#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s9g n PRO 4 N 0.00 2.81 -4.06 -1.46 -0.02 -1.26 -4.95 135.00 126.05 1s9g n PRO 4 Ca 0.00 1.02 -0.22 0.00 -2.02 0.00 0.00 63.50 62.28 1s9g n PRO 4 Cb 0.00 -2.89 -0.04 0.00 -0.02 0.00 0.00 33.50 30.56 1s9g n PRO 4 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1s9g s ILE 5 N 1.91 4.64 0.06 4.25 1.01 -1.26 -5.07 121.20 126.74 1s9g s ILE 5 Ca 0.78 -1.29 -0.30 0.00 0.00 0.00 0.00 60.65 59.84 1s9g s ILE 5 Cb -0.49 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.41 1s9g s ILE 5 CO 0.34 -0.34 1.15 -0.70 0.00 0.00 0.00 174.94 175.40 1s9g s GLU 6 N -3.89 4.47 0.61 2.79 2.12 -1.26 -4.85 118.70 118.68 1s9g s GLU 6 Ca 0.34 1.71 -0.13 0.00 0.36 0.00 0.00 54.97 57.24 1s9g s GLU 6 Cb -0.08 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 1s9g s GLU 6 CO 0.26 -0.19 1.03 0.95 -0.54 0.00 0.00 175.26 176.77 1s9g s THR 7 N 0.94 4.35 -0.33 -1.70 -4.23 -1.26 -4.99 115.64 108.41 1s9g s THR 7 Ca 0.57 0.91 -0.06 0.00 -1.18 0.00 0.00 61.69 61.93 1s9g s THR 7 Cb -0.28 -3.63 0.04 0.00 1.34 0.00 0.00 72.50 69.96 1s9g s THR 7 CO 0.29 -0.85 0.10 -0.69 -0.54 0.00 0.00 174.62 172.93 1s9g s VAL 8 N -2.88 3.75 -0.18 2.29 1.01 -1.26 -4.99 120.40 118.14 1s9g s VAL 8 Ca 0.58 -1.10 -0.39 0.00 0.00 0.00 0.00 61.98 61.07 1s9g s VAL 8 Cb -0.12 -3.11 -0.16 0.00 0.00 0.00 0.00 36.38 32.99 1s9g s VAL 8 CO 0.45 -0.15 1.63 -2.65 0.00 0.00 0.00 175.10 174.38 1s9g n PRO 9 N 4.81 1.11 -4.15 2.72 -0.02 -1.26 -4.61 135.00 133.60 1s9g n PRO 9 Ca -0.13 0.41 -0.34 0.00 -2.02 0.00 0.00 63.50 61.41 1s9g n PRO 9 Cb 0.45 -2.07 -0.14 0.00 -0.02 0.00 0.00 33.50 31.72 1s9g n PRO 9 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1s9g s VAL 10 N 2.68 3.40 -0.13 -1.45 1.01 -1.26 -5.08 120.40 119.58 1s9g s VAL 10 Ca 0.95 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 62.42 1s9g s VAL 10 Cb -1.05 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 32.84 1s9g s VAL 10 CO 0.61 0.45 -0.07 -0.54 0.00 0.00 0.00 175.10 175.56 1s9g s LYS 11 N 1.09 1.47 0.90 2.72 3.01 -1.26 -4.66 119.74 123.01 1s9g s LYS 11 Ca 0.01 -0.31 -0.11 0.00 -1.01 0.00 0.00 55.97 54.55 1s9g s LYS 11 Cb -0.15 -1.69 0.13 0.00 -1.01 0.00 0.00 37.83 35.12 1s9g s LYS 11 CO -0.01 -0.31 1.10 -0.51 0.51 0.00 0.00 175.35 176.13 1s9g s LEU 12 N 1.70 2.52 0.25 3.17 1.02 -1.26 -4.92 118.68 121.16 1s9g s LEU 12 Ca 0.04 1.84 -0.31 0.00 0.02 0.00 0.00 54.13 55.72 1s9g s LEU 12 Cb -0.13 -4.27 -0.13 0.00 0.02 0.00 0.00 46.19 41.69 1s9g s LEU 12 CO -0.08 -2.82 1.54 1.17 0.02 0.00 0.00 176.35 176.18 1s9g n LYS 13 N -4.03 2.40 -1.17 1.70 4.81 -1.25 -4.90 118.16 115.72 1s9g n LYS 13 Ca 0.09 0.86 -0.35 0.00 -0.87 0.00 0.00 58.31 58.04 1s9g n LYS 13 Cb 0.53 -2.60 0.09 0.00 0.02 0.00 0.00 35.03 33.08 1s9g n LYS 13 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1s9g n PRO 14 N 2.41 0.22 -1.78 1.64 -0.02 -1.26 -2.22 135.00 134.00 1s9g n PRO 14 Ca 0.11 0.13 -0.14 0.00 -2.02 0.00 0.00 63.50 61.58 1s9g n PRO 14 Cb 0.34 -2.03 -0.04 0.00 -0.02 0.00 0.00 33.50 31.74 1s9g n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s9g n GLY 15 N 1.29 0.77 2.92 -1.23 0.00 -1.26 -4.98 105.19 102.70 1s9g n GLY 15 Ca 0.11 -0.32 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 1s9g n GLY 15 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1s9g s MET 16 N -3.84 1.45 0.26 1.61 0.00 -0.94 -5.14 119.30 112.70 1s9g s MET 16 Ca 0.00 -0.25 0.06 0.00 0.00 0.00 0.00 55.69 55.50 1s9g s MET 16 Cb 0.00 -1.45 -0.03 0.00 0.00 0.00 0.00 34.83 33.35 1s9g s MET 16 CO 0.00 -0.19 0.30 0.34 0.00 0.00 0.00 175.02 175.47 1s9g s ASP 17 N 1.44 5.92 1.12 1.11 3.68 -1.26 -4.81 116.67 123.87 1s9g s ASP 17 Ca -0.01 -0.11 -0.14 0.00 2.13 0.00 0.00 52.55 54.42 1s9g s ASP 17 Cb -0.13 -1.58 0.20 0.00 -1.45 0.00 0.00 42.92 39.96 1s9g s ASP 17 CO -0.05 -0.11 0.66 0.61 0.13 0.00 0.00 175.17 176.42 1s9g n GLY 18 N -1.34 -2.02 3.77 2.66 0.00 -1.26 -4.96 105.19 102.04 1s9g n GLY 18 Ca -0.07 -0.98 -0.39 0.00 0.00 0.00 0.00 46.02 44.57 1s9g n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1s9g s PRO 19 N -4.06 4.08 -0.38 1.61 0.04 -1.26 -4.96 135.00 130.07 1s9g s PRO 19 Ca 0.64 2.08 0.11 0.00 0.04 0.00 0.00 61.00 63.86 1s9g s PRO 19 Cb -0.21 -2.81 0.32 0.00 0.04 0.00 0.00 34.50 31.84 1s9g s PRO 19 CO 0.65 -0.37 0.68 1.63 0.04 0.00 0.00 177.00 179.64 1s9g n LYS 20 N 0.28 0.89 -3.73 4.56 5.02 -1.24 -0.92 118.16 123.02 1s9g n LYS 20 Ca 0.03 -3.26 -0.33 0.00 -2.02 0.00 0.00 58.31 52.73 1s9g n LYS 20 Cb 0.44 -1.54 -0.05 0.00 -0.02 0.00 0.00 35.03 33.86 1s9g n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1s9g s VAL 21 N -1.94 5.23 -0.09 -0.18 1.01 0.80 -4.89 120.40 120.36 1s9g s VAL 21 Ca 0.38 0.04 -0.14 0.00 0.00 0.00 0.00 61.98 62.25 1s9g s VAL 21 Cb 0.29 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.01 1s9g s VAL 21 CO -0.09 0.17 0.36 -0.54 0.00 0.00 0.00 175.10 175.00 1s9g s LYS 22 N -2.32 4.07 0.05 2.72 -0.14 -1.26 -4.50 119.74 118.36 1s9g s LYS 22 Ca 0.36 0.27 -0.30 0.00 -1.36 0.00 0.00 55.97 54.93 1s9g s LYS 22 Cb -0.13 -3.33 -0.09 0.00 -1.68 0.00 0.00 37.83 32.61 1s9g s LYS 22 CO 0.22 0.45 1.81 -1.14 -0.76 0.00 0.00 175.35 175.93 1s9g s GLN 23 N -0.24 4.16 0.52 1.68 2.00 -1.26 -4.86 119.66 121.67 1s9g s GLN 23 Ca 0.21 2.47 -0.21 0.00 -2.00 0.00 0.00 55.36 55.83 1s9g s GLN 23 Cb -0.15 -3.86 -0.06 0.00 0.80 0.00 0.00 33.01 29.75 1s9g s GLN 23 CO 0.09 -0.86 1.24 -1.58 -0.50 0.00 0.00 175.29 173.68 1s9g s TRP 24 N 3.54 2.56 0.37 1.67 0.52 -1.26 -4.97 118.94 121.36 1s9g s TRP 24 Ca 0.81 1.48 -0.25 0.00 0.02 0.00 0.00 56.10 58.15 1s9g s TRP 24 Cb -0.41 -3.54 -0.09 0.00 -1.15 0.00 0.00 33.47 28.28 1s9g s TRP 24 CO 0.36 -2.13 1.08 -1.25 0.02 0.00 0.00 176.95 175.03 1s9g s PRO 25 N -2.94 4.24 0.37 4.98 0.04 -1.26 -4.94 135.00 135.50 1s9g s PRO 25 Ca 0.70 1.64 0.08 0.00 0.04 0.00 0.00 61.00 63.46 1s9g s PRO 25 Cb -0.33 -2.71 -0.06 0.00 0.04 0.00 0.00 34.50 31.44 1s9g s PRO 25 CO 0.38 -0.10 0.04 -0.51 0.04 0.00 0.00 177.00 176.85 1s9g s LEU 26 N -2.35 2.96 0.57 -3.56 1.43 -1.26 -5.11 118.68 111.36 1s9g s LEU 26 Ca 0.55 -1.12 -0.18 0.00 -1.03 0.00 0.00 54.13 52.35 1s9g s LEU 26 Cb -0.26 -1.24 -0.05 0.00 0.03 0.00 0.00 46.19 44.68 1s9g s LEU 26 CO 0.33 -0.35 1.11 -0.89 0.23 0.00 0.00 176.35 176.77 1s9g s THR 27 N -2.59 3.33 0.26 5.49 2.01 -1.26 -4.85 115.64 118.04 1s9g s THR 27 Ca 0.36 0.76 -0.05 0.00 0.31 0.00 0.00 61.69 63.07 1s9g s THR 27 Cb 0.03 -3.28 0.25 0.00 0.01 0.00 0.00 72.50 69.52 1s9g s THR 27 CO 0.19 -0.24 1.93 -0.08 -0.69 0.00 0.00 174.62 175.73 1s9g h GLU 28 N 0.92 1.23 -0.29 4.92 4.81 -2.00 -1.03 114.58 123.15 1s9g h GLU 28 Ca -0.49 -0.09 0.03 0.00 -0.13 0.00 0.00 59.36 58.69 1s9g h GLU 28 Cb 1.25 -0.27 -0.06 0.00 0.63 0.00 0.00 28.75 30.30 1s9g h GLU 28 CO 0.57 0.83 -0.41 1.49 -0.73 0.00 0.00 179.01 180.76 1s9g h GLU 29 N 1.27 -0.29 -0.91 1.92 4.81 -1.99 0.40 114.58 119.79 1s9g h GLU 29 Ca 0.34 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.60 1s9g h GLU 29 Cb -0.12 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 1s9g h GLU 29 CO -0.07 -0.19 0.60 0.87 -0.73 0.00 0.00 179.01 179.49 1s9g h LYS 30 N -0.30 1.19 -0.04 1.92 1.79 -1.84 -1.06 116.57 118.23 1s9g h LYS 30 Ca 0.05 -0.07 0.03 0.00 -2.18 0.00 0.00 60.65 58.48 1s9g h LYS 30 Cb 0.44 -0.27 -0.04 0.00 -1.58 0.00 0.00 32.23 30.78 1s9g h LYS 30 CO -0.43 0.79 -0.16 0.82 -1.08 0.00 0.00 179.45 179.38 1s9g h ILE 31 N 1.22 0.59 -0.73 1.86 5.03 -0.30 -0.50 117.51 124.69 1s9g h ILE 31 Ca 0.33 0.00 0.16 0.00 -0.12 0.00 0.00 64.86 65.24 1s9g h ILE 31 Cb -0.13 0.59 -0.13 0.00 -3.03 0.00 0.00 36.82 34.12 1s9g h ILE 31 CO -0.07 0.00 -0.01 0.11 -0.68 0.00 0.00 178.15 177.49 1s9g h LYS 32 N -0.25 0.09 0.46 2.37 1.57 0.80 0.51 116.57 122.12 1s9g h LYS 32 Ca 0.07 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1s9g h LYS 32 Cb 0.34 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1s9g h LYS 32 CO -0.18 0.06 -0.22 0.00 -0.57 0.00 0.00 179.45 178.54 1s9g h ALA 33 N 1.68 -0.62 -0.62 3.86 0.00 -0.78 -1.82 119.26 120.97 1s9g h ALA 33 Ca 0.39 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.21 1s9g h ALA 33 Cb 0.67 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 1s9g h ALA 33 CO -0.65 -0.74 0.26 -0.07 0.00 0.00 0.00 179.25 178.05 1s9g h LEU 34 N -0.82 0.29 -0.48 0.00 3.38 -0.52 0.37 115.31 117.53 1s9g h LEU 34 Ca -0.06 0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.07 1s9g h LEU 34 Cb 0.56 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.27 1s9g h LEU 34 CO 0.10 0.17 0.04 0.58 0.09 0.00 0.00 178.44 179.42 1s9g h VAL 35 N 0.46 0.67 0.69 1.22 2.07 0.15 0.34 116.25 121.84 1s9g h VAL 35 Ca 0.31 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 67.74 1s9g h VAL 35 Cb 0.36 0.50 0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1s9g h VAL 35 CO -0.29 0.03 -0.33 -0.08 0.02 0.00 0.00 177.57 176.92 1s9g h GLU 36 N 0.16 -0.89 -0.38 1.57 4.81 -0.18 -0.70 114.58 118.97 1s9g h GLU 36 Ca 0.24 0.06 0.08 0.00 -0.13 0.00 0.00 59.36 59.61 1s9g h GLU 36 Cb 0.35 0.20 -0.09 0.00 0.63 0.00 0.00 28.75 29.84 1s9g h GLU 36 CO -0.36 -0.58 -0.30 0.82 -0.73 0.00 0.00 179.01 177.86 1s9g h ILE 37 N -1.00 0.27 -0.47 2.32 2.04 0.18 -1.00 117.51 119.84 1s9g h ILE 37 Ca -0.09 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 1s9g h ILE 37 Cb 0.73 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1s9g h ILE 37 CO 0.16 0.00 0.29 0.00 0.00 0.00 0.00 178.15 178.59 1s9g h THR 39 N 0.63 0.64 -0.08 0.00 2.02 0.03 0.33 112.91 116.47 1s9g h THR 39 Ca 0.17 -0.21 -0.11 0.00 0.77 0.00 0.00 66.41 67.03 1s9g h THR 39 Cb -0.01 -0.03 0.01 0.00 -1.74 0.00 0.00 68.15 66.38 1s9g h THR 39 CO -0.03 0.11 -0.39 -0.08 0.37 0.00 0.00 175.52 175.50 1s9g h GLU 40 N 0.61 0.41 -0.08 6.66 4.22 -0.38 -2.90 114.58 123.13 1s9g h GLU 40 Ca 0.58 -0.33 -0.01 0.00 0.08 0.00 0.00 59.36 59.68 1s9g h GLU 40 Cb 1.12 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1s9g h GLU 40 CO -0.35 0.97 0.02 0.52 -2.18 0.00 0.00 179.01 177.98 1s9g h MET 41 N -0.05 0.10 -0.65 1.92 2.86 0.76 -1.00 114.93 118.87 1s9g h MET 41 Ca -0.03 -0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.55 1s9g h MET 41 Cb 1.04 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.65 1s9g h MET 41 CO 0.08 0.10 0.17 1.49 1.06 0.00 0.00 176.91 179.81 1s9g h GLU 42 N 0.11 1.01 0.33 1.72 4.81 -0.33 0.27 114.58 122.51 1s9g h GLU 42 Ca 0.03 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 1s9g h GLU 42 Cb 0.05 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.28 1s9g h GLU 42 CO -0.00 0.89 -0.16 0.87 -0.73 0.00 0.00 179.01 179.88 1s9g h LYS 43 N 0.97 -0.43 0.00 1.92 1.57 -1.03 -2.13 116.57 117.44 1s9g h LYS 43 Ca 0.21 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1s9g h LYS 43 Cb 0.32 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1s9g h LYS 43 CO -0.00 -0.11 0.02 0.39 -0.57 0.00 0.00 179.45 179.18 1s9g n GLU 44 N -5.14 0.00 -1.00 3.15 1.02 -0.56 -4.77 120.64 113.34 1s9g n GLU 44 Ca -0.09 0.44 -0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1s9g n GLU 44 Cb 0.27 -1.52 -0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1s9g n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s9g n GLY 45 N -1.44 0.46 0.12 0.62 0.00 0.13 -4.94 105.19 100.14 1s9g n GLY 45 Ca 0.00 -0.06 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 1s9g n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s9g h LYS 46 N 0.86 0.30 -6.41 1.61 1.57 -0.81 -3.43 116.57 110.26 1s9g h LYS 46 Ca -0.00 -0.10 -0.62 0.00 -1.87 0.00 0.00 60.65 58.06 1s9g h LYS 46 Cb 0.09 -0.03 -0.17 0.00 0.08 0.00 0.00 32.23 32.20 1s9g h LYS 46 CO 0.00 0.53 -0.80 0.96 -0.57 0.00 0.00 179.45 179.57 1s9g s ILE 47 N -4.93 2.31 0.03 1.86 -4.36 -1.21 -0.27 121.20 114.62 1s9g s ILE 47 Ca -0.14 -2.11 0.03 0.00 -0.26 0.00 0.00 60.65 58.16 1s9g s ILE 47 Cb 0.06 -2.13 -0.02 0.00 1.25 0.00 0.00 42.46 41.62 1s9g s ILE 47 CO 0.72 -0.22 -0.08 -0.44 0.24 0.00 0.00 174.94 175.16 1s9g s SER 48 N -2.89 0.97 0.39 4.36 0.01 0.35 -4.11 113.70 112.78 1s9g s SER 48 Ca 0.22 -0.39 -0.26 0.00 1.31 0.00 0.00 55.95 56.84 1s9g s SER 48 Cb -0.07 -0.03 -0.09 0.00 0.21 0.00 0.00 66.02 66.05 1s9g s SER 48 CO 0.11 -0.07 1.25 -0.54 0.41 0.00 0.00 173.24 174.40 1s9g s LYS 49 N -1.03 4.06 0.34 12.44 1.02 -1.26 -1.36 119.74 133.96 1s9g s LYS 49 Ca -0.04 2.04 0.07 0.00 0.02 0.00 0.00 55.97 58.06 1s9g s LYS 49 Cb -0.07 -2.78 -0.07 0.00 -0.52 0.00 0.00 37.83 34.39 1s9g s LYS 49 CO 0.00 -0.37 -0.02 0.96 -0.92 0.00 0.00 175.35 175.00 1s9g s ILE 50 N -1.30 1.76 0.00 2.17 -4.36 -0.91 -4.88 121.20 113.68 1s9g s ILE 50 Ca 0.56 -2.07 0.00 0.00 -0.26 0.00 0.00 60.65 58.87 1s9g s ILE 50 Cb -0.35 -2.73 0.00 0.00 1.25 0.00 0.00 42.46 40.63 1s9g s ILE 50 CO 0.45 -0.12 0.00 0.61 0.24 0.00 0.00 174.94 176.12 1s9g n GLY 51 N -0.76 3.25 0.10 6.27 0.00 -1.26 -4.84 105.19 107.95 1s9g n GLY 51 Ca -0.04 -2.07 0.13 0.00 0.00 0.00 0.00 46.02 44.04 1s9g n GLY 51 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1s9g n PRO 52 N -0.20 0.27 0.00 1.61 -0.02 -1.26 -3.29 135.00 132.11 1s9g n PRO 52 Ca 0.00 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1s9g n PRO 52 Cb 0.00 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1s9g n PRO 52 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1s9g n GLU 53 N -2.25 0.58 -3.81 -0.52 0.00 -1.26 -4.09 120.64 109.30 1s9g n GLU 53 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 57.16 56.91 1s9g n GLU 53 Cb 0.43 -1.13 -0.15 0.00 0.00 0.00 0.00 31.44 30.60 1s9g n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1s9g s ASN 54 N -0.98 4.20 0.00 -1.84 3.84 -1.21 -4.96 114.94 113.99 1s9g s ASN 54 Ca 0.00 -1.84 0.28 0.00 0.21 0.00 0.00 52.86 51.51 1s9g s ASN 54 Cb 0.00 -1.07 1.11 0.00 -0.55 0.00 0.00 41.25 40.73 1s9g s ASN 54 CO 0.00 -0.40 1.80 -0.81 -2.79 0.00 0.00 177.10 174.91 1s9g n PRO 55 N 4.61 0.35 -2.50 0.43 -0.04 -1.26 -4.92 135.00 131.66 1s9g n PRO 55 Ca 0.00 -0.11 -0.33 0.00 -0.04 0.00 0.00 63.50 63.03 1s9g n PRO 55 Cb 0.41 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.34 1s9g n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1s9g s TYR 56 N -2.73 3.35 -0.30 0.54 2.02 -1.26 -4.84 117.35 114.13 1s9g s TYR 56 Ca 0.21 1.52 -0.13 0.00 -0.37 0.00 0.00 57.07 58.30 1s9g s TYR 56 Cb 0.19 -2.84 0.16 0.00 -0.40 0.00 0.00 41.96 39.07 1s9g s TYR 56 CO 0.53 -0.37 0.87 1.21 -1.57 0.00 0.00 175.55 176.22 1s9g s ASN 57 N -2.74 -0.79 0.05 2.29 2.47 -0.10 -4.69 114.94 111.43 1s9g s ASN 57 Ca 0.61 1.02 0.03 0.00 0.42 0.00 0.00 52.86 54.94 1s9g s ASN 57 Cb -0.10 1.87 -0.04 0.00 -1.45 0.00 0.00 41.25 41.53 1s9g s ASN 57 CO 0.26 -0.15 0.02 0.28 -3.72 0.00 0.00 177.10 173.79 1s9g s THR 58 N 2.64 4.22 0.65 -5.21 -1.32 0.03 -0.14 115.64 116.50 1s9g s THR 58 Ca -0.02 -0.76 -0.14 0.00 -1.21 0.00 0.00 61.69 59.55 1s9g s THR 58 Cb -0.09 -2.96 -0.01 0.00 -1.51 0.00 0.00 72.50 67.94 1s9g s THR 58 CO -0.18 0.24 1.08 -2.16 -2.21 0.00 0.00 174.62 171.39 1s9g s PRO 59 N -1.99 2.97 0.01 7.08 0.05 -1.26 -4.33 135.00 137.52 1s9g s PRO 59 Ca 0.24 1.25 0.02 0.00 0.05 0.00 0.00 61.00 62.56 1s9g s PRO 59 Cb -0.12 -1.98 -0.01 0.00 0.05 0.00 0.00 34.50 32.44 1s9g s PRO 59 CO 0.16 -1.10 -0.07 0.14 0.05 0.00 0.00 177.00 176.18 1s9g s VAL 60 N -2.51 0.54 0.24 -0.36 -7.23 -1.26 -1.67 120.40 108.15 1s9g s VAL 60 Ca 0.64 -0.47 0.01 0.00 -1.81 0.00 0.00 61.98 60.35 1s9g s VAL 60 Cb -0.18 -0.49 -0.01 0.00 0.56 0.00 0.00 36.38 36.27 1s9g s VAL 60 CO 0.42 0.03 0.05 0.49 -0.31 0.00 0.00 175.10 175.78 1s9g n PHE 61 N 2.57 0.28 -3.72 2.82 3.01 -0.09 -4.85 117.46 117.48 1s9g n PHE 61 Ca -0.15 -1.39 -0.25 0.00 1.01 0.00 0.00 57.45 56.67 1s9g n PHE 61 Cb 0.57 -0.07 -0.17 0.00 -0.01 0.00 0.00 39.48 39.80 1s9g n PHE 61 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1s9g s ALA 62 N -2.55 0.71 0.30 4.37 0.00 -1.26 -1.90 121.76 121.43 1s9g s ALA 62 Ca 0.07 -0.31 0.09 0.00 0.00 0.00 0.00 51.96 51.81 1s9g s ALA 62 Cb 0.00 -0.92 -0.05 0.00 0.00 0.00 0.00 23.12 22.16 1s9g s ALA 62 CO 0.05 -0.81 0.04 0.96 0.00 0.00 0.00 175.76 176.00 1s9g s ILE 63 N 1.98 3.12 -0.38 0.00 -4.36 -0.40 -4.93 121.20 116.24 1s9g s ILE 63 Ca 0.03 -1.88 -0.22 0.00 -0.26 0.00 0.00 60.65 58.32 1s9g s ILE 63 Cb -0.14 -2.86 0.01 0.00 1.25 0.00 0.00 42.46 40.72 1s9g s ILE 63 CO -0.06 -0.28 0.73 -0.75 0.24 0.00 0.00 174.94 174.81 1s9g s LYS 64 N -3.73 3.66 0.00 0.37 2.47 -1.26 0.51 119.74 121.76 1s9g s LYS 64 Ca 0.34 0.14 0.00 0.00 -1.56 0.00 0.00 55.97 54.89 1s9g s LYS 64 Cb -0.04 -3.83 0.00 0.00 -1.46 0.00 0.00 37.83 32.50 1s9g s LYS 64 CO 0.20 -0.85 0.09 1.63 0.16 0.00 0.00 175.35 176.58 1s9g n LYS 65 N 6.33 0.00 -3.04 4.03 5.02 -1.23 -4.05 118.16 125.21 1s9g n LYS 65 Ca 0.01 0.07 -0.24 0.00 -2.02 0.00 0.00 58.31 56.14 1s9g n LYS 65 Cb 0.48 -0.59 -0.04 0.00 -0.02 0.00 0.00 35.03 34.87 1s9g n LYS 65 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1s9g n LYS 66 N -0.16 2.38 0.00 1.97 4.76 -1.26 -4.95 118.16 120.90 1s9g n LYS 66 Ca 0.00 -4.31 0.00 0.00 -2.87 0.00 0.00 58.31 51.13 1s9g n LYS 66 Cb 0.00 -2.04 0.00 0.00 -1.84 0.00 0.00 35.03 31.15 1s9g n LYS 66 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1s9g n ASP 67 N -0.02 0.00 -3.80 4.39 5.75 -1.26 -4.86 116.55 116.75 1s9g n ASP 67 Ca 0.29 0.00 -0.24 0.00 -0.01 0.00 0.00 54.79 54.82 1s9g n ASP 67 Cb 0.49 0.00 0.17 0.00 -1.03 0.00 0.00 41.12 40.75 1s9g n ASP 67 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1s9g n SER 68 N 0.00 -2.90 -0.46 -1.12 3.41 -1.26 -4.65 113.62 106.64 1s9g n SER 68 Ca 0.00 -0.34 0.38 0.00 -0.26 0.00 0.00 58.87 58.65 1s9g n SER 68 Cb 0.00 -0.85 0.62 0.00 -0.26 0.00 0.00 64.21 63.72 1s9g n SER 68 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1s9g n THR 69 N -4.55 -0.17 -4.18 6.66 -1.04 -1.26 -4.59 114.28 105.14 1s9g n THR 69 Ca 0.05 1.51 -0.22 0.00 -2.04 0.00 0.00 64.05 63.34 1s9g n THR 69 Cb 0.47 -2.48 -0.06 0.00 -1.82 0.00 0.00 70.33 66.45 1s9g n THR 69 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1s9g s LYS 70 N -4.93 2.62 0.35 -2.82 2.20 -1.26 -5.13 119.74 110.77 1s9g s LYS 70 Ca -0.06 -1.24 0.07 0.00 -0.36 0.00 0.00 55.97 54.38 1s9g s LYS 70 Cb 0.26 -2.37 -0.01 0.00 -1.51 0.00 0.00 37.83 34.21 1s9g s LYS 70 CO 0.73 0.36 0.47 -1.58 -0.36 0.00 0.00 175.35 174.98 1s9g s TRP 71 N -2.24 3.05 0.17 4.03 0.52 -1.26 -3.51 118.94 119.70 1s9g s TRP 71 Ca 0.33 -0.25 0.11 0.00 0.02 0.00 0.00 56.10 56.30 1s9g s TRP 71 Cb -0.07 -2.04 -0.04 0.00 -1.15 0.00 0.00 33.47 30.17 1s9g s TRP 71 CO 0.23 -0.06 -0.25 -0.98 0.02 0.00 0.00 176.95 175.91 1s9g s ARG 72 N -4.19 1.46 -0.07 4.98 1.04 0.18 -4.76 118.95 117.60 1s9g s ARG 72 Ca 0.46 -1.45 -0.15 0.00 -1.04 0.00 0.00 55.73 53.55 1s9g s ARG 72 Cb -0.09 -1.84 -0.05 0.00 -2.04 0.00 0.00 34.95 30.93 1s9g s ARG 72 CO 0.31 0.41 0.39 0.21 -0.04 0.00 0.00 175.30 176.59 1s9g s LYS 73 N -2.42 4.09 -0.31 3.89 2.20 -1.26 -1.27 119.74 124.65 1s9g s LYS 73 Ca 0.18 0.34 0.03 0.00 -0.36 0.00 0.00 55.97 56.15 1s9g s LYS 73 Cb -0.09 -3.32 0.09 0.00 -1.51 0.00 0.00 37.83 33.00 1s9g s LYS 73 CO 0.08 0.45 0.01 -1.17 -0.36 0.00 0.00 175.35 174.37 1s9g s LEU 74 N -0.29 3.84 -0.47 5.43 2.96 -0.80 -4.92 118.68 124.43 1s9g s LEU 74 Ca 0.22 -1.80 -0.25 0.00 -0.22 0.00 0.00 54.13 52.09 1s9g s LEU 74 Cb -0.15 -1.44 0.03 0.00 0.50 0.00 0.00 46.19 45.13 1s9g s LEU 74 CO 0.10 -0.33 0.90 -0.69 -1.32 0.00 0.00 176.35 175.02 1s9g s VAL 75 N 1.11 4.49 -0.56 1.68 1.01 -1.26 -0.91 120.40 125.95 1s9g s VAL 75 Ca 0.05 0.62 -0.22 0.00 0.00 0.00 0.00 61.98 62.43 1s9g s VAL 75 Cb -0.19 -4.43 -0.19 0.00 0.00 0.00 0.00 36.38 31.57 1s9g s VAL 75 CO -0.10 -0.86 1.82 -0.67 0.00 0.00 0.00 175.10 175.30 1s9g n ASP 76 N 7.13 2.27 -1.04 3.32 2.03 -0.67 -4.73 116.55 124.85 1s9g n ASP 76 Ca 0.05 -2.57 0.00 0.00 0.52 0.00 0.00 54.79 52.79 1s9g n ASP 76 Cb 0.48 -0.94 0.00 0.00 -0.72 0.00 0.00 41.12 39.95 1s9g n ASP 76 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1s9g n PHE 77 N 7.42 0.00 0.11 -0.67 3.72 -1.26 -4.28 117.46 122.50 1s9g n PHE 77 Ca 0.46 -0.41 -0.13 0.00 -0.05 0.00 0.00 57.45 57.33 1s9g n PHE 77 Cb 0.36 -0.23 -0.06 0.00 -0.94 0.00 0.00 39.48 38.61 1s9g n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1s9g h ARG 78 N 0.55 -0.31 0.25 -1.08 3.08 -1.87 0.11 114.38 115.11 1s9g h ARG 78 Ca 0.00 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 1s9g h ARG 78 Cb 0.77 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.89 1s9g h ARG 78 CO 0.00 -0.21 -0.12 1.49 -1.07 0.00 0.00 179.97 180.06 1s9g h GLU 79 N -0.33 -0.32 -0.09 0.04 4.57 -2.01 -1.61 114.58 114.84 1s9g h GLU 79 Ca 0.01 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.24 1s9g h GLU 79 Cb 0.32 0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.98 1s9g h GLU 79 CO -0.06 -0.20 0.10 1.25 -1.18 0.00 0.00 179.01 178.91 1s9g h LEU 80 N -0.34 0.00 0.47 1.64 5.85 -1.85 -1.44 115.31 119.64 1s9g h LEU 80 Ca -0.03 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1s9g h LEU 80 Cb 0.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1s9g h LEU 80 CO 0.06 0.00 -0.23 0.78 -0.34 0.00 0.00 178.44 178.71 1s9g h ASN 81 N 0.00 -0.54 -0.89 1.25 2.35 0.16 -1.87 115.58 116.05 1s9g h ASN 81 Ca 0.04 -0.03 0.22 0.00 -0.55 0.00 0.00 56.30 55.99 1s9g h ASN 81 Cb 0.24 0.14 -0.13 0.00 0.05 0.00 0.00 38.32 38.62 1s9g h ASN 81 CO -0.00 -0.11 0.38 0.11 -1.65 0.00 0.00 177.43 176.15 1s9g h LYS 82 N -1.13 0.36 0.00 0.81 1.57 -1.07 1.27 116.57 118.39 1s9g h LYS 82 Ca -0.06 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1s9g h LYS 82 Cb 0.53 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1s9g h LYS 82 CO 0.11 0.24 0.00 0.54 -0.57 0.00 0.00 179.45 179.77 1s9g n ARG 83 N -5.07 0.17 0.00 3.15 1.74 -0.57 -4.29 116.66 111.79 1s9g n ARG 83 Ca 0.22 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.46 1s9g n ARG 83 Cb 0.67 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 1s9g n ARG 83 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1s9g n THR 84 N -1.33 0.00 0.09 0.55 -2.24 0.42 -3.75 114.28 108.02 1s9g n THR 84 Ca 0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 1s9g n THR 84 Cb 0.14 -0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1s9g n THR 84 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1s9g n GLN 85 N -0.22 0.01 0.20 -0.78 0.00 -0.41 0.50 117.38 116.68 1s9g n GLN 85 Ca 0.00 0.26 0.10 0.00 -0.00 0.00 0.00 57.00 57.35 1s9g n GLN 85 Cb 0.00 -0.82 0.23 0.00 0.00 0.00 0.00 30.24 29.65 1s9g n GLN 85 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 1s9g h ASP 86 N 0.00 0.00 -0.33 1.69 3.58 -1.74 0.33 116.42 119.96 1s9g h ASP 86 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1s9g h ASP 86 Cb 0.61 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.66 1s9g h ASP 86 CO 0.00 0.18 0.00 0.49 -2.88 0.00 0.00 179.24 177.03 1s9g n PHE 87 N -3.18 0.42 -2.33 0.28 3.01 1.86 -4.00 117.46 113.52 1s9g n PHE 87 Ca 0.02 -0.24 -0.06 0.00 1.01 0.00 0.00 57.45 58.18 1s9g n PHE 87 Cb 0.55 -0.00 0.06 0.00 -0.01 0.00 0.00 39.48 40.07 1s9g n PHE 87 CO 0.00 0.00 0.00 0.91 1.01 0.00 0.00 176.76 178.68 1s9g n TRP 88 N 1.29 1.34 -0.13 1.38 7.02 -0.61 -2.61 117.44 125.12 1s9g n TRP 88 Ca 0.17 -1.79 0.00 0.00 -1.02 0.00 0.00 57.50 54.85 1s9g n TRP 88 Cb 0.55 -0.26 0.00 0.00 -2.42 0.00 0.00 31.31 29.19 1s9g n TRP 88 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1s9g n GLU 89 N -0.53 2.13 0.00 -0.99 2.13 0.11 -4.38 120.64 119.11 1s9g n GLU 89 Ca 0.21 -0.04 0.00 0.00 0.66 0.00 0.00 57.16 57.98 1s9g n GLU 89 Cb 0.90 -0.31 0.00 0.00 0.27 0.00 0.00 31.44 32.30 1s9g n GLU 89 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1s9g n VAL 90 N -0.32 0.00 0.00 6.31 0.31 -1.26 -3.66 118.33 119.72 1s9g n VAL 90 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1s9g n VAL 90 Cb 0.03 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 32.72 1s9g n VAL 90 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1s9g n GLN 91 N -0.10 0.00 -0.42 5.55 0.00 -1.07 -1.27 117.38 120.06 1s9g n GLN 91 Ca 0.00 0.11 0.00 0.00 -0.00 0.00 0.00 57.00 57.11 1s9g n GLN 91 Cb 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 30.24 28.60 1s9g n GLN 91 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1s9g n LEU 92 N -0.96 0.00 -2.77 1.69 4.77 -1.26 -5.01 117.00 113.46 1s9g n LEU 92 Ca 0.00 -0.91 -0.33 0.00 -0.03 0.00 0.00 56.01 54.75 1s9g n LEU 92 Cb 0.14 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1s9g n LEU 92 CO 0.00 0.75 0.13 0.61 -1.33 0.00 0.00 177.39 177.55 1s9g n GLY 93 N 0.00 -0.74 3.16 -0.72 0.00 -0.39 -4.80 105.19 101.70 1s9g n GLY 93 Ca 0.00 0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.95 1s9g n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9g s ILE 94 N -0.38 3.80 0.31 -0.61 1.01 -1.26 -5.00 121.20 119.07 1s9g s ILE 94 Ca 0.46 -2.06 -0.26 0.00 0.00 0.00 0.00 60.65 58.79 1s9g s ILE 94 Cb -0.66 -3.53 -0.15 0.00 0.01 0.00 0.00 42.46 38.13 1s9g s ILE 94 CO 0.35 -0.76 0.65 -0.81 0.00 0.00 0.00 174.94 174.37 1s9g n PRO 95 N 4.58 0.59 -3.89 2.79 -0.04 -1.26 -4.98 135.00 132.79 1s9g n PRO 95 Ca -0.03 0.21 -0.35 0.00 -0.04 0.00 0.00 63.50 63.29 1s9g n PRO 95 Cb 0.41 -1.42 -0.14 0.00 -0.04 0.00 0.00 33.50 32.31 1s9g n PRO 95 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1s9g s HIS 96 N -1.22 2.97 -0.46 0.54 2.46 -1.26 -4.91 115.29 113.40 1s9g s HIS 96 Ca 0.62 -0.89 -0.27 0.00 0.47 0.00 0.00 55.06 54.98 1s9g s HIS 96 Cb -0.73 -2.12 -0.04 0.00 -0.13 0.00 0.00 32.58 29.56 1s9g s HIS 96 CO 0.58 -0.53 2.03 -1.25 -2.47 0.00 0.00 174.74 173.10 1s9g s PRO 97 N 1.49 2.72 0.00 2.88 0.04 -1.26 -4.90 135.00 135.98 1s9g s PRO 97 Ca 0.06 1.19 0.01 0.00 0.04 0.00 0.00 61.00 62.30 1s9g s PRO 97 Cb -0.14 -4.39 0.07 0.00 0.04 0.00 0.00 34.50 30.07 1s9g s PRO 97 CO -0.03 -2.58 0.45 0.00 0.04 0.00 0.00 177.00 174.88 1s9g n ALA 98 N 12.84 1.88 -0.39 8.56 0.00 -1.26 -2.60 120.51 139.55 1s9g n ALA 98 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1s9g n ALA 98 Cb 0.51 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1s9g n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s9g n GLY 99 N -0.14 0.20 0.29 0.00 0.00 -1.26 -4.66 105.19 99.62 1s9g n GLY 99 Ca 0.01 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.19 1s9g n GLY 99 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1s9g h LEU 100 N 0.00 0.00 0.00 0.99 5.85 -1.78 0.65 115.31 121.01 1s9g h LEU 100 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1s9g h LEU 100 Cb 0.50 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1s9g h LEU 100 CO 0.00 0.04 0.00 2.29 -0.34 0.00 0.00 178.44 180.43 1s9g n LYS 101 N -3.62 0.10 -0.02 1.25 2.85 -1.26 -3.21 118.16 114.24 1s9g n LYS 101 Ca -0.03 0.05 -0.05 0.00 -1.05 0.00 0.00 58.31 57.23 1s9g n LYS 101 Cb 0.13 -1.50 -0.13 0.00 -0.65 0.00 0.00 35.03 32.88 1s9g n LYS 101 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1s9g n LYS 102 N -1.45 0.64 -1.56 -1.58 5.02 0.22 -3.79 118.16 115.68 1s9g n LYS 102 Ca 0.08 0.17 -0.37 0.00 -2.02 0.00 0.00 58.31 56.16 1s9g n LYS 102 Cb 0.28 -1.71 0.06 0.00 -0.02 0.00 0.00 35.03 33.64 1s9g n LYS 102 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1s9g n LYS 103 N -2.87 0.76 0.23 1.97 4.76 -1.15 -4.53 118.16 117.32 1s9g n LYS 103 Ca -0.18 0.30 0.08 0.00 -2.87 0.00 0.00 58.31 55.65 1s9g n LYS 103 Cb 0.98 -2.12 0.53 0.00 -1.84 0.00 0.00 35.03 32.59 1s9g n LYS 103 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1s9g h LYS 104 N 0.28 0.00 -2.31 1.97 3.11 -1.48 -3.34 116.57 114.81 1s9g h LYS 104 Ca -0.48 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 57.30 1s9g h LYS 104 Cb 1.37 0.00 -0.23 0.00 -1.00 0.00 0.00 32.23 32.36 1s9g h LYS 104 CO 0.49 0.24 -0.09 -1.12 -2.81 0.00 0.00 179.45 176.16 1s9g s SER 105 N -6.44 -0.70 -0.10 4.20 0.01 -0.36 -4.53 113.70 105.79 1s9g s SER 105 Ca -0.02 1.21 0.04 0.00 1.31 0.00 0.00 55.95 58.49 1s9g s SER 105 Cb 0.13 1.14 0.00 0.00 0.21 0.00 0.00 66.02 67.50 1s9g s SER 105 CO 0.65 -0.21 -0.22 -0.69 0.41 0.00 0.00 173.24 173.17 1s9g s VAL 106 N 1.05 1.94 0.11 3.43 1.01 0.07 -0.31 120.40 127.70 1s9g s VAL 106 Ca -0.06 -0.94 0.09 0.00 0.00 0.00 0.00 61.98 61.06 1s9g s VAL 106 Cb -0.06 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 1s9g s VAL 106 CO -0.10 0.53 -0.16 -0.89 0.00 0.00 0.00 175.10 174.48 1s9g s THR 107 N 0.44 2.95 -0.17 3.92 2.01 0.15 -0.46 115.64 124.47 1s9g s THR 107 Ca -0.17 -1.46 -0.01 0.00 0.31 0.00 0.00 61.69 60.37 1s9g s THR 107 Cb -0.17 -2.36 -0.00 0.00 0.01 0.00 0.00 72.50 69.98 1s9g s THR 107 CO 0.07 0.10 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.29 1s9g s VAL 108 N -1.16 2.84 -0.04 3.82 1.01 -1.16 -0.72 120.40 124.99 1s9g s VAL 108 Ca 0.19 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.52 1s9g s VAL 108 Cb -0.11 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 1s9g s VAL 108 CO 0.11 0.49 -0.20 -1.48 0.00 0.00 0.00 175.10 174.02 1s9g s LEU 109 N 1.01 2.40 -0.95 3.92 2.34 -0.08 -4.81 118.68 122.52 1s9g s LEU 109 Ca -0.01 -0.33 -0.23 0.00 0.06 0.00 0.00 54.13 53.62 1s9g s LEU 109 Cb -0.15 -1.45 0.06 0.00 -0.56 0.00 0.00 46.19 44.09 1s9g s LEU 109 CO -0.02 0.33 1.36 -0.62 -1.06 0.00 0.00 176.35 176.34 1s9g s ASP 110 N -0.64 6.45 0.00 1.48 2.15 -1.26 -0.85 116.67 124.00 1s9g s ASP 110 Ca 0.10 -1.36 0.25 0.00 0.43 0.00 0.00 52.55 51.97 1s9g s ASP 110 Cb -0.10 -2.54 0.53 0.00 -0.30 0.00 0.00 42.92 40.50 1s9g s ASP 110 CO -0.00 -1.50 1.42 1.33 -0.17 0.00 0.00 175.17 176.25 1s9g n VAL 111 N 6.59 0.00 -0.44 1.11 0.24 -0.02 -4.41 118.33 121.41 1s9g n VAL 111 Ca 0.26 -0.15 0.36 0.00 -2.04 