#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 0.00 -3.29 2.12 -0.58 -1.26 -4.90 120.64 112.73 1bfm n GLU 2 Ca 0.00 0.05 -0.36 0.00 -0.42 0.00 0.00 57.16 56.43 1bfm n GLU 2 Cb 0.00 -0.39 -0.06 0.00 -0.57 0.00 0.00 31.44 30.42 1bfm n GLU 2 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1bfm s LEU 3 N -2.24 4.38 0.38 -4.62 1.43 -1.26 -5.06 118.68 111.68 1bfm s LEU 3 Ca 0.00 1.18 -0.27 0.00 -1.03 0.00 0.00 54.13 54.00 1bfm s LEU 3 Cb 0.00 -3.25 -0.10 0.00 0.03 0.00 0.00 46.19 42.87 1bfm s LEU 3 CO 0.00 0.13 1.43 -2.16 0.23 0.00 0.00 176.35 175.97 1bfm s PRO 4 N -1.79 4.06 0.00 1.29 0.04 -1.26 -4.94 135.00 132.41 1bfm s PRO 4 Ca 0.37 2.45 0.22 0.00 0.04 0.00 0.00 61.00 64.08 1bfm s PRO 4 Cb -0.16 -2.91 -0.02 0.00 0.04 0.00 0.00 34.50 31.44 1bfm s PRO 4 CO 0.19 -0.52 1.02 0.44 0.04 0.00 0.00 177.00 178.17 1bfm n ILE 5 N 0.37 0.02 0.21 0.56 -0.00 -1.26 -3.64 119.36 115.62 1bfm n ILE 5 Ca 0.02 -0.05 -0.15 0.00 -0.00 0.00 0.00 62.75 62.57 1bfm n ILE 5 Cb 0.40 0.68 -0.08 0.00 -0.00 0.00 0.00 39.64 40.65 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 2.90 -0.49 -0.04 -1.28 0.00 -1.99 0.46 119.26 118.83 1bfm h ALA 6 Ca 0.00 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1bfm h ALA 6 Cb 0.55 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 1bfm h ALA 6 CO 0.00 -0.75 -0.42 -1.00 0.00 0.00 0.00 179.25 177.09 1bfm h PRO 7 N -0.54 -0.52 0.00 0.00 0.13 -1.99 -0.94 132.00 128.14 1bfm h PRO 7 Ca -0.05 0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.11 1bfm h PRO 7 Cb 0.41 0.12 -0.00 0.00 0.13 0.00 0.00 31.00 31.65 1bfm h PRO 7 CO 0.08 -0.35 -0.05 0.82 -0.23 0.00 0.00 178.00 178.27 1bfm h ILE 8 N -0.54 0.63 0.48 -3.56 2.04 -1.59 0.20 117.51 115.18 1bfm h ILE 8 Ca 0.06 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 1bfm h ILE 8 Cb 0.64 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1bfm h ILE 8 CO -0.34 0.05 -0.23 1.23 0.00 0.00 0.00 178.15 178.85 1bfm h GLY 9 N 0.28 -0.68 2.00 5.37 0.00 0.13 -2.42 103.07 107.76 1bfm h GLY 9 Ca -0.00 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1bfm h GLY 9 CO 0.01 -0.25 0.00 3.21 0.00 0.00 0.00 176.54 179.51 1bfm h ARG 10 N -0.69 0.00 0.00 4.80 2.47 -0.04 -1.58 114.38 119.34 1bfm h ARG 10 Ca -0.07 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 1bfm h ARG 10 Cb 0.52 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.84 1bfm h ARG 10 CO 0.11 0.00 0.00 -0.89 0.56 0.00 0.00 179.97 179.75 1bfm n ILE 11 N -2.55 0.00 0.30 2.04 5.41 -0.72 -0.79 119.36 123.05 1bfm n ILE 11 Ca 0.04 1.28 0.17 0.00 1.00 0.00 0.00 62.75 65.23 1bfm n ILE 11 Cb 0.39 -2.26 0.94 0.00 -0.71 0.00 0.00 39.64 38.00 1bfm n ILE 11 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1bfm h ILE 12 N 0.00 0.36 -0.37 1.39 1.08 -1.37 0.67 117.51 119.28 1bfm h ILE 12 Ca 0.00 -0.17 -0.15 0.00 -0.39 0.00 0.00 64.86 64.15 1bfm h ILE 12 Cb 0.00 1.12 -0.01 0.00 -3.07 0.00 0.00 36.82 34.86 1bfm h ILE 12 CO 0.00 0.03 -0.35 0.11 -0.69 0.00 0.00 178.15 177.25 1bfm h LYS 13 N 0.00 0.84 -0.32 2.37 1.57 -1.35 -0.67 116.57 119.02 1bfm h LYS 13 Ca -0.00 -0.42 -0.03 0.00 -1.87 0.00 0.00 60.65 58.34 1bfm h LYS 13 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1bfm h LYS 13 CO 0.00 1.06 0.08 0.22 -0.57 0.00 0.00 179.45 180.24 1bfm h ASP 14 N 0.70 0.41 0.26 0.86 1.82 0.25 0.56 116.42 121.27 1bfm h ASP 14 Ca 0.07 -0.05 -0.01 0.00 -0.39 0.00 0.00 57.03 56.65 1bfm h ASP 14 Cb 0.91 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 40.81 1bfm h ASP 14 CO 0.08 0.42 -0.17 0.00 -1.61 0.00 0.00 179.24 177.96 1bfm h ALA 15 N 1.64 -0.40 0.00 -0.78 0.00 -1.12 -3.46 119.26 115.14 1bfm h ALA 15 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1bfm h ALA 15 Cb 0.17 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1bfm h ALA 15 CO -0.00 -0.74 0.00 0.41 0.00 0.00 0.00 179.25 178.92 1bfm n GLY 16 N -1.29 -0.36 2.37 0.00 0.00 0.20 -5.13 105.19 100.98 1bfm n GLY 16 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1bfm n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bfm n ALA 17 N 0.00 -3.18 0.03 4.61 0.00 -0.30 -4.95 120.51 116.72 1bfm n ALA 17 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 53.44 52.31 1bfm n ALA 17 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.36 1bfm n ALA 17 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1bfm n GLU 18 N -4.36 0.00 -3.01 0.00 0.28 -1.26 -4.50 120.64 107.78 1bfm n GLU 18 Ca 0.10 0.00 -0.44 0.00 -0.16 0.00 0.00 57.16 56.66 1bfm n GLU 18 Cb 0.43 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.26 1bfm n GLU 18 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1bfm s ARG 19 N -2.00 3.12 -0.23 3.44 0.52 -1.26 -5.00 118.95 117.54 1bfm s ARG 19 Ca 0.00 -1.20 -0.03 0.00 -0.52 0.00 0.00 55.73 53.98 1bfm s ARG 19 Cb 0.00 -4.31 0.01 0.00 0.52 0.00 0.00 34.95 31.17 1bfm s ARG 19 CO 0.00 -1.66 -0.06 0.08 0.02 0.00 0.00 175.30 173.69 1bfm s VAL 20 N 3.14 3.10 0.88 3.52 1.01 -1.26 -5.10 120.40 125.69 1bfm s VAL 20 Ca 0.17 -0.75 -0.11 0.00 0.00 0.00 0.00 61.98 61.30 1bfm s VAL 20 Cb -0.20 -2.48 0.12 0.00 0.00 0.00 0.00 36.38 33.83 1bfm s VAL 20 CO 0.06 0.33 1.15 -0.55 0.00 0.00 0.00 175.10 176.09 1bfm s SER 21 N 1.41 3.22 0.61 3.32 0.15 -1.26 -4.56 113.70 116.59 1bfm s SER 21 Ca 0.03 2.17 0.36 0.00 0.70 0.00 0.00 55.95 59.22 1bfm s SER 21 Cb -0.15 -2.57 2.02 0.00 -1.71 0.00 0.00 66.02 63.61 1bfm s SER 21 CO -0.04 -2.91 2.28 0.44 1.20 0.00 0.00 173.24 174.21 1bfm h ASP 22 N -1.62 0.00 0.11 5.45 3.32 -1.99 0.19 116.42 121.88 1bfm h ASP 22 Ca -0.44 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.25 1bfm h ASP 22 Cb 1.27 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.76 1bfm h ASP 22 CO 0.43 0.01 -2.22 -0.67 -1.72 0.00 0.00 179.24 175.07 1bfm n ASP 23 N -3.48 1.22 -0.27 6.45 2.03 -1.26 -1.93 116.55 119.31 1bfm n ASP 23 Ca -0.03 0.07 -0.01 0.00 0.52 0.00 0.00 54.79 55.34 1bfm n ASP 23 Cb 0.10 -0.01 0.18 0.00 -0.72 0.00 0.00 41.12 40.67 1bfm n ASP 23 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bfm h ALA 24 N 0.49 1.34 0.24 -1.67 0.00 -1.84 0.58 119.26 118.40 1bfm h ALA 24 Ca -0.49 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 1bfm h ALA 24 Cb 2.05 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1bfm