#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1faf n ASP 2 N 0.00 0.25 -3.40 7.83 2.03 -1.26 -5.06 116.55 116.94 1faf n ASP 2 Ca 0.00 0.16 -0.18 0.00 0.52 0.00 0.00 54.79 55.29 1faf n ASP 2 Cb 0.00 0.02 -0.09 0.00 -0.72 0.00 0.00 41.12 40.32 1faf n ASP 2 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1faf s ARG 3 N -1.51 0.40 -0.05 -0.67 0.52 -1.26 -5.12 118.95 111.27 1faf s ARG 3 Ca 0.00 -0.36 -0.02 0.00 -0.52 0.00 0.00 55.73 54.83 1faf s ARG 3 Cb 0.00 -0.71 0.03 0.00 0.52 0.00 0.00 34.95 34.79 1faf s ARG 3 CO 0.00 -1.07 0.05 0.14 0.02 0.00 0.00 175.30 174.43 1faf s VAL 4 N 2.10 -0.02 0.48 3.52 -7.23 -1.26 -4.80 120.40 113.19 1faf s VAL 4 Ca 0.11 0.37 -0.22 0.00 -1.81 0.00 0.00 61.98 60.43 1faf s VAL 4 Cb -0.15 -0.22 -0.07 0.00 0.56 0.00 0.00 36.38 36.50 1faf s VAL 4 CO -0.25 0.19 1.18 -1.48 -0.31 0.00 0.00 175.10 174.44 1faf s LEU 5 N 2.12 3.96 0.00 1.32 0.05 -1.26 -5.05 118.68 119.83 1faf s LEU 5 Ca 0.05 2.35 -0.00 0.00 0.05 0.00 0.00 54.13 56.58 1faf s LEU 5 Cb -0.12 -4.29 0.01 0.00 -2.05 0.00 0.00 46.19 39.74 1faf s LEU 5 CO -0.03 -1.04 0.04 -1.54 -0.55 0.00 0.00 176.35 173.22 1faf n SER 6 N -0.66 0.04 0.24 1.48 3.41 -1.26 -4.60 113.62 112.27 1faf n SER 6 Ca 0.08 -1.03 0.07 0.00 -0.26 0.00 0.00 58.87 57.73 1faf n SER 6 Cb 0.48 -0.02 0.58 0.00 -0.26 0.00 0.00 64.21 64.98 1faf n SER 6 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 1faf h ARG 7 N 0.00 0.00 0.01 4.33 -0.00 -1.96 0.95 114.38 117.71 1faf h ARG 7 Ca -0.01 0.00 -0.20 0.00 -0.00 0.00 0.00 59.98 59.77 1faf h ARG 7 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.00 1faf h ARG 7 CO 0.01 0.12 -0.90 0.00 -0.00 0.00 0.00 179.97 179.20 1faf h ALA 8 N 1.88 0.49 0.04 0.08 0.00 -1.99 -2.60 119.26 117.16 1faf h ALA 8 Ca -0.00 -0.74 -0.27 0.00 0.00 0.00 0.00 54.91 53.89 1faf h ALA 8 Cb 0.21 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1faf h ALA 8 CO 0.02 0.94 -1.47 -0.44 0.00 0.00 0.00 179.25 178.30 1faf h ASP 9 N 0.10 0.13 -0.01 0.00 3.32 -1.73 -3.31 116.42 114.91 1faf h ASP 9 Ca -0.05 -0.65 0.00 0.00 0.02 0.00 0.00 57.03 56.36 1faf h ASP 9 Cb 1.55 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 41.05 1faf h ASP 9 CO 0.14 1.60 0.01 0.07 -1.72 0.00 0.00 179.24 179.33 1faf h LYS 10 N -0.68 0.00 -0.05 3.56 2.10 0.79 0.76 116.57 123.04 1faf h LYS 10 Ca -0.37 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.17 1faf h LYS 10 Cb 1.52 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.84 1faf h LYS 10 CO -0.12 0.00 -0.47 1.05 -2.00 0.00 0.00 179.45 177.91 1faf h GLU 11 N 0.00 0.13 -0.91 0.07 4.11 -1.61 -2.61 114.58 113.77 1faf h GLU 11 Ca 0.00 -0.07 -0.00 0.00 0.07 0.00 0.00 59.36 59.36 1faf h GLU 11 Cb 0.