#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 1.51 0.42 2.12 3.00 -1.26 -5.14 118.95 119.60 1ftt s ARG 1 Ca 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 55.73 53.91 1ftt s ARG 1 Cb 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 34.95 34.33 1ftt s ARG 1 CO 0.00 -0.20 0.00 0.54 0.00 0.00 0.00 175.30 175.64 1ftt n ARG 2 N -0.56 -2.42 -2.02 3.54 5.12 -1.26 -4.52 116.66 114.53 1ftt n ARG 2 Ca -0.02 1.91 -0.42 0.00 -1.93 0.00 0.00 57.85 57.39 1ftt n ARG 2 Cb 0.66 -2.86 0.00 0.00 -1.16 0.00 0.00 32.46 29.10 1ftt n ARG 2 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1ftt n LYS 3 N -3.80 3.33 0.00 5.56 4.81 -1.26 -4.76 118.16 122.04 1ftt n LYS 3 Ca -0.05 -3.08 0.00 0.00 -0.87 0.00 0.00 58.31 54.31 1ftt n LYS 3 Cb 0.51 -3.07 0.00 0.00 0.02 0.00 0.00 35.03 32.49 1ftt n LYS 3 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1ftt n ARG 4 N 4.73 0.00 -2.52 1.64 5.12 -1.26 -4.77 116.66 119.60 1ftt n ARG 4 Ca 0.47 0.00 -0.40 0.00 -1.93 0.00 0.00 57.85 55.99 1ftt n ARG 4 Cb 0.37 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.63 1ftt n ARG 4 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1ftt s ARG 5 N 0.00 3.49 0.00 5.56 1.81 -1.26 -4.77 118.95 123.79 1ftt s ARG 5 Ca 0.00 -1.02 0.00 0.00 -1.72 0.00 0.00 55.73 52.99 1ftt s ARG 5 Cb 0.00 -5.30 0.00 0.00 -0.45 0.00 0.00 34.95 29.20 1ftt s ARG 5 CO 0.00 -2.30 0.32 0.28 -0.68 0.00 0.00 175.30 172.92 1ftt n VAL 6 N 6.95 0.00 -2.71 3.52 0.31 -1.26 -4.88 118.33 120.26 1ftt n VAL 6 Ca 0.33 0.67 -0.04 0.00 -0.01 0.00 0.00 64.34 65.29 1ftt n VAL 6 Cb 0.51 -1.38 0.03 0.00 -0.91 0.00 0.00 33.84 32.09 1ftt n VAL 6 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1ftt n LEU 7 N -0.46 -2.41 -4.23 7.52 0.00 -1.26 -4.84 117.00 111.33 1ftt n LEU 7 Ca 0.00 -2.06 -0.20 0.00 0.00 0.00 0.00 56.01 53.74 1ftt n LEU 7 Cb 0.00 0.66 -0.12 0.00 0.00 0.00 0.00 43.42 43.96 1ftt n LEU 7 CO 0.00 1.61 -0.48 -0.36 0.00 0.00 0.00 177.39 178.16 1ftt s PHE 8 N 0.83 1.46 0.58 1.96 0.08 -1.26 -5.09 117.98 116.55 1ftt s PHE 8 Ca 0.27 -0.46 -0.02 0.00 0.12 0.00 0.00 56.93 56.85 1ftt s PHE 8 Cb 0.09 -0.80 0.03 0.00 -0.57 0.00 0.00 43.02 41.78 1ftt s PHE 8 CO -0.10 0.13 0.84 -1.54 -0.10 0.00 0.00 175.22 174.45 1ftt s SER 9 N -1.92 5.24 0.12 1.36 1.04 -1.26 -4.95 113.70 113.33 1ftt s SER 9 Ca 0.03 0.21 -0.20 0.00 0.48 0.00 0.00 55.95 56.47 1ftt s SER 9 Cb -0.09 -1.08 -0.05 0.00 0.10 0.00 0.00 66.02 64.90 1ftt s SER 9 CO 0.03 -1.21 1.73 1.56 0.98 0.00 0.00 173.24 176.33 1ftt h GLN 10 N -0.10 0.09 -0.45 4.02 7.50 -2.01 -2.14 115.11 122.01 1ftt h GLN 10 Ca -0.43 -0.01 0.05 0.00 0.50 0.00 0.00 58.65 58.76 1ftt h GLN 10 Cb 