#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bc6 s TYR 2 N 0.00 0.99 0.15 0.00 2.02 -1.26 -4.63 117.35 114.62 1bc6 s TYR 2 Ca 0.00 -0.23 0.05 0.00 -0.37 0.00 0.00 57.07 56.52 1bc6 s TYR 2 Cb 0.00 -0.68 -0.04 0.00 -0.40 0.00 0.00 41.96 40.84 1bc6 s TYR 2 CO 0.00 -0.07 -0.12 0.08 -1.57 0.00 0.00 175.55 173.87 1bc6 s VAL 3 N 0.03 1.31 0.80 0.71 1.01 0.45 -4.86 120.40 119.85 1bc6 s VAL 3 Ca -0.01 -2.01 -0.11 0.00 0.00 0.00 0.00 61.98 59.85 1bc6 s VAL 3 Cb -0.07 -1.81 0.07 0.00 0.00 0.00 0.00 36.38 34.57 1bc6 s VAL 3 CO 0.00 -0.65 1.11 -0.51 0.00 0.00 0.00 175.10 175.06 1bc6 s ILE 4 N -2.99 2.92 0.00 2.22 1.10 -1.26 -0.26 121.20 122.93 1bc6 s ILE 4 Ca 0.16 0.32 0.00 0.00 -0.51 0.00 0.00 60.65 60.62 1bc6 s ILE 4 Cb 0.00 -2.69 0.00 0.00 0.15 0.00 0.00 42.46 39.92 1bc6 s ILE 4 CO 0.02 -0.37 0.00 0.35 -2.11 0.00 0.00 174.94 172.83 1bc6 n THR 5 N -3.55 0.00 0.05 4.00 -2.24 -1.00 -4.65 114.28 106.89 1bc6 n THR 5 Ca 0.10 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.78 1bc6 n THR 5 Cb 0.52 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.68 1bc6 n THR 5 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1bc6 h GLU 6 N 0.00 -0.20 -0.77 -0.78 4.57 -1.98 -3.36 114.58 112.06 1bc6 h GLU 6 Ca 0.00 0.01 0.22 0.00 -1.18 0.00 0.00 59.36 58.42 1bc6 h GLU 6 Cb 0.00 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.60 1bc6 h GLU 6 CO 0.00 0.24 0.60 -1.35 -1.18 0.00 0.00 179.01 177.32 1bc6 h PRO 7 N -0.87 0.00 -0.80 0.92 0.10 -1.98 -0.65 132.00 128.72 1bc6 h PRO 7 Ca -0.02 0.00 0.08 0.00 0.10 0.00 0.00 66.00 66.16 1bc6 h PRO 7 Cb 0.53 0.00 -0.05 0.00 0.10 0.00 0.00 31.00 31.57 1bc6 h PRO 7 CO 0.03 0.00 0.52 0.00 0.10 0.00 0.00 178.00 178.66 1bc6 n ILE 9 N -4.50 0.00 -0.87 0.00 5.41 -0.25 -0.87 119.36 118.28 1bc6 n ILE 9 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.88 1bc6 n ILE 9 Cb 0.28 -0.35 0.00 0.00 -0.71 0.00 0.00 39.64 38.86 1bc6 n ILE 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1bc6 n GLY 10 N 2.92 0.54 0.30 7.39 0.00 -1.17 -4.88 105.19 110.29 1bc6 n GLY 10 Ca 0.23 -0.22 0.04 0.00 0.00 0.00 0.00 46.02 46.07 1bc6 n GLY 10 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bc6 n THR 11 N -2.87 -0.12 -4.21 2.61 -1.04 -0.05 -5.00 114.28 103.61 1bc6 n THR 11 Ca 0.00 0.16 -0.12 0.00 -2.04 0.00 0.00 64.05 62.05 1bc6 n THR 11 Cb 0.00 -0.26 -0.10 0.00 -1.82 0.00 0.00 70.33 68.15 1bc6 n THR 11 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1bc6 s LYS 12 N -2.85 1.01 0.06 -2.82 3.01 -1.26 -4.99 119.74 111.91 1bc6 s LYS 12 Ca 0.00 -1.47 -0.15 0.00 -1.01 0.00 0.00 55.97 53.33 1bc6 s LYS 12 Cb 0.00 -0.14 -0.05 0.00 -1.01 