h ALA 24 CO 0.01 0.57 -0.12 -0.09 0.00 0.00 0.00 179.25 179.63 1bfm h ARG 25 N 1.13 -0.31 -0.15 0.00 2.43 -0.68 -0.85 114.38 115.95 1bfm h ARG 25 Ca 0.30 0.02 -0.19 0.00 -0.81 0.00 0.00 59.98 59.30 1bfm h ARG 25 Cb -0.07 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1bfm h ARG 25 CO -0.06 -0.20 -0.68 0.97 -1.51 0.00 0.00 179.97 178.49 1bfm h ILE 26 N -0.33 1.32 0.18 1.20 6.09 -0.93 -2.34 117.51 122.69 1bfm h ILE 26 Ca -0.03 -1.95 -0.01 0.00 -1.37 0.00 0.00 64.86 61.49 1bfm h ILE 26 Cb 0.25 1.93 0.00 0.00 0.47 0.00 0.00 36.82 39.47 1bfm h ILE 26 CO 0.05 0.61 -0.08 0.74 -3.07 0.00 0.00 178.15 176.40 1bfm h THR 27 N 0.45 0.86 0.00 2.19 2.02 0.35 0.46 112.91 119.24 1bfm h THR 27 Ca -0.02 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1bfm h THR 27 Cb 1.27 0.95 -0.00 0.00 -1.74 0.00 0.00 68.15 68.63 1bfm h THR 27 CO 0.13 0.03 -0.04 0.25 0.37 0.00 0.00 175.52 176.27 1bfm h LEU 28 N -0.31 0.00 0.15 2.58 5.85 -1.05 0.59 115.31 123.13 1bfm h LEU 28 Ca -0.02 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1bfm h LEU 28 Cb 0.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1bfm h LEU 28 CO 0.04 0.04 -0.07 0.00 -0.34 0.00 0.00 178.44 178.11 1bfm h ALA 29 N 1.96 -0.21 0.00 1.25 0.00 -1.15 -1.41 119.26 119.70 1bfm h ALA 29 Ca -0.00 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1bfm h ALA 29 Cb 0.10 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1bfm h ALA 29 CO 0.01 -0.34 -0.44 0.87 0.00 0.00 0.00 179.25 179.34 1bfm h LYS 30 N -0.76 0.00 0.00 0.00 1.79 0.78 0.38 116.57 118.76 1bfm h LYS 30 Ca -0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1bfm h LYS 30 Cb 0.52 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 1bfm h LYS 30 CO 0.03 0.44 0.00 -0.89 -1.08 0.00 0.00 179.45 177.96 1bfm n ILE 31 N -3.84 0.00 0.31 1.86 5.41 0.20 -2.03 119.36 121.26 1bfm n ILE 31 Ca -0.01 1.30 0.21 0.00 1.00 0.00 0.00 62.75 65.24 1bfm n ILE 31 Cb 0.49 -2.28 1.11 0.00 -0.71 0.00 0.00 39.64 38.25 1bfm n ILE 31 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1bfm h LEU 32 N 0.00 0.00 0.09 1.39 4.07 -0.70 0.20 115.31 120.36 1bfm h LEU 32 Ca 0.00 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 57.61 1bfm h LEU 32 Cb 0.00 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 1bfm h LEU 32 CO 0.00 0.00 -1.94 -1.84 -1.08 0.00 0.00 178.44 173.58 1bfm n GLU 33 N -2.93 0.71 -0.06 1.13 -0.00 0.08 0.57 120.64 120.15 1bfm n GLU 33 Ca -0.03 0.30 0.01 0.00 -0.00 0.00 0.00 57.16 57.45 1bfm n GLU 33 Cb 0.07 -1.69 0.33 0.00 -0.00 0.00 0.00 31.44 30.14 1bfm n GLU 33 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 1bfm h GLU 34 N -0.14 0.65 0.39 3.44 4.81 -0.77 -0.16 114.58 122.81 1bfm h GLU 34 Ca -0.44 -0.08 -0.02 0.00 -0.13 0.00 0.00 59.36 58.70 1bfm h GLU 34 Cb 1.89 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 31.15 1bfm h GLU 34 CO 0.01 0.51 -0.19 0.52 -0.73 0.00 0.00 179.01 179.14 1bfm h MET 35 N 0.65 -0.51 -0.67 1.92 2.86 -0.59 -2.25 114.93 116.35 1bfm h MET 35 Ca 0.16 0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.81 1bfm h MET 35 Cb 0.08 