#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 3.04 -3.94 0.03 0.63 -1.26 -4.86 116.66 110.31 1ftt n ARG 1 Ca 0.00 -2.96 -0.15 0.00 -0.92 0.00 0.00 57.85 53.82 1ftt n ARG 1 Cb 0.00 -3.36 -0.15 0.00 0.45 0.00 0.00 32.46 29.40 1ftt n ARG 1 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1ftt s ARG 2 N 3.49 0.21 0.36 -0.14 3.00 -1.26 -5.17 118.95 119.44 1ftt s ARG 2 Ca 0.50 0.03 0.05 0.00 0.00 0.00 0.00 55.73 56.30 1ftt s ARG 2 Cb 0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 34.95 34.71 1ftt s ARG 2 CO -0.01 -0.06 0.52 -1.59 0.00 0.00 0.00 175.30 174.16 1ftt s LYS 3 N 0.58 3.11 -1.34 3.54 0.00 -1.26 -4.56 119.74 119.80 1ftt s LYS 3 Ca -0.06 -0.87 -0.01 0.00 0.00 0.00 0.00 55.97 55.03 1ftt s LYS 3 Cb -0.08 -2.75 -0.00 0.00 0.00 0.00 0.00 37.83 34.99 1ftt s LYS 3 CO -0.01 -0.02 0.56 -2.13 0.00 0.00 0.00 175.35 173.75 1ftt n ARG 4 N -1.75 -3.83 -2.90 1.78 3.00 -1.26 -4.91 116.66 106.79 1ftt n ARG 4 Ca 0.00 0.50 -0.44 0.00 -0.00 0.00 0.00 57.85 57.92 1ftt n ARG 4 Cb 0.58 -4.78 -0.00 0.00 0.00 0.00 0.00 32.46 28.26 1ftt n ARG 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1ftt s ARG 5 N -6.25 4.06 0.09 -0.14 3.52 -1.26 -5.00 118.95 113.97 1ftt s ARG 5 Ca 0.04 -2.49 -0.31 0.00 -0.13 0.00 0.00 55.73 52.84 1ftt s ARG 5 Cb -0.01 -5.12 -0.08 0.00 -1.56 0.00 0.00 34.95 28.18 1ftt s ARG 5 CO 0.85 -1.83 1.51 0.08 -0.81 0.00 0.00 175.30 175.10 1ftt s VAL 6 N 1.94 3.17 -0.06 7.11 1.01 -1.26 -5.01 120.40 127.30 1ftt s VAL 6 Ca 0.44 0.74 -0.01 0.00 0.00 0.00 0.00 61.98 63.14 1ftt s VAL 6 Cb -0.02 -3.47 0.03 0.00 0.00 0.00 0.00 36.38 32.91 1ftt s VAL 6 CO 0.01 0.03 0.02 -0.76 0.00 0.00 0.00 175.10 174.39 1ftt s LEU 7 N 1.84 0.51 0.00 3.92 1.43 -1.26 -5.12 118.68 119.99 1ftt s LEU 7 Ca 0.68 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 1ftt s LEU 7 Cb -0.38 -0.33 0.00 0.00 0.03 0.00 0.00 46.19 45.51 1ftt s LEU 7 CO 0.30 -0.20 0.00 0.49 0.23 0.00 0.00 176.35 177.17 1ftt n PHE 8 N 5.09 -3.40 -2.19 0.29 3.72 -1.26 -4.81 117.46 114.89 1ftt n PHE 8 Ca -0.08 1.53 -0.26 0.00 -0.05 0.00 0.00 57.45 58.60 1ftt n PHE 8 Cb 0.50 -2.83 0.08 0.00 -0.94 0.00 0.00 39.48 36.29 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 -6.44 4.68 0.19 4.37 1.04 -1.26 -4.89 113.70 111.40 1ftt s SER 9 Ca 0.00 0.41 -0.11 0.00 0.48 0.00 0.00 55.95 56.73 1ftt s SER 9 Cb 0.00 -1.01 0.18 0.00 0.10 0.00 0.00 66.02 65.29 1ftt s SER 9 CO 0.00 -1.69 1.79 1.56 0.98 0.00 0.00 173.24 175.89 1ftt h GLN 10 N -0.67 0.55 -0.13 4.02 7.50 -1.99 -1.51 115.11 122.88 1ftt h GLN 10 Ca -0.44 -0.03 -0.00 0.00 0.50 0.00 0.00 58.65 58.67 1ftt h GLN 10 Cb 1.31 -0.12 -0.01 0.00 0.05 0.00 0.00 