#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ftt n ARG 1 N 0.00 -2.27 -2.25 3.17 1.74 -1.26 -4.90 116.66 110.90 1ftt n ARG 1 Ca 0.00 1.59 -0.35 0.00 -0.77 0.00 0.00 57.85 58.31 1ftt n ARG 1 Cb 0.00 -2.74 0.00 0.00 -1.02 0.00 0.00 32.46 28.71 1ftt n ARG 1 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1ftt s ARG 2 N -2.37 3.39 0.42 5.56 3.03 -1.26 -4.90 118.95 122.81 1ftt s ARG 2 Ca 0.00 1.65 0.00 0.00 2.03 0.00 0.00 55.73 59.41 1ftt s ARG 2 Cb 0.00 -2.05 0.00 0.00 -1.03 0.00 0.00 34.95 31.87 1ftt s ARG 2 CO 0.00 -0.83 0.00 1.63 -1.13 0.00 0.00 175.30 174.97 1ftt n LYS 3 N -1.21 -2.63 0.00 3.89 4.76 -1.26 -4.59 118.16 117.13 1ftt n LYS 3 Ca 0.11 1.99 0.00 0.00 -2.87 0.00 0.00 58.31 57.54 1ftt n LYS 3 Cb 0.50 -3.13 0.00 0.00 -1.84 0.00 0.00 35.03 30.57 1ftt n LYS 3 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1ftt n ARG 4 N -4.01 0.00 -1.71 1.97 1.74 -1.26 -4.80 116.66 108.59 1ftt n ARG 4 Ca -0.04 0.00 -0.62 0.00 -0.77 0.00 0.00 57.85 56.42 1ftt n ARG 4 Cb 0.56 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.92 1ftt n ARG 4 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1ftt n ARG 5 N -1.90 0.58 0.23 5.56 1.85 -1.26 -4.91 116.66 116.81 1ftt n ARG 5 Ca 0.00 0.21 -0.15 0.00 -1.00 0.00 0.00 57.85 56.91 1ftt n ARG 5 Cb 0.00 -1.80 -0.08 0.00 -1.05 0.00 0.00 32.46 29.53 1ftt n ARG 5 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1ftt h VAL 6 N 4.95 0.56 -3.99 8.89 2.07 -2.02 -3.43 116.25 123.27 1ftt h VAL 6 Ca -0.46 -0.33 -0.54 0.00 0.82 0.00 0.00 66.70 66.19 1ftt h VAL 6 Cb 1.35 0.71 0.12 0.00 -1.52 0.00 0.00 31.29 31.95 1ftt h VAL 6 CO 0.95 0.06 0.70 -1.48 0.02 0.00 0.00 177.57 177.81 1ftt s LEU 7 N -9.75 4.09 0.36 2.57 0.05 -1.26 -5.03 118.68 109.71 1ftt s LEU 7 Ca -0.15 2.91 0.04 0.00 0.05 0.00 0.00 54.13 56.99 1ftt s LEU 7 Cb 0.03 -3.96 -0.06 0.00 -2.05 0.00 0.00 46.19 40.15 1ftt s LEU 7 CO 0.57 -1.21 0.05 -0.36 -0.55 0.00 0.00 176.35 174.85 1ftt s PHE 8 N -1.21 2.09 0.59 3.48 0.08 -1.26 -5.11 117.98 116.64 1ftt s PHE 8 Ca 0.62 -0.91 -0.03 0.00 0.12 0.00 0.00 56.93 56.73 1ftt s PHE 8 Cb -0.44 -1.41 0.03 0.00 -0.57 0.00 0.00 43.02 40.63 1ftt s PHE 8 CO 0.56 0.11 0.86 -1.54 -0.10 0.00 0.00 175.22 175.10 1ftt s SER 9 N -3.56 5.31 0.13 1.36 1.04 -1.26 -4.99 113.70 111.74 1ftt s SER 9 Ca 0.35 0.35 -0.18 0.00 0.48 0.00 0.00 55.95 56.95 1ftt s SER 9 Cb 0.09 -1.25 -0.03 0.00 0.10 0.00 0.00 66.02 64.92 1ftt s SER 9 CO 0.16 -1.18 1.77 1.56 0.98 0.00 0.00 173.24 176.52 1ftt h GLN 10 N -0.13 0.40 -0.42 4.02 1.08 -2.02 -2.69 115.11 115.35 1ftt h GLN 10 Ca -0.44 -0.03 0.05 0.00 -1.45 0.00 0.00 58.65 56.77 1ftt h GLN 10 Cb 1.29 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 