#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 3.13 0.05 3.17 3.00 -1.26 -5.01 118.95 122.03 1ftt s ARG 1 Ca 0.00 2.14 -0.01 0.00 0.00 0.00 0.00 55.73 57.86 1ftt s ARG 1 Cb 0.00 -2.20 0.01 0.00 0.00 0.00 0.00 34.95 32.76 1ftt s ARG 1 CO 0.00 -1.17 0.07 -2.13 0.00 0.00 0.00 175.30 172.07 1ftt n ARG 2 N -1.11 0.24 -0.82 3.54 0.63 -1.26 -4.81 116.66 113.08 1ftt n ARG 2 Ca 0.11 -0.14 0.11 0.00 -0.92 0.00 0.00 57.85 57.01 1ftt n ARG 2 Cb 0.46 -0.06 -0.03 0.00 0.45 0.00 0.00 32.46 33.28 1ftt n ARG 2 CO 0.00 0.00 0.00 0.36 -2.51 0.00 0.00 177.63 175.48 1ftt n LYS 3 N -1.14 -1.65 -1.66 -0.14 -0.00 -1.26 -4.83 118.16 107.49 1ftt n LYS 3 Ca 0.01 1.09 -0.55 0.00 -0.00 0.00 0.00 58.31 58.86 1ftt n LYS 3 Cb 0.03 -2.01 -0.07 0.00 -0.00 0.00 0.00 35.03 32.99 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 -2.85 1.22 -4.80 -1.58 3.00 -1.26 -4.95 116.66 105.45 1ftt n ARG 4 Ca 0.01 0.45 -0.33 0.00 -0.00 0.00 0.00 57.85 57.97 1ftt n ARG 4 Cb 0.37 -2.12 -0.15 0.00 0.00 0.00 0.00 32.46 30.56 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 2.34 3.26 0.00 -0.14 6.06 -1.26 -5.08 118.95 124.13 1ftt s ARG 5 Ca 0.92 -0.75 0.00 0.00 -2.50 0.00 0.00 55.73 53.41 1ftt s ARG 5 Cb -1.00 -2.56 0.00 0.00 0.06 0.00 0.00 34.95 31.45 1ftt s ARG 5 CO 0.57 0.15 0.36 0.28 -2.50 0.00 0.00 175.30 174.16 1ftt n VAL 6 N 3.68 0.00 -3.18 7.11 0.31 -1.26 -4.80 118.33 120.19 1ftt n VAL 6 Ca -0.19 0.72 -0.30 0.00 -0.01 0.00 0.00 64.34 64.56 1ftt n VAL 6 Cb 0.52 -1.43 -0.04 0.00 -0.91 0.00 0.00 33.84 31.99 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 -2.28 4.00 0.00 7.52 0.05 -1.26 -4.96 118.68 121.75 1ftt s LEU 7 Ca 0.00 0.91 0.00 0.00 0.05 0.00 0.00 54.13 55.09 1ftt s LEU 7 Cb 0.00 -3.74 0.00 0.00 -2.05 0.00 0.00 46.19 40.40 1ftt s LEU 7 CO 0.00 -0.25 0.00 0.49 -0.55 0.00 0.00 176.35 176.04 1ftt n PHE 8 N -0.91 -3.47 -3.94 3.48 3.01 -1.26 -5.03 117.46 109.34 1ftt n PHE 8 Ca 0.00 1.60 -0.09 0.00 1.01 0.00 0.00 57.45 59.97 1ftt n PHE 8 Cb 0.54 -2.96 -0.06 0.00 -0.01 0.00 0.00 39.48 36.99 1ftt n PHE 8 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1ftt s SER 9 N -6.49 -0.07 0.14 4.37 1.04 -1.26 -4.77 113.70 106.66 1ftt s SER 9 Ca 0.00 -0.84 -0.17 0.00 0.48 0.00 0.00 55.95 55.42 1ftt s SER 9 Cb 0.00 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 1ftt s SER 9 CO 0.00 -1.03 1.78 1.56 0.98 0.00 0.00 173.24 176.53 1ftt h GLN 10 N 2.35 0.48 -0.48 4.02 7.50 -1.92 -1.07 115.11 125.99 1ftt h GLN 10 Ca -0.29 -0.04 0.03 0.00 0.50 0.00 0.00 58.65 58.86 1ftt h GLN 10 Cb 1.24 -0.10 -0.04 0.00 0.05 0.00 0.00 27.48 28.63 1ftt h GLN 10 CO 0.41 0.35 0.26 0.00 -1.50 0.00 