#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a5j s ILE 2 N 0.00 4.03 0.00 -0.61 -4.36 -1.26 -5.06 121.20 113.94 1a5j s ILE 2 Ca 0.00 0.69 0.00 0.00 -0.26 0.00 0.00 60.65 61.08 1a5j s ILE 2 Cb 0.00 -3.41 0.00 0.00 1.25 0.00 0.00 42.46 40.30 1a5j s ILE 2 CO 0.00 -0.83 0.00 -0.81 0.24 0.00 0.00 174.94 173.54 1a5j n PRO 3 N -3.00 0.75 -0.27 0.37 -0.04 -1.26 -5.01 135.00 126.54 1a5j n PRO 3 Ca 0.08 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.40 1a5j n PRO 3 Cb 0.53 0.00 0.13 0.00 -0.04 0.00 0.00 33.50 34.12 1a5j n PRO 3 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1a5j n ASP 4 N -0.49 -2.37 -0.61 3.54 2.03 -1.26 -4.09 116.55 113.29 1a5j n ASP 4 Ca 0.00 -0.58 -0.08 0.00 0.52 0.00 0.00 54.79 54.65 1a5j n ASP 4 Cb 0.00 -0.46 -0.03 0.00 -0.72 0.00 0.00 41.12 39.90 1a5j n ASP 4 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1a5j n LEU 5 N 0.00 -0.55 0.11 -2.67 4.32 -1.26 -4.88 117.00 112.07 1a5j n LEU 5 Ca 0.07 0.20 -0.03 0.00 -0.02 0.00 0.00 56.01 56.22 1a5j n LEU 5 Cb 0.28 -1.45 0.07 0.00 -1.62 0.00 0.00 43.42 40.69 1a5j n LEU 5 CO 0.19 -0.44 0.37 0.58 -1.22 0.00 0.00 177.39 176.86 1a5j h VAL 6 N 0.00 1.54 0.00 4.08 2.07 -1.96 -0.22 116.25 121.76 1a5j h VAL 6 Ca -0.16 -2.57 0.00 0.00 0.82 0.00 0.00 66.70 64.79 1a5j h VAL 6 Cb 0.55 2.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 1a5j h VAL 6 CO 0.24 0.73 0.00 0.29 0.02 0.00 0.00 177.57 178.85 1a5j n LYS 7 N -3.65 0.99 0.00 1.57 4.01 -1.26 -4.05 118.16 115.77 1a5j n LYS 7 Ca -0.01 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.79 1a5j n LYS 7 Cb 0.73 -1.35 0.00 0.00 -0.51 0.00 0.00 35.03 33.90 1a5j n LYS 7 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1a5j n GLY 8 N 0.15 -1.83 3.80 0.72 0.00 -1.02 -5.16 105.19 101.84 1a5j n GLY 8 Ca 0.00 0.79 -0.34 0.00 0.00 0.00 0.00 46.02 46.47 1a5j n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a5j s PRO 9 N 0.00 3.78 0.68 1.61 0.04 -0.12 -4.89 135.00 136.10 1a5j s PRO 9 Ca 0.00 1.35 -0.13 0.00 0.04 0.00 0.00 61.00 62.26 1a5j s PRO 9 Cb 0.00 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.45 1a5j s PRO 9 CO 0.00 -0.44 1.08 -1.58 0.04 0.00 0.00 177.00 176.09 1a5j s TRP 10 N -2.00 2.85 0.31 0.56 0.52 -1.26 -5.06 118.94 114.85 1a5j s TRP 10 Ca 0.67 1.50 -0.11 0.00 0.02 0.00 0.00 56.10 58.19 1a5j s TRP 10 Cb -0.16 -3.01 0.01 0.00 -1.15 0.00 0.00 33.47 29.16 1a5j s TRP 10 CO 0.21 -1.43 0.56 0.95 0.02 0.00 0.00 176.95 177.25 1a5j s THR 11 N -2.71 0.00 0.52 2.01 -4.23 -1.26 -5.00 115.64 104.97 1a5j s THR 11 Ca 0.62 -1.35 0.33 0.00 -1.18 0.00 0.00 61.69 60.11 1a5j s THR 11 Cb -0.17 -2.46 0.52 0.00 1.34 0.00 0.00 72.50 71.74 1a5j s THR 11 CO 0.48 0.00 1.81 0.50 -0.54 0.00 0.00 174.62 176.86 1a5j h LYS 12 N 2.14 0.06 0.00 3.99 3.64 -1.99 2.23 116.57 126.65 1a5j h LYS 12 Ca -0.27 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1a5j h LYS 12 Cb 1.25 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1a5j h LYS 12 CO 0.36 0.04 0.00 1.49 -2.27 0.00 0.00 179.45 179.08 1a5j h GLU 13 N 0.07 0.00 0.10 1.90 4.22 -1.98 0.15 114.58 119.04 1a5j h GLU 13 Ca 0.56 0.00 -0.32 0.00 0.08 0.00 0.00 59.36 59.68 1a5j h GLU 13 Cb 2.