#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tk9 h LEU 3 N 0.00 0.12 -0.75 1.04 3.38 -2.06 -2.10 115.31 114.95 1tk9 h LEU 3 Ca 0.00 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1tk9 h LEU 3 Cb 0.00 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1tk9 h LEU 3 CO 0.00 0.32 0.05 0.40 0.09 0.00 0.00 178.44 179.30 1tk9 h ILE 4 N 0.12 1.26 -0.26 1.22 2.04 -2.05 -1.20 117.51 118.63 1tk9 h ILE 4 Ca 0.02 -1.06 -0.08 0.00 1.00 0.00 0.00 64.86 64.74 1tk9 h ILE 4 Cb 0.41 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1tk9 h ILE 4 CO 0.03 0.39 -0.17 0.78 0.00 0.00 0.00 178.15 179.18 1tk9 h ASN 5 N 0.93 0.45 -0.11 1.72 2.35 -1.84 -1.39 115.58 117.70 1tk9 h ASN 5 Ca 0.18 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1tk9 h ASN 5 Cb 0.48 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 1tk9 h ASN 5 CO 0.02 0.64 0.06 0.25 -1.65 0.00 0.00 177.43 176.75 1tk9 h LEU 6 N 0.42 0.13 -0.71 1.61 6.46 -0.75 -0.70 115.31 121.77 1tk9 h LEU 6 Ca 0.07 -0.07 0.04 0.00 -0.12 0.00 0.00 57.88 57.81 1tk9 h LEU 6 Cb 0.54 -0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 40.39 1tk9 h LEU 6 CO 0.04 0.17 0.43 0.58 -0.62 0.00 0.00 178.44 179.03 1tk9 h VAL 7 N 0.09 1.05 -0.77 1.05 2.07 -0.83 -1.55 116.25 117.35 1tk9 h VAL 7 Ca 0.04 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.30 1tk9 h VAL 7 Cb 0.06 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 29.95 1tk9 h VAL 7 CO -0.01 0.15 0.50 -0.33 0.02 0.00 0.00 177.57 177.90 1tk9 h GLU 8 N 0.82 0.97 -0.56 1.57 5.08 -0.82 -0.34 114.58 121.31 1tk9 h GLU 8 Ca 0.30 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.55 1tk9 h GLU 8 Cb 0.09 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1tk9 h GLU 8 CO -0.14 0.64 0.15 -0.22 -1.00 0.00 0.00 179.01 178.45 1tk9 h LYS 9 N 1.00 0.88 -0.33 2.33 3.64 -0.42 0.29 116.57 123.96 1tk9 h LYS 9 Ca 0.29 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1tk9 h LYS 9 Cb -0.06 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 1tk9 h LYS 9 CO -0.08 0.81 0.20 0.93 -2.27 0.00 0.00 179.45 179.04 1tk9 h GLU 10 N 0.78 0.41 -0.34 1.90 4.39 -0.84 0.58 114.58 121.46 1tk9 h GLU 10 Ca 0.18 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.86 1tk9 h GLU 10 Cb 0.32 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 1tk9 h GLU 10 CO -0.00 0.27 0.22 -1.49 -1.16 0.00 0.00 179.01 176.84 1tk9 h TRP 11 N 0.42 0.41 -0.79 4.33 6.55 -0.61 -0.79 115.95 125.47 1tk9 h TRP 11 Ca 0.12 0.01 -0.04 0.00 0.95 0.00 0.00 58.89 59.93 1tk9 h TRP 11 Cb -0.02 -0.14 -0.04 0.00 -0.86 0.00 0.00 29.16 28.10 1tk9 h TRP 11 CO -0.06 0.25 0.33 0.37 -1.05 0.00 0.00 178.44 178.28 1tk9 h GLN 12 N 0.44 1.17 -0.34 0.49 4.15 -0.01 -0.86 115.11 120.15 1tk9 h GLN 12 Ca 0.13 -0.20 -0.11 0.00 0.77 0.00 0.00 58.65 59.23 1tk9 h GLN 12 Cb -0.03 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.45 1tk9 h GLN 12 CO -0.04 0.94 -0.26 0.93 -1.93 0.00 0.00 178.83 178.47 1tk9 h GLU 13 N 1.14 0.68 -0.49 1.69 4.39 -0.66 -1.29 114.58 120.04 1tk9 h GLU 13 Ca 0.27 -0.28 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 1tk9 h GLU 13 Cb 0.19 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1tk9 h GLU 13 CO -0.03 0.87 0.21 1.25 -1.16 0.00 0.00 179.01 180.16 1tk9 h HIS 14 N 0.59 0.73 -0.87 4.33 2.76 -0.65 -1.65 115.15 120.39 1tk9 h HIS 14 Ca 0.08 -0.05 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 1tk9 h HIS 14 Cb 0.75 -0.22 -0.05 0.00 1.55 0.00 0.00 27.41 29.44 1tk9 h HIS 14 CO 0.03 0.60 0.57 1.96 -1.30 0.00 0.00 177.93 179.79 1tk9 h GLN 15 N 0.65 1.11 -0.31 5.26 4.20 -0.83 -0.45 115.11 124.73 1tk9 h GLN 15 Ca 0.16 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1tk9 h GLN 15 Cb 0.17 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1tk9 h GLN 15 CO -0.02 0.73 0.16 0.87 -0.67 0.00 0.00 178.83 179.91 1tk9 h LYS 16 N 1.14 0.44 -0.19 1.46 1.57 -0.79 -2.05 116.57 118.15 1tk9 h LYS 16 Ca 0.33 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.97 1tk9 h LYS 16 Cb -0.08 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1tk9 h LYS 16 CO -0.09 0.39 -0.26 0.82 -0.57 0.00 0.00 179.45 179.75 1tk9 h ILE 17 N 0.38 1.26 -0.01 1.86 1.08 -0.98 -0.81 117.51 120.29 1tk9 h ILE 17 Ca 0.11 -1.21 -0.00 0.00 -0.39 0.00 0.00 64.86 63.37 1tk9 h ILE 17 Cb 0.08 1.40 -0.00 0.00 -3.07 0.00 0.00 36.82 35.23 1tk9 h ILE 17 CO -0.02 0.38 0.01 0.58 -0.69 0.00 0.00 178.15 178.41 1tk9 h VAL 18 N 0.32 1.03 -0.35 1.67 2.07 -0.73 0.64 116.25 120.90 1tk9 h VAL 18 Ca 0.05 -0.08 -0.09 0.00 0.82 0.00 0.00 66.70 67.39 1tk9 h VAL 18 Cb 0.63 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1tk9 h VAL 18 CO 0.05 0.02 -0.17 -0.61 0.02 0.00 0.00 177.57 176.88 1tk9 h GLN 19 N -0.02 0.64 0.00 1.57 4.15 -1.18 -2.43 115.11 117.84 1tk9 h GLN 19 Ca 0.00 -0.22 -0.08 0.00 0.77 0.00 0.00 58.65 59.12 1tk9 h GLN 19 Cb 0.03 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 1tk9 h GLN 19 CO -0.00 0.78 -0.38 0.00 -1.93 0.00 0.00 178.83 177.30 1tk9 h ALA 20 N 1.24 1.18 -0.00 3.38 0.00 -0.87 -2.81 119.26 121.38 1tk9 h ALA 20 Ca 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1tk9 h ALA 20 Cb 0.62 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1tk9 h ALA 20 CO 0.04 0.47 0.00 0.43 0.00 0.00 0.00 179.25 180.19 1tk9 n SER 21 N -3.81 0.03 0.22 0.00 7.64 0.19 -3.43 113.62 114.47 1tk9 n SER 21 Ca -0.01 -1.31 0.15 0.00 1.01 0.00 0.00 58.87 58.72 1tk9 n SER 21 Cb 0.45 -0.00 0.67 0.00 -1.01 0.00 0.00 64.21 64.32 1tk9 n SER 21 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1tk9 h GLU 22 N 0.05 0.00 0.00 1.43 5.08 -1.48 -2.28 114.58 117.38 1tk9 h GLU 22 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1tk9 h GLU 22 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1tk9 h GLU 22 CO 0.00 0.00 0.00 0.44 -1.00 0.00 0.00 179.01 178.45 1tk9 n ILE 23 N -2.70 0.83 1.30 3.13 -5.35 -1.22 -2.56 119.36 112.79 1tk9 n ILE 23 Ca 0.01 0.19 0.13 0.00 -0.27 0.00 0.00 62.75 62.81 1tk9 n ILE 23 Cb 0.22 -1.07 0.41 0.00 -1.74 0.00 0.00 39.64 37.47 1tk9 n ILE 23 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1tk9 n LEU 24 N -2.06 