#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ftt s ARG 1 N 0.00 2.65 3.94 2.12 0.52 -1.26 -4.79 118.95 122.13 1ftt s ARG 1 Ca 0.00 -0.60 0.00 0.00 -0.52 0.00 0.00 55.73 54.61 1ftt s ARG 1 Cb 0.00 -5.14 0.00 0.00 0.52 0.00 0.00 34.95 30.33 1ftt s ARG 1 CO 0.00 -3.41 0.00 0.54 0.02 0.00 0.00 175.30 172.45 1ftt n ARG 2 N 8.71 0.00 -0.06 3.54 1.74 -1.26 -3.98 116.66 125.35 1ftt n ARG 2 Ca 0.41 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 57.32 1ftt n ARG 2 Cb 0.47 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 31.78 1ftt n ARG 2 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1ftt h LYS 3 N 0.00 0.04 -6.08 5.56 2.10 -2.04 -3.49 116.57 112.65 1ftt h LYS 3 Ca 0.00 -0.07 -0.36 0.00 -2.00 0.00 0.00 60.65 58.22 1ftt h LYS 3 Cb 0.00 0.03 0.01 0.00 -0.90 0.00 0.00 32.23 31.36 1ftt h LYS 3 CO 0.00 1.03 -0.89 -2.13 -2.00 0.00 0.00 179.45 175.46 1ftt n ARG 4 N -4.48 -1.29 -2.48 0.07 0.00 -1.26 -3.80 116.66 103.43 1ftt n ARG 4 Ca -0.17 0.75 -0.02 0.00 -0.00 0.00 0.00 57.85 58.41 1ftt n ARG 4 Cb 0.59 -1.64 0.00 0.00 0.00 0.00 0.00 32.46 31.41 1ftt n ARG 4 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1ftt n ARG 5 N -1.47 -2.50 -1.58 -0.14 0.00 -1.26 -4.87 116.66 104.84 1ftt n ARG 5 Ca -0.19 2.15 -0.48 0.00 -0.00 0.00 0.00 57.85 59.33 1ftt n ARG 5 Cb 0.54 -4.54 -0.04 0.00 0.00 0.00 0.00 32.46 28.42 1ftt n ARG 5 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1ftt n VAL 6 N 0.29 1.03 -3.83 5.15 0.31 -1.25 -4.99 118.33 115.04 1ftt n VAL 6 Ca 0.03 -0.26 -0.09 0.00 -0.01 0.00 0.00 64.34 64.01 1ftt n VAL 6 Cb 0.10 -0.87 -0.04 0.00 -0.91 0.00 0.00 33.84 32.13 1ftt n VAL 6 CO 0.00 0.00 0.00 -1.48 -1.32 0.00 0.00 176.83 174.03 1ftt s LEU 7 N 0.65 0.11 0.00 7.52 0.05 -1.26 -5.03 118.68 120.71 1ftt s LEU 7 Ca 0.71 -0.63 0.00 0.00 0.05 0.00 0.00 54.13 54.26 1ftt s LEU 7 Cb -0.83 2.12 0.00 0.00 -2.05 0.00 0.00 46.19 45.43 1ftt s LEU 7 CO 0.53 -1.12 0.00 0.49 -0.55 0.00 0.00 176.35 175.70 1ftt n PHE 8 N -0.37 -0.07 -4.08 3.48 3.72 -1.26 -5.09 117.46 113.80 1ftt n PHE 8 Ca -0.07 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.23 1ftt n PHE 8 Cb 0.62 0.37 -0.08 0.00 -0.94 0.00 0.00 39.48 39.44 1ftt n PHE 8 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1ftt s SER 9 N -2.57 0.13 0.11 4.37 1.04 -1.26 -5.03 113.70 110.48 1ftt s SER 9 Ca 0.00 -1.11 -0.24 0.00 0.48 0.00 0.00 55.95 55.09 1ftt s SER 9 Cb 0.00 0.40 -0.08 0.00 0.10 0.00 0.00 66.02 66.44 1ftt s SER 9 CO 0.00 -0.87 1.69 1.56 0.98 0.00 0.00 173.24 176.60 1ftt h GLN 10 N 2.61 -0.20 0.09 4.02 7.50 -2.01 -0.97 115.11 126.15 1ftt h GLN 10 Ca -0.33 0.01 -0.00 0.00 0.50 0.00 0.00 58.65 58.83 