#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 6.61 -0.93 7.83 2.15 -1.26 -4.98 116.67 126.10 1faf s ASP 2 Ca 0.00 2.27 -0.15 0.00 0.43 0.00 0.00 52.55 55.09 1faf s ASP 2 Cb 0.00 -2.61 0.19 0.00 -0.30 0.00 0.00 42.92 40.20 1faf s ASP 2 CO 0.00 -0.61 0.99 -0.13 -0.17 0.00 0.00 175.17 175.26 1faf s ARG 3 N -2.30 3.71 -0.05 4.34 0.52 -1.26 -4.99 118.95 118.91 1faf s ARG 3 Ca 0.57 -2.29 0.01 0.00 -0.52 0.00 0.00 55.73 53.50 1faf s ARG 3 Cb -0.29 -4.68 0.02 0.00 0.52 0.00 0.00 34.95 30.53 1faf s ARG 3 CO 0.36 -1.51 -0.04 0.14 0.02 0.00 0.00 175.30 174.27 1faf s VAL 4 N 1.09 0.56 0.42 3.52 -7.23 -1.26 -4.75 120.40 112.75 1faf s VAL 4 Ca 0.27 -0.11 -0.17 0.00 -1.81 0.00 0.00 61.98 60.16 1faf s VAL 4 Cb -0.07 -0.59 -0.09 0.00 0.56 0.00 0.00 36.38 36.18 1faf s VAL 4 CO -0.08 0.24 0.88 -1.48 -0.31 0.00 0.00 175.10 174.34 1faf s LEU 5 N 1.07 3.87 0.00 1.32 2.34 -1.26 -5.08 118.68 120.93 1faf s LEU 5 Ca -0.09 1.47 -0.03 0.00 0.06 0.00 0.00 54.13 55.55 1faf s LEU 5 Cb -0.14 -4.34 0.15 0.00 -0.56 0.00 0.00 46.19 41.30 1faf s LEU 5 CO -0.01 -0.39 0.98 -1.54 -1.06 0.00 0.00 176.35 174.33 1faf n SER 6 N -0.92 1.06 -0.00 1.48 3.41 -1.26 -4.81 113.62 112.58 1faf n SER 6 Ca 0.05 -1.95 0.17 0.00 -0.26 0.00 0.00 58.87 56.88 1faf n SER 6 Cb 0.54 -0.65 0.64 0.00 -0.26 0.00 0.00 64.21 64.47 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 0.10 -0.32 4.33 -0.00 -1.99 -0.89 114.38 115.61 1faf h ARG 7 Ca -0.32 -0.01 -0.08 0.00 -0.00 0.00 0.00 59.98 59.57 1faf h ARG 7 Cb 1.13 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.97 31.06 1faf h ARG 7 CO 0.32 0.06 -0.12 0.00 -0.00 0.00 0.00 179.97 180.23 1faf h ALA 8 N 1.75 0.45 0.54 0.08 0.00 -1.97 -1.59 119.26 118.51 1faf h ALA 8 Ca 0.24 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1faf h ALA 8 Cb 0.82 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1faf h ALA 8 CO -0.02 0.33 -0.26 -0.44 0.00 0.00 0.00 179.25 178.85 1faf h ASP 9 N 0.42 -0.61 -0.65 0.00 5.19 -1.54 0.30 116.42 119.52 1faf h ASP 9 Ca 0.08 -0.05 0.09 0.00 -0.62 0.00 0.00 57.03 56.53 1faf h ASP 9 Cb 0.64 0.16 -0.07 0.00 0.18 0.00 0.00 39.33 40.24 1faf h ASP 9 CO 0.04 -0.24 0.28 0.07 -3.12 0.00 0.00 179.24 176.27 1faf h LYS 10 N -1.05 0.47 0.00 3.56 5.09 -1.43 0.99 116.57 124.19 1faf h LYS 10 Ca -0.07 -0.03 -0.07 0.00 0.09 0.00 0.00 60.65 60.57 1faf h LYS 10 Cb 0.63 -0.11 -0.01 0.00 0.10 0.00 0.00 32.23 32.84 1faf h LYS 10 CO 0.12 0.31 -0.32 0.93 -2.09 0.00 0.00 179.45 178.40 1faf h GLU 11 N 0.48 0.00 0.09 0.07 4.39 -1.32 -2.47 114.58 115.83 1faf h GLU 11 Ca 0.33 