#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bfm n GLU 2 N 0.00 0.33 -3.07 0.03 1.02 -1.26 -5.01 120.64 112.68 1bfm n GLU 2 Ca 0.00 0.08 -0.40 0.00 -0.02 0.00 0.00 57.16 56.82 1bfm n GLU 2 Cb 0.00 -1.26 -0.05 0.00 -0.02 0.00 0.00 31.44 30.11 1bfm n GLU 2 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1bfm s LEU 3 N -5.78 4.21 0.59 -4.62 2.01 -1.26 -5.02 118.68 108.81 1bfm s LEU 3 Ca -0.18 1.01 -0.20 0.00 0.01 0.00 0.00 54.13 54.77 1bfm s LEU 3 Cb 0.05 -3.00 -0.03 0.00 0.01 0.00 0.00 46.19 43.21 1bfm s LEU 3 CO 0.30 -0.23 1.32 -2.16 1.01 0.00 0.00 176.35 176.60 1bfm s PRO 4 N 1.50 2.89 -0.00 1.29 0.04 -1.26 -4.97 135.00 134.50 1bfm s PRO 4 Ca 0.33 2.13 0.04 0.00 0.04 0.00 0.00 61.00 63.55 1bfm s PRO 4 Cb -0.16 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.25 1bfm s PRO 4 CO 0.13 -1.35 0.16 0.44 0.04 0.00 0.00 177.00 176.42 1bfm n ILE 5 N -1.42 0.00 0.15 0.56 -0.00 -1.26 -3.44 119.36 113.95 1bfm n ILE 5 Ca 0.13 -0.32 -0.11 0.00 -0.00 0.00 0.00 62.75 62.44 1bfm n ILE 5 Cb 0.47 0.85 -0.07 0.00 -0.00 0.00 0.00 39.64 40.89 1bfm n ILE 5 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1bfm h ALA 6 N 0.57 -0.43 0.15 -1.28 0.00 -1.95 0.56 119.26 116.89 1bfm h ALA 6 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1bfm h ALA 6 Cb 0.13 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1bfm h ALA 6 CO 0.00 -0.49 -0.07 -1.00 0.00 0.00 0.00 179.25 177.69 1bfm h PRO 7 N -0.93 -0.20 0.53 0.00 0.13 -1.99 0.56 132.00 130.10 1bfm h PRO 7 Ca -0.04 0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.07 1bfm h PRO 7 Cb 0.51 0.05 0.01 0.00 0.13 0.00 0.00 31.00 31.69 1bfm h PRO 7 CO 0.07 -0.00 -0.26 0.82 -0.23 0.00 0.00 178.00 178.41 1bfm h ILE 8 N -0.37 0.47 -0.00 -3.56 2.04 -1.70 -2.19 117.51 112.20 1bfm h ILE 8 Ca -0.02 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 1bfm h ILE 8 Cb 0.29 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1bfm h ILE 8 CO 0.03 0.01 -0.10 1.23 0.00 0.00 0.00 178.15 179.33 1bfm h GLY 9 N -0.76 0.01 1.44 5.37 0.00 0.22 0.31 103.07 109.66 1bfm h GLY 9 Ca -0.07 -0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.13 1bfm h GLY 9 CO 0.12 0.00 -0.31 3.21 0.00 0.00 0.00 176.54 179.56 1bfm h ARG 10 N 0.01 0.63 -0.91 4.80 2.47 0.53 0.32 114.38 122.23 1bfm h ARG 10 Ca 0.00 -0.28 -0.00 0.00 -1.26 0.00 0.00 59.98 58.44 1bfm h ARG 10 Cb 0.17 -0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 28.43 1bfm h ARG 10 CO 0.01 0.87 0.57 0.82 0.56 0.00 0.00 179.97 182.79 1bfm h ILE 11 N 0.54 1.25 -0.45 2.04 2.04 0.22 -1.37 117.51 121.78 1bfm h ILE 11 Ca 0.06 -0.51 -0.12 0.00 1.00 0.00 0.00 64.86 65.29 1bfm h ILE 11 Cb 0.80 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1bfm h ILE 11 CO 0.07 0.25 -0.18 0.40 0.00 0.00 0.00 178.15 178.69 1bfm h ILE 12 N 1.25 1.27 -0.41 -0.67 1.08 -0.42 0.09 117.51 119.71 1bfm h ILE 12 Ca 0.33 -1.33 -0.02 0.00 -0.39 0.00 0.00 64.86 63.45 1bfm h ILE 12 Cb -0.08 1.