1ftt h GLN 10 Cb 1.23 0.05 -0.00 0.00 0.05 0.00 0.00 27.48 28.80 1ftt h GLN 10 CO 0.51 -0.14 -0.07 0.00 -1.50 0.00 0.00 178.83 177.63 1ftt h ALA 11 N 0.74 -0.15 0.22 3.87 0.00 -1.98 -0.62 119.26 121.34 1ftt h ALA 11 Ca 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ftt h ALA 11 Cb 0.27 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1ftt h ALA 11 CO -0.12 -0.59 -0.14 1.96 0.00 0.00 0.00 179.25 180.35 1ftt h GLN 12 N -0.17 -0.35 -0.77 0.00 4.20 -1.82 -1.14 115.11 115.07 1ftt h GLN 12 Ca -0.00 0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.68 1ftt h GLN 12 Cb 0.15 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.97 1ftt h GLN 12 CO -0.00 -0.23 0.29 0.28 -0.67 0.00 0.00 178.83 178.50 1ftt h VAL 13 N -0.36 1.26 -0.20 -0.54 2.07 -1.19 0.46 116.25 117.75 1ftt h VAL 13 Ca -0.02 -0.84 0.06 0.00 0.82 0.00 0.00 66.70 66.71 1ftt h VAL 13 Cb 0.31 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.37 1ftt h VAL 13 CO 0.01 0.34 -0.31 0.22 0.02 0.00 0.00 177.57 177.86 1ftt h TYR 14 N 1.12 -0.85 -0.62 1.57 3.20 -0.88 0.17 116.97 120.69 1ftt h TYR 14 Ca 0.25 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.16 1ftt h TYR 14 Cb 0.24 0.40 -0.03 0.00 1.54 0.00 0.00 36.73 38.88 1ftt h TYR 14 CO 0.02 -0.38 0.35 0.93 -1.64 0.00 0.00 178.16 177.44 1ftt h GLU 15 N -0.34 0.86 0.28 1.82 5.08 -0.62 -0.43 114.58 121.23 1ftt h GLU 15 Ca 0.12 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1ftt h GLU 15 Cb 0.53 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1ftt h GLU 15 CO -0.39 0.65 -0.14 -0.07 -1.00 0.00 0.00 179.01 178.06 1ftt h LEU 16 N 0.84 -0.32 -0.14 1.33 3.38 -0.57 0.70 115.31 120.54 1ftt h LEU 16 Ca 0.22 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.20 1ftt h LEU 16 Cb 0.03 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1ftt h LEU 16 CO -0.04 -0.20 -0.01 -0.33 0.09 0.00 0.00 178.44 177.96 1ftt h GLU 17 N -0.42 0.04 -0.92 1.13 5.08 -0.93 -0.05 114.58 118.50 1ftt h GLU 17 Ca -0.04 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.42 1ftt h GLU 17 Cb 0.32 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.48 1ftt h GLU 17 CO 0.06 0.03 0.56 -0.09 -1.00 0.00 0.00 179.01 178.57 1ftt h ARG 18 N 0.04 0.90 -0.05 2.33 1.12 -0.93 -0.69 114.38 117.09 1ftt h ARG 18 Ca 0.07 -0.05 -0.03 0.00 -1.11 0.00 0.00 59.98 58.85 1ftt h ARG 18 Cb 0.08 -0.20 -0.00 0.00 -0.01 0.00 0.00 29.97 29.84 1ftt h ARG 18 CO -0.12 0.59 -0.09 -0.09 -3.11 0.00 0.00 179.97 177.16 1ftt h ARG 19 N 0.92 0.16 -0.99 0.20 1.12 -0.44 -2.19 114.38 113.16 1ftt h ARG 19 Ca 0.44 -0.10 0.21 0.00 -1.11 0.00 0.00 59.98 59.42 1ftt h ARG 19 Cb 0.38 0.01 -0.10 0.00 -0.01 0.00 0.00 