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.32 1a5j h GLU 13 CO -0.06 0.00 -1.71 1.05 -2.18 0.00 0.00 179.01 176.11 1a5j h GLU 14 N 0.00 0.21 0.00 1.92 -0.00 0.33 -2.67 114.58 114.38 1a5j h GLU 14 Ca 0.00 -0.37 0.00 0.00 -0.00 0.00 0.00 59.36 58.99 1a5j h GLU 14 Cb 0.13 0.14 0.00 0.00 -0.00 0.00 0.00 28.75 29.02 1a5j h GLU 14 CO 0.00 1.18 0.00 -0.44 -0.00 0.00 0.00 179.01 179.75 1a5j h ASP 15 N -0.23 0.00 0.14 3.06 3.32 -1.22 0.11 116.42 121.60 1a5j h ASP 15 Ca -0.38 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.37 1a5j h ASP 15 Cb 1.83 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.38 1a5j h ASP 15 CO 0.02 0.00 -1.52 0.06 -1.72 0.00 0.00 179.24 176.08 1a5j h GLN 16 N 0.00 0.30 0.07 3.56 3.07 -0.84 -2.81 115.11 118.46 1a5j h GLN 16 Ca 0.00 -0.51 -0.00 0.00 0.09 0.00 0.00 58.65 58.22 1a5j h GLN 16 Cb 0.64 0.19 0.00 0.00 0.08 0.00 0.00 27.48 28.39 1a5j h GLN 16 CO 0.00 1.25 -0.03 -0.22 0.09 0.00 0.00 178.83 179.91 1a5j h LYS 17 N -0.16 -0.09 -1.00 0.06 3.64 -1.38 -1.53 116.57 116.12 1a5j h LYS 17 Ca -0.31 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.17 1a5j h LYS 17 Cb 1.88 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 33.64 1a5j h LYS 17 CO 0.10 0.45 0.63 0.28 -2.27 0.00 0.00 179.45 178.65 1a5j h VAL 18 N -0.71 1.00 0.29 2.00 2.07 -0.95 -0.94 116.25 119.00 1a5j h VAL 18 Ca -0.01 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1a5j h VAL 18 Cb 0.58 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1a5j h VAL 18 CO 0.02 0.19 -0.14 0.40 0.02 0.00 0.00 177.57 178.06 1a5j h ILE 19 N 1.07 0.74 0.00 4.57 5.03 -1.48 0.50 117.51 127.93 1a5j h ILE 19 Ca 0.46 -0.15 0.00 0.00 -0.12 0.00 0.00 64.86 65.06 1a5j h ILE 19 Cb 0.34 0.82 0.00 0.00 -3.03 0.00 0.00 36.82 34.95 1a5j h ILE 19 CO -0.22 0.03 0.15 -0.08 -0.68 0.00 0.00 178.15 177.35 1a5j h GLU 20 N -0.46 0.00 0.02 2.37 4.81 -0.35 -0.75 114.58 120.21 1a5j h GLU 20 Ca -0.04 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 58.93 1a5j h GLU 20 Cb 0.35 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 1a5j h GLU 20 CO 0.07 0.00 -1.43 1.28 -0.73 0.00 0.00 179.01 178.19 1a5j n LEU 21 N -2.60 1.99 0.12 1.64 4.77 -0.45 -2.41 117.00 120.06 1a5j n LEU 21 Ca -0.02 0.38 0.19 0.00 -0.03 0.00 0.00 56.01 56.53 1a5j n LEU 21 Cb 0.19 -0.99 0.66 0.00 -2.33 0.00 0.00 43.42 40.96 1a5j n LEU 21 CO 0.13 0.38 1.17 0.58 -1.33 0.00 0.00 177.39 178.31 1a5j h VAL 22 N -0.83 0.19 0.07 4.08 2.07 0.14 1.83 116.25 123.80 1a5j h VAL 22 Ca -0.38 0.00 -0.33 0.00 0.82 0.00 0.00 66.70 66.81 1a5j h VAL 22 Cb 1.43 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 1a5j h VAL 22 CO -0.17 0.00 -1.84 2.29 0.02 0.00 0.00 177.57 177.87 1a5j n LYS 23 N -3.34 0.68 0.05 1.57 2.85 -0.83 -0.46 118.16 118.68 1a5j n LYS 23 Ca 0.07 0.35 0.09 0.00 -1.05 0.00 0.00 58.31 57.77 1a5j n LYS 23 Cb 0.73 -1.69 0.39 0.00 -0.65 0.00 0.00 35.03 33.80 1a5j n LYS 23 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1a5j n LYS 24 N -3.82 0.08 -0.08 -1.58 4.81 0.12 -3.42 118.16 114.27 1a5j n LYS 24 Ca -0.35 0.31 -0.17 0.00 -0.87 0.00 0.00 58.31 57.23 1a5j n LYS 24 Cb 0.92 -1.64 -0.06 0.00 0.02 0.00 0.00 35.03 34.27 1a5j n LYS 24 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1a5j n TYR 25 N -1.78 0.00 0.00 5.64 4.02 0.58 -5.04 117.16 120.58 1a5j n TYR 25 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 1a5j n TYR 25 Cb 0.20 -0.57 0.00 0.00 -0.02 0.00 0.00 39.34 38.95 1a5j n TYR 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1a5j n GLY 26 N 2.05 0.98 1.79 2.72 0.00 0.39 -4.60 105.19 108.51 1a5j n GLY 26 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1a5j n GLY 26 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1a5j n THR 27 N 0.00 0.00 -0.02 2.61 -1.04 0.26 -4.94 114.28 111.16 1a5j n THR 27 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 1a5j n THR 27 Cb 0.00 -0.45 -0.00 0.00 -1.82 0.00 0.00 70.33 68.06 1a5j n THR 27 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1a5j n LYS 28 N -1.58 0.12 -2.29 -2.82 0.00 -1.26 -4.66 118.16 105.66 1a5j n LYS 28 Ca 0.00 0.29 -0.34 0.00 0.00 0.00 0.00 58.31 58.26 1a5j n LYS 28 Cb 0.31 -0.96 -0.04 0.00 0.00 0.00 0.00 35.03 34.34 1a5j n LYS 28 