#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j05 s ILE 2 N 0.00 4.81 0.03 2.12 1.01 -1.26 -5.00 121.20 122.91 1j05 s ILE 2 Ca 0.00 1.01 -0.27 0.00 0.00 0.00 0.00 60.65 61.39 1j05 s ILE 2 Cb 0.00 -4.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.29 1j05 s ILE 2 CO 0.00 -0.28 0.86 -0.69 0.00 0.00 0.00 174.94 174.83 1j05 s VAL 3 N 2.91 4.77 -0.15 2.92 1.01 -1.26 -4.76 120.40 125.85 1j05 s VAL 3 Ca 0.30 1.81 -0.01 0.00 0.00 0.00 0.00 61.98 64.08 1j05 s VAL 3 Cb -0.14 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 1j05 s VAL 3 CO 0.14 0.28 -0.10 -0.76 0.00 0.00 0.00 175.10 174.65 1j05 s LEU 4 N 0.39 2.81 -0.19 3.92 1.43 -1.26 -0.83 118.68 124.95 1j05 s LEU 4 Ca 0.44 -0.31 -0.02 0.00 -1.03 0.00 0.00 54.13 53.21 1j05 s LEU 4 Cb -0.21 -1.65 -0.00 0.00 0.03 0.00 0.00 46.19 44.36 1j05 s LEU 4 CO 0.25 0.14 -0.10 -0.89 0.23 0.00 0.00 176.35 175.97 1j05 s THR 5 N 0.54 2.98 0.06 5.49 2.01 0.70 -4.24 115.64 123.18 1j05 s THR 5 Ca -0.07 -0.64 0.01 0.00 0.31 0.00 0.00 61.69 61.30 1j05 s THR 5 Cb -0.15 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.00 1j05 s THR 5 CO 0.04 0.47 0.13 -1.10 -0.69 0.00 0.00 174.62 173.47 1j05 s GLN 6 N 1.18 3.13 -0.00 4.92 -0.21 -1.26 -0.59 119.66 126.83 1j05 s GLN 6 Ca 0.02 -0.57 -0.18 0.00 0.02 0.00 0.00 55.36 54.65 1j05 s GLN 6 Cb -0.14 -2.87 0.03 0.00 1.00 0.00 0.00 33.01 31.03 1j05 s GLN 6 CO -0.04 0.59 0.40 0.45 -2.12 0.00 0.00 175.29 174.57 1j05 s SER 7 N -2.37 -0.29 0.84 5.90 0.15 -0.79 -4.57 113.70 112.57 1j05 s SER 7 Ca 0.31 0.16 -0.12 0.00 0.70 0.00 0.00 55.95 57.00 1j05 s SER 7 Cb -0.12 0.38 0.09 0.00 -1.71 0.00 0.00 66.02 64.66 1j05 s SER 7 CO 0.24 -0.53 1.10 -2.16 1.20 0.00 0.00 173.24 173.09 1j05 s PRO 8 N -1.63 1.74 0.26 5.44 0.04 -1.26 -1.22 135.00 138.37 1j05 s PRO 8 Ca -0.11 0.58 -0.04 0.00 0.04 0.00 0.00 61.00 61.48 1j05 s PRO 8 Cb -0.03 -1.88 0.32 0.00 0.04 0.00 0.00 34.50 32.94 1j05 s PRO 8 CO 0.03 -1.85 1.86 0.00 0.04 0.00 0.00 177.00 177.08 1j05 h ALA 9 N -1.25 1.21 -3.73 8.56 0.00 -1.83 -3.41 119.26 118.81 1j05 h ALA 9 Ca -0.48 -0.15 -0.28 0.00 0.00 0.00 0.00 54.91 54.00 1j05 h ALA 9 Cb 1.29 -0.30 -0.27 0.00 0.00 0.00 0.00 17.79 18.50 1j05 h ALA 9 CO 0.59 0.60 -0.74 0.45 0.00 0.00 0.00 179.25 180.15 1j05 s SER 10 N -6.39 0.41 -0.05 0.00 0.15 -1.26 -1.18 113.70 105.37 1j05 s SER 10 Ca -0.11 -0.12 -0.01 0.00 0.70 0.00 0.00 55.95 56.40 1j05 s SER 10 Cb 0.16 -0.03 0.03 0.00 -1.71 0.00 0.00 66.02 64.47 1j05 s SER 10 CO 0.81 -0.00 0.01 -0.22 1.20 0.00 0.00 173.24 175.04 1j05 s LEU 11 N -0.28 0.73 -0.20 3.45 2.96 0.38 -4.91 118.68 120.81 1j05 s LEU 11 Ca -0.01 -0.05 -0.07 0.00 -0.22 0.00 0.00 54.13 53.78 1j05 s LEU 11 Cb -0.02 -0.34 -0.04 0.00 0.50 0.00 0.00 46.19 46.29 1j05 s LEU 11 CO -0.00 -0.17 0.06 0.00 -1.32 0.00 0.00 176.35 174.92 1j05 s ALA 12 N 1.66 3.33 0.02 5.97 0.00 -1.26 -0.34 121.76 131.15 1j05 s ALA 12 Ca -0.00 -0.83 0.02 0.00 0.00 0.00 0.00 51.96 51.15 1j05 s ALA 12 Cb -0.13 -1.94 -0.02 0.00 0.00 0.00 0.00 23.12 21.03 1j05 s ALA 12 CO -0.03 0.03 -0.08 0.54 0.00 0.00 0.00 175.76 176.22 1j05 s VAL 13 N 0.65 0.56 0.48 0.00 0.11 -0.54 -4.65 120.40 117.01 1j05 s VAL 13 Ca 0.03 -0.73 -0.21 0.00 -2.93 0.00 0.00 61.98 58.14 1j05 s VAL 13 Cb -0.13 -0.56 -0.08 0.00 -1.53 0.00 0.00 36.38 34.09 1j05 s VAL 13 CO 0.02 -0.13 1.08 -0.44 -3.33 0.00 0.00 175.10 172.30 1j05 s SER 14 N -0.94 6.23 0.36 3.54 0.01 -1.26 -0.78 113.70 120.87 1j05 s SER 14 Ca -0.04 2.08 -0.28 0.00 1.31 0.00 0.00 55.95 59.02 1j05 s SER 14 Cb -0.07 -2.58 -0.11 0.00 0.21 0.00 0.00 66.02 63.48 1j05 s SER 14 CO 0.00 -0.86 1.49 0.18 0.41 0.00 0.00 173.24 174.46 