29.97 30.26 1ftt h ARG 19 CO -0.24 0.67 0.62 0.35 -3.11 0.00 0.00 179.97 178.25 1ftt h PHE 20 N -0.33 0.88 0.51 2.20 3.57 -0.56 0.55 116.94 123.76 1ftt h PHE 20 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 1ftt h PHE 20 Cb 0.65 -0.26 0.01 0.00 2.79 0.00 0.00 35.95 39.14 1ftt h PHE 20 CO 0.11 0.18 -0.25 -0.22 -2.23 0.00 0.00 178.31 175.90 1ftt h LYS 21 N 0.61 -0.67 -0.58 1.11 3.11 -1.06 -3.32 116.57 115.78 1ftt h LYS 21 Ca 0.56 0.05 -0.00 0.00 -2.81 0.00 0.00 60.65 58.44 1ftt h LYS 21 Cb 1.08 0.15 -0.03 0.00 -1.00 0.00 0.00 32.23 32.43 1ftt h LYS 21 CO -0.32 -0.36 0.36 1.96 -2.81 0.00 0.00 179.45 178.27 1ftt h GLN 22 N -0.93 0.79 -3.32 1.90 1.08 -0.52 -3.42 115.11 110.68 1ftt h GLN 22 Ca -0.07 -0.07 -0.16 0.00 -1.45 0.00 0.00 58.65 56.90 1ftt h GLN 22 Cb 0.61 -0.17 -0.23 0.00 -0.05 0.00 0.00 27.48 27.64 1ftt h GLN 22 CO 0.12 0.56 -0.46 1.14 -0.95 0.00 0.00 178.83 179.24 1ftt s GLN 23 N -6.01 0.38 0.12 1.46 -2.07 0.05 -5.09 119.66 108.51 1ftt s GLN 23 Ca -0.13 -0.03 -0.18 0.00 -1.82 0.00 0.00 55.36 53.19 1ftt s GLN 23 Cb 0.13 0.17 -0.04 0.00 -1.09 0.00 0.00 33.01 32.18 1ftt s GLN 23 CO 0.76 -0.08 1.73 -0.22 -1.32 0.00 0.00 175.29 176.16 1ftt h LYS 24 N 5.00 0.39 -4.32 9.60 1.63 -1.81 -3.31 116.57 123.74 1ftt h LYS 24 Ca -0.28 -0.04 -0.30 0.00 -0.85 0.00 0.00 60.65 59.17 1ftt h LYS 24 Cb 1.19 -0.08 -0.27 0.00 -0.60 0.00 0.00 32.23 32.48 1ftt h LYS 24 CO 0.39 0.33 -0.75 0.71 -3.45 0.00 0.00 179.45 176.68 1ftt s TYR 25 N -5.90 0.48 0.18 1.91 2.02 -1.26 -4.79 117.35 109.99 1ftt s TYR 25 Ca -0.13 -0.18 -0.27 0.00 -0.37 0.00 0.00 57.07 56.11 1ftt s TYR 25 Cb 0.09 -0.30 -0.08 0.00 -0.40 0.00 0.00 41.96 41.27 1ftt s TYR 25 CO 0.71 -0.03 0.83 -0.51 -1.57 0.00 0.00 175.55 174.99 1ftt s LEU 26 N -0.47 4.60 0.00 -1.29 1.02 -1.26 -5.09 118.68 116.19 1ftt s LEU 26 Ca -0.01 1.73 -0.11 0.00 0.02 0.00 0.00 54.13 55.75 1ftt s LEU 26 Cb -0.04 -3.39 0.18 0.00 0.02 0.00 0.00 46.19 42.96 1ftt s LEU 26 CO -0.00 0.17 1.11 -1.54 0.02 0.00 0.00 176.35 176.11 1ftt n SER 27 N 1.69 0.39 0.03 2.29 3.41 -1.26 -4.69 113.62 115.48 1ftt n SER 27 Ca -0.04 -1.59 -0.10 0.00 -0.26 0.00 0.00 58.87 56.88 1ftt n SER 27 Cb 0.48 -0.82 -0.04 0.00 -0.26 0.00 0.00 64.21 63.57 1ftt n SER 27 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ftt h ALA 28 N -1.49 -0.20 -0.14 7.33 0.00 -1.99 0.77 119.26 123.55 1ftt h ALA 28 Ca -0.36 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.41 1ftt h ALA 28 Cb 1.07 0.36 0.01 0.00 0.00 0.00 0.00 17.79 19.23 1ftt h ALA 28 CO 0.28 -0.67 -0.53 -1.00 0.00 0.00 0.00 179.25 177.33 1ftt h PRO 29 N -0.28 0.61 -0.80 0.00 0.13 -2.00 -3.00 132.00 126.66 1ftt h PRO 29 