0.00 178.83 178.34 1ftt h ALA 11 N 1.10 0.61 0.54 3.87 0.00 -1.98 0.12 119.26 123.53 1ftt h ALA 11 Ca 0.13 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1ftt h ALA 11 Cb -0.02 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1ftt h ALA 11 CO -0.03 -0.08 -0.26 1.96 0.00 0.00 0.00 179.25 180.85 1ftt h GLN 12 N 0.51 -0.70 0.00 0.00 4.20 -1.80 -3.23 115.11 114.09 1ftt h GLN 12 Ca 0.20 0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.89 1ftt h GLN 12 Cb 0.08 0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1ftt h GLN 12 CO -0.12 -0.40 -0.35 0.28 -0.67 0.00 0.00 178.83 177.56 1ftt h VAL 13 N -0.96 0.91 -0.42 -0.54 2.07 -1.17 -2.34 116.25 113.80 1ftt h VAL 13 Ca -0.07 -1.40 0.09 0.00 0.82 0.00 0.00 66.70 66.13 1ftt h VAL 13 Cb 0.63 1.84 -0.09 0.00 -1.52 0.00 0.00 31.29 32.15 1ftt h VAL 13 CO 0.12 0.35 -0.26 0.22 0.02 0.00 0.00 177.57 178.02 1ftt h TYR 14 N 0.00 -0.68 -0.31 1.57 3.20 -0.80 0.16 116.97 120.10 1ftt h TYR 14 Ca -0.00 0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.85 1ftt h TYR 14 Cb 0.81 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.43 1ftt h TYR 14 CO 0.00 -0.33 -0.09 0.93 -1.64 0.00 0.00 178.16 177.03 1ftt h GLU 15 N -0.18 0.52 -0.10 1.82 5.08 -1.45 -1.93 114.58 118.34 1ftt h GLU 15 Ca 0.20 -0.14 -0.19 0.00 -1.00 0.00 0.00 59.36 58.23 1ftt h GLU 15 Cb 0.49 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1ftt h GLU 15 CO -0.53 0.62 -0.67 -0.07 -1.00 0.00 0.00 179.01 177.36 1ftt h LEU 16 N 0.49 0.76 -0.20 1.33 3.38 -1.09 -0.81 115.31 119.17 1ftt h LEU 16 Ca 0.09 -0.66 0.05 0.00 0.09 0.00 0.00 57.88 57.45 1ftt h LEU 16 Cb 0.46 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 1ftt h LEU 16 CO 0.02 1.30 -0.09 -0.33 0.09 0.00 0.00 178.44 179.43 1ftt h GLU 17 N 0.28 -0.07 -0.26 1.13 5.08 -0.71 0.10 114.58 120.14 1ftt h GLU 17 Ca -0.05 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1ftt h GLU 17 Cb 1.31 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.52 1ftt h GLU 17 CO 0.14 -0.04 -0.09 -0.09 -1.00 0.00 0.00 179.01 177.92 1ftt h ARG 18 N -0.07 -0.03 -0.64 2.33 2.43 -1.30 -2.44 114.38 114.66 1ftt h ARG 18 Ca 0.11 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 1ftt h ARG 18 Cb 0.23 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1ftt h ARG 18 CO -0.24 -0.02 0.24 -0.09 -1.51 0.00 0.00 179.97 178.35 1ftt h ARG 19 N -0.04 0.95 -0.12 0.20 9.65 -0.87 -3.00 114.38 121.15 1ftt h ARG 19 Ca 0.13 -0.16 0.04 0.00 -1.10 0.00 0.00 59.98 58.88 1ftt h ARG 19 Cb 0.23 -0.16 -0.00 0.00 -1.39 0.00 0.00 29.97 28.65 1ftt h ARG 19 CO -0.29 0.78 0.12 0.35 2.80 0.00 0.00 179.97 183.74 1ftt h PHE 