#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b6w s LEU 3 N 0.00 4.42 0.38 -4.62 1.43 -1.26 -5.03 118.68 114.01 1b6w s LEU 3 Ca 0.00 1.79 -0.24 0.00 -1.03 0.00 0.00 54.13 54.65 1b6w s LEU 3 Cb 0.00 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 42.55 1b6w s LEU 3 CO 0.00 -0.23 1.02 -2.16 0.23 0.00 0.00 176.35 175.21 1b6w s PRO 4 N 0.59 4.26 0.22 1.29 0.04 -1.26 -5.01 135.00 135.14 1b6w s PRO 4 Ca 0.51 1.45 0.04 0.00 0.04 0.00 0.00 61.00 63.04 1b6w s PRO 4 Cb -0.24 -2.58 0.20 0.00 0.04 0.00 0.00 34.50 31.93 1b6w s PRO 4 CO 0.29 -0.04 1.53 0.82 0.04 0.00 0.00 177.00 179.64 1b6w h ILE 5 N 2.27 1.40 -0.45 0.56 1.08 -1.95 -3.36 117.51 117.05 1b6w h ILE 5 Ca -0.48 -2.08 -0.10 0.00 -0.39 0.00 0.00 64.86 61.81 1b6w h ILE 5 Cb 1.21 2.07 -0.01 0.00 -3.07 0.00 0.00 36.82 37.02 1b6w h ILE 5 CO 0.63 0.61 -0.12 0.00 -0.69 0.00 0.00 178.15 178.58 1b6w h ALA 6 N 1.15 0.63 -0.67 1.87 0.00 -1.97 -2.26 119.26 118.00 1b6w h ALA 6 Ca -0.01 -0.34 0.03 0.00 0.00 0.00 0.00 54.91 54.59 1b6w h ALA 6 Cb 1.17 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 1b6w h ALA 6 CO 0.10 0.53 0.44 -1.35 0.00 0.00 0.00 179.25 178.98 1b6w h PRO 7 N 0.72 0.78 -0.54 0.00 0.11 -2.00 -2.04 132.00 129.04 1b6w h PRO 7 Ca 0.11 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.08 1b6w h PRO 7 Cb 0.67 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 1b6w h PRO 7 CO 0.05 0.52 -0.05 0.82 -0.21 0.00 0.00 178.00 179.12 1b6w h ILE 8 N 0.81 1.27 -0.94 4.15 1.08 -1.58 -2.10 117.51 120.20 1b6w h ILE 8 Ca 0.27 -1.19 0.01 0.00 -0.39 0.00 0.00 64.86 63.56 1b6w h ILE 8 Cb 0.06 0.95 -0.05 0.00 -3.07 0.00 0.00 36.82 34.72 1b6w h ILE 8 CO -0.07 0.42 0.62 1.23 -0.69 0.00 0.00 178.15 179.66 1b6w h GLY 9 N 0.85 1.32 1.84 5.37 0.00 -0.96 -1.89 103.07 109.61 1b6w h GLY 9 Ca 0.14 -0.49 -0.07 0.00 0.00 0.00 0.00 47.33 46.92 1b6w h GLY 9 CO 0.04 0.47 -0.26 3.21 0.00 0.00 0.00 176.54 179.99 1b6w h ARG 10 N 1.25 0.19 -0.57 4.80 3.08 -1.17 -1.84 114.38 120.13 1b6w h ARG 10 Ca 0.35 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.23 1b6w h ARG 10 Cb -0.12 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 1b6w h ARG 10 CO -0.08 0.45 -0.05 0.82 -1.07 0.00 0.00 179.97 180.03 1b6w h ILE 11 N 0.17 1.27 -0.31 2.04 2.04 -0.65 -1.34 117.51 120.73 1b6w h ILE 11 Ca 0.03 -1.20 -0.14 0.00 1.00 0.00 0.00 64.86 64.55 1b6w h ILE 11 Cb 0.56 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1b6w h ILE 11 CO 0.04 0.43 -0.35 0.40 0.00 0.00 0.00 178.15 178.67 1b6w h ILE 12 N 0.93 1.29 -0.72 -0.67 2.04 -1.27 -2.05 117.51 117.06 1b6w h ILE 12 Ca 0.16 -1.53 0.01 0.00 1.00 0.00 0.00 64.86 64.49 1b6w h ILE 12 Cb 0.61 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 38.20 1b6w h ILE 12 CO 0.04 0.50 0.48 0.11 0.00 0.00 0.00 178.15 179.27 1b6w h LYS 13 N 0.55 0.96 0.00 2.37 1.79 -1.32 -2.49 116.57 118.44 1b6w h LYS 13 Ca 0.04 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.44 1b6w h LYS 13 Cb 0.94 -0.21 -0.00 0.00 -1.58 0.00 0.00 32.23 