#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8c s GLN 2 N 0.00 1.72 -0.22 0.54 0.74 -1.26 -5.11 119.66 116.07 1z8c s GLN 2 Ca 0.00 -1.20 -0.10 0.00 0.05 0.00 0.00 55.36 54.12 1z8c s GLN 2 Cb 0.00 -2.71 -0.05 0.00 1.10 0.00 0.00 33.01 31.35 1z8c s GLN 2 CO 0.00 -0.65 0.13 0.42 -0.55 0.00 0.00 175.29 174.64 1z8c s ILE 3 N 1.27 5.24 0.46 -2.34 1.01 -1.26 -5.10 121.20 120.48 1z8c s ILE 3 Ca -0.04 0.13 -0.05 0.00 0.00 0.00 0.00 60.65 60.70 1z8c s ILE 3 Cb -0.19 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1z8c s ILE 3 CO -0.07 0.39 0.75 0.42 0.00 0.00 0.00 174.94 176.43 1z8c s THR 4 N 0.80 4.93 -0.41 2.92 -4.23 -1.26 -5.02 115.64 113.37 1z8c s THR 4 Ca 0.07 0.13 0.05 0.00 -1.18 0.00 0.00 61.69 60.76 1z8c s THR 4 Cb -0.13 -3.86 0.64 0.00 1.34 0.00 0.00 72.50 70.50 1z8c s THR 4 CO 0.02 -0.80 1.83 0.18 -0.54 0.00 0.00 174.62 175.31 1z8c n LEU 5 N -2.16 6.21 0.17 4.79 4.77 -1.26 -4.52 117.00 125.01 1z8c n LEU 5 Ca -0.00 -3.62 0.02 0.00 -0.03 0.00 0.00 56.01 52.38 1z8c n LEU 5 Cb 0.55 -0.80 0.32 0.00 -2.33 0.00 0.00 43.42 41.16 1z8c n LEU 5 CO 0.52 1.08 0.66 -0.50 -1.33 0.00 0.00 177.39 177.82 1z8c h TRP 6 N 1.10 0.00 -3.32 -1.77 4.06 -2.06 -3.44 115.95 110.52 1z8c h TRP 6 Ca 0.54 0.00 -0.37 0.00 2.06 0.00 0.00 58.89 61.12 1z8c h TRP 6 Cb 2.61 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 30.63 1z8c h TRP 6 CO 1.47 0.44 -0.67 1.14 -3.56 0.00 0.00 178.44 177.26 1z8c s GLN 7 N -3.90 1.27 0.23 0.49 -2.07 -1.26 -5.11 119.66 109.31 1z8c s GLN 7 Ca -0.02 -1.62 -0.32 0.00 -1.82 0.00 0.00 55.36 51.58 1z8c s GLN 7 Cb 0.13 -0.63 -0.13 0.00 -1.09 0.00 0.00 33.01 31.29 1z8c s GLN 7 CO 0.72 -0.05 1.43 0.54 -1.32 0.00 0.00 175.29 176.61 1z8c n ARG 8 N -0.37 2.04 -2.29 9.60 1.74 -1.26 -4.84 116.66 121.28 1z8c n ARG 8 Ca -0.06 0.73 -0.39 0.00 -0.77 0.00 0.00 57.85 57.35 1z8c n ARG 8 Cb 0.63 -2.40 -0.02 0.00 -1.02 0.00 0.00 32.46 29.65 1z8c n ARG 8 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1z8c n PRO 9 N 2.24 2.71 -3.35 5.56 -0.04 -1.26 -4.95 135.00 135.91 1z8c n PRO 9 Ca 0.12 -2.94 -0.38 0.00 -0.04 0.00 0.00 63.50 60.26 1z8c n PRO 9 Cb 0.31 -3.50 -0.06 0.00 -0.04 0.00 0.00 33.50 30.21 1z8c n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1z8c s LEU 10 N 5.44 4.51 0.20 1.53 1.43 -1.26 -0.97 118.68 129.55 1z8c s LEU 10 Ca 0.57 1.16 -0.00 0.00 -1.03 0.00 0.00 54.13 54.83 1z8c s LEU 10 Cb 0.05 -2.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.43 1z8c s LEU 10 CO 0.08 0.29 0.10 0.68 0.23 0.00 0.00 176.35 177.72 1z8c s VAL 11 N -1.09 0.18 -0.02 -1.59 -7.23 -0.61 -4.95 120.40 105.09 1z8c s VAL 11 Ca 0.27 -1.98 -0.20 0.00 -1.81 0.00 0.00 61.98 58.26 1z8c s VAL 11 Cb -0.19 -2.41 -0.05 0.00 0.56 0.00 0.00 36.38 34.30 1z8c s VAL 11 CO 0.17 -0.13 0.57 -0.89 -0.31 0.00 0.00 175.10 174.52 1z8c s THR 12 N -4.02 4.96 -0.03 5.32 2.01 -1.26 -1.66 115.64 120.96 1z8c s THR 12 Ca 0.35 1.19 0.03 0.00 0.31 0.00 0.00 61.69 63.57 1z8c s THR 12 Cb 0.07 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.67 1z8c s THR 12 CO 0.10 0.41 -0.11 0.27 -0.69 0.00 0.00 174.62 174.59 1z8c s ILE 13 N -0.09 0.96 -0.16 1.82 -4.36 0.50 -4.48 121.20 115.39 1z8c s ILE 13 Ca 0.30 -0.46 -0.02 