#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 2.67 -0.29 0.03 0.41 -1.26 -5.02 118.70 115.23 1bfm s GLU 2 Ca 0.00 -1.38 -0.28 0.00 -0.41 0.00 0.00 54.97 52.91 1bfm s GLU 2 Cb 0.00 -2.47 -0.05 0.00 -1.78 0.00 0.00 34.13 29.84 1bfm s GLU 2 CO 0.00 -0.04 2.20 -0.51 -0.49 0.00 0.00 175.26 176.41 1bfm s LEU 3 N -4.07 3.43 0.54 1.80 1.43 -1.26 -4.93 118.68 115.62 1bfm s LEU 3 Ca 0.45 1.62 -0.19 0.00 -1.03 0.00 0.00 54.13 54.98 1bfm s LEU 3 Cb -0.05 -3.30 -0.09 0.00 0.03 0.00 0.00 46.19 42.78 1bfm s LEU 3 CO 0.28 -2.12 0.66 -2.65 0.23 0.00 0.00 176.35 172.75 1bfm n PRO 4 N 8.78 0.67 -0.61 1.29 -0.02 -1.26 -4.82 135.00 139.04 1bfm n PRO 4 Ca 0.30 0.26 0.03 0.00 -2.02 0.00 0.00 63.50 62.07 1bfm n PRO 4 Cb 0.47 -1.80 0.26 0.00 -0.02 0.00 0.00 33.50 32.41 1bfm n PRO 4 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1bfm n ILE 5 N -1.48 1.86 -0.06 4.25 -6.64 -1.26 -3.93 119.36 112.09 1bfm n ILE 5 Ca 0.12 -0.94 -0.03 0.00 -1.77 0.00 0.00 62.75 60.12 1bfm n ILE 5 Cb 0.46 -0.38 -0.01 0.00 -1.44 0.00 0.00 39.64 38.27 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 3.19 0.01 -0.32 -1.28 0.00 -1.96 -0.47 119.26 118.42 1bfm h ALA 6 Ca 0.03 -0.31 0.07 0.00 0.00 0.00 0.00 54.91 54.70 1bfm h ALA 6 Cb 1.53 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 19.54 1bfm h ALA 6 CO 0.35 0.28 -0.11 -1.00 0.00 0.00 0.00 179.25 178.78 1bfm h PRO 7 N -1.00 -0.04 -0.02 0.00 0.13 -1.97 -0.01 132.00 129.09 1bfm h PRO 7 Ca -0.01 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.03 1bfm h PRO 7 Cb 0.32 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 1bfm h PRO 7 CO -0.01 -0.03 -0.45 0.82 -0.23 0.00 0.00 178.00 178.11 1bfm h ILE 8 N -0.04 1.32 -0.75 -3.56 2.04 -1.73 -1.50 117.51 113.29 1bfm h ILE 8 Ca 0.16 -1.55 -0.01 0.00 1.00 0.00 0.00 64.86 64.46 1bfm h ILE 8 Cb 0.28 1.82 -0.04 0.00 -0.74 0.00 0.00 36.82 38.14 1bfm h ILE 8 CO -0.35 0.45 0.44 1.23 0.00 0.00 0.00 178.15 179.92 1bfm h GLY 9 N 1.34 1.10 1.85 5.37 0.00 0.15 -1.02 103.07 111.86 1bfm h GLY 9 Ca -0.00 -0.47 -0.21 0.00 0.00 0.00 0.00 47.33 46.65 1bfm h GLY 9 CO 0.06 0.45 -0.99 3.21 0.00 0.00 0.00 176.54 179.27 1bfm h ARG 10 N 1.03 0.12 -0.95 4.80 3.08 -0.09 -1.07 114.38 121.30 1bfm h ARG 10 Ca 0.27 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.15 1bfm h ARG 10 Cb -0.02 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.04 1bfm h ARG 10 CO -0.05 1.01 0.58 0.82 -1.07 0.00 0.00 179.97 181.26 1bfm h ILE 11 N 0.05 1.26 0.00 2.04 2.04 -0.71 -2.33 117.51 119.85 1bfm h ILE 11 Ca -0.05 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1bfm h ILE 11 Cb 1.68 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1bfm