0.00 0.00 64.34 62.77 1s9g n VAL 111 Cb 0.50 0.63 0.60 0.00 -1.47 0.00 0.00 33.84 34.10 1s9g n VAL 111 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1s9g n GLY 112 N 1.37 -0.73 0.00 7.63 0.00 0.54 0.18 105.19 114.17 1s9g n GLY 112 Ca 0.11 0.63 0.03 0.00 0.00 0.00 0.00 46.02 46.78 1s9g n GLY 112 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1s9g n ASP 113 N -4.21 0.00 0.18 1.61 -0.08 -1.26 -3.01 116.55 109.78 1s9g n ASP 113 Ca 0.35 0.30 -0.13 0.00 -1.51 0.00 0.00 54.79 53.80 1s9g n ASP 113 Cb 1.40 -0.35 -0.08 0.00 2.34 0.00 0.00 41.12 44.43 1s9g n ASP 113 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1s9g h ALA 114 N 2.24 -0.49 -0.73 -1.67 0.00 -0.57 -3.26 119.26 114.77 1s9g h ALA 114 Ca 0.00 -0.19 0.21 0.00 0.00 0.00 0.00 54.91 54.93 1s9g h ALA 114 Cb 0.07 0.19 -0.14 0.00 0.00 0.00 0.00 17.79 17.91 1s9g h ALA 114 CO 0.00 -0.60 0.03 0.66 0.00 0.00 0.00 179.25 179.34 1s9g n TYR 115 N -5.17 0.48 0.00 0.00 0.53 -1.16 -2.24 117.16 109.60 1s9g n TYR 115 Ca -0.10 0.88 0.00 0.00 -1.02 0.00 0.00 57.90 57.66 1s9g n TYR 115 Cb 0.28 -1.06 0.00 0.00 -1.03 0.00 0.00 39.34 37.53 1s9g n TYR 115 CO 0.00 0.00 0.00 1.19 -1.02 0.00 0.00 176.86 177.03 1s9g n PHE 116 N -4.99 0.00 -0.10 -0.72 0.99 -1.23 -1.06 117.46 110.35 1s9g n PHE 116 Ca 0.18 0.00 -0.18 0.00 -0.00 0.00 0.00 57.45 57.44 1s9g n PHE 116 Cb 0.58 -0.09 -0.07 0.00 -1.00 0.00 0.00 39.48 38.89 1s9g n PHE 116 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1s9g n SER 117 N -1.06 1.89 -4.63 4.37 3.41 -0.95 -4.87 113.62 111.79 1s9g n SER 117 Ca 0.00 0.43 -0.55 0.00 -0.26 0.00 0.00 58.87 58.48 1s9g n SER 117 Cb 0.37 -0.86 -0.07 0.00 -0.26 0.00 0.00 64.21 63.39 1s9g n SER 117 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1s9g n VAL 118 N -4.42 0.30 -2.25 -3.33 0.31 -0.22 -4.89 118.33 103.82 1s9g n VAL 118 Ca -0.30 -0.10 -0.36 0.00 -0.01 0.00 0.00 64.34 63.56 1s9g n VAL 118 Cb 0.62 -1.35 -0.00 0.00 -0.91 0.00 0.00 33.84 32.20 1s9g n VAL 118 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1s9g s PRO 119 N 4.33 3.60 -0.01 5.55 0.04 -1.26 -1.02 135.00 146.24 1s9g s PRO 119 Ca 1.01 1.73 -0.20 0.00 0.04 0.00 0.00 61.00 63.58 1s9g s PRO 119 Cb -1.01 -2.26 -0.05 0.00 0.04 0.00 0.00 34.50 31.21 1s9g s PRO 119 CO 0.61 -0.67 0.57 -1.17 0.04 0.00 0.00 177.00 176.38 1s9g s LEU 120 N -3.31 4.42 -0.26 -3.56 2.96 -0.84 -4.53 118.68 113.57 1s9g s LEU 120 Ca 0.67 1.12 -0.43 0.00 -0.22 0.00 0.00 54.13 55.27 1s9g s LEU 120 Cb -0.27 -2.87 -0.20 0.00 0.50 0.00 0.00 46.19 43.35 1s9g s LEU 120 CO 0.32 0.13 1.37 -0.67 -1.32 0.00 0.00 176.35 176.18 1s9g n ASP 121 N 2.63 0.73 -0.17 3.68 2.03 -1.26 -4.73 116.55 119.47 1s9g n ASP 121 Ca -0.08 1.17 0.25 0.00 0.52 0.00 0.00 54.79 56.65 1s9g n ASP 121 Cb 0.51 -0.92 0.66 0.00 -0.72 0.00 0.00 41.12 40.66 1s9g n ASP 121 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1s9g h GLU 122 N 4.19 0.10 0.03 -0.67 4.57 -1.96 -2.71 114.58 118.14 1s9g h GLU 122 Ca -0.47 -0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 57.63 1s9g h GLU 122 Cb 1.39 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.96 1s9g h GLU 122 CO 0.83 0.07 -0.33 -0.44 -1.18 0.00 0.00 179.01 177.96 1s9g h ASP 123 N 0.11 0.09 0.10 1.04 3.32 -1.96 -3.34 116.42 115.78 1s9g h ASP 123 Ca 0.41 -0.93 -0.00 0.00 0.02 0.00 0.00 57.03 56.52 1s9g h ASP 123 Cb 1.45 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.97 1s9g h ASP 123 CO -0.05 1.14 -0.01 0.15 -1.72 0.00 0.00 179.24 178.76 1s9g h PHE 124 N -0.87 0.00 -0.27 4.55 3.57 -1.76 -3.27 116.94 118.89 1s9g h PHE 124 Ca -0.07 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.46 1s9g h PHE 124 Cb 1.17 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.85 1s9g h PHE 124 CO 0.24 0.01 -0.39 0.00 -2.23 0.00 0.00 178.31 175.94 1s9g h ARG 125 N 0.00 -0.28 -1.43 1.11 3.08 -1.63 0.15 114.38 115.38 1s9g h ARG 125 Ca -0.00 0.02 0.45 0.00 0.07 0.00 0.00 59.98 60.52 1s9g h ARG 125 Cb 0.06 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.08 1s9g h ARG 125 CO 0.00 -0.19 0.99 0.36 -1.07 0.00 0.00 179.97 180.06 1s9g n LYS 126 N -4.58 -0.01 0.00 0.04 2.85 -1.24 0.67 118.16 115.89 1s9g n LYS 126 Ca -0.03 0.98 0.08 0.00 -1.05 0.00 0.00 58.31 58.29 1s9g n LYS 126 Cb 0.24 -2.09 0.37 0.00 -0.65 0.00 0.00 35.03 32.90 1s9g n LYS 126 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1s9g n TYR 127 N -3.98 0.00 0.97 5.58 4.01 0.04 -2.87 117.16 120.92 1s9g n TYR 127 Ca 0.36 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 58.20 1s9g n TYR 127 Cb 1.52 -0.38 -0.10 0.00 -0.31 0.00 0.00 39.34 40.06 1s9g n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1s9g n THR 128 N -1.38 0.00 -1.21 -0.72 -2.24 0.21 -4.55 114.28 104.39 1s9g n THR 128 Ca 0.06 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.38 1s9g n THR 128 Cb 0.15 1.03 -0.03 0.00 -2.10 0.00 0.00 70.33 69.38 1s9g n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s9g n ALA 129 N -1.34 -2.68 -2.18 6.98 0.00 -1.14 -4.50 120.51 115.66 1s9g n ALA 129 Ca 0.04 0.39 -0.11 0.00 0.00 0.00 0.00 53.44 53.76 1s9g n ALA 129 Cb 0.33 -1.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.29 1s9g n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1s9g s PHE 130 N -0.75 1.02 -0.07 0.00 -0.71 0.70 -0.79 117.98 117.37 1s9g s PHE 130 Ca 0.57 -1.24 0.01 0.00 -1.04 0.00 0.00 56.93 55.23 1s9g s PHE 130 Cb -0.83 -0.55 0.02 0.00 -1.21 0.00 0.00 43.02 40.45 1s9g s PHE 130 CO 0.48 -0.50 -0.07 0.99 -1.34 0.00 0.00 175.22 174.78 1s9g s THR 131 N -4.01 0.80 -0.26 -4.49 2.01 -1.26 -0.40 115.64 108.04 1s9g s THR 131 Ca 0.29 -0.23 -0.24 0.00 0.31 0.00 0.00 61.69 61.82 1s9g s THR 131 Cb 0.07 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.76 1s9g s THR 131 CO 0.05 0.30 0.79 -0.63 -0.69 0.00 0.00 174.62 174.45 1s9g s ILE 132 N 1.20 4.85 0.87 1.82 1.01 0.26 -4.76 121.20 126.43 1s9g s ILE 132 Ca -0.06 1.42 -0.12 0.00 0.00 0.00 0.00 60.65 61.90 1s9g s ILE 132 Cb -0.14 -4.10 0.11 0.00 0.01 0.00 0.00 42.46 38.34 1s9g s ILE 132 CO -0.02 -0.10 1.11 -2.16 0.00 0.00 0.00 174.94 173.77 1s9g s PRO 133 N 2.82 1.51 0.05 2.79 0.04 -1.26 0.13 135.00 141.08 1s9g s PRO 133 Ca 0.33 0.55 0.07 0.00 0.04 0.00 0.00 61.00 61.99 1s9g s PRO 133 Cb -0.15 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 1s9g s PRO 133 CO 0.09 -2.00 -0.15 -1.54 0.04 0.00 0.00 177.00 173.44 1s9g s SER 134 N -3.82 4.06 0.15 6.66 1.04 -1.26 -4.81 113.70 115.72 1s9g s SER 134 Ca 0.62 -0.38 -0.31 0.00 0.48 0.00 0.00 55.95 56.37 1s9g s SER 134 Cb -0.15 -0.73 -0.09 0.00 0.10 0.00 0.00 66.02 65.15 1s9g s SER 134 CO 0.55 0.24 1.41 -0.63 0.98 0.00 0.00 173.24 175.79 1s9g s ILE 135 N -1.01 3.11 -1.37 -1.02 1.01 -1.26 -2.59 121.20 118.08 1s9g s ILE 135 Ca 0.17 0.83 -0.08 0.00 0.00 0.00 0.00 60.65 61.56 1s9g s ILE 135 Cb -0.11 -3.53 0.05 0.00 0.01 0.00 0.00 42.46 38.88 1s9g s ILE 135 CO 0.08 0.08 0.54 -3.20 0.00 0.00 0.00 174.94 172.44 1s9g n ASN 136 N 3.57 -4.46 0.00 3.58 2.85 -1.26 -3.03 115.26 116.50 1s9g n ASN 136 Ca 0.10 -0.37 0.00 0.00 -0.11 0.00 0.00 54.58 54.21 1s9g n ASN 136 Cb 0.42 -3.65 0.00 0.00 1.24 0.00 0.00 39.78 37.78 1s9g n ASN 136 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1s9g n ASN 137 N -2.37 -1.17 0.00 1.20 3.02 -1.07 -4.67 115.26 110.19 1s9g n ASN 137 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 1s9g n ASN 137 Cb 0.56 -1.10 0.00 0.00 -0.61 0.00 0.00 39.78 38.64 1s9g n ASN 137 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1s9g n GLU 138 N 0.24 0.00 -3.66 3.52 1.02 -1.17 -4.55 120.64 116.04 1s9g n GLU 138 Ca 0.00 0.12 -0.13 0.00 -0.02 0.00 0.00 57.16 57.14 1s9g n GLU 138 Cb 0.10 -1.58 -0.06 0.00 -0.02 0.00 0.00 31.44 29.88 1s9g n GLU 138 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1s9g s THR 139 N -2.02 0.06 0.02 2.62 -1.32 -1.26 -5.11 115.64 108.61 1s9g s THR 139 Ca 0.00 -0.46 -0.30 0.00 -1.21 0.00 0.00 61.69 59.72 1s9g s THR 139 Cb 0.00 -0.95 -0.06 0.00 -1.51 0.00 0.00 72.50 69.98 1s9g s THR 139 CO 0.00 -0.25 1.39 -2.16 -2.21 0.00 0.00 174.62 171.39 1s9g s PRO 140 N -2.48 4.29 0.83 7.08 0.04 -1.26 -4.53 135.00 138.98 1s9g s PRO 140 Ca -0.05 1.97 -0.17 0.00 0.04 0.00 0.00 61.00 62.79 1s9g s PRO 140 Cb -0.01 -3.53 -0.14 0.00 0.04 0.00 0.00 34.50 30.86 1s9g s PRO 140 CO -0.02 -0.55 -0.60 0.41 0.04 0.00 0.00 177.00 176.28 1s9g n GLY 141 N 3.61 -4.13 3.76 0.56 0.00 -1.26 -4.86 105.19 102.87 1s9g n GLY 141 Ca 0.13 -0.61 -0.38 0.00 0.00 0.00 0.00 46.02 45.16 1s9g n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9g s ILE 142 N -1.93 5.11 -0.15 -0.61 1.01 0.34 -4.84 121.20 120.12 1s9g s ILE 142 Ca 0.43 0.94 0.00 0.00 0.00 0.00 0.00 60.65 62.02 1s9g s ILE 142 Cb -0.26 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.42 1s9g s ILE 142 CO 0.76 0.41 -0.16 -0.13 0.00 0.00 0.00 174.94 175.82 1s9g s ARG 143 N 0.05 3.19 0.09 2.79 0.52 -1.26 0.89 118.95 125.21 1s9g s ARG 143 Ca 0.25 -0.76 0.02 0.00 -0.52 0.00 0.00 55.73 54.72 1s9g s ARG 143 Cb -0.16 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.67 1s9g s ARG 143 CO 0.12 0.00 -0.08 0.71 0.02 0.00 0.00 175.30 176.07 1s9g s TYR 144 N 0.84 0.90 0.03 -0.53 2.02 0.47 -2.13 117.35 118.94 1s9g s TYR 144 Ca -0.05 -0.77 0.03 0.00 -0.37 0.00 0.00 57.07 55.91 1s9g s TYR 144 Cb -0.15 -0.51 -0.02 0.00 -0.40 0.00 0.00 41.96 40.88 1s9g s TYR 144 CO -0.01 -0.09 -0.10 -1.14 -1.57 0.00 0.00 175.55 172.64 1s9g s GLN 145 N -3.18 0.70 0.29 -0.62 0.74 -0.46 0.25 119.66 117.38 1s9g s GLN 145 Ca 0.07 -0.62 -0.29 0.00 0.05 0.00 0.00 55.36 54.57 1s9g s GLN 145 Cb 0.01 -0.64 -0.09 0.00 1.10 0.00 0.00 33.01 33.39 1s9g s GLN 145 CO -0.03 0.15 1.06 0.71 -0.55 0.00 0.00 175.29 176.64 1s9g s TYR 146 N -0.82 3.61 -0.26 1.67 2.02 -1.26 -0.50 117.35 121.81 1s9g s TYR 146 Ca -0.02 1.73 0.03 0.00 -0.37 0.00 0.00 57.07 58.45 1s9g s TYR 146 Cb -0.07 -3.20 0.08 0.00 -0.40 0.00 0.00 41.96 38.37 1s9g s TYR 146 CO 0.01 -0.37 1.06 0.09 -1.57 0.00 0.00 175.55 174.76 1s9g n ASN 147 N 1.05 2.23 -3.77 2.29 3.02 0.63 -4.65 115.26 116.07 1s9g n ASN 147 Ca -0.00 -1.97 -0.10 0.00 -0.03 0.00 0.00 54.58 52.48 1s9g n ASN 147 Cb 0.46 -0.06 -0.05 0.00 -0.61 0.00 0.00 39.78 39.52 1s9g n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1s9g s VAL 148 N -0.98 0.04 0.29 2.41 -7.23 -1.24 -1.98 120.40 111.71 1s9g s VAL 148 Ca 0.06 -0.87 -0.30 0.00 -1.81 0.00 0.00 61.98 59.06 1s9g s VAL 148 Cb 0.03 -1.56 -0.11 0.00 0.56 0.00 0.00 36.38 35.30 1s9g s VAL 148 CO 0.04 -0.19 1.59 -0.76 -0.31 0.00 0.00 175.10 175.47 1s9g s LEU 149 N -2.88 4.35 0.12 1.32 1.43 -0.18 -4.42 118.68 118.42 1s9g s LEU 149 Ca 0.10 2.93 0.05 0.00 -1.03 0.00 0.00 54.13 56.18 1s9g s LEU 149 Cb 0.00 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1s9g s LEU 149 CO -0.04 -0.90 0.04 -2.16 0.23 0.00 0.00 176.35 173.52 1s9g s PRO 150 N -0.44 2.63 0.04 1.29 0.04 -1.26 -3.71 135.00 133.59 1s9g s PRO 150 Ca 0.63 -0.89 -0.30 0.00 0.04 0.00 0.00 61.00 60.48 1s9g s PRO 150 Cb -0.47 -2.54 -0.05 0.00 0.04 0.00 0.00 34.50 31.47 1s9g s PRO 150 CO 0.47 0.51 1.18 -0.65 0.04 0.00 0.00 177.00 178.56 1s9g s GLN 151 N -2.63 4.43 0.00 4.56 -0.21 -1.26 -3.03 119.66 121.52 1s9g s GLN 151 Ca 0.28 1.73 0.00 0.00 0.02 0.00 0.00 55.36 57.39 1s9g s GLN 151 Cb -0.11 -3.38 0.00 0.00 1.00 0.00 0.00 33.01 30.52 1s9g s GLN 151 CO 0.20 -0.26 0.00 0.41 -2.12 0.00 0.00 175.29 173.51 1s9g n GLY 152 N 3.21 2.71 3.57 3.09 0.00 -1.26 -4.54 105.19 111.97 1s9g n GLY 152 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1s9g n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1s9g s TRP 153 N -2.45 3.20 -1.18 1.61 -0.00 -1.17 -4.43 118.94 114.53 1s9g s TRP 153 Ca 0.00 0.20 0.00 0.00 -0.00 0.00 0.00 56.10 56.30 1s9g s TRP 153 Cb 0.00 -2.79 0.00 0.00 -0.00 0.00 0.00 33.47 30.68 1s9g s TRP 153 CO 0.00 -0.44 0.68 1.63 -0.00 0.00 0.00 176.95 178.81 1s9g n LYS 154 N 5.57 0.00 0.02 5.86 5.02 -1.26 -0.69 118.16 132.68 1s9g n LYS 154 Ca -0.06 0.22 0.13 0.00 -2.02 0.00 0.00 58.31 56.58 1s9g n LYS 154 Cb 0.49 -1.55 0.46 0.00 -0.02 0.00 0.00 35.03 34.42 1s9g n LYS 154 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s9g n GLY 155 N -1.18 -1.45 0.10 0.72 0.00 -1.26 -3.24 105.19 98.88 1s9g n GLY 155 Ca 0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 1s9g n GLY 155 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1s9g h SER 156 N 0.00 -0.10 0.07 1.61 0.02 -1.16 -1.15 113.55 112.84 1s9g h SER 156 Ca 0.00 -0.43 -0.01 0.00 -0.84 0.00 0.00 61.79 60.51 1s9g h SER 156 Cb 0.54 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 1s9g h SER 156 CO 0.00 0.55 -0.07 1.55 -1.14 0.00 0.00 176.83 177.72 1s9g h PRO 157 N -0.93 0.00 -0.52 3.45 0.13 -1.75 0.04 132.00 132.42 1s9g h PRO 157 Ca -0.01 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.06 1s9g h PRO 157 Cb 0.52 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.63 1s9g h PRO 157 CO 0.02 0.07 0.09 0.00 -0.23 0.00 0.00 178.00 177.95 1s9g h ALA 158 N 1.93 0.69 0.00 -0.56 0.00 -1.52 0.16 119.26 119.97 1s9g h ALA 158 Ca -0.00 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1s9g h ALA 158 Cb 0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1s9g h ALA 158 CO 0.01 0.42 -0.60 0.82 0.00 0.00 0.00 179.25 179.91 1s9g h ILE 159 N 0.75 0.87 0.00 0.00 2.04 -0.75 -3.26 117.51 117.16 1s9g h ILE 159 Ca 0.16 -2.25 -0.09 0.00 1.00 0.00 0.00 64.86 63.69 1s9g h ILE 159 Cb 0.39 2.