#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 6.71 -0.40 6.12 -4.77 -1.26 -4.92 116.67 118.14 1faf s ASP 2 Ca 0.00 0.73 0.09 0.00 -3.30 0.00 0.00 52.55 50.07 1faf s ASP 2 Cb 0.00 -2.55 0.27 0.00 -1.09 0.00 0.00 42.92 39.56 1faf s ASP 2 CO 0.00 -1.14 0.59 -1.14 0.70 0.00 0.00 175.17 174.18 1faf n ARG 3 N 7.52 0.91 -3.85 2.11 0.63 -1.26 -5.08 116.66 117.63 1faf n ARG 3 Ca 0.13 -3.36 -0.18 0.00 -0.92 0.00 0.00 57.85 53.51 1faf n ARG 3 Cb 0.48 -1.39 -0.17 0.00 0.45 0.00 0.00 32.46 31.83 1faf n ARG 3 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 1faf s VAL 4 N -1.58 0.15 0.16 5.15 -7.23 -1.26 -4.91 120.40 110.88 1faf s VAL 4 Ca 0.37 0.15 -0.23 0.00 -1.81 0.00 0.00 61.98 60.46 1faf s VAL 4 Cb 0.21 -0.28 -0.08 0.00 0.56 0.00 0.00 36.38 36.79 1faf s VAL 4 CO -0.10 0.16 0.74 -1.48 -0.31 0.00 0.00 175.10 174.11 1faf s LEU 5 N 1.36 4.54 0.00 1.32 0.05 -1.26 -5.08 118.68 119.61 1faf s LEU 5 Ca -0.05 1.55 0.00 0.00 0.05 0.00 0.00 54.13 55.68 1faf s LEU 5 Cb -0.13 -3.28 0.00 0.00 -2.05 0.00 0.00 46.19 40.73 1faf s LEU 5 CO -0.03 0.19 0.00 -1.54 -0.55 0.00 0.00 176.35 174.42 1faf n SER 6 N 1.46 0.00 -0.23 1.48 3.41 -1.26 -4.71 113.62 113.76 1faf n SER 6 Ca -0.06 -0.72 -0.01 0.00 -0.26 0.00 0.00 58.87 57.83 1faf n SER 6 Cb 0.49 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.65 1faf n SER 6 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1faf h ARG 7 N 0.00 1.03 0.15 4.33 3.08 -1.98 -0.24 114.38 120.76 1faf h ARG 7 Ca 0.00 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1faf h ARG 7 Cb 0.00 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.83 1faf h ARG 7 CO 0.00 0.72 -0.07 0.00 -1.07 0.00 0.00 179.97 179.54 1faf h ALA 8 N 1.47 -0.20 -0.05 0.04 0.00 -1.98 -0.36 119.26 118.17 1faf h ALA 8 Ca 0.28 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1faf h ALA 8 Cb -0.06 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1faf h ALA 8 CO -0.05 -0.41 0.01 -0.44 0.00 0.00 0.00 179.25 178.35 1faf h ASP 9 N -0.62 0.00 -0.42 0.00 3.32 -1.88 0.88 116.42 117.71 1faf h ASP 9 Ca -0.02 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1faf h ASP 9 Cb 0.46 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 1faf h ASP 9 CO 0.03 0.01 0.24 0.07 -1.72 0.00 0.00 179.24 177.87 1faf h LYS 10 N 0.03 0.60 -0.52 3.56 5.09 -1.10 -0.47 116.57 123.75 1faf h LYS 10 Ca 0.02 -0.06 -0.08 0.00 0.09 0.00 0.00 60.65 60.62 1faf h LYS 10 Cb 0.02 -0.13 -0.02 0.00 0.10 0.00 0.00 32.23 32.20 1faf h LYS 10 CO -0.03 0.44 -0.00 0.93 -2.09 0.00 0.00 179.45 178.70 1faf h GLU 11 N 0.61 0.88 -0.27 0.07 5.08 -0.30 -2.18 