#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a9c n SER 2 N 0.00 0.00 -4.80 3.54 2.88 -1.26 -5.13 113.62 108.85 1a9c n SER 2 Ca 0.00 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.16 1a9c n SER 2 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 1a9c n SER 2 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1a9c s LEU 3 N -1.39 4.45 0.76 2.46 1.43 -1.26 -4.92 118.68 120.21 1a9c s LEU 3 Ca 0.00 1.51 -0.11 0.00 -1.03 0.00 0.00 54.13 54.50 1a9c s LEU 3 Cb 0.00 -3.45 0.05 0.00 0.03 0.00 0.00 46.19 42.81 1a9c s LEU 3 CO 0.00 0.11 1.08 -0.94 0.23 0.00 0.00 176.35 176.83 1a9c s SER 4 N -1.43 4.81 0.24 2.29 1.04 -1.26 -4.80 113.70 114.59 1a9c s SER 4 Ca 0.40 1.43 -0.06 0.00 0.48 0.00 0.00 55.95 58.20 1a9c s SER 4 Cb -0.19 -2.22 0.37 0.00 0.10 0.00 0.00 66.02 64.08 1a9c s SER 4 CO 0.23 -1.78 1.79 0.11 0.98 0.00 0.00 173.24 174.57 1a9c h LYS 5 N -0.95 0.65 0.25 4.02 1.57 -1.99 -0.88 116.57 119.23 1a9c h LYS 5 Ca -0.46 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.27 1a9c h LYS 5 Cb 1.25 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 1a9c h LYS 5 CO 0.58 0.43 -0.14 0.93 -0.57 0.00 0.00 179.45 180.68 1a9c h GLU 6 N 0.67 -0.35 -0.23 3.15 3.07 -1.97 0.43 114.58 119.34 1a9c h GLU 6 Ca 0.38 0.02 0.06 0.00 -0.50 0.00 0.00 59.36 59.32 1a9c h GLU 6 Cb 0.39 0.08 -0.07 0.00 -0.84 0.00 0.00 28.75 28.31 1a9c h GLU 6 CO -0.27 -0.23 -0.22 0.00 -1.40 0.00 0.00 179.01 176.89 1a9c h ALA 7 N 0.39 -0.10 -0.02 3.43 0.00 -1.74 0.28 119.26 121.50 1a9c h ALA 7 Ca -0.03 0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1a9c h ALA 7 Cb 0.29 0.46 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 1a9c h ALA 7 CO 0.04 -0.65 -0.25 0.00 0.00 0.00 0.00 179.25 178.39 1a9c h ALA 8 N 0.83 -0.33 -0.11 0.00 0.00 -0.95 -0.39 119.26 118.31 1a9c h ALA 8 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.09 1a9c h ALA 8 Cb 0.43 0.45 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1a9c h ALA 8 CO -0.36 -0.75 -0.26 -0.07 0.00 0.00 0.00 179.25 177.80 1a9c h LEU 9 N -0.38 -0.81 -0.17 0.00 3.38 -0.24 -0.57 115.31 116.53 1a9c h LEU 9 Ca 0.07 0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.18 1a9c h LEU 9 Cb 0.48 0.35 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1a9c h LEU 9 CO -0.24 -0.31 0.03 0.58 0.09 0.00 0.00 178.44 178.59 1a9c h VAL 10 N -0.34 0.92 -0.39 1.22 2.07 -0.75 -0.19 116.25 118.79 1a9c h VAL 10 Ca 0.10 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.64 1a9c h VAL 10 Cb 0.48 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 1a9c h VAL 10 CO -0.31 0.02 0.07 -0.74 0.02 0.00 0.00 177.57 176.63 1a9c h HIS 11 N 0.09 0.12 -0.17 1.57 -0.00 -0.71 -0.50 115.15 115.56 1a9c h HIS 11 Ca 0.08 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.47 1a9c h HIS 11 Cb 0.07 0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.48 1a9c h HIS 11 CO -0.14 0.01 0.10 0.93 -0.00 0.00 0.00 177.93 178.83 1a9c h GLU 12 N 0.20 0.22 -0.45 5.26 5.08 -0.77 -1.46 114.58 122.66 1a9c h GLU 12 Ca 0.19 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.61 1a9c h GLU 12 Cb 0.23 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.36 1a9c h GLU 12 CO -0.25 0.18 0.02 0.00 -1.00 0.00 0.00 179.01 177.96 1a9c h ALA 13 N 1.03 0.44 0.09 3.43 0.00 -0.43 0.19 119.26 124.01 1a9c h ALA 13 Ca 0.06 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1a9c h ALA 13 Cb 0.02 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1a9c h ALA 13 CO -0.01 -0.37 -0.04 -0.07 0.00 0.00 0.00 179.25 178.75 1a9c h LEU 14 N 0.14 -0.10 -0.62 0.00 3.38 -0.92 -1.68 115.31 115.51 1a9c h LEU 14 Ca 0.22 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.24 1a9c h LEU 14 Cb 0.32 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.04 1a9c h LEU 14 CO -0.35 -0.05 0.31 0.58 0.09 0.00 0.00 178.44 179.02 1a9c h VAL 15 N -0.15 0.92 -0.46 1.22 2.07 -0.62 0.16 116.25 119.40 1a9c h VAL 15 Ca -0.01 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.35 1a9c h VAL 15 Cb 0.11 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 1a9c h VAL 15 CO 0.02 0.11 0.21 0.00 0.02 0.00 0.00 177.57 177.93 1a9c h ALA 16 N 1.35 0.57 0.00 1.67 0.00 -0.38 -0.56 119.26 121.91 1a9c h ALA 16 Ca 0.29 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1a9c h ALA 16 Cb 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1a9c h ALA 16 CO -0.20 -0.15 0.00 0.54 0.00 0.00 0.00 179.25 179.43 1a9c n ARG 17 N -4.93 0.05 -1.96 0.00 3.00 -0.65 -4.90 116.66 107.26 1a9c n ARG 17 Ca 0.03 0.07 -0.03 0.00 -0.01 0.00 0.00 57.85 57.91 1a9c n ARG 17 Cb 0.13 -1.56 -0.00 0.00 0.00 0.00 0.00 32.46 31.03 1a9c n ARG 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1a9c n GLY 18 N 1.27 0.27 1.01 -0.13 0.00 0.35 -4.95 105.19 103.01 1a9c n GLY 18 Ca 0.06 -0.77 0.08 0.00 0.00 0.00 0.00 46.02 45.40 1a9c n GLY 18 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1a9c n LEU 19 N -0.47 3.54 -4.82 0.99 4.77 0.06 -4.99 117.00 116.08 1a9c n LEU 19 Ca -0.04 -2.11 -0.32 0.00 -0.03 0.00 0.00 56.01 53.51 1a9c n LEU 19 Cb 0.49 -0.38 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 1a9c n LEU 19 CO 0.05 0.83 0.70 -1.61 -1.33 0.00 0.00 177.39 176.03 1a9c s GLU 20 N -1.20 3.60 0.24 3.23 0.41 -1.24 -4.78 118.70 118.96 1a9c s GLU 20 Ca 0.36 1.10 -0.30 0.00 -0.41 0.00 0.00 54.97 55.72 1a9c s GLU 20 Cb 0.20 -2.08 -0.09 0.00 -1.78 0.00 0.00 34.13 30.38 1a9c s GLU 20 CO 0.22 -0.57 1.30 0.99 -0.49 0.00 0.00 175.26 176.71 1a9c s THR 21 N -2.52 3.08 -0.62 3.63 2.01 -1.26 -4.86 115.64 115.10 1a9c s THR 21 Ca 0.62 0.95 -0.28 0.00 0.31 0.00 0.00 61.69 63.29 1a9c s THR 21 Cb -0.13 -3.61 -0.11 0.00 0.01 0.00 0.00 72.50 68.66 1a9c s THR 21 CO 0.34 0.17 2.49 -2.65 -0.69 0.00 0.00 174.62 174.28 1a9c n PRO 22 N 2.04 0.78 -4.66 4.92 -0.02 -1.26 -4.92 135.00 131.88 1a9c n PRO 22 Ca 0.04 0.01 -0.23 0.00 -2.02 0.00 0.00 63.50 61.30 1a9c n PRO 22 Cb 0.43 -2.91 -0.15 0.00 -0.02 0.00 0.00 33.50 30.85 1a9c n PRO 22 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1a9c s LEU 23 N 11.23 2.09 -0.08 2.45 1.43 -1.26 -5.13 118.68 129.40 1a9c s LEU 23 Ca 1.09 -0.37 -0.04 0.00 -1.03 0.00 0.00 54.13 53.77 1a9c s LEU 23 Cb -0.48 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.88 1a9c s LEU 23 CO 0.33 0.16 0.10 -0.13 0.23 0.00 0.00 176.35 177.03 1a9c s ARG 24 N -0.70 3.25 0.59 1.70 0.52 -1.26 -5.07 118.95 117.99 1a9c s ARG 24 Ca 0.06 -0.28 -0.20 0.00 -0.52 0.00 0.00 55.73 54.79 1a9c s ARG 24 Cb -0.07 -3.02 -0.04 0.00 0.52 0.00 0.00 34.95 32.34 1a9c s ARG 24 CO 0.00 0.73 1.20 -0.35 0.02 0.00 0.00 175.30 176.90 1a9c n PRO 25 N 1.83 1.23 -1.53 3.54 -0.04 -1.26 -4.72 135.00 134.05 1a9c n PRO 25 Ca -0.18 0.47 -0.25 0.00 -0.04 0.00 0.00 63.50 63.50 1a9c n PRO 25 Cb 0.54 -2.41 -0.13 0.00 -0.04 0.00 0.00 33.50 31.46 1a9c n PRO 25 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1a9c n PRO 26 N -1.26 0.35 -0.20 0.54 -0.04 -1.26 -4.77 135.00 128.36 1a9c n PRO 26 Ca 0.13 -0.27 0.13 0.00 -0.04 0.00 0.00 63.50 63.45 1a9c n PRO 26 Cb 0.46 -2.36 0.24 0.00 -0.04 0.00 0.00 33.50 31.81 1a9c n PRO 26 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1a9c n VAL 27 N 7.33 -0.25 -3.67 0.52 0.31 -1.26 -4.49 118.33 116.82 1a9c n VAL 27 Ca 0.56 1.28 -0.13 0.00 -0.01 0.00 0.00 64.34 66.04 1a9c n VAL 27 Cb 0.28 -1.95 -0.07 0.00 -0.91 0.00 0.00 33.84 31.19 1a9c n VAL 27 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1a9c s HIS 28 N -5.26 -0.28 -1.07 3.52 3.76 -1.26 -5.07 115.29 109.63 1a9c s HIS 28 Ca -0.07 0.30 -0.24 0.00 -0.15 0.00 0.00 55.06 54.90 1a9c s HIS 28 Cb 0.19 0.21 -0.09 0.00 1.11 0.00 0.00 32.58 34.00 1a9c s HIS 28 CO 0.47 -0.54 1.98 -1.21 -0.85 0.00 0.00 174.74 174.59 1a9c s GLU 29 N -2.18 2.34 -0.08 1.40 2.02 -1.26 -4.91 118.70 