#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 3.11 -3.99 0.03 0.63 -1.26 -4.62 116.66 110.55 1ftt n ARG 1 Ca 0.00 -2.27 -0.41 0.00 -0.92 0.00 0.00 57.85 54.25 1ftt n ARG 1 Cb 0.00 -2.97 0.02 0.00 0.45 0.00 0.00 32.46 29.96 1ftt n ARG 1 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1ftt n ARG 2 N 4.83 -0.60 -2.09 -0.14 0.63 -1.26 -3.53 116.66 114.50 1ftt n ARG 2 Ca 0.64 0.26 -0.00 0.00 -0.92 0.00 0.00 57.85 57.83 1ftt n ARG 2 Cb 0.30 -2.54 0.00 0.00 0.45 0.00 0.00 32.46 30.67 1ftt n ARG 2 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1ftt n LYS 3 N -4.42 -1.65 0.00 -0.14 0.00 -1.26 -5.04 118.16 105.64 1ftt n LYS 3 Ca -0.16 1.58 0.00 0.00 0.00 0.00 0.00 58.31 59.74 1ftt n LYS 3 Cb 0.59 -3.16 0.00 0.00 0.00 0.00 0.00 35.03 32.47 1ftt n LYS 3 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1ftt n ARG 4 N 0.28 0.00 -1.23 1.64 3.00 -1.23 -4.90 116.66 114.21 1ftt n ARG 4 Ca 0.00 0.26 -0.33 0.00 -0.00 0.00 0.00 57.85 57.79 1ftt n ARG 4 Cb 0.02 -1.06 0.11 0.00 0.00 0.00 0.00 32.46 31.53 1ftt n ARG 4 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 1ftt s ARG 5 N -1.43 1.86 0.00 -0.14 3.03 -1.26 -4.99 118.95 116.02 1ftt s ARG 5 Ca 0.00 1.67 0.00 0.00 2.03 0.00 0.00 55.73 59.43 1ftt s ARG 5 Cb 0.00 -1.81 0.00 0.00 -1.03 0.00 0.00 34.95 32.11 1ftt s ARG 5 CO 0.00 -2.03 0.44 0.28 -1.13 0.00 0.00 175.30 172.86 1ftt n VAL 6 N -3.16 0.00 -3.58 4.99 0.31 -1.26 -5.02 118.33 110.61 1ftt n VAL 6 Ca 0.13 0.84 -0.10 0.00 -0.01 0.00 0.00 64.34 65.20 1ftt n VAL 6 Cb 0.51 -1.65 -0.05 0.00 -0.91 0.00 0.00 33.84 31.74 1ftt n VAL 6 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1ftt s LEU 7 N -2.63 -0.35 0.07 7.52 0.20 -1.26 -5.18 118.68 117.04 1ftt s LEU 7 Ca 0.00 0.38 -0.07 0.00 0.69 0.00 0.00 54.13 55.13 1ftt s LEU 7 Cb 0.00 1.82 -0.01 0.00 -0.43 0.00 0.00 46.19 47.57 1ftt s LEU 7 CO 0.00 -0.33 0.14 -0.36 -0.29 0.00 0.00 176.35 175.51 1ftt s PHE 8 N -1.10 0.21 0.30 5.38 0.08 -1.26 -5.08 117.98 116.51 1ftt s PHE 8 Ca -0.01 -0.62 -0.17 0.00 0.12 0.00 0.00 56.93 56.25 1ftt s PHE 8 Cb -0.00 -0.12 0.02 0.00 -0.57 0.00 0.00 43.02 42.34 1ftt s PHE 8 CO 0.01 -0.48 0.68 -1.54 -0.10 0.00 0.00 175.22 173.79 1ftt s SER 9 N -2.68 -0.10 0.11 1.36 1.04 -1.26 -5.02 113.70 107.16 1ftt s SER 9 Ca 0.03 -0.85 -0.25 0.00 0.48 0.00 0.00 55.95 55.36 1ftt s SER 9 Cb 0.04 0.73 -0.09 0.00 0.10 0.00 0.00 66.02 66.80 1ftt s SER 9 CO -0.09 -1.39 1.68 1.56 0.98 0.00 0.00 173.24 175.97 1ftt h GLN 10 N 2.05 -0.26 -0.15 4.02 7.50 -2.03 -0.91 115.11 125.34 1ftt h GLN 10 Ca -0.24 0.02 -0.00 0.00 0.50 0.00 0.00 58.65 58.93 1ftt h GLN 10 Cb 1.25 0.06 -0.01 0.00 0.05 0.00 0.00 27.48 28.83 1ftt