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.84 1bfm h ILE 12 CO -0.06 0.45 0.16 0.50 -0.69 0.00 0.00 178.15 178.51 1bfm h LYS 13 N 0.74 0.58 -0.44 2.37 3.11 -0.84 -1.69 116.57 120.40 1bfm h LYS 13 Ca 0.10 -0.08 -0.03 0.00 -2.81 0.00 0.00 60.65 57.84 1bfm h LYS 13 Cb 0.75 -0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 31.85 1bfm h LYS 13 CO 0.06 0.49 0.16 0.22 -2.81 0.00 0.00 179.45 177.57 1bfm h ASP 14 N 0.58 0.58 0.30 4.20 1.82 0.13 0.56 116.42 124.58 1bfm h ASP 14 Ca 0.14 -0.07 -0.01 0.00 -0.39 0.00 0.00 57.03 56.70 1bfm h ASP 14 Cb 0.13 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 39.99 1bfm h ASP 14 CO -0.01 0.53 -0.15 0.00 -1.61 0.00 0.00 179.24 178.00 1bfm h ALA 15 N 1.55 -0.41 0.00 -0.78 0.00 -0.70 -3.46 119.26 115.45 1bfm h ALA 15 Ca 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1bfm h ALA 15 Cb 0.15 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1bfm h ALA 15 CO -0.01 -0.74 0.00 0.41 0.00 0.00 0.00 179.25 178.91 1bfm n GLY 16 N -1.28 0.03 3.71 0.00 0.00 0.20 -5.12 105.19 102.73 1bfm n GLY 16 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1bfm n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bfm s ALA 17 N -0.03 3.89 -0.15 4.61 0.00 -0.71 -4.88 121.76 124.49 1bfm s ALA 17 Ca 0.00 1.53 0.04 0.00 0.00 0.00 0.00 51.96 53.53 1bfm s ALA 17 Cb 0.00 -3.70 -0.12 0.00 0.00 0.00 0.00 23.12 19.31 1bfm s ALA 17 CO 0.00 -0.96 -0.10 -1.91 0.00 0.00 0.00 175.76 172.80 1bfm n GLU 18 N 4.28 0.77 -3.38 0.00 2.13 -1.26 -4.63 120.64 118.55 1bfm n GLU 18 Ca 0.16 0.07 -0.11 0.00 0.66 0.00 0.00 57.16 57.94 1bfm n GLU 18 Cb 0.36 -1.32 -0.09 0.00 0.27 0.00 0.00 31.44 30.66 1bfm n GLU 18 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1bfm s ARG 19 N -2.32 0.31 -0.18 5.31 6.06 -1.26 -5.13 118.95 121.75 1bfm s ARG 19 Ca -0.18 0.44 -0.05 0.00 -2.50 0.00 0.00 55.73 53.44 1bfm s ARG 19 Cb 0.05 -0.65 -0.03 0.00 0.06 0.00 0.00 34.95 34.38 1bfm s ARG 19 CO 0.40 -0.66 0.00 0.08 -2.50 0.00 0.00 175.30 172.63 1bfm s VAL 20 N 2.49 4.14 0.53 7.11 1.01 -1.26 -5.10 120.40 129.32 1bfm s VAL 20 Ca 0.11 -0.26 -0.22 0.00 0.00 0.00 0.00 61.98 61.61 1bfm s VAL 20 Cb -0.15 -2.85 -0.05 0.00 0.00 0.00 0.00 36.38 33.32 1bfm s VAL 20 CO -0.16 0.46 1.32 -0.55 0.00 0.00 0.00 175.10 176.17 1bfm s SER 21 N 0.64 5.44 0.48 3.32 0.15 -1.26 -4.81 113.70 117.66 1bfm s SER 21 Ca -0.00 2.67 0.15 0.00 