1j05 n LEU 15 N -0.80 4.67 0.00 2.44 4.77 -1.26 -1.73 117.00 125.08 1j05 n LEU 15 Ca 0.09 1.22 0.00 0.00 -0.03 0.00 0.00 56.01 57.28 1j05 n LEU 15 Cb 0.51 -1.61 0.00 0.00 -2.33 0.00 0.00 43.42 39.99 1j05 n LEU 15 CO 0.43 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1j05 n GLY 16 N 0.69 1.86 3.99 -0.72 0.00 -0.27 -4.94 105.19 105.80 1j05 n GLY 16 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 1j05 n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j05 s GLN 17 N -0.45 1.54 0.00 1.61 -1.52 -0.71 -4.45 119.66 115.69 1j05 s GLN 17 Ca 0.00 -1.07 -0.19 0.00 -1.95 0.00 0.00 55.36 52.16 1j05 s GLN 17 Cb 0.00 -2.28 -0.06 0.00 -0.22 0.00 0.00 33.01 30.45 1j05 s GLN 17 CO 0.00 -1.57 0.53 0.50 -0.25 0.00 0.00 175.29 174.50 1j05 s ARG 18 N -5.23 4.20 -0.21 2.91 3.52 -1.26 -0.62 118.95 122.26 1j05 s ARG 18 Ca 0.67 0.62 -0.08 0.00 -0.13 0.00 0.00 55.73 56.81 1j05 s ARG 18 Cb -0.05 -3.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.00 1j05 s ARG 18 CO 0.45 0.48 0.08 0.00 -0.81 0.00 0.00 175.30 175.51 1j05 s ALA 19 N -0.52 3.36 -0.16 6.12 0.00 0.03 -4.95 121.76 125.64 1j05 s ALA 19 Ca 0.28 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.36 1j05 s ALA 19 Cb -0.18 -2.03 0.02 0.00 0.00 0.00 0.00 23.12 20.93 1j05 s ALA 19 CO 0.16 -0.09 -0.18 0.99 0.00 0.00 0.00 175.76 176.63 1j05 s THR 20 N 0.88 1.89 -0.11 0.00 2.01 -1.26 -0.77 115.64 118.27 1j05 s THR 20 Ca 0.04 -0.84 0.03 0.00 0.31 0.00 0.00 61.69 61.23 1j05 s THR 20 Cb -0.14 -1.71 -0.01 0.00 0.01 0.00 0.00 72.50 70.65 1j05 s THR 20 CO 0.03 0.51 -0.21 -0.04 -0.69 0.00 0.00 174.62 174.22 1j05 s MET 21 N 1.26 3.11 -0.04 4.92 -1.94 0.05 -4.81 119.30 121.85 1j05 s MET 21 Ca 0.03 -0.82 -0.02 0.00 -1.71 0.00 0.00 55.69 53.17 1j05 s MET 21 Cb -0.13 -2.39 -0.04 0.00 2.01 0.00 0.00 34.83 34.27 1j05 s MET 21 CO -0.10 0.21 0.09 0.45 -0.01 0.00 0.00 175.02 175.66 1j05 s SER 22 N 0.29 5.83 -0.08 3.03 0.15 -0.36 -0.66 113.70 121.90 1j05 s SER 22 Ca -0.15 0.24 -0.01 0.00 0.70 0.00 0.00 55.95 56.73 1j05 s SER 22 Cb -0.17 -1.74 0.03 0.00 -1.71 0.00 0.00 66.02 62.43 1j05 s SER 22 CO 0.07 0.32 -0.02 0.00 1.20 0.00 0.00 173.24 174.82 1j05 s ARG 24 N 1.85 3.17 -0.04 0.00 0.52 0.24 -0.64 118.95 124.05 1j05 s ARG 24 Ca 0.04 -0.79 -0.14 0.00 -0.52 0.00 0.00 55.73 54.32 1j05 s ARG 24 Cb -0.12 -2.53 -0.05 0.00 0.52 0.00 0.00 34.95 32.77 1j05 s ARG 24 CO -0.05 0.07 0.37 0.00 0.02 0.00 0.00 175.30 175.71 1j05 s ALA 25 N 0.66 3.68 -0.47 2.13 0.00 0.45 -0.22 121.76 128.00 1j05 s ALA 25 Ca -0.09 -0.29 0.26 0.00 0.00 0.00 0.00 51.96 51.84 1j05 s ALA 25 Cb -0.16 -2.37 0.92 0.00 0.00 0.00 0.00 23.12 21.51 1j05 s ALA 25 CO 0.02 0.40 1.77 0.78 0.00 0.00 0.00 175.76 178.73 1j05 h GLY 26 N 5.16 0.00 -2.80 0.00 0.00 -1.31 -3.44 103.07 100.68 1j05 h GLY 26 Ca -0.50 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 46.61 1j05 h GLY 26 CO 0.64 0.00 -0.65 -1.83 0.00 0.00 0.00 176.54 174.70 1j05 s GLU 27 N -3.29 1.01 0.40 4.80 -1.05 -1.26 -4.98 118.70 114.33 1j05 s GLU 27 Ca 0.06 -1.49 -0.26 0.00 -0.15 0.00 0.00 54.97 53.13 1j05 s GLU 27 Cb 0.10 0.07 -0.09 0.00 -0.44 0.00 0.00 34.13 33.77 1j05 s GLU 27 CO 0.51 -0.23 1.27 -1.54 0.95 0.00 0.00 175.26 176.23 1j05 s SER 27 N -3.10 6.38 -0.08 0.83 1.04 -1.26 -4.73 113.70 112.77 1j05 s SER 27 Ca 0.25 2.59 0.12 0.00 0.48 0.00 0.00 55.95 59.40 1j05 s SER 27 Cb 0.07 -2.63 0.34 0.00 0.10 0.00 0.00 66.02 63.90 1j05 s SER 27 CO 0.03 -0.80 1.27 1.33 0.98 0.00 0.00 173.24 176.05 1j05 n VAL 27 N 0.15 1.58 -3.73 5.02 0.24 -0.12 -5.00 118.33 116.47 1j05 n VAL 27 Ca 0.04 -1.48 -0.31 0.00 -2.04 0.00 0.00 64.34 60.55 1j05 n VAL 27 