#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 0.87 0.34 3.17 2.12 -1.26 -5.01 118.70 118.93 1bfm s GLU 2 Ca 0.00 -0.14 -0.29 0.00 0.36 0.00 0.00 54.97 54.91 1bfm s GLU 2 Cb 0.00 -1.85 -0.11 0.00 0.26 0.00 0.00 34.13 32.44 1bfm s GLU 2 CO 0.00 -2.30 1.44 -0.51 -0.54 0.00 0.00 175.26 173.35 1bfm s LEU 3 N -5.94 4.36 0.61 2.70 1.43 -1.26 -4.97 118.68 115.62 1bfm s LEU 3 Ca 0.69 2.88 -0.19 0.00 -1.03 0.00 0.00 54.13 56.48 1bfm s LEU 3 Cb -0.08 -3.65 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 1bfm s LEU 3 CO 0.52 -0.76 1.25 -0.81 0.23 0.00 0.00 176.35 176.79 1bfm n PRO 4 N 1.01 1.22 0.03 1.29 -0.05 -1.26 -4.95 135.00 132.29 1bfm n PRO 4 Ca 0.02 0.47 -0.06 0.00 -0.05 0.00 0.00 63.50 63.89 1bfm n PRO 4 Cb 0.40 -2.48 -0.11 0.00 -0.05 0.00 0.00 33.50 31.27 1bfm n PRO 4 CO 0.00 0.00 0.00 -0.84 -0.05 0.00 0.00 175.50 174.61 1bfm h ILE 5 N 0.76 1.14 0.71 0.52 -0.00 -1.93 -3.34 117.51 115.37 1bfm h ILE 5 Ca -0.50 -2.84 -0.03 0.00 -0.00 0.00 0.00 64.86 61.48 1bfm h ILE 5 Cb 1.34 2.54 0.01 0.00 -0.00 0.00 0.00 36.82 40.70 1bfm h ILE 5 CO 0.54 0.65 -0.34 0.00 -0.00 0.00 0.00 178.15 179.00 1bfm h ALA 6 N 1.11 -1.15 -0.63 0.16 0.00 -1.98 0.25 119.26 117.02 1bfm h ALA 6 Ca -0.13 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.69 1bfm h ALA 6 Cb 1.80 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 19.87 1bfm h ALA 6 CO 0.09 -1.08 0.17 -1.00 0.00 0.00 0.00 179.25 177.43 1bfm h PRO 7 N -1.04 0.30 0.86 0.00 0.13 -2.00 0.23 132.00 130.49 1bfm h PRO 7 Ca -0.10 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 64.97 1bfm h PRO 7 Cb 0.73 -0.07 0.01 0.00 0.13 0.00 0.00 31.00 31.80 1bfm h PRO 7 CO 0.16 0.20 -0.42 0.82 -0.23 0.00 0.00 178.00 178.53 1bfm h ILE 8 N 0.31 0.10 0.00 -3.56 2.04 -1.68 -1.93 117.51 112.80 1bfm h ILE 8 Ca 0.33 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 66.11 1bfm h ILE 8 Cb 0.49 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 1bfm h ILE 8 CO -0.40 0.00 -0.06 1.23 0.00 0.00 0.00 178.15 178.93 1bfm h GLY 9 N -1.22 0.00 1.76 5.37 0.00 -0.27 0.23 103.07 108.93 1bfm h GLY 9 Ca -0.12 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.03 1bfm h GLY 9 CO 0.19 0.00 -0.81 -0.09 0.00 0.00 0.00 176.54 175.84 1bfm h ARG 10 N 0.00 0.22 -0.87 4.80 2.43 -0.24 -1.26 114.38 119.46 1bfm h ARG 10 Ca -0.00 -0.22 -0.00 0.00 -0.81 0.00 0.00 59.98 58.95 1bfm h ARG 10 Cb 0.13 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 1bfm h ARG 10 CO 0.01 0.92 0.53 0.82 -1.51 0.00 0.00 179.97 180.74 1bfm h ILE 11 N 0.13 1.24 -0.27 1.20 2.04 0.22 -1.78 117.51 120.30 1bfm h ILE 11 Ca -0.04 -0.51 -0.08 0.00 1.00 0.00 0.00 64.86 65.23 1bfm h ILE 11 Cb 1.41 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1bfm h ILE 11 CO 0.12 0.25 -0.19 0.40 0.00 0.00 0.00 178.15 178.73 1bfm h ILE 12 N 1.20 1.25 0.00 -0.67 1.08 -0.69 0.19 117.51 119.87 1bfm h ILE 12 Ca 0.31 -1.15 -0.12 0.00 -0.39 0.00 0.00 64.86 63.51 1bfm h ILE 12 Cb -0.06 1.25 -0.02 0.00 -3.07 0.00 0.00 36.82 34.92 1bfm h ILE 12 CO -0.06 0.37 -0.56 0.50 -0.69 0.00 0.00 178.15 177.71 1bfm h LYS 13 N 0.45 0.00 -0.47 2.37 3.64 -1.07 -2.28 116.57 119.20 1bfm h LYS 13 Ca 0.07 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1bfm h LYS 13 Cb 0.59 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 1bfm h LYS 13 CO 0.04 0.56 0.16 0.22 -2.27 0.00 0.00 179.45 178.15 1bfm h ASP 14 N 0.00 0.62 0.31 4.20 1.82 0.25 0.56 116.42 124.18 1bfm h ASP 14 Ca -0.01 -0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.54 1bfm h ASP 14 Cb 0.99 -0.16 -0.00 0.00 0.68 0.00 0.00 39.33 40.84 1bfm h ASP 14 CO 0.07 0.59 -0.17 0.00 -1.61 0.00 0.00 179.24 178.12 1bfm h ALA 15 N 1.51 -0.45 0.00 -0.78 0.00 -0.96 -3.46 119.26 115.11 1bfm h ALA 15 Ca 0.16 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1bfm h ALA 15 Cb 0.18 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1bfm h ALA 15 CO -0.01 -0.76 0.00 0.41 0.00 0.00 0.00 179.25 178.89 1bfm n GLY 16 N -1.30 -0.14 3.77 0.00 0.00 0.20 -5.13 105.19 102.59 1bfm n GLY 16 Ca -0.10 0.00 -0.40 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 3.31 0.00 4.61 0.00 -0.90 -4.93 121.76 123.86 1bfm s ALA 17 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.44 1bfm s ALA 17 Cb 0.00 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1bfm s ALA 17 CO 0.00 -1.15 0.00 -1.91 0.00 0.00 0.00 175.76 172.70 1bfm n GLU 18 N -0.04 2.23 -3.37 0.00 4.07 -1.26 -4.38 120.64 117.88 1bfm n GLU 18 Ca 0.04 0.00 -0.22 0.00 -0.06 0.00 0.00 57.16 56.92 1bfm n GLU 18 Cb 0.41 -0.93 -0.09 0.00 -0.06 0.00 0.00 31.44 30.77 1bfm n GLU 18 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1bfm s ARG 19 N -1.87 0.67 -0.10 5.31 0.52 -1.26 -5.11 118.95 117.11 1bfm s ARG 19 Ca 0.00 -1.23 0.02 0.00 -0.52 0.00 0.00 55.73 53.99 1bfm s ARG 19 Cb 0.00 -1.00 -0.02 0.00 0.52 0.00 0.00 34.95 34.45 1bfm s ARG 19 CO 0.00 -1.24 -0.15 0.08 0.02 0.00 0.00 175.30 174.01 1bfm s VAL 20 N 1.06 2.92 0.35 3.52 1.01 -1.26 -5.13 120.40 122.87 1bfm s VAL 20 Ca 0.20 -0.73 -0.03 0.00 0.00 0.00 0.00 61.98 61.42 1bfm s VAL 20 Cb -0.15 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1bfm s VAL 20 CO -0.04 0.55 0.60 -0.55 0.00 0.00 0.00 175.10 175.66 1bfm s SER 21 N -0.03 6.35 0.61 3.32 0.15 -1.26 -4.94 113.70 117.90 1bfm s SER 21 Ca -0.04 0.66 0.38 0.00 0.70 0.00 0.00 55.95 57.65 1bfm s SER 21 Cb -0.14 -2.12 1.93 0.00 -1.71 0.00 0.00 66.02 63.98 1bfm s SER 21 CO 0.04 -0.31 2.20 0.44 1.20 0.00 0.00 173.24 176.82 1bfm h ASP 22 N 1.04 0.00 -0.09 5.45 5.19 -2.00 0.19 116.42 126.20 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 0.63 0.02 0.05 0.44 -3.12 0.00 0.00 179.24 177.27 1bfm h ASP 23 N 0.00 0.11 -0.50 6.45 3.32 -1.98 -1.99 116.42 121.83 1bfm h ASP 23 Ca -0.00 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1bfm h ASP 23 Cb 0.21 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1bfm h ASP 23 CO 0.00 0.13 0.26 0.00 -1.72 0.00 0.00 179.24 177.92 1bfm h ALA 24 N 0.98 0.65 -0.22 3.45 0.00 -1.01 0.58 119.26 123.68 1bfm h ALA 24 Ca 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1bfm