#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c9k s ILE 2 N 0.00 1.39 -0.17 3.17 1.01 0.77 -1.27 121.20 126.10 1c9k s ILE 2 Ca 0.00 -0.59 -0.05 0.00 0.00 0.00 0.00 60.65 60.01 1c9k s ILE 2 Cb 0.00 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 41.17 1c9k s ILE 2 CO 0.00 0.42 -0.01 -0.22 0.00 0.00 0.00 174.94 175.13 1c9k s LEU 3 N 0.88 3.38 -0.19 2.97 2.96 -0.51 0.19 118.68 128.36 1c9k s LEU 3 Ca -0.09 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 1c9k s LEU 3 Cb -0.15 -1.83 0.01 0.00 0.50 0.00 0.00 46.19 44.72 1c9k s LEU 3 CO 0.01 0.15 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.33 1c9k s VAL 4 N 0.47 2.35 0.33 1.68 1.01 -0.29 -1.81 120.40 124.14 1c9k s VAL 4 Ca -0.02 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.18 1c9k s VAL 4 Cb -0.14 -2.01 -0.07 0.00 0.00 0.00 0.00 36.38 34.17 1c9k s VAL 4 CO 0.02 0.52 -0.02 0.28 0.00 0.00 0.00 175.10 175.90 1c9k s THR 5 N 1.30 1.70 0.00 3.92 -1.32 -0.12 -1.10 115.64 120.02 1c9k s THR 5 Ca 0.04 -2.08 0.00 0.00 -1.21 0.00 0.00 61.69 58.45 1c9k s THR 5 Cb -0.13 -2.70 0.00 0.00 -1.51 0.00 0.00 72.50 68.16 1c9k s THR 5 CO -0.10 -0.14 0.00 0.61 -2.21 0.00 0.00 174.62 172.78 1c9k n GLY 6 N -0.73 2.10 3.80 6.08 0.00 -1.18 -0.22 105.19 115.04 1c9k n GLY 6 Ca -0.04 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 1c9k n GLY 6 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c9k s GLY 7 N 0.00 1.59 0.34 -0.02 0.00 -1.26 -1.55 107.32 106.42 1c9k s GLY 7 Ca 0.00 -0.45 -0.29 0.00 0.00 0.00 0.00 44.72 43.98 1c9k s GLY 7 CO 0.00 0.07 1.51 0.00 0.00 0.00 0.00 173.10 174.68 1c9k n ALA 8 N -3.64 2.31 -3.79 3.20 0.00 -1.26 -1.94 120.51 115.38 1c9k n ALA 8 Ca 0.07 0.36 -0.29 0.00 0.00 0.00 0.00 53.44 53.58 1c9k n ALA 8 Cb 0.59 -2.42 0.02 0.00 0.00 0.00 0.00 19.45 17.64 1c9k n ALA 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1c9k n ARG 9 N 1.19 -5.24 0.08 0.00 5.12 -1.26 -4.86 116.66 111.69 1c9k n ARG 9 Ca 0.05 0.60 0.12 0.00 -1.93 0.00 0.00 57.85 56.69 1c9k n ARG 9 Cb 0.37 -5.48 0.05 0.00 -1.16 0.00 0.00 32.46 26.25 1c9k n ARG 9 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1c9k n SER 10 N -2.74 0.77 -0.02 0.55 3.41 -0.82 -4.88 113.62 109.90 1c9k n SER 10 Ca 0.03 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 1c9k n SER 10 Cb 0.53 0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.91 1c9k n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c9k n GLY 11 N 1.25 1.09 0.12 5.00 0.00 -1.26 0.85 105.19 112.23 1c9k n GLY 11 Ca 0.01 -0.48 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 1c9k n GLY 11 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1c9k h LYS 12 N 0.00 0.13 0.82 1.61 2.10 -1.91 -2.65 116.57 116.67 1c9k h LYS 12 Ca 0.00 -0.14 -0.04 0.00 -2.00 0.00 0.00 60.65 58.47 1c9k h LYS 12 Cb 0.55 0.04 0.01 0.00 -0.90 0.00 0.00 32.23 31.93 1c9k h LYS 12 CO 0.00 0.90 -0.39 0.77 -2.00 0.00 0.00 179.45 178.73 1c9k h SER 13 N 0.07 -0.93 -0.97 7.07 0.02 -1.97 0.18 113.55 117.01 1c9k h SER 13 Ca -0.03 0.02 0.20 0.00 -0.84 0.00 0.00 61.79 61.14 1c9k h SER 13 Cb 1.49 0.24 -0.09 0.00 0.14 0.00 0.00 62.40 64.18 1c9k h SER 13 CO 0.12 -0.64 0.61 0.03 -1.14 0.00 0.00 176.83 175.82 1c9k h ARG 14 N -1.15 0.59 -0.15 3.45 -0.00 -1.99 0.10 114.38 115.23 1c9k h ARG 14 Ca -0.11 -0.04 -0.17 0.00 -0.50 0.00 0.00 59.98 59.16 1c9k h ARG 14 Cb 0.85 -0.13 -0.01 0.00 0.00 0.00 0.00 29.97 30.68 1c9k h ARG 14 CO 0.19 0.39 -0.61 1.25 0.00 0.00 0.00 179.97 181.19 1c9k h HIS 15 N 0.61 0.64 0.83 3.04 6.17 -1.08 0.68 115.15 126.05 1c9k h HIS 15 Ca 0.54 -0.24 -0.04 0.00 0.71 0.00 0.00 60.37 61.33 1c9k h HIS 15 Cb 1.04 -0.11 0.01 0.00 2.52 0.00 0.00 27.41 30.87 1c9k h HIS 15 CO -0.00 0.98 -0.40 0.00 0.71 0.00 0.00 177.93 179.21 1c9k h ALA 16 N 0.97 -1.12 -0.63 5.26 0.00 0.15 -1.22 119.26 122.66 1c9k h ALA 16 Ca -0.01 -0.25 0.12 0.00 0.00 0.00 0.00 54.91 54.78 1c9k h ALA 16 Cb 1.16 0.43 -0.09 0.00 0.00 0.00 0.00 17.79 19.29 1c9k h ALA 16 CO 0.11 -1.10 0.15 0.93 0.00 0.00 0.00 179.25 179.34 1c9k h GLU 17 N -1.18 0.27 -0.04 0.00 5.08 -0.86 1.00 114.58 118.85 1c9k h GLU 17 Ca -0.11 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1c9k h GLU 17 Cb 0.86 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.05 1c9k h GLU 17 CO 0.19 0.18 0.06 0.00 -1.00 0.00 0.00 179.01 178.43 1c9k h ALA 18 N 1.50 1.52 0.04 3.43 0.00 -0.69 0.26 119.26 125.32 1c9k h ALA 18 Ca 0.34 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.99 1c9k h ALA 18 Cb 0.51 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.31 1c9k h ALA 18 CO -0.42 -0.08 -1.06 -0.07 0.00 0.00 0.00 179.25 177.63 1c9k h LEU 19 N 0.00 0.62 0.27 0.00 4.07 0.22 -3.29 115.31 117.20 1c9k h LEU 19 Ca 0.02 -0.53 -0.01 0.00 0.08 0.00 0.00 57.88 57.43 1c9k h LEU 19 Cb 0.13 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.68 1c9k h LEU 19 CO -0.00 1.35 -0.13 0.40 -1.08 0.00 0.00 178.44 178.98 1c9k h ILE 20 N 0.23 0.74 0.00 1.22 1.08 0.68 -3.49 117.51 117.96 1c9k h ILE 20 Ca -0.11 -0.02 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1c9k h ILE 20 Cb 1.72 0.76 0.00 0.00 -3.07 0.00 0.00 36.82 36.22 1c9k h ILE 20 CO 0.19 0.01 0.00 0.61 -0.69 0.00 0.00 178.15 178.26 1c9k n GLY 21 N -1.21 0.97 0.00 5.37 0.00 -0.01 -4.21 105.19 106.10 1c9k n GLY 21 Ca -0.10 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1c9k n GLY 21 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1c9k n ASP 22 N 3.71 0.00 -2.13 1.61 5.68 -1.26 -4.95 116.55 119.21 1c9k n ASP 22 Ca 0.00 0.46 -0.02 0.00 -0.50 0.00 0.00 54.79 54.73 1c9k n ASP 22 Cb 0.00 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 