#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jfi s ARG 11 N 0.00 4.02 0.05 0.00 6.06 -1.26 -4.77 118.95 123.05 1jfi s ARG 11 Ca 0.00 0.55 0.06 0.00 -2.50 0.00 0.00 55.73 53.84 1jfi s ARG 11 Cb 0.00 -2.91 -0.03 0.00 0.06 0.00 0.00 34.95 32.07 1jfi s ARG 11 CO 0.00 0.46 -0.12 -0.06 -2.50 0.00 0.00 175.30 173.08 1jfi s PHE 12 N -1.49 2.72 -0.57 5.12 0.40 -1.26 -5.06 117.98 117.85 1jfi s PHE 12 Ca 0.39 -0.15 -0.29 0.00 -0.60 0.00 0.00 56.93 56.28 1jfi s PHE 12 Cb -0.15 -1.50 -0.11 0.00 0.51 0.00 0.00 43.02 41.76 1jfi s PHE 12 CO 0.19 0.34 2.43 -2.30 0.70 0.00 0.00 175.22 176.59 1jfi n PRO 13 N 1.32 0.87 -0.24 0.24 -0.02 -1.26 -4.87 135.00 131.03 1jfi n PRO 13 Ca -0.15 0.09 0.01 0.00 -2.02 0.00 0.00 63.50 61.43 1jfi n PRO 13 Cb 0.52 -2.79 0.13 0.00 -0.02 0.00 0.00 33.50 31.35 1jfi n PRO 13 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1jfi h PRO 14 N 16.17 0.55 -0.52 0.52 0.11 -1.97 0.55 132.00 147.40 1jfi h PRO 14 Ca -0.21 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.95 1jfi h PRO 14 Cb 1.29 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 32.20 1jfi h PRO 14 CO 1.17 0.36 0.11 0.00 -0.21 0.00 0.00 178.00 179.44 1jfi h ALA 15 N 1.43 0.60 -0.57 -0.75 0.00 -1.96 0.36 119.26 118.37 1jfi h ALA 15 Ca 0.34 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.31 1jfi h ALA 15 Cb 0.37 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1jfi h ALA 15 CO -0.28 -0.30 0.18 -0.09 0.00 0.00 0.00 179.25 178.76 1jfi h ARG 16 N 0.26 0.89 -0.95 0.00 9.65 -1.66 -1.31 114.38 121.25 1jfi h ARG 16 Ca 0.26 -0.19 -0.01 0.00 -1.10 0.00 0.00 59.98 58.95 1jfi h ARG 16 Cb 0.35 -0.13 -0.05 0.00 -1.39 0.00 0.00 29.97 28.76 1jfi h ARG 16 CO -0.33 0.80 0.58 0.82 2.80 0.00 0.00 179.97 184.63 1jfi h ILE 17 N 0.80 1.26 -0.34 1.20 2.04 0.58 0.78 117.51 123.83 1jfi h ILE 17 Ca 0.18 -0.57 -0.13 0.00 1.00 0.00 0.00 64.86 65.34 1jfi h ILE 17 Cb 0.28 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 1jfi h ILE 17 CO -0.01 0.27 -0.31 0.50 0.00 0.00 0.00 178.15 178.61 1jfi h LYS 18 N 1.32 0.81 -0.76 2.37 3.64 -0.06 -0.02 116.57 123.87 1jfi h LYS 18 Ca 0.34 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1jfi h LYS 18 Cb -0.06 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 1jfi h LYS 18 CO -0.06 1.05 0.49 0.87 -2.27 0.00 0.00 179.45 179.52 1jfi h LYS 19 N 0.59 1.01 -0.26 1.90 6.56 -0.86 -1.39 116.57 124.12 1jfi h LYS 19 Ca 0.06 -0.07 -0.02 0.00 -1.06 0.00 0.00 60.65 59.55 1jfi h LYS 19 Cb 0.89 -0.22 -0.01 0.00 -0.57 0.00 0.00 32.23 32.32 1jfi h LYS 19 CO 0.08 0.68 0.07 0.82 -2.06 0.00 0.00 179.45 179.04 1jfi h ILE 20 N 1.03 1.20 -0.84 1.86 2.04 -0.63 -2.83 117.51 119.34 1jfi h ILE 20 Ca 0.28 -0.66 0.12 0.00 1.00 0.00 0.00 64.86 65.60 1jfi h ILE 20 Cb -0.09 1.16 -0.08 0.00 -0.74 0.00 0.00 36.82 