1.16 -0.31 7.28 4.77 -0.86 -4.37 117.00 122.61 1tk9 n LEU 24 Ca 0.03 -0.33 0.05 0.00 -0.03 0.00 0.00 56.01 55.73 1tk9 n LEU 24 Cb 0.23 -0.09 0.21 0.00 -2.33 0.00 0.00 43.42 41.44 1tk9 n LEU 24 CO 0.19 0.21 1.16 0.07 -1.33 0.00 0.00 177.39 177.69 1tk9 h LYS 25 N 1.52 0.78 -0.37 3.23 2.10 -1.67 0.21 116.57 122.37 1tk9 h LYS 25 Ca 0.00 -0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.59 1tk9 h LYS 25 Cb 0.51 -0.18 -0.02 0.00 -0.90 0.00 0.00 32.23 31.65 1tk9 h LYS 25 CO 0.00 0.52 0.17 0.78 -2.00 0.00 0.00 179.45 178.92 1tk9 h GLY 26 N 0.81 0.58 1.06 0.07 0.00 -1.84 -1.37 103.07 102.37 1tk9 h GLY 26 Ca 0.45 -0.30 -0.08 0.00 0.00 0.00 0.00 47.33 47.40 1tk9 h GLY 26 CO -0.28 0.28 0.08 1.46 0.00 0.00 0.00 176.54 178.07 1tk9 h GLN 27 N 0.46 1.06 -0.46 4.80 4.20 -1.54 -2.29 115.11 121.35 1tk9 h GLN 27 Ca 0.13 -0.30 -0.03 0.00 0.06 0.00 0.00 58.65 58.51 1tk9 h GLN 27 Cb 0.14 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 1tk9 h GLN 27 CO -0.01 1.00 0.16 0.82 -0.67 0.00 0.00 178.83 180.13 1tk9 h ILE 28 N 0.97 1.21 -0.41 2.54 2.04 -0.47 -0.71 117.51 122.68 1tk9 h ILE 28 Ca 0.19 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.36 1tk9 h ILE 28 Cb 0.47 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1tk9 h ILE 28 CO 0.02 0.25 0.26 0.00 0.00 0.00 0.00 178.15 178.68 1tk9 h ALA 29 N 1.01 0.52 -0.65 1.87 0.00 -1.17 -0.05 119.26 120.79 1tk9 h ALA 29 Ca 0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1tk9 h ALA 29 Cb 0.23 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1tk9 h ALA 29 CO -0.01 -0.01 0.31 -0.22 0.00 0.00 0.00 179.25 179.32 1tk9 h LYS 30 N 0.55 0.93 -0.34 0.00 1.63 -1.22 -1.47 116.57 116.65 1tk9 h LYS 30 Ca 0.15 -0.14 -0.02 0.00 -0.85 0.00 0.00 60.65 59.79 1tk9 h LYS 30 Cb -0.04 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 31.41 1tk9 h LYS 30 CO -0.03 0.74 0.12 0.28 -3.45 0.00 0.00 179.45 177.12 1tk9 h VAL 31 N 0.90 1.20 -0.98 2.00 2.07 -0.84 -1.10 116.25 119.49 1tk9 h VAL 31 Ca 0.22 -0.62 0.09 0.00 0.82 0.00 0.00 66.70 67.21 1tk9 h VAL 31 Cb 0.12 0.96 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 1tk9 h VAL 31 CO -0.03 0.21 0.62 1.23 0.02 0.00 0.00 177.57 179.63 1tk9 h GLY 32 N 0.40 1.54 0.95 2.17 0.00 -0.70 0.11 103.07 107.54 1tk9 h GLY 32 Ca 0.11 -0.44 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 1tk9 h GLY 32 CO -0.01 0.26 -0.04 -2.09 0.00 0.00 0.00 176.54 174.66 1tk9 h GLU 33 N 1.07 0.70 -0.74 4.80 4.81 -0.93 -2.15 114.58 122.14 1tk9 h GLU 33 Ca 0.45 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 1tk9 h GLU 33 Cb 0.29 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1tk9 h GLU 33 CO -0.21 0.82 0.40 -0.07 -0.73 0.00 0.00 179.01 179.22 1tk9 h LEU 34 N 0.52 0.93 -0.89 1.64 3.38 -0.06 -1.56 115.31 119.26 1tk9 h LEU 34 Ca 0.10 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1tk9 h LEU 34 Cb 0.53 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 1tk9 h LEU 34 CO 0.03 0.76 0.37 -0.07 0.09 0.00 0.00 178.44 179.62 1tk9 h LEU 35 N 1.02 1.07 -0.39 1.67 3.38 -0.68 -0.21 115.31 121.17 1tk9 h LEU 35 Ca 0.26 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1tk9 h LEU 35 Cb 0.04 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1tk9 h LEU 35 CO -0.04 0.91 0.12 0.00 0.09 0.00 0.00 178.44 179.52 1tk9 h GLU 37 N 0.48 1.13 0.45 0.00 5.08 -0.82 -0.42 114.58 120.48 1tk9 h GLU 37 Ca 0.12 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1tk9 h GLU 37 Cb 0.26 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1tk9 h GLU 37 CO -0.00 0.75 -0.25 0.00 -1.00 0.00 0.00 179.01 178.51 1tk9 h LEU 39 N -0.65 -0.00 -2.14 0.00 3.38 -1.02 0.16 115.31 115.04 1tk9 h LEU 39 Ca -0.05 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1tk9 h LEU 39 Cb 0.52 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 1tk9 h LEU 39 CO 0.07 0.02 -0.00 0.11 0.09 0.00 0.00 178.44 178.73 1tk9 h LYS 40 N 0.07 0.00 -0.01 1.13 1.57 -1.07 -0.39 116.57 117.88 1tk9 h LYS 40 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1tk9 h LYS 40 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1tk9 h LYS 40 CO -0.08 0.00 -0.18 1.17 -0.57 0.00 0.00 179.45 179.80 1tk9 n LYS 41 N -3.10 0.71 -0.26 3.15 4.81 -0.59 -4.90 118.16 117.98 1tk9 n LYS 41 Ca -0.01 -0.33 0.00 0.00 -0.87 0.00 0.00 58.31 57.10 1tk9 n LYS 41 Cb 0.20 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.76 1tk9 n LYS 41 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1tk9 n GLY 42 N 1.32 0.86 3.96 3.14 0.00 -0.15 -5.07 105.19 109.24 1tk9 n GLY 42 Ca 0.13 -0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 1tk9 n GLY 42 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tk9 s GLY 43 N -2.05 1.75 0.14 -0.02 0.00 0.52 -4.99 107.32 102.68 1tk9 s GLY 43 Ca 0.00 -1.32 0.06 0.00 0.00 0.00 0.00 44.72 43.47 1tk9 s GLY 43 CO 0.00 -0.83 -0.14 -1.59 0.00 0.00 0.00 173.10 170.54 1tk9 s LYS 44 N -5.21 1.11 -0.29 2.90 -2.85 -1.26 -4.25 119.74 109.89 1tk9 s LYS 44 Ca 0.64 -1.34 -0.08 0.00 -1.00 0.00 0.00 55.97 54.18 1tk9 s LYS 44 Cb -0.08 -0.95 -0.01 0.00 -2.06 0.00 0.00 37.83 34.73 1tk9 s LYS 44 CO 0.45 0.17 0.11 0.42 0.10 0.00 0.00 175.35 176.60 1tk9 s ILE 45 N -2.41 4.30 -0.13 3.79 1.01 0.33 -1.21 121.20 126.87 1tk9 s ILE 45 Ca 0.13 -0.45 -0.10 0.00 0.00 0.00 0.00 60.65 60.23 1tk9 s ILE 45 Cb -0.03 -3.16 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 1tk9 s ILE 45 CO 0.04 0.14 0.19 -0.76 0.00 0.00 0.00 174.94 174.55 1tk9 s LEU 46 N 1.57 4.34 -0.05 2.97 1.43 0.73 -0.77 118.68 128.90 1tk9 s LEU 46 Ca 0.04 0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.64 1tk9 s LEU 46 Cb -0.17 -2.18 0.01 0.00 0.03 0.00 0.00 46.19 43.89 1tk9 s LEU 46 CO 0.04 0.30 -0.09 -0.63 0.23 0.00 0.00 176.35 176.20 1tk9 s ILE 47 N -0.49 0.85 0.05 -0.59 1.01 -0.26 0.42 121.20 122.18 1tk9 s ILE 47 Ca 0.14 -0.34 -0.03 0.00 0.00 0.00 0.00 60.65 60.42 1tk9 s ILE 47 Cb -0.12 -0.79 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 1tk9 s ILE 47 CO 0.04 0.28 0.04 0.00 0.00 0.00 0.00 174.94 175.30 1tk9 n GLY 49 N 0.52 0.25 3.53 0.00 0.00 -1.26 -1.12 105.19 107.12 1tk9 n