27.48 28.71 1ftt h GLN 10 CO 0.58 0.36 0.07 0.00 -1.50 0.00 0.00 178.83 178.34 1ftt h ALA 11 N 1.31 0.17 0.07 3.87 0.00 -1.98 0.97 119.26 123.67 1ftt h ALA 11 Ca 0.26 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1ftt h ALA 11 Cb 0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1ftt h ALA 11 CO -0.17 -0.27 -0.22 1.96 0.00 0.00 0.00 179.25 180.54 1ftt h GLN 12 N 0.09 -0.37 -0.49 0.00 1.08 -1.86 -1.64 115.11 111.91 1ftt h GLN 12 Ca 0.05 0.03 -0.07 0.00 -1.45 0.00 0.00 58.65 57.20 1ftt h GLN 12 Cb 0.11 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 1ftt h GLN 12 CO -0.01 -0.25 0.03 0.28 -0.95 0.00 0.00 178.83 177.93 1ftt h VAL 13 N -0.39 1.24 -0.31 -0.54 2.07 -1.27 -2.05 116.25 114.99 1ftt h VAL 13 Ca 0.04 -0.96 0.05 0.00 0.82 0.00 0.00 66.70 66.65 1ftt h VAL 13 Cb 0.43 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1ftt h VAL 13 CO -0.16 0.34 0.06 0.22 0.02 0.00 0.00 177.57 178.05 1ftt h TYR 14 N 0.75 0.09 -0.58 1.57 3.20 -0.25 0.14 116.97 121.89 1ftt h TYR 14 Ca 0.15 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 1ftt h TYR 14 Cb 0.41 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.66 1ftt h TYR 14 CO 0.02 0.01 0.27 0.93 -1.64 0.00 0.00 178.16 177.75 1ftt h GLU 15 N 0.17 0.84 -0.09 1.82 3.07 -1.10 -0.06 114.58 119.22 1ftt h GLU 15 Ca 0.15 -0.13 -0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1ftt h GLU 15 Cb 0.16 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1ftt h GLU 15 CO -0.20 0.69 0.04 -0.07 -1.40 0.00 0.00 179.01 178.07 1ftt h LEU 16 N 0.79 0.12 -0.09 1.33 3.38 -0.83 -2.18 115.31 117.83 1ftt h LEU 16 Ca 0.20 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ftt h LEU 16 Cb 0.14 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1ftt h LEU 16 CO -0.02 0.24 0.06 -0.33 0.09 0.00 0.00 178.44 178.47 1ftt h GLU 17 N -0.00 0.12 -0.68 1.13 5.08 -0.72 -0.61 114.58 118.90 1ftt h GLU 17 Ca 0.03 -0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.53 1ftt h GLU 17 Cb 0.15 -0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.26 1ftt h GLU 17 CO -0.00 0.08 -0.01 -0.09 -1.00 0.00 0.00 179.01 177.99 1ftt h ARG 18 N 0.12 0.10 0.16 2.33 2.43 -0.91 0.03 114.38 118.65 1ftt h ARG 18 Ca 0.03 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1ftt h ARG 18 Cb -0.01 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1ftt h ARG 18 CO -0.01 0.07 -0.08 -0.09 -1.51 0.00 0.00 179.97 178.35 1ftt h ARG 19 N 0.10 -0.21 -0.73 0.20 9.65 -1.24 -3.31 114.38 118.84 1ftt h ARG 19 Ca 0.36 0.01 0.12 0.00 -1.10 0.00 0.00 59.98 59.37 1ftt h ARG 19 Cb 0.60 0.05 -0.08 0.00 -1.39 0.00 0.00 29.97 29.15 1ftt h ARG 19 CO -0.60 0.06 