Ca 0.08 -0.47 0.02 0.00 -0.87 0.00 0.00 66.00 64.76 1ftt h PRO 29 Cb 0.39 0.09 -0.04 0.00 0.13 0.00 0.00 31.00 31.56 1ftt h PRO 29 CO -0.22 1.09 0.52 1.49 -0.23 0.00 0.00 178.00 180.65 1ftt h GLU 30 N 0.26 1.02 -0.02 0.86 4.57 -1.92 -0.96 114.58 118.39 1ftt h GLU 30 Ca -0.03 -0.06 -0.14 0.00 -1.18 0.00 0.00 59.36 57.95 1ftt h GLU 30 Cb 1.16 -0.23 -0.02 0.00 -0.16 0.00 0.00 28.75 29.51 1ftt h GLU 30 CO 0.11 0.67 -0.65 0.07 -1.18 0.00 0.00 179.01 178.04 1ftt h ARG 31 N 1.05 0.09 -0.21 1.92 0.11 -0.90 -0.28 114.38 116.16 1ftt h ARG 31 Ca 0.31 -0.07 -0.02 0.00 0.10 0.00 0.00 59.98 60.29 1ftt h ARG 31 Cb -0.07 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.02 1ftt h ARG 31 CO -0.09 0.71 0.05 1.49 0.10 0.00 0.00 179.97 182.23 1ftt h GLU 32 N 0.07 0.34 -0.22 0.08 4.81 -1.33 0.10 114.58 118.43 1ftt h GLU 32 Ca -0.01 -0.08 0.06 0.00 -0.13 0.00 0.00 59.36 59.19 1ftt h GLU 32 Cb 1.15 -0.04 -0.07 0.00 0.63 0.00 0.00 28.75 30.42 1ftt h GLU 32 CO 0.09 0.47 -0.22 1.25 -0.73 0.00 0.00 179.01 179.86 1ftt h HIS 33 N 0.15 -0.59 0.24 0.92 -0.00 -0.94 -1.43 115.15 113.51 1ftt h HIS 33 Ca 0.07 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.46 1ftt h HIS 33 Cb 0.28 0.29 0.00 0.00 -0.00 0.00 0.00 27.41 27.99 1ftt h HIS 33 CO 0.01 -0.30 -0.12 1.25 -0.00 0.00 0.00 177.93 178.77 1ftt h LEU 34 N -0.24 -0.28 -0.79 0.26 5.85 -0.99 -0.65 115.31 118.48 1ftt h LEU 34 Ca 0.13 -0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.95 1ftt h LEU 34 Cb 0.44 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.45 1ftt h LEU 34 CO -0.36 -0.16 0.39 0.00 -0.34 0.00 0.00 178.44 177.97 1ftt h ALA 35 N 0.38 1.14 0.19 1.25 0.00 -0.70 0.84 119.26 122.36 1ftt h ALA 35 Ca -0.03 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1ftt h ALA 35 Cb 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ftt h ALA 35 CO 0.05 -0.08 -0.09 1.03 0.00 0.00 0.00 179.25 180.17 1ftt h SER 36 N 0.60 -0.22 0.90 0.00 0.87 -1.19 -0.91 113.55 113.62 1ftt h SER 36 Ca 0.41 -0.20 -0.04 0.00 -1.23 0.00 0.00 61.79 60.72 1ftt h SER 36 Cb 0.53 0.06 0.01 0.00 -0.44 0.00 0.00 62.40 62.55 1ftt h SER 36 CO -0.33 0.10 -0.43 -0.03 -0.53 0.00 0.00 176.83 175.60 1ftt h MET 37 N -0.54 -1.17 -0.14 2.24 -1.53 0.12 -3.23 114.93 110.68 1ftt h MET 37 Ca -0.03 0.08 -0.02 0.00 -3.44 0.00 0.00 59.70 56.29 1ftt h MET 37 Cb 0.41 0.27 -0.01 0.00 -0.55 0.00 0.00 31.60 31.72 1ftt h MET 37 CO 0.04 -0.78 0.00 -0.84 0.14 0.00 0.00 176.91 175.48 1ftt h ILE 38 N -1.28 1.25 0.00 1.77 3.07 -1.06 -3.49 117.51 117.77 1ftt h ILE 38 Ca -0.12 -0.82 0.00 0.00 1.55 0.00 0.00 64.86 65.47 1ftt h ILE 38 Cb 0.93 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 