0.70 0.00 0.00 55.95 59.46 1bfm s SER 21 Cb -0.14 -2.63 1.14 0.00 -1.71 0.00 0.00 66.02 62.68 1bfm s SER 21 CO 0.02 -1.45 2.08 -2.24 1.20 0.00 0.00 173.24 172.86 1bfm h ASP 22 N 1.56 0.03 -0.40 5.45 3.04 -1.99 0.39 116.42 124.50 1bfm h ASP 22 Ca -0.51 -0.00 -0.00 0.00 -3.24 0.00 0.00 57.03 53.28 1bfm h ASP 22 Cb 1.29 -0.01 -0.02 0.00 -1.04 0.00 0.00 39.33 39.55 1bfm h ASP 22 CO 0.58 0.09 0.24 -0.78 -2.04 0.00 0.00 179.24 177.33 1bfm h ASP 23 N 0.04 0.48 0.66 4.15 3.58 -1.99 -2.24 116.42 121.10 1bfm h ASP 23 Ca 0.01 -0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.38 1bfm h ASP 23 Cb 0.12 -0.12 0.01 0.00 1.72 0.00 0.00 39.33 41.06 1bfm h ASP 23 CO 0.01 0.39 -0.32 0.00 -2.88 0.00 0.00 179.24 176.44 1bfm h ALA 24 N 1.11 -0.89 0.00 -0.78 0.00 -0.64 -1.06 119.26 117.01 1bfm h ALA 24 Ca 0.14 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1bfm h ALA 24 Cb -0.00 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1bfm h ALA 24 CO -0.03 -0.85 -0.05 0.07 0.00 0.00 0.00 179.25 178.39 1bfm h ARG 25 N -1.17 0.00 0.06 0.00 0.11 -1.20 0.90 114.38 113.09 1bfm h ARG 25 Ca -0.09 0.00 -0.26 0.00 0.10 0.00 0.00 59.98 59.73 1bfm h ARG 25 Cb 0.71 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.77 1bfm h ARG 25 CO 0.15 0.05 -1.29 0.82 0.10 0.00 0.00 179.97 179.79 1bfm h ILE 26 N 0.00 1.40 -0.87 0.08 2.04 -1.31 -2.46 117.51 116.39 1bfm h ILE 26 Ca -0.00 -3.08 -0.01 0.00 1.00 0.00 0.00 64.86 62.77 1bfm h ILE 26 Cb 0.16 2.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.99 1bfm h ILE 26 CO 0.01 0.85 0.50 0.74 0.00 0.00 0.00 178.15 180.25 1bfm h THR 27 N 0.04 1.25 -0.48 -0.27 2.02 0.51 0.51 112.91 116.48 1bfm h THR 27 Ca -0.14 -0.58 -0.00 0.00 0.77 0.00 0.00 66.41 66.46 1bfm h THR 27 Cb 1.92 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 1bfm h THR 27 CO 0.15 0.27 0.29 0.25 0.37 0.00 0.00 175.52 176.85 1bfm h LEU 28 N 1.21 0.57 -0.65 2.58 5.85 -1.27 0.57 115.31 124.18 1bfm h LEU 28 Ca 0.31 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 1bfm h LEU 28 Cb -0.01 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1bfm h LEU 28 CO -0.05 0.45 0.37 0.00 -0.34 0.00 0.00 178.44 178.87 1bfm h ALA 29 N 1.14 0.83 0.00 1.25 0.00 -0.84 0.58 119.26 122.22 1bfm h ALA 29 Ca 0.17 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1bfm h ALA 29 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1bfm h ALA 29 CO -0.03 0.34 -0.43 -0.22 0.00 0.00 0.00 179.25 178.91 1bfm h LYS 30 N 0.89 0.00 0.04 0.00 3.64 0.34 0.26 116.57 121.74 1bfm h LYS 30 Ca 0.23 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1bfm h LYS 30 Cb 0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1bfm