h GLN 10 CO 0.30 -0.17 0.08 0.00 -1.50 0.00 0.00 178.83 177.54 1ftt h ALA 11 N 0.63 0.19 0.67 3.87 0.00 -1.97 0.13 119.26 122.78 1ftt h ALA 11 Ca 0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1ftt h ALA 11 Cb 0.31 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1ftt h ALA 11 CO -0.11 -0.29 -0.32 1.96 0.00 0.00 0.00 179.25 180.50 1ftt h GLN 12 N 0.15 -0.87 -0.58 0.00 4.20 -1.80 -2.15 115.11 114.05 1ftt h GLN 12 Ca 0.05 0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.76 1ftt h GLN 12 Cb 0.05 0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1ftt h GLN 12 CO -0.01 -0.57 0.12 0.28 -0.67 0.00 0.00 178.83 177.98 1ftt h VAL 13 N -0.94 1.24 -0.16 -0.54 2.07 -1.20 -0.79 116.25 115.94 1ftt h VAL 13 Ca -0.09 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 66.58 1ftt h VAL 13 Cb 0.70 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 1ftt h VAL 13 CO 0.15 0.33 -0.26 0.22 0.02 0.00 0.00 177.57 178.03 1ftt h TYR 14 N 0.87 -0.70 0.24 1.57 3.20 -0.89 0.80 116.97 122.05 1ftt h TYR 14 Ca 0.19 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 1ftt h TYR 14 Cb 0.34 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1ftt h TYR 14 CO 0.02 -0.34 -0.19 0.93 -1.64 0.00 0.00 178.16 176.94 1ftt h GLU 15 N -0.32 -0.43 -0.32 1.82 4.39 -1.00 -1.22 114.58 117.51 1ftt h GLU 15 Ca 0.11 0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.89 1ftt h GLU 15 Cb 0.48 0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.18 1ftt h GLU 15 CO -0.34 -0.29 0.03 -0.07 -1.16 0.00 0.00 179.01 177.19 1ftt h LEU 16 N -0.45 -0.06 0.05 1.33 3.38 -0.78 0.79 115.31 119.57 1ftt h LEU 16 Ca -0.01 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ftt h LEU 16 Cb 0.40 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1ftt h LEU 16 CO -0.02 0.00 -0.02 -0.33 0.09 0.00 0.00 178.44 178.16 1ftt h GLU 17 N 0.13 -0.07 -0.70 1.13 5.08 -0.86 -0.03 114.58 119.27 1ftt h GLU 17 Ca 0.15 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.58 1ftt h GLU 17 Cb 0.19 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.40 1ftt h GLU 17 CO -0.23 0.19 0.40 -0.09 -1.00 0.00 0.00 179.01 178.28 1ftt h ARG 18 N -0.32 0.72 0.34 2.33 2.43 -0.96 -1.55 114.38 117.36 1ftt h ARG 18 Ca -0.01 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1ftt h ARG 18 Cb 0.29 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1ftt h ARG 18 CO 0.01 0.48 -0.16 -0.09 -1.51 0.00 0.00 179.97 178.69 1ftt h ARG 19 N 0.74 -0.44 -0.89 0.20 9.65 -0.80 -2.90 114.38 119.95 1ftt h ARG 19 Ca 0.31 0.03 0.17 0.00 -1.10 0.00 0.00 59.98 59.39 1ftt h ARG 19 Cb 0.18 0.10 -0.10 0.00 -1.39 0.00 0.00 29.97 28.75 1ftt h ARG 19 CO -0.18 -0.27 