28.58 1ftt h GLN 10 CO 0.57 0.30 0.16 0.00 -0.95 0.00 0.00 178.83 178.91 1ftt h ALA 11 N 1.08 0.50 0.40 3.87 0.00 -1.98 0.31 119.26 123.44 1ftt h ALA 11 Ca 0.11 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ftt h ALA 11 Cb -0.01 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1ftt h ALA 11 CO -0.02 -0.22 -0.40 1.96 0.00 0.00 0.00 179.25 180.56 1ftt h GLN 12 N 0.33 -0.79 -0.45 0.00 4.20 -1.80 -0.85 115.11 115.74 1ftt h GLN 12 Ca 0.19 0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.88 1ftt h GLN 12 Cb 0.16 0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 1ftt h GLN 12 CO -0.18 -0.53 -0.01 0.28 -0.67 0.00 0.00 178.83 177.72 1ftt h VAL 13 N -0.82 1.24 -0.11 -0.54 2.07 -1.39 -1.28 116.25 115.42 1ftt h VAL 13 Ca -0.03 -0.99 0.04 0.00 0.82 0.00 0.00 66.70 66.53 1ftt h VAL 13 Cb 0.73 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1ftt h VAL 13 CO -0.07 0.35 -0.13 0.22 0.02 0.00 0.00 177.57 177.96 1ftt h TYR 14 N 0.70 -0.33 -0.78 1.57 3.20 -0.73 0.41 116.97 121.02 1ftt h TYR 14 Ca 0.14 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.04 1ftt h TYR 14 Cb 0.45 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.84 1ftt h TYR 14 CO 0.02 -0.19 0.51 0.93 -1.64 0.00 0.00 178.16 177.79 1ftt h GLU 15 N -0.17 0.99 0.81 1.82 4.39 -0.77 0.87 114.58 122.53 1ftt h GLU 15 Ca 0.08 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 1ftt h GLU 15 Cb 0.29 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1ftt h GLU 15 CO -0.21 0.65 -0.39 -0.07 -1.16 0.00 0.00 179.01 177.84 1ftt h LEU 16 N 1.02 -0.92 -0.87 1.33 3.38 -0.75 -1.25 115.31 117.24 1ftt h LEU 16 Ca 0.29 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.40 1ftt h LEU 16 Cb -0.07 0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 1ftt h LEU 16 CO -0.08 -0.59 0.50 -0.33 0.09 0.00 0.00 178.44 178.03 1ftt h GLU 17 N -1.23 0.77 -0.41 1.13 5.08 -0.93 0.19 114.58 119.18 1ftt h GLU 17 Ca -0.11 -0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.27 1ftt h GLU 17 Cb 0.85 -0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.87 1ftt h GLU 17 CO 0.18 0.51 0.07 -0.09 -1.00 0.00 0.00 179.01 178.68 1ftt h ARG 18 N 0.79 0.19 0.28 2.33 9.65 -0.71 -0.76 114.38 126.16 1ftt h ARG 18 Ca 0.44 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 59.30 1ftt h ARG 18 Cb 0.48 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.02 1ftt h ARG 18 CO -0.29 0.13 -0.14 -0.09 2.80 0.00 0.00 179.97 182.39 1ftt h ARG 19 N 0.20 -0.36 -0.87 0.20 1.12 -0.67 -3.25 114.38 110.74 1ftt h ARG 19 Ca 0.20 0.02 0.22 0.00 -1.11 0.00 0.00 59.98 59.32 1ftt h ARG 19 Cb 0.25 0.08 -0.15 0.00 -0.01 0.00 0.00 29.97 