37.06 1jfi h ILE 20 CO -0.06 0.21 0.45 0.24 0.00 0.00 0.00 178.15 179.00 1jfi h MET 21 N 0.24 0.68 -0.57 2.37 2.86 -0.61 -1.96 114.93 117.95 1jfi h MET 21 Ca 0.08 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1jfi h MET 21 Cb 0.26 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1jfi h MET 21 CO -0.00 0.45 0.00 1.04 1.06 0.00 0.00 176.91 179.46 1jfi n GLN 22 N -4.81 1.45 0.00 1.72 6.02 -0.56 -2.84 117.38 118.37 1jfi n GLN 22 Ca 0.15 -0.45 0.14 0.00 -0.01 0.00 0.00 57.00 56.83 1jfi n GLN 22 Cb 0.36 -1.38 0.68 0.00 1.02 0.00 0.00 30.24 30.92 1jfi n GLN 22 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1jfi n THR 23 N -0.02 0.06 -3.54 5.09 -1.04 -0.74 -4.52 114.28 109.57 1jfi n THR 23 Ca 0.04 0.01 -0.40 0.00 -2.04 0.00 0.00 64.05 61.66 1jfi n THR 23 Cb 0.26 -0.53 -0.11 0.00 -1.82 0.00 0.00 70.33 68.13 1jfi n THR 23 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1jfi s ASP 24 N -2.73 6.05 0.54 8.00 -1.08 -1.13 -4.97 116.67 121.35 1jfi s ASP 24 Ca 0.22 -0.40 0.23 0.00 -0.52 0.00 0.00 52.55 52.08 1jfi s ASP 24 Cb 0.19 -2.13 1.50 0.00 -1.46 0.00 0.00 42.92 41.02 1jfi s ASP 24 CO 0.47 -0.22 2.17 -0.33 0.52 0.00 0.00 175.17 177.78 1jfi h GLU 25 N 8.48 0.00 -0.04 4.34 4.39 -1.90 -2.50 114.58 127.35 1jfi h GLU 25 Ca -0.32 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.27 1jfi h GLU 25 Cb 1.16 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 1jfi h GLU 25 CO 0.63 0.03 -0.52 0.93 -1.16 0.00 0.00 179.01 178.92 1jfi h GLU 26 N 0.00 0.09 -6.24 2.33 4.39 -1.95 -3.43 114.58 109.78 1jfi h GLU 26 Ca -0.00 -0.05 -0.56 0.00 0.34 0.00 0.00 59.36 59.09 1jfi h GLU 26 Cb 0.06 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 1jfi h GLU 26 CO 0.00 0.59 1.06 0.42 -1.16 0.00 0.00 179.01 179.92 1jfi s ILE 27 N -3.88 3.76 0.00 3.13 1.09 -0.94 -4.99 121.20 119.36 1jfi s ILE 27 Ca -0.03 0.90 0.00 0.00 -1.10 0.00 0.00 60.65 60.43 1jfi s ILE 27 Cb 0.13 -3.62 0.00 0.00 -1.06 0.00 0.00 42.46 37.91 1jfi s ILE 27 CO 0.76 -0.13 0.00 0.61 -0.10 0.00 0.00 174.94 176.09 1jfi n GLY 28 N 4.13 0.93 3.79 6.18 0.00 -1.26 -4.93 105.19 114.04 1jfi n GLY 28 Ca 0.17 -0.56 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 1jfi n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jfi s LYS 29 N 1.40 4.07 -0.05 1.61 1.02 -1.26 -5.02 119.74 121.52 1jfi s LYS 29 Ca 0.00 1.39 0.02 0.00 0.02 0.00 0.00 55.97 57.40 1jfi s LYS 29 Cb 0.00 -2.35 0.02 0.00 -0.52 0.00 0.00 37.83 34.98 1jfi s LYS 29 CO 0.00 -0.20 -0.08 0.54 -0.92 0.00 0.00 175.35 174.69 1jfi s VAL 30 N -1.84 0.75 0.10 3.17 0.11 -1.26 -5.12 120.40 116.31 1jfi s VAL 30 Ca 0.61 -0.27 -0.34 0.00 -2.93 0.00 0.00 61.98 59.06 1jfi s VAL 30 Cb -0.18 -0.71 -0.13 0.00 -1.53 0.00 0.00 36.38 33.82 1jfi s VAL 30 CO 0.23 0.26 1.67 0.00 -3.33 0.00 0.00 175.10 173.93 