#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1do9 h LYS 2 N 0.00 0.00 -4.63 -0.67 2.10 -2.09 -3.43 116.57 107.86 1do9 h LYS 2 Ca 0.00 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.32 1do9 h LYS 2 Cb 0.00 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 31.20 1do9 h LYS 2 CO 0.00 0.00 -0.50 -0.51 -2.00 0.00 0.00 179.45 176.44 1do9 s ASP 3 N -5.54 0.81 0.00 7.07 1.01 -1.26 -5.18 116.67 113.58 1do9 s ASP 3 Ca 0.00 -1.52 0.00 0.00 0.71 0.00 0.00 52.55 51.74 1do9 s ASP 3 Cb 0.10 0.49 0.00 0.00 1.01 0.00 0.00 42.92 44.51 1do9 s ASP 3 CO 0.51 -0.98 0.00 0.52 0.21 0.00 0.00 175.17 175.43 1do9 n VAL 4 N -0.44 0.00 0.00 -1.27 0.31 -1.26 -5.10 118.33 110.56 1do9 n VAL 4 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1do9 n VAL 4 Cb 0.64 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.57 1do9 n VAL 4 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1do9 n LYS 5 N 0.00 1.80 -3.20 5.55 4.76 -1.26 -4.98 118.16 120.83 1do9 n LYS 5 Ca 0.00 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.28 1do9 n LYS 5 Cb 0.00 -0.61 0.02 0.00 -1.84 0.00 0.00 35.03 32.59 1do9 n LYS 5 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1do9 n TYR 6 N -0.71 -2.03 -3.98 2.13 4.01 -1.23 -4.93 117.16 110.41 1do9 n TYR 6 Ca 0.00 0.86 -0.30 0.00 -0.16 0.00 0.00 57.90 58.30 1do9 n TYR 6 Cb 0.08 -2.13 -0.05 0.00 -0.31 0.00 0.00 39.34 36.94 1do9 n TYR 6 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1do9 s TYR 7 N -1.48 3.38 0.45 -0.72 2.02 -0.93 -4.79 117.35 115.28 1do9 s TYR 7 Ca 0.18 0.15 -0.05 0.00 -0.37 0.00 0.00 57.07 56.98 1do9 s TYR 7 Cb -0.02 -1.68 -0.04 0.00 -0.40 0.00 0.00 41.96 39.82 1do9 s TYR 7 CO 0.54 0.55 0.74 0.95 -1.57 0.00 0.00 175.55 176.76 1do9 s THR 8 N -1.53 4.93 0.25 -0.71 -4.23 -1.26 -1.41 115.64 111.69 1do9 s THR 8 Ca 0.33 0.12 -0.03 0.00 -1.18 0.00 0.00 61.69 60.93 1do9 s THR 8 Cb -0.12 -3.85 0.25 0.00 1.34 0.00 0.00 72.50 70.12 1do9 s THR 8 CO 0.26 -0.77 1.68 -0.07 -0.54 0.00 0.00 174.62 175.17 1do9 h LEU 9 N 0.40 0.03 -0.57 4.79 -0.00 -1.99 0.27 115.31 118.25 1do9 h LEU 9 Ca -0.47 0.16 0.09 0.00 -0.00 0.00 0.00 57.88 57.65 1do9 h LEU 9 Cb 1.21 0.21 -0.07 0.00 -0.00 0.00 0.00 40.66 42.00 1do9 h LEU 9 CO 0.62 -0.05 0.19 -0.08 -0.00 0.00 0.00 178.44 179.12 1do9 h GLU 10 N 0.27 0.35 -0.39 1.13 4.81 -1.97 -0.27 114.58 118.52 1do9 h GLU 10 Ca 0.45 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.66 1do9 h GLU 10 Cb 0.79 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 1do9 h GLU 10 CO -0.54 0.23 0.26 0.93 -0.73 0.00 0.00 179.01 179.17 1do9 h GLU 11 N 0.36 0.52 -0.05 1.92 4.39 -1.33 0.18 114.58 120.57 1do9 h GLU 11 Ca 0.28 -0.03 -0.07 0.00 0.34 0.00 0.00 59.36 59.88 1do9 h GLU 11 Cb 0.35 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1do9 h GLU 11 CO -0.30 0.34 -0.32 0.82 -1.16 0.00 0.00 179.01 178.39 1do9 h ILE 12 N 0.53 1.25 0.00 3.13 2.04 -0.95 0.29 117.51 123.79 1do9 h ILE 12 Ca 0.14 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.83 1do9 h ILE 12 Cb -0.06 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1do9 h ILE 12 CO -0.03 0.34 0.00 0.29 0.00 0.00 0.00 178.15 178.75 1do9 n LYS 13 N -4.14 0.20 -0.04 