0.00 -0.26 0.00 0.00 60.65 60.21 1z8c s ILE 13 Cb -0.18 -0.84 -0.01 0.00 1.25 0.00 0.00 42.46 42.69 1z8c s ILE 13 CO 0.16 0.29 -0.09 -0.75 0.24 0.00 0.00 174.94 174.79 1z8c s LYS 14 N 0.11 3.41 -0.19 0.37 2.20 0.26 -0.44 119.74 125.45 1z8c s LYS 14 Ca -0.02 -0.65 -0.05 0.00 -0.36 0.00 0.00 55.97 54.89 1z8c s LYS 14 Cb -0.09 -2.78 0.10 0.00 -1.51 0.00 0.00 37.83 33.54 1z8c s LYS 14 CO 0.01 0.07 0.33 -1.50 -0.36 0.00 0.00 175.35 173.90 1z8c s ILE 15 N 0.74 -0.52 -0.66 5.43 2.07 0.23 -0.74 121.20 127.75 1z8c s ILE 15 Ca -0.04 0.09 -0.03 0.00 -1.41 0.00 0.00 60.65 59.25 1z8c s ILE 15 Cb -0.15 -0.65 0.00 0.00 0.13 0.00 0.00 42.46 41.79 1z8c s ILE 15 CO 0.02 -0.01 0.57 0.61 -1.91 0.00 0.00 174.94 174.21 1z8c n GLY 16 N 5.36 0.15 4.26 1.50 0.00 -1.26 -2.61 105.19 112.59 1z8c n GLY 16 Ca -0.06 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1z8c n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1z8c n GLY 17 N -1.20 2.00 3.73 -0.02 0.00 -1.26 -4.96 105.19 103.47 1z8c n GLY 17 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1z8c n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1z8c s GLN 18 N 0.00 4.61 -0.06 1.61 -0.21 -1.07 -5.06 119.66 119.48 1z8c s GLN 18 Ca 0.00 1.32 -0.13 0.00 0.02 0.00 0.00 55.36 56.57 1z8c s GLN 18 Cb 0.00 -3.39 -0.05 0.00 1.00 0.00 0.00 33.01 30.57 1z8c s GLN 18 CO 0.00 0.19 0.34 -0.51 -2.12 0.00 0.00 175.29 173.18 1z8c s LEU 19 N 0.17 4.41 0.35 2.90 1.43 -1.26 -0.60 118.68 126.07 1z8c s LEU 19 Ca 0.45 0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 54.29 1z8c s LEU 19 Cb -0.22 -2.45 0.01 0.00 0.03 0.00 0.00 46.19 43.56 1z8c s LEU 19 CO 0.27 0.28 0.49 -0.54 0.23 0.00 0.00 176.35 177.09 1z8c s LYS 20 N -0.69 1.93 0.01 1.70 1.02 0.42 -5.00 119.74 119.12 1z8c s LYS 20 Ca 0.21 -1.74 0.08 0.00 0.02 0.00 0.00 55.97 54.54 1z8c s LYS 20 Cb -0.15 0.46 -0.02 0.00 -0.52 0.00 0.00 37.83 37.59 1z8c s LYS 20 CO 0.10 -0.81 -0.24 -1.21 -0.92 0.00 0.00 175.35 172.26 1z8c s GLU 21 N -3.01 1.85 0.04 1.68 2.02 -1.26 -0.37 118.70 119.64 1z8c s GLU 21 Ca 0.30 -0.94 -0.06 0.00 0.02 0.00 0.00 54.97 54.28 1z8c s GLU 21 Cb -0.01 -1.87 -0.01 0.00 0.10 0.00 0.00 34.13 32.34 1z8c s GLU 21 CO 0.20 0.50 0.12 0.00 0.02 0.00 0.00 175.26 176.10 1z8c s ALA 22 N -0.66 -0.13 -0.12 5.21 0.00 -0.66 -4.54 121.76 120.85 1z8c s ALA 22 Ca 0.10 -0.49 -0.22 0.00 0.00 0.00 0.00 51.96 51.35 1z8c s ALA 22 Cb -0.09 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 1z8c s ALA 22 CO 0.00 -0.33 0.65 -1.17 0.00 0.00 0.00 175.76 174.91 1z8c s LEU 23 N -2.12 4.24 -0.47 0.00 2.96 -0.24 -1.57 118.68 121.49 1z8c s LEU 23 Ca -0.05 1.01 -0.28 0.00 -0.22 0.00 0.00 54.13 54.58 1z8c s LEU 23 Cb -0.01 -2.96 0.01 0.00 0.50 0.00 0.00 46.19 43.73 1z8c s LEU 23 CO -0.04 -0.17 1.37 -0.76 -1.32 0.00 0.00 176.35 175.43 1z8c s LEU 24 N 1.22 3.53 -0.37 -0.68 1.43 -0.15 -0.05 118.68 123.61 1z8c s LEU 24 Ca 0.33 0.59 -0.00 0.00 -1.03 0.00 0.00 54.13 54.01 1z8c s LEU 24 Cb -0.17 -3.39 0.10 0.00 0.03 0.00 0.00 46.19 42.77 1z8c s LEU 24 CO 0.14 -1.50 0.13 -0.62 0.23 0.00 0.00 176.35 174.73 1z8c s ASP 25 N 3.86 5.05 0.02 2.29 -1.08 -0.42 -4.77 116.67 121.62 1z8c s ASP 25 Ca 0.56 -1.97 0.25 0.00 -0.52 0.00 