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.79 1faf h GLU 11 Cb 0.38 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.05 1faf h GLU 11 CO -0.29 0.32 -0.96 -0.09 -1.16 0.00 0.00 179.01 176.83 1faf h ARG 12 N 0.00 0.49 -0.12 2.33 2.43 0.15 -3.21 114.38 116.46 1faf h ARG 12 Ca -0.00 -0.65 0.02 0.00 -0.81 0.00 0.00 59.98 58.54 1faf h ARG 12 Cb 0.64 0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.40 1faf h ARG 12 CO 0.04 1.27 0.08 1.25 -1.51 0.00 0.00 179.97 181.10 1faf h LEU 13 N 0.01 0.04 -0.73 3.80 5.85 0.10 -0.81 115.31 123.58 1faf h LEU 13 Ca -0.15 -0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.47 1faf h LEU 13 Cb 1.68 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.68 1faf h LEU 13 CO 0.18 0.03 -0.13 -0.07 -0.34 0.00 0.00 178.44 178.11 1faf h LEU 14 N 0.05 0.83 -0.77 2.25 3.38 -1.45 -1.04 115.31 118.56 1faf h LEU 14 Ca 0.05 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1faf h LEU 14 Cb 0.15 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1faf h LEU 14 CO -0.00 0.97 0.50 -0.33 0.09 0.00 0.00 178.44 179.67 1faf h GLU 15 N 0.74 0.99 0.00 1.13 4.39 -1.15 -0.65 114.58 120.03 1faf h GLU 15 Ca 0.12 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1faf h GLU 15 Cb 0.64 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1faf h GLU 15 CO 0.04 0.66 0.00 -0.07 -1.16 0.00 0.00 179.01 178.48 1faf h LEU 16 N 1.02 0.00 -0.33 1.33 4.07 -1.37 -3.07 115.31 116.97 1faf h LEU 16 Ca 0.29 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.25 1faf h LEU 16 Cb -0.09 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.65 1faf h LEU 16 CO -0.07 0.00 -0.33 0.18 -1.08 0.00 0.00 178.44 177.14 1faf n LEU 17 N -2.61 0.84 -1.54 1.67 7.99 -0.41 -4.79 117.00 118.15 1faf n LEU 17 Ca 0.04 -0.17 -0.12 0.00 -0.01 0.00 0.00 56.01 55.75 1faf n LEU 17 Cb 0.44 -0.16 -0.05 0.00 -0.11 0.00 0.00 43.42 43.54 1faf n LEU 17 CO 0.31 0.17 -0.13 0.29 -1.51 0.00 0.00 177.39 176.52 1faf n LYS 18 N -0.93 -1.43 -3.87 3.23 5.02 -0.38 -4.72 118.16 115.09 1faf n LYS 18 Ca 0.10 0.72 -0.36 0.00 -2.02 0.00 0.00 58.31 56.75 1faf n LYS 18 Cb 0.34 -5.01 -0.13 0.00 -0.02 0.00 0.00 35.03 30.21 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 -3.98 3.68 1.03 -0.35 0.20 -1.14 -5.08 118.68 113.05 1faf s LEU 19 Ca 0.00 -0.96 -0.19 0.00 0.69 0.00 0.00 54.13 53.66 1faf s LEU 19 Cb 0.00 -1.76 -0.03 0.00 -0.43 0.00 0.00 46.19 43.97 1faf s LEU 19 CO 0.00 -0.20 -0.45 -2.65 -0.29 0.00 0.00 176.35 172.76 1faf n PRO 20 N 4.73 -0.65 0.00 0.98 -0.02 -1.26 -4.71 135.00 134.06 1faf n PRO 20 Ca -0.15 -0.18 0.13 0.00 -2.02 0.00 