#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1syg s LEU 7 N 0.00 3.56 -0.04 -0.35 1.43 -1.26 -5.06 118.68 116.96 1syg s LEU 7 Ca 0.00 2.31 -0.10 0.00 -1.03 0.00 0.00 54.13 55.31 1syg s LEU 7 Cb 0.00 -4.59 0.02 0.00 0.03 0.00 0.00 46.19 41.65 1syg s LEU 7 CO 0.00 -1.71 0.23 -1.38 0.23 0.00 0.00 176.35 173.72 1syg s HIS 8 N -1.80 -0.14 0.22 0.29 -3.43 -1.26 -5.13 115.29 104.05 1syg s HIS 8 Ca 0.75 0.28 -0.16 0.00 -0.80 0.00 0.00 55.06 55.12 1syg s HIS 8 Cb -0.28 0.05 -0.08 0.00 -1.43 0.00 0.00 32.58 30.84 1syg s HIS 8 CO 0.36 -0.26 0.66 0.15 -2.00 0.00 0.00 174.74 173.65 1syg s LYS 9 N -0.82 4.08 0.02 -0.38 1.02 -1.26 -4.47 119.74 117.93 1syg s LYS 9 Ca -0.09 0.66 0.04 0.00 0.02 0.00 0.00 55.97 56.61 1syg s LYS 9 Cb -0.05 -2.77 -0.02 0.00 -0.52 0.00 0.00 37.83 34.48 1syg s LYS 9 CO 0.02 0.36 -0.13 -1.21 -0.92 0.00 0.00 175.35 173.46 1syg s GLU 10 N -2.28 0.98 0.61 1.68 2.02 -0.03 -4.94 118.70 116.74 1syg s GLU 10 Ca 0.44 -0.62 -0.16 0.00 0.02 0.00 0.00 54.97 54.65 1syg s GLU 10 Cb -0.14 -0.96 -0.03 0.00 0.10 0.00 0.00 34.13 33.10 1syg s GLU 10 CO 0.20 0.25 1.10 -1.25 0.02 0.00 0.00 175.26 175.58 1syg s PRO 11 N -0.76 3.08 0.24 0.39 0.04 -1.26 -0.47 135.00 136.27 1syg s PRO 11 Ca 0.03 1.40 -0.13 0.00 0.04 0.00 0.00 61.00 62.35 1syg s PRO 11 Cb -0.07 -1.99 -0.00 0.00 0.04 0.00 0.00 34.50 32.48 1syg s PRO 11 CO 0.00 -1.03 0.46 0.00 0.04 0.00 0.00 177.00 176.48 1syg s ALA 12 N -2.21 -0.23 -0.06 8.56 0.00 -0.84 -4.64 121.76 122.34 1syg s ALA 12 Ca 0.68 -0.87 0.02 0.00 0.00 0.00 0.00 51.96 51.78 1syg s ALA 12 Cb -0.20 1.06 0.02 0.00 0.00 0.00 0.00 23.12 24.00 1syg s ALA 12 CO 0.36 -0.84 -0.11 0.99 0.00 0.00 0.00 175.76 176.17 1syg s THR 13 N -4.01 1.01 0.31 0.00 2.01 -0.63 -4.22 115.64 110.10 1syg s THR 13 Ca 0.22 -0.40 -0.29 0.00 0.31 0.00 0.00 61.69 61.53 1syg s THR 13 Cb -0.00 -0.95 -0.11 0.00 0.01 0.00 0.00 72.50 71.46 1syg s THR 13 CO 0.08 0.33 1.44 -0.22 -0.69 0.00 0.00 174.62 175.56 1syg s LEU 14 N 0.74 4.38 -0.06 4.42 2.96 -1.26 -0.06 118.68 129.79 1syg s LEU 14 Ca -0.13 2.80 -0.04 0.00 -0.22 0.00 0.00 54.13 56.54 1syg s LEU 14 Cb -0.15 -3.64 -0.03 0.00 0.50 0.00 0.00 46.19 42.86 1syg s LEU 14 CO 0.03 -0.73 -0.10 -0.38 -1.32 0.00 0.00 176.35 173.85 1syg n ILE 15 N 1.46 0.58 -3.64 6.68 5.41 -0.62 -4.80 119.36 124.43 1syg n ILE 15 Ca 0.04 -0.04 -0.07 0.00 1.00 0.00 0.00 62.75 63.68 1syg n ILE 15 Cb 0.40 -1.64 -0.07 0.00 -0.71 0.00 0.00 39.64 37.62 1syg n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1syg s LYS 16 N -2.16 0.58 -0.14 0.38 2.20 -0.97 -5.02 119.74 114.61 1syg s LYS 16 Ca -0.11 0.86 -0.24 0.00 -0.36 0.00 0.00 55.97 56.13 1syg s LYS 16 Cb 0.04 0.19 -0.02 0.00 -1.51 0.00 0.00 37.83 36.52 1syg s LYS 16 CO 0.14 -0.10 0.75 0.00 -0.36 0.00 0.00 175.35 175.78 1syg s ALA 17 N 1.01 3.45 -0.24 3.13 0.00 -1.26 -0.07 121.76 127.77 1syg s ALA 17 Ca -0.05 0.02 -0.17 0.00 0.00 0.00 0.00 51.96 51.76 1syg s ALA 17 Cb -0.05 -3.09 -0.15 0.00 0.00 0.00 0.00 23.12 19.84 1syg s ALA 17 CO -0.12 -0.44 -0.10 -0.89 0.00 0.00 0.00 175.76 174.21 1syg n ILE 18 N 4.39 1.53 -4.07 0.00 2.08 -0.50 -4.93 119.36 117.85 1syg n ILE 18 Ca 0.02 -0.19 -0.14 0.00 0.56 0.00 0.00 62.75 63.00 1syg n ILE 18 Cb 0.50 -1.99 -0.04 0.00 -0.75 0.00 0.00 39.64 37.36 1syg n ILE 18 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1syg s ASP 19 N -7.09 0.87 0.44 4.38 -1.08 -0.14 -4.97 116.67 109.09 1syg s ASP 19 Ca -0.33 -1.47 0.12 0.00 -0.52 0.00 0.00 52.55 50.35 1syg s ASP 19 Cb 0.10 0.68 1.01 0.00 -1.46 0.00 0.00 42.92 43.25 1syg s ASP 19 CO 0.52 -1.33 2.04 1.23 0.52 0.00 0.00 175.17 178.15 1syg h GLY 20 N 2.10 0.46 -1.02 2.66 0.00 -1.84 -2.89 103.07 102.54 1syg h GLY 20 Ca -0.28 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1syg h GLY 20 CO 0.39 0.13 0.00 2.09 0.00 0.00 0.00 176.54 179.14 1syg n ASP 21 N -4.48 2.57 -3.87 0.19 5.68 -1.26 -4.76 116.55 110.61 1syg n ASP 21 Ca 0.05 -1.86 -0.18 0.00 -0.50 0.00 0.00 54.79 52.30 1syg n ASP 21 Cb 0.21 -0.15 -0.16 0.00 -1.14 0.00 0.00 41.12 39.87 1syg n ASP 21 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1syg s THR 22 N -0.95 0.37 0.00 2.12 2.01 -1.09 -1.18 115.64 116.92 1syg s THR 22 Ca 0.18 -0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.14 1syg s THR 22 Cb 0.10 -0.42 -0.00 0.00 0.01 0.00 0.00 72.50 72.19 1syg s THR 22 CO 0.13 0.18 -0.03 0.68 -0.69 0.00 0.00 174.62 174.89 1syg s VAL 23 N 0.83 0.25 -0.19 3.82 -7.23 -0.79 -0.96 120.40 116.13 1syg s VAL 23 Ca -0.10 -0.20 -0.15 0.00 -1.81 0.00 0.00 61.98 59.72 1syg s VAL 23 Cb -0.13 -0.23 -0.04 0.00 0.56 0.00 0.00 36.38 36.54 1syg s VAL 23 CO -0.01 0.02 0.36 -0.75 -0.31 0.00 0.00 175.10 174.41 1syg s LYS 24 N -0.20 4.20 0.14 4.82 2.47 0.89 -0.42 119.74 131.65 1syg s LYS 24 Ca -0.00 0.15 0.03 0.00 -1.56 0.00 0.00 55.97 54.59 1syg s LYS 24 Cb -0.02 -3.50 -0.04 0.00 -1.46 0.00 0.00 37.83 32.81 1syg s LYS 24 CO -0.00 0.06 -0.06 -0.51 0.16 0.00 0.00 175.35 175.00 1syg s LEU 25 N 1.00 2.41 -0.45 5.43 1.43 0.64 -1.58 118.68 127.56 1syg s LEU 25 Ca 0.18 -1.06 -0.16 0.00 -1.03 0.00 0.00 54.13 52.06 1syg s LEU 25 Cb -0.14 -0.16 0.04 0.00 0.03 0.00 0.00 46.19 45.96 1syg s LEU 25 CO 0.07 -0.45 0.39 -0.32 0.23 0.00 0.00 176.35 176.26 1syg s MET 26 N -3.83 3.00 -0.20 1.70 -2.45 0.91 -0.04 119.30 118.39 1syg s MET 26 Ca 0.17 -1.11 -0.01 0.00 -1.25 0.00 0.00 55.69 53.49 1syg s MET 26 Cb 0.05 -4.05 0.01 0.00 1.25 0.00 0.00 34.83 32.08 1syg s MET 26 CO -0.00 -0.92 -0.12 -0.47 1.05 0.00 0.00 175.02 174.55 1syg s TYR 27 N 1.81 2.87 -1.29 4.11 5.04 -0.08 -1.61 117.35 128.20 1syg s TYR 27 Ca 0.06 -1.33 -0.03 0.00 -2.44 0.00 0.00 57.07 53.34 1syg s TYR 27 Cb -0.21 -2.01 -0.00 0.00 0.35 0.00 0.00 41.96 40.09 1syg s TYR 27 CO 0.09 -0.69 0.66 1.63 -1.34 0.00 0.00 175.55 175.91 1syg n LYS 28 N 4.70 -4.03 -1.45 4.97 5.02 -1.26 -1.93 118.16 124.17 1syg n LYS 28 Ca -0.20 0.57 -0.14 0.00 -2.02 0.00 0.00 58.31 56.52 1syg n LYS 28 Cb 0.50 -4.95 -0.06 0.00 -0.02 0.00 0.00 35.03 30.50 1syg n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1syg n GLY 29 N -1.65 1.40 3.08 0.72 0.00 -1.26 -4.99 105.19 102.49 1syg n GLY 29 Ca -0.27 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 1syg n GLY 29 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1syg s GLN 30 N -3.28 0.23 0.31 1.61 -2.07 -0.81 -5.14 119.66 110.51 1syg s GLN 30 Ca 0.00 0.52 -0.29 0.00 -1.82 0.00 0.00 55.36 53.77 1syg s GLN 30 Cb 0.00 -0.08 -0.10 0.00 -1.09 0.00 0.00 33.01 31.73 1syg s GLN 30 CO 0.00 -0.15 1.40 -1.25 -1.32 0.00 0.00 175.29 173.98 1syg s PRO 31 N 1.12 4.26 -0.03 9.60 0.04 -1.26 -0.91 135.00 147.83 1syg s PRO 31 Ca -0.08 2.34 -0.11 0.00 0.04 0.00 0.00 61.00 63.19 1syg s PRO 31 Cb -0.09 -3.06 0.02 0.00 0.04 0.00 0.00 34.50 31.41 1syg s PRO 31 CO -0.08 -0.36 0.24 -1.64 0.04 0.00 0.00 177.00 175.21 1syg s MET 32 N -1.36 0.53 -0.19 4.56 -1.94 0.94 -4.90 119.30 116.94 1syg s MET 32 Ca 0.54 -0.14 -0.13 0.00 -1.71 0.00 0.00 55.69 54.25 1syg s MET 32 Cb -0.42 0.23 -0.05 0.00 2.01 0.00 0.00 34.83 36.60 1syg s MET 32 CO 0.52 -0.13 0.25 0.99 -0.01 0.00 0.00 175.02 176.64 1syg s THR 33 N -1.03 5.32 -0.08 2.05 2.01 -1.26 -0.26 115.64 122.38 1syg s THR 33 Ca -0.11 0.44 0.01 0.00 0.31 0.00 0.00 61.69 62.34 1syg s THR 33 Cb -0.05 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.84 1syg s THR 33 CO 0.03 0.37 -0.11 -0.36 -0.69 0.00 0.00 174.62 173.86 1syg s PHE 34 N 0.67 2.82 -0.21 4.92 0.40 0.44 -0.62 117.98 126.40 1syg s PHE 34 Ca 0.14 -0.24 -0.06 0.00 -0.60 0.00 0.00 56.93 56.16 1syg s PHE 34 Cb -0.13 -1.74 -0.03 0.00 0.51 0.00 0.00 43.02 41.64 1syg s PHE 34 CO 0.03 0.10 0.02 0.50 0.70 0.00 0.00 175.22 176.58 1syg s ARG 35 N -0.38 3.64 0.01 0.44 6.06 0.55 -1.89 118.95 127.38 1syg s ARG 35 Ca 0.05 -0.50 -0.30 0.00 -2.50 0.00 0.00 55.73 52.47 1syg s ARG 35 Cb -0.12 -3.16 -0.06 0.00 0.06 0.00 0.00 34.95 31.66 1syg s ARG 35 CO 0.02 -0.04 1.56 -0.51 -2.50 0.00 0.00 175.30 173.83 1syg s LEU 36 N 1.17 4.33 0.62 -0.88 1.02 -0.32 -2.86 118.68 121.76 1syg s LEU 36 Ca 0.03 2.27 -0.18 0.00 0.02 0.00 0.00 54.13 56.27 1syg s LEU 36 Cb -0.14 -3.55 -0.02 0.00 0.02 0.00 0.00 46.19 42.49 1syg s LEU 36 CO 0.02 -0.84 1.24 -0.76 0.02 0.00 0.00 176.35 176.04 1syg s LEU 37 N 2.95 3.61 -0.90 1.79 1.43 -0.44 -3.92 118.68 123.19 1syg s LEU 37 Ca 0.70 2.49 -0.02 0.00 -1.03 0.00 0.00 54.13 56.26 1syg s LEU 37 Cb -0.35 -4.61 0.02 0.00 0.03 0.00 0.00 46.19 41.28 1syg s LEU 37 CO 0.29 -1.80 0.11 0.18 0.23 0.00 0.00 176.35 175.36 1syg n LEU 38 N -1.78 -1.01 -4.00 1.79 4.77 -1.26 -4.96 117.00 110.56 1syg n LEU 38 Ca 0.15 0.12 -0.11 0.00 -0.03 0.00 0.00 56.01 56.13 1syg n LEU 38 Cb 0.49 -1.91 -0.12 0.00 -2.33 0.00 0.00 43.42 39.55 1syg n LEU 38 CO 0.46 -0.04 -0.38 -0.69 -1.33 0.00 0.00 177.39 175.41 1syg s VAL 39 N -2.57 0.27 -0.28 4.08 1.01 -1.25 -2.03 120.40 119.62 1syg s VAL 39 Ca 0.09 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 1syg s VAL 39 Cb -0.05 -0.36 0.09 0.00 0.00 0.00 0.00 36.38 36.06 1syg s VAL 39 CO 0.12 -0.37 0.09 -1.81 0.00 0.00 0.00 175.10 173.12 1syg s ASP 40 N -1.28 3.68 0.12 3.32 1.01 0.84 -4.57 116.67 119.79 1syg s ASP 40 Ca -0.11 -1.38 -0.02 0.00 0.71 0.00 0.00 52.55 51.74 1syg s ASP 40 Cb -0.09 -0.69 -0.05 0.00 1.01 0.00 0.00 42.92 43.11 1syg s ASP 40 CO -0.00 -0.40 