0.00 0.00 37.83 36.63 1bc6 s LYS 12 CO 0.00 -0.14 1.26 0.38 0.51 0.00 0.00 175.35 177.36 1bc6 h ASP 13 N 2.78 -0.91 0.00 2.83 3.04 -2.00 -3.02 116.42 119.15 1bc6 h ASP 13 Ca -0.36 0.12 -0.59 0.00 -3.24 0.00 0.00 57.03 52.96 1bc6 h ASP 13 Cb 1.20 0.38 0.01 0.00 -1.04 0.00 0.00 39.33 39.87 1bc6 h ASP 13 CO 0.62 -0.18 3.06 0.00 -2.04 0.00 0.00 179.24 180.71 1bc6 n ALA 14 N -2.92 5.53 -1.26 4.15 0.00 -1.26 -4.95 120.51 119.80 1bc6 n ALA 14 Ca -0.01 -3.14 -0.34 0.00 0.00 0.00 0.00 53.44 49.95 1bc6 n ALA 14 Cb 0.16 -3.36 0.10 0.00 0.00 0.00 0.00 19.45 16.35 1bc6 n ALA 14 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1bc6 s SER 15 N 3.27 4.00 -0.05 0.00 0.01 -1.14 -4.63 113.70 115.16 1bc6 s SER 15 Ca 0.54 2.33 -0.01 0.00 1.31 0.00 0.00 55.95 60.12 1bc6 s SER 15 Cb 0.14 -2.58 -0.00 0.00 0.21 0.00 0.00 66.02 63.78 1bc6 s SER 15 CO -0.03 -2.39 0.05 0.00 0.41 0.00 0.00 173.24 171.28 1bc6 n VAL 17 N -3.55 0.00 0.27 0.00 0.24 -1.26 -1.61 118.33 112.42 1bc6 n VAL 17 Ca -0.00 0.00 0.16 0.00 -2.04 0.00 0.00 64.34 62.46 1bc6 n VAL 17 Cb 0.01 0.00 0.61 0.00 -1.47 0.00 0.00 33.84 32.99 1bc6 n VAL 17 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1bc6 h GLU 18 N 0.00 0.00 0.00 7.34 4.11 -1.93 -3.23 114.58 120.88 1bc6 h GLU 18 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 1bc6 h GLU 18 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1bc6 h GLU 18 CO 0.00 0.02 -0.13 -0.39 0.07 0.00 0.00 179.01 178.58 1bc6 h VAL 19 N 0.00 0.40 -2.79 -1.06 -1.51 -1.65 -3.45 116.25 106.19 1bc6 h VAL 19 Ca -0.00 -0.72 -0.56 0.00 -1.23 0.00 0.00 66.70 64.19 1bc6 h VAL 19 Cb 0.59 1.52 -0.03 0.00 -2.13 0.00 0.00 31.29 31.24 1bc6 h VAL 19 CO 0.00 0.13 0.99 0.00 -1.23 0.00 0.00 177.57 177.45 1bc6 h PRO 21 N 8.86 0.00 0.00 0.00 0.11 -1.94 -0.34 132.00 138.68 1bc6 h PRO 21 Ca -0.32 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.79 1bc6 h PRO 21 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1bc6 h PRO 21 CO 0.97 0.00 -0.22 1.33 -0.21 0.00 0.00 178.00 179.86 1bc6 n VAL 22 N -3.67 2.03 0.00 3.15 0.24 -1.26 -5.02 118.33 113.79 1bc6 n VAL 22 Ca 0.12 -2.71 0.00 0.00 -2.04 0.00 0.00 64.34 59.71 1bc6 n VAL 22 Cb 0.84 -0.24 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 1bc6 n VAL 22 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1bc6 n ASP 23 N -1.30 0.00 -1.74 -1.34 9.92 -0.14 -4.82 116.55 117.13 1bc6 n ASP 23 Ca 0.17 0.00 -0.07 0.00 -0.53 0.00 0.00 54.79 54.36 1bc6 n ASP 23 Cb 0.66 -0.04 -0.03 0.00 -0.64 0.00 0.00 41.12 41.07 1bc6 n ASP 23 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bc6 s ILE 25 N -0.38 4.65 0.28 0.00 1.09 -1.26 -1.57 