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.87 1s9g h ILE 159 CO 0.01 0.49 -0.80 0.15 0.00 0.00 0.00 178.15 178.01 1s9g h PHE 160 N 0.00 0.00 -0.61 1.37 3.57 -0.86 -3.35 116.94 117.06 1s9g h PHE 160 Ca -0.02 0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.60 1s9g h PHE 160 Cb 1.42 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 40.04 1s9g h PHE 160 CO 0.00 0.34 -0.17 0.94 -2.23 0.00 0.00 178.31 177.19 1s9g n GLN 161 N -2.99 -0.08 0.00 1.11 7.27 0.55 0.23 117.38 123.48 1s9g n GLN 161 Ca -0.02 0.95 0.00 0.00 0.07 0.00 0.00 57.00 58.01 1s9g n GLN 161 Cb 0.70 -1.42 0.00 0.00 2.41 0.00 0.00 30.24 31.92 1s9g n GLN 161 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 1s9g n SER 162 N -4.98 0.00 -0.30 1.69 2.88 -1.26 -1.23 113.62 110.42 1s9g n SER 162 Ca 0.09 0.81 0.11 0.00 -1.33 0.00 0.00 58.87 58.55 1s9g n SER 162 Cb 0.29 -0.31 0.24 0.00 -0.75 0.00 0.00 64.21 63.68 1s9g n SER 162 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1s9g h SER 163 N 0.00 -0.30 0.87 -3.46 0.02 -0.48 -2.86 113.55 107.34 1s9g h SER 163 Ca 0.00 0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 61.14 1s9g h SER 163 Cb 0.00 0.38 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1s9g h SER 163 CO 0.00 -0.24 -0.48 -0.03 -1.14 0.00 0.00 176.83 174.94 1s9g h MET 164 N 0.10 -1.20 0.00 3.45 -1.53 -0.21 -1.39 114.93 114.14 1s9g h MET 164 Ca 0.52 0.08 0.00 0.00 -3.44 0.00 0.00 59.70 56.86 1s9g h MET 164 Cb 1.02 0.27 0.00 0.00 -0.55 0.00 0.00 31.60 32.34 1s9g h MET 164 CO -0.76 -0.80 0.25 1.79 0.14 0.00 0.00 176.91 177.52 1s9g h THR 165 N -1.25 0.00 0.06 -0.77 1.35 -0.94 -0.69 112.91 110.67 1s9g h THR 165 Ca -0.12 0.00 -0.25 0.00 -0.55 0.00 0.00 66.41 65.49 1s9g h THR 165 Cb 0.98 0.60 -0.02 0.00 -1.73 0.00 0.00 68.15 67.99 1s9g h THR 165 CO 0.15 0.00 -1.32 0.50 -0.25 0.00 0.00 175.52 174.61 1s9g h LYS 166 N 0.00 0.13 -0.68 4.72 3.64 -1.32 -2.64 116.57 120.42 1s9g h LYS 166 Ca 0.00 -0.22 0.01 0.00 -1.27 0.00 0.00 60.65 59.17 1s9g h LYS 166 Cb 0.49 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 1s9g h LYS 166 CO 0.00 1.10 0.45 0.82 -2.27 0.00 0.00 179.45 179.55 1s9g h ILE 167 N -0.59 1.16 0.00 2.00 2.04 -0.43 -2.36 117.51 119.34 1s9g h ILE 167 Ca -0.31 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.23 1s9g h ILE 167 Cb 1.55 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1s9g h ILE 167 CO -0.05 0.17 -0.46 -0.07 0.00 0.00 0.00 178.15 177.73 1s9g h LEU 168 N 0.91 0.00 -0.06 1.44 3.38 -1.30 -3.40 115.31 116.29 1s9g h LEU 168 Ca 0.25 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.24 1s9g h LEU 168 Cb -0.08 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.61 1s9g h LEU 168 CO -0.06 0.01 -0.42 -0.08 0.09 0.00 0.00 178.44 177.98 1s9g h GLU 169 N 0.00 -0.52 -1.82 1.13 4.57 -1.03 0.14 114.58 117.05 1s9g h GLU 169 Ca 0.00 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1s9g h GLU 169 Cb 0.97 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 1s9g h GLU 169 CO 0.00 -0.35 0.00 -0.35 -1.18 0.00 0.00 179.01 177.13 1s9g n PRO 170 N -5.44 0.63 0.00 0.92 -0.04 -1.26 -1.48 135.00 128.32 1s9g n PRO 170 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1s9g n PRO 170 Cb 0.37 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 1s9g n PRO 170 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1s9g n PHE 171 N 1.40 -0.48 0.30 0.54 -0.00 -0.78 -4.73 117.46 113.71 1s9g n PHE 171 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.45 57.48 1s9g n PHE 171 Cb 0.31 0.27 0.15 0.00 -0.00 0.00 0.00 39.48 40.21 1s9g n PHE 171 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 1s9g n LYS 172 N -2.04 0.13 0.00 -4.13 5.02 0.40 -1.53 118.16 116.01 1s9g n LYS 172 Ca 0.00 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1s9g n LYS 172 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1s9g n LYS 172 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1s9g n LYS 173 N -1.12 0.00 -0.32 1.97 3.00 -0.94 -3.56 118.16 117.19 1s9g n LYS 173 Ca 0.03 0.13 0.14 0.00 -0.00 0.00 0.00 58.31 58.61 1s9g n LYS 173 Cb 0.03 -0.52 0.28 0.00 0.00 0.00 0.00 35.03 34.81 1s9g n LYS 173 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1s9g n GLN 174 N -1.91 -0.07 -3.75 1.64 6.02 -1.11 -2.34 117.38 115.85 1s9g n GLN 174 Ca 0.00 1.39 -0.35 0.00 -0.01 0.00 0.00 57.00 58.03 1s9g n GLN 174 Cb 0.00 -2.21 -0.10 0.00 1.02 0.00 0.00 30.24 28.95 1s9g n GLN 174 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1s9g s ASN 175 N -5.00 5.24 0.00 1.08 0.01 -0.58 -4.93 114.94 110.75 1s9g s ASN 175 Ca -0.12 -3.19 0.27 0.00 -0.71 0.00 0.00 52.86 49.11 1s9g s ASN 175 Cb 0.27 -1.82 1.31 0.00 0.41 0.00 0.00 41.25 41.42 1s9g s ASN 175 CO 0.72 -0.28 1.88 -0.81 -1.51 0.00 0.00 177.10 177.11 1s9g n PRO 176 N 3.00 1.37 -0.00 -0.60 -0.04 -0.99 -3.90 135.00 133.84 1s9g n PRO 176 Ca 0.12 -0.55 0.08 0.00 -0.04 0.00 0.00 63.50 63.11 1s9g n PRO 176 Cb 0.37 -1.45 -0.10 0.00 -0.04 0.00 0.00 33.50 32.28 1s9g n PRO 176 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1s9g n ASP 177 N -0.31 0.80 -4.73 3.54 8.00 -1.26 -4.92 116.55 117.67 1s9g n ASP 177 Ca 0.20 -0.87 -0.41 0.00 0.71 0.00 0.00 54.79 54.42 1s9g n ASP 177 Cb 0.24 1.02 -0.04 0.00 -0.02 0.00 0.00 41.12 42.32 1s9g n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1s9g s ILE 178 N -2.61 4.70 -0.24 0.53 1.01 -1.25 -4.85 121.20 118.48 1s9g s ILE 178 Ca 0.06 1.89 -0.12 0.00 0.00 0.00 0.00 60.65 62.48 1s9g s ILE 178 Cb 0.13 -4.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.31 1s9g s ILE 178 CO 0.69 0.29 0.24 0.68 0.00 0.00 0.00 174.94 176.84 1s9g s VAL 179 N 0.28 5.30 -0.15 2.92 -7.23 -0.53 -4.91 120.40 116.08 1s9g s VAL 179 Ca 0.45 0.33 -0.00 0.00 -1.81 0.00 0.00 61.98 60.95 1s9g s VAL 179 Cb -0.21 -3.57 -0.01 0.00 0.56 0.00 0.00 36.38 33.14 1s9g s VAL 179 CO 0.26 0.29 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.59 1s9g s ILE 180 N 1.33 2.92 -0.07 -0.62 1.01 -1.26 -0.94 121.20 123.58 1s9g s ILE 180 Ca 0.11 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 60.12 1s9g s ILE 180 Cb -0.14 -2.24 -0.00 0.00 0.01 0.00 0.00 42.46 40.08 1s9g s ILE 180 CO 0.07 0.51 -0.23 -0.47 0.00 0.00 0.00 174.94 174.82 1s9g s TYR 181 N 0.68 2.32 -0.35 3.97 5.04 -0.97 -4.96 117.35 123.08 1s9g s TYR 181 Ca -0.06 -0.79 -0.05 0.00 -2.44 0.00 0.00 57.07 53.73 1s9g s TYR 181 Cb -0.15 -1.54 0.06 0.00 0.35 0.00 0.00 41.96 40.67 1s9g s TYR 181 CO 0.02 -0.28 0.11 -1.14 -1.34 0.00 0.00 175.55 172.92 1s9g s GLN 182 N 0.07 2.45 -0.39 4.97 0.74 -1.26 0.71 119.66 126.95 1s9g s GLN 182 Ca -0.09 -1.35 -0.06 0.00 0.05 0.00 0.00 55.36 53.91 1s9g s GLN 182 Cb -0.15 -3.43 0.08 0.00 1.10 0.00 0.00 33.01 30.61 1s9g s GLN 182 CO 0.05 -0.75 0.19 -0.47 -0.55 0.00 0.00 175.29 173.76 1s9g s TYR 183 N 1.31 3.37 0.00 1.67 5.04 -0.05 -4.99 117.35 123.71 1s9g s TYR 183 Ca -0.01 -1.75 0.00 0.00 -2.44 0.00 0.00 57.07 52.87 1s9g s TYR 183 Cb -0.21 -2.81 0.00 0.00 0.35 0.00 0.00 41.96 39.29 1s9g s TYR 183 CO 0.00 -0.85 0.00 -1.33 -1.34 0.00 0.00 175.55 172.03 1s9g n MET 184 N 4.79 0.00 -0.10 4.97 2.81 -1.26 -1.74 117.12 126.59 1s9g n MET 184 Ca -0.09 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.90 1s9g n MET 184 Cb 0.43 0.00 0.33 0.00 -0.71 0.00 0.00 33.22 33.27 1s9g n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1s9g n ASP 185 N 8.15 1.75 -4.36 7.83 8.00 -1.26 -4.53 116.55 132.14 1s9g n ASP 185 Ca 0.00 -1.77 -0.32 0.00 0.71 0.00 0.00 54.79 53.41 1s9g n ASP 185 Cb 0.00 -0.14 -0.15 0.00 -0.02 0.00 0.00 41.12 40.81 1s9g n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1s9g s ASP 186 N -1.45 3.41 -0.23 -2.24 1.01 -0.71 -0.34 116.67 116.12 1s9g s ASP 186 Ca 0.31 -0.38 -0.10 0.00 0.71 0.00 0.00 52.55 53.09 1s9g s ASP 186 Cb 0.17 -0.59 -0.05 0.00 1.01 0.00 0.00 42.92 43.46 1s9g s ASP 186 CO 0.24 0.32 0.15 -0.22 0.21 0.00 0.00 175.17 175.87 1s9g s LEU 187 N -0.59 4.14 -0.51 1.23 2.96 -0.03 -0.87 118.68 125.01 1s9g s LEU 187 Ca 0.09 0.14 -0.06 0.00 -0.22 0.00 0.00 54.13 54.07 1s9g s LEU 187 Cb -0.11 -2.10 0.13 0.00 0.50 0.00 0.00 46.19 44.62 1s9g s LEU 187 CO 0.00 0.09 0.36 -0.31 -1.32 0.00 0.00 176.35 175.17 1s9g s TYR 188 N 0.88 3.49 -0.19 5.38 1.51 0.22 -0.90 117.35 127.75 1s9g s TYR 188 Ca 0.08 -2.23 -0.27 0.00 -1.01 0.00 0.00 57.07 53.64 1s9g s TYR 188 Cb -0.13 -3.38 -0.01 0.00 -0.11 0.00 0.00 41.96 38.34 1s9g s TYR 188 CO 0.03 -0.95 0.91 0.08 -1.11 0.00 0.00 175.55 174.51 1s9g s VAL 189 N 0.90 4.80 -0.12 0.71 1.01 0.10 -2.30 120.40 125.50 1s9g s VAL 189 Ca 0.10 1.79 0.02 0.00 0.00 0.00 0.00 61.98 63.89 1s9g s VAL 189 Cb -0.23 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 31.96 1s9g s VAL 189 CO -0.03 -0.05 -0.20 -0.83 0.00 0.00 0.00 175.10 173.99 1s9g s GLY 190 N 1.20 1.25 0.29 4.51 0.00 -0.11 0.29 107.32 114.75 1s9g s GLY 190 Ca 0.41 -0.96 0.04 0.00 0.00 0.00 0.00 44.72 44.20 1s9g s GLY 190 CO 0.10 0.01 0.04 -1.35 0.00 0.00 0.00 173.10 171.90 1s9g s SER 191 N 0.79 2.14 -0.15 1.64 1.04 0.58 -1.45 113.70 118.30 1s9g s SER 191 Ca -0.09 -1.33 0.18 0.00 0.48 0.00 0.00 55.95 55.19 1s9g s SER 191 Cb -0.16 -0.04 0.36 0.00 0.10 0.00 0.00 66.02 66.28 1s9g s SER 191 CO -0.00 -0.58 1.23 0.47 0.98 0.00 0.00 173.24 175.34 1s9g n ASP 192 N -0.59 2.69 -4.82 7.02 8.00 -1.26 -1.14 116.55 126.45 1s9g n ASP 192 Ca -0.03 -3.14 -0.30 0.00 0.71 0.00 0.00 54.79 52.04 1s9g n ASP 192 Cb 0.66 -0.47 0.08 0.00 -0.02 0.00 0.00 41.12 41.37 1s9g n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1s9g s LEU 193 N -2.90 2.63 0.20 0.64 1.43 -1.26 -4.90 118.68 114.52 1s9g s LEU 193 Ca 0.35 1.26 -0.30 0.00 -1.03 0.00 0.00 54.13 54.41 1s9g s LEU 193 Cb 0.30 -3.89 -0.08 0.00 0.03 0.00 0.00 46.19 42.55 1s9g s LEU 193 CO 0.04 -1.89 1.15 -0.70 0.23 0.00 0.00 176.35 175.18 1s9g s GLU 194 N -5.20 4.55 0.14 1.70 -6.30 -1.26 -4.72 118.70 107.61 1s9g s GLU 194 Ca 0.60 1.81 -0.12 0.00 -2.50 0.00 0.00 54.97 54.76 1s9g s GLU 194 Cb -0.14 -3.25 0.12 0.00 0.00 0.00 0.00 34.13 30.87 1s9g s GLU 194 CO 0.54 0.01 0.95 0.44 0.02 0.00 0.00 175.26 177.22 1s9g n ILE 195 N 2.26 -0.34 -0.31 -3.70 -5.35 -1.26 -0.11 119.36 110.56 1s9g n ILE 195 Ca 0.03 1.45 0.13 0.00 -0.27 0.00 0.00 62.75 64.09 1s9g n ILE 195 Cb 0.45 -1.90 0.28 0.00 -1.74 0.00 0.00 39.64 36.74 1s9g n ILE 195 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1s9g h GLY 196 N 0.00 1.28 0.78 3.28 0.00 -2.00 0.34 103.07 106.74 1s9g h GLY 196 Ca 0.20 0.05 -0.12 0.00 0.00 0.00 0.00 47.33 47.46 1s9g h GLY 196 CO -0.61 -0.42 -0.41 1.46 0.00 0.00 0.00 176.54 176.56 1s9g h GLN 197 N 0.12 0.43 0.08 4.80 4.20 -0.87 -2.97 115.11 120.90 1s9g h GLN 197 Ca 0.56 -0.35 0.01 0.00 0.06 0.00 0.00 58.65 58.93 1s9g h GLN 197 Cb 1.13 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.94 1s9g h GLN 197 CO -0.75 0.98 -0.54 1.25 -0.67 0.00 0.00 178.83 179.11 1s9g h HIS 198 N -0.03 -1.56 -0.95 2.96 2.76 -0.58 1.29 115.15 119.05 1s9g h HIS 198 Ca -0.03 0.04 0.29 0.00 -2.20 0.00 0.00 60.37 58.48 1s9g h HIS 198 Cb 1.06 0.67 -0.16 0.00 1.55 0.00 0.00 27.41 30.53 1s9g h HIS 198 CO 0.12 -0.59 0.32 0.00 -1.30 0.00 0.00 177.93 176.48 1s9g h ARG 199 N -0.73 0.16 0.04 5.26 3.08 -0.46 0.62 114.38 122.34 1s9g h ARG 199 Ca -0.00 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1s9g h ARG 199 Cb 0.75 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.77 1s9g h ARG 199 CO -0.31 0.10 -0.02 1.15 -1.07 0.00 0.00 179.97 179.83 1s9g h THR 200 N 0.16 1.33 -0.90 2.04 2.02 -0.87 -2.16 112.91 114.53 1s9g h THR 200 Ca 0.65 -1.24 0.18 0.00 0.77 0.00 0.00 66.41 66.77 1s9g h THR 200 Cb 1.45 2.14 -0.11 0.00 -1.74 0.00 0.00 68.15 69.90 1s9g h THR 200 CO -0.71 0.31 0.47 0.50 0.37 0.00 0.00 175.52 176.46 1s9g h LYS 201 N -0.60 0.58 0.52 6.66 1.63 0.52 0.85 116.57 126.73 1s9g h LYS 201 Ca -0.00 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.73 1s9g h LYS 201 Cb 0.54 -0.13 0.01 0.00 -0.60 0.00 0.00 32.23 32.05 1s9g h LYS 201 CO 0.01 0.39 -0.25 0.82 -3.45 0.00 0.00 179.45 176.96 1s9g h ILE 202 N 0.60 0.45 0.00 2.00 1.08 0.13 0.50 117.51 122.27 1s9g h ILE 202 Ca 0.52 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.74 1s9g h ILE 202 Cb 0.82 0.55 0.00 0.00 -3.07 0.00 0.00 36.82 35.12 1s9g h ILE 202 CO -0.41 0.04 0.00 1.21 -0.69 0.00 0.00 178.15 178.30 1s9g n GLU 203 N -5.33 0.13 -0.05 2.37 4.07 -0.46 0.22 120.64 121.59 1s9g n GLU 203 Ca -0.12 0.21 -0.14 0.00 -0.06 0.00 0.00 57.16 57.06 1s9g n GLU 203 Cb 0.31 -1.50 -0.12 0.00 -0.06 0.00 0.00 31.44 30.08 1s9g n GLU 203 CO 0.00 0.00 0.00 1.49 -0.06 0.00 0.00 177.13 178.56 1s9g h GLU 204 N 0.00 -0.00 -0.22 5.31 4.81 0.19 -2.55 114.58 122.12 1s9g h GLU 204 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1s9g h GLU 204 Cb 0.10 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1s9g h GLU 204 CO 0.00 0.82 0.08 1.25 -0.73 0.00 0.00 179.01 180.43 1s9g h LEU 205 N -0.82 0.31 -0.82 1.64 5.85 0.21 -0.16 115.31 121.51 1s9g h LEU 205 Ca -0.00 -0.18 0.20 0.00 0.84 0.00 0.00 57.88 58.74 1s9g h LEU 205 Cb 0.82 -0.08 -0.13 0.00 0.37 0.00 0.00 40.66 41.64 1s9g h LEU 205 CO 0.00 0.40 0.20 0.03 -0.34 0.00 0.00 178.44 178.74 1s9g h ARG 206 N 0.19 0.23 0.00 1.25 2.47 0.27 0.29 114.38 119.08 1s9g h ARG 206 Ca 0.07 -0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.74 1s9g h ARG 206 Cb 0.20 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.46 1s9g h ARG 206 CO -0.00 0.15 -0.54 1.96 0.56 0.00 0.00 179.97 182.10 1s9g h GLN 207 N 0.23 0.00 0.93 0.04 4.20 -1.08 -2.48 115.11 116.96 1s9g h GLN 207 Ca 0.49 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 59.16 1s9g h GLN 207 Cb 0.93 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.72 1s9g h GLN 207 CO -0.60 0.11 -0.45 1.25 -0.67 0.00 0.00 178.83 178.47 1s9g h HIS 208 N 0.00 -1.16 -0.38 2.96 2.76 0.14 -0.65 115.15 118.81 1s9g h HIS 208 Ca -0.02 -0.03 0.08 0.00 -2.20 0.00 0.00 60.37 58.21 1s9g h HIS 208 Cb 1.12 0.38 -0.09 0.00 1.55 0.00 0.00 27.41 30.38 1s9g h HIS 208 CO 0.00 -0.72 -0.26 -0.07 -1.30 0.00 0.00 177.93 175.58 1s9g h LEU 209 N -1.32 -0.86 -0.92 0.26 3.38 -1.18 -2.03 115.31 112.64 1s9g h LEU 209 Ca -0.13 0.17 0.17 0.00 0.09 0.00 0.00 57.88 58.18 1s9g h LEU 209 Cb 0.96 0.43 -0.10 0.00 0.09 0.00 0.00 40.66 42.04 1s9g h LEU 209 CO 0.21 -0.28 0.51 0.25 0.09 0.00 0.00 178.44 179.22 1s9g h LEU 210 N -0.20 0.64 -0.57 1.67 5.85 -1.23 0.15 115.31 121.62 1s9g h LEU 210 Ca 0.18 0.10 0.00 0.00 0.84 0.00 0.00 57.88 59.00 1s9g h LEU 210 Cb 0.49 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1s9g h LEU 210 CO -0.50 0.24 0.00 -2.11 -0.34 0.00 0.00 178.44 175.74 1s9g n ARG 211 N -4.83 1.36 0.00 1.25 1.85 -0.27 -2.67 116.66 113.36 1s9g n ARG 211 Ca 0.20 -0.56 0.00 0.00 -1.00 0.00 0.00 57.85 56.49 1s9g n ARG 211 Cb 0.49 -1.16 0.00 0.00 -1.05 0.00 0.00 32.46 30.75 1s9g n ARG 211 CO 0.00 0.00 0.00 0.91 -0.01 0.00 0.00 177.63 178.53 1s9g n TRP 212 N -0.08 0.00 0.00 2.89 5.03 0.47 -5.03 117.44 120.72 1s9g n TRP 212 Ca 0.07 -0.26 0.00 0.00 3.03 0.00 0.00 57.50 60.34 1s9g n TRP 212 Cb 0.14 -0.03 0.00 0.00 -1.03 0.00 0.00 31.31 30.40 1s9g n TRP 212 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1s9g n GLY 213 N -0.26 3.38 3.58 6.99 0.00 -0.77 -5.06 105.19 113.05 1s9g n GLY 213 Ca 0.00 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.67 1s9g n GLY 213 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s9g n LEU 214 N 0.00 3.11 -4.76 0.99 4.77 -1.02 -4.84 117.00 115.25 1s9g n LEU 214 Ca 0.00 0.16 -0.40 0.00 -0.03 0.00 0.00 56.01 55.74 1s9g n LEU 214 Cb 0.00 -1.54 -0.05 0.00 -2.33 0.00 0.00 43.42 39.50 1s9g n LEU 214 CO 0.00 -0.76 0.49 -0.89 -1.33 0.00 0.00 177.39 174.90 1s9g s THR 215 N 8.57 4.55 -0.20 -5.08 2.01 -1.26 -2.72 115.64 121.51 1s9g s THR 215 Ca 1.02 1.71 -0.02 0.00 0.31 0.00 0.00 61.69 64.70 1s9g s THR 215 Cb -0.36 -4.15 0.06 0.00 0.01 0.00 0.00 72.50 68.06 1s9g s THR 215 CO 0.35 0.43 0.02 0.42 -0.69 0.00 0.00 174.62 175.15 1s9g s THR 216 N -0.52 0.72 -1.56 -0.82 -4.23 -1.26 -4.69 115.64 103.28 1s9g s THR 216 Ca 0.38 -0.66 0.04 0.00 -1.18 0.00 0.00 61.69 60.27 1s9g s THR 216 Cb -0.22 -1.16 0.08 0.00 1.34 0.00 0.00 72.50 72.54 1s9g s THR 216 CO 0.25 -0.17 0.89 -0.81 -0.54 0.00 0.00 174.62 174.25 1s9g n PRO 217 N 4.98 0.07 -0.04 3.99 -0.04 -1.26 -4.26 135.00 138.44 1s9g n PRO 217 Ca -0.09 0.19 -0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1s9g n PRO 217 Cb 0.47 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.42 1s9g n PRO 217 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1s9g n ASP 218 N -1.22 0.31 -3.51 3.54 9.92 -1.26 -4.07 116.55 120.26 1s9g n ASP 218 Ca 0.02 -1.24 -0.40 0.00 -0.53 0.00 0.00 54.79 52.64 1s9g n ASP 218 Cb 0.03 -0.07 0.02 0.00 -0.64 0.00 0.00 41.12 40.46 1s9g n ASP 218 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1s9g n LYS 219 N 2.30 4.98 -0.33 -1.24 4.81 -1.26 -4.89 118.16 122.54 1s9g n LYS 219 Ca 0.01 -4.50 0.14 0.00 -0.87 0.00 0.00 58.31 53.10 1s9g n LYS 219 Cb 0.04 -2.43 0.29 0.00 0.02 0.00 0.00 35.03 32.94 1s9g n LYS 219 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1s9g h LYS 220 N 3.99 0.04 0.00 1.64 3.64 -1.97 -3.45 116.57 120.46 1s9g h LYS 220 Ca 0.53 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.91 1s9g h LYS 220 Cb 0.28 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1s9g h LYS 220 CO 1.21 0.02 0.00 -2.39 -2.27 0.00 0.00 179.45 176.03 1s9g n HIS 221 N -5.44 -0.78 -4.56 1.91 1.44 -1.26 -5.11 115.22 101.42 1s9g n HIS 221 Ca 0.23 -0.01 -0.26 0.00 -2.01 0.00 0.00 57.72 55.67 1s9g n HIS 221 Cb 0.75 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.75 1s9g n HIS 221 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1s9g s GLN 222 N -2.00 1.85 0.00 -1.40 1.11 -1.26 -5.00 119.66 112.95 1s9g s GLN 222 Ca 0.00 -2.03 0.00 0.00 0.01 0.00 0.00 55.36 53.34 1s9g s GLN 222 Cb -0.00 -1.40 0.00 0.00 -1.01 0.00 0.00 33.01 30.60 1s9g s GLN 222 CO 0.00 -0.08 0.11 1.63 0.01 0.00 0.00 175.29 176.97 1s9g n LYS 223 N -0.87 0.00 -3.64 2.91 5.02 -1.26 -4.38 118.16 115.95 1s9g n LYS 223 Ca -0.04 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.87 1s9g n LYS 223 Cb 0.67 -1.41 -0.12 0.00 -0.02 0.00 0.00 35.03 34.15 1s9g n LYS 223 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1s9g s GLU 224 N -1.14 3.73 -0.90 1.97 2.02 -1.26 -5.07 118.70 118.06 1s9g s GLU 224 Ca 0.00 -0.46 -0.18 0.00 0.02 0.00 0.00 54.97 54.35 1s9g s GLU 224 Cb 0.00 -3.56 0.14 0.00 0.10 0.00 0.00 34.13 30.81 1s9g s GLU 224 CO 0.00 -0.24 1.06 -2.14 0.02 0.00 0.00 175.26 173.95 1s9g s PRO 225 N 1.69 3.57 -0.21 0.39 0.02 -1.26 -4.86 135.00 134.33 1s9g s PRO 225 Ca 0.06 -1.82 0.12 0.00 0.02 0.00 0.00 61.00 59.39 1s9g s PRO 225 Cb -0.16 -4.80 0.74 0.00 0.02 0.00 0.00 34.50 30.30 1s9g s PRO 225 CO 0.08 -1.70 1.62 -0.35 -0.33 0.00 0.00 177.00 176.33 1s9g n PRO 226 N 6.20 4.51 -3.29 5.54 -0.04 -1.26 -4.93 135.00 141.73 1s9g n PRO 226 Ca 0.21 -2.84 -0.16 0.00 -0.04 0.00 0.00 63.50 60.67 1s9g n PRO 226 Cb 0.48 -2.20 0.08 0.00 -0.04 0.00 0.00 33.50 31.83 1s9g n PRO 226 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1s9g n PHE 227 N 0.55 -2.27 -3.57 0.54 1.16 -1.26 -5.06 117.46 107.56 1s9g n PHE 227 Ca 0.25 0.87 -0.32 0.00 -1.87 0.00 0.00 57.45 56.38 1s9g n PHE 227 Cb 1.11 -4.54 -0.05 0.00 -1.61 0.00 0.00 39.48 34.39 1s9g n PHE 227 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 1s9g s LEU 228 N -5.77 4.24 -0.34 5.98 2.96 -1.26 -5.04 118.68 119.45 1s9g s LEU 228 Ca 0.23 0.74 -0.29 0.00 -0.22 0.00 0.00 54.13 54.59 1s9g s LEU 228 Cb -0.03 -3.40 0.00 0.00 0.50 0.00 0.00 46.19 43.27 1s9g s LEU 228 CO 0.71 0.03 1.34 0.26 -1.32 0.00 0.00 176.35 177.37 1s9g s TRP 229 N -1.68 2.58 0.63 5.38 0.52 -1.26 -4.99 118.94 120.12 1s9g s TRP 229 Ca 0.42 0.79 -0.17 0.00 0.02 0.00 0.00 56.10 57.16 1s9g s TRP 229 Cb -0.12 -4.07 -0.06 0.00 -1.15 0.00 0.00 33.47 28.07 1s9g s TRP 229 CO 0.22 -1.81 0.66 -1.33 0.02 0.00 0.00 176.95 174.71 1s9g n MET 230 N 7.60 0.54 0.00 4.98 2.81 -1.26 -4.84 117.12 126.95 1s9g n MET 230 Ca 0.15 0.22 0.00 0.00 -1.81 0.00 0.00 57.70 56.26 1s9g n MET 230 Cb 0.47 -1.88 0.00 0.00 -0.71 0.00 0.00 33.22 31.11 1s9g n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1s9g n GLY 231 N 1.60 0.00 2.75 3.03 0.00 -1.26 -4.31 105.19 107.00 1s9g n GLY 231 Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.06 1s9g n GLY 231 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1s9g n TYR 232 N 0.00 0.48 -3.10 1.61 4.19 -1.26 -4.67 117.16 114.41 1s9g n TYR 232 Ca 0.00 -1.00 -0.42 0.00 3.31 0.00 0.00 57.90 59.79 1s9g n TYR 232 Cb 0.00 -1.00 -0.07 0.00 0.49 0.00 0.00 39.34 38.77 1s9g n TYR 232 CO 0.00 0.00 0.00 -1.21 0.91 0.00 0.00 176.86 176.56 1s9g s GLU 233 N 3.99 3.50 0.17 2.98 2.02 -1.25 -2.99 118.70 127.13 1s9g s GLU 233 Ca 0.17 -0.13 0.03 0.00 0.02 0.00 0.00 54.97 55.06 1s9g s GLU 233 Cb 0.05 -3.87 -0.03 0.00 0.10 0.00 0.00 34.13 30.37 1s9g s GLU 233 CO -0.01 -0.87 0.29 -0.51 0.02 0.00 0.00 175.26 174.17 1s9g s LEU 234 N 2.80 4.29 -0.48 1.80 1.43 0.39 -4.89 118.68 124.02 1s9g s LEU 234 Ca 0.24 0.12 0.05 0.00 -1.03 0.00 0.00 54.13 53.51 1s9g s LEU 234 Cb -0.14 -2.85 0.19 0.00 0.03 0.00 0.00 46.19 43.42 1s9g s LEU 234 CO 0.17 0.02 0.43 1.41 0.23 0.00 0.00 176.35 178.61 1s9g n HIS 235 N -0.74 0.22 0.58 0.29 8.25 -1.26 -0.75 115.22 121.80 1s9g n HIS 235 Ca -0.08 -3.59 0.05 0.00 -0.26 0.00 0.00 57.72 53.84 1s9g n HIS 235 Cb 0.55 -0.06 0.27 0.00 1.12 0.00 0.00 29.99 31.87 1s9g n HIS 235 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1s9g n PRO 236 N 2.29 0.29 0.00 -0.41 -0.04 -1.26 -1.77 135.00 134.10 1s9g n PRO 236 Ca 0.26 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.84 1s9g n PRO 236 Cb 0.46 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.58 1s9g n PRO 236 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1s9g n ASP 237 N -1.00 0.62 -0.49 3.54 5.68 -1.25 -3.60 116.55 120.05 1s9g n ASP 237 Ca 0.07 -0.39 0.06 0.00 -0.50 0.00 0.00 54.79 54.03 1s9g n ASP 237 Cb 0.03 0.44 0.05 0.00 -1.14 0.00 0.00 41.12 40.50 1s9g n ASP 237 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1s9g n LYS 238 N -1.55 0.70 -1.96 0.11 4.76 -0.73 -4.96 118.16 114.52 1s9g n LYS 238 Ca 0.05 -1.23 -0.42 0.00 -2.87 0.00 0.00 58.31 53.84 1s9g n LYS 238 Cb 0.34 -1.23 -0.03 0.00 -1.84 0.00 0.00 35.03 32.27 1s9g n LYS 238 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1s9g s TRP 239 N -1.01 2.11 0.03 2.13 0.23 -1.24 -4.91 118.94 116.27 1s9g s TRP 239 Ca 0.14 0.21 -0.18 0.00 -2.03 0.00 0.00 56.10 54.25 1s9g s TRP 239 Cb 0.10 -3.95 0.06 0.00 0.03 0.00 0.00 33.47 29.71 1s9g s TRP 239 CO 0.15 -3.93 0.81 2.41 0.96 0.00 0.00 176.95 177.35 1s9g n THR 240 N 5.19 0.00 0.00 2.01 -1.04 -1.26 -5.06 114.28 114.11 1s9g n THR 240 Ca 0.17 -0.18 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1s9g n THR 240 Cb 0.42 0.42 0.00 0.00 -1.82 0.00 0.00 70.33 69.35 1s9g n THR 240 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1s9g n VAL 241 N -0.58 0.00 -2.14 12.58 3.14 -1.26 -4.92 118.33 125.15 1s9g n VAL 241 Ca 0.02 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.38 1s9g n VAL 241 Cb 0.39 0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 33.15 1s9g n VAL 241 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1s9g n GLN 242 N -0.23 0.00 0.00 1.45 -0.00 -1.26 -4.95 117.38 112.38 1s9g n GLN 242 Ca 0.00 -1.09 0.00 0.00 -0.00 0.00 0.00 57.00 55.91 1s9g n GLN 242 Cb 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 30.24 30.33 1s9g n GLN 242 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 1s9g n PRO 243 N 0.14 0.30 -1.03 2.61 -0.02 -1.26 -4.05 135.00 131.69 1s9g n PRO 243 Ca -0.08 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.21 1s9g n PRO 243 Cb 0.79 -1.31 -0.12 0.00 -0.02 0.00 0.00 33.50 32.83 1s9g n PRO 243 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1s9g n ILE 244 N 0.76 3.21 -2.85 4.25 5.41 -1.26 -4.85 119.36 124.03 1s9g n ILE 244 Ca 0.00 -1.72 -0.43 0.00 1.00 0.00 0.00 62.75 61.60 1s9g n ILE 244 Cb 0.13 -2.15 -0.04 0.00 -0.71 0.00 0.00 39.64 36.88 1s9g n ILE 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1s9g s VAL 245 N 1.46 4.55 0.35 1.39 0.11 -1.26 -4.90 120.40 122.11 1s9g s VAL 245 Ca 0.64 0.83 -0.14 0.00 -2.93 0.00 0.00 61.98 60.39 1s9g s VAL 245 Cb 0.26 -4.37 -0.08 0.00 -1.53 0.00 0.00 36.38 30.66 1s9g s VAL 245 CO -0.02 -0.70 0.75 -0.76 -3.33 0.00 0.00 175.10 171.04 1s9g s LEU 246 N 3.56 3.97 0.12 2.54 1.43 -1.26 -5.03 118.68 124.02 1s9g s LEU 246 Ca 0.36 1.24 -0.24 0.00 -1.03 0.00 0.00 54.13 54.46 1s9g s LEU 246 Cb -0.11 -4.07 -0.07 0.00 0.03 0.00 0.00 46.19 41.96 1s9g s LEU 246 CO 0.23 -0.28 0.73 -2.84 0.23 0.00 0.00 176.35 174.42 1s9g s PRO 247 N -3.30 4.47 -0.75 1.29 0.02 -1.26 -4.99 135.00 130.49 1s9g s PRO 247 Ca 0.53 1.04 -0.16 0.00 0.02 0.00 0.00 61.00 62.44 1s9g s PRO 247 Cb -0.10 -3.28 0.17 0.00 0.02 0.00 0.00 34.50 31.31 1s9g s PRO 247 CO 0.22 0.53 0.75 -1.83 -0.33 0.00 0.00 177.00 176.34 1s9g s GLU 248 N -0.93 3.40 0.52 5.54 -1.05 -1.26 -5.04 118.70 119.87 1s9g s GLU 248 Ca 0.35 -2.05 -0.04 0.00 -0.15 0.00 0.00 54.97 53.07 1s9g s GLU 248 Cb -0.22 -4.44 -0.01 0.00 -0.44 0.00 0.00 34.13 29.02 1s9g s GLU 248 CO 0.24 -1.40 0.80 0.15 0.95 0.00 0.00 175.26 176.00 1s9g s LYS 249 N 1.15 3.13 -0.08 -4.83 1.02 -1.26 -5.02 119.74 113.85 1s9g s LYS 249 Ca 0.16 -0.09 -0.24 0.00 0.02 0.00 0.00 55.97 55.82 1s9g s LYS 249 Cb -0.16 -2.39 -0.20 0.00 -0.52 0.00 0.00 37.83 34.57 1s9g s LYS 249 CO -0.04 -0.43 0.87 -0.44 -0.92 0.00 0.00 175.35 174.39 1s9g h ASP 250 N 0.11 -0.06 -4.00 2.83 3.32 -2.06 -3.46 116.42 113.10 1s9g h ASP 250 Ca -0.46 -0.60 -0.50 0.00 0.02 0.00 0.00 57.03 55.49 1s9g h ASP 250 Cb 1.24 0.02 -0.20 0.00 0.22 0.00 0.00 39.33 40.61 1s9g h ASP 250 CO 0.60 0.64 -0.79 -0.94 -1.72 0.00 0.00 179.24 177.03 1s9g s SER 251 N -5.81 2.35 -0.15 6.45 1.04 -1.26 -5.12 113.70 111.21 1s9g s SER 251 Ca -0.15 -0.76 0.02 0.00 0.48 0.00 0.00 55.95 55.54 1s9g s SER 251 Cb -0.01 -0.12 0.01 0.00 0.10 0.00 0.00 66.02 66.01 1s9g s SER 251 CO 0.57 -0.03 -0.20 0.26 0.98 0.00 0.00 173.24 174.82 1s9g s TRP 252 N -1.67 2.54 0.55 5.02 0.52 -1.26 -5.05 118.94 119.59 1s9g s TRP 252 Ca 0.09 -1.35 0.06 0.00 0.02 0.00 0.00 56.10 54.92 1s9g s TRP 252 Cb -0.08 -1.76 0.06 0.00 -1.15 0.00 0.00 33.47 30.55 1s9g s TRP 252 CO 0.04 -0.65 0.76 0.95 0.02 0.00 0.00 176.95 178.07 1s9g s THR 253 N 1.04 2.47 0.27 2.01 -4.23 -1.26 0.78 115.64 116.72 1s9g s THR 253 Ca -0.02 -0.88 -0.04 0.00 -1.18 0.00 0.00 61.69 59.57 1s9g s THR 253 Cb -0.14 -2.59 0.24 0.00 1.34 0.00 0.00 72.50 71.34 1s9g s THR 253 CO -0.06 0.00 1.92 0.58 -0.54 0.00 0.00 174.62 176.52 1s9g h VAL 254 N 0.18 1.23 0.31 2.29 2.07 -0.94 -2.44 116.25 118.95 1s9g h VAL 254 Ca -0.36 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.64 1s9g h VAL 254 Cb 1.28 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1s9g h VAL 254 CO 0.43 0.24 -0.15 -1.13 0.02 0.00 0.00 177.57 176.99 1s9g h ASN 255 N 1.15 -0.35 -0.95 0.57 -1.24 -1.80 -1.97 115.58 110.98 1s9g h ASN 255 Ca 0.30 -0.18 0.09 0.00 0.71 0.00 0.00 56.30 57.22 1s9g h ASN 255 Cb -0.05 0.09 -0.12 0.00 0.73 0.00 0.00 38.32 38.98 1s9g h ASN 255 CO -0.06 0.09 -0.54 0.47 -1.29 0.00 0.00 177.43 176.11 1s9g n ASP 256 N -5.08 -0.96 0.40 1.15 8.00 -1.12 0.69 116.55 119.62 1s9g n ASP 256 Ca -0.09 1.69 -0.19 0.00 0.71 0.00 0.00 54.79 56.91 1s9g n ASP 256 Cb 0.27 -0.24 -0.10 0.00 -0.02 0.00 0.00 41.12 41.03 1s9g n ASP 256 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 1s9g h ILE 257 N 0.00 0.06 -0.76 0.53 2.10 -1.53 0.20 117.51 118.10 1s9g h ILE 257 Ca 0.17 0.00 0.09 0.00 1.08 0.00 0.00 64.86 66.20 1s9g h ILE 257 Cb 0.41 0.06 -0.11 0.00 -1.09 0.00 0.00 36.82 36.09 1s9g h ILE 257 CO -0.90 0.00 -0.38 0.00 -1.08 0.00 0.00 178.15 175.79 1s9g n GLN 258 N -5.60 -0.27 0.00 2.19 6.02 0.93 0.17 117.38 120.83 1s9g n GLN 258 Ca -0.14 1.16 0.00 0.00 -0.01 0.00 0.00 57.00 58.01 1s9g n GLN 258 Cb 0.48 -1.71 0.00 0.00 1.02 0.00 0.00 30.24 30.02 1s9g n GLN 258 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1s9g n LYS 259 N -5.03 0.00 -0.02 -1.09 5.02 0.22 -1.57 118.16 115.69 1s9g n LYS 259 Ca 0.04 0.63 -0.01 0.00 -2.02 0.00 0.00 58.31 56.96 1s9g n LYS 259 Cb 0.25 -1.46 -0.01 0.00 -0.02 0.00 0.00 35.03 33.79 1s9g n LYS 259 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1s9g n LEU 260 N -2.21 -0.06 -0.01 -0.35 7.94 0.29 0.35 117.00 122.95 1s9g n LEU 260 Ca 0.00 0.70 0.20 0.00 -1.11 0.00 0.00 56.01 55.80 1s9g n LEU 260 Cb 0.00 -0.31 0.46 0.00 0.53 0.00 0.00 43.42 44.09 1s9g n LEU 260 CO 0.00 -0.38 1.19 0.58 -1.11 0.00 0.00 177.39 177.67 1s9g h VAL 261 N 0.00 0.08 0.21 1.96 2.07 0.17 -0.48 116.25 120.26 1s9g h VAL 261 Ca 0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 1s9g h VAL 261 Cb 0.02 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 29.99 1s9g h VAL 261 CO -0.05 0.00 -0.10 1.23 0.02 0.00 0.00 177.57 178.67 1s9g h GLY 262 N 0.00 -0.29 0.04 2.17 0.00 0.69 -2.94 103.07 102.74 1s9g h GLY 262 Ca 0.30 0.11 0.12 0.00 0.00 0.00 0.00 47.33 47.86 1s9g h GLY 262 CO -0.00 -0.10 0.05 0.50 0.00 0.00 0.00 176.54 176.98 1s9g h LYS 263 N -1.07 0.16 -0.07 4.80 1.79 -0.61 0.46 116.57 122.03 1s9g h LYS 263 Ca -0.03 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1s9g h LYS 263 Cb 0.21 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1s9g h LYS 263 CO 0.05 0.11 0.15 -0.07 -1.08 0.00 0.00 179.45 178.60 1s9g h LEU 264 N 0.17 0.00 0.00 2.94 3.38 -1.41 0.27 115.31 120.66 1s9g h LEU 264 Ca 0.32 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.11 1s9g h LEU 264 Cb 0.50 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1s9g h LEU 264 CO -0.47 0.00 -0.87 -1.13 0.09 0.00 0.00 178.44 176.06 1s9g h ASN 265 N 0.00 0.00 1.50 -0.43 -0.73 0.11 -3.17 115.58 112.87 1s9g h ASN 265 Ca 0.03 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.20 1s9g h ASN 265 Cb 0.32 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.91 1s9g h ASN 265 CO -0.00 0.80 -0.44 -0.25 -0.37 0.00 0.00 177.43 177.17 1s9g h TRP 266 N 0.00 0.00 0.00 0.67 -0.00 -0.79 -2.20 115.95 113.64 1s9g h TRP 266 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.86 1s9g h TRP 266 Cb 1.63 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.79 1s9g h TRP 266 CO 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 178.44 178.46 1s9g h ALA 267 N 2.06 1.02 -0.59 2.65 0.00 -1.34 -2.53 119.26 120.53 1s9g h ALA 267 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.08 1s9g h ALA 267 Cb 0.97 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1s9g h ALA 267 CO 0.00 -0.02 0.46 1.03 0.00 0.00 0.00 179.25 180.72 1s9g h SER 268 N 0.00 0.00 -0.01 0.00 0.87 -1.43 2.01 113.55 114.99 1s9g h SER 268 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1s9g h SER 268 Cb 0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1s9g h SER 268 CO 0.00 0.00 -0.19 1.67 -0.53 0.00 0.00 176.83 177.78 1s9g n GLN 269 N -4.19 1.55 -0.10 2.24 -0.06 -0.95 -3.33 117.38 112.54 1s9g n GLN 269 Ca 0.11 -0.96 -0.17 0.00 -2.00 