30.15 1ftt h ARG 19 CO -0.27 -0.02 0.11 0.35 -3.11 0.00 0.00 179.97 177.02 1ftt h PHE 20 N -0.80 0.12 -0.75 2.20 3.57 -0.76 0.11 116.94 120.63 1ftt h PHE 20 Ca -0.04 0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.52 1ftt h PHE 20 Cb 0.51 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 1ftt h PHE 20 CO 0.04 -0.28 0.49 -0.22 -2.23 0.00 0.00 178.31 176.11 1ftt h LYS 21 N 0.12 0.99 0.09 1.11 3.64 -1.19 -3.01 116.57 118.32 1ftt h LYS 21 Ca 0.52 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.83 1ftt h LYS 21 Cb 1.02 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1ftt h LYS 21 CO -0.73 0.66 -0.04 1.96 -2.27 0.00 0.00 179.45 179.04 1ftt h GLN 22 N 1.02 -0.11 -2.82 1.90 4.20 -0.91 -3.47 115.11 114.92 1ftt h GLN 22 Ca 0.27 0.01 -0.14 0.00 0.06 0.00 0.00 58.65 58.86 1ftt h GLN 22 Cb -0.11 0.03 -0.26 0.00 0.30 0.00 0.00 27.48 27.44 1ftt h GLN 22 CO -0.06 0.37 -0.32 1.14 -0.67 0.00 0.00 178.83 179.30 1ftt s GLN 23 N -2.72 0.39 -0.16 1.46 -2.07 -0.08 -5.05 119.66 111.43 1ftt s GLN 23 Ca -0.12 0.58 -0.01 0.00 -1.82 0.00 0.00 55.36 54.00 1ftt s GLN 23 Cb -0.01 0.10 0.10 0.00 -1.09 0.00 0.00 33.01 32.12 1ftt s GLN 23 CO 0.43 -0.09 2.03 0.36 -1.32 0.00 0.00 175.29 176.70 1ftt n LYS 24 N 3.42 1.41 -3.92 9.60 -0.00 -1.15 -3.31 118.16 124.21 1ftt n LYS 24 Ca -0.17 -0.78 -0.10 0.00 -0.00 0.00 0.00 58.31 57.26 1ftt n LYS 24 Cb 0.56 -1.31 -0.10 0.00 -0.00 0.00 0.00 35.03 34.18 1ftt n LYS 24 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1ftt s TYR 25 N -0.87 0.15 0.04 5.58 2.02 -1.26 -5.02 117.35 117.99 1ftt s TYR 25 Ca 0.16 -0.34 0.09 0.00 -0.37 0.00 0.00 57.07 56.61 1ftt s TYR 25 Cb 0.12 -0.12 -0.03 0.00 -0.40 0.00 0.00 41.96 41.54 1ftt s TYR 25 CO -0.00 -0.26 -0.25 -0.51 -1.57 0.00 0.00 175.55 172.95 1ftt s LEU 26 N -1.54 2.15 0.73 -1.29 1.43 -1.26 -4.93 118.68 113.97 1ftt s LEU 26 Ca -0.14 -0.56 -0.11 0.00 -1.03 0.00 0.00 54.13 52.29 1ftt s LEU 26 Cb -0.07 -1.25 0.03 0.00 0.03 0.00 0.00 46.19 44.93 1ftt s LEU 26 CO -0.00 0.25 1.09 -0.94 0.23 0.00 0.00 176.35 176.98 1ftt s SER 27 N -1.14 5.22 0.19 2.29 1.04 -1.26 -4.74 113.70 115.30 1ftt s SER 27 Ca 0.11 1.20 -0.16 0.00 0.48 0.00 0.00 55.95 57.59 1ftt s SER 27 Cb -0.10 -2.00 0.17 0.00 0.10 0.00 0.00 66.02 64.20 1ftt s SER 27 CO 0.02 -1.50 1.64 0.00 0.98 0.00 0.00 173.24 174.38 1ftt h ALA 28 N -0.76 0.31 0.10 5.32 0.00 -2.01 0.64 119.26 122.85 1ftt h ALA 28 Ca -0.45 0.20 -0.19 0.00 0.00 0.00 0.00 54.91 54.47 1ftt h ALA 28 Cb 1.25 0.45 0.02 0.00 0.00 0.00 0.00 17.79 19.51 1ftt h ALA 28 CO 0.62 -0.46 -0.82 -1.00 0.00 0.00 0.00 179.25 177.59 1ftt h PRO 29 N -0.03 0.38 -0.86 0.00 0.13 -2.01 -3.31 132.00 126.30 1ftt h PRO 29 Ca 