Cb 0.44 0.13 -0.04 0.00 -1.47 0.00 0.00 33.84 32.90 1j05 n VAL 27 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1j05 s ASP 27 N -1.57 6.44 -0.39 -1.34 -4.77 -1.26 -1.70 116.67 112.08 1j05 s ASP 27 Ca 0.28 0.49 -0.01 0.00 -3.30 0.00 0.00 52.55 50.01 1j05 s ASP 27 Cb 0.20 -2.05 0.11 0.00 -1.09 0.00 0.00 42.92 40.09 1j05 s ASP 27 CO 0.09 0.06 0.16 -0.63 0.70 0.00 0.00 175.17 175.55 1j05 s ILE 27 N -1.67 2.96 -1.33 2.11 -1.09 0.72 -4.73 121.20 118.17 1j05 s ILE 27 Ca 0.39 -2.18 -0.05 0.00 -2.23 0.00 0.00 60.65 56.58 1j05 s ILE 27 Cb -0.12 -3.07 0.02 0.00 -1.58 0.00 0.00 42.46 37.71 1j05 s ILE 27 CO 0.26 -0.67 0.99 0.49 -1.23 0.00 0.00 174.94 174.78 1j05 n PHE 28 N 4.44 -2.36 -2.05 3.97 3.72 -1.26 -1.50 117.46 122.42 1j05 n PHE 28 Ca 0.00 0.94 -0.14 0.00 -0.05 0.00 0.00 57.45 58.20 1j05 n PHE 28 Cb 0.41 -4.73 -0.02 0.00 -0.94 0.00 0.00 39.48 34.21 1j05 n PHE 28 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1j05 n GLY 29 N -1.59 0.21 3.10 1.37 0.00 -1.26 -4.99 105.19 102.02 1j05 n GLY 29 Ca -0.14 -0.31 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 1j05 n GLY 29 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j05 s VAL 30 N -2.66 2.08 -0.14 1.61 1.01 -0.56 -4.99 120.40 116.75 1j05 s VAL 30 Ca 0.00 -1.20 -0.26 0.00 0.00 0.00 0.00 61.98 60.52 1j05 s VAL 30 Cb 0.00 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 1j05 s VAL 30 CO 0.00 0.31 0.86 -0.83 0.00 0.00 0.00 175.10 175.45 1j05 s GLY 31 N 1.23 2.24 -1.17 4.51 0.00 -1.21 -0.20 107.32 112.72 1j05 s GLY 31 Ca -0.00 0.14 -0.07 0.00 0.00 0.00 0.00 44.72 44.79 1j05 s GLY 31 CO -0.10 1.68 1.64 0.69 0.00 0.00 0.00 173.10 177.01 1j05 n PHE 32 N 4.99 2.68 -3.81 1.90 3.01 -0.69 -2.91 117.46 122.63 1j05 n PHE 32 Ca 0.05 -2.72 -0.24 0.00 1.01 0.00 0.00 57.45 55.55 1j05 n PHE 32 Cb 0.49 -1.58 -0.17 0.00 -0.01 0.00 0.00 39.48 38.21 1j05 n PHE 32 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1j05 s LEU 33 N -1.56 0.80 0.23 4.37 1.98 -1.26 -1.52 118.68 121.72 1j05 s LEU 33 Ca 0.35 -0.18 0.12 0.00 -2.89 0.00 0.00 54.13 51.52 1j05 s LEU 33 Cb 0.06 -0.57 -0.05 0.00 0.66 0.00 0.00 46.19 46.29 1j05 s LEU 33 CO 0.06 -0.18 -0.22 -1.00 -1.89 0.00 0.00 176.35 173.12 1j05 s HIS 34 N 1.89 2.30 -0.03 5.38 3.76 -0.05 -0.13 115.29 128.40 1j05 s HIS 34 Ca 0.05 -0.35 0.06 0.00 -0.15 0.00 0.00 55.06 54.67 1j05 s HIS 34 Cb -0.13 -1.08 -0.01 0.00 1.11 0.00 0.00 32.58 32.47 1j05 s HIS 34 CO -0.06 0.58 -0.21 -1.58 -0.85 0.00 0.00 174.74 172.62 1j05 s TRP 35 N -1.99 1.99 0.06 1.40 0.52 0.08 -1.33 118.94 119.68 1j05 s TRP 35 Ca 0.24 -0.49 0.07 0.00 0.02 0.00 0.00 56.10 55.95 1j05 s TRP 35 Cb -0.07 -1.30 -0.03 0.00 -1.15 0.00 0.00 33.47 30.92 1j05 s TRP 35 CO 0.12 -0.11 -0.19 0.71 0.02 0.00 0.00 176.95 177.50 1j05 s TYR 36 N -0.27 1.63 -0.05 -1.98 1.51 -0.25 -0.47 117.35 117.46 1j05 s TYR 36 Ca 0.02 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.71 1j05 s TYR 36 Cb -0.10 -0.94 -0.03 0.00 -0.11 0.00 0.00 41.96 40.78 1j05 s TYR 36 CO 0.01 0.11 -0.08 -1.14 -1.11 0.00 0.00 175.55 173.34 1j05 s GLN 37 N -1.46 2.66 -0.02 -0.62 0.74 -0.06 -1.19 119.66 119.70 1j05 s GLN 37 Ca 0.05 -0.61 0.00 0.00 0.05 0.00 0.00 55.36 54.85 1j05 s GLN 37 Cb -0.09 -2.53 0.03 0.00 1.10 0.00 0.00 33.01 31.51 1j05 s GLN 37 CO 0.03 0.64 0.02 -1.14 -0.55 0.00 0.00 175.29 174.29 1j05 s GLN 38 N -0.93 0.03 0.24 1.67 0.74 0.74 -0.05 119.66 122.11 1j05 s GLN 38 Ca 0.13 0.17 0.09 0.00 0.05 0.00 0.00 55.36 55.80 1j05 s GLN 38 Cb -0.11 -0.31 -0.04 0.00 1.10 0.00 0.00 33.01 33.65 1j05 s GLN 38 CO 0.03 -0.17 -0.00 0.15 -0.55 0.00 0.00 175.29 174.74 1j05 s LYS 39 N 1.11 2.32 