0.00 52.55 50.88 1z8c s ASP 25 Cb -0.12 -1.75 1.05 0.00 -1.46 0.00 0.00 42.92 40.65 1z8c s ASP 25 CO 0.30 -0.45 1.80 0.35 0.52 0.00 0.00 175.17 177.69 1z8c n THR 26 N 4.49 0.30 1.23 1.71 -2.24 -1.26 -2.54 114.28 115.97 1z8c n THR 26 Ca -0.02 0.06 0.13 0.00 -2.27 0.00 0.00 64.05 61.95 1z8c n THR 26 Cb 0.42 -0.65 0.37 0.00 -2.10 0.00 0.00 70.33 68.37 1z8c n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1z8c n GLY 27 N 1.07 -0.63 3.61 3.38 0.00 -1.26 -4.84 105.19 106.53 1z8c n GLY 27 Ca 0.06 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 1z8c n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z8c s ALA 28 N -2.52 3.41 0.16 4.61 0.00 -1.05 -4.99 121.76 121.37 1z8c s ALA 28 Ca 0.24 -0.82 -0.08 0.00 0.00 0.00 0.00 51.96 51.30 1z8c s ALA 28 Cb 0.19 -2.01 0.01 0.00 0.00 0.00 0.00 23.12 21.32 1z8c s ALA 28 CO 0.53 0.03 1.47 -0.44 0.00 0.00 0.00 175.76 177.35 1z8c h ASP 29 N 7.03 0.84 -1.83 0.00 3.32 -1.88 0.51 116.42 124.41 1z8c h ASP 29 Ca -0.37 -0.43 -0.59 0.00 0.02 0.00 0.00 57.03 55.66 1z8c h ASP 29 Cb 1.17 -0.24 -0.11 0.00 0.22 0.00 0.00 39.33 40.37 1z8c h ASP 29 CO 0.68 1.19 -0.60 -1.81 -1.72 0.00 0.00 179.24 176.98 1z8c s ASP 30 N -6.91 4.12 -0.25 6.45 1.01 -1.26 -2.68 116.67 117.16 1z8c s ASP 30 Ca -0.09 -1.09 -0.13 0.00 0.71 0.00 0.00 52.55 51.94 1z8c s ASP 30 Cb 0.11 -0.48 -0.04 0.00 1.01 0.00 0.00 42.92 43.52 1z8c s ASP 30 CO 0.87 -0.32 0.29 -0.89 0.21 0.00 0.00 175.17 175.33 1z8c s THR 31 N -2.57 5.25 -0.13 -1.27 2.01 -1.26 -2.96 115.64 114.72 1z8c s THR 31 Ca 0.36 0.43 0.02 0.00 0.31 0.00 0.00 61.69 62.81 1z8c s THR 31 Cb 0.02 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.92 1z8c s THR 31 CO 0.19 0.25 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.49 1z8c s VAL 32 N 1.55 1.85 0.21 3.82 1.01 -0.05 -1.18 120.40 127.61 1z8c s VAL 32 Ca 0.13 -0.86 0.09 0.00 0.00 0.00 0.00 61.98 61.34 1z8c s VAL 32 Cb -0.15 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.53 1z8c s VAL 32 CO 0.08 0.51 -0.17 -0.76 0.00 0.00 0.00 175.10 174.76 1z8c s LEU 33 N 0.87 2.53 0.99 3.92 1.43 0.13 -0.97 118.68 127.58 1z8c s LEU 33 Ca -0.07 -0.98 -0.12 0.00 -1.03 0.00 0.00 54.13 51.93 1z8c s LEU 33 Cb -0.15 -0.84 0.19 0.00 0.03 0.00 0.00 46.19 45.41 1z8c s LEU 33 CO -0.02 -0.07 1.08 -1.83 0.23 0.00 0.00 176.35 175.75 1z8c s GLU 34 N -3.35 0.46 0.03 1.70 -1.05 -1.26 -1.05 118.70 114.17 1z8c s GLU 34 Ca 0.23 0.67 -0.35 0.00 -0.15 0.00 0.00 54.97 55.36 1z8c s GLU 34 Cb -0.03 -1.73 -0.14 0.00 -0.44 0.00 0.00 34.13 31.79 1z8c s GLU 34 CO 0.09 -2.75 1.63 -1.91 0.95 0.00 0.00 175.26 173.27 1z8c n GLU 35 N -4.21 1.84 -0.06 -4.83 4.07 -1.26 -4.68 120.64 111.51 1z8c n GLU 35 Ca 0.05 0.67 0.05 0.00 -0.06 0.00 0.00 57.16 57.87 1z8c n GLU 35 Cb 0.56 -2.42 0.07 0.00 -0.06 0.00 0.00 31.44 29.59 1z8c n GLU 35 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 1z8c n MET 36 N 4.31 1.27 -3.98 5.31 2.81 -1.26 -5.00 117.12 120.58 1z8c n MET 36 Ca 0.20 -1.41 -0.37 0.00 -1.81 0.00 0.00 57.70 54.31 1z8c n MET 36 Cb 0.25 -1.21 0.01 0.00 -0.71 0.00 0.00 33.22 31.56 1z8c n MET 36 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1z8c n SER 37 N 0.50 -3.23 -4.77 7.83 7.64 -1.26 -4.92 113.62 