1c9k n ASP 22 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1c9k n ALA 23 N -0.69 -3.38 -0.05 2.12 0.00 -1.26 -4.81 120.51 112.44 1c9k n ALA 23 Ca 0.00 1.08 -0.01 0.00 0.00 0.00 0.00 53.44 54.51 1c9k n ALA 23 Cb 0.00 -2.12 -0.01 0.00 0.00 0.00 0.00 19.45 17.32 1c9k n ALA 23 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1c9k n PRO 24 N 0.80 -0.06 -4.87 0.00 -0.05 -1.26 -4.35 135.00 125.21 1c9k n PRO 24 Ca -0.18 0.56 -0.33 0.00 -0.05 0.00 0.00 63.50 63.51 1c9k n PRO 24 Cb 0.27 -0.84 -0.14 0.00 -0.05 0.00 0.00 33.50 32.74 1c9k n PRO 24 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 175.50 176.59 1c9k s GLN 25 N -3.58 2.88 -0.05 0.54 1.03 -1.26 -4.98 119.66 114.24 1c9k s GLN 25 Ca -0.02 -0.71 -0.01 0.00 0.04 0.00 0.00 55.36 54.67 1c9k s GLN 25 Cb 0.01 -2.47 0.03 0.00 0.03 0.00 0.00 33.01 30.61 1c9k s GLN 25 CO 0.08 0.43 0.01 0.08 -2.54 0.00 0.00 175.29 173.35 1c9k s VAL 26 N -0.23 0.22 -0.26 3.63 1.01 -1.26 -1.33 120.40 122.18 1c9k s VAL 26 Ca 0.01 0.14 -0.10 0.00 0.00 0.00 0.00 61.98 62.02 1c9k s VAL 26 Cb -0.13 -0.36 -0.05 0.00 0.00 0.00 0.00 36.38 35.84 1c9k s VAL 26 CO 0.03 0.20 0.16 -0.22 0.00 0.00 0.00 175.10 175.27 1c9k s LEU 27 N 1.51 3.98 -0.28 3.92 2.96 0.20 -0.50 118.68 130.47 1c9k s LEU 27 Ca -0.03 0.01 -0.08 0.00 -0.22 0.00 0.00 54.13 53.81 1c9k s LEU 27 Cb -0.13 -2.09 -0.02 0.00 0.50 0.00 0.00 46.19 44.45 1c9k s LEU 27 CO -0.03 -0.00 0.11 -0.47 -1.32 0.00 0.00 176.35 174.64 1c9k s TYR 28 N 1.47 3.14 -0.47 5.38 6.14 -0.47 -0.71 117.35 131.82 1c9k s TYR 28 Ca 0.07 -0.45 -0.12 0.00 0.64 0.00 0.00 57.07 57.21 1c9k s TYR 28 Cb -0.15 -2.30 0.10 0.00 0.42 0.00 0.00 41.96 40.03 1c9k s TYR 28 CO 0.08 -0.39 0.37 0.42 0.64 0.00 0.00 175.55 176.67 1c9k s ILE 29 N 1.62 4.69 -0.80 3.14 1.01 0.54 -1.14 121.20 130.26 1c9k s ILE 29 Ca 0.06 -1.43 -0.13 0.00 0.00 0.00 0.00 60.65 59.15 1c9k s ILE 29 Cb -0.16 -3.93 0.21 0.00 0.01 0.00 0.00 42.46 38.59 1c9k s ILE 29 CO 0.05 -0.67 0.73 0.00 0.00 0.00 0.00 174.94 175.05 1c9k s ALA 30 N 1.50 4.02 0.32 9.38 0.00 -1.24 0.32 121.76 136.07 1c9k s ALA 30 Ca 0.04 -3.31 0.31 0.00 0.00 0.00 0.00 51.96 49.00 1c9k s ALA 30 Cb -0.26 -3.41 1.49 0.00 0.00 0.00 0.00 23.12 20.94 1c9k s ALA 30 CO 0.03 -2.26 2.05 1.79 0.00 0.00 0.00 175.76 177.37 1c9k h THR 31 N 4.85 0.33 -3.99 0.00 1.35 -1.20 -3.47 112.91 110.78 1c9k h THR 31 Ca 0.09 -0.55 -0.55 0.00 -0.55 0.00 0.00 66.41 64.85 1c9k h THR 31 Cb 1.03 1.41 0.13 0.00 -1.73 0.00 0.00 68.15 68.99 1c9k h THR 31 CO 0.75 0.09 0.69 -1.54 -0.25 0.00 0.00 175.52 175.26 1c9k n SER 32 N -3.37 3.23 -4.80 5.36 3.41 -1.26 -4.72 113.62 111.48 1c9k n SER 32 Ca -0.01 1.09 -0.37 0.00 -0.26 0.00 0.00 58.87 59.33 1c9k n SER 32 Cb 0.26 -1.60 -0.07 0.00 -0.26 0.00 0.00 64.21 62.54 1c9k n SER 32 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1c9k s GLN 33 N -2.54 3.92 -0.84 4.33 -0.21 -1.26 -5.00 119.66 118.06 1c9k s GLN 33 Ca 0.63 0.05 -0.25 0.00 0.02 0.00 0.00 55.36 55.82 1c9k s GLN 33 Cb -0.44 -3.31 0.05 0.00 1.00 0.00 0.00 33.01 30.31 1c9k s GLN 33 CO 0.56 0.51 1.31 0.42 -2.12 0.00 0.00 175.29 175.97 1c9k s ILE 34 N -0.34 3.89 -1.25 1.08 1.09 -1.26 -5.19 121.20 119.22 1c9k s ILE 34 Ca 0.16 -0.17 0.12 0.00 -1.10 0.00 0.00 60.65 59.66 1c9k s ILE 34 Cb -0.13 -4.94 0.24 0.00 -1.06 0.00 0.00 42.46 36.57 1c9k s ILE 34 CO 0.05 -1.84 1.12 0.18 -0.10 0.00 0.00 174.94 174.36 1c9k n LEU 35 N 8.93 2.62 0.00 2.97 7.99 -1.26 -5.35 117.00 132.89 1c9k n LEU 35 Ca 0.14 -1.58 0.00 0.00 -0.01 0.00 0.00 56.01 54.56 1c9k n LEU 35 Cb 0.49 -0.15 0.00 0.00 -0.11 0.00 0.00 43.42 43.65 1c9k n LEU 35 CO 0.68 0.60 0.00 0.00 -1.51 0.00 0.00 177.39 177.16 1c9k n HIS 45 N 0.66 0.00 0.02 -1.77 -0.00 -1.26 -5.32 115.22 107.56 1c9k n HIS 45 Ca 0.11 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.63 1c9k n HIS 45 Cb 0.39 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 30.24 1c9k n HIS 45 CO 0.00 0.00 0.00 1.12 -0.00 0.00 0.00 176.34 177.46 1c9k h HIS 46 N 0.00 0.42 0.00 -1.40 -0.00 -2.02 -3.09 115.15 109.06 1c9k h HIS 46 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 60.37 60.06 1c9k h HIS 46 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 27.39 1c9k h HIS 46 CO 0.00 1.30 0.25 0.87 -0.00 0.00 0.00 177.93 180.35 1c9k h LYS 47 N -0.49 0.00 0.13 5.12 1.57 -2.04 -1.22 116.57 119.65 1c9k h LYS 47 Ca -0.15 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.30 1c9k h LYS 47 Cb 1.54 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.84 1c9k h LYS 47 CO 0.10 0.00 -1.73 -0.44 -0.57 0.00 0.00 179.45 176.81 1c9k h ASP 48 N 0.00 0.44 1.29 0.86 3.45 -2.01 -3.35 116.42 117.10 1c9k h ASP 48 Ca 0.00 -0.89 0.00 0.00 0.43 0.00 0.00 57.03 56.57 1c9k h ASP 48 Cb 0.50 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 39.13 1c9k h ASP 48 CO 0.00 1.76 0.00 1.23 -1.57 0.00 0.00 179.24 180.66 1c9k h GLY 49 N 0.57 0.00 -4.79 2.75 0.00 -1.17 -3.45 103.07 96.98 1c9k h GLY 49 Ca -0.37 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.43 1c9k h GLY 49 CO 0.08 0.00 0.97 -1.60 0.00 0.00 0.00 176.54 175.99 1c9k s ARG 50 N -3.26 4.19 0.51 4.80 3.52 -0.71 -4.93 118.95 123.08 1c9k s ARG 50 Ca 0.07 2.41 -0.22 0.00 -0.13 0.00 0.00 55.73 57.86 1c9k s ARG 50 Cb 0.10 -3.37 -0.07 0.00 -1.56 0.00 0.00 34.95 30.04 1c9k s ARG 50 CO 0.54 -0.70 1.09 -2.30 -0.81 0.00 0.00 175.30 173.12 1c9k n PRO 51 N 4.81 1.33 -0.01 5.12 -0.02 -1.26 -4.85 135.00 140.12 1c9k n PRO 51 Ca 0.15 0.49 0.07 0.00 -2.02 0.00 0.00 63.50 62.19 1c9k n PRO 51 Cb 0.39 -2.23 0.47 0.00 -0.02 0.00 0.00 33.50 32.11 1c9k n PRO 51 