#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1faf s ASP 2 N 0.00 6.49 -0.36 7.83 1.11 -1.26 -4.95 116.67 125.53 1faf s ASP 2 Ca 0.00 2.61 0.01 0.00 0.18 0.00 0.00 52.55 55.35 1faf s ASP 2 Cb 0.00 -2.55 0.15 0.00 1.07 0.00 0.00 42.92 41.59 1faf s ASP 2 CO 0.00 -1.00 0.27 -0.60 1.18 0.00 0.00 175.17 175.02 1faf s ARG 3 N 3.65 0.58 -0.14 8.23 6.06 -1.26 -5.12 118.95 130.96 1faf s ARG 3 Ca 0.82 -1.18 -0.27 0.00 -2.50 0.00 0.00 55.73 52.61 1faf s ARG 3 Cb -0.42 -1.10 -0.02 0.00 0.06 0.00 0.00 34.95 33.48 1faf s ARG 3 CO 0.37 -1.21 0.88 0.14 -2.50 0.00 0.00 175.30 172.99 1faf s VAL 4 N 1.18 4.86 0.06 7.11 -7.23 -1.26 -4.57 120.40 120.54 1faf s VAL 4 Ca 0.18 1.76 -0.18 0.00 -1.81 0.00 0.00 61.98 61.93 1faf s VAL 4 Cb -0.20 -4.19 -0.06 0.00 0.56 0.00 0.00 36.38 32.48 1faf s VAL 4 CO -0.00 0.04 0.53 -1.48 -0.31 0.00 0.00 175.10 173.87 1faf s LEU 5 N 2.00 4.51 0.00 1.32 0.05 -1.26 -5.09 118.68 120.21 1faf s LEU 5 Ca 0.42 1.18 -0.02 0.00 0.05 0.00 0.00 54.13 55.76 1faf s LEU 5 Cb -0.17 -2.84 0.05 0.00 -2.05 0.00 0.00 46.19 41.17 1faf s LEU 5 CO 0.15 0.28 0.29 -1.54 -0.55 0.00 0.00 176.35 174.97 1faf n SER 6 N 1.69 0.21 -0.06 1.48 3.41 -1.26 -4.69 113.62 114.40 1faf n SER 6 Ca -0.11 -1.22 0.08 0.00 -0.26 0.00 0.00 58.87 57.36 1faf n SER 6 Cb 0.51 -0.20 0.44 0.00 -0.26 0.00 0.00 64.21 64.70 1faf n SER 6 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1faf h ARG 7 N 0.00 0.51 0.04 4.33 2.43 -1.98 -0.45 114.38 119.26 1faf h ARG 7 Ca -0.09 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.04 1faf h ARG 7 Cb 0.31 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1faf h ARG 7 CO 0.08 0.34 -0.02 0.00 -1.51 0.00 0.00 179.97 178.86 1faf h ALA 8 N 1.70 -0.06 0.01 2.80 0.00 -1.98 -1.86 119.26 119.88 1faf h ALA 8 Ca 0.23 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1faf h ALA 8 Cb 0.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1faf h ALA 8 CO -0.06 -0.25 -0.01 -0.44 0.00 0.00 0.00 179.25 178.49 1faf h ASP 9 N -0.63 -0.02 -0.18 0.00 3.32 -1.84 -0.95 116.42 116.12 1faf h ASP 9 Ca -0.01 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1faf h ASP 9 Cb 0.56 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 1faf h ASP 9 CO 0.01 0.04 0.12 0.07 -1.72 0.00 0.00 179.24 177.76 1faf h LYS 10 N -0.07 0.26 -0.37 3.56 2.10 -1.19 0.77 116.57 121.63 1faf h LYS 10 Ca -0.00 -0.02 -0.08 0.00 -2.00 0.00 0.00 60.65 58.55 1faf h LYS 10 Cb 0.07 -0.06 -0.02 0.00 -0.90 0.00 0.00 32.23 31.32 1faf h LYS 10 CO 0.00 0.18 -0.09 1.49 -2.00 0.00 0.00 179.45 179.03 1faf h GLU 11 N 0.26 0.63 0.00 0.07 4.81 -0.66 -1.82 114.58 117.86 1faf h GLU 11 Ca 0.07 -0.18 -0.08 0.00 -0.13 0.00 0.00 59.36 59.03 1faf h GLU 11 Cb -0.01 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1faf h GLU 11 CO -0.01 0.71 -0.40 -0.09 -0.73 0.00 0.00 179.01 178.49 1faf h ARG 12 N 0.58 0.00 -0.14 1.92 9.65 0.46 -2.55 114.38 124.29 1faf h ARG 12 Ca 0.11 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.90 1faf h ARG 12 Cb 0.50 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.07 1faf h ARG 12 CO 0.03 0.40 -0.31 1.25 2.80 0.00 0.00 179.97 184.13 1faf h LEU 13 N 0.00 0.27 -0.13 3.80 5.85 -0.44 -2.89 115.31 121.77 1faf h LEU 13 Ca -0.00 -0.09 -0.24 0.00 0.84 0.00 0.00 57.88 58.39 1faf h LEU 13 Cb 0.79 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.76 1faf h LEU 13 CO 0.05 0.58 -0.93 -0.07 -0.34 0.00 0.00 178.44 177.73 1faf h LEU 14 N 0.24 0.73 -0.53 2.25 3.38 -1.22 -2.64 115.31 117.52 1faf h LEU 14 Ca 0.03 -0.55 0.07 0.00 0.09 0.00 0.00 57.88 57.52 1faf h LEU 14 Cb 0.67 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 1faf h LEU 14 CO 0.05 1.35 0.19 -0.08 0.09 0.00 0.00 178.44 180.04 1faf h GLU 15 N 0.34 0.36 0.00 1.13 4.57 -1.28 0.48 114.58 120.19 1faf h GLU 15 Ca -0.09 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 1faf h GLU 15 Cb 1.57 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 30.08 1faf h GLU 15 CO 0.17 0.24 0.00 1.28 -1.18 0.00 0.00 179.01 179.52 1faf n LEU 16 N -5.00 0.55 -0.05 1.64 4.32 -1.15 -3.11 117.00 114.19 1faf n LEU 16 Ca 0.06 0.55 0.12 0.00 -0.02 0.00 0.00 56.01 56.73 1faf n LEU 16 Cb 0.22 -0.39 0.27 0.00 -1.62 0.00 0.00 43.42 41.90 1faf n LEU 16 CO 0.24 -0.14 0.49 0.18 -1.22 0.00 0.00 177.39 176.94 1faf n LEU 17 N -2.01 0.61 -1.33 2.23 7.99 0.03 -4.84 117.00 119.67 1faf n LEU 17 Ca 0.06 -0.06 -0.15 0.00 -0.01 0.00 0.00 56.01 55.85 1faf n LEU 17 Cb 0.39 -0.22 -0.06 0.00 -0.11 0.00 0.00 43.42 43.42 1faf n LEU 17 CO 0.29 0.14 -0.14 0.29 -1.51 0.00 0.00 177.39 176.46 1faf n LYS 18 N -1.34 -1.42 -3.85 3.23 5.02 -0.41 -4.63 118.16 114.76 1faf n LYS 18 Ca 0.07 0.91 -0.36 0.00 -2.02 0.00 0.00 58.31 56.91 1faf n LYS 18 Cb 0.34 -5.19 -0.13 0.00 -0.02 0.00 0.00 35.03 30.02 1faf n LYS 18 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1faf s LEU 19 N -3.76 4.03 1.06 -0.35 0.20 -1.18 -5.09 118.68 113.60 1faf s LEU 19 Ca 0.00 -1.22 -0.23 0.00 0.69 0.00 0.00 54.13 53.38 1faf s LEU 19 Cb 0.00 -1.77 -0.03 0.00 -0.43 0.00 0.00 46.19 43.96 1faf s LEU 19 CO 0.00 -0.28 -0.69 -2.65 -0.29 0.00 0.00 176.35 172.44 1faf n PRO 20 N 4.69 -0.85 0.01 0.98 -0.02 -1.26 -4.71 135.00 133.83 1faf n PRO 20 Ca -0.13 -0.24 0.12 0.00 -2.02 0.00 0.00 63.50 61.23 1faf n PRO 20 Cb 0.44 -1.38 0.21 0.00 -0.02 0.00 