121.20 124.01 1bc6 s ILE 25 Ca 0.24 1.73 0.03 0.00 -1.10 0.00 0.00 60.65 61.55 1bc6 s ILE 25 Cb 0.14 -4.16 -0.06 0.00 -1.06 0.00 0.00 42.46 37.32 1bc6 s ILE 25 CO -0.02 0.37 0.06 -1.00 -0.10 0.00 0.00 174.94 174.25 1bc6 s HIS 26 N -0.13 1.74 0.13 3.97 3.76 0.36 -4.98 115.29 120.15 1bc6 s HIS 26 Ca 0.40 -1.04 0.03 0.00 -0.15 0.00 0.00 55.06 54.31 1bc6 s HIS 26 Cb -0.21 -1.07 -0.04 0.00 1.11 0.00 0.00 32.58 32.37 1bc6 s HIS 26 CO 0.25 -0.13 0.18 -1.21 -0.85 0.00 0.00 174.74 172.97 1bc6 s GLU 27 N -3.94 3.12 0.00 1.40 2.02 -1.26 -0.41 118.70 119.63 1bc6 s GLU 27 Ca 0.36 -0.71 0.00 0.00 0.02 0.00 0.00 54.97 54.64 1bc6 s GLU 27 Cb 0.08 -2.80 0.00 0.00 0.10 0.00 0.00 34.13 31.51 1bc6 s GLU 27 CO 0.14 0.53 0.00 0.41 0.02 0.00 0.00 175.26 176.35 1bc6 n GLY 28 N -0.19 2.85 0.38 -1.39 0.00 0.22 -4.74 105.19 102.33 1bc6 n GLY 28 Ca -0.08 -0.32 -0.15 0.00 0.00 0.00 0.00 46.02 45.48 1bc6 n GLY 28 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1bc6 h GLU 29 N 0.00 -0.92 0.00 1.61 3.07 -2.00 -3.44 114.58 112.90 1bc6 h GLU 29 Ca 0.00 0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1bc6 h GLU 29 Cb 0.00 0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 1bc6 h GLU 29 CO 0.00 -0.62 -0.18 -3.47 -1.40 0.00 0.00 179.01 173.34 1bc6 n ASP 30 N -4.77 0.09 -4.40 1.42 -0.08 -1.26 -5.08 116.55 102.47 1bc6 n ASP 30 Ca -0.12 0.16 -0.41 0.00 -1.51 0.00 0.00 54.79 52.92 1bc6 n ASP 30 Cb 0.38 0.08 0.01 0.00 2.34 0.00 0.00 41.12 43.93 1bc6 n ASP 30 CO 0.00 0.00 0.00 1.67 0.12 0.00 0.00 177.20 178.99 1bc6 n GLN 31 N -3.00 0.38 -3.95 -0.67 -0.06 -1.26 -3.07 117.38 105.75 1bc6 n GLN 31 Ca 0.00 0.14 -0.21 0.00 -2.00 0.00 0.00 57.00 54.93 1bc6 n GLN 31 Cb 0.09 -1.38 -0.04 0.00 -4.06 0.00 0.00 30.24 24.86 1bc6 n GLN 31 CO 0.00 0.00 0.00 0.71 -0.20 0.00 0.00 177.06 177.57 1bc6 s TYR 32 N -1.61 3.07 0.26 3.69 1.51 -1.26 -0.61 117.35 122.40 1bc6 s TYR 32 Ca 0.63 -0.18 0.02 0.00 -1.01 0.00 0.00 57.07 56.52 1bc6 s TYR 32 Cb -0.58 -1.60 -0.04 0.00 -0.11 0.00 0.00 41.96 39.63 1bc6 s TYR 32 CO 0.59 0.35 0.15 0.71 -1.11 0.00 0.00 175.55 176.25 1bc6 s TYR 33 N -2.19 1.44 0.00 2.71 1.51 0.45 -4.80 117.35 116.48 1bc6 s TYR 33 Ca 0.37 -1.37 0.01 0.00 -1.01 0.00 0.00 57.07 55.07 1bc6 s TYR 33 Cb -0.07 -0.74 -0.01 0.00 -0.11 0.00 0.00 41.96 41.04 1bc6 s TYR 33 CO 0.26 -0.57 -0.05 0.42 -1.11 0.00 0.00 175.55 174.50 1bc6 s ILE 34 N -3.83 0.37 -0.37 2.71 1.01 -1.26 -0.48 121.20 119.34 1bc6 s ILE 34 Ca 0.38 -0.29 -0.29 0.00 0.00 0.00 0.00 60.65 60.45 1bc6 s ILE 34 Cb 0.06 -0.33 0.01 0.00 0.01 0.00 0.00 42.46 42.21 1bc6 s ILE 34 CO 0.16 0.05 1.22 -0.62 0.00 0.00 0.00 174.94 175.75 