114.58 118.47 1faf h GLU 11 Ca 0.16 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 1faf h GLU 11 Cb 0.02 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1faf h GLU 11 CO -0.03 0.88 -0.08 -0.09 -1.00 0.00 0.00 179.01 178.69 1faf h ARG 12 N 0.81 0.43 -0.60 2.33 9.65 0.72 -2.43 114.38 125.29 1faf h ARG 12 Ca 0.15 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.92 1faf h ARG 12 Cb 0.49 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.98 1faf h ARG 12 CO 0.02 0.52 0.33 1.25 2.80 0.00 0.00 179.97 184.89 1faf h LEU 13 N 0.41 0.75 -0.69 3.80 5.85 -0.63 -2.57 115.31 122.22 1faf h LEU 13 Ca 0.08 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 1faf h LEU 13 Cb 0.39 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 1faf h LEU 13 CO 0.02 0.63 0.20 -0.07 -0.34 0.00 0.00 178.44 178.88 1faf h LEU 14 N 0.81 1.02 -1.72 2.25 3.38 -1.21 -2.18 115.31 117.67 1faf h LEU 14 Ca 0.21 -0.22 0.12 0.00 0.09 0.00 0.00 57.88 58.08 1faf h LEU 14 Cb 0.05 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 1faf h LEU 14 CO -0.03 0.97 0.41 -0.33 0.09 0.00 0.00 178.44 179.54 1faf h GLU 15 N 1.03 0.30 0.00 1.13 5.08 -1.05 0.16 114.58 121.22 1faf h GLU 15 Ca 0.22 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1faf h GLU 15 Cb 0.32 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 1faf h GLU 15 CO -0.00 0.20 -0.54 -0.07 -1.00 0.00 0.00 179.01 177.59 1faf h LEU 16 N 0.30 0.00 -0.25 1.33 -0.00 -1.21 -3.25 115.31 112.23 1faf h LEU 16 Ca 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.16 1faf h LEU 16 Cb 0.70 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.36 1faf h LEU 16 CO -0.07 0.05 -0.15 0.18 -0.00 0.00 0.00 178.44 178.46 1faf n LEU 17 N -2.91 0.53 -1.40 1.67 4.32 0.48 -4.89 117.00 114.81 1faf n LEU 17 Ca 0.01 -0.01 -0.14 0.00 -0.02 0.00 0.00 56.01 55.86 1faf n LEU 17 Cb 0.56 -0.19 -0.06 0.00 -1.62 0.00 0.00 43.42 42.11 1faf n LEU 17 CO 0.37 0.10 -0.13 0.29 -1.22 0.00 0.00 177.39 176.80 1faf n LYS 18 N -0.96 -1.30 -4.21 3.23 4.01 -0.71 -4.58 118.16 113.63 1faf n LYS 18 Ca 0.13 0.81 -0.34 0.00 -0.51 0.00 0.00 58.31 58.40 1faf n LYS 18 Cb 0.29 -5.07 -0.13 0.00 -0.51 0.00 0.00 35.03 29.61 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 -3.82 3.01 1.01 -0.35 0.20 -1.22 -5.09 118.68 112.42 1faf s LEU 19 Ca 0.00 -0.28 -0.19 0.00 0.69 0.00 0.00 54.13 54.35 1faf s LEU 19 Cb 0.00 -1.74 -0.06 0.00 -0.43 0.00 0.00 46.19 43.95 1faf s LEU 19 CO 0.00 0.07 -0.53 -2.65 -0.29 0.00 0.00 176.35 172.95 1faf n PRO 20 N 4.17 -0.40 0.05 0.98 -0.02 -1.26 -4.72 135.00 133.81 1faf n PRO 20 Ca -0.18 -0.10 