GLY 49 Ca -0.17 -0.84 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 1tk9 n GLY 49 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1tk9 s ASN 50 N 0.00 4.12 1.52 1.61 0.01 -1.26 -3.52 114.94 117.42 1tk9 s ASN 50 Ca 0.00 -0.51 0.00 0.00 -0.71 0.00 0.00 52.86 51.64 1tk9 s ASN 50 Cb 0.00 -0.67 0.00 0.00 0.41 0.00 0.00 41.25 40.99 1tk9 s ASN 50 CO 0.00 0.16 0.00 0.61 -1.51 0.00 0.00 177.10 176.36 1tk9 n GLY 51 N 0.59 3.84 0.24 0.66 0.00 -1.26 -0.54 105.19 108.72 1tk9 n GLY 51 Ca -0.14 0.19 0.06 0.00 0.00 0.00 0.00 46.02 46.13 1tk9 n GLY 51 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1tk9 h GLY 52 N 0.00 0.04 2.00 -0.02 0.00 -2.00 -0.58 103.07 102.51 1tk9 h GLY 52 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1tk9 h GLY 52 CO 0.00 0.02 -0.06 1.76 0.00 0.00 0.00 176.54 178.26 1tk9 h SER 53 N 0.03 0.00 0.43 0.19 0.02 -1.14 -1.28 113.55 111.81 1tk9 h SER 53 Ca 0.01 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.72 1tk9 h SER 53 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1tk9 h SER 53 CO 0.01 0.06 -1.00 0.00 -1.14 0.00 0.00 176.83 174.76 1tk9 h ALA 54 N 1.94 0.32 -0.51 3.77 0.00 -1.00 -1.86 119.26 121.92 1tk9 h ALA 54 Ca -0.00 -0.75 -0.13 0.00 0.00 0.00 0.00 54.91 54.03 1tk9 h ALA 54 Cb 0.71 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1tk9 h ALA 54 CO 0.01 0.86 -0.17 0.00 0.00 0.00 0.00 179.25 179.95 1tk9 h ALA 55 N 0.73 0.71 -0.47 0.00 0.00 -1.01 -2.56 119.26 116.66 1tk9 h ALA 55 Ca -0.09 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 1tk9 h ALA 55 Cb 1.66 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 1tk9 h ALA 55 CO 0.17 0.67 -0.00 -0.44 0.00 0.00 0.00 179.25 179.65 1tk9 h ASP 56 N 0.89 0.75 -0.02 0.00 3.32 -1.21 -1.43 116.42 118.72 1tk9 h ASP 56 Ca 0.12 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1tk9 h ASP 56 Cb 0.75 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 1tk9 h ASP 56 CO 0.06 0.82 0.01 0.00 -1.72 0.00 0.00 179.24 178.41 1tk9 h ALA 57 N 1.27 0.03 -0.25 3.45 0.00 -1.10 0.10 119.26 122.75 1tk9 h ALA 57 Ca 0.14 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1tk9 h ALA 57 Cb 0.45 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1tk9 h ALA 57 CO 0.02 -0.44 -0.42 -0.56 0.00 0.00 0.00 179.25 177.85 1tk9 h GLN 58 N -0.04 0.60 -0.09 0.00 3.07 -1.39 -1.75 115.11 115.50 1tk9 h GLN 58 Ca 0.01 -0.32 0.02 0.00 0.09 0.00 0.00 58.65 58.45 1tk9 h GLN 58 Cb 0.07 0.01 -0.02 0.00 0.08 0.00 0.00 27.48 27.62 1tk9 h GLN 58 CO -0.00 0.92 -0.04 1.25 0.09 0.00 0.00 178.83 181.05 1tk9 h HIS 59 N 0.49 -0.09 -0.08 0.06 2.76 -1.06 0.28 115.15 117.53 1tk9 h HIS 59 Ca 0.04 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.24 1tk9 h HIS 59 Cb 0.94 0.05 -0.02 0.00 1.55 0.00 0.00 27.41 29.93 1tk9 h HIS 59 CO 0.04 -0.06 -0.04 0.35 -1.30 0.00 0.00 177.93 176.92 1tk9 h PHE 60 N -0.03 -0.09 -0.09 5.26 3.04 -0.85 -2.08 116.94 122.10 1tk9 h PHE 60 Ca 0.05 0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.03 1tk9 h PHE 60 Cb 0.10 0.05 -0.03 0.00 2.56 0.00 0.00 35.95 38.64 1tk9 h PHE 60 CO -0.15 -0.06 -0.06 0.00 -2.02 0.00 0.00 178.31 176.01 1tk9 h ALA 61 N 1.04 0.02 -0.58 2.41 0.00 -1.02 -2.21 119.26 118.92 1tk9 h ALA 61 Ca 0.05 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1tk9 h ALA 61 Cb 0.10 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1tk9 h ALA 61 CO -0.10 -0.52 0.39 0.00 0.00 0.00 0.00 179.25 179.01 1tk9 h ALA 62 N 1.02 1.79 -0.53 0.00 0.00 -0.80 0.40 119.26 121.14 1tk9 h ALA 62 Ca 0.06 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1tk9 h ALA 62 Cb 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1tk9 h ALA 62 CO -0.13 0.12 -0.01 0.93 0.00 0.00 0.00 179.25 180.16 1tk9 h GLU 63 N 0.59 0.91 -0.01 0.00 4.39 -0.79 0.21 114.58 119.88 1tk9 h GLU 63 Ca 0.25 -0.27 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 1tk9 h GLU 63 Cb 0.23 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1tk9 h GLU 63 CO -0.07 0.91 -0.03 -0.07 -1.16 0.00 0.00 179.01 178.59 1tk9 h LEU 64 N 0.84 0.04 -0.74 1.33 3.38 -0.72 -3.17 115.31 116.27 1tk9 h LEU 64 Ca 0.16 -0.65 -0.11 0.00 0.09 0.00 0.00 57.88 57.36 1tk9 h LEU 64 Cb 0.51 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1tk9 h LEU 64 CO 0.03 0.68 -0.27 0.77 0.09 0.00 0.00 178.44 179.74 1tk9 h SER 65 N -0.60 0.68 0.00 -0.43 4.64 -0.93 -0.17 113.55 116.75 1tk9 h SER 65 Ca -0.00 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1tk9 h SER 65 Cb 0.68 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1tk9 h SER 65 CO 0.01 0.92 0.00 0.61 -0.87 0.00 0.00 176.83 177.49 1tk9 n GLY 66 N -0.22 0.48 3.06 -0.77 0.00 0.73 -4.14 105.19 104.33 1tk9 n GLY 66 Ca -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1tk9 n GLY 66 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tk9 s ARG 67 N 2.80 0.68 -0.11 1.61 3.00 -1.20 -4.68 118.95 121.04 1tk9 s ARG 67 Ca 0.00 -0.57 -0.08 0.00 0.00 0.00 0.00 55.73 55.08 1tk9 s ARG 67 Cb 0.00 -0.61 -0.03 0.00 0.00 0.00 0.00 34.95 34.32 1tk9 s ARG 67 CO 0.00 0.15 -0.16 0.98 0.00 0.00 0.00 175.30 176.27 1tk9 n TYR 68 N 2.15 0.53 0.00 -0.53 9.36 -1.21 -4.70 117.16 122.76 1tk9 n TYR 68 Ca -0.18 0.23 0.00 0.00 3.32 0.00 0.00 57.90 61.28 1tk9 n TYR 68 Cb 0.56 -0.57 0.00 0.00 -0.63 0.00 0.00 39.34 38.69 1tk9 n TYR 68 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1tk9 n LYS 69 N -3.98 0.00 -2.61 2.98 5.02 -1.26 -5.11 118.16 113.19 1tk9 n LYS 69 Ca -0.06 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.89 1tk9 n LYS 69 Cb 0.24 -0.04 -0.05 0.00 -0.02 0.00 0.00 35.03 35.16 1tk9 n LYS 69 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1tk9 s LYS 70 N -1.89 3.98 -0.93 1.97 2.20 -1.26 -4.97 119.74 118.83 1tk9 s LYS 70 Ca 0.00 1.18 -0.22 0.00 -0.36 0.00 0.00 55.97 56.57 1tk9 s LYS 70 Cb 0.00 -2.13 0.07 0.00 -1.51 0.00 0.00 37.83 34.26 1tk9 s LYS 70 CO 0.00 -0.26 1.30 -1.21 -0.36 0.00 0.00 175.35 174.83 1tk9 s GLU 71 N -3.40 3.50 0.43 4.03 0.41 -1.26 -4.89 118.70 117.53 1tk9 s GLU 71 Ca 0.63 -1.16 0.03 0.00 -0.41 0.00 0.00 54.97 54.07 1tk9 s GLU 71 Cb -0.12 -5.00 -0.03 0.00 -1.78 