h ILE 11 CO 0.14 0.27 -1.39 -0.38 0.00 0.00 0.00 178.15 176.79 1bfm n ILE 12 N -4.36 0.08 -0.12 -0.67 5.41 -0.44 -1.23 119.36 118.02 1bfm n ILE 12 Ca 0.11 -0.29 -0.07 0.00 1.00 0.00 0.00 62.75 63.50 1bfm n ILE 12 Cb 0.05 0.33 0.09 0.00 -0.71 0.00 0.00 39.64 39.40 1bfm n ILE 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1bfm h LYS 13 N 0.00 0.86 -0.23 0.38 3.11 -1.20 0.22 116.57 119.71 1bfm h LYS 13 Ca 0.00 -0.30 -0.07 0.00 -2.81 0.00 0.00 60.65 57.46 1bfm h LYS 13 Cb 0.78 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.93 1bfm h LYS 13 CO 0.00 0.94 -0.17 0.22 -2.81 0.00 0.00 179.45 177.62 1bfm h ASP 14 N 0.77 0.38 0.08 4.20 3.58 -1.15 0.16 116.42 124.45 1bfm h ASP 14 Ca 0.12 -0.10 0.01 0.00 0.42 0.00 0.00 57.03 57.48 1bfm h ASP 14 Cb 0.64 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.57 1bfm h ASP 14 CO 0.04 0.58 -0.13 0.00 -2.88 0.00 0.00 179.24 176.86 1bfm h ALA 15 N 1.46 -0.21 0.00 -0.78 0.00 -0.82 -3.45 119.26 115.45 1bfm h ALA 15 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1bfm h ALA 15 Cb 0.52 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1bfm h ALA 15 CO 0.03 -0.65 0.00 0.41 0.00 0.00 0.00 179.25 179.05 1bfm n GLY 16 N -1.25 0.00 3.81 0.00 0.00 0.56 -5.07 105.19 103.23 1bfm n GLY 16 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 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 2.88 0.00 4.61 0.00 0.67 -4.95 121.76 124.96 1bfm s ALA 17 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.40 1bfm s ALA 17 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.91 1bfm s ALA 17 CO 0.00 -0.43 0.00 -0.85 0.00 0.00 0.00 175.76 174.48 1bfm n GLU 18 N -1.41 0.00 -3.47 0.00 0.28 -1.26 -4.61 120.64 110.17 1bfm n GLU 18 Ca 0.08 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.98 1bfm n GLU 18 Cb 0.53 -0.51 -0.09 0.00 1.43 0.00 0.00 31.44 32.79 1bfm n GLU 18 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1bfm s ARG 19 N -1.51 0.31 0.11 3.44 6.06 -1.26 -5.16 118.95 120.94 1bfm s ARG 19 Ca 0.00 0.66 0.01 0.00 -2.50 0.00 0.00 55.73 53.90 1bfm s ARG 19 Cb 0.00 -0.28 -0.04 0.00 0.06 0.00 0.00 34.95 34.69 1bfm s ARG 19 CO 0.00 -0.51 -0.02 0.08 -2.50 0.00 0.00 175.30 172.35 1bfm s VAL 20 N 2.53 0.48 -0.02 7.11 1.01 -1.26 -5.14 120.40 125.11 1bfm s VAL 20 Ca 0.07 -1.91 -0.21 0.00 0.00 0.00 0.00 61.98 59.93 1bfm s VAL 20 Cb -0.14 -1.81 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 1bfm s VAL 20 CO -0.14 -0.74 0.61 -0.94 0.00 0.00 0.00 175.10 173.89 1bfm s SER 21 N -3.04 6.97 0.54 3.32 1.04 -1.26 -4.95 113.70 116.32 1bfm s SER 21 Ca 0.16 1.16 0.27 0.00 0.48 0.00 0.00 55.95 58.02 1bfm s SER 21 Cb 0.06 -2.37 1.55 