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1a5j s GLN 29 N -1.33 3.12 0.00 1.64 -0.21 -1.26 -4.69 119.66 116.93 1a5j s GLN 29 Ca -0.04 -1.26 0.11 0.00 0.02 0.00 0.00 55.36 54.19 1a5j s GLN 29 Cb 0.01 -5.32 0.55 0.00 1.00 0.00 0.00 33.01 29.24 1a5j s GLN 29 CO 0.06 -3.10 1.29 0.91 -2.12 0.00 0.00 175.29 172.34 1a5j n TRP 30 N 11.69 0.00 -0.05 0.91 7.02 -1.26 -1.94 117.44 133.80 1a5j n TRP 30 Ca 0.44 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.76 1a5j n TRP 30 Cb 0.47 -0.35 -0.07 0.00 -2.42 0.00 0.00 31.31 28.94 1a5j n TRP 30 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1a5j h THR 31 N 0.00 1.32 -0.45 -0.99 1.03 -1.96 -2.87 112.91 108.99 1a5j h THR 31 Ca 0.00 -1.75 0.13 0.00 -0.01 0.00 0.00 66.41 64.78 1a5j h THR 31 Cb 0.13 1.94 -0.02 0.00 -1.07 0.00 0.00 68.15 69.13 1a5j h THR 31 CO 0.00 0.54 0.53 0.17 -0.01 0.00 0.00 175.52 176.75 1a5j h LEU 32 N 0.34 0.00 -0.21 0.00 -0.00 -1.79 1.26 115.31 114.92 1a5j h LEU 32 Ca -0.01 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.70 1a5j h LEU 32 Cb 1.13 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.79 1a5j h LEU 32 CO 0.11 0.00 -0.50 0.40 -0.00 0.00 0.00 178.44 178.44 1a5j h ILE 33 N 0.00 1.31 -0.56 0.15 5.03 -1.66 -1.81 117.51 119.97 1a5j h ILE 33 Ca 0.22 -1.73 -0.15 0.00 -0.12 0.00 0.00 64.86 63.08 1a5j h ILE 33 Cb 1.27 1.86 -0.09 0.00 -3.03 0.00 0.00 36.82 36.83 1a5j h ILE 33 CO -0.00 0.54 0.14 0.00 -0.68 0.00 0.00 178.15 178.15 1a5j n ALA 34 N -2.55 4.12 -0.01 1.87 0.00 0.26 -3.95 120.51 120.26 1a5j n ALA 34 Ca -0.06 -2.43 -0.01 0.00 0.00 0.00 0.00 53.44 50.95 1a5j n ALA 34 Cb 0.60 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 19.00 1a5j n ALA 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1a5j n LYS 35 N -0.33 2.77 0.15 0.00 4.81 0.36 -4.29 118.16 121.62 1a5j n LYS 35 Ca 0.34 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.87 1a5j n LYS 35 Cb 1.21 -1.03 0.06 0.00 0.02 0.00 0.00 35.03 35.30 1a5j n LYS 35 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1a5j h HIS 36 N 0.00 0.00 -3.36 5.64 3.86 -1.50 -3.41 115.15 116.38 1a5j h HIS 36 Ca -0.03 0.00 -0.76 0.00 -1.16 0.00 0.00 60.37 58.43 1a5j h HIS 36 Cb 1.06 0.00 -0.27 0.00 1.06 0.00 0.00 27.41 29.26 1a5j h HIS 36 CO 0.00 0.16 -0.19 -0.51 0.86 0.00 0.00 177.93 178.26 1a5j s LEU 37 N -5.95 6.17 -0.30 2.43 2.01 -1.25 -5.02 118.68 116.76 1a5j s LEU 37 Ca 0.03 -2.13 -0.32 0.00 0.01 0.00 0.00 54.13 51.72 1a5j s LEU 37 Cb 0.07 -2.14 -0.09 0.00 0.01 0.00 0.00 46.19 44.05 1a5j s LEU 37 CO 0.74 -0.71 2.22 0.29 1.01 0.00 0.00 176.35 179.89 1a5j n LYS 38 N 4.71 1.45 0.00 1.70 4.01 -1.26 -3.66 118.16 125.10 1a5j n LYS 38 Ca -0.04 0.38 0.00 0.00 -0.51 0.00 0.00 58.31 58.15 1a5j n LYS 38 Cb 0.42 -2.82 0.00 0.00 -0.51 0.00 0.00 35.03 32.12 1a5j n LYS 38 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1a5j n GLY 39 N 6.21 0.22 1.53 0.72 0.00 -1.26 -4.94 105.19 107.66 1a5j n GLY 39 Ca 0.37 -0.01 -0.00 0.00 0.00 0.00 0.00 46.02 46.38 1a5j n GLY 39 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1a5j n ARG 40 N 0.00 -0.03 -1.50 1.61 0.63 -1.24 -5.04 116.66 111.08 1a5j n ARG 40 Ca 0.00 0.06 -0.16 0.00 -0.92 0.00 0.00 57.85 56.83 1a5j n ARG 40 Cb 0.00 -1.57 0.10 0.00 0.45 0.00 0.00 32.46 31.44 1a5j n ARG 40 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1a5j n LEU 41 N -1.48 0.00 0.00 6.15 7.99 -1.26 -5.01 117.00 123.39 1a5j n LEU 41 Ca -0.00 -1.10 0.00 0.00 -0.01 0.00 0.00 56.01 54.90 1a5j n LEU 41 Cb 0.50 -0.51 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1a5j n LEU 41 CO 0.01 -0.93 0.00 0.61 -1.51 0.00 0.00 177.39 175.56 1a5j n GLY 42 N 0.00 0.00 0.84 -0.72 0.00 -1.26 -4.80 105.19 99.25 1a5j n GLY 42 