h LYS 30 CO -0.04 0.43 -0.02 0.82 -2.27 0.00 0.00 179.45 178.37 1bfm h ILE 31 N 0.00 1.03 -0.70 2.00 5.03 0.40 -2.42 117.51 122.85 1bfm h ILE 31 Ca -0.00 -0.21 0.04 0.00 -0.12 0.00 0.00 64.86 64.57 1bfm h ILE 31 Cb 1.14 1.17 -0.04 0.00 -3.03 0.00 0.00 36.82 36.05 1bfm h ILE 31 CO 0.06 0.05 0.46 -0.07 -0.68 0.00 0.00 178.15 177.97 1bfm h LEU 32 N -0.14 0.71 0.21 1.44 -0.00 0.34 0.01 115.31 117.88 1bfm h LEU 32 Ca -0.01 -0.01 -0.30 0.00 -0.00 0.00 0.00 57.88 57.57 1bfm h LEU 32 Cb 0.13 -0.16 0.03 0.00 -0.00 0.00 0.00 40.66 40.65 1bfm h LEU 32 CO 0.01 0.48 -1.36 -0.08 -0.00 0.00 0.00 178.44 177.49 1bfm h GLU 33 N 0.82 0.44 0.00 1.13 4.57 -0.84 0.48 114.58 121.18 1bfm h GLU 33 Ca 0.28 -0.76 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 1bfm h GLU 33 Cb 0.10 0.28 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 1bfm h GLU 33 CO -0.08 1.36 -0.60 1.49 -1.18 0.00 0.00 179.01 180.00 1bfm h GLU 34 N -0.02 0.00 -0.03 1.92 4.22 -1.20 0.57 114.58 120.03 1bfm h GLU 34 Ca -0.25 0.00 -0.14 0.00 0.08 0.00 0.00 59.36 59.05 1bfm h GLU 34 Cb 2.01 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.27 1bfm h GLU 34 CO 0.22 0.00 -0.53 1.98 -2.18 0.00 0.00 179.01 178.49 1bfm h MET 35 N 0.00 0.42 -0.71 1.92 4.05 -1.01 -1.90 114.93 117.71 1bfm h MET 35 Ca 0.00 -0.41 -0.01 0.00 -0.28 0.00 0.00 59.70 59.00 1bfm h MET 35 Cb 0.95 0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.82 1bfm h MET 35 CO 0.00 1.06 0.40 0.78 0.23 0.00 0.00 176.91 179.39 1bfm h GLY 36 N -0.07 1.05 1.50 1.39 0.00 0.18 0.92 103.07 108.04 1bfm h GLY 36 Ca -0.06 -0.47 -0.12 0.00 0.00 0.00 0.00 47.33 46.69 1bfm h GLY 36 CO 0.11 0.45 -0.31 0.07 0.00 0.00 0.00 176.54 176.85 1bfm h ARG 37 N 0.98 0.57 -0.01 4.80 -0.00 0.02 -2.50 114.38 118.24 1bfm h ARG 37 Ca 0.25 -0.25 -0.00 0.00 -0.00 0.00 0.00 59.98 59.98 1bfm h ARG 37 Cb 0.02 -0.02 -0.00 0.00 -0.00 0.00 0.00 29.97 29.97 1bfm h ARG 37 CO -0.04 0.82 0.01 -0.44 -0.00 0.00 0.00 179.97 180.31 1bfm h ASP 38 N 0.49 0.01 0.28 0.08 3.32 0.15 -1.32 116.42 119.43 1bfm h ASP 38 Ca 0.06 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1bfm h ASP 38 Cb 0.79 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1bfm h ASP 38 CO 0.06 0.07 -0.14 0.40 -1.72 0.00 0.00 179.24 177.91 1bfm h ILE 39 N -0.04 0.74 -0.17 0.35 2.04 -0.25 -2.08 117.51 118.09 1bfm h ILE 39 Ca 0.00 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1bfm h ILE 39 Cb 0.06 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1bfm h ILE 39 CO -0.00 0.03 0.07 0.00 0.00 0.00 0.00 178.15 178.25 1bfm h ALA 40 N 0.23 0.23 0.00 1.87 0.00 -1.11 0.60 119.26 121.09 1bfm h ALA 40 Ca -0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1bfm h ALA 40 Cb 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1bfm h ALA 40 CO 0.06 -0.18 0.00 1.03 0.00 0.00 0.00 179.25 180.16 1bfm h SER 41 N 0.12 0.00 0.00 0.00 0.87 -1.24 0.58 113.55 113.88 1bfm h SER 41 Ca 0.06 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1bfm h SER 41 Cb 0.