20 N 0.93 0.00 -0.70 2.20 3.57 -0.29 0.21 116.94 122.85 1ftt h PHE 20 Ca 0.22 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 1ftt h PHE 20 Cb 0.20 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 1ftt h PHE 20 CO 0.01 0.00 0.35 -0.22 -2.23 0.00 0.00 178.31 176.23 1ftt h LYS 21 N 0.00 1.00 0.00 1.11 3.64 -1.50 -3.37 116.57 117.45 1ftt h LYS 21 Ca 0.06 -0.14 -0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1ftt h LYS 21 Cb 0.30 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1ftt h LYS 21 CO -0.00 0.78 -0.00 0.37 -2.27 0.00 0.00 179.45 178.33 1ftt h GLN 22 N 0.97 -0.00 -5.39 1.90 4.15 -0.84 -3.47 115.11 112.43 1ftt h GLN 22 Ca 0.24 0.00 -0.67 0.00 0.77 0.00 0.00 58.65 59.00 1ftt h GLN 22 Cb 0.09 0.00 -0.29 0.00 0.21 0.00 0.00 27.48 27.49 1ftt h GLN 22 CO -0.03 -0.00 -0.81 -0.65 -1.93 0.00 0.00 178.83 175.40 1ftt s GLN 23 N -1.01 3.20 0.20 1.69 -0.21 0.07 -5.01 119.66 118.59 1ftt s GLN 23 Ca -0.00 -0.77 0.26 0.00 0.02 0.00 0.00 55.36 54.88 1ftt s GLN 23 Cb 0.00 -2.48 0.84 0.00 1.00 0.00 0.00 33.01 32.37 1ftt s GLN 23 CO 0.00 0.22 1.78 1.63 -2.12 0.00 0.00 175.29 176.81 1ftt n LYS 24 N 3.45 0.24 -3.68 2.91 4.76 -1.26 -3.98 118.16 120.61 1ftt n LYS 24 Ca -0.18 0.21 -0.09 0.00 -2.87 0.00 0.00 58.31 55.38 1ftt n LYS 24 Cb 0.53 -1.79 -0.10 0.00 -1.84 0.00 0.00 35.03 31.83 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 -3.10 -0.72 0.64 2.13 2.02 -1.26 -4.73 117.35 112.32 1ftt s TYR 25 Ca 0.11 1.47 -0.16 0.00 -0.37 0.00 0.00 57.07 58.12 1ftt s TYR 25 Cb 0.13 0.34 -0.01 0.00 -0.40 0.00 0.00 41.96 42.01 1ftt s TYR 25 CO 0.58 -0.40 1.10 -0.51 -1.57 0.00 0.00 175.55 174.76 1ftt s LEU 26 N 1.67 3.45 0.93 -1.29 1.02 -1.26 -5.05 118.68 118.15 1ftt s LEU 26 Ca -0.08 1.99 -0.12 0.00 0.02 0.00 0.00 54.13 55.93 1ftt s LEU 26 Cb -0.09 -4.55 0.15 0.00 0.02 0.00 0.00 46.19 41.72 1ftt s LEU 26 CO -0.14 -1.51 1.13 -0.94 0.02 0.00 0.00 176.35 174.91 1ftt s SER 27 N -2.53 3.27 0.18 2.29 1.04 -1.26 -4.74 113.70 111.96 1ftt s SER 27 Ca 0.67 0.99 -0.18 0.00 0.48 0.00 0.00 55.95 57.91 1ftt s SER 27 Cb -0.20 -1.58 0.14 0.00 0.10 0.00 0.00 66.02 64.48 1ftt s SER 27 CO 0.39 -2.70 1.62 0.00 0.98 0.00 0.00 173.24 173.53 1ftt h ALA 28 N -1.60 0.15 -0.20 5.32 0.00 -2.01 -1.79 119.26 119.13 1ftt h ALA 28 Ca -0.51 0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.40 1ftt h ALA 28 Cb 1.33 0.53 0.00 0.00 0.00 0.00 0.00 17.79 19.66 1ftt h ALA 28 CO 0.61 -0.55 -0.53 -1.00 0.00 0.00 0.00 179.25 177.77 1ftt h PRO 29 N -0.10 0.72 -0.72 0.00 0.13 -2.01 -3.29 132.00 126.73 1ftt h PRO 29 Ca 0.23 -0.50 -0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1ftt