31.37 1b6w h LYS 13 CO 0.09 0.64 -0.08 -0.44 -1.08 0.00 0.00 179.45 178.57 1b6w h ASP 14 N 0.98 0.00 0.42 0.86 3.32 -0.99 0.62 116.42 121.63 1b6w h ASP 14 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1b6w h ASP 14 Cb -0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1b6w h ASP 14 CO -0.06 0.08 -0.07 0.00 -1.72 0.00 0.00 179.24 177.47 1b6w n ALA 15 N -2.30 2.67 0.00 3.45 0.00 -0.79 -4.93 120.51 118.61 1b6w n ALA 15 Ca -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1b6w n ALA 15 Cb 0.19 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1b6w n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b6w n GLY 16 N 1.27 0.91 3.77 0.00 0.00 0.21 -5.10 105.19 106.25 1b6w n GLY 16 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1b6w n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b6w s ALA 17 N -2.00 3.30 0.03 4.61 0.00 -1.10 -4.92 121.76 121.67 1b6w s ALA 17 Ca 0.00 1.42 -0.12 0.00 0.00 0.00 0.00 51.96 53.26 1b6w s ALA 17 Cb 0.00 -3.57 -0.33 0.00 0.00 0.00 0.00 23.12 19.22 1b6w s ALA 17 CO 0.00 -1.07 0.98 0.93 0.00 0.00 0.00 175.76 176.60 1b6w h GLU 18 N 2.53 0.45 -3.79 0.00 5.08 -1.92 -3.42 114.58 113.49 1b6w h GLU 18 Ca -0.51 -0.76 -0.16 0.00 -1.00 0.00 0.00 59.36 56.93 1b6w h GLU 18 Cb 1.26 0.28 -0.21 0.00 0.50 0.00 0.00 28.75 30.58 1b6w h GLU 18 CO 0.62 1.36 -0.62 0.50 -1.00 0.00 0.00 179.01 179.87 1b6w s ARG 19 N -2.61 0.37 -0.04 2.33 3.52 -1.26 -5.11 118.95 116.15 1b6w s ARG 19 Ca -0.09 -0.52 0.00 0.00 -0.13 0.00 0.00 55.73 55.00 1b6w s ARG 19 Cb 0.05 0.14 0.03 0.00 -1.56 0.00 0.00 34.95 33.61 1b6w s ARG 19 CO 0.92 -0.07 -0.01 0.08 -0.81 0.00 0.00 175.30 175.40 1b6w s VAL 20 N -1.40 0.31 0.61 7.11 1.01 -1.26 -5.07 120.40 121.70 1b6w s VAL 20 Ca -0.15 0.04 -0.10 0.00 0.00 0.00 0.00 61.98 61.77 1b6w s VAL 20 Cb -0.09 -0.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.86 1b6w s VAL 20 CO 0.00 0.19 0.99 -0.94 0.00 0.00 0.00 175.10 175.34 1b6w s SER 21 N 1.19 6.07 0.29 3.32 1.04 -1.26 -4.97 113.70 119.38 1b6w s SER 21 Ca -0.07 1.25 -0.02 0.00 0.48 0.00 0.00 55.95 57.58 1b6w s SER 21 Cb -0.14 -2.30 0.42 0.00 0.10 0.00 0.00 66.02 64.11 1b6w s SER 21 CO -0.02 -0.91 1.94 0.44 0.98 0.00 0.00 173.24 175.67 1b6w h ASP 22 N -0.27 0.93 -0.23 7.02 5.19 -2.00 -2.60 116.42 124.44 1b6w h ASP 22 Ca -0.45 -0.05 -0.05 0.00 -0.62 0.00 0.00 57.03 55.86 1b6w h ASP 22 Cb 1.21 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 40.47 1b6w h ASP 22 CO 0.62 0.71 0.02 -0.78 -3.12 0.00 0.00 179.24 176.69 1b6w h ASP 23 N 1.07 0.48 -0.33 6.45 1.82 -1.99 -1.40 116.42 122.52 1b6w h ASP 23 Ca 0.28 -0.08 -0.16 0.00 -0.39 0.00 0.00 57.03 56.67 1b6w h ASP 23 Cb -0.04 -0.12 -0.00 0.00 0.68 0.00 0.00 39.33 39.84 1b6w h ASP 23 CO -0.05 0.54 -0.43 0.00 -1.61 0.00 0.00 179.24 177.68 1b6w h ALA 24 N 1.53 0.50 -0.06 -0.78 0.00 -1.86 -1.04 119.26 117.54 1b6w h ALA 24 Ca 0.11 -0.47 0.02 0.00 0.00 0.00 0.00 54.91 54.57 1b6w h ALA 24 Cb 0.30 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1b6w h