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 1bfm h MET 35 CO -0.02 -0.31 0.29 0.78 1.06 0.00 0.00 176.91 178.71 1bfm h GLY 36 N -0.58 1.03 1.62 8.32 0.00 0.14 0.84 103.07 114.44 1bfm h GLY 36 Ca -0.05 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.75 1bfm h GLY 36 CO 0.09 0.49 0.19 3.21 0.00 0.00 0.00 176.54 180.52 1bfm h ARG 37 N 0.95 0.51 0.35 4.80 3.08 -1.07 -2.17 114.38 120.83 1bfm h ARG 37 Ca 0.23 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 1bfm h ARG 37 Cb 0.14 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1bfm h ARG 37 CO -0.02 0.38 -0.17 -0.44 -1.07 0.00 0.00 179.97 178.65 1bfm h ASP 38 N 0.51 -0.40 -0.82 7.04 3.32 0.13 -2.35 116.42 123.85 1bfm h ASP 38 Ca 0.13 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1bfm h ASP 38 Cb 0.03 0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 1bfm h ASP 38 CO -0.02 -0.19 0.46 0.40 -1.72 0.00 0.00 179.24 178.17 1bfm h ILE 39 N -0.59 1.24 0.59 0.35 2.04 -0.79 -2.19 117.51 118.15 1bfm h ILE 39 Ca -0.05 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 1bfm h ILE 39 Cb 0.43 0.12 0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1bfm h ILE 39 CO 0.08 0.26 -0.28 0.00 0.00 0.00 0.00 178.15 178.21 1bfm h ALA 40 N 1.36 -0.79 -0.06 1.87 0.00 -1.09 0.57 119.26 121.12 1bfm h ALA 40 Ca 0.29 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1bfm h ALA 40 Cb 0.01 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1bfm h ALA 40 CO -0.05 -0.85 -0.05 1.03 0.00 0.00 0.00 179.25 179.33 1bfm h SER 41 N -0.98 0.07 0.98 0.00 0.87 -1.47 0.72 113.55 113.74 1bfm h SER 41 Ca -0.08 -0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.42 1bfm h SER 41 Cb 0.66 -0.02 0.01 0.00 -0.44 0.00 0.00 62.40 62.61 1bfm h SER 41 CO 0.13 0.14 -0.47 -0.33 -0.53 0.00 0.00 176.83 175.77 1bfm h GLU 42 N 0.08 -1.27 0.00 2.24 4.39 -1.33 -2.20 114.58 116.49 1bfm h GLU 42 Ca 0.02 0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1bfm h GLU 42 Cb 0.14 0.29 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1bfm h GLU 42 CO 0.01 -0.84 0.00 0.00 -1.16 0.00 0.00 179.01 177.01 1bfm n ALA 43 N -2.68 1.11 -0.08 3.43 0.00 0.20 -0.07 120.51 122.41 1bfm n ALA 43 Ca -0.16 0.07 -0.09 0.00 0.00 0.00 0.00 53.44 53.25 1bfm n ALA 43 Cb 0.52 -1.15 -0.05 0.00 0.00 0.00 0.00 19.45 18.76 1bfm n ALA 43 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1bfm h ILE 44 N 0.00 0.46 0.00 0.00 2.10 0.75 0.29 117.51 121.11 1bfm h ILE 44 Ca 0.00 -1.48 -0.03 0.00 1.08 0.00 0.00 64.86 64.44 1bfm h ILE 44 Cb 0.04 1.00 -0.00 0.00 -1.09 0.00 0.00 36.82 36.77 1bfm h ILE 44 CO 0.00 0.16 -0.14 0.50 -1.08 0.00 0.00 178.15 177.59 1bfm h LYS 45 N -1.00 0.00 -0.09 2.19 3.64 -1.05 0.14 116.57 120.40 1bfm h LYS 45 Ca -0.09 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1bfm h LYS 45 Cb 0.67 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1bfm h LYS 45 CO -0.06 0.14 0.05 -0.07 -2.27 0.00 0.00 179.45 177.24 1bfm h LEU 46 N 0.00 0.11 -2.06 5.20 4.07 -0.49 -2.43 115.31 119.71 1bfm h LEU 46 Ca -0.00 -0.06 -0.01 0.00 0.08 0.00 0.00 57.88 57.89 1bfm h LEU 46 Cb 0.51 