0.12 0.00 -2.02 0.00 0.00 63.50 61.31 1faf n PRO 20 Cb 0.52 -1.35 0.09 0.00 -0.02 0.00 0.00 33.50 32.74 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 0.55 0.34 -0.07 -0.52 1.85 -1.26 -4.11 116.66 113.43 1faf n ARG 21 Ca 0.01 0.06 -0.04 0.00 -1.00 0.00 0.00 57.85 56.88 1faf n ARG 21 Cb 0.62 -1.67 0.19 0.00 -1.05 0.00 0.00 32.46 30.54 1faf n ARG 21 CO 0.00 0.00 0.00 0.37 -0.01 0.00 0.00 177.63 177.99 1faf h GLN 22 N 0.00 0.70 -0.19 2.89 4.15 -2.06 -2.47 115.11 118.13 1faf h GLN 22 Ca 0.00 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 59.23 1faf h GLN 22 Cb 0.78 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.39 1faf h GLN 22 CO 0.00 0.74 0.00 1.47 -1.93 0.00 0.00 178.83 179.11 1faf n LEU 23 N -4.21 1.87 -4.52 -2.39 -0.00 -1.26 -4.90 117.00 101.59 1faf n LEU 23 Ca 0.02 -0.79 -0.39 0.00 -0.00 0.00 0.00 56.01 54.85 1faf n LEU 23 Cb 0.31 -0.12 -0.08 0.00 -0.00 0.00 0.00 43.42 43.52 1faf n LEU 23 CO 0.41 0.39 2.09 1.87 -0.00 0.00 0.00 177.39 182.16 1faf n TRP 24 N 0.46 1.10 0.00 1.47 -0.00 -0.93 -2.55 117.44 116.99 1faf n TRP 24 Ca 0.16 0.23 0.00 0.00 -0.00 0.00 0.00 57.50 57.89 1faf n TRP 24 Cb 0.36 -2.53 0.00 0.00 -0.00 0.00 0.00 31.31 29.14 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 6.24 2.15 3.51 5.87 0.00 -1.26 -5.09 105.19 116.60 1faf n GLY 25 Ca 0.49 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 6.31 0.31 1.61 2.15 -1.06 -4.89 116.67 121.11 1faf s ASP 26 Ca 0.00 -1.08 0.05 0.00 0.43 0.00 0.00 52.55 51.95 1faf s ASP 26 Cb 0.00 -2.50 0.82 0.00 -0.30 0.00 0.00 42.92 40.94 1faf s ASP 26 CO 0.00 -1.53 1.61 0.15 -0.17 0.00 0.00 175.17 175.23 1faf h PHE 27 N 9.66 0.27 -0.86 -5.34 3.57 -1.98 0.38 116.94 122.64 1faf h PHE 27 Ca -0.10 0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.52 1faf h PHE 27 Cb 1.04 0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.75 1faf h PHE 27 CO 1.12 -0.34 0.53 0.78 -2.23 0.00 0.00 178.31 178.18 1faf h GLY 28 N 0.10 1.31 0.11 2.40 0.00 -1.98 0.44 103.07 105.45 1faf h GLY 28 Ca 0.61 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.56 1faf h GLY 28 CO -0.78 0.24 -0.01 3.21 0.00 0.00 0.00 176.54 179.21 1faf h ARG 29 N 0.95 -0.02 -0.92 4.80 3.08 -0.75 -2.56 114.38 118.97 1faf h ARG 29 Ca 0.38 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.46 1faf h ARG 29 Cb 0.20 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.21 1faf h ARG 29 CO -0.19 0.73 0.60 0.00 -1.07 0.00 0.00 179.97 180.04 1faf h MET 30 N -0.92 1.16 -0.15 0.04 -0.00 -0.87 -1.42 114.93 112.76 1faf h MET 30 Ca -0.00 -0.07 -0.09 0.00 -0.00 0.00 0.00 59.70 59.54 