h ILE 227 CO -0.01 0.37 0.37 -0.07 -0.69 0.00 0.00 178.15 178.12 1y9a h LEU 228 N 0.62 0.99 -0.10 1.44 3.38 -0.47 -1.51 115.31 119.67 1y9a h LEU 228 Ca 0.12 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1y9a h LEU 228 Cb 0.53 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1y9a h LEU 228 CO 0.03 0.84 0.01 0.50 0.09 0.00 0.00 178.44 179.92 1y9a h LYS 229 N 1.07 0.05 0.00 1.13 1.63 -0.97 0.66 116.57 120.14 1y9a h LYS 229 Ca 0.26 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.05 1y9a h LYS 229 Cb 0.11 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1y9a h LYS 229 CO -0.03 0.04 -0.03 0.00 -3.45 0.00 0.00 179.45 175.97 1y9a h ALA 230 N 1.07 1.10 -0.33 5.00 0.00 -0.90 -2.18 119.26 123.01 1y9a h ALA 230 Ca 0.04 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1y9a h ALA 230 Cb 0.04 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.75 1y9a h ALA 230 CO -0.06 0.04 -0.02 0.25 0.00 0.00 0.00 179.25 179.46 1y9a n THR 231 N -3.27 2.46 -4.21 0.00 -2.24 -0.59 -4.96 114.28 101.47 1y9a n THR 231 Ca -0.02 -2.37 -0.33 0.00 -2.27 0.00 0.00 64.05 59.06 1y9a n THR 231 Cb 0.19 -0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 68.07 1y9a n THR 231 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1y9a n ASP 232 N -0.90 -1.32 0.00 3.42 8.00 -0.82 -0.89 116.55 124.03 1y9a n ASP 232 Ca 0.29 -1.10 0.00 0.00 0.71 0.00 0.00 54.79 54.69 1y9a n ASP 232 Cb 1.00 -2.43 0.00 0.00 -0.02 0.00 0.00 41.12 39.67 1y9a n ASP 232 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1y9a n GLY 233 N -1.77 2.58 0.13 0.44 0.00 0.23 -4.87 105.19 101.93 1y9a n GLY 233 Ca -0.12 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.93 1y9a n GLY 233 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1y9a h LYS 234 N 1.69 0.00 0.00 1.61 -0.00 -1.24 -3.49 116.57 115.14 1y9a h LYS 234 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.65 1y9a h LYS 234 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.23 1y9a h LYS 234 CO 0.00 0.44 0.00 0.41 -0.00 0.00 0.00 179.45 180.30 1y9a n GLY 235 N 1.25 -2.57 3.97 0.07 0.00 -1.26 -4.35 105.19 102.30 1y9a n GLY 235 Ca -0.00 -1.79 -0.21 0.00 0.00 0.00 0.00 46.02 44.02 1y9a n GLY 235 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1y9a s VAL 236 N -0.46 4.78 0.04 1.61 -7.23 -0.40 -4.80 120.40 113.94 1y9a s VAL 236 Ca 0.00 -0.89 -0.17 0.00 -1.81 0.00 0.00 61.98 59.10 1y9a s VAL 236 Cb 0.00 -3.69 -0.20 0.00 0.56 0.00 0.00 36.38 33.05 1y9a s VAL 236 CO 0.00 -0.30 1.19 0.44 -0.31 0.00 0.00 175.10 176.12 1y9a h ASP 237 N 0.98 0.67 -4.86 4.85 3.32 -1.38 -0.91 116.42 119.08 1y9a h ASP 237 Ca -0.49 -0.69 -0.14 0.00 0.02 0.00 0.00 57.03 55.73 1y9a h ASP 237 Cb 1.24 -0.20 -0.21 0.00 0.22 0.00 0.00 39.33 40.38 1y9a h ASP 237 CO 0.58 1.26 -0.42 -0.54 -1.72 0.00 0.00 179.24 178.40 1y9a s LYS 238 N -3.49 0.52 -0.02 3.56 -0.14 -1.05 -4.26 119.74 114.86 1y9a s LYS 238 Ca -0.12 -0.27 0.04 0.00 -1.36 0.00 0.00 55.97 54.26 1y9a s LYS 238 Cb 0.05 0.22 -0.00 0.00 -1.68 0.00 0.00 37.83 36.42 1y9a s LYS 238 CO 0.85 -0.13 -0.12 0.08 -0.76 0.00 0.00 175.35 175.27 1y9a s VAL 239 N -1.22 1.01 -0.14 3.17 1.01 -0.84 -1.66 120.40 121.73 1y9a s VAL 239 Ca -0.13 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 1y9a s VAL 239 Cb -0.06 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.44 1y9a s VAL 239 CO 0.02 0.29 -0.10 -0.69 0.00 0.00 0.00 175.10 174.63 1y9a s VAL 240 N -0.09 3.33 -0.27 2.92 1.01 0.15 -0.88 120.40 126.58 1y9a s VAL 240 Ca 0.01 -0.56 -0.10 0.00 0.00 0.00 0.00 61.98 61.33 1y9a s VAL 240 Cb -0.07 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 1y9a s VAL 240 CO 0.00 0.52 0.16 -0.63 0.00 0.00 0.00 175.10 175.15 1y9a s ILE 241 N 0.31 5.03 -0.04 2.22 1.01 0.10 -1.27 121.20 128.56 1y9a s ILE 241 Ca -0.08 0.08 0.06 0.00 0.00 0.00 0.00 60.65 60.71 1y9a s ILE 241 Cb -0.15 -3.39 0.09 0.00 0.01 0.00 0.00 42.46 39.02 1y9a s ILE 241 CO 0.05 0.27 1.00 0.00 0.00 0.00 0.00 174.94 176.26 1y9a n ALA 242 N 5.02 1.99 -3.40 9.38 0.00 0.57 -1.43 120.51 132.64 1y9a n ALA 242 Ca -0.15 -1.48 0.07 0.00 0.00 0.00 0.00 53.44 51.89 1y9a n ALA 242 Cb 0.52 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.59 1y9a n ALA 242 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y9a n GLY 243 N -0.49 0.40 4.50 0.00 0.00 -0.96 -4.33 105.19 104.31 1y9a n GLY 243 Ca 0.05 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1y9a n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y9a n GLY 244 N -0.37 0.59 0.27 -0.02 0.00 -1.26 -4.74 105.19 99.66 1y9a n GLY 