39.00 1ftt h ILE 38 CO 0.20 0.24 0.00 1.41 -1.05 0.00 0.00 178.15 178.95 1ftt n HIS 39 N -4.77 0.00 -3.71 0.16 8.25 -0.95 -4.77 115.22 109.43 1ftt n HIS 39 Ca -0.05 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.38 1ftt n HIS 39 Cb 0.21 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.33 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 -4.93 2.41 4.77 -0.39 -5.03 117.00 113.83 1ftt n LEU 40 Ca 0.00 -1.09 -0.26 0.00 -0.03 0.00 0.00 56.01 54.63 1ftt n LEU 40 Cb 0.00 1.98 -0.03 0.00 -2.33 0.00 0.00 43.42 43.04 1ftt n LEU 40 CO 0.00 -0.36 -0.11 0.42 -1.33 0.00 0.00 177.39 176.01 1ftt s THR 41 N -2.25 5.22 0.63 -5.08 -4.23 -1.26 -4.47 115.64 104.20 1ftt s THR 41 Ca 0.15 -0.74 0.36 0.00 -1.18 0.00 0.00 61.69 60.28 1ftt s THR 41 Cb -0.02 -3.69 0.39 0.00 1.34 0.00 0.00 72.50 70.52 1ftt s THR 41 CO 0.04 -0.10 2.26 1.55 -0.54 0.00 0.00 174.62 177.83 1ftt h PRO 42 N 2.15 0.00 0.05 3.99 0.13 -1.93 -0.57 132.00 135.82 1ftt h PRO 42 Ca -0.48 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1ftt h PRO 42 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1ftt h PRO 42 CO 0.68 0.00 -0.02 1.15 -0.23 0.00 0.00 178.00 179.57 1ftt h THR 43 N 0.00 1.25 -0.50 1.56 2.02 -1.97 -2.25 112.91 113.02 1ftt h THR 43 Ca 0.01 -1.60 -0.06 0.00 0.77 0.00 0.00 66.41 65.53 1ftt h THR 43 Cb 0.14 2.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.74 1ftt h THR 43 CO -0.00 0.37 0.08 -0.61 0.37 0.00 0.00 175.52 175.73 1ftt h GLN 44 N -0.86 0.78 -0.08 6.66 4.15 -1.82 -0.57 115.11 123.36 1ftt h GLN 44 Ca -0.01 -0.17 0.02 0.00 0.77 0.00 0.00 58.65 59.26 1ftt h GLN 44 Cb 0.66 -0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.19 1ftt h GLN 44 CO 0.01 0.73 -0.40 0.28 -1.93 0.00 0.00 178.83 177.52 1ftt h VAL 45 N 0.74 0.00 -0.91 2.39 2.07 -1.25 -2.74 116.25 116.55 1ftt h VAL 45 Ca 0.16 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.89 1ftt h VAL 45 Cb 0.34 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.99 1ftt h VAL 45 CO 0.01 0.00 0.45 0.50 0.02 0.00 0.00 177.57 178.54 1ftt h LYS 46 N -0.44 0.47 -0.25 1.57 3.64 -0.53 -0.93 116.57 120.10 1ftt h LYS 46 Ca 0.02 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1ftt h LYS 46 Cb 0.51 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1ftt h LYS 46 CO -0.31 0.31 0.17 0.82 -2.27 0.00 0.00 179.45 178.17 1ftt h ILE 47 N 0.49 1.07 -0.29 2.00 2.04 -1.04 0.22 117.51 121.99 1ftt h ILE 47 Ca 0.56 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 66.35 1ftt h ILE 47 Cb 1.01 0.69 -0.05 0.00 -0.74 0.00 0.00 36.82 37.74 1ftt h ILE 47 CO -0.48 0.06 0.01 -0.25 0.00 0.00 0.00 178.15 177.49 1ftt h TRP 48 N 0.34 -0.00 -0.51 1.37 7.01 -0.91 -1.31 115.95 121.94 1ftt h TRP 48 Ca 0.09 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.09 1ftt h TRP 48 Cb -0.04 0.04 -0.03 0.00 -2.10 0.00 0.00 29.16 27.04 1ftt h TRP 48 CO -0.06 -0.04 0.23 0.74 -2.79 0.00 0.00 178.44 176.52 1ftt h PHE 49 N 0.10 0.72 -0.10 2.65 -1.00 -0.75 -0.43 116.94 118.13 1ftt h PHE 49 Ca 0.14 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.87 1ftt h PHE 49 Cb 0.18 -0.23 -0.00 0.00 3.61 0.00 0.00 35.95 39.51 1ftt h PHE 49 CO -0.21 0.54 -0.02 0.37 -1.61 0.00 0.00 178.31 177.38 1ftt h GLN 50 N 0.72 0.19 -0.39 1.51 4.15 -0.22 -1.65 115.11 119.42 1ftt h GLN 50 Ca 0.18 -0.07 -0.13 0.00 0.77 0.00 0.00 58.65 59.39 1ftt h GLN 50 Cb 0.11 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 1ftt h GLN 50 CO -0.02 0.49 -0.30 -0.91 -1.93 0.00 0.00 178.83 176.16 1ftt h ASN 51 N -0.13 0.87 -0.07 -0.69 2.35 -0.96 -1.24 115.58 115.70 1ftt h ASN 51 Ca 0.03 -0.35 -0.03 0.00 -0.55 0.00 0.00 56.30 55.39 1ftt h ASN 51 Cb 0.42 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 1ftt h ASN 51 CO 0.01 1.10 -0.07 0.45 -1.65 0.00 0.00 177.43 177.28 1ftt h HIS 52 N 0.71 0.21 -0.88 1.19 3.86 -1.12 -1.35 115.15 117.77 1ftt h HIS 52 Ca 0.08 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1ftt h HIS 52 Cb 0.85 -0.04 -0.04 0.00 1.06 0.00 0.00 27.41 29.23 1ftt h HIS 52 CO 0.05 0.60 0.50 0.07 0.86 0.00 0.00 177.93 180.01 1ftt h ARG 53 N -0.24 1.22 0.50 2.45 0.11 -1.31 -2.07 114.38 115.04 1ftt h ARG 53 Ca 0.01 -0.13 -0.02 0.00 0.10 0.00 0.00 59.98 59.94 1ftt h ARG 53 Cb 0.56 -0.24 -0.01 0.00 1.11 0.00 0.00 29.97 31.39 1ftt h ARG 53 CO 0.02 0.88 -0.34 -0.92 0.10 0.00 0.00 179.97 179.71 1ftt h TYR 54 N 1.23 -0.90 0.08 4.08 3.20 -1.17 -1.61 116.97 121.88 1ftt h TYR 54 Ca 0.31 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.20 1ftt h TYR 54 Cb 0.01 0.33 -0.04 0.00 1.54 0.00 0.00 36.73 38.57 1ftt h TYR 54 CO 0.01 -0.51 -0.29 -0.22 -1.64 0.00 0.00 178.16 175.50 1ftt h LYS 55 N -0.81 -0.47 -0.08 1.82 1.63 -1.04 -0.46 116.57 117.16 1ftt h LYS 55 Ca -0.05 0.03 -0.11 0.00 -0.85 0.00 0.00 60.65 59.66 1ftt h LYS 55 Cb 0.68 0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.40 1ftt h LYS 55 CO 0.03 -0.32 -0.46 0.00 -3.45 0.00 0.00 179.45 175.26 1ftt h MET 56 N -0.49 0.20 0.07 1.90 -0.00 -1.41 -1.47 114.93 113.73 1ftt h MET 56 Ca 0.04 -0.11 -0.24 0.00 -0.00 0.00 0.00 59.70 59.39 1ftt h MET 56 Cb 0.54 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.14 1ftt h MET 56 CO -0.20 0.63 -1.09 1.57 -0.00 0.00 0.00 176.91 177.81 1ftt h LYS 57 N 0.17 0.23 -0.01 -0.10 2.10 -1.12 0.20 116.57 118.03 1ftt h LYS 57 Ca 0.01 -0.34 -0.00 0.00 -2.00 