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1c9k h ALA 52 N 1.22 1.84 -0.81 3.55 0.00 -1.94 -2.69 119.26 120.44 1c9k h ALA 52 Ca -0.48 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 1c9k h ALA 52 Cb 1.33 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1c9k h ALA 52 CO 0.55 0.10 0.43 1.12 0.00 0.00 0.00 179.25 181.45 1c9k h HIS 53 N 0.45 1.12 -3.99 0.00 2.07 -1.98 -3.44 115.15 109.39 1c9k h HIS 53 Ca 0.18 -0.03 -0.54 0.00 -2.85 0.00 0.00 60.37 57.13 1c9k h HIS 53 Cb 0.16 -0.36 0.12 0.00 2.57 0.00 0.00 27.41 29.90 1c9k h HIS 53 CO -0.00 0.79 0.71 -1.58 -3.07 0.00 0.00 177.93 174.77 1c9k s TRP 54 N -5.73 2.44 0.26 6.12 0.52 -1.01 -4.68 118.94 116.86 1c9k s TRP 54 Ca -0.12 1.26 0.05 0.00 0.02 0.00 0.00 56.10 57.31 1c9k s TRP 54 Cb 0.17 -3.93 -0.03 0.00 -1.15 0.00 0.00 33.47 28.53 1c9k s TRP 54 CO 0.82 -2.98 0.38 -0.98 0.02 0.00 0.00 176.95 174.20 1c9k s ARG 55 N -2.47 3.35 -0.04 4.98 1.70 0.34 -4.95 118.95 121.87 1c9k s ARG 55 Ca 0.61 -0.83 0.02 0.00 -0.47 0.00 0.00 55.73 55.07 1c9k s ARG 55 Cb -0.44 -2.86 0.01 0.00 -0.57 0.00 0.00 34.95 31.08 1c9k s ARG 55 CO 0.57 0.35 -0.10 0.99 -1.08 0.00 0.00 175.30 176.02 1c9k s THR 56 N -2.03 0.93 0.00 4.99 2.01 -1.26 -1.36 115.64 118.92 1c9k s THR 56 Ca 0.36 -0.41 0.00 0.00 0.31 0.00 0.00 61.69 61.96 1c9k s THR 56 Cb -0.09 -0.84 0.00 0.00 0.01 0.00 0.00 72.50 71.57 1c9k s THR 56 CO 0.29 0.30 0.00 0.00 -0.69 0.00 0.00 174.62 174.52 1c9k n ALA 57 N 3.52 0.00 -0.65 7.40 0.00 -0.29 -4.95 120.51 125.54 1c9k n ALA 57 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1c9k n ALA 57 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1c9k n ALA 57 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1c9k n ARG 61 N 0.00 0.00 -3.90 0.00 -4.01 -1.26 -3.69 116.66 103.80 1c9k n ARG 61 Ca 0.00 0.00 -0.28 0.00 -1.04 0.00 0.00 57.85 56.53 1c9k n ARG 61 Cb 0.00 -0.32 -0.01 0.00 -3.04 0.00 0.00 32.46 29.09 1c9k n ARG 61 CO 0.00 0.00 0.00 -2.39 -3.04 0.00 0.00 177.63 172.20 1c9k n HIS 62 N -0.77 -1.69 -0.31 2.89 -0.00 -1.26 -4.97 115.22 109.12 1c9k n HIS 62 Ca 0.00 0.65 0.09 0.00 -0.00 0.00 0.00 57.72 58.46 1c9k n HIS 62 Cb 0.00 -3.64 0.25 0.00 -0.00 0.00 0.00 29.99 26.60 1c9k n HIS 62 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 1c9k h LEU 63 N -1.88 0.60 -1.69 2.39 -0.00 -2.00 -2.08 115.31 110.64 1c9k h LEU 63 Ca -0.64 0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.33 1c9k h LEU 63 Cb 1.37 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 42.03 1c9k h LEU 63 CO 0.59 0.24 0.00 -2.24 -0.00 0.00 0.00 178.44 177.03 1c9k h ASP 64 N 0.66 0.00 1.48 -0.43 2.03 -1.90 0.56 116.42 118.83 1c9k h ASP 64 Ca 0.49 0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 56.72 1c9k h ASP 64 Cb 0.71 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.20 1c9k h ASP 64 CO -0.37 0.00 -0.34 0.74 -1.03 0.00 0.00 179.24 178.24 1c9k h THR 65 N 0.00 0.62 0.05 1.15 2.02 -1.78 -3.27 112.91 111.69 1c9k h THR 65 Ca 0.00 -1.74 -0.35 0.00 0.77 0.00 0.00 66.41 65.09 1c9k h THR 65 Cb 0.28 2.20 -0.05 0.00 -1.74 0.00 0.00 68.15 68.84 1c9k h THR 65 CO 0.00 0.33 -2.09 0.18 0.37 0.00 0.00 175.52 174.31 1c9k n LEU 66 N -3.23 1.82 -4.45 2.58 4.77 0.01 -4.64 117.00 113.85 1c9k n LEU 66 Ca 0.02 0.15 -0.44 0.00 -0.03 0.00 0.00 56.01 55.72 1c9k n LEU 66 Cb 0.63 -0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 1c9k n LEU 66 CO 0.38 0.69 1.02 -0.63 -1.33 0.00 0.00 177.39 177.52 1c9k s ILE 67 N -2.55 4.72 0.21 -0.08 1.01 -0.17 -4.97 121.20 119.37 1c9k s ILE 67 Ca -0.18 -1.60 0.07 0.00 0.00 0.00 0.00 60.65 58.94 1c9k s ILE 67 Cb 0.07 -4.79 -0.04 0.00 0.01 0.00 0.00 42.46 37.71 1c9k s ILE 67 CO 0.76 -1.53 0.09 -0.89 0.00 0.00 0.00 174.94 173.37 1c9k s THR 68 N 2.71 4.05 -0.14 2.92 2.01 -1.26 -4.66 115.64 121.26 1c9k s THR 68 Ca 0.34 -1.44 0.20 0.00 0.31 0.00 0.00 61.69 61.09 1c9k s THR 68 Cb -0.05 -3.12 0.19 0.00 0.01 0.00 0.00 72.50 69.53 1c9k s THR 68 CO -0.09 -0.24 1.61 0.00 -0.69 0.00 0.00 174.62 175.21 1c9k h ALA 69 N 2.11 0.86 -0.78 7.40 0.00 -1.88 -3.31 119.26 123.66 1c9k h ALA 69 Ca -0.47 -0.26 -0.41 0.00 0.00 0.00 0.00 54.91 53.76 1c9k h ALA 69 Cb 1.22 -0.05 -0.24 0.00 0.00 0.00 0.00 17.79 18.73 1c9k h ALA 69 CO 0.60 0.36 0.53 -0.40 0.00 0.00 0.00 179.25 180.34 1c9k n ASP 70 N -3.23 3.89 -4.91 0.00 5.75 -1.26 -4.47 116.55 112.32 1c9k n ASP 70 Ca 0.02 -3.27 -0.21 0.00 -0.01 0.00 0.00 54.79 51.32 1c9k n ASP 70 Cb 0.59 -0.79 0.07 0.00 -1.03 0.00 0.00 41.12 39.96 1c9k n ASP 70 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1c9k s LEU 71 N -2.60 3.13 0.19 -2.12 1.02 -1.25 -5.08 118.68 111.98 1c9k s LEU 71 Ca 0.45 -0.60 -0.05 0.00 0.02 0.00 0.00 54.13 53.95 1c9k s LEU 71 Cb 0.37 -1.92 -0.06 0.00 0.02 0.00 0.00 46.19 44.61 1c9k s LEU 71 CO 0.08 -1.44 0.44 0.00 0.02 0.00 0.00 176.35 175.44 1c9k s ALA 72 N -2.80 3.73 0.29 4.21 0.00 -1.26 -4.58 121.76 121.35 1c9k s ALA 72 Ca 0.62 -0.55 0.02 0.00 0.00 0.00 0.00 51.96 52.05 1c9k s ALA 72 Cb -0.06 -2.19 0.43 0.00 0.00 0.00 0.00 23.12 21.30 1c9k s ALA 72 CO 0.40 0.53 1.75 -1.35 0.00 0.00 0.00 175.76 177.09 1c9k h PRO 73 N 2.45 0.53 0.00 0.00 0.11 -1.93 -2.20 132.00 130.96 1c9k h PRO 73 Ca -0.47 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 65.47 1c9k h PRO 73 Cb 1.17 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1c9k h PRO 73 CO 0.70 0.69 0.00 -0.44 -0.21 0.00 0.00 178.00 178.74 1c9k h ASP 74 N 0.48 0.00 -4.27 -2.05 3.32 -1.94 -3.35 116.42 108.62 1c9k h ASP 74 Ca 0.08 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.62 1c9k h ASP 74 Cb 0.59 0.00 0.13 0.00 0.22 0.00 0.00 39.33 40.27 1c9k h