244 Ca 0.02 -1.12 0.18 0.00 0.00 0.00 0.00 46.02 45.10 1y9a n GLY 244 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1y9a h VAL 246 N 0.00 0.00 -0.01 1.61 -1.51 -1.91 -3.48 116.25 110.95 1y9a h VAL 246 Ca 0.00 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.23 1y9a h VAL 246 Cb 0.00 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 30.31 1y9a h VAL 246 CO 0.00 0.00 -0.20 1.41 -1.23 0.00 0.00 177.57 177.55 1y9a n HIS 247 N -2.90 0.00 0.15 5.19 8.25 -1.26 -3.97 115.22 120.68 1y9a n HIS 247 Ca -0.01 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.46 1y9a n HIS 247 Cb 0.18 -0.08 0.23 0.00 1.12 0.00 0.00 29.99 31.44 1y9a n HIS 247 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1y9a h THR 248 N 1.73 1.28 -0.63 1.59 2.02 -1.94 -3.15 112.91 113.80 1y9a h THR 248 Ca 0.00 -1.90 -0.04 0.00 0.77 0.00 0.00 66.41 65.23 1y9a h THR 248 Cb 0.54 2.06 -0.03 0.00 -1.74 0.00 0.00 68.15 68.98 1y9a h THR 248 CO 0.00 0.53 0.22 -0.26 0.37 0.00 0.00 175.52 176.38 1y9a h PHE 249 N 0.00 0.96 -0.78 3.16 -1.00 -1.87 -1.42 116.94 115.99 1y9a h PHE 249 Ca -0.01 -0.07 -0.02 0.00 2.81 0.00 0.00 57.97 60.68 1y9a h PHE 249 Cb 1.01 -0.29 -0.04 0.00 3.61 0.00 0.00 35.95 40.25 1y9a h PHE 249 CO 0.00 0.76 0.39 0.00 -1.61 0.00 0.00 178.31 177.85 1y9a h ALA 250 N 1.32 1.22 -0.05 2.45 0.00 -1.64 -0.85 119.26 121.71 1y9a h ALA 250 Ca 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1y9a h ALA 250 Cb 0.23 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1y9a h ALA 250 CO -0.01 0.61 0.03 1.96 0.00 0.00 0.00 179.25 181.84 1y9a h GLN 251 N 1.11 0.07 -0.39 0.00 4.20 -1.48 -0.34 115.11 118.28 1y9a h GLN 251 Ca 0.27 -0.00 0.07 0.00 0.06 0.00 0.00 58.65 59.05 1y9a h GLN 251 Cb 0.08 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.79 1y9a h GLN 251 CO -0.04 0.04 0.01 0.00 -0.67 0.00 0.00 178.83 178.18 1y9a h ALA 252 N 1.02 0.37 -0.79 3.87 0.00 -1.03 -1.38 119.26 121.31 1y9a h ALA 252 Ca 0.02 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1y9a h ALA 252 Cb -0.01 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1y9a h ALA 252 CO -0.01 -0.38 0.47 0.28 0.00 0.00 0.00 179.25 179.62 1y9a h VAL 253 N 0.12 1.22 0.00 0.00 2.07 -0.85 -2.55 116.25 116.27 1y9a h VAL 253 Ca 0.19 -0.49 -0.06 0.00 0.82 0.00 0.00 66.70 67.16 1y9a h VAL 253 Cb 0.26 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 1y9a h VAL 253 CO -0.31 0.23 -0.27 0.11 0.02 0.00 0.00 177.57 177.36 1y9a h LYS 254 N 1.08 0.00 -0.00 1.57 1.57 -0.49 -3.18 116.57 117.12 1y9a h LYS 254 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1y9a h LYS 254 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1y9a h LYS 254 CO -0.05 0.27 -0.83 0.00 -0.57 0.00 0.00 179.45 178.26 1y9a n MET 255 N -3.51 0.13 -3.92 3.15 0.00 -0.57 -4.97 117.12 107.43 1y9a n MET 255 Ca -0.00 -0.10 -0.33 0.00 0.00 0.00 0.00 57.70 57.26 1y9a n MET 255 Cb 0.42 -1.50 -0.05 0.00 0.00 0.00 0.00 33.22 32.10 1y9a n MET 255 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 175.97 174.47 1y9a s ILE 256 N -2.94 5.39 0.77 3.17 2.07 -0.99 -1.28 121.20 127.40 1y9a s ILE 256 Ca 0.10 -0.22 -0.14 0.00 -1.41 0.00 0.00 60.65 58.98 1y9a s ILE 256 Cb 0.17 -3.54 0.06 0.00 0.13 0.00 0.00 42.46 39.28 1y9a s ILE 256 CO 0.80 0.29 1.21 -0.54 -1.91 0.00 0.00 174.94 174.79 1y9a s LYS 257 N -2.04 1.88 0.63 3.50 1.02 -0.35 -4.82 119.74 119.56 1y9a s LYS 257 Ca 0.29 1.77 -0.17 0.00 0.02 0.00 0.00 55.97 57.88 1y9a s LYS 257 Cb -0.13 -1.80 -0.01 0.00 -0.52 0.00 0.00 37.83 35.37 1y9a s LYS 257 CO 0.20 -2.04 1.14 -1.25 -0.92 0.00 0.00 175.35 172.49 1y9a s PRO 258 N -4.02 2.84 -0.36 -1.68 0.04 -1.26 -4.21 135.00 126.36 1y9a s PRO 258 Ca 0.74 1.57 -0.03 0.00 0.04 0.00 0.00 61.00 63.32 1y9a s PRO 258 Cb -0.29 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1y9a s PRO 258 CO 0.48 -1.25 0.37 0.41 0.04 0.00 0.00 177.00 177.05 1y9a n GLY 259 N -0.06 -0.89 3.83 0.56 0.00 -0.66 -4.97 105.19 102.99 1y9a n GLY 259 Ca 0.12 0.32 -0.06 0.00 0.00 0.00 0.00 46.02 46.40 1y9a n GLY 259 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y9a s SER 260 N -2.35 -0.09 -0.01 1.61 1.04 -0.24 -5.00 113.70 108.66 1y9a s SER 260 Ca 0.04 -0.78 0.01 0.00 0.48 0.00 0.00 55.95 55.71 1y9a s SER 260 Cb -0.01 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.78 1y9a s SER 260 CO 0.42 -1.30 -0.03 -1.81 0.98 0.00 0.00 173.24 171.50 1y9a s ASP 261 N -3.09 0.41 -0.22 7.02 1.01 -1.26 -1.13 116.67 119.41 1y9a s ASP 261 Ca 0.15 -0.06 -0.02 0.00 0.71 0.00 0.00 52.55 53.34 1y9a s ASP 261 Cb -0.04 -0.08 0.01 