0.00 0.00 57.00 53.98 1s9g n GLN 269 Cb 0.69 -1.23 -0.13 0.00 -4.06 0.00 0.00 30.24 25.51 1s9g n GLN 269 CO 0.00 0.00 0.00 1.51 -0.20 0.00 0.00 177.06 178.37 1s9g n ILE 270 N 0.18 1.53 -3.46 1.69 3.06 0.35 -4.74 119.36 117.97 1s9g n ILE 270 Ca 0.07 -0.64 -0.26 0.00 -2.50 0.00 0.00 62.75 59.42 1s9g n ILE 270 Cb 0.32 -1.30 -0.12 0.00 0.54 0.00 0.00 39.64 39.08 1s9g n ILE 270 CO 0.00 0.00 0.00 -0.31 -2.50 0.00 0.00 176.55 173.74 1s9g s TYR 271 N -2.52 0.31 -2.00 9.51 2.02 0.66 -4.86 117.35 120.46 1s9g s TYR 271 Ca -0.27 -1.14 0.01 0.00 -0.37 0.00 0.00 57.07 55.29 1s9g s TYR 271 Cb 0.08 -0.77 0.04 0.00 -0.40 0.00 0.00 41.96 40.91 1s9g s TYR 271 CO 0.68 -0.86 0.23 -0.35 -1.57 0.00 0.00 175.55 173.67 1s9g n PRO 272 N 4.51 0.15 0.00 -1.71 -0.04 -1.21 -3.53 135.00 133.16 1s9g n PRO 272 Ca 0.06 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.67 1s9g n PRO 272 Cb 0.41 -1.07 0.70 0.00 -0.04 0.00 0.00 33.50 33.50 1s9g n PRO 272 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1s9g n GLY 273 N -0.40 -1.12 3.11 0.55 0.00 -1.26 -4.86 105.19 101.21 1s9g n GLY 273 Ca 0.00 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 1s9g n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9g s ILE 274 N -2.50 2.39 0.33 -0.61 1.01 -1.23 -5.06 121.20 115.54 1s9g s ILE 274 Ca 0.30 -1.45 -0.27 0.00 0.00 0.00 0.00 60.65 59.23 1s9g s ILE 274 Cb 0.20 -2.34 -0.09 0.00 0.01 0.00 0.00 42.46 40.24 1s9g s ILE 274 CO 0.46 0.04 1.03 -0.54 0.00 0.00 0.00 174.94 175.94 1s9g s LYS 275 N 1.17 4.45 0.00 2.79 1.02 -1.26 -4.91 119.74 123.00 1s9g s LYS 275 Ca -0.06 1.56 0.00 0.00 0.02 0.00 0.00 55.97 57.49 1s9g s LYS 275 Cb -0.19 -2.85 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 1s9g s LYS 275 CO -0.05 0.10 0.07 1.33 -0.92 0.00 0.00 175.35 175.88 1s9g n VAL 276 N 0.56 0.00 -0.45 3.17 0.24 -1.26 -4.70 118.33 115.90 1s9g n VAL 276 Ca 0.02 -0.40 0.38 0.00 -2.04 0.00 0.00 64.34 62.31 1s9g n VAL 276 Cb 0.48 1.04 0.66 0.00 -1.47 0.00 0.00 33.84 34.55 1s9g n VAL 276 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1s9g h ARG 277 N 0.00 0.03 -0.04 7.34 2.47 -1.94 2.24 114.38 124.47 1s9g h ARG 277 Ca 0.00 -0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.59 1s9g h ARG 277 Cb 0.02 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.32 1s9g h ARG 277 CO 0.00 0.02 -0.55 0.37 0.56 0.00 0.00 179.97 180.38 1s9g h GLN 278 N 0.04 0.13 0.00 0.04 5.75 -1.94 0.21 115.11 119.33 1s9g h GLN 278 Ca 0.86 -0.08 -0.20 0.00 -0.15 0.00 0.00 58.65 59.08 1s9g h GLN 278 Cb 2.70 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 31.22 1s9g h GLN 278 CO -0.48 0.64 -1.26 1.28 -2.65 0.00 0.00 178.83 176.36 1s9g n LEU 279 N -3.90 1.86 0.09 -2.39 4.77 0.62 -4.29 117.00 113.76 1s9g n LEU 279 Ca -0.02 0.45 0.19 0.00 -0.03 0.00 0.00 56.01 56.60 1s9g n LEU 279 Cb 0.57 -0.92 0.73 0.00 -2.33 0.00 0.00 43.42 41.47 1s9g n LEU 279 CO 0.42 0.13 1.17 0.77 -1.33 0.00 0.00 177.39 178.55 1s9g h SER 280 N -1.00 0.00 0.30 -1.43 4.64 0.24 0.60 113.55 116.90 1s9g h SER 280 Ca -0.31 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.97 1s9g h SER 280 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1s9g h SER 280 CO -0.19 0.00 -0.22 0.07 -0.87 0.00 0.00 176.83 175.62 1s9g h LYS 281 N 0.00 0.00 -0.22 4.77 2.10 -0.72 -1.20 116.57 121.30 1s9g h LYS 281 Ca 0.18 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.83 1s9g h LYS 281 Cb 0.82 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.15 1s9g h LYS 281 CO -0.00 0.22 0.00 -0.11 -2.00 0.00 0.00 179.45 177.56 1s9g n LEU 282 N -4.07 0.22 0.00 7.07 7.94 0.20 -2.13 117.00 126.24 1s9g n LEU 282 Ca -0.02 -0.11 0.00 0.00 -1.11 0.00 0.00 56.01 54.77 1s9g n LEU 282 Cb 0.29 -0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.13 1s9g n LEU 282 CO 0.35 0.05 0.23 0.18 -1.11 0.00 0.00 177.39 177.10 1s9g n LEU 283 N -0.23 0.24 0.11 -1.96 4.77 -0.45 -4.79 117.00 114.69 1s9g n LEU 283 Ca 0.00 -0.24 0.09 0.00 -0.03 0.00 0.00 56.01 55.83 1s9g n LEU 283 Cb 0.05 0.00 0.44 0.00 -2.33 0.00 0.00 43.42 41.58 1s9g n LEU 283 CO 0.00 0.06 0.77 -2.11 -1.33 0.00 0.00 177.39 174.78 1s9g n ARG 284 N -0.05 0.12 -3.20 3.23 1.85 -0.90 -4.66 116.66 113.04 1s9g n ARG 284 Ca 0.00 0.52 -0.29 0.00 -1.00 0.00 0.00 57.85 57.08 1s9g n ARG 284 Cb 0.42 -1.82 -0.03 0.00 -1.05 0.00 0.00 32.46 29.98 1s9g n ARG 284 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1s9g s GLY 285 N -3.41 1.83 -0.97 2.89 0.00 -1.26 -5.01 107.32 101.39 1s9g s GLY 285 Ca 0.01 -0.49 -0.02 0.00 0.00 0.00 0.00 44.72 44.22 1s9g s GLY 285 CO 0.22 -0.37 1.95 -1.30 0.00 0.00 0.00 173.10 173.60 1s9g n THR 286 N -1.12 5.21 -2.16 0.90 -2.24 -1.26 -5.00 114.28 108.61 1s9g n THR 286 Ca -0.01 -5.30 -0.27 0.00 -2.27 0.00 0.00 64.05 56.21 1s9g n THR 286 Cb 0.54 -1.48 0.10 0.00 -2.10 0.00 0.00 70.33 67.40 1s9g n THR 286 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1s9g s LYS 287 N -4.03 1.72 1.27 -0.78 1.02 -1.26 -5.07 119.74 112.61 1s9g s LYS 287 Ca 0.44 -0.38 -0.17 0.00 0.02 0.00 0.00 55.97 55.89 1s9g s LYS 287 Cb 0.27 -2.09 0.32 0.00 -0.52 0.00 0.00 37.83 35.81 1s9g s LYS 287 CO -0.22 -1.59 0.99 0.00 -0.92 0.00 0.00 175.35 173.61 1s9g s ALA 288 N -3.42 -0.62 -0.24 5.17 0.00 -1.26 -4.99 121.76 116.40 1s9g s ALA 288 Ca 0.65 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.19 1s9g s ALA 288 Cb -0.08 -3.12 -0.15 0.00 0.00 0.00 0.00 23.12 19.76 1s9g s ALA 288 CO 0.47 -4.15 -0.22 1.28 0.00 0.00 0.00 175.76 173.14 1s9g n LEU 289 N -5.20 2.86 0.00 0.00 4.77 -1.26 -4.22 117.00 113.95 1s9g n LEU 289 Ca 0.06 -0.08 0.09 0.00 -0.03 0.00 0.00 56.01 56.05 1s9g n LEU 289 Cb 0.57 -0.82 0.42 0.00 -2.33 0.00 0.00 43.42 41.26 1s9g n LEU 289 CO 0.52 0.86 0.79 0.41 -1.33 0.00 0.00 177.39 178.65 1s9g n THR 290 N -3.29 0.62 -1.99 -5.08 -1.04 -1.26 -2.78 114.28 99.46 1s9g n THR 290 Ca -0.43 0.16 -0.42 0.00 -2.04 0.00 0.00 64.05 61.31 1s9g n THR 290 Cb 0.94 -0.84 -0.03 0.00 -1.82 0.00 0.00 70.33 68.58 1s9g n THR 290 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1s9g s GLU 291 N -2.86 3.99 -0.12 -2.82 2.12 -1.26 -4.82 118.70 112.94 1s9g s GLU 291 Ca 0.12 2.04 -0.28 0.00 0.36 0.00 0.00 54.97 57.21 1s9g s GLU 291 Cb 0.12 -4.04 -0.01 0.00 0.26 0.00 0.00 34.13 30.46 1s9g s GLU 291 CO 0.32 -1.07 0.94 0.08 -0.54 0.00 0.00 175.26 174.99 1s9g s VAL 292 N 4.70 4.82 -0.31 3.70 1.01 -1.26 -0.76 120.40 132.30 1s9g s VAL 292 Ca 0.76 1.91 -0.02 0.00 0.00 0.00 0.00 61.98 64.62 1s9g s VAL 292 Cb -0.31 -4.25 0.11 0.00 0.00 0.00 0.00 36.38 31.92 1s9g s VAL 292 CO 0.31 0.03 0.14 0.27 0.00 0.00 0.00 175.10 175.84 1s9g s ILE 293 N 1.95 0.34 0.00 2.22 -4.36 0.23 -4.91 121.20 116.68 1s9g s ILE 293 Ca 0.45 -1.18 0.00 0.00 -0.26 0.00 0.00 60.65 59.66 1s9g s ILE 293 Cb -0.18 -1.27 0.00 0.00 1.25 0.00 0.00 42.46 42.26 1s9g s ILE 293 CO 0.17 -0.76 0.14 -2.65 0.24 0.00 0.00 174.94 172.08 1s9g n PRO 294 N 4.88 0.00 -0.42 0.37 -0.02 -1.25 -4.71 135.00 133.84 1s9g n PRO 294 Ca -0.02 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1s9g n PRO 294 Cb 0.41 -0.33 0.00 0.00 -0.02 0.00 0.00 33.50 33.56 1s9g n PRO 294 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1s9g n LEU 295 N -0.52 0.00 0.00 2.45 -0.00 -1.26 -4.75 117.00 112.92 1s9g n LEU 295 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 56.01 55.98 1s9g n LEU 295 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.41 1s9g n LEU 295 CO 0.00 0.00 0.03 0.35 -0.00 0.00 0.00 177.39 177.77 1s9g n THR 296 N 0.00 0.00 0.00 1.47 -2.24 -1.26 -5.06 114.28 107.18 1s9g n THR 296 Ca 0.00 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 1s9g n THR 296 Cb 0.00 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 1s9g n THR 296 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1s9g n GLU 297 N -0.11 0.00 0.00 -0.78 2.13 -1.26 -3.39 120.64 117.22 1s9g n GLU 297 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1s9g n GLU 297 Cb 0.11 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.82 1s9g n GLU 297 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1s9g n GLU 298 N 0.00 0.92 0.13 5.31 2.13 -1.26 -3.74 120.64 124.13 1s9g n GLU 298 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 1s9g n GLU 298 Cb 0.00 -1.14 -0.08 0.00 0.27 0.00 0.00 31.44 30.49 1s9g n GLU 298 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1s9g h ALA 299 N 2.56 -0.95 -0.58 4.31 0.00 -1.74 3.28 119.26 126.13 1s9g h ALA 299 Ca 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1s9g h ALA 299 Cb 0.14 0.75 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1s9g h ALA 299 CO 0.00 -1.03 0.39 0.93 0.00 0.00 0.00 179.25 179.54 1s9g h GLU 300 N -0.64 0.73 -0.38 0.00 4.39 -1.69 -0.13 114.58 116.87 1s9g h GLU 300 Ca -0.02 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.58 1s9g h GLU 300 Cb 0.61 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1s9g h GLU 300 CO -0.18 0.48 0.01 -0.07 -1.16 0.00 0.00 179.01 178.10 1s9g h LEU 301 N 0.75 0.64 -2.39 1.33 3.38 -1.45 0.38 115.31 117.96 1s9g h LEU 301 Ca 0.22 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1s9g h LEU 301 Cb -0.03 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 1s9g h LEU 301 CO -0.05 0.78 -0.03 -0.33 0.09 0.00 0.00 178.44 178.89 1s9g h GLU 302 N 0.48 0.00 0.00 1.13 4.39 0.76 0.53 114.58 121.87 1s9g h GLU 302 Ca 0.11 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 1s9g h GLU 302 Cb 0.44 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1s9g h GLU 302 CO 0.02 0.03 -0.46 1.25 -1.16 0.00 0.00 179.01 178.69 1s9g h LEU 303 N 0.00 0.00 -1.80 1.33 5.85 -0.41 -2.80 115.31 117.48 1s9g h LEU 303 Ca -0.00 -0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 1s9g h LEU 303 Cb 0.13 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1s9g h LEU 303 CO 0.00 0.84 -0.13 0.00 -0.34 0.00 0.00 178.44 178.81 1s9g h ALA 304 N -0.82 1.65 0.02 1.25 0.00 -0.18 -0.27 119.26 120.92 1s9g h ALA 304 Ca -0.06 -0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.51 1s9g h ALA 304 Cb 0.56 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1s9g h ALA 304 CO -0.04 0.17 -0.99 1.05 0.00 0.00 0.00 179.25 179.44 1s9g h GLU 305 N 0.00 0.08 0.10 0.00 -0.00 -0.08 -3.28 114.58 111.40 1s9g h GLU 305 Ca -0.00 -0.11 -0.28 0.00 -0.00 0.00 0.00 59.36 58.97 1s9g h GLU 305 Cb 0.26 0.04 0.02 0.00 -0.00 0.00 0.00 28.75 29.06 1s9g h GLU 305 CO 0.02 1.00 -1.18 -2.95 -0.00 0.00 0.00 179.01 175.90 1s9g h ASN 306 N 0.03 0.68 0.00 3.06 7.08 -1.13 -2.94 115.58 122.36 1s9g h ASN 306 Ca -0.04 -0.63 0.00 0.00 -3.08 0.00 0.00 56.30 52.55 1s9g h ASN 306 Cb 1.71 -0.21 0.00 0.00 -2.08 0.00 0.00 38.32 37.74 1s9g h ASN 306 CO 0.14 1.46 0.07 0.54 -2.08 0.00 0.00 177.43 177.55 1s9g n ARG 307 N -3.71 0.00 -0.09 4.14 1.74 -0.17 -1.47 116.66 117.10 1s9g n ARG 307 Ca -0.11 0.36 -0.10 0.00 -0.77 0.00 0.00 57.85 57.23 1s9g n ARG 307 Cb 0.96 -1.57 -0.04 0.00 -1.02 0.00 0.00 32.46 30.80 1s9g n ARG 307 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1s9g n GLU 308 N -1.35 0.53 0.28 5.56 0.28 -1.12 -3.70 120.64 121.13 1s9g n GLU 308 Ca 0.00 0.24 0.13 0.00 -0.16 0.00 0.00 57.16 57.37 1s9g n GLU 308 Cb 0.07 -1.46 0.83 0.00 1.43 0.00 0.00 31.44 32.31 1s9g n GLU 308 CO 0.00 0.00 0.00 -0.84 -0.16 0.00 0.00 177.13 176.13 1s9g h ILE 309 N -1.00 0.63 0.00 3.84 3.07 -1.43 0.71 117.51 123.33 1s9g h ILE 309 Ca -0.06 -0.12 -0.01 0.00 1.55 0.00 0.00 64.86 66.21 1s9g h ILE 309 Cb 1.02 1.08 -0.00 0.00 -0.27 0.00 0.00 36.82 38.64 1s9g h ILE 309 CO -0.04 0.03 -0.07 0.25 -1.05 0.00 0.00 178.15 177.28 1s9g h LEU 310 N 0.00 0.00 -1.84 0.16 6.46 -1.48 -2.86 115.31 115.76 1s9g h LEU 310 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1s9g h LEU 310 Cb 0.07 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.00 1s9g h LEU 310 CO 0.00 0.07 0.00 1.17 -0.62 0.00 0.00 178.44 179.06 1s9g n LYS 311 N -3.13 2.20 -3.90 1.25 4.81 0.24 -4.69 118.16 114.94 1s9g n LYS 311 Ca 0.03 -1.81 -0.30 0.00 -0.87 0.00 0.00 58.31 55.35 1s9g n LYS 311 Cb 0.50 -1.46 -0.15 0.00 0.02 0.00 0.00 35.03 33.94 1s9g n LYS 311 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1s9g s GLU 312 N -1.58 1.25 0.59 1.64 2.02 -0.81 -5.06 118.70 116.75 1s9g s GLU 312 Ca 0.36 -1.38 -0.18 0.00 0.02 0.00 0.00 54.97 53.80 1s9g s GLU 312 Cb 0.20 -2.63 -0.10 0.00 0.10 0.00 0.00 34.13 31.70 1s9g s GLU 312 CO 0.29 -0.87 0.25 -0.35 0.02 0.00 0.00 175.26 174.60 1s9g n PRO 313 N 4.56 0.29 -1.82 0.39 -0.04 -1.26 -4.87 135.00 132.25 1s9g n PRO 313 Ca -0.02 0.12 -0.30 0.00 -0.04 0.00 0.00 63.50 63.25 1s9g n PRO 313 Cb 0.42 -1.45 0.04 0.00 -0.04 0.00 0.00 33.50 32.47 1s9g n PRO 313 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1s9g s VAL 314 N -1.85 3.91 0.53 0.52 0.11 -1.26 -5.11 120.40 117.24 1s9g s VAL 314 Ca 0.63 0.62 0.01 0.00 -2.93 0.00 0.00 61.98 60.31 1s9g s VAL 314 Cb -0.44 -3.56 0.00 0.00 -1.53 0.00 0.00 36.38 30.85 1s9g s VAL 314 CO 0.60 -0.81 0.05 -1.00 -3.33 0.00 0.00 175.10 170.61 1s9g s HIS 315 N -3.25 1.76 0.00 1.54 3.76 -1.26 -4.56 115.29 113.28 1s9g s HIS 315 Ca 0.57 -0.97 0.00 0.00 -0.15 0.00 0.00 55.06 54.51 1s9g s HIS 315 Cb -0.12 -1.63 0.00 0.00 1.11 0.00 0.00 32.58 31.94 1s9g s HIS 315 CO 0.53 0.12 0.00 0.41 -0.85 0.00 0.00 174.74 174.95 1s9g n GLY 316 N -1.36 2.95 3.57 -2.22 0.00 -1.26 -4.92 105.19 101.95 1s9g n GLY 316 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 1s9g n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s9g s VAL 317 N -1.91 3.90 0.23 1.61 1.01 -1.26 -4.94 120.40 119.04 1s9g s VAL 317 Ca 0.00 -1.14 0.11 0.00 0.00 0.00 0.00 61.98 60.95 1s9g s VAL 317 Cb 0.00 -4.95 -0.05 0.00 0.00 0.00 0.00 36.38 31.39 1s9g s VAL 317 CO 0.00 -1.77 -0.19 -0.31 0.00 0.00 0.00 175.10 172.83 1s9g s TYR 318 N 5.85 2.36 -0.24 5.22 1.51 -1.26 -5.01 117.35 125.78 1s9g s TYR 318 Ca 0.54 -0.32 -0.24 0.00 -1.01 0.00 0.00 57.07 56.03 1s9g s TYR 318 Cb 0.01 -1.10 -0.01 0.00 -0.11 0.00 0.00 41.96 40.75 1s9g s TYR 318 CO -0.00 0.60 0.83 -0.47 -1.11 0.00 0.00 175.55 175.39 1s9g s TYR 319 N -2.06 3.31 -0.33 2.71 5.04 -1.26 -5.03 117.35 119.73 1s9g s TYR 319 Ca 0.26 1.12 -0.15 0.00 -2.44 0.00 0.00 57.07 55.86 1s9g s TYR 319 Cb -0.07 -3.05 -0.02 0.00 0.35 0.00 0.00 41.96 39.18 1s9g s TYR 319 CO 0.13 -0.40 0.35 0.34 -1.34 0.00 0.00 175.55 174.63 1s9g s ASP 320 N 1.35 6.17 0.41 4.32 -1.08 -1.26 -4.95 116.67 121.63 1s9g s ASP 320 Ca 0.35 -0.15 0.29 0.00 -0.52 0.00 0.00 52.55 52.51 1s9g s ASP 320 Cb -0.15 -2.19 1.17 0.00 -1.46 0.00 0.00 42.92 40.28 1s9g s ASP 320 CO 0.07 -0.29 1.85 -0.65 0.52 0.00 0.00 175.17 176.67 1s9g h PRO 321 N 8.42 0.00 -0.13 4.34 0.11 -2.01 -2.79 132.00 139.93 1s9g h PRO 321 Ca -0.30 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.64 1s9g h PRO 321 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1s9g h PRO 321 CO 0.67 0.00 -0.60 0.66 -0.21 0.00 0.00 178.00 178.52 1s9g h SER 322 N 0.00 0.51 -4.43 -2.05 4.64 -2.04 -3.45 113.55 106.73 1s9g h SER 322 Ca 0.00 -0.29 -0.48 0.00 -0.47 0.00 0.00 61.79 60.55 1s9g h SER 322 Cb 0.45 -0.15 0.08 0.00 -0.31 0.00 0.00 62.40 62.48 1s9g h SER 322 CO 0.00 0.99 0.39 -0.54 -0.87 0.00 0.00 176.83 176.80 1s9g s LYS 323 N -3.86 2.64 0.27 4.77 1.02 -1.05 -5.09 119.74 118.44 1s9g s LYS 323 Ca -0.06 0.33 -0.00 0.00 0.02 0.00 0.00 55.97 56.25 1s9g s LYS 323 Cb 0.11 -2.03 -0.04 0.00 -0.52 0.00 0.00 37.83 35.35 1s9g s LYS 323 CO 0.83 -1.14 0.46 -0.51 -0.92 0.00 0.00 175.35 174.07 1s9g s ASP 324 N -4.41 6.35 -0.17 2.83 1.01 -1.26 -4.95 116.67 116.07 1s9g s ASP 324 Ca 0.59 0.42 -0.16 0.00 0.71 0.00 0.00 52.55 54.11 1s9g s ASP 324 Cb -0.11 -2.02 -0.04 0.00 1.01 0.00 0.00 42.92 41.76 1s9g s ASP 324 CO 0.50 -0.15 0.40 -0.76 0.21 0.00 0.00 175.17 175.37 1s9g s LEU 325 N -3.77 4.20 -0.19 1.23 1.43 -1.26 -4.58 118.68 115.74 1s9g s LEU 325 Ca 0.39 0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 54.04 1s9g s LEU 325 Cb -0.10 -2.53 -0.02 0.00 0.03 0.00 0.00 46.19 43.57 1s9g s LEU 325 CO 0.32 -0.03 -0.03 -0.63 0.23 0.00 0.00 176.35 176.21 1s9g s ILE 326 N 0.98 3.72 -0.44 -0.59 1.01 0.27 0.01 121.20 126.16 1s9g s ILE 326 Ca 0.20 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.45 1s9g s ILE 326 Cb -0.14 -2.66 0.12 0.00 0.01 0.00 0.00 42.46 39.78 1s9g s ILE 326 CO 0.08 0.45 0.21 0.00 0.00 0.00 0.00 174.94 175.68 1s9g s ALA 327 N 0.91 3.18 0.10 9.38 0.00 -0.31 -0.34 121.76 134.68 1s9g s ALA 327 Ca -0.00 -2.78 -0.25 0.00 0.00 0.00 0.00 51.96 48.93 1s9g s ALA 327 Cb -0.14 -2.29 -0.07 0.00 0.00 0.00 0.00 23.12 20.62 1s9g s ALA 327 CO 0.01 -1.86 0.78 -1.21 0.00 0.00 0.00 175.76 173.49 1s9g s GLU 328 N 0.64 4.54 0.43 0.00 2.02 -0.64 -2.08 118.70 123.61 1s9g s GLU 328 Ca 0.12 1.13 0.04 0.00 0.02 0.00 0.00 54.97 56.28 1s9g s GLU 328 Cb -0.22 -3.32 -0.05 0.00 0.10 0.00 0.00 34.13 30.64 1s9g s GLU 328 CO -0.05 0.40 0.02 0.42 0.02 0.00 0.00 175.26 176.08 1s9g s ILE 329 N -0.52 1.50 -0.24 -1.63 1.01 -1.24 -1.19 121.20 118.89 1s9g s ILE 329 Ca 0.38 -2.00 -0.26 0.00 0.00 0.00 0.00 60.65 58.77 1s9g s ILE 329 Cb -0.22 -2.64 0.09 0.00 0.01 0.00 0.00 42.46 39.70 1s9g s ILE 329 CO 0.25 0.00 0.80 0.00 0.00 0.00 0.00 174.94 175.99 1s9g s GLN 330 N -3.79 0.78 0.05 2.79 0.00 -0.79 -4.57 119.66 114.12 1s9g s GLN 330 Ca 0.25 0.76 -0.30 0.00 -0.00 0.00 0.00 55.36 56.06 1s9g s GLN 330 Cb 0.06 0.38 -0.05 0.00 0.00 0.00 0.00 33.01 33.40 1s9g s GLN 330 CO 0.12 -0.13 1.20 0.21 0.00 0.00 0.00 175.29 176.69 1s9g s LYS 331 N 0.05 4.43 -0.01 9.60 2.20 -1.26 -2.81 119.74 131.94 1s9g s LYS 331 Ca -0.01 1.75 0.10 0.00 -0.36 0.00 0.00 55.97 57.46 1s9g s LYS 331 Cb -0.04 -3.37 -0.14 0.00 -1.51 0.00 0.00 37.83 32.77 1s9g s LYS 331 CO 0.01 -0.27 0.29 1.04 -0.36 0.00 0.00 175.35 176.05 1s9g n GLN 332 N 4.06 1.41 0.00 4.03 1.13 0.21 -4.92 117.38 123.31 1s9g n GLN 332 Ca 0.09 -0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 1s9g n GLN 332 Cb 0.46 -1.15 0.00 0.00 0.11 0.00 0.00 30.24 29.66 1s9g n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1s9g n GLY 333 N 1.70 1.70 3.12 1.08 0.00 -1.08 -4.83 105.19 106.89 1s9g n GLY 333 Ca -0.01 -1.52 -0.04 0.00 0.00 0.00 0.00 46.02 44.45 1s9g n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1s9g n GLN 334 N 1.89 -1.53 -0.49 1.61 6.02 -1.26 -2.41 117.38 121.20 1s9g n GLN 334 Ca 0.00 1.33 -0.01 0.00 -0.01 0.00 0.00 57.00 58.31 1s9g n GLN 334 Cb 0.00 -5.70 -0.01 0.00 1.02 0.00 0.00 30.24 25.55 1s9g n GLN 334 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s9g n GLY 335 N -1.65 0.13 3.82 1.08 0.00 -1.26 -4.82 105.19 102.49 1s9g n GLY 335 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1s9g n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s9g s GLN 336 N -1.02 3.79 -0.06 1.61 -0.21 -1.01 -3.59 119.66 119.17 1s9g s GLN 336 Ca 0.00 -0.05 -0.01 0.00 0.02 0.00 0.00 55.36 55.32 1s9g s GLN 336 Cb 0.00 -3.28 0.03 0.00 1.00 0.00 0.00 33.01 30.76 1s9g s GLN 336 CO 0.00 0.58 0.01 -1.58 -2.12 0.00 0.00 175.29 172.19 1s9g s TRP 337 N -0.50 0.48 0.17 0.91 0.52 -0.01 0.64 118.94 121.15 1s9g s TRP 337 Ca 0.15 -0.05 -0.00 0.00 0.02 0.00 0.00 56.10 56.22 1s9g s TRP 337 Cb -0.13 -0.68 -0.04 0.00 -1.15 0.00 0.00 33.47 31.48 1s9g s TRP 337 CO 0.04 -0.27 0.34 0.95 0.02 0.00 0.00 176.95 178.03 1s9g s THR 338 N 1.88 5.26 -0.19 2.01 -4.23 -1.12 -0.51 115.64 118.73 1s9g s THR 338 Ca 0.03 -0.42 -0.15 0.00 -1.18 0.00 0.00 61.69 59.96 1s9g s THR 338 Cb -0.12 -3.71 0.05 0.00 1.34 0.00 0.00 72.50 70.06 1s9g s THR 338 CO -0.04 -0.10 0.50 -0.72 -0.54 0.00 0.00 174.62 173.73 1s9g s TYR 339 N -1.77 -0.62 0.13 3.99 1.13 -0.98 -1.89 117.35 117.34 1s9g s TYR 339 Ca 0.37 1.42 0.07 0.00 -1.41 0.00 0.00 57.07 57.52 1s9g s TYR 339 Cb -0.11 0.25 -0.04 0.00 -1.10 0.00 0.00 41.96 40.96 1s9g s TYR 339 CO 0.28 -0.31 -0.04 -0.65 -2.51 0.00 0.00 175.55 172.32 1s9g s GLN 340 N 0.67 2.31 -0.18 -3.49 1.11 -0.33 -0.73 119.66 119.02 1s9g s GLN 340 Ca -0.03 -1.04 0.00 0.00 0.01 0.00 0.00 55.36 54.30 1s9g s GLN 340 Cb -0.05 -2.36 0.04 0.00 -1.01 0.00 0.00 33.01 29.63 1s9g s GLN 340 CO -0.05 0.49 -0.07 0.42 0.01 0.00 0.00 175.29 176.09 1s9g s ILE 341 N -1.47 1.36 0.10 1.08 1.01 -0.74 -1.63 121.20 120.91 1s9g s ILE 341 Ca 0.25 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 60.09 1s9g s ILE 341 Cb -0.10 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.86 1s9g s ILE 341 CO 0.17 0.13 0.06 0.00 0.00 0.00 0.00 174.94 175.30 1s9g n TYR 342 N 4.78 -0.11 0.00 3.97 0.18 0.54 -0.89 117.16 125.63 1s9g n TYR 342 Ca -0.13 -0.72 0.00 0.00 1.88 0.00 0.00 57.90 58.92 1s9g n TYR 342 Cb 0.47 0.05 0.00 0.00 -0.38 0.00 0.00 39.34 39.48 1s9g n TYR 342 CO 0.00 0.00 0.00 1.04 -2.08 0.00 0.00 176.86 175.82 1s9g n GLN 343 N -0.20 2.83 -3.85 -3.48 6.02 -1.26 -0.56 117.38 116.89 1s9g n GLN 343 Ca 0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.87 1s9g n GLN 343 Cb 0.16 -0.54 -0.14 0.00 1.02 0.00 0.00 30.24 30.74 1s9g n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1s9g s GLU 344 N -0.63 0.02 0.21 -1.09 0.41 -1.26 -4.96 118.70 111.39 1s9g s GLU 344 Ca 0.00 0.07 -0.29 0.00 -0.41 0.00 0.00 54.97 54.33 1s9g s GLU 344 Cb 0.00 -0.03 -0.16 0.00 -1.78 0.00 0.00 34.13 32.16 1s9g s GLU 344 CO 0.00 -0.03 0.76 -0.35 -0.49 0.00 0.00 175.26 175.15 1s9g n PRO 345 N 3.25 0.48 -3.30 0.39 -0.04 -1.26 -2.13 135.00 132.38 1s9g n PRO 345 Ca -0.15 0.17 -0.23 0.00 -0.04 0.00 0.00 63.50 63.25 1s9g n PRO 345 Cb 0.58 -1.36 0.01 0.00 -0.04 0.00 0.00 33.50 32.69 1s9g n PRO 345 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1s9g n PHE 346 N 0.33 -1.86 -3.14 0.54 3.01 -1.26 -4.85 117.46 110.22 1s9g n PHE 346 Ca 0.16 0.51 -0.19 0.00 1.01 0.00 0.00 57.45 58.94 1s9g n PHE 346 Cb 0.25 -3.40 -0.03 0.00 -0.01 0.00 0.00 39.48 36.30 1s9g n PHE 346 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1s9g n LYS 347 N -3.86 1.22 -1.72 -1.08 4.76 -0.91 -4.61 118.16 111.96 1s9g n LYS 347 Ca -0.04 -3.53 -0.43 0.00 -2.87 0.00 0.00 58.31 51.45 1s9g n LYS 347 Cb 0.56 -1.74 -0.02 0.00 -1.84 0.00 0.00 35.03 31.99 1s9g n LYS 347 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1s9g n ASN 348 N 0.21 3.58 0.04 4.39 3.02 -1.26 -4.27 115.26 120.97 1s9g n ASN 348 Ca 0.25 1.13 0.05 0.00 -0.03 0.00 0.00 54.58 55.98 1s9g n ASN 348 Cb 0.64 -1.54 -0.07 0.00 -0.61 0.00 0.00 39.78 38.20 1s9g n ASN 348 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1s9g n LEU 349 N 2.43 0.68 0.00 3.41 4.77 -0.07 -4.90 117.00 123.32 1s9g n LEU 349 Ca 0.10 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1s9g n LEU 349 Cb 0.35 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1s9g n LEU 349 CO 0.64 0.02 0.00 1.17 -1.33 0.00 0.00 177.39 177.89 1s9g n LYS 350 N -2.71 0.00 -2.59 3.23 4.81 -1.15 -5.02 118.16 114.74 1s9g n LYS 350 Ca -0.07 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.13 1s9g n LYS 350 Cb 0.72 0.00 0.12 0.00 0.02 0.00 0.00 35.03 35.89 1s9g n LYS 350 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1s9g s THR 351 N 0.00 2.03 -0.16 3.15 -4.23 -1.26 -1.80 115.64 113.36 1s9g s THR 351 Ca 0.00 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.92 1s9g s THR 351 Cb 0.00 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.40 1s9g s THR 351 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1s9g n GLY 352 N -2.93 -1.04 3.50 3.99 0.00 0.09 -4.88 105.19 103.93 1s9g n GLY 352 Ca 0.17 -0.75 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 1s9g n GLY 352 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1s9g s LYS 353 N -0.07 1.37 0.10 1.61 2.20 -1.26 -2.33 119.74 121.36 1s9g s LYS 353 Ca 0.00 -0.61 -0.14 0.00 -0.36 0.00 0.00 55.97 54.87 1s9g s LYS 353 Cb 0.00 0.58 0.02 0.00 -1.51 0.00 0.00 37.83 36.92 1s9g s LYS 353 CO 0.00 -0.60 0.33 -0.47 -0.36 0.00 0.00 175.35 174.24 1s9g s TYR 354 N -3.79 -0.08 0.02 4.03 6.14 0.33 -4.95 117.35 119.05 1s9g s TYR 354 Ca 0.04 -0.24 -0.28 0.00 0.64 0.00 0.00 57.07 57.22 1s9g s TYR 354 Cb -0.02 0.14 0.10 0.00 0.42 0.00 0.00 41.96 42.60 1s9g s TYR 354 CO -0.09 -0.63 0.88 0.00 0.64 0.00 0.00 175.55 176.35 1s9g s ALA 355 N -3.67 -1.80 0.00 3.97 0.00 -1.26 -0.83 121.76 118.18 1s9g s ALA 355 Ca 0.03 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.90 1s9g s ALA 355 Cb 0.03 0.46 0.00 0.00 0.00 0.00 0.00 23.12 23.61 1s9g s ALA 355 CO -0.11 -0.72 0.00 -2.13 0.00 0.00 0.00 175.76 172.80 1s9g n ARG 356 N -0.27 3.87 -3.59 0.00 3.00 -1.24 -5.05 116.66 113.38 1s9g n ARG 356 Ca -0.09 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.35 1s9g n ARG 356 Cb 0.62 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.98 1s9g n ARG 356 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.63 179.04 1s9g s MET 357 N 2.55 2.72 0.54 -0.14 0.00 -1.26 -5.01 119.30 118.69 1s9g s MET 357 Ca 0.00 -1.29 -0.21 0.00 0.00 0.00 0.00 55.69 54.19 1s9g s MET 357 Cb 0.00 -3.77 -0.06 0.00 0.00 0.00 0.00 34.83 30.99 1s9g s MET 357 CO 0.00 -0.85 1.06 2.89 0.00 0.00 0.00 175.02 178.12 1s9g n ARG 358 N 4.97 1.20 0.00 4.11 1.85 -1.26 -4.74 116.66 122.79 1s9g n ARG 358 Ca -0.11 0.45 0.00 0.00 -1.00 0.00 0.00 57.85 57.19 1s9g n ARG 358 Cb 0.44 -2.22 0.00 0.00 -1.05 0.00 0.00 32.46 29.63 1s9g n ARG 358 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1s9g n GLY 359 N 1.14 0.73 0.86 2.89 0.00 -1.26 -4.92 105.19 104.63 1s9g n GLY 359 Ca 0.12 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1s9g n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s9g n ALA 360 N -1.00 2.27 0.00 4.61 0.00 -1.26 -3.78 120.51 121.35 1s9g n ALA 360 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1s9g n ALA 360 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1s9g n ALA 360 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1s9g n HIS 361 N 0.46 0.00 -4.50 0.00 1.44 -1.26 -5.11 115.22 106.25 1s9g n HIS 361 Ca 0.00 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.37 1s9g n HIS 361 Cb 0.34 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.34 1s9g n HIS 361 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 1s9g s THR 362 N -1.00 3.91 0.58 0.61 2.01 -1.25 -5.13 115.64 115.38 1s9g s THR 362 Ca 0.00 -0.38 0.08 0.00 0.31 0.00 0.00 61.69 61.70 1s9g s THR 362 Cb 0.00 -2.65 0.08 0.00 0.01 0.00 0.00 72.50 69.94 1s9g s THR 362 CO 0.00 0.57 0.66 0.54 -0.69 0.00 0.00 174.62 175.70 1s9g s ASN 363 N -0.47 4.86 -0.01 3.53 6.03 -1.26 -4.69 114.94 122.93 1s9g s ASN 363 Ca 0.07 -1.06 -0.24 0.00 -1.03 0.00 0.00 52.86 50.60 1s9g s ASN 363 Cb -0.12 0.48 -0.17 0.00 -3.03 0.00 0.00 41.25 38.42 1s9g s ASN 363 CO 0.02 -1.33 1.15 0.44 -2.03 0.00 0.00 177.10 175.36 1s9g h ASP 364 N 0.34 -0.27 -0.39 3.54 3.32 -2.00 -3.04 116.42 117.93 1s9g h ASP 364 Ca -0.31 -0.25 0.08 0.00 0.02 0.00 0.00 57.03 56.57 1s9g h ASP 364 Cb 1.30 0.07 -0.09 0.00 0.22 0.00 0.00 39.33 40.83 1s9g h ASP 364 CO 0.47 0.15 -0.35 0.58 -1.72 0.00 0.00 179.24 178.37 1s9g h VAL 365 N -0.74 0.20 -0.97 -1.35 2.07 -1.98 0.33 116.25 113.80 1s9g h VAL 365 Ca -0.03 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.65 1s9g h VAL 365 Cb 0.50 0.20 -0.10 0.00 -1.52 0.00 0.00 31.29 30.37 1s9g h VAL 365 CO 0.05 0.00 0.58 0.50 0.02 0.00 0.00 177.57 178.73 1s9g h LYS 366 N -0.28 0.77 0.74 1.57 3.64 -1.95 0.75 116.57 121.81 1s9g h LYS 366 Ca 0.16 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 1s9g h LYS 366 Cb 0.55 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1s9g h LYS 366 CO -0.54 0.51 -0.35 1.96 -2.27 0.00 0.00 179.45 178.76 1s9g h GLN 367 N 0.79 -0.96 -0.40 1.90 4.20 -0.37 -1.36 115.11 118.91 1s9g h GLN 367 Ca 0.54 0.07 0.08 0.00 0.06 0.00 0.00 58.65 59.39 1s9g h GLN 367 Cb 0.75 0.22 -0.08 0.00 0.30 0.00 0.00 27.48 28.67 1s9g h GLN 367 CO -0.35 -0.63 -0.10 1.25 -0.67 0.00 0.00 178.83 178.33 1s9g h LEU 368 N -1.02 -0.37 -1.76 1.46 5.85 0.32 1.31 115.31 121.10 1s9g h LEU 368 Ca -0.10 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1s9g h LEU 368 Cb 0.77 0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1s9g h LEU 368 CO 0.17 -0.13 0.09 0.74 -0.34 0.00 0.00 178.44 178.96 1s9g h THR 369 N 0.00 0.00 0.00 1.05 2.02 0.71 0.50 112.91 117.19 1s9g h THR 369 Ca 0.19 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.37 1s9g h THR 369 Cb 0.30 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1s9g h THR 369 CO -0.42 0.00 -0.84 -0.62 0.37 0.00 0.00 175.52 174.01 1s9g n GLU 370 N -2.48 0.47 -0.26 6.66 1.02 0.32 -3.43 120.64 122.95 1s9g n GLU 370 Ca -0.02 0.24 0.32 0.00 -0.02 0.00 0.00 57.16 57.68 1s9g n GLU 370 Cb 0.13 -1.40 0.57 0.00 -0.02 0.00 0.00 31.44 30.73 1s9g n GLU 370 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1s9g h ALA 371 N -1.08 3.01 0.21 0.62 0.00 0.17 0.28 119.26 122.47 1s9g h ALA 371 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1s9g h ALA 371 Cb 0.84 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1s9g h ALA 371 CO 0.00 -1.69 -0.10 0.28 0.00 0.00 0.00 179.25 177.74 1s9g h VAL 372 N 0.00 0.24 -0.17 0.00 2.07 -1.07 0.07 116.25 117.39 1s9g h VAL 372 Ca 0.53 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 67.19 1s9g h VAL 372 Cb 2.75 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.93 1s9g h VAL 372 CO -0.01 0.07 0.25 1.56 0.02 0.00 0.00 177.57 179.46 1s9g h GLN 373 N -1.04 0.00 0.09 1.57 4.20 -0.63 0.60 115.11 119.90 1s9g h GLN 373 Ca -0.03 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 1s9g h GLN 373 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1s9g h GLN 373 CO 0.05 0.00 -0.04 -0.22 -0.67 0.00 0.00 178.83 177.95 1s9g h LYS 374 N 0.00 -0.11 -0.95 1.46 1.63 -0.66 -2.77 116.57 115.17 1s9g h LYS 374 Ca 0.08 0.01 0.27 0.00 -0.85 0.00 0.00 60.65 60.16 1s9g h LYS 374 Cb 0.58 0.03 -0.14 0.00 -0.60 0.00 0.00 32.23 