0.00 33.50 32.75 1faf n PRO 20 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1faf n ARG 21 N 0.03 0.04 -0.01 -0.52 0.00 -1.26 -3.92 116.66 111.02 1faf n ARG 21 Ca -0.00 0.01 -0.08 0.00 -0.00 0.00 0.00 57.85 57.77 1faf n ARG 21 Cb 0.68 -1.52 0.08 0.00 -0.00 0.00 0.00 32.46 31.70 1faf n ARG 21 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 1faf h GLN 22 N 0.00 0.60 -0.68 2.89 5.75 -2.06 -2.90 115.11 118.71 1faf h GLN 22 Ca 0.00 -0.33 0.00 0.00 -0.15 0.00 0.00 58.65 58.17 1faf h GLN 22 Cb 0.53 0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.10 1faf h GLN 22 CO 0.00 0.93 0.00 1.47 -2.65 0.00 0.00 178.83 178.58 1faf n LEU 23 N -4.01 3.78 -4.54 -2.39 -0.00 -1.26 -4.91 117.00 103.67 1faf n LEU 23 Ca -0.02 -1.89 -0.21 0.00 -0.00 0.00 0.00 56.01 53.89 1faf n LEU 23 Cb 0.55 -0.47 -0.10 0.00 -0.00 0.00 0.00 43.42 43.39 1faf n LEU 23 CO 0.46 0.89 1.59 1.87 -0.00 0.00 0.00 177.39 182.20 1faf n TRP 24 N 1.43 0.95 0.00 1.47 -0.00 -1.10 -2.40 117.44 117.80 1faf n TRP 24 Ca 0.23 0.03 0.00 0.00 -0.00 0.00 0.00 57.50 57.76 1faf n TRP 24 Cb 0.61 -2.20 0.00 0.00 -0.00 0.00 0.00 31.31 29.72 1faf n TRP 24 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1faf n GLY 25 N 6.40 0.32 3.56 5.87 0.00 -1.26 -5.10 105.19 114.98 1faf n GLY 25 Ca 0.50 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.11 1faf n GLY 25 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1faf s ASP 26 N 0.00 6.13 0.47 1.61 2.15 -1.01 -4.87 116.67 121.14 1faf s ASP 26 Ca 0.00 -0.20 0.20 0.00 0.43 0.00 0.00 52.55 52.98 1faf s ASP 26 Cb 0.00 -2.55 1.18 0.00 -0.30 0.00 0.00 42.92 41.25 1faf s ASP 26 CO 0.00 -1.81 1.94 0.15 -0.17 0.00 0.00 175.17 175.28 1faf h PHE 27 N 10.51 0.31 -0.07 -5.34 3.57 -1.99 -0.70 116.94 123.23 1faf h PHE 27 Ca -0.27 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.09 1faf h PHE 27 Cb 1.07 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 1faf h PHE 27 CO 1.10 0.12 -0.59 0.78 -2.23 0.00 0.00 178.31 177.48 1faf h GLY 28 N 0.26 0.27 1.26 2.40 0.00 -2.00 -2.45 103.07 102.81 1faf h GLY 28 Ca 0.34 -0.32 -0.31 0.00 0.00 0.00 0.00 47.33 47.03 1faf h GLY 28 CO -0.08 0.29 -1.51 -0.09 0.00 0.00 0.00 176.54 175.15 1faf h ARG 29 N 0.18 0.34 -0.26 4.80 1.12 -1.59 -2.97 114.38 116.00 1faf h ARG 29 Ca -0.00 -0.57 -0.07 0.00 -1.11 0.00 0.00 59.98 58.23 1faf h ARG 29 Cb 1.08 0.21 -0.01 0.00 -0.01 0.00 0.00 29.97 31.25 1faf h ARG 29 CO 0.09 1.23 -0.09 0.00 -3.11 0.00 0.00 179.97 178.09 1faf h MET 30 N 0.09 0.53 -0.61 0.20 -0.00 -1.27 -2.61 114.93 111.27 1faf h MET 30 Ca -0.24 -0.22 -0.05 0.00 -0.00 0.00 0.00 59.70 59.18 1faf h MET 30 Cb 2.05 -0.02 -0.03 