#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bfm s GLU 2 N 0.00 0.01 0.33 3.17 -1.05 -1.26 -5.05 118.70 114.85 1bfm s GLU 2 Ca 0.00 0.50 -0.29 0.00 -0.15 0.00 0.00 54.97 55.03 1bfm s GLU 2 Cb 0.00 -0.32 -0.12 0.00 -0.44 0.00 0.00 34.13 33.25 1bfm s GLU 2 CO 0.00 -0.30 1.39 1.28 0.95 0.00 0.00 175.26 178.58 1bfm n LEU 3 N 5.21 3.92 -4.77 1.83 4.32 -1.26 -4.89 117.00 121.35 1bfm n LEU 3 Ca -0.06 1.20 -0.40 0.00 -0.02 0.00 0.00 56.01 56.72 1bfm n LEU 3 Cb 0.50 -1.53 -0.00 0.00 -1.62 0.00 0.00 43.42 40.77 1bfm n LEU 3 CO 0.06 -0.25 1.03 -2.16 -1.22 0.00 0.00 177.39 174.86 1bfm s PRO 4 N -1.63 4.07 -0.01 3.23 0.04 -1.26 -4.85 135.00 134.59 1bfm s PRO 4 Ca 0.57 2.33 0.21 0.00 0.04 0.00 0.00 61.00 64.15 1bfm s PRO 4 Cb -0.54 -2.89 -0.26 0.00 0.04 0.00 0.00 34.50 30.84 1bfm s PRO 4 CO 0.60 -0.47 0.75 0.44 0.04 0.00 0.00 177.00 178.36 1bfm n ILE 5 N 0.35 0.00 0.06 0.56 -5.35 -1.26 -2.84 119.36 110.89 1bfm n ILE 5 Ca 0.02 -0.17 -0.10 0.00 -0.27 0.00 0.00 62.75 62.23 1bfm n ILE 5 Cb 0.42 0.66 -0.07 0.00 -1.74 0.00 0.00 39.64 38.91 1bfm n ILE 5 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1bfm h ALA 6 N 2.63 -0.25 -0.04 -1.28 0.00 -1.96 0.56 119.26 118.92 1bfm h ALA 6 Ca 0.00 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1bfm h ALA 6 Cb 0.66 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 1bfm h ALA 6 CO 0.00 -0.30 -0.48 -1.35 0.00 0.00 0.00 179.25 177.12 1bfm h PRO 7 N -0.92 -0.55 -0.04 0.00 0.11 -1.99 0.33 132.00 128.94 1bfm h PRO 7 Ca -0.03 0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 1bfm h PRO 7 Cb 0.49 0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.72 1bfm h PRO 7 CO 0.04 -0.37 0.02 0.82 -0.21 0.00 0.00 178.00 178.31 1bfm h ILE 8 N -0.57 1.06 -0.48 4.15 2.04 -1.65 -2.38 117.51 119.68 1bfm h ILE 8 Ca 0.02 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 1bfm h ILE 8 Cb 0.63 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1bfm h ILE 8 CO -0.34 0.05 0.21 1.23 0.00 0.00 0.00 178.15 179.30 1bfm h GLY 9 N -0.01 0.73 1.02 5.37 0.00 0.41 0.65 103.07 111.23 1bfm h GLY 9 Ca 0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1bfm h GLY 9 CO -0.00 0.33 0.48 3.21 0.00 0.00 0.00 176.54 180.56 1bfm h ARG 10 N 0.68 1.16 -0.56 4.80 2.47 0.13 -1.29 114.38 121.76 1bfm h ARG 10 Ca 0.17 -0.12 -0.02 0.00 -1.26 0.00 0.00 59.98 58.75 1bfm h ARG 10 Cb 0.11 -0.23 -0.03 0.00 -1.65 0.00 0.00 29.97 28.17 1bfm h ARG 10 CO -0.02 0.83 0.28 0.82 0.56 0.00 0.00 179.97 182.44 1bfm h ILE 11 N 1.16 1.18 -0.10 2.04 2.04 0.78 -0.84 117.51 123.77 1bfm h ILE 11 Ca 0.30 -0.50 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 1bfm h ILE 