0.46 0.35 2.80 0.00 0.00 179.97 183.14 1ftt h PHE 20 N -0.49 0.80 -0.62 2.20 3.57 -0.44 0.29 116.94 122.24 1ftt h PHE 20 Ca -0.05 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1ftt h PHE 20 Cb 0.37 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 1ftt h PHE 20 CO -0.04 0.14 0.31 -0.22 -2.23 0.00 0.00 178.31 176.27 1ftt h LYS 21 N 0.60 0.89 0.02 1.11 3.64 -1.20 -3.26 116.57 118.37 1ftt h LYS 21 Ca 0.51 -0.12 -0.26 0.00 -1.27 0.00 0.00 60.65 59.50 1ftt h LYS 21 Cb 0.79 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.41 1ftt h LYS 21 CO -0.40 0.70 -1.39 1.96 -2.27 0.00 0.00 179.45 178.05 1ftt h GLN 22 N 0.86 0.04 -7.12 1.90 4.20 -1.00 -3.49 115.11 110.50 1ftt h GLN 22 Ca 0.22 -0.06 -0.49 0.00 0.06 0.00 0.00 58.65 58.37 1ftt h GLN 22 Cb 0.10 0.02 0.06 0.00 0.30 0.00 0.00 27.48 27.96 1ftt h GLN 22 CO -0.03 0.80 0.40 -1.14 -0.67 0.00 0.00 178.83 178.19 1ftt s GLN 23 N -2.65 3.40 -0.11 1.46 0.74 0.88 -5.02 119.66 118.38 1ftt s GLN 23 Ca -0.03 1.43 -0.10 0.00 0.05 0.00 0.00 55.36 56.70 1ftt s GLN 23 Cb 0.09 -2.03 -0.03 0.00 1.10 0.00 0.00 33.01 32.13 1ftt s GLN 23 CO 0.83 -0.77 -0.20 1.63 -0.55 0.00 0.00 175.29 176.23 1ftt n LYS 24 N -1.50 0.32 -3.71 1.67 4.76 -1.26 -4.87 118.16 113.57 1ftt n LYS 24 Ca 0.10 0.18 -0.14 0.00 -2.87 0.00 0.00 58.31 55.59 1ftt n LYS 24 Cb 0.52 -1.12 -0.09 0.00 -1.84 0.00 0.00 35.03 32.50 1ftt n LYS 24 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1ftt s TYR 25 N -2.11 -0.43 -0.41 2.13 2.02 -1.26 -4.16 117.35 113.13 1ftt s TYR 25 Ca -0.16 0.97 -0.28 0.00 -0.37 0.00 0.00 57.07 57.22 1ftt s TYR 25 Cb 0.02 0.17 0.00 0.00 -0.40 0.00 0.00 41.96 41.75 1ftt s TYR 25 CO 0.24 -0.30 1.54 -0.51 -1.57 0.00 0.00 175.55 174.95 1ftt s LEU 26 N -0.25 3.53 1.06 -1.29 1.43 -1.26 -5.00 118.68 116.91 1ftt s LEU 26 Ca -0.04 0.90 -0.16 0.00 -1.03 0.00 0.00 54.13 53.80 1ftt s LEU 26 Cb -0.03 -3.45 0.22 0.00 0.03 0.00 0.00 46.19 42.96 1ftt s LEU 26 CO 0.02 -1.58 1.17 -0.94 0.23 0.00 0.00 176.35 175.25 1ftt s SER 27 N 4.77 2.17 0.24 2.29 1.04 -1.26 -4.48 113.70 118.46 1ftt s SER 27 Ca 0.66 0.66 -0.05 0.00 0.48 0.00 0.00 55.95 57.70 1ftt s SER 27 Cb -0.16 -0.96 0.42 0.00 0.10 0.00 0.00 66.02 65.42 1ftt s SER 27 CO 0.32 -3.35 1.72 0.00 0.98 0.00 0.00 173.24 172.90 1ftt h ALA 28 N -2.06 0.97 0.03 5.32 0.00 -2.01 -0.24 119.26 121.28 1ftt h ALA 28 Ca -0.47 0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.38 1ftt h ALA 28 Cb 1.29 0.13 0.02 0.00 0.00 0.00 0.00 17.79 19.23 1ftt h ALA 28 CO 0.43 -0.25 -0.76 -1.00 0.00 0.00 0.00 179.25 177.67 1ftt h PRO 29 N 0.38 0.45 -0.60 0.00 0.13 -2.01 -3.37 132.00 126.98 1ftt h PRO 29 Ca 0.39 -0.54 -0.06 0.00 -0.87 