ASP 74 CO 0.04 0.00 0.34 -1.81 -1.72 0.00 0.00 179.24 176.09 1c9k s ASP 75 N -4.82 4.63 -0.07 6.45 1.01 -0.84 -4.17 116.67 118.85 1c9k s ASP 75 Ca 0.08 1.92 -0.07 0.00 0.71 0.00 0.00 52.55 55.20 1c9k s ASP 75 Cb 0.10 -2.54 0.02 0.00 1.01 0.00 0.00 42.92 41.52 1c9k s ASP 75 CO 0.57 -1.95 0.20 0.00 0.21 0.00 0.00 175.17 174.19 1c9k s ALA 76 N -2.66 -0.49 -0.07 5.23 0.00 -0.44 -1.14 121.76 122.19 1c9k s ALA 76 Ca 0.64 0.54 0.05 0.00 0.00 0.00 0.00 51.96 53.19 1c9k s ALA 76 Cb -0.19 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 1c9k s ALA 76 CO 0.51 -0.10 -0.23 0.42 0.00 0.00 0.00 175.76 176.36 1c9k s ILE 77 N 0.07 2.22 -0.20 0.00 1.01 0.20 -0.63 121.20 123.88 1c9k s ILE 77 Ca -0.00 -1.00 0.01 0.00 0.00 0.00 0.00 60.65 59.66 1c9k s ILE 77 Cb -0.02 -1.82 0.04 0.00 0.01 0.00 0.00 42.46 40.67 1c9k s ILE 77 CO 0.00 0.57 -0.13 -0.22 0.00 0.00 0.00 174.94 175.16 1c9k s LEU 78 N -0.13 2.37 -0.19 2.97 0.20 0.11 -0.54 118.68 123.46 1c9k s LEU 78 Ca -0.04 -0.87 -0.05 0.00 0.69 0.00 0.00 54.13 53.86 1c9k s LEU 78 Cb -0.14 -1.33 -0.03 0.00 -0.43 0.00 0.00 46.19 44.26 1c9k s LEU 78 CO 0.04 -0.11 0.00 -0.22 -0.29 0.00 0.00 176.35 175.77 1c9k s LEU 79 N 1.33 3.33 -0.15 -0.68 0.20 -0.85 0.20 118.68 122.07 1c9k s LEU 79 Ca -0.00 -0.15 -0.04 0.00 0.69 0.00 0.00 54.13 54.63 1c9k s LEU 79 Cb -0.16 -1.84 0.05 0.00 -0.43 0.00 0.00 46.19 43.82 1c9k s LEU 79 CO -0.09 0.09 0.07 -0.70 -0.29 0.00 0.00 176.35 175.43 1c9k s GLU 80 N 0.82 0.22 0.29 1.98 2.12 0.98 -1.78 118.70 123.33 1c9k s GLU 80 Ca 0.01 -0.08 0.02 0.00 0.36 0.00 0.00 54.97 55.28 1c9k s GLU 80 Cb -0.14 -1.63 -0.06 0.00 0.26 0.00 0.00 34.13 32.56 1c9k s GLU 80 CO 0.02 -0.58 0.08 0.00 -0.54 0.00 0.00 175.26 174.24 1c9k h ILE 82 N 2.25 1.28 0.41 0.00 1.08 0.11 -2.99 117.51 119.64 1c9k h ILE 82 Ca -0.39 -1.34 -0.01 0.00 -0.39 0.00 0.00 64.86 62.72 1c9k h ILE 82 Cb 1.25 1.40 -0.01 0.00 -3.07 0.00 0.00 36.82 36.39 1c9k h ILE 82 CO 0.65 0.42 -0.29 0.74 -0.69 0.00 0.00 178.15 178.98 1c9k h THR 83 N 0.43 0.40 -0.49 -0.27 2.02 -1.94 0.12 112.91 113.19 1c9k h THR 83 Ca 0.06 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.32 1c9k h THR 83 Cb 0.72 0.40 -0.07 0.00 -1.74 0.00 0.00 68.15 67.47 1c9k h THR 83 CO 0.06 0.00 0.07 0.74 0.37 0.00 0.00 175.52 176.75 1c9k h THR 84 N -0.68 0.69 -0.95 3.16 2.02 -1.94 0.33 112.91 115.54 1c9k h THR 84 Ca -0.04 -0.07 0.02 0.00 0.77 0.00 0.00 66.41 67.10 1c9k h THR 84 Cb 0.58 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.42 1c9k h THR 84 CO 0.02 0.04 0.62 -0.03 0.37 0.00 0.00 175.52 176.54 1c9k h MET 85 N 0.19 1.20 -0.29 6.66 -1.53 -1.41 0.64 114.93 120.38 1c9k h MET 85 Ca 0.24 -0.07 -0.02 0.00 -3.44 0.00 0.00 59.70 56.41 1c9k h MET 85 Cb 0.34 -0.27 -0.01 0.00 -0.55 0.00 0.00 31.60 31.11 1c9k h MET 85 CO -0.34 0.79 0.11 0.28 0.14 0.00 0.00 176.91 177.89 1c9k h VAL 86 N 1.23 1.18 -0.21 -5.77 2.07 0.16 -2.84 116.25 112.07 1c9k h VAL 86 Ca 0.37 -0.57 0.02 0.00 0.82 0.00 0.00 66.70 67.33 1c9k h VAL 86 Cb -0.06 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1c9k h VAL 86 CO -0.10 0.19 0.08 0.74 0.02 0.00 0.00 177.57 178.50 1c9k h THR 87 N 0.32 0.97 -0.88 2.57 2.02 0.77 -2.37 112.91 116.31 1c9k h THR 87 Ca 0.10 -0.06 0.09 0.00 0.77 0.00 0.00 66.41 67.31 1c9k h THR 87 Cb 0.20 0.77 -0.07 0.00 -1.74 0.00 0.00 68.15 67.30 1c9k h THR 87 CO -0.01 0.03 0.53 0.78 0.37 0.00 0.00 175.52 177.23 1c9k h ASN 88 N 0.18 0.78 -0.45 4.18 2.35 -0.92 -2.58 115.58 119.12 1c9k h ASN 88 Ca 0.09 0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.82 1c9k h ASN 88 Cb 0.04 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1c9k h ASN 88 CO -0.08 0.45 0.07 -0.07 -1.65 0.00 0.00 177.43 176.15 1c9k h LEU 89 N 0.89 0.72 0.31 1.61 3.38 -1.28 -1.28 115.31 119.66 1c9k h LEU 89 Ca 0.42 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1c9k h LEU 89 Cb 0.35 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1c9k h LEU 89 CO -0.24 0.80 -0.23 -0.07 0.09 0.00 0.00 178.44 178.79 1c9k h LEU 90 N 0.62 -0.59 -0.45 1.67 3.38 -1.03 0.63 115.31 119.54 1c9k h LEU 90 Ca 0.14 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.24 1c9k h LEU 90 Cb 0.38 0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.24 1c9k h LEU 90 CO 0.01 -0.35 -0.05 -0.26 0.09 0.00 0.00 178.44 177.88 1c9k h PHE 91 N -0.54 -0.12 -0.35 1.13 -1.00 -1.52 2.18 116.94 116.72 1c9k h PHE 91 Ca -0.02 0.04 0.04 0.00 2.81 0.00 0.00 57.97 60.84 1c9k h PHE 91 Cb 0.47 0.12 -0.04 0.00 3.61 0.00 0.00 35.95 40.11 1c9k h PHE 91 CO -0.12 -0.14 0.10 0.00 -1.61 0.00 0.00 178.31 176.54 1c9k h ALA 92 N 1.42 0.39 -0.10 2.45 0.00 -0.93 -0.06 119.26 122.43 1c9k h ALA 92 Ca 0.22 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 1c9k h ALA 92 Cb 0.33 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1c9k h ALA 92 CO -0.41 -0.30 -0.21 -0.07 0.00 0.00 0.00 179.25 178.26 1c9k h LEU 93 N 0.24 0.16 0.00 0.00 4.07 0.19 -3.51 115.31 116.47 1c9k h LEU 93 Ca 0.16 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.08 1c9k h LEU 93 Cb 0.16 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 41.85 1c9k h LEU 93 CO -0.19 0.38 0.00 0.61 -1.08 0.00 0.00 178.44 178.17 1c9k n GLY 94 N -0.75 -2.76 3.50 0.83 0.00 0.72 -5.06 105.19 101.68 1c9k n GLY 94 Ca -0.01 -1.32 -0.43 0.00 0.00 0.00 0.00 46.02 44.26 1c9k n GLY 94 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1c9k n ASP 98 N -0.60 -0.12 0.00 1.61 2.03 -1.26 -4.94 116.55 113.27 1c9k n ASP 98 Ca 0.00 1.02 0.01 0.00 0.52 0.00 0.00 54.79 56.33 1c9k n ASP 98 Cb 0.00 -1.17 0.05 0.00 -0.72 0.00 0.00 41.12 39.28 1c9k n ASP 98 