0.00 1.01 0.00 0.00 42.92 43.83 1y9a s ASP 261 CO 0.07 0.02 -0.09 -0.63 0.21 0.00 0.00 175.17 174.76 1y9a s ILE 262 N 0.08 2.84 -0.39 0.77 1.01 0.13 -1.99 121.20 123.66 1y9a s ILE 262 Ca -0.00 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 59.75 1y9a s ILE 262 Cb -0.03 -2.34 0.07 0.00 0.01 0.00 0.00 42.46 40.17 1y9a s ILE 262 CO -0.00 0.36 0.19 -0.83 0.00 0.00 0.00 174.94 174.65 1y9a s GLY 263 N 1.37 1.92 -0.13 6.18 0.00 -0.06 -0.95 107.32 115.65 1y9a s GLY 263 Ca 0.03 -2.06 -0.12 0.00 0.00 0.00 0.00 44.72 42.57 1y9a s GLY 263 CO -0.06 0.90 0.27 0.21 0.00 0.00 0.00 173.10 174.42 1y9a s ASN 264 N 1.81 6.47 0.00 1.64 2.47 0.50 -0.72 114.94 127.11 1y9a s ASN 264 Ca 0.02 0.55 0.00 0.00 0.42 0.00 0.00 52.86 53.85 1y9a s ASN 264 Cb -0.22 -2.16 0.00 0.00 -1.45 0.00 0.00 41.25 37.42 1y9a s ASN 264 CO 0.01 0.20 0.59 1.33 -3.72 0.00 0.00 177.10 175.51 1y9a n VAL 265 N 3.00 0.34 -2.27 -5.21 0.24 -0.51 -1.53 118.33 112.40 1y9a n VAL 265 Ca -0.14 -0.48 -0.42 0.00 -2.04 0.00 0.00 64.34 61.26 1y9a n VAL 265 Cb 0.52 1.00 -0.03 0.00 -1.47 0.00 0.00 33.84 33.86 1y9a n VAL 265 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1y9a s ASN 266 N -0.34 6.92 -0.44 -1.34 2.47 -1.18 -4.97 114.94 116.05 1y9a s ASN 266 Ca 0.00 2.18 -0.28 0.00 0.42 0.00 0.00 52.86 55.17 1y9a s ASN 266 Cb 0.00 -2.58 0.03 0.00 -1.45 0.00 0.00 41.25 37.25 1y9a s ASN 266 CO 0.00 -0.60 1.07 -0.47 -3.72 0.00 0.00 177.10 173.38 1y9a s TYR 267 N 1.33 2.90 -0.29 0.43 6.04 -1.26 -4.98 117.35 121.51 1y9a s TYR 267 Ca 0.62 0.73 -0.25 0.00 0.04 0.00 0.00 57.07 58.22 1y9a s TYR 267 Cb -0.33 -4.18 0.00 0.00 -1.04 0.00 0.00 41.96 36.41 1y9a s TYR 267 CO 0.29 -1.13 0.86 -0.51 -1.54 0.00 0.00 175.55 173.52 1y9a s LEU 268 N 4.14 4.06 0.22 6.97 1.43 -1.26 -4.94 118.68 129.30 1y9a s LEU 268 Ca 0.45 0.83 0.23 0.00 -1.03 0.00 0.00 54.13 54.60 1y9a s LEU 268 Cb -0.09 -3.20 0.12 0.00 0.03 0.00 0.00 46.19 43.06 1y9a s LEU 268 CO 0.27 -0.65 1.19 1.23 0.23 0.00 0.00 176.35 178.62 1y9a h GLY 269 N 9.53 0.00 -2.81 -3.19 0.00 -1.93 -3.48 103.07 101.18 1y9a h GLY 269 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1y9a h GLY 269 CO 0.91 0.00 0.23 -1.83 0.00 0.00 0.00 176.54 175.85 1y9a s GLU 270 N -3.30 1.36 0.00 4.80 -1.05 -1.26 -4.32 118.70 114.93 1y9a s GLU 270 Ca 0.02 -0.57 0.00 0.00 -0.15 0.00 0.00 54.97 54.27 1y9a s GLU 270 Cb 0.10 0.58 0.00 0.00 -0.44 0.00 0.00 34.13 34.37 1y9a s GLU 270 CO 0.76 -0.60 0.00 0.41 0.95 0.00 0.00 175.26 176.77 1y9a n GLY 271 N -0.39 3.00 0.19 -3.83 0.00 -1.26 -4.63 105.19 98.27 1y9a n GLY 271 Ca -0.14 -1.57 -0.18 0.00 0.00 0.00 0.00 46.02 44.13 1y9a n GLY 271 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1y9a h ASP 272 N 0.00 0.83 -4.09 1.61 3.32 -2.03 -3.47 116.42 112.59 1y9a h ASP 272 Ca 0.00 -0.69 -0.28 0.00 0.02 0.00 0.00 57.03 56.07 1y9a h ASP 272 Cb 0.00 -0.25 -0.27 0.00 0.22 0.00 0.00 39.33 39.03 1y9a h ASP 272 CO 0.00 1.40 -0.74 0.20 -1.72 0.00 0.00 179.24 178.38 1y9a s ASN 273 N -7.07 0.50 -0.30 6.45 0.01 -1.26 -5.12 114.94 108.16 1y9a s ASN 273 Ca -0.11 -0.18 -0.17 0.00 -0.71 0.00 0.00 52.86 51.69 1y9a s ASN 273 Cb 0.07 -0.02 -0.02 0.00 0.41 0.00 0.00 41.25 41.68 1y9a s ASN 273 CO 0.89 -0.02 0.46 -0.63 -1.51 0.00 0.00 177.10 176.29 1y9a s ILE 274 N -0.41 5.09 -0.21 0.60 1.01 -1.26 -4.88 121.20 121.14 1y9a s ILE 274 Ca -0.02 0.55 -0.21 0.00 0.00 0.00 0.00 60.65 60.97 1y9a s ILE 274 Cb -0.04 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 1y9a s ILE 274 CO -0.00 -0.01 0.64 1.51 0.00 0.00 0.00 174.94 177.08 1y9a s ASP 275 N 1.66 6.68 -0.23 3.58 -4.77 -1.26 -5.06 116.67 117.27 1y9a s ASP 275 Ca 0.18 0.83 -0.06 0.00 -3.30 0.00 0.00 52.55 50.19 1y9a s ASP 275 Cb -0.16 -2.35 -0.02 0.00 -1.09 0.00 0.00 42.92 39.30 1y9a s ASP 275 CO 0.11 -0.31 0.03 -0.63 0.70 0.00 0.00 175.17 175.08 1y9a s ILE 276 N 2.07 4.06 -0.01 2.11 -1.09 -1.26 -3.78 121.20 123.30 1y9a s ILE 276 Ca 0.29 -0.26 -0.30 0.00 -2.23 0.00 0.00 60.65 58.14 1y9a s ILE 276 Cb -0.16 -2.87 -0.05 0.00 -1.58 0.00 0.00 42.46 37.80 1y9a s ILE 276 CO 0.10 0.38 1.36 -2.16 -1.23 0.00 0.00 174.94 173.39 1y9a s PRO 277 N 1.45 4.30 0.12 2.79 0.04 -1.26 -4.94 135.00 137.49 1y9a s PRO 277 Ca 0.05 1.92 -0.24 0.00 0.04 0.00 0.00 61.00 62.77 1y9a s PRO 277 Cb -0.15 -3.56 -0.07 0.00 0.04 0.00 0.00 34.50 30.77 1y9a s PRO 277 CO 0.02 -0.55 1.67 -0.09 0.04 0.00 0.00 177.00 178.09 1y9a h ARG 278 N 7.73 -0.26 -0.12 4.56 2.43 -1.98 -1.97 114.38 124.77 1y9a h ARG 278 Ca -0.37 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 58.81 1y9a