#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 2.92 -0.50 2.12 1.74 -1.26 -4.14 116.66 117.54 1ftt n ARG 1 Ca 0.00 -2.64 0.00 0.00 -0.77 0.00 0.00 57.85 54.44 1ftt n ARG 1 Cb 0.00 -3.26 0.00 0.00 -1.02 0.00 0.00 32.46 28.18 1ftt n ARG 1 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1ftt n ARG 2 N 5.90 0.00 -0.04 5.56 -4.01 -1.26 -4.93 116.66 117.88 1ftt n ARG 2 Ca 0.52 -0.38 -0.14 0.00 -1.04 0.00 0.00 57.85 56.81 1ftt n ARG 2 Cb 0.38 -0.19 -0.09 0.00 -3.04 0.00 0.00 32.46 29.52 1ftt n ARG 2 CO 0.00 0.00 0.00 -0.22 -3.04 0.00 0.00 177.63 174.37 1ftt h LYS 3 N 0.00 0.30 0.00 2.89 1.63 -2.04 -3.47 116.57 115.89 1ftt h LYS 3 Ca 0.00 -0.21 0.00 0.00 -0.85 0.00 0.00 60.65 59.59 1ftt h LYS 3 Cb 1.15 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.82 1ftt h LYS 3 CO 0.00 0.83 0.00 -2.13 -3.45 0.00 0.00 179.45 174.70 1ftt n ARG 4 N -4.51 0.00 -1.78 1.90 0.63 -1.26 -4.43 116.66 107.22 1ftt n ARG 4 Ca -0.08 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.44 1ftt n ARG 4 Cb 0.44 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.35 1ftt n ARG 4 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 1ftt n ARG 5 N 0.00 3.12 0.13 -0.14 -4.01 -1.26 -4.75 116.66 109.75 1ftt n ARG 5 Ca 0.00 -2.71 -0.06 0.00 -1.04 0.00 0.00 57.85 54.04 1ftt n ARG 5 Cb 0.00 -3.15 -0.03 0.00 -3.04 0.00 0.00 32.46 26.24 1ftt n ARG 5 CO 0.00 0.00 0.00 0.28 -3.04 0.00 0.00 177.63 174.87 1ftt h VAL 6 N 3.80 0.00 -2.16 8.89 2.07 -2.00 -3.41 116.25 123.43 1ftt h VAL 6 Ca 0.59 0.00 -0.42 0.00 0.82 0.00 0.00 66.70 67.69 1ftt h VAL 6 Cb 0.58 0.00 -0.34 0.00 -1.52 0.00 0.00 31.29 30.02 1ftt h VAL 6 CO 1.83 0.00 -0.72 -0.22 0.02 0.00 0.00 177.57 178.48 1ftt s LEU 7 N -5.94 0.17 0.35 2.57 2.96 -1.26 -5.11 118.68 112.42 1ftt s LEU 7 Ca -0.06 -1.58 0.00 0.00 -0.22 0.00 0.00 54.13 52.27 1ftt s LEU 7 Cb 0.01 0.30 0.00 0.00 0.50 0.00 0.00 46.19 46.99 1ftt s LEU 7 CO 0.18 -0.30 0.00 0.49 -1.32 0.00 0.00 176.35 175.40 1ftt n PHE 8 N 4.40 -3.56 -3.83 5.38 3.72 -1.26 -5.04 117.46 117.27 1ftt n PHE 8 Ca 0.09 1.79 -0.09 0.00 -0.05 0.00 0.00 57.45 59.18 1ftt n PHE 8 Cb 0.43 -3.24 -0.05 0.00 -0.94 0.00 0.00 39.48 35.69 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 -7.03 -0.15 0.17 4.37 1.04 -1.26 -4.73 113.70 106.12 1ftt s SER 9 Ca 0.00 -0.63 -0.14 0.00 0.48 0.00 0.00 55.95 55.66 1ftt s SER 9 Cb 0.00 0.53 0.13 0.00 0.10 0.00 0.00 66.02 66.78 1ftt s SER 9 CO 0.00 -1.01 1.75 1.56 0.98 0.00 0.00 173.24 176.52 1ftt h GLN 10 N 2.32 0.31 0.08 4.02 4.20 -1.99 -0.85 115.11 123.20 1ftt h GLN 10 Ca -0.29 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.39 1ftt h GLN 10 Cb 1.25 