0.23 1.67 1.02 -1.26 -1.19 119.74 123.63 1j05 s LYS 39 Ca -0.09 -1.32 -0.32 0.00 0.02 0.00 0.00 55.97 54.27 1j05 s LYS 39 Cb -0.13 -2.22 -0.13 0.00 -0.52 0.00 0.00 37.83 34.83 1j05 s LYS 39 CO -0.03 0.39 1.52 -2.30 -0.92 0.00 0.00 175.35 174.02 1j05 n PRO 40 N -0.64 2.29 -0.85 -1.68 -0.02 -1.26 -1.59 135.00 131.25 1j05 n PRO 40 Ca -0.08 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1j05 n PRO 40 Cb 0.58 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1j05 n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j05 n GLY 41 N 2.64 0.86 3.39 -1.23 0.00 -1.26 -5.01 105.19 104.59 1j05 n GLY 41 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 1j05 n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j05 s GLN 42 N -0.15 1.44 0.86 1.61 -0.21 -0.62 -5.14 119.66 117.44 1j05 s GLN 42 Ca 0.00 -1.48 -0.12 0.00 0.02 0.00 0.00 55.36 53.78 1j05 s GLN 42 Cb 0.00 -1.69 0.11 0.00 1.00 0.00 0.00 33.01 32.42 1j05 s GLN 42 CO 0.00 0.36 1.12 -1.25 -2.12 0.00 0.00 175.29 173.40 1j05 s PRO 43 N -2.68 1.58 0.65 2.91 0.04 -1.26 -4.57 135.00 131.67 1j05 s PRO 43 Ca 0.19 0.47 -0.18 0.00 0.04 0.00 0.00 61.00 61.52 1j05 s PRO 43 Cb -0.07 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 1j05 s PRO 43 CO 0.09 -1.93 1.25 -2.30 0.04 0.00 0.00 177.00 174.14 1j05 n PRO 44 N -3.61 1.06 -4.61 0.56 -0.02 -1.26 -4.60 135.00 122.52 1j05 n PRO 44 Ca 0.07 0.42 -0.32 0.00 -2.02 0.00 0.00 63.50 61.65 1j05 n PRO 44 Cb 0.58 -2.48 -0.17 0.00 -0.02 0.00 0.00 33.50 31.41 1j05 n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1j05 s LYS 45 N -3.31 2.82 0.12 -0.52 2.20 0.93 -4.93 119.74 117.04 1j05 s LYS 45 Ca 0.82 -0.78 -0.31 0.00 -0.36 0.00 0.00 55.97 55.34 1j05 s LYS 45 Cb -0.38 -2.30 -0.09 0.00 -1.51 0.00 0.00 37.83 33.55 1j05 s LYS 45 CO 0.41 -0.03 1.52 -1.17 -0.36 0.00 0.00 175.35 175.72 1j05 s LEU 46 N 0.87 4.36 -0.19 5.43 2.96 -1.26 -0.88 118.68 129.97 1j05 s LEU 46 Ca -0.07 2.46 -0.10 0.00 -0.22 0.00 0.00 54.13 56.20 1j05 s LEU 46 Cb -0.15 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 42.87 1j05 s LEU 46 CO -0.02 -0.77 -0.25 0.18 -1.32 0.00 0.00 176.35 174.16 1j05 n LEU 47 N 4.41 1.39 -3.83 -0.68 4.77 0.37 -4.80 117.00 118.63 1j05 n LEU 47 Ca 0.13 0.24 -0.16 0.00 -0.03 0.00 0.00 56.01 56.19 1j05 n LEU 47 Cb 0.40 -0.57 -0.16 0.00 -2.33 0.00 0.00 43.42 40.76 1j05 n LEU 47 CO 0.61 0.35 -0.37 -0.63 -1.33 0.00 0.00 177.39 176.02 1j05 s ILE 48 N -2.37 0.13 0.16 -0.08 -1.09 -1.10 -1.35 121.20 115.50 1j05 s ILE 48 Ca -0.27 0.07 0.10 0.00 -2.23 0.00 0.00 60.65 58.32 1j05 s ILE 48 Cb 0.10 -0.21 -0.04 0.00 -1.58 0.00 0.00 42.46 40.73 1j05 s ILE 48 CO 0.34 0.11 -0.16 -0.72 -1.23 0.00 0.00 174.94 173.28 1j05 s TYR 49 N 0.80 2.51 -1.31 3.97 -0.85 0.06 -0.74 117.35 121.79 1j05 s TYR 49 Ca -0.08 -0.27 -0.10 0.00 -0.52 0.00 0.00 57.07 56.10 1j05 s TYR 49 Cb -0.11 -1.26 0.00 0.00 0.38 0.00 0.00 41.96 40.97 1j05 s TYR 49 CO -0.02 0.47 0.53 0.54 -1.52 0.00 0.00 175.55 175.56 1j05 n ARG 50 N 0.33 -2.28 0.00 -3.49 1.74 -1.18 -1.60 116.66 110.18 1j05 n ARG 50 Ca -0.13 0.37 0.00 0.00 -0.77 0.00 0.00 57.85 57.33 1j05 n ARG 50 Cb 0.55 -4.17 0.00 0.00 -1.02 0.00 0.00 32.46 27.81 1j05 n ARG 50 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1j05 n ALA 51 N -4.41 0.00 -1.16 7.54 0.00 0.81 -4.10 120.51 119.20 1j05 n ALA 51 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1j05 n ALA 51 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1j05 n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1j05 n SER 52 N 1.37 0.00 -4.62 0.00 3.41 -1.19 -3.35 113.62 109.23 1j05 n SER 52 Ca 0.00 -1.00 -0.39 0.00 -0.26 0.00 0.00 