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1a5j n GLY 42 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1a5j n LYS 43 N 0.00 0.00 -0.75 1.61 0.00 -1.26 -4.87 118.16 112.89 1a5j n LYS 43 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 58.31 58.08 1a5j n LYS 43 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.01 1a5j n LYS 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1a5j n GLN 44 N -1.88 1.93 -3.89 1.64 3.00 -1.26 -4.84 117.38 112.08 1a5j n GLN 44 Ca 0.00 -1.46 -0.36 0.00 -0.01 0.00 0.00 57.00 55.17 1a5j n GLN 44 Cb 0.00 -2.48 -0.06 0.00 0.00 0.00 0.00 30.24 27.70 1a5j n GLN 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1a5j n ARG 46 N 1.84 -2.37 -2.72 0.00 1.74 -1.26 -5.05 116.66 108.84 1a5j n ARG 46 Ca -0.19 2.07 -0.07 0.00 -0.77 0.00 0.00 57.85 58.89 1a5j n ARG 46 Cb 0.55 -4.30 0.07 0.00 -1.02 0.00 0.00 32.46 27.76 1a5j n ARG 46 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1a5j n GLU 47 N 0.31 0.59 0.00 5.56 2.13 -1.26 -4.83 120.64 123.13 1a5j n GLU 47 Ca 0.02 -1.40 0.00 0.00 0.66 0.00 0.00 57.16 56.44 1a5j n GLU 47 Cb 0.08 -0.97 0.00 0.00 0.27 0.00 0.00 31.44 30.82 1a5j n GLU 47 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1a5j n ARG 48 N 1.34 0.00 -0.01 5.31 3.00 -1.26 -4.93 116.66 120.10 1a5j n ARG 48 Ca 0.05 0.00 0.03 0.00 -0.00 0.00 0.00 57.85 57.94 1a5j n ARG 48 Cb 0.67 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 33.05 1a5j n ARG 48 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.63 174.96 1a5j n TRP 49 N -0.83 0.00 0.00 -0.14 2.14 -1.26 -4.39 117.44 112.97 1a5j n TRP 49 Ca 0.00 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.57 1a5j n TRP 49 Cb 0.00 -0.31 0.00 0.00 -0.81 0.00 0.00 31.31 30.19 1a5j n TRP 49 CO 0.00 0.00 0.00 1.58 2.07 0.00 0.00 177.69 181.34 1a5j n HIS 50 N -1.99 0.00 -0.33 -2.67 -0.00 -1.26 0.39 115.22 109.36 1a5j n HIS 50 Ca -0.05 0.00 0.19 0.00 0.46 0.00 0.00 57.72 58.32 1a5j n HIS 50 Cb 0.40 -0.39 0.37 0.00 -0.12 0.00 0.00 29.99 30.26 1a5j n HIS 50 CO 0.00 0.00 0.00 -2.95 0.46 0.00 0.00 176.34 173.85 1a5j h ASN 51 N 0.00 -0.23 0.25 0.26 7.08 -1.89 0.82 115.58 121.86 1a5j h ASN 51 Ca 0.00 0.27 -0.01 0.00 -3.08 0.00 0.00 56.30 53.48 1a5j h ASN 51 Cb 0.00 0.41 0.00 0.00 -2.08 0.00 0.00 38.32 36.66 1a5j h ASN 51 CO 0.00 -0.36 -0.12 0.45 -2.08 0.00 0.00 177.43 175.32 1a5j h HIS 52 N 0.02 -0.31 -5.19 4.14 3.86 -1.76 -3.47 115.15 112.45 1a5j h HIS 52 Ca 0.66 -0.01 -0.25 0.00 -1.16 0.00 0.00 60.37 59.62 1a5j h HIS 52 Cb 1.50 0.10 0.17 0.00 1.06 0.00 0.00 27.41 30.24 1a5j h HIS 52 CO -0.35 -0.10 -0.73 -0.11 0.86 0.00 0.00 177.93 177.49 1a5j n LEU 53 N -5.18 -4.73 -2.71 2.43 -0.00 0.28 -4.98 117.00 102.11 1a5j n LEU 53 Ca -0.09 -0.60 -0.07 0.00 -0.00 0.00 0.00 56.01 55.25 1a5j n LEU 53 Cb 0.19 -2.88 0.08 0.00 -0.00 0.00 0.00 43.42 40.81 1a5j n LEU 53 CO 0.34 0.18 0.41 -3.20 -0.00 0.00 0.00 177.39 175.11 1a5j n ASN 54 N -2.98 -2.16 -3.25 1.96 2.85 -1.25 -5.09 115.26 105.34 1a5j n ASN 54 Ca -0.13 -2.96 0.00 0.00 -0.11 0.00 0.00 54.58 51.38 1a5j n ASN 54 Cb 0.62 1.58 0.00 0.00 1.24 0.00 0.00 39.78 43.22 1a5j n ASN 54 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1a5j n PRO 55 N 0.96 1.40 -2.81 1.20 -0.04 -1.26 -4.57 135.00 129.88 1a5j n PRO 55 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1a5j n PRO 55 Cb 0.69 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.15 1a5j n PRO 55 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1a5j n GLU 56 N 0.00 -0.30 0.12 0.54 2.13 -1.26 -4.77 120.64 117.09 1a5j n GLU 56 Ca 0.00 0.70 0.12 0.00 0.66 0.00 0.00 57.16 58.64 1a5j n GLU 56 Cb 0.00 -0.83 0.46 0.00 0.27 0.00 0.00 31.44 31.35 1a5j n GLU 56 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1a5j