1jfi n ALA 31 N 3.81 1.36 -0.29 1.54 0.00 -1.26 -4.87 120.51 120.80 1jfi n ALA 31 Ca -0.23 0.40 0.19 0.00 0.00 0.00 0.00 53.44 53.80 1jfi n ALA 31 Cb 0.52 -2.41 0.36 0.00 0.00 0.00 0.00 19.45 17.92 1jfi n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jfi n ALA 32 N 4.33 0.63 0.23 0.00 0.00 -1.26 0.56 120.51 125.01 1jfi n ALA 32 Ca 0.18 0.90 0.10 0.00 0.00 0.00 0.00 53.44 54.63 1jfi n ALA 32 Cb 0.30 -0.76 0.51 0.00 0.00 0.00 0.00 19.45 19.49 1jfi n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jfi h ALA 33 N 1.72 1.06 0.14 0.00 0.00 -2.03 -3.35 119.26 116.81 1jfi h ALA 33 Ca 0.61 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.35 1jfi h ALA 33 Cb 1.45 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.16 1jfi h ALA 33 CO -0.75 0.26 -0.46 0.28 0.00 0.00 0.00 179.25 178.59 1jfi h VAL 34 N 0.00 0.09 -0.99 0.00 2.07 -0.23 -2.20 116.25 114.98 1jfi h VAL 34 Ca -0.00 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.79 1jfi h VAL 34 Cb 0.68 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.49 1jfi h VAL 34 CO 0.03 0.00 0.69 -0.65 0.02 0.00 0.00 177.57 177.66 1jfi h PRO 35 N -0.71 0.13 -0.04 1.57 0.11 -1.72 -0.09 132.00 131.26 1jfi h PRO 35 Ca 0.01 -0.01 -0.18 0.00 0.11 0.00 0.00 66.00 65.93 1jfi h PRO 35 Cb 0.72 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 1jfi h PRO 35 CO -0.25 0.09 -0.77 -0.39 -0.21 0.00 0.00 178.00 176.47 1jfi h VAL 36 N 0.14 1.42 -0.08 3.15 -1.51 -1.61 -1.02 116.25 116.73 1jfi h VAL 36 Ca 0.50 -2.30 -0.24 0.00 -1.23 0.00 0.00 66.70 63.43 1jfi h VAL 36 Cb 1.71 2.24 0.01 0.00 -2.13 0.00 0.00 31.29 33.12 1jfi h VAL 36 CO -0.09 0.68 -0.89 0.16 -1.23 0.00 0.00 177.57 176.20 1jfi h ILE 37 N 0.19 1.28 -0.36 7.19 3.07 -0.82 -2.50 117.51 125.55 1jfi h ILE 37 Ca -0.03 -2.11 0.01 0.00 1.55 0.00 0.00 64.86 64.28 1jfi h ILE 37 Cb 1.35 2.16 -0.02 0.00 -0.27 0.00 0.00 36.82 40.04 1jfi h ILE 37 CO 0.12 0.66 0.24 0.40 -1.05 0.00 0.00 178.15 178.52 1jfi h ILE 38 N 0.47 1.08 -0.30 0.16 2.04 -1.10 0.22 117.51 120.08 1jfi h ILE 38 Ca -0.09 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 1jfi h ILE 38 Cb 1.53 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 1jfi h ILE 38 CO 0.18 0.08 0.17 -1.28 0.00 0.00 0.00 178.15 177.30 1jfi h SER 39 N 0.46 0.37 -0.84 1.72 0.87 -0.88 0.61 113.55 115.86 1jfi h SER 39 Ca 0.13 -0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.59 1jfi h SER 39 Cb -0.02 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 61.81 1jfi h SER 39 CO -0.03 0.34 0.41 -0.09 -0.53 0.00 0.00 176.83 176.94 1jfi h ARG 40 N 0.37 1.21 -0.30 2.24 9.65 -0.60 0.15 114.38 127.10 1jfi h ARG 40 Ca 0.11 -0.17 -0.02 0.00 -1.10 0.00 0.00 59.98 58.79 1jfi h ARG 40 Cb 0.05 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 28.39 1jfi h ARG 40 CO -0.02 0.92 