1.29 -0.02 -0.04 0.00 0.05 0.00 0.00 27.48 28.76 1ftt h GLN 10 CO 0.56 0.06 0.20 0.00 -1.50 0.00 0.00 178.83 178.14 1ftt h ALA 11 N 1.13 0.56 0.70 3.87 0.00 -1.98 0.66 119.26 124.21 1ftt h ALA 11 Ca 0.08 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1ftt h ALA 11 Cb 0.08 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ftt h ALA 11 CO -0.12 -0.17 -0.40 1.96 0.00 0.00 0.00 179.25 180.52 1ftt h GLN 12 N 0.40 -0.99 -0.54 0.00 4.20 -1.90 -1.05 115.11 115.23 1ftt h GLN 12 Ca 0.21 0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.96 1ftt h GLN 12 Cb 0.16 0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 1ftt h GLN 12 CO -0.17 -0.66 0.24 0.28 -0.67 0.00 0.00 178.83 177.84 1ftt h VAL 13 N -1.03 1.19 0.17 -0.54 2.07 -1.32 -1.21 116.25 115.58 1ftt h VAL 13 Ca -0.09 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 66.88 1ftt h VAL 13 Cb 0.82 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1ftt h VAL 13 CO 0.11 0.22 -0.20 0.22 0.02 0.00 0.00 177.57 177.94 1ftt h TYR 14 N 0.76 -0.54 -0.01 1.57 3.20 -0.68 0.73 116.97 122.00 1ftt h TYR 14 Ca 0.19 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.06 1ftt h TYR 14 Cb 0.11 0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.60 1ftt h TYR 14 CO 0.01 -0.30 0.00 0.93 -1.64 0.00 0.00 178.16 177.16 1ftt h GLU 15 N -0.42 0.01 -0.84 1.82 4.39 -0.77 0.38 114.58 119.14 1ftt h GLU 15 Ca 0.01 -0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.76 1ftt h GLU 15 Cb 0.41 -0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.00 1ftt h GLU 15 CO -0.08 0.10 0.53 -0.07 -1.16 0.00 0.00 179.01 178.33 1ftt h LEU 16 N -0.07 0.86 -0.47 1.33 4.07 -1.19 -0.61 115.31 119.23 1ftt h LEU 16 Ca 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.95 1ftt h LEU 16 Cb 0.09 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.63 1ftt h LEU 16 CO -0.00 0.57 0.23 -0.33 -1.08 0.00 0.00 178.44 177.83 1ftt h GLU 17 N 1.00 0.67 -0.66 1.13 5.08 -0.68 0.49 114.58 121.60 1ftt h GLU 17 Ca 0.35 -0.09 0.11 0.00 -1.00 0.00 0.00 59.36 58.73 1ftt h GLU 17 Cb 0.09 -0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.13 1ftt h GLU 17 CO -0.14 0.56 0.24 -0.09 -1.00 0.00 0.00 179.01 178.57 1ftt h ARG 18 N 0.61 0.39 0.79 2.33 2.43 -0.29 -0.86 114.38 119.78 1ftt h ARG 18 Ca 0.16 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.27 1ftt h ARG 18 Cb 0.10 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1ftt h ARG 18 CO -0.02 0.26 -0.38 -0.09 -1.51 0.00 0.00 179.97 178.22 1ftt h ARG 19 N 0.40 -1.03 -0.74 0.20 9.65 -0.99 -3.29 114.38 118.59 1ftt h ARG 19 Ca 0.35 0.07 0.15 0.00 -1.10 0.00 0.00 59.98 59.45 1ftt h ARG 19 Cb 0.48 