0.32 0.35 2.80 0.00 0.00 179.97 182.90 1ftt h PHE 20 N -0.47 0.56 0.00 2.20 3.57 0.12 -0.41 116.94 122.51 1ftt h PHE 20 Ca -0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1ftt h PHE 20 Cb 0.36 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.97 1ftt h PHE 20 CO 0.01 0.13 0.00 0.36 -2.23 0.00 0.00 178.31 176.58 1ftt n LYS 21 N -4.94 0.70 0.00 1.11 -0.00 -0.12 -3.62 118.16 111.28 1ftt n LYS 21 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.44 1ftt n LYS 21 Cb 0.35 -1.39 0.00 0.00 -0.00 0.00 0.00 35.03 33.99 1ftt n LYS 21 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1ftt n GLN 22 N -0.89 0.00 -4.98 -1.58 1.13 -0.29 -5.04 117.38 105.72 1ftt n GLN 22 Ca 0.13 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.87 1ftt n GLN 22 Cb 0.06 -0.22 -0.16 0.00 0.11 0.00 0.00 30.24 30.03 1ftt n GLN 22 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1ftt s GLN 23 N -0.68 3.16 -0.07 -1.09 0.74 -0.46 -5.02 119.66 116.23 1ftt s GLN 23 Ca 0.00 -0.81 0.01 0.00 0.05 0.00 0.00 55.36 54.61 1ftt s GLN 23 Cb 0.00 -2.44 0.13 0.00 1.10 0.00 0.00 33.01 31.80 1ftt s GLN 23 CO 0.00 0.16 1.05 1.63 -0.55 0.00 0.00 175.29 177.58 1ftt n LYS 24 N 3.62 1.37 -3.57 1.67 4.01 -1.24 -3.70 118.16 120.31 1ftt n LYS 24 Ca -0.19 -0.57 -0.10 0.00 -0.51 0.00 0.00 58.31 56.95 1ftt n LYS 24 Cb 0.53 -1.34 -0.05 0.00 -0.51 0.00 0.00 35.03 33.67 1ftt n LYS 24 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 1ftt s TYR 25 N -0.81 -0.34 0.07 2.13 2.02 -1.26 -4.87 117.35 114.29 1ftt s TYR 25 Ca 0.10 0.53 -0.13 0.00 -0.37 0.00 0.00 57.07 57.21 1ftt s TYR 25 Cb 0.09 0.47 -0.06 0.00 -0.40 0.00 0.00 41.96 42.05 1ftt s TYR 25 CO 0.02 -0.35 0.45 -0.51 -1.57 0.00 0.00 175.55 173.59 1ftt s LEU 26 N -1.32 4.39 0.91 -1.29 1.43 -1.26 -5.01 118.68 116.52 1ftt s LEU 26 Ca 0.00 0.93 -0.13 0.00 -1.03 0.00 0.00 54.13 53.90 1ftt s LEU 26 Cb -0.01 -2.94 0.14 0.00 0.03 0.00 0.00 46.19 43.41 1ftt s LEU 26 CO -0.00 0.20 1.17 -0.94 0.23 0.00 0.00 176.35 177.00 1ftt s SER 27 N -1.54 3.58 0.17 2.29 1.04 -1.26 -4.69 113.70 113.30 1ftt s SER 27 Ca 0.32 0.83 -0.21 0.00 0.48 0.00 0.00 55.95 57.36 1ftt s SER 27 Cb -0.15 -1.31 0.09 0.00 0.10 0.00 0.00 66.02 64.75 1ftt s SER 27 CO 0.17 -2.49 1.60 0.00 0.98 0.00 0.00 173.24 173.50 1ftt h ALA 28 N -1.46 -0.08 -0.22 5.32 0.00 -1.99 0.11 119.26 120.93 1ftt h ALA 28 Ca -0.48 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 1ftt h ALA 28 Cb 1.32 0.70 -0.00 0.00 0.00 0.00 0.00 17.79 19.80 1ftt h ALA 28 CO 0.59 -0.68 -0.23 -1.00 0.00 0.00 0.00 179.25 177.93 1ftt h PRO 29 N -0.20 0.55 -0.97 0.00 0.13 -1.99 -2.35 132.00 127.16 1ftt h PRO 29 Ca 0.20 -0.29 