0.26 -0.54 0.13 0.00 -0.87 0.00 0.00 66.00 64.98 1ftt h PRO 29 Cb 0.42 0.19 -0.07 0.00 0.13 0.00 0.00 31.00 31.67 1ftt h PRO 29 CO -0.57 1.22 0.56 1.49 -0.23 0.00 0.00 178.00 180.47 1ftt h GLU 30 N -0.20 0.67 -0.28 0.86 4.81 -1.88 -0.58 114.58 117.98 1ftt h GLU 30 Ca -0.13 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.07 1ftt h GLU 30 Cb 1.59 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.80 1ftt h GLU 30 CO 0.16 0.44 0.16 -0.09 -0.73 0.00 0.00 179.01 178.95 1ftt h ARG 31 N 0.69 0.33 -0.30 1.92 1.12 -0.96 0.95 114.38 118.12 1ftt h ARG 31 Ca 0.42 -0.02 -0.17 0.00 -1.11 0.00 0.00 59.98 59.10 1ftt h ARG 31 Cb 0.66 -0.07 -0.00 0.00 -0.01 0.00 0.00 29.97 30.54 1ftt h ARG 31 CO -0.18 0.22 -0.49 1.49 -3.11 0.00 0.00 179.97 177.89 1ftt h GLU 32 N 0.34 0.86 -0.35 0.20 4.81 -1.37 -1.22 114.58 117.85 1ftt h GLU 32 Ca 0.11 -0.52 0.05 0.00 -0.13 0.00 0.00 59.36 58.87 1ftt h GLU 32 Cb 0.00 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.39 1ftt h GLU 32 CO -0.06 1.16 0.08 1.25 -0.73 0.00 0.00 179.01 180.72 1ftt h HIS 33 N 0.65 0.14 0.06 0.92 2.76 -1.01 -1.14 115.15 117.53 1ftt h HIS 33 Ca 0.02 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1ftt h HIS 33 Cb 1.09 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.04 1ftt h HIS 33 CO 0.07 0.04 -0.03 1.25 -1.30 0.00 0.00 177.93 177.96 1ftt h LEU 34 N 0.21 -0.07 -0.75 0.26 6.46 -0.72 0.03 115.31 120.73 1ftt h LEU 34 Ca 0.16 -0.00 0.08 0.00 -0.12 0.00 0.00 57.88 58.00 1ftt h LEU 34 Cb 0.18 0.02 -0.07 0.00 -0.73 0.00 0.00 40.66 40.06 1ftt h LEU 34 CO -0.20 -0.04 0.41 0.00 -0.62 0.00 0.00 178.44 177.98 1ftt h ALA 35 N 0.85 1.04 0.04 1.25 0.00 -0.79 0.68 119.26 122.32 1ftt h ALA 35 Ca -0.01 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ftt h ALA 35 Cb 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ftt h ALA 35 CO 0.01 0.05 -0.02 1.03 0.00 0.00 0.00 179.25 180.33 1ftt h SER 36 N 0.72 -0.04 0.59 0.00 0.87 -1.13 -0.18 113.55 114.38 1ftt h SER 36 Ca 0.35 -0.26 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 1ftt h SER 36 Cb 0.30 0.01 0.01 0.00 -0.44 0.00 0.00 62.40 62.28 1ftt h SER 36 CO -0.23 0.24 -0.29 -0.03 -0.53 0.00 0.00 176.83 176.00 1ftt h MET 37 N -0.33 -0.77 -0.11 2.24 1.85 -0.03 -3.35 114.93 114.43 1ftt h MET 37 Ca -0.01 0.05 -0.11 0.00 -0.61 0.00 0.00 59.70 59.03 1ftt h MET 37 Cb 0.30 0.17 0.00 0.00 0.43 0.00 0.00 31.60 32.51 1ftt h MET 37 CO 0.01 -0.51 -0.36 -0.84 -0.40 0.00 0.00 176.91 174.81 1ftt h ILE 38 N -1.20 1.39 0.00 1.77 3.07 -1.09 -3.49 117.51 117.95 1ftt h ILE 38 Ca -0.08 -1.69 0.00 0.00 1.55 0.00 0.00 64.86 64.64 1ftt h ILE 38 Cb 0.61 2.18 0.00 0.00 -0.27 0.00 0.00 36.82 39.34 1ftt h