n VAL 57 N 1.29 0.74 -1.67 6.31 0.31 -1.26 -5.00 118.33 119.05 1a5j n VAL 57 Ca 0.00 0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1a5j n VAL 57 Cb 0.39 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 1a5j n VAL 57 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1a5j n LYS 58 N -2.22 -4.79 0.14 5.55 3.00 -1.26 -4.28 118.16 114.30 1a5j n LYS 58 Ca 0.03 3.55 0.01 0.00 -0.00 0.00 0.00 58.31 61.90 1a5j n LYS 58 Cb 0.30 -3.98 0.14 0.00 0.00 0.00 0.00 35.03 31.48 1a5j n LYS 58 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.40 178.97 1a5j h LYS 59 N 1.90 0.00 -0.96 1.64 5.09 -1.96 -3.18 116.57 119.11 1a5j h LYS 59 Ca 0.00 0.00 0.28 0.00 0.09 0.00 0.00 60.65 61.02 1a5j h LYS 59 Cb 0.00 0.00 -0.14 0.00 0.10 0.00 0.00 32.23 32.19 1a5j h LYS 59 CO 0.00 0.59 0.46 0.66 -2.09 0.00 0.00 179.45 179.06 1a5j h SER 60 N 0.00 0.36 -5.21 7.07 4.64 -2.02 -3.44 113.55 114.95 1a5j h SER 60 Ca -0.01 0.19 0.14 0.00 -0.47 0.00 0.00 61.79 61.64 1a5j h SER 60 Cb 1.22 0.17 -0.07 0.00 -0.31 0.00 0.00 62.40 63.41 1a5j h SER 60 CO 0.08 -0.11 0.40 -0.94 -0.87 0.00 0.00 176.83 175.38 1a5j s SER 61 N -5.00 -0.19 1.23 4.97 1.04 -1.20 -5.17 113.70 109.37 1a5j s SER 61 Ca -0.11 -0.50 -0.14 0.00 0.48 0.00 0.00 55.95 55.68 1a5j s SER 61 Cb 0.28 0.58 0.22 0.00 0.10 0.00 0.00 66.02 67.20 1a5j s SER 61 CO 0.78 -1.08 0.63 0.79 0.98 0.00 0.00 173.24 175.35 1a5j n TRP 62 N -0.48 -3.37 0.00 5.02 7.02 -1.26 -4.35 117.44 120.02 1a5j n TRP 62 Ca -0.05 -0.58 0.00 0.00 -1.02 0.00 0.00 57.50 55.85 1a5j n TRP 62 Cb 0.60 -0.76 0.00 0.00 -2.42 0.00 0.00 31.31 28.73 1a5j n TRP 62 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 1a5j n THR 63 N -4.40 0.00 0.00 -0.99 -1.04 -1.26 -4.87 114.28 101.72 1a5j n THR 63 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1a5j n THR 63 Cb 0.38 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.89 1a5j n THR 63 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1a5j n GLU 64 N 0.00 0.00 -0.13 -2.82 1.02 -1.26 -3.89 120.64 113.56 1a5j n GLU 64 Ca 0.00 0.04 -0.03 0.00 -0.02 0.00 0.00 57.16 57.14 1a5j n GLU 64 Cb 0.00 -0.27 -0.03 0.00 -0.02 0.00 0.00 31.44 31.12 1a5j n GLU 64 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1a5j h GLU 65 N 0.00 -0.00 -1.22 3.49 5.08 -1.95 1.65 114.58 121.62 1a5j h GLU 65 Ca 0.00 0.00 0.36 0.00 -1.00 0.00 0.00 59.36 58.72 1a5j h GLU 65 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1a5j h GLU 65 CO 0.00 -0.00 0.93 0.93 -1.00 0.00 0.00 179.01 179.87 1a5j h GLU 66 N -0.00 0.00 0.76 2.33 5.08 -1.95 0.21 114.58 121.01 1a5j h GLU 66 Ca 0.05 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1a5j h GLU 66 Cb 0.13 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.38 1a5j h GLU 66 CO -0.29 0.00 -0.37 0.22 -1.00 0.00 0.00 179.01 177.58 1a5j h ASP 67 N 0.00 -0.87 0.29 1.42 1.82 0.23 -2.32 116.42 116.98 1a5j h ASP 67 Ca 0.58 0.02 -0.00 0.00 -0.39 0.00 0.00 57.03 57.24 1a5j h ASP 67 Cb 2.44 0.22 -0.01 0.00 0.68 0.00 0.00 39.33 42.66 1a5j h ASP 67 CO -0.01 -0.52 -0.24 0.03 -1.61 0.00 0.00 179.24 176.89 1a5j h ARG 68 N -1.22 -0.52 -0.94 0.28 3.08 0.63 -2.31 114.38 113.37 1a5j h ARG 68 Ca -0.10 0.04 0.18 0.00 0.07 0.00 0.00 59.98 60.16 1a5j h ARG 68 Cb 0.80 0.12 -0.17 0.00 0.08 0.00 0.00 29.97 30.79 1a5j h ARG 68 CO 0.17 -0.35 -0.26 -0.89 -1.07 0.00 0.00 179.97 177.58 1a5j n ILE 69 N -5.37 -0.41 0.02 2.04 5.41 0.02 0.17 119.36 121.23 1a5j n ILE 69 Ca -0.09 2.16 -0.01 0.00 1.00 0.00 0.00 62.75 65.81 1a5j n ILE 69 Cb 0.27 -2.97 -0.01 0.00 -0.71 0.00 0.00 39.64 36.23 1a5j n ILE 69 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1a5j h ILE 70 N 0.00 0.00 -0.01 1.39 1.08 -0.91 0.16 