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.96 1ftt h GLN 10 CO 0.41 0.21 -0.04 0.00 -0.67 0.00 0.00 178.83 178.73 1ftt h ALA 11 N 1.30 -0.11 -0.08 3.87 0.00 -1.98 -0.58 119.26 121.67 1ftt h ALA 11 Ca 0.21 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ftt h ALA 11 Cb 0.21 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ftt h ALA 11 CO -0.22 -0.53 0.05 1.96 0.00 0.00 0.00 179.25 180.51 1ftt h GLN 12 N -0.18 0.11 0.10 0.00 4.20 -1.77 -0.58 115.11 117.00 1ftt h GLN 12 Ca -0.01 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 1ftt h GLN 12 Cb 0.15 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1ftt h GLN 12 CO 0.02 0.13 -0.05 0.28 -0.67 0.00 0.00 178.83 178.54 1ftt h VAL 13 N 0.06 0.91 -0.64 -0.54 2.07 -1.21 -0.15 116.25 116.76 1ftt h VAL 13 Ca 0.03 -0.04 0.13 0.00 0.82 0.00 0.00 66.70 67.64 1ftt h VAL 13 Cb 0.05 0.94 -0.12 0.00 -1.52 0.00 0.00 31.29 30.64 1ftt h VAL 13 CO -0.01 0.01 -0.15 0.22 0.02 0.00 0.00 177.57 177.67 1ftt h TYR 14 N -0.15 -0.32 -0.58 1.57 3.20 -0.79 0.14 116.97 120.03 1ftt h TYR 14 Ca -0.01 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1ftt h TYR 14 Cb 0.12 0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 1ftt h TYR 14 CO -0.07 -0.27 0.38 0.93 -1.64 0.00 0.00 178.16 177.50 1ftt h GLU 15 N 0.01 0.77 0.94 1.82 5.08 -0.88 -0.84 114.58 121.48 1ftt h GLU 15 Ca 0.31 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.57 1ftt h GLU 15 Cb 0.47 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.56 1ftt h GLU 15 CO -0.65 0.52 -0.45 -0.07 -1.00 0.00 0.00 179.01 177.36 1ftt h LEU 16 N 0.79 -1.07 -0.68 1.33 3.38 0.11 -0.16 115.31 119.02 1ftt h LEU 16 Ca 0.21 0.04 0.13 0.00 0.09 0.00 0.00 57.88 58.35 1ftt h LEU 16 Cb -0.08 0.28 -0.09 0.00 0.09 0.00 0.00 40.66 40.85 1ftt h LEU 16 CO -0.05 -0.74 0.19 -0.33 0.09 0.00 0.00 178.44 177.60 1ftt h GLU 17 N -1.32 0.31 -0.98 1.13 3.07 -0.99 0.49 114.58 116.29 1ftt h GLU 17 Ca -0.13 -0.02 0.09 0.00 -0.50 0.00 0.00 59.36 58.80 1ftt h GLU 17 Cb 0.97 -0.07 -0.07 0.00 -0.84 0.00 0.00 28.75 28.74 1ftt h GLU 17 CO 0.21 0.20 0.63 -0.09 -1.40 0.00 0.00 179.01 178.56 1ftt h ARG 18 N 0.32 1.03 0.12 2.33 1.12 -0.93 -1.72 114.38 116.65 1ftt h ARG 18 Ca 0.37 -0.06 -0.23 0.00 -1.11 0.00 0.00 59.98 58.94 1ftt h ARG 18 Cb 0.56 -0.23 0.02 0.00 -0.01 0.00 0.00 29.97 30.32 1ftt h ARG 18 CO -0.43 0.68 -0.99 -0.09 -3.11 0.00 0.00 179.97 176.03 1ftt h ARG 19 N 1.06 0.46 -0.89 0.20 1.12 -0.28 -3.32 114.38 112.73 1ftt h ARG 19 Ca 0.44 -0.66 0.18 0.00 -1.11 0.00 0.00 59.98 58.83 1ftt h ARG 19 Cb 0.30 0.23 -0.10 0.00 -0.01 0.00 0.00 29.97 30.38 1ftt h ARG 19 CO -0.20 1.29 0.46 0.35 -3.11 0.00 