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1bfm h SER 41 CO -0.00 0.00 -0.00 -0.08 -0.53 0.00 0.00 176.83 176.22 1bfm h GLU 42 N 0.00 -0.00 -0.06 2.24 4.57 -0.42 0.56 114.58 121.48 1bfm h GLU 42 Ca 0.00 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.04 1bfm h GLU 42 Cb 0.23 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 1bfm h GLU 42 CO 0.00 0.93 -0.58 0.00 -1.18 0.00 0.00 179.01 178.17 1bfm h ALA 43 N 0.06 0.91 -0.58 2.92 0.00 0.30 0.58 119.26 123.46 1bfm h ALA 43 Ca -0.00 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 1bfm h ALA 43 Cb 0.93 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1bfm h ALA 43 CO 0.00 0.72 0.36 0.82 0.00 0.00 0.00 179.25 181.15 1bfm h ILE 44 N 0.14 1.16 -0.10 0.00 2.04 0.08 0.11 117.51 120.94 1bfm h ILE 44 Ca -0.00 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 1bfm h ILE 44 Cb 1.07 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1bfm h ILE 44 CO 0.09 0.17 0.04 0.11 0.00 0.00 0.00 178.15 178.55 1bfm h LYS 45 N 0.78 0.14 0.17 2.37 6.56 0.80 0.44 116.57 127.82 1bfm h LYS 45 Ca 0.21 -0.01 -0.23 0.00 -1.06 0.00 0.00 60.65 59.56 1bfm h LYS 45 Cb -0.04 -0.03 0.02 0.00 -0.57 0.00 0.00 32.23 31.61 1bfm h LYS 45 CO -0.04 0.12 -1.01 -0.07 -2.06 0.00 0.00 179.45 176.39 1bfm h LEU 46 N 0.14 0.55 -1.07 2.94 3.38 0.20 0.14 115.31 121.58 1bfm h LEU 46 Ca 0.04 -0.94 -0.00 0.00 0.09 0.00 0.00 57.88 57.06 1bfm h LEU 46 Cb 0.04 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1bfm h LEU 46 CO -0.00 1.48 0.52 0.00 0.09 0.00 0.00 178.44 180.53 1bfm h ALA 47 N 0.09 1.31 -0.07 1.53 0.00 -0.62 -1.99 119.26 119.50 1bfm h ALA 47 Ca -0.18 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1bfm h ALA 47 Cb 1.77 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1bfm h ALA 47 CO 0.17 0.60 -0.15 -0.09 0.00 0.00 0.00 179.25 179.78 1bfm h ARG 48 N 1.17 0.23 -0.43 0.00 9.65 -0.02 0.77 114.38 125.76 1bfm h ARG 48 Ca 0.31 -0.15 -0.01 0.00 -1.10 0.00 0.00 59.98 59.03 1bfm h ARG 48 Cb -0.06 0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.52 1bfm h ARG 48 CO -0.06 0.75 0.23 0.45 2.80 0.00 0.00 179.97 184.14 1bfm h HIS 49 N -0.26 0.56 -0.20 2.20 3.86 -0.74 0.56 115.15 121.12 1bfm h HIS 49 Ca 0.00 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1bfm h HIS 49 Cb 0.75 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 