ILE 38 CO 0.13 0.50 0.00 1.41 -1.05 0.00 0.00 178.15 179.14 1ftt n HIS 39 N -4.36 0.00 -3.89 0.16 8.25 -1.17 -4.70 115.22 109.50 1ftt n HIS 39 Ca -0.08 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.27 1ftt n HIS 39 Cb 0.52 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.63 1ftt n HIS 39 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1ftt n LEU 40 N 0.00 0.00 -4.92 2.41 4.32 -0.09 -4.97 117.00 113.75 1ftt n LEU 40 Ca 0.00 -2.64 -0.29 0.00 -0.02 0.00 0.00 56.01 53.06 1ftt n LEU 40 Cb 0.00 3.17 -0.04 0.00 -1.62 0.00 0.00 43.42 44.94 1ftt n LEU 40 CO 0.00 -0.75 -0.02 0.42 -1.22 0.00 0.00 177.39 175.82 1ftt s THR 41 N -2.44 5.25 0.55 -5.08 -4.23 -1.26 -4.40 115.64 104.03 1ftt s THR 41 Ca 0.21 -0.30 0.22 0.00 -1.18 0.00 0.00 61.69 60.65 1ftt s THR 41 Cb -0.03 -3.68 0.32 0.00 1.34 0.00 0.00 72.50 70.44 1ftt s THR 41 CO 0.16 -0.05 2.16 1.55 -0.54 0.00 0.00 174.62 177.90 1ftt h PRO 42 N 2.44 0.00 0.33 3.99 0.13 -1.91 -0.26 132.00 136.72 1ftt h PRO 42 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 1ftt h PRO 42 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1ftt h PRO 42 CO 0.71 0.00 -0.16 1.15 -0.23 0.00 0.00 178.00 179.47 1ftt h THR 43 N 0.00 0.64 -0.68 1.56 2.02 -1.98 -2.06 112.91 112.41 1ftt h THR 43 Ca 0.03 -0.59 -0.02 0.00 0.77 0.00 0.00 66.41 66.60 1ftt h THR 43 Cb 0.15 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.45 1ftt h THR 43 CO -0.00 0.11 0.33 1.56 0.37 0.00 0.00 175.52 177.88 1ftt h GLN 44 N -0.80 0.97 0.03 6.66 7.50 -1.77 0.02 115.11 127.73 1ftt h GLN 44 Ca -0.05 -0.13 0.01 0.00 0.50 0.00 0.00 58.65 58.99 1ftt h GLN 44 Cb 0.52 -0.18 -0.04 0.00 0.05 0.00 0.00 27.48 27.82 1ftt h GLN 44 CO 0.07 0.75 -0.42 0.28 -1.50 0.00 0.00 178.83 178.01 1ftt h VAL 45 N 0.97 0.00 -0.88 -0.54 2.07 -1.13 -0.96 116.25 115.77 1ftt h VAL 45 Ca 0.24 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.84 1ftt h VAL 45 Cb 0.10 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.80 1ftt h VAL 45 CO -0.03 0.00 0.53 0.50 0.02 0.00 0.00 177.57 178.59 1ftt h LYS 46 N -0.56 0.89 -0.20 1.57 3.64 -0.56 -1.01 116.57 120.36 1ftt h LYS 46 Ca 0.00 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1ftt h LYS 46 Cb 0.58 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1ftt h LYS 46 CO -0.27 0.59 0.09 0.82 -2.27 0.00 0.00 179.45 178.42 1ftt h ILE 47 N 0.92 1.13 -0.54 2.00 1.08 -0.93 0.82 117.51 122.00 1ftt h ILE 47 Ca 0.41 -0.38 0.08 0.00 -0.39 0.00 0.00 64.86 64.58 1ftt h ILE 47 Cb 0.29 1.02 -0.06 0.00 -3.07 0.00 0.00 36.82 35.01 1ftt h ILE 47 CO -0.22 0.13 0.19 -0.25 -0.69 0.00 0.00 178.15 177.31 1ftt h TRP 48 N 0.19 0.34 -0.12 1.37 7.01 -0.42 0.02 115.95 124.34 