#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 3.40 0.15 0.00 1.51 -1.26 -3.55 117.35 117.60 1bc6 s TYR 2 Ca 0.00 0.67 0.05 0.00 -1.01 0.00 0.00 57.07 56.78 1bc6 s TYR 2 Cb 0.00 -2.53 -0.04 0.00 -0.11 0.00 0.00 41.96 39.27 1bc6 s TYR 2 CO 0.00 0.02 -0.10 0.08 -1.11 0.00 0.00 175.55 174.44 1bc6 s VAL 3 N 1.19 1.21 0.83 0.71 1.01 0.34 -4.83 120.40 120.86 1bc6 s VAL 3 Ca 0.20 -2.07 -0.10 0.00 0.00 0.00 0.00 61.98 60.01 1bc6 s VAL 3 Cb -0.15 -1.88 0.09 0.00 0.00 0.00 0.00 36.38 34.45 1bc6 s VAL 3 CO 0.08 -0.72 1.11 -0.51 0.00 0.00 0.00 175.10 175.06 1bc6 s ILE 4 N -3.30 2.82 0.09 2.22 1.10 -1.26 -0.26 121.20 122.61 1bc6 s ILE 4 Ca 0.18 0.27 -0.01 0.00 -0.51 0.00 0.00 60.65 60.57 1bc6 s ILE 4 Cb 0.02 -2.57 -0.04 0.00 0.15 0.00 0.00 42.46 40.03 1bc6 s ILE 4 CO 0.01 -0.35 0.02 0.42 -2.11 0.00 0.00 174.94 172.94 1bc6 s THR 5 N -2.80 0.15 0.00 4.00 -4.23 -0.81 -4.68 115.64 107.27 1bc6 s THR 5 Ca 0.63 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1bc6 s THR 5 Cb -0.19 -1.79 0.00 0.00 1.34 0.00 0.00 72.50 71.86 1bc6 s THR 5 CO 0.57 -0.70 0.00 1.21 -0.54 0.00 0.00 174.62 175.15 1bc6 n GLU 6 N -0.00 0.00 0.06 3.99 4.07 -1.26 -1.40 120.64 126.10 1bc6 n GLU 6 Ca -0.10 0.00 0.03 0.00 -0.06 0.00 0.00 57.16 57.04 1bc6 n GLU 6 Cb 0.62 0.00 0.18 0.00 -0.06 0.00 0.00 31.44 32.19 1bc6 n GLU 6 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1bc6 n PRO 7 N -1.00 0.04 -0.07 5.31 -0.04 -1.26 -0.60 135.00 137.39 1bc6 n PRO 7 Ca 0.00 0.47 -0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1bc6 n PRO 7 Cb 0.00 -1.78 0.28 0.00 -0.04 0.00 0.00 33.50 31.96 1bc6 n PRO 7 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bc6 n ILE 9 N -4.33 0.31 0.00 0.00 5.41 0.23 -0.80 119.36 120.18 1bc6 n ILE 9 Ca 0.03 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.73 1bc6 n ILE 9 Cb 0.18 -1.38 0.00 0.00 -0.71 0.00 0.00 39.64 37.74 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 3.93 1.06 3.26 7.39 0.00 -1.26 -5.00 105.19 114.57 1bc6 n GLY 10 Ca 0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 -5.70 -1.66 2.61 -1.04 0.02 -4.96 114.28 103.54 1bc6 n THR 11 Ca 0.00 0.45 -0.30 0.00 -2.04 0.00 0.00 64.05 62.17 1bc6 n THR 11 Cb 0.00 -4.49 0.19 0.00 -1.82 0.00 0.00 70.33 64.21 1bc6 n THR 11 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1bc6 s LYS 12 N -2.18 0.30 0.00 -2.82 0.00 -1.26 -5.06 119.74 108.72 1bc6 s LYS 12 Ca 0.26 -0.20 0.00 0.00 0.00 0.00 0.00 55.97 56.03 1bc6 s LYS 12 Cb -0.04 -1.79 0.00 0.00 0.00 0.00 0.00 37.83 36.01 1bc6 s LYS 12 CO 0.70 -2.67 0.00 -0.40 0.00 0.00 0.00 175.35 172.97 