1faf h MET 30 Cb 0.76 -0.26 -0.01 0.00 -0.00 0.00 0.00 31.60 32.09 1faf h MET 30 CO 0.00 0.76 -0.32 0.37 -0.00 0.00 0.00 176.91 177.73 1faf h GLN 31 N 1.19 0.29 -0.51 -0.10 4.15 -0.22 -1.80 115.11 118.11 1faf h GLN 31 Ca 0.35 -0.12 0.04 0.00 0.77 0.00 0.00 58.65 59.69 1faf h GLN 31 Cb -0.06 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.59 1faf h GLN 31 CO -0.10 0.58 0.34 0.37 -1.93 0.00 0.00 178.83 178.09 1faf h GLN 32 N 0.25 0.54 0.06 1.69 5.75 -0.82 0.63 115.11 123.21 1faf h GLN 32 Ca 0.03 -0.03 -0.11 0.00 -0.15 0.00 0.00 58.65 58.39 1faf h GLN 32 Cb 0.70 -0.12 0.01 0.00 1.07 0.00 0.00 27.48 29.14 1faf h GLN 32 CO 0.05 0.36 -0.48 0.00 -2.65 0.00 0.00 178.83 176.12 1faf h ALA 33 N 1.71 -0.02 -0.43 3.38 0.00 -1.12 -2.77 119.26 120.01 1faf h ALA 33 Ca 0.21 -0.58 0.07 0.00 0.00 0.00 0.00 54.91 54.60 1faf h ALA 33 Cb 0.12 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1faf h ALA 33 CO -0.05 0.22 0.08 -0.92 0.00 0.00 0.00 179.25 178.58 1faf h TYR 34 N -0.50 0.13 -0.83 0.00 5.03 -0.84 1.20 116.97 121.15 1faf h TYR 34 Ca -0.08 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.25 1faf h TYR 34 Cb 1.31 0.01 -0.04 0.00 1.55 0.00 0.00 36.73 39.56 1faf h TYR 34 CO 0.20 0.00 0.46 0.87 -1.32 0.00 0.00 178.16 178.38 1faf h LYS 35 N 0.21 1.15 0.00 1.82 1.57 -0.99 0.73 116.57 121.06 1faf h LYS 35 Ca 0.21 -0.13 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 1faf h LYS 35 Cb 0.26 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1faf h LYS 35 CO -0.28 0.84 -0.26 0.37 -0.57 0.00 0.00 179.45 179.55 1faf h GLN 36 N 1.15 0.00 0.00 3.15 4.15 -0.97 -3.13 115.11 119.47 1faf h GLN 36 Ca 0.29 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.63 1faf h GLN 36 Cb 0.01 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 1faf h GLN 36 CO -0.05 0.26 -1.18 1.96 -1.93 0.00 0.00 178.83 177.90 1faf h GLN 37 N 0.00 0.00 0.00 1.69 7.50 0.22 -3.33 115.11 121.19 1faf h GLN 37 Ca -0.00 0.00 -0.11 0.00 0.50 0.00 0.00 58.65 59.04 1faf h GLN 37 Cb 1.02 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.54 1faf h GLN 37 CO 0.03 0.15 -0.52 0.66 -1.50 0.00 0.00 178.83 177.65 1faf h SER 38 N 0.00 0.00 0.06 1.46 4.64 0.50 -2.34 113.55 117.87 1faf h SER 38 Ca -0.08 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.17 1faf h SER 38 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 1faf h SER 38 CO 0.02 0.52 -0.22 -0.07 -0.87 0.00 0.00 176.83 176.22 1faf h LEU 39 N 0.00 0.27 0.00 5.97 3.38 -1.65 -1.53 115.31 121.75 1faf h LEU 39 Ca -0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1faf h LEU 39 Cb 0.97 