116.03 1a9c s GLU 29 Ca -0.07 -0.75 -0.03 0.00 0.02 0.00 0.00 54.97 54.13 1a9c s GLU 29 Cb -0.01 -5.14 -0.04 0.00 0.10 0.00 0.00 34.13 29.04 1a9c s GLU 29 CO -0.00 -3.98 0.07 -1.64 0.02 0.00 0.00 175.26 169.73 1a9c s MET 30 N 6.94 3.18 0.52 1.61 -1.94 -1.26 -5.10 119.30 123.26 1a9c s MET 30 Ca 0.71 -0.32 -0.18 0.00 -1.71 0.00 0.00 55.69 54.19 1a9c s MET 30 Cb -0.04 -2.96 -0.07 0.00 2.01 0.00 0.00 34.83 33.78 1a9c s MET 30 CO 0.09 0.72 1.02 -0.51 -0.01 0.00 0.00 175.02 176.34 1a9c s ASP 31 N -1.14 6.28 0.50 3.03 1.11 -1.26 -4.88 116.67 120.30 1a9c s ASP 31 Ca 0.16 1.79 0.21 0.00 0.18 0.00 0.00 52.55 54.89 1a9c s ASP 31 Cb -0.12 -2.54 1.32 0.00 1.07 0.00 0.00 42.92 42.66 1a9c s ASP 31 CO 0.06 -0.82 2.08 0.78 1.18 0.00 0.00 175.17 178.45 1a9c h ASN 32 N 1.07 0.00 -0.35 0.27 4.21 -1.99 -0.71 115.58 118.09 1a9c h ASN 32 Ca -0.48 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.03 1a9c h ASN 32 Cb 1.21 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.39 1a9c h ASN 32 CO 0.59 0.11 0.21 -0.33 -1.29 0.00 0.00 177.43 176.72 1a9c h GLU 33 N 0.00 0.48 -0.11 0.81 5.08 -1.99 0.14 114.58 118.98 1a9c h GLU 33 Ca -0.00 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.14 1a9c h GLU 33 Cb 0.23 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1a9c h GLU 33 CO 0.01 0.37 -0.65 1.79 -1.00 0.00 0.00 179.01 179.53 1a9c h THR 34 N 0.45 1.36 -0.45 1.13 1.35 -1.60 -1.83 112.91 113.32 1a9c h THR 34 Ca 0.12 -2.00 -0.01 0.00 -0.55 0.00 0.00 66.41 63.97 1a9c h THR 34 Cb 0.01 1.98 -0.02 0.00 -1.73 0.00 0.00 68.15 68.40 1a9c h THR 34 CO -0.02 0.60 0.22 0.03 -0.25 0.00 0.00 175.52 176.11 1a9c h ARG 35 N 0.31 0.64 -0.12 4.72 3.08 -0.82 -1.27 114.38 120.92 1a9c h ARG 35 Ca -0.01 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 1a9c h ARG 35 Cb 1.20 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 1a9c h ARG 35 CO 0.11 0.54 0.07 0.87 -1.07 0.00 0.00 179.97 180.49 1a9c h LYS 36 N 0.59 0.18 -0.73 0.04 1.57 -0.65 0.89 116.57 118.45 1a9c h LYS 36 Ca 0.16 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1a9c h LYS 36 Cb 0.10 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 1a9c h LYS 36 CO -0.02 0.21 0.47 0.66 -0.57 0.00 0.00 179.45 180.20 1a9c h SER 37 N 0.09 0.85 -0.27 0.86 4.64 -1.17 0.15 113.55 118.70 1a9c h SER 37 Ca 0.04 -0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.27 1a9c h SER 37 Cb 0.09 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 1a9c h SER 37 CO -0.01 0.63 -0.05 -0.07 -0.87 0.00 0.00 176.83 176.46 1a9c h LEU 38 N 1.00 0.52 -0.49 5.97 3.38 -0.83 -0.64 115.31 124.21 1a9c h LEU 38 Ca 0.27 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1a9c h LEU 38 Cb -0.09 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1a9c h LEU 38 CO -0.05 0.75 0.32 0.40 0.09 0.00 0.00 178.44 179.95 1a9c h ILE 39 N 0.28 1.13 -0.67 1.22 2.04 -0.26 -1.47 117.51 119.78 1a9c h ILE 39 Ca 0.07 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 1a9c h ILE 39 Cb 0.52 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 1a9c h ILE 39 CO 0.02 0.13 0.41 0.00 0.00 0.00 0.00 178.15 178.71 1a9c h ALA 40 N 1.17 1.46 -0.33 1.87 0.00 -0.58 -0.58 119.26 122.26 1a9c h ALA 40 Ca 0.18 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1a9c h ALA 40 Cb -0.06 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1a9c h ALA 40 CO -0.04 0.48 0.20 0.78 0.00 0.00 0.00 179.25 180.67 1a9c h GLY 41 N 0.95 0.48 1.02 0.00 0.00 -0.11 0.66 103.07 106.06 1a9c h GLY 41 Ca 0.24 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 1a9c h GLY 41 CO -0.05 0.19 0.20 0.45 0.00 0.00 0.00 176.54 177.34 1a9c h HIS 42 N 0.43 1.02 -0.66 5.60 -0.00 -0.67 -2.03 115.15 118.83 1a9c h HIS 42 Ca 0.12 -0.10 -0.00 0.00 -0.00 0.00 0.00 60.37 60.38 1a9c h HIS 42 Cb 0.01 -0.29 -0.03 0.00 -0.00 0.00 0.00 27.41 27.09 1a9c h HIS 42 CO -0.04 0.83 0.39 0.52 -0.00 0.00 0.00 177.93 179.63 1a9c h MET 43 N 0.91 0.89 -0.43 2.45 2.86 -0.70 0.31 114.93 121.22 1a9c h MET 43 Ca 0.21 -0.08 0.07 0.00 -2.06 0.00 0.00 59.70 57.84 1a9c h MET 43 Cb 0.28 -0.19 -0.06 0.00 0.06 0.00 0.00 31.60 31.69 1a9c h MET 43 CO -0.01 0.64 0.04 1.15 1.06 0.00 0.00 176.91 179.80 1a9c h THR 44 N 0.89 0.72 0.00 2.22 2.02 -0.51 0.20 112.91 118.45 1a9c h THR 44 Ca 0.23 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 67.37 1a9c h THR 44 Cb -0.02 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1a9c h THR 44 CO -0.04 0.03 -0.07 -0.33 0.37 0.00 0.00 175.52 175.48 1a9c h GLU 45 N 0.16 -0.12 -0.36 6.66 4.39 -0.63 -0.49 114.58 124.19 1a9c h GLU 45 Ca 0.21 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.96 1a9c h GLU 45 Cb 0.29 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.93 1a9c h GLU 45 CO -0.32 -0.08 0.14 0.82 -1.16 0.00 0.00 179.01 178.42 1a9c h ILE 46 N -0.12 0.92 -0.81 3.13 2.04 -0.18 0.08 117.51 122.58 1a9c h ILE 46 Ca 0.03 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 1a9c h ILE 46 Cb 0.16 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 1a9c h ILE 46 CO -0.07 0.06 0.50 0.24 0.00 0.00 0.00 178.15 178.87 1a9c h MET 47 N 0.31 1.09 -0.26 2.37 2.86 -0.37 -1.17 114.93 119.75 1a9c h MET 47 Ca 0.16 -0.09 -0.10 0.00 -2.06 0.00 0.00 59.70 57.62 1a9c h MET 47 Cb 0.11 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.53 1a9c h MET 47 CO -0.15 0.75 -0.25 1.96 1.06 0.00 0.00 176.91 180.29 1a9c h GLN 48 N 1.11 0.50 0.00 1.72 4.20 -0.24 -1.89 115.11 120.51 1a9c h GLN 48 Ca 0.29 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 1a9c h GLN 48 Cb -0.07 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1a9c h GLN 48 CO -0.06 0.71 -0.21 -0.07 -0.67 0.00 0.00 178.83 178.53 1a9c h LEU 49 N 0.44 0.00 -0.71 1.46 3.38 0.14 -1.50 115.31 118.52 1a9c h LEU 49 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1a9c h LEU 49 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1a9c h LEU 49 CO 0.05 0.21 0.00 0.18 0.09 0.00 0.00 178.44 178.96 1a9c n LEU 50 N -3.63 1.09 -0.77 1.67 4.77 -0.64 -4.92 117.00 114.58 1a9c n LEU 50 Ca -0.01 -0.39 -0.09 0.00 -0.03 0.00 0.00 56.01 55.49 1a9c n LEU 50 Cb 0.34 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.38 1a9c n LEU 50 CO 0.33 0.19 -0.09 0.59 -1.33 0.00 0.00 177.39 177.08 1a9c n ASN 51 N -0.13 -3.81 -4.74 -1.43 3.02 -0.57 -5.01 115.26 102.60 1a9c n ASN 51 Ca 0.19 0.16 -0.41 0.00 -0.03 0.00 0.00 54.58 54.50 1a9c n ASN 51 Cb 0.28 -2.36 -0.04 0.00 -0.61 0.00 0.00 39.78 37.04 1a9c n ASN 51 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1a9c s LEU 52 N -2.16 4.52 -1.10 3.41 1.43 -0.81 -4.94 118.68 119.02 1a9c s LEU 52 Ca 0.00 2.07 -0.21 0.00 -1.03 0.00 0.00 54.13 54.95 1a9c s LEU 52 Cb 0.00 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.67 1a9c s LEU 52 CO 0.00 -0.15 1.52 -0.62 0.23 0.00 0.00 176.35 177.34 1a9c s ASP 53 N -0.33 6.61 0.00 2.29 2.15 -1.26 -4.61 116.67 121.51 1a9c s ASP 53 Ca 0.47 -1.76 0.02 0.00 0.43 0.00 0.00 52.55 51.71 1a9c s ASP 53 Cb -0.29 -2.57 0.10 0.00 -0.30 0.00 0.00 42.92 39.86 1a9c s ASP 53 CO 0.35 -1.40 0.85 0.18 -0.17 0.00 0.00 175.17 174.99 1a9c n LEU 54 N 8.66 0.00 0.03 -1.34 4.77 -1.26 -1.30 117.00 126.56 1a9c n LEU 54 Ca 0.37 0.27 0.13 0.00 -0.03 0.00 0.00 56.01 56.76 1a9c n LEU 54 Cb 0.49 -0.27 0.44 0.00 -2.33 0.00 0.00 43.42 41.75 1a9c n LEU 54 CO 0.69 -0.26 0.75 0.00 -1.33 0.00 0.00 177.39 177.24 1a9c n ALA 55 N -1.27 2.69 -2.06 -1.18 0.00 -1.26 -3.37 120.51 114.06 1a9c n ALA 55 Ca 0.01 -0.17 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 1a9c n ALA 55 Cb 0.01 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.09 1a9c n ALA 55 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1a9c s ASP 56 N -3.41 6.71 0.35 0.00 2.15 -0.42 -4.86 116.67 117.20 1a9c s ASP 56 Ca 0.12 2.40 0.15 0.00 0.43 