1bc6 n ASP 13 N -4.00 0.00 -4.61 0.03 5.75 -1.26 -4.57 116.55 107.90 1bc6 n ASP 13 Ca 0.13 0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.48 1bc6 n ASP 13 Cb 0.60 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.66 1bc6 n ASP 13 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bc6 s ALA 14 N -2.18 2.86 0.03 2.12 0.00 -1.26 -4.92 121.76 118.40 1bc6 s ALA 14 Ca 0.00 0.65 0.06 0.00 0.00 0.00 0.00 51.96 52.67 1bc6 s ALA 14 Cb 0.00 -4.03 -0.03 0.00 0.00 0.00 0.00 23.12 19.06 1bc6 s ALA 14 CO 0.00 -2.61 -0.15 -1.12 0.00 0.00 0.00 175.76 171.88 1bc6 s SER 15 N 7.16 4.03 0.27 0.00 0.01 -1.26 -5.00 113.70 118.90 1bc6 s SER 15 Ca 0.92 -0.34 0.10 0.00 1.31 0.00 0.00 55.95 57.94 1bc6 s SER 15 Cb -0.30 -0.74 0.84 0.00 0.21 0.00 0.00 66.02 66.02 1bc6 s SER 15 CO 0.35 0.27 1.22 0.00 0.41 0.00 0.00 173.24 175.48 1bc6 h VAL 17 N 0.00 0.05 0.00 0.00 3.04 -1.95 -0.56 116.25 116.83 1bc6 h VAL 17 Ca 0.57 -0.01 -0.01 0.00 -1.01 0.00 0.00 66.70 66.24 1bc6 h VAL 17 Cb 1.39 0.01 -0.00 0.00 -2.01 0.00 0.00 31.29 30.68 1bc6 h VAL 17 CO -0.65 0.01 -0.03 -0.33 -1.01 0.00 0.00 177.57 175.56 1bc6 h GLU 18 N 0.04 0.00 0.00 4.17 5.08 -1.37 -3.22 114.58 119.29 1bc6 h GLU 18 Ca 0.70 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.99 1bc6 h GLU 18 Cb 1.66 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.89 1bc6 h GLU 18 CO -0.82 0.03 -1.88 1.33 -1.00 0.00 0.00 179.01 176.67 1bc6 n VAL 19 N -3.96 0.28 -2.27 3.13 0.24 -0.22 -4.99 118.33 110.53 1bc6 n VAL 19 Ca -0.03 -0.47 -0.43 0.00 -2.04 0.00 0.00 64.34 61.37 1bc6 n VAL 19 Cb 0.11 -0.07 -0.02 0.00 -1.47 0.00 0.00 33.84 32.39 1bc6 n VAL 19 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bc6 h PRO 21 N 9.10 0.58 -0.50 0.00 0.11 -1.94 -0.91 132.00 138.43 1bc6 h PRO 21 Ca -0.31 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1bc6 h PRO 21 Cb 1.13 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1bc6 h PRO 21 CO 0.98 0.38 0.00 1.33 -0.21 0.00 0.00 178.00 180.48 1bc6 n VAL 22 N -4.70 0.66 -3.71 3.15 0.24 -1.26 -5.00 118.33 107.70 1bc6 n VAL 22 Ca 0.24 -0.82 -0.25 0.00 -2.04 0.00 0.00 64.34 61.47 1bc6 n VAL 22 Cb 0.69 0.80 0.01 0.00 -1.47 0.00 0.00 33.84 33.86 1bc6 n VAL 22 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1bc6 n ASP 23 N 1.52 -2.92 -0.75 -1.34 2.03 -0.35 -4.87 116.55 109.87 1bc6 n ASP 23 Ca 0.21 -0.78 0.09 0.00 0.52 0.00 0.00 54.79 54.83 1bc6 n ASP 23 Cb 0.60 -1.05 0.24 0.00 -0.72 0.00 0.00 41.12 40.19 1bc6 n ASP 23 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bc6 s ILE 25 N -2.85 4.98 0.16 0.00 1.09 -1.26 -0.85 121.20 