0.00 63.50 61.29 1faf n PRO 20 Cb 0.46 -1.44 0.41 0.00 -0.02 0.00 0.00 33.50 32.91 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 -0.07 1.03 0.09 -0.52 1.74 -1.26 -3.92 116.66 113.75 1faf n ARG 21 Ca 0.01 -0.60 -0.12 0.00 -0.77 0.00 0.00 57.85 56.37 1faf n ARG 21 Cb 0.63 -1.49 -0.07 0.00 -1.02 0.00 0.00 32.46 30.51 1faf n ARG 21 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 1faf h GLN 22 N 1.47 0.26 -0.68 5.56 4.15 -2.05 -3.22 115.11 120.59 1faf h GLN 22 Ca 0.00 -0.34 0.00 0.00 0.77 0.00 0.00 58.65 59.08 1faf h GLN 22 Cb 0.51 0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.30 1faf h GLN 22 CO 0.00 1.08 0.00 1.47 -1.93 0.00 0.00 178.83 179.45 1faf n LEU 23 N -3.61 4.16 -4.52 -2.39 -0.00 -1.25 -4.95 117.00 104.43 1faf n LEU 23 Ca -0.06 -2.15 -0.40 0.00 -0.00 0.00 0.00 56.01 53.40 1faf n LEU 23 Cb 0.90 -0.50 -0.07 0.00 -0.00 0.00 0.00 43.42 43.74 1faf n LEU 23 CO 0.51 0.92 2.05 1.87 -0.00 0.00 0.00 177.39 182.73 1faf n TRP 24 N 1.39 1.20 0.00 1.47 -0.00 -1.22 -2.66 117.44 117.62 1faf n TRP 24 Ca 0.24 0.22 0.00 0.00 -0.00 0.00 0.00 57.50 57.96 1faf n TRP 24 Cb 0.70 -2.54 0.00 0.00 -0.00 0.00 0.00 31.31 29.47 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 6.25 0.54 3.57 5.87 0.00 -1.26 -5.08 105.19 115.08 1faf n GLY 25 Ca 0.47 0.00 -0.39 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 6.39 0.29 1.61 2.15 -1.09 -4.79 116.67 121.23 1faf s ASP 26 Ca 0.00 -1.71 0.03 0.00 0.43 0.00 0.00 52.55 51.30 1faf s ASP 26 Cb 0.00 -2.57 0.74 0.00 -0.30 0.00 0.00 42.92 40.79 1faf s ASP 26 CO 0.00 -1.61 1.63 0.15 -0.17 0.00 0.00 175.17 175.16 1faf h PHE 27 N 9.22 0.29 -0.58 -5.34 3.57 -1.98 0.48 116.94 122.60 1faf h PHE 27 Ca 0.27 0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.83 1faf h PHE 27 Cb 0.96 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.69 1faf h PHE 27 CO 1.32 -0.27 0.38 0.78 -2.23 0.00 0.00 178.31 178.29 1faf h GLY 28 N 0.15 0.81 0.22 2.40 0.00 -1.99 0.63 103.07 105.30 1faf h GLY 28 Ca 0.57 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.60 1faf h GLY 28 CO -0.71 0.29 -0.04 -0.09 0.00 0.00 0.00 176.54 175.99 1faf h ARG 29 N 0.78 -0.12 -0.46 4.80 2.43 -0.52 -2.85 114.38 118.44 1faf h ARG 29 Ca 0.21 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.42 1faf h ARG 29 Cb -0.08 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 1faf h ARG 29 CO -0.05 0.38 0.25 0.00 -1.51 0.00 0.00 179.97 179.05 1faf h MET 30 N -0.90 0.49 -0.79 0.20 -0.00 -1.10 -1.67 114.93 111.16 1faf h MET 30 Ca -0.01 -0.03 0.04 0.00 -0.00 0.00 0.00 59.70 59.70 1faf h MET 30 Cb 