58.87 57.22 1j05 n SER 52 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 1j05 n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1j05 s ASN 53 N 0.00 6.30 0.15 4.04 0.01 -0.62 -4.56 114.94 120.26 1j05 s ASN 53 Ca 0.00 0.35 -0.30 0.00 -0.71 0.00 0.00 52.86 52.20 1j05 s ASN 53 Cb 0.00 -2.22 -0.07 0.00 0.41 0.00 0.00 41.25 39.37 1j05 s ASN 53 CO 0.00 -0.16 1.24 -0.76 -1.51 0.00 0.00 177.10 175.91 1j05 s LEU 54 N 1.87 4.41 0.41 0.60 1.02 -1.26 -0.76 118.68 124.98 1j05 s LEU 54 Ca 0.16 2.21 -0.25 0.00 0.02 0.00 0.00 54.13 56.27 1j05 s LEU 54 Cb -0.15 -3.60 -0.08 0.00 0.02 0.00 0.00 46.19 42.38 1j05 s LEU 54 CO 0.09 -0.45 1.21 -0.70 0.02 0.00 0.00 176.35 176.52 1j05 s GLU 55 N 0.29 3.98 0.25 1.70 2.56 -0.46 -4.91 118.70 122.11 1j05 s GLU 55 Ca 0.56 1.94 -0.31 0.00 0.00 0.00 0.00 54.97 57.16 1j05 s GLU 55 Cb -0.33 -2.67 -0.13 0.00 2.00 0.00 0.00 34.13 33.00 1j05 s GLU 55 CO 0.34 -0.41 1.38 0.45 -0.56 0.00 0.00 175.26 176.46 1j05 n SER 56 N 0.02 2.66 0.00 -1.70 2.88 -1.26 -1.77 113.62 114.45 1j05 n SER 56 Ca 0.04 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 1j05 n SER 56 Cb 0.46 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.50 1j05 n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1j05 n GLY 57 N 2.02 2.11 3.74 0.46 0.00 -1.26 -5.05 105.19 107.20 1j05 n GLY 57 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1j05 n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j05 s ILE 58 N -2.31 4.52 0.63 -0.61 -1.09 -0.73 -5.00 121.20 116.61 1j05 s ILE 58 Ca 0.00 1.92 -0.18 0.00 -2.23 0.00 0.00 60.65 60.16 1j05 s ILE 58 Cb 0.00 -4.25 -0.03 0.00 -1.58 0.00 0.00 42.46 36.60 1j05 s ILE 58 CO 0.00 0.36 1.15 -2.65 -1.23 0.00 0.00 174.94 172.57 1j05 n PRO 59 N 2.60 1.03 0.05 2.79 -0.02 -1.26 -4.87 135.00 135.31 1j05 n PRO 59 Ca -0.00 0.40 0.08 0.00 -2.02 0.00 0.00 63.50 61.96 1j05 n PRO 59 Cb 0.49 -2.37 0.34 0.00 -0.02 0.00 0.00 33.50 31.94 1j05 n PRO 59 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1j05 n VAL 60 N -1.83 1.08 0.51 -1.45 0.24 -1.26 -1.96 118.33 113.67 1j05 n VAL 60 Ca 0.15 0.31 0.07 0.00 -2.04 0.00 0.00 64.34 62.83 1j05 n VAL 60 Cb 0.48 -1.17 0.31 0.00 -1.47 0.00 0.00 33.84 31.99 1j05 n VAL 60 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1j05 n ARG 61 N -1.77 0.02 -3.37 7.34 1.85 -1.26 -4.63 116.66 114.83 1j05 n ARG 61 Ca 0.02 0.24 -0.38 0.00 -1.00 0.00 0.00 57.85 56.73 1j05 n ARG 61 Cb 0.16 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 30.01 1j05 n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1j05 s PHE 62 N -2.96 3.72 0.13 2.89 0.40 -0.83 -1.24 117.98 120.08 1j05 s PHE 62 Ca 0.08 1.09 -0.10 0.00 -0.60 0.00 0.00 56.93 57.39 1j05 s PHE 62 Cb 0.09 -2.43 0.00 0.00 0.51 0.00 0.00 43.02 41.20 1j05 s PHE 62 CO 0.26 0.52 0.27 -1.54 0.70 0.00 0.00 175.22 175.43 1j05 s SER 63 N -0.73 0.03 0.03 1.36 1.04 -0.22 -4.97 113.70 110.25 1j05 s SER 63 Ca 0.26 -0.68 0.02 0.00 0.48 0.00 0.00 55.95 56.03 1j05 s SER 63 Cb -0.17 0.40 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 1j05 s SER 63 CO 0.15 -0.82 -0.07 -0.83 0.98 0.00 0.00 173.24 172.65 1j05 s GLY 64 N -2.89 0.46 0.06 7.32 0.00 -1.26 -0.92 107.32 110.09 1j05 s GLY 64 Ca 0.09 -0.66 0.00 0.00 0.00 0.00 0.00 44.72 44.16 1j05 s GLY 64 CO -0.07 -0.69 -0.05 -0.51 0.00 0.00 0.00 173.10 171.78 1j05 s THR 65 N -1.12 0.37 0.00 0.90 -4.23 -0.46 -4.26 115.64 106.84 1j05 s THR 65 Ca -0.07 -1.54 0.00 0.00 -1.18 0.00 0.00 61.69 58.90 1j05 s THR 65 Cb -0.08 -1.16 0.00 0.00 1.34 0.00 0.00 72.50 72.60 1j05 s THR 65 CO 0.00 -0.77 0.00 0.61 -0.54 0.00 0.00 174.62 173.93 1j05 n GLY 66 N 0.59 2.99 0.00 3.99 