122.47 1bc6 s ILE 25 Ca 0.40 1.45 0.02 0.00 -1.10 0.00 0.00 60.65 61.43 1bc6 s ILE 25 Cb 0.33 -4.05 -0.05 0.00 -1.06 0.00 0.00 42.46 37.63 1bc6 s ILE 25 CO 0.08 0.13 -0.03 -1.00 -0.10 0.00 0.00 174.94 174.02 1bc6 s HIS 26 N 1.59 1.20 0.33 3.97 3.76 0.15 -4.96 115.29 121.32 1bc6 s HIS 26 Ca 0.36 -0.94 -0.04 0.00 -0.15 0.00 0.00 55.06 54.28 1bc6 s HIS 26 Cb -0.17 -0.67 -0.05 0.00 1.11 0.00 0.00 32.58 32.80 1bc6 s HIS 26 CO 0.14 -0.13 0.59 -1.21 -0.85 0.00 0.00 174.74 173.28 1bc6 s GLU 27 N -3.87 3.60 0.00 1.40 2.02 -1.26 -0.13 118.70 120.46 1bc6 s GLU 27 Ca 0.21 -0.03 0.00 0.00 0.02 0.00 0.00 54.97 55.17 1bc6 s GLU 27 Cb 0.05 -2.61 0.00 0.00 0.10 0.00 0.00 34.13 31.67 1bc6 s GLU 27 CO 0.02 0.15 0.00 0.41 0.02 0.00 0.00 175.26 175.86 1bc6 n GLY 28 N -1.27 6.30 0.15 -1.39 0.00 -0.83 -4.69 105.19 103.47 1bc6 n GLY 28 Ca -0.02 -1.84 -0.05 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.31 0.00 1.61 3.07 -1.99 -3.42 114.58 113.54 1bc6 h GLU 29 Ca 0.00 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1bc6 h GLU 29 Cb 0.00 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1bc6 h GLU 29 CO 0.00 -0.21 -0.12 -3.47 -1.40 0.00 0.00 179.01 173.81 1bc6 n ASP 30 N -3.12 0.33 -4.52 1.42 -0.08 -1.26 -5.04 116.55 104.27 1bc6 n ASP 30 Ca -0.04 0.05 -0.58 0.00 -1.51 0.00 0.00 54.79 52.71 1bc6 n ASP 30 Cb 0.14 -0.35 -0.09 0.00 2.34 0.00 0.00 41.12 43.16 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 -2.82 0.66 -1.33 -0.67 7.27 -1.26 -4.83 117.38 114.39 1bc6 n GLN 31 Ca -0.02 0.21 -0.32 0.00 0.07 0.00 0.00 57.00 56.95 1bc6 n GLN 31 Cb 0.06 -1.95 0.09 0.00 2.41 0.00 0.00 30.24 30.86 1bc6 n GLN 31 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 1bc6 s TYR 32 N 5.13 2.33 0.39 3.69 1.51 -1.26 -1.96 117.35 127.18 1bc6 s TYR 32 Ca 1.08 1.61 0.04 0.00 -1.01 0.00 0.00 57.07 58.78 1bc6 s TYR 32 Cb -1.19 -3.20 -0.04 0.00 -0.11 0.00 0.00 41.96 37.41 1bc6 s TYR 32 CO 0.64 -2.08 0.07 0.71 -1.11 0.00 0.00 175.55 173.78 1bc6 s TYR 33 N -2.55 1.92 -0.04 2.71 2.02 0.82 -4.80 117.35 117.42 1bc6 s TYR 33 Ca 0.66 -1.06 0.02 0.00 -0.37 0.00 0.00 57.07 56.31 1bc6 s TYR 33 Cb -0.21 -1.31 0.01 0.00 -0.40 0.00 0.00 41.96 40.05 1bc6 s TYR 33 CO 0.50 -0.05 -0.07 0.42 -1.57 0.00 0.00 175.55 174.78 1bc6 s ILE 34 N -3.17 0.72 -0.22 2.71 1.01 -1.26 -0.68 121.20 120.31 1bc6 s ILE 34 Ca 0.27 -0.26 -0.29 0.00 0.00 0.00 0.00 60.65 60.37 1bc6 s ILE 34 Cb 0.05 -0.69 -0.03 0.00 0.01 0.00 0.00 42.46 41.81 1bc6 s ILE 34 CO 0.14 0.25 1.67 -0.62 0.00 0.00 0.00 174.94 176.38 1bc6 s ASP 35 N 0.64 6.29 0.00 3.58 -1.08 -0.03 -4.70 116.67 