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1faf h GLU 11 CO -0.00 0.58 0.55 -0.09 0.07 0.00 0.00 179.01 180.12 1faf h ARG 12 N 0.11 1.23 -0.38 1.06 1.12 -0.93 -1.17 114.38 115.40 1faf h ARG 12 Ca 0.00 -0.11 -0.07 0.00 -1.11 0.00 0.00 59.98 58.70 1faf h ARG 12 Cb 0.88 -0.26 -0.02 0.00 -0.01 0.00 0.00 29.97 30.56 1faf h ARG 12 CO 0.07 0.85 -0.05 1.25 -3.11 0.00 0.00 179.97 178.98 1faf h LEU 13 N 1.25 0.60 -0.53 3.80 5.85 -1.32 -2.73 115.31 122.23 1faf h LEU 13 Ca 0.33 -0.14 -0.10 0.00 0.84 0.00 0.00 57.88 58.80 1faf h LEU 13 Cb -0.06 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 1faf h LEU 13 CO -0.06 0.71 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.61 1faf h LEU 14 N 0.59 0.97 0.02 2.25 3.38 -1.05 -1.55 115.31 119.92 1faf h LEU 14 Ca 0.11 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.77 1faf h LEU 14 Cb 0.44 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1faf h LEU 14 CO 0.02 1.08 -0.17 -0.33 0.09 0.00 0.00 178.44 179.13 1faf h GLU 15 N 0.85 -0.28 0.00 1.13 5.08 -0.98 -0.33 114.58 120.05 1faf h GLU 15 Ca 0.14 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1faf h GLU 15 Cb 0.62 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.93 1faf h GLU 15 CO 0.04 -0.19 0.00 1.28 -1.00 0.00 0.00 179.01 179.14 1faf n LEU 16 N -5.30 0.37 0.00 1.33 4.77 -1.13 -2.42 117.00 114.62 1faf n LEU 16 Ca -0.05 0.58 0.12 0.00 -0.03 0.00 0.00 56.01 56.62 1faf n LEU 16 Cb 0.22 -0.51 0.22 0.00 -2.33 0.00 0.00 43.42 41.02 1faf n LEU 16 CO 0.26 -0.34 0.41 0.18 -1.33 0.00 0.00 177.39 176.57 1faf n LEU 17 N -1.89 0.54 -1.42 2.23 7.99 -0.26 -4.76 117.00 119.42 1faf n LEU 17 Ca 0.04 -0.01 -0.13 0.00 -0.01 0.00 0.00 56.01 55.89 1faf n LEU 17 Cb 0.25 -0.23 -0.06 0.00 -0.11 0.00 0.00 43.42 43.27 1faf n LEU 17 CO 0.20 0.12 -0.13 0.29 -1.51 0.00 0.00 177.39 176.35 1faf n LYS 18 N -1.55 -1.32 -3.78 3.23 4.01 -0.48 -4.71 118.16 113.55 1faf n LYS 18 Ca 0.05 0.79 -0.37 0.00 -0.51 0.00 0.00 58.31 58.27 1faf n LYS 18 Cb 0.34 -5.05 -0.13 0.00 -0.51 0.00 0.00 35.03 29.69 1faf n LYS 18 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 1faf s LEU 19 N -3.84 4.03 1.04 -0.35 0.20 -1.20 -5.09 118.68 113.47 1faf s LEU 19 Ca 0.00 -0.97 -0.21 0.00 0.69 0.00 0.00 54.13 53.64 1faf s LEU 19 Cb 0.00 -1.85 -0.05 0.00 -0.43 0.00 0.00 46.19 43.87 1faf s LEU 19 CO 0.00 -0.26 -0.62 -2.65 -0.29 0.00 0.00 176.35 172.53 1faf n PRO 20 N 4.81 -0.62 0.00 0.98 -0.02 -1.26 -4.78 135.00 134.10 1faf n PRO 20 