0.56 -0.11 -0.05 0.00 -0.00 0.00 0.00 31.60 32.00 1faf h MET 30 CO 0.02 0.33 0.52 0.37 -0.00 0.00 0.00 176.91 178.15 1faf h GLN 31 N 0.51 0.94 -0.76 -0.10 4.15 -0.99 0.33 115.11 119.18 1faf h GLN 31 Ca 0.19 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.52 1faf h GLN 31 Cb 0.06 -0.21 -0.03 0.00 0.21 0.00 0.00 27.48 27.50 1faf h GLN 31 CO -0.11 0.62 0.35 1.96 -1.93 0.00 0.00 178.83 179.72 1faf h GLN 32 N 0.97 1.11 -0.15 1.69 1.08 -1.08 -2.18 115.11 116.55 1faf h GLN 32 Ca 0.32 -0.17 -0.20 0.00 -1.45 0.00 0.00 58.65 57.14 1faf h GLN 32 Cb 0.06 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.30 1faf h GLN 32 CO -0.09 0.88 -0.71 0.00 -0.95 0.00 0.00 178.83 177.95 1faf h ALA 33 N 1.18 0.46 -0.83 3.87 0.00 -0.44 -2.75 119.26 120.75 1faf h ALA 33 Ca 0.26 -0.58 0.10 0.00 0.00 0.00 0.00 54.91 54.69 1faf h ALA 33 Cb 0.14 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.82 1faf h ALA 33 CO -0.03 0.71 0.47 -0.92 0.00 0.00 0.00 179.25 179.48 1faf h TYR 34 N 0.47 0.85 0.00 0.00 5.03 -0.04 0.29 116.97 123.57 1faf h TYR 34 Ca -0.03 0.03 -0.12 0.00 2.58 0.00 0.00 58.73 61.19 1faf h TYR 34 Cb 1.31 -0.26 -0.02 0.00 1.55 0.00 0.00 36.73 39.32 1faf h TYR 34 CO 0.07 0.33 -0.58 0.87 -1.32 0.00 0.00 178.16 177.53 1faf h LYS 35 N 0.77 0.00 -0.34 1.82 1.79 -1.37 0.31 116.57 119.56 1faf h LYS 35 Ca 0.41 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.82 1faf h LYS 35 Cb 0.40 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1faf h LYS 35 CO -0.26 0.58 0.00 0.37 -1.08 0.00 0.00 179.45 179.06 1faf h GLN 36 N 0.00 0.59 0.00 3.15 -0.00 -0.68 -2.78 115.11 115.40 1faf h GLN 36 Ca -0.01 -0.19 -0.04 0.00 -0.00 0.00 0.00 58.65 58.42 1faf h GLN 36 Cb 1.03 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 28.45 1faf h GLN 36 CO 0.08 0.71 -0.62 1.96 0.00 0.00 0.00 178.83 180.96 1faf h GLN 37 N 0.40 0.00 -0.04 1.69 1.08 -1.22 -3.30 115.11 113.73 1faf h GLN 37 Ca 0.10 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.22 1faf h GLN 37 Cb 0.44 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.86 1faf h GLN 37 CO 0.02 0.12 -0.33 0.77 -0.95 0.00 0.00 178.83 178.45 1faf h SER 38 N 0.00 0.06 0.55 1.46 0.02 -0.83 -0.75 113.55 114.06 1faf h SER 38 Ca -0.02 -0.02 -0.16 0.00 -0.84 0.00 0.00 61.79 60.75 1faf h SER 38 Cb 1.14 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.64 1faf h SER 38 CO 0.02 0.39 -0.71 -0.07 -1.14 0.00 0.00 176.83 175.32 1faf h LEU 39 N 0.06 0.16 0.00 5.07 3.38 -1.57 -2.71 115.31 119.71 1faf h LEU 39 Ca 0.01 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1faf h LEU 39 Cb 