0.00 0.00 34.13 27.20 1tk9 s GLU 71 CO 0.20 -2.05 0.08 -0.98 -0.49 0.00 0.00 175.26 172.01 1tk9 s ARG 72 N 4.39 1.99 0.89 1.61 1.70 -1.26 -5.14 118.95 123.12 1tk9 s ARG 72 Ca 0.39 -2.22 -0.11 0.00 -0.47 0.00 0.00 55.73 53.32 1tk9 s ARG 72 Cb -0.04 -0.95 0.13 0.00 -0.57 0.00 0.00 34.95 33.52 1tk9 s ARG 72 CO -0.05 -0.40 1.10 -1.59 -1.08 0.00 0.00 175.30 173.28 1tk9 s LYS 73 N -3.78 1.30 0.28 3.89 -2.85 -1.26 -4.96 119.74 112.37 1tk9 s LYS 73 Ca 0.20 1.08 -0.29 0.00 -1.00 0.00 0.00 55.97 55.96 1tk9 s LYS 73 Cb 0.03 -1.79 -0.10 0.00 -2.06 0.00 0.00 37.83 33.91 1tk9 s LYS 73 CO 0.11 -2.28 1.12 0.00 0.10 0.00 0.00 175.35 174.41 1tk9 s ALA 74 N -2.82 3.42 0.11 0.59 0.00 -1.26 -4.96 121.76 116.83 1tk9 s ALA 74 Ca 0.64 0.94 0.07 0.00 0.00 0.00 0.00 51.96 53.61 1tk9 s ALA 74 Cb -0.19 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 1tk9 s ALA 74 CO 0.58 -0.22 -0.11 -0.51 0.00 0.00 0.00 175.76 175.49 1tk9 s LEU 75 N -1.40 2.98 -1.02 0.00 1.43 -0.08 -4.97 118.68 115.62 1tk9 s LEU 75 Ca 0.45 -0.42 -0.23 0.00 -1.03 0.00 0.00 54.13 52.90 1tk9 s LEU 75 Cb -0.33 -1.78 -0.12 0.00 0.03 0.00 0.00 46.19 43.99 1tk9 s LEU 75 CO 0.42 0.18 1.92 0.00 0.23 0.00 0.00 176.35 179.10 1tk9 n ALA 76 N 0.69 2.25 -2.73 4.21 0.00 -1.26 -3.19 120.51 120.48 1tk9 n ALA 76 Ca -0.14 -3.10 -0.33 0.00 0.00 0.00 0.00 53.44 49.88 1tk9 n ALA 76 Cb 0.52 -3.54 -0.14 0.00 0.00 0.00 0.00 19.45 16.30 1tk9 n ALA 76 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1tk9 s GLY 77 N 6.03 1.51 -0.05 0.00 0.00 -1.26 -0.51 107.32 113.04 1tk9 s GLY 77 Ca 0.65 -0.95 -0.02 0.00 0.00 0.00 0.00 44.72 44.40 1tk9 s GLY 77 CO 0.14 -0.53 0.08 -0.42 0.00 0.00 0.00 173.10 172.36 1tk9 s ILE 78 N -0.26 -0.11 -0.00 0.90 1.01 0.05 -4.66 121.20 118.12 1tk9 s ILE 78 Ca 0.01 0.32 -0.20 0.00 0.00 0.00 0.00 60.65 60.77 1tk9 s ILE 78 Cb -0.13 -0.17 -0.05 0.00 0.01 0.00 0.00 42.46 42.12 1tk9 s ILE 78 CO 0.03 0.13 0.59 0.00 0.00 0.00 0.00 174.94 175.69 1tk9 s ALA 79 N 1.71 3.49 -1.28 9.38 0.00 -1.26 -1.11 121.76 132.70 1tk9 s ALA 79 Ca -0.02 0.02 0.17 0.00 0.00 0.00 0.00 51.96 52.14 1tk9 s ALA 79 Cb -0.12 -2.73 0.65 0.00 0.00 0.00 0.00 23.12 20.92 1tk9 s ALA 79 CO -0.04 0.18 1.55 1.28 0.00 0.00 0.00 175.76 178.73 1tk9 n LEU 80 N 2.67 4.30 -0.64 0.00 4.77 0.12 -4.20 117.00 124.03 1tk9 n LEU 80 Ca -0.07 -2.17 0.06 0.00 -0.03 0.00 0.00 56.01 53.80 1tk9 n LEU 80 Cb 0.51 -0.54 0.16 0.00 -2.33 0.00 0.00 43.42 41.22 1tk9 n LEU 80 CO 0.43 0.76 0.63 0.35 -1.33 0.00 0.00 177.39 178.24 1tk9 n THR 81 N 1.07 1.24 -0.08 -5.08 -2.24 -1.26 -4.72 114.28 103.21 1tk9 n THR 81 Ca 0.23 -1.17 -0.09 0.00 -2.27 0.00 0.00 64.05 60.75 1tk9 n THR 81 Cb 0.80 0.35 -0.12 0.00 -2.10 0.00 0.00 70.33 69.26 1tk9 n THR 81 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1tk9 n THR 82 N 0.24 1.10 -2.34 4.28 -2.24 -1.26 -4.85 114.28 109.20 1tk9 n THR 82 Ca 0.13 -0.62 -0.38 0.00 -2.27 0.00 0.00 64.05 60.91 1tk9 n THR 82 Cb 0.50 -0.72 -0.03 0.00 -2.10 0.00 0.00 70.33 67.98 1tk9 n THR 82 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1tk9 s ASP 83 N -5.17 5.85 0.54 3.42 -1.08 -1.26 -4.83 116.67 114.13 1tk9 s ASP 83 Ca -0.12 -0.51 0.29 0.00 -0.52 0.00 0.00 52.55 51.69 1tk9 s ASP 83 Cb 0.05 -2.55 1.52 0.00 -1.46 0.00 0.00 42.92 40.48 1tk9 s ASP 83 CO 0.61 -2.05 2.10 0.71 0.52 0.00 0.00 175.17 177.06 1tk9 h THR 84 N 6.61 0.51 -0.29 1.71 1.35 -1.98 -0.63 112.91 120.19 1tk9 h THR 84 Ca -0.11 -0.46 -0.18 0.00 -0.55 0.00 0.00 66.41 65.10 1tk9 h THR 84 Cb 1.06 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 1tk9 h THR 84 CO 1.29 0.10 -0.53 0.28 -0.25 0.00 0.00 175.52 176.40 1tk9 h SER 85 N 0.00 0.97 -0.28 5.36 0.02 -1.99 -1.78 113.55 115.84 1tk9 h SER 85 Ca -0.00 -0.53 -0.19 0.00 -0.84 0.00 0.00 61.79 60.23 1tk9 h SER 85 Cb 0.30 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1tk9 h SER 85 CO 0.01 1.32 -0.57 0.00 -1.14 0.00 0.00 176.83 176.45 1tk9 h ALA 86 N 0.68 0.44 -0.28 3.77 0.00 -1.79 -1.31 119.26 120.77 1tk9 h ALA 86 Ca 0.02 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.36 1tk9 h ALA 86 Cb 1.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1tk9 h ALA 86 CO 0.12 0.67 0.00 -0.07 0.00 0.00 0.00 179.25 179.98 1tk9 h LEU 87 N 0.66 0.48 -0.28 0.00 3.38 -1.14 -2.50 115.31 115.90 1tk9 h LEU 87 Ca 0.01 -0.31 -0.20 0.00 0.09 0.00 0.00 57.88 57.47 1tk9 h LEU 87 Cb 1.18 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1tk9 h LEU 87 CO 0.13 0.67 -0.75 0.77 0.09 0.00 0.00 178.44 179.35 1tk9 h SER 88 N 0.27 0.73 0.06 -0.43 4.64 -1.38 -1.05 113.55 116.39 1tk9 h SER 88 Ca 0.08 -0.47 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1tk9 h SER 88 Cb 0.42 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1tk9 h SER 88 CO 0.01 1.24 -0.03 0.00 -0.87 0.00 0.00 176.83 177.19 1tk9 h ALA 89 N 0.74 -0.09 -0.30 5.18 0.00 -1.25 0.10 119.26 123.65 1tk9 h ALA 89 Ca -0.04 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 1tk9 h ALA 89 Cb 1.35 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 1tk9 h ALA 89 CO 0.14 -0.48 -0.29 0.82 0.00 0.00 0.00 179.25 179.44 1tk9 h ILE 90 N -0.21 1.30 -0.74 0.00 1.08 -1.53 -0.98 117.51 116.42 1tk9 h ILE 90 Ca -0.01 -1.46 0.03 0.00 -0.39 0.00 0.00 64.86 63.03 1tk9 h ILE 90 Cb 0.18 1.56 -0.05 0.00 -3.07 0.00 0.00 36.82 35.45 1tk9 h ILE 90 CO 0.01 0.47 0.47 1.23 -0.69 0.00 0.00 178.15 179.64 1tk9 h GLY 91 N 0.48 1.07 1.63 5.37 0.00 -1.11 0.34 103.07 110.85 1tk9 h GLY 91 Ca 0.05 -0.35 -0.26 0.00 0.00 0.00 0.00 47.33 46.76 1tk9 h GLY 91 CO 0.07 0.29 -1.18 -0.57 0.00 0.00 0.00 176.54 175.15 1tk9 h ASN 92 N 0.90 0.43 0.36 0.19 -0.73 -0.75 -3.00 115.58 112.98 1tk9 h ASN 92 Ca 0.30 -0.44 -0.32 0.00 1.87 0.00 0.00 56.30 57.71 1tk9 h ASN 92 Cb 0.03 -0.14 -0.03 0.00 0.27 0.00 0.00 38.32 38.45 1tk9 h ASN 92 CO -0.11 1.32 -1.76 0.44 -0.37 0.00 0.00 177.43 176.95 1tk9 h ASP 93 N 0.10 0.24 0.00 1.15 3.32 -1.07 -3.43 116.42 116.73 1tk9 h ASP 93 Ca -0.12 -0.47 -0.08 0.00 0.02 0.00 0.00 57.03 56.38 1tk9 h ASP 93 Cb 1.89 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 41.35 1tk9 h ASP 93 CO 0.19 1.41 -1.32 -1.22 -1.72 0.00 0.00 179.24 176.59 1tk9 n TYR 94 N -3.30 0.00 0.00 4.55 4.02 -0.01 -5.08 117.16 117.34 1tk9 n TYR 94 Ca -0.22 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.67 1tk9 n TYR 94 Cb 1.05 -0.22 0.00 0.00 -0.02 0.00 0.00 39.34 40.14 1tk9 n TYR 94 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1tk9 n GLY 95 N 2.95 4.81 0.28 2.72 0.00 -0.47 -4.94 105.19 110.55 1tk9 n GLY 95 Ca -0.09 -1.08 0.15 0.00 0.00 0.00 0.00 46.02 45.00 1tk9 n GLY 95 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1tk9 h PHE 96 N 0.00 0.00 0.00 1.61 3.57 -1.79 -2.23 116.94 118.11 1tk9 h PHE 96 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1tk9 h PHE 96 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1tk9 h PHE 96 CO 0.00 0.06 0.00 -0.85 -2.23 0.00 0.00 178.31 175.29 1tk9 n GLU 97 N -3.61 0.07 0.00 1.11 0.00 -1.26 -2.74 120.64 114.21 1tk9 n GLU 97 Ca -0.02 0.33 0.09 0.00 0.00 0.00 0.00 57.16 57.56 1tk9 n GLU 97 Cb 0.17 -1.64 0.00 0.00 0.00 0.00 0.00 31.44 29.97 1tk9 n GLU 97 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1tk9 n PHE 98 N -1.78 0.00 -0.28 -1.84 3.01 -0.84 -4.04 117.46 111.70 1tk9 n PHE 98 Ca 0.03 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.57 1tk9 n PHE 98 Cb 0.18 0.00 0.23 0.00 -0.01 0.00 0.00 39.48 39.88 1tk9 n PHE 98 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 1tk9 h VAL 99 N 2.10 0.56 0.16 -4.37 -1.51 -1.63 -0.94 116.25 110.62 1tk9 h VAL 99 Ca 0.00 -0.14 -0.34 0.00 -1.23 0.00 0.00 66.70 64.99 1tk9 h VAL 99 Cb 0.62 0.12 0.00 0.00 -2.13 0.00 0.00 31.29 29.90 1tk9 h VAL 99 CO 0.00 0.07 -1.75 -0.26 -1.23 0.00 0.00 177.57 174.40 1tk9 h PHE 100 N 0.40 0.61 -0.98 5.19 0.05 -1.83 -3.34 116.94 117.04 1tk9 h PHE 100 Ca 0.47 -0.45 0.05 0.00 3.82 0.00 0.00 57.97 61.86 1tk9 h PHE 100 Cb 0.81 -0.02 -0.06 0.00 2.00 0.00 0.00 35.95 38.67 1tk9 h PHE 100 CO -0.18 1.69 0.63 0.66 -0.18 0.00 0.00 178.31 180.93 1tk9 h SER 101 N 0.02 1.03 -0.77 2.17 4.64 -1.72 -1.11 113.55 117.82 1tk9 h SER 101 Ca -0.36 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.95 1tk9 h SER 101 Cb 2.02 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 63.85 1tk9 h SER 101 CO 0.13 0.68 0.44 -0.09 -0.87 0.00 0.00 176.83 177.13 1tk9 h ARG 102 N 1.19 1.07 0.00 4.77 9.65 -1.33 -1.40 114.38 128.32 1tk9 h ARG 102 Ca 0.41 -0.11 -0.11 0.00 -1.10 0.00 0.00 59.98 59.07 1tk9 h ARG 102 Cb 0.09 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.43 1tk9 h ARG 102 CO -0.15 0.77 -0.54 1.96 2.80 0.00 0.00 179.97 184.81 1tk9 h GLN 103 N 1.08 0.00 -0.48 0.20 4.20 -1.42 -2.20 115.11 116.49 1tk9 h GLN 103 Ca 0.28 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.87 1tk9 h GLN 103 Cb -0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1tk9 h GLN 103 CO -0.05 0.54 -0.18 0.28 -0.67 0.00 0.00 178.83 178.76 1tk9 h VAL 104 N 0.00 1.27 -0.48 -0.54 2.07 -0.50 -1.68 116.25 116.38 1tk9 h VAL 104 Ca -0.01 -1.33 -0.04 0.00 0.82 0.00 0.00 66.70 66.14 1tk9 h VAL 104 Cb 1.05 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1tk9 h VAL 104 CO 0.07 0.46 0.12 -0.33 0.02 0.00 0.00 177.57 177.91 1tk9 h GLU 105 N 0.83 0.73 0.00 1.57 5.08 -0.95 0.30 114.58 122.14 1tk9 h GLU 105 Ca 0.12 -0.14 -0.17 0.00 -1.00 0.00 0.00 59.36 58.17 1tk9 h GLU 105 Cb 0.73 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1tk9 h GLU 105 CO 0.06 0.66 -0.81 0.00 -1.00 0.00 0.00 179.01 177.92 1tk9 h ALA 106 N 1.42 0.59 0.00 3.43 0.00 -1.06 -3.39 119.26 120.25 1tk9 h ALA 106 Ca 0.16 -0.74 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 1tk9 h ALA 106 Cb 0.26 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1tk9 h ALA 106 CO -0.00 1.01 -1.11 1.28 0.00 0.00 0.00 179.25 180.43 1tk9 n LEU 107 N -3.47 0.00 -4.82 0.00 4.77 -0.66 -5.07 117.00 107.75 1tk9 n LEU 107 Ca -0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 1tk9 n LEU 107 Cb 0.81 0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.84 1tk9 n LEU 107 CO 0.44 0.01 0.65 -0.83 -1.33 0.00 0.00 177.39 176.33 1tk9 s GLY 108 N -2.38 2.40 0.08 -0.72 0.00 0.08 -5.08 107.32 101.71 1tk9 s GLY 108 Ca -0.01 0.42 -0.05 0.00 0.00 0.00 0.00 44.72 45.08 1tk9 s GLY 108 CO 0.09 0.70 0.10 0.54 0.00 0.00 0.00 173.10 174.53 1tk9 s ASN 109 N -2.16 0.28 0.26 1.64 4.22 -1.26 -4.95 114.94 112.96 1tk9 s ASN 109 Ca 0.62 -0.85 0.08 0.00 -2.14 0.00 0.00 52.86 50.57 1tk9 s ASN 109 Cb -0.10 0.29 0.43 0.00 1.28 0.00 0.00 41.25 43.15 1tk9 s ASN 109 CO 0.14 -0.69 1.07 -1.84 -2.04 0.00 0.00 177.10 173.74 1tk9 n GLU 110 N -0.01 0.06 0.00 3.55 -0.00 -1.17 0.00 120.64 123.08 1tk9 n GLU 110 Ca -0.13 0.48 0.13 0.00 -0.00 0.00 0.00 57.16 57.64 1tk9 n GLU 110 Cb 0.62 -2.07 0.34 0.00 -0.00 0.00 0.00 31.44 30.33 1tk9 n GLU 110 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1tk9 n LYS 111 N -1.82 1.54 -2.89 3.44 4.81 -1.26 -4.77 118.16 117.21 1tk9 n LYS 111 Ca -0.01 -1.04 -0.19 0.00 -0.87 0.00 0.00 58.31 56.20 1tk9 n LYS 111 Cb 0.40 -1.48 0.03 0.00 0.02 0.00 0.00 35.03 34.00 1tk9 n LYS 111 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1tk9 s ASP 112 N -2.18 5.40 0.02 3.14 1.01 0.10 -4.16 116.67 120.00 1tk9 s ASP 112 Ca 0.30 -0.36 0.06 0.00 0.71 0.00 0.00 52.55 53.26 1tk9 s ASP 112 Cb 0.20 -0.55 -0.02 0.00 1.01 0.00 0.00 42.92 43.56 1tk9 s ASP 112 CO 0.40 -1.01 -0.18 -0.69 0.21 0.00 0.00 175.17 173.90 1tk9 s VAL 113 N -2.55 1.46 -0.17 -1.27 1.01 -0.35 -2.50 120.40 116.02 1tk9 s VAL 113 Ca 0.57 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.57 1tk9 s VAL 113 Cb -0.09 -1.26 0.01 0.00 0.00 0.00 0.00 36.38 35.04 1tk9 s VAL 113 CO 0.36 0.25 -0.18 -0.22 0.00 0.00 0.00 175.10 175.30 1tk9 s LEU 114 N -0.87 2.26 -0.29 3.92 2.96 -0.08 -0.20 118.68 126.38 1tk9 s LEU 114 Ca 0.06 -0.59 -0.07 0.00 -0.22 0.00 0.00 54.13 53.32 1tk9 s LEU 114 Cb -0.08 -1.51 0.01 0.00 0.50 0.00 0.00 46.19 45.11 1tk9 s LEU 114 CO 0.01 0.03 0.08 -0.63 -1.32 0.00 0.00 176.35 174.51 1tk9 s ILE 115 N 1.14 3.96 -0.11 6.68 1.01 0.17 -0.85 121.20 133.20 1tk9 s ILE 115 Ca 0.01 -0.68 -0.09 0.00 0.00 0.00 0.00 60.65 59.89 1tk9 s ILE 115 Cb -0.14 -3.04 -0.04 0.00 0.01 0.00 0.00 42.46 39.25 1tk9 