0.00 0.10 0.00 0.00 66.02 65.36 1bfm s SER 21 CO -0.03 0.06 2.13 -2.24 0.98 0.00 0.00 173.24 174.14 1bfm h ASP 22 N 5.86 0.00 -0.59 7.02 2.03 -2.01 0.63 116.42 129.37 1bfm h ASP 22 Ca -0.44 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 55.85 1bfm h ASP 22 Cb 1.20 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.67 1bfm h ASP 22 CO 0.71 0.08 0.35 0.44 -1.03 0.00 0.00 179.24 179.79 1bfm h ASP 23 N 0.00 0.73 0.23 4.15 3.32 -1.99 0.59 116.42 123.46 1bfm h ASP 23 Ca -0.00 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1bfm h ASP 23 Cb 0.21 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1bfm h ASP 23 CO 0.01 0.58 -0.11 0.00 -1.72 0.00 0.00 179.24 178.00 1bfm h ALA 24 N 1.54 -0.31 0.00 3.45 0.00 -1.29 -2.35 119.26 120.31 1bfm h ALA 24 Ca 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1bfm h ALA 24 Cb -0.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1bfm h ALA 24 CO -0.04 -0.59 0.00 -0.09 0.00 0.00 0.00 179.25 178.53 1bfm h ARG 25 N -0.47 0.00 0.18 0.00 9.65 -0.09 -0.78 114.38 122.87 1bfm h ARG 25 Ca -0.03 0.00 -0.32 0.00 -1.10 0.00 0.00 59.98 58.53 1bfm h ARG 25 Cb 0.35 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 28.95 1bfm h ARG 25 CO 0.05 0.00 -1.50 0.82 2.80 0.00 0.00 179.97 182.14 1bfm h ILE 26 N 0.00 1.22 -0.22 1.20 2.04 0.04 -1.30 117.51 120.49 1bfm h ILE 26 Ca 0.00 -2.76 -0.01 0.00 1.00 0.00 0.00 64.86 63.09 1bfm h ILE 26 Cb 0.40 2.89 -0.01 0.00 -0.74 0.00 0.00 36.82 39.36 1bfm h ILE 26 CO 0.00 0.84 0.11 0.74 0.00 0.00 0.00 178.15 179.84 1bfm h THR 27 N 0.10 1.08 0.04 -0.27 2.02 -0.63 0.57 112.91 115.82 1bfm h THR 27 Ca -0.25 -0.22 -0.33 0.00 0.77 0.00 0.00 66.41 66.38 1bfm h THR 27 Cb 2.08 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 69.24 1bfm h THR 27 CO 0.21 0.09 -1.93 -0.11 0.37 0.00 0.00 175.52 174.15 1bfm n LEU 28 N -4.46 1.46 -0.28 2.58 7.94 -0.49 -0.60 117.00 123.15 1bfm n LEU 28 Ca 0.00 0.27 -0.05 0.00 -1.11 0.00 0.00 56.01 55.12 1bfm n LEU 28 Cb 0.11 -0.26 0.06 0.00 0.53 0.00 0.00 43.42 43.86 1bfm n LEU 28 CO 0.35 0.58 1.15 0.00 -1.11 0.00 0.00 177.39 178.36 1bfm h ALA 29 N 0.65 0.98 -0.42 1.96 0.00 -0.91 -1.62 119.26 119.89 1bfm h ALA 29 Ca -0.38 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 1bfm h ALA 29 Cb 2.04 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 1bfm h ALA 29 CO 0.07 0.45 -0.02 -0.22 0.00 0.00 0.00 179.25 179.53 1bfm h LYS 30 N 1.05 0.69 -0.34 0.00 3.64 0.22 -2.48 116.57 119.35 1bfm h LYS 30 Ca 0.27 -0.18 -0.09 0.00 -1.27 0.00 0.00 60.65 59.39 1bfm h LYS 30 Cb -0.02 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1bfm h LYS 30 CO -0.05 0.72 -0.13 0.82 -2.27 0.00 0.00 