Ca -0.14 -0.17 0.13 0.00 -2.02 0.00 0.00 63.50 61.31 1faf n PRO 20 Cb 0.46 -1.37 0.45 0.00 -0.02 0.00 0.00 33.50 33.02 1faf n PRO 20 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1faf n ARG 21 N 0.27 1.26 0.11 -0.52 1.74 -1.26 -3.92 116.66 114.35 1faf n ARG 21 Ca 0.00 -0.74 0.03 0.00 -0.77 0.00 0.00 57.85 56.37 1faf n ARG 21 Cb 0.65 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 1faf n ARG 21 CO 0.00 0.00 0.00 -0.56 -1.52 0.00 0.00 177.63 175.55 1faf h GLN 22 N 1.81 0.00 -0.42 5.56 -0.00 -2.05 -3.28 115.11 116.73 1faf h GLN 22 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1faf h GLN 22 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.99 1faf h GLN 22 CO 0.00 0.37 0.00 1.47 -0.00 0.00 0.00 178.83 180.67 1faf n LEU 23 N -3.08 3.18 -4.54 0.06 -0.00 -1.25 -4.96 117.00 106.40 1faf n LEU 23 Ca -0.01 -2.05 -0.32 0.00 -0.00 0.00 0.00 56.01 53.63 1faf n LEU 23 Cb 0.74 -0.29 -0.07 0.00 -0.00 0.00 0.00 43.42 43.80 1faf n LEU 23 CO 0.41 0.77 1.90 1.87 -0.00 0.00 0.00 177.39 182.35 1faf n TRP 24 N 0.68 1.18 0.00 1.47 -0.00 -1.24 -2.51 117.44 117.02 1faf n TRP 24 Ca 0.14 0.13 0.00 0.00 -0.00 0.00 0.00 57.50 57.77 1faf n TRP 24 Cb 0.49 -2.50 0.00 0.00 -0.00 0.00 0.00 31.31 29.30 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 6.22 0.44 3.56 5.87 0.00 -1.26 -5.09 105.19 114.93 1faf n GLY 25 Ca 0.45 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.09 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 5.97 0.32 1.61 -1.08 -1.04 -4.85 116.67 117.60 1faf s ASP 26 Ca 0.00 -0.83 0.11 0.00 -0.52 0.00 0.00 52.55 51.31 1faf s ASP 26 Cb 0.00 -2.56 0.95 0.00 -1.46 0.00 0.00 42.92 39.85 1faf s ASP 26 CO 0.00 -1.96 1.69 0.15 0.52 0.00 0.00 175.17 175.57 1faf h PHE 27 N 10.81 0.91 -0.29 -5.34 3.57 -1.98 0.20 116.94 124.82 1faf h PHE 27 Ca 0.01 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 1faf h PHE 27 Cb 1.04 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.52 1faf h PHE 27 CO 1.20 -0.07 -0.02 0.78 -2.23 0.00 0.00 178.31 177.98 1faf h GLY 28 N 0.43 0.47 0.72 2.40 0.00 -1.99 -1.80 103.07 103.30 1faf h GLY 28 Ca 0.67 -0.27 -0.23 0.00 0.00 0.00 0.00 47.33 47.50 1faf h GLY 28 CO -0.55 0.25 -1.06 3.21 0.00 0.00 0.00 176.54 178.39 1faf h ARG 29 N 0.42 0.32 -0.19 4.80 3.08 -1.06 -2.81 114.38 118.94 1faf h ARG 29 Ca 0.09 -0.54 -0.00 0.00 0.07 0.00 0.00 59.98 59.60 1faf h ARG 29 Cb 0.31 0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1faf h ARG 29 CO 0.01 1.26 0.11 0.00 -1.07 0.00 0.00 179.97 180.28 1faf h MET 30 N -0.29 0.27 -0.32 0.04 -0.00 -1.17 -1.82 114.93 111.64 1faf