117.51 119.22 1a5j h ILE 70 Ca 0.43 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.90 1a5j h ILE 70 Cb 0.66 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.41 1a5j h ILE 70 CO -0.96 0.00 0.48 0.15 -0.69 0.00 0.00 178.15 177.13 1a5j h PHE 71 N -0.06 0.00 0.05 1.37 3.04 -0.49 0.53 116.94 121.39 1a5j h PHE 71 Ca -0.00 0.00 -0.17 0.00 3.98 0.00 0.00 57.97 61.78 1a5j h PHE 71 Cb 0.05 0.00 0.02 0.00 2.56 0.00 0.00 35.95 38.57 1a5j h PHE 71 CO -0.02 0.00 -0.69 1.49 -2.02 0.00 0.00 178.31 177.07 1a5j h GLU 72 N 0.00 0.38 -0.08 1.11 4.81 0.29 -2.91 114.58 118.19 1a5j h GLU 72 Ca 0.01 -0.47 -0.19 0.00 -0.13 0.00 0.00 59.36 58.57 1a5j h GLU 72 Cb 0.97 0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.50 1a5j h GLU 72 CO -0.00 1.15 -0.76 0.00 -0.73 0.00 0.00 179.01 178.68 1a5j h ALA 73 N 0.25 0.53 0.00 2.92 0.00 0.27 -2.64 119.26 120.59 1a5j h ALA 73 Ca -0.10 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1a5j h ALA 73 Cb 1.43 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1a5j h ALA 73 CO 0.13 0.75 0.00 1.58 0.00 0.00 0.00 179.25 181.72 1a5j n HIS 74 N -3.84 0.73 -0.71 0.00 -0.00 0.73 -0.46 115.22 111.67 1a5j n HIS 74 Ca -0.05 0.32 0.08 0.00 0.46 0.00 0.00 57.72 58.54 1a5j n HIS 74 Cb 0.73 -1.02 0.33 0.00 -0.12 0.00 0.00 29.99 29.91 1a5j n HIS 74 CO 0.00 0.00 0.00 0.36 0.46 0.00 0.00 176.34 177.16 1a5j n LYS 75 N -2.20 3.73 0.00 1.57 2.85 -1.00 -3.81 118.16 119.31 1a5j n LYS 75 Ca 0.01 -2.85 0.00 0.00 -1.05 0.00 0.00 58.31 54.42 1a5j n LYS 75 Cb 0.15 -1.89 0.00 0.00 -0.65 0.00 0.00 35.03 32.63 1a5j n LYS 75 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1a5j n VAL 76 N 0.63 0.00 0.00 0.58 0.31 0.40 -5.00 118.33 115.25 1a5j n VAL 76 Ca 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.57 1a5j n VAL 76 Cb 0.90 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 1a5j n VAL 76 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1a5j n LEU 77 N -2.31 0.00 0.00 7.52 4.32 -0.20 -5.12 117.00 121.21 1a5j n LEU 77 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1a5j n LEU 77 Cb 0.35 -0.05 0.00 0.00 -1.62 0.00 0.00 43.42 42.11 1a5j n LEU 77 CO 0.00 -0.14 0.00 0.61 -1.22 0.00 0.00 177.39 176.64 1a5j n GLY 78 N 3.31 -0.51 1.25 -0.72 0.00 -1.25 -4.88 105.19 102.39 1a5j n GLY 78 Ca 0.00 0.01 0.01 0.00 0.00 0.00 0.00 46.02 46.05 1a5j n GLY 78 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1a5j n ASN 79 N 0.00 3.35 -2.87 1.61 6.94 -1.26 -4.46 115.26 118.58 1a5j n ASN 79 Ca 0.00 -2.51 -0.17 0.00 -0.02 0.00 0.00 54.58 51.88 1a5j n ASN 79 Cb 0.00 -0.60 -0.04 0.00 -2.36 0.00 0.00 39.78 36.77 1a5j n ASN 79 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1a5j n ARG 80 N 0.22 1.82 -0.25 -3.83 3.00 -1.26 -4.50 116.66 111.86 1a5j n ARG 80 Ca 0.16 -1.19 0.20 0.00 -0.01 0.00 0.00 57.85 57.02 1a5j n ARG 80 Cb 0.77 -2.24 0.53 0.00 0.00 0.00 0.00 32.46 31.52 1a5j n ARG 80 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.63 176.14 1a5j h TRP 81 N 5.62 0.50 -0.02 -1.55 4.06 -1.87 3.44 115.95 126.13 1a5j h TRP 81 Ca 0.38 0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.35 1a5j h TRP 81 Cb 0.39 -0.15 -0.00 0.00 -1.00 0.00 0.00 29.16 28.40 1a5j h TRP 81 CO 1.80 0.12 0.02 0.00 -3.56 0.00 0.00 178.44 176.81 1a5j h ALA 82 N 1.60 1.68 0.00 1.49 0.00 -1.86 0.48 119.26 122.65 1a5j h ALA 82 Ca 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1a5j h ALA 82 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1a5j h ALA 82 CO -0.17 -0.02 -1.45 -0.85 0.00 0.00 0.00 179.25 176.75 1a5j n GLU 83 N -4.04 0.41 -0.04 0.00 -0.00 0.56 -4.26 120.64 113.27 1a5j n GLU 83 Ca -0.03 -0.09 -0.13 0.00 -0.00 0.00 0.00 57.16 56.91 1a5j n GLU 83 Cb 0.10 -1.24 -0.08 