0.00 0.00 52.55 55.65 1a9c s ASP 56 Cb 0.17 -2.58 1.16 0.00 -0.30 0.00 0.00 42.92 41.37 1a9c s ASP 56 CO 0.61 -0.77 1.58 -2.24 -0.17 0.00 0.00 175.17 174.18 1a9c h ASP 57 N 7.40 0.09 0.21 -0.34 2.03 -1.90 0.41 116.42 124.32 1a9c h ASP 57 Ca -0.42 0.26 -0.01 0.00 -0.73 0.00 0.00 57.03 56.14 1a9c h ASP 57 Cb 1.20 0.33 0.00 0.00 -0.83 0.00 0.00 39.33 40.03 1a9c h ASP 57 CO 0.90 -0.40 -0.10 -1.28 -1.03 0.00 0.00 179.24 177.33 1a9c h SER 58 N 0.02 -0.23 -0.70 4.15 0.87 -1.95 -3.35 113.55 112.35 1a9c h SER 58 Ca 0.77 0.01 0.17 0.00 -1.23 0.00 0.00 61.79 61.51 1a9c h SER 58 Cb 1.92 0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 63.90 1a9c h SER 58 CO -0.81 0.07 0.48 -0.07 -0.53 0.00 0.00 176.83 175.97 1a9c h LEU 59 N -0.74 0.18 -0.95 2.23 3.38 -1.72 -3.13 115.31 114.56 1a9c h LEU 59 Ca -0.03 0.01 0.28 0.00 0.09 0.00 0.00 57.88 58.24 1a9c h LEU 59 Cb 0.21 -0.02 -0.15 0.00 0.09 0.00 0.00 40.66 40.79 1a9c h LEU 59 CO 0.05 0.09 0.41 -0.03 0.09 0.00 0.00 178.44 179.05 1a9c h MET 60 N 0.19 0.25 -0.29 1.13 4.05 -0.94 -1.58 114.93 117.74 1a9c h MET 60 Ca 0.34 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.75 1a9c h MET 60 Cb 1.07 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.81 1a9c h MET 60 CO -0.06 0.17 0.00 0.39 0.23 0.00 0.00 176.91 177.64 1a9c n GLU 61 N -5.14 2.38 -0.25 0.39 1.02 -1.18 -4.50 120.64 113.35 1a9c n GLU 61 Ca 0.27 -2.07 -0.04 0.00 -0.02 0.00 0.00 57.16 55.31 1a9c n GLU 61 Cb 0.85 -1.49 0.07 0.00 -0.02 0.00 0.00 31.44 30.85 1a9c n GLU 61 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1a9c h THR 62 N 4.24 1.11 -0.90 2.62 2.02 -1.45 -0.80 112.91 119.75 1a9c h THR 62 Ca 0.00 -0.30 0.07 0.00 0.77 0.00 0.00 66.41 66.95 1a9c h THR 62 Cb 0.93 0.16 -0.07 0.00 -1.74 0.00 0.00 68.15 67.43 1a9c h THR 62 CO 0.00 0.16 0.56 -0.65 0.37 0.00 0.00 175.52 175.96 1a9c h PRO 63 N 0.87 0.98 0.13 6.66 0.11 -1.79 0.11 132.00 139.07 1a9c h PRO 63 Ca 0.28 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.32 1a9c h PRO 63 Cb 0.00 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 30.89 1a9c h PRO 63 CO -0.10 0.65 -0.06 0.45 -0.21 0.00 0.00 178.00 178.72 1a9c h HIS 64 N 1.00 -0.17 -0.54 0.65 3.86 -1.71 -1.29 115.15 116.96 1a9c h HIS 64 Ca 0.40 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.68 1a9c h HIS 64 Cb 0.21 0.06 -0.06 0.00 1.06 0.00 0.00 27.41 28.68 1a9c h HIS 64 CO -0.03 0.06 0.20 0.00 0.86 0.00 0.00 177.93 179.03 1a9c h ARG 65 N -0.38 0.37 -0.52 2.45 3.08 -0.55 -1.20 114.38 117.64 1a9c h ARG 65 Ca -0.02 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1a9c h ARG 65 Cb 0.30 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1a9c h ARG 65 CO 0.03 0.25 0.15 0.82 -1.07 0.00 0.00 179.97 180.15 1a9c h ILE 66 N 0.39 1.23 -0.16 2.04 2.04 -0.74 0.08 117.51 122.39 1a9c h ILE 66 Ca 0.26 -0.80 0.01 0.00 1.00 0.00 0.00 64.86 65.33 1a9c h ILE 66 Cb 0.29 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1a9c h ILE 66 CO -0.26 0.29 0.09 0.00 0.00 0.00 0.00 178.15 178.28 1a9c h ALA 67 N 1.02 0.20 -0.43 1.87 0.00 -0.67 -0.82 119.26 120.42 1a9c h ALA 67 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1a9c h ALA 67 Cb 0.29 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1a9c h ALA 67 CO -0.00 -0.33 0.28 -0.22 0.00 0.00 0.00 179.25 178.98 1a9c h LYS 68 N 0.20 0.57 -0.00 0.00 3.64 -1.08 -1.98 116.57 117.91 1a9c h LYS 68 Ca 0.06 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1a9c h LYS 68 Cb -0.01 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 1a9c h LYS 68 CO -0.03 0.38 -0.11 1.98 -2.27 0.00 0.00 179.45 179.41 1a9c h MET 69 N 0.58 -0.17 0.45 1.90 4.05 -0.65 0.23 114.93 121.31 1a9c h MET 69 Ca 0.16 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.57 1a9c h MET 69 Cb -0.06 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.77 1a9c h MET 69 CO -0.03 -0.12 -0.30 1.88 0.23 0.00 0.00 176.91 178.57 1a9c h TYR 70 N -0.18 -0.79 0.35 1.39 -1.99 -0.98 0.51 116.97 115.28 1a9c h TYR 70 Ca 0.04 -0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 1a9c h TYR 70 Cb 0.23 0.29 0.00 0.00 2.00 0.00 0.00 36.73 39.25 1a9c h TYR 70 CO -0.17 -0.45 -0.17 0.28 -0.00 0.00 0.00 178.16 177.65 1a9c h VAL 71 N -0.72 0.62 0.17 -2.88 2.07 -1.31 -2.05 116.25 112.15 1a9c h VAL 71 Ca -0.05 -0.56 -0.33 0.00 0.82 0.00 0.00 66.70 66.58 1a9c h VAL 71 Cb 0.60 0.88 0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1a9c h VAL 71 CO 0.03 0.10 -1.62 0.44 0.02 0.00 0.00 177.57 176.54 1a9c h ASP 72 N -0.80 0.58 0.00 0.57 3.32 -0.65 -3.34 116.42 116.10 1a9c h ASP 72 Ca -0.05 -0.78 0.00 0.00 0.02 0.00 0.00 57.03 56.22 1a9c h ASP 72 Cb 0.52 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1a9c h ASP 72 CO 0.08 1.65 0.00 -0.62 -1.72 0.00 0.00 179.24 178.63 1a9c n GLU 73 N -3.56 0.00 0.28 3.56 1.02 -0.06 -4.45 120.64 117.42 1a9c n GLU 73 Ca -0.20 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.09 1a9c n GLU 73 Cb 1.07 0.00 0.73 0.00 -0.02 0.00 0.00 31.44 33.22 1a9c n GLU 73 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1a9c h ILE 74 N 0.00 0.07 -0.02 -3.67 3.07 -1.19 -1.40 117.51 114.38 1a9c h ILE 74 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 1a9c h ILE 74 Cb 0.00 0.59 0.00 0.00 -0.27 0.00 0.00 36.82 37.14 1a9c h ILE 74 CO 0.00 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.59 1a9c n PHE 75 N -3.03 0.04 0.33 0.16 3.72 -0.77 -2.81 117.46 115.11 1a9c n PHE 75 Ca 0.01 -0.73 0.22 0.00 -0.05 0.00 0.00 57.45 56.90 1a9c n PHE 75 Cb 0.51 -0.10 1.17 0.00 -0.94 0.00 0.00 39.48 40.11 1a9c n PHE 75 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1a9c h SER 76 N 0.12 0.00 0.46 4.37 4.64 -1.24 -1.76 113.55 120.14 1a9c h SER 76 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1a9c h SER 76 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1a9c h SER 76 CO 0.01 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1a9c n GLY 77 N -1.07 -1.08 0.16 -0.77 0.00 0.51 -2.08 105.19 100.86 1a9c n GLY 77 Ca -0.03 0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.22 1a9c n GLY 77 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1a9c h LEU 78 N 0.00 0.00 -8.30 0.99 3.38 -1.42 -3.41 115.31 106.54 1a9c h LEU 78 Ca 0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 1a9c h LEU 78 Cb 0.23 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.71 1a9c h LEU 78 CO 0.00 0.00 -0.58 -0.62 0.09 0.00 0.00 178.44 177.33 1a9c s ASP 79 N -4.85 5.42 0.00 -0.43 -1.08 -0.88 -4.95 116.67 109.90 1a9c s ASP 79 Ca 0.06 -0.99 0.05 0.00 -0.52 0.00 0.00 52.55 51.16 1a9c s ASP 79 Cb 0.10 -1.93 0.29 0.00 -1.46 0.00 0.00 42.92 39.92 1a9c s ASP 79 CO 0.53 -0.31 0.91 -1.22 0.52 0.00 0.00 175.17 175.59 1a9c n TYR 80 N 4.89 0.00 0.30 -5.34 4.02 -1.26 -0.33 117.16 119.43 1a9c n TYR 80 Ca -0.13 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 57.91 1a9c n TYR 80 Cb 0.46 -0.16 0.48 0.00 -0.02 0.00 0.00 39.34 40.10 1a9c n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1a9c h ALA 81 N 2.29 1.00 -0.39 -0.72 0.00 -1.91 -2.30 119.26 117.23 1a9c h ALA 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1a9c h ALA 81 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1a9c h ALA 81 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 1a9c n ASN 82 N -2.94 2.68 -4.77 0.00 3.02 0.55 -4.95 115.26 108.84 1a9c n ASN 82 Ca 0.02 -1.92 -0.40 0.00 -0.03 0.00 0.00 54.58 52.25 1a9c n ASN 82 Cb 0.38 -0.25 -0.00 0.00 -0.61 0.00 0.00 39.78 39.29 1a9c n ASN 82 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1a9c s PHE 83 N -1.49 2.75 0.72 3.10 5.36 -0.87 -4.96 117.98 122.59 1a9c s PHE 83 Ca 0.35 1.33 -0.13 0.00 -0.96 0.00 0.00 56.93 57.52 1a9c s PHE 83 Cb 0.19 -3.80 0.03 0.00 -0.34 0.00 0.00 43.02 39.11 1a9c s PHE 83 CO 0.27 -2.40 1.11 -1.25 -1.46 0.00 0.00 175.22 171.48 1a9c s PRO 84 N -2.15 2.47 -0.18 10.12 0.04 -1.26 -4.98 135.00 139.06 1a9c s PRO 84 Ca 0.55 1.31 -0.29 0.00 0.04 0.00 0.00 61.00 62.61 1a9c s PRO 84 Cb -0.41 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.21 1a9c s PRO 84 CO 0.54 -1.50 1.03 0.15 0.04 0.00 0.00 177.00 177.27 1a9c s LYS 85 N -4.46 4.32 -0.05 4.56 1.02 -1.26 -4.92 119.74 118.95 1a9c s LYS 85 Ca 0.65 1.38 -0.12 0.00 0.02 0.00 0.00 55.97 57.90 1a9c s LYS 85 Cb -0.19 -3.61 -0.05 0.00 -0.52 0.00 0.00 37.83 33.46 1a9c s LYS 85 CO 0.49 -0.52 0.30 0.42 -0.92 0.00 0.00 175.35 175.12 1a9c s ILE 86 N 2.77 5.22 -0.05 2.17 1.09 -1.26 -4.96 121.20 126.18 1a9c s ILE 86 Ca 0.46 0.59 0.02 0.00 -1.10 0.00 0.00 60.65 60.62 1a9c s ILE 86 Cb -0.16 -3.59 0.01 0.00 -1.06 0.00 0.00 42.46 37.66 1a9c s ILE 86 CO 0.11 0.58 -0.09 0.42 -0.10 0.00 0.00 174.94 175.86 1a9c s THR 87 N -0.97 0.88 0.02 2.92 -4.23 -1.26 -5.10 115.64 107.90 1a9c s THR 87 Ca 0.20 -0.34 0.06 0.00 -1.18 0.00 0.00 61.69 60.43 1a9c s THR 87 Cb -0.15 -0.83 -0.02 0.00 1.34 0.00 0.00 72.50 72.85 1a9c s THR 87 CO 0.09 0.29 -0.19 -0.76 -0.54 0.00 0.00 174.62 173.51 1a9c s LEU 88 N 0.66 2.11 -0.01 4.79 1.43 -1.26 -1.87 118.68 124.53 1a9c s LEU 88 Ca -0.12 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 52.58 1a9c s LEU 88 Cb -0.14 -0.95 -0.03 0.00 0.03 0.00 0.00 46.19 45.10 1a9c s LEU 88 CO 0.02 0.18 -0.10 0.27 0.23 0.00 0.00 176.35 176.95 1a9c s ILE 89 N -0.65 3.41 0.22 -0.59 -4.36 0.22 -4.94 121.20 114.51 1a9c s ILE 89 Ca 0.07 -0.79 -0.31 0.00 -0.26 0.00 0.00 60.65 59.35 1a9c s ILE 89 Cb -0.08 -2.44 -0.11 0.00 1.25 0.00 0.00 42.46 41.07 1a9c s ILE 89 CO 0.01 0.45 1.66 -0.70 0.24 0.00 0.00 174.94 176.60 1a9c s GLU 90 N -1.22 4.14 -1.02 0.37 2.12 -1.26 -0.54 118.70 121.29 1a9c s GLU 90 Ca 0.15 2.55 -0.16 0.00 0.36 0.00 0.00 54.97 57.87 1a9c s GLU 90 Cb -0.11 -3.08 -0.09 0.00 0.26 0.00 0.00 34.13 31.12 1a9c s GLU 90 CO 0.05 -0.70 2.10 -1.71 -0.54 0.00 0.00 175.26 174.47 1a9c n ASN 91 N 3.56 3.69 0.10 -1.70 5.15 -0.76 -4.51 115.26 120.79 1a9c n ASN 91 Ca 0.14 -2.64 -0.03 0.00 -0.60 0.00 0.00 54.58 51.44 1a9c n ASN 91 Cb 0.36 -1.27 0.01 0.00 -0.53 0.00 0.00 39.78 38.35 1a9c n ASN 91 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1a9c h LYS 92 N 6.96 0.00 0.00 1.20 1.57 -1.89 -3.04 116.57 121.38 1a9c h LYS 92 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1a9c h LYS 92 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1a9c h LYS 92 CO 1.84 0.78 0.00 -1.33 -0.57 0.00 0.00 179.45 180.17 1a9c n MET 93 N -3.44 0.00 -3.66 3.15 2.81 -1.26 -4.85 117.12 109.87 1a9c n MET 93 Ca 0.00 0.38 -0.22 0.00 -1.81 0.00 0.00 57.70 56.05 1a9c n MET 93 Cb 0.80 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 31.86 1a9c n MET 93 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1a9c n LYS 94 N -1.50 -5.92 -2.26 0.03 5.02 -1.15 -4.91 118.16 107.48 1a9c n LYS 94 Ca 0.02 0.70 -0.42 0.00 -2.02 0.00 0.00 58.31 56.59 1a9c n LYS 94 Cb 0.08 -5.51 -0.03 0.00 -0.02 0.00 0.00 35.03 29.55 1a9c n LYS 94 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1a9c s VAL 95 N -3.47 3.80 -0.02 -0.18 1.01 -1.26 -4.87 120.40 115.40 1a9c s VAL 95 Ca 0.21 1.17 0.03 0.00 0.00 0.00 0.00 61.98 63.40 1a9c s VAL 95 Cb -0.10 -3.75 0.05 0.00 0.00 0.00 0.00 36.38 32.57 1a9c s VAL 95 CO 0.78 -0.00 0.92 -0.90 0.00 0.00 0.00 175.10 175.90 1a9c n ASP 96 N 5.32 1.50 -4.46 3.32 5.68 -1.26 -4.49 116.55 122.15 1a9c n ASP 96 Ca 0.13 -1.96 -0.26 0.00 -0.50 0.00 0.00 54.79 52.19 1a9c n ASP 96 Cb 0.44 -0.08 -0.11 0.00 -1.14 0.00 0.00 41.12 40.23 1a9c n ASP 96 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1a9c s GLU 97 N -1.03 1.66 0.52 0.11 0.41 -1.26 -4.93 118.70 114.19 1a9c s GLU 97 Ca 0.05 -1.53 -0.21 0.00 -0.41 0.00 0.00 54.97 52.87 1a9c s GLU 97 Cb 0.05 -1.89 -0.06 0.00 -1.78 0.00 0.00 34.13 30.45 1a9c s GLU 97 CO 0.00 0.39 1.22 0.00 -0.49 0.00 0.00 175.26 176.39 1a9c s MET 98 N -2.89 3.36 -0.15 1.61 0.23 -1.26 -4.37 119.30 115.83 1a9c s MET 98 Ca 0.23 1.90 -0.02 0.00 -1.03 0.00 0.00 55.69 56.77 1a9c s MET 98 Cb -0.07 -2.21 -0.02 0.00 -1.53 0.00 0.00 34.83 30.99 1a9c s MET 98 CO 0.12 -0.91 -0.07 0.08 -2.03 0.00 0.00 175.02 172.21 1a9c s VAL 99 N -1.51 3.55 -0.11 5.16 1.01 0.20 -4.93 120.40 123.77 1a9c s VAL 99 Ca 0.70 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 62.23 1a9c s VAL 99 Cb -0.32 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.53 1a9c s VAL 99 CO 0.37 0.50 -0.21 -0.89 0.00 0.00 0.00 175.10 174.87 1a9c s THR 100 N 0.45 1.88 -0.28 3.92 2.01 -1.26 -1.76 115.64 120.60 1a9c s THR 100 Ca -0.06 -0.89 -0.05 0.00 0.31 0.00 0.00 61.69 61.00 1a9c s THR 100 Cb -0.15 -1.65 0.02 0.00 0.01 0.00 0.00 72.50 70.73 1a9c s THR 100 CO 0.04 0.52 0.03 -0.69 -0.69 0.00 0.00 174.62 173.82 1a9c s VAL 101 N 0.60 3.52 0.19 3.82 1.01 0.27 -5.00 120.40 124.81 1a9c s VAL 101 Ca -0.13 -0.86 0.08 0.00 0.00 0.00 0.00 61.98 61.06 1a9c s VAL 101 Cb -0.17 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 1a9c s VAL 101 CO 0.04 0.10 -0.03 0.00 0.00 0.00 0.00 175.10 175.21 1a9c s ARG 102 N 1.42 2.26 -1.30 2.72 1.70 -1.26 -1.22 118.95 123.27 1a9c s ARG 102 Ca 0.01 -1.22 -0.05 0.00 -0.47 0.00 0.00 55.73 54.00 1a9c s ARG 102 Cb -0.17 -2.25 0.01 0.00 -0.57 0.00 0.00 34.95 31.97 1a9c s ARG 102 CO -0.00 0.43 1.08 -0.25 -1.08 0.00 0.00 175.30 175.48 1a9c n ASP 103 N -0.21 -4.32 -4.68 -2.89 8.00 -1.14 -4.95 116.55 106.36 1a9c n ASP 103 Ca -0.09 -0.60 -0.42 0.00 0.71 0.00 0.00 54.79 54.38 1a9c n ASP 103 Cb 0.56 -4.98 -0.03 0.00 -0.02 0.00 0.00 41.12 36.66 1a9c n ASP 103 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1a9c s ILE 104 N -3.35 4.05 0.18 0.53 1.01 0.55 -4.82 121.20 119.35 1a9c s ILE 104 Ca 0.33 1.35 -0.32 0.00 0.00 0.00 0.00 60.65 62.02 1a9c s ILE 104 Cb -0.15 -3.87 -0.11 0.00 0.01 0.00 0.00 42.46 38.34 1a9c s ILE 104 CO 0.74 -0.05 1.76 -0.89 0.00 0.00 0.00 174.94 176.50 1a9c s THR 105 N 2.79 2.19 -0.11 2.92 2.01 -1.26 -0.95 115.64 123.23 1a9c s THR 105 Ca 0.59 0.03 -0.02 0.00 0.31 0.00 0.00 61.69 62.59 1a9c s THR 105 Cb -0.26 -3.02 0.04 0.00 0.01 0.00 0.00 72.50 69.27 1a9c s THR 105 CO 0.22 0.00 0.04 -0.22 -0.69 0.00 0.00 174.62 173.96 1a9c s LEU 106 N 1.71 0.61 -0.15 4.42 0.20 -0.51 -4.80 118.68 120.15 1a9c s LEU 106 Ca 0.77 -0.32 0.01 0.00 0.69 0.00 0.00 54.13 55.27 1a9c s LEU 106 Cb -0.49 -0.39 0.02 0.00 -0.43 0.00 0.00 46.19 44.91 1a9c s LEU 106 CO 0.33 -0.26 -0.16 0.42 -0.29 0.00 0.00 176.35 176.40 1a9c s THR 107 N 2.01 1.66 0.31 3.68 -4.23 -1.26 -0.49 115.64 117.32 1a9c s THR 107 Ca 0.03 -0.70 0.04 0.00 -1.18 0.00 0.00 61.69 59.88 1a9c s THR 107 Cb -0.14 -1.54 -0.01 0.00 1.34 0.00 0.00 72.50 72.15 1a9c s THR 107 CO -0.06 0.47 0.13 -0.24 -0.54 0.00 0.00 174.62 174.38 1a9c n SER 108 N 4.65 0.89 -4.06 3.99 2.88 0.05 -4.50 113.62 117.53 1a9c n SER 108 Ca -0.18 -2.69 -0.23 0.00 -1.33 0.00 0.00 58.87 54.45 1a9c n SER 108 Cb 0.50 0.88 -0.16 0.00 -0.75 0.00 0.00 64.21 64.68 1a9c n SER 108 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1a9c s THR 109 N -2.79 1.07 0.12 2.46 2.01 -1.25 -0.93 115.64 116.34 1a9c s THR 109 Ca 0.18 -0.52 -0.30 0.00 0.31 0.00 0.00 61.69 61.36 1a9c s THR 109 Cb 0.01 -0.93 -0.06 0.00 0.01 0.00 0.00 72.50 71.52 1a9c s THR 109 CO 0.13 0.32 1.08 -0.94 -0.69 0.00 0.00 174.62 174.52 1a9c s SER 110 N 0.10 7.29 0.37 3.53 1.04 0.14 -0.21 113.70 125.96 1a9c s SER 110 Ca -0.03 1.96 0.27 0.00 0.48 0.00 0.00 55.95 58.63 1a9c s SER 110 Cb -0.10 -2.59 1.02 0.00 0.10 0.00 0.00 66.02 64.46 1a9c s SER 110 CO 0.01 -0.25 1.80 1.05 0.98 0.00 0.00 173.24 176.84 1a9c h GLU 111 N 5.79 0.00 0.01 4.02 4.11 -1.32 0.29 114.58 127.48 1a9c h GLU 111 Ca -0.43 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 