h ARG 278 Cb 1.18 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 1y9a h ARG 278 CO 0.90 -0.18 0.06 0.77 -1.51 0.00 0.00 179.97 180.02 1y9a h SER 279 N -0.27 0.15 0.96 -3.80 0.02 -1.96 -0.20 113.55 108.45 1y9a h SER 279 Ca 0.05 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1y9a h SER 279 Cb 0.34 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1y9a h SER 279 CO -0.16 0.20 0.00 -0.33 -1.14 0.00 0.00 176.83 175.41 1y9a h GLU 280 N 0.09 0.00 -0.50 3.45 3.07 -1.95 -0.97 114.58 117.77 1y9a h GLU 280 Ca 0.04 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 1y9a h GLU 280 Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1y9a h GLU 280 CO -0.01 0.00 0.00 1.87 -1.40 0.00 0.00 179.01 179.47 1y9a n TRP 281 N -2.66 0.54 -2.41 4.33 -0.00 -0.74 -4.83 117.44 111.67 1y9a n TRP 281 Ca 0.02 -0.22 -0.06 0.00 -0.00 0.00 0.00 57.50 57.23 1y9a n TRP 281 Cb 0.29 -0.10 0.01 0.00 -0.00 0.00 0.00 31.31 31.50 1y9a n TRP 281 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1y9a n GLY 282 N 0.66 0.29 4.20 5.87 0.00 -0.37 -2.42 105.19 113.42 1y9a n GLY 282 Ca 0.10 -0.54 -0.36 0.00 0.00 0.00 0.00 46.02 45.22 1y9a n GLY 282 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1y9a n VAL 283 N -3.68 -0.69 -0.06 1.61 0.24 -0.11 -1.23 118.33 114.42 1y9a n VAL 283 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 1y9a n VAL 283 Cb 0.54 -1.30 0.00 0.00 -1.47 0.00 0.00 33.84 31.61 1y9a n VAL 283 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1y9a n GLY 284 N -1.25 0.46 0.20 7.63 0.00 -1.14 -4.96 105.19 106.12 1y9a n GLY 284 Ca 0.08 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.11 1y9a n GLY 284 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1y9a n MET 285 N -2.00 0.32 0.00 1.61 2.81 -0.36 -4.86 117.12 114.64 1y9a n MET 285 Ca 0.00 -0.91 0.15 0.00 -1.81 0.00 0.00 57.70 55.13 1y9a n MET 285 Cb 0.00 -0.61 0.84 0.00 -0.71 0.00 0.00 33.22 32.74 1y9a n MET 285 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1y9a n GLY 286 N -0.14 -1.14 4.23 3.03 0.00 -1.01 -4.92 105.19 105.25 1y9a n GLY 286 Ca 0.01 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 1y9a n GLY 286 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1y9a n HIS 287 N -1.15 -1.65 -3.19 1.61 8.25 -1.26 -1.66 115.22 116.17 1y9a n HIS 287 Ca 0.19 0.77 -0.46 0.00 -0.26 0.00 0.00 57.72 57.96 1y9a n HIS 287 Cb 0.18 -2.92 -0.03 0.00 1.12 0.00 0.00 29.99 28.34 1y9a n HIS 287 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1y9a s LYS 288 N -6.94 3.52 0.22 -0.41 1.02 -1.26 -1.08 119.74 114.80 1y9a s LYS 288 Ca 0.63 -2.12 -0.30 0.00 0.02 0.00 0.00 55.97 54.20 1y9a s LYS 288 Cb -0.34 -4.54 -0.08 0.00 -0.52 0.00 0.00 37.83 32.34 1y9a s LYS 288 CO 0.94 -1.45 1.09 -1.01 -0.92 0.00 0.00 175.35 174.00 1y9a s HIS 289 N 1.19 3.61 -0.16 3.18 3.76 -0.28 -4.90 115.29 121.69 1y9a s HIS 289 Ca 0.21 1.65 0.01 0.00 -0.15 0.00 0.00 55.06 56.77 1y9a s HIS 289 Cb -0.11 -3.26 0.01 0.00 1.11 0.00 0.00 32.58 30.32 1y9a s HIS 289 CO -0.07 -0.53 -0.17 0.42 -0.85 0.00 0.00 174.74 173.54 1y9a s ILE 290 N -0.62 2.44 -0.00 0.60 1.01 -1.26 -0.69 121.20 122.67 1y9a s ILE 290 Ca 0.47 -0.84 0.05 0.00 0.00 0.00 0.00 60.65 60.34 1y9a s ILE 290 Cb -0.30 -2.03 -0.01 0.00 0.01 0.00 0.00 42.46 40.13 1y9a s ILE 290 CO 0.37 0.52 -0.16 -1.00 0.00 0.00 0.00 174.94 174.67 1y9a s HIS 291 N 0.98 1.44 -0.21 3.97 3.76 -0.12 -4.99 115.29 120.12 1y9a s HIS 291 Ca -0.03 -0.29 -0.04 0.00 -0.15 0.00 0.00 55.06 54.56 1y9a s HIS 291 Cb -0.15 -0.91 0.10 0.00 1.11 0.00 0.00 32.58 32.73 1y9a s HIS 291 CO -0.04 -0.01 0.25 0.20 -0.85 0.00 0.00 174.74 174.29 1y9a s GLY 292 N -0.54 -0.06 0.00 -2.22 0.00 -1.26 -0.37 107.32 102.88 1y9a s GLY 292 Ca 0.06 0.31 0.00 0.00 0.00 0.00 0.00 44.72 45.09 1y9a s GLY 292 CO -0.00 2.25 -0.01 -0.32 0.00 0.00 0.00 173.10 175.02 1y9a s GLY 293 N 2.36 0.07 0.32 0.20 0.00 -0.58 -4.99 107.32 104.70 1y9a s GLY 293 Ca 0.08 -0.14 -0.28 0.00 0.00 0.00 0.00 44.72 44.38 1y9a s GLY 293 CO -0.14 -0.15 1.12 -2.27 0.00 0.00 0.00 173.10 171.66 1y9a s LEU 294 N -0.30 4.43 0.32 0.66 2.96 -1.26 -4.58 118.68 120.90 1y9a s LEU 294 Ca -0.03 2.29 -0.28 0.00 -0.22 0.00 0.00 54.13 55.89 1y9a s LEU 294 Cb -0.02 -3.77 -0.13 0.00 0.50 0.00 0.00 46.19 42.77 1y9a s LEU 294 CO -0.00 -0.30 1.16 1.07 -1.32 0.00 0.00 176.35 176.95 1y9a n THR 295 N 0.81 1.99 -0.78 3.68 5.66 -1.26 -4.95 114.28 119.43 1y9a n THR 295 Ca 0.01 -0.50 -0.33 0.00 -3.05 0.00 0.00 64.05 60.18 1y9a n THR 295 Cb 0.45 -1.30 0.13 0.00 -1.55 0.00 0.00 70.33 68.06 1y9a n THR 