121.38 1bc6 s ASP 35 Ca -0.10 1.64 0.25 0.00 -0.52 0.00 0.00 52.55 53.82 1bc6 s ASP 35 Cb -0.13 -2.53 0.88 0.00 -1.46 0.00 0.00 42.92 39.68 1bc6 s ASP 35 CO 0.01 -1.33 1.64 -0.81 0.52 0.00 0.00 175.17 175.21 1bc6 n PRO 36 N 7.78 1.76 -0.04 4.34 -0.04 -1.26 -1.98 135.00 145.56 1bc6 n PRO 36 Ca 0.20 -1.12 -0.11 0.00 -0.04 0.00 0.00 63.50 62.42 1bc6 n PRO 36 Cb 0.45 -1.46 -0.14 0.00 -0.04 0.00 0.00 33.50 32.31 1bc6 n PRO 36 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1bc6 n ASP 37 N 0.35 0.97 -0.01 3.54 8.00 -1.26 -4.32 116.55 123.81 1bc6 n ASP 37 Ca 0.18 0.27 -0.16 0.00 0.71 0.00 0.00 54.79 55.79 1bc6 n ASP 37 Cb 0.37 -0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.36 1bc6 n ASP 37 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1bc6 h VAL 38 N 0.01 1.51 -1.68 2.53 2.07 -1.97 -3.46 116.25 115.26 1bc6 h VAL 38 Ca -0.38 -2.01 -0.70 0.00 0.82 0.00 0.00 66.70 64.43 1bc6 h VAL 38 Cb 2.06 2.73 0.03 0.00 -1.52 0.00 0.00 31.29 34.58 1bc6 h VAL 38 CO 0.06 0.56 0.79 0.00 0.02 0.00 0.00 177.57 179.01 1bc6 n ILE 40 N 4.00 0.10 -2.81 0.00 -5.35 -1.26 -4.68 119.36 109.36 1bc6 n ILE 40 Ca 0.23 -0.12 -0.05 0.00 -0.27 0.00 0.00 62.75 62.55 1bc6 n ILE 40 Cb 0.17 -0.02 0.01 0.00 -1.74 0.00 0.00 39.64 38.06 1bc6 n ILE 40 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1bc6 n ASP 41 N -0.33 -7.94 0.00 7.28 8.00 -1.26 -5.02 116.55 117.27 1bc6 n ASP 41 Ca 0.09 0.96 0.00 0.00 0.71 0.00 0.00 54.79 56.55 1bc6 n ASP 41 Cb 0.12 -5.25 0.00 0.00 -0.02 0.00 0.00 41.12 35.97 1bc6 n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bc6 s GLY 43 N 0.00 0.74 0.00 0.00 0.00 -1.26 -4.98 107.32 101.83 1bc6 s GLY 43 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 43.67 1bc6 s GLY 43 CO 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 173.10 172.32 1bc6 n ALA 44 N -0.37 0.00 -0.11 3.20 0.00 -1.26 -4.93 120.51 117.03 1bc6 n ALA 44 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1bc6 n ALA 44 Cb 0.63 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.05 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 0.39 0.89 -0.16 0.00 -0.00 -1.92 -1.11 114.58 112.68 1bc6 h GLU 46 Ca 0.10 -0.08 -0.00 0.00 -0.00 0.00 0.00 59.36 59.37 1bc6 h GLU 46 Cb 0.40 -0.19 -0.01 0.00 -0.00 0.00 0.00 28.75 28.96 1bc6 h GLU 46 CO 0.01 0.64 0.10 0.00 -0.00 0.00 0.00 179.01 179.76 1bc6 h ALA 47 N 1.20 0.20 0.00 1.06 0.00 -1.89 -2.93 119.26 116.90 1bc6 h ALA 47 Ca 0.23 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 1bc6 h ALA 47 Cb -0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1bc6 h ALA 47 CO -0.04 -0.29 -0.40 -0.24 0.00 0.00 0.00 179.25 178.27 1bc6 h VAL 48 N 0.19 1.03 -3.35 0.00 3.04 -0.98 -3.45 116.25 112.73 1bc6 h VAL 48 Ca 0.06 -1.52 -0.53 0.00 -1.01 0.00 0.00 66.70 63.70 1bc6 h VAL 48 Cb 0.02 1.89 0.00 0.00 -2.01 0.00 0.00 31.29 31.19 1bc6 h VAL 48 CO -0.01 0.39 0.52 0.00 -1.01 0.00 0.00 177.57 177.47 1bc6 s PRO 50 N 0.46 3.94 -1.88 0.00 0.04 -1.26 -0.70 135.00 135.59 1bc6 s PRO 50 Ca 0.55 2.42 0.00 0.00 0.04 0.00 0.00 61.00 64.01 1bc6 s PRO 50 Cb -0.29 -4.18 0.00 0.00 0.04 0.00 0.00 34.50 30.07 1bc6 s PRO 50 CO 0.32 -1.17 0.00 0.28 0.04 0.00 0.00 177.00 176.46 1bc6 n VAL 51 N 5.99 -0.47 -3.74 -0.36 0.31 -1.26 -2.92 118.33 115.87 1bc6 n VAL 51 Ca 0.21 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.28 1bc6 n VAL 51 Cb 0.42 -2.34 0.02 0.00 -0.91 0.00 0.00 33.84 31.03 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 -1.62 -2.84 -0.11 4.52 2.88 0.12 -4.85 113.62 111.72 1bc6 n SER 52 Ca -0.22 -0.95 0.17 0.00 -1.33 0.00 0.00 58.87 56.54 1bc6 n SER 52 Cb 0.66 -3.55 0.56 0.00 -0.75 0.00 0.00 64.21 61.13 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 0.79 2.22 -1.97 -1.46 0.00 -1.74 -3.32 119.26 113.79 1bc6 h ALA 53 Ca -0.64 -0.01 -0.58 0.00 0.00 0.00 0.00 54.91 53.68 1bc6 h ALA 53 Cb 1.36 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 1bc6 h ALA 53 CO 0.54 -0.40 1.42 0.42 0.00 0.00 0.00 179.25 181.23 1bc6 s ILE 54 N -5.29 3.14 0.10 0.00 1.01 -1.26 -1.92 121.20 116.98 1bc6 s ILE 54 Ca -0.07 0.15 0.08 0.00 0.00 0.00 0.00 60.65 60.80 1bc6 s ILE 54 Cb 0.20 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 1bc6 s ILE 54 CO 0.76 -0.11 -0.20 -0.31 0.00 0.00 0.00 174.94 175.07 1bc6 s TYR 55 N 7.76 1.72 0.43 3.97 2.02 0.64 -4.75 117.35 129.14 1bc6 s TYR 55 Ca 0.94 -0.43 -0.23 0.00 -0.37 0.00 0.00 57.07 56.99 1bc6 s TYR 55 Cb -0.30 -0.94 -0.08 0.00 -0.40 0.00 0.00 41.96 40.23 1bc6 s TYR 55 CO 0.35 0.19 1.10 -1.58 -1.57 0.00 0.00 175.55 174.04 1bc6 s HIS 56 N -1.21 3.07 0.30 2.71 5.65 -1.26 -0.50 115.29 124.06 1bc6 s HIS 56 Ca 0.06 1.59 0.07 0.00 0.25 0.00 0.00 55.06 57.03 1bc6 s HIS 56 Cb -0.10 -3.24 0.88 0.00 -1.18 0.00 0.00 32.58 28.94 1bc6 s HIS 56 CO 0.04 -1.04 1.45 -1.91 -0.65 0.00 0.00 174.74 172.63 1bc6 n GLU 57 N -0.31 -0.07 0.04 2.88 4.07 -1.23 -0.10 120.64 125.92 1bc6 n GLU 57 Ca 0.06 1.35 -0.11 0.00 -0.06 0.00 0.00 57.16 58.40 1bc6 n GLU 57 Cb 0.49 -2.23 -0.06 0.00 -0.06 0.00 0.00 31.44 29.58 1bc6 n GLU 57 CO 0.00 0.00 0.00 0.22 -0.06 0.00 0.00 177.13 177.29 1bc6 h ASP 58 N 0.00 -0.13 0.46 4.31 3.58 -1.91 -2.36 116.42 120.36 1bc6 h ASP 58 Ca 0.63 0.02 -0.13 0.00 0.42 