0.00 0.00 60.65 58.32 1ftt h LYS 57 Cb 0.88 0.12 -0.00 0.00 -0.90 0.00 0.00 32.23 32.33 1ftt h LYS 57 CO 0.07 1.12 0.01 -0.09 -2.00 0.00 0.00 179.45 178.56 1ftt h ARG 58 N 0.09 0.02 -0.87 0.07 1.12 -0.96 -2.38 114.38 111.47 1ftt h ARG 58 Ca -0.09 -0.00 0.06 0.00 -1.11 0.00 0.00 59.98 58.84 1ftt h ARG 58 Cb 1.80 -0.00 -0.06 0.00 -0.01 0.00 0.00 29.97 31.69 1ftt h ARG 58 CO 0.17 0.13 0.55 0.37 -3.11 0.00 0.00 179.97 178.08 1ftt h GLN 59 N -0.10 0.98 -1.15 0.20 -0.00 -1.30 -3.48 115.11 110.25 1ftt h GLN 59 Ca 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 1ftt h GLN 59 Cb 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 27.48 27.38 1ftt h GLN 59 CO -0.00 0.65 0.00 0.00 0.00 0.00 0.00 178.83 179.48 1ftt n ALA 60 N -2.35 -1.15 -2.07 3.38 0.00 0.51 -5.09 120.51 113.74 1ftt n ALA 60 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1ftt n ALA 60 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1ftt n ALA 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ftt n LYS 61 N -0.03 0.00 -0.38 0.00 0.00 -0.11 -4.82 118.16 112.83 1ftt n LYS 61 Ca 0.00 -0.99 0.05 0.00 0.00 0.00 0.00 58.31 57.37 1ftt n LYS 61 Cb 0.00 -0.31 0.20 0.00 0.00 0.00 0.00 35.03 34.93 1ftt n LYS 61 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1ftt n ASP 62 N 0.07 3.03 0.24 3.14 9.92 -1.26 -4.63 116.55 127.07 1ftt n ASP 62 Ca -0.00 -2.31 0.17 0.00 -0.53 0.00 0.00 54.79 52.12 1ftt n ASP 62 Cb 0.73 -0.47 0.88 0.00 -0.64 0.00 0.00 41.12 41.62 1ftt n ASP 62 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1ftt h LYS 63 N 2.25 0.00 -0.70 -1.24 1.57 -1.88 0.88 116.57 117.45 1ftt h LYS 63 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ftt h LYS 63 Cb 1.01 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.28 1ftt h LYS 63 CO 0.16 0.00 0.43 0.00 -0.57 0.00 0.00 179.45 179.48 1ftt h ALA 64 N 1.81 1.44 0.00 3.86 0.00 -1.95 -3.40 119.26 121.02 1ftt h ALA 64 Ca 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ftt h ALA 64 Cb 0.35 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1ftt h ALA 64 CO -0.00 0.49 -0.23 0.00 0.00 0.00 0.00 179.25 179.51 1ftt n ALA 65 N -2.43 2.47 -2.58 0.00 0.00 -0.39 -5.09 120.51 112.48 1ftt n ALA 65 Ca 0.07 -0.19 -0.07 0.00 0.00 0.00 0.00 53.44 53.25 1ftt n ALA 65 Cb 0.06 0.18 0.03 0.00 0.00 0.00 0.00 19.45 19.73 1ftt n ALA 65 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ftt n GLN 66 N -3.65 0.55 0.00 0.00 6.02 0.17 -5.16 117.38 115.32 1ftt n GLN 66 Ca -0.03 -0.90 0.00 0.00 -0.01 0.00 0.00 57.00 56.06 1ftt n GLN 66 Cb 0.12 -0.16 0.00 0.00 1.02 0.00 0.00 30.24 31.21 1ftt n GLN 66 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05