179.45 178.54 1bfm h ILE 31 N 0.65 1.29 0.55 2.00 2.04 0.10 -1.16 117.51 122.98 1bfm h ILE 31 Ca 0.13 -1.22 -0.03 0.00 1.00 0.00 0.00 64.86 64.74 1bfm h ILE 31 Cb 0.43 1.37 0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1bfm h ILE 31 CO 0.02 0.40 -0.27 -0.07 0.00 0.00 0.00 178.15 178.23 1bfm h LEU 32 N 0.46 -0.63 -1.57 1.44 4.07 -1.36 -2.50 115.31 115.21 1bfm h LEU 32 Ca 0.08 -0.05 -0.02 0.00 0.08 0.00 0.00 57.88 57.98 1bfm h LEU 32 Cb 0.65 0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.54 1bfm h LEU 32 CO 0.04 -0.27 0.10 -0.08 -1.08 0.00 0.00 178.44 177.15 1bfm h GLU 33 N -1.03 0.38 -0.85 1.13 4.22 -1.18 0.96 114.58 118.20 1bfm h GLU 33 Ca -0.08 -0.04 -0.03 0.00 0.08 0.00 0.00 59.36 59.29 1bfm h GLU 33 Cb 0.64 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 1bfm h GLU 33 CO 0.13 0.33 0.42 1.49 -2.18 0.00 0.00 179.01 179.19 1bfm h GLU 34 N 0.38 1.21 -0.55 1.92 4.81 -1.21 -0.86 114.58 120.28 1bfm h GLU 34 Ca 0.10 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 1bfm h GLU 34 Cb 0.10 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 1bfm h GLU 34 CO -0.01 0.92 0.04 0.52 -0.73 0.00 0.00 179.01 179.75 1bfm h MET 35 N 1.20 0.91 0.06 1.92 2.86 0.11 -0.55 114.93 121.44 1bfm h MET 35 Ca 0.29 -0.24 -0.27 0.00 -2.06 0.00 0.00 59.70 57.42 1bfm h MET 35 Cb 0.10 -0.11 0.02 0.00 0.06 0.00 0.00 31.60 31.68 1bfm h MET 35 CO -0.04 0.88 -1.10 0.78 1.06 0.00 0.00 176.91 178.49 1bfm h GLY 36 N 1.00 0.71 2.00 8.32 0.00 0.67 0.18 103.07 115.95 1bfm h GLY 36 Ca 0.17 -1.37 -0.01 0.00 0.00 0.00 0.00 47.33 46.12 1bfm h GLY 36 CO 0.02 1.21 -0.03 -0.09 0.00 0.00 0.00 176.54 177.65 1bfm h ARG 37 N 0.27 0.00 0.54 4.80 1.12 -1.12 -1.69 114.38 118.30 1bfm h ARG 37 Ca -0.16 0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 58.69 1bfm h ARG 37 Cb 1.77 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.74 1bfm h ARG 37 CO 0.21 0.03 -0.26 0.22 -3.11 0.00 0.00 179.97 177.06 1bfm h ASP 38 N 0.00 -0.61 -0.10 -3.80 1.82 0.27 -2.49 116.42 111.50 1bfm h ASP 38 Ca -0.00 0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.65 1bfm h ASP 38 Cb 0.08 0.16 -0.01 0.00 0.68 0.00 0.00 39.33 40.24 1bfm h ASP 38 CO 0.00 -0.23 0.03 0.40 -1.61 0.00 0.00 179.24 177.83 1bfm h ILE 39 N -1.14 1.09 0.82 2.25 2.04 -0.52 -1.78 117.51 120.27 1bfm h ILE 39 Ca -0.07 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 1bfm h ILE 39 Cb 0.56 0.93 0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1bfm h ILE 39 CO 0.12 0.11 -0.39 0.00 0.00 0.00 0.00 178.15 177.98 1bfm h ALA 40 N 1.82 -1.23 0.00 1.87 0.00 -1.20 0.28 119.26 120.80 1bfm h ALA 40 Ca 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1bfm