0.00 -0.00 0.00 0.00 31.60 33.61 1faf h MET 30 CO 0.19 0.76 0.17 0.37 -0.00 0.00 0.00 176.91 178.41 1faf h GLN 31 N 0.27 0.96 -0.64 -0.10 4.15 -1.58 0.60 115.11 118.77 1faf h GLN 31 Ca 0.06 -0.22 0.11 0.00 0.77 0.00 0.00 58.65 59.37 1faf h GLN 31 Cb 0.59 -0.13 -0.04 0.00 0.21 0.00 0.00 27.48 28.10 1faf h GLN 31 CO 0.03 0.87 0.43 0.37 -1.93 0.00 0.00 178.83 178.59 1faf h GLN 32 N 0.88 0.42 0.11 1.69 4.15 -1.45 0.72 115.11 121.63 1faf h GLN 32 Ca 0.19 -0.03 -0.16 0.00 0.77 0.00 0.00 58.65 59.42 1faf h GLN 32 Cb 0.32 -0.09 0.02 0.00 0.21 0.00 0.00 27.48 27.94 1faf h GLN 32 CO -0.00 0.28 -0.71 0.00 -1.93 0.00 0.00 178.83 176.46 1faf h ALA 33 N 1.68 -0.07 -0.65 3.38 0.00 -1.00 -2.77 119.26 119.83 1faf h ALA 33 Ca 0.30 -0.66 0.08 0.00 0.00 0.00 0.00 54.91 54.63 1faf h ALA 33 Cb 0.59 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 1faf h ALA 33 CO -0.09 0.34 0.31 -0.92 0.00 0.00 0.00 179.25 178.89 1faf h TYR 34 N -0.40 0.55 -0.42 0.00 5.03 -0.04 -1.44 116.97 120.25 1faf h TYR 34 Ca -0.12 0.03 -0.11 0.00 2.58 0.00 0.00 58.73 61.10 1faf h TYR 34 Cb 1.55 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 39.66 1faf h TYR 34 CO 0.20 0.21 -0.20 0.87 -1.32 0.00 0.00 178.16 177.92 1faf h LYS 35 N 0.55 0.83 -0.82 1.82 1.57 -0.99 0.10 116.57 119.62 1faf h LYS 35 Ca 0.32 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1faf h LYS 35 Cb 0.32 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 1faf h LYS 35 CO -0.25 0.95 0.53 0.37 -0.57 0.00 0.00 179.45 180.48 1faf h GLN 36 N 0.72 1.09 0.00 3.15 4.15 -0.99 -2.30 115.11 120.94 1faf h GLN 36 Ca 0.10 -0.07 -0.05 0.00 0.77 0.00 0.00 58.65 59.40 1faf h GLN 36 Cb 0.72 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 28.16 1faf h GLN 36 CO 0.05 0.74 -1.00 1.96 -1.93 0.00 0.00 178.83 178.65 1faf h GLN 37 N 1.12 0.00 -0.22 1.69 1.08 -1.17 -3.33 115.11 114.27 1faf h GLN 37 Ca 0.30 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.43 1faf h GLN 37 Cb -0.11 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.31 1faf h GLN 37 CO -0.06 0.10 -0.19 0.66 -0.95 0.00 0.00 178.83 178.39 1faf h SER 38 N 0.00 0.38 -0.36 1.46 4.64 -0.26 0.05 113.55 119.46 1faf h SER 38 Ca -0.04 -0.11 -0.11 0.00 -0.47 0.00 0.00 61.79 61.06 1faf h SER 38 Cb 1.18 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 1faf h SER 38 CO 0.02 0.59 -0.20 -0.07 -0.87 0.00 0.00 176.83 176.29 1faf h LEU 39 N 0.36 0.79 -0.02 5.97 3.38 -1.56 -2.78 115.31 121.44 1faf h LEU 39 Ca 0.06 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1faf h LEU 39 Cb 0.54 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1faf h LEU 39 CO 0.04 1.03 -0.07 