0.00 0.00 66.00 64.93 1ftt h PRO 29 Cb 0.61 0.16 -0.03 0.00 0.13 0.00 0.00 31.00 31.87 1ftt h PRO 29 CO -0.42 1.18 0.13 1.49 -0.23 0.00 0.00 178.00 180.16 1ftt h GLU 30 N -0.04 0.94 -0.80 0.86 4.81 -1.75 -0.74 114.58 117.86 1ftt h GLU 30 Ca -0.11 -0.21 0.03 0.00 -0.13 0.00 0.00 59.36 58.95 1ftt h GLU 30 Cb 1.48 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.68 1ftt h GLU 30 CO 0.15 0.85 0.51 0.07 -0.73 0.00 0.00 179.01 179.86 1ftt h ARG 31 N 0.90 0.97 -0.15 1.92 0.11 -1.24 0.88 114.38 117.77 1ftt h ARG 31 Ca 0.19 -0.06 -0.14 0.00 0.10 0.00 0.00 59.98 60.08 1ftt h ARG 31 Cb 0.34 -0.22 0.00 0.00 1.11 0.00 0.00 29.97 31.20 1ftt h ARG 31 CO 0.00 0.64 -0.45 1.49 0.10 0.00 0.00 179.97 181.75 1ftt h GLU 32 N 1.00 0.56 -0.60 0.08 4.81 -1.61 -0.56 114.58 118.26 1ftt h GLU 32 Ca 0.32 -0.41 0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1ftt h GLU 32 Cb 0.02 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 1ftt h GLU 32 CO -0.12 1.03 0.38 1.25 -0.73 0.00 0.00 179.01 180.83 1ftt h HIS 33 N 0.20 0.72 0.10 0.92 2.76 -0.90 -0.59 115.15 118.36 1ftt h HIS 33 Ca -0.01 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1ftt h HIS 33 Cb 1.07 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.79 1ftt h HIS 33 CO 0.10 0.43 -0.05 1.25 -1.30 0.00 0.00 177.93 178.36 1ftt h LEU 34 N 0.77 -0.12 -0.77 0.26 5.85 -0.84 -1.14 115.31 119.33 1ftt h LEU 34 Ca 0.23 -0.17 0.15 0.00 0.84 0.00 0.00 57.88 58.93 1ftt h LEU 34 Cb -0.03 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 40.94 1ftt h LEU 34 CO -0.08 0.10 0.31 0.00 -0.34 0.00 0.00 178.44 178.43 1ftt h ALA 35 N 0.53 1.09 0.20 1.25 0.00 -0.66 0.52 119.26 122.19 1ftt h ALA 35 Ca -0.01 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ftt h ALA 35 Cb 0.28 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ftt h ALA 35 CO 0.02 -0.22 -0.10 1.03 0.00 0.00 0.00 179.25 179.99 1ftt h SER 36 N 0.44 -0.23 0.20 0.00 0.87 -1.10 -0.05 113.55 113.69 1ftt h SER 36 Ca 0.42 -0.15 0.01 0.00 -1.23 0.00 0.00 61.79 60.84 1ftt h SER 36 Cb 0.65 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.64 1ftt h SER 36 CO -0.41 0.02 -0.33 -0.03 -0.53 0.00 0.00 176.83 175.55 1ftt h MET 37 N -0.48 -0.58 -0.11 2.24 -1.53 0.13 -3.04 114.93 111.56 1ftt h MET 37 Ca -0.03 0.04 -0.03 0.00 -3.44 0.00 0.00 59.70 56.24 1ftt h MET 37 Cb 0.37 0.13 -0.00 0.00 -0.55 0.00 0.00 31.60 31.55 1ftt h MET 37 CO 0.05 -0.39 -0.05 -0.84 0.14 0.00 0.00 176.91 175.82 1ftt h ILE 38 N -0.60 1.31 -0.38 1.77 3.07 -1.07 -3.49 117.51 118.11 1ftt h ILE 38 Ca 0.01 -1.05 0.00 0.00 1.55 0.00 0.00 64.86 65.38 1ftt h ILE 38 Cb 0.60 1.78 0.00 0.00 -0.27 0.00 0.00 36.82 38.93 1ftt h ILE 