2.37 5.02 -0.18 -2.48 118.16 118.91 1do9 n LYS 13 Ca -0.02 0.22 0.06 0.00 -2.02 0.00 0.00 58.31 56.55 1do9 n LYS 13 Cb 0.38 -1.76 0.27 0.00 -0.02 0.00 0.00 35.03 33.90 1do9 n LYS 13 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1do9 n LYS 14 N -2.11 1.26 0.00 1.97 5.02 0.56 -4.74 118.16 120.13 1do9 n LYS 14 Ca 0.05 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 55.94 1do9 n LYS 14 Cb 0.37 -1.21 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 1do9 n LYS 14 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1do9 n HIS 15 N -0.29 0.00 -4.03 2.13 8.25 -1.03 -4.94 115.22 115.31 1do9 n HIS 15 Ca 0.09 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.25 1do9 n HIS 15 Cb 0.13 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.23 1do9 n HIS 15 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1do9 n ASN 16 N 0.00 -2.63 0.00 0.41 0.23 -0.36 -4.92 115.26 107.99 1do9 n ASN 16 Ca 0.00 -0.94 0.00 0.00 -0.53 0.00 0.00 54.58 53.11 1do9 n ASN 16 Cb 0.00 -3.23 0.00 0.00 -2.08 0.00 0.00 39.78 34.47 1do9 n ASN 16 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1do9 n HIS 17 N -4.46 0.00 0.00 -2.53 8.25 -0.61 -5.00 115.22 110.87 1do9 n HIS 17 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 1do9 n HIS 17 Cb 0.57 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.68 1do9 n HIS 17 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1do9 n SER 18 N -0.67 0.00 -0.45 0.41 2.88 -1.26 -4.89 113.62 109.64 1do9 n SER 18 Ca 0.00 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.58 1do9 n SER 18 Cb 0.00 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 63.56 1do9 n SER 18 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1do9 n LYS 19 N -0.63 2.52 -3.66 -1.46 4.01 -1.26 -4.93 118.16 112.74 1do9 n LYS 19 Ca 0.00 -1.77 -0.08 0.00 -0.51 0.00 0.00 58.31 55.95 1do9 n LYS 19 Cb 0.00 -1.19 -0.09 0.00 -0.51 0.00 0.00 35.03 33.24 1do9 n LYS 19 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1do9 s SER 20 N -0.95 -0.36 -0.37 4.39 1.04 -1.26 -4.97 113.70 111.21 1do9 s SER 20 Ca 0.16 1.03 0.01 0.00 0.48 0.00 0.00 55.95 57.62 1do9 s SER 20 Cb 0.09 1.34 0.14 0.00 0.10 0.00 0.00 66.02 67.68 1do9 s SER 20 CO 0.11 -0.23 0.21 -0.89 0.98 0.00 0.00 173.24 173.43 1do9 s THR 21 N 2.45 0.53 0.53 2.02 2.01 -1.26 -1.23 115.64 120.69 1do9 s THR 21 Ca -0.03 -1.93 0.03 0.00 0.31 0.00 0.00 61.69 60.07 1do9 s THR 21 Cb -0.11 -1.39 0.03 0.00 0.01 0.00 0.00 72.50 71.04 1do9 s THR 21 CO -0.13 -0.95 0.73 0.26 -0.69 0.00 0.00 174.62 173.84 1do9 s TRP 22 N 0.90 2.77 0.17 4.92 0.52 -1.26 -1.62 118.94 125.34 1do9 s TRP 22 Ca 0.17 -0.13 -0.24 0.00 0.02 0.00 0.00 56.10 55.92 1do9 s TRP 22 Cb -0.23 -2.66 0.06 0.00 -1.15 0.00 0.00 33.47 29.48 1do9 s TRP 22 CO -0.01 -0.80 0.90 -0.48 0.02 0.00 0.00 176.95 176.58 1do9 s LEU 23 N -4.67 -0.22 -0.49 2.99 0.05 -0.17 -0.91 118.68 115.25 1do9 s LEU 23 Ca 0.57 -0.41 0.01 0.00 0.05 0.00 0.00 54.13 54.35 1do9 s LEU 23 Cb -0.10 2.28 0.13 0.00 -2.05 0.00 0.00 46.19 46.45 1do9 s LEU 23 CO 0.37 -0.98 0.25 -0.63 -0.55 0.00 0.00 176.35 174.82 1do9 s ILE 24 N -3.42 2.92 -0.46 1.48 1.01 -0.20 -1.81 121.20 120.71 1do9 s ILE 24 Ca 0.11 -2.84 -0.10 