0.61 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1faf h LEU 39 CO 0.04 0.82 -0.60 0.00 0.09 0.00 0.00 178.44 178.79 1faf n LEU 40 N -3.75 0.60 0.00 1.67 -0.00 -1.02 -3.73 117.00 110.77 1faf n LEU 40 Ca -0.02 0.13 0.11 0.00 -0.00 0.00 0.00 56.01 56.22 1faf n LEU 40 Cb 0.69 -0.21 0.05 0.00 -0.00 0.00 0.00 43.42 43.96 1faf n LEU 40 CO 0.45 0.02 0.15 0.18 -0.00 0.00 0.00 177.39 178.19 1faf n LEU 41 N -1.85 0.71 -4.73 1.47 4.77 -0.32 -3.66 117.00 113.40 1faf n LEU 41 Ca 0.04 -0.20 -0.42 0.00 -0.03 0.00 0.00 56.01 55.40 1faf n LEU 41 Cb 0.40 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 1faf n LEU 41 CO 0.36 0.16 1.12 -2.28 -1.33 0.00 0.00 177.39 175.42 1faf s HIS 42 N -3.04 3.09 -0.53 -1.77 2.46 -1.03 -3.24 115.29 111.23 1faf s HIS 42 Ca 0.08 0.92 0.10 0.00 0.47 0.00 0.00 55.06 56.63 1faf s HIS 42 Cb 0.16 -3.81 0.54 0.00 -0.13 0.00 0.00 32.58 29.35 1faf s HIS 42 CO 0.79 -2.76 1.27 -0.35 -2.47 0.00 0.00 174.74 171.23 1faf n PRO 43 N 3.07 0.06 0.17 2.88 -0.04 -1.24 -0.95 135.00 138.95 1faf n PRO 43 Ca 0.09 0.54 0.09 0.00 -0.04 0.00 0.00 63.50 64.18 1faf n PRO 43 Cb 0.40 -1.77 0.08 0.00 -0.04 0.00 0.00 33.50 32.18 1faf n PRO 43 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1faf h ASP 44 N 0.00 0.00 -0.48 3.54 5.19 -1.89 -3.28 116.42 119.49 1faf h ASP 44 Ca 0.00 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 56.18 1faf h ASP 44 Cb 0.11 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 39.48 1faf h ASP 44 CO 0.00 0.17 0.07 0.29 -3.12 0.00 0.00 179.24 176.65 1faf n LYS 45 N -3.04 2.05 0.00 3.56 4.76 -0.12 -4.90 118.16 120.46 1faf n LYS 45 Ca 0.02 -3.13 0.00 0.00 -2.87 0.00 0.00 58.31 52.33 1faf n LYS 45 Cb 0.61 -1.90 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 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 -1.05 2.21 3.64 0.72 0.00 -1.23 -4.93 105.19 104.54 1faf n GLY 46 Ca 0.38 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.96 1.64 0.33 -0.02 0.00 -0.62 -4.92 107.32 101.76 1faf s GLY 47 Ca 0.00 0.26 -0.07 0.00 0.00 0.00 0.00 44.72 44.91 1faf s GLY 47 CO 0.00 0.77 0.62 -0.56 0.00 0.00 0.00 173.10 173.93 1faf s SER 48 N -2.81 6.47 -0.00 1.64 0.01 -1.20 -3.72 113.70 114.08 1faf s SER 48 Ca 0.66 0.85 -0.18 0.00 1.31 0.00 0.00 55.95 58.59 1faf s SER 48 Cb -0.22 -2.20 -0.34 0.00 0.21 0.00 0.00 66.02 63.47 1faf s SER 48 CO 0.59 -0.26 0.95 -0.74 0.41 0.00 0.00 173.24 174.19 1faf h HIS 49 N 1.55 0.81 0.00 2.43 2.76 -1.96 -2.82 115.15 117.92 1faf h HIS 49 Ca -0.47 -0.59 -0.05 0.00 -2.20 0.00 0.00 60.37 57.05 1faf h HIS 49 Cb 1.19 