h PRO 29 Cb 0.46 0.08 -0.04 0.00 0.13 0.00 0.00 31.00 31.63 1ftt h PRO 29 CO -0.56 1.13 0.44 0.93 -0.23 0.00 0.00 178.00 179.71 1ftt h GLU 30 N 0.44 0.97 -0.17 0.86 4.39 -1.85 -0.58 114.58 118.64 1ftt h GLU 30 Ca -0.01 -0.08 -0.12 0.00 0.34 0.00 0.00 59.36 59.50 1ftt h GLU 30 Cb 1.15 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.58 1ftt h GLU 30 CO 0.12 0.67 -0.40 0.07 -1.16 0.00 0.00 179.01 178.31 1ftt h ARG 31 N 0.99 0.38 -0.49 2.33 0.11 -1.40 -0.64 114.38 115.65 1ftt h ARG 31 Ca 0.26 -0.18 -0.13 0.00 0.10 0.00 0.00 59.98 60.03 1ftt h ARG 31 Cb -0.06 -0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.01 1ftt h ARG 31 CO -0.05 0.71 -0.21 0.93 0.10 0.00 0.00 179.97 181.45 1ftt h GLU 32 N 0.31 1.00 -0.08 0.08 4.39 -1.49 -1.39 114.58 117.40 1ftt h GLU 32 Ca 0.03 -0.42 0.03 0.00 0.34 0.00 0.00 59.36 59.33 1ftt h GLU 32 Cb 0.84 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.42 1ftt h GLU 32 CO 0.07 1.10 -0.09 1.25 -1.16 0.00 0.00 179.01 180.18 1ftt h HIS 33 N 0.86 -0.22 -0.37 4.33 2.76 -0.74 -1.53 115.15 120.24 1ftt h HIS 33 Ca 0.11 0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.37 1ftt h HIS 33 Cb 0.79 0.11 -0.09 0.00 1.55 0.00 0.00 27.41 29.77 1ftt h HIS 33 CO 0.05 -0.14 -0.27 -0.07 -1.30 0.00 0.00 177.93 176.21 1ftt h LEU 34 N -0.12 -0.88 -1.14 0.26 4.07 -1.09 0.14 115.31 116.55 1ftt h LEU 34 Ca 0.06 0.17 0.02 0.00 0.08 0.00 0.00 57.88 58.21 1ftt h LEU 34 Cb 0.20 0.43 -0.05 0.00 1.08 0.00 0.00 40.66 42.33 1ftt h LEU 34 CO -0.15 -0.28 0.59 0.00 -1.08 0.00 0.00 178.44 177.51 1ftt h ALA 35 N 0.90 1.40 0.26 1.53 0.00 -0.34 0.16 119.26 123.17 1ftt h ALA 35 Ca 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1ftt h ALA 35 Cb 0.49 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ftt h ALA 35 CO -0.49 0.53 -0.13 1.03 0.00 0.00 0.00 179.25 180.19 1ftt h SER 36 N 1.16 -0.30 0.48 0.00 0.87 -1.25 -2.47 113.55 112.04 1ftt h SER 36 Ca 0.34 -0.23 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1ftt h SER 36 Cb -0.06 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1ftt h SER 36 CO -0.09 0.17 -0.23 -0.03 -0.53 0.00 0.00 176.83 176.12 1ftt h MET 37 N -0.89 -0.63 0.00 2.24 -1.53 -0.25 -3.37 114.93 110.51 1ftt h MET 37 Ca -0.04 0.04 -0.06 0.00 -3.44 0.00 0.00 59.70 56.21 1ftt h MET 37 Cb 0.51 0.14 0.00 0.00 -0.55 0.00 0.00 31.60 31.71 1ftt h MET 37 CO 0.06 -0.42 -0.22 -0.84 0.14 0.00 0.00 176.91 175.63 1ftt h ILE 38 N -0.81 1.57 0.00 1.77 3.07 -0.93 -3.49 117.51 118.69 1ftt h ILE 38 Ca -0.07 -1.97 0.00 0.00 1.55 0.00 0.00 64.86 64.37 1ftt h ILE 38 Cb 0.50 2.82 0.00 0.00 -0.27 0.00 0.00 36.82 39.87 1ftt h ILE 38 CO 