s ILE 115 CO -0.08 0.09 0.19 -0.83 0.00 0.00 0.00 174.94 174.31 1tk9 s GLY 116 N 1.50 2.20 -0.14 6.18 0.00 0.33 -1.78 107.32 115.61 1tk9 s GLY 116 Ca 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 44.72 44.18 1tk9 s GLY 116 CO 0.02 -0.19 -0.12 -0.42 0.00 0.00 0.00 173.10 172.40 1tk9 s ILE 117 N -0.80 1.39 -0.23 0.90 1.01 -0.27 -0.91 121.20 122.28 1tk9 s ILE 117 Ca 0.16 -0.54 -0.10 0.00 0.00 0.00 0.00 60.65 60.16 1tk9 s ILE 117 Cb -0.13 -1.35 0.09 0.00 0.01 0.00 0.00 42.46 41.08 1tk9 s ILE 117 CO 0.05 0.40 0.53 -0.55 0.00 0.00 0.00 174.94 175.37 1tk9 s SER 118 N 1.56 -0.67 0.38 3.58 0.15 -0.40 -4.07 113.70 114.23 1tk9 s SER 118 Ca 0.05 1.21 0.28 0.00 0.70 0.00 0.00 55.95 58.18 1tk9 s SER 118 Cb -0.13 1.42 1.29 0.00 -1.71 0.00 0.00 66.02 66.89 1tk9 s SER 118 CO -0.10 -0.22 1.83 0.71 1.20 0.00 0.00 173.24 176.66 1tk9 h THR 119 N 5.73 0.00 0.00 6.45 1.35 -1.90 -2.86 112.91 121.68 1tk9 h THR 119 Ca -0.25 -0.19 -0.02 0.00 -0.55 0.00 0.00 66.41 65.40 1tk9 h THR 119 Cb 1.15 0.94 -0.00 0.00 -1.73 0.00 0.00 68.15 68.51 1tk9 h THR 119 CO 0.17 0.00 -1.55 -1.54 -0.25 0.00 0.00 175.52 172.35 1tk9 n SER 120 N -2.51 2.37 -0.63 5.36 3.41 -1.26 -2.92 113.62 117.44 1tk9 n SER 120 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.53 1tk9 n SER 120 Cb 0.17 1.45 -0.03 0.00 -0.26 0.00 0.00 64.21 65.54 1tk9 n SER 120 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tk9 n GLY 121 N 1.90 0.91 0.00 5.00 0.00 -1.08 -3.26 105.19 108.66 1tk9 n GLY 121 Ca -0.04 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1tk9 n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tk9 n LYS 122 N -2.68 0.40 -1.76 1.61 5.02 -1.26 -4.21 118.16 115.28 1tk9 n LYS 122 Ca -0.08 -0.53 -0.42 0.00 -2.02 0.00 0.00 58.31 55.26 1tk9 n LYS 122 Cb 0.29 -0.64 -0.03 0.00 -0.02 0.00 0.00 35.03 34.63 1tk9 n LYS 122 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1tk9 s SER 123 N -0.17 6.27 0.19 4.39 0.01 -1.26 -4.89 113.70 118.24 1tk9 s SER 123 Ca 0.00 2.33 -0.14 0.00 1.31 0.00 0.00 55.95 59.45 1tk9 s SER 123 Cb 0.00 -2.53 0.20 0.00 0.21 0.00 0.00 66.02 63.90 1tk9 s SER 123 CO 0.00 -1.24 1.65 -0.65 0.41 0.00 0.00 173.24 173.41 1tk9 h PRO 124 N 11.36 0.03 -0.53 12.44 0.11 -1.97 -0.25 132.00 153.20 1tk9 h PRO 124 Ca -0.45 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 1tk9 h PRO 124 Cb 1.22 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 1tk9 h PRO 124 CO 0.95 0.02 0.22 -2.95 -0.21 0.00 0.00 178.00 176.04 1tk9 h ASN 125 N 0.03 0.69 -0.17 -2.05 7.08 -1.81 -0.20 115.58 119.15 1tk9 h ASN 125 Ca 0.27 -0.08 -0.07 0.00 -3.08 0.00 0.00 56.30 53.35 1tk9 h ASN 125 Cb 0.41 -0.18 -0.00 0.00 -2.08 0.00 0.00 38.32 36.48 1tk9 h ASN 125 CO -0.53 0.61 -0.15 0.58 -2.08 0.00 0.00 177.43 175.86 1tk9 h VAL 126 N 0.76 1.33 -0.70 6.14 2.07 -1.68 -1.73 116.25 122.45 1tk9 h VAL 126 Ca 0.18 -1.29 0.06 0.00 0.82 0.00 0.00 66.70 66.48 1tk9 h VAL 126 Cb 0.13 1.80 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 1tk9 h VAL 126 CO -0.02 0.38 0.39 -0.07 0.02 0.00 0.00 177.57 178.28 1tk9 h LEU 127 N 0.05 0.58 -0.75 2.57 3.38 -0.63 -0.94 115.31 119.58 1tk9 h LEU 127 Ca 0.03 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1tk9 h LEU 127 Cb 0.67 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1tk9 h LEU 127 CO 0.04 0.37 -0.00 -0.08 0.09 0.00 0.00 178.44 178.86 1tk9 h GLU 128 N 0.72 0.95 -0.71 1.13 4.57 -0.97 -2.24 114.58 118.03 1tk9 h GLU 128 Ca 0.31 -0.29 -0.07 0.00 -1.18 0.00 0.00 59.36 58.14 1tk9 h GLU 128 Cb 0.20 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.66 1tk9 h GLU 128 CO -0.19 0.94 0.18 0.00 -1.18 0.00 0.00 179.01 178.76 1tk9 h ALA 129 N 1.11 0.97 -0.54 2.92 0.00 -0.50 -1.70 119.26 121.52 1tk9 h ALA 129 Ca 0.16 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1tk9 h ALA 129 Cb 0.52 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1tk9 h ALA 129 CO 0.03 0.67 0.02 -0.07 0.00 0.00 0.00 179.25 179.89 1tk9 h LEU 130 N 1.08 0.86 -0.27 0.00 3.38 -0.95 -0.28 115.31 119.12 1tk9 h LEU 130 Ca 0.22 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1tk9 h LEU 130 Cb 0.36 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1tk9 h LEU 130 CO 0.00 0.91 0.03 0.11 0.09 0.00 0.00 178.44 179.58 1tk9 h LYS 131 N 0.84 0.47 -0.34 1.13 1.57 -1.14 -1.55 116.57 117.54 1tk9 h LYS 131 Ca 0.16 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1tk9 h LYS 131 Cb 0.47 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1tk9 h LYS 131 CO 0.02 0.60 0.17 -0.22 -0.57 0.00 0.00 179.45 179.44 1tk9 h LYS 132 N 0.27 0.49 -0.43 3.15 1.63 -1.09 -1.71 116.57 118.88 1tk9 h LYS 132 Ca 0.08 -0.07 0.05 0.00 -0.85 0.00 0.00 60.65 59.86 1tk9 h LYS 132 Cb 0.37 -0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 31.86 1tk9 h LYS 132 CO 0.01 0.45 0.16 0.00 -3.45 0.00 0.00 179.45 176.61 1tk9 h ALA 133 N 1.02 0.52 -0.49 5.00 0.00 -0.96 -0.95 119.26 123.39 1tk9 h ALA 133 Ca 0.12 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1tk9 h ALA 133 Cb 0.12 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1tk9 h ALA 133 CO -0.02 -0.23 0.22 -0.22 0.00 0.00 0.00 179.25 179.01 1tk9 h LYS 134 N 0.33 0.69 -0.35 0.00 3.64 -1.06 -0.86 116.57 118.96 1tk9 h LYS 134 Ca 0.20 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1tk9 h LYS 134 Cb 0.18 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1tk9 h LYS 134 CO -0.20 0.55 0.18 0.93 -2.27 0.00 0.00 179.45 178.64 1tk9 h GLU 135 N 0.69 0.48 -0.62 1.90 5.08 -0.26 -0.49 114.58 121.35 1tk9 h GLU 135 Ca 0.17 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1tk9 h GLU 135 Cb 0.10 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1tk9 h GLU 135 CO -0.02 0.37 0.00 1.28 -1.00 0.00 0.00 179.01 179.63 1tk9 n LEU 136 N -4.43 2.85 -2.69 1.33 4.77 -0.35 -5.11 117.00 113.37 1tk9 n LEU 136 Ca 0.02 -1.44 -0.04 0.00 -0.03 0.00 0.00 56.01 54.52 1tk9 n LEU 136 Cb 0.11 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 40.70 1tk9 n LEU 136 CO 0.36 0.47 -0.58 0.59 -1.33 0.00 0.00 177.39 176.89 1tk9 n ASN 137 N 0.43 -2.96 -4.37 -1.43 3.02 -0.20 -3.01 115.26 106.74 1tk9 