0.03 0.00 -0.87 0.00 0.00 66.00 65.06 1ftt h PRO 29 Cb 0.53 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 31.62 1ftt h PRO 29 CO -0.58 0.88 0.64 0.93 -0.23 0.00 0.00 178.00 179.64 1ftt h GLU 30 N 0.24 1.22 -0.28 0.86 5.08 -1.88 -0.36 114.58 119.46 1ftt h GLU 30 Ca 0.04 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 1ftt h GLU 30 Cb 0.78 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1ftt h GLU 30 CO 0.06 0.81 -0.23 -0.09 -1.00 0.00 0.00 179.01 178.56 1ftt h ARG 31 N 1.26 0.65 -0.45 2.33 2.43 -0.71 0.66 114.38 120.56 1ftt h ARG 31 Ca 0.37 -0.33 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 1ftt h ARG 31 Cb -0.06 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 1ftt h ARG 31 CO -0.11 0.93 0.11 1.49 -1.51 0.00 0.00 179.97 180.88 1ftt h GLU 32 N 0.39 0.71 0.06 0.20 4.57 -1.26 0.57 114.58 119.82 1ftt h GLU 32 Ca 0.05 -0.17 0.01 0.00 -1.18 0.00 0.00 59.36 58.07 1ftt h GLU 32 Cb 0.78 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 1ftt h GLU 32 CO 0.06 0.71 -0.08 1.25 -1.18 0.00 0.00 179.01 179.77 1ftt h HIS 33 N 0.59 -0.20 -0.35 0.92 2.76 -0.92 -0.77 115.15 117.17 1ftt h HIS 33 Ca 0.14 0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.33 1ftt h HIS 33 Cb 0.32 0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.33 1ftt h HIS 33 CO 0.02 -0.12 0.20 1.25 -1.30 0.00 0.00 177.93 177.97 1ftt h LEU 34 N -0.16 0.31 -0.70 0.26 6.46 -0.83 -0.10 115.31 120.55 1ftt h LEU 34 Ca 0.01 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.78 1ftt h LEU 34 Cb 0.17 -0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.01 1ftt h LEU 34 CO -0.04 0.23 0.44 0.00 -0.62 0.00 0.00 178.44 178.44 1ftt h ALA 35 N 1.16 0.89 -0.01 1.25 0.00 -0.54 0.40 119.26 122.41 1ftt h ALA 35 Ca 0.14 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ftt h ALA 35 Cb 0.02 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1ftt h ALA 35 CO -0.08 0.34 0.00 1.03 0.00 0.00 0.00 179.25 180.55 1ftt h SER 36 N 0.95 0.02 0.53 0.00 0.87 -1.03 -1.02 113.55 113.87 1ftt h SER 36 Ca 0.25 -0.27 -0.03 0.00 -1.23 0.00 0.00 61.79 60.52 1ftt h SER 36 Cb -0.06 -0.01 0.01 0.00 -0.44 0.00 0.00 62.40 61.90 1ftt h SER 36 CO -0.05 0.28 -0.25 -0.03 -0.53 0.00 0.00 176.83 176.25 1ftt h MET 37 N -0.24 -0.68 0.08 2.24 1.85 -0.48 -3.36 114.93 114.33 1ftt h MET 37 Ca 0.00 0.05 -0.00 0.00 -0.61 0.00 0.00 59.70 59.14 1ftt h MET 37 Cb 0.27 0.16 0.00 0.00 0.43 0.00 0.00 31.60 32.46 1ftt h MET 37 CO 0.00 -0.45 -0.04 -0.84 -0.40 0.00 0.00 176.91 175.19 1ftt h ILE 38 N -1.18 1.20 0.00 1.77 3.07 -1.12 -3.49 117.51 117.76 1ftt h ILE 38 Ca -0.07 -1.17 0.00 0.00 1.55 0.00 0.00 64.86 65.16 1ftt h