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 30.11 1faf h HIS 49 CO 0.59 1.47 -0.26 0.00 -1.30 0.00 0.00 177.93 178.43 1faf h ALA 50 N 0.12 1.37 0.01 5.26 0.00 -1.95 -1.99 119.26 122.07 1faf h ALA 50 Ca -0.22 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1faf h ALA 50 Cb 1.96 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.71 1faf h ALA 50 CO 0.23 0.32 -0.00 -0.07 0.00 0.00 0.00 179.25 179.73 1faf h LEU 51 N 0.00 -0.01 -0.70 0.00 4.07 -1.92 -2.72 115.31 114.04 1faf h LEU 51 Ca -0.00 -0.83 0.04 0.00 0.08 0.00 0.00 57.88 57.17 1faf h LEU 51 Cb 0.53 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.22 1faf h LEU 51 CO 0.03 0.88 0.42 -0.03 -1.08 0.00 0.00 178.44 178.66 1faf h MET 52 N -0.95 0.77 -0.18 1.13 4.05 -1.47 -1.59 114.93 116.70 1faf h MET 52 Ca -0.00 -0.05 -0.09 0.00 -0.28 0.00 0.00 59.70 59.29 1faf h MET 52 Cb 0.84 -0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 31.45 1faf h MET 52 CO 0.00 0.51 -0.27 -0.56 0.23 0.00 0.00 176.91 176.83 1faf h GLN 53 N 0.80 0.34 0.13 0.39 3.07 -1.49 -2.44 115.11 115.91 1faf h GLN 53 Ca 0.30 -0.12 -0.01 0.00 0.09 0.00 0.00 58.65 58.91 1faf h GLN 53 Cb 0.10 -0.02 0.00 0.00 0.08 0.00 0.00 27.48 27.64 1faf h GLN 53 CO -0.14 0.58 -0.06 1.49 0.09 0.00 0.00 178.83 180.79 1faf h GLU 54 N 0.30 -0.16 -0.45 0.06 4.57 -0.96 -2.21 114.58 115.73 1faf h GLU 54 Ca 0.05 0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.18 1faf h GLU 54 Cb 0.63 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.24 1faf h GLU 54 CO 0.05 -0.10 0.06 1.25 -1.18 0.00 0.00 179.01 179.09 1faf h LEU 55 N -0.18 0.66 -1.77 1.64 5.85 -1.37 -1.85 115.31 118.29 1faf h LEU 55 Ca -0.02 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 1faf h LEU 55 Cb 0.14 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 1faf h LEU 55 CO 0.03 0.69 -0.06 -1.13 -0.34 0.00 0.00 178.44 177.63 1faf h ASN 56 N 0.67 0.06 0.56 1.25 -0.73 -1.12 0.85 115.58 117.13 1faf h ASN 56 Ca 0.14 -0.01 -0.29 0.00 1.87 0.00 0.00 56.30 58.02 1faf h ASN 56 Cb 0.33 -0.02 -0.01 0.00 0.27 0.00 0.00 38.32 38.89 1faf h ASN 56 CO 0.01 0.13 -1.42 0.28 -0.37 0.00 0.00 177.43 176.06 1faf h SER 57 N 0.07 0.32 1.48 1.15 0.02 -0.80 -2.74 113.55 113.05 1faf h SER 57 Ca 0.02 -0.42 -0.05 0.00 -0.84 0.00 0.00 61.79 60.50 1faf h SER 57 Cb 0.15 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 1faf h SER 57 CO 0.01 1.35 -0.24 -0.07 -1.14 0.00 0.00 176.83 176.73 1faf h LEU 58 N 0.06 0.00 0.00 5.07 3.38 -0.86 -2.83 115.31 120.13 1faf h LEU 58 Ca -0.20 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1faf h LEU 58 Cb 1.98 