1bfm h HIS 49 CO 0.12 0.40 0.10 0.00 0.86 0.00 0.00 177.93 179.40 1bfm h ALA 50 N 1.67 0.26 -0.78 2.45 0.00 -1.18 -3.48 119.26 118.20 1bfm h ALA 50 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1bfm h ALA 50 Cb 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1bfm h ALA 50 CO -0.03 -0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.44 1bfm n GLY 51 N -0.86 0.79 3.50 0.00 0.00 0.22 -5.08 105.19 103.76 1bfm n GLY 51 Ca -0.04 -0.35 -0.24 0.00 0.00 0.00 0.00 46.02 45.40 1bfm n GLY 51 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bfm s ARG 52 N -2.48 1.75 0.13 1.61 6.06 0.15 -5.01 118.95 121.16 1bfm s ARG 52 Ca 0.00 -1.77 -0.09 0.00 -2.50 0.00 0.00 55.73 51.37 1bfm s ARG 52 Cb 0.00 -1.79 -0.06 0.00 0.06 0.00 0.00 34.95 33.16 1bfm s ARG 52 CO 0.00 0.30 0.43 0.21 -2.50 0.00 0.00 175.30 173.74 1bfm s LYS 53 N -3.54 3.74 0.22 5.12 2.20 -1.26 -4.62 119.74 121.60 1bfm s LYS 53 Ca 0.31 0.14 0.00 0.00 -0.36 0.00 0.00 55.97 56.06 1bfm s LYS 53 Cb -0.04 -2.89 0.00 0.00 -1.51 0.00 0.00 37.83 33.39 1bfm s LYS 53 CO 0.16 0.48 0.00 2.41 -0.36 0.00 0.00 175.35 178.04 1bfm n THR 54 N 0.48 -4.86 -3.39 3.43 -1.04 -1.26 -4.96 114.28 102.67 1bfm n THR 54 Ca -0.05 1.73 -0.38 0.00 -2.04 0.00 0.00 64.05 63.31 1bfm n THR 54 Cb 0.52 -2.82 -0.06 0.00 -1.82 0.00 0.00 70.33 66.16 1bfm n THR 54 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1bfm s ILE 55 N -1.39 4.94 0.06 12.58 -1.09 -1.26 -4.99 121.20 130.05 1bfm s ILE 55 Ca 0.00 1.00 0.01 0.00 -2.23 0.00 0.00 60.65 59.42 1bfm s ILE 55 Cb 0.00 -3.79 -0.00 0.00 -1.58 0.00 0.00 42.46 37.08 1bfm s ILE 55 CO 0.00 0.54 0.07 0.29 -1.23 0.00 0.00 174.94 174.61 1bfm n LYS 56 N 1.99 0.10 0.01 2.79 5.02 -1.26 -5.00 118.16 121.81 1bfm n LYS 56 Ca -0.12 -0.56 -0.17 0.00 -2.02 0.00 0.00 58.31 55.45 1bfm n LYS 56 Cb 0.52 0.50 -0.06 0.00 -0.02 0.00 0.00 35.03 35.96 1bfm n LYS 56 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bfm h ALA 57 N 1.37 0.32 -0.59 7.82 0.00 -1.98 0.13 119.26 126.33 1bfm h ALA 57 Ca -0.05 -0.63 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 1bfm h ALA 57 Cb 0.22 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1bfm h ALA 57 CO 0.06 0.71 0.31 0.93 0.00 0.00 0.00 179.25 181.26 1bfm h GLU 58 N 0.45 0.81 0.13 0.00 3.07 -1.97 0.03 114.58 117.10 1bfm h GLU 58 Ca -0.07 -0.09 -0.23 0.00 -0.50 0.00 0.00 59.36 58.48 1bfm h GLU 58 Cb 1.47 -0.16 0.02 0.00 -0.84 0.00 0.00 28.75 29.24 1bfm h GLU 58 CO 0.17 0.61 -0.97 -0.44 -1.40 0.00 0.00 179.01 176.97 1bfm h ASP 59 N 0.82 0.64 0.63 1.42 3.32 -1.81 -0.47 116.42 120.96 1bfm h ASP 59 Ca 0.21 -0.88 -0.03 0.00 0.02 0.00 0.00 57.03 56.35 1bfm h ASP 59 Cb 