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1c9k n PRO 99 N 0.61 0.27 0.02 -0.67 -0.02 -1.26 -2.65 135.00 131.30 1c9k n PRO 99 Ca 0.12 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.68 1c9k n PRO 99 Cb 0.36 -1.09 -0.11 0.00 -0.02 0.00 0.00 33.50 32.64 1c9k n PRO 99 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1c9k n GLU 100 N -0.59 0.64 0.00 -0.52 4.71 -1.26 -3.83 120.64 119.79 1c9k n GLU 100 Ca 0.01 -0.05 0.13 0.00 -0.01 0.00 0.00 57.16 57.24 1c9k n GLU 100 Cb 0.01 -1.64 0.25 0.00 -1.01 0.00 0.00 31.44 29.04 1c9k n GLU 100 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1c9k n GLN 101 N -2.48 1.92 -1.86 3.49 10.64 -1.09 -4.97 117.38 123.04 1c9k n GLN 101 Ca -0.05 -1.44 -0.41 0.00 -1.83 0.00 0.00 57.00 53.26 1c9k n GLN 101 Cb 0.63 -1.47 -0.01 0.00 -0.86 0.00 0.00 30.24 28.53 1c9k n GLN 101 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 1c9k s TRP 102 N -2.07 2.79 -1.09 2.61 0.52 -1.25 -4.96 118.94 115.49 1c9k s TRP 102 Ca 0.30 0.96 -0.07 0.00 0.02 0.00 0.00 56.10 57.31 1c9k s TRP 102 Cb 0.20 -3.98 0.28 0.00 -1.15 0.00 0.00 33.47 28.82 1c9k s TRP 102 CO 0.35 -3.15 1.18 -3.47 0.02 0.00 0.00 176.95 171.88 1c9k n ASP 103 N 1.76 5.63 -0.62 2.95 4.64 -1.26 -4.88 116.55 124.78 1c9k n ASP 103 Ca 0.06 -3.14 0.49 0.00 -1.38 0.00 0.00 54.79 50.81 1c9k n ASP 103 Cb 0.39 -1.32 0.80 0.00 -1.04 0.00 0.00 41.12 39.95 1c9k n ASP 103 CO 0.00 0.00 0.00 1.88 -0.82 0.00 0.00 177.20 178.26 1c9k h TYR 104 N 6.26 0.00 -0.21 -0.67 -1.99 -1.96 -0.18 116.97 118.22 1c9k h TYR 104 Ca 0.18 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.88 1c9k h TYR 104 Cb 0.80 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.52 1c9k h TYR 104 CO 0.81 0.00 -0.01 0.00 -0.00 0.00 0.00 178.16 178.96 1c9k h ALA 105 N 1.07 0.29 -0.27 3.88 0.00 -2.00 -1.87 119.26 120.35 1c9k h ALA 105 Ca 0.85 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 55.43 1c9k h ALA 105 Cb 3.45 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 21.15 1c9k h ALA 105 CO -0.01 0.02 -0.30 0.00 0.00 0.00 0.00 179.25 178.96 1c9k h ALA 106 N 0.78 0.97 -0.25 0.00 0.00 -1.46 -2.90 119.26 116.40 1c9k h ALA 106 Ca 0.06 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1c9k h ALA 106 Cb 0.42 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1c9k h ALA 106 CO 0.01 0.60 0.10 0.52 0.00 0.00 0.00 179.25 180.49 1c9k h MET 107 N 0.48 0.37 0.19 0.00 2.07 -1.46 -1.95 114.93 114.63 1c9k h MET 107 Ca 0.06 -0.06 0.01 0.00 -2.07 0.00 0.00 59.70 57.64 1c9k h MET 107 Cb 0.76 -0.06 -0.04 0.00 -1.87 0.00 0.00 31.60 30.40 1c9k h MET 107 CO 0.06 0.40 -0.36 1.49 1.07 0.00 0.00 176.91 179.57 1c9k h GLU 108 N 0.25 -0.61 -0.42 1.72 4.81 -1.19 -0.76 114.58 118.38 1c9k h GLU 108 Ca 0.08 0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.44 1c9k h GLU 108 Cb 0.17 0.14 -0.09 0.00 0.63 0.00 0.00 28.75 29.59 1c9k h GLU 108 CO -0.01 -0.41 -0.27 0.00 -0.73 0.00 0.00 179.01 177.60 1c9k h ARG 109 N -0.63 -0.18 -0.38 1.92 3.08 -1.33 0.28 114.38 117.14 1c9k h ARG 109 Ca 0.01 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.15 1c9k h ARG 109 Cb 0.63 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.66 1c9k h ARG 109 CO -0.17 -0.12 -0.01 0.00 -1.07 0.00 0.00 179.97 178.61 1c9k h ALA 110 N 0.98 0.34 -0.95 0.04 0.00 -1.23 0.24 119.26 118.68 1c9k h ALA 110 Ca 0.19 0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.34 1c9k h ALA 110 Cb 0.50 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.41 1c9k h ALA 110 CO -0.53 -0.40 0.61 0.82 0.00 0.00 0.00 179.25 179.75 1c9k h ILE 111 N 0.10 0.91 -0.65 0.00 2.04 0.49 0.12 117.51 120.52 1c9k h ILE 111 Ca 0.19 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.69 1c9k h ILE 111 Cb 0.26 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.25 1c9k h ILE 111 CO -0.32 0.16 0.19 -0.78 0.00 0.00 0.00 178.15 177.41 1c9k h ASP 112 N 0.89 0.93 0.05 1.72 3.58 0.27 -1.57 116.42 122.30 1c9k h ASP 112 Ca 0.47 -0.16 0.03 0.00 0.42 0.00 0.00 57.03 57.78 1c9k h ASP 112 Cb 0.54 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 41.30 1c9k h ASP 112 CO -0.23 0.87 -0.29 0.44 -2.88 0.00 0.00 179.24 177.15 1c9k h ASP 113 N 0.96 -0.86 -0.53 2.28 3.45 0.86 0.62 116.42 123.20 1c9k h ASP 113 Ca 0.21 0.11 0.08 0.00 0.43 0.00 0.00 57.03 57.86 1c9k h ASP 113 Cb 0.29 0.34 -0.07 0.00 -0.56 0.00 0.00 39.33 39.33 1c9k h ASP 113 CO -0.01 -0.37 0.16 -0.33 -1.57 0.00 0.00 179.24 177.13 1c9k h GLU 114 N -0.47 0.32 -0.20 3.56 4.39 -1.15 -1.38 114.58 119.65 1c9k h GLU 114 Ca 0.05 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.64 1c9k h GLU 114 Cb 0.53 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1c9k h GLU 114 CO -0.21 0.21 -0.27 0.82 -1.16 0.00 0.00 179.01 178.40 1c9k h ILE 115 N 0.33 1.26 -0.20 3.13 1.08 -0.96 -1.07 117.51 121.07 1c9k h ILE 115 Ca 0.27 -1.25 -0.07 0.00 -0.39 0.00 0.00 64.86 63.42 1c9k h ILE 115 Cb 0.33 1.41 -0.01 0.00 -3.07 0.00 0.00 36.82 35.47 1c9k h ILE 115 CO -0.29 0.39 -0.20 1.56 -0.69 0.00 0.00 178.15 178.91 1c9k h GLN 116 N 0.34 0.34 -0.29 2.37 1.08 0.15 -0.18 115.11 118.92 1c9k h GLN 116 Ca 0.05 -0.11 -0.07 0.00 -1.45 0.00 0.00 58.65 57.07 1c9k h GLN 116 Cb 0.65 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 1c9k h GLN 116 CO 0.05 0.53 -0.10 0.82 -0.95 0.00 0.00 178.83 179.18 1c9k h ILE 117 N 0.31 1.29 -0.15 2.54 2.04 -0.62 -0.21 117.51 122.70 1c9k h ILE 117 Ca 0.05 -1.16 -0.00 0.00 1.00 0.00 0.00 64.86 64.75 1c9k h ILE 117 Cb 0.53 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 1c9k h ILE 117 CO 0.04 0.37 0.08 0.25 0.00 0.00 0.00 178.15 178.88 1c9k h LEU 