0.00 0.09 0.00 0.00 178.44 179.53 1faf n LEU 40 N -4.28 0.11 -0.69 1.67 -0.00 -1.10 -3.15 117.00 109.56 1faf n LEU 40 Ca -0.02 0.34 0.13 0.00 -0.00 0.00 0.00 56.01 56.46 1faf n LEU 40 Cb 0.42 -0.39 0.29 0.00 -0.00 0.00 0.00 43.42 43.74 1faf n LEU 40 CO 0.44 0.02 0.71 0.18 -0.00 0.00 0.00 177.39 178.75 1faf n LEU 41 N -1.40 2.19 -4.66 1.47 4.77 -0.02 -3.98 117.00 115.38 1faf n LEU 41 Ca 0.09 -0.73 -0.41 0.00 -0.03 0.00 0.00 56.01 54.93 1faf n LEU 41 Cb 0.31 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1faf n LEU 41 CO 0.27 0.37 0.53 -2.28 -1.33 0.00 0.00 177.39 174.94 1faf s HIS 42 N -2.06 3.39 0.65 -1.77 2.46 -1.11 -4.02 115.29 112.84 1faf s HIS 42 Ca 0.31 1.12 0.12 0.00 0.47 0.00 0.00 55.06 57.08 1faf s HIS 42 Cb 0.20 -2.94 0.50 0.00 -0.13 0.00 0.00 32.58 30.21 1faf s HIS 42 CO 0.34 -0.23 1.23 -1.35 -2.47 0.00 0.00 174.74 172.27 1faf h PRO 43 N 7.42 0.00 0.00 2.88 0.11 -1.80 1.23 132.00 141.83 1faf h PRO 43 Ca -0.30 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.65 1faf h PRO 43 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1faf h PRO 43 CO 0.82 0.00 -0.80 0.22 -0.21 0.00 0.00 178.00 178.02 1faf h ASP 44 N 0.00 0.00 -0.80 -2.05 3.58 -1.91 -3.25 116.42 111.99 1faf h ASP 44 Ca 0.13 0.00 -0.42 0.00 0.42 0.00 0.00 57.03 57.15 1faf h ASP 44 Cb 2.00 0.00 -0.25 0.00 1.72 0.00 0.00 39.33 42.80 1faf h ASP 44 CO -0.00 0.80 0.43 0.29 -2.88 0.00 0.00 179.24 177.88 1faf n LYS 45 N -3.33 2.14 -2.41 0.28 4.76 0.42 -4.91 118.16 115.11 1faf n LYS 45 Ca 0.01 -3.08 -0.07 0.00 -2.87 0.00 0.00 58.31 52.30 1faf n LYS 45 Cb 0.85 -2.07 0.03 0.00 -1.84 0.00 0.00 35.03 32.00 1faf n LYS 45 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1faf n GLY 46 N -1.14 0.03 3.19 0.72 0.00 -1.17 -4.80 105.19 102.03 1faf n GLY 46 Ca 0.52 -0.02 -0.12 0.00 0.00 0.00 0.00 46.02 46.40 1faf n GLY 46 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1faf s GLY 47 N -3.33 0.98 0.42 -0.02 0.00 -1.13 -4.86 107.32 99.38 1faf s GLY 47 Ca 0.13 -1.47 -0.03 0.00 0.00 0.00 0.00 44.72 43.35 1faf s GLY 47 CO 0.32 -1.47 0.68 -0.56 0.00 0.00 0.00 173.10 172.07 1faf s SER 48 N -3.10 6.28 -0.12 1.64 0.01 -1.26 -3.37 113.70 113.79 1faf s SER 48 Ca 0.19 0.72 -0.24 0.00 1.31 0.00 0.00 55.95 57.92 1faf s SER 48 Cb 0.06 -2.15 -0.27 0.00 0.21 0.00 0.00 66.02 63.87 1faf s SER 48 CO -0.00 -0.45 0.71 -0.74 0.41 0.00 0.00 173.24 173.17 1faf h HIS 49 N 0.47 0.22 -0.05 2.43 2.76 -1.99 -3.21 115.15 115.77 1faf h HIS 49 Ca -0.48 -0.16 0.02 0.00 -2.20 0.00 0.00 60.37 57.55 1faf h HIS 49 Cb 1.21 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 30.16 1faf h HIS 49 CO 0.55 1.22 0.07 0.00 -1.30 0.00 0.00 177.93 178.48 1faf h ALA 50 N -0.04 1.52 0.02 5.26 0.00 -1.95 -2.09 119.26 121.97 1faf h ALA 50 Ca -0.12 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1faf h ALA 50 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1faf h ALA 50 CO 0.03 -0.10 -0.01 -0.07 0.00 0.00 0.00 179.25 179.10 1faf h LEU 51 N 0.00 -0.02 -0.68 0.00 4.07 -1.92 -2.32 115.31 114.44 1faf h LEU 51 Ca 0.03 -0.71 0.00 0.00 0.08 0.00 0.00 57.88 57.28 1faf h LEU 51 Cb 0.17 0.01 -0.03 0.00 1.08 0.00 0.00 40.66 41.88 1faf h LEU 51 CO -0.00 0.72 0.43 -0.03 -1.08 0.00 0.00 178.44 178.48 1faf h MET 52 N -0.80 0.91 -0.01 1.13 4.05 -1.45 -2.20 114.93 116.56 1faf h MET 52 Ca -0.00 -0.07 -0.10 0.00 -0.28 0.00 0.00 59.70 59.25 1faf h MET 52 Cb 0.73 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 1faf h MET 52 CO 0.00 0.63 -0.45 -0.56 0.23 0.00 0.00 176.91 176.77 1faf h GLN 53 N 0.92 0.03 0.55 0.39 3.07 -1.50 -2.88 115.11 115.69 1faf h GLN 53 Ca 0.25 -0.01 -0.03 0.00 0.09 0.00 0.00 58.65 58.94 1faf h GLN 53 Cb -0.06 -0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.51 1faf h GLN 53 CO -0.05 0.47 -0.27 1.49 0.09 0.00 0.00 178.83 180.57 1faf h GLU 54 N 0.02 -0.72 -0.81 0.06 4.81 -0.81 -2.61 114.58 114.52 1faf h GLU 54 Ca -0.00 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.37 1faf h GLU 54 Cb 0.80 0.16 -0.06 0.00 0.63 0.00 0.00 28.75 30.29 1faf h GLU 54 CO 0.06 -0.45 0.53 1.25 -0.73 0.00 0.00 179.01 179.67 1faf h LEU 55 N -0.82 0.70 -1.92 1.64 5.85 -1.47 0.25 115.31 119.54 1faf h LEU 55 Ca -0.08 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1faf h LEU 55 Cb 0.60 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 1faf h LEU 55 CO 0.12 0.42 -0.07 0.78 -0.34 0.00 0.00 178.44 179.36 1faf h ASN 56 N 0.78 0.00 0.04 1.25 2.35 -1.28 0.57 115.58 119.28 1faf h ASN 56 Ca 0.37 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.91 1faf h ASN 56 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1faf h ASN 56 CO -0.14 0.07 -0.77 -1.28 -1.65 0.00 0.00 177.43 173.66 1faf h SER 57 N 0.00 0.74 0.77 5.81 0.87 -0.57 0.66 113.55 121.83 1faf h SER 57 Ca -0.00 -0.49 -0.25 0.00 -1.23 0.00 0.00 61.79 59.82 1faf h SER 57 Cb 0.12 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 61.83 1faf h SER 57 CO 0.01 1.26 -1.29 -0.07 -0.53 0.00 0.00 176.83 176.21 1faf h LEU 58 N 0.42 0.04 0.00 2.23 3.38 -1.15 -3.19 115.31 117.04 1faf h LEU 58 Ca -0.05 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1faf h LEU 58 Cb 1.37 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1faf h LEU 58 CO 0.15 1.05 -0.89 1.87 0.09 0.00 0.00 178.44 180.70 1faf n TRP 59 N -3.26 0.77 0.08 