h ALA 24 Cb 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1bfm h ALA 24 CO -0.01 0.19 0.09 0.00 0.00 0.00 0.00 179.25 179.52 1bfm h ARG 25 N 0.67 0.33 -0.27 0.00 3.08 -1.38 0.29 114.38 117.11 1bfm h ARG 25 Ca 0.17 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 1bfm h ARG 25 Cb 0.08 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1bfm h ARG 25 CO -0.03 0.39 0.14 0.82 -1.07 0.00 0.00 179.97 180.23 1bfm h ILE 26 N 0.21 1.09 -0.36 2.04 1.08 -0.83 -1.50 117.51 119.24 1bfm h ILE 26 Ca 0.07 -0.24 -0.09 0.00 -0.39 0.00 0.00 64.86 64.22 1bfm h ILE 26 Cb 0.18 0.74 -0.01 0.00 -3.07 0.00 0.00 36.82 34.66 1bfm h ILE 26 CO -0.01 0.10 -0.11 0.74 -0.69 0.00 0.00 178.15 178.18 1bfm h THR 27 N 0.37 1.28 -0.38 -0.27 2.02 0.11 -2.43 112.91 113.60 1bfm h THR 27 Ca 0.10 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.07 1bfm h THR 27 Cb 0.02 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1bfm h THR 27 CO -0.02 0.39 0.18 -0.07 0.37 0.00 0.00 175.52 176.38 1bfm h LEU 28 N 0.51 0.47 -0.00 2.58 -0.00 0.49 -1.72 115.31 117.64 1bfm h LEU 28 Ca 0.09 -0.04 -0.06 0.00 -0.00 0.00 0.00 57.88 57.88 1bfm h LEU 28 Cb 0.63 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1bfm h LEU 28 CO 0.04 0.41 -0.21 0.00 -0.00 0.00 0.00 178.44 178.68 1bfm h ALA 29 N 1.67 0.03 -0.27 1.53 0.00 -1.17 0.57 119.26 121.62 1bfm h ALA 29 Ca 0.14 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1bfm h ALA 29 Cb 0.07 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1bfm h ALA 29 CO -0.02 0.06 0.14 -0.22 0.00 0.00 0.00 179.25 179.21 1bfm h LYS 30 N -0.54 0.36 0.00 0.00 3.64 -1.31 0.33 116.57 119.06 1bfm h LYS 30 Ca -0.03 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1bfm h LYS 30 Cb 0.97 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 1bfm h LYS 30 CO 0.04 0.28 0.00 -0.89 -2.27 0.00 0.00 179.45 176.61 1bfm n ILE 31 N -4.46 0.00 0.17 2.00 5.41 -0.66 -1.91 119.36 119.92 1bfm n ILE 31 Ca 0.01 1.10 0.14 0.00 1.00 0.00 0.00 62.75 64.99 1bfm n ILE 31 Cb 0.10 -2.07 0.70 0.00 -0.71 0.00 0.00 39.64 37.67 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 -0.02 1.39 4.07 0.16 0.65 115.31 121.56 1bfm h LEU 32 Ca 0.00 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 57.75 1bfm h LEU 32 Cb 0.00 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.76 1bfm h LEU 32 CO 0.00 0.00 -0.82 1.05 -1.08 0.00 0.00 178.44 177.59 1bfm h GLU 33 N 0.00 0.59 0.00 1.13 -0.00 -0.54 0.57 114.58 116.34 1bfm h GLU 33 Ca 0.09 -0.61 -0.04 0.00 -0.00 0.00 0.00 59.36 58.80 1bfm h GLU 33 Cb 0.39 0.17 -0.01 0.00 -0.00 0.00 0.00 28.75 29.30 1bfm h GLU 33 CO -0.00 1.22 -0.21 1.49 -0.00 0.00 0.00 179.01 181.51 1bfm h GLU 34 N 0.21 0.00 0.09 1.06 4.81 0.04 0.27 114.58 121.05 1bfm h GLU 34 Ca -0.10 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.87 1bfm h GLU 34 Cb 1.49 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.86 1bfm h GLU 34 CO 0.16 0.21 -1.27 0.52 -0.73 0.00 0.00 179.01 177.91 1bfm h MET 35 N 0.00 0.18 -0.41 