58.81 1a9c h GLU 111 Cb 1.21 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 1a9c h GLU 111 CO 0.74 0.00 -0.88 0.45 0.07 0.00 0.00 179.01 179.39 1a9c h HIS 112 N 0.00 0.20 0.00 2.06 3.86 -1.91 -3.39 115.15 115.97 1a9c h HIS 112 Ca 0.00 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.09 1a9c h HIS 112 Cb 0.53 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.98 1a9c h HIS 112 CO 0.00 0.94 0.00 0.72 0.86 0.00 0.00 177.93 180.45 1a9c n HIS 113 N -3.61 0.00 -3.70 2.45 8.25 -1.22 -5.02 115.22 112.36 1a9c n HIS 113 Ca -0.03 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.17 1a9c n HIS 113 Cb 0.82 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.99 1a9c n HIS 113 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1a9c n PHE 114 N -0.01 -2.69 -4.35 4.41 3.01 0.10 -4.99 117.46 112.95 1a9c n PHE 114 Ca 0.00 0.98 -0.30 0.00 1.01 0.00 0.00 57.45 59.14 1a9c n PHE 114 Cb 0.19 -4.70 -0.11 0.00 -0.01 0.00 0.00 39.48 34.85 1a9c n PHE 114 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1a9c s VAL 115 N -3.32 2.98 0.27 -4.37 1.01 -1.24 -4.82 120.40 110.92 1a9c s VAL 115 Ca 0.60 -1.37 -0.28 0.00 0.00 0.00 0.00 61.98 60.92 1a9c s VAL 115 Cb -0.28 -2.36 -0.14 0.00 0.00 0.00 0.00 36.38 33.60 1a9c s VAL 115 CO 0.76 0.15 0.98 0.41 0.00 0.00 0.00 175.10 177.40 1a9c n THR 116 N 0.92 1.93 -3.95 3.92 -1.04 -1.26 -0.68 114.28 114.12 1a9c n THR 116 Ca -0.15 -0.48 -0.29 0.00 -2.04 0.00 0.00 64.05 61.09 1a9c n THR 116 Cb 0.52 -0.90 -0.16 0.00 -1.82 0.00 0.00 70.33 67.97 1a9c n THR 116 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1a9c s ILE 117 N -1.00 1.33 -0.15 12.58 1.01 -0.10 -1.02 121.20 133.85 1a9c s ILE 117 Ca 0.60 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 60.61 1a9c s ILE 117 Cb -0.73 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 40.36 1a9c s ILE 117 CO 0.59 0.26 -0.19 -0.62 0.00 0.00 0.00 174.94 174.98 1a9c s ASP 118 N 1.56 3.35 0.00 3.58 2.15 -0.52 -0.77 116.67 126.02 1a9c s ASP 118 Ca 0.02 -0.55 0.00 0.00 0.43 0.00 0.00 52.55 52.45 1a9c s ASP 118 Cb -0.14 -1.50 0.00 0.00 -0.30 0.00 0.00 42.92 40.98 1a9c s ASP 118 CO -0.09 0.08 0.00 0.61 -0.17 0.00 0.00 175.17 175.61 1a9c n GLY 119 N 4.06 2.23 2.99 2.66 0.00 0.36 -0.45 105.19 117.04 1a9c n GLY 119 Ca -0.20 -0.93 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 1a9c n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a9c s LYS 120 N -1.16 0.14 0.07 1.61 1.02 0.20 -1.43 119.74 120.19 1a9c s LYS 120 Ca 0.00 0.18 0.05 0.00 0.02 0.00 0.00 55.97 56.22 1a9c s LYS 120 Cb 0.00 0.05 -0.04 0.00 -0.52 0.00 0.00 37.83 37.32 1a9c s LYS 120 CO 0.00 -0.03 -0.04 0.00 -0.92 0.00 0.00 175.35 174.36 1a9c s ALA 121 N 0.13 3.15 -0.14 5.17 0.00 -0.13 -1.72 121.76 128.23 1a9c s ALA 121 Ca -0.01 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.84 1a9c s ALA 121 Cb -0.02 -1.12 0.02 0.00 0.00 0.00 0.00 23.12 22.01 1a9c s ALA 121 CO -0.00 0.66 -0.13 0.99 0.00 0.00 0.00 175.76 177.28 1a9c s THR 122 N -1.20 1.46 -0.05 0.00 2.01 0.19 -0.33 115.64 117.73 1a9c s THR 122 Ca 0.22 -0.57 0.06 0.00 0.31 0.00 0.00 61.69 61.72 1a9c s THR 122 Cb -0.11 -1.39 -0.01 0.00 0.01 0.00 0.00 72.50 71.00 1a9c s THR 122 CO 0.14 0.44 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.58 1a9c s VAL 123 N 1.51 1.94 0.00 3.82 1.01 -0.36 -1.03 120.40 127.29 1a9c s VAL 123 Ca 0.04 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 60.98 1a9c s VAL 123 Cb -0.13 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 1a9c s VAL 123 CO -0.10 0.54 0.06 0.00 0.00 0.00 0.00 175.10 175.61 1a9c s ALA 124 N -0.22 -0.13 0.11 5.51 0.00 -0.71 -0.56 121.76 125.76 1a9c s ALA 124 Ca -0.01 -0.24 -0.19 0.00 0.00 0.00 0.00 51.96 51.53 1a9c s ALA 124 Cb -0.13 0.07 0.05 0.00 0.00 0.00 0.00 23.12 23.11 1a9c s ALA 124 CO 0.02 -0.15 0.47 1.52 0.00 0.00 0.00 175.76 177.62 1a9c s TYR 125 N -1.12 -0.32 -0.34 0.00 1.13 -0.72 -1.09 117.35 114.90 1a9c s TYR 125 Ca -0.12 0.13 -0.08 0.00 -1.41 0.00 0.00 57.07 55.60 1a9c s TYR 125 Cb -0.07 0.33 0.03 0.00 -1.10 0.00 0.00 41.96 41.15 1a9c s TYR 125 CO 0.00 -0.70 0.12 0.42 -2.51 0.00 0.00 175.55 172.88 1a9c s ILE 126 N -3.36 4.02 0.24 -3.49 1.01 -0.98 -0.62 121.20 118.02 1a9c s ILE 126 Ca -0.00 -0.96 -0.31 0.00 0.00 0.00 0.00 60.65 59.38 1a9c s ILE 126 Cb 0.01 -3.22 -0.14 0.00 0.01 0.00 0.00 42.46 39.11 1a9c s ILE 126 CO -0.09 -0.13 1.29 -2.65 0.00 0.00 0.00 174.94 173.35 1a9c n PRO 127 N 4.87 1.77 0.00 2.79 -0.02 -1.26 -4.86 135.00 138.28 1a9c n PRO 127 Ca -0.13 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1a9c n PRO 127 Cb 0.46 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1a9c n PRO 127 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1a9c n LYS 128 N 1.61 0.00 0.08 -0.52 4.81 -1.26 -4.71 118.16 118.17 1a9c n LYS 128 Ca 0.11 0.00 0.01 0.00 -0.87 0.00 0.00 58.31 57.56 1a9c n LYS 128 Cb 0.31 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.32 1a9c n LYS 128 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1a9c h ASP 129 N 0.00 0.00 -4.85 3.14 3.32 -1.90 -3.45 116.42 112.68 1a9c h ASP 129 Ca 0.00 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 1a9c h ASP 129 Cb 0.00 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.39 1a9c h ASP 129 CO 0.00 0.54 -0.70 -0.94 -1.72 0.00 0.00 179.24 176.43 1a9c s SER 130 N -6.10 0.83 -0.18 6.45 1.04 -1.26 -1.84 113.70 112.65 1a9c s SER 130 Ca 0.00 -0.91 -0.02 0.00 0.48 0.00 0.00 55.95 55.50 1a9c s SER 130 Cb 0.08 0.12 -0.01 0.00 0.10 0.00 0.00 66.02 66.31 1a9c s SER 130 CO 0.78 -0.46 -0.08 -0.69 0.98 0.00 0.00 173.24 173.77 1a9c s VAL 131 N -3.28 3.31 0.34 5.02 1.01 0.30 -4.74 120.40 122.35 1a9c s VAL 131 Ca 0.06 -0.54 -0.19 0.00 0.00 0.00 0.00 61.98 61.30 1a9c s VAL 131 Cb 0.03 -2.45 -0.10 0.00 0.00 0.00 0.00 36.38 33.86 1a9c s VAL 131 CO -0.06 0.47 0.83 -0.51 0.00 0.00 0.00 175.10 175.84 1a9c s ILE 132 N 0.88 4.49 0.12 2.22 2.07 -1.26 -0.61 121.20 129.11 1a9c s ILE 132 Ca -0.02 1.32 -0.31 0.00 -1.41 0.00 0.00 60.65 60.23 1a9c s ILE 132 Cb -0.15 -3.72 -0.10 0.00 0.13 0.00 0.00 42.46 38.63 1a9c s ILE 132 CO 0.01 -0.10 1.69 -0.83 -1.91 0.00 0.00 174.94 173.80 1a9c s GLY 133 N -2.02 1.46 0.22 1.50 0.00 -0.78 -4.90 107.32 102.79 1a9c s GLY 133 Ca 0.54 1.35 -0.18 0.00 0.00 0.00 0.00 44.72 46.43 1a9c s GLY 133 CO 0.18 2.90 1.57 1.41 0.00 0.00 0.00 173.10 179.16 1a9c h LEU 134 N 7.98 -1.20 -2.13 0.66 3.38 -1.94 0.58 115.31 122.64 1a9c h LEU 134 Ca -0.44 0.27 0.05 0.00 0.09 0.00 0.00 57.88 57.85 1a9c h LEU 134 Cb 1.21 0.64 -0.01 0.00 0.09 0.00 0.00 40.66 42.59 1a9c h LEU 134 CO 0.93 -0.29 0.14 0.77 0.09 0.00 0.00 178.44 180.08 1a9c h SER 135 N -0.07 0.00 -0.47 -0.43 4.64 -2.00 -1.68 113.55 113.54 1a9c h SER 135 Ca 0.31 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1a9c h SER 135 Cb 0.58 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.65 1a9c h SER 135 CO -0.84 0.00 0.29 0.11 -0.87 0.00 0.00 176.83 175.52 1a9c h LYS 136 N 0.00 0.66 -0.62 4.77 1.79 -1.24 -0.14 116.57 121.79 1a9c h LYS 136 Ca 0.08 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 1a9c h LYS 136 Cb 0.37 -0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 30.85 1a9c h LYS 136 CO -0.00 0.47 0.33 0.82 -1.08 0.00 0.00 179.45 179.98 1a9c h ILE 137 N 0.67 1.20 -0.05 1.86 2.04 -1.37 0.55 117.51 122.43 1a9c h ILE 137 Ca 0.18 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 1a9c h ILE 137 Cb -0.02 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1a9c h ILE 137 CO -0.03 0.22 0.02 0.78 0.00 0.00 0.00 178.15 179.14 1a9c h ASN 138 N 0.84 0.06 -0.46 1.72 2.35 -1.36 -2.06 115.58 116.67 1a9c h ASN 138 Ca 0.22 -0.14 0.04 0.00 -0.55 0.00 0.00 56.30 55.86 1a9c h ASN 138 Cb 0.06 -0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.38 