0.00 -1.26 -1.18 105.19 110.33 1j05 n GLY 66 Ca -0.17 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.81 1j05 n GLY 66 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1j05 n SER 67 N 0.00 0.00 0.00 1.61 3.41 -1.25 -4.68 113.62 112.70 1j05 n SER 67 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1j05 n SER 67 Cb 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1j05 n SER 67 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1j05 n ARG 68 N -0.19 0.02 0.00 4.33 1.74 -1.26 -3.30 116.66 118.01 1j05 n ARG 68 Ca 0.00 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 1j05 n ARG 68 Cb 0.00 -0.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.20 1j05 n ARG 68 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1j05 n THR 69 N -2.67 0.00 -4.44 0.55 -2.24 -1.26 -0.95 114.28 103.27 1j05 n THR 69 Ca -0.01 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 1j05 n THR 69 Cb 0.02 -0.27 -0.14 0.00 -2.10 0.00 0.00 70.33 67.84 1j05 n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1j05 s ASP 70 N -2.51 4.16 0.07 3.42 1.11 -1.26 -0.41 116.67 121.25 1j05 s ASP 70 Ca 0.00 -0.33 0.03 0.00 0.18 0.00 0.00 52.55 52.43 1j05 s ASP 70 Cb 0.00 -1.67 -0.03 0.00 1.07 0.00 0.00 42.92 42.29 1j05 s ASP 70 CO 0.00 0.10 -0.10 -0.36 1.18 0.00 0.00 175.17 176.00 1j05 s PHE 71 N 0.73 0.91 0.01 4.23 0.40 0.19 -3.92 117.98 120.53 1j05 s PHE 71 Ca -0.04 -0.56 0.01 0.00 -0.60 0.00 0.00 56.93 55.74 1j05 s PHE 71 Cb -0.15 -0.52 -0.01 0.00 0.51 0.00 0.00 43.02 42.85 1j05 s PHE 71 CO 0.02 -0.04 -0.05 0.95 0.70 0.00 0.00 175.22 176.80 1j05 s THR 72 N -1.80 0.38 -0.21 0.64 -4.23 -0.32 -1.16 115.64 108.95 1j05 s THR 72 Ca -0.03 -0.52 -0.10 0.00 -1.18 0.00 0.00 61.69 59.87 1j05 s THR 72 Cb -0.07 -0.39 -0.05 0.00 1.34 0.00 0.00 72.50 73.34 1j05 s THR 72 CO 0.00 -0.10 0.13 -0.22 -0.54 0.00 0.00 174.62 173.89 1j05 s LEU 73 N -0.66 4.10 -0.07 4.79 2.96 0.17 -1.35 118.68 128.61 1j05 s LEU 73 Ca -0.03 0.16 0.05 0.00 -0.22 0.00 0.00 54.13 54.08 1j05 s LEU 73 Cb -0.05 -2.07 -0.00 0.00 0.50 0.00 0.00 46.19 44.57 1j05 s LEU 73 CO -0.00 0.14 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.32 1j05 s ILE 74 N 0.62 1.83 -0.16 6.68 1.01 -0.09 -0.77 121.20 130.32 1j05 s ILE 74 Ca 0.07 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.82 1j05 s ILE 74 Cb -0.12 -1.57 0.02 0.00 0.01 0.00 0.00 42.46 40.79 1j05 s ILE 74 CO 0.01 0.51 -0.20 -0.63 0.00 0.00 0.00 174.94 174.62 1j05 s ILE 75 N 0.15 2.00 -0.28 2.92 1.01 0.05 -1.05 121.20 125.99 1j05 s ILE 75 Ca -0.10 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 59.57 1j05 s ILE 75 Cb -0.15 -1.79 0.15 0.00 0.01 0.00 0.00 42.46 40.68 1j05 s ILE 75 CO 0.05 0.53 0.57 -0.62 0.00 0.00 0.00 174.94 175.48 1j05 s ASP 76 N 1.06 -1.00 0.20 3.58 -1.08 -0.37 -0.79 116.67 118.26 1j05 s ASP 76 Ca -0.01 1.08 -0.09 0.00 -0.52 0.00 0.00 52.55 53.00 1j05 s ASP 76 Cb -0.14 2.02 -0.07 0.00 -1.46 0.00 0.00 42.92 43.27 1j05 s ASP 76 CO -0.07 -0.25 0.51 -2.16 0.52 0.00 0.00 175.17 173.72 1j05 s PRO 77 N 2.81 3.79 0.26 4.34 0.04 -1.26 -4.59 135.00 140.39 1j05 s PRO 77 Ca 0.08 0.23 -0.29 0.00 0.04 0.00 0.00 61.00 61.06 1j05 s PRO 77 Cb -0.14 -2.73 -0.09 0.00 0.04 0.00 0.00 34.50 31.58 1j05 s PRO 77 CO -0.19 0.37 1.21 0.08 0.04 0.00 0.00 177.00 178.52 1j05 s VAL 78 N -1.73 3.25 0.21 -0.36 1.01 0.20 -4.80 120.40 118.19 1j05 s VAL 78 Ca 0.44 1.17 0.08 0.00 0.00 0.00 0.00 61.98 63.67 1j05 s VAL 78 Cb -0.12 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 1j05 s VAL 78 CO 0.21 0.24 0.03 -1.61 0.00 0.00 0.00 175.10 173.98 1j05 s GLU 79 N -1.05 2.46 0.48 2.72 0.41 -1.26 -1.12 118.70 