295 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1y9a n PRO 296 N 0.64 -0.32 0.00 1.09 -0.02 -1.26 -4.79 135.00 130.34 1y9a n PRO 296 Ca 0.07 -0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1y9a n PRO 296 Cb 0.34 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1y9a n PRO 296 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y9a n GLY 297 N 1.36 4.43 0.00 -1.23 0.00 -1.26 -4.69 105.19 103.80 1y9a n GLY 297 Ca 0.07 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1y9a n GLY 297 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y9a n GLY 298 N 0.00 -0.94 0.25 -0.02 0.00 -0.91 -4.34 105.19 99.24 1y9a n GLY 298 Ca 0.00 -1.66 -0.11 0.00 0.00 0.00 0.00 46.02 44.25 1y9a n GLY 298 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1y9a h ARG 299 N 0.00 0.80 -0.40 1.61 0.11 -1.26 -2.94 114.38 112.30 1y9a h ARG 299 Ca 0.00 -0.41 -0.03 0.00 0.10 0.00 0.00 59.98 59.64 1y9a h ARG 299 Cb 0.00 0.01 -0.02 0.00 1.11 0.00 0.00 29.97 31.07 1y9a h ARG 299 CO 0.00 1.04 0.14 0.28 0.10 0.00 0.00 179.97 181.53 1y9a h VAL 300 N 0.65 1.21 -0.49 0.08 2.07 -1.84 0.17 116.25 118.10 1y9a h VAL 300 Ca 0.05 -0.66 0.06 0.00 0.82 0.00 0.00 66.70 66.98 1y9a h VAL 300 Cb 0.95 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 31.56 1y9a h VAL 300 CO 0.09 0.23 0.20 -0.09 0.02 0.00 0.00 177.57 178.02 1y9a h ARG 301 N 0.49 0.38 -0.56 1.57 9.65 -1.74 -0.34 114.38 123.83 1y9a h ARG 301 Ca 0.13 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.97 1y9a h ARG 301 Cb 0.23 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.69 1y9a h ARG 301 CO -0.01 0.25 0.27 0.52 2.80 0.00 0.00 179.97 183.81 1y9a h MET 302 N 0.39 0.80 -0.53 0.20 2.86 -1.19 -2.51 114.93 114.95 1y9a h MET 302 Ca 0.23 -0.12 0.03 0.00 -2.06 0.00 0.00 59.70 57.78 1y9a h MET 302 Cb 0.21 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.69 1y9a h MET 302 CO -0.21 0.65 0.31 0.93 1.06 0.00 0.00 176.91 179.65 1y9a h GLU 303 N 0.75 0.59 -0.16 1.72 5.08 -0.17 0.31 114.58 122.71 1y9a h GLU 303 Ca 0.19 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1y9a h GLU 303 Cb 0.11 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1y9a h GLU 303 CO -0.02 0.39 0.02 0.87 -1.00 0.00 0.00 179.01 179.27 1y9a h LYS 304 N 0.61 0.28 -0.26 2.33 1.79 -1.05 -2.31 116.57 117.95 1y9a h LYS 304 Ca 0.22 -0.08 -0.15 0.00 -2.18 0.00 0.00 60.65 58.46 1y9a h LYS 304 Cb 0.04 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.66 1y9a h LYS 304 CO -0.11 0.46 -0.43 -0.07 -1.08 0.00 0.00 179.45 178.22 1y9a h LEU 305 N 0.05 0.71 -1.68 2.94 3.38 -1.41 -2.78 115.31 116.53 1y9a h LEU 305 Ca 0.05 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.73 1y9a h LEU 305 Cb 0.32 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1y9a h LEU 305 CO 0.00 1.05 0.28 0.00 0.09 0.00 0.00 178.44 179.86 1y9a h ALA 306 N 0.98 1.88 0.00 1.53 0.00 -0.85 -1.48 119.26 121.31 1y9a h ALA 306 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1y9a h ALA 306 Cb 0.97 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1y9a h ALA 306 CO 0.09 0.06 -0.05 0.66 0.00 0.00 0.00 179.25 180.01 1y9a h SER 307 N 0.41 0.00 0.46 0.00 4.64 -1.12 -0.86 113.55 117.08 1y9a h SER 307 Ca 0.18 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.36 1y9a h SER 307 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1y9a h SER 307 CO -0.04 0.05 -0.58 -0.07 -0.87 0.00 0.00 176.83 175.32 1y9a h LEU 308 N 0.00 0.14 -0.07 5.97 3.38 -1.33 -1.44 115.31 121.96 1y9a h LEU 308 Ca -0.00 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 1y9a h LEU 308 Cb 0.10 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1y9a h LEU 308 CO 0.01 0.69 -0.13 0.40 0.09 0.00 0.00 178.44 179.50 1y9a h ILE 309 N 0.10 1.40 -0.27 1.22 2.04 -1.21 0.95 117.51 121.73 1y9a h ILE 309 Ca -0.00 -1.41 -0.02 0.00 1.00 0.00 0.00 64.86 64.42 1y9a h ILE 309 Cb 1.06 2.16 -0.01 0.00 -0.74 0.00 0.00 36.82 39.28 1y9a h ILE 309 CO 0.08 0.40 0.08 0.28 0.00 0.00 0.00 178.15 178.99 1y9a h SER 310 N -0.25 0.35 0.07 1.72 0.02 -1.09 -2.04 113.55 112.34 1y9a h SER 310 Ca 0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1y9a h SER 310 Cb 0.70 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1y9a h SER 310 CO 0.03 0.34 -0.04 0.35 -1.14 0.00 0.00 176.83 176.37 1y9a n THR 311 N -4.40 0.00 -0.69 -2.27 -2.24 -0.55 -4.92 114.28 99.21 1y9a n THR 311 Ca 0.01 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1y9a n THR 311 Cb 0.15 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 1y9a n THR 311 