0.23 -0.14 0.00 -1.39 0.00 0.00 29.97 29.16 1ftt h ARG 19 CO -0.36 -0.69 -0.14 0.35 2.80 0.00 0.00 179.97 181.93 1ftt h PHE 20 N -1.28 -0.31 -0.61 2.20 3.04 -0.43 0.07 116.94 119.63 1ftt h PHE 20 Ca -0.11 0.06 -0.06 0.00 3.98 0.00 0.00 57.97 61.85 1ftt h PHE 20 Cb 0.82 0.25 -0.03 0.00 2.56 0.00 0.00 35.95 39.55 1ftt h PHE 20 CO 0.00 -0.30 0.15 -0.22 -2.02 0.00 0.00 178.31 175.92 1ftt h LYS 21 N 0.02 0.94 0.04 1.11 1.63 -1.29 -3.21 116.57 115.80 1ftt h LYS 21 Ca 0.37 -0.20 -0.00 0.00 -0.85 0.00 0.00 60.65 59.96 1ftt h LYS 21 Cb 0.58 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.08 1ftt h LYS 21 CO -0.73 0.84 -0.02 1.96 -3.45 0.00 0.00 179.45 178.04 1ftt h GLN 22 N 0.90 -0.05 -4.03 1.90 4.20 -1.41 -3.46 115.11 113.16 1ftt h GLN 22 Ca 0.19 0.00 -0.44 0.00 0.06 0.00 0.00 58.65 58.47 1ftt h GLN 22 Cb 0.32 0.01 -0.35 0.00 0.30 0.00 0.00 27.48 27.76 1ftt h GLN 22 CO -0.00 0.50 -0.78 -0.65 -0.67 0.00 0.00 178.83 177.23 1ftt s GLN 23 N -2.28 0.94 0.25 1.46 -0.21 -0.07 -5.08 119.66 114.68 1ftt s GLN 23 Ca -0.11 -0.11 -0.06 0.00 0.02 0.00 0.00 55.36 55.10 1ftt s GLN 23 Cb -0.01 -1.00 0.27 0.00 1.00 0.00 0.00 33.01 33.26 1ftt s GLN 23 CO 0.42 -0.14 1.93 -0.22 -2.12 0.00 0.00 175.29 175.16 1ftt h LYS 24 N 7.50 1.31 -4.06 2.91 1.63 -1.80 -3.27 116.57 120.79 1ftt h LYS 24 Ca -0.32 -0.08 -0.27 0.00 -0.85 0.00 0.00 60.65 59.12 1ftt h LYS 24 Cb 1.15 -0.30 -0.27 0.00 -0.60 0.00 0.00 32.23 32.21 1ftt h LYS 24 CO 0.42 0.87 -0.74 0.71 -3.45 0.00 0.00 179.45 177.26 1ftt s TYR 25 N -6.12 0.27 0.50 1.91 2.02 -1.26 -4.77 117.35 109.91 1ftt s TYR 25 Ca -0.13 -0.10 -0.23 0.00 -0.37 0.00 0.00 57.07 56.24 1ftt s TYR 25 Cb 0.18 -0.17 -0.07 0.00 -0.40 0.00 0.00 41.96 41.50 1ftt s TYR 25 CO 0.82 -0.02 1.39 1.28 -1.57 0.00 0.00 175.55 177.45 1ftt n LEU 26 N 2.85 5.30 -4.90 -1.29 4.77 -1.26 -5.03 117.00 117.43 1ftt n LEU 26 Ca -0.14 1.04 -0.29 0.00 -0.03 0.00 0.00 56.01 56.60 1ftt n LEU 26 Cb 0.59 -1.59 0.08 0.00 -2.33 0.00 0.00 43.42 40.17 1ftt n LEU 26 CO 0.25 -0.41 0.78 -0.94 -1.33 0.00 0.00 177.39 175.75 1ftt s SER 27 N -0.71 4.63 0.12 -1.43 1.04 -1.26 -4.81 113.70 111.28 1ftt s SER 27 Ca 0.67 0.82 -0.29 0.00 0.48 0.00 0.00 55.95 57.63 1ftt s SER 27 Cb -0.43 -1.35 -0.08 0.00 0.10 0.00 0.00 66.02 64.25 1ftt s SER 27 CO 0.53 -1.83 1.60 0.00 0.98 0.00 0.00 173.24 174.52 1ftt h ALA 28 N -1.00 -0.61 -0.49 5.32 0.00 -1.99 0.90 119.26 121.40 1ftt h ALA 28 Ca -0.46 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 1ftt h ALA 28 Cb 1.32 0.61 -0.02 0.00 0.00 0.00 0.00 17.79 19.71 1ftt h ALA 28 CO 0.66 -0.91 -0.04 -1.00 0.00 0.00 0.00 179.25 177.96 1ftt h PRO 29 N -0.57 0.89 -0.49 0.00 