11 Cb -0.01 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 1bfm h ILE 11 CO -0.05 0.21 -0.36 0.40 0.00 0.00 0.00 178.15 178.35 1bfm h ILE 12 N 0.78 1.39 -0.17 -0.67 1.08 -0.60 -2.04 117.51 117.28 1bfm h ILE 12 Ca 0.20 -1.70 -0.02 0.00 -0.39 0.00 0.00 64.86 62.94 1bfm h ILE 12 Cb 0.07 2.20 -0.01 0.00 -3.07 0.00 0.00 36.82 36.00 1bfm h ILE 12 CO -0.03 0.50 0.00 0.50 -0.69 0.00 0.00 178.15 178.43 1bfm h LYS 13 N -0.02 0.24 -0.29 2.37 3.64 -1.00 -2.12 116.57 119.39 1bfm h LYS 13 Ca -0.02 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1bfm h LYS 13 Cb 0.99 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.75 1bfm h LYS 13 CO 0.08 0.27 0.09 0.22 -2.27 0.00 0.00 179.45 177.84 1bfm h ASP 14 N 0.24 0.37 0.28 4.20 3.58 -0.56 0.56 116.42 125.09 1bfm h ASP 14 Ca 0.06 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 1bfm h ASP 14 Cb 0.17 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.12 1bfm h ASP 14 CO 0.00 0.37 -0.16 0.00 -2.88 0.00 0.00 179.24 176.57 1bfm h ALA 15 N 1.69 -0.41 0.00 -0.78 0.00 -0.75 -3.46 119.26 115.54 1bfm h ALA 15 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1bfm h ALA 15 Cb 0.13 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.12 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 -1.29 0.66 3.66 0.00 0.00 0.20 -5.10 105.19 103.32 1bfm n GLY 16 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.66 3.57 0.00 4.61 0.00 -0.90 -4.91 121.76 123.47 1bfm s ALA 17 Ca 0.00 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1bfm s ALA 17 Cb 0.00 -3.84 0.00 0.00 0.00 0.00 0.00 23.12 19.28 1bfm s ALA 17 CO 0.00 -1.57 0.33 -1.91 0.00 0.00 0.00 175.76 172.61 1bfm n GLU 18 N 7.51 0.00 -4.65 0.00 2.13 -1.26 -4.72 120.64 119.65 1bfm n GLU 18 Ca 0.20 0.40 -0.25 0.00 0.66 0.00 0.00 57.16 58.17 1bfm n GLU 18 Cb 0.41 -1.09 -0.16 0.00 0.27 0.00 0.00 31.44 30.87 1bfm n GLU 18 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1bfm s ARG 19 N -1.47 1.70 -0.06 5.31 0.52 -1.26 -5.11 118.95 118.57 1bfm s ARG 19 Ca 0.00 -0.47 0.04 0.00 -0.52 0.00 0.00 55.73 54.79 1bfm s ARG 19 Cb 0.00 -1.42 -0.00 0.00 0.52 0.00 0.00 34.95 34.05 1bfm s ARG 19 CO 0.00 0.09 -0.18 0.08 0.02 0.00 0.00 175.30 175.31 1bfm s VAL 20 N 0.46 1.57 0.20 3.52 1.01 -1.26 -5.13 120.40 120.77 1bfm s VAL 20 Ca -0.11 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 60.80 1bfm s VAL 20 Cb -0.14 -1.36 -0.08 0.00 0.00 0.00 0.00 36.38 34.79 1bfm s VAL 20 CO 0.03 0.45 1.16 -0.94 0.00 0.00 0.00 175.10 175.81 1bfm s SER 21 N 0.20 7.15 0.19 3.32 1.04 -1.26 -4.89 113.70 119.45 1bfm s SER 21 Ca -0.09 2.22 0.14 0.00 0.48 0.00 0.00 55.95 58.69 1bfm s SER 21 Cb -0.14 -2.61 0.72 0.00 0.10 0.00 0.00 66.02 64.09 1bfm s SER 21 CO 0.04 -0.31 1.42 0.47 0.98 0.00 0.00 173.24 175.84 1bfm n ASP 22 N 2.25 0.35 0.12 7.02 8.00 -1.26 -0.38 116.55 132.64 1bfm n ASP 22 Ca 0.03 0.65 0.08 0.00 0.71 0.00 0.00 54.79 56.26 1bfm n ASP 22 Cb 0.45 -0.70 0.02 0.00 -0.02 0.00 0.00 41.12 40.87 1bfm n ASP 22 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1bfm h ASP 23 N 0.00 0.00 -0.20 -2.24 5.19 -1.99 -1.60 116.42 115.58 1bfm h ASP 23 Ca 0.00 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.24 1bfm h ASP 23 Cb 0.03 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.54 1bfm h ASP 23 CO 0.00 0.19 -0.49 0.00 -3.12 0.00 0.00 179.24 175.82 1bfm h ALA 24 N 1.81 0.60 -0.14 3.45 0.00 -1.09 -1.43 119.26 122.46 1bfm h ALA 24 Ca -0.04 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 1bfm h ALA 24 Cb 1.18 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1bfm h ALA 24 CO 0.02 0.68 0.01 0.00 0.00 0.00 0.00 179.25 179.96 1bfm h ARG 25 N 0.61 0.19 0.06 0.00 3.08 -0.86 0.23 114.38 117.68 1bfm h ARG 25 Ca 0.03 -0.02 -0.32 0.00 0.07 0.00 0.00 59.98 59.73 1bfm h ARG 25 Cb 1.07 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.05 1bfm h ARG 25 CO 0.11 0.20 -1.81 0.97 -1.07 0.00 0.00 179.97 178.37 1bfm h ILE 26 N 0.19 0.78 -0.81 2.04 6.09 -1.28 -2.03 117.51 122.49 1bfm h ILE 26 Ca 0.05 -2.56 -0.01 0.00 -1.37 0.00 0.00 64.86 60.96 1bfm h ILE 26 Cb 0.11 2.49 -0.04 0.00 0.47 0.00 0.00 36.82 39.85 1bfm h ILE 26 CO 0.00 0.69 0.45 0.74 -3.07 0.00 0.00 178.15 176.96 1bfm h THR 27 N 0.04 1.24 -0.48 2.19 2.02 -0.29 0.58 112.91 118.21 1bfm h THR 27 Ca -0.34 -0.59 0.02 0.00 0.77 0.00 0.00 66.41 66.27 1bfm h THR 27 Cb 2.02 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 68.56 1bfm h THR 27 CO 0.09 0.26 0.30 0.25 0.37 0.00 0.00 175.52 176.79 1bfm h LEU 28 N 1.12 0.49 -0.63 2.58 5.85 -1.06 0.23 115.31 123.88 1bfm h LEU 28 Ca 0.28 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 1bfm h LEU 28 Cb 0.02 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1bfm h LEU 28 CO -0.05 0.35 0.35 0.00 -0.34 0.00 0.00 178.44 178.75 1bfm h ALA 29 N 1.20 0.81 0.00 1.25 0.00 -0.61 0.57 119.26 122.48 1bfm h ALA 29 Ca 0.19 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1bfm h ALA 29 Cb -0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1bfm h ALA 29 CO -0.07 0.32 -0.67 0.87 0.00 0.00 0.00 179.25 179.70 1bfm h LYS 30 N 0.86 0.00 0.00 0.00 1.57 0.70 -2.06 116.57 117.64 1bfm h LYS 30 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1bfm h LYS 30 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1bfm h LYS 30 CO -0.04 0.67 0.00 -0.89 -0.57 