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.22 1bfm h LEU 46 CO 0.02 0.14 -0.05 0.00 -1.08 0.00 0.00 178.44 177.46 1bfm h ALA 47 N 0.98 1.69 0.23 1.53 0.00 0.16 0.57 119.26 124.43 1bfm h ALA 47 Ca 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1bfm h ALA 47 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1bfm h ALA 47 CO -0.01 0.07 -0.11 0.00 0.00 0.00 0.00 179.25 179.20 1bfm h ARG 48 N 0.00 -0.30 0.00 0.00 3.08 -1.02 0.17 114.38 116.31 1bfm h ARG 48 Ca -0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1bfm h ARG 48 Cb 0.11 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1bfm h ARG 48 CO 0.01 -0.00 0.00 1.25 -1.07 0.00 0.00 179.97 180.16 1bfm h HIS 49 N -0.61 0.00 0.49 3.04 2.76 -1.18 -1.61 115.15 118.04 1bfm h HIS 49 Ca -0.03 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.11 1bfm h HIS 49 Cb 0.44 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.41 1bfm h HIS 49 CO 0.02 0.00 -0.24 0.00 -1.30 0.00 0.00 177.93 176.41 1bfm h ALA 50 N 2.18 -0.66 0.00 5.26 0.00 0.96 -3.47 119.26 123.53 1bfm h ALA 50 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1bfm h ALA 50 Cb 0.50 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1bfm h ALA 50 CO 0.00 -0.85 0.00 0.41 0.00 0.00 0.00 179.25 178.81 1bfm n GLY 51 N -1.25 0.57 5.00 0.00 0.00 -0.11 -4.94 105.19 104.46 1bfm n GLY 51 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1bfm n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bfm n ARG 52 N 0.00 0.00 -1.56 1.61 3.00 0.41 -4.86 116.66 115.27 1bfm n ARG 52 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 57.85 57.51 1bfm n ARG 52 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 32.42 1bfm n ARG 52 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1bfm s LYS 53 N 0.00 2.02 0.14 5.56 1.02 -1.26 -4.47 119.74 122.74 1bfm s LYS 53 Ca 0.00 1.28 0.00 0.00 0.02 0.00 0.00 55.97 57.27 1bfm s LYS 53 Cb 0.00 -4.61 0.00 0.00 -0.52 0.00 0.00 37.83 32.70 1bfm s LYS 53 CO 0.00 -3.46 0.00 2.41 -0.92 0.00 0.00 175.35 173.38 1bfm n THR 54 N 8.11 -6.53 -2.70 2.17 -1.04 -1.26 -4.94 114.28 108.08 1bfm n THR 54 Ca 0.38 1.65 -0.40 0.00 -2.04 0.00 0.00 64.05 63.64 1bfm n THR 54 Cb 0.53 -3.33 -0.06 0.00 -1.82 0.00 0.00 70.33 65.66 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 -0.68 3.98 0.15 12.58 1.01 -1.26 -5.01 121.20 131.97 1bfm s ILE 55 Ca 0.00 1.98 0.01 0.00 0.00 0.00 0.00 60.65 62.64 1bfm s ILE 55 Cb 0.00 -4.25 -0.00 0.00 0.01 0.00 0.00 42.46 38.22 1bfm s ILE 55 CO 0.00 0.46 0.17 0.29 0.00 0.00 0.00 174.94 175.86 1bfm n LYS 56 N 1.39 0.25 0.17 2.79 4.76 -1.26 -5.00 118.16 121.26 1bfm n LYS 56 Ca -0.02 -1.36 0.05 0.00 -2.87 0.00 0.00 58.31 54.11 1bfm n LYS 56 Cb 0.47 1.21 0.52 0.00 -1.84 0.00 0.00 35.03 35.39 1bfm n LYS 56 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1bfm h ALA 57 N 1.59 1.78 -0.41 7.82 0.00 -1.97 0.38 119.26 128.45 1bfm h ALA 57 Ca -0.11 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1bfm h ALA 57 Cb 0.53 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1bfm h ALA 57 CO 0.16 0.17 -0.10 1.49 0.00 0.00 0.00 179.25 180.97 1bfm h GLU 58 