38 CO -0.14 0.30 0.00 1.41 -1.05 0.00 0.00 178.15 178.66 1ftt n HIS 39 N -4.72 0.00 -2.78 0.16 8.25 -0.41 -4.67 115.22 111.05 1ftt n HIS 39 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 1ftt n HIS 39 Cb 0.27 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 31.18 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 -0.06 0.00 -4.69 2.41 4.77 -0.17 -5.03 117.00 114.23 1ftt n LEU 40 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.72 1ftt n LEU 40 Cb 0.00 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1ftt n LEU 40 CO 0.00 0.00 -0.30 0.42 -1.33 0.00 0.00 177.39 176.18 1ftt s THR 41 N -2.99 3.84 0.58 -5.08 -4.23 -1.26 -4.38 115.64 102.12 1ftt s THR 41 Ca 0.00 -1.44 0.28 0.00 -1.18 0.00 0.00 61.69 59.35 1ftt s THR 41 Cb 0.00 -2.96 0.35 0.00 1.34 0.00 0.00 72.50 71.23 1ftt s THR 41 CO 0.00 -0.16 2.17 1.55 -0.54 0.00 0.00 174.62 177.64 1ftt h PRO 42 N 2.47 0.00 0.20 3.99 0.13 -1.92 -0.60 132.00 136.26 1ftt h PRO 42 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1ftt h PRO 42 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1ftt h PRO 42 CO 0.59 0.00 -0.09 1.15 -0.23 0.00 0.00 178.00 179.42 1ftt h THR 43 N 0.00 0.85 -0.12 1.56 2.02 -1.95 -1.06 112.91 114.21 1ftt h THR 43 Ca 0.04 -0.93 0.01 0.00 0.77 0.00 0.00 66.41 66.30 1ftt h THR 43 Cb 0.25 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 1ftt h THR 43 CO -0.00 0.19 0.05 -0.61 0.37 0.00 0.00 175.52 175.52 1ftt h GLN 44 N -0.77 0.11 -0.50 6.66 -0.00 -1.84 -0.63 115.11 118.14 1ftt h GLN 44 Ca -0.03 -0.01 0.05 0.00 -0.00 0.00 0.00 58.65 58.67 1ftt h GLN 44 Cb 0.51 -0.03 -0.07 0.00 0.00 0.00 0.00 27.48 27.90 1ftt h GLN 44 CO 0.04 0.07 -0.40 0.28 0.00 0.00 0.00 178.83 178.83 1ftt h VAL 45 N 0.12 0.00 -0.79 2.39 2.07 -1.23 -1.27 116.25 117.54 1ftt h VAL 45 Ca 0.05 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.66 1ftt h VAL 45 Cb 0.02 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.73 1ftt h VAL 45 CO -0.04 0.00 0.52 0.50 0.02 0.00 0.00 177.57 178.56 1ftt h LYS 46 N -0.14 0.72 0.05 1.57 3.64 -0.57 -0.50 116.57 121.34 1ftt h LYS 46 Ca 0.08 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1ftt h LYS 46 Cb 0.35 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1ftt h LYS 46 CO -0.54 0.47 -0.02 0.82 -2.27 0.00 0.00 179.45 177.91 1ftt h ILE 47 N 0.74 1.13 -0.51 2.00 2.04 -0.58 0.57 117.51 122.91 1ftt h ILE 47 Ca 0.36 -0.58 0.09 0.00 1.00 0.00 0.00 64.86 65.73 1ftt h ILE 47 Cb 0.42 1.52 -0.07 0.00 -0.74 0.00 0.00 36.82 37.95 1ftt h ILE 47 CO -0.14 0.15 0.08 -0.25 0.00 0.00 0.00 178.15 177.99 1ftt h TRP 48 N -0.32 0.13 0.07 1.37 7.01 -0.43 -1.66 115.95 122.12 1ftt h TRP 48 Ca -0.01 