0.00 0.00 179.45 178.63 1bfm n ILE 31 N -3.46 0.00 0.24 1.86 5.41 0.76 -2.15 119.36 122.01 1bfm n ILE 31 Ca 0.00 1.31 0.18 0.00 1.00 0.00 0.00 62.75 65.24 1bfm n ILE 31 Cb 0.73 -2.30 0.87 0.00 -0.71 0.00 0.00 39.64 38.24 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 0.62 1.39 -0.00 0.43 0.84 115.31 118.59 1bfm h LEU 32 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.85 1bfm h LEU 32 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 40.67 1bfm h LEU 32 CO 0.00 0.00 -0.30 -0.08 -0.00 0.00 0.00 178.44 178.06 1bfm h GLU 33 N 0.00 -0.80 0.00 1.13 4.22 -1.47 -1.75 114.58 115.90 1bfm h GLU 33 Ca 0.07 0.05 -0.01 0.00 0.08 0.00 0.00 59.36 59.55 1bfm h GLU 33 Cb 0.52 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 1bfm h GLU 33 CO -0.00 -0.54 -0.04 1.49 -2.18 0.00 0.00 179.01 177.74 1bfm h GLU 34 N -1.15 0.00 -0.25 1.92 4.22 0.11 0.96 114.58 120.39 1bfm h GLU 34 Ca -0.09 0.00 -0.19 0.00 0.08 0.00 0.00 59.36 59.17 1bfm h GLU 34 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1bfm h GLU 34 CO 0.14 0.04 -0.58 0.52 -2.18 0.00 0.00 179.01 176.95 1bfm h MET 35 N 0.00 0.79 -0.34 1.92 2.86 -1.17 -1.78 114.93 117.21 1bfm h MET 35 Ca -0.00 -0.52 -0.06 0.00 -2.06 0.00 0.00 59.70 57.06 1bfm h MET 35 Cb 0.08 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1bfm h MET 35 CO 0.01 1.14 -0.02 0.78 1.06 0.00 0.00 176.91 179.88 1bfm h GLY 36 N 0.78 0.66 1.89 8.32 0.00 0.16 0.81 103.07 115.68 1bfm h GLY 36 Ca 0.00 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 1bfm h GLY 36 CO 0.12 0.46 0.02 3.21 0.00 0.00 0.00 176.54 180.35 1bfm h ARG 37 N 0.42 0.15 0.26 4.80 3.08 0.08 -2.45 114.38 120.72 1bfm h ARG 37 Ca 0.09 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1bfm h ARG 37 Cb 0.48 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1bfm h ARG 37 CO 0.02 0.15 -0.13 -0.44 -1.07 0.00 0.00 179.97 178.51 1bfm h ASP 38 N 0.15 -0.30 -0.42 7.04 3.32 0.12 -2.34 116.42 124.00 1bfm h ASP 38 Ca 0.04 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 1bfm h ASP 38 Cb 0.08 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1bfm h ASP 38 CO -0.00 0.05 0.24 0.40 -1.72 0.00 0.00 179.24 178.20 1bfm h ILE 39 N -0.67 1.15 -0.15 0.35 2.04 0.28 -1.89 117.51 118.62 1bfm h ILE 39 Ca -0.04 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 1bfm h ILE 39 Cb 0.47 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1bfm h ILE 39 CO 0.06 0.15 0.09 0.00 0.00 0.00 0.00 178.15 178.45 1bfm h ALA 40 N 1.09 0.19 0.00 1.87 0.00 -1.37 0.59 119.26 121.63 1bfm h ALA 40 Ca 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1bfm h ALA 40 Cb 