0.10 0.00 2.80 0.00 0.00 179.97 183.78 1jfi h ALA 41 N 1.22 0.39 -0.64 2.80 0.00 -0.21 -0.74 119.26 122.08 1jfi h ALA 41 Ca 0.29 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1jfi h ALA 41 Cb 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1jfi h ALA 41 CO -0.04 0.01 0.42 1.25 0.00 0.00 0.00 179.25 180.89 1jfi h LEU 42 N 0.33 0.68 -0.43 0.00 5.85 0.89 -0.13 115.31 122.50 1jfi h LEU 42 Ca 0.10 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 1jfi h LEU 42 Cb 0.22 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1jfi h LEU 42 CO -0.01 0.47 0.02 -0.08 -0.34 0.00 0.00 178.44 178.51 1jfi h GLU 43 N 0.79 0.74 -0.06 1.25 4.81 -0.44 -1.81 114.58 119.86 1jfi h GLU 43 Ca 0.25 -0.22 -0.09 0.00 -0.13 0.00 0.00 59.36 59.16 1jfi h GLU 43 Cb 0.02 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1jfi h GLU 43 CO -0.06 0.80 -0.39 -0.07 -0.73 0.00 0.00 179.01 178.55 1jfi h LEU 44 N 0.58 0.13 -0.35 1.64 3.38 -0.22 -2.53 115.31 117.94 1jfi h LEU 44 Ca 0.12 -0.05 -0.19 0.00 0.09 0.00 0.00 57.88 57.85 1jfi h LEU 44 Cb 0.45 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1jfi h LEU 44 CO 0.02 0.52 -0.67 0.15 0.09 0.00 0.00 178.44 178.55 1jfi h PHE 45 N 0.11 0.80 -0.15 1.13 3.04 -0.85 -2.54 116.94 118.47 1jfi h PHE 45 Ca 0.01 -0.33 -0.20 0.00 3.98 0.00 0.00 57.97 61.43 1jfi h PHE 45 Cb 0.75 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 39.13 1jfi h PHE 45 CO 0.01 1.11 -0.72 -0.07 -2.02 0.00 0.00 178.31 176.62 1jfi h LEU 46 N 0.44 0.80 -0.33 0.59 3.38 -1.22 -0.62 115.31 118.35 1jfi h LEU 46 Ca -0.02 -0.50 -0.03 0.00 0.09 0.00 0.00 57.88 57.42 1jfi h LEU 46 Cb 1.26 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1jfi h LEU 46 CO 0.13 1.28 0.11 -0.08 0.09 0.00 0.00 178.44 179.96 1jfi h GLU 47 N 0.48 0.52 -0.49 1.13 4.81 -1.48 0.33 114.58 119.87 1jfi h GLU 47 Ca -0.03 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 59.02 1jfi h GLU 47 Cb 1.32 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 1jfi h GLU 47 CO 0.14 0.55 0.03 1.03 -0.73 0.00 0.00 179.01 180.03 1jfi h SER 48 N 0.39 0.83 0.06 1.04 0.87 -1.46 -2.13 113.55 113.15 1jfi h SER 48 Ca 0.11 -0.29 -0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1jfi h SER 48 Cb 0.24 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1jfi h SER 48 CO -0.00 0.92 -0.03 0.25 -0.53 0.00 0.00 176.83 177.44 1jfi h LEU 49 N 0.72 -0.07 -1.05 2.23 5.85 -0.90 -2.75 115.31 119.34 1jfi h LEU 49 Ca 0.14 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1jfi h LEU 49 Cb 0.47 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1jfi h LEU 49 CO 0.02 0.26 0.42 -0.07 -0.34 0.00 0.00 178.44 178.73 1jfi h LEU 50 N -0.40 0.97 -1.41 2.25 3.38 -0.38 -1.01 115.31 118.70 1jfi h LEU 50 Ca -0.01 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1jfi