1ftt h TRP 48 Ca 0.07 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.10 1ftt h TRP 48 Cb 0.12 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.10 1ftt h TRP 48 CO -0.03 0.10 0.07 0.74 -2.79 0.00 0.00 178.44 176.54 1ftt h PHE 49 N 0.37 0.14 -0.62 2.65 0.04 -0.95 -1.67 116.94 116.90 1ftt h PHE 49 Ca 0.26 0.00 0.10 0.00 2.80 0.00 0.00 57.97 61.13 1ftt h PHE 49 Cb 0.29 -0.04 -0.07 0.00 2.20 0.00 0.00 35.95 38.32 1ftt h PHE 49 CO -0.16 0.08 0.23 0.37 -0.60 0.00 0.00 178.31 178.23 1ftt h GLN 50 N 0.15 0.40 -0.25 1.51 4.15 -0.34 -1.16 115.11 119.57 1ftt h GLN 50 Ca 0.05 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.40 1ftt h GLN 50 Cb -0.01 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 1ftt h GLN 50 CO -0.02 0.26 -0.02 -0.91 -1.93 0.00 0.00 178.83 176.22 1ftt h ASN 51 N 0.41 0.45 -0.12 -0.69 2.35 -0.76 -1.12 115.58 116.10 1ftt h ASN 51 Ca 0.31 -0.33 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1ftt h ASN 51 Cb 0.39 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.64 1ftt h ASN 51 CO -0.31 0.67 -0.01 0.45 -1.65 0.00 0.00 177.43 176.58 1ftt h HIS 52 N 0.22 0.23 -0.37 1.19 3.86 -1.01 -1.27 115.15 118.01 1ftt h HIS 52 Ca 0.07 -0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 1ftt h HIS 52 Cb 0.45 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.84 1ftt h HIS 52 CO 0.04 0.47 0.11 0.07 0.86 0.00 0.00 177.93 179.47 1ftt h ARG 53 N -0.08 0.53 -0.12 2.45 -0.00 -1.27 -2.46 114.38 113.44 1ftt h ARG 53 Ca 0.03 -0.08 -0.01 0.00 -0.00 0.00 0.00 59.98 59.92 1ftt h ARG 53 Cb 0.38 -0.10 -0.01 0.00 -0.00 0.00 0.00 29.97 30.25 1ftt h ARG 53 CO 0.01 0.48 0.03 -0.92 -0.00 0.00 0.00 179.97 179.56 1ftt h TYR 54 N 0.53 0.21 0.04 4.08 3.20 -0.99 -2.32 116.97 121.72 1ftt h TYR 54 Ca 0.13 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1ftt h TYR 54 Cb 0.17 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.39 1ftt h TYR 54 CO 0.01 0.36 -0.02 -0.22 -1.64 0.00 0.00 178.16 176.65 1ftt h LYS 55 N -0.00 -0.05 -0.41 1.82 3.11 -0.96 0.75 116.57 120.84 1ftt h LYS 55 Ca 0.04 0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 57.80 1ftt h LYS 55 Cb 0.26 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.48 1ftt h LYS 55 CO 0.00 0.11 -0.07 0.00 -2.81 0.00 0.00 179.45 176.69 1ftt h MET 56 N -0.20 0.69 -0.43 1.90 -0.00 -1.54 -1.40 114.93 113.95 1ftt h MET 56 Ca -0.00 -0.20 -0.14 0.00 -0.00 0.00 0.00 59.70 59.35 1ftt h MET 56 Cb 0.18 -0.07 -0.01 0.00 -0.00 0.00 0.00 31.60 31.70 1ftt h MET 56 CO 0.01 0.75 -0.29 -0.22 -0.00 0.00 0.00 176.91 177.16 1ftt h LYS 57 N 0.64 0.95 0.07 -0.10 1.63 -1.21 -3.35 116.57 115.20 1ftt h LYS 57 Ca 0.12 -0.45 -0.00 0.00 -0.85 