0.00 0.00 0.00 0.00 60.65 57.82 1do9 s ILE 24 Cb -0.02 -3.01 0.11 0.00 0.01 0.00 0.00 42.46 39.55 1do9 s ILE 24 CO 0.02 -0.76 0.34 -0.76 0.00 0.00 0.00 174.94 173.78 1do9 s LEU 25 N 0.23 5.60 -0.40 2.97 1.43 -1.14 -2.77 118.68 124.60 1do9 s LEU 25 Ca 0.14 -1.74 -0.08 0.00 -1.03 0.00 0.00 54.13 51.43 1do9 s LEU 25 Cb -0.23 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 43.96 1do9 s LEU 25 CO -0.03 -0.67 0.47 1.41 0.23 0.00 0.00 176.35 177.76 1do9 n HIS 26 N 4.98 -2.49 -3.19 0.29 8.25 -1.26 -3.96 115.22 117.84 1do9 n HIS 26 Ca -0.10 0.99 -0.16 0.00 -0.26 0.00 0.00 57.72 58.19 1do9 n HIS 26 Cb 0.41 -3.44 -0.04 0.00 1.12 0.00 0.00 29.99 28.04 1do9 n HIS 26 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1do9 n HIS 27 N -0.75 -0.57 -3.85 4.41 1.44 -1.26 -4.89 115.22 109.75 1do9 n HIS 27 Ca 0.06 0.30 -0.09 0.00 -2.01 0.00 0.00 57.72 55.98 1do9 n HIS 27 Cb 0.39 -1.14 -0.07 0.00 0.12 0.00 0.00 29.99 29.29 1do9 n HIS 27 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1do9 s LYS 28 N -4.62 0.82 -0.31 -1.40 1.02 -1.25 -3.98 119.74 110.02 1do9 s LYS 28 Ca 0.14 -0.91 -0.03 0.00 0.02 0.00 0.00 55.97 55.19 1do9 s LYS 28 Cb -0.08 0.34 0.04 0.00 -0.52 0.00 0.00 37.83 37.61 1do9 s LYS 28 CO 0.47 -0.26 0.03 0.08 -0.92 0.00 0.00 175.35 174.75 1do9 s VAL 29 N -3.68 3.25 0.03 3.17 1.01 -0.74 -2.87 120.40 120.56 1do9 s VAL 29 Ca 0.04 -1.28 0.03 0.00 0.00 0.00 0.00 61.98 60.76 1do9 s VAL 29 Cb 0.04 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1do9 s VAL 29 CO -0.10 -0.11 -0.01 -0.31 0.00 0.00 0.00 175.10 174.56 1do9 s TYR 30 N 1.31 3.01 -0.27 5.22 2.02 -0.75 -1.49 117.35 126.39 1do9 s TYR 30 Ca -0.04 0.02 0.01 0.00 -0.37 0.00 0.00 57.07 56.69 1do9 s TYR 30 Cb -0.20 -1.62 0.05 0.00 -0.40 0.00 0.00 41.96 39.80 1do9 s TYR 30 CO 0.00 0.45 -0.06 0.34 -1.57 0.00 0.00 175.55 174.71 1do9 s ASP 31 N -1.77 4.60 -0.15 2.29 -1.08 0.14 -1.00 116.67 119.71 1do9 s ASP 31 Ca 0.21 -1.29 0.16 0.00 -0.52 0.00 0.00 52.55 51.11 1do9 s ASP 31 Cb -0.11 -1.63 0.49 0.00 -1.46 0.00 0.00 42.92 40.21 1do9 s ASP 31 CO 0.12 -0.21 1.39 0.18 0.52 0.00 0.00 175.17 177.17 1do9 n LEU 32 N 4.54 3.72 -0.25 -1.34 4.77 -0.64 -4.62 117.00 123.18 1do9 n LEU 32 Ca -0.14 -2.83 0.05 0.00 -0.03 0.00 0.00 56.01 53.06 1do9 n LEU 32 Cb 0.43 -0.49 0.16 0.00 -2.33 0.00 0.00 43.42 41.19 1do9 n LEU 32 CO 0.24 0.68 0.86 0.00 -1.33 0.00 0.00 177.39 177.84 1do9 h THR 33 N 1.86 0.40 0.00 -5.08 1.03 -1.91 0.40 112.91 109.61 1do9 h THR 33 Ca 0.00 -0.05 0.00 0.00 -0.01 0.00 0.00 66.41 66.35 1do9 h THR 33 Cb 1.32 0.24 0.00 0.00 -1.07 0.00 0.00 68.15 68.64 1do9 h THR 33 CO 0.18 0.03 0.00 0.07 -0.01 0.00 0.00 175.52 175.79 1do9 h LYS 34 N 0.15 0.00 0.00 0.00 5.09 -1.92 -2.98 116.57 116.90 1do9 h LYS 34 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.15 1do9 h LYS 34 Cb 0.72 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.05 1do9 h LYS 34 CO -0.61 0.00 -0.99 0.34 -2.09 0.00 0.00 179.45 176.10 1do9 n PHE 35 N -2.53 0.17 0.04 0.07 7.35 0.10 -4.36 117.46 118.30 1do9 n PHE 35 Ca 0.03 0.05 -0.11 0.00 -0.76 0.00 0.00 57.45 56.66 1do9 n PHE 35 Cb 0.36 -0.33 -0.07 0.00 0.35 0.00 0.00 39.48 39.78 1do9 n PHE 35 