0.11 0.53 0.00 1.41 -1.05 0.00 0.00 178.15 179.15 1ftt n HIS 39 N -4.53 0.00 -4.07 0.16 8.25 -1.19 -4.70 115.22 109.14 1ftt n HIS 39 Ca -0.10 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.27 1ftt n HIS 39 Cb 0.50 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.57 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 -4.42 2.41 7.99 -0.93 -5.04 117.00 117.01 1ftt n LEU 40 Ca 0.00 -1.59 -0.29 0.00 -0.01 0.00 0.00 56.01 54.12 1ftt n LEU 40 Cb 0.00 0.97 -0.12 0.00 -0.11 0.00 0.00 43.42 44.16 1ftt n LEU 40 CO 0.00 -0.29 -0.55 0.42 -1.51 0.00 0.00 177.39 175.47 1ftt s THR 41 N -2.68 2.39 0.57 -5.08 -4.23 -1.26 -4.62 115.64 100.73 1ftt s THR 41 Ca 0.19 -1.76 0.38 0.00 -1.18 0.00 0.00 61.69 59.32 1ftt s THR 41 Cb 0.01 -2.09 0.40 0.00 1.34 0.00 0.00 72.50 72.16 1ftt s THR 41 CO 0.14 0.05 2.28 1.55 -0.54 0.00 0.00 174.62 178.10 1ftt h PRO 42 N 3.72 0.00 -0.02 3.99 0.13 -1.95 -0.05 132.00 137.82 1ftt h PRO 42 Ca -0.50 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.58 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 0.42 0.01 -0.18 1.15 -0.23 0.00 0.00 178.00 179.17 1ftt h THR 43 N 0.00 1.53 -0.56 1.56 2.02 -1.96 -2.53 112.91 112.97 1ftt h THR 43 Ca -0.00 -1.81 -0.02 0.00 0.77 0.00 0.00 66.41 65.36 1ftt h THR 43 Cb 0.08 2.65 -0.03 0.00 -1.74 0.00 0.00 68.15 69.11 1ftt h THR 43 CO 0.00 0.49 0.27 -0.61 0.37 0.00 0.00 175.52 176.05 1ftt h GLN 44 N -0.49 0.79 0.12 6.66 4.15 -1.64 -0.63 115.11 124.07 1ftt h GLN 44 Ca -0.02 -0.09 -0.00 0.00 0.77 0.00 0.00 58.65 59.31 1ftt h GLN 44 Cb 0.90 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.43 1ftt h GLN 44 CO 0.04 0.61 -0.19 0.28 -1.93 0.00 0.00 178.83 177.64 1ftt h VAL 45 N 0.79 0.00 -0.88 2.39 2.07 -1.12 -1.87 116.25 117.62 1ftt h VAL 45 Ca 0.20 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.94 1ftt h VAL 45 Cb 0.08 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.69 1ftt h VAL 45 CO -0.03 0.00 0.08 0.50 0.02 0.00 0.00 177.57 178.14 1ftt h LYS 46 N -0.32 0.09 0.16 1.57 1.63 -0.99 -0.87 116.57 117.84 1ftt h LYS 46 Ca -0.01 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1ftt h LYS 46 Cb 0.30 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.90 1ftt h LYS 46 CO -0.06 0.06 -0.14 0.82 -3.45 0.00 0.00 179.45 176.68 1ftt h ILE 47 N 0.10 0.69 -0.51 2.00 2.04 -1.00 0.15 117.51 120.97 1ftt h ILE 47 Ca 0.52 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.48 1ftt h ILE 47 Cb 1.03 0.69 -0.08 0.00 -0.74 0.00 0.00 36.82 37.72 1ftt h ILE 47 CO -0.76 0.00 0.06 -0.25 0.00 0.00 0.00 178.15 177.20 1ftt h TRP 48 N -0.32 0.08 -0.65 1.37 7.01 -0.35 -0.78 115.95 122.31 1ftt h