0.32 0.42 0.21 0.00 0.00 175.17 175.72 1syg s THR 41 N 1.78 5.26 0.29 -1.27 -4.23 -1.26 -1.43 115.64 114.78 1syg s THR 41 Ca 0.07 -0.19 -0.30 0.00 -1.18 0.00 0.00 61.69 60.09 1syg s THR 41 Cb -0.17 -3.64 -0.11 0.00 1.34 0.00 0.00 72.50 69.92 1syg s THR 41 CO -0.24 0.04 1.53 -2.84 -0.54 0.00 0.00 174.62 172.57 1syg s PRO 42 N -2.72 4.16 0.24 3.99 0.02 -1.26 -4.94 135.00 134.49 1syg s PRO 42 Ca 0.38 2.50 -0.04 0.00 0.02 0.00 0.00 61.00 63.86 1syg s PRO 42 Cb -0.12 -3.04 -0.05 0.00 0.02 0.00 0.00 34.50 31.31 1syg s PRO 42 CO 0.27 -0.55 0.48 -1.21 -0.33 0.00 0.00 177.00 175.65 1syg s GLU 43 N -0.73 3.61 -0.14 5.54 2.02 -1.26 -4.27 118.70 123.47 1syg s GLU 43 Ca 0.60 -0.10 0.06 0.00 0.02 0.00 0.00 54.97 55.55 1syg s GLU 43 Cb -0.46 -2.74 -0.13 0.00 0.10 0.00 0.00 34.13 30.91 1syg s GLU 43 CO 0.49 0.32 -0.05 0.25 0.02 0.00 0.00 175.26 176.29 1syg n THR 44 N -0.65 0.87 -2.93 3.63 -2.24 -1.26 -1.10 114.28 110.60 1syg n THR 44 Ca -0.03 -0.43 -0.36 0.00 -2.27 0.00 0.00 64.05 60.96 1syg n THR 44 Cb 0.53 -0.86 -0.01 0.00 -2.10 0.00 0.00 70.33 67.89 1syg n THR 44 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1syg n LYS 45 N -2.70 4.20 -3.45 -0.78 5.02 -1.26 -4.28 118.16 114.91 1syg n LYS 45 Ca -0.24 -4.70 -0.37 0.00 -2.02 0.00 0.00 58.31 50.98 1syg n LYS 45 Cb 0.85 -2.39 -0.06 0.00 -0.02 0.00 0.00 35.03 33.41 1syg n LYS 45 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1syg s HIS 46 N -3.48 3.52 0.08 2.13 2.46 -1.26 -5.00 115.29 113.74 1syg s HIS 46 Ca 0.40 0.76 -0.35 0.00 0.47 0.00 0.00 55.06 56.35 1syg s HIS 46 Cb 0.18 -2.41 -0.17 0.00 -0.13 0.00 0.00 32.58 30.05 1syg s HIS 46 CO -0.06 0.27 1.54 -1.35 -2.47 0.00 0.00 174.74 172.67 1syg h PRO 47 N 6.41 -0.94 -5.84 2.88 0.11 -1.97 -3.41 132.00 129.23 1syg h PRO 47 Ca -0.43 0.06 -0.68 0.00 0.11 0.00 0.00 66.00 65.07 1syg h PRO 47 Cb 1.18 0.21 -0.12 0.00 0.11 0.00 0.00 31.00 32.38 1syg h PRO 47 CO 0.73 -0.63 -0.57 -1.59 -0.21 0.00 0.00 178.00 175.74 1syg s LYS 48 N -5.74 3.16 0.00 1.05 -2.85 -1.26 -4.94 119.74 109.16 1syg s LYS 48 Ca -0.17 -0.31 0.00 0.00 -1.00 0.00 0.00 55.97 54.49 1syg s LYS 48 Cb 0.04 -2.94 0.00 0.00 -2.06 0.00 0.00 37.83 32.87 1syg s LYS 48 CO 0.58 0.72 0.00 1.17 0.10 0.00 0.00 175.35 177.92 1syg n LYS 49 N 2.11 0.00 0.00 1.78 4.81 -1.26 -5.07 118.16 120.53 1syg n LYS 49 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.25 1syg n LYS 49 Cb 0.54 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.59 1syg n LYS 49 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1syg n GLY 50 N -0.40 -1.63 3.50 3.14 0.00 -1.26 -4.36 105.19 104.17 1syg n GLY 50 Ca 0.00 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 1syg n GLY 50 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1syg n VAL 51 N -1.44 0.02 -1.39 1.61 0.31 -1.26 -4.79 118.33 111.38 1syg n VAL 51 Ca 0.00 -0.37 -0.32 0.00 -0.01 0.00 0.00 64.34 63.64 1syg n VAL 51 Cb 0.00 -1.67 0.08 0.00 -0.91 0.00 0.00 33.84 31.34 1syg n VAL 51 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1syg s GLU 52 N 7.95 2.40 0.26 5.55 2.02 -0.26 -4.93 118.70 131.69 1syg s GLU 52 Ca 1.14 1.22 -0.31 0.00 0.02 0.00 0.00 54.97 57.05 1syg s GLU 52 Cb -0.75 -1.91 -0.12 0.00 0.10 0.00 0.00 34.13 31.45 1syg s GLU 52 CO 0.41 -1.54 1.65 1.17 0.02 0.00 0.00 175.26 176.97 1syg n LYS 53 N -3.24 2.75 -0.90 1.61 3.00 -1.26 -1.23 118.16 118.89 1syg n LYS 53 Ca 0.09 0.98 0.00 0.00 -0.00 0.00 0.00 58.31 59.39 1syg n LYS 53 Cb 0.53 -2.79 0.00 0.00 0.00 0.00 0.00 35.03 32.76 1syg n LYS 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1syg n TYR 54 N 2.88 0.00 0.16 5.64 4.01 -1.26 -4.74 117.16 123.84 1syg n TYR 54 Ca 0.11 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.72 1syg n TYR 54 Cb 0.36 -0.35 -0.07 0.00 -0.31 0.00 0.00 39.34 38.97 1syg n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1syg h GLY 55 N 0.00 -0.36 0.76 2.72 0.00 -1.35 -1.59 103.07 103.26 1syg h GLY 55 Ca 0.00 0.15 0.08 0.00 0.00 0.00 0.00 47.33 47.55 1syg h GLY 55 CO 0.00 -0.14 0.60 -2.55 0.00 0.00 0.00 176.54 174.45 1syg h PRO 56 N -0.35 1.00 -0.11 4.80 0.11 -1.87 -1.89 132.00 133.68 1syg h PRO 56 Ca -0.03 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1syg h PRO 56 Cb 0.28 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 31.16 1syg h PRO 56 CO 0.03 0.66 0.04 0.93 -0.21 0.00 0.00 178.00 179.45 1syg h GLU 57 N 1.02 0.17 -0.73 1.05 3.07 -1.88 -1.28 114.58 116.01 1syg h GLU 57 Ca 0.42 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 59.21 1syg h GLU 57 Cb 0.27 -0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.12 1syg h GLU 57 CO -0.17 0.29 0.32 0.00 -1.40 