0.13 -1.99 -1.82 132.00 128.15 1ftt h PRO 29 Ca 0.04 -0.30 -0.08 0.00 -0.87 0.00 0.00 66.00 64.79 1ftt h PRO 29 Cb 0.62 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.66 1ftt h PRO 29 CO -0.24 0.95 -0.01 1.49 -0.23 0.00 0.00 178.00 179.96 1ftt h GLU 30 N 0.75 0.82 -0.05 0.86 4.81 -1.94 0.11 114.58 119.94 1ftt h GLU 30 Ca 0.13 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1ftt h GLU 30 Cb 0.57 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 1ftt h GLU 30 CO 0.03 0.83 0.02 -0.09 -0.73 0.00 0.00 179.01 179.07 1ftt h ARG 31 N 0.76 0.07 -0.84 1.92 2.43 -0.53 -0.15 114.38 118.04 1ftt h ARG 31 Ca 0.15 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1ftt h ARG 31 Cb 0.47 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 1ftt h ARG 31 CO 0.02 0.16 0.47 0.93 -1.51 0.00 0.00 179.97 180.05 1ftt h GLU 32 N -0.04 1.17 0.20 0.20 3.07 -1.14 0.27 114.58 118.30 1ftt h GLU 32 Ca 0.02 -0.13 -0.01 0.00 -0.50 0.00 0.00 59.36 58.74 1ftt h GLU 32 Cb 0.12 -0.23 -0.00 0.00 -0.84 0.00 0.00 28.75 27.79 1ftt h GLU 32 CO -0.00 0.85 -0.12 1.25 -1.40 0.00 0.00 179.01 179.60 1ftt h HIS 33 N 1.17 -0.30 0.36 4.33 2.76 -0.76 -1.22 115.15 121.48 1ftt h HIS 33 Ca 0.30 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.46 1ftt h HIS 33 Cb 0.02 0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.06 1ftt h HIS 33 CO 0.00 -0.18 -0.35 -0.07 -1.30 0.00 0.00 177.93 176.03 1ftt h LEU 34 N -0.30 -0.94 -0.57 0.26 4.07 -0.87 -1.72 115.31 115.23 1ftt h LEU 34 Ca -0.02 0.08 0.11 0.00 0.08 0.00 0.00 57.88 58.13 1ftt h LEU 34 Cb 0.25 0.32 -0.11 0.00 1.08 0.00 0.00 40.66 42.19 1ftt h LEU 34 CO 0.03 -0.49 -0.19 0.00 -1.08 0.00 0.00 178.44 176.70 1ftt h ALA 35 N -0.26 0.28 -0.18 1.53 0.00 -0.77 0.30 119.26 120.16 1ftt h ALA 35 Ca -0.02 0.21 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1ftt h ALA 35 Cb 0.66 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1ftt h ALA 35 CO -0.06 -0.49 0.03 1.03 0.00 0.00 0.00 179.25 179.75 1ftt h SER 36 N -0.05 -0.01 0.24 0.00 0.87 -1.19 -3.24 113.55 110.17 1ftt h SER 36 Ca 0.27 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.85 1ftt h SER 36 Cb 0.47 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1ftt h SER 36 CO -0.62 0.02 -0.11 -0.03 -0.53 0.00 0.00 176.83 175.56 1ftt h MET 37 N 0.10 -0.31 0.60 2.24 -1.53 -0.14 -3.41 114.93 112.48 1ftt h MET 37 Ca 0.08 0.02 -0.03 0.00 -3.44 0.00 0.00 59.70 56.33 1ftt h MET 37 Cb 0.08 0.07 0.01 0.00 -0.55 0.00 0.00 31.60 31.21 1ftt h MET 37 CO -0.11 -0.15 -0.29 -0.84 0.14 0.00 0.00 176.91 175.66 1ftt h ILE 38 N -1.07 0.00 0.00 1.77 3.07 -0.62 -3.49 117.51 117.18 1ftt h ILE 38 Ca -0.03 -0.35 