121.35 1j05 s GLU 79 Ca 0.49 -1.19 0.18 0.00 -0.41 0.00 0.00 54.97 54.05 1j05 s GLU 79 Cb -0.35 -2.34 1.19 0.00 -1.78 0.00 0.00 34.13 30.86 1j05 s GLU 79 CO 0.43 0.42 2.06 0.00 -0.49 0.00 0.00 175.26 177.68 1j05 h ALA 80 N 2.27 1.68 -0.05 5.21 0.00 -2.00 -0.86 119.26 125.51 1j05 h ALA 80 Ca -0.46 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1j05 h ALA 80 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1j05 h ALA 80 CO 0.59 0.15 0.00 -0.40 0.00 0.00 0.00 179.25 179.60 1j05 n ASP 81 N -4.23 0.95 -0.78 0.00 5.75 -1.26 -2.53 116.55 114.45 1j05 n ASP 81 Ca -0.03 -2.04 0.12 0.00 -0.01 0.00 0.00 54.79 52.83 1j05 n ASP 81 Cb 0.20 -0.32 0.29 0.00 -1.03 0.00 0.00 41.12 40.27 1j05 n ASP 81 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1j05 n ASP 82 N -0.10 2.41 -4.68 -1.12 8.00 -0.33 -4.88 116.55 115.84 1j05 n ASP 82 Ca 0.02 -1.80 -0.42 0.00 0.71 0.00 0.00 54.79 53.30 1j05 n ASP 82 Cb 0.21 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 1j05 n ASP 82 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1j05 s VAL 83 N -1.89 3.37 0.00 2.53 1.01 -1.05 -4.83 120.40 119.54 1j05 s VAL 83 Ca 0.34 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.98 1j05 s VAL 83 Cb 0.20 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 33.16 1j05 s VAL 83 CO 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 175.10 175.38 1j05 n ALA 84 N 6.22 0.00 -2.76 5.51 0.00 -1.17 -4.92 120.51 123.40 1j05 n ALA 84 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.25 1j05 n ALA 84 Cb 0.42 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.78 1j05 n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1j05 s THR 85 N -2.00 4.54 -0.08 0.00 2.01 -0.34 -0.75 115.64 119.03 1j05 s THR 85 Ca 0.00 -0.15 0.03 0.00 0.31 0.00 0.00 61.69 61.88 1j05 s THR 85 Cb 0.00 -2.95 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 1j05 s THR 85 CO 0.00 0.58 -0.16 -0.31 -0.69 0.00 0.00 174.62 174.04 1j05 s TYR 86 N -0.61 2.69 -0.01 4.92 1.51 0.47 -0.18 117.35 126.13 1j05 s TYR 86 Ca 0.10 -0.41 0.07 0.00 -1.01 0.00 0.00 57.07 55.82 1j05 s TYR 86 Cb -0.12 -1.69 -0.02 0.00 -0.11 0.00 0.00 41.96 40.02 1j05 s TYR 86 CO 0.02 -0.01 -0.22 0.71 -1.11 0.00 0.00 175.55 174.95 1j05 s TYR 87 N -0.29 1.94 0.24 2.71 2.02 -0.34 -1.22 117.35 122.40 1j05 s TYR 87 Ca 0.02 -0.37 0.03 0.00 -0.37 0.00 0.00 57.07 56.38 1j05 s TYR 87 Cb -0.13 -1.24 -0.03 0.00 -0.40 0.00 0.00 41.96 40.15 1j05 s TYR 87 CO 0.03 -0.02 0.39 0.00 -1.57 0.00 0.00 175.55 174.37 1j05 s GLN 89 N -3.77 0.20 0.09 0.00 0.74 -0.44 -0.54 119.66 115.95 1j05 s GLN 89 Ca 0.36 0.15 0.06 0.00 0.05 0.00 0.00 55.36 55.98 1j05 s GLN 89 Cb -0.10 0.10 -0.04 0.00 1.10 0.00 0.00 33.01 34.07 1j05 s GLN 89 CO 0.30 -0.03 -0.08 1.14 -0.55 0.00 0.00 175.29 176.08 1j05 s GLN 90 N -0.06 2.25 -0.10 1.67 1.03 -0.57 -0.87 119.66 123.00 1j05 s GLN 90 Ca -0.01 -0.96 0.16 0.00 0.04 0.00 0.00 55.36 54.59 1j05 s GLN 90 Cb -0.02 -2.37 0.36 0.00 0.03 0.00 0.00 33.01 31.02 1j05 s GLN 90 CO 0.00 0.52 1.17 0.25 -2.54 0.00 0.00 175.29 174.69 1j05 n THR 91 N 0.74 1.11 -0.09 3.63 -2.24 -0.57 -3.27 114.28 113.59 1j05 n THR 91 Ca -0.13 -1.95 -0.06 0.00 -2.27 0.00 0.00 64.05 59.65 1j05 n THR 91 Cb 0.52 0.30 0.13 0.00 -2.10 0.00 0.00 70.33 69.18 1j05 n THR 91 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1j05 h ASN 92 N 0.77 0.75 -5.02 3.42 -1.24 -1.84 -3.45 115.58 108.98 1j05 h ASN 92 Ca -0.08 -0.22 -0.12 0.00 0.71 0.00 0.00 56.30 56.58 1j05 h ASN 92 Cb 1.38 -0.20 -0.19 0.00 0.73 0.00 0.00 38.32 40.03 1j05 h ASN 92 CO 0.04 0.89 -0.35 -1.83 -1.29 0.00 0.00 177.43 174.89 1j05 s GLU 93 N -4.80 0.65 