115.41 1z8c n SER 37 Ca 0.07 -1.17 -0.40 0.00 1.01 0.00 0.00 58.87 58.38 1z8c n SER 37 Cb 0.30 -2.37 -0.06 0.00 -1.01 0.00 0.00 64.21 61.08 1z8c n SER 37 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1z8c s LEU 38 N -7.09 4.61 0.81 -3.43 1.43 -1.26 -5.06 118.68 108.68 1z8c s LEU 38 Ca 0.35 1.78 -0.12 0.00 -1.03 0.00 0.00 54.13 55.12 1z8c s LEU 38 Cb -0.17 -3.45 0.07 0.00 0.03 0.00 0.00 46.19 42.68 1z8c s LEU 38 CO 0.93 0.18 1.10 -2.84 0.23 0.00 0.00 176.35 175.96 1z8c s PRO 39 N -1.19 2.01 0.00 1.29 0.02 -1.26 -4.94 135.00 130.93 1z8c s PRO 39 Ca 0.38 0.57 0.00 0.00 0.02 0.00 0.00 61.00 61.98 1z8c s PRO 39 Cb -0.24 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.36 1z8c s PRO 39 CO 0.29 -1.65 0.00 0.41 -0.33 0.00 0.00 177.00 175.71 1z8c n GLY 40 N -2.20 0.35 3.89 0.52 0.00 -1.26 -5.01 105.19 101.49 1z8c n GLY 40 Ca 0.07 -1.92 -0.29 0.00 0.00 0.00 0.00 46.02 43.88 1z8c n GLY 40 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1z8c s ARG 41 N -1.60 2.87 0.19 1.61 1.04 -1.26 -5.10 118.95 116.69 1z8c s ARG 41 Ca 0.00 0.32 -0.10 0.00 -1.04 0.00 0.00 55.73 54.90 1z8c s ARG 41 Cb 0.00 -2.09 -0.00 0.00 -2.04 0.00 0.00 34.95 30.81 1z8c s ARG 41 CO 0.00 -0.94 0.34 1.67 -0.04 0.00 0.00 175.30 176.33 1z8c s TRP 42 N -3.25 0.36 -0.08 5.89 1.48 -1.26 -4.72 118.94 117.36 1z8c s TRP 42 Ca 0.57 -0.71 0.03 0.00 -1.06 0.00 0.00 56.10 54.92 1z8c s TRP 42 Cb -0.11 0.02 0.01 0.00 -1.16 0.00 0.00 33.47 32.24 1z8c s TRP 42 CO 0.50 -0.79 -0.16 0.21 -4.06 0.00 0.00 176.95 172.65 1z8c s LYS 43 N -3.97 2.11 0.62 3.25 2.20 -0.81 -4.87 119.74 118.26 1z8c s LYS 43 Ca 0.18 -0.55 -0.15 0.00 -0.36 0.00 0.00 55.97 55.09 1z8c s LYS 43 Cb 0.02 -1.69 -0.02 0.00 -1.51 0.00 0.00 37.83 34.63 1z8c s LYS 43 CO 0.02 0.06 1.08 -1.25 -0.36 0.00 0.00 175.35 174.89 1z8c s PRO 44 N 0.61 3.14 0.21 4.03 0.04 -1.26 -0.27 135.00 141.49 1z8c s PRO 44 Ca -0.15 1.26 -0.23 0.00 0.04 0.00 0.00 61.00 61.92 1z8c s PRO 44 Cb -0.16 -2.00 0.05 0.00 0.04 0.00 0.00 34.50 32.42 1z8c s PRO 44 CO 0.05 -0.96 0.88 -1.59 0.04 0.00 0.00 177.00 175.42 1z8c s LYS 45 N -4.10 1.44 -0.00 4.56 -2.85 -0.75 -4.87 119.74 113.17 1z8c s LYS 45 Ca 0.65 -0.81 0.07 0.00 -1.00 0.00 0.00 55.97 54.88 1z8c s LYS 45 Cb -0.17 0.48 -0.02 0.00 -2.06 0.00 0.00 37.83 36.05 1z8c s LYS 45 CO 0.39 -0.66 -0.23 -1.64 0.10 0.00 0.00 175.35 173.30 1z8c s MET 46 N -3.37 2.10 0.11 1.78 -1.94 -1.26 -1.28 119.30 115.44 1z8c s MET 46 Ca 0.13 -0.94 0.03 0.00 -1.71 0.00 0.00 55.69 53.19 1z8c s MET 46 Cb -0.03 -2.10 -0.04 0.00 2.01 0.00 0.00 34.83 34.67 1z8c s MET 46 CO 0.04 0.56 -0.08 0.96 -0.01 0.00 0.00 175.02 176.49 1z8c s ILE 47 N -0.71 0.83 0.24 2.53 -4.36 -0.82 -4.98 121.20 113.92 1z8c s ILE 47 Ca 0.11 -1.93 0.06 0.00 -0.26 0.00 0.00 60.65 58.63 1z8c s ILE 47 Cb -0.10 -1.68 -0.05 0.00 1.25 0.00 0.00 42.46 41.88 1z8c s ILE 47 CO 0.01 -0.81 -0.06 -0.83 0.24 0.00 0.00 174.94 173.48 1z8c s GLY 48 N -3.00 1.58 0.00 6.27 0.00 -1.26 -0.94 107.32 109.97 1z8c s GLY 48 Ca 0.12 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 43.07 1z8c s GLY 48 CO -0.03 -1.74 0.00 0.61 0.00 0.00 0.00 173.10 171.94 1z8c n GLY 49 N -0.45 5.10 0.34 0.20 0.00 -0.73 -5.00 105.19 104.65 