0.00 179.97 178.76 1ftt h PHE 20 N -0.05 0.80 0.00 2.20 3.57 -0.49 0.67 116.94 123.64 1ftt h PHE 20 Ca -0.16 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.38 1ftt h PHE 20 Cb 1.73 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 40.25 1ftt h PHE 20 CO 0.15 0.13 0.00 0.36 -2.23 0.00 0.00 178.31 176.73 1ftt n LYS 21 N -4.90 0.32 -0.05 1.11 -0.00 -0.69 -3.92 118.16 110.04 1ftt n LYS 21 Ca 0.20 0.07 -0.05 0.00 -0.00 0.00 0.00 58.31 58.52 1ftt n LYS 21 Cb 0.52 -1.50 -0.02 0.00 -0.00 0.00 0.00 35.03 34.03 1ftt n LYS 21 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1ftt n GLN 22 N -1.29 0.31 -1.32 -1.58 7.27 -0.01 -5.04 117.38 115.73 1ftt n GLN 22 Ca 0.11 0.12 -0.31 0.00 0.07 0.00 0.00 57.00 56.99 1ftt n GLN 22 Cb 0.18 -1.02 0.09 0.00 2.41 0.00 0.00 30.24 31.90 1ftt n GLN 22 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 1ftt s GLN 23 N -2.29 2.33 -0.11 3.69 -1.52 0.02 -5.01 119.66 116.77 1ftt s GLN 23 Ca -0.17 1.18 -0.04 0.00 -1.95 0.00 0.00 55.36 54.38 1ftt s GLN 23 Cb 0.02 -1.91 -0.03 0.00 -0.22 0.00 0.00 33.01 30.88 1ftt s GLN 23 CO 0.25 -1.59 0.04 0.87 -0.25 0.00 0.00 175.29 174.62 1ftt h LYS 24 N -1.01 0.00 -2.63 2.91 1.79 -1.89 -3.44 116.57 112.29 1ftt h LYS 24 Ca -0.44 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 57.92 1ftt h LYS 24 Cb 1.23 0.00 -0.26 0.00 -1.58 0.00 0.00 32.23 31.62 1ftt h LYS 24 CO 0.52 0.10 -0.27 0.71 -1.08 0.00 0.00 179.45 179.43 1ftt s TYR 25 N -1.72 -0.59 0.17 -1.35 2.02 -1.26 -5.06 117.35 109.56 1ftt s TYR 25 Ca -0.04 1.29 -0.31 0.00 -0.37 0.00 0.00 57.07 57.64 1ftt s TYR 25 Cb 0.00 0.26 -0.08 0.00 -0.40 0.00 0.00 41.96 41.73 1ftt s TYR 25 CO 0.10 -0.32 1.35 -0.51 -1.57 0.00 0.00 175.55 174.59 1ftt s LEU 26 N 1.13 4.40 1.06 -1.29 1.02 -1.26 -5.04 118.68 118.69 1ftt s LEU 26 Ca -0.07 2.39 -0.17 0.00 0.02 0.00 0.00 54.13 56.29 1ftt s LEU 26 Cb -0.07 -3.60 0.23 0.00 0.02 0.00 0.00 46.19 42.77 1ftt s LEU 26 CO -0.10 -0.59 1.23 -0.94 0.02 0.00 0.00 176.35 175.97 1ftt s SER 27 N 0.65 2.21 0.15 2.29 1.04 -1.26 -4.61 113.70 114.18 1ftt s SER 27 Ca 0.60 0.44 -0.19 0.00 0.48 0.00 0.00 55.95 57.29 1ftt s SER 27 Cb -0.37 -0.59 0.05 0.00 0.10 0.00 0.00 66.02 65.21 1ftt s SER 27 CO 0.35 -3.31 1.67 0.00 0.98 0.00 0.00 173.24 172.93 1ftt h ALA 28 N -2.03 0.14 -0.12 5.32 0.00 -1.99 -0.27 119.26 120.30 1ftt h ALA 28 Ca -0.45 0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.41 1ftt h ALA 28 Cb 1.26 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.36 1ftt h ALA 28 CO 0.37 -0.51 -0.66 -1.00 0.00 0.00 0.00 179.25 177.46 1ftt h PRO 29 N -0.06 0.46 0.01 0.00 0.13 -2.00 -3.10 132.00 127.44 1ftt h PRO 29 Ca 