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y9a n GLY 312 N 1.17 0.61 0.38 3.38 0.00 -0.77 -4.94 105.19 105.03 1y9a n GLY 312 Ca 0.19 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.91 1y9a n GLY 312 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1y9a n LYS 313 N -2.69 1.39 -3.69 1.61 5.02 0.20 -4.87 118.16 115.14 1y9a n LYS 313 Ca 0.00 -0.80 -0.10 0.00 -2.02 0.00 0.00 58.31 55.40 1y9a n LYS 313 Cb 0.00 -1.38 -0.10 0.00 -0.02 0.00 0.00 35.03 33.53 1y9a n LYS 313 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1y9a s LEU 314 N -2.33 -0.25 -0.41 -0.35 2.96 -0.45 -4.92 118.68 112.93 1y9a s LEU 314 Ca 0.15 0.96 -0.01 0.00 -0.22 0.00 0.00 54.13 55.00 1y9a s LEU 314 Cb 0.15 1.44 0.11 0.00 0.50 0.00 0.00 46.19 48.39 1y9a s LEU 314 CO 0.52 -0.20 0.19 -0.62 -1.32 0.00 0.00 176.35 174.91 1y9a s ASP 315 N 1.60 5.15 0.08 3.68 -1.08 -1.26 -4.07 116.67 120.76 1y9a s ASP 315 Ca -0.09 -2.10 0.27 0.00 -0.52 0.00 0.00 52.55 50.11 1y9a s ASP 315 Cb -0.09 -1.79 0.84 0.00 -1.46 0.00 0.00 42.92 40.42 1y9a s ASP 315 CO -0.13 -0.50 1.69 0.35 0.52 0.00 0.00 175.17 177.10 1y9a n THR 316 N 4.47 0.23 0.28 1.71 -2.24 -1.26 -3.95 114.28 113.52 1y9a n THR 316 Ca -0.01 -0.13 0.12 0.00 -2.27 0.00 0.00 64.05 61.76 1y9a n THR 316 Cb 0.41 -0.33 0.79 0.00 -2.10 0.00 0.00 70.33 69.10 1y9a n THR 316 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1y9a h SER 317 N 0.00 0.00 0.31 3.42 4.64 -1.92 -1.92 113.55 118.08 1y9a h SER 317 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1y9a h SER 317 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1y9a h SER 317 CO 0.00 0.01 0.00 0.11 -0.87 0.00 0.00 176.83 176.08 1y9a h LYS 318 N 0.00 0.00 0.00 4.77 1.57 -2.02 -2.23 116.57 118.66 1y9a h LYS 318 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1y9a h LYS 318 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1y9a h LYS 318 CO 0.00 0.00 -0.06 -0.07 -0.57 0.00 0.00 179.45 178.75 1y9a h LEU 319 N 0.00 0.00 -8.90 2.94 3.38 -1.63 -3.45 115.31 107.65 1y9a h LEU 319 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 1y9a h LEU 319 Cb 0.16 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.78 1y9a h LEU 319 CO 0.00 0.06 0.14 -0.63 0.09 0.00 0.00 178.44 178.10 1y9a s ILE 320 N -3.34 4.95 -0.14 1.22 1.01 -0.84 -1.22 121.20 122.84 1y9a s ILE 320 Ca 0.05 0.87 0.07 0.00 0.00 0.00 0.00 60.65 61.63 1y9a s ILE 320 Cb 0.07 -3.99 -0.09 0.00 0.01 0.00 0.00 42.46 38.46 1y9a s ILE 320 CO 0.64 -0.12 0.21 0.35 0.00 0.00 0.00 174.94 176.02 1y9a n THR 321 N 5.37 0.00 -3.84 2.92 -2.24 -0.26 -4.90 114.28 111.33 1y9a n THR 321 Ca -0.01 -0.24 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 1y9a n THR 321 Cb 0.49 0.62 -0.15 0.00 -2.10 0.00 0.00 70.33 69.19 1y9a n THR 321 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1y9a s HIS 322 N -2.12 0.07 -0.06 4.78 3.76 -1.23 -4.96 115.29 115.53 1y9a s HIS 322 Ca -0.00 0.06 0.04 0.00 -0.15 0.00 0.00 55.06 55.01 1y9a s HIS 322 Cb 0.05 -0.19 -0.00 0.00 1.11 0.00 0.00 32.58 33.55 1y9a s HIS 322 CO 0.28 -0.06 -0.19 1.03 -0.85 0.00 0.00 174.74 174.95 1y9a s ARG 323 N 0.67 2.18 0.26 1.40 0.52 -1.26 -0.97 118.95 121.76 1y9a s ARG 323 Ca -0.06 -0.68 0.07 0.00 -0.52 0.00 0.00 55.73 54.54 1y9a s ARG 323 Cb -0.08 -1.79 -0.05 0.00 0.52 0.00 0.00 34.95 33.54 1y9a s ARG 323 CO -0.02 0.21 -0.09 -0.06 0.02 0.00 0.00 175.30 175.36 1y9a s PHE 324 N 0.19 1.94 -0.05 -0.53 0.40 0.11 -4.97 117.98 115.06 1y9a s PHE 324 Ca -0.09 -0.64 0.04 0.00 -0.60 0.00 0.00 56.93 55.65 1y9a s PHE 324 Cb -0.14 -1.04 -0.00 0.00 0.51 0.00 0.00 43.02 42.35 1y9a s PHE 324 CO 0.04 0.34 -0.18 -1.21 0.70 0.00 0.00 175.22 174.91 1y9a s GLU 325 N -3.69 1.93 0.00 0.44 0.41 -1.26 -0.82 118.70 115.72 1y9a s GLU 325 Ca 0.28 -0.65 0.00 0.00 -0.41 0.00 0.00 54.97 54.19 1y9a s GLU 325 Cb 0.02 -1.66 0.00 0.00 -1.78 0.00 0.00 34.13 30.71 1y9a s GLU 325 CO 0.11 0.25 0.00 0.41 -0.49 0.00 0.00 175.26 175.54 1y9a n GLY 326 N 3.16 1.76 0.37 -1.39 0.00 0.48 -4.66 105.19 104.92 1y9a n GLY 326 Ca -0.18 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1y9a n GLY 326 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1y9a h LEU 327 N 0.00 1.07 -2.40 0.99 5.85 -1.97 -1.80 115.31 117.04 1y9a h LEU 327 Ca 0.00 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1y9a h LEU 327 Cb 0.00 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.78 1y9a h LEU 327 CO 0.00 0.74 -0.03 1.05 -0.34 0.00 0.00 178.44 179.86 1y9a h GLU 328 N 1.24 0.00 0.00 1.25 -0.00 -1.99 -1.57 114.58 113.52 1y9a h GLU 328 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.74 