h MET 30 Ca -0.20 -0.03 -0.08 0.00 -0.00 0.00 0.00 59.70 59.39 1faf h MET 30 Cb 1.74 -0.05 -0.02 0.00 -0.00 0.00 0.00 31.60 33.27 1faf h MET 30 CO 0.14 0.25 -0.15 0.37 -0.00 0.00 0.00 176.91 177.52 1faf h GLN 31 N 0.21 0.57 -0.63 -0.10 4.15 -1.48 -1.45 115.11 116.38 1faf h GLN 31 Ca 0.07 -0.18 0.03 0.00 0.77 0.00 0.00 58.65 59.33 1faf h GLN 31 Cb 0.06 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.66 1faf h GLN 31 CO -0.01 0.71 0.39 1.96 -1.93 0.00 0.00 178.83 179.94 1faf h GLN 32 N 0.52 0.74 -0.35 1.69 4.20 -1.20 -1.96 115.11 118.75 1faf h GLN 32 Ca 0.09 -0.04 -0.16 0.00 0.06 0.00 0.00 58.65 58.59 1faf h GLN 32 Cb 0.57 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.18 1faf h GLN 32 CO 0.04 0.49 -0.42 0.00 -0.67 0.00 0.00 178.83 178.27 1faf h ALA 33 N 1.27 0.52 -0.44 3.87 0.00 -1.06 -2.64 119.26 120.79 1faf h ALA 33 Ca 0.25 -0.47 0.08 0.00 0.00 0.00 0.00 54.91 54.78 1faf h ALA 33 Cb 0.02 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 1faf h ALA 33 CO -0.10 0.65 0.03 -0.92 0.00 0.00 0.00 179.25 178.90 1faf h TYR 34 N 0.70 0.03 -0.09 0.00 5.03 -0.79 0.17 116.97 122.02 1faf h TYR 34 Ca 0.05 0.03 -0.08 0.00 2.58 0.00 0.00 58.73 61.30 1faf h TYR 34 Cb 1.02 0.06 -0.01 0.00 1.55 0.00 0.00 36.73 39.34 1faf h TYR 34 CO 0.07 -0.06 -0.33 0.87 -1.32 0.00 0.00 178.16 177.39 1faf h LYS 35 N 0.14 0.17 -0.29 1.82 1.57 -1.36 0.62 116.57 119.24 1faf h LYS 35 Ca 0.22 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.78 1faf h LYS 35 Cb 0.31 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1faf h LYS 35 CO -0.34 0.48 -0.45 1.96 -0.57 0.00 0.00 179.45 180.53 1faf h GLN 36 N 0.15 0.76 0.00 3.15 1.08 -0.72 -2.45 115.11 117.06 1faf h GLN 36 Ca 0.02 -0.42 -0.10 0.00 -1.45 0.00 0.00 58.65 56.69 1faf h GLN 36 Cb 0.66 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.10 1faf h GLN 36 CO 0.05 1.05 -1.26 1.04 -0.95 0.00 0.00 178.83 178.76 1faf n GLN 37 N -4.02 0.61 0.12 1.46 1.13 0.44 -3.87 117.38 113.25 1faf n GLN 37 Ca -0.03 0.18 -0.03 0.00 -1.94 0.00 0.00 57.00 55.19 1faf n GLN 37 Cb 0.57 -1.81 0.14 0.00 0.11 0.00 0.00 30.24 29.24 1faf n GLN 37 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1faf h SER 38 N 0.00 0.08 0.60 1.08 4.64 0.26 -2.42 113.55 117.80 1faf h SER 38 Ca -0.10 -0.05 -0.14 0.00 -0.47 0.00 0.00 61.79 61.02 1faf h SER 38 Cb 1.35 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.40 1faf h SER 38 CO 0.03 0.70 -0.67 -0.07 -0.87 0.00 0.00 176.83 175.95 1faf h LEU 39 N 0.05 0.07 0.00 5.97 3.38 -1.56 -3.04 115.31 120.18 1faf h LEU 39 Ca -0.01 