ALA 24 CO 0.01 0.63 -0.04 0.00 0.00 0.00 0.00 179.25 179.85 1b6w h ARG 25 N 0.67 -0.03 -0.21 0.00 3.08 -1.12 -2.34 114.38 114.43 1b6w h ARG 25 Ca 0.04 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 1b6w h ARG 25 Cb 1.03 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 1b6w h ARG 25 CO 0.10 -0.02 0.12 0.82 -1.07 0.00 0.00 179.97 179.91 1b6w h ILE 26 N -0.04 1.10 -0.18 2.04 2.04 -1.27 -1.56 117.51 119.65 1b6w h ILE 26 Ca 0.04 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1b6w h ILE 26 Cb 0.09 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1b6w h ILE 26 CO -0.09 0.10 0.09 0.74 0.00 0.00 0.00 178.15 179.00 1b6w h THR 27 N 0.23 1.00 -0.08 -0.27 2.02 -1.20 -1.46 112.91 113.16 1b6w h THR 27 Ca 0.07 -0.07 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1b6w h THR 27 Cb 0.06 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1b6w h THR 27 CO -0.01 0.04 -0.16 0.25 0.37 0.00 0.00 175.52 176.01 1b6w h LEU 28 N 0.20 0.11 -0.49 2.58 5.85 -1.40 -2.15 115.31 120.00 1b6w h LEU 28 Ca 0.07 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.67 1b6w h LEU 28 Cb 0.01 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1b6w h LEU 28 CO -0.05 0.28 -0.09 0.00 -0.34 0.00 0.00 178.44 178.25 1b6w h ALA 29 N 1.73 0.68 -0.59 1.25 0.00 -0.97 -0.56 119.26 120.79 1b6w h ALA 29 Ca 0.02 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 1b6w h ALA 29 Cb 0.35 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1b6w h ALA 29 CO 0.02 0.57 0.13 0.87 0.00 0.00 0.00 179.25 180.84 1b6w h LYS 30 N 0.79 0.95 -0.30 0.00 1.57 -1.13 -1.81 116.57 116.63 1b6w h LYS 30 Ca 0.13 -0.24 -0.14 0.00 -1.87 0.00 0.00 60.65 58.53 1b6w h LYS 30 Cb 0.64 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1b6w h LYS 30 CO 0.04 0.89 -0.39 0.82 -0.57 0.00 0.00 179.45 180.24 1b6w h ILE 31 N 0.86 1.29 -0.51 1.86 2.04 -1.08 -2.15 117.51 119.81 1b6w h ILE 31 Ca 0.18 -1.57 -0.10 0.00 1.00 0.00 0.00 64.86 64.38 1b6w h ILE 31 Cb 0.37 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.91 1b6w h ILE 31 CO 0.00 0.51 -0.07 -0.07 0.00 0.00 0.00 178.15 178.52 1b6w h LEU 32 N 0.59 0.95 -0.50 1.44 3.38 -1.05 -2.99 115.31 117.13 1b6w h LEU 32 Ca 0.05 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1b6w h LEU 32 Cb 0.94 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1b6w h LEU 32 CO 0.09 1.07 0.32 -0.08 0.09 0.00 0.00 178.44 179.92 1b6w h GLU 33 N 0.82 0.67 -0.68 1.13 4.81 -1.26 0.13 114.58 120.19 1b6w h GLU 33 Ca 0.14 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1b6w h GLU 33 Cb 0.62 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1b6w h GLU 33 CO 0.04 0.46 0.00 0.39 -0.73 0.00 0.00 179.01 179.17 1b6w n GLU 34 N -4.72 0.00 0.00 1.92 1.02 -0.82 -1.55 120.64 116.50 1b6w n GLU 34 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1b6w n GLU 34 Cb 0.04 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 1b6w n GLU 34 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b6w n GLY 36 N 0.64 0.00 0.23 