0.00 0.00 1.55 0.00 0.00 64.86 66.03 1ftt h ILE 38 Cb 0.30 0.00 0.00 0.00 -0.27 0.00 0.00 36.82 36.85 1ftt h ILE 38 CO 0.05 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 178.56 1ftt n HIS 39 N -5.13 0.00 -0.60 0.16 8.25 -1.22 -5.01 115.22 111.67 1ftt n HIS 39 Ca -0.10 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.05 1ftt n HIS 39 Cb 0.32 0.00 0.21 0.00 1.12 0.00 0.00 29.99 31.63 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 -1.56 -4.89 2.41 4.32 -1.25 -4.90 117.00 111.13 1ftt n LEU 40 Ca 0.00 -0.09 -0.24 0.00 -0.02 0.00 0.00 56.01 55.67 1ftt n LEU 40 Cb 0.00 -1.13 -0.04 0.00 -1.62 0.00 0.00 43.42 40.64 1ftt n LEU 40 CO 0.00 -3.18 -0.13 0.42 -1.22 0.00 0.00 177.39 173.28 1ftt s THR 41 N -2.34 4.91 0.49 -5.08 -4.23 -1.26 -4.35 115.64 103.79 1ftt s THR 41 Ca 0.62 -1.03 0.22 0.00 -1.18 0.00 0.00 61.69 60.32 1ftt s THR 41 Cb -0.19 -3.59 0.39 0.00 1.34 0.00 0.00 72.50 70.45 1ftt s THR 41 CO 0.66 -0.22 1.97 1.55 -0.54 0.00 0.00 174.62 178.03 1ftt h PRO 42 N 1.78 0.14 0.29 3.99 0.13 -1.93 0.24 132.00 136.64 1ftt h PRO 42 Ca -0.49 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1ftt h PRO 42 Cb 1.22 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1ftt h PRO 42 CO 0.63 0.09 -0.14 1.15 -0.23 0.00 0.00 178.00 179.51 1ftt h THR 43 N 0.15 0.72 -0.74 1.56 2.02 -1.99 -1.30 112.91 113.33 1ftt h THR 43 Ca 0.30 -0.63 0.06 0.00 0.77 0.00 0.00 66.41 66.91 1ftt h THR 43 Cb 0.97 1.05 -0.06 0.00 -1.74 0.00 0.00 68.15 68.37 1ftt h THR 43 CO -0.04 0.12 0.43 1.56 0.37 0.00 0.00 175.52 177.96 1ftt h GLN 44 N -0.74 0.76 0.28 6.66 4.20 -1.69 -0.36 115.11 124.21 1ftt h GLN 44 Ca -0.04 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1ftt h GLN 44 Cb 0.50 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 1ftt h GLN 44 CO 0.06 0.50 -0.44 0.28 -0.67 0.00 0.00 178.83 178.56 1ftt h VAL 45 N 0.78 0.12 -1.01 -0.54 2.07 -1.01 -0.51 116.25 116.16 1ftt h VAL 45 Ca 0.33 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.95 1ftt h VAL 45 Cb 0.20 0.12 -0.08 0.00 -1.52 0.00 0.00 31.29 30.02 1ftt h VAL 45 CO -0.19 0.00 0.64 0.50 0.02 0.00 0.00 177.57 178.54 1ftt h LYS 46 N -0.79 1.04 0.12 1.57 3.64 -0.65 -0.42 116.57 121.09 1ftt h LYS 46 Ca -0.01 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1ftt h LYS 46 Cb 0.74 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1ftt h LYS 46 CO -0.16 0.69 -0.06 0.82 -2.27 0.00 0.00 179.45 178.47 1ftt h ILE 47 N 1.07 0.96 -0.67 2.00 1.08 -0.87 -0.13 117.51 120.96 1ftt h ILE 47 Ca 0.47 -0.31 0.14 0.00 -0.39 0.00 0.00 64.86 64.76 1ftt h ILE 47 Cb 0.35 1.16 -0.10 0.00 -3.07 0.00 0.00 36.82 35.16 1ftt h ILE 47 CO -0.23 