0.00 0.00 179.01 178.05 1syg h ALA 58 N 0.87 1.19 -0.42 3.43 0.00 -0.97 0.42 119.26 123.78 1syg h ALA 58 Ca 0.04 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1syg h ALA 58 Cb 0.19 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1syg h ALA 58 CO -0.00 0.60 0.08 0.77 0.00 0.00 0.00 179.25 180.71 1syg h SER 59 N 1.05 0.66 -0.60 0.00 0.02 -1.18 -1.64 113.55 111.85 1syg h SER 59 Ca 0.25 -0.25 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1syg h SER 59 Cb 0.15 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1syg h SER 59 CO -0.03 0.74 0.06 0.00 -1.14 0.00 0.00 176.83 176.46 1syg h ALA 60 N 0.94 0.81 0.55 3.77 0.00 -0.85 -0.78 119.26 123.70 1syg h ALA 60 Ca 0.13 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1syg h ALA 60 Cb 0.35 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1syg h ALA 60 CO 0.01 0.59 -0.26 0.35 0.00 0.00 0.00 179.25 179.93 1syg h PHE 61 N 0.92 -0.68 -0.14 0.00 3.04 -0.73 0.72 116.94 120.08 1syg h PHE 61 Ca 0.18 -0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.12 1syg h PHE 61 Cb 0.47 0.23 -0.01 0.00 2.56 0.00 0.00 35.95 39.19 1syg h PHE 61 CO 0.03 -0.42 0.05 1.15 -2.02 0.00 0.00 178.31 177.11 1syg h THR 62 N -0.74 0.98 -0.05 4.41 2.02 -1.28 -1.39 112.91 116.86 1syg h THR 62 Ca -0.08 -0.04 0.04 0.00 0.77 0.00 0.00 66.41 67.10 1syg h THR 62 Cb 0.57 0.84 -0.05 0.00 -1.74 0.00 0.00 68.15 67.77 1syg h THR 62 CO 0.12 0.02 -0.24 0.50 0.37 0.00 0.00 175.52 176.29 1syg h LYS 63 N 0.12 -0.34 -0.29 6.66 3.64 -1.07 -1.18 116.57 124.11 1syg h LYS 63 Ca 0.06 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 1syg h LYS 63 Cb 0.03 0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.88 1syg h LYS 63 CO -0.06 -0.23 0.00 -0.22 -2.27 0.00 0.00 179.45 176.68 1syg h LYS 64 N -0.35 0.09 -0.44 1.90 1.63 -0.70 -0.93 116.57 117.75 1syg h LYS 64 Ca 0.08 -0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.88 1syg h LYS 64 Cb 0.46 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.04 1syg h LYS 64 CO -0.25 0.06 0.28 1.98 -3.45 0.00 0.00 179.45 178.06 1syg h MET 65 N 0.09 0.55 0.05 1.90 4.05 -0.77 -2.16 114.93 118.64 1syg h MET 65 Ca 0.14 -0.03 -0.23 0.00 -0.28 0.00 0.00 59.70 59.30 1syg h MET 65 Cb 0.18 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 30.85 1syg h MET 65 CO -0.23 0.36 -1.05 -0.39 0.23 0.00 0.00 176.91 175.83 1syg h VAL 66 N 0.56 1.56 -0.11 -5.77 -1.51 -1.02 -3.22 116.25 106.73 1syg h VAL 66 Ca 0.17 -3.01 -0.14 0.00 -1.23 0.00 0.00 66.70 62.49 1syg h VAL 66 Cb -0.03 2.76 -0.01 0.00 -2.13 0.00 0.00 31.29 31.88 1syg h VAL 66 CO -0.06 0.87 -0.54 -0.33 -1.23 0.00 0.00 177.57 176.29 1syg h GLU 67 N 0.07 0.32 -0.00 5.19 5.08 -1.06 -3.05 114.58 121.12 1syg h GLU 67 Ca -0.07 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1syg h GLU 67 Cb 1.76 0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.03 1syg h GLU 67 CO 0.16 0.78 -0.13 0.09 -1.00 0.00 0.00 179.01 178.91 1syg n ASN 68 N -3.93 0.61 -4.79 1.42 5.03 -0.82 -4.92 115.26 107.86 1syg n ASN 68 Ca -0.02 -0.68 -0.35 0.00 0.87 0.00 0.00 54.58 54.39 1syg n ASN 68 Cb 0.58 -0.03 -0.05 0.00 -1.02 0.00 0.00 39.78 39.26 1syg n ASN 68 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1syg s ALA 69 N -2.45 3.06 -0.03 5.41 0.00 -1.15 -4.98 121.76 121.62 1syg s ALA 69 Ca 0.29 0.58 0.06 0.00 0.00 0.00 0.00 51.96 52.88 1syg s ALA 69 Cb 0.20 -3.22 -0.24 0.00 0.00 0.00 0.00 23.12 19.85 1syg s ALA 69 CO 0.48 -0.07 0.71 0.87 0.00 0.00 0.00 175.76 177.74 1syg h LYS 70 N 2.33 0.09 -3.89 0.00 1.57 -1.91 -3.46 116.57 111.30 1syg h LYS 70 Ca -0.48 -0.16 -0.43 0.00 -1.87 0.00 0.00 60.65 57.70 1syg h LYS 70 Cb 1.20 0.06 -0.36 0.00 0.08 0.00 0.00 32.23 33.21 1syg h LYS 70 CO 0.62 0.79 -0.77 0.15 -0.57 0.00 0.00 179.45 179.66 1syg s LYS 71 N -2.61 0.80 -0.11 3.15 1.02 -1.26 -5.03 119.74 115.70 1syg s LYS 71 Ca -0.08 -0.02 -0.02 0.00 0.02 0.00 0.00 55.97 55.87 1syg s LYS 71 Cb 0.08 -0.98 -0.03 0.00 -0.52 0.00 0.00 37.83 36.38 1syg s LYS 71 CO 0.82 -0.20 -0.02 0.42 -0.92 0.00 0.00 175.35 175.44 1syg s ILE 72 N 1.49 4.07 0.03 2.17 -1.09 -1.26 -1.10 121.20 125.52 1syg s ILE 72 Ca -0.02 -0.32 0.03 0.00 -2.23 0.00 0.00 60.65 58.10 1syg s ILE 72 Cb -0.13 -2.73 -0.02 0.00 -1.58 0.00 0.00 42.46 38.00 1syg s ILE 72 CO -0.03 0.56 -0.08 -1.61 -1.23 0.00 0.00 174.94 172.55 1syg s GLU 73 N -0.41 0.57 0.08 2.79 2.02 -0.31 -1.99 118.70 121.45 1syg s GLU 73 Ca 0.07 -0.59 0.07 0.00 0.02 0.00 0.00 54.97 54.54 1syg s GLU 73 Cb -0.12 -0.45 -0.04 0.00 0.10 0.00 0.00 34.13 33.63 1syg s GLU 73 CO 0.02 0.10 -0.15 0.14 0.02 0.00 0.00 175.26 175.39 1syg s VAL 74 N -0.91 3.04 -0.22 2.63 -7.23 0.38 -0.70 120.40 117.39 1syg s VAL 74 Ca -0.04 -1.28 -0.04 0.00 -1.81 0.00 0.00 61.98 58.81 1syg s VAL 74 Cb -0.07 -2.36 0.07 0.00 0.56 0.00 0.00 36.38 34.58 1syg s VAL 74 CO 0.00 0.20 0.09 -0.70 -0.31 0.00 0.00 175.10 174.38 1syg s GLU 75 N -1.89 0.32 0.52 4.82 2.12 0.06 -0.85 118.70 123.81 1syg s GLU 75 Ca 0.18 -0.40 -0.18 0.00 0.36 0.00 0.00 54.97 54.93 1syg s GLU 75 Cb -0.11 -1.75 -0.07 0.00 0.26 0.00 0.00 34.13 32.47 1syg s GLU 75 CO 0.09 -0.79 1.02 -0.06 -0.54 0.00 0.00 175.26 174.99 1syg s PHE 76 N 2.00 3.13 0.00 5.30 0.08 -1.26 -0.73 117.98 126.49 1syg s PHE 76 Ca 0.04 1.53 0.00 0.00 0.12 0.00 0.00 56.93 58.62 1syg s PHE 76 Cb -0.16 -2.96 0.00 0.00 -0.57 0.00 0.00 43.02 39.32 1syg s PHE 76 CO -0.18 -0.75 0.00 -3.47 -0.10 0.00 0.00 175.22 170.72 1syg n ASP 77 N -1.45 0.00 0.16 1.36 -0.08 -1.26 -4.69 116.55 110.59 1syg n ASP 77 Ca 0.08 -0.52 0.11 0.00 -1.51 0.00 0.00 54.79 52.96 1syg n ASP 77 Cb 0.53 0.00 0.08 0.00 2.34 0.00 0.00 41.12 44.07 1syg n ASP 77 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1syg h LYS 78 N 0.00 0.00 0.00 -0.67 1.57 -1.94 -3.47 116.57 112.05 1syg h LYS 78 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1syg h LYS 78 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1syg h LYS 78 CO 0.00 0.03 0.00 0.41 -0.57 0.00 0.00 179.45 179.32 1syg n GLY 79 N 1.15 1.02 3.77 3.86 0.00 -1.25 -4.95 105.19 108.79 1syg n GLY 79 Ca 0.02 -1.53 -0.40 0.00 0.00 0.00 0.00 46.02 44.11 1syg n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1syg s GLN 80 N 0.46 4.02 0.00 1.61 -0.21 -1.24 -4.94 119.66 119.36 1syg s GLN 80 Ca 0.00 2.29 0.23 0.00 0.02 0.00 0.00 55.36 57.89 1syg s GLN 80 Cb 0.00 -2.84 0.11 0.00 1.00 0.00 0.00 33.01 31.28 1syg s GLN 80 CO 0.00 -0.49 1.17 0.54 -2.12 0.00 0.00 175.29 174.38 1syg n ARG 81 N 0.27 1.87 -3.88 2.91 1.74 -1.26 -4.79 116.66 113.51 1syg n ARG 81 Ca 0.03 -1.56 -0.11 0.00 -0.77 0.00 0.00 57.85 55.44 1syg n ARG 81 Cb 0.42 -1.45 -0.11 0.00 -1.02 0.00 0.00 32.46 30.30 1syg n ARG 81 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1syg s THR 82 N -2.09 0.06 0.41 0.55 -4.23 -1.26 -0.79 115.64 108.28 1syg s THR 82 Ca 0.24 -0.49 0.00 0.00 -1.18 0.00 0.00 61.69 60.25 1syg s THR 82 Cb 0.19 -0.29 0.08 0.00 1.34 0.00 0.00 72.50 73.82 1syg s THR 82 CO 0.38 -0.27 0.56 -0.90 -0.54 0.00 0.00 174.62 173.85 1syg n ASP 83 N 2.05 0.77 0.00 3.99 5.75 -0.21 -4.89 116.55 124.02 1syg n ASP 83 Ca -0.19 -1.65 0.04 0.00 -0.01 0.00 0.00 54.79 52.98 1syg n ASP 83 Cb 0.57 -0.36 0.19 0.00 -1.03 0.00 0.00 41.12 40.49 1syg n ASP 83 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1syg n LYS 84 N -2.03 0.02 -0.04 0.11 2.85 -1.26 -1.73 118.16 116.08 1syg n LYS 84 Ca 0.09 0.33 0.12 0.00 -1.05 0.00 0.00 58.31 57.80 1syg n LYS 84 Cb 0.33 -1.50 0.13 0.00 -0.65 0.00 0.00 35.03 33.34 1syg n LYS 84 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1syg n TYR 85 N -1.47 0.12 -0.56 5.58 4.01 -1.26 -4.95 117.16 118.62 1syg n TYR 85 Ca 0.02 -0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1syg n TYR 85 Cb 0.10 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 1syg n TYR 85 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1syg n GLY 86 N 1.37 0.75 3.73 2.72 0.00 -0.70 -5.05 105.19 108.00 1syg n GLY 86 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1syg n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1syg s ARG 87 N -0.44 4.49 0.38 1.61 0.52 -1.26 -4.71 118.95 119.55 1syg s ARG 87 Ca 0.00 1.07 -0.26 0.00 -0.52 0.00 0.00 55.73 56.02 1syg s ARG 87 Cb 0.00 -3.41 -0.09 0.00 0.52 0.00 0.00 34.95 31.97 1syg s ARG 87 CO 0.00 0.14 1.22 0.20 0.02 0.00 0.00 175.30 176.88 1syg s GLY 88 N 0.45 2.92 -0.33 -3.53 0.00 0.21 -1.04 107.32 106.00 1syg s GLY 88 Ca 0.41 1.08 -0.08 0.00 0.00 0.00 0.00 44.72 46.13 1syg s GLY 88 CO 0.22 1.64 0.13 1.08 0.00 0.00 0.00 173.10 176.17 1syg s LEU 89 N -2.30 4.22 0.29 0.66 1.43 0.03 -0.33 118.68 122.68 1syg s LEU 89 Ca 0.55 -0.85 -0.14 0.00 -1.03 0.00 0.00 54.13 52.66 1syg s LEU 89 Cb -0.34 -1.93 0.01 0.00 0.03 0.00 0.00 46.19 43.96 1syg s LEU 89 CO 0.44 -0.27 0.59 0.00 0.23 0.00 0.00 176.35 177.33 1syg s ALA 90 N 1.51 -0.42 -0.20 4.21 0.00 -1.13 -4.36 121.76 121.37 1syg s ALA 90 Ca 0.02 -0.81 -0.12 0.00 0.00 0.00 0.00 51.96 51.05 1syg s ALA 90 Cb -0.18 0.96 -0.05 0.00 0.00 0.00 0.00 23.12 23.85 1syg s ALA 90 CO 0.04 -0.91 0.21 0.71 0.00 0.00 0.00 175.76 175.81 1syg s TYR 91 N -3.58 3.40 -0.12 0.00 2.02 0.09 -1.33 117.35 117.83 1syg s TYR 91 Ca 0.20 0.42 -0.03 0.00 -0.37 0.00 0.00 57.07 57.28 1syg s TYR 91 Cb -0.03 -2.28 -0.03 0.00 -0.40 0.00 0.00 41.96 39.23 1syg s TYR 91 CO 