n ASN 137 Ca 0.13 1.32 -0.33 0.00 -0.03 0.00 0.00 54.58 55.68 1tk9 n ASN 137 Cb 0.57 -4.92 -0.14 0.00 -0.61 0.00 0.00 39.78 34.68 1tk9 n ASN 137 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1tk9 s LEU 139 N -0.87 2.66 -0.25 3.41 2.96 -1.04 -4.47 118.68 121.07 1tk9 s LEU 139 Ca -0.19 -0.33 -0.04 0.00 -0.22 0.00 0.00 54.13 53.34 1tk9 s LEU 139 Cb 0.01 -1.59 0.00 0.00 0.50 0.00 0.00 46.19 45.12 1tk9 s LEU 139 CO 0.72 0.19 -0.01 0.00 -1.32 0.00 0.00 176.35 175.92 1tk9 s LEU 141 N 1.46 2.31 0.02 0.00 1.43 -0.03 -0.30 118.68 123.58 1tk9 s LEU 141 Ca 0.04 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.41 1tk9 s LEU 141 Cb -0.15 -1.12 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 1tk9 s LEU 141 CO -0.02 0.15 -0.04 -0.83 0.23 0.00 0.00 176.35 175.84 1tk9 s GLY 142 N -2.02 0.28 -0.18 -3.19 0.00 -0.14 -0.51 107.32 101.57 1tk9 s GLY 142 Ca 0.12 -0.62 0.01 0.00 0.00 0.00 0.00 44.72 44.23 1tk9 s GLY 142 CO 0.05 -0.69 -0.13 1.08 0.00 0.00 0.00 173.10 173.41 1tk9 s LEU 143 N -1.48 2.03 0.00 0.66 1.43 -0.09 0.15 118.68 121.37 1tk9 s LEU 143 Ca -0.15 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.26 1tk9 s LEU 143 Cb -0.10 -1.25 0.00 0.00 0.03 0.00 0.00 46.19 44.87 1tk9 s LEU 143 CO -0.01 -0.09 0.00 -1.54 0.23 0.00 0.00 176.35 174.95 1tk9 n SER 144 N 4.71 0.00 -0.49 2.29 3.41 -0.42 -1.28 113.62 121.83 1tk9 n SER 144 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 1tk9 n SER 144 Cb 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1tk9 n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tk9 n GLY 145 N 0.00 1.33 3.93 5.00 0.00 -1.15 -0.45 105.19 113.84 1tk9 n GLY 145 Ca 0.00 -0.77 -0.28 0.00 0.00 0.00 0.00 46.02 44.97 1tk9 n GLY 145 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tk9 n LYS 146 N 0.00 -4.57 0.00 1.61 5.02 -0.35 -1.50 118.16 118.38 1tk9 n LYS 146 Ca 0.00 0.53 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 1tk9 n LYS 146 Cb 0.00 -5.17 0.00 0.00 -0.02 0.00 0.00 35.03 29.84 1tk9 n LYS 146 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tk9 n GLY 147 N -1.67 3.16 0.00 0.72 0.00 -1.26 -4.19 105.19 101.94 1tk9 n GLY 147 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1tk9 n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tk9 n GLY 148 N -1.67 2.25 4.00 -0.02 0.00 -0.56 -4.94 105.19 104.24 1tk9 n GLY 148 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1tk9 n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tk9 n GLY 149 N -1.36 0.00 0.00 -0.02 0.00 -1.20 -4.47 105.19 98.14 1tk9 n GLY 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1tk9 n GLY 149 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tk9 n ASN 152 N 0.00 0.00 -0.00 1.61 3.02 -1.26 -4.97 115.26 113.66 1tk9 n ASN 152 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.33 1tk9 n ASN 152 Cb 0.00 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.03 1tk9 n ASN 152 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1tk9 h LYS 153 N 0.00 0.23 0.00 3.52 3.64 -1.99 -3.38 116.57 118.59 1tk9 h LYS 153 Ca 0.00 -0.40 -0.02 0.00 -1.27 0.00 0.00 60.65 58.96 1tk9 h LYS 153 Cb 0.00 0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1tk9 h LYS 153 CO 0.00 1.19 -0.11 -0.07 -2.27 0.00 0.00 179.45 178.19 1tk9 h LEU 154 N -0.27 0.00 -9.65 5.20 3.38 -1.98 -3.44 115.31 108.55 1tk9 h LEU 154 Ca -0.34 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 56.96 1tk9 h LEU 154 Cb 1.80 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.48 1tk9 h LEU 154 CO 0.04 0.11 -0.49 0.00 0.09 0.00 0.00 178.44 178.19 1tk9 h ASP 156 N 4.78 0.42 -3.39 0.00 3.32 -0.96 -3.41 116.42 117.19 1tk9 h ASP 156 Ca -0.54 -0.15 -0.33 0.00 0.02 0.00 0.00 57.03 56.04 1tk9 h ASP 156 Cb 1.22 -0.12 -0.36 0.00 0.22 0.00 0.00 39.33 40.29 1tk9 h ASP 156 CO 0.60 0.70 -0.72 -1.00 -1.72 0.00 0.00 179.24 177.10 1tk9 s HIS 157 N -4.43 0.02 -0.21 4.55 3.76 -1.18 -5.07 115.29 112.73 1tk9 s HIS 157 Ca -0.06 0.25 0.00 0.00 -0.15 0.00 0.00 55.06 55.10 1tk9 s HIS 157 Cb 0.14 -0.34 0.05 0.00 1.11 0.00 0.00 32.58 33.54 1tk9 s HIS 157 CO 0.78 -0.15 -0.06 1.21 -0.85 0.00 0.00 174.74 175.67 1tk9 s ASN 158 N 1.68 3.52 -0.98 1.40 2.47 -1.26 -0.97 114.94 120.80 1tk9 s ASN 158 Ca -0.02 -1.00 -0.22 0.00 0.42 0.00 0.00 52.86 52.05 1tk9 s ASN 158 Cb -0.12 -1.13 0.07 0.00 -1.45 0.00 0.00 41.25 38.62 1tk9 s ASN 158 CO -0.03 -0.20 1.35 -0.76 -3.72 0.00 0.00 177.10 173.73 1tk9 s LEU 159 N 1.45 3.95 -0.41 3.21 1.43 0.12 -4.96 118.68 123.48 1tk9 s LEU 159 Ca -0.03 -1.59 -0.25 0.00 -1.03 0.00 0.00 54.13 51.23 1tk9 s LEU 159 Cb -0.17 -2.52 0.02 0.00 0.03 0.00 0.00 46.19 43.55 1tk9 s LEU 159 CO -0.07 -1.39 0.90 -0.69 0.23 0.00 0.00 176.35 175.33 1tk9 s VAL 160 N 4.33 4.56 0.03 -1.59 1.01 -1.26 -1.30 120.40 126.18 1tk9 s VAL 160 Ca 0.42 0.96 -0.30 0.00 0.00 0.00 0.00 61.98 63.05 1tk9 s VAL 160 Cb -0.02 -4.36 -0.06 0.00 0.00 0.00 0.00 36.38 31.95 1tk9 s VAL 160 CO -0.09 -0.64 1.36 -0.69 0.00 0.00 0.00 175.10 175.04 1tk9 s VAL 161 N 3.53 3.70 -0.64 2.92 1.01 0.40 -4.88 120.40 126.45 1tk9 s VAL 161 Ca 0.37 1.14 -0.08 0.00 0.00 0.00 0.00 61.98 63.40 1tk9 s VAL 161 Cb -0.11 -3.73 -0.07 0.00 0.00 0.00 0.00 36.38 32.47 1tk9 s VAL 161 CO 0.21 0.03 1.80 -0.81 0.00 0.00 0.00 175.10 176.33 1tk9 n PRO 162 N 4.89 1.41 -3.43 2.72 -0.04 -1.26 -3.89 135.00 135.40 1tk9 n PRO 162 Ca 0.12 -1.26 -0.12 0.00 -0.04 0.00 0.00 63.50 62.20 1tk9 n PRO 162 Cb 0.44 -2.41 -0.02 0.00 -0.04 0.00 0.00 33.50 31.46 1tk9 n PRO 162 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1tk9 s SER 163 N 4.18 -0.56 0.00 3.54 0.15 -1.26 -4.96 113.70 114.79 1tk9 s SER 163 Ca 0.34 0.05 0.08 0.00 0.70 0.00 0.00 55.95 57.12 1tk9 s SER 163 Cb 0.09 0.58 0.03 0.00 -1.71 0.00 0.00 66.02 65.00 1tk9 s SER 163 CO 0.01 -0.91 0.64 0.47 1.20 0.00 0.00 173.24 174.65 1tk9 n ASP 164 N -0.28 1.32 -4.60 5.45 8.00 -1.26 -1.21 116.55 123.98 1tk9 n ASP 164 Ca -0.16 -1.16 -0.42 0.00 0.71 0.00 0.00 54.79 53.75 1tk9 n ASP 164 Cb 0.64 0.27 -0.04 0.00 -0.02 0.00 0.00 41.12 41.97 1tk9 n ASP 164 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1tk9 s ASP 165 