1z8c n GLY 49 Ca -0.06 -1.03 -0.01 0.00 0.00 0.00 0.00 46.02 44.92 1z8c n GLY 49 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1z8c h ILE 50 N 0.00 1.21 -0.37 -0.61 6.09 -2.02 -3.32 117.51 118.49 1z8c h ILE 50 Ca 0.00 -0.48 -0.24 0.00 -1.37 0.00 0.00 64.86 62.77 1z8c h ILE 50 Cb 0.00 0.17 -0.16 0.00 0.47 0.00 0.00 36.82 37.30 1z8c h ILE 50 CO 0.00 0.22 -0.33 0.61 -3.07 0.00 0.00 178.15 175.59 1z8c n GLY 51 N -1.28 5.38 0.00 8.18 0.00 -1.26 -5.08 105.19 111.13 1z8c n GLY 51 Ca 0.08 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1z8c n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1z8c n GLY 52 N -1.02 0.62 3.55 -0.02 0.00 -1.25 -5.10 105.19 101.97 1z8c n GLY 52 Ca 0.33 -2.14 -0.25 0.00 0.00 0.00 0.00 46.02 43.96 1z8c n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1z8c s PHE 53 N -1.01 2.53 0.09 1.61 0.40 -1.26 -1.76 117.98 118.57 1z8c s PHE 53 Ca 0.00 -0.27 0.03 0.00 -0.60 0.00 0.00 56.93 56.09 1z8c s PHE 53 Cb 0.00 -1.18 -0.04 0.00 0.51 0.00 0.00 43.02 42.32 1z8c s PHE 53 CO 0.00 0.58 -0.09 0.96 0.70 0.00 0.00 175.22 177.37 1z8c s ILE 54 N -2.03 0.81 -0.12 0.64 -4.36 -0.11 -4.98 121.20 111.05 1z8c s ILE 54 Ca 0.27 -1.61 -0.13 0.00 -0.26 0.00 0.00 60.65 58.92 1z8c s ILE 54 Cb -0.07 -1.30 -0.05 0.00 1.25 0.00 0.00 42.46 42.29 1z8c s ILE 54 CO 0.15 -0.60 0.31 -0.75 0.24 0.00 0.00 174.94 174.29 1z8c s LYS 55 N -2.83 4.08 0.20 0.37 2.20 -1.26 -1.94 119.74 120.56 1z8c s LYS 55 Ca 0.04 0.15 0.02 0.00 -0.36 0.00 0.00 55.97 55.83 1z8c s LYS 55 Cb -0.02 -3.35 -0.05 0.00 -1.51 0.00 0.00 37.83 32.90 1z8c s LYS 55 CO -0.01 0.40 0.01 0.14 -0.36 0.00 0.00 175.35 175.54 1z8c s VAL 56 N -0.06 0.78 -0.17 4.02 -7.23 -0.41 -4.38 120.40 112.95 1z8c s VAL 56 Ca 0.18 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.32 1z8c s VAL 56 Cb -0.14 -2.26 -0.02 0.00 0.56 0.00 0.00 36.38 34.53 1z8c s VAL 56 CO 0.06 -0.37 -0.04 -0.13 -0.31 0.00 0.00 175.10 174.31 1z8c s ARG 57 N -3.91 3.57 -0.26 4.82 0.52 0.92 -1.80 118.95 122.80 1z8c s ARG 57 Ca 0.27 -0.56 -0.15 0.00 -0.52 0.00 0.00 55.73 54.77 1z8c s ARG 57 Cb 0.06 -2.92 -0.04 0.00 0.52 0.00 0.00 34.95 32.57 1z8c s ARG 57 CO 0.07 0.12 0.37 -1.14 0.02 0.00 0.00 175.30 174.74 1z8c s GLN 58 N 0.67 4.03 -0.18 3.54 0.74 0.62 -0.82 119.66 128.26 1z8c s GLN 58 Ca -0.02 0.05 -0.02 0.00 0.05 0.00 0.00 55.36 55.42 1z8c s GLN 58 Cb -0.15 -3.65 -0.00 0.00 1.10 0.00 0.00 33.01 30.31 1z8c s GLN 58 CO 0.02 -0.26 -0.10 0.71 -0.55 0.00 0.00 175.29 175.11 1z8c s TYR 59 N 2.01 2.87 0.35 1.67 1.51 -0.16 -1.93 117.35 123.67 1z8c s TYR 59 Ca 0.15 -0.99 0.03 0.00 -1.01 0.00 0.00 57.07 55.25 1z8c s TYR 59 Cb -0.16 -1.98 -0.02 0.00 -0.11 0.00 0.00 41.96 39.69 1z8c s TYR 59 CO 0.10 -0.50 0.52 -0.51 -1.11 0.00 0.00 175.55 174.05 1z8c s ASP 60 N 1.09 6.11 -1.46 2.29 1.01 -1.26 -0.64 116.67 123.81 1z8c s ASP 60 Ca 0.00 0.18 -0.10 0.00 0.71 0.00 0.00 52.55 53.34 1z8c s ASP 60 Cb -0.15 -1.69 0.05 0.00 1.01 0.00 0.00 42.92 42.14 1z8c s ASP 60 CO -0.02 -0.38 0.91 0.00 0.21 0.00 0.00 175.17 175.89 1z8c n GLN 61 N -1.74 -5.88 -2.89 8.23 6.02 -1.19 -4.91 117.38 115.01 1z8c n GLN 61 Ca -0.03 0.72 -0.41 0.00 -0.01 0.00 0.00 57.00 57.26 1z8c n GLN 61 Cb 0.57 -5.63 -0.04 0.00 1.02 0.00 0.00 30.24 26.16 1z8c n GLN 61 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1z8c s ILE 62 N -3.24 4.87 -0.17 5.09 -1.09 -0.33 -4.74 121.20 121.60 1z8c s ILE 62 Ca 0.54 1.61 -0.29 0.00 -2.23 0.00 0.00 60.65 60.28 1z8c s ILE 62 Cb -0.26 -4.13 -0.01 0.00 -1.58 0.00 0.00 42.46 36.49 1z8c s ILE 62 CO 0.67 0.01 1.16 -2.84 -1.23 0.00 0.00 174.94 172.70 1z8c s PRO 63 N 2.30 4.28 0.01 2.79 0.02 -1.26 -1.80 135.00 141.34 1z8c s PRO 63 Ca 0.37 1.54 0.02 0.00 0.02 0.00 0.00 61.00 62.95 1z8c s PRO 63 Cb -0.16 -3.67 -0.01 0.00 0.02 0.00 0.00 34.50 30.67 1z8c s PRO 63 CO 0.11 -0.61 -0.06 -1.50 -0.33 0.00 0.00 177.00 174.61 1z8c s ILE 64 N 3.08 0.46 -0.18 2.83 2.07 0.47 -4.49 121.20 125.44 1z8c s ILE 64 Ca 0.51 -0.53 -0.03 0.00 -1.41 0.00 0.00 60.65 59.19 1z8c s ILE 64 Cb -0.20 -0.44 -0.01 0.00 0.13 0.00 0.00 42.46 41.94 1z8c s ILE 64 CO 0.13 -0.06 -0.07 -0.70 -1.91 0.00 0.00 174.94 172.33 1z8c s GLU 65 N -0.65 3.44 -0.25 3.50 2.12 0.08 -1.04 118.70 125.90 1z8c s GLU 65 Ca -0.02 -0.62 0.11 0.00 0.36 0.00 0.00 54.97 54.79 1z8c s GLU 65 Cb -0.05 -2.89 0.46 0.00 0.26 0.00 0.00 34.13 31.91 1z8c s GLU 65 CO 0.00 0.01 1.19 -0.89 -0.54 0.00 0.00 175.26 175.02 1z8c n ILE 66 N 4.19 2.19 0.00 -3.70 5.41 -1.26 -0.57 119.36 125.61 1z8c n ILE 66 Ca -0.18 -3.69 0.00 0.00 1.00 0.00 0.00 62.75 59.88 1z8c n ILE 66 Cb 0.52 -0.54 0.00 0.00 -0.71 0.00 0.00 39.64 38.91 1z8c n ILE 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1z8c n GLY 68 N -0.74 0.00 3.66 7.39 0.00 -1.26 -4.72 105.19 109.52 1z8c n GLY 68 Ca 0.32 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.98 1z8c n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1z8c s HIS 69 N 0.00 3.31 -0.21 1.61 4.02 -1.26 -5.08 115.29 117.68 1z8c s HIS 69 Ca 0.00 0.20 -0.14 0.00 1.02 0.00 0.00 55.06 56.14 1z8c s HIS 69 Cb 0.00 -2.25 -0.04 0.00 -1.02 0.00 0.00 32.58 29.27 1z8c s HIS 69 CO 0.00 0.07 0.32 0.15 1.02 0.00 0.00 174.74 176.30 1z8c s LYS 70 N 0.97 4.16 0.20 1.40 1.02 -1.26 -4.34 119.74 121.90 1z8c s LYS 70 Ca 0.07 0.06 0.01 0.00 0.02 0.00 0.00 55.97 56.13 1z8c s LYS 70 Cb -0.13 -3.52 -0.05 0.00 -0.52 0.00 0.00 37.83 33.61 1z8c s LYS 70 CO 0.04 0.03 0.05 0.14 -0.92 0.00 0.00 175.35 174.68 1z8c s VAL 71 N 1.11 0.57 -0.05 3.17 -7.23 -0.21 -5.00 120.40 112.77 1z8c s VAL 71 Ca 0.16 -1.99 0.01 0.00 -1.81 0.00 0.00 61.98 58.35 1z8c s VAL 71 Cb -0.14 -2.33 0.02 0.00 0.56 0.00 0.00 36.38 34.49 1z8c s VAL 71 CO 0.06 -0.27 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.91 1z8c s ILE 72 N -3.74 0.54 0.14 -0.62 1.01 -1.26 -0.39 121.20 116.88 1z8c s ILE 72 Ca 0.30 -0.12 -0.15 0.00 0.00 0.00 0.00 60.65 60.68 1z8c s ILE 72 Cb 0.07 -0.57 0.05 0.00 0.01 0.00 0.00 42.46 42.02 1z8c s ILE 72 CO 0.08 0.23 0.71 0.61 0.00 0.00 0.00 174.94 176.57 1z8c n GLY 73 N 4.10 0.84 3.73 6.18 0.00 -0.74 -4.86 105.19 114.43 1z8c n GLY 73 Ca -0.24 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.29 1z8c n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1z8c s THR 74 N -2.22 4.71 -0.06 2.61 2.01 -1.26 -1.19 115.64 120.24 1z8c s THR 74 Ca 0.16 1.87 0.06 0.00 0.31 0.00 0.00 61.69 64.08 1z8c s THR 74 Cb -0.02 -4.23 -0.01 0.00 0.01 0.00 0.00 72.50 68.25 1z8c s THR 74 CO 0.04 0.29 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.32 1z8c s VAL 75 N 0.29 2.05 -0.22 3.82 1.01 0.19 -4.54 120.40 123.00 1z8c s VAL 75 Ca 0.44 -1.