ILE 38 Cb 0.55 1.94 0.00 0.00 -0.27 0.00 0.00 36.82 39.04 1ftt h ILE 38 CO 0.12 0.28 0.00 1.41 -1.05 0.00 0.00 178.15 178.91 1ftt n HIS 39 N -4.88 0.00 -4.12 0.16 8.25 -1.16 -4.97 115.22 108.50 1ftt n HIS 39 Ca -0.08 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.32 1ftt n HIS 39 Cb 0.27 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.37 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 -4.66 2.41 7.99 -0.39 -5.05 117.00 117.30 1ftt n LEU 40 Ca 0.00 -0.63 -0.29 0.00 -0.01 0.00 0.00 56.01 55.08 1ftt n LEU 40 Cb 0.00 0.16 -0.08 0.00 -0.11 0.00 0.00 43.42 43.39 1ftt n LEU 40 CO 0.00 -0.09 -0.35 0.42 -1.51 0.00 0.00 177.39 175.86 1ftt s THR 41 N -1.69 3.81 0.57 -5.08 -4.23 -1.26 -4.47 115.64 103.29 1ftt s THR 41 Ca 0.03 -1.19 0.27 0.00 -1.18 0.00 0.00 61.69 59.62 1ftt s THR 41 Cb 0.00 -2.85 0.35 0.00 1.34 0.00 0.00 72.50 71.35 1ftt s THR 41 CO 0.02 0.03 2.11 1.55 -0.54 0.00 0.00 174.62 177.79 1ftt h PRO 42 N 3.19 0.00 0.12 3.99 0.13 -1.91 -0.30 132.00 137.21 1ftt h PRO 42 Ca -0.48 0.00 -0.01 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 0.58 0.00 -0.06 1.15 -0.23 0.00 0.00 178.00 179.44 1ftt h THR 43 N 0.00 1.07 -0.97 1.56 2.02 -1.96 -1.73 112.91 112.90 1ftt h THR 43 Ca 0.09 -0.90 0.01 0.00 0.77 0.00 0.00 66.41 66.38 1ftt h THR 43 Cb 0.44 1.62 -0.05 0.00 -1.74 0.00 0.00 68.15 68.43 1ftt h THR 43 CO -0.00 0.21 0.64 1.56 0.37 0.00 0.00 175.52 178.30 1ftt h GLN 44 N -0.59 1.27 0.22 6.66 1.08 -1.62 -0.32 115.11 121.80 1ftt h GLN 44 Ca -0.02 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.11 1ftt h GLN 44 Cb 0.47 -0.29 -0.03 0.00 -0.05 0.00 0.00 27.48 27.58 1ftt h GLN 44 CO 0.03 0.84 -0.44 0.28 -0.95 0.00 0.00 178.83 178.58 1ftt h VAL 45 N 1.30 0.00 -0.99 -0.54 2.07 -1.15 -1.63 116.25 115.32 1ftt h VAL 45 Ca 0.36 0.00 0.15 0.00 0.82 0.00 0.00 66.70 68.03 1ftt h VAL 45 Cb -0.14 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.54 1ftt h VAL 45 CO -0.08 0.00 0.61 0.50 0.02 0.00 0.00 177.57 178.62 1ftt h LYS 46 N -0.72 0.85 0.24 1.57 3.64 -0.71 -0.43 116.57 121.02 1ftt h LYS 46 Ca -0.02 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1ftt h LYS 46 Cb 0.68 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1ftt h LYS 46 CO -0.18 0.56 -0.12 0.82 -2.27 0.00 0.00 179.45 178.27 1ftt h ILE 47 N 0.88 0.80 -0.61 2.00 2.04 -0.94 0.52 117.51 122.20 1ftt h ILE 47 Ca 0.53 -0.25 0.11 0.00 1.00 0.00 0.00 64.86 66.25 1ftt h ILE 47 Cb 0.67 0.95 -0.08 0.00 -0.74 0.00 0.00 36.82 37.61 1ftt h ILE 47 CO -0.32 0.06 0.18 -0.25 0.00 0.00 0.00 178.15 177.81 1ftt h TRP 48 N -0.45 0.30 -0.30 1.37 7.01 -0.47 -0.97 115.95 122.43 1ftt h TRP 48 Ca -0.03 