1y9a h GLU 328 Cb -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.73 1y9a h GLU 328 CO -0.11 0.03 0.00 1.63 -0.00 0.00 0.00 179.01 180.56 1y9a n LYS 329 N -3.57 0.25 0.30 1.06 4.76 -0.68 -2.49 118.16 117.80 1y9a n LYS 329 Ca -0.02 0.12 0.17 0.00 -2.87 0.00 0.00 58.31 55.70 1y9a n LYS 329 Cb 0.13 -1.50 0.91 0.00 -1.84 0.00 0.00 35.03 32.73 1y9a n LYS 329 CO 0.00 0.00 0.00 -0.39 -1.37 0.00 0.00 177.40 175.64 1y9a h VAL 330 N 0.00 0.26 0.14 -0.18 -1.51 -1.45 -1.41 116.25 112.11 1y9a h VAL 330 Ca 0.00 -0.30 -0.01 0.00 -1.23 0.00 0.00 66.70 65.17 1y9a h VAL 330 Cb 0.17 1.23 0.00 0.00 -2.13 0.00 0.00 31.29 30.55 1y9a h VAL 330 CO 0.00 0.04 -0.07 -0.08 -1.23 0.00 0.00 177.57 176.24 1y9a h GLU 331 N 0.00 -0.18 -0.71 5.19 4.81 -1.72 -1.13 114.58 120.83 1y9a h GLU 331 Ca -0.00 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.34 1y9a h GLU 331 Cb 0.22 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.57 1y9a h GLU 331 CO 0.01 0.23 0.34 -0.44 -0.73 0.00 0.00 179.01 178.41 1y9a h ASP 332 N -0.65 0.42 -0.28 1.04 5.19 -1.70 -0.81 116.42 119.63 1y9a h ASP 332 Ca -0.02 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 1y9a h ASP 332 Cb 0.49 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.99 1y9a h ASP 332 CO 0.03 0.23 0.18 0.00 -3.12 0.00 0.00 179.24 176.56 1y9a h ALA 333 N 1.45 0.36 -0.46 3.45 0.00 -1.22 -0.93 119.26 121.91 1y9a h ALA 333 Ca 0.36 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 1y9a h ALA 333 Cb 0.41 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1y9a h ALA 333 CO -0.29 -0.16 0.03 1.25 0.00 0.00 0.00 179.25 180.08 1y9a h LEU 334 N 0.37 0.70 -1.10 0.00 5.85 -0.88 -2.29 115.31 117.96 1y9a h LEU 334 Ca 0.10 -0.15 -0.07 0.00 0.84 0.00 0.00 57.88 58.60 1y9a h LEU 334 Cb -0.02 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 1y9a h LEU 334 CO -0.02 0.75 -0.15 0.24 -0.34 0.00 0.00 178.44 178.92 1y9a h MET 335 N 0.70 0.45 -0.70 1.25 2.86 -0.58 -1.06 114.93 117.84 1y9a h MET 335 Ca 0.14 -0.14 0.09 0.00 -2.06 0.00 0.00 59.70 57.74 1y9a h MET 335 Cb 0.39 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 31.94 1y9a h MET 335 CO 0.01 0.60 0.35 -0.07 1.06 0.00 0.00 176.91 178.87 1y9a h LEU 336 N 0.42 0.47 -1.65 1.22 3.38 -0.61 0.83 115.31 119.36 1y9a h LEU 336 Ca 0.08 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1y9a h LEU 336 Cb 0.52 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1y9a h LEU 336 CO 0.03 0.27 -0.19 0.24 0.09 0.00 0.00 178.44 178.88 1y9a h MET 337 N 0.61 0.00 0.03 1.13 2.86 -0.97 -0.42 114.93 118.16 1y9a h MET 337 Ca 0.34 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.94 1y9a h MET 337 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 1y9a h MET 337 CO -0.26 0.19 -0.18 -0.22 1.06 0.00 0.00 176.91 177.50 1y9a h LYS 338 N 0.00 0.06 0.00 1.72 3.64 -0.60 -3.37 116.57 118.02 1y9a h LYS 338 Ca -0.00 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 1y9a h LYS 338 Cb 0.36 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1y9a h LYS 338 CO 0.02 1.05 -0.12 -0.91 -2.27 0.00 0.00 179.45 177.22 1y9a h ASN 339 N -0.87 0.00 -5.96 4.20 2.35 -0.80 -3.49 115.58 111.00 1y9a h ASN 339 Ca -0.03 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.40 1y9a h ASN 339 Cb 1.13 0.00 0.08 0.00 0.05 0.00 0.00 38.32 39.58 1y9a h ASN 339 CO 0.03 0.12 -0.75 0.29 -1.65 0.00 0.00 177.43 175.48 1y9a n LYS 340 N -3.14 -1.47 -1.72 0.81 4.76 -0.18 -5.00 118.16 112.22 1y9a n LYS 340 Ca 0.03 0.79 -0.36 0.00 -2.87 0.00 0.00 58.31 55.91 1y9a n LYS 340 Cb 0.55 -4.56 0.06 0.00 -1.84 0.00 0.00 35.03 29.24 1y9a n LYS 340 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1y9a s PRO 341 N -4.92 2.55 0.00 1.97 0.04 -1.26 -4.91 135.00 128.47 1y9a s PRO 341 Ca 0.32 1.86 0.13 0.00 0.04 0.00 0.00 61.00 63.34 1y9a s PRO 341 Cb -0.09 -1.87 0.56 0.00 0.04 0.00 0.00 34.50 33.14 1y9a s PRO 341 CO 0.82 -1.54 1.41 0.00 0.04 0.00 0.00 177.00 177.73 1y9a n ALA 342 N -2.10 1.60 0.27 8.56 0.00 -1.26 -2.08 120.51 125.51 1y9a n ALA 342 Ca 0.14 -0.05 0.17 0.00 0.00 0.00 0.00 53.44 53.70 1y9a n ALA 342 Cb 0.49 -1.21 0.66 0.00 0.00 0.00 0.00 19.45 19.40 1y9a n ALA 342 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1y9a h ASP 343 N 0.00 0.00 -3.24 0.00 1.82 -2.01 -3.48 116.42 109.51 1y9a h ASP 343 Ca 0.00 0.00 -0.59 0.00 -0.39 0.00 0.00 57.03 56.05 1y9a h ASP 343 Cb 0.22 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 40.15 1y9a h ASP 343 CO 0.00 0.02 -0.19 -0.22 -1.61 0.00 0.00 179.24 177.24 1y9a s LEU 344 N -6.26 