#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 1.16 0.33 0.03 2.56 -1.26 -5.10 118.70 116.43 1bfm s GLU 2 Ca 0.00 -1.38 -0.29 0.00 0.00 0.00 0.00 54.97 53.30 1bfm s GLU 2 Cb 0.00 -1.04 -0.12 0.00 2.00 0.00 0.00 34.13 34.96 1bfm s GLU 2 CO 0.00 0.19 1.38 1.28 -0.56 0.00 0.00 175.26 177.55 1bfm n LEU 3 N 0.19 3.86 -4.77 2.70 4.32 -1.26 -4.89 117.00 117.16 1bfm n LEU 3 Ca -0.13 1.20 -0.40 0.00 -0.02 0.00 0.00 56.01 56.66 1bfm n LEU 3 Cb 0.58 -1.52 0.01 0.00 -1.62 0.00 0.00 43.42 40.87 1bfm n LEU 3 CO 0.30 -0.28 1.07 -2.16 -1.22 0.00 0.00 177.39 175.10 1bfm s PRO 4 N -1.64 3.81 -0.03 3.23 0.04 -1.26 -4.87 135.00 134.27 1bfm s PRO 4 Ca 0.57 2.42 0.19 0.00 0.04 0.00 0.00 61.00 64.22 1bfm s PRO 4 Cb -0.55 -2.73 -0.22 0.00 0.04 0.00 0.00 34.50 31.04 1bfm s PRO 4 CO 0.60 -0.72 0.53 0.44 0.04 0.00 0.00 177.00 177.88 1bfm n ILE 5 N -0.02 0.92 0.33 0.56 -6.64 -1.26 -3.36 119.36 109.89 1bfm n ILE 5 Ca 0.04 -0.69 -0.17 0.00 -1.77 0.00 0.00 62.75 60.17 1bfm n ILE 5 Cb 0.41 -0.46 -0.09 0.00 -1.44 0.00 0.00 39.64 38.07 1bfm n ILE 5 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1bfm h ALA 6 N 1.47 -0.81 0.44 -1.28 0.00 -1.97 0.45 119.26 117.56 1bfm h ALA 6 Ca -0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1bfm h ALA 6 Cb 1.61 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.70 1bfm h ALA 6 CO 0.03 -0.91 -0.29 -1.00 0.00 0.00 0.00 179.25 177.08 1bfm h PRO 7 N -0.90 -0.68 -0.45 0.00 0.13 -1.99 -0.04 132.00 128.07 1bfm h PRO 7 Ca -0.08 0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1bfm h PRO 7 Cb 0.65 0.15 -0.02 0.00 0.13 0.00 0.00 31.00 31.92 1bfm h PRO 7 CO 0.14 -0.45 0.25 0.82 -0.23 0.00 0.00 178.00 178.53 1bfm h ILE 8 N -0.70 1.16 -0.72 -3.56 2.04 -1.65 -1.42 117.51 112.65 1bfm h ILE 8 Ca -0.05 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.39 1bfm h ILE 8 Cb 0.58 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 1bfm h ILE 8 CO 0.04 0.17 0.37 1.23 0.00 0.00 0.00 178.15 179.95 1bfm h GLY 9 N 0.59 1.09 1.90 5.37 0.00 0.10 -0.96 103.07 111.16 1bfm h GLY 9 Ca 0.16 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 46.94 1bfm h GLY 9 CO -0.03 0.48 -0.29 0.07 0.00 0.00 0.00 176.54 176.78 1bfm h ARG 10 N 1.02 0.00 0.03 4.80 0.11 -0.19 -1.96 114.38 118.19 1bfm h ARG 10 Ca 0.25 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.33 1bfm h ARG 10 Cb 0.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.15 1bfm h ARG 10 CO -0.04 0.18 -0.02 0.82 0.10 0.00 0.00 179.97 181.02 1bfm h ILE 11 N 0.00 1.06 -0.68 0.08 2.04 -0.16 0.45 117.51 120.30 1bfm h ILE 11 Ca -0.01 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 1bfm h ILE 11 Cb 1.15 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 38.47 1bfm h ILE 11 CO 0.02 0.08 0.26 0.40 0.00 0.00 0.00 178.15 178.91 1bfm h ILE 12 N -0.18 1.25 -0.36 -0.67 1.08 -1.15 0.35 117.51 117.84 1bfm h ILE 12 Ca -0.00 -0.80 -0.03 0.00 -0.39 0.00 0.00 64.86 63.63 1bfm h ILE 12 Cb 0.16 0.48 -0.02 0.00 -3.07 0.00 0.00 36.82 34.38 1bfm h ILE 12 CO 0.01 0.31 0.07 0.50 -0.69 0.00 0.00 178.15 178.36 1bfm h LYS 13 N 0.98 