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1faf h LEU 39 Cb 1.14 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1faf h LEU 39 CO 0.09 0.72 -0.48 0.17 0.09 0.00 0.00 178.44 179.02 1faf h LEU 40 N 0.04 0.00 -2.68 1.67 8.10 -1.65 -3.22 115.31 117.57 1faf h LEU 40 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.98 1faf h LEU 40 Cb 1.19 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.41 1faf h LEU 40 CO 0.09 0.12 0.00 0.18 -4.11 0.00 0.00 178.44 174.72 1faf n LEU 41 N -2.97 4.13 -4.75 0.17 4.77 -0.92 -4.68 117.00 112.75 1faf n LEU 41 Ca 0.01 -2.09 -0.40 0.00 -0.03 0.00 0.00 56.01 53.51 1faf n LEU 41 Cb 0.59 -0.56 -0.05 0.00 -2.33 0.00 0.00 43.42 41.07 1faf n LEU 41 CO 0.37 0.62 0.42 -2.28 -1.33 0.00 0.00 177.39 175.20 1faf s HIS 42 N -1.98 3.72 0.40 -1.77 2.46 -1.16 -4.50 115.29 112.47 1faf s HIS 42 Ca 0.41 1.40 0.23 0.00 0.47 0.00 0.00 55.06 57.57 1faf s HIS 42 Cb 0.28 -2.76 1.28 0.00 -0.13 0.00 0.00 32.58 31.25 1faf s HIS 42 CO 0.17 0.29 1.65 -1.35 -2.47 0.00 0.00 174.74 173.03 1faf h PRO 43 N 5.66 0.18 0.00 2.88 0.11 -1.87 1.08 132.00 140.03 1faf h PRO 43 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1faf h PRO 43 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1faf h PRO 43 CO 0.71 0.12 0.00 0.22 -0.21 0.00 0.00 178.00 178.83 1faf h ASP 44 N 0.18 0.00 -0.46 -2.05 3.58 -1.92 -2.15 116.42 113.61 1faf h ASP 44 Ca 0.77 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.97 1faf h ASP 44 Cb 2.15 0.00 -0.15 0.00 1.72 0.00 0.00 39.33 43.05 1faf h ASP 44 CO -0.49 0.00 -0.04 0.29 -2.88 0.00 0.00 179.24 176.12 1faf n LYS 45 N -2.51 2.00 -3.17 0.28 4.76 0.37 -4.97 118.16 114.92 1faf n LYS 45 Ca -0.00 -3.25 -0.07 0.00 -2.87 0.00 0.00 58.31 52.12 1faf n LYS 45 Cb 0.14 -1.89 0.02 0.00 -1.84 0.00 0.00 35.03 31.46 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 -1.10 -1.21 3.26 0.72 0.00 -0.81 -4.84 105.19 101.21 1faf n GLY 46 Ca 0.37 0.51 -0.15 0.00 0.00 0.00 0.00 46.02 46.76 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 -3.12 1.66 0.27 -0.02 0.00 -1.24 -4.99 107.32 99.88 1faf s GLY 47 Ca 0.14 -1.78 -0.09 0.00 0.00 0.00 0.00 44.72 42.99 1faf s GLY 47 CO 0.76 -1.49 0.60 -0.56 0.00 0.00 0.00 173.10 172.41 1faf s SER 48 N -3.25 6.59 -0.05 1.64 0.01 -1.26 -4.49 113.70 112.89 1faf s SER 48 Ca 0.38 0.94 -0.23 0.00 1.31 0.00 0.00 55.95 58.36 1faf s SER 48 Cb 0.07 -2.24 -0.30 0.00 0.21 0.00 0.00 66.02 63.76 1faf s SER 48 CO 0.14 -0.15 0.90 -0.74 0.41 0.00 0.00 173.24 173.80 1faf h HIS 49 N 2.17 0.49 -0.06 2.43 2.76 -2.00 -3.23 115.15 117.71 1faf h HIS 49 Ca -0.47 -0.34 0.02 0.00 -2.20 0.00 0.00 60.37 57.37 1faf h HIS 49 Cb 1.18 -0.02 -0.00 0.00 1.55 0.00 0.00 27.41 30.11 1faf h HIS 49 CO 0.61 1.26 0.08 0.00 -1.30 0.00 0.00 177.93 178.57 1faf h ALA 50 N 0.10 1.52 0.30 5.26 0.00 -1.98 -1.89 119.26 122.57 1faf h ALA 50 Ca -0.12 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1faf h ALA 50 Cb 1.