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.00 1ftt h TRP 48 Cb 0.34 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 27.35 1ftt h TRP 48 CO -0.03 0.02 0.18 0.74 -2.79 0.00 0.00 178.44 176.57 1ftt h PHE 49 N 0.33 0.40 -0.33 2.65 0.04 -0.92 -1.92 116.94 117.19 1ftt h PHE 49 Ca 0.32 -0.00 0.06 0.00 2.80 0.00 0.00 57.97 61.15 1ftt h PHE 49 Cb 0.45 -0.13 -0.05 0.00 2.20 0.00 0.00 35.95 38.41 1ftt h PHE 49 CO -0.21 0.29 -0.02 0.37 -0.60 0.00 0.00 178.31 178.15 1ftt h GLN 50 N 0.39 0.07 -0.87 1.51 -0.00 -0.30 -0.74 115.11 115.16 1ftt h GLN 50 Ca 0.11 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.73 1ftt h GLN 50 Cb 0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 27.48 27.43 1ftt h GLN 50 CO -0.02 0.05 0.46 -0.91 0.00 0.00 0.00 178.83 178.41 1ftt h ASN 51 N 0.08 1.11 -0.02 -0.69 2.35 -0.89 0.90 115.58 118.41 1ftt h ASN 51 Ca 0.16 -0.11 -0.18 0.00 -0.55 0.00 0.00 56.30 55.62 1ftt h ASN 51 Cb 0.22 -0.28 0.01 0.00 0.05 0.00 0.00 38.32 38.32 1ftt h ASN 51 CO -0.28 0.90 -0.67 0.45 -1.65 0.00 0.00 177.43 176.18 1ftt h HIS 52 N 1.23 0.72 -0.36 1.19 3.86 -1.10 -1.89 115.15 118.80 1ftt h HIS 52 Ca 0.30 -0.38 0.03 0.00 -1.16 0.00 0.00 60.37 59.17 1ftt h HIS 52 Cb 0.06 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.40 1ftt h HIS 52 CO 0.01 1.19 0.15 -0.09 0.86 0.00 0.00 177.93 180.05 1ftt h ARG 53 N 0.05 0.31 -0.21 2.45 2.43 -1.02 -2.40 114.38 115.99 1ftt h ARG 53 Ca -0.08 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.13 1ftt h ARG 53 Cb 1.36 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.77 1ftt h ARG 53 CO 0.13 0.20 -0.23 -0.92 -1.51 0.00 0.00 179.97 177.64 1ftt h TYR 54 N 0.32 -0.61 -0.43 2.20 3.20 -0.85 -2.31 116.97 118.48 1ftt h TYR 54 Ca 0.16 0.03 0.08 0.00 3.14 0.00 0.00 58.73 62.14 1ftt h TYR 54 Cb 0.11 0.30 -0.07 0.00 1.54 0.00 0.00 36.73 38.61 1ftt h TYR 54 CO -0.12 -0.31 -0.01 -0.22 -1.64 0.00 0.00 178.16 175.86 1ftt h LYS 55 N -0.25 0.09 0.15 1.82 1.63 -0.95 -0.38 116.57 118.67 1ftt h LYS 55 Ca 0.13 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.91 1ftt h LYS 55 Cb 0.45 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.06 1ftt h LYS 55 CO -0.35 0.06 -0.07 0.52 -3.45 0.00 0.00 179.45 176.16 1ftt h MET 56 N 0.10 -0.19 -0.27 1.90 2.86 -1.25 0.96 114.93 119.04 1ftt h MET 56 Ca 0.21 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.82 1ftt h MET 56 Cb 0.31 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1ftt h MET 56 CO -0.37 -0.00 0.00 0.87 1.06 0.00 0.00 176.91 178.47 1ftt h LYS 57 N -0.34 0.48 -0.70 1.72 1.57 -1.18 -2.64 116.57 115.48 1ftt h LYS 57 Ca -0.02 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1ftt