0.08 0.12 -0.25 -0.69 0.00 0.00 178.15 177.18 1ftt h TRP 48 N -0.31 0.18 -0.03 1.37 7.01 -0.41 -0.69 115.95 123.06 1ftt h TRP 48 Ca -0.02 0.04 -0.00 0.00 2.11 0.00 0.00 58.89 61.02 1ftt h TRP 48 Cb 0.25 0.03 -0.00 0.00 -2.10 0.00 0.00 29.16 27.34 1ftt h TRP 48 CO -0.02 -0.09 0.02 0.74 -2.79 0.00 0.00 178.44 176.29 1ftt h PHE 49 N 0.23 0.05 -0.35 2.65 -1.00 -0.88 -1.37 116.94 116.26 1ftt h PHE 49 Ca 0.36 -0.00 0.08 0.00 2.81 0.00 0.00 57.97 61.22 1ftt h PHE 49 Cb 0.59 -0.01 -0.08 0.00 3.61 0.00 0.00 35.95 40.05 1ftt h PHE 49 CO -0.28 0.14 -0.23 0.37 -1.61 0.00 0.00 178.31 176.69 1ftt h GLN 50 N -0.06 -0.18 -0.66 1.51 -0.00 -0.52 -1.18 115.11 114.02 1ftt h GLN 50 Ca 0.01 0.01 -0.01 0.00 -0.00 0.00 0.00 58.65 58.67 1ftt h GLN 50 Cb 0.11 0.04 -0.03 0.00 0.00 0.00 0.00 27.48 27.60 1ftt h GLN 50 CO -0.00 -0.12 0.38 -0.91 0.00 0.00 0.00 178.83 178.18 1ftt h ASN 51 N -0.18 0.80 0.19 -0.69 2.35 -0.92 -0.65 115.58 116.47 1ftt h ASN 51 Ca 0.18 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1ftt h ASN 51 Cb 0.46 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1ftt h ASN 51 CO -0.46 0.62 -0.09 0.45 -1.65 0.00 0.00 177.43 176.30 1ftt h HIS 52 N 0.91 -0.24 0.00 1.19 3.86 -0.70 -1.96 115.15 118.22 1ftt h HIS 52 Ca 0.24 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.43 1ftt h HIS 52 Cb -0.01 0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.54 1ftt h HIS 52 CO 0.00 0.13 -0.03 0.07 0.86 0.00 0.00 177.93 178.97 1ftt h ARG 53 N -0.69 0.00 0.66 2.45 -0.00 -0.97 0.74 114.38 116.58 1ftt h ARG 53 Ca -0.03 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 59.92 1ftt h ARG 53 Cb 0.48 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.46 1ftt h ARG 53 CO 0.04 0.03 -0.32 -0.92 -0.00 0.00 0.00 179.97 178.81 1ftt h TYR 54 N 0.00 -0.82 -0.26 4.08 3.20 -1.08 -2.87 116.97 119.22 1ftt h TYR 54 Ca -0.00 -0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.75 1ftt h TYR 54 Cb 0.12 0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1ftt h TYR 54 CO 0.00 -0.51 -0.27 -0.22 -1.64 0.00 0.00 178.16 175.52 1ftt h LYS 55 N -1.23 0.52 -0.30 1.82 1.63 -0.69 -1.05 116.57 117.28 1ftt h LYS 55 Ca -0.09 -0.21 -0.16 0.00 -0.85 0.00 0.00 60.65 59.34 1ftt h LYS 55 Cb 0.68 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.28 1ftt h LYS 55 CO 0.15 0.75 -0.45 0.52 -3.45 0.00 0.00 179.45 176.96 1ftt h MET 56 N 0.45 0.78 -0.54 1.90 2.86 -1.02 -0.44 114.93 118.91 1ftt h MET 56 Ca 0.06 -0.44 -0.07 0.00 -2.06 0.00 0.00 59.70 57.19 1ftt h MET 56 Cb 0.71 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.38 1ftt h MET 56 CO 0.05 1.07 0.06 -0.22 1.06 0.00 0.00 176.91 178.93 1ftt h