0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.03 1ftt h TRP 48 Cb 0.29 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.36 1ftt h TRP 48 CO 0.01 -0.03 -0.09 0.74 -2.79 0.00 0.00 178.44 176.29 1ftt h PHE 49 N 0.21 -0.22 -0.65 2.65 0.04 -1.00 -2.25 116.94 115.72 1ftt h PHE 49 Ca 0.26 0.00 0.11 0.00 2.80 0.00 0.00 57.97 61.14 1ftt h PHE 49 Cb 0.36 0.09 -0.12 0.00 2.20 0.00 0.00 35.95 38.47 1ftt h PHE 49 CO -0.25 -0.13 -0.32 0.37 -0.60 0.00 0.00 178.31 177.38 1ftt h GLN 50 N -0.18 -0.12 -0.96 1.51 4.15 -0.44 -0.09 115.11 118.98 1ftt h GLN 50 Ca 0.01 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 1ftt h GLN 50 Cb 0.19 0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.86 1ftt h GLN 50 CO -0.04 -0.08 0.59 -0.91 -1.93 0.00 0.00 178.83 176.46 1ftt h ASN 51 N -0.13 1.14 -0.05 -0.69 2.35 -1.05 -0.44 115.58 116.70 1ftt h ASN 51 Ca 0.26 -0.06 -0.08 0.00 -0.55 0.00 0.00 56.30 55.86 1ftt h ASN 51 Cb 0.55 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1ftt h ASN 51 CO -0.72 0.87 -0.30 0.45 -1.65 0.00 0.00 177.43 176.08 1ftt h HIS 52 N 1.32 0.40 -0.31 1.19 3.86 -0.70 -1.48 115.15 119.43 1ftt h HIS 52 Ca 0.35 -0.18 -0.03 0.00 -1.16 0.00 0.00 60.37 59.34 1ftt h HIS 52 Cb -0.08 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.32 1ftt h HIS 52 CO 0.00 0.92 0.05 0.07 0.86 0.00 0.00 177.93 179.83 1ftt h ARG 53 N -0.23 0.45 -0.25 2.45 0.11 -0.96 -2.48 114.38 113.48 1ftt h ARG 53 Ca -0.02 -0.07 -0.03 0.00 0.10 0.00 0.00 59.98 59.96 1ftt h ARG 53 Cb 0.96 -0.08 -0.01 0.00 1.11 0.00 0.00 29.97 31.95 1ftt h ARG 53 CO 0.06 0.44 0.05 -0.92 0.10 0.00 0.00 179.97 179.71 1ftt h TYR 54 N 0.44 0.42 -0.31 4.08 5.03 -1.05 -3.14 116.97 122.44 1ftt h TYR 54 Ca 0.10 -0.05 0.05 0.00 2.58 0.00 0.00 58.73 61.41 1ftt h TYR 54 Cb 0.22 -0.12 -0.05 0.00 1.55 0.00 0.00 36.73 38.34 1ftt h TYR 54 CO 0.01 0.50 0.03 -0.22 -1.32 0.00 0.00 178.16 177.16 1ftt h LYS 55 N 0.22 0.13 -0.29 1.82 1.63 -0.81 0.70 116.57 119.97 1ftt h LYS 55 Ca 0.08 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 1ftt h LYS 55 Cb 0.30 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.88 1ftt h LYS 55 CO 0.00 0.08 0.14 0.00 -3.45 0.00 0.00 179.45 176.23 1ftt h MET 56 N 0.13 0.41 0.00 1.90 -0.00 -1.56 -1.19 114.93 114.63 1ftt h MET 56 Ca 0.15 -0.06 -0.15 0.00 -0.00 0.00 0.00 59.70 59.64 1ftt h MET 56 Cb 0.18 -0.08 -0.02 0.00 -0.00 0.00 0.00 31.60 31.69 1ftt h MET 56 CO -0.22 0.38 -0.71 1.57 -0.00 0.00 0.00 176.91 177.93 1ftt h LYS 57 N 0.33 0.00 -0.19 -0.10 2.10 -1.28 -1.30 116.57 116.13 1ftt h LYS 57 Ca 0.10 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.71 1ftt h LYS 57 Cb 0.10 