h LYS 57 Cb 0.27 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1ftt h LYS 57 CO 0.03 0.64 0.45 -0.09 -0.57 0.00 0.00 179.45 179.91 1ftt h ARG 58 N 0.27 0.93 -3.42 3.15 2.43 -1.13 -3.47 114.38 113.14 1ftt h ARG 58 Ca 0.08 -0.07 -0.39 0.00 -0.81 0.00 0.00 59.98 58.79 1ftt h ARG 58 Cb 0.42 -0.20 0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1ftt h ARG 58 CO 0.01 0.63 -0.53 0.94 -1.51 0.00 0.00 179.97 179.51 1ftt n GLN 59 N -4.58 -2.92 0.00 0.20 7.27 0.33 -4.59 117.38 113.09 1ftt n GLN 59 Ca 0.06 0.91 0.00 0.00 0.07 0.00 0.00 57.00 58.04 1ftt n GLN 59 Cb 0.03 -5.57 0.00 0.00 2.41 0.00 0.00 30.24 27.12 1ftt n GLN 59 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1ftt n ALA 60 N -2.61 0.00 0.00 1.69 0.00 -1.24 -4.70 120.51 113.64 1ftt n ALA 60 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1ftt n ALA 60 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 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 0.00 0.04 0.00 5.02 -1.26 -3.59 118.16 118.37 1ftt n LYS 61 Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1ftt n LYS 61 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 1ftt n LYS 61 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1ftt h ASP 62 N 0.00 0.00 0.03 4.39 3.32 -1.84 -1.70 116.42 120.62 1ftt h ASP 62 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ftt h ASP 62 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ftt h ASP 62 CO 0.00 0.66 -0.01 0.11 -1.72 0.00 0.00 179.24 178.27 1ftt h LYS 63 N 0.00 -0.04 -0.36 3.56 6.56 -1.87 -3.44 116.57 120.98 1ftt h LYS 63 Ca -0.14 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.43 1ftt h LYS 63 Cb 1.63 0.01 -0.15 0.00 -0.57 0.00 0.00 32.23 33.14 1ftt h LYS 63 CO 0.06 0.62 -0.20 0.00 -2.06 0.00 0.00 179.45 177.87 1ftt s ALA 64 N -3.36 -4.01 0.00 3.86 0.00 -1.26 -5.05 121.76 111.94 1ftt s ALA 64 Ca -0.16 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1ftt s ALA 64 Cb -0.00 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.18 1ftt s ALA 64 CO 0.63 -2.47 0.00 0.00 0.00 0.00 0.00 175.76 173.92 1ftt n ALA 65 N 2.72 2.63 -0.48 0.00 0.00 -1.09 -4.91 120.51 119.39 1ftt n ALA 65 Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.55 1ftt n ALA 65 Cb 0.63 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.05 1ftt n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ftt n GLN 66 N -2.28 0.97 0.00 0.00 10.64 -0.66 -4.95 117.38 121.09 1ftt n GLN 66 Ca 0.00 -0.15 0.00 0.00 -1.83 0.00 0.00 57.00 55.02 1ftt n GLN 66 Cb 0.00 -1.24 0.00 0.00 -0.86 0.00 0.00 30.24 28.14 1ftt n GLN 66 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23