h LEU 50 Cb 0.36 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1jfi h LEU 50 CO 0.01 0.78 -0.25 0.11 0.09 0.00 0.00 178.44 179.18 1jfi h LYS 51 N 1.09 0.00 0.05 1.13 1.57 -1.39 0.16 116.57 119.17 1jfi h LYS 51 Ca 0.27 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.97 1jfi h LYS 51 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1jfi h LYS 51 CO -0.04 0.25 -0.42 0.87 -0.57 0.00 0.00 179.45 179.54 1jfi h LYS 52 N 0.00 0.10 0.00 3.15 1.79 -1.14 -3.10 116.57 117.37 1jfi h LYS 52 Ca -0.00 -0.17 -0.00 0.00 -2.18 0.00 0.00 60.65 58.29 1jfi h LYS 52 Cb 0.60 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 31.31 1jfi h LYS 52 CO 0.03 1.08 -0.00 0.00 -1.08 0.00 0.00 179.45 179.48 1jfi h ALA 53 N -0.02 1.95 -0.40 3.86 0.00 -1.00 0.78 119.26 124.44 1jfi h ALA 53 Ca -0.09 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1jfi h ALA 53 Cb 1.26 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1jfi h ALA 53 CO 0.03 0.01 -0.21 0.00 0.00 0.00 0.00 179.25 179.08 1jfi h GLN 55 N 0.69 -0.07 -0.46 0.00 4.20 -0.80 -1.40 115.11 117.26 1jfi h GLN 55 Ca 0.10 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.87 1jfi h GLN 55 Cb 0.71 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 1jfi h GLN 55 CO 0.05 0.05 0.31 0.28 -0.67 0.00 0.00 178.83 178.85 1jfi h VAL 56 N -0.17 0.98 -0.22 -0.54 2.07 -1.05 -2.07 116.25 115.26 1jfi h VAL 56 Ca -0.01 -0.14 -0.15 0.00 0.82 0.00 0.00 66.70 67.22 1jfi h VAL 56 Cb 0.15 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1jfi h VAL 56 CO 0.01 0.07 -0.45 0.71 0.02 0.00 0.00 177.57 177.93 1jfi h THR 57 N 0.40 1.31 0.00 2.57 1.35 -0.61 -3.01 112.91 114.93 1jfi h THR 57 Ca 0.20 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 64.39 1jfi h THR 57 Cb 0.27 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 1jfi h THR 57 CO -0.05 0.52 0.00 0.00 -0.25 0.00 0.00 175.52 175.75 1jfi n GLN 58 N -4.18 0.41 -0.96 4.72 6.02 -0.57 -2.44 117.38 120.39 1jfi n GLN 58 Ca -0.06 0.06 -0.11 0.00 -0.01 0.00 0.00 57.00 56.89 1jfi n GLN 58 Cb 0.57 -1.50 0.19 0.00 1.02 0.00 0.00 30.24 30.52 1jfi n GLN 58 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1jfi n SER 59 N -1.18 2.91 0.00 1.08 3.41 -0.98 -5.09 113.62 113.78 1jfi n SER 59 Ca 0.11 -3.73 0.00 0.00 -0.26 0.00 0.00 58.87 55.00 1jfi n SER 59 Cb 0.12 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 1jfi n SER 59 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1jfi n ARG 60 N -1.12 0.00 -0.04 4.33 5.12 -1.02 -5.04 116.66 118.88 1jfi n ARG 60 Ca 0.42 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.34 1jfi n ARG 60 Cb 1.26 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 32.56 1jfi n ARG 60 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1jfi n THR 64 N -0.87 0.00 -2.54 0.55 -1.04 -1.26 -5.05 114.28 104.08 1jfi n THR 64 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.60 1jfi n THR 64 Cb 0.00 -0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.47 1jfi n THR 64 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 1jfi s MET 65 N -0.02 4.55 0.46 -2.82 1.75 -1.26 -5.03 119.30 116.93 1jfi s MET 65 Ca 0.00 1.66 0.05 0.00 -1.25 0.00 0.00 55.69 56.15 1jfi s MET 65 Cb 0.00 -3.33 -0.03 0.00 2.84 0.00 0.00 34.83 34.30 1jfi s MET 65 CO 0.00 -0.02 0.10 0.95 -0.65 0.00 0.00 175.02 175.40 1jfi s THR 66 N 0.33 1.74 0.40 10.11 -4.23 -1.26 -5.03 115.64 117.71 1jfi s THR 66 Ca 0.52 -1.86 0.11 0.00 -1.18 0.00 0.00 61.69 59.28 1jfi s THR 66 Cb -0.28 -2.60 0.31 0.00 1.34 0.00 0.00 72.50 71.28 1jfi s THR 66 CO 0.32 0.00 1.97 0.00 -0.54 0.00 0.00 174.62 176.37 1jfi h THR 67 N 1.41 0.94 -0.02 3.99 1.03 -2.01 -2.73 112.91 115.52 1jfi h THR 67 Ca -0.43 -0.19 -0.01 0.00 -0.01 0.00 0.00 66.41 65.78 1jfi h THR 67 Cb 1.28 0.35 -0.00 0.00 -1.07 0.00 0.00 68.15 68.70 1jfi h THR 67 CO 0.73 0.10 -0.02 0.77 -0.01 0.00 0.00 175.52 177.09 1jfi h SER 68 N 0.54 0.06 -0.36 0.00 4.64 -2.00 -2.20 113.55 114.23 1jfi h SER 68 Ca 0.29 -0.44 0.10 0.00 -0.47 0.00 0.00 61.79 61.28 1jfi h SER 68 Cb 0.44 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 1jfi h SER 68 CO -0.09 0.48 0.39 0.45 -0.87 0.00 0.00 176.83 177.19 1jfi h HIS 69 N -0.37 0.00 0.00 4.77 -0.00 -1.85 -2.45 115.15 115.24 1jfi h HIS 69 Ca 0.01 0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.30 1jfi h HIS 69 Cb 0.46 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.86 1jfi h HIS 69 CO 0.08 0.00 -0.48 -0.07 -0.00 0.00 0.00 177.93 177.45 1jfi h LEU 70 N 0.00 0.00 -1.21 2.43 4.07 -1.44 -3.37 115.31 115.80 1jfi h LEU 70 Ca 0.17 -0.59 0.25 0.00 0.08 0.00 0.00 57.88 57.79 1jfi h LEU 70 Cb 0.94 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.58 1jfi h LEU 70 CO -0.00 1.08 0.64 0.11 -1.08 0.00 0.00 178.44 179.18 1jfi h LYS 71 N -1.00 0.48 -0.54 1.13 1.57 -0.94 0.15 116.57 117.41 1jfi h LYS 71 Ca -0.12 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1jfi h LYS 71 Cb 0.92 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.12 1jfi h LYS 71 CO -0.07 0.32 0.00 1.04 -0.57 0.00 0.00 179.45 180.16 1jfi n GLN 72 N -4.73 0.53 0.00 3.15 6.02 -1.02 -0.80 117.38 120.52 1jfi n GLN 72 Ca 0.26 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.25 1jfi n GLN 72 Cb 0.80 -1.26 0.00 0.00 1.02 0.00 0.00 30.24 30.80 1jfi n GLN 72 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jfi n ILE 74 N -0.83 2.32 1.94 0.00 5.41 0.02 -5.11 119.36 123.10 1jfi n ILE 74 Ca 0.00 -2.20 0.16 0.00 1.00 0.00 0.00 62.75 61.70 1jfi n ILE 74 Cb 0.00 -0.27 0.90 0.00 -0.71 0.00 0.00 39.64 39.55 1jfi n ILE 74 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71