1.13 -0.00 0.19 -3.21 117.44 113.14 1faf n TRP 59 Ca -0.07 0.22 -0.04 0.00 -0.00 0.00 0.00 57.50 57.61 1faf n TRP 59 Cb 0.99 -0.81 -0.02 0.00 -0.00 0.00 0.00 31.31 31.47 1faf n TRP 59 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 177.69 178.47 1faf h GLY 60 N 4.21 -0.29 0.66 5.87 0.00 0.27 -0.82 103.07 112.97 1faf h GLY 60 Ca 0.00 0.11 0.03 0.00 0.00 0.00 0.00 47.33 47.47 1faf h GLY 60 CO 0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 176.54 176.38 1faf h THR 61 N -0.89 0.81 -0.72 4.70 1.03 -1.75 -0.54 112.91 115.56 1faf h THR 61 Ca -0.03 0.00 0.13 0.00 -0.01 0.00 0.00 66.41 66.50 1faf h THR 61 Cb 0.21 0.81 -0.13 0.00 -1.07 0.00 0.00 68.15 67.98 1faf h THR 61 CO 0.05 0.00 -0.31 0.15 -0.01 0.00 0.00 175.52 175.40 1faf h PHE 62 N -0.02 -0.83 -0.75 0.00 3.57 -1.67 0.45 116.94 117.69 1faf h PHE 62 Ca 0.08 0.08 0.10 0.00 3.53 0.00 0.00 57.97 61.76 1faf h PHE 62 Cb 0.14 0.47 -0.07 0.00 2.79 0.00 0.00 35.95 39.28 1faf h PHE 62 CO -0.20 -0.38 0.39 -0.22 -2.23 0.00 0.00 178.31 175.67 1faf h LYS 63 N -0.09 0.62 -1.04 1.11 3.64 0.12 0.40 116.57 121.33 1faf h LYS 63 Ca 0.29 -0.04 0.27 0.00 -1.27 0.00 0.00 60.65 59.90 1faf h LYS 63 Cb 0.57 -0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 32.15 1faf h LYS 63 CO -0.77 0.41 0.66 1.15 -2.27 0.00 0.00 179.45 178.63 1faf h THR 64 N 0.64 0.51 0.02 1.00 2.02 0.14 0.90 112.91 118.14 1faf h THR 64 Ca 0.37 -0.14 -0.26 0.00 0.77 0.00 0.00 66.41 67.15 1faf h THR 64 Cb 0.41 0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 66.85 1faf h THR 64 CO -0.28 0.07 -1.41 -0.33 0.37 0.00 0.00 175.52 173.95 1faf h GLU 65 N 0.41 0.03 -0.71 6.66 4.39 -0.51 -3.34 114.58 121.51 1faf h GLU 65 Ca 0.61 -0.06 0.10 0.00 0.34 0.00 0.00 59.36 60.35 1faf h GLU 65 Cb 1.50 0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 30.10 1faf h GLU 65 CO -0.33 0.78 0.33 0.28 -1.16 0.00 0.00 179.01 178.92 1faf h VAL 66 N 0.01 0.81 0.00 3.13 2.07 0.49 0.92 116.25 123.68 1faf h VAL 66 Ca -0.17 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 1faf h VAL 66 Cb 1.92 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1faf h VAL 66 CO 0.11 0.10 -0.15 1.88 0.02 0.00 0.00 177.57 179.53 1faf h TYR 67 N 0.56 0.00 0.00 1.57 0.05 -1.22 -2.01 116.97 115.91 1faf h TYR 67 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.14 1faf h TYR 67 Cb 0.41 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.15 1faf h TYR 67 CO -0.12 0.15 -1.03 0.09 -1.05 0.00 0.00 178.16 176.20 1faf n ASN 68 N -4.24 0.79 -0.29 3.88 3.02 0.42 -4.09 115.26 114.75 1faf n ASN 68 Ca -0.02 0.28 -0.02 0.00 -0.03 0.00 0.00 54.58 54.78 1faf n ASN 68 Cb 0.22 0.52 