TRP 48 Ca -0.00 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 60.94 1ftt h TRP 48 Cb 0.30 0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.37 1ftt h TRP 48 CO -0.12 -0.06 0.06 0.74 -2.79 0.00 0.00 178.44 176.27 1ftt h PHE 49 N 0.18 1.18 -0.23 2.65 0.04 -0.88 -1.33 116.94 118.56 1ftt h PHE 49 Ca 0.26 -0.18 0.01 0.00 2.80 0.00 0.00 57.97 60.86 1ftt h PHE 49 Cb 0.38 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 1ftt h PHE 49 CO -0.27 1.01 0.14 0.37 -0.60 0.00 0.00 178.31 178.96 1ftt h GLN 50 N 1.02 0.28 -0.79 1.51 4.15 -0.29 -0.76 115.11 120.22 1ftt h GLN 50 Ca 0.19 -0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.54 1ftt h GLN 50 Cb 0.50 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 28.09 1ftt h GLN 50 CO 0.02 0.18 0.30 -0.91 -1.93 0.00 0.00 178.83 176.49 1ftt h ASN 51 N 0.28 1.11 -0.10 -0.69 2.35 -0.82 0.57 115.58 118.28 1ftt h ASN 51 Ca 0.09 -0.18 -0.19 0.00 -0.55 0.00 0.00 56.30 55.46 1ftt h ASN 51 Cb -0.01 -0.29 0.01 0.00 0.05 0.00 0.00 38.32 38.08 1ftt h ASN 51 CO -0.04 0.99 -0.69 0.45 -1.65 0.00 0.00 177.43 176.49 1ftt h HIS 52 N 1.16 0.90 -0.54 1.19 3.86 -1.15 -1.22 115.15 119.35 1ftt h HIS 52 Ca 0.26 -0.41 0.03 0.00 -1.16 0.00 0.00 60.37 59.09 1ftt h HIS 52 Cb 0.24 -0.13 -0.04 0.00 1.06 0.00 0.00 27.41 28.54 1ftt h HIS 52 CO 0.02 1.23 0.31 -0.09 0.86 0.00 0.00 177.93 180.26 1ftt h ARG 53 N 0.31 0.59 0.05 2.45 1.12 -1.01 -2.11 114.38 115.79 1ftt h ARG 53 Ca -0.06 -0.04 0.02 0.00 -1.11 0.00 0.00 59.98 58.80 1ftt h ARG 53 Cb 1.33 -0.13 -0.03 0.00 -0.01 0.00 0.00 29.97 31.13 1ftt h ARG 53 CO 0.14 0.39 -0.18 -0.92 -3.11 0.00 0.00 179.97 176.29 1ftt h TYR 54 N 0.61 -0.47 -0.67 2.20 3.20 -0.84 -2.81 116.97 118.18 1ftt h TYR 54 Ca 0.23 0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.24 1ftt h TYR 54 Cb 0.07 0.20 -0.10 0.00 1.54 0.00 0.00 36.73 38.44 1ftt h TYR 54 CO -0.07 -0.26 0.14 -0.22 -1.64 0.00 0.00 178.16 176.11 1ftt h LYS 55 N -0.32 0.25 -0.52 1.82 1.63 -0.91 -1.00 116.57 117.52 1ftt h LYS 55 Ca 0.04 -0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.84 1ftt h LYS 55 Cb 0.36 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.91 1ftt h LYS 55 CO -0.13 0.16 0.32 0.52 -3.45 0.00 0.00 179.45 176.87 1ftt h MET 56 N 0.26 0.63 -0.48 1.90 2.86 -1.18 -1.28 114.93 117.63 1ftt h MET 56 Ca 0.37 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.91 1ftt h MET 56 Cb 0.59 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 32.09 1ftt h MET 56 CO -0.47 0.42 0.06 0.87 1.06 0.00 0.00 176.91 178.85 1ftt h LYS 57 N 0.65 0.81 0.79 1.72 1.57 -1.09 -2.12 116.57 118.90 1ftt h LYS 57 Ca 0.20 -0.23 