LYS 57 N 0.62 0.92 -0.18 1.72 3.64 -1.26 -3.20 116.57 118.83 1ftt h LYS 57 Ca 0.04 -0.27 -0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1ftt h LYS 57 Cb 1.02 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 1ftt h LYS 57 CO 0.10 0.91 0.11 -0.09 -2.27 0.00 0.00 179.45 178.21 1ftt h ARG 58 N 0.81 0.25 0.00 1.90 1.12 -0.92 -3.45 114.38 114.08 1ftt h ARG 58 Ca 0.16 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 59.01 1ftt h ARG 58 Cb 0.46 -0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.36 1ftt h ARG 58 CO 0.02 0.21 0.00 0.00 -3.11 0.00 0.00 179.97 177.09 1ftt n GLN 59 N -4.93 0.00 0.00 0.20 10.64 -0.24 -5.09 117.38 117.96 1ftt n GLN 59 Ca -0.04 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.13 1ftt n GLN 59 Cb 0.05 -0.01 0.00 0.00 -0.86 0.00 0.00 30.24 29.42 1ftt n GLN 59 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ftt n ALA 60 N -2.25 0.00 -0.81 2.61 0.00 -0.83 -4.42 120.51 114.80 1ftt n ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ftt n ALA 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -2.50 0.00 5.02 -1.25 -1.72 118.16 117.71 1ftt n LYS 61 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 1ftt n LYS 61 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.04 1ftt n LYS 61 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1ftt n ASP 62 N 9.97 3.09 -2.83 4.39 8.00 -1.26 -4.88 116.55 133.03 1ftt n ASP 62 Ca 0.00 -2.96 -0.06 0.00 0.71 0.00 0.00 54.79 52.47 1ftt n ASP 62 Cb 0.00 -0.44 0.03 0.00 -0.02 0.00 0.00 41.12 40.68 1ftt n ASP 62 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1ftt n LYS 63 N -0.51 0.91 -0.07 -1.24 2.85 -0.70 -5.08 118.16 114.32 1ftt n LYS 63 Ca 0.24 -1.84 -0.12 0.00 -1.05 0.00 0.00 58.31 55.53 1ftt n LYS 63 Cb 0.83 2.35 -0.10 0.00 -0.65 0.00 0.00 35.03 37.46 1ftt n LYS 63 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ftt h ALA 64 N 2.00 0.03 -0.65 0.58 0.00 -1.78 -3.15 119.26 116.29 1ftt h ALA 64 Ca -0.29 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.12 1ftt h ALA 64 Cb 1.14 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1ftt h ALA 64 CO 0.38 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.72 1ftt n ALA 65 N -2.75 0.00 -0.28 0.00 0.00 -1.26 -4.58 120.51 111.64 1ftt n ALA 65 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1ftt n ALA 65 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 14.00 0.00 0.00 0.00 1.13 -1.26 -5.15 117.38 126.09 1ftt n GLN 66 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1ftt n GLN 66 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 1ftt n GLN 66 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66