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1do9 h LEU 36 N 0.00 -1.19 -1.29 -2.13 -0.00 -0.32 0.46 115.31 110.84 1do9 h LEU 36 Ca 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 57.88 58.01 1do9 h LEU 36 Cb 0.67 0.45 0.00 0.00 -0.00 0.00 0.00 40.66 41.78 1do9 h LEU 36 CO 0.00 -0.38 0.00 -0.62 -0.00 0.00 0.00 178.44 177.44 1do9 n GLU 37 N -4.63 0.74 0.00 1.13 -0.58 -1.26 -2.89 120.64 113.15 1do9 n GLU 37 Ca -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 1do9 n GLU 37 Cb 0.29 -1.30 0.00 0.00 -0.57 0.00 0.00 31.44 29.86 1do9 n GLU 37 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1do9 n GLU 38 N 0.28 2.38 -2.10 3.49 2.13 -0.31 -5.09 120.64 121.41 1do9 n GLU 38 Ca 0.00 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 1do9 n GLU 38 Cb 0.24 -0.20 -0.03 0.00 0.27 0.00 0.00 31.44 31.72 1do9 n GLU 38 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1do9 s HIS 39 N 0.00 2.60 -1.13 4.31 2.46 0.15 -4.84 115.29 118.83 1do9 s HIS 39 Ca 0.00 0.58 -0.22 0.00 0.47 0.00 0.00 55.06 55.89 1do9 s HIS 39 Cb 0.00 -3.79 -0.03 0.00 -0.13 0.00 0.00 32.58 28.63 1do9 s HIS 39 CO 0.00 -3.08 1.84 -1.25 -2.47 0.00 0.00 174.74 169.78 1do9 s PRO 40 N 2.72 2.96 0.00 2.88 0.04 -1.26 -3.01 135.00 139.32 1do9 s PRO 40 Ca 0.68 -1.16 0.00 0.00 0.04 0.00 0.00 61.00 60.56 1do9 s PRO 40 Cb -0.34 -5.28 0.00 0.00 0.04 0.00 0.00 34.50 28.92 1do9 s PRO 40 CO 0.28 -3.28 0.00 0.41 0.04 0.00 0.00 177.00 174.45 1do9 n GLY 41 N 6.06 -0.07 0.00 0.56 0.00 -1.26 -5.13 105.19 105.35 1do9 n GLY 41 Ca 0.43 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.68 1do9 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1do9 n GLY 42 N 0.00 3.00 1.12 -0.02 0.00 -1.16 -5.07 105.19 103.05 1do9 n GLY 42 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1do9 n GLY 42 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1do9 n GLU 43 N 0.00 0.00 0.12 1.61 0.28 -1.26 -4.04 120.64 117.34 1do9 n GLU 43 Ca 0.00 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.01 1do9 n GLU 43 Cb 0.00 -0.18 0.35 0.00 1.43 0.00 0.00 31.44 33.04 1do9 n GLU 43 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1do9 h GLU 44 N 0.00 0.22 -0.76 3.44 4.57 -1.98 0.31 114.58 120.39 1do9 h GLU 44 Ca 0.00 -0.06 0.13 0.00 -1.18 0.00 0.00 59.36 58.25 1do9 h GLU 44 Cb 0.00 -0.02 -0.09 0.00 -0.16 0.00 0.00 28.75 28.48 1do9 h GLU 44 CO 0.00 0.43 0.33 -0.39 -1.18 0.00 0.00 179.01 178.20 1do9 h VAL 45 N 0.21 0.71 0.00 0.32 -1.51 -1.99 0.26 116.25 114.25 1do9 h VAL 45 Ca 0.04 -0.17 -0.05 0.00 -1.23 0.00 0.00 66.70 65.29 1do9 h VAL 45 Cb 0.49 0.16 -0.01 0.00 -2.13 0.00 0.00 31.29 29.80 1do9 h VAL 45 CO 0.03 0.09 -0.24 -0.07 -1.23 0.00 0.00 177.57 176.15 1do9 h LEU 46 N 0.50 0.00 0.00 4.19 3.38 -0.73 -2.65 115.31 119.99 1do9 h LEU 46 Ca 0.41 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.24 1do9 h LEU 46 Cb 0.58 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1do9 h LEU 46 CO -0.37 0.24 -0.74 -0.09 0.09 0.00 0.00 178.44 177.58 1do9 h ARG 47 N 0.00 0.00 0.00 1.13 2.43 -0.48 -1.96 114.38 115.50 1do9 h ARG 47 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1do9 h ARG 47 Cb 0.47 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1do9 h ARG 47 CO 0.03 0.61 0.00 0.93 -1.51 0.00 0.00 179.97 180.03 1do9 h GLU 48 N 0.00 0.00 -0.04 0.20 4.39 -0.27 -2.81 114.58 116.05 1do9 h GLU 48 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1do9 h GLU 48 Cb 1.