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 1z8c s VAL 75 Cb -0.21 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1z8c s VAL 75 CO 0.26 0.57 0.02 -0.76 0.00 0.00 0.00 175.10 175.19 1z8c s LEU 76 N -0.11 3.32 -0.14 3.92 1.43 -0.33 -0.99 118.68 125.78 1z8c s LEU 76 Ca -0.05 -0.20 -0.05 0.00 -1.03 0.00 0.00 54.13 52.79 1z8c s LEU 76 Cb -0.14 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 1z8c s LEU 76 CO 0.04 0.03 0.06 -0.69 0.23 0.00 0.00 176.35 176.02 1z8c s VAL 77 N 1.20 4.77 -0.29 -1.59 1.01 -0.00 0.22 120.40 125.72 1z8c s VAL 77 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1z8c s VAL 77 Cb -0.14 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.15 1z8c s VAL 77 CO 0.02 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1z8c n GLY 78 N 2.76 -0.93 2.24 4.51 0.00 -0.22 -0.05 105.19 113.50 1z8c n GLY 78 Ca -0.18 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.79 1z8c n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1z8c n PRO 79 N 0.00 3.24 -3.55 1.61 -0.04 -1.26 -4.29 135.00 130.71 1z8c n PRO 79 Ca 0.00 -1.88 -0.38 0.00 -0.04 0.00 0.00 63.50 61.20 1z8c n PRO 79 Cb 0.00 -2.59 -0.06 0.00 -0.04 0.00 0.00 33.50 30.81 1z8c n PRO 79 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1z8c s THR 80 N 1.91 5.14 0.39 0.52 -1.32 -1.26 -4.96 115.64 116.06 1z8c s THR 80 Ca 0.68 0.72 0.33 0.00 -1.21 0.00 0.00 61.69 62.22 1z8c s THR 80 Cb 0.21 -3.66 0.36 0.00 -1.51 0.00 0.00 72.50 67.90 1z8c s THR 80 CO -0.04 0.55 2.12 -0.65 -2.21 0.00 0.00 174.62 174.39 1z8c h PRO 81 N 5.04 0.00 -2.73 7.08 0.11 -1.99 -3.45 132.00 136.07 1z8c h PRO 81 Ca -0.51 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.50 1z8c h PRO 81 Cb 1.21 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.13 1z8c h PRO 81 CO 0.63 0.06 -0.14 -0.08 -0.21 0.00 0.00 178.00 178.26 1z8c s THR 82 N -4.04 0.04 0.29 -1.15 -1.32 -1.26 -5.13 115.64 103.07 1z8c s THR 82 Ca -0.02 -0.33 -0.29 0.00 -1.21 0.00 0.00 61.69 59.84 1z8c s THR 82 Cb 0.12 -0.73 -0.10 0.00 -1.51 0.00 0.00 72.50 70.28 1z8c s THR 82 CO 0.53 -0.18 1.34 0.20 -2.21 0.00 0.00 174.62 174.30 1z8c s ASN 83 N -1.26 6.76 -0.07 8.08 0.01 -1.26 -4.86 114.94 122.33 1z8c s ASN 83 Ca -0.13 2.64 0.01 0.00 -0.71 0.00 0.00 52.86 54.67 1z8c s ASN 83 Cb -0.04 -2.64 0.02 0.00 0.41 0.00 0.00 41.25 39.01 1z8c s ASN 83 CO 0.06 -0.58 -0.08 -0.69 -1.51 0.00 0.00 177.10 174.30 1z8c s VAL 84 N -0.66 0.88 -0.43 1.60 1.01 -0.15 -1.08 120.40 121.58 1z8c s VAL 84 Ca 0.53 -0.28 -0.17 0.00 0.00 0.00 0.00 61.98 62.06 1z8c s VAL 84 Cb -0.40 -0.87 0.02 0.00 0.00 0.00 0.00 36.38 35.14 1z8c s VAL 84 CO 0.48 0.32 0.43 -0.63 0.00 0.00 0.00 175.10 175.70 1z8c s ILE 85 N 1.14 5.10 0.76 2.22 -1.09 0.92 -0.87 121.20 129.38 1z8c s ILE 85 Ca -0.07 -0.41 -0.06 0.00 -2.23 0.00 0.00 60.65 57.88 1z8c s ILE 85 Cb -0.14 -4.04 0.16 0.00 -1.58 0.00 0.00 42.46 36.86 1z8c s ILE 85 CO -0.01 -0.44 1.04 0.61 -1.23 0.00 0.00 174.94 174.91 1z8c n GLY 86 N 5.12 -0.22 0.32 6.18 0.00 -1.15 -1.30 105.19 114.14 1z8c n GLY 86 Ca -0.08 -1.89 0.18 0.00 0.00 0.00 0.00 46.02 44.23 1z8c n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1z8c h ARG 87 N 0.00 0.00 -0.01 1.61 3.08 -0.90 -1.13 114.38 117.03 1z8c h ARG 87 Ca -0.34 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.66 1z8c h ARG 87 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 1z8c h ARG 87 CO 0.31 0.00 -0.21 -2.95 -1.07 0.00 0.00 179.97 176.05 1z8c h ASN 88 N 0.00 0.02 0.00 7.04 -1.07 -1.77 -2.55 115.58 117.25 1z8c h ASN 88 Ca 0.00 -0.00 -0.22 0.00 0.07 0.00 0.00 56.30 56.14 1z8c h ASN 88 Cb 0.00 -0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.20 1z8c h ASN 88 CO -0.00 0.23 -2.06 0.18 0.07 0.00 0.00 177.43 175.85 1z8c n LEU 89 N -4.28 0.00 -0.16 6.14 4.77 -0.64 -4.20 117.00 118.62 1z8c n LEU 89 Ca -0.02 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.95 1z8c n LEU 89 Cb 0.27 0.30 0.24 0.00 -2.33 0.00 0.00 43.42 41.90 1z8c n LEU 89 CO 0.37 0.30 1.12 -0.07 -1.33 0.00 0.00 177.39 177.78 1z8c h LEU 90 N 0.00 0.79 -0.84 2.23 3.38 -1.21 -2.14 115.31 117.51 1z8c h LEU 90 Ca -0.33 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.47 1z8c h LEU 90 Cb 1.71 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.24 1z8c h LEU 90 CO 0.02 0.66 -0.13 0.71 0.09 0.00 0.00 178.44 179.78 1z8c h THR 91 N 0.88 1.26 0.00 0.22 1.35 -1.65 -1.55 112.91 113.42 1z8c h THR 91 Ca 0.22 -1.18 -0.02 0.00 -0.55 0.00 0.00 66.41 64.89 1z8c h THR 91 Cb 0.06 1.10 -0.00 0.00 -1.73 0.00 0.00 68.15 67.58 1z8c h THR 91 CO -0.03 0.40 -0.09 1.56 -0.25 0.00 0.00 175.52 177.11 1z8c h GLN 92 N 0.65 0.00 -0.49 4.72 1.08 -1.56 -1.79 115.11 117.71 1z8c h GLN 92 Ca 0.11 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 1z8c h GLN 92 Cb 0.60 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1z8c h GLN 92 CO 0.04 0.09 0.00 0.44 -0.95 0.00 0.00 178.83 178.45 1z8c n ILE 93 N -3.70 0.65 -2.11 2.54 -5.35 -1.06 -4.94 119.36 105.39 1z8c n ILE 93 Ca -0.02 -0.79 -0.09 0.00 -0.27 0.00 0.00 62.75 61.59 1z8c n ILE 93 Cb 0.20 0.72 -0.01 0.00 -1.74 0.00 0.00 39.64 38.81 1z8c n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1z8c n GLY 94 N 1.52 0.08 3.71 3.28 0.00 -0.67 -5.01 105.19 108.09 1z8c n GLY 94 Ca 0.21 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1z8c n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z8c s THR 96 N 0.97 1.60 -0.14 0.00 -4.23 -1.26 -4.67 115.64 107.92 1z8c s THR 96 Ca 0.54 -2.16 -0.09 0.00 -1.18 0.00 0.00 61.69 58.79 1z8c s THR 96 Cb -0.23 -2.13 -0.05 0.00 1.34 0.00 0.00 72.50 71.43 1z8c s THR 96 CO 0.28 -0.53 0.18 -0.76 -0.54 0.00 0.00 174.62 173.26 1z8c s LEU 97 N -3.33 4.33 -0.00 4.79 1.43 -1.26 -5.09 118.68 119.55 1z8c s LEU 97 Ca 0.24 0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.81 1z8c s LEU 97 Cb 0.01 -2.16 -0.00 0.00 0.03 0.00 0.00 46.19 44.06 1z8c s LEU 97 CO 0.07 0.30 -0.05 0.20 0.23 0.00 0.00 176.35 177.10 1z8c s ASN 98 N -0.46 0.59 0.00 2.29 0.01 -1.26 -5.28 114.94 110.83 1z8c s ASN 98 Ca 0.14 -0.09 0.00 0.00 -0.71 0.00 0.00 52.86 52.20 1z8c s ASN 98 Cb -0.12 -0.07 0.00 0.00 0.41 0.00 0.00 41.25 41.47 1z8c s ASN 98 CO 0.03 0.06 0.00 2.22 -1.51 0.00 0.00 177.10 177.90