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1ftt h LYS 57 Cb -0.02 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.21 1ftt h LYS 57 CO -0.07 0.83 -0.38 0.00 -0.57 0.00 0.00 179.45 179.26 1ftt h ARG 58 N 0.67 -1.02 -0.09 3.15 2.47 -0.84 -3.42 114.38 115.30 1ftt h ARG 58 Ca 0.14 0.07 -0.21 0.00 -1.26 0.00 0.00 59.98 58.73 1ftt h ARG 58 Cb 0.42 0.23 -0.18 0.00 -1.65 0.00 0.00 29.97 28.80 1ftt h ARG 58 CO 0.01 -0.67 -0.41 0.00 0.56 0.00 0.00 179.97 179.46 1ftt n GLN 59 N -5.48 1.31 0.00 0.04 0.00 -0.52 -4.94 117.38 107.79 1ftt n GLN 59 Ca -0.13 -1.73 0.00 0.00 0.00 0.00 0.00 57.00 55.13 1ftt n GLN 59 Cb 0.42 0.01 0.00 0.00 0.00 0.00 0.00 30.24 30.67 1ftt n GLN 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ftt n ALA 60 N -1.01 0.00 -1.00 2.61 0.00 -0.80 -2.55 120.51 117.77 1ftt n ALA 60 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1ftt n ALA 60 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.31 1ftt n ALA 60 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1ftt n LYS 61 N 0.00 0.00 -2.50 0.00 0.00 -1.26 -3.20 118.16 111.20 1ftt n LYS 61 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.00 1ftt n LYS 61 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 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 0.00 5.59 -3.34 -5.58 9.92 -1.25 -4.83 116.55 117.05 1ftt n ASP 62 Ca 0.00 -3.73 0.02 0.00 -0.53 0.00 0.00 54.79 50.55 1ftt n ASP 62 Cb 0.00 -0.70 -0.02 0.00 -0.64 0.00 0.00 41.12 39.76 1ftt n ASP 62 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1ftt s LYS 63 N -3.74 0.57 0.00 -1.24 2.47 -1.06 -5.14 119.74 111.61 1ftt s LYS 63 Ca 0.48 1.18 0.00 0.00 -1.56 0.00 0.00 55.97 56.07 1ftt s LYS 63 Cb 0.35 0.68 0.00 0.00 -1.46 0.00 0.00 37.83 37.40 1ftt s LYS 63 CO -0.22 -0.45 0.00 0.00 0.16 0.00 0.00 175.35 174.84 1ftt n ALA 64 N 5.44 0.00 -0.82 3.13 0.00 -1.26 -4.44 120.51 122.56 1ftt n ALA 64 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.08 1ftt n ALA 64 Cb 0.50 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.10 1ftt n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ftt s ALA 65 N -3.80 1.63 -0.38 0.00 0.00 -1.26 -5.01 121.76 112.95 1ftt s ALA 65 Ca 0.00 0.56 0.12 0.00 0.00 0.00 0.00 51.96 52.64 1ftt s ALA 65 Cb 0.00 -3.42 0.39 0.00 0.00 0.00 0.00 23.12 20.09 1ftt s ALA 65 CO 0.00 -2.56 1.07 0.94 0.00 0.00 0.00 175.76 175.21 1ftt n GLN 66 N -4.05 1.11 0.00 0.00 -0.06 -1.26 -5.26 117.38 107.86 1ftt n GLN 66 Ca 0.11 -2.61 0.00 0.00 -2.00 0.00 0.00 57.00 52.51 1ftt n GLN 66 Cb 0.52 -0.92 0.00 0.00 -4.06 0.00 0.00 30.24 25.78 1ftt n GLN 66 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90