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1faf h ALA 50 CO 0.13 -0.11 -0.14 -0.07 0.00 0.00 0.00 179.25 179.06 1faf h LEU 51 N 0.00 -0.34 -0.69 0.00 4.07 -1.95 -2.27 115.31 114.14 1faf h LEU 51 Ca 0.03 -0.00 0.08 0.00 0.08 0.00 0.00 57.88 58.07 1faf h LEU 51 Cb 0.18 0.09 -0.07 0.00 1.08 0.00 0.00 40.66 41.94 1faf h LEU 51 CO -0.00 0.12 0.35 -0.03 -1.08 0.00 0.00 178.44 177.80 1faf h MET 52 N -1.10 0.59 0.00 1.13 4.05 -1.53 -0.76 114.93 117.31 1faf h MET 52 Ca -0.04 -0.04 -0.07 0.00 -0.28 0.00 0.00 59.70 59.27 1faf h MET 52 Cb 0.32 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.97 1faf h MET 52 CO 0.07 0.39 -0.35 -0.56 0.23 0.00 0.00 176.91 176.69 1faf h GLN 53 N 0.61 0.00 -0.66 0.39 -0.00 -1.47 -2.75 115.11 111.23 1faf h GLN 53 Ca 0.33 0.00 -0.07 0.00 -0.00 0.00 0.00 58.65 58.91 1faf h GLN 53 Cb 0.32 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.77 1faf h GLN 53 CO -0.25 0.35 0.13 0.93 -0.00 0.00 0.00 178.83 179.99 1faf h GLU 54 N 0.00 1.06 -0.20 0.06 5.08 -0.52 -2.64 114.58 117.42 1faf h GLU 54 Ca -0.00 -0.26 -0.12 0.00 -1.00 0.00 0.00 59.36 57.97 1faf h GLU 54 Cb 0.62 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 1faf h GLU 54 CO 0.05 0.96 -0.39 1.25 -1.00 0.00 0.00 179.01 179.87 1faf h LEU 55 N 1.00 0.48 -1.45 1.33 5.85 -1.18 -2.83 115.31 118.52 1faf h LEU 55 Ca 0.21 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1faf h LEU 55 Cb 0.39 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1faf h LEU 55 CO 0.01 0.83 -0.26 -1.13 -0.34 0.00 0.00 178.44 177.55 1faf h ASN 56 N 0.38 0.02 0.49 1.25 -0.73 -1.26 0.93 115.58 116.67 1faf h ASN 56 Ca 0.04 -0.01 -0.12 0.00 1.87 0.00 0.00 56.30 58.08 1faf h ASN 56 Cb 0.86 -0.01 -0.02 0.00 0.27 0.00 0.00 38.32 39.43 1faf h ASN 56 CO 0.07 0.29 -0.56 0.28 -0.37 0.00 0.00 177.43 177.14 1faf h SER 57 N 0.02 0.08 0.56 1.15 0.02 -1.23 0.75 113.55 114.91 1faf h SER 57 Ca 0.00 -0.04 -0.27 0.00 -0.84 0.00 0.00 61.79 60.64 1faf h SER 57 Cb 0.47 -0.02 -0.05 0.00 0.14 0.00 0.00 62.40 62.94 1faf h SER 57 CO 0.03 0.63 -1.62 -0.07 -1.14 0.00 0.00 176.83 174.66 1faf h LEU 58 N 0.06 0.00 0.00 5.07 3.38 -1.39 -3.22 115.31 119.21 1faf h LEU 58 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1faf h LEU 58 Cb 1.