h ALA 40 Cb 0.10 0.43 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1bfm h ALA 40 CO -0.00 -1.15 -0.06 0.77 0.00 0.00 0.00 179.25 178.81 1bfm h SER 41 N -1.16 0.00 -0.15 0.00 0.02 -1.24 0.65 113.55 111.67 1bfm h SER 41 Ca -0.11 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1bfm h SER 41 Cb 0.84 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 1bfm h SER 41 CO 0.18 0.06 0.09 -0.33 -1.14 0.00 0.00 176.83 175.69 1bfm h GLU 42 N 0.00 0.20 0.00 3.45 5.08 -1.29 -1.64 114.58 120.39 1bfm h GLU 42 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1bfm h GLU 42 Cb 0.12 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1bfm h GLU 42 CO 0.01 0.19 0.00 0.00 -1.00 0.00 0.00 179.01 178.21 1bfm n ALA 43 N -2.16 1.81 -0.07 3.43 0.00 0.97 -1.39 120.51 123.10 1bfm n ALA 43 Ca -0.04 -0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.31 1bfm n ALA 43 Cb 0.06 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.12 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 0.42 0.00 0.00 6.09 0.11 -0.84 117.51 123.29 1bfm h ILE 44 Ca 0.00 -1.42 0.00 0.00 -1.37 0.00 0.00 64.86 62.07 1bfm h ILE 44 Cb 0.38 0.90 0.00 0.00 0.47 0.00 0.00 36.82 38.56 1bfm h ILE 44 CO 0.00 0.14 0.00 0.50 -3.07 0.00 0.00 178.15 175.72 1bfm h LYS 45 N -1.00 0.00 -0.57 2.19 3.64 -1.44 0.72 116.57 120.12 1bfm h LYS 45 Ca -0.07 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1bfm h LYS 45 Cb 0.59 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 1bfm h LYS 45 CO -0.04 0.00 0.34 -0.07 -2.27 0.00 0.00 179.45 177.41 1bfm h LEU 46 N 0.00 0.68 0.83 5.20 4.07 -1.19 -1.83 115.31 123.07 1bfm h LEU 46 Ca 0.00 -0.06 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 1bfm h LEU 46 Cb 0.32 -0.17 0.01 0.00 1.08 0.00 0.00 40.66 41.90 1bfm h LEU 46 CO 0.00 0.54 -0.40 0.00 -1.08 0.00 0.00 178.44 177.50 1bfm h ALA 47 N 1.17 -1.11 0.00 1.53 0.00 0.20 -2.33 119.26 118.71 1bfm h ALA 47 Ca 0.20 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1bfm h ALA 47 Cb -0.02 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1bfm h ALA 47 CO -0.04 -1.09 -0.49 0.07 0.00 0.00 0.00 179.25 177.71 1bfm h ARG 48 N -1.19 0.00 -0.95 0.00 0.11 -1.40 0.77 114.38 111.72 1bfm h ARG 48 Ca -0.11 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.97 1bfm h ARG 48 Cb 0.86 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.90 1bfm h ARG 48 CO 0.19 0.49 0.59 1.25 0.10 0.00 0.00 179.97 182.59 1bfm h HIS 49 N 0.00 1.22 0.50 4.08 2.76 -1.28 0.36 115.15 122.79 1bfm h HIS 49 Ca -0.00 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.15 1bfm h HIS 49 Cb 0.93 -0.41 0.00 0.00 1.55 0.00 0.00 27.41 29.49 1bfm h HIS 