0.62 0.00 0.47 -1.93 105.19 105.22 1b6w n GLY 36 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1b6w n GLY 36 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1b6w h ARG 37 N 0.00 0.77 -0.55 1.61 3.08 -1.54 -0.73 114.38 117.02 1b6w h ARG 37 Ca 0.00 -0.40 -0.06 0.00 0.07 0.00 0.00 59.98 59.59 1b6w h ARG 37 Cb 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1b6w h ARG 37 CO 0.00 1.02 0.11 -0.44 -1.07 0.00 0.00 179.97 179.59 1b6w h ASP 38 N 0.54 0.86 -0.58 7.04 3.32 -1.66 -1.38 116.42 124.56 1b6w h ASP 38 Ca 0.06 -0.25 -0.06 0.00 0.02 0.00 0.00 57.03 56.80 1b6w h ASP 38 Cb 0.87 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 1b6w h ASP 38 CO 0.07 0.89 0.13 0.40 -1.72 0.00 0.00 179.24 179.02 1b6w h ILE 39 N 0.80 1.25 -0.64 0.35 2.04 -1.83 -2.71 117.51 116.77 1b6w h ILE 39 Ca 0.17 -0.91 -0.05 0.00 1.00 0.00 0.00 64.86 65.07 1b6w h ILE 39 Cb 0.38 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1b6w h ILE 39 CO 0.01 0.34 0.20 0.00 0.00 0.00 0.00 178.15 178.69 1b6w h ALA 40 N 1.03 0.83 -0.67 1.87 0.00 -1.06 -0.48 119.26 120.78 1b6w h ALA 40 Ca 0.18 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1b6w h ALA 40 Cb 0.36 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1b6w h ALA 40 CO 0.00 0.51 0.19 1.03 0.00 0.00 0.00 179.25 180.98 1b6w h SER 41 N 0.92 0.98 -0.24 0.00 0.87 -1.16 -1.12 113.55 113.79 1b6w h SER 41 Ca 0.21 -0.19 -0.17 0.00 -1.23 0.00 0.00 61.79 60.41 1b6w h SER 41 Cb 0.29 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1b6w h SER 41 CO -0.01 0.93 -0.48 -0.08 -0.53 0.00 0.00 176.83 176.66 1b6w h GLU 42 N 1.00 0.82 -0.58 2.24 4.57 -1.26 -3.09 114.58 118.28 1b6w h GLU 42 Ca 0.22 -0.48 -0.02 0.00 -1.18 0.00 0.00 59.36 57.90 1b6w h GLU 42 Cb 0.32 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.92 1b6w h GLU 42 CO -0.00 1.11 0.28 0.00 -1.18 0.00 0.00 179.01 179.22 1b6w h ALA 43 N 0.80 1.42 -0.29 2.92 0.00 -0.74 -1.61 119.26 121.77 1b6w h ALA 43 Ca 0.03 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1b6w h ALA 43 Cb 1.07 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1b6w h ALA 43 CO 0.11 0.46 0.16 0.82 0.00 0.00 0.00 179.25 180.80 1b6w h ILE 44 N 0.81 1.12 -0.81 0.00 2.04 -1.18 -0.29 117.51 119.19 1b6w h ILE 44 Ca 0.20 -0.29 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 1b6w h ILE 44 Cb 0.07 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 1b6w h ILE 44 CO -0.03 0.12 0.35 0.11 0.00 0.00 0.00 178.15 178.70 1b6w h LYS 45 N 0.35 1.19 -0.36 2.37 1.57 -1.35 -2.37 116.57 117.97 1b6w h LYS 45 Ca 0.10 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1b6w h LYS 45 Cb 0.04 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 1b6w h LYS 45 CO -0.02 0.94 0.19 -0.07 -0.57 0.00 0.00 179.45 179.92 1b6w h LEU 46 N 1.17 0.47 -1.58 2.94 3.38 -0.94 -2.14 115.31 118.60 1b6w h LEU 46 Ca 0.27 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.15 1b6w h LEU 46 Cb 0.17 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1b6w h LEU 46 