1.92 2.86 0.43 -1.51 114.93 118.39 1bfm h MET 35 Ca -0.00 -0.31 -0.15 0.00 -2.06 0.00 0.00 59.70 57.18 1bfm h MET 35 Cb 0.57 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1bfm h MET 35 CO 0.03 1.10 -0.31 0.78 1.06 0.00 0.00 176.91 179.57 1bfm h GLY 36 N 2.07 1.01 1.65 8.32 0.00 0.24 0.85 103.07 117.21 1bfm h GLY 36 Ca -0.13 -0.96 -0.01 0.00 0.00 0.00 0.00 47.33 46.22 1bfm h GLY 36 CO 0.17 0.87 0.17 -0.09 0.00 0.00 0.00 176.54 177.66 1bfm h ARG 37 N 0.78 0.46 0.72 4.80 2.43 -0.62 -2.01 114.38 120.93 1bfm h ARG 37 Ca 0.08 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1bfm h ARG 37 Cb 0.89 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.35 1bfm h ARG 37 CO 0.08 0.35 -0.34 0.22 -1.51 0.00 0.00 179.97 178.77 1bfm h ASP 38 N 0.46 -0.82 0.06 -3.80 1.82 0.15 -2.39 116.42 111.91 1bfm h ASP 38 Ca 0.12 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.78 1bfm h ASP 38 Cb 0.04 0.21 -0.00 0.00 0.68 0.00 0.00 39.33 40.26 1bfm h ASP 38 CO -0.02 -0.48 -0.05 0.40 -1.61 0.00 0.00 179.24 177.48 1bfm h ILE 39 N -1.17 0.97 0.62 2.25 2.04 0.20 -2.21 117.51 120.21 1bfm h ILE 39 Ca -0.10 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 1bfm h ILE 39 Cb 0.74 1.10 0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1bfm h ILE 39 CO 0.16 0.05 -0.30 0.00 0.00 0.00 0.00 178.15 178.07 1bfm h ALA 40 N 1.95 -1.16 0.00 1.87 0.00 -1.08 0.28 119.26 121.11 1bfm h ALA 40 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1bfm h ALA 40 Cb 0.10 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1bfm h ALA 40 CO 0.01 -1.10 -0.06 0.66 0.00 0.00 0.00 179.25 178.76 1bfm h SER 41 N -0.88 0.00 -0.40 0.00 4.64 -1.28 0.67 113.55 116.29 1bfm h SER 41 Ca -0.09 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1bfm h SER 41 Cb 0.64 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.71 1bfm h SER 41 CO 0.14 0.06 0.24 -0.33 -0.87 0.00 0.00 176.83 176.06 1bfm h GLU 42 N 0.00 0.55 0.00 4.77 4.39 -1.37 -1.72 114.58 121.20 1bfm h GLU 42 Ca -0.00 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1bfm h GLU 42 Cb 0.13 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1bfm h GLU 42 CO 0.01 0.42 0.00 0.00 -1.16 0.00 0.00 179.01 178.28 1bfm n ALA 43 N -2.24 2.15 -0.09 3.43 0.00 0.97 -1.29 120.51 123.44 1bfm n ALA 43 Ca 0.00 -0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.23 1bfm n ALA 43 Cb 0.06 -1.39 -0.06 0.00 0.00 0.00 0.00 19.45 18.07 1bfm n ALA 43 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1bfm n ILE 44 N -1.41 1.47 0.31 0.00 3.06 0.20 -1.28 119.36 121.71 1bfm n ILE 44 Ca 0.08 0.11 0.20 0.00 -2.50 0.00 0.00 62.75 60.63 1bfm n ILE 44 Cb 0.24 -2.25 0.99 0.00 0.54 0.00 0.00 39.64 39.17 1bfm n ILE 44 CO 0.00 0.00 0.00 0.50 -2.50 0.00 0.00 176.55 174.55 1bfm h LYS 45 N -1.00 0.00 0.79 9.51 3.64 -1.44 0.11 116.57 128.18 1bfm h LYS 45 Ca -0.15 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.19 1bfm h LYS 45 Cb 0.86 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.68 1bfm h LYS 45 CO -0.09 0.02 -0.38 -0.07 -2.27 0.00 0.00 179.45 176.66 1bfm h LEU 46 N 0.00 -0.89 -2.56 5.20 4.07 -1.19 0.57 115.31 120.50 1bfm h LEU 46 Ca -0.00 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.98 1bfm h LEU 46 Cb 0.19 0.23 -0.00 0.00 1.08 0.00 0.00 40.66 42.16 1bfm h LEU 46 CO 0.00 -0.60 -0.02 0.00 -1.08 0.00 0.00 178.44 176.74 1bfm h ALA 47 N -0.93 1.18 0.01 1.53 0.00 0.52 -2.14 119.26 119.41 1bfm h ALA 47 Ca -0.11 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.44 1bfm h ALA 47 Cb 0.82 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.54 1bfm h ALA 47 CO 0.18 0.02 -2.21 -2.13 0.00 0.00 0.00 179.25 175.11 1bfm n ARG 48 N -3.36 0.67 -0.02 0.00 0.63 -0.12 -1.96 116.66 112.51 1bfm n ARG 48 Ca -0.02 0.10 0.03 0.00 -0.92 0.00 0.00 57.85 57.03 1bfm n ARG 48 Cb 0.12 -1.60 0.38 0.00 0.45 0.00 0.00 32.46 31.81 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 0.56 -0.00 -0.14 2.76 0.68 0.57 115.15 119.58 1bfm h HIS 49 Ca -0.48 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 57.69 1bfm h HIS 49 Cb 2.14 -0.18 -0.00 0.00 1.55 0.00 0.00 27.41 30.92 1bfm h HIS 49 CO 0.01 0.39 0.00 0.00 -1.30 0.00 0.00 177.93 177.03 1bfm h ALA 50 N 1.68 0.00 -3.15 5.26 0.00 -1.47 -3.47 119.26 118.10 1bfm h ALA 50 Ca 0.15 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 1bfm h ALA 50 Cb 0.01 -0.00 0.06 0.00 0.00 0.00 0.00 17.79 17.86 1bfm h ALA 50 CO -0.03 -0.47 -0.30 0.41 0.00 0.00 0.00 179.25 178.86 1bfm n GLY 51 N -0.94 0.28 0.00 0.00 0.00 0.20 -5.01 105.19 99.72 1bfm n GLY 51 Ca -0.07 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.45 1.41 -3.61 1.61 3.00 -0.96 -5.03 116.66 110.63 1bfm n ARG 52 Ca -0.01 0.00 -0.38 0.00 -0.01 0.00 0.00 57.85 57.45 1bfm n ARG 52 Cb 0.53 0.00 -0.11 0.00 0.00 0.00 0.00 32.46 32.88 1bfm n ARG 52 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1bfm s LYS 53 N -1.09 3.72 0.38 5.56 2.36 -1.26 -4.91 119.74 124.51 1bfm s LYS 53 Ca 0.00 -0.47 0.00 0.00 -2.55 0.00 0.00 55.97 52.95 1bfm s LYS 53 Cb 0.00 -3.62 0.00 0.00 -1.05 0.00 0.00 37.83 33.16 1bfm s LYS 53 CO 0.00 -0.27 0.00 2.41 1.55 0.00 0.00 175.35 179.04 1bfm n THR 54 N 5.04 -0.52 -3.94 3.43 -1.04 -1.26 -4.91 114.28 111.06 1bfm n THR 54 Ca -0.14 0.57 -0.32 0.00 -2.04 0.00 0.00 64.05 62.11 1bfm n THR 54 Cb 0.51 -0.87 -0.05 0.00 -1.82 0.00 0.00 70.33 68.10 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 -3.69 5.27 0.05 12.58 1.01 -1.26 -4.94 121.20 130.22 1bfm s ILE 55 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1bfm s ILE 55 Cb 0.00 -3.49 -0.00 0.00 0.01 0.00 0.00 42.46 38.97 1bfm s ILE 55 CO 0.00 0.26 0.06 2.29 0.00 0.00 0.00 174.94 177.55 1bfm n LYS 56 N 0.75 0.09 -0.24 2.79 2.85 -1.26 -5.01 118.16 118.12 1bfm n LYS 56 Ca -0.09 -0.41 -0.06 0.00 -1.05 0.00 0.00 58.31 56.69 1bfm n LYS 56 Cb 0.52 0.38 0.04 0.00 -0.65 0.00 0.00 35.03 35.32 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 1.40 0.86 0.00 0.58 0.00 -1.99 -0.19 119.26 119.92 1bfm h ALA 57 Ca -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1bfm h ALA 57 Cb 