4.32 0.00 2.28 2.96 -0.88 -4.89 118.68 116.21 1y9a s LEU 344 Ca 0.01 0.79 0.00 0.00 -0.22 0.00 0.00 54.13 54.71 1y9a s LEU 344 Cb 0.09 -2.60 0.00 0.00 0.50 0.00 0.00 46.19 44.18 1y9a s LEU 344 CO 0.55 0.11 0.00 -0.38 -1.32 0.00 0.00 176.35 175.31 1y9a n ILE 345 N 3.17 0.00 -4.58 6.68 5.41 -1.26 -5.01 119.36 123.77 1y9a n ILE 345 Ca -0.10 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.39 1y9a n ILE 345 Cb 0.52 -0.33 -0.17 0.00 -0.71 0.00 0.00 39.64 38.95 1y9a n ILE 345 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1y9a s LYS 346 N 0.00 1.99 0.50 0.38 -0.14 -0.36 -4.79 119.74 117.33 1y9a s LYS 346 Ca 0.00 -0.50 -0.16 0.00 -1.36 0.00 0.00 55.97 53.95 1y9a s LYS 346 Cb 0.00 -1.66 -0.08 0.00 -1.68 0.00 0.00 37.83 34.42 1y9a s LYS 346 CO 0.00 0.00 0.96 -2.14 -0.76 0.00 0.00 175.35 173.41 1y9a s PRO 347 N 0.78 3.95 0.02 -1.68 0.02 -1.26 -1.10 135.00 135.72 1y9a s PRO 347 Ca -0.12 0.92 0.04 0.00 0.02 0.00 0.00 61.00 61.86 1y9a s PRO 347 Cb -0.16 -2.16 -0.02 0.00 0.02 0.00 0.00 34.50 32.19 1y9a s PRO 347 CO 0.02 -0.24 -0.12 0.14 -0.33 0.00 0.00 177.00 176.48 1y9a s VAL 348 N -2.58 0.92 -0.15 3.83 -7.23 -0.14 -4.31 120.40 110.74 1y9a s VAL 348 Ca 0.58 -0.77 -0.00 0.00 -1.81 0.00 0.00 61.98 59.98 1y9a s VAL 348 Cb -0.10 -0.82 -0.01 0.00 0.56 0.00 0.00 36.38 36.01 1y9a s VAL 348 CO 0.30 0.05 -0.14 -0.69 -0.31 0.00 0.00 175.10 174.32 1y9a s VAL 349 N -0.65 2.84 -0.16 1.32 1.01 0.09 -0.71 120.40 124.13 1y9a s VAL 349 Ca 0.01 -0.72 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 1y9a s VAL 349 Cb -0.06 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1y9a s VAL 349 CO 0.00 0.51 0.09 -0.60 0.00 0.00 0.00 175.10 175.11 1y9a s ARG 350 N 0.71 3.77 -0.09 2.72 6.06 0.00 -0.73 118.95 131.40 1y9a s ARG 350 Ca -0.06 -0.27 0.02 0.00 -2.50 0.00 0.00 55.73 52.92 1y9a s ARG 350 Cb -0.15 -3.21 0.01 0.00 0.06 0.00 0.00 34.95 31.66 1y9a s ARG 350 CO 0.02 0.46 -0.15 0.42 -2.50 0.00 0.00 175.30 173.55 1y9a s ILE 351 N -0.14 1.37 0.20 4.11 1.09 -0.23 -0.39 121.20 127.21 1y9a s ILE 351 Ca 0.08 -0.60 0.08 0.00 -1.10 0.00 0.00 60.65 59.12 1y9a s ILE 351 Cb -0.12 -1.25 -0.04 0.00 -1.06 0.00 0.00 42.46 39.99 1y9a s ILE 351 CO 0.01 0.41 -0.02 -1.00 -0.10 0.00 0.00 174.94 174.24 1y9a s HIS 352 N 0.77 2.75 0.04 3.97 3.76 -1.26 -4.51 115.29 120.82 1y9a s HIS 352 Ca -0.12 -0.18 0.03 0.00 -0.15 0.00 0.00 55.06 54.64 1y9a s HIS 352 Cb -0.16 -1.30 -0.02 0.00 1.11 0.00 0.00 32.58 32.21 1y9a s HIS 352 CO 0.02 0.54 -0.09 0.71 -0.85 0.00 0.00 174.74 175.08 1y9a s TYR 353 N -1.89 0.74 0.38 1.40 1.51 -1.26 -5.05 117.35 113.19 1y9a s TYR 353 Ca 0.28 -0.45 0.07 0.00 -1.01 0.00 0.00 57.07 55.95 1y9a s TYR 353 Cb -0.08 -0.44 0.80 0.00 -0.11 0.00 0.00 41.96 42.13 1y9a s TYR 353 CO 0.18 -0.06 1.99 0.22 -1.11 0.00 0.00 175.55 176.77 1y9a h ASP 354 N 4.62 0.59 -0.47 2.29 1.82 -2.06 -2.25 116.42 120.95 1y9a h ASP 354 Ca -0.36 -0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 56.10 1y9a h ASP 354 Cb 1.20 -0.13 -0.11 0.00 0.68 0.00 0.00 39.33 40.97 1y9a h ASP 354 CO 0.41 0.39 0.09 -0.90 -1.61 0.00 0.00 179.24 177.63 1y9a n ASP 355 N -4.47 3.35 -0.27 2.28 5.75 -1.26 -4.66 116.55 117.27 1y9a n ASP 355 Ca 0.08 -3.48 0.16 0.00 -0.01 0.00 0.00 54.79 51.55 1y9a n ASP 355 Cb 0.20 -0.66 0.44 0.00 -1.03 0.00 0.00 41.12 40.06 1y9a n ASP 355 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1y9a h GLU 356 N 1.45 0.54 -0.02 0.11 4.81 -1.81 0.19 114.58 119.85 1y9a h GLU 356 Ca 0.23 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1y9a h GLU 356 Cb 1.87 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 31.13 1y9a h GLU 356 CO 0.49 0.36 -0.04 -0.25 -0.73 0.00 0.00 179.01 178.85 1y9a n ASP 357 N -4.58 2.49 0.00 1.04 8.00 -1.26 -4.57 116.55 117.67 1y9a n ASP 357 Ca 0.20 -1.74 0.00 0.00 0.71 0.00 0.00 54.79 53.95 1y9a n ASP 357 Cb 0.61 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 1y9a n ASP 357 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1y9a n THR 358 N 0.95 0.00 -1.61 -3.53 -2.24 -0.70 -5.05 114.28 102.11 1y9a n THR 358 Ca 0.11 -0.15 -0.50 0.00 -2.27 0.00 0.00 64.05 61.24 1y9a n THR 358 Cb 0.46 0.65 -0.05 0.00 -2.10 0.00 0.00 70.33 69.29 1y9a n THR 358 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1y9a n LEU 359 N -1.33 1.97 0.00 3.22 7.94 0.59 -5.07 117.00 124.32 1y9a n LEU 359 Ca 0.00 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.02 1y9a n LEU 359 Cb 0.00 -1.25 0.00 0.00 0.53 0.00 0.00 43.42 42.70 1y9a n LEU 359 CO 0.00 -0.94 0.00 0.00 -1.11 0.00 0.00 177.39 175.34