1bc6 s ASP 35 N -0.27 6.67 0.00 3.58 -1.08 -0.61 -4.73 116.67 120.23 1bc6 s ASP 35 Ca 0.00 0.90 0.21 0.00 -0.52 0.00 0.00 52.55 53.14 1bc6 s ASP 35 Cb -0.03 -2.54 0.78 0.00 -1.46 0.00 0.00 42.92 39.67 1bc6 s ASP 35 CO -0.00 -1.14 1.56 -0.81 0.52 0.00 0.00 175.17 175.30 1bc6 n PRO 36 N 7.49 1.68 -0.05 4.34 -0.04 -1.26 -1.64 135.00 145.52 1bc6 n PRO 36 Ca 0.14 -1.02 -0.20 0.00 -0.04 0.00 0.00 63.50 62.38 1bc6 n PRO 36 Cb 0.48 -1.39 -0.13 0.00 -0.04 0.00 0.00 33.50 32.42 1bc6 n PRO 36 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1bc6 n ASP 37 N 0.24 2.06 -0.06 3.54 2.03 -1.26 -4.38 116.55 118.73 1bc6 n ASP 37 Ca 0.16 0.06 -0.13 0.00 0.52 0.00 0.00 54.79 55.40 1bc6 n ASP 37 Cb 0.31 -0.67 -0.06 0.00 -0.72 0.00 0.00 41.12 39.98 1bc6 n ASP 37 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1bc6 h VAL 38 N 0.04 1.32 -1.52 5.18 2.07 -1.98 -3.44 116.25 117.92 1bc6 h VAL 38 Ca -0.49 -1.17 -0.67 0.00 0.82 0.00 0.00 66.70 65.18 1bc6 h VAL 38 Cb 1.98 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 33.46 1bc6 h VAL 38 CO 0.01 0.35 1.20 0.00 0.02 0.00 0.00 177.57 179.15 1bc6 n ILE 40 N 5.98 1.06 -1.71 0.00 -5.35 -1.26 -4.41 119.36 113.67 1bc6 n ILE 40 Ca 0.32 0.28 -0.01 0.00 -0.27 0.00 0.00 62.75 63.07 1bc6 n ILE 40 Cb 0.23 -1.09 -0.00 0.00 -1.74 0.00 0.00 39.64 37.04 1bc6 n ILE 40 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1bc6 n ASP 41 N -1.65 -2.39 -3.80 7.28 -0.08 -1.26 -4.83 116.55 109.82 1bc6 n ASP 41 Ca 0.03 0.25 -0.12 0.00 -1.51 0.00 0.00 54.79 53.43 1bc6 n ASP 41 Cb 0.16 -1.77 -0.09 0.00 2.34 0.00 0.00 41.12 41.76 1bc6 n ASP 41 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1bc6 n GLY 43 N 1.31 5.54 0.08 0.00 0.00 -1.26 -4.51 105.19 106.35 1bc6 n GLY 43 Ca -0.22 -2.42 -0.04 0.00 0.00 0.00 0.00 46.02 43.34 1bc6 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bc6 n ALA 44 N -0.56 0.55 -0.12 4.61 0.00 -1.26 -4.47 120.51 119.26 1bc6 n ALA 44 Ca 0.55 -0.52 -0.06 0.00 0.00 0.00 0.00 53.44 53.41 1bc6 n ALA 44 Cb 0.32 0.02 0.02 0.00 0.00 0.00 0.00 19.45 19.82 1bc6 n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bc6 h GLU 46 N 0.35 0.37 -0.85 0.00 5.08 -1.85 0.01 114.58 117.69 1bc6 h GLU 46 Ca 0.18 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1bc6 h GLU 46 Cb 0.12 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1bc6 h GLU 46 CO -0.15 0.24 0.46 0.00 -1.00 0.00 0.00 179.01 178.56 1bc6 h ALA 47 N 1.60 1.21 0.09 3.43 0.00 -1.59 -2.86 119.26 121.14 1bc6 h ALA 47 Ca 0.44 -0.13 -0.30 0.00 0.00 0.00 0.00 54.91 54.92 1bc6 h ALA 47 Cb 0.72 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1bc6 h ALA 47 CO -0.46 0.63 -1.54 -0.39 0.00 0.00 0.00 179.25 177.49 1bc6 h VAL 48 N 1.19 1.12 -2.11 0.00 -1.51 -1.37 -3.47 116.25 110.10 1bc6 h VAL 48 Ca 0.30 -2.81 -0.60 0.00 -1.23 0.00 0.00 66.70 62.36 1bc6 h VAL 48 Cb 0.03 2.70 0.03 0.00 -2.13 0.00 0.00 31.29 31.92 1bc6 h VAL 48 CO -0.05 0.79 0.99 0.00 -1.23 0.00 0.00 177.57 178.08 1bc6 n PRO 50 N 5.54 2.05 -1.51 0.00 -0.02 -1.26 -0.54 135.00 139.27 1bc6 n PRO 50 Ca 0.21 0.75 -0.17 0.00 -2.02 0.00 0.00 63.50 62.27 1bc6 n PRO 50 Cb 0.29 -2.58 -0.07 0.00 -0.02 0.00 0.00 33.50 31.12 1bc6 n PRO 50 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1bc6 n VAL 51 N 5.03 0.00 -3.85 -1.45 0.31 -1.26 -2.90 118.33 114.20 1bc6 n VAL 51 Ca 0.23 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.26 1bc6 n VAL 51 Cb 0.27 -1.78 0.01 0.00 -0.91 0.00 0.00 33.84 31.43 1bc6 n VAL 51 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1bc6 n SER 52 N -1.07 -2.84 -0.07 4.52 2.88 0.30 -4.85 113.62 112.49 1bc6 n SER 52 Ca -0.17 -1.05 0.17 0.00 -1.33 0.00 0.00 58.87 56.49 1bc6 n SER 52 Cb 0.61 -3.03 0.60 0.00 -0.75 0.00 0.00 64.21 61.64 1bc6 n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bc6 h ALA 53 N 0.91 2.30 -2.09 -1.46 0.00 -1.73 -3.34 119.26 113.85 1bc6 h ALA 53 Ca -0.66 -0.01 -0.56 0.00 0.00 0.00 0.00 54.91 53.68 1bc6 h ALA 53 Cb 1.37 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1bc6 h ALA 53 CO 0.55 -0.47 1.23 0.42 0.00 0.00 0.00 179.25 180.98 1bc6 s ILE 54 N -5.20 3.41 0.07 0.00 1.01 -1.26 -2.36 121.20 116.87 1bc6 s ILE 54 Ca -0.06 0.47 0.03 0.00 0.00 0.00 0.00 60.65 61.08 1bc6 s ILE 54 Cb 0.20 -3.42 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 1bc6 s ILE 54 CO 0.75 -0.17 -0.09 -0.31 0.00 0.00 0.00 174.94 175.11 1bc6 s TYR 55 N 5.70 0.92 0.43 3.97 2.02 0.64 -4.83 117.35 126.20 1bc6 s TYR 55 Ca 0.81 -0.62 -0.23 0.00 -0.37 0.00 0.00 57.07 56.66 1bc6 s TYR 55 Cb -0.30 -0.52 -0.08 0.00 -0.40 0.00 0.00 41.96 40.65 1bc6 s TYR 55 CO 0.33 -0.05 1.07 -1.58 -1.57 0.00 0.00 175.55 173.76 1bc6 s HIS 56 N -2.12 3.12 0.33 2.71 5.65 -1.26 -0.41 115.29 123.31 1bc6 s HIS 56 Ca 0.00 1.61 0.10 0.00 0.25 0.00 0.00 55.06 57.02 1bc6 s HIS 56 Cb -0.05 -3.17 1.01 0.00 -1.18 0.00 0.00 32.58 29.19 1bc6 s HIS 56 CO -0.00 -0.87 1.59 1.49 -0.65 0.00 0.00 174.74 176.30 1bc6 h GLU 57 N 2.19 0.06 0.83 2.88 4.81 -1.92 0.31 114.58 123.74 1bc6 h GLU 57 Ca -0.49 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.70 1bc6 h GLU 57 Cb 1.22 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 1bc6 h GLU 57 CO 0.61 0.04 -0.50 0.22 -0.73 0.00 0.00 179.01 178.65 1bc6 h ASP 58 N 0.06 -1.25 -0.42 1.04 3.58 -1.96 -2.87 116.42 114.60 