0.11 0.20 0.00 0.42 -1.57 0.00 0.00 175.55 174.70 1syg s ILE 92 N 0.64 4.28 -0.09 2.71 -1.09 -1.26 -0.76 121.20 125.63 1syg s ILE 92 Ca 0.12 -0.24 0.04 0.00 -2.23 0.00 0.00 60.65 58.34 1syg s ILE 92 Cb -0.12 -2.84 -0.01 0.00 -1.58 0.00 0.00 42.46 37.91 1syg s ILE 92 CO 0.02 0.55 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.76 1syg s TYR 93 N -0.36 2.57 -0.28 3.97 1.51 0.12 0.19 117.35 125.08 1syg s TYR 93 Ca 0.07 -0.80 -0.01 0.00 -1.01 0.00 0.00 57.07 55.32 1syg s TYR 93 Cb -0.12 -1.69 0.04 0.00 -0.11 0.00 0.00 41.96 40.08 1syg s TYR 93 CO 0.02 -0.27 -0.03 0.00 -1.11 0.00 0.00 175.55 174.16 1syg s ALA 94 N 0.09 2.75 -1.46 3.71 0.00 0.35 -1.16 121.76 126.04 1syg s ALA 94 Ca -0.10 -1.66 -0.07 0.00 0.00 0.00 0.00 51.96 50.14 1syg s ALA 94 Cb -0.16 -1.82 0.05 0.00 0.00 0.00 0.00 23.12 21.20 1syg s ALA 94 CO 0.06 -1.10 0.70 -0.25 0.00 0.00 0.00 175.76 175.16 1syg n ASP 95 N 4.62 -2.17 0.00 0.00 8.00 -0.25 -0.63 116.55 126.12 1syg n ASP 95 Ca -0.14 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.45 1syg n ASP 95 Cb 0.44 -3.48 0.00 0.00 -0.02 0.00 0.00 41.12 38.07 1syg n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1syg n GLY 96 N -1.71 2.53 3.65 0.44 0.00 -1.26 -5.01 105.19 103.82 1syg n GLY 96 Ca -0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 1syg n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1syg s LYS 97 N -0.20 4.06 -0.13 1.61 1.02 0.20 -5.04 119.74 121.27 1syg s LYS 97 Ca 0.00 -0.22 -0.29 0.00 0.02 0.00 0.00 55.97 55.48 1syg s LYS 97 Cb 0.00 -3.57 -0.04 0.00 -0.52 0.00 0.00 37.83 33.71 1syg s LYS 97 CO 0.00 -0.01 1.55 1.41 -0.92 0.00 0.00 175.35 177.39 1syg s MET 98 N 1.25 4.09 0.34 1.68 -2.45 -1.26 -0.50 119.30 122.45 1syg s MET 98 Ca 0.09 1.92 0.03 0.00 -1.25 0.00 0.00 55.69 56.48 1syg s MET 98 Cb -0.14 -3.95 0.60 0.00 1.25 0.00 0.00 34.83 32.59 1syg s MET 98 CO 0.06 -0.94 1.93 0.28 1.05 0.00 0.00 175.02 177.40 1syg h VAL 99 N 5.71 1.18 -0.26 10.11 2.07 -0.62 -2.27 116.25 132.18 1syg h VAL 99 Ca -0.35 -0.56 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1syg h VAL 99 Cb 1.15 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1syg h VAL 99 CO 0.97 0.22 0.11 0.78 0.02 0.00 0.00 177.57 179.67 1syg h ASN 100 N 0.68 0.14 -0.35 0.57 4.21 -1.90 -2.30 115.58 116.63 1syg h ASN 100 Ca 0.17 0.02 -0.07 0.00 1.21 0.00 0.00 56.30 57.62 1syg h ASN 100 Cb 0.14 -0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.33 1syg h ASN 100 CO -0.02 0.12 -0.06 -0.08 -1.29 0.00 0.00 177.43 176.10 1syg h GLU 101 N 0.24 0.66 -0.66 0.81 4.22 -1.86 -3.06 114.58 114.92 1syg h GLU 101 Ca 0.11 -0.24 0.07 0.00 0.08 0.00 0.00 59.36 59.38 1syg h GLU 101 Cb 0.06 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 1syg h GLU 101 CO -0.10 0.81 0.35 0.00 -2.18 0.00 0.00 179.01 177.90 1syg h ALA 102 N 0.83 0.89 -0.45 2.92 0.00 -1.24 0.15 119.26 122.36 1syg h ALA 102 Ca 0.09 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1syg h ALA 102 Cb 0.55 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1syg h ALA 102 CO 0.03 0.01 0.29 -0.07 0.00 0.00 0.00 179.25 179.51 1syg h LEU 103 N 0.64 0.50 0.12 0.00 3.38 -1.40 -1.06 115.31 117.49 1syg h LEU 103 Ca 0.30 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 1syg h LEU 103 Cb 0.23 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1syg h LEU 103 CO -0.20 0.36 -0.06 0.58 0.09 0.00 0.00 178.44 179.21 1syg h VAL 104 N 0.60 1.01 -0.67 1.22 2.07 -1.32 0.18 116.25 119.34 1syg h VAL 104 Ca 0.17 -0.50 0.10 0.00 0.82 0.00 0.00 66.70 67.28 1syg h VAL 104 Cb -0.06 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1syg h VAL 104 CO -0.04 0.12 0.45 -0.09 0.02 0.00 0.00 177.57 178.02 1syg h ARG 105 N -0.39 0.50 -0.02 1.57 9.65 -0.55 0.14 114.38 125.27 1syg h ARG 105 Ca -0.02 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 1syg h ARG 105 Cb 0.32 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.78 1syg h ARG 105 CO 0.03 0.33 0.00 1.04 2.80 0.00 0.00 179.97 184.17 1syg n GLN 106 N -4.48 1.28 -2.08 0.20 1.13 -0.42 -4.44 117.38 108.58 1syg n GLN 106 Ca 0.11 -0.42 -0.10 0.00 -1.94 0.00 0.00 57.00 54.66 1syg n GLN 106 Cb 0.36 -1.46 -0.01 0.00 0.11 0.00 0.00 30.24 29.25 1syg n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1syg n GLY 107 N 1.04 0.10 0.94 1.08 0.00 0.47 -4.47 105.19 104.36 1syg n GLY 107 Ca 0.20 -0.48 0.08 0.00 0.00 0.00 0.00 46.02 45.82 1syg n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1syg n LEU 108 N -1.39 3.86 -3.57 0.99 4.77 0.62 -2.06 117.00 120.22 1syg n LEU 108 Ca -0.12 -2.77 -0.08 0.00 -0.03 0.00 0.00 56.01 53.01 1syg n LEU 108 Cb 0.56 