N -0.95 6.62 0.24 -2.24 -1.08 -1.26 -4.88 116.67 113.13 1tk9 s ASP 165 Ca 0.08 0.48 -0.05 0.00 -0.52 0.00 0.00 52.55 52.54 1tk9 s ASP 165 Cb 0.06 -2.43 0.42 0.00 -1.46 0.00 0.00 42.92 39.51 1tk9 s ASP 165 CO 0.15 -0.80 1.75 0.71 0.52 0.00 0.00 175.17 177.51 1tk9 h THR 166 N 5.79 0.73 -0.26 1.71 1.35 -1.93 -0.27 112.91 120.02 1tk9 h THR 166 Ca -0.24 -0.18 -0.00 0.00 -0.55 0.00 0.00 66.41 65.44 1tk9 h THR 166 Cb 1.09 0.17 -0.01 0.00 -1.73 0.00 0.00 68.15 67.66 1tk9 h THR 166 CO 0.95 0.09 0.15 0.00 -0.25 0.00 0.00 175.52 176.46 1tk9 h ALA 167 N 1.51 0.34 -0.83 6.62 0.00 -1.99 -1.11 119.26 123.78 1tk9 h ALA 167 Ca 0.40 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1tk9 h ALA 167 Cb 0.54 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1tk9 h ALA 167 CO -0.35 -0.15 0.39 0.00 0.00 0.00 0.00 179.25 179.14 1tk9 h ARG 168 N 0.32 1.21 -0.26 0.00 2.47 -1.79 -1.46 114.38 114.86 1tk9 h ARG 168 Ca 0.09 -0.18 -0.01 0.00 -1.26 0.00 0.00 59.98 58.62 1tk9 h ARG 168 Cb 0.04 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.13 1tk9 h ARG 168 CO -0.02 0.93 0.12 0.82 0.56 0.00 0.00 179.97 182.38 1tk9 h ILE 169 N 1.19 1.16 -0.48 2.04 2.04 -0.79 -2.87 117.51 119.79 1tk9 h ILE 169 Ca 0.28 -0.46 -0.07 0.00 1.00 0.00 0.00 64.86 65.61 1tk9 h ILE 169 Cb 0.13 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1tk9 h ILE 169 CO -0.03 0.16 0.01 1.56 0.00 0.00 0.00 178.15 179.84 1tk9 h GLN 170 N 0.28 0.79 -0.66 2.37 4.20 -1.02 -0.30 115.11 120.76 1tk9 h GLN 170 Ca 0.09 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1tk9 h GLN 170 Cb 0.14 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1tk9 h GLN 170 CO -0.01 0.79 0.00 0.39 -0.67 0.00 0.00 178.83 179.33 1tk9 n GLU 171 N -4.22 0.07 0.00 1.46 1.02 -0.57 -2.12 120.64 116.28 1tk9 n GLU 171 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1tk9 n GLU 171 Cb 0.30 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 1tk9 n GLU 171 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1tk9 n HIS 173 N 0.63 0.00 -0.21 -0.32 8.25 -0.13 -2.93 115.22 120.51 1tk9 n HIS 173 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 1tk9 n HIS 173 Cb 0.02 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.16 1tk9 n HIS 173 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 1tk9 h ILE 174 N 0.00 1.25 -0.73 1.59 6.09 -1.71 0.47 117.51 124.48 1tk9 h ILE 174 Ca 0.00 -0.95 -0.03 0.00 -1.37 0.00 0.00 64.86 62.51 1tk9 h ILE 174 Cb 0.00 0.74 -0.03 0.00 0.47 0.00 0.00 36.82 37.99 1tk9 h ILE 174 CO 0.00 0.35 0.32 0.25 -3.07 0.00 0.00 178.15 176.00 1tk9 h LEU 175 N 0.86 0.96 -0.01 2.19 5.85 -1.82 -0.60 115.31 122.75 1tk9 h LEU 175 Ca 0.18 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1tk9 h LEU 175 Cb 0.39 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 1tk9 h LEU 175 CO 0.01 0.84 0.00 0.40 -0.34 0.00 0.00 178.44 179.35 1tk9 h ILE 176 N 1.04 1.15 -0.64 4.05 2.04 -1.75 -0.88 117.51 122.52 1tk9 h ILE 176 Ca 0.25 -0.45 0.08 0.00 1.00 0.00 0.00 64.86 65.74 1tk9 h ILE 176 Cb 0.15 1.44 -0.06 0.00 -0.74 0.00 0.00 36.82 37.61 1tk9 h ILE 176 CO -0.03 0.12 0.30 0.40 0.00 0.00 0.00 178.15 178.94 1tk9 h ILE 177 N -0.17 0.86 -0.58 -0.67 2.04 -0.55 0.15 117.51 118.59 1tk9 h ILE 177 Ca 0.00 -0.18 -0.08 0.00 1.00 0.00 0.00 64.86 65.60 1tk9 h ILE 177 Cb 0.19 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1tk9 h ILE 177 CO -0.00 0.10 0.06 0.45 0.00 0.00 0.00 178.15 178.76 1tk9 h HIS 178 N 0.54 1.01 -0.56 1.37 3.86 -0.96 0.61 115.15 121.02 1tk9 h HIS 178 Ca 0.31 -0.14 -0.08 0.00 -1.16 0.00 0.00 60.37 59.30 1tk9 h HIS 178 Cb 0.30 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.47 1tk9 h HIS 178 CO -0.12 0.88 0.06 1.15 0.86 0.00 0.00 177.93 180.76 1tk9 h THR 179 N 0.89 1.26 -0.34 2.45 2.02 -0.15 0.19 112.91 119.23 1tk9 h THR 179 Ca 0.18 -1.03 -0.08 0.00 0.77 0.00 0.00 66.41 66.25 1tk9 h THR 179 Cb 0.44 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 1tk9 h THR 179 CO 0.02 0.37 -0.12 -0.07 0.37 0.00 0.00 175.52 176.09 1tk9 h LEU 180 N 0.84 0.57 -0.85 2.58 3.38 -0.39 -1.22 115.31 120.23 1tk9 h LEU 180 Ca 0.17 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 1tk9 h LEU 180 Cb 0.46 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1tk9 h LEU 180 CO 0.02 0.72 -0.36 0.00 0.09 0.00 0.00 178.44 178.91 1tk9 h GLN 182 N 0.36 0.57 -0.54 0.00 5.75 -0.37 0.17 115.11 121.06 1tk9 h GLN 182 Ca 0.04 -0.18 0.01 0.00 -0.15 0.00 0.00 58.65 58.37 1tk9 h GLN 182 Cb 0.80 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.27 1tk9 h GLN 182 CO 0.06 0.70 0.35 0.82 -2.65 0.00 0.00 178.83 178.11 1tk9 h ILE 183 N 0.37 1.11 -0.69 2.39 2.04 -1.03 -1.20 117.51 120.50 1tk9 h ILE 183 Ca 0.09 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.65 1tk9 h ILE 183 Cb 0.45 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 1tk9 h ILE 183 CO 0.02 0.13 0.18 0.40 0.00 0.00 0.00 178.15 178.87 1tk9 h ILE 184 N 0.70 1.26 0.00 -0.67 2.04 -1.06 -2.51 117.51 117.27 1tk9 h ILE 184 Ca 0.20 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 65.12 1tk9 h ILE 184 Cb -0.05 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 1tk9 h ILE 184 CO -0.06 0.36 -0.02 0.44 0.00 0.00 0.00 178.15 178.87 1tk9 h ASP 185 N 1.04 -0.06 0.38 1.72 5.19 -0.44 -1.79 116.42 122.46 1tk9 h ASP 185 Ca 0.22 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.64 1tk9 h ASP 185 Cb 0.35 0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.89 1tk9 h ASP 185 CO 0.00 -0.04 0.00 -0.62 -3.12 0.00 0.00 179.24 175.46 1tk9 n GLU 186 N -5.12 0.05 0.00 3.56 1.02 -0.50 -2.25 120.64 117.40 1tk9 n GLU 186 Ca -0.07 0.38 -0.14 0.00 -0.02 0.00 0.00 57.16 57.31 1tk9 n GLU 186 Cb 0.06 -1.62 -0.14 0.00 -0.02 0.00 0.00 31.44 29.72 1tk9 n GLU 186 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1tk9 h SER 187 N 0.00 0.20 -0.03 1.62 0.87 -0.90 -3.51 113.55 111.80 1tk9 h SER 187 Ca 0.00 -0.40 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1tk9 h SER 187 Cb 0.19 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1tk9 h SER 187 CO 0.00 1.35 0.00 0.49 -0.53 0.00 0.00 176.83 178.14