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1faf h LEU 58 CO 0.08 0.93 -0.99 -0.25 0.09 0.00 0.00 178.44 178.30 1faf h TRP 59 N 0.00 0.00 0.29 1.13 2.91 -0.80 -3.14 115.95 116.34 1faf h TRP 59 Ca -0.25 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.76 1faf h TRP 59 Cb 1.93 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 30.58 1faf h TRP 59 CO 0.00 0.14 -0.14 0.78 -1.03 0.00 0.00 178.44 178.19 1faf h GLY 60 N 3.92 -0.40 0.51 2.65 0.00 0.40 0.94 103.07 111.08 1faf h GLY 60 Ca -0.04 0.15 0.05 0.00 0.00 0.00 0.00 47.33 47.50 1faf h GLY 60 CO 0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 176.54 176.40 1faf h THR 61 N -1.08 0.77 -0.47 4.70 1.03 -1.74 -0.91 112.91 115.20 1faf h THR 61 Ca -0.04 -0.03 0.08 0.00 -0.01 0.00 0.00 66.41 66.42 1faf h THR 61 Cb 0.30 0.68 -0.10 0.00 -1.07 0.00 0.00 68.15 67.96 1faf h THR 61 CO 0.06 0.02 -0.37 0.15 -0.01 0.00 0.00 175.52 175.37 1faf h PHE 62 N 0.08 -1.05 -1.02 0.00 3.57 -1.64 0.23 116.94 117.11 1faf h PHE 62 Ca 0.15 0.07 0.25 0.00 3.53 0.00 0.00 57.97 61.96 1faf h PHE 62 Cb 0.20 0.53 -0.10 0.00 2.79 0.00 0.00 35.95 39.37 1faf h PHE 62 CO -0.23 -0.40 0.64 -0.22 -2.23 0.00 0.00 178.31 175.86 1faf h LYS 63 N -0.25 0.49 -0.79 1.11 3.64 0.55 0.70 116.57 122.02 1faf h LYS 63 Ca 0.18 -0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.63 1faf h LYS 63 Cb 0.56 -0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 32.19 1faf h LYS 63 CO -0.60 0.32 0.42 1.15 -2.27 0.00 0.00 179.45 178.47 1faf h THR 64 N 0.50 0.85 0.00 1.00 2.02 0.26 0.96 112.91 118.50 1faf h THR 64 Ca 0.60 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.53 1faf h THR 64 Cb 1.33 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1faf h THR 64 CO -0.36 0.13 -0.53 1.05 0.37 0.00 0.00 175.52 176.18 1faf h GLU 65 N 0.69 0.00 -0.94 6.66 -0.00 -0.14 -3.32 114.58 117.52 1faf h GLU 65 Ca 0.39 0.00 0.07 0.00 -0.00 0.00 0.00 59.36 59.82 1faf h GLU 65 Cb 0.42 0.00 -0.07 0.00 -0.00 0.00 0.00 28.75 29.10 1faf h GLU 65 CO -0.28 0.05 0.60 0.28 -0.00 0.00 0.00 179.01 179.66 1faf h VAL 66 N 0.00 1.06 -0.45 -1.06 2.07 0.27 0.93 116.25 119.08 1faf h VAL 66 Ca -0.01 -0.37 -0.11 0.00 0.82 0.00 0.00 66.70 67.03 1faf h VAL 66 Cb 1.06 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1faf h VAL 66 CO 0.01 0.20 -0.17 1.88 0.02 0.00 0.00 177.57 179.50 1faf h TYR 67 N 1.08 0.98 0.00 1.57 -1.99 -1.53 -2.90 116.97 114.19 1faf h TYR 67 Ca 0.41 -0.21 0.00 0.00 2.00 0.00 0.00 58.73 60.93 1faf h TYR 67 Cb 0.18 -0.24 0.00 0.00 2.00 0.00 0.00 36.73 38.67 1faf h TYR 67 CO -0.02 0.97 -0.40 0.27 -0.00 0.00 