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1faf h LEU 39 CO 0.07 0.51 -0.79 0.17 0.09 0.00 0.00 178.44 178.49 1faf h LEU 40 N 0.26 0.00 -1.44 1.67 8.10 -1.68 -3.29 115.31 118.93 1faf h LEU 40 Ca 0.04 -0.15 0.00 0.00 0.11 0.00 0.00 57.88 57.89 1faf h LEU 40 Cb 0.53 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.75 1faf h LEU 40 CO 0.04 0.07 0.00 0.18 -4.11 0.00 0.00 178.44 174.62 1faf n LEU 41 N -2.33 2.22 -4.82 0.17 4.77 -0.90 -4.05 117.00 112.06 1faf n LEU 41 Ca 0.02 -0.78 -0.37 0.00 -0.03 0.00 0.00 56.01 54.84 1faf n LEU 41 Cb 0.48 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.48 1faf n LEU 41 CO 0.38 0.39 0.30 -2.28 -1.33 0.00 0.00 177.39 174.86 1faf s HIS 42 N -1.93 3.72 -1.41 -1.77 2.46 -0.61 -4.08 115.29 111.67 1faf s HIS 42 Ca 0.34 1.26 0.07 0.00 0.47 0.00 0.00 55.06 57.20 1faf s HIS 42 Cb 0.20 -2.50 0.37 0.00 -0.13 0.00 0.00 32.58 30.53 1faf s HIS 42 CO 0.31 0.48 1.10 -0.35 -2.47 0.00 0.00 174.74 173.82 1faf n PRO 43 N 1.23 0.10 0.10 2.88 -0.04 -1.25 -1.47 135.00 136.54 1faf n PRO 43 Ca -0.07 0.22 0.08 0.00 -0.04 0.00 0.00 63.50 63.70 1faf n PRO 43 Cb 0.51 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.46 1faf n PRO 43 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1faf h ASP 44 N 0.00 0.00 -0.51 3.54 3.58 -1.90 -3.33 116.42 117.79 1faf h ASP 44 Ca 0.00 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.20 1faf h ASP 44 Cb 0.07 0.00 -0.15 0.00 1.72 0.00 0.00 39.33 40.97 1faf h ASP 44 CO 0.00 0.16 0.10 0.29 -2.88 0.00 0.00 179.24 176.91 1faf n LYS 45 N -2.78 2.01 -2.96 0.28 4.01 -0.75 -4.91 118.16 113.05 1faf n LYS 45 Ca -0.02 -3.14 -0.11 0.00 -0.51 0.00 0.00 58.31 54.54 1faf n LYS 45 Cb 0.63 -1.91 0.04 0.00 -0.51 0.00 0.00 35.03 33.27 1faf n LYS 45 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1faf n GLY 46 N -1.09 0.23 3.62 0.72 0.00 -1.23 -4.90 105.19 102.54 1faf n GLY 46 Ca 0.39 -0.24 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.22 1.97 0.17 -0.02 0.00 -0.55 -4.99 107.32 100.69 1faf s GLY 47 Ca 0.24 -1.89 -0.13 0.00 0.00 0.00 0.00 44.72 42.93 1faf s GLY 47 CO 0.34 -1.87 0.56 -0.56 0.00 0.00 0.00 173.10 171.57 1faf s SER 48 N -3.69 6.78 0.40 1.64 0.01 -1.26 -3.74 113.70 113.84 1faf s SER 48 Ca 0.34 1.06 0.22 0.00 1.31 0.00 0.00 55.95 58.87 1faf s SER 48 Cb -0.02 -2.28 0.39 0.00 0.21 0.00 0.00 66.02 64.32 1faf s SER 48 CO 0.19 0.05 1.61 1.12 0.41 0.00 0.00 173.24 176.62 1faf h HIS 49 N 3.27 0.00 0.00 2.43 2.07 -1.95 -3.17 115.15 117.79 1faf h HIS 49 Ca -0.48 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 56.93 1faf h HIS 49 Cb 1.19 