0.16 -0.34 -0.00 0.00 -0.87 0.00 0.00 66.00 64.95 1ftt h PRO 29 Cb 0.30 0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.49 1ftt h PRO 29 CO -0.36 0.96 -0.01 1.49 -0.23 0.00 0.00 178.00 179.86 1ftt h GLU 30 N 0.33 -0.01 -0.30 0.86 4.81 -1.83 -2.18 114.58 116.25 1ftt h GLU 30 Ca -0.02 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1ftt h GLU 30 Cb 1.22 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.58 1ftt h GLU 30 CO 0.12 0.25 0.10 0.07 -0.73 0.00 0.00 179.01 178.82 1ftt h ARG 31 N -0.28 0.42 0.25 1.92 -0.00 -1.17 -1.21 114.38 114.31 1ftt h ARG 31 Ca -0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 59.98 59.93 1ftt h ARG 31 Cb 0.27 -0.08 -0.02 0.00 -0.00 0.00 0.00 29.97 30.14 1ftt h ARG 31 CO 0.00 0.37 -0.24 1.49 -0.00 0.00 0.00 179.97 181.59 1ftt h GLU 32 N 0.42 -0.51 -0.18 0.08 4.57 -1.40 -0.72 114.58 116.85 1ftt h GLU 32 Ca 0.10 0.03 -0.14 0.00 -1.18 0.00 0.00 59.36 58.18 1ftt h GLU 32 Cb 0.12 0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 1ftt h GLU 32 CO -0.01 -0.34 -0.47 1.12 -1.18 0.00 0.00 179.01 178.14 1ftt h HIS 33 N -0.53 0.54 -0.41 0.92 2.07 -1.05 -2.65 115.15 114.05 1ftt h HIS 33 Ca -0.01 -0.17 0.06 0.00 -2.85 0.00 0.00 60.37 57.41 1ftt h HIS 33 Cb 0.48 -0.11 -0.05 0.00 2.57 0.00 0.00 27.41 30.30 1ftt h HIS 33 CO -0.16 0.83 0.10 1.25 -3.07 0.00 0.00 177.93 176.88 1ftt h LEU 34 N 0.36 0.04 -0.96 6.12 6.46 -1.11 -1.36 115.31 124.86 1ftt h LEU 34 Ca 0.02 0.07 0.16 0.00 -0.12 0.00 0.00 57.88 58.01 1ftt h LEU 34 Cb 0.96 0.08 -0.10 0.00 -0.73 0.00 0.00 40.66 40.87 1ftt h LEU 34 CO 0.08 0.06 0.57 0.00 -0.62 0.00 0.00 178.44 178.53 1ftt h ALA 35 N 1.31 1.52 0.18 1.25 0.00 -0.75 0.64 119.26 123.41 1ftt h ALA 35 Ca 0.20 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1ftt h ALA 35 Cb 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ftt h ALA 35 CO -0.25 0.02 -0.09 1.03 0.00 0.00 0.00 179.25 179.96 1ftt h SER 36 N 0.79 -0.21 0.87 0.00 0.87 -1.41 -1.93 113.55 112.54 1ftt h SER 36 Ca 0.53 -0.27 -0.04 0.00 -1.23 0.00 0.00 61.79 60.77 1ftt h SER 36 Cb 0.72 0.05 0.01 0.00 -0.44 0.00 0.00 62.40 62.74 1ftt h SER 36 CO -0.35 0.19 -0.42 0.24 -0.53 0.00 0.00 176.83 175.96 1ftt h MET 37 N -0.64 -1.13 -0.30 2.24 2.07 -0.11 -3.17 114.93 113.90 1ftt h MET 37 Ca -0.03 0.08 -0.03 0.00 -2.07 0.00 0.00 59.70 57.66 1ftt h MET 37 Cb 0.47 0.26 -0.01 0.00 -1.87 0.00 0.00 31.60 30.44 1ftt h MET 37 CO 0.04 -0.75 0.09 -0.84 1.07 0.00 0.00 176.91 176.52 1ftt h ILE 38 N -1.20 1.21 -0.43 -1.22 3.07 -1.10 -3.49 117.51 114.34 1ftt h ILE 38 Ca -0.12 -0.67 0.00 0.00 1.55 0.00 0.00 64.86 65.62 1ftt h ILE 38 Cb 0.90 1.09 0.00 0.00 -0.27 0.00 