0.00 0.00 57.03 57.97 1bc6 h ASP 58 Cb 1.45 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 42.54 1bc6 h ASP 58 CO -0.82 -0.07 -0.58 -0.26 -2.88 0.00 0.00 179.24 174.63 1bc6 h PHE 59 N -0.08 0.16 -2.75 0.28 0.04 -1.15 -3.45 116.94 110.00 1bc6 h PHE 59 Ca 0.02 -0.06 -0.53 0.00 2.80 0.00 0.00 57.97 60.20 1bc6 h PHE 59 Cb 0.11 -0.03 0.03 0.00 2.20 0.00 0.00 35.95 38.26 1bc6 h PHE 59 CO -0.12 0.68 0.95 0.08 -0.60 0.00 0.00 178.31 179.29 1bc6 s VAL 60 N -3.76 2.82 0.56 -0.55 1.01 0.86 -4.95 120.40 116.39 1bc6 s VAL 60 Ca -0.03 0.45 -0.20 0.00 0.00 0.00 0.00 61.98 62.20 1bc6 s VAL 60 Cb 0.13 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 1bc6 s VAL 60 CO 0.78 0.02 1.20 -2.16 0.00 0.00 0.00 175.10 174.94 1bc6 s PRO 61 N 1.92 3.18 0.34 2.72 0.04 -1.26 -4.70 135.00 137.25 1bc6 s PRO 61 Ca 0.72 1.83 0.12 0.00 0.04 0.00 0.00 61.00 63.71 1bc6 s PRO 61 Cb -0.42 -2.05 0.93 0.00 0.04 0.00 0.00 34.50 32.99 1bc6 s PRO 61 CO 0.32 -1.04 1.76 0.93 0.04 0.00 0.00 177.00 179.01 1bc6 h GLU 62 N 1.19 0.55 -0.69 4.56 3.07 -1.93 0.52 114.58 121.85 1bc6 h GLU 62 Ca -0.50 -0.03 0.08 0.00 -0.50 0.00 0.00 59.36 58.41 1bc6 h GLU 62 Cb 1.28 -0.12 -0.11 0.00 -0.84 0.00 0.00 28.75 28.96 1bc6 h GLU 62 CO 0.56 0.36 -0.52 1.49 -1.40 0.00 0.00 179.01 179.50 1bc6 h GLU 63 N 0.56 -0.19 -0.01 2.33 4.22 -2.03 -2.56 114.58 116.90 1bc6 h GLU 63 Ca 0.60 0.01 0.00 0.00 0.08 0.00 0.00 59.36 60.06 1bc6 h GLU 63 Cb 1.23 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1bc6 h GLU 63 CO -0.38 -0.13 -0.04 0.91 -2.18 0.00 0.00 179.01 177.20 1bc6 n TRP 64 N -5.35 0.00 -0.31 0.92 8.01 0.16 -2.39 117.44 118.48 1bc6 n TRP 64 Ca 0.01 0.00 0.24 0.00 -1.31 0.00 0.00 57.50 56.44 1bc6 n TRP 64 Cb 0.32 -0.03 0.55 0.00 -2.01 0.00 0.00 31.31 30.14 1bc6 n TRP 64 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.69 176.46 1bc6 h LYS 65 N 1.73 0.32 -0.55 -0.99 1.63 -0.59 0.17 116.57 118.29 1bc6 h LYS 65 Ca 0.00 -0.02 0.11 0.00 -0.85 0.00 0.00 60.65 59.89 1bc6 h LYS 65 Cb 0.41 -0.07 -0.09 0.00 -0.60 0.00 0.00 32.23 31.88 1bc6 h LYS 65 CO 0.00 0.21 0.01 0.77 -3.45 0.00 0.00 179.45 176.99 1bc6 h SER 66 N 0.33 -0.23 -0.56 4.20 0.02 -1.59 -0.68 113.55 115.05 1bc6 h SER 66 Ca 0.57 0.13 -0.10 0.00 -0.84 0.00 0.00 61.79 61.55 1bc6 h SER 66 Cb 1.56 0.23 -0.02 0.00 0.14 0.00 0.00 62.40 64.31 1bc6 h SER 66 CO -0.23 -0.09 -0.02 1.88 -1.14 0.00 0.00 176.83 177.23 1bc6 h TYR 67 N 0.12 1.11 -0.23 3.45 0.05 -0.90 0.17 116.97 120.74 1bc6 h TYR 67 Ca 0.28 -0.19 -0.00 0.00 0.05 0.00 0.00 58.73 58.87 1bc6 h TYR 67 Cb 0.44 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.88 