0.00 178.16 178.98 1faf n ASN 68 N -4.13 0.46 -0.21 3.88 0.23 -0.68 -3.94 115.26 110.88 1faf n ASN 68 Ca 0.01 0.04 -0.09 0.00 -0.53 0.00 0.00 54.58 54.00 1faf n ASN 68 Cb 0.42 0.02 0.02 0.00 -2.08 0.00 0.00 39.78 38.16 1faf n ASN 68 CO 0.00 0.00 0.00 0.17 -0.93 0.00 0.00 177.26 176.50 1faf h LEU 69 N 0.00 1.05 0.00 -4.53 8.10 0.11 -2.27 115.31 117.77 1faf h LEU 69 Ca 0.00 -0.31 0.00 0.00 0.11 0.00 0.00 57.88 57.68 1faf h LEU 69 Cb 0.57 -0.28 0.00 0.00 -0.44 0.00 0.00 40.66 40.51 1faf h LEU 69 CO 0.00 1.11 0.00 0.54 -4.11 0.00 0.00 178.44 175.98 1faf n ARG 70 N -4.18 0.90 -0.11 0.17 1.74 -1.24 -2.72 116.66 111.23 1faf n ARG 70 Ca 0.03 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.16 1faf n ARG 70 Cb 0.36 -1.44 0.11 0.00 -1.02 0.00 0.00 32.46 30.47 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 -0.94 2.32 0.00 5.56 2.81 -0.87 -4.81 117.12 121.20 1faf n MET 71 Ca 0.19 -2.15 0.00 0.00 -1.81 0.00 0.00 57.70 53.93 1faf n MET 71 Cb 0.09 -1.33 0.00 0.00 -0.71 0.00 0.00 33.22 31.27 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 -0.73 0.00 -4.51 7.83 5.03 -1.10 -4.82 115.26 116.94 1faf n ASN 72 Ca 0.10 0.00 -0.43 0.00 0.87 0.00 0.00 54.58 55.13 1faf n ASN 72 Cb 0.50 -0.31 -0.02 0.00 -1.02 0.00 0.00 39.78 38.93 1faf n ASN 72 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1faf s LEU 73 N -4.33 4.26 0.00 3.41 1.43 -1.26 -4.92 118.68 117.27 1faf s LEU 73 Ca 0.00 -1.98 0.00 0.00 -1.03 0.00 0.00 54.13 51.12 1faf s LEU 73 Cb 0.00 -2.49 0.00 0.00 0.03 0.00 0.00 46.19 43.73 1faf s LEU 73 CO 0.00 -1.22 0.00 0.61 0.23 0.00 0.00 176.35 175.97 1faf n GLY 74 N 5.87 4.27 0.00 -3.19 0.00 -1.26 -5.04 105.19 105.84 1faf n GLY 74 Ca 0.33 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.62 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 0.90 0.00 3.72 -0.02 0.00 -1.26 -5.13 105.19 103.39 1faf n GLY 75 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 4.00 0.00 2.61 -4.23 -1.26 -3.66 115.64 113.10 1faf s THR 76 Ca 0.00 1.48 0.00 0.00 -1.18 0.00 0.00 61.69 61.99 1faf s THR 76 Cb 0.00 -3.95 0.00 0.00 1.34 0.00 0.00 72.50 69.89 1faf s THR 76 CO 0.00 0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.83 1faf n GLY 77 N 3.01 2.76 3.64 3.99 0.00 -1.26 -4.99 105.19 112.35 1faf n GLY 77 Ca 0.08 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 3.33 -2.54 1.61 0.40 -1.24 -5.36 117.98 114.17 1faf s PHE 78 Ca 0.00 0.82 0.28 0.00 -0.60 0.00 0.00 56.93 57.43 1faf s PHE 78 Cb 0.00 -2.78 0.98 0.00 0.51 0.00 0.00 43.02 41.73 1faf s PHE 78 CO 0.00 -0.23 1.70 1.04 0.70 0.00 0.00 175.22 178.44