0.00 36.82 38.54 1ftt h ILE 38 CO 0.20 0.22 0.00 1.41 -1.05 0.00 0.00 178.15 178.93 1ftt n HIS 39 N -4.69 0.00 -0.22 0.16 8.25 -0.92 -4.73 115.22 113.08 1ftt n HIS 39 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1ftt n HIS 39 Cb 0.17 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 30.83 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 -4.89 2.41 4.77 -0.77 -4.93 117.00 113.58 1ftt n LEU 40 Ca 0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 1ftt n LEU 40 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1ftt n LEU 40 CO 0.00 0.00 -0.02 0.42 -1.33 0.00 0.00 177.39 176.46 1ftt s THR 41 N -2.06 5.23 0.59 -5.08 -4.23 -1.26 -4.49 115.64 104.34 1ftt s THR 41 Ca 0.00 0.05 0.39 0.00 -1.18 0.00 0.00 61.69 60.95 1ftt s THR 41 Cb 0.00 -3.61 0.41 0.00 1.34 0.00 0.00 72.50 70.64 1ftt s THR 41 CO 0.00 0.17 2.30 1.55 -0.54 0.00 0.00 174.62 178.10 1ftt h PRO 42 N 3.27 0.00 0.09 3.99 0.13 -1.91 -0.27 132.00 137.29 1ftt h PRO 42 Ca -0.47 0.00 -0.00 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 0.01 -0.04 1.15 -0.23 0.00 0.00 178.00 179.59 1ftt h THR 43 N 0.00 0.78 -0.72 1.56 2.02 -1.96 -2.82 112.91 111.77 1ftt h THR 43 Ca -0.00 -1.37 -0.04 0.00 0.77 0.00 0.00 66.41 65.77 1ftt h THR 43 Cb 0.06 1.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1ftt h THR 43 CO 0.00 0.24 0.28 -0.61 0.37 0.00 0.00 175.52 175.80 1ftt h GLN 44 N -0.96 1.07 -0.28 6.66 4.15 -1.85 -0.18 115.11 123.72 1ftt h GLN 44 Ca -0.01 -0.19 0.03 0.00 0.77 0.00 0.00 58.65 59.25 1ftt h GLN 44 Cb 0.48 -0.18 -0.04 0.00 0.21 0.00 0.00 27.48 27.95 1ftt h GLN 44 CO 0.02 0.87 -0.26 0.28 -1.93 0.00 0.00 178.83 177.81 1ftt h VAL 45 N 1.05 0.00 -0.88 2.39 2.07 -1.21 -0.75 116.25 118.91 1ftt h VAL 45 Ca 0.24 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.82 1ftt h VAL 45 Cb 0.21 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.92 1ftt h VAL 45 CO -0.02 0.00 0.58 0.50 0.02 0.00 0.00 177.57 178.65 1ftt h LYS 46 N -0.12 0.98 -0.30 1.57 1.63 -1.01 -1.34 116.57 117.98 1ftt h LYS 46 Ca 0.05 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1ftt h LYS 46 Cb 0.25 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.64 1ftt h LYS 46 CO -0.33 0.65 0.17 0.82 -3.45 0.00 0.00 179.45 177.31 1ftt h ILE 47 N 1.01 1.12 -0.33 2.00 2.04 -0.85 0.12 117.51 122.63 1ftt h ILE 47 Ca 0.38 -0.32 0.05 0.00 1.00 0.00 0.00 64.86 65.97 1ftt h ILE 47 Cb 0.18 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 1ftt h ILE 47 CO -0.14 0.12 0.03 -0.25 0.00 0.00 0.00 178.15 177.92 1ftt h TRP 48 N 0.37 0.04 -0.69 1.37 7.01 -0.19 -0.26 115.95 123.60 1ftt h TRP 48 Ca 0.11 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.14 