49 CO 0.00 0.80 -0.24 0.00 -1.30 0.00 0.00 177.93 177.19 1bfm h ALA 50 N 1.36 -0.67 0.00 5.26 0.00 -0.52 -3.47 119.26 121.22 1bfm h ALA 50 Ca 0.34 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1bfm h ALA 50 Cb -0.09 0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1bfm h ALA 50 CO -0.07 -0.87 0.00 0.41 0.00 0.00 0.00 179.25 178.72 1bfm n GLY 51 N -1.34 0.45 5.47 0.00 0.00 0.21 -5.00 105.19 104.98 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 -2.13 0.00 0.00 0.00 173.32 171.19 1bfm n ARG 52 N 0.00 0.00 0.00 1.61 0.63 0.20 -4.86 116.66 114.24 1bfm n ARG 52 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1bfm n ARG 52 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1bfm n ARG 52 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1bfm n LYS 53 N 0.00 0.00 -3.84 -0.14 4.76 -1.26 -4.46 118.16 113.22 1bfm n LYS 53 Ca 0.00 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.36 1bfm n LYS 53 Cb 0.00 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.16 1bfm n LYS 53 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1bfm s THR 54 N 0.00 0.00 0.13 -0.18 2.01 -1.26 -5.14 115.64 111.20 1bfm s THR 54 Ca 0.00 -0.97 -0.27 0.00 0.31 0.00 0.00 61.69 60.76 1bfm s THR 54 Cb 0.00 -1.90 -0.07 0.00 0.01 0.00 0.00 72.50 70.54 1bfm s THR 54 CO 0.00 -0.02 0.85 -0.63 -0.69 0.00 0.00 174.62 174.14 1bfm s ILE 55 N -3.92 4.45 0.05 1.82 -1.09 -1.26 -4.91 121.20 116.33 1bfm s ILE 55 Ca 0.12 1.85 -0.07 0.00 -2.23 0.00 0.00 60.65 60.32 1bfm s ILE 55 Cb -0.04 -4.22 -0.01 0.00 -1.58 0.00 0.00 42.46 36.62 1bfm s ILE 55 CO 0.04 0.42 0.14 -0.75 -1.23 0.00 0.00 174.94 173.57 1bfm s LYS 56 N -0.55 0.67 0.51 2.79 2.20 -1.26 -5.01 119.74 119.09 1bfm s LYS 56 Ca 0.40 -0.76 0.18 0.00 -0.36 0.00 0.00 55.97 55.43 1bfm s LYS 56 Cb -0.23 0.27 1.26 0.00 -1.51 0.00 0.00 37.83 37.62 1bfm s LYS 56 CO 0.27 -0.18 2.11 0.00 -0.36 0.00 0.00 175.35 177.19 1bfm h ALA 57 N 3.41 1.82 -0.69 3.13 0.00 -1.98 0.95 119.26 125.91 1bfm h ALA 57 Ca -0.33 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1bfm h ALA 57 Cb 1.19 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1bfm h ALA 57 CO 0.51 0.08 0.38 0.93 0.00 0.00 0.00 179.25 181.15 1bfm h GLU 58 N 0.00 0.96 -0.34 0.00 4.39 -1.98 0.20 114.58 117.81 1bfm h GLU 58 Ca -0.00 -0.11 -0.09 0.00 0.34 0.00 0.00 59.36 59.50 1bfm h GLU 58 Cb 0.11 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 1bfm h GLU 58 CO 0.01 0.72 -0.14 -0.44 -1.16 0.00 0.00 179.01 178.00 1bfm h ASP 59 N 0.95 0.72 -0.40 1.42 3.32 0.21 0.57 116.42 123.20 1bfm h ASP 59 Ca 0.24 -0.39 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 1bfm h ASP 59 Cb 0.03 