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.72 1faf h LEU 58 CO 0.16 0.24 -1.15 1.87 0.09 0.00 0.00 178.44 179.65 1faf n TRP 59 N -3.21 0.94 0.04 1.13 -0.00 0.25 -3.16 117.44 113.43 1faf n TRP 59 Ca 0.02 0.28 -0.03 0.00 -0.00 0.00 0.00 57.50 57.77 1faf n TRP 59 Cb 0.57 -0.98 -0.01 0.00 -0.00 0.00 0.00 31.31 30.88 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 3.93 -0.20 0.26 5.87 0.00 -1.42 -1.68 103.07 109.82 1faf h GLY 60 Ca -0.04 0.08 0.08 0.00 0.00 0.00 0.00 47.33 47.44 1faf h GLY 60 CO 0.01 -0.07 -0.08 0.00 0.00 0.00 0.00 176.54 176.40 1faf h THR 61 N -0.91 0.63 -0.71 4.70 1.03 -1.70 0.11 112.91 116.06 1faf h THR 61 Ca -0.02 -0.00 0.14 0.00 -0.01 0.00 0.00 66.41 66.52 1faf h THR 61 Cb 0.15 0.62 -0.14 0.00 -1.07 0.00 0.00 68.15 67.71 1faf h THR 61 CO 0.03 0.00 -0.21 0.15 -0.01 0.00 0.00 175.52 175.49 1faf h PHE 62 N 0.01 -0.48 -0.64 0.00 3.57 -1.67 0.82 116.94 118.56 1faf h PHE 62 Ca 0.18 0.07 0.09 0.00 3.53 0.00 0.00 57.97 61.84 1faf h PHE 62 Cb 0.28 0.32 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 1faf h PHE 62 CO -0.33 -0.33 0.43 -0.22 -2.23 0.00 0.00 178.31 175.63 1faf h LYS 63 N -0.02 0.52 -1.02 1.11 3.64 0.15 0.14 116.57 121.09 1faf h LYS 63 Ca 0.33 -0.03 0.25 0.00 -1.27 0.00 0.00 60.65 59.94 1faf h LYS 63 Cb 0.54 -0.12 -0.09 0.00 -0.41 0.00 0.00 32.23 32.15 1faf h LYS 63 CO -0.75 0.35 0.66 1.15 -2.27 0.00 0.00 179.45 178.59 1faf h THR 64 N 0.54 0.56 0.01 1.00 2.02 0.18 0.91 112.91 118.13 1faf h THR 64 Ca 0.29 -0.14 -0.26 0.00 0.77 0.00 0.00 66.41 67.07 1faf h THR 64 Cb 0.43 0.11 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 1faf h THR 64 CO -0.09 0.07 -1.42 -0.33 0.37 0.00 0.00 175.52 174.12 1faf h GLU 65 N 0.41 0.03 -0.50 6.66 4.39 -0.97 -3.32 114.58 121.27 1faf h GLU 65 Ca 0.57 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 60.22 1faf h GLU 65 Cb 1.44 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 30.08 1faf h GLU 65 CO -0.27 0.75 0.28 0.28 -1.16 0.00 0.00 179.01 178.89 1faf h VAL 66 N 0.01 1.15 -0.50 3.13 2.07 0.17 0.38 116.25 122.66 1faf h VAL 66 Ca -0.18 -0.37 -0.07 0.00 0.82 0.00 0.00 66.70 66.90 1faf h VAL 66 Cb 1.92 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1faf h VAL 66 CO 0.11 0.16 0.01 1.88 0.02 0.00 0.00 177.57 179.75 1faf h TYR 67 N 0.69 0.88 0.00 1.57 -1.99 -0.62 -2.72 116.97 114.79 1faf h TYR 67 Ca 0.18 -0.12 0.00 0.00 2.00 0.00 0.00 58.73 60.79 1faf h TYR 67 Cb 0.01 -0.24 0.00 0.00 2.00 0.00 0.00 36.73 38.49 1faf h TYR 67 CO 0.00 0.80 -0.67 0.27 -0.00 0.00 0.00 178.16 178.57 1faf n ASN 68 N -4.22 0.61 -0.03 3.88 