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.16 1do9 h GLU 48 CO 0.08 0.00 0.00 1.04 -1.16 0.00 0.00 179.01 178.97 1do9 n GLN 49 N -2.99 0.85 -1.82 2.33 1.13 -1.13 -5.02 117.38 110.72 1do9 n GLN 49 Ca 0.02 -1.08 -0.36 0.00 -1.94 0.00 0.00 57.00 53.64 1do9 n GLN 49 Cb 0.38 -1.07 0.06 0.00 0.11 0.00 0.00 30.24 29.72 1do9 n GLN 49 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1do9 s ALA 50 N -0.56 2.42 -1.67 -1.58 0.00 -0.74 -2.08 121.76 117.55 1do9 s ALA 50 Ca 0.05 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.05 1do9 s ALA 50 Cb 0.03 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1do9 s ALA 50 CO 0.04 -1.43 0.00 0.41 0.00 0.00 0.00 175.76 174.79 1do9 n GLY 51 N 0.59 1.50 3.63 0.00 0.00 -0.09 -4.89 105.19 105.93 1do9 n GLY 51 Ca 0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 1do9 n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1do9 s GLY 52 N -2.43 0.91 -1.06 -0.02 0.00 -0.88 -4.51 107.32 99.33 1do9 s GLY 52 Ca 0.00 -1.12 -0.22 0.00 0.00 0.00 0.00 44.72 43.38 1do9 s GLY 52 CO 0.00 -0.67 1.49 0.51 0.00 0.00 0.00 173.10 174.43 1do9 s ASP 53 N -3.14 6.54 0.00 1.64 -4.77 -1.26 -1.03 116.67 114.65 1do9 s ASP 53 Ca 0.23 -1.59 0.27 0.00 -3.30 0.00 0.00 52.55 48.17 1do9 s ASP 53 Cb -0.02 -2.57 1.38 0.00 -1.09 0.00 0.00 42.92 40.61 1do9 s ASP 53 CO 0.15 -1.47 1.92 0.00 0.70 0.00 0.00 175.17 176.47 1do9 n ALA 54 N 8.84 2.35 -0.11 2.11 0.00 -1.12 -3.84 120.51 128.76 1do9 n ALA 54 Ca 0.35 -0.13 0.10 0.00 0.00 0.00 0.00 53.44 53.77 1do9 n ALA 54 Cb 0.50 -1.44 0.46 0.00 0.00 0.00 0.00 19.45 18.98 1do9 n ALA 54 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1do9 h THR 55 N 0.00 0.93 -0.47 0.00 2.02 -1.88 -0.30 112.91 113.22 1do9 h THR 55 Ca 0.00 -0.17 0.06 0.00 0.77 0.00 0.00 66.41 67.07 1do9 h THR 55 Cb 0.23 0.39 -0.05 0.00 -1.74 0.00 0.00 68.15 66.97 1do9 h THR 55 CO 0.00 0.09 0.17 -0.33 0.37 0.00 0.00 175.52 175.82 1do9 h GLU 56 N 0.50 0.34 0.03 6.66 4.39 -1.94 -1.01 114.58 123.55 1do9 h GLU 56 Ca 0.29 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.96 1do9 h GLU 56 Cb 0.47 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1do9 h GLU 56 CO -0.09 0.22 -0.01 -0.91 -1.16 0.00 0.00 179.01 177.06 1do9 h ASN 57 N 0.35 -0.03 -0.98 1.42 4.21 -1.39 -0.67 115.58 118.50 1do9 h ASN 57 Ca 0.22 -0.46 0.22 0.00 1.21 0.00 0.00 56.30 57.48 1do9 h ASN 57 Cb 0.21 0.01 -0.09 0.00 -1.12 0.00 0.00 38.32 37.33 1do9 h ASN 57 CO -0.22 0.45 0.62 0.15 -1.29 0.00 0.00 177.43 177.15 1do9 h PHE 58 N -0.53 0.75 0.14 1.19 3.57 -1.03 -0.71 116.94 120.32 1do9 h PHE 58 Ca -0.00 0.02 -0.29 0.00 3.53 0.00 0.00 57.97 61.23 1do9 h PHE 58 Cb 0.49 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.01 1do9 h PHE 58 CO 0.09 0.15 -1.39 0.93 -2.23 0.00 0.00 178.31 175.86 1do9 h GLU 59 N 0.52 0.29 -0.89 1.11 4.39 -1.17 -2.49 114.58 116.34 1do9 h GLU 59 Ca 0.54 -0.50 0.07 0.00 0.34 0.00 0.00 59.36 59.82 1do9 h GLU 59 Cb 1.17 