0.00 -0.00 0.00 0.00 31.44 30.22 1a5j n GLU 83 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.13 178.10 1a5j h ILE 84 N 0.00 1.36 0.00 3.84 6.09 0.63 -2.85 117.51 126.57 1a5j h ILE 84 Ca 0.00 -1.24 -0.04 0.00 -1.37 0.00 0.00 64.86 62.21 1a5j h ILE 84 Cb 0.47 1.95 -0.01 0.00 0.47 0.00 0.00 36.82 39.71 1a5j h ILE 84 CO 0.00 0.35 -0.19 0.00 -3.07 0.00 0.00 178.15 175.24 1a5j h ALA 85 N 0.59 1.51 0.00 0.18 0.00 -1.15 -0.62 119.26 119.77 1a5j h ALA 85 Ca 0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1a5j h ALA 85 Cb 0.60 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1a5j h ALA 85 CO 0.02 0.24 -0.06 0.87 0.00 0.00 0.00 179.25 180.32 1a5j h LYS 86 N 0.00 0.00 0.00 0.00 1.57 -1.68 0.33 116.57 116.78 1a5j h LYS 86 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1a5j h LYS 86 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1a5j h LYS 86 CO 0.03 0.06 0.00 1.28 -0.57 0.00 0.00 179.45 180.25 1a5j n LEU 87 N -3.72 0.00 -4.65 2.94 4.32 -0.24 -4.78 117.00 110.88 1a5j n LEU 87 Ca -0.02 0.00 -0.23 0.00 -0.02 0.00 0.00 56.01 55.74 1a5j n LEU 87 Cb 0.16 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 41.89 1a5j n LEU 87 CO 0.29 0.00 -0.32 -0.76 -1.22 0.00 0.00 177.39 175.38 1a5j s LEU 88 N -1.88 3.17 0.00 2.23 1.43 0.11 -5.00 118.68 118.74 1a5j s LEU 88 Ca 0.40 -0.69 0.24 0.00 -1.03 0.00 0.00 54.13 53.05 1a5j s LEU 88 Cb 0.18 -1.68 1.37 0.00 0.03 0.00 0.00 46.19 46.10 1a5j s LEU 88 CO 0.31 -0.04 1.79 -0.81 0.23 0.00 0.00 176.35 177.82 1a5j n PRO 89 N -0.92 0.65 0.00 1.29 -0.04 -1.26 -4.87 135.00 129.85 1a5j n PRO 89 Ca -0.06 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1a5j n PRO 89 Cb 0.59 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 1a5j n PRO 89 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1a5j n GLY 90 N 0.54 2.01 1.26 0.55 0.00 -1.26 -5.17 105.19 103.11 1a5j n GLY 90 Ca 0.16 0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.40 1a5j n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a5j n ARG 91 N 0.00 -2.55 -4.08 1.61 5.12 -1.26 -4.70 116.66 110.79 1a5j n ARG 91 Ca 0.00 2.00 -0.25 0.00 -1.93 0.00 0.00 57.85 57.67 1a5j n ARG 91 Cb 0.00 -3.13 -0.05 0.00 -1.16 0.00 0.00 32.46 28.12 1a5j n ARG 91 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1a5j n THR 92 N -3.94 0.00 -0.04 0.55 -2.24 -1.26 -4.86 114.28 102.48 1a5j n THR 92 Ca -0.05 -1.87 -0.15 0.00 -2.27 0.00 0.00 64.05 59.71 1a5j n THR 92 Cb 0.60 0.37 -0.07 0.00 -2.10 0.00 0.00 70.33 69.12 1a5j n THR 92 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 1a5j h ASP 93 N 0.94 0.62 0.69 3.42 2.03 -1.92 -2.59 116.42 119.61 1a5j h ASP 93 Ca -0.33 -0.59 0.00 0.00 -0.73 0.00 0.00 57.03 55.38 1a5j h ASP 93 Cb 0.99 -0.18 0.00 0.00 -0.83 0.00 0.00 39.33 39.31 1a5j h ASP 93 CO 0.54 1.10 0.00 0.59 -1.03 0.00 0.00 179.24 180.45 1a5j n ASN 94 N -4.27 0.61 0.03 4.15 3.02 -1.26 -0.98 115.26 116.56 1a5j n ASN 94 Ca -0.07 0.65 -0.02 0.00 -0.03 0.00 0.00 54.58 55.11 1a5j n ASN 94 Cb 0.55 -0.78 -0.01 0.00 -0.61 0.00 0.00 39.78 38.93 1a5j n ASN 94 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a5j h ALA 95 N 2.28 -0.22 0.16 5.41 0.00 -1.88 -2.76 119.26 122.25 1a5j h ALA 95 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1a5j h ALA 95 Cb 0.35 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1a5j h ALA 95 CO 0.00 -0.21 -0.08 0.28 0.00 0.00 0.00 179.25 179.24 1a5j h VAL 96 N -0.67 0.83 -0.71 0.00 2.07 -1.43 0.25 116.25 116.59 1a5j h VAL 96 Ca -0.02 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.60 1a5j h VAL 96 Cb 0.12 0.83 -0.12 0.00 -1.52 0.00 0.00 31.29 30.60 1a5j h VAL 96 CO 0.03 0.00 -0.45 0.50 0.02 0.00 0.00 177.57 177.66 1a5j h LYS 97 N -0.22 -0.15 -0.59 1.57 3.64 -1.22 1.00 116.57 120.59 1a5j h LYS 97 Ca -0.02 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1a5j h LYS 97 Cb 0.18 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 1a5j h LYS 97 CO 0.03 -0.10 0.26 -0.97 -2.27 0.00 0.00 179.45 176.40 1a5j h ASN 98 N -0.16 0.76 0.09 4.20 -0.73 -1.22 -0.18 115.58 118.34 1a5j h ASN 98 Ca 0.20 -0.09 -0.01 0.00 1.87 0.00 0.00 56.30 58.28 1a5j h ASN 98 Cb 0.55 -0.20 -0.00 0.00 0.27 0.00 0.00 38.32 38.94 1a5j h ASN 98 CO -0.78 0.67 -0.03 -0.74 -0.37 0.00 0.00 177.43 176.18 1a5j h HIS 99 N 0.84 0.00 -0.32 0.67 2.76 0.43 0.51 115.15 120.03 1a5j h HIS 99 Ca 0.20 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.34 1a5j h HIS 99 Cb 0.13 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 1a5j h HIS 99 CO 0.01 0.03 0.07 2.35 -1.30 0.00 0.00 177.93 179.09 1a5j h TRP 100 N 0.00 0.55 -0.07 5.26 -0.00 0.21 -1.91 115.95 119.98 1a5j h TRP 100 Ca -0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 58.89 58.82 1a5j h TRP 100 Cb 0.09 -0.15 0.00 0.00 -0.00 0.00 0.00 29.16 29.09 1a5j h TRP 100 CO 0.00 0.58 0.00 0.09 -0.00 0.00 0.00 178.44 179.11 1a5j n ASN 101 N -4.63 1.57 0.00 2.65 3.02 -0.37 -3.20 115.26 114.30 1a5j n ASN 101 Ca -0.02 -1.57 0.00 0.00 -0.03 0.00 0.00 54.58 52.96 1a5j n ASN 101 Cb 0.20 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 1a5j n ASN 101 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1a5j n SER 102 N 0.23 0.00 0.00 6.41 2.88 0.16 -4.82 113.62 118.49 1a5j n SER 102 Ca 0.18 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 1a5j n SER 102 Cb 0.35 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.81 1a5j n SER 102 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1a5j n THR 103 N -0.28 0.00 -0.68 2.46 -1.04 -1.15 -4.69 114.28 108.90 1a5j n THR 103 Ca 0.00 -0.42 -0.12 0.00 -2.04 0.00 0.00 64.05 61.47 1a5j n THR 103 Cb 0.00 1.05 0.03 0.00 -1.82 0.00 0.00 70.33 69.59 1a5j n THR 103 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1a5j n ILE 104 N -0.60 2.50 -3.33 12.58 5.41 -1.11 -4.82 119.36 129.98 1a5j n ILE 104 Ca 0.00 -1.30 0.00 0.00 1.00 0.00 0.00 62.75 62.45 1a5j n ILE 104 Cb 0.01 -1.31 0.00 0.00 -0.71 0.00 0.00 39.64 37.64 1a5j n ILE 104 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1a5j n LYS 105 N 0.53 2.19 0.00 0.38 4.76 -1.19 -4.72 118.16 120.11 1a5j n LYS 105 Ca 0.23 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.67 1a5j n LYS 105 Cb 0.60 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.79 1a5j n LYS 105 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1a5j n ARG 106 N -0.27 0.00 -0.67 1.97 5.12 -1.26 -4.58 116.66 116.97 1a5j n ARG 106 Ca 0.00 0.00 -0.20 0.00 -1.93 0.00 0.00 57.85 55.72 1a5j n ARG 106 Cb 0.00 -0.11 -0.02 0.00 -1.16 0.00 0.00 32.46 31.17 1a5j n ARG 106 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1a5j n LYS 107 N -1.15 1.88 -0.00 5.56 4.81 -1.26 -3.57 118.16 124.43 1a5j n LYS 107 Ca 0.00 -1.34 -0.02 0.00 -0.87 0.00 0.00 58.31 56.08 1a5j n LYS 107 Cb 0.00 -2.39 -0.01 0.00 0.02 0.00 0.00 35.03 32.66 1a5j n LYS 107 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 1a5j n VAL 108 N 4.20 0.29 -3.92 3.15 3.14 -1.26 -5.04 118.33 118.89 1a5j n VAL 108 Ca 0.40 0.04 -0.35 0.00 -2.96 0.00 0.00 64.34 61.47 1a5j n VAL 108 Cb 0.14 -1.55 0.01 0.00 -1.06 0.00 0.00 33.84 31.38 1a5j n VAL 108 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1a5j n ASP 109 N -3.16 -3.56 0.00 6.55 2.03 -1.23 -5.12 116.55 112.05 1a5j n ASP 109 Ca -0.03 -1.03 0.00 0.00 0.52 0.00 0.00 54.79 54.25 1a5j n ASP 109 Cb 0.45 -1.32 0.00 0.00 -0.72 0.00 0.00 41.12 39.53 1a5j n ASP 109 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35