32.09 1s9g h LYS 374 CO -0.00 -0.08 0.44 0.82 -3.45 0.00 0.00 179.45 177.19 1s9g h ILE 375 N -0.32 0.35 0.00 2.00 2.04 -0.40 -1.96 117.51 119.22 1s9g h ILE 375 Ca -0.01 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1s9g h ILE 375 Cb 0.09 -0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.17 1s9g h ILE 375 CO 0.02 0.06 0.00 0.41 0.00 0.00 0.00 178.15 178.64 1s9g n THR 376 N -5.09 0.00 -0.01 -0.27 -1.04 0.20 -1.61 114.28 106.46 1s9g n THR 376 Ca 0.27 0.79 0.00 0.00 -2.04 0.00 0.00 64.05 63.07 1s9g n THR 376 Cb 0.82 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.62 1s9g n THR 376 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1s9g n THR 377 N -0.33 -0.02 -0.14 12.58 -1.04 -1.04 0.35 114.28 124.63 1s9g n THR 377 Ca 0.00 0.09 -0.03 0.00 -2.04 0.00 0.00 64.05 62.06 1s9g n THR 377 Cb 0.00 -0.11 0.04 0.00 -1.82 0.00 0.00 70.33 68.44 1s9g n THR 377 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1s9g h GLU 378 N 0.00 0.08 0.14 -2.82 5.08 -1.16 0.65 114.58 116.55 1s9g h GLU 378 Ca 0.01 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1s9g h GLU 378 Cb 0.02 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1s9g h GLU 378 CO -0.04 0.05 -0.22 0.77 -1.00 0.00 0.00 179.01 178.57 1s9g h SER 379 N 0.08 -0.61 -0.05 1.42 0.02 0.70 0.28 113.55 115.39 1s9g h SER 379 Ca 0.23 0.07 0.03 0.00 -0.84 0.00 0.00 61.79 61.28 1s9g h SER 379 Cb 0.35 0.23 -0.06 0.00 0.14 0.00 0.00 62.40 63.05 1s9g h SER 379 CO -0.41 -0.31 -0.45 0.40 -1.14 0.00 0.00 176.83 174.92 1s9g h ILE 380 N -0.43 0.11 -0.29 3.27 2.04 -1.01 0.40 117.51 121.59 1s9g h ILE 380 Ca 0.02 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.95 1s9g h ILE 380 Cb 0.44 0.11 -0.08 0.00 -0.74 0.00 0.00 36.82 36.55 1s9g h ILE 380 CO -0.10 0.00 -0.25 0.58 0.00 0.00 0.00 178.15 178.38 1s9g h VAL 381 N -0.57 0.37 0.49 1.67 2.07 -0.64 1.29 116.25 120.93 1s9g h VAL 381 Ca 0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 1s9g h VAL 381 Cb 0.66 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1s9g h VAL 381 CO -0.36 0.00 -0.23 0.40 0.02 0.00 0.00 177.57 177.39 1s9g h ILE 382 N -0.23 0.00 -0.27 4.57 2.04 -0.60 -3.39 117.51 119.63 1s9g h ILE 382 Ca 0.15 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1s9g h ILE 382 Cb 0.47 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 1s9g h ILE 382 CO -0.42 0.00 0.00 0.79 0.00 0.00 0.00 178.15 178.52 1s9g n TRP 383 N -4.62 0.89 -4.04 1.37 8.01 0.14 -4.91 117.44 114.27 1s9g n TRP 383 Ca -0.08 -0.83 -0.32 0.00 -1.31 0.00 0.00 57.50 54.95 1s9g n TRP 383 Cb 0.26 -0.28 0.00 0.00 -2.01 0.00 0.00 31.31 29.28 1s9g n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1s9g n GLY 384 N -0.39 -0.45 3.65 6.99 0.00 0.44 -4.92 105.19 110.51 1s9g n GLY 384 Ca 0.20 0.17 -0.03 0.00 0.00 0.00 0.00 46.02 46.36 1s9g n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s9g s LYS 385 N -6.73 0.24 0.56 1.61 -2.85 -1.25 -4.94 119.74 106.38 1s9g s LYS 385 Ca 0.64 0.35 -0.17 0.00 -1.00 0.00 0.00 55.97 55.79 1s9g s LYS 385 Cb -0.33 0.09 -0.05 0.00 -2.06 0.00 0.00 37.83 35.47 1s9g s LYS 385 CO 0.87 -0.04 1.06 0.95 0.10 0.00 0.00 175.35 178.29 1s9g s THR 386 N 0.66 3.72 0.66 3.79 -4.23 -1.26 -3.88 115.64 115.10 1s9g s THR 386 Ca -0.02 0.92 0.03 0.00 -1.18 0.00 0.00 61.69 61.44 1s9g s THR 386 Cb -0.04 -3.38 0.11 0.00 1.34 0.00 0.00 72.50 70.53 1s9g s THR 386 CO -0.12 -0.38 0.91 -2.16 -0.54 0.00 0.00 174.62 172.33 1s9g s PRO 387 N -3.73 1.93 -0.35 3.99 0.04 -1.26 -4.61 135.00 131.00 1s9g s PRO 387 Ca 0.66 -1.27 -0.06 0.00 0.04 0.00 0.00 61.00 60.37 1s9g s PRO 387 Cb -0.17 -2.44 0.05 0.00 0.04 0.00 0.00 34.50 31.97 1s9g s PRO 387 CO 0.31 -1.21 0.12 0.21 0.04 0.00 0.00 177.00 176.46 1s9g s LYS 388 N -4.96 2.58 0.06 4.56 2.47 0.10 -3.67 119.74 120.88 1s9g s LYS 388 Ca 0.64 -1.23 -0.29 0.00 -1.56 0.00 0.00 55.97 53.53 1s9g s LYS 388 Cb -0.06 -3.48 -0.05 0.00 -1.46 0.00 0.00 37.83 32.79 1s9g s LYS 388 CO 0.42 -0.70 0.94 -0.06 0.16 0.00 0.00 175.35 176.11 1s9g s PHE 389 N 1.39 3.74 -1.08 4.03 0.40 0.13 -1.17 117.98 125.43 1s9g s PHE 389 Ca -0.01 1.72 -0.07 0.00 -0.60 0.00 0.00 56.93 57.97 1s9g s PHE 389 Cb -0.20 -3.05 0.28 0.00 0.51 0.00 0.00 43.02 40.56 1s9g s PHE 389 CO 0.02 0.13 1.16 1.63 0.70 0.00 0.00 175.22 178.86 1s9g n LYS 390 N 3.23 3.64 -2.08 0.44 5.02 -0.88 0.48 118.16 128.01 1s9g n LYS 390 Ca 0.03 -4.49 -0.43 0.00 -2.02 0.00 0.00 58.31 51.41 1s9g n LYS 390 Cb 0.50 -2.52 -0.03 0.00 -0.02 0.00 0.00 35.03 32.97 1s9g n LYS 390 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1s9g s LEU 391 N -1.68 4.06 -1.01 -0.35 1.43 0.02 -3.68 118.68 117.47 1s9g s LEU 391 Ca 0.31 1.86 -0.23 0.00 -1.03 0.00 0.00 54.13 55.04 1s9g s LEU 391 Cb -0.06 -3.53 0.04 0.00 0.03 0.00 0.00 46.19 42.67 1s9g s LEU 391 CO -0.04 -1.12 1.52 -2.16 0.23 0.00 0.00 176.35 174.77 1s9g s PRO 392 N 4.41 3.46 -0.21 1.29 0.04 -1.26 -2.38 135.00 140.35 1s9g s PRO 392 Ca 0.72 -1.03 -0.30 0.00 0.04 0.00 0.00 61.00 60.44 1s9g s PRO 392 Cb -0.28 -5.32 0.15 0.00 0.04 0.00 0.00 34.50 29.09 1s9g s PRO 392 CO 0.29 -2.36 1.15 -1.50 0.04 0.00 0.00 177.00 174.61 1s9g s ILE 393 N 5.62 0.00 0.06 0.56 2.07 -1.24 -4.91 121.20 123.35 1s9g s ILE 393 Ca 0.49 0.00 -0.31 0.00 -1.41 0.00 0.00 60.65 59.43 1s9g s ILE 393 Cb -0.01 -1.00 -0.07 0.00 0.13 0.00 0.00 42.46 41.51 1s9g s ILE 393 CO -0.09 0.00 1.46 -1.58 -1.91 0.00 0.00 174.94 172.82 1s9g s GLN 394 N -1.05 4.27 0.23 3.50 0.74 -1.26 -4.62 119.66 121.47 1s9g s GLN 394 Ca 0.03 2.10 -0.16 0.00 0.05 0.00 0.00 55.36 57.37 1s9g s GLN 394 Cb -0.01 -3.45 0.25 0.00 1.10 0.00 0.00 33.01 30.90 1s9g s GLN 394 CO -0.02 -0.57 1.57 -0.22 -0.55 0.00 0.00 175.29 175.50 1s9g h LYS 395 N 7.56 -0.04 -0.36 1.67 3.64 -1.94 -1.71 116.57 125.39 1s9g h LYS 395 Ca -0.40 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.96 1s9g h LYS 395 Cb 1.19 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.01 1s9g h LYS 395 CO 0.90 -0.03 0.16 0.93 -2.27 0.00 0.00 179.45 179.14 1s9g h GLU 396 N -0.04 0.54 0.29 1.90 3.07 -1.96 0.64 114.58 119.01 1s9g h GLU 396 Ca 0.34 -0.09 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 1s9g h GLU 396 Cb 0.60 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.39 1s9g h GLU 396 CO -0.90 0.51 -0.37 1.15 -1.40 0.00 0.00 179.01 177.99 1s9g h THR 397 N 0.45 0.24 -0.50 1.13 2.02 -1.77 -0.89 112.91 113.59 1s9g h THR 397 Ca 0.12 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.37 1s9g h THR 397 Cb 0.16 0.24 -0.06 0.00 -1.74 0.00 0.00 68.15 66.75 1s9g h THR 397 CO -0.01 0.00 0.16 -0.25 0.37 0.00 0.00 175.52 175.79 1s9g h TRP 398 N -0.72 0.28 0.00 3.16 2.91 -1.14 -0.46 115.95 119.98 1s9g h TRP 398 Ca -0.01 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.03 1s9g h TRP 398 Cb 0.67 -0.05 0.00 0.00 -0.51 0.00 0.00 29.16 29.27 1s9g h TRP 398 CO -0.25 0.08 0.05 0.39 -1.03 0.00 0.00 178.44 177.68 1s9g n GLU 399 N -5.03 0.08 -0.11 2.65 1.02 0.22 -1.31 120.64 118.16 1s9g n GLU 399 Ca 0.05 0.57 -0.14 0.00 -0.02 0.00 0.00 57.16 57.62 1s9g n GLU 399 Cb 0.21 -1.82 -0.14 0.00 -0.02 0.00 0.00 31.44 29.67 1s9g n GLU 399 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1s9g n THR 400 N -1.94 1.46 -0.03 2.62 -1.04 -0.22 -4.73 114.28 110.40 1s9g n THR 400 Ca -0.01 -0.71 0.03 0.00 -2.04 0.00 0.00 64.05 61.32 1s9g n THR 400 Cb 0.07 -1.00 -0.13 0.00 -1.82 0.00 0.00 70.33 67.45 1s9g n THR 400 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 1s9g n TRP 401 N -3.04 0.00 -0.33 -1.42 7.02 -0.91 -4.59 117.44 114.17 1s9g n TRP 401 Ca -0.39 0.00 0.26 0.00 -1.02 0.00 0.00 57.50 56.36 1s9g n TRP 401 Cb 1.07 -0.52 0.50 0.00 -2.42 0.00 0.00 31.31 29.94 1s9g n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 1s9g h TRP 402 N 0.00 0.74 -0.54 -5.99 5.08 -1.45 1.95 115.95 115.74 1s9g h TRP 402 Ca -0.15 0.04 -0.01 0.00 1.08 0.00 0.00 58.89 59.85 1s9g h TRP 402 Cb 1.20 -0.16 -0.03 0.00 -3.00 0.00 0.00 29.16 27.18 1s9g h TRP 402 CO 0.00 -0.36 0.30 0.00 -1.28 0.00 0.00 178.44 177.10 1s9g h THR 403 N 0.12 1.16 -0.71 0.12 1.03 -1.83 -3.03 112.91 109.78 1s9g h THR 403 Ca 0.77 -0.40 0.12 0.00 -0.01 0.00 0.00 66.41 66.89 1s9g h THR 403 Cb 1.88 0.43 -0.09 0.00 -1.07 0.00 0.00 68.15 69.30 1s9g h THR 403 CO -0.72 0.18 0.28 -0.08 -0.01 0.00 0.00 175.52 175.16 1s9g h GLU 404 N 0.75 0.43 -0.37 0.00 4.57 0.28 -1.19 114.58 119.05 1s9g h GLU 404 Ca 0.19 -0.03 -0.12 0.00 -1.18 0.00 0.00 59.36 58.23 1s9g h GLU 404 Cb 0.01 -0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 28.43 1s9g h GLU 404 CO -0.03 0.28 0.02 0.66 -1.18 0.00 0.00 179.01 178.76 1s9g n TYR 405 N -4.99 1.23 -3.18 0.92 4.02 -1.20 -4.85 117.16 109.10 1s9g n TYR 405 Ca 0.12 -1.26 -0.39 0.00 -0.01 0.00 0.00 57.90 56.36 1s9g n TYR 405 Cb 0.36 -0.45 -0.05 0.00 -0.02 0.00 0.00 39.34 39.18 1s9g n TYR 405 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 1s9g s TRP 406 N -3.05 3.57 0.00 -0.72 -0.11 -0.45 -4.83 118.94 113.36 1s9g s TRP 406 Ca 0.45 1.10 0.00 0.00 1.22 0.00 0.00 56.10 58.87 1s9g s TRP 406 Cb 0.38 -2.67 0.00 0.00 -1.50 0.00 0.00 33.47 29.68 1s9g s TRP 406 CO 0.05 0.16 0.00 1.04 -4.62 0.00 0.00 176.95 173.59 1s9g n GLN 407 N 3.56 2.16 -2.14 5.86 6.02 -1.26 -4.60 117.38 126.98 1s9g n GLN 407 Ca -0.04 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.58 1s9g n GLN 407 Cb 0.51 -0.79 0.01 0.00 1.02 0.00 0.00 30.24 30.99 1s9g n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1s9g s ALA 408 N -1.38 2.84 -2.02 -1.58 0.00 -1.26 -4.90 121.76 113.45 1s9g s ALA 408 Ca 0.00 0.99 0.10 0.00 0.00 0.00 0.00 51.96 53.05 1s9g s ALA 408 Cb 0.00 -3.42 0.54 0.00 0.00 0.00 0.00 23.12 20.24 1s9g s ALA 408 CO 0.00 -0.87 1.36 0.25 0.00 0.00 0.00 175.76 176.50 1s9g n THR 409 N -0.88 0.06 -4.46 0.00 -2.24 -1.26 -4.85 114.28 100.64 1s9g n THR 409 Ca 0.09 -0.07 -0.22 0.00 -2.27 0.00 0.00 64.05 61.58 1s9g n THR 409 Cb 0.48 -0.07 -0.10 0.00 -2.10 0.00 0.00 70.33 68.54 1s9g n THR 409 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1s9g s TRP 410 N -1.94 1.89 -0.23 4.78 -0.00 -1.26 -4.58 118.94 117.59 1s9g s TRP 410 Ca 0.16 -1.05 -0.03 0.00 -0.00 0.00 0.00 56.10 55.17 1s9g s TRP 410 Cb 0.08 -1.23 0.08 0.00 -0.00 0.00 0.00 33.47 32.39 1s9g s TRP 410 CO 0.12 -0.09 0.08 0.42 -0.00 0.00 0.00 176.95 177.48 1s9g s ILE 411 N -3.30 0.36 0.60 0.66 1.01 -1.26 -5.04 121.20 114.23 1s9g s ILE 411 Ca 0.33 -0.70 -0.10 0.00 0.00 0.00 0.00 60.65 60.18 1s9g s ILE 411 Cb 0.07 -1.07 0.15 0.00 0.01 0.00 0.00 42.46 41.63 1s9g s ILE 411 CO 0.15 -0.43 0.35 -0.81 0.00 0.00 0.00 174.94 174.20 1s9g n PRO 412 N 5.09 -2.98 -4.10 2.79 -0.04 -1.26 -4.94 135.00 129.57 1s9g n PRO 412 Ca -0.07 -0.58 -0.35 0.00 -0.04 0.00 0.00 63.50 62.46 1s9g n PRO 412 Cb 0.45 -0.78 -0.09 0.00 -0.04 0.00 0.00 33.50 33.04 1s9g n PRO 412 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1s9g s GLU 413 N -3.73 3.57 0.12 0.54 0.41 -1.24 -5.02 118.70 113.35 1s9g s GLU 413 Ca 0.27 -0.32 -0.07 0.00 -0.41 0.00 0.00 54.97 54.43 1s9g s GLU 413 Cb -0.05 -3.08 -0.01 0.00 -1.78 0.00 0.00 34.13 29.22 1s9g s GLU 413 CO 0.22 0.50 0.20 1.67 -0.49 0.00 0.00 175.26 177.37 1s9g s TRP 414 N -0.29 0.35 0.27 1.61 -2.14 -1.26 0.22 118.94 117.70 1s9g s TRP 414 Ca 0.08 -0.76 0.03 0.00 2.66 0.00 0.00 56.10 58.11 1s9g s TRP 414 Cb -0.12 -0.13 -0.03 0.00 -3.10 0.00 0.00 33.47 30.09 1s9g s TRP 414 CO 0.02 -0.60 0.22 -1.83 -2.66 0.00 0.00 176.95 172.10 1s9g s GLU 415 N -3.93 1.50 -0.16 3.25 -1.05 0.18 -4.90 118.70 113.59 1s9g s GLU 415 Ca 0.12 -1.82 0.00 0.00 -0.15 0.00 0.00 54.97 53.12 1s9g s GLU 415 Cb 0.05 0.31 0.03 0.00 -0.44 0.00 0.00 34.13 34.07 1s9g s GLU 415 CO -0.05 -0.54 -0.12 -0.06 0.95 0.00 0.00 175.26 175.44 1s9g s PHE 416 N -3.77 2.20 0.33 4.83 0.08 -1.26 -0.80 117.98 119.59 1s9g s PHE 416 Ca 0.39 -1.32 -0.12 0.00 0.12 0.00 0.00 56.93 56.01 1s9g s PHE 416 Cb 0.04 -1.58 -0.08 0.00 -0.57 0.00 0.00 43.02 40.84 1s9g s PHE 416 CO 0.20 -0.69 0.70 0.14 -0.10 0.00 0.00 175.22 175.47 1s9g s VAL 417 N 1.47 4.79 -0.14 -0.44 -7.23 -1.00 -4.94 120.40 112.90 1s9g s VAL 417 Ca 0.03 0.69 0.24 0.00 -1.81 0.00 0.00 61.98 61.12 1s9g s VAL 417 Cb -0.14 -3.66 0.47 0.00 0.56 0.00 0.00 36.38 33.61 1s9g s VAL 417 CO -0.10 -0.28 1.14 -0.46 -0.31 0.00 0.00 175.10 175.10 1s9g n ASN 418 N -0.66 1.40 -0.30 4.85 2.04 -1.26 -3.72 115.26 117.60 1s9g n ASN 418 Ca 0.02 -2.10 0.00 0.00 -0.44 0.00 0.00 54.58 52.06 1s9g n ASN 418 Cb 0.53 -0.39 0.00 0.00 -2.53 0.00 0.00 39.78 37.39 1s9g n ASN 418 CO 0.00 0.00 0.00 0.41 -0.44 0.00 0.00 177.26 177.23 1s9g n THR 419 N -0.11 0.00 -1.51 5.53 -1.04 -1.26 -5.10 114.28 110.79 1s9g n THR 419 Ca 0.08 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.72 1s9g n THR 419 Cb 0.96 0.23 -0.14 0.00 -1.82 0.00 0.00 70.33 69.57 1s9g n THR 419 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1s9g n PRO 420 N 0.00 0.19 -0.66 -2.82 -0.02 -1.26 -4.87 135.00 125.56 1s9g n PRO 420 Ca 0.00 -0.03 -0.30 0.00 -2.02 0.00 0.00 63.50 61.15 1s9g n PRO 420 Cb 0.54 -1.84 0.26 0.00 -0.02 0.00 0.00 33.50 32.44 1s9g n PRO 420 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1s9g s PRO 421 N 8.59 -1.78 0.00 0.52 0.04 -1.26 -4.70 135.00 136.41 1s9g s PRO 421 Ca 1.28 0.27 -0.00 0.00 0.04 0.00 0.00 61.00 62.58 1s9g s PRO 421 Cb -0.98 -1.50 -0.02 0.00 0.04 0.00 0.00 34.50 32.04 1s9g s PRO 421 CO 0.45 -4.15 0.80 1.28 0.04 0.00 0.00 177.00 175.42 1s9g n LEU 422 N -5.13 1.66 -0.07 -3.56 4.77 -1.26 -2.43 117.00 110.97 1s9g n LEU 422 Ca 0.10 -0.87 0.15 0.00 -0.03 0.00 0.00 56.01 55.35 1s9g n LEU 422 Cb 0.58 -0.37 0.71 0.00 -2.33 0.00 0.00 43.42 42.01 1s9g n LEU 422 CO 0.48 0.29 0.96 0.52 -1.33 0.00 0.00 177.39 178.31 1s9g n VAL 423 N 2.06 0.00 0.05 4.08 0.31 -1.26 -1.86 118.33 121.71 1s9g n VAL 423 Ca 0.03 -0.04 -0.11 0.00 -0.01 0.00 0.00 64.34 64.22 1s9g n VAL 423 Cb 0.18 -0.28 -0.13 0.00 -0.91 0.00 0.00 33.84 32.70 1s9g n VAL 423 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1s9g h LYS 424 N 0.34 0.09 0.50 5.55 3.64 -1.81 -3.28 116.57 121.60 1s9g h LYS 424 Ca 0.00 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.21 1s9g h LYS 424 Cb 0.28 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1s9g h LYS 424 CO 0.00 0.94 -0.24 -0.07 -2.27 0.00 0.00 179.45 177.81 1s9g h LEU 425 N 0.02 -0.57 -1.70 5.20 3.38 -1.65 -3.21 115.31 116.78 1s9g h LEU 425 Ca -0.14 0.02 0.35 0.00 0.09 0.00 0.00 57.88 58.21 1s9g h LEU 425 Cb 1.90 0.15 -0.08 0.00 0.09 0.00 0.00 40.66 42.72 1s9g h LEU 425 CO 0.13 -0.27 0.84 -0.25 0.09 0.00 0.00 178.44 178.99 1s9g h TRP 426 N -0.96 0.29 -0.02 1.13 2.91 -1.71 -3.52 115.95 114.07 1s9g h TRP 426 Ca -0.07 0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.96 1s9g h TRP 426 Cb 0.52 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.09 1s9g h TRP 426 CO 0.03 -0.02 0.00 0.66 -1.03 0.00 0.00 178.44 178.09