0.04 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.39 1bfm h ASP 59 CO -0.03 1.46 -0.30 0.40 -1.72 0.00 0.00 179.24 179.05 1bfm h ILE 60 N -0.09 0.36 0.00 0.35 1.08 -0.76 -2.50 117.51 115.96 1bfm h ILE 60 Ca -0.16 -0.08 -0.01 0.00 -0.39 0.00 0.00 64.86 64.22 1bfm h ILE 60 Cb 1.72 0.39 -0.00 0.00 -3.07 0.00 0.00 36.82 35.87 1bfm h ILE 60 CO 0.19 0.01 -0.03 -0.33 -0.69 0.00 0.00 178.15 177.30 1bfm h GLU 61 N -0.90 0.00 0.26 2.37 5.08 -1.03 0.96 114.58 121.32 1bfm h GLU 61 Ca -0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1bfm h GLU 61 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1bfm h GLU 61 CO 0.14 0.03 -0.12 -0.07 -1.00 0.00 0.00 179.01 177.99 1bfm h LEU 62 N 0.00 -0.29 -0.52 1.33 -0.00 -0.96 -0.51 115.31 114.37 1bfm h LEU 62 Ca -0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1bfm h LEU 62 Cb 0.13 0.08 -0.03 0.00 -0.00 0.00 0.00 40.66 40.84 1bfm h LEU 62 CO 0.00 -0.19 0.33 0.00 -0.00 0.00 0.00 178.44 178.59 1bfm h ALA 63 N 0.37 0.65 0.00 1.53 0.00 0.11 -1.39 119.26 120.53 1bfm h ALA 63 Ca -0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1bfm h ALA 63 Cb 0.29 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1bfm h ALA 63 CO 0.06 0.11 -0.00 -0.24 0.00 0.00 0.00 179.25 179.18 1bfm h VAL 64 N 0.70 0.80 -0.01 0.00 3.04 0.44 -2.45 116.25 118.77 1bfm h VAL 64 Ca 0.19 -1.60 0.00 0.00 -1.01 0.00 0.00 66.70 64.29 1bfm h VAL 64 Cb -0.06 1.52 -0.00 0.00 -2.01 0.00 0.00 31.29 30.73 1bfm h VAL 64 CO -0.04 0.27 0.01 -0.09 -1.01 0.00 0.00 177.57 176.71 1bfm h ARG 65 N -1.00 0.00 -0.70 4.17 2.43 -1.17 0.20 114.38 118.30 1bfm h ARG 65 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1bfm h ARG 65 Cb 0.45 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 1bfm h ARG 65 CO 0.00 0.00 0.41 -0.09 -1.51 0.00 0.00 179.97 178.78 1bfm h ARG 66 N 0.00 0.97 0.46 0.20 2.43 -1.06 -2.53 114.38 114.86 1bfm h ARG 66 Ca 0.01 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.05 1bfm h ARG 66 Cb 0.03 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1bfm h ARG 66 CO -0.00 0.70 -0.22 0.74 -1.51 0.00 0.00 179.97 179.68 1bfm h PHE 67 N 0.96 -0.58 -2.58 2.20 0.04 -0.17 -3.42 116.94 113.39 1bfm h PHE 67 Ca 0.25 -0.01 -0.56 0.00 2.80 0.00 0.00 57.97 60.44 1bfm h PHE 67 Cb 0.00 0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 1bfm h PHE 67 CO -0.01 -0.34 1.19 0.15 -0.60 0.00 0.00 178.31 178.71 1bfm s LYS 68 N -5.94 3.78 0.00 1.51 1.02 -0.63 -5.13 119.74 114.35 1bfm s LYS 68 Ca -0.16 1.90 0.02 0.00 0.02 0.00 0.00 55.97 57.74 1bfm s LYS 68 Cb 0.04 -4.10 0.09 0.00 -0.52 0.00 0.00 37.83 33.34 1bfm s LYS 68 CO 0.62 -1.33 0.58 1.17 -0.92 0.00 0.00 175.35 175.48