1ftt h TRP 48 Cb 0.05 0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.11 1ftt h TRP 48 CO -0.03 -0.02 0.46 0.74 -2.79 0.00 0.00 178.44 176.79 1ftt h PHE 49 N 0.13 0.87 -0.14 2.65 0.04 -0.99 -1.06 116.94 118.44 1ftt h PHE 49 Ca 0.16 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.97 1ftt h PHE 49 Cb 0.20 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.03 1ftt h PHE 49 CO -0.21 0.55 -0.00 0.37 -0.60 0.00 0.00 178.31 178.42 1ftt h GLN 50 N 0.94 0.04 -0.22 1.51 -0.00 -0.30 -1.42 115.11 115.66 1ftt h GLN 50 Ca 0.25 -0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.84 1ftt h GLN 50 Cb -0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.36 1ftt h GLN 50 CO -0.05 0.03 -0.11 -0.91 0.00 0.00 0.00 178.83 177.79 1ftt h ASN 51 N 0.04 0.48 -0.13 -0.69 2.35 -0.71 -0.79 115.58 116.14 1ftt h ASN 51 Ca 0.07 -0.41 -0.01 0.00 -0.55 0.00 0.00 56.30 55.39 1ftt h ASN 51 Cb 0.08 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1ftt h ASN 51 CO -0.12 0.78 0.03 0.45 -1.65 0.00 0.00 177.43 176.92 1ftt h HIS 52 N 0.17 0.22 -0.72 1.19 3.86 -1.18 -1.36 115.15 117.32 1ftt h HIS 52 Ca 0.05 -0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.20 1ftt h HIS 52 Cb 0.60 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.98 1ftt h HIS 52 CO 0.06 0.37 0.31 0.07 0.86 0.00 0.00 177.93 179.60 1ftt h ARG 53 N -0.00 1.07 -0.75 2.45 -0.00 -1.28 -3.06 114.38 112.80 1ftt h ARG 53 Ca 0.04 -0.18 -0.05 0.00 -0.00 0.00 0.00 59.98 59.79 1ftt h ARG 53 Cb 0.27 -0.18 -0.03 0.00 -0.00 0.00 0.00 29.97 30.02 1ftt h ARG 53 CO 0.00 0.86 0.28 -0.92 -0.00 0.00 0.00 179.97 180.20 1ftt h TYR 54 N 1.03 1.16 0.45 4.08 3.20 -0.98 -1.35 116.97 124.56 1ftt h TYR 54 Ca 0.24 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 1ftt h TYR 54 Cb 0.18 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.11 1ftt h TYR 54 CO 0.01 0.89 -0.22 -0.22 -1.64 0.00 0.00 178.16 176.99 1ftt h LYS 55 N 1.09 -0.58 0.00 1.82 3.11 -1.16 0.81 116.57 121.66 1ftt h LYS 55 Ca 0.25 0.04 -0.10 0.00 -2.81 0.00 0.00 60.65 58.03 1ftt h LYS 55 Cb 0.24 0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.59 1ftt h LYS 55 CO -0.02 -0.39 -0.46 0.00 -2.81 0.00 0.00 179.45 175.78 1ftt h MET 56 N -0.61 0.00 -0.10 1.90 -0.00 -1.51 -1.16 114.93 113.46 1ftt h MET 56 Ca -0.06 0.00 -0.21 0.00 -0.00 0.00 0.00 59.70 59.43 1ftt h MET 56 Cb 0.46 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 32.07 1ftt h MET 56 CO 0.10 0.46 -0.79 -0.22 -0.00 0.00 0.00 176.91 176.46 1ftt h LYS 57 N 0.00 0.62 0.76 -0.10 3.64 -1.05 -3.28 116.57 117.15 1ftt h LYS 57 Ca -0.00 -0.53 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 