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.15 1faf h HIS 49 CO 0.64 0.15 -0.51 0.00 -3.07 0.00 0.00 177.93 175.14 1faf h ALA 50 N 1.85 0.87 0.01 6.11 0.00 -1.94 -2.86 119.26 123.30 1faf h ALA 50 Ca -0.00 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1faf h ALA 50 Cb 1.05 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1faf h ALA 50 CO 0.02 0.64 -0.00 -0.07 0.00 0.00 0.00 179.25 179.83 1faf h LEU 51 N 0.00 -0.01 -0.98 0.00 4.07 -1.89 -2.42 115.31 114.08 1faf h LEU 51 Ca -0.01 -0.80 0.10 0.00 0.08 0.00 0.00 57.88 57.25 1faf h LEU 51 Cb 1.11 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 42.78 1faf h LEU 51 CO 0.07 0.85 0.62 -0.03 -1.08 0.00 0.00 178.44 178.87 1faf h MET 52 N -0.93 1.01 -0.07 1.13 4.05 -1.62 -0.88 114.93 117.62 1faf h MET 52 Ca -0.00 -0.06 -0.20 0.00 -0.28 0.00 0.00 59.70 59.15 1faf h MET 52 Cb 0.82 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 31.39 1faf h MET 52 CO 0.00 0.67 -0.81 -0.56 0.23 0.00 0.00 176.91 176.44 1faf h GLN 53 N 1.04 0.48 0.07 0.39 3.07 -1.62 -2.59 115.11 115.94 1faf h GLN 53 Ca 0.46 -0.42 -0.00 0.00 0.09 0.00 0.00 58.65 58.78 1faf h GLN 53 Cb 0.36 0.10 0.00 0.00 0.08 0.00 0.00 27.48 28.02 1faf h GLN 53 CO -0.23 1.06 -0.03 1.49 0.09 0.00 0.00 178.83 181.21 1faf h GLU 54 N 0.31 -0.08 -0.66 0.06 4.57 -0.81 -2.34 114.58 115.63 1faf h GLU 54 Ca -0.05 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.10 1faf h GLU 54 Cb 1.41 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.99 1faf h GLU 54 CO 0.14 0.07 0.28 1.25 -1.18 0.00 0.00 179.01 179.58 1faf h LEU 55 N -0.23 0.88 -1.28 1.64 5.85 -1.27 -2.35 115.31 118.55 1faf h LEU 55 Ca -0.01 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.61 1faf h LEU 55 Cb 0.20 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 1faf h LEU 55 CO 0.01 0.77 0.49 0.78 -0.34 0.00 0.00 178.44 180.16 1faf h ASN 56 N 0.95 0.84 0.44 1.25 2.35 -1.28 0.31 115.58 120.44 1faf h ASN 56 Ca 0.23 -0.02 -0.10 0.00 -0.55 0.00 0.00 56.30 55.86 1faf h ASN 56 Cb 0.16 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1faf h ASN 56 CO -0.02 0.61 -0.45 0.28 -1.65 0.00 0.00 177.43 176.19 1faf h SER 57 N 0.99 0.02 0.94 5.81 0.02 -0.89 0.36 113.55 120.80 1faf h SER 57 Ca 0.27 -0.01 -0.17 0.00 -0.84 0.00 0.00 61.79 61.04 1faf h SER 57 Cb -0.11 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 1faf h SER 57 CO -0.06 0.47 -1.14 -0.07 -1.14 0.00 0.00 176.83 174.89 1faf h LEU 58 N 0.02 0.00 0.00 5.07 3.38 -1.01 -3.22 115.31 119.55 1faf h LEU 58 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1faf h LEU 58 