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1syg n LEU 108 CO 0.14 0.69 0.83 0.00 -1.33 0.00 0.00 177.39 177.72 1syg s ALA 109 N -2.40 -1.95 0.15 -1.18 0.00 -1.20 -4.38 121.76 110.81 1syg s ALA 109 Ca 0.39 1.45 0.07 0.00 0.00 0.00 0.00 51.96 53.88 1syg s ALA 109 Cb 0.30 -0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 1syg s ALA 109 CO 0.11 -0.47 -0.02 0.15 0.00 0.00 0.00 175.76 175.53 1syg s LYS 110 N -1.96 2.37 -0.34 0.00 1.02 -0.52 -4.52 119.74 115.80 1syg s LYS 110 Ca 0.03 -1.06 -0.28 0.00 0.02 0.00 0.00 55.97 54.68 1syg s LYS 110 Cb -0.01 -2.37 0.02 0.00 -0.52 0.00 0.00 37.83 34.95 1syg s LYS 110 CO -0.04 0.47 1.05 0.54 -0.92 0.00 0.00 175.35 176.46 1syg s VAL 111 N -1.59 4.50 0.99 3.17 0.11 -1.26 -0.11 120.40 126.20 1syg s VAL 111 Ca 0.26 1.58 -0.15 0.00 -2.93 0.00 0.00 61.98 60.75 1syg s VAL 111 Cb -0.10 -4.41 0.19 0.00 -1.53 0.00 0.00 36.38 30.53 1syg s VAL 111 CO 0.18 -0.53 1.17 0.00 -3.33 0.00 0.00 175.10 172.59 1syg s ALA 112 N 3.68 1.59 0.63 1.54 0.00 -0.86 -4.90 121.76 123.44 1syg s ALA 112 Ca 0.44 -0.77 -0.17 0.00 0.00 0.00 0.00 51.96 51.46 1syg s ALA 112 Cb -0.12 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 1syg s ALA 112 CO 0.17 -2.63 1.15 0.71 0.00 0.00 0.00 175.76 175.17 1syg s TYR 113 N -3.34 2.48 0.30 0.00 2.02 -1.26 -4.78 117.35 112.76 1syg s TYR 113 Ca 0.68 1.55 -0.29 0.00 -0.37 0.00 0.00 57.07 58.64 1syg s TYR 113 Cb -0.11 -3.33 -0.10 0.00 -0.40 0.00 0.00 41.96 38.02 1syg s TYR 113 CO 0.54 -1.95 1.28 0.08 -1.57 0.00 0.00 175.55 173.94 1syg s VAL 114 N -1.96 2.88 -0.40 0.71 1.01 -1.26 -4.75 120.40 116.63 1syg s VAL 114 Ca 0.72 0.86 -0.04 0.00 0.00 0.00 0.00 61.98 63.52 1syg s VAL 114 Cb -0.25 -3.55 0.10 0.00 0.00 0.00 0.00 36.38 32.68 1syg s VAL 114 CO 0.36 0.19 0.20 -0.47 0.00 0.00 0.00 175.10 175.38 1syg s TYR 115 N -0.94 3.51 -0.97 5.22 5.04 -1.26 -4.83 117.35 123.12 1syg s TYR 115 Ca 0.50 -2.20 -0.12 0.00 -2.44 0.00 0.00 57.07 52.81 1syg s TYR 115 Cb -0.38 -3.08 0.00 0.00 0.35 0.00 0.00 41.96 38.85 1syg s TYR 115 CO 0.49 -0.94 0.70 1.63 -1.34 0.00 0.00 175.55 176.09 1syg n LYS 116 N 4.66 -1.20 -0.88 4.97 4.01 -1.26 -2.48 118.16 125.98 1syg n LYS 116 Ca -0.05 0.69 0.00 0.00 -0.51 0.00 0.00 58.31 58.44 1syg n LYS 116 Cb 0.42 -3.53 0.00 0.00 -0.51 0.00 0.00 35.03 31.40 1syg n LYS 116 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1syg n ALA 117 N -3.34 0.00 -2.55 7.82 0.00 -1.26 -3.66 120.51 117.52 1syg n ALA 117 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.85 1syg n ALA 117 Cb 0.61 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1syg n ALA 117 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1syg n ASN 118 N -0.13 5.04 -0.28 0.00 3.02 -1.04 -3.97 115.26 117.90 1syg n ASN 118 Ca 0.00 -3.03 0.01 0.00 -0.03 0.00 0.00 54.58 51.54 1syg n ASN 118 Cb 0.07 -1.55 0.02 0.00 -0.61 0.00 0.00 39.78 37.71 1syg n ASN 118 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1syg n ASN 119 N 5.05 0.48 -0.29 6.41 0.23 -1.26 -4.21 115.26 121.67 1syg n ASN 119 Ca 0.40 -1.92 0.09 0.00 -0.53 0.00 0.00 54.58 52.62 1syg n ASN 119 Cb 0.40 -0.17 0.25 0.00 -2.08 0.00 0.00 39.78 38.17 1syg n ASN 119 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1syg h THR 120 N 4.55 0.56 -0.60 5.53 2.02 -2.02 -1.70 112.91 121.25 1syg h THR 120 Ca 0.00 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1syg h THR 120 Cb 1.19 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1syg h THR 120 CO 0.00 0.08 0.00 1.41 0.37 0.00 0.00 175.52 177.38 1syg n HIS 121 N -5.02 1.57 -0.09 3.16 8.25 -1.26 -4.60 115.22 117.23 1syg n HIS 121 Ca 0.19 -0.65 -0.09 0.00 -0.26 0.00 0.00 57.72 56.90 1syg n HIS 121 Cb 0.54 -0.31 -0.01 0.00 1.12 0.00 0.00 29.99 31.33 1syg n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1syg h GLU 122 N 3.87 0.42 -0.26 -0.41 4.81 -1.66 -1.77 114.58 119.59 1syg h GLU 122 Ca 0.00 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1syg h GLU 122 Cb 1.56 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.82 1syg h GLU 122 CO 0.29 0.28 0.09 1.96 -0.73 0.00 0.00 179.01 180.89 1syg h GLN 123 N 0.44 0.20 -0.17 1.92 7.50 -1.81 0.16 115.11 123.34 1syg h GLN 123 Ca 0.12 -0.01 0.04 0.00 0.50 0.00 0.00 58.65 59.29 1syg h GLN 123 Cb -0.05 -0.04 -0.04 0.00 0.05 0.00 0.00 27.48 27.40 1syg h GLN 123 CO -0.03 0.13 -0.06 1.25 -1.50 0.00 0.00 178.83 178.62 1syg h HIS 124 N 0.20 -0.14 -0.56 2.96 2.76 -1.84 -1.58 115.15 116.95 1syg h HIS 124 Ca 0.11 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.27 1syg h HIS 124 Cb 0.08 0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.10 1syg h HIS 124 CO -0.13 -0.10 0.23 -0.07 -1.30 0.00 