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1bfm h ASP 59 CO -0.04 0.95 0.23 0.40 -1.72 0.00 0.00 179.24 179.06 1bfm h ILE 60 N 0.48 1.14 0.00 0.35 1.08 0.48 0.38 117.51 121.43 1bfm h ILE 60 Ca 0.08 -0.34 -0.13 0.00 -0.39 0.00 0.00 64.86 64.08 1bfm h ILE 60 Cb 0.66 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 35.04 1bfm h ILE 60 CO 0.04 0.14 -0.62 -0.08 -0.69 0.00 0.00 178.15 176.94 1bfm h GLU 61 N 0.52 0.00 -0.42 2.37 4.81 -0.24 0.15 114.58 121.76 1bfm h GLU 61 Ca 0.14 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.31 1bfm h GLU 61 Cb 0.03 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 1bfm h GLU 61 CO -0.02 0.62 0.01 -0.07 -0.73 0.00 0.00 179.01 178.82 1bfm h LEU 62 N 0.00 0.72 -0.78 1.64 4.07 0.27 0.11 115.31 121.33 1bfm h LEU 62 Ca -0.01 -0.30 -0.01 0.00 0.08 0.00 0.00 57.88 57.64 1bfm h LEU 62 Cb 1.22 -0.19 -0.04 0.00 1.08 0.00 0.00 40.66 42.73 1bfm h LEU 62 CO 0.08 0.84 0.44 0.00 -1.08 0.00 0.00 178.44 178.72 1bfm h ALA 63 N 0.90 1.00 0.00 1.53 0.00 0.13 0.89 119.26 123.71 1bfm h ALA 63 Ca 0.12 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1bfm h ALA 63 Cb 0.47 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1bfm h ALA 63 CO 0.02 0.51 -0.34 -0.24 0.00 0.00 0.00 179.25 179.20 1bfm h VAL 64 N 1.08 0.72 -0.03 0.00 3.04 -0.60 -1.37 116.25 119.09 1bfm h VAL 64 Ca 0.28 -1.63 0.01 0.00 -1.01 0.00 0.00 66.70 64.34 1bfm h VAL 64 Cb 0.02 1.45 -0.00 0.00 -2.01 0.00 0.00 31.29 30.75 1bfm h VAL 64 CO -0.05 0.24 0.02 -0.09 -1.01 0.00 0.00 177.57 176.69 1bfm h ARG 65 N -1.00 0.00 -0.24 4.17 1.12 -0.79 0.88 114.38 118.52 1bfm h ARG 65 Ca -0.07 0.00 -0.14 0.00 -1.11 0.00 0.00 59.98 58.66 1bfm h ARG 65 Cb 0.65 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.60 1bfm h ARG 65 CO -0.04 0.00 -0.43 -0.09 -3.11 0.00 0.00 179.97 176.30 1bfm h ARG 66 N 0.00 0.60 0.00 0.20 2.43 -0.83 -1.47 114.38 115.30 1bfm h ARG 66 Ca 0.01 -0.32 -0.01 0.00 -0.81 0.00 0.00 59.98 58.86 1bfm h ARG 66 Cb 0.06 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1bfm h ARG 66 CO -0.00 0.91 -0.03 0.35 -1.51 0.00 0.00 179.97 179.70 1bfm h PHE 67 N 0.49 0.00 -2.91 2.20 3.57 0.18 -3.47 116.94 116.99 1bfm h PHE 67 Ca 0.04 0.00 0.32 0.00 3.53 0.00 0.00 57.97 61.85 1bfm h PHE 67 Cb 0.94 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 39.55 1bfm h PHE 67 CO 0.04 0.03 -0.81 1.63 -2.23 0.00 0.00 178.31 176.96 1bfm n LYS 68 N -4.21 -2.71 -0.55 1.11 5.02 0.64 -5.08 118.16 112.37 1bfm n LYS 68 Ca -0.03 2.05 0.00 0.00 -2.02 0.00 0.00 58.31 58.31 1bfm n LYS 68 Cb 0.11 -3.23 0.00 0.00 -0.02 0.00 0.00 35.03 31.89 1bfm n LYS 68 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51