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1bfm h ALA 40 CO -0.02 -0.28 -0.08 1.03 0.00 0.00 0.00 179.25 179.89 1bfm h SER 41 N 0.16 0.00 -0.33 0.00 0.87 -1.28 0.61 113.55 113.58 1bfm h SER 41 Ca 0.05 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.52 1bfm h SER 41 Cb 0.05 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 1bfm h SER 41 CO -0.01 0.08 -0.16 -0.33 -0.53 0.00 0.00 176.83 175.88 1bfm h GLU 42 N 0.00 0.69 0.00 2.24 3.07 -0.49 -2.13 114.58 117.96 1bfm h GLU 42 Ca -0.00 -0.30 0.00 0.00 -0.50 0.00 0.00 59.36 58.56 1bfm h GLU 42 Cb 0.17 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1bfm h GLU 42 CO 0.01 0.90 0.00 0.00 -1.40 0.00 0.00 179.01 178.52 1bfm n ALA 43 N -2.45 1.96 -0.09 3.43 0.00 0.20 -1.48 120.51 122.08 1bfm n ALA 43 Ca -0.03 -0.08 -0.16 0.00 0.00 0.00 0.00 53.44 53.17 1bfm n ALA 43 Cb 0.39 -1.31 -0.10 0.00 0.00 0.00 0.00 19.45 18.43 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 0.94 -0.17 0.00 6.09 0.79 0.14 117.51 125.30 1bfm h ILE 44 Ca 0.00 -1.98 0.02 0.00 -1.37 0.00 0.00 64.86 61.54 1bfm h ILE 44 Cb 0.25 2.04 -0.01 0.00 0.47 0.00 0.00 36.82 39.58 1bfm h ILE 44 CO 0.00 0.32 0.12 0.50 -3.07 0.00 0.00 178.15 176.02 1bfm h LYS 45 N -1.00 0.14 0.11 2.19 3.64 -1.35 0.15 116.57 120.45 1bfm h LYS 45 Ca -0.19 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.17 1bfm h LYS 45 Cb 1.03 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1bfm h LYS 45 CO -0.12 0.09 -0.05 -0.07 -2.27 0.00 0.00 179.45 177.04 1bfm h LEU 46 N 0.15 -0.12 -0.71 5.20 3.38 -1.18 0.56 115.31 122.59 1bfm h LEU 46 Ca 0.07 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 1bfm h LEU 46 Cb 0.11 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1bfm h LEU 46 CO -0.01 -0.03 -0.59 0.00 0.09 0.00 0.00 178.44 177.89 1bfm h ALA 47 N 0.68 0.90 -0.25 1.53 0.00 0.62 0.28 119.26 123.02 1bfm h ALA 47 Ca -0.01 -0.54 -0.15 0.00 0.00 0.00 0.00 54.91 54.21 1bfm h ALA 47 Cb 0.16 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1bfm h ALA 47 CO 0.02 0.73 -0.41 -0.09 0.00 0.00 0.00 179.25 179.50 1bfm h ARG 48 N 0.13 0.73 -0.13 0.00 9.65 -1.05 -1.69 114.38 122.01 1bfm h ARG 48 Ca -0.01 -0.44 -0.04 0.00 -1.10 0.00 0.00 59.98 58.40 1bfm h ARG 48 Cb 1.08 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.70 1bfm h ARG 48 CO 0.09 1.06 -0.08 1.25 2.80 0.00 0.00 179.97 185.09 1bfm h HIS 49 N 0.46 0.20 -0.12 2.20 2.76 0.65 0.55 115.15 121.85 1bfm h HIS 49 Ca 0.02 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1bfm h HIS 49 Cb 1.00 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.90 1bfm h HIS 49 CO 0.08 0.28 0.06 0.00 -1.30 0.00 0.00 177.93 177.05 1bfm h ALA 50 