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 1ftt h LYS 57 CO -0.01 0.71 -0.04 -0.09 -2.00 0.00 0.00 179.45 178.01 1ftt h ARG 58 N 0.00 0.36 0.00 0.07 9.65 -0.74 -3.44 114.38 120.28 1ftt h ARG 58 Ca -0.01 -0.14 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 1ftt h ARG 58 Cb 1.33 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.89 1ftt h ARG 58 CO 0.09 0.62 0.00 0.00 2.80 0.00 0.00 179.97 183.48 1ftt n GLN 59 N -4.64 0.00 -0.03 0.20 10.64 -0.55 -5.05 117.38 117.94 1ftt n GLN 59 Ca -0.05 0.00 -0.14 0.00 -1.83 0.00 0.00 57.00 54.99 1ftt n GLN 59 Cb 0.27 -0.05 -0.10 0.00 -0.86 0.00 0.00 30.24 29.50 1ftt n GLN 59 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ftt h ALA 60 N 0.00 0.05 -3.00 2.61 0.00 -1.05 -3.49 119.26 114.38 1ftt h ALA 60 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1ftt h ALA 60 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ftt h ALA 60 CO 0.00 -0.09 0.00 1.63 0.00 0.00 0.00 179.25 180.79 1ftt n LYS 61 N -4.70 0.00 -2.44 0.00 5.02 -0.51 -4.99 118.16 110.54 1ftt n LYS 61 Ca -0.08 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.78 1ftt n LYS 61 Cb 0.35 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.33 1ftt n LYS 61 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ftt s ASP 62 N 1.48 7.07 0.04 4.39 1.11 -1.23 -4.60 116.67 124.93 1ftt s ASP 62 Ca 0.00 1.91 0.15 0.00 0.18 0.00 0.00 52.55 54.79 1ftt s ASP 62 Cb 0.00 -2.57 -0.16 0.00 1.07 0.00 0.00 42.92 41.26 1ftt s ASP 62 CO 0.00 -0.52 0.81 0.07 1.18 0.00 0.00 175.17 176.71 1ftt h LYS 63 N 7.15 0.00 0.07 8.23 2.10 -1.86 -2.56 116.57 129.70 1ftt h LYS 63 Ca -0.38 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.13 1ftt h LYS 63 Cb 1.19 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.53 1ftt h LYS 63 CO 0.84 0.37 -0.59 0.00 -2.00 0.00 0.00 179.45 178.08 1ftt h ALA 64 N 1.29 -0.02 -2.70 0.07 0.00 -1.97 -3.47 119.26 112.46 1ftt h ALA 64 Ca -0.19 -0.61 -0.54 0.00 0.00 0.00 0.00 54.91 53.57 1ftt h ALA 64 Cb 1.71 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.53 1ftt h ALA 64 CO 0.06 0.29 0.15 0.00 0.00 0.00 0.00 179.25 179.75 1ftt s ALA 65 N -2.70 3.43 0.05 0.00 0.00 -1.26 -5.08 121.76 116.19 1ftt s ALA 65 Ca -0.14 0.29 0.05 0.00 0.00 0.00 0.00 51.96 52.16 1ftt s ALA 65 Cb 0.01 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.16 1ftt s ALA 65 CO 0.80 0.20 -0.13 -0.65 0.00 0.00 0.00 175.76 175.97 1ftt s GLN 66 N -0.64 0.84 0.00 0.00 1.11 -1.26 -4.85 119.66 114.86 1ftt s GLN 66 Ca 0.36 -0.83 0.00 0.00 0.01 0.00 0.00 55.36 54.90 1ftt s GLN 66 Cb -0.22 -0.83 0.00 0.00 -1.01 0.00 0.00 33.01 30.95 1ftt s GLN 66 CO 0.24 0.19 0.13 1.04 0.01 0.00 0.00 175.29 176.90