0.14 0.00 -0.61 0.00 0.00 39.78 40.05 1faf n ASN 68 CO 0.00 0.00 0.00 0.17 -2.62 0.00 0.00 177.26 174.81 1faf h LEU 69 N 0.00 1.03 -0.53 3.41 8.10 0.15 0.54 115.31 128.01 1faf h LEU 69 Ca 0.00 -0.08 0.00 0.00 0.11 0.00 0.00 57.88 57.91 1faf h LEU 69 Cb 0.98 -0.26 0.00 0.00 -0.44 0.00 0.00 40.66 40.93 1faf h LEU 69 CO 0.00 0.82 0.00 0.54 -4.11 0.00 0.00 178.44 175.69 1faf n ARG 70 N -4.35 1.36 0.00 0.17 1.74 -1.22 -3.40 116.66 110.96 1faf n ARG 70 Ca 0.09 -0.53 0.01 0.00 -0.77 0.00 0.00 57.85 56.65 1faf n ARG 70 Cb 0.09 -1.46 -0.01 0.00 -1.02 0.00 0.00 32.46 30.06 1faf n ARG 70 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1faf n MET 71 N -0.34 6.04 0.00 5.56 2.81 -0.36 -4.51 117.12 126.32 1faf n MET 71 Ca 0.20 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 1faf n MET 71 Cb 0.23 -0.62 0.00 0.00 -0.71 0.00 0.00 33.22 32.12 1faf n MET 71 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1faf n ASN 72 N -1.03 0.00 -1.80 7.83 3.02 0.18 -4.66 115.26 118.79 1faf n ASN 72 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.40 1faf n ASN 72 Cb 0.04 -0.30 0.06 0.00 -0.61 0.00 0.00 39.78 38.96 1faf n ASN 72 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1faf n LEU 73 N -2.15 5.93 -1.60 3.41 7.94 -1.22 -4.54 117.00 124.77 1faf n LEU 73 Ca 0.00 -3.05 -0.10 0.00 -1.11 0.00 0.00 56.01 51.74 1faf n LEU 73 Cb 0.00 -0.92 0.05 0.00 0.53 0.00 0.00 43.42 43.08 1faf n LEU 73 CO 0.00 1.07 0.96 0.61 -1.11 0.00 0.00 177.39 178.92 1faf n GLY 74 N 0.09 3.25 0.50 -3.96 0.00 -1.26 -4.87 105.19 98.94 1faf n GLY 74 Ca 0.31 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1faf n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1faf n GLY 75 N 0.28 -1.21 3.76 -0.02 0.00 -1.26 -5.03 105.19 101.70 1faf n GLY 75 Ca 0.21 -0.81 -0.34 0.00 0.00 0.00 0.00 46.02 45.08 1faf n GLY 75 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1faf s THR 76 N 0.00 2.94 -0.37 2.61 -4.23 -1.26 -5.00 115.64 110.33 1faf s THR 76 Ca 0.00 0.49 0.14 0.00 -1.18 0.00 0.00 61.69 61.14 1faf s THR 76 Cb 0.00 -3.07 0.42 0.00 1.34 0.00 0.00 72.50 71.19 1faf s THR 76 CO 0.00 -0.21 0.93 0.61 -0.54 0.00 0.00 174.62 175.40 1faf n GLY 77 N -0.03 3.02 3.56 3.99 0.00 -1.26 -5.06 105.19 109.40 1faf n GLY 77 Ca 0.12 -1.73 -0.43 0.00 0.00 0.00 0.00 46.02 43.98 1faf n GLY 77 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1faf s PHE 78 N -3.06 3.06 -2.74 1.61 0.08 -1.26 -5.33 117.98 110.34 1faf s PHE 78 Ca 0.35 0.33 0.26 0.00 0.12 0.00 0.00 56.93 57.99 1faf s PHE 78 Cb 0.41 -3.49 0.64 0.00 -0.57 0.00 0.00 43.02 40.02 1faf s PHE 78 CO -0.04 -0.84 1.51 1.04 -0.10 0.00 0.00 175.22 176.80