0.52 -0.32 2.37 3.64 -1.34 -2.29 116.57 120.14 1bfm h LYS 13 Ca 0.23 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 1bfm h LYS 13 Cb 0.24 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1bfm h LYS 13 CO -0.02 0.49 0.08 0.22 -2.27 0.00 0.00 179.45 177.96 1bfm h ASP 14 N 0.51 0.43 0.25 4.20 3.58 0.20 0.56 116.42 126.15 1bfm h ASP 14 Ca 0.12 -0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 1bfm h ASP 14 Cb 0.22 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.16 1bfm h ASP 14 CO -0.00 0.44 -0.16 0.00 -2.88 0.00 0.00 179.24 176.64 1bfm h ALA 15 N 1.63 -0.38 0.00 -0.78 0.00 -0.93 -3.46 119.26 115.33 1bfm h ALA 15 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1bfm h ALA 15 Cb 0.18 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1bfm h ALA 15 CO -0.00 -0.73 0.00 0.41 0.00 0.00 0.00 179.25 178.93 1bfm n GLY 16 N -1.28 -0.11 3.76 0.00 0.00 0.20 -5.13 105.19 102.63 1bfm n GLY 16 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 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 0.00 3.68 -0.03 4.61 0.00 -0.89 -4.91 121.76 124.21 1bfm s ALA 17 Ca 0.00 1.56 0.06 0.00 0.00 0.00 0.00 51.96 53.57 1bfm s ALA 17 Cb 0.00 -3.63 -0.08 0.00 0.00 0.00 0.00 23.12 19.41 1bfm s ALA 17 CO 0.00 -0.99 0.07 -0.85 0.00 0.00 0.00 175.76 173.99 1bfm n GLU 18 N 1.56 1.74 -3.28 0.00 0.28 -1.26 -4.44 120.64 115.24 1bfm n GLU 18 Ca 0.05 -0.03 -0.08 0.00 -0.16 0.00 0.00 57.16 56.95 1bfm n GLU 18 Cb 0.38 -1.15 -0.04 0.00 1.43 0.00 0.00 31.44 32.06 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 -2.27 0.65 -0.07 3.44 0.52 -1.26 -5.13 118.95 114.82 1bfm s ARG 19 Ca -0.03 -0.36 0.04 0.00 -0.52 0.00 0.00 55.73 54.87 1bfm s ARG 19 Cb 0.03 -0.29 -0.01 0.00 0.52 0.00 0.00 34.95 35.19 1bfm s ARG 19 CO 0.25 -1.15 -0.21 0.08 0.02 0.00 0.00 175.30 174.29 1bfm s VAL 20 N 1.90 2.43 0.29 3.52 1.01 -1.26 -5.13 120.40 123.16 1bfm s VAL 20 Ca 0.15 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 61.17 1bfm s VAL 20 Cb -0.10 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 1bfm s VAL 20 CO -0.12 0.56 0.54 -0.55 0.00 0.00 0.00 175.10 175.54 1bfm s SER 21 N -0.14 6.40 0.50 3.32 0.15 -1.26 -4.94 113.70 117.74 1bfm s SER 21 Ca -0.03 0.64 0.34 0.00 0.70 0.00 0.00 55.95 57.59 1bfm s SER 21 Cb -0.14 -2.11 1.80 0.00 -1.71 0.00 0.00 66.02 63.86 1bfm s SER 21 CO 0.04 -0.21 2.04 0.44 1.20 0.00 0.00 173.24 176.75 1bfm h ASP 22 N 1.51 0.00 0.02 5.45 5.19 -2.00 0.38 116.42 126.97 1bfm h ASP 22 Ca -0.48 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 55.93 1bfm h ASP 22 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1bfm h ASP 22 CO 0.65 0.00 -0.01 0.44 -3.12 0.00 0.00 179.24 177.20 1bfm h ASP 23 N 0.00 -0.02 -0.48 6.45 3.32 -1.98 -2.37 116.42 121.34 1bfm h ASP 23 Ca 0.00 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.87 1bfm h ASP 23 Cb 0.05 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 1bfm h ASP 23 CO 0.00 0.15 0.24 0.00 -1.72 0.00 0.00 179.24 177.91 1bfm h ALA 24 N 0.78 0.61 0.05 3.45 0.00 -0.63 0.57 119.26 124.09 1bfm h ALA 24 Ca -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1bfm h ALA 24 Cb 0.19 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1bfm h ALA 24 CO 0.00 0.16 -0.02 0.00 0.00 0.00 0.00 179.25 179.39 1bfm h ARG 25 N 0.63 -0.06 -0.18 0.00 3.08 -1.45 0.26 114.38 116.66 1bfm h ARG 25 Ca 0.17 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 1bfm h ARG 25 Cb 0.09 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1bfm h ARG 25 CO -0.02 0.03 0.08 0.82 -1.07 0.00 0.00 179.97 179.81 1bfm h ILE 26 N -0.14 1.07 -0.41 2.04 1.08 -0.94 0.03 117.51 120.24 1bfm h ILE 26 Ca -0.01 -0.21 -0.07 0.00 -0.39 0.00 0.00 64.86 64.19 1bfm h ILE 26 Cb 0.12 0.84 -0.01 0.00 -3.07 0.00 0.00 36.82 34.70 1bfm h ILE 26 CO 0.01 0.08 -0.00 0.74 -0.69 0.00 0.00 178.15 178.29 1bfm h THR 27 N 0.25 1.26 -0.19 -0.27 2.02 0.93 -2.50 112.91 114.41 1bfm h THR 27 Ca 0.07 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.21 1bfm h THR 27 Cb 0.04 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1bfm h THR 27 CO -0.01 0.35 0.06 -0.07 0.37 0.00 0.00 175.52 176.22 1bfm h LEU 28 N 0.57 0.24 0.05 2.58 -0.00 0.14 -1.66 115.31 117.23 1bfm h LEU 28 Ca 0.12 -0.02 -0.11 0.00 -0.00 0.00 0.00 57.88 57.87 1bfm h LEU 28 Cb 0.48 -0.06 0.01 0.00 -0.00 0.00 0.00 40.66 41.10 1bfm h LEU 28 CO 0.02 0.23 -0.47 0.00 -0.00 0.00 0.00 178.44 178.23 1bfm h ALA 29 N 1.81 -0.01 -0.27 1.53 0.00 -1.14 0.57 119.26 121.75 1bfm h ALA 29 Ca 0.07 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1bfm h ALA 29 Cb 0.08 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1bfm h ALA 29 CO -0.01 0.22 0.13 -0.22 0.00 0.00 0.00 179.25 179.38 1bfm h LYS 30 N -0.48 0.36 0.00 0.00 3.64 -1.24 0.60 116.57 119.45 1bfm h LYS 30 Ca -0.07 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1bfm h LYS 30 Cb 1.29 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1bfm h LYS 30 CO 0.09 0.28 0.00 -0.89 -2.27 0.00 0.00 179.45 176.66 1bfm n ILE 31 N -4.45 0.00 0.18 2.00 5.41 -0.64 -2.00 119.36 119.86 1bfm n ILE 31 Ca 0.01 1.18 0.15 0.00 1.00 0.00 0.00 62.75 65.09 1bfm n ILE 31 Cb 0.11 -2.16 0.74 0.00 -0.71 0.00 0.00 39.64 37.61 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 0.03 1.39 4.07 0.15 0.46 115.31 121.41 1bfm h LEU 32 Ca 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.85 1bfm h LEU 32 Cb 0.00 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.75 1bfm h LEU 32 CO 0.00 0.00 -0.46 1.05 -1.08 0.00 0.00 178.44 177.95 1bfm h GLU 33 N 0.00 0.26 0.00 1.13 -0.00 0.04 0.57 114.58 116.58 1bfm h GLU 33 Ca 0.09 -0.32 -0.04 0.00 -0.00 0.00 0.00 59.36 59.09 1bfm h GLU 33 Cb 0.40 0.10 -0.01 0.00 -0.00 0.00 0.00 28.75 29.24 1bfm h GLU 33 CO -0.00 1.05 -0.21 1.49 -0.00 0.00 0.00 179.01 181.34 1bfm h GLU 34 N -0.40 0.00 -0.10 1.06 4.81 -0.55 0.63 114.58 120.04 1bfm h GLU 34 Ca -0.07 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 58.97 1bfm h GLU 34 Cb 1.