0.18 -0.07 0.00 -0.10 0.00 0.00 28.75 29.94 1do9 h GLU 59 CO -0.28 1.20 0.55 0.22 -1.16 0.00 0.00 179.01 179.54 1do9 h ASP 60 N 0.08 0.85 1.43 1.42 3.58 0.28 -1.27 116.42 122.80 1do9 h ASP 60 Ca -0.19 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.28 1do9 h ASP 60 Cb 2.01 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.91 1do9 h ASP 60 CO 0.19 0.53 -0.56 -0.37 -2.88 0.00 0.00 179.24 176.16 1do9 h VAL 61 N 0.98 0.00 -3.53 2.25 -1.51 -1.34 -3.48 116.25 109.61 1do9 h VAL 61 Ca 0.40 -0.99 -0.11 0.00 -1.23 0.00 0.00 66.70 64.77 1do9 h VAL 61 Cb 0.23 1.71 0.07 0.00 -2.13 0.00 0.00 31.29 31.16 1do9 h VAL 61 CO -0.19 0.00 -0.29 0.61 -1.23 0.00 0.00 177.57 176.46 1do9 n GLY 62 N 1.15 0.15 3.47 5.19 0.00 -0.48 -4.91 105.19 109.76 1do9 n GLY 62 Ca 0.02 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 1do9 n GLY 62 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1do9 n HIS 63 N -2.14 -0.86 -1.36 1.61 8.25 -1.16 -4.99 115.22 114.57 1do9 n HIS 63 Ca -0.08 0.29 -0.31 0.00 -0.26 0.00 0.00 57.72 57.36 1do9 n HIS 63 Cb 0.56 -1.86 0.09 0.00 1.12 0.00 0.00 29.99 29.89 1do9 n HIS 63 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1do9 s SER 64 N -1.97 4.63 0.16 0.41 1.04 -1.26 -4.90 113.70 111.81 1do9 s SER 64 Ca 0.61 1.70 -0.13 0.00 0.48 0.00 0.00 55.95 58.60 1do9 s SER 64 Cb -0.25 -2.44 0.05 0.00 0.10 0.00 0.00 66.02 63.47 1do9 s SER 64 CO 0.63 -1.94 1.70 0.74 0.98 0.00 0.00 173.24 175.35 1do9 h THR 65 N -1.06 1.22 -0.30 2.02 2.02 -1.99 -1.63 112.91 113.19 1do9 h THR 65 Ca -0.44 -0.73 0.08 0.00 0.77 0.00 0.00 66.41 66.09 1do9 h THR 65 Cb 1.23 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 1do9 h THR 65 CO 0.54 0.27 0.22 0.44 0.37 0.00 0.00 175.52 177.35 1do9 h ASP 66 N 0.72 0.04 0.37 4.18 5.19 -2.00 0.12 116.42 125.04 1do9 h ASP 66 Ca 0.17 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.37 1do9 h ASP 66 Cb 0.23 -0.01 -0.00 0.00 0.18 0.00 0.00 39.33 39.73 1do9 h ASP 66 CO -0.01 0.03 -0.89 0.00 -3.12 0.00 0.00 179.24 175.25 1do9 h ALA 67 N 1.85 0.44 0.00 3.45 0.00 -1.71 -1.84 119.26 121.44 1do9 h ALA 67 Ca 0.14 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1do9 h ALA 67 Cb 0.51 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1do9 h ALA 67 CO -0.01 0.83 0.00 0.00 0.00 0.00 0.00 179.25 180.07 1do9 h ARG 68 N 0.21 0.00 0.05 0.00 3.08 0.10 -3.20 114.38 114.63 1do9 h ARG 68 Ca -0.06 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.63 1do9 h ARG 68 Cb 1.51 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.51 1do9 h ARG 68 CO 0.15 0.00 -2.07 0.39 -1.07 0.00 0.00 179.97 177.36 1do9 n GLU 69 N -2.70 0.67 -0.07 0.04 1.02 -0.76 -4.25 120.64 114.59 1do9 n GLU 69 Ca -0.02 0.29 0.14 0.00 -0.02 0.00 0.00 57.16 57.55 1do9 n GLU 69 Cb 0.06 -1.63 0.54 0.00 -0.02 0.00 0.00 31.44 30.39 1do9 n GLU 69 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1do9 h LEU 70 N -0.32 0.29 -0.93 -4.62 3.38 -1.37 0.22 115.31 111.96 1do9 h LEU 70 Ca -0.50 0.01 0.13 0.00 0.09 0.00 0.00 57.88 57.61 1do9 h LEU 70 Cb 1.79 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 42.40 1do9 h LEU 70 CO -0.10 0.17 0.55 0.77 0.09 0.00 0.00 178.44 179.91 1do9 h SER 71 