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1faf h LEU 58 CO 0.06 0.66 -0.97 1.87 0.09 0.00 0.00 178.44 180.15 1faf n TRP 59 N -3.06 0.89 0.05 1.13 -0.00 0.98 -3.21 117.44 114.21 1faf n TRP 59 Ca -0.06 0.26 -0.03 0.00 -0.00 0.00 0.00 57.50 57.67 1faf n TRP 59 Cb 0.85 -0.90 -0.01 0.00 -0.00 0.00 0.00 31.31 31.25 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 4.08 -0.20 0.45 5.87 0.00 -0.37 -1.24 103.07 111.66 1faf h GLY 60 Ca 0.00 0.08 0.06 0.00 0.00 0.00 0.00 47.33 47.46 1faf h GLY 60 CO 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 176.54 176.41 1faf h THR 61 N -0.79 0.73 -0.68 4.70 1.03 -1.75 0.46 112.91 116.60 1faf h THR 61 Ca -0.02 -0.01 0.11 0.00 -0.01 0.00 0.00 66.41 66.49 1faf h THR 61 Cb 0.15 0.71 -0.12 0.00 -1.07 0.00 0.00 68.15 67.81 1faf h THR 61 CO 0.03 0.00 -0.35 0.15 -0.01 0.00 0.00 175.52 175.34 1faf h PHE 62 N 0.02 -0.99 -0.67 0.00 3.57 -1.68 0.39 116.94 117.58 1faf h PHE 62 Ca 0.14 0.08 0.09 0.00 3.53 0.00 0.00 57.97 61.81 1faf h PHE 62 Cb 0.21 0.53 -0.07 0.00 2.79 0.00 0.00 35.95 39.41 1faf h PHE 62 CO -0.27 -0.39 0.31 -0.22 -2.23 0.00 0.00 178.31 175.51 1faf h LYS 63 N -0.13 0.51 -1.01 1.11 3.64 0.18 0.66 116.57 121.54 1faf h LYS 63 Ca 0.25 -0.03 0.25 0.00 -1.27 0.00 0.00 60.65 59.86 1faf h LYS 63 Cb 0.56 -0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 32.19 1faf h LYS 63 CO -0.75 0.34 0.66 1.15 -2.27 0.00 0.00 179.45 178.58 1faf h THR 64 N 0.53 0.56 0.00 1.00 2.02 0.18 0.93 112.91 118.13 1faf h THR 64 Ca 0.33 -0.12 -0.25 0.00 0.77 0.00 0.00 66.41 67.14 1faf h THR 64 Cb 0.37 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 1faf h THR 64 CO -0.28 0.07 -1.38 -0.33 0.37 0.00 0.00 175.52 173.97 1faf h GLU 65 N 0.36 0.00 -0.90 6.66 4.39 0.05 -3.34 114.58 121.80 1faf h GLU 65 Ca 0.55 -0.01 0.09 0.00 0.34 0.00 0.00 59.36 60.33 1faf h GLU 65 Cb 1.47 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 30.05 1faf h GLU 65 CO -0.23 0.74 0.55 0.28 -1.16 0.00 0.00 179.01 179.19 1faf h VAL 66 N 0.00 0.96 -0.65 3.13 2.07 0.64 0.97 116.25 123.37 1faf h VAL 66 Ca -0.16 -0.32 -0.09 0.00 0.82 0.00 0.00 66.70 66.96 1faf h VAL 66 Cb 1.90 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1faf h VAL 66 CO 0.10 0.17 0.07 0.22 0.02 0.00 0.00 177.57 178.16 1faf h TYR 67 N 0.94 1.18 0.00 1.57 3.20 -1.30 -2.81 116.97 119.75 1faf h TYR 67 Ca 0.42 -0.18 0.00 0.00 3.14 0.00 0.00 58.73 62.12 1faf h TYR 67 Cb 0.33 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.28 1faf h TYR 67 CO -0.03 1.00 -0.43 0.27 -1.64 0.00 0.00 178.16 177.33 1faf n ASN 68 N -4.21 0.49 -0.26 -2.11 0.23 -0.72 -3.92 115.26 104.77 1faf n ASN 68 Ca 0.04 0.03 -0.01 0.00 -0.53 0.00 0.00 54.58 54.11 1faf n ASN 68 Cb 0.31 0.05 0.19 0.00 -2.08 0.00 0.00 39.78 38.25 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 0.95 -0.11 -4.53 8.10 0.12 0.75 115.31 120.59 1faf h LEU 69 Ca 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 57.88 57.94 1faf h LEU 69 Cb 0.58 -0.24 0.00 0.00 -0.44 0.00 0.00 40.66 40.56 1faf h LEU 69 CO 0.00 0.72 0.00 0.54 -4.11 0.00 0.00 178.44 175.59 1faf n ARG 70 N -4.39 1.08 -0.04 0.17 1.74 -1.25 -3.66 116.66 110.32 1faf n ARG 70 Ca 0.09 -0.11 -0.05 0.00 -0.77 0.00 0.00 57.85 57.01 1faf n ARG 70 Cb 0.05 -1.44 -0.03 0.00 -1.02 0.00 0.00 32.46 30.02 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 -0.81 0.20 -1.81 5.56 2.81 -0.19 -5.02 117.12 117.86 1faf n MET 71 Ca 0.21 0.04 -0.41 0.00 -1.81 0.00 0.00 57.70 55.73 1faf n MET 71 Cb 0.12 -1.15 -0.01 0.00 -0.71 0.00 0.00 33.22 31.47 1faf n MET 71 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1faf s ASN 72 N -4.71 6.40 0.00 7.83 0.01 0.24 -4.94 114.94 119.77 1faf s ASN 72 Ca -0.10 2.94 -0.02 0.00 -0.71 0.00 0.00 52.86 54.97 1faf s ASN 72 Cb 0.03 -2.64 -0.01 0.00 0.41 0.00 0.00 41.25 39.04 1faf s ASN 72 CO 0.17 -0.88 -0.04 -0.11 -1.51 0.00 0.00 177.10 174.73 1faf n LEU 73 N 1.75 0.46 0.01 0.60 -0.00 -1.26 -4.94 117.00 113.62 1faf n LEU 73 Ca 0.06 0.07 0.00 0.00 -0.00 0.00 0.00 56.01 56.14 1faf n LEU 73 Cb 0.38 -0.27 0.00 0.00 -0.00 0.00 0.00 43.42 43.53 1faf n LEU 73 CO 0.63 -0.53 -0.22 0.61 -0.00 0.00 0.00 177.39 177.89 1faf n GLY 74 N 2.81 -0.01 0.00 -3.96 0.00 -1.26 -5.10 105.19 97.66 1faf n GLY 74 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 2.22 0.71 3.53 -0.02 0.00 -1.26 -5.06 105.19 105.30 1faf n GLY 75 Ca 0.00 -0.44 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 1faf n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1faf s THR 76 N -1.17 4.35 0.00 2.61 2.01 -1.26 -4.29 115.64 117.89 1faf s THR 76 Ca 0.00 0.39 0.00 0.00 0.31 0.00 0.00 61.69 62.39 1faf s THR 76 Cb 0.00 -4.55 0.00 0.00 0.01 0.00 0.00 72.50 67.96 1faf s THR 76 CO 0.00 -1.12 0.00 0.61 -0.69 0.00 0.00 174.62 173.42 1faf n GLY 77 N 5.10 2.08 3.78 4.40 0.00 -1.26 -5.10 105.19 114.17 1faf n GLY 77 Ca 0.03 -0.46 -0.38 0.00 0.00 0.00 0.00 46.02 45.22 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 3.41 -2.00 1.61 0.08 -1.26 -5.33 117.98 114.49 1faf s PHE 78 Ca 0.00 1.68 0.26 0.00 0.12 0.00 0.00 56.93 58.99 1faf s PHE 78 Cb 0.00 -3.13 1.56 0.00 -0.57 0.00 0.00 43.02 40.88 1faf s PHE 78 CO 0.00 -0.47 1.91 0.94 -0.10 0.00 0.00 175.22 177.50