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1bfm h GLU 34 CO 0.09 0.21 -0.76 0.52 -0.73 0.00 0.00 179.01 178.34 1bfm h MET 35 N 0.00 0.52 -0.30 1.92 2.86 0.14 -0.94 114.93 119.13 1bfm h MET 35 Ca -0.00 -0.43 -0.12 0.00 -2.06 0.00 0.00 59.70 57.08 1bfm h MET 35 Cb 0.48 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 1bfm h MET 35 CO 0.03 1.06 -0.29 0.78 1.06 0.00 0.00 176.91 179.55 1bfm h GLY 36 N 1.06 0.80 2.00 8.32 0.00 0.53 0.74 103.07 116.52 1bfm h GLY 36 Ca -0.04 -0.82 -0.01 0.00 0.00 0.00 0.00 47.33 46.47 1bfm h GLY 36 CO 0.14 0.74 -0.03 -0.09 0.00 0.00 0.00 176.54 177.30 1bfm h ARG 37 N 0.49 0.00 0.31 4.80 2.43 -0.21 -0.78 114.38 121.42 1bfm h ARG 37 Ca 0.05 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1bfm h ARG 37 Cb 0.87 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 1bfm h ARG 37 CO 0.07 0.03 -0.15 0.22 -1.51 0.00 0.00 179.97 178.63 1bfm h ASP 38 N 0.00 -0.35 0.26 -3.80 1.82 0.16 -2.47 116.42 112.04 1bfm h ASP 38 Ca -0.00 -0.04 -0.00 0.00 -0.39 0.00 0.00 57.03 56.60 1bfm h ASP 38 Cb 0.07 0.09 -0.00 0.00 0.68 0.00 0.00 39.33 40.17 1bfm h ASP 38 CO 0.00 0.11 -0.00 0.40 -1.61 0.00 0.00 179.24 178.14 1bfm h ILE 39 N -1.09 0.00 0.00 2.25 2.04 0.24 -2.06 117.51 118.90 1bfm h ILE 39 Ca -0.04 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.68 1bfm h ILE 39 Cb 0.37 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1bfm h ILE 39 CO 0.07 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.22 1bfm n ALA 40 N -2.08 -0.41 0.28 1.87 0.00 -0.31 -0.27 120.51 119.59 1bfm n ALA 40 Ca -0.02 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.56 1bfm n ALA 40 Cb 0.13 0.00 0.84 0.00 0.00 0.00 0.00 19.45 20.42 1bfm n ALA 40 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1bfm h SER 41 N 0.00 0.00 0.40 0.00 4.64 -1.26 0.72 113.55 118.04 1bfm h SER 41 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1bfm h SER 41 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1bfm h SER 41 CO 0.00 0.04 -0.19 -0.33 -0.87 0.00 0.00 176.83 175.48 1bfm h GLU 42 N 0.00 -0.51 0.00 4.77 4.39 -1.43 -2.33 114.58 119.47 1bfm h GLU 42 Ca -0.00 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1bfm h GLU 42 Cb 0.11 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1bfm h GLU 42 CO 0.01 -0.29 0.00 0.00 -1.16 0.00 0.00 179.01 177.56 1bfm n ALA 43 N -2.37 1.52 -0.08 3.43 0.00 0.17 -1.27 120.51 121.92 1bfm n ALA 43 Ca -0.11 -0.03 -0.08 0.00 0.00 0.00 0.00 53.44 53.22 1bfm n ALA 43 Cb 0.25 -1.20 -0.04 0.00 0.00 0.00 0.00 19.45 18.46 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 0.22 0.00 0.00 2.10 0.65 -1.16 117.51 119.32 1bfm h ILE 44 Ca 0.00 -1.28 0.00 0.00 1.08 0.00 0.00 64.86 64.66 1bfm h ILE 44 Cb 0.20 0.53 0.00 0.00 -1.09 0.00 0.00 36.82 36.46 1bfm h ILE 44 CO 0.00 0.08 0.00 0.50 -1.08 0.00 0.00 178.15 177.65 1bfm h LYS 45 N -1.00 0.00 0.55 2.19 3.64 -1.43 0.13 116.57 120.65 1bfm h LYS 45 Ca -0.08 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 1bfm h LYS 45 Cb 0.66 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1bfm h LYS 45 CO -0.05 0.00 -0.26 -0.07 -2.27 0.00 0.00 179.45 176.80 1bfm h LEU 46 N 0.00 -0.63 -2.47 5.20 4.07 -1.18 0.57 115.31 120.87 1bfm h LEU 46 Ca 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1bfm h LEU 46 Cb 0.23 0.16 -0.00 0.00 1.08 0.00 0.00 40.66 42.13 1bfm h LEU 46 CO 0.00 -0.40 -0.02 0.00 -1.08 0.00 0.00 178.44 176.93 1bfm h ALA 47 N -0.38 1.27 0.00 1.53 0.00 0.52 -2.30 119.26 119.89 1bfm h ALA 47 Ca -0.08 -0.02 -0.36 0.00 0.00 0.00 0.00 54.91 54.46 1bfm h ALA 47 Cb 0.59 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.31 1bfm h ALA 47 CO 0.12 0.03 -2.34 -2.13 0.00 0.00 0.00 179.25 174.94 1bfm n ARG 48 N -3.51 0.81 -0.05 0.00 0.63 -0.49 -1.79 116.66 112.26 1bfm n ARG 48 Ca -0.03 -0.01 0.02 0.00 -0.92 0.00 0.00 57.85 56.92 1bfm n ARG 48 Cb 0.12 -1.50 0.35 0.00 0.45 0.00 0.00 32.46 31.89 1bfm n ARG 48 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 1bfm h HIS 49 N 0.00 0.62 0.07 -0.14 2.76 0.51 0.57 115.15 119.54 1bfm h HIS 49 Ca -0.53 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 57.63 1bfm h HIS 49 Cb 2.19 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 30.95 1bfm h HIS 49 CO 0.00 0.44 -0.03 0.00 -1.30 0.00 0.00 177.93 177.03 1bfm h ALA 50 N 1.64 -0.10 -3.90 5.26 0.00 -1.50 -3.47 119.26 117.19 1bfm h ALA 50 Ca 0.17 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.82 1bfm h ALA 50 Cb 0.01 0.04 0.09 0.00 0.00 0.00 0.00 17.79 17.93 1bfm h ALA 50 CO -0.03 -0.53 -0.41 0.41 0.00 0.00 0.00 179.25 178.69 1bfm n GLY 51 N -1.01 0.05 0.00 0.00 0.00 0.20 -4.99 105.19 99.44 1bfm n GLY 51 Ca -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.01 0.79 0.00 1.61 3.00 -0.96 -5.03 116.66 113.06 1bfm n ARG 52 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.79 1bfm n ARG 52 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.02 1bfm n ARG 52 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1bfm n LYS 53 N 0.00 -1.19 -0.52 5.56 5.02 -1.26 -4.92 118.16 120.85 1bfm n LYS 53 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 1bfm n LYS 53 Cb 0.00 0.00 0.25 0.00 -0.02 0.00 0.00 35.03 35.26 1bfm n LYS 53 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1bfm s THR 54 N -0.86 2.01 0.24 -0.18 -1.32 -1.26 -4.94 115.64 109.33 1bfm s THR 54 Ca 0.00 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.19 1bfm s THR 54 Cb 0.00 -2.03 -0.09 0.00 -1.51 0.00 0.00 72.50 68.87 1bfm s THR 54 CO 0.00 -0.00 1.21 -0.63 -2.21 0.00 0.00 174.62 172.99 1bfm s ILE 55 N -2.45 3.33 0.20 5.08 1.01 -1.26 -5.02 121.20 122.10 1bfm s ILE 55 Ca 0.69 1.20 0.01 0.00 0.00 0.00 0.00 60.65 62.55 1bfm s ILE 55 Cb -0.25 -3.77 -0.00 0.00 0.01 0.00 0.00 42.46 38.45 1bfm s ILE 55 CO 0.64 0.23 0.24 2.29 0.00 0.00 0.00 174.94 178.35 1bfm n LYS 56 N 1.89 0.34 -0.04 2.79 2.85 -1.26 -5.04 118.16 119.69 1bfm n LYS 56 Ca 0.02 -1.78 -0.10 0.00 -1.05 0.00 0.00 58.31 55.40 1bfm n LYS 56 Cb 0.44 1.60 -0.04 0.00 -0.65 0.00 0.00 35.03 36.38 1bfm n LYS 56 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1bfm h ALA 57 N 1.72 0.24 0.00 0.58 0.00 -1.99 -1.29 119.26 118.51 1bfm h ALA 57 Ca -0.15 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1bfm h ALA 57 Cb 0.70 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1bfm h ALA 57 CO 0.21 -0.24 -0.06 0.93 0.00 0.00 0.00 179.25 180.10 1bfm h GLU 58 N 0.20 