N 0.32 0.75 -0.08 -0.43 4.64 -1.74 -0.94 113.55 116.06 1do9 h SER 71 Ca 0.28 0.07 0.02 0.00 -0.47 0.00 0.00 61.79 61.69 1do9 h SER 71 Cb 0.68 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1do9 h SER 71 CO -0.07 0.37 0.12 0.50 -0.87 0.00 0.00 176.83 176.88 1do9 h LYS 72 N 0.82 0.00 -0.00 4.77 3.64 -0.73 0.30 116.57 125.36 1do9 h LYS 72 Ca 0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.86 1do9 h LYS 72 Cb 0.57 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1do9 h LYS 72 CO -0.30 0.00 -0.63 -2.37 -2.27 0.00 0.00 179.45 173.88 1do9 n THR 73 N -3.64 0.00 0.60 1.00 5.66 -0.39 -4.01 114.28 113.50 1do9 n THR 73 Ca -0.01 -0.06 0.10 0.00 -3.05 0.00 0.00 64.05 61.03 1do9 n THR 73 Cb 0.21 0.67 -0.13 0.00 -1.55 0.00 0.00 70.33 69.53 1do9 n THR 73 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 1do9 n PHE 74 N -1.15 0.00 -1.68 1.09 3.72 0.80 -4.91 117.46 115.32 1do9 n PHE 74 Ca 0.07 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.04 1do9 n PHE 74 Cb 0.35 -0.18 -0.03 0.00 -0.94 0.00 0.00 39.48 38.68 1do9 n PHE 74 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 1do9 s ILE 75 N -3.13 3.10 -2.13 4.37 2.07 0.22 -0.68 121.20 125.01 1do9 s ILE 75 Ca 0.02 0.10 0.24 0.00 -1.41 0.00 0.00 60.65 59.60 1do9 s ILE 75 Cb 0.15 -3.12 0.08 0.00 0.13 0.00 0.00 42.46 39.70 1do9 s ILE 75 CO 0.85 -0.07 1.21 2.30 -1.91 0.00 0.00 174.94 177.33 1do9 n ILE 76 N 7.42 0.00 -2.68 2.00 -6.64 -0.56 -4.92 119.36 113.98 1do9 n ILE 76 Ca 0.27 -0.27 0.00 0.00 -1.77 0.00 0.00 62.75 60.99 1do9 n ILE 76 Cb 0.45 1.12 0.00 0.00 -1.44 0.00 0.00 39.64 39.77 1do9 n ILE 76 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1do9 n GLY 77 N 1.39 -1.30 3.24 3.28 0.00 -1.01 -4.47 105.19 106.32 1do9 n GLY 77 Ca 0.11 -0.91 -0.15 0.00 0.00 0.00 0.00 46.02 45.06 1do9 n GLY 77 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1do9 s GLU 78 N -0.64 1.02 0.87 1.61 2.12 -1.26 -1.80 118.70 120.62 1do9 s GLU 78 Ca 0.00 -1.34 -0.12 0.00 0.36 0.00 0.00 54.97 53.87 1do9 s GLU 78 Cb 0.00 -0.70 0.09 0.00 0.26 0.00 0.00 34.13 33.78 1do9 s GLU 78 CO 0.00 0.11 1.01 1.28 -0.54 0.00 0.00 175.26 177.12 1do9 n LEU 79 N 0.14 3.04 -4.55 2.70 7.99 -1.26 -2.18 117.00 122.88 1do9 n LEU 79 Ca -0.13 0.48 -0.39 0.00 -0.01 0.00 0.00 56.01 55.97 1do9 n LEU 79 Cb 0.59 -1.43 0.04 0.00 -0.11 0.00 0.00 43.42 42.51 1do9 n LEU 79 CO 0.30 -2.27 0.35 1.41 -1.51 0.00 0.00 177.39 175.67 1do9 n HIS 80 N -3.66 0.26 0.25 -1.77 8.25 -0.50 -4.69 115.22 113.36 1do9 n HIS 80 Ca 0.12 0.46 0.13 0.00 -0.26 0.00 0.00 57.72 58.17 1do9 n HIS 80 Cb 0.51 -2.08 0.65 0.00 1.12 0.00 0.00 29.99 30.20 1do9 n HIS 80 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1do9 h PRO 81 N 0.56 0.00 -0.19 -0.41 0.13 -1.92 -0.49 132.00 129.68 1do9 h PRO 81 Ca -0.46 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.47 1do9 h PRO 81 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1do9 h PRO 81 CO 0.50 0.13 -0.68 -0.44 -0.23 0.00 0.00 178.00 177.29 1do9 h ASP 82 N 0.00 0.85 0.43 1.44 3.32 -1.89 -3.09 116.42 117.48 1do9 h ASP 82 Ca -0.00 -0.51 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1do9 h ASP 82 Cb 0.50 