0.00 177.93 176.56 1syg h LEU 125 N -0.03 0.73 -0.48 0.26 4.07 -0.95 -2.54 115.31 116.36 1syg h LEU 125 Ca 0.09 -0.09 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 1syg h LEU 125 Cb 0.17 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.70 1syg h LEU 125 CO -0.20 0.65 0.29 0.03 -1.08 0.00 0.00 178.44 178.14 1syg h ARG 126 N 0.80 0.66 -0.45 1.13 2.47 0.07 -0.86 114.38 118.19 1syg h ARG 126 Ca 0.19 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.84 1syg h ARG 126 Cb 0.14 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.31 1syg h ARG 126 CO -0.02 0.48 0.23 0.87 0.56 0.00 0.00 179.97 182.10 1syg h LYS 127 N 0.64 0.63 -0.63 0.04 1.57 -0.92 -1.16 116.57 116.75 1syg h LYS 127 Ca 0.17 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1syg h LYS 127 Cb -0.00 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 1syg h LYS 127 CO -0.03 0.52 0.23 0.77 -0.57 0.00 0.00 179.45 180.36 1syg h SER 128 N 0.58 0.86 -0.28 0.86 0.02 -1.20 -1.93 113.55 112.47 1syg h SER 128 Ca 0.16 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.87 1syg h SER 128 Cb 0.08 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1syg h SER 128 CO -0.02 0.79 -0.20 -0.08 -1.14 0.00 0.00 176.83 176.17 1syg h GLU 129 N 0.91 0.75 -0.44 3.45 4.81 -0.84 -1.61 114.58 121.62 1syg h GLU 129 Ca 0.21 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1syg h GLU 129 Cb 0.22 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1syg h GLU 129 CO -0.01 0.89 0.22 0.00 -0.73 0.00 0.00 179.01 179.38 1syg h ALA 130 N 1.11 0.56 -0.38 2.92 0.00 -0.64 -2.22 119.26 120.61 1syg h ALA 130 Ca 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1syg h ALA 130 Cb 0.70 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1syg h ALA 130 CO 0.05 0.10 0.19 0.37 0.00 0.00 0.00 179.25 179.96 1syg h GLN 131 N 0.56 0.55 -0.72 0.00 5.75 -1.17 -2.03 115.11 118.06 1syg h GLN 131 Ca 0.15 -0.08 0.05 0.00 -0.15 0.00 0.00 58.65 58.62 1syg h GLN 131 Cb 0.09 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.50 1syg h GLN 131 CO -0.02 0.49 0.47 0.00 -2.65 0.00 0.00 178.83 177.12 1syg h ALA 132 N 1.04 1.65 0.01 3.38 0.00 -1.06 -1.41 119.26 122.87 1syg h ALA 132 Ca 0.13 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.81 1syg h ALA 132 Cb 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1syg h ALA 132 CO -0.02 0.25 -0.91 1.57 0.00 0.00 0.00 179.25 180.15 1syg h LYS 133 N 0.80 0.16 -0.76 0.00 2.10 -1.10 -1.70 116.57 116.07 1syg h LYS 133 Ca 0.30 -0.19 -0.02 0.00 -2.00 0.00 0.00 60.65 58.74 1syg h LYS 133 Cb 0.17 0.06 -0.04 0.00 -0.90 0.00 0.00 32.23 31.52 1syg h LYS 133 CO -0.09 0.96 0.39 0.87 -2.00 0.00 0.00 179.45 179.58 1syg h LYS 134 N 0.08 1.07 -0.04 0.07 1.57 -0.63 -0.71 116.57 117.99 1syg h LYS 134 Ca -0.04 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1syg h LYS 134 Cb 1.55 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1syg h LYS 134 CO 0.13 0.80 0.00 0.39 -0.57 0.00 0.00 179.45 180.21 1syg n GLU 135 N -4.34 1.22 -3.97 3.15 1.02 -0.61 -4.92 120.64 112.19 1syg n GLU 135 Ca 0.08 -0.32 -0.27 0.00 -0.02 0.00 0.00 57.16 56.62 1syg n GLU 135 Cb 0.12 -1.36 -0.01 0.00 -0.02 0.00 0.00 31.44 30.16 1syg n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1syg n LYS 136 N -0.50 -3.71 -2.98 3.49 4.01 -0.27 -4.91 118.16 113.28 1syg n LYS 136 Ca 0.17 0.45 -0.40 0.00 -0.51 0.00 0.00 58.31 58.01 1syg n LYS 136 Cb 0.15 -4.81 -0.05 0.00 -0.51 0.00 0.00 35.03 29.81 1syg n LYS 136 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1syg s LEU 137 N -7.02 4.45 0.00 -0.35 1.43 -0.68 -4.11 118.68 112.41 1syg s LEU 137 Ca 0.21 1.45 0.00 0.00 -1.03 0.00 0.00 54.13 54.76 1syg s LEU 137 Cb -0.11 -3.23 0.00 0.00 0.03 0.00 0.00 46.19 42.88 1syg s LEU 137 CO 0.88 0.02 0.00 0.59 0.23 0.00 0.00 176.35 178.07 1syg n ASN 138 N 2.78 0.00 -0.22 2.29 3.02 -1.26 -0.23 115.26 121.64 1syg n ASN 138 Ca -0.02 0.00 0.15 0.00 -0.03 0.00 0.00 54.58 54.67 1syg n ASN 138 Cb 0.50 0.00 0.45 0.00 -0.61 0.00 0.00 39.78 40.12 1syg n ASN 138 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1syg h ILE 139 N 0.00 0.79 -0.33 2.41 2.04 -1.74 -1.76 117.51 118.92 1syg h ILE 139 Ca 0.00 -0.18 -0.15 0.00 1.00 0.00 0.00 64.86 65.53 1syg h ILE 139 Cb 0.00 0.21 -0.09 0.00 -0.74 0.00 0.00 36.82 36.21 1syg h ILE 139 CO 0.00 0.10 0.19 0.79 0.00 0.00 0.00 178.15 179.22 1syg n TRP 140 N -4.52 1.04 1.97 1.37 7.02 0.68 -5.15 117.44 119.85 1syg n TRP 140 Ca 0.16 -0.83 0.16 0.00 -1.02 0.00 0.00 57.50 55.97 1syg n TRP 140 Cb 0.53 -0.45 0.92 0.00 -2.42 0.00 0.00 31.31 29.90 1syg n TRP 140 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10