1a9c h ASN 138 CO -0.03 0.18 0.23 0.03 -1.65 0.00 0.00 177.43 176.19 1a9c h ARG 139 N -0.06 0.44 -0.45 0.81 3.08 -0.59 -0.93 114.38 116.69 1a9c h ARG 139 Ca 0.02 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1a9c h ARG 139 Cb 0.14 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1a9c h ARG 139 CO -0.00 0.29 0.28 0.82 -1.07 0.00 0.00 179.97 180.29 1a9c h ILE 140 N 0.46 1.14 0.08 2.04 2.04 -0.79 0.52 117.51 122.98 1a9c h ILE 140 Ca 0.20 -0.29 0.01 0.00 1.00 0.00 0.00 64.86 65.78 1a9c h ILE 140 Cb 0.11 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 1a9c h ILE 140 CO -0.14 0.14 -0.14 0.58 0.00 0.00 0.00 178.15 178.59 1a9c h VAL 141 N 0.60 0.68 -0.86 1.67 2.07 -0.95 -2.17 116.25 117.28 1a9c h VAL 141 Ca 0.16 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.72 1a9c h VAL 141 Cb -0.02 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.38 1a9c h VAL 141 CO -0.03 0.00 0.57 -0.61 0.02 0.00 0.00 177.57 177.51 1a9c h GLN 142 N -0.27 1.03 0.39 1.57 4.15 -0.84 -1.00 115.11 120.13 1a9c h GLN 142 Ca 0.02 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 1a9c h GLN 142 Cb 0.29 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 1a9c h GLN 142 CO -0.08 0.68 -0.46 0.35 -1.93 0.00 0.00 178.83 177.39 1a9c h PHE 143 N 1.06 -1.30 0.00 3.99 3.57 -0.27 -0.29 116.94 123.70 1a9c h PHE 143 Ca 0.35 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.84 1a9c h PHE 143 Cb 0.05 0.51 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 1a9c h PHE 143 CO -0.00 -0.60 -0.12 0.74 -2.23 0.00 0.00 178.31 176.11 1a9c h PHE 144 N -0.87 0.00 -0.03 0.41 0.04 -1.29 -1.81 116.94 113.39 1a9c h PHE 144 Ca -0.05 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.60 1a9c h PHE 144 Cb 0.77 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.91 1a9c h PHE 144 CO -0.28 0.12 -0.55 0.00 -0.60 0.00 0.00 178.31 177.00 1a9c h ALA 145 N 1.88 1.02 0.00 2.45 0.00 -0.45 -3.33 119.26 120.84 1a9c h ALA 145 Ca -0.00 -0.51 -0.64 0.00 0.00 0.00 0.00 54.91 53.76 1a9c h ALA 145 Cb 0.36 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.08 1a9c h ALA 145 CO 0.02 0.69 3.55 1.04 0.00 0.00 0.00 179.25 184.54 1a9c n GLN 146 N -3.89 3.30 -3.53 0.00 1.13 -0.19 -4.13 117.38 110.07 1a9c n GLN 146 Ca -0.02 -2.16 -0.10 0.00 -1.94 0.00 0.00 57.00 52.78 1a9c n GLN 146 Cb 0.57 -2.84 -0.02 0.00 0.11 0.00 0.00 30.24 28.06 1a9c n GLN 146 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1a9c s ARG 147 N 2.58 1.31 -0.32 -1.09 0.52 -1.12 -0.36 118.95 120.46 1a9c s ARG 147 Ca 0.62 -0.55 -0.29 0.00 -0.52 0.00 0.00 55.73 54.99 1a9c s ARG 147 Cb 0.16 0.56 -0.00 0.00 0.52 0.00 0.00 34.95 36.19 1a9c s ARG 147 CO -0.06 -0.58 1.45 -2.14 0.02 0.00 0.00 175.30 174.00 1a9c s PRO 148 N -3.67 3.71 0.49 3.54 0.02 -1.26 -3.76 135.00 134.07 1a9c s PRO 148 Ca 0.04 1.24 0.05 0.00 0.02 0.00 0.00 61.00 62.35 1a9c s PRO 148 Cb -0.02 -3.99 -0.01 0.00 0.02 0.00 0.00 34.50 30.50 1a9c s PRO 148 CO -0.08 -1.38 0.19 -0.65 -0.33 0.00 0.00 177.00 174.75 1a9c s GLN 149 N 4.69 2.21 -0.11 5.54 -1.52 0.71 -4.56 119.66 126.61 1a9c s GLN 149 Ca 0.63 -2.11 -0.04 0.00 -1.95 0.00 0.00 55.36 51.90 1a9c s GLN 149 Cb -0.18 -1.85 0.05 0.00 -0.22 0.00 0.00 33.01 30.81 1a9c s GLN 149 CO 0.29 -0.37 0.09 0.08 -0.25 0.00 0.00 175.29 175.13 1a9c s VAL 150 N -2.76 -0.13 0.31 1.09 1.01 -1.26 -1.02 120.40 117.65 1a9c s VAL 150 Ca 0.26 0.12 0.07 0.00 0.00 0.00 0.00 61.98 62.43 1a9c s VAL 150 Cb 0.01 -0.39 0.34 0.00 0.00 0.00 0.00 36.38 36.34 1a9c s VAL 150 CO 0.15 -0.06 1.63 -0.61 0.00 0.00 0.00 175.10 176.21 1a9c h GLN 151 N 8.42 0.18 -0.96 2.72 4.15 -1.99 0.20 115.11 127.82 1a9c h GLN 151 Ca -0.14 -0.01 0.08 0.00 0.77 0.00 0.00 58.65 59.35 1a9c h GLN 151 Cb 1.14 -0.04 -0.07 0.00 0.21 0.00 0.00 27.48 28.72 1a9c h GLN 151 CO 0.22 0.12 0.62 0.93 -1.93 0.00 0.00 178.83 178.79 1a9c h GLU 152 N 0.18 1.03 0.01 1.69 3.07 -1.99 -1.60 114.58 116.96 1a9c h GLU 152 Ca 0.64 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.36 59.30 1a9c h GLU 152 Cb 1.39 -0.23 0.01 0.00 -0.84 0.00 0.00 28.75 29.08 1a9c h GLU 152 CO -0.70 0.68 -0.52 -0.09 -1.40 0.00 0.00 179.01 176.98 1a9c h ARG 153 N 1.06 0.34 -0.60 2.33 2.43 -1.09 -3.19 114.38 115.66 1a9c h ARG 153 Ca 0.43 -0.37 0.11 0.00 -0.81 0.00 0.00 59.98 59.33 1a9c h ARG 153 Cb 0.27 0.11 -0.08 0.00 -0.42 0.00 0.00 29.97 29.84 1a9c h ARG 153 CO -0.18 1.06 0.13 1.25 -1.51 0.00 0.00 179.97 180.73 1a9c h LEU 154 N -0.23 0.01 -0.10 3.80 5.85 -0.87 0.77 115.31 124.53 1a9c h LEU 154 Ca -0.07 0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1a9c h LEU 154 Cb 1.25 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 1a9c h LEU 154 CO 0.10 0.02 0.01 0.74 -0.34 0.00 0.00 178.44 178.97 1a9c h THR 155 N 0.27 0.94 -0.32 1.05 2.02 -1.40 -1.82 112.91 113.65 1a9c h THR 155 Ca 0.31 -0.02 0.04 0.00 0.77 0.00 0.00 66.41 67.52 1a9c h THR 155 Cb 0.46 0.89 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 1a9c h THR 155 CO -0.39 0.01 0.09 1.56 0.37 0.00 0.00 175.52 177.15 1a9c h GLN 156 N 0.05 0.21 -0.11 6.66 1.08 -1.26 -1.65 115.11 120.09 1a9c h GLN 156 Ca 0.05 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.26 1a9c h GLN 156 Cb 0.05 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 1a9c h GLN 156 CO -0.07 0.14 -0.04 1.96 -0.95 0.00 0.00 178.83 179.87 1a9c h GLN 157 N 0.22 -0.02 -0.64 1.46 4.20 -0.64 -1.15 115.11 118.54 1a9c h GLN 157 Ca 0.14 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.90 1a9c h GLN 157 Cb 0.13 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.87 1a9c h GLN 157 CO -0.17 -0.01 0.37 0.82 -0.67 0.00 0.00 178.83 179.17 1a9c h ILE 158 N -0.02 1.00 0.16 2.54 2.04 -1.09 0.51 117.51 122.65 1a9c h ILE 158 Ca 0.06 -0.24 0.01 0.00 1.00 0.00 0.00 64.86 65.69 1a9c h ILE 158 Cb 0.11 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 1a9c h ILE 158 CO -0.12 0.13 -0.22 0.25 0.00 0.00 0.00 178.15 178.18 1a9c h LEU 159 N 0.69 -0.61 -0.07 1.44 5.85 -0.74 -2.07 115.31 119.81 1a9c h LEU 159 Ca 0.28 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 59.06 1a9c h LEU 159 Cb 0.13 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 1a9c h LEU 159 CO -0.16 -0.31 0.04 0.40 -0.34 0.00 0.00 178.44 178.07 1a9c h ILE 160 N -0.44 1.06 -0.65 4.05 2.04 -0.74 -0.46 117.51 122.37 1a9c h ILE 160 Ca 0.02 -0.15 0.14 0.00 1.00 0.00 0.00 64.86 65.86 1a9c h ILE 160 Cb 0.44 1.03 -0.11 0.00 -0.74 0.00 0.00 36.82 37.44 1a9c h ILE 160 CO -0.10 0.05 0.04 0.00 0.00 0.00 0.00 178.15 178.15 1a9c h ALA 161 N 0.98 0.70 -0.10 1.87 0.00 -0.77 0.03 119.26 121.96 1a9c h ALA 161 Ca 0.03 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1a9c h ALA 161 Cb 0.04 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1a9c h ALA 161 CO -0.00 -0.38 -0.05 -0.07 0.00 0.00 0.00 179.25 178.74 1a9c h LEU 162 N 0.15 0.23 -0.73 0.00 3.38 -1.14 -1.58 115.31 115.62 1a9c h LEU 162 Ca 0.35 -0.41 0.12 0.00 0.09 0.00 0.00 57.88 58.03 1a9c h LEU 162 Cb 0.58 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 1a9c h LEU 162 CO -0.53 0.59 0.32 1.56 0.09 0.00 0.00 178.44 180.46 1a9c h GLN 163 N -0.14 0.49 0.58 1.13 4.20 -0.34 0.14 115.11 121.17 1a9c h GLN 163 Ca 0.02 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1a9c h GLN 163 Cb 0.50 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 28.18 1a9c h GLN 163 CO 0.02 0.32 -0.28 1.15 -0.67 0.00 0.00 178.83 179.37 1a9c h THR 164 N 0.50 0.41 -0.76 -0.54 2.02 -0.94 -0.68 112.91 112.94 1a9c h THR 164 Ca 0.39 -0.09 -0.04 0.00 0.77 0.00 0.00 66.41 67.43 1a9c h THR 164 Cb 0.52 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 1a9c h THR 164 CO -0.35 0.01 0.30 -0.07 0.37 0.00 0.00 175.52 175.79 1a9c h LEU 165 N -0.84 1.04 0.00 2.58 3.38 -0.74 -3.07 115.31 117.67 1a9c h LEU 165 Ca -0.08 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1a9c h LEU 165 Cb 0.62 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1a9c h LEU 165 CO 0.13 0.93 -0.02 -0.07 0.09 0.00 0.00 178.44 179.50 1a9c h LEU 166 N 1.09 0.00 0.31 1.67 3.38 -0.75 -3.48 115.31 117.53 1a9c h LEU 166 Ca 0.25 -0.01 -0.25 0.00 0.09 0.00 0.00 57.88 57.97 1a9c h LEU 166 Cb 0.21 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.01 1a9c h LEU 166 CO -0.02 0.00 -0.38 0.61 0.09 0.00 0.00 178.44 178.74 1a9c n GLY 167 N 1.26 -0.05 3.24 0.83 0.00 -0.28 -4.66 105.19 105.52 1a9c n GLY 167 Ca 0.05 -0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 1a9c n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a9c s THR 168 N -2.95 0.06 -1.27 2.61 2.01 -1.06 -4.88 115.64 110.16 1a9c s THR 168 Ca 0.20 -0.51 0.23 0.00 0.31 0.00 0.00 61.69 61.92 1a9c s THR 168 Cb -0.09 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.71 1a9c s THR 168 CO 0.25 -0.28 1.21 0.59 -0.69 0.00 0.00 174.62 175.70 1a9c n ASN 169 N 1.15 0.98 -4.25 3.53 3.02 -1.26 -4.33 115.26 114.10 1a9c n ASN 169 Ca -0.21 -0.80 -0.41 0.00 -0.03 0.00 0.00 54.58 53.13 1a9c n ASN 169 Cb 0.57 0.53 -0.01 0.00 -0.61 0.00 0.00 39.78 40.25 1a9c n ASN 169 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1a9c n ASN 170 N -1.15 4.28 -3.99 6.41 3.02 -1.26 -0.48 115.26 122.09 1a9c n ASN 170 Ca 0.07 -2.86 -0.10 0.00 -0.03 0.00 0.00 54.58 51.66 1a9c n ASN 170 Cb 0.35 -1.68 -0.11 0.00 -0.61 0.00 0.00 39.78 37.73 1a9c n ASN 170 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1a9c s VAL 171 N 4.57 0.17 -0.08 2.41 1.01 -1.24 -2.32 120.40 124.91 1a9c s VAL 171 Ca 0.53 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 1a9c s VAL 171 Cb 0.07 -0.30 0.02 0.00 0.00 0.00 0.00 36.38 36.18 1a9c s VAL 171 CO 0.03 -0.47 0.22 0.00 0.00 0.00 0.00 175.10 174.89 1a9c s ALA 172 N -1.40 -0.55 -0.01 5.51 0.00 -0.25 0.13 121.76 125.20 1a9c s ALA 172 Ca -0.15 0.65 0.02 0.00 0.00 0.00 0.00 51.96 52.48 1a9c s ALA 172 Cb -0.10 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.64 1a9c s ALA 172 CO -0.01 -0.11 -0.06 0.08 0.00 0.00 0.00 175.76 175.67 1a9c s VAL 173 N 0.20 0.48 -0.02 0.00 1.01 -0.49 -1.73 120.40 119.85 1a9c s VAL 173 Ca -0.01 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.77 1a9c s VAL 173 Cb -0.02 -0.43 0.01 0.00 0.00 0.00 0.00 36.38 35.94 1a9c s VAL 173 CO -0.00 0.15 -0.04 -0.55 0.00 0.00 0.00 175.10 174.66 1a9c s SER 174 N 0.10 0.70 -0.05 3.32 0.15 -0.20 -0.69 113.70 117.03 1a9c s SER 174 Ca -0.01 -0.10 0.03 0.00 0.70 0.00 0.00 55.95 56.57 1a9c s SER 174 Cb -0.05 -0.22 0.01 0.00 -1.71 0.00 0.00 66.02 64.05 1a9c s SER 174 CO -0.00 0.00 -0.12 -0.63 1.20 0.00 0.00 173.24 173.69 1a9c s ILE 175 N 0.40 1.04 -0.14 6.45 1.01 0.25 -0.64 121.20 129.57 1a9c s ILE 175 Ca -0.05 -0.46 0.02 0.00 0.00 0.00 0.00 60.65 60.17 1a9c s ILE 175 Cb -0.08 -0.94 0.01 0.00 0.01 0.00 0.00 42.46 41.46 1a9c s ILE 175 CO -0.00 0.32 -0.21 -0.62 0.00 0.00 0.00 174.94 174.43 1a9c s ASP 176 N 0.45 3.06 0.08 3.58 -1.08 -0.70 -0.90 116.67 121.17 1a9c s ASP 176 Ca -0.09 -0.59 -0.13 0.00 -0.52 0.00 0.00 52.55 51.21 1a9c s ASP 176 Cb -0.13 -1.42 0.02 0.00 -1.46 0.00 0.00 42.92 39.93 1a9c s ASP 176 CO 0.02 0.07 0.31 0.00 0.52 0.00 0.00 175.17 176.09 1a9c s ALA 177 N 0.83 -0.64 -0.18 3.66 0.00 0.03 -0.63 121.76 124.84 1a9c s ALA 177 Ca -0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 51.96 51.67 1a9c s ALA 177 Cb -0.15 0.50 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 1a9c s ALA 177 CO -0.02 -0.52 -0.05 0.08 0.00 0.00 0.00 175.76 175.25 1a9c s VAL 178 N -3.36 3.59 -0.30 0.00 1.01 0.40 -0.75 120.40 120.99 1a9c s VAL 178 Ca 0.01 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.42 1a9c s VAL 178 Cb 0.02 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 1a9c s VAL 178 CO -0.09 0.47 0.24 -1.00 0.00 0.00 0.00 175.10 174.72 1a9c s HIS 179 N 0.79 3.22 -0.64 5.22 3.76 -1.26 -1.43 115.29 124.94 1a9c s HIS 179 Ca -0.02 0.04 0.20 0.00 -0.15 0.00 0.00 55.06 55.13 1a9c s HIS 179 Cb -0.15 -2.45 0.84 0.00 1.11 0.00 0.00 32.58 31.93 1a9c s HIS 179 CO 0.02 -0.25 1.60 0.66 -0.85 0.00 0.00 174.74 175.92 1a9c n TYR 180 N 5.13 0.52 1.68 1.40 4.02 -0.19 -1.50 117.16 128.22 1a9c n TYR 180 Ca -0.13 0.21 0.07 0.00 -0.01 0.00 0.00 57.90 58.05 1a9c n TYR 180 Cb 0.51 -0.84 0.35 0.00 -0.02 0.00 0.00 39.34 39.34 1a9c n TYR 180 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1a9c n VAL 182 N -0.30 0.00 -0.06 0.00 0.31 -0.56 -4.64 118.33 113.07 1a9c n VAL 182 Ca 0.11 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.37 1a9c n VAL 182 Cb 0.14 -0.56 -0.06 0.00 -0.91 0.00 0.00 33.84 32.46 1a9c n VAL 182 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1a9c h LYS 183 N 0.00 0.00 0.00 5.55 3.64 -1.21 -0.74 116.57 123.81 1a9c h LYS 183 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1a9c h LYS 183 Cb 0.97 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1a9c h LYS 183 CO 0.00 0.42 0.00 0.00 -2.27 0.00 0.00 179.45 177.60 1a9c n ALA 184 N -2.91 1.98 -3.78 5.00 0.00 0.49 -4.13 120.51 117.16 1a9c n ALA 184 Ca -0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 53.44 53.26 1a9c n ALA 184 Cb 0.26 -1.34 -0.00 0.00 0.00 0.00 0.00 19.45 18.37 1a9c n ALA 184 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1a9c s ARG 185 N -2.91 1.15 6.80 0.00 3.03 -1.24 -4.96 118.95 120.82 1a9c s ARG 185 Ca 0.12 -0.67 0.00 0.00 2.03 0.00 0.00 55.73 57.21 1a9c s ARG 185 Cb 0.14 0.37 0.00 0.00 -1.03 0.00 0.00 34.95 34.43 1a9c s ARG 185 CO 0.37 -0.53 0.00 0.41 -1.13 0.00 0.00 175.30 174.42 1a9c n GLY 186 N -0.53 2.00 0.13 3.88 0.00 -1.26 -2.59 105.19 106.82 1a9c n GLY 186 Ca -0.05 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.84 1a9c n GLY 186 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1a9c h ILE 187 N 0.00 0.00 -6.47 -0.61 2.10 -1.87 -3.48 117.51 107.18 1a9c h ILE 187 Ca 0.00 -0.49 -0.49 0.00 1.08 0.00 0.00 64.86 64.96 1a9c h ILE 187 Cb 0.00 1.44 0.03 0.00 -1.09 0.00 0.00 36.82 37.20 1a9c h ILE 187 CO 0.00 0.00 -0.95 0.54 -1.08 0.00 0.00 178.15 176.66 1a9c n ARG 188 N -2.38 -1.36 -3.06 2.19 1.74 -0.59 -4.90 116.66 108.30 1a9c n ARG 188 Ca 0.05 0.35 -0.44 0.00 -0.77 0.00 0.00 57.85 57.04 1a9c n ARG 188 Cb 0.40 -3.80 -0.05 0.00 -1.02 0.00 0.00 32.46 27.98 1a9c n ARG 188 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1a9c s ASP 189 N -3.68 6.25 0.29 0.55 -1.08 -0.39 -4.91 116.67 113.70 1a9c s ASP 189 Ca 0.38 -0.82 0.25 0.00 -0.52 0.00 0.00 52.55 51.84 1a9c s ASP 189 Cb -0.16 -2.33 0.98 0.00 -1.46 0.00 0.00 42.92 39.95 1a9c s ASP 189 CO 0.90 -1.02 1.76 0.00 0.52 0.00 0.00 175.17 177.32 1a9c h ALA 190 N 9.12 1.00 0.00 3.66 0.00 -1.86 -3.36 119.26 127.82 1a9c h ALA 190 Ca -0.27 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.40 1a9c h ALA 190 Cb 1.09 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 1a9c h ALA 190 CO 1.02 0.00 -1.93 0.25 0.00 0.00 0.00 179.25 178.59 1a9c n THR 191 N -2.38 0.88 -1.85 0.00 -2.24 -1.26 -5.04 114.28 102.38 1a9c n THR 191 Ca 0.03 -0.57 -0.36 0.00 -2.27 0.00 0.00 64.05 60.88 1a9c n THR 191 Cb 0.29 -0.56 0.05 0.00 -2.10 0.00 0.00 70.33 68.01 1a9c n THR 191 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1a9c s SER 192 N -4.63 4.90 0.02 3.42 1.04 -1.26 -5.06 113.70 112.13 1a9c s SER 192 Ca -0.07 2.42 -0.05 0.00 0.48 0.00 0.00 55.95 58.72 1a9c s SER 192 Cb 0.05 -2.60 -0.01 0.00 0.10 0.00 0.00 66.02 63.56 1a9c s SER 192 CO 0.57 -1.79 0.09 0.00 0.98 0.00 0.00 173.24 173.10 1a9c s ALA 193 N -1.65 -0.17 -0.06 5.32 0.00 -1.26 -4.77 121.76 119.18 1a9c s ALA 193 Ca 0.78 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 52.42 1a9c s ALA 193 Cb -0.31 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 22.94 1a9c s ALA 193 CO 0.37 -0.23 -0.11 0.99 0.00 0.00 0.00 175.76 176.77 1a9c s THR 194 N -1.73 3.30 -0.10 0.00 2.01 0.07 -4.94 115.64 114.25 1a9c s THR 194 Ca -0.12 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.26 1a9c s THR 194 Cb -0.06 -2.32 0.01 0.00 0.01 0.00 0.00 72.50 70.14 1a9c s THR 194 CO -0.01 0.59 -0.15 -0.89 -0.69 0.00 0.00 174.62 173.47 1a9c s THR 195 N -0.74 1.49 0.01 -0.82 2.01 -1.26 -0.79 115.64 115.54 1a9c s THR 195 Ca 0.11 -0.64 0.06 0.00 0.31 0.00 0.00 61.69 61.53 1a9c s THR 195 Cb -0.11 -1.35 -0.02 0.00 0.01 0.00 0.00 72.50 71.03 1a9c s THR 195 CO 0.01 0.44 -0.17 0.42 -0.69 0.00 0.00 174.62 174.62 1a9c s THR 196 N 0.92 1.38 0.01 -0.82 -4.23 -0.08 -4.99 115.64 107.83 1a9c s THR 196 Ca -0.08 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.53 1a9c s THR 196 Cb -0.15 -1.18 -0.01 0.00 1.34 0.00 0.00 72.50 72.50 1a9c s THR 196 CO -0.01 0.25 -0.03 0.42 -0.54 0.00 0.00 174.62 174.72 1a9c s THR 197 N -0.60 0.21 -0.12 3.99 -4.23 -1.26 -0.58 115.64 113.04 1a9c s THR 197 Ca 0.06 -0.38 -0.01 0.00 -1.18 0.00 0.00 61.69 60.18 1a9c s THR 197 Cb -0.07 -0.23 0.03 0.00 1.34 0.00 0.00 72.50 73.56 1a9c s THR 197 CO 0.00 -0.11 -0.06 -0.94 -0.54 0.00 0.00 174.62 172.97 1a9c s SER 198 N -0.52 2.27 -0.10 3.99 1.04 0.13 -5.00 113.70 115.51 1a9c s SER 198 Ca -0.04 -0.36 -0.02 0.00 0.48 0.00 0.00 55.95 56.01 1a9c s SER 198 Cb -0.04 -0.81 -0.03 0.00 0.10 0.00 0.00 66.02 65.24 1a9c s SER 198 CO -0.00 -0.14 -0.03 -0.76 0.98 0.00 0.00 173.24 173.28 1a9c s LEU 199 N 1.72 3.36 0.21 2.42 1.43 -1.26 -1.39 118.68 125.17 1a9c s LEU 199 Ca 0.04 0.01 0.09 0.00 -1.03 0.00 0.00 54.13 53.25 1a9c s LEU 199 Cb -0.13 -1.77 -0.05 0.00 0.03 0.00 0.00 46.19 44.27 1a9c s LEU 199 CO -0.08 0.31 -0.18 -0.83 0.23 0.00 0.00 176.35 175.80 1a9c s GLY 200 N -0.49 1.57 0.00 -3.19 0.00 0.12 -4.67 107.32 100.66 1a9c s GLY 200 Ca 0.08 -1.67 0.00 0.00 0.00 0.00 0.00 44.72 43.13 1a9c s GLY 200 CO 0.02 -1.75 0.00 0.61 0.00 0.00 0.00 173.10 171.98 1a9c n GLY 201 N -0.21 2.73 0.37 0.20 0.00 0.36 -1.80 105.19 106.84 1a9c n GLY 201 Ca -0.09 -0.15 0.17 0.00 0.00 0.00 0.00 46.02 45.95 1a9c n GLY 201 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1a9c h LEU 202 N 0.00 0.16 -0.82 0.99 3.38 -1.94 0.02 115.31 117.11 1a9c h LEU 202 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1a9c h LEU 202 Cb 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1a9c h LEU 202 CO 0.00 0.09 0.00 0.49 0.09 0.00 0.00 178.44 179.11 1a9c n PHE 203 N -4.43 0.47 -0.03 1.13 3.72 -0.75 -0.53 117.46 117.05 1a9c n PHE 203 Ca 0.10 0.23 -0.04 0.00 -0.05 0.00 0.00 57.45 57.69 1a9c n PHE 203 Cb 0.52 -0.87 -0.03 0.00 -0.94 0.00 0.00 39.48 38.16 1a9c n PHE 203 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1a9c n LYS 204 N -1.97 0.17 0.22 -1.08 4.81 -0.12 -4.08 118.16 116.10 1a9c n LYS 204 Ca -0.00 0.04 -0.11 0.00 -0.87 0.00 0.00 58.31 57.36 1a9c n LYS 204 Cb 0.06 -1.13 -0.06 0.00 0.02 0.00 0.00 35.03 33.92 1a9c n LYS 204 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 1a9c h SER 205 N 0.00 -0.53 -3.48 3.14 0.02 -0.98 -3.43 113.55 108.29 1a9c h SER 205 Ca -0.14 -0.04 -0.58 0.00 -0.84 0.00 0.00 61.79 60.18 1a9c h SER 205 Cb 1.22 0.14 -0.08 0.00 0.14 0.00 0.00 62.40 63.81 1a9c h SER 205 CO -0.02 -0.11 0.69 -0.55 -1.14 0.00 0.00 176.83 175.70 1a9c s SER 206 N -4.86 6.73 0.51 3.07 0.15 0.31 -4.90 113.70 114.71 1a9c s SER 206 Ca -0.11 0.66 0.24 0.00 0.70 0.00 0.00 55.95 57.45 1a9c s SER 206 Cb 0.01 -2.49 1.36 0.00 -1.71 0.00 0.00 66.02 63.19 1a9c s SER 206 CO 0.36 -0.91 2.06 -0.61 1.20 0.00 0.00 173.24 175.34 1a9c h GLN 207 N 8.49 0.00 0.46 5.44 4.15 -1.83 0.40 115.11 132.21 1a9c h GLN 207 Ca -0.23 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.17 1a9c h GLN 207 Cb 1.07 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.77 1a9c h GLN 207 CO 1.01 0.13 -0.22 -0.97 -1.93 0.00 0.00 178.83 176.85 1a9c h ASN 208 N 0.00 -0.53 -0.05 -0.69 -1.24 -1.91 -1.83 115.58 109.34 1a9c h ASN 208 Ca -0.00 -0.07 -0.00 0.00 0.71 0.00 0.00 56.30 56.94 1a9c h ASN 208 Cb 0.32 0.14 -0.00 0.00 0.73 0.00 0.00 38.32 39.51 1a9c h ASN 208 CO 0.02 -0.24 0.02 0.74 -1.29 0.00 0.00 177.43 176.68 1a9c h THR 209 N -0.81 1.12 -0.41 -3.57 2.02 -1.74 -2.40 112.91 107.13 1a9c h THR 209 Ca -0.06 -0.36 0.09 0.00 0.77 0.00 0.00 66.41 66.84 1a9c h THR 209 Cb 0.56 1.28 -0.09 0.00 -1.74 0.00 0.00 68.15 68.16 1a9c h THR 209 CO 0.10 0.10 -0.25 -0.09 0.37 0.00 0.00 175.52 175.75 1a9c h ARG 210 N -0.07 -0.17 -0.25 6.66 2.43 -0.95 -1.66 114.38 120.37 1a9c h ARG 210 Ca 0.02 0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.09 1a9c h ARG 210 Cb 0.14 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1a9c h ARG 210 CO -0.00 -0.12 -0.30 0.45 -1.51 0.00 0.00 179.97 178.50 1a9c h HIS 211 N -0.18 0.57 -0.90 2.20 3.86 -1.29 -0.97 115.15 118.43 1a9c h HIS 211 Ca 0.19 -0.13 0.04 0.00 -1.16 0.00 0.00 60.37 59.31 1a9c h HIS 211 Cb 0.49 -0.13 -0.06 0.00 1.06 0.00 0.00 27.41 28.77 1a9c h HIS 211 CO -0.49 0.74 0.58 0.93 0.86 0.00 0.00 177.93 180.56 1a9c h GLU 212 N 0.43 1.07 0.11 2.45 5.08 -0.80 0.16 114.58 123.08 1a9c h GLU 212 Ca 0.06 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1a9c h GLU 212 Cb 0.74 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1a9c h GLU 212 CO 0.06 0.71 -0.05 0.35 -1.00 0.00 0.00 179.01 179.07 1a9c h PHE 213 N 1.10 -0.14 -0.89 4.33 3.57 -1.05 -2.64 116.94 121.22 1a9c h PHE 213 Ca 0.37 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.97 1a9c h PHE 213 Cb 0.05 0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.77 1a9c h PHE 213 CO -0.02 0.28 0.58 -0.07 -2.23 0.00 0.00 178.31 176.85 1a9c h LEU 214 N -0.61 0.78 -0.66 0.59 3.38 -0.79 -0.44 115.31 117.55 1a9c h LEU 214 Ca -0.02 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1a9c h LEU 214 Cb 0.48 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1a9c h LEU 214 CO 0.03 0.45 0.31 -0.09 0.09 0.00 0.00 178.44 179.23 1a9c h ARG 215 N 0.86 0.95 0.00 1.13 2.43 -0.70 -2.52 114.38 116.52 1a9c h ARG 215 Ca 0.42 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 1a9c h ARG 215 Cb 0.46 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1a9c h ARG 215 CO -0.18 0.76 0.00 0.00 -1.51 0.00 0.00 179.97 179.03 1a9c h ALA 216 N 1.14 1.00 -2.84 2.80 0.00 -0.72 -3.45 119.26 117.20 1a9c h ALA 216 Ca 0.23 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.62 1a9c h ALA 216 Cb 0.12 0.00 0.06 0.00 0.00 0.00 0.00 17.79 17.98 1a9c h ALA 216 CO -0.03 0.00 0.58 0.08 0.00 0.00 0.00 179.25 179.89 1a9c s VAL 217 N -3.69 2.86 0.06 0.00 1.01 -0.84 -4.77 120.40 115.03 1a9c s VAL 217 Ca 0.01 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.79 1a9c s VAL 217 Cb 0.09 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1a9c s VAL 217 CO 0.51 0.15 0.00 -1.14 0.00 0.00 0.00 175.10 174.62 1a9c n ARG 218 N 0.47 -1.46 -3.69 2.72 3.00 -1.26 -5.05 116.66 111.40 1a9c n ARG 218 Ca 0.02 1.38 -0.14 0.00 -0.00 0.00 0.00 57.85 59.11 1a9c n ARG 218 Cb 0.44 -1.11 -0.14 0.00 0.00 0.00 0.00 32.46 31.65 1a9c n ARG 218 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1a9c s HIS 219 N -0.20 -0.32 0.11 -0.14 3.76 -1.26 -5.13 115.29 112.10 1a9c s HIS 219 Ca 0.00 0.80 -0.31 0.00 -0.15 0.00 0.00 55.06 55.40 1a9c s HIS 219 Cb 0.00 -0.07 -0.09 0.00 1.11 0.00 0.00 32.58 33.53 1a9c s HIS 219 CO 0.00 -0.29 1.58 -1.01 -0.85 0.00 0.00 174.74 174.17 1a9c s HIS 220 N 1.99 2.78 0.00 1.40 3.76 -1.26 -4.94 115.29 119.02 1a9c s HIS 220 Ca -0.02 0.53 0.00 0.00 -0.15 0.00 0.00 55.06 55.42 1a9c s HIS 220 Cb -0.12 -3.90 0.00 0.00 1.11 0.00 0.00 32.58 29.67 1a9c s HIS 220 CO -0.08 -3.46 0.00 0.09 -0.85 0.00 0.00 174.74 170.45