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1do9 h ASP 82 CO 0.02 1.29 0.00 -0.78 -1.72 0.00 0.00 179.24 178.05 1do9 h ASP 83 N 0.53 0.00 -0.26 6.45 3.58 -1.32 0.20 116.42 125.61 1do9 h ASP 83 Ca -0.02 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.39 1do9 h ASP 83 Cb 1.28 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.31 1do9 h ASP 83 CO 0.14 0.00 0.06 -0.09 -2.88 0.00 0.00 179.24 176.47 1do9 h ARG 84 N 0.00 0.50 0.00 0.28 1.12 -1.41 -3.42 114.38 111.46 1do9 h ARG 84 Ca 0.00 -0.08 0.00 0.00 -1.11 0.00 0.00 59.98 58.79 1do9 h ARG 84 Cb 0.22 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.09 1do9 h ARG 84 CO 0.00 0.48 0.00 0.45 -3.11 0.00 0.00 179.97 177.79 1do9 n SER 85 N -4.33 0.00 -2.89 -3.80 2.88 -1.07 -5.11 113.62 99.30 1do9 n SER 85 Ca 0.02 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.45 1do9 n SER 85 Cb 0.20 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.65 1do9 n SER 85 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1do9 n LYS 86 N 0.00 0.56 -2.20 -1.46 5.02 0.68 -5.01 118.16 115.75 1do9 n LYS 86 Ca 0.00 -2.23 -0.29 0.00 -2.02 0.00 0.00 58.31 53.77 1do9 n LYS 86 Cb 0.00 -1.48 0.02 0.00 -0.02 0.00 0.00 35.03 33.55 1do9 n LYS 86 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1do9 n LEU 87 N 2.46 5.49 -3.07 -0.35 4.77 -1.24 -4.50 117.00 120.56 1do9 n LEU 87 Ca 0.18 -4.99 -0.02 0.00 -0.03 0.00 0.00 56.01 51.15 1do9 n LEU 87 Cb 0.56 -0.59 -0.01 0.00 -2.33 0.00 0.00 43.42 41.06 1do9 n LEU 87 CO 0.03 2.07 0.08 -0.55 -1.33 0.00 0.00 177.39 177.69 1do9 s SER 88 N -2.98 -1.36 -0.15 -1.43 0.15 -1.26 -5.13 113.70 101.54 1do9 s SER 88 Ca 0.51 -1.16 -0.11 0.00 0.70 0.00 0.00 55.95 55.88 1do9 s SER 88 Cb 0.42 1.85 -0.05 0.00 -1.71 0.00 0.00 66.02 66.53 1do9 s SER 88 CO -0.17 -0.13 0.21 -0.75 1.20 0.00 0.00 173.24 173.59 1do9 s LYS 89 N 1.48 3.99 1.10 5.44 2.47 -1.26 -5.11 119.74 127.86 1do9 s LYS 89 Ca 0.21 -0.04 -0.19 0.00 -1.56 0.00 0.00 55.97 54.39 1do9 s LYS 89 Cb -0.03 -3.35 0.27 0.00 -1.46 0.00 0.00 37.83 33.26 1do9 s LYS 89 CO -0.06 0.44 1.17 -0.35 0.16 0.00 0.00 175.35 176.70 1do9 n PRO 90 N 2.99 -2.32 -2.48 4.03 -0.04 -1.26 -5.10 135.00 130.82 1do9 n PRO 90 Ca -0.16 -1.84 -0.18 0.00 -0.04 0.00 0.00 63.50 61.28 1do9 n PRO 90 Cb 0.53 -1.49 0.08 0.00 -0.04 0.00 0.00 33.50 32.58 1do9 n PRO 90 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1do9 n MET 91 N -4.34 0.30 -3.79 0.54 0.00 -1.26 -5.15 117.12 103.41 1do9 n MET 91 Ca 0.15 -2.50 -0.10 0.00 0.00 0.00 0.00 57.70 55.26 1do9 n MET 91 Cb 0.57 -0.40 -0.06 0.00 0.00 0.00 0.00 33.22 33.33 1do9 n MET 91 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1do9 s GLU 92 N -4.52 1.12 0.17 3.17 -6.30 -1.26 -5.19 118.70 105.89 1do9 s GLU 92 Ca 0.55 -0.93 -0.03 0.00 -2.50 0.00 0.00 54.97 52.06 1do9 s GLU 92 Cb -0.04 0.43 0.01 0.00 0.00 0.00 0.00 34.13 34.54 1do9 s GLU 92 CO 0.36 -0.43 0.27 -2.37 0.02 0.00 0.00 175.26 173.11 1do9 n THR 93 N -0.22 0.00 0.69 -1.70 5.66 -1.26 -5.36 114.28 112.09 1do9 n THR 93 Ca -0.12 -0.67 0.05 0.00 -3.05 0.00 0.00 64.05 60.26 1do9 n THR 93 Cb 0.63 0.48 0.33 0.00 -1.55 0.00 0.00 70.33 70.21 1do9 n THR 93 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91