1bc6 h TYR 67 CO -0.33 0.99 0.12 0.82 -1.05 0.00 0.00 178.16 178.71 1bc6 h ILE 68 N 0.93 1.11 -0.93 -2.88 5.03 -0.81 0.26 117.51 120.23 1bc6 h ILE 68 Ca 0.16 -0.31 0.02 0.00 -0.12 0.00 0.00 64.86 64.61 1bc6 h ILE 68 Cb 0.56 0.90 -0.05 0.00 -3.03 0.00 0.00 36.82 35.21 1bc6 h ILE 68 CO 0.03 0.11 0.61 1.56 -0.68 0.00 0.00 178.15 179.79 1bc6 h GLN 69 N 0.26 1.19 -0.03 2.37 7.50 -1.00 -1.17 115.11 124.23 1bc6 h GLN 69 Ca 0.08 -0.07 0.00 0.00 0.50 0.00 0.00 58.65 59.16 1bc6 h GLN 69 Cb 0.07 -0.27 -0.00 0.00 0.05 0.00 0.00 27.48 27.33 1bc6 h GLN 69 CO -0.01 0.79 0.00 -0.22 -1.50 0.00 0.00 178.83 177.89 1bc6 h LYS 70 N 1.23 0.02 -0.52 1.46 3.64 0.55 0.29 116.57 123.23 1bc6 h LYS 70 Ca 0.35 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.81 1bc6 h LYS 70 Cb -0.09 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.66 1bc6 h LYS 70 CO -0.09 0.01 0.18 -0.91 -2.27 0.00 0.00 179.45 176.37 1bc6 h ASN 71 N 0.02 0.17 0.06 4.20 -0.26 -0.19 0.13 115.58 119.71 1bc6 h ASN 71 Ca 0.01 0.07 0.03 0.00 -0.56 0.00 0.00 56.30 55.85 1bc6 h ASN 71 Cb 0.01 0.06 -0.05 0.00 -1.06 0.00 0.00 38.32 37.28 1bc6 h ASN 71 CO -0.02 0.12 -0.33 0.03 -1.06 0.00 0.00 177.43 176.17 1bc6 h ARG 72 N 0.35 -0.50 -0.82 0.81 3.08 -0.85 -3.04 114.38 113.41 1bc6 h ARG 72 Ca 0.26 0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.45 1bc6 h ARG 72 Cb 0.29 0.11 -0.08 0.00 0.08 0.00 0.00 29.97 30.38 1bc6 h ARG 72 CO -0.27 -0.34 0.45 0.22 -1.07 0.00 0.00 179.97 178.96 1bc6 h ASP 73 N -0.52 0.61 -1.02 7.04 3.58 0.11 0.11 116.42 126.34 1bc6 h ASP 73 Ca 0.04 0.06 0.28 0.00 0.42 0.00 0.00 57.03 57.84 1bc6 h ASP 73 Cb 0.58 -0.05 -0.13 0.00 1.72 0.00 0.00 39.33 41.45 1bc6 h ASP 73 CO -0.23 0.33 0.60 -0.26 -2.88 0.00 0.00 179.24 176.80 1bc6 h PHE 74 N 0.72 0.94 -0.28 0.28 -1.00 -0.69 -0.79 116.94 116.13 1bc6 h PHE 74 Ca 0.41 0.03 -0.07 0.00 2.81 0.00 0.00 57.97 61.16 1bc6 h PHE 74 Cb 0.44 -0.26 -0.04 0.00 3.61 0.00 0.00 35.95 39.70 1bc6 h PHE 74 CO -0.07 -0.03 -0.02 1.19 -1.61 0.00 0.00 178.31 177.77 1bc6 n PHE 75 N -4.92 0.93 -3.04 -0.55 3.72 0.30 -4.75 117.46 109.16 1bc6 n PHE 75 Ca 0.29 -1.15 -0.17 0.00 -0.05 0.00 0.00 57.45 56.37 1bc6 n PHE 75 Cb 0.86 -0.37 -0.02 0.00 -0.94 0.00 0.00 39.48 39.02 1bc6 n PHE 75 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1bc6 n LYS 76 N -0.81 0.82 0.00 -1.08 4.81 -0.30 -5.06 118.16 116.54 1bc6 n LYS 76 Ca 0.25 -2.78 0.00 0.00 -0.87 0.00 0.00 58.31 54.92 1bc6 n LYS 76 Cb 0.93 -1.36 0.00 0.00 0.02 0.00 0.00 35.03 34.62 1bc6 n LYS 76 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20