0.00 0.13 0.00 3.07 -1.99 0.79 114.58 116.77 1bfm h GLU 58 Ca 0.07 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 1bfm h GLU 58 Cb 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1bfm h GLU 58 CO -0.01 0.06 -0.06 -0.44 -1.40 0.00 0.00 179.01 177.16 1bfm h ASP 59 N 0.00 -0.14 -0.60 1.42 3.32 -1.74 -2.28 116.42 116.39 1bfm h ASP 59 Ca -0.00 -0.41 -0.09 0.00 0.02 0.00 0.00 57.03 56.55 1bfm h ASP 59 Cb 0.17 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 1bfm h ASP 59 CO 0.01 0.40 0.03 0.40 -1.72 0.00 0.00 179.24 178.36 1bfm h ILE 60 N -0.77 1.26 -0.72 0.35 1.08 0.20 0.59 117.51 119.50 1bfm h ILE 60 Ca -0.02 -1.11 -0.02 0.00 -0.39 0.00 0.00 64.86 63.32 1bfm h ILE 60 Cb 0.54 0.76 -0.03 0.00 -3.07 0.00 0.00 36.82 35.02 1bfm h ILE 60 CO 0.03 0.41 0.39 -0.33 -0.69 0.00 0.00 178.15 177.95 1bfm h GLU 61 N 0.98 1.01 -0.24 2.37 5.08 -1.34 -1.76 114.58 120.68 1bfm h GLU 61 Ca 0.18 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1bfm h GLU 61 Cb 0.52 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1bfm h GLU 61 CO 0.03 0.76 0.11 -0.07 -1.00 0.00 0.00 179.01 178.84 1bfm h LEU 62 N 1.00 0.32 -1.70 1.33 -0.00 -0.67 -1.69 115.31 113.90 1bfm h LEU 62 Ca 0.25 -0.13 -0.02 0.00 -0.00 0.00 0.00 57.88 57.98 1bfm h LEU 62 Cb 0.05 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 40.62 1bfm h LEU 62 CO -0.04 0.37 0.00 0.00 -0.00 0.00 0.00 178.44 178.77 1bfm h ALA 63 N 0.97 1.77 0.00 1.53 0.00 0.46 -0.40 119.26 123.59 1bfm h ALA 63 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bfm h ALA 63 Cb 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1bfm h ALA 63 CO -0.01 0.18 -0.40 -0.24 0.00 0.00 0.00 179.25 178.78 1bfm h VAL 64 N 0.18 0.00 0.00 0.00 3.04 -0.47 -2.52 116.25 116.49 1bfm h VAL 64 Ca 0.05 -0.81 0.00 0.00 -1.01 0.00 0.00 66.70 64.93 1bfm h VAL 64 Cb 0.13 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.41 1bfm h VAL 64 CO 0.00 0.00 0.00 0.03 -1.01 0.00 0.00 177.57 176.59 1bfm h ARG 65 N -0.81 0.00 0.00 4.17 3.08 -1.41 -2.42 114.38 116.99 1bfm h ARG 65 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bfm h ARG 65 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1bfm h ARG 65 CO 0.00 0.00 0.00 -2.13 -1.07 0.00 0.00 179.97 176.77 1bfm n ARG 66 N -2.93 0.00 0.29 0.04 3.00 -0.16 -3.74 116.66 113.16 1bfm n ARG 66 Ca -0.03 0.13 0.18 0.00 -0.00 0.00 0.00 57.85 58.13 1bfm n ARG 66 Cb 0.07 -1.05 0.88 0.00 0.00 0.00 0.00 32.46 32.37 1bfm n ARG 66 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1bfm h PHE 67 N 0.00 0.00 -0.56 -0.14 -0.00 -1.04 0.40 116.94 115.60 1bfm h PHE 67 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1bfm h PHE 67 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 35.92 1bfm h PHE 67 CO 0.05 0.04 0.34 1.57 -0.00 0.00 0.00 178.31 180.31 1bfm h LYS 68 N 0.00 0.75 0.00 6.09 2.10 -1.61 -3.52 116.57 120.39 1bfm h LYS 68 Ca -0.00 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 1bfm h LYS 68 Cb 0.28 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 1bfm h LYS 68 CO 0.01 0.53 0.00 0.36 -2.00 0.00 0.00 179.45 178.34