0.17 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1bfm h ALA 57 CO 0.05 0.39 -0.04 0.93 0.00 0.00 0.00 179.25 180.59 1bfm h GLU 58 N 0.92 0.00 0.00 0.00 3.07 -1.99 -1.96 114.58 114.62 1bfm h GLU 58 Ca 0.23 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.08 1bfm h GLU 58 Cb 0.07 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1bfm h GLU 58 CO -0.03 0.04 -0.09 -0.44 -1.40 0.00 0.00 179.01 177.08 1bfm h ASP 59 N 0.00 0.00 -0.71 1.42 3.32 -1.50 -2.27 116.42 116.68 1bfm h ASP 59 Ca -0.00 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.64 1bfm h ASP 59 Cb 0.13 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1bfm h ASP 59 CO 0.00 0.75 0.41 0.40 -1.72 0.00 0.00 179.24 179.08 1bfm h ILE 60 N -1.00 1.21 -0.38 0.35 1.08 -1.09 0.59 117.51 118.27 1bfm h ILE 60 Ca -0.02 -0.50 -0.01 0.00 -0.39 0.00 0.00 64.86 63.95 1bfm h ILE 60 Cb 0.47 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 34.42 1bfm h ILE 60 CO -0.01 0.23 0.21 -0.33 -0.69 0.00 0.00 178.15 177.56 1bfm h GLU 61 N 1.00 0.52 -0.36 2.37 5.08 -1.48 -2.14 114.58 119.58 1bfm h GLU 61 Ca 0.26 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1bfm h GLU 61 Cb -0.00 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1bfm h GLU 61 CO -0.04 0.42 0.16 -0.07 -1.00 0.00 0.00 179.01 178.48 1bfm h LEU 62 N 0.48 0.48 -1.81 1.33 -0.00 -0.63 -1.43 115.31 113.73 1bfm h LEU 62 Ca 0.13 -0.14 -0.02 0.00 -0.00 0.00 0.00 57.88 57.85 1bfm h LEU 62 Cb 0.05 -0.12 -0.00 0.00 -0.00 0.00 0.00 40.66 40.58 1bfm h LEU 62 CO -0.02 0.49 -0.06 0.00 -0.00 0.00 0.00 178.44 178.85 1bfm h ALA 63 N 1.01 1.84 0.00 1.53 0.00 0.34 -0.04 119.26 123.94 1bfm h ALA 63 Ca 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1bfm h ALA 63 Cb 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1bfm h ALA 63 CO -0.01 0.12 -0.39 -0.24 0.00 0.00 0.00 179.25 178.73 1bfm h VAL 64 N 0.04 0.00 0.00 0.00 3.04 -0.61 -2.52 116.25 116.20 1bfm h VAL 64 Ca 0.01 -0.78 0.00 0.00 -1.01 0.00 0.00 66.70 64.92 1bfm h VAL 64 Cb 0.14 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.42 1bfm h VAL 64 CO 0.01 0.00 0.00 0.03 -1.01 0.00 0.00 177.57 176.60 1bfm h ARG 65 N -0.78 0.00 0.00 4.17 3.08 -1.41 -2.42 114.38 117.02 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 0.39 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.44 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 -2.82 0.00 0.29 0.04 3.00 -0.03 -3.84 116.66 113.29 1bfm n ARG 66 Ca -0.02 0.16 0.17 0.00 -0.00 0.00 0.00 57.85 58.16 1bfm n ARG 66 Cb 0.07 -1.05 0.86 0.00 0.00 0.00 0.00 32.46 32.33 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 -0.51 -0.14 -0.00 -1.07 0.27 116.94 115.49 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 0.06 0.05 0.30 1.57 -0.00 0.00 0.00 178.31 180.29 1bfm h LYS 68 N 0.00 0.69 0.00 6.09 2.10 -1.62 -3.52 116.57 120.32 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 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 1bfm h LYS 68 CO 0.01 0.49 0.00 0.36 -2.00 0.00 0.00 179.45 178.31