1bc6 h ASP 58 Ca 0.70 0.07 -0.02 0.00 0.42 0.00 0.00 57.03 58.20 1bc6 h ASP 58 Cb 1.66 0.36 -0.02 0.00 1.72 0.00 0.00 39.33 43.04 1bc6 h ASP 58 CO -0.80 -0.77 0.21 -0.26 -2.88 0.00 0.00 179.24 174.74 1bc6 h PHE 59 N -1.23 0.64 -2.51 0.28 0.04 -1.61 -3.43 116.94 109.12 1bc6 h PHE 59 Ca -0.11 -0.02 -0.53 0.00 2.80 0.00 0.00 57.97 60.11 1bc6 h PHE 59 Cb 0.98 -0.20 0.04 0.00 2.20 0.00 0.00 35.95 38.97 1bc6 h PHE 59 CO -0.09 0.49 1.09 0.28 -0.60 0.00 0.00 178.31 179.47 1bc6 n VAL 60 N -4.38 0.31 -1.80 -0.55 0.31 0.96 -4.94 118.33 108.24 1bc6 n VAL 60 Ca 0.04 -0.05 -0.37 0.00 -0.01 0.00 0.00 64.34 63.94 1bc6 n VAL 60 Cb 0.13 -2.09 0.06 0.00 -0.91 0.00 0.00 33.84 31.03 1bc6 n VAL 60 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1bc6 s PRO 61 N 2.47 2.66 0.27 5.55 0.04 -1.26 -4.53 135.00 140.21 1bc6 s PRO 61 Ca 0.81 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.88 1bc6 s PRO 61 Cb -0.49 -1.88 0.63 0.00 0.04 0.00 0.00 34.50 32.81 1bc6 s PRO 61 CO 0.37 -1.50 1.68 0.93 0.04 0.00 0.00 177.00 178.52 1bc6 h GLU 62 N 0.65 0.32 -0.95 4.56 3.07 -1.93 0.59 114.58 120.89 1bc6 h GLU 62 Ca -0.51 -0.02 0.21 0.00 -0.50 0.00 0.00 59.36 58.55 1bc6 h GLU 62 Cb 1.33 -0.07 -0.18 0.00 -0.84 0.00 0.00 28.75 28.99 1bc6 h GLU 62 CO 0.54 0.21 -0.15 1.49 -1.40 0.00 0.00 179.01 179.70 1bc6 h GLU 63 N 0.33 0.01 -0.02 2.33 4.81 -2.03 -2.24 114.58 117.77 1bc6 h GLU 63 Ca 0.51 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.74 1bc6 h GLU 63 Cb 0.95 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.33 1bc6 h GLU 63 CO -0.55 0.01 -0.46 0.91 -0.73 0.00 0.00 179.01 178.19 1bc6 n TRP 64 N -5.56 0.00 -0.17 0.92 8.01 0.18 -3.67 117.44 117.15 1bc6 n TRP 64 Ca 0.17 0.00 0.24 0.00 -1.31 0.00 0.00 57.50 56.60 1bc6 n TRP 64 Cb 0.56 0.00 0.64 0.00 -2.01 0.00 0.00 31.31 30.51 1bc6 n TRP 64 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1bc6 h LYS 65 N 2.36 0.14 -0.46 -0.99 1.57 -0.03 0.27 116.57 119.43 1bc6 h LYS 65 Ca 0.00 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 1bc6 h LYS 65 Cb 0.73 -0.03 -0.10 0.00 0.08 0.00 0.00 32.23 32.91 1bc6 h LYS 65 CO 0.00 0.09 -0.22 0.77 -0.57 0.00 0.00 179.45 179.52 1bc6 h SER 66 N 0.14 -0.77 -0.55 0.86 0.02 -1.63 -0.65 113.55 110.97 1bc6 h SER 66 Ca 0.41 0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 61.50 1bc6 h SER 66 Cb 1.41 0.41 -0.03 0.00 0.14 0.00 0.00 62.40 64.33 1bc6 h SER 66 CO -0.07 -0.25 0.22 1.88 -1.14 0.00 0.00 176.83 177.48 1bc6 h TYR 67 N -0.13 0.87 -0.20 3.45 0.05 -0.72 0.12 116.97 120.42 1bc6 h TYR 67 Ca 0.22 -0.05 -0.04 0.00 0.05 0.00 0.00 58.73 58.90 1bc6 h TYR 67 Cb 0.47 