N 0.15 0.80 0.13 0.00 4.81 -1.97 0.56 114.58 119.05 1bfm h GLU 58 Ca 0.04 -0.31 -0.29 0.00 -0.13 0.00 0.00 59.36 58.67 1bfm h GLU 58 Cb 0.14 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 1bfm h GLU 58 CO 0.00 0.92 -1.40 -0.44 -0.73 0.00 0.00 179.01 177.37 1bfm h ASP 59 N 0.62 0.41 -0.94 1.04 3.32 -1.28 0.48 116.42 120.07 1bfm h ASP 59 Ca 0.10 -0.50 -0.01 0.00 0.02 0.00 0.00 57.03 56.64 1bfm h ASP 59 Cb 0.63 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.00 1bfm h ASP 59 CO 0.04 1.41 0.55 0.40 -1.72 0.00 0.00 179.24 179.92 1bfm h ILE 60 N 0.07 1.26 0.10 0.35 1.08 -0.25 -0.77 117.51 119.36 1bfm h ILE 60 Ca -0.19 -0.59 -0.26 0.00 -0.39 0.00 0.00 64.86 63.42 1bfm h ILE 60 Cb 2.00 -0.04 -0.00 0.00 -3.07 0.00 0.00 36.82 35.70 1bfm h ILE 60 CO 0.18 0.28 -1.22 -0.33 -0.69 0.00 0.00 178.15 176.37 1bfm h GLU 61 N 1.30 0.22 -0.47 2.37 5.08 0.51 -2.32 114.58 121.26 1bfm h GLU 61 Ca 0.33 -0.38 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1bfm h GLU 61 Cb -0.03 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1bfm h GLU 61 CO -0.06 1.17 0.29 -0.07 -1.00 0.00 0.00 179.01 179.34 1bfm h LEU 62 N 0.06 0.57 -1.22 1.33 3.38 0.06 -1.98 115.31 117.50 1bfm h LEU 62 Ca -0.12 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 1bfm h LEU 62 Cb 1.94 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 42.52 1bfm h LEU 62 CO 0.19 0.45 0.36 0.00 0.09 0.00 0.00 178.44 179.53 1bfm h ALA 63 N 1.14 1.41 0.07 1.53 0.00 -0.92 -1.11 119.26 121.37 1bfm h ALA 63 Ca 0.17 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1bfm h ALA 63 Cb -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1bfm h ALA 63 CO -0.03 0.49 -0.03 -0.24 0.00 0.00 0.00 179.25 179.44 1bfm h VAL 64 N 0.90 1.18 0.00 0.00 3.04 -0.82 0.12 116.25 120.67 1bfm h VAL 64 Ca 0.23 -1.51 0.00 0.00 -1.01 0.00 0.00 66.70 64.41 1bfm h VAL 64 Cb 0.02 2.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.37 1bfm h VAL 64 CO -0.04 0.34 0.00 0.03 -1.01 0.00 0.00 177.57 176.89 1bfm h ARG 65 N -0.85 0.00 0.00 4.17 3.08 -1.27 -1.97 114.38 117.54 1bfm h ARG 65 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1bfm h ARG 65 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1bfm h ARG 65 CO 0.01 0.00 -1.04 -2.13 -1.07 0.00 0.00 179.97 175.75 1bfm n ARG 66 N -2.64 1.25 -0.03 0.04 0.00 -0.43 -3.74 116.66 111.12 1bfm n ARG 66 Ca -0.01 -0.04 0.06 0.00 -0.00 0.00 0.00 57.85 57.86 1bfm n ARG 66 Cb 0.13 -1.32 -0.16 0.00 0.00 0.00 0.00 32.46 31.11 1bfm n ARG 66 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.63 179.60 1bfm n PHE 67 N -1.57 0.00 -1.63 -0.14 -1.74 0.27 -4.98 117.46 107.67 1bfm n PHE 67 Ca 0.02 0.00 -0.40 0.00 -0.56 0.00 0.00 57.45 56.50 1bfm n PHE 67 Cb 0.31 -0.58 -0.03 0.00 1.52 0.00 0.00 39.48 40.70 1bfm n PHE 67 CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 1bfm s LYS 68 N -3.20 2.73 0.00 3.97 2.36 -0.74 -5.11 119.74 119.75 1bfm s LYS 68 Ca -0.08 1.70 0.00 0.00 -2.55 0.00 0.00 55.97 55.04 1bfm s LYS 68 Cb 0.11 -4.44 0.00 0.00 -1.05 0.00 0.00 37.83 32.45 1bfm s LYS 68 CO 0.84 -2.56 0.00 1.17 1.55 0.00 0.00 175.35 176.35