0.23 -0.76 -3.99 115.26 110.98 1faf n ASN 68 Ca 0.03 -0.09 0.01 0.00 -0.53 0.00 0.00 54.58 54.00 1faf n ASN 68 Cb 0.30 0.33 0.33 0.00 -2.08 0.00 0.00 39.78 38.66 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 0.54 -0.47 -4.53 8.10 0.06 -0.06 115.31 118.95 1faf h LEU 69 Ca 0.00 -0.06 0.00 0.00 0.11 0.00 0.00 57.88 57.93 1faf h LEU 69 Cb 0.65 -0.14 0.00 0.00 -0.44 0.00 0.00 40.66 40.73 1faf h LEU 69 CO 0.00 0.50 0.00 0.54 -4.11 0.00 0.00 178.44 175.37 1faf n ARG 70 N -4.36 1.32 -0.02 0.17 5.12 -1.24 -1.02 116.66 116.63 1faf n ARG 70 Ca 0.03 -0.46 0.07 0.00 -1.93 0.00 0.00 57.85 55.55 1faf n ARG 70 Cb 0.16 -1.44 -0.13 0.00 -1.16 0.00 0.00 32.46 29.88 1faf n ARG 70 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1faf n MET 71 N -0.40 0.62 0.00 5.56 2.81 -0.10 -4.58 117.12 121.02 1faf n MET 71 Ca 0.20 -0.14 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 1faf n MET 71 Cb 0.21 -1.41 0.00 0.00 -0.71 0.00 0.00 33.22 31.31 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 -2.16 0.00 0.00 7.83 4.13 -0.79 -4.93 115.26 119.34 1faf n ASN 72 Ca -0.06 0.17 0.00 0.00 1.68 0.00 0.00 54.58 56.37 1faf n ASN 72 Cb 0.52 -0.35 0.00 0.00 -1.54 0.00 0.00 39.78 38.41 1faf n ASN 72 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1faf n LEU 73 N -1.89 2.22 -0.45 3.41 7.94 -1.22 -5.06 117.00 121.94 1faf n LEU 73 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1faf n LEU 73 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1faf n LEU 73 CO 0.00 0.37 0.00 0.61 -1.11 0.00 0.00 177.39 177.26 1faf n GLY 74 N 3.27 0.91 4.83 -3.96 0.00 -0.19 -4.82 105.19 105.22 1faf n GLY 74 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.45 0.68 3.77 -0.02 0.00 -1.26 -4.87 105.19 103.03 1faf n GLY 75 Ca 0.00 -0.88 -0.38 0.00 0.00 0.00 0.00 46.02 44.76 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 3.99 0.15 2.61 -4.23 -1.26 -4.97 115.64 111.93 1faf s THR 76 Ca 0.00 1.76 -0.08 0.00 -1.18 0.00 0.00 61.69 62.19 1faf s THR 76 Cb 0.00 -4.03 -0.09 0.00 1.34 0.00 0.00 72.50 69.73 1faf s THR 76 CO 0.00 0.24 1.43 1.23 -0.54 0.00 0.00 174.62 176.97 1faf h GLY 77 N 3.39 0.80 -7.07 3.99 0.00 -1.89 -3.41 103.07 98.88 1faf h GLY 77 Ca -0.47 -0.97 -0.63 0.00 0.00 0.00 0.00 47.33 45.26 1faf h GLY 77 CO 0.66 0.87 0.31 -1.36 0.00 0.00 0.00 176.54 177.02 1faf s PHE 78 N -4.00 3.01 -2.20 5.60 0.40 -1.26 -5.17 117.98 114.35 1faf s PHE 78 Ca -0.09 0.12 0.30 0.00 -0.60 0.00 0.00 56.93 56.66 1faf s PHE 78 Cb 0.10 -3.60 1.57 0.00 0.51 0.00 0.00 43.02 41.60 1faf s PHE 78 CO 0.87 -0.96 2.04 1.04 0.70 0.00 0.00 175.22 178.91