N 1.73 0.15 -0.06 5.26 0.00 -0.34 -3.48 119.26 122.53 1bfm h ALA 50 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1bfm h ALA 50 Cb 0.27 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1bfm h ALA 50 CO 0.01 -0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.36 1bfm n GLY 51 N -0.88 1.40 3.15 0.00 0.00 0.19 -5.09 105.19 103.95 1bfm n GLY 51 Ca -0.05 -0.09 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 1bfm n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1bfm s ARG 52 N -0.95 0.29 0.18 1.61 1.70 -0.70 -5.04 118.95 116.04 1bfm s ARG 52 Ca 0.00 0.54 -0.13 0.00 -0.47 0.00 0.00 55.73 55.67 1bfm s ARG 52 Cb 0.00 0.00 0.09 0.00 -0.57 0.00 0.00 34.95 34.47 1bfm s ARG 52 CO 0.00 -0.12 1.80 0.87 -1.08 0.00 0.00 175.30 176.77 1bfm h LYS 53 N 6.63 0.83 -6.46 3.89 1.79 -1.96 -3.35 116.57 117.93 1bfm h LYS 53 Ca -0.35 -0.09 -0.53 0.00 -2.18 0.00 0.00 60.65 57.50 1bfm h LYS 53 Cb 1.17 -0.17 0.02 0.00 -1.58 0.00 0.00 32.23 31.68 1bfm h LYS 53 CO 0.34 0.62 0.92 0.99 -1.08 0.00 0.00 179.45 181.24 1bfm s THR 54 N -5.90 3.15 0.30 -0.16 2.01 -1.26 -4.85 115.64 108.93 1bfm s THR 54 Ca -0.13 0.66 -0.06 0.00 0.31 0.00 0.00 61.69 62.47 1bfm s THR 54 Cb 0.13 -3.42 -0.05 0.00 0.01 0.00 0.00 72.50 69.16 1bfm s THR 54 CO 0.77 0.01 0.57 -0.63 -0.69 0.00 0.00 174.62 174.65 1bfm s ILE 55 N 2.24 5.00 0.32 1.82 1.01 -1.26 -4.93 121.20 125.40 1bfm s ILE 55 Ca 0.70 0.12 -0.18 0.00 0.00 0.00 0.00 60.65 61.30 1bfm s ILE 55 Cb -0.38 -3.73 0.03 0.00 0.01 0.00 0.00 42.46 38.39 1bfm s ILE 55 CO 0.31 -0.33 0.72 -0.75 0.00 0.00 0.00 174.94 174.88 1bfm s LYS 56 N -3.55 1.94 0.38 2.79 2.20 -1.26 -4.97 119.74 117.27 1bfm s LYS 56 Ca 0.45 -1.21 0.26 0.00 -0.36 0.00 0.00 55.97 55.11 1bfm s LYS 56 Cb -0.11 0.60 1.36 0.00 -1.51 0.00 0.00 37.83 38.17 1bfm s LYS 56 CO 0.30 -0.89 1.80 0.00 -0.36 0.00 0.00 175.35 176.20 1bfm h ALA 57 N 2.03 1.00 0.18 3.13 0.00 -1.98 0.95 119.26 124.57 1bfm h ALA 57 Ca -0.25 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.35 1bfm h ALA 57 Cb 1.25 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.05 1bfm h ALA 57 CO 0.31 0.00 -1.49 1.49 0.00 0.00 0.00 179.25 179.56 1bfm h GLU 58 N 0.00 0.38 -0.07 0.00 4.81 -1.99 -2.44 114.58 115.27 1bfm h GLU 58 Ca 0.00 -0.64 0.00 0.00 -0.13 0.00 0.00 59.36 58.59 1bfm h GLU 58 Cb 0.08 0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1bfm h GLU 58 CO 0.00 1.31 0.04 -0.44 -0.73 0.00 0.00 179.01 179.19 1bfm h ASP 59 N -0.06 0.07 0.97 1.04 5.19 0.25 -2.18 116.42 121.70 1bfm h ASP 59 Ca -0.29 -0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.07 1bfm h ASP 59 Cb 1.97 -0.02 0.01 0.00 0.18 0.00 0.00 