0.49 6.67 -1.05 -1.26 -5.10 118.70 114.31 1j05 s GLU 93 Ca -0.09 -0.39 -0.21 0.00 -0.15 0.00 0.00 54.97 54.13 1j05 s GLU 93 Cb 0.14 0.28 -0.07 0.00 -0.44 0.00 0.00 34.13 34.04 1j05 s GLU 93 CO 0.82 -0.18 1.09 -0.51 0.95 0.00 0.00 175.26 177.43 1j05 s ASP 94 N -1.63 6.13 0.33 0.83 1.01 -1.26 -3.64 116.67 118.44 1j05 s ASP 94 Ca -0.11 2.09 -0.27 0.00 0.71 0.00 0.00 52.55 54.98 1j05 s ASP 94 Cb -0.04 -2.58 -0.09 0.00 1.01 0.00 0.00 42.92 41.22 1j05 s ASP 94 CO 0.01 -0.93 1.06 -2.16 0.21 0.00 0.00 175.17 173.35 1j05 s PRO 95 N -3.09 4.44 0.34 8.23 0.04 -1.26 -4.97 135.00 138.74 1j05 s PRO 95 Ca 0.68 1.62 -0.29 0.00 0.04 0.00 0.00 61.00 63.05 1j05 s PRO 95 Cb -0.22 -2.89 -0.11 0.00 0.04 0.00 0.00 34.50 31.32 1j05 s PRO 95 CO 0.26 0.08 1.49 0.66 0.04 0.00 0.00 177.00 179.53 1j05 n TYR 96 N 0.62 2.84 -4.23 0.56 4.01 -1.24 -4.70 117.16 115.03 1j05 n TYR 96 Ca 0.02 0.40 -0.14 0.00 -0.16 0.00 0.00 57.90 58.02 1j05 n TYR 96 Cb 0.47 -2.54 -0.10 0.00 -0.31 0.00 0.00 39.34 36.87 1j05 n TYR 96 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1j05 s THR 97 N -0.75 1.08 0.09 -0.72 -4.23 -1.20 -5.00 115.64 104.90 1j05 s THR 97 Ca 0.57 -2.02 0.09 0.00 -1.18 0.00 0.00 61.69 59.15 1j05 s THR 97 Cb -0.50 -1.80 -0.03 0.00 1.34 0.00 0.00 72.50 71.51 1j05 s THR 97 CO 0.59 -0.76 -0.23 -0.36 -0.54 0.00 0.00 174.62 173.32 1j05 s PHE 98 N -3.33 1.94 0.91 3.99 0.08 -1.26 -1.52 117.98 118.79 1j05 s PHE 98 Ca 0.15 -0.40 -0.12 0.00 0.12 0.00 0.00 56.93 56.68 1j05 s PHE 98 Cb 0.03 -1.09 0.13 0.00 -0.57 0.00 0.00 43.02 41.52 1j05 s PHE 98 CO -0.00 0.20 1.14 0.20 -0.10 0.00 0.00 175.22 176.65 1j05 s GLY 99 N -1.70 1.58 0.00 4.36 0.00 0.30 -4.50 107.32 107.36 1j05 s GLY 99 Ca 0.09 -0.53 0.27 0.00 0.00 0.00 0.00 44.72 44.55 1j05 s GLY 99 CO 0.04 0.03 1.96 0.61 0.00 0.00 0.00 173.10 175.74 1j05 n GLY 100 N -2.26 -0.71 0.00 0.20 0.00 -1.26 -4.68 105.19 96.48 1j05 n GLY 100 Ca 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1j05 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j05 n GLY 101 N 0.99 0.24 3.03 -0.02 0.00 -1.26 -5.04 105.19 103.14 1j05 n GLY 101 Ca 0.20 -1.63 -0.28 0.00 0.00 0.00 0.00 46.02 44.31 1j05 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j05 s THR 102 N -2.88 1.43 -0.19 2.61 2.01 -0.36 -4.68 115.64 113.58 1j05 s THR 102 Ca 0.00 -0.59 -0.17 0.00 0.31 0.00 0.00 61.69 61.24 1j05 s THR 102 Cb 0.00 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 1j05 s THR 102 CO 0.00 0.43 0.47 -0.75 -0.69 0.00 0.00 174.62 174.08 1j05 s LYS 103 N 1.13 4.21 -0.20 4.92 2.47 -0.33 -0.40 119.74 131.54 1j05 s LYS 103 Ca -0.04 0.34 -0.09 0.00 -1.56 0.00 0.00 55.97 54.62 1j05 s LYS 103 Cb -0.14 -3.53 -0.05 0.00 -1.46 0.00 0.00 37.83 32.65 1j05 s LYS 103 CO -0.03 -0.06 0.11 -1.17 0.16 0.00 0.00 175.35 174.35 1j05 s LEU 104 N 1.35 4.01 0.23 5.43 2.96 0.07 -0.47 118.68 132.26 1j05 s LEU 104 Ca 0.22 0.14 0.08 0.00 -0.22 0.00 0.00 54.13 54.35 1j05 s LEU 104 Cb -0.15 -2.04 -0.05 0.00 0.50 0.00 0.00 46.19 44.45 1j05 s LEU 104 CO 0.09 0.15 -0.13 -1.61 -1.32 0.00 0.00 176.35 173.53 1j05 s GLU 105 N 0.52 1.42 -0.19 1.98 8.01 0.54 -3.02 118.70 127.96 1j05 s GLU 105 Ca 0.06 -1.66 -0.16 0.00 0.01 0.00 0.00 54.97 53.22 1j05 s GLU 105 Cb -0.12 -1.19 -0.04 0.00 -4.31 0.00 0.00 34.13 28.47 1j05 s GLU 105 CO 0.00 0.16 0.42 0.42 0.01 0.00 0.00 175.26 176.27 1j05 s ILE 106 N -2.94 5.19 -2.15 -1.63 -1.09 -1.26 -1.46 121.20 115.86 1j05 s ILE 106 Ca 0.25 0.77 0.31 0.00 -2.23 0.00 0.00 60.65 59.75 1j05 s ILE 106 Cb -0.00 -3.75 0.80 0.00 -1.58 0.00 0.00 42.46 37.93 1j05 s ILE 106 CO 0.09 0.26 2.09 1.17 -1.23 0.00 0.00 174.94 177.32