118 N 0.34 0.20 -0.20 1.44 5.85 -0.90 -1.16 115.31 120.88 1c9k h LEU 118 Ca 0.07 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1c9k h LEU 118 Cb 0.60 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.53 1c9k h LEU 118 CO 0.03 0.24 -0.12 0.40 -0.34 0.00 0.00 178.44 178.66 1c9k h ILE 119 N 0.13 0.64 -0.28 4.05 2.04 -0.91 0.23 117.51 123.42 1c9k h ILE 119 Ca 0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.98 1c9k h ILE 119 Cb 0.09 0.64 -0.08 0.00 -0.74 0.00 0.00 36.82 36.74 1c9k h ILE 119 CO -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 178.15 177.81 1c9k h ALA 120 N 1.05 -0.29 0.25 1.87 0.00 -0.71 0.70 119.26 122.13 1c9k h ALA 120 Ca 0.11 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1c9k h ALA 120 Cb 0.27 0.68 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 1c9k h ALA 120 CO -0.27 -0.77 -0.43 0.00 0.00 0.00 0.00 179.25 177.78 1c9k h ALA 121 N 0.57 -0.85 -0.85 0.00 0.00 -0.74 -1.17 119.26 116.22 1c9k h ALA 121 Ca 0.13 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 55.06 1c9k h ALA 121 Cb 0.55 0.69 -0.06 0.00 0.00 0.00 0.00 17.79 18.96 1c9k h ALA 121 CO -0.46 -1.03 0.55 0.00 0.00 0.00 0.00 179.25 178.31 1c9k h GLN 123 N 0.70 -0.15 -0.04 0.00 7.50 0.16 -2.72 115.11 120.55 1c9k h GLN 123 Ca 0.41 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.58 1c9k h GLN 123 Cb 0.62 0.03 0.00 0.00 0.05 0.00 0.00 27.48 28.18 1c9k h GLN 123 CO -0.18 -0.10 0.00 2.89 -1.50 0.00 0.00 178.83 179.94 1c9k n ARG 124 N -5.27 1.43 -3.16 1.46 0.00 -0.72 -4.88 116.66 105.53 1c9k n ARG 124 Ca -0.03 -0.64 -0.41 0.00 -0.00 0.00 0.00 57.85 56.77 1c9k n ARG 124 Cb 0.19 -1.44 -0.07 0.00 -0.00 0.00 0.00 32.46 31.14 1c9k n ARG 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1c9k n PRO 126 N 5.84 0.01 -2.72 0.00 -0.02 -1.26 -4.73 135.00 132.11 1c9k n PRO 126 Ca -0.02 0.32 -0.25 0.00 -2.02 0.00 0.00 63.50 61.52 1c9k n PRO 126 Cb 0.49 -1.51 0.01 0.00 -0.02 0.00 0.00 33.50 32.47 1c9k n PRO 126 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1c9k s ALA 127 N -3.01 3.51 -0.04 3.55 0.00 -1.15 -3.12 121.76 121.50 1c9k s ALA 127 Ca 0.05 -0.79 -0.30 0.00 0.00 0.00 0.00 51.96 50.92 1c9k s ALA 127 Cb 0.07 -2.41 -0.04 0.00 0.00 0.00 0.00 23.12 20.75 1c9k s ALA 127 CO 0.21 -0.50 1.21 0.21 0.00 0.00 0.00 175.76 176.88 1c9k s LYS 128 N -4.74 4.36 -0.15 0.00 2.20 -0.30 -4.89 119.74 116.22 1c9k s LYS 128 Ca 0.50 1.70 0.00 0.00 -0.36 0.00 0.00 55.97 57.81 1c9k s LYS 128 Cb -0.10 -3.54 -0.00 0.00 -1.51 0.00 0.00 37.83 32.68 1c9k s LYS 128 CO 0.42 -0.43 -0.16 0.08 -0.36 0.00 0.00 175.35 174.90 1c9k s VAL 129 N 2.11 2.68 -0.22 4.02 1.01 -1.26 0.62 120.40 129.36 1c9k s VAL 129 Ca 0.57 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.78 1c9k s VAL 129 Cb -0.25 -2.12 0.05 0.00 0.00 0.00 0.00 36.38 34.06 1c9k s VAL 129 CO 0.23 0.52 -0.06 -0.69 0.00 0.00 0.00 175.10 175.10 1c9k s VAL 130 N 0.70 1.47 -0.20 2.92 1.01 0.30 -0.16 120.40 126.44 1c9k s VAL 130 Ca -0.07 -1.08 -0.11 0.00 0.00 0.00 0.00 61.98 60.72 1c9k s VAL 130 Cb -0.16 -1.69 -0.05 0.00 0.00 0.00 0.00 36.38 34.48 1c9k s VAL 130 CO 0.02 -0.01 0.17 -0.76 0.00 0.00 0.00 175.10 174.51 1c9k s LEU 131 N 1.44 4.20 -0.16 3.92 1.43 0.13 -2.01 118.68 127.64 1c9k s LEU 131 Ca -0.04 0.28 -0.04 0.00 -1.03 0.00 0.00 54.13 53.30 1c9k s LEU 131 Cb -0.18 -2.16 -0.03 0.00 0.03 0.00 0.00 46.19 43.86 1c9k s LEU 131 CO -0.07 0.15 -0.03 -0.69 0.23 0.00 0.00 176.35 175.93 1c9k s VAL 132 N 0.48 3.91 0.31 -1.59 1.01 -0.73 -1.14 120.40 122.66 1c9k s VAL 132 Ca 0.10 -0.35 0.04 0.00 0.00 0.00 0.00 61.98 61.77 1c9k s VAL 132 Cb -0.12 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 1c9k s VAL 132 CO 0.00 0.49 0.18 0.28 0.00 0.00 0.00 175.10 176.05 1c9k s THR 133 N 0.39 0.25 0.17 3.92 -1.32 -0.26 0.15 115.64 118.93 1c9k s THR 133 Ca -0.04 -2.00 0.10 0.00 -1.21 0.00 0.00 61.69 58.55 1c9k s THR 133 Cb -0.14 -2.49 -0.04 0.00 -1.51 0.00 0.00 72.50 68.32 1c9k s THR 133 CO 0.03 0.00 -0.23 0.20 -2.21 0.00 0.00 174.62 172.41 1c9k s ASN 134 N -3.38 3.17 -0.31 8.08 -0.87 -1.26 -3.12 114.94 117.25 1c9k s ASN 134 Ca 0.36 -0.82 -0.18 0.00 -1.57 0.00 0.00 52.86 50.65 1c9k s ASN 134 Cb 0.04 -0.22 -0.01 0.00 -0.02 0.00 0.00 41.25 41.04 1c9k s ASN 134 CO 0.19 0.10 0.49 -1.61 -2.57 0.00 0.00 177.10 173.70 1c9k s GLU 135 N -2.49 3.80 -0.07 -0.60 0.41 -0.59 -4.75 118.70 114.40 1c9k s GLU 135 Ca 0.17 0.00 0.11 0.00 -0.41 0.00 0.00 54.97 54.84 1c9k s GLU 135 Cb -0.08 -3.74 0.17 0.00 -1.78 0.00 0.00 34.13 28.69 1c9k s GLU 135 CO 0.08 -0.51 1.07 1.33 -0.49 0.00 0.00 175.26 176.74 1c9k n VAL 136 N 5.31 1.42 -2.58 2.63 0.24 -1.26 -4.53 118.33 119.55 1c9k n VAL 136 Ca -0.05 -1.64 -0.00 0.00 -2.04 0.00 0.00 64.34 60.61 1c9k n VAL 136 Cb 0.49 0.09 0.05 0.00 -1.47 0.00 0.00 33.84 33.00 1c9k n VAL 136 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1c9k n GLY 137 N -0.99 2.10 1.13 7.63 0.00 -1.26 -4.68 105.19 109.12 1c9k n GLY 137 Ca 0.09 -1.14 0.12 0.00 0.00 0.00 0.00 46.02 45.09 1c9k n GLY 137 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1c9k n MET 138 N -0.26 2.46 -0.82 1.61 1.56 -1.26 -4.90 117.12 115.51 1c9k n MET 138 Ca 0.11 -2.22 0.00 0.00 -0.27 0.00 0.00 57.70 55.32 1c9k n MET 138 Cb 0.93 -1.51 0.00 0.00 2.15 0.00 0.00 33.22 34.79 1c9k n MET 138 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1c9k n GLY 139 N 1.49 2.02 3.87 -5.12 0.00 -1.26 -5.12 105.19 101.08 1c9k n GLY 139 Ca 0.20 -2.11 -0.31 0.00 0.00 0.00 0.00 46.02 43.80 1c9k n GLY 139 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c9k s ILE 140 N 1.15 4.80 -0.06 -0.61 1.09 -1.26 -4.99 121.20 121.31 1c9k s ILE 140 Ca 0.00 0.61 -0.31 0.00 -1.10 0.00 0.00 60.65 59.85 1c9k s ILE 140 Cb 0.00 -3.70 -0.09 0.00 -1.06 0.00 0.00 42.46 37.61 1c9k s ILE 140 CO 0.00 -0.40 2.01 0.52 -0.10 0.00 0.00 174.94 176.97 1c9k n VAL 141 N -0.99 0.62 -1.93 2.92 0.31 -1.26 -4.94 118.33 113.06 1c9k n VAL 141 Ca 0.02 -0.20 -0.33 0.00 -0.01 0.00 0.00 64.34 63.82 1c9k n VAL 141 Cb 0.54 -2.23 0.03 0.00 -0.91 0.00 0.00 33.84 31.27 1c9k n VAL 141 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1c9k s PRO 142 N 4.83 3.02 0.07 5.55 0.04 -1.26 -4.95 135.00 142.30 1c9k s PRO 142 Ca 0.93 1.40 -0.14 0.00 0.04 0.00 0.00 61.00 63.24 1c9k s PRO 142 Cb -0.50 -1.98 -0.25 0.00 0.04 0.00 0.00 34.50 31.81 1c9k s PRO 142 CO 0.44 -1.08 1.16 1.05 0.04 0.00 0.00 177.00 178.61 1c9k h GLU 143 N 0.37 0.67 -6.24 4.56 9.09 -1.99 -3.44 114.58 117.60 1c9k h GLU 143 Ca -0.47 -0.78 -0.55 0.00 0.05 0.00 0.00 59.36 57.60 1c9k h GLU 143 Cb 1.24 0.24 -0.00 0.00 -1.65 0.00 0.00 28.75 28.58 1c9k h GLU 143 CO 0.55 1.35 1.24 1.21 0.05 0.00 0.00 179.01 183.41 1c9k s ASN 144 N -7.35 6.26 0.15 3.06 2.47 -1.26 -4.92 114.94 113.34 1c9k s ASN 144 Ca -0.09 2.18 -0.22 0.00 0.42 0.00 0.00 52.86 55.15 1c9k s ASN 144 Cb 0.06 -2.53 0.03 0.00 -1.45 0.00 0.00 41.25 37.36 1c9k s ASN 144 CO 0.93 -1.28 1.64 -0.09 -3.72 0.00 0.00 177.10 174.58 1c9k h ARG 145 N 11.41 -0.20 -0.73 0.43 2.43 -1.98 0.47 114.38 126.20 1c9k h ARG 145 Ca -0.42 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 58.82 1c9k h ARG 145 Cb 1.21 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 30.75 1c9k h ARG 145 CO 0.96 -0.14 0.42 1.25 -1.51 0.00 0.00 179.97 180.95 1c9k h LEU 146 N -0.21 0.63 -0.55 3.80 6.46 -1.92 1.13 115.31 124.65 1c9k h LEU 146 Ca 0.13 0.03 0.07 0.00 -0.12 0.00 0.00 57.88 57.99 1c9k h LEU 146 Cb 0.42 -0.10 -0.06 0.00 -0.73 0.00 0.00 40.66 40.19 1c9k h LEU 146 CO -0.36 0.40 0.23 0.00 -0.62 0.00 0.00 178.44 178.10 1c9k h ALA 147 N 1.37 0.70 -0.31 1.25 0.00 -1.73 2.17 119.26 122.71 1c9k h ALA 147 Ca 0.32 0.05 -0.16 0.00 0.00 0.00 0.00 54.91 55.13 1c9k h ALA 147 Cb 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1c9k h ALA 147 CO -0.18 -0.15 -0.44 0.00 0.00 0.00 0.00 179.25 178.47 1c9k h ARG 148 N 0.44 0.84 0.19 0.00 3.08 0.14 -1.40 114.38 117.67 1c9k h ARG 148 Ca 0.26 -0.50 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 1c9k h ARG 148 Cb 0.26 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1c9k h ARG 148 CO -0.23 1.13 -0.09 0.45 -1.07 0.00 0.00 179.97 180.16 1c9k h HIS 149 N 0.62 -0.23 -0.26 3.04 3.86 0.25 -2.87 115.15 119.56 1c9k h HIS 149 Ca 0.03 -0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.28 1c9k h HIS 149 Cb 1.05 0.08 -0.08 0.00 1.06 0.00 0.00 27.41 29.52 1c9k h HIS 149 CO 0.07 -0.09 -0.49 0.35 0.86 0.00 0.00 177.93 178.64 1c9k h PHE 150 N -0.33 -1.45 -0.90 2.45 3.04 0.36 -1.37 116.94 118.74 1c9k h PHE 150 Ca -0.03 0.06 0.15 0.00 3.98 0.00 0.00 57.97 62.13 1c9k h PHE 150 Cb 0.25 0.67 -0.07 0.00 2.56 0.00 0.00 35.95 39.36 1c9k h PHE 150 CO -0.04 -0.50 0.58 0.07 -2.02 0.00 0.00 178.31 176.40 1c9k h ARG 151 N -0.46 0.68 0.53 1.11 0.11 -1.19 -1.17 114.38 114.00 1c9k h ARG 151 Ca 0.08 -0.04 -0.03 0.00 0.10 0.00 0.00 59.98 60.09 1c9k h ARG 151 Cb 0.63 -0.15 0.01 0.00 1.11 0.00 0.00 29.97 31.56 1c9k h ARG 151 CO -0.50 0.45 -0.26 -0.44 0.10 0.00 0.00 179.97 179.33 1c9k h ASP 152 N 0.70 -0.61 -0.42 0.08 3.32 -1.05 -2.62 116.42 115.82 1c9k h ASP 152 Ca 0.46 -0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.55 1c9k h ASP 152 Cb 0.73 0.16 -0.07 0.00 0.22 0.00 0.00 39.33 40.36 1c9k h ASP 152 CO -0.21 -0.34 -0.01 0.40 -1.72 0.00 0.00 179.24 177.36 1c9k h ILE 153 N -0.85 0.67 -0.97 0.35 2.04 -0.95 -1.46 117.51 116.35 1c9k h ILE 153 Ca -0.07 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 65.81 1c9k h ILE 153 Cb 0.60 0.56 -0.06 0.00 -0.74 0.00 0.00 36.82 37.18 1c9k h ILE 153 CO 0.12 0.02 0.63 0.00 0.00 0.00 0.00 178.15 178.92 1c9k h ALA 154 N 1.38 1.43 -0.48 1.87 0.00 -1.23 0.40 119.26 122.63 1c9k h ALA 154 Ca 0.21 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 1c9k h ALA 154 Cb 0.30 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1c9k h ALA 154 CO -0.35 0.43 -0.09 0.78 0.00 0.00 0.00 179.25 180.01 1c9k h GLY 155 N 1.14 0.98 1.08 0.00 0.00 -1.01 -0.80 103.07 104.46 1c9k h GLY 155 Ca 0.41 -0.80 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 1c9k h GLY 155 CO -0.16 0.73 -0.02 3.21 0.00 0.00 0.00 176.54 180.30 1c9k h ARG 156 N 0.76 1.05 -0.74 4.80 -0.00 -0.48 -2.00 114.38 117.77 1c9k h ARG 156 Ca 0.12 -0.34 -0.05 0.00 -0.50 0.00 0.00 59.98 59.21 1c9k h ARG 156 Cb 0.64 -0.09 -0.03 0.00 0.00 0.00 0.00 29.97 30.49 1c9k h ARG 156 CO 0.04 1.04 0.26 0.28 0.00 0.00 0.00 179.97 181.59 1c9k h VAL 157 N 0.95 1.26 -0.66 2.04 2.07 0.00 -2.56 116.25 119.35 1c9k h VAL 157 Ca 0.17 -0.87 -0.08 0.00 0.82 0.00 0.00 66.70 66.74 1c9k h VAL 157 Cb 0.58 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1c9k h VAL 157 CO 0.03 0.34 0.10 0.78 0.02 0.00 0.00 177.57 178.85 1c9k h ASN 158 N 1.09 1.04 -0.28 0.57 4.21 -0.98 -1.13 115.58 120.10 1c9k h ASN 158 Ca 0.24 -0.25 0.02 0.00 1.21 0.00 0.00 56.30 57.53 1c9k h ASN 158 Cb 0.27 -0.28 -0.02 0.00 -1.12 0.00 0.00 38.32 37.17 1c9k h ASN 158 CO -0.01 1.03 0.13 1.56 -1.29 0.00 0.00 177.43 178.85 1c9k h GLN 159 N 1.02 0.27 0.01 0.81 4.20 -1.18 0.21 115.11 120.45 1c9k h GLN 159 Ca 0.20 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.93 1c9k h GLN 159 Cb 0.44 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.11 1c9k h GLN 159 CO 0.01 0.18 -0.27 0.00 -0.67 0.00 0.00 178.83 178.08 1c9k h ARG 160 N 0.28 -0.40 -0.22 1.46 2.47 -1.09 -0.53 114.38 116.34 1c9k h ARG 160 Ca 0.12 0.03 0.04 0.00 -1.26 0.00 0.00 59.98 58.90 1c9k h ARG 160 Cb 0.04 0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.42 1c9k h ARG 160 CO -0.09 -0.27 -0.01 -0.07 0.56 0.00 0.00 179.97 180.10 1c9k h LEU 161 N -0.42 -0.09 -0.78 3.04 3.38 -0.86 0.17 115.31 119.75 1c9k h LEU 161 Ca 0.06 0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.19 1c9k h LEU 161 Cb 0.50 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.26 1c9k h LEU 161 CO -0.23 -0.02 0.40 0.00 0.09 0.00 0.00 178.44 178.68 1c9k h ALA 162 N 1.19 1.11 -0.38 1.53 0.00 -0.13 2.54 119.26 125.12 1c9k h ALA 162 Ca 0.10 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1c9k h ALA 162 Cb 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1c9k h ALA 162 CO -0.18 -0.05 0.06 0.00 0.00 0.00 0.00 179.25 179.09 1c9k h ALA 163 N 1.48 0.51 -0.37 0.00 0.00 -0.80 -2.75 119.26 117.33 1c9k h ALA 163 Ca 0.40 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 1c9k h ALA 163 Cb 0.48 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1c9k h ALA 163 CO -0.31 0.22 -0.08 0.00 0.00 0.00 0.00 179.25 179.09 1c9k h ALA 164 N 0.92 0.51 -2.04 0.00 0.00 0.58 -3.46 119.26 115.77 1c9k h ALA 164 Ca 0.12 -0.30 -0.52 0.00 0.00 0.00 0.00 54.91 54.20 1c9k h ALA 164 Cb 0.37 -0.13 0.22 0.00 0.00 0.00 0.00 17.79 18.25 1c9k h ALA 164 CO 0.01 0.35 -0.98 0.00 0.00 0.00 0.00 179.25 178.63 1c9k n ALA 165 N -2.43 -3.51 -0.11 0.00 0.00 0.84 -4.67 120.51 110.64 1c9k n ALA 165 Ca -0.02 -0.73 -0.13 0.00 0.00 0.00 0.00 53.44 52.56 1c9k n ALA 165 Cb 0.34 -1.59 -0.12 0.00 0.00 0.00 0.00 19.45 18.07 1c9k n ALA 165 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1c9k n ASP 166 N -0.19 1.41 -3.90 0.00 8.00 -0.40 -4.91 116.55 116.58 1c9k n ASP 166 Ca 0.04 -0.07 -0.14 0.00 0.71 0.00 0.00 54.79 55.33 1c9k n ASP 166 Cb 0.56 0.21 -0.14 0.00 -0.02 0.00 0.00 41.12 41.73 1c9k n ASP 166 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1c9k s GLU 167 N -2.46 0.16 -0.03 -1.24 2.02 -1.23 -4.96 118.70 110.97 1c9k s GLU 167 Ca -0.22 -0.06 0.00 0.00 0.02 0.00 0.00 54.97 54.71 1c9k s GLU 167 Cb 0.07 -0.16 0.03 0.00 0.10 0.00 0.00 34.13 34.16 1c9k s GLU 167 CO 0.64 0.03 -0.00 0.08 0.02 0.00 0.00 175.26 176.03 1c9k s VAL 168 N -0.00 0.19 0.09 2.63 1.01 -1.26 -1.43 120.40 121.63 1c9k s VAL 168 Ca 0.00 0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.14 1c9k s VAL 168 Cb -0.01 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 1c9k s VAL 168 CO -0.00 0.14 -0.23 0.26 0.00 0.00 0.00 175.10 175.27 1c9k s TRP 169 N 0.97 2.01 -0.09 5.22 0.52 -0.75 0.12 118.94 126.94 1c9k s TRP 169 Ca -0.10 -0.40 0.04 0.00 0.02 0.00 0.00 56.10 55.66 1c9k s TRP 169 Cb -0.13 -1.13 0.00 0.00 -1.15 0.00 0.00 33.47 31.06 1c9k s TRP 169 CO -0.02 0.21 -0.22 -1.17 0.02 0.00 0.00 176.95 175.77 1c9k s LEU 170 N -1.70 2.03 -0.15 2.99 2.96 0.98 -0.95 118.68 124.85 1c9k s LEU 170 Ca 0.09 -0.52 -0.04 0.00 -0.22 0.00 0.00 54.13 53.44 1c9k s LEU 170 Cb -0.10 -1.33 -0.03 0.00 0.50 0.00 0.00 46.19 45.23 1c9k s LEU 170 CO 0.04 0.14 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.52 1c9k s VAL 171 N 0.37 4.21 -0.06 1.68 1.01 0.70 0.12 120.40 128.43 1c9k s VAL 171 Ca -0.18 -0.25 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 1c9k s VAL 171 Cb -0.18 -2.84 0.03 0.00 0.00 0.00 0.00 36.38 33.39 1c9k s VAL 171 CO 0.08 0.51 -0.02 0.54 0.00 0.00 0.00 175.10 176.21 1c9k s VAL 172 N 0.10 0.44 -1.55 2.92 0.11 -0.11 -4.27 120.40 118.03 1c9k s VAL 172 Ca 0.01 0.03 -0.14 0.00 -2.93 0.00 0.00 61.98 58.95 1c9k s VAL 172 Cb -0.13 -0.55 0.09 0.00 -1.53 0.00 0.00 36.38 34.26 1c9k s VAL 172 CO 0.02 0.25 0.96 -1.20 -3.33 0.00 0.00 175.10 171.80 1c9k n SER 173 N 4.77 -4.70 0.00 3.54 7.64 -1.23 0.10 113.62 123.74 1c9k n SER 173 Ca -0.13 -0.80 0.00 0.00 1.01 0.00 0.00 58.87 58.95 1c9k n SER 173 Cb 0.50 -3.76 0.00 0.00 -1.01 0.00 0.00 64.21 59.94 1c9k n SER 173 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c9k n GLY 174 N -1.66 0.88 3.48 0.23 0.00 0.25 -5.00 105.19 103.37 1c9k n GLY 174 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1c9k n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c9k s ILE 175 N -3.63 5.14 -0.09 -0.61 -1.09 0.28 -4.98 121.20 116.23 1c9k s ILE 175 Ca 0.00 -0.45 -0.30 0.00 -2.23 0.00 0.00 60.65 57.67 1c9k s ILE 175 Cb 0.00 -4.01 -0.04 0.00 -1.58 0.00 0.00 42.46 36.84 1c9k s ILE 175 CO 0.00 -0.39 1.45 -0.83 -1.23 0.00 0.00 174.94 173.95 1c9k s GLY 176 N 1.77 1.63 -0.31 6.18 0.00 -1.26 -0.94 107.32 114.39 1c9k s GLY 176 Ca 0.10 0.74 0.00 0.00 0.00 0.00 0.00 44.72 45.56 1c9k s GLY 176 CO 0.12 2.73 0.00 0.14 0.00 0.00 0.00 173.10 176.10 1c9k s VAL 177 N 3.54 2.68 -0.52 1.40 1.01 0.33 -4.93 120.40 123.91 1c9k s VAL 177 Ca 0.64 -1.69 -0.27 0.00 0.00 0.00 0.00 61.98 60.66 1c9k s VAL 177 Cb -0.28 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 1c9k s VAL 177 CO 0.23 -0.24 1.92 -0.75 0.00 0.00 0.00 175.10 176.27 1c9k s LYS 178 N 1.14 2.74 0.03 2.72 2.20 -1.26 -0.01 119.74 127.29 1c9k s LYS 178 Ca -0.02 0.94 0.24 0.00 -0.36 0.00 0.00 55.97 56.77 1c9k s LYS 178 Cb -0.20 -4.37 0.32 0.00 -1.51 0.00 0.00 37.83 32.07 1c9k s LYS 178 CO -0.04 -2.58 1.27 0.44 -0.36 0.00 0.00 175.35 174.08 1c9k n ILE 179 N 7.38 0.10 -1.99 5.43 -5.35 0.32 -4.95 119.36 120.28 1c9k n ILE 179 Ca 0.23 -0.10 0.00 0.00 -0.27 0.00 0.00 62.75 62.62 1c9k n ILE 179 Cb 0.51 0.24 0.00 0.00 -1.74 0.00 0.00 39.64 38.65 1c9k n ILE 179 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96