39.33 41.47 1bfm h ASP 59 CO 0.16 0.05 -0.47 0.40 -3.12 0.00 0.00 179.24 176.27 1bfm h ILE 60 N 0.08 0.01 0.00 0.35 1.08 -0.01 0.11 117.51 119.14 1bfm h ILE 60 Ca 0.02 -0.04 -0.02 0.00 -0.39 0.00 0.00 64.86 64.44 1bfm h ILE 60 Cb -0.01 0.01 -0.00 0.00 -3.07 0.00 0.00 36.82 33.75 1bfm h ILE 60 CO -0.01 0.00 -0.08 -0.33 -0.69 0.00 0.00 178.15 177.04 1bfm h GLU 61 N -1.35 0.00 -0.43 2.37 5.08 -1.47 0.48 114.58 119.26 1bfm h GLU 61 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1bfm h GLU 61 Cb 1.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 1bfm h GLU 61 CO 0.22 0.08 0.28 -0.07 -1.00 0.00 0.00 179.01 178.52 1bfm h LEU 62 N 0.00 0.51 -0.66 1.33 4.07 -1.26 -1.14 115.31 118.16 1bfm h LEU 62 Ca -0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 57.88 57.92 1bfm h LEU 62 Cb 0.16 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 41.74 1bfm h LEU 62 CO 0.01 0.39 0.39 0.00 -1.08 0.00 0.00 178.44 178.14 1bfm h ALA 63 N 1.14 0.85 0.00 1.53 0.00 0.20 0.07 119.26 123.05 1bfm h ALA 63 Ca 0.16 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1bfm h ALA 63 Cb -0.04 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1bfm h ALA 63 CO -0.03 0.34 -0.19 -0.24 0.00 0.00 0.00 179.25 179.12 1bfm h VAL 64 N 0.90 0.79 0.00 0.00 3.04 -0.73 0.34 116.25 120.60 1bfm h VAL 64 Ca 0.24 -1.65 -0.00 0.00 -1.01 0.00 0.00 66.70 64.28 1bfm h VAL 64 Cb -0.00 1.55 -0.00 0.00 -2.01 0.00 0.00 31.29 30.83 1bfm h VAL 64 CO -0.04 0.27 -0.02 -0.09 -1.01 0.00 0.00 177.57 176.68 1bfm h ARG 65 N -1.00 0.00 0.00 4.17 2.43 -1.23 0.81 114.38 119.56 1bfm h ARG 65 Ca -0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1bfm h ARG 65 Cb 0.58 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1bfm h ARG 65 CO -0.02 0.02 -0.93 -2.13 -1.51 0.00 0.00 179.97 175.40 1bfm n ARG 66 N -3.34 0.27 0.00 0.20 3.00 0.01 -4.25 116.66 112.55 1bfm n ARG 66 Ca -0.02 0.01 0.00 0.00 -0.00 0.00 0.00 57.85 57.84 1bfm n ARG 66 Cb 0.12 -1.60 0.00 0.00 0.00 0.00 0.00 32.46 30.97 1bfm n ARG 66 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1bfm n PHE 67 N -1.96 0.00 -1.33 -0.14 -0.00 0.27 -4.80 117.46 109.51 1bfm n PHE 67 Ca 0.02 0.00 -0.12 0.00 -0.00 0.00 0.00 57.45 57.35 1bfm n PHE 67 Cb 0.43 -0.20 -0.05 0.00 -0.00 0.00 0.00 39.48 39.66 1bfm n PHE 67 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.76 177.93 1bfm n LYS 68 N -1.10 -1.67 -0.53 -4.13 4.81 -0.72 -5.08 118.16 109.74 1bfm n LYS 68 Ca 0.00 0.90 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 1bfm n LYS 68 Cb 0.00 -5.29 0.00 0.00 0.02 0.00 0.00 35.03 29.76 1bfm n LYS 68 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74