CO -0.03 0.44 0.29 0.00 0.09 0.00 0.00 178.44 179.23 1b6w h ALA 47 N 1.04 1.71 -0.58 1.53 0.00 -0.96 -2.22 119.26 119.78 1b6w h ALA 47 Ca 0.13 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1b6w h ALA 47 Cb 0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1b6w h ALA 47 CO -0.02 0.26 -0.02 -0.09 0.00 0.00 0.00 179.25 179.39 1b6w h ARG 48 N 0.57 1.03 0.00 0.00 2.43 -1.11 -0.80 114.38 116.51 1b6w h ARG 48 Ca 0.16 -0.34 -0.02 0.00 -0.81 0.00 0.00 59.98 58.97 1b6w h ARG 48 Cb -0.04 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1b6w h ARG 48 CO -0.04 1.03 -0.09 1.25 -1.51 0.00 0.00 179.97 180.61 1b6w h HIS 49 N 0.92 0.00 -0.60 2.20 2.76 -0.80 -1.61 115.15 118.03 1b6w h HIS 49 Ca 0.16 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1b6w h HIS 49 Cb 0.57 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.53 1b6w h HIS 49 CO 0.04 0.09 0.00 0.00 -1.30 0.00 0.00 177.93 176.76 1b6w n ALA 50 N -2.23 2.83 -1.25 5.26 0.00 -0.92 -4.95 120.51 119.25 1b6w n ALA 50 Ca -0.02 -1.31 -0.03 0.00 0.00 0.00 0.00 53.44 52.09 1b6w n ALA 50 Cb 0.23 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 1b6w n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b6w n GLY 51 N 1.20 0.56 3.40 0.00 0.00 -0.60 -5.05 105.19 104.70 1b6w n GLY 51 Ca 0.22 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 45.07 1b6w n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b6w s ARG 52 N -2.58 1.45 -0.03 1.61 0.52 -0.35 -5.01 118.95 114.56 1b6w s ARG 52 Ca 0.00 -1.46 0.18 0.00 -0.52 0.00 0.00 55.73 53.92 1b6w s ARG 52 Cb 0.00 -1.78 -0.28 0.00 0.52 0.00 0.00 34.95 33.41 1b6w s ARG 52 CO 0.00 0.39 0.38 1.63 0.02 0.00 0.00 175.30 177.72 1b6w n LYS 53 N 0.42 0.58 -3.10 3.54 5.02 -1.26 -3.75 118.16 119.61 1b6w n LYS 53 Ca -0.14 -0.16 -0.39 0.00 -2.02 0.00 0.00 58.31 55.60 1b6w n LYS 53 Cb 0.55 -1.43 -0.05 0.00 -0.02 0.00 0.00 35.03 34.09 1b6w n LYS 53 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1b6w s THR 54 N -3.20 5.07 0.02 -0.18 2.01 -1.26 -5.04 115.64 113.05 1b6w s THR 54 Ca -0.07 1.34 -0.26 0.00 0.31 0.00 0.00 61.69 63.02 1b6w s THR 54 Cb 0.11 -3.99 -0.05 0.00 0.01 0.00 0.00 72.50 68.58 1b6w s THR 54 CO 0.75 0.27 0.80 -0.63 -0.69 0.00 0.00 174.62 175.12 1b6w s ILE 55 N 0.72 4.81 0.43 1.82 -1.09 -1.26 -4.94 121.20 121.68 1b6w s ILE 55 Ca 0.35 1.70 0.07 0.00 -2.23 0.00 0.00 60.65 60.53 1b6w s ILE 55 Cb -0.17 -4.15 -0.05 0.00 -1.58 0.00 0.00 42.46 36.51 1b6w s ILE 55 CO 0.17 0.30 0.13 -0.54 -1.23 0.00 0.00 174.94 173.76 1b6w s LYS 56 N 0.34 2.14 0.41 2.79 1.02 -1.26 -5.03 119.74 120.15 1b6w s LYS 56 Ca 0.41 -1.98 0.07 0.00 0.02 0.00 0.00 55.97 54.50 1b6w s LYS 56 Cb -0.20 -1.85 0.85 0.00 -0.52 0.00 0.00 37.83 36.11 1b6w s LYS 56 CO 0.23 -0.14 2.05 0.00 -0.92 0.00 0.00 175.35 176.58 1b6w h ALA 57 N 1.49 1.71 -0.18 5.17 0.00 -2.01 -2.40 119.26 123.04 1b6w h ALA 57 Ca -0.43 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 1b6w h ALA 57 Cb 1.26 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1b6w