1ftt h LYS 57 Cb 0.82 0.12 0.01 0.00 -0.41 0.00 0.00 32.23 32.77 1ftt h LYS 57 CO 0.06 1.15 -0.36 -0.09 -2.27 0.00 0.00 179.45 177.93 1ftt h ARG 58 N 0.41 -0.98 -6.95 1.90 2.43 -0.71 -3.48 114.38 107.01 1ftt h ARG 58 Ca -0.05 0.07 -0.48 0.00 -0.81 0.00 0.00 59.98 58.71 1ftt h ARG 58 Cb 1.41 0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 31.17 1ftt h ARG 58 CO 0.15 -0.65 -0.84 0.00 -1.51 0.00 0.00 179.97 177.12 1ftt n GLN 59 N -5.45 -0.52 -2.11 0.20 -0.00 -0.45 -4.80 117.38 104.25 1ftt n GLN 59 Ca -0.13 0.06 -0.29 0.00 -0.00 0.00 0.00 57.00 56.65 1ftt n GLN 59 Cb 0.40 -1.78 -0.05 0.00 -0.00 0.00 0.00 30.24 28.81 1ftt n GLN 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ftt s ALA 60 N -3.62 1.86 0.05 2.61 0.00 -1.26 -4.31 121.76 117.09 1ftt s ALA 60 Ca 0.33 -1.95 0.00 0.00 0.00 0.00 0.00 51.96 50.34 1ftt s ALA 60 Cb -0.18 -4.62 0.00 0.00 0.00 0.00 0.00 23.12 18.31 1ftt s ALA 60 CO 0.78 -4.91 0.00 1.63 0.00 0.00 0.00 175.76 173.26 1ftt n LYS 61 N 8.53 -2.20 -1.37 0.00 4.76 -1.26 -4.83 118.16 121.79 1ftt n LYS 61 Ca 0.43 1.87 -0.39 0.00 -2.87 0.00 0.00 58.31 57.35 1ftt n LYS 61 Cb 0.47 -1.94 -0.03 0.00 -1.84 0.00 0.00 35.03 31.69 1ftt n LYS 61 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1ftt n ASP 62 N 0.76 8.34 -4.10 4.39 9.92 -1.26 -4.86 116.55 129.74 1ftt n ASP 62 Ca 0.00 -2.61 -0.42 0.00 -0.53 0.00 0.00 54.79 51.22 1ftt n ASP 62 Cb 0.00 -1.56 0.00 0.00 -0.64 0.00 0.00 41.12 38.92 1ftt n ASP 62 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1ftt n LYS 63 N 3.74 3.02 -0.21 -1.24 5.02 -1.26 -4.64 118.16 122.59 1ftt n LYS 63 Ca 0.76 -2.92 -0.08 0.00 -2.02 0.00 0.00 58.31 54.06 1ftt n LYS 63 Cb 0.24 -3.37 0.03 0.00 -0.02 0.00 0.00 35.03 31.91 1ftt n LYS 63 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ftt h ALA 64 N 6.66 0.76 -0.14 7.82 0.00 -2.03 -3.45 119.26 128.88 1ftt h ALA 64 Ca 0.51 -0.17 -0.69 0.00 0.00 0.00 0.00 54.91 54.56 1ftt h ALA 64 Cb 0.74 -0.23 -0.13 0.00 0.00 0.00 0.00 17.79 18.17 1ftt h ALA 64 CO 1.70 0.39 -0.50 0.00 0.00 0.00 0.00 179.25 180.83 1ftt s ALA 65 N -5.51 4.28 0.00 0.00 0.00 -1.26 -5.08 121.76 114.18 1ftt s ALA 65 Ca -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1ftt s ALA 65 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.25 1ftt s ALA 65 CO 0.80 -0.00 0.01 0.00 0.00 0.00 0.00 175.76 176.56 1ftt n GLN 66 N -1.31 0.31 0.00 0.00 10.64 -1.26 -5.10 117.38 120.65 1ftt n GLN 66 Ca -0.22 -0.01 0.00 0.00 -1.83 0.00 0.00 57.00 54.95 1ftt n GLN 66 Cb 0.67 -0.17 0.00 0.00 -0.86 0.00 0.00 30.24 29.88 1ftt n GLN 66 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23