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 1bc6 h TYR 67 CO -0.49 0.68 -0.03 0.82 -1.05 0.00 0.00 178.16 178.10 1bc6 h ILE 68 N 0.85 1.27 -0.99 -2.88 5.03 -0.88 0.28 117.51 120.19 1bc6 h ILE 68 Ca 0.20 -0.96 0.15 0.00 -0.12 0.00 0.00 64.86 64.12 1bc6 h ILE 68 Cb 0.19 1.51 -0.09 0.00 -3.03 0.00 0.00 36.82 35.39 1bc6 h ILE 68 CO -0.02 0.29 0.62 1.56 -0.68 0.00 0.00 178.15 179.93 1bc6 h GLN 69 N 0.11 0.85 0.02 2.37 7.50 -0.93 0.19 115.11 125.22 1bc6 h GLN 69 Ca 0.05 -0.05 -0.00 0.00 0.50 0.00 0.00 58.65 59.15 1bc6 h GLN 69 Cb 0.45 -0.19 0.00 0.00 0.05 0.00 0.00 27.48 27.79 1bc6 h GLN 69 CO 0.02 0.56 -0.01 -0.22 -1.50 0.00 0.00 178.83 177.68 1bc6 h LYS 70 N 0.88 -0.02 -0.64 1.46 3.64 0.40 0.17 116.57 122.44 1bc6 h LYS 70 Ca 0.52 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 60.02 1bc6 h LYS 70 Cb 0.67 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.41 1bc6 h LYS 70 CO -0.30 0.16 0.21 -0.91 -2.27 0.00 0.00 179.45 176.35 1bc6 h ASN 71 N -0.21 0.16 0.21 4.20 2.35 0.04 0.19 115.58 122.51 1bc6 h ASN 71 Ca -0.00 0.10 0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1bc6 h ASN 71 Cb 0.20 0.10 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 1bc6 h ASN 71 CO 0.00 0.08 -0.37 0.03 -1.65 0.00 0.00 177.43 175.52 1bc6 h ARG 72 N 0.36 -0.63 -0.54 0.81 3.08 -0.77 -3.14 114.38 113.54 1bc6 h ARG 72 Ca 0.34 0.04 0.09 0.00 0.07 0.00 0.00 59.98 60.52 1bc6 h ARG 72 Cb 0.48 0.14 -0.07 0.00 0.08 0.00 0.00 29.97 30.60 1bc6 h ARG 72 CO -0.37 -0.42 0.17 0.22 -1.07 0.00 0.00 179.97 178.50 1bc6 h ASP 73 N -0.66 0.13 -0.93 7.04 3.58 0.82 -0.73 116.42 125.67 1bc6 h ASP 73 Ca 0.01 0.08 0.18 0.00 0.42 0.00 0.00 57.03 57.72 1bc6 h ASP 73 Cb 0.65 0.08 -0.17 0.00 1.72 0.00 0.00 39.33 41.61 1bc6 h ASP 73 CO -0.17 0.09 -0.25 -0.26 -2.88 0.00 0.00 179.24 175.77 1bc6 h PHE 74 N 0.33 -0.57 -0.42 0.28 -1.00 -0.65 -0.46 116.94 114.45 1bc6 h PHE 74 Ca 0.27 0.09 0.00 0.00 2.81 0.00 0.00 57.97 61.14 1bc6 h PHE 74 Cb 0.34 0.39 0.00 0.00 3.61 0.00 0.00 35.95 40.29 1bc6 h PHE 74 CO -0.19 -0.40 0.00 1.19 -1.61 0.00 0.00 178.31 177.30 1bc6 n PHE 75 N -5.58 0.99 0.08 -0.55 3.72 -0.65 -4.54 117.46 110.93 1bc6 n PHE 75 Ca 0.14 -0.67 -0.13 0.00 -0.05 0.00 0.00 57.45 56.74 1bc6 n PHE 75 Cb 0.46 -0.21 -0.13 0.00 -0.94 0.00 0.00 39.48 38.66 1bc6 n PHE 75 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1bc6 h LYS 76 N 2.63 0.17 0.00 -1.08 3.64 0.36 -3.51 116.57 118.78 1bc6 h LYS 76 Ca 0.00 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 1bc6 h LYS 76 Cb 1.23 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 1bc6 h LYS 76 CO 0.16 1.09 0.00 0.36 -2.27 0.00 0.00 179.45 178.79