h ALA 57 CO 0.73 0.27 -0.23 1.05 0.00 0.00 0.00 179.25 181.07 1b6w h GLU 58 N 0.57 0.32 -0.62 0.00 4.11 -1.99 -1.86 114.58 115.11 1b6w h GLU 58 Ca 0.16 -0.11 -0.03 0.00 0.07 0.00 0.00 59.36 59.45 1b6w h GLU 58 Cb -0.05 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1b6w h GLU 58 CO -0.04 0.54 0.25 -0.44 0.07 0.00 0.00 179.01 179.40 1b6w h ASP 59 N 0.29 0.85 -0.25 3.06 3.32 -1.78 -0.81 116.42 121.10 1b6w h ASP 59 Ca 0.05 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1b6w h ASP 59 Cb 0.57 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1b6w h ASP 59 CO 0.04 0.79 0.09 0.40 -1.72 0.00 0.00 179.24 178.84 1b6w h ILE 60 N 0.87 1.18 -0.13 0.35 1.08 -1.45 -0.79 117.51 118.62 1b6w h ILE 60 Ca 0.21 -0.57 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 1b6w h ILE 60 Cb 0.20 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 35.03 1b6w h ILE 60 CO -0.02 0.19 0.08 -0.33 -0.69 0.00 0.00 178.15 177.38 1b6w h GLU 61 N 0.25 0.18 -0.50 2.37 4.39 -1.30 -0.43 114.58 119.54 1b6w h GLU 61 Ca 0.08 -0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.69 1b6w h GLU 61 Cb 0.21 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1b6w h GLU 61 CO -0.00 0.15 0.01 1.25 -1.16 0.00 0.00 179.01 179.26 1b6w h LEU 62 N 0.16 0.80 -0.96 1.33 5.85 -1.16 -2.84 115.31 118.49 1b6w h LEU 62 Ca 0.05 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.53 1b6w h LEU 62 Cb 0.02 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 1b6w h LEU 62 CO -0.01 0.86 0.21 0.00 -0.34 0.00 0.00 178.44 179.16 1b6w h ALA 63 N 1.23 1.17 -0.23 1.25 0.00 -0.67 -2.19 119.26 119.83 1b6w h ALA 63 Ca 0.15 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1b6w h ALA 63 Cb 0.45 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1b6w h ALA 63 CO 0.02 0.58 -0.22 -0.39 0.00 0.00 0.00 179.25 179.24 1b6w h VAL 64 N 0.93 1.25 0.00 0.00 -1.51 -0.94 -2.31 116.25 113.67 1b6w h VAL 64 Ca 0.21 -1.16 -0.07 0.00 -1.23 0.00 0.00 66.70 64.45 1b6w h VAL 64 Cb 0.25 1.32 -0.01 0.00 -2.13 0.00 0.00 31.29 30.72 1b6w h VAL 64 CO -0.01 0.37 -0.32 0.03 -1.23 0.00 0.00 177.57 176.40 1b6w h ARG 65 N 0.37 0.00 -0.99 5.19 3.08 -1.27 -3.15 114.38 117.61 1b6w h ARG 65 Ca 0.06 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.89 1b6w h ARG 65 Cb 0.59 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.51 1b6w h ARG 65 CO 0.04 0.32 0.29 0.54 -1.07 0.00 0.00 179.97 180.09 1b6w n ARG 66 N -3.87 1.59 0.00 0.04 1.74 -0.84 -2.33 116.66 112.99 1b6w n ARG 66 Ca -0.01 -1.34 0.00 0.00 -0.77 0.00 0.00 57.85 55.73 1b6w n ARG 66 Cb 0.40 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 1b6w n ARG 66 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1b6w n PHE 67 N -0.22 0.00 -0.95 -1.55 3.72 -1.19 -5.02 117.46 112.25 1b6w n PHE 67 Ca 0.26 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.66 1b6w n PHE 67 Cb 1.01 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.55 1b6w n PHE 67 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34