0.00 0.00 60.65 59.47 1ftt h LYS 57 Cb 0.50 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1ftt h LYS 57 CO 0.03 1.11 -0.03 -0.09 -3.45 0.00 0.00 179.45 177.02 1ftt h ARG 58 N 0.80 -0.09 -6.62 1.90 2.43 -0.60 -3.40 114.38 108.80 1ftt h ARG 58 Ca 0.09 0.01 -0.56 0.00 -0.81 0.00 0.00 59.98 58.70 1ftt h ARG 58 Cb 0.87 0.02 0.07 0.00 -0.42 0.00 0.00 29.97 30.52 1ftt h ARG 58 CO 0.08 0.50 0.78 0.00 -1.51 0.00 0.00 179.97 179.81 1ftt n GLN 59 N -4.81 2.31 0.00 0.20 10.64 -0.55 -1.70 117.38 123.48 1ftt n GLN 59 Ca -0.08 0.83 0.00 0.00 -1.83 0.00 0.00 57.00 55.92 1ftt n GLN 59 Cb 0.31 -2.57 0.00 0.00 -0.86 0.00 0.00 30.24 27.12 1ftt n GLN 59 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ftt n ALA 60 N 2.66 0.00 -0.97 2.61 0.00 -1.26 -4.72 120.51 118.83 1ftt n ALA 60 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.45 1ftt n ALA 60 Cb 0.32 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.67 1ftt n ALA 60 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ftt n LYS 61 N 0.00 1.85 0.00 0.00 4.01 -0.69 -4.73 118.16 118.61 1ftt n LYS 61 Ca 0.00 -1.05 0.00 0.00 -0.51 0.00 0.00 58.31 56.75 1ftt n LYS 61 Cb 0.00 -1.80 0.00 0.00 -0.51 0.00 0.00 35.03 32.72 1ftt n LYS 61 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1ftt n ASP 62 N 1.90 0.32 -0.10 4.39 8.00 -1.10 -1.26 116.55 128.70 1ftt n ASP 62 Ca 0.34 -1.77 0.01 0.00 0.71 0.00 0.00 54.79 54.09 1ftt n ASP 62 Cb 0.75 -0.16 0.31 0.00 -0.02 0.00 0.00 41.12 42.00 1ftt n ASP 62 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1ftt h LYS 63 N 0.04 0.74 -0.88 -1.24 1.79 -1.86 -1.54 116.57 113.63 1ftt h LYS 63 Ca 0.00 -0.07 0.03 0.00 -2.18 0.00 0.00 60.65 58.43 1ftt h LYS 63 Cb 0.16 -0.15 -0.05 0.00 -1.58 0.00 0.00 32.23 30.61 1ftt h LYS 63 CO 0.00 0.55 0.58 0.00 -1.08 0.00 0.00 179.45 179.49 1ftt h ALA 64 N 1.57 1.45 -0.26 3.86 0.00 -1.41 0.69 119.26 125.17 1ftt h ALA 64 Ca 0.19 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1ftt h ALA 64 Cb 0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1ftt h ALA 64 CO -0.03 0.47 -0.02 0.00 0.00 0.00 0.00 179.25 179.67 1ftt h ALA 65 N 1.49 0.36 0.70 0.00 0.00 -1.64 -3.32 119.26 116.84 1ftt h ALA 65 Ca 0.35 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1ftt h ALA 65 Cb 0.01 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ftt h ALA 65 CO -0.10 0.12 -0.34 0.37 0.00 0.00 0.00 179.25 179.30 1ftt h GLN 66 N 0.25 -0.91 0.00 0.00 -0.00 -0.87 -3.52 115.11 110.06 1ftt h GLN 66 Ca 0.07 0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.78 1ftt h GLN 66 Cb 0.46 0.21 0.00 0.00 0.00 0.00 0.00 27.48 28.15 1ftt h GLN 66 CO 0.02 -0.61 0.00 0.94 0.00 0.00 0.00 178.83 179.18