#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a5j n ILE 2 N 0.00 -8.01 -0.25 -0.61 2.08 -1.26 -5.04 119.36 106.27 1a5j n ILE 2 Ca 0.00 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.28 1a5j n ILE 2 Cb 0.00 -6.13 0.00 0.00 -0.75 0.00 0.00 39.64 32.76 1a5j n ILE 2 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1a5j n PRO 3 N -1.35 0.51 -1.04 0.38 -0.04 -1.26 -4.94 135.00 127.25 1a5j n PRO 3 Ca 0.02 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.18 1a5j n PRO 3 Cb 0.47 0.00 0.17 0.00 -0.04 0.00 0.00 33.50 34.10 1a5j n PRO 3 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1a5j s ASP 4 N -1.25 2.73 -0.35 3.54 2.15 -1.26 -3.43 116.67 118.81 1a5j s ASP 4 Ca 0.00 1.46 0.00 0.00 0.43 0.00 0.00 52.55 54.44 1a5j s ASP 4 Cb 0.00 -2.14 0.00 0.00 -0.30 0.00 0.00 42.92 40.48 1a5j s ASP 4 CO 0.00 -3.10 0.00 0.18 -0.17 0.00 0.00 175.17 172.08 1a5j n LEU 5 N -4.18 -0.08 0.01 -1.34 4.32 -1.26 -4.86 117.00 109.61 1a5j n LEU 5 Ca 0.06 0.08 0.01 0.00 -0.02 0.00 0.00 56.01 56.14 1a5j n LEU 5 Cb 0.55 -1.19 -0.10 0.00 -1.62 0.00 0.00 43.42 41.06 1a5j n LEU 5 CO 0.56 -0.33 -0.50 0.52 -1.22 0.00 0.00 177.39 176.42 1a5j n VAL 6 N -2.75 0.97 0.93 4.08 0.31 -1.22 -3.13 118.33 117.52 1a5j n VAL 6 Ca -0.03 -0.68 0.00 0.00 -0.01 0.00 0.00 64.34 63.62 1a5j n VAL 6 Cb 0.19 -0.53 0.00 0.00 -0.91 0.00 0.00 33.84 32.58 1a5j n VAL 6 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1a5j n LYS 7 N -2.74 0.93 0.00 5.55 4.01 -1.26 -4.00 118.16 120.64 1a5j n LYS 7 Ca -0.12 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.68 1a5j n LYS 7 Cb 0.82 -1.46 0.00 0.00 -0.51 0.00 0.00 35.03 33.88 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 0.04 -1.82 3.66 0.72 0.00 -1.25 -5.13 105.19 101.41 1a5j n GLY 8 Ca 0.00 0.76 -0.43 0.00 0.00 0.00 0.00 46.02 46.35 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 4.22 0.87 1.61 0.04 -1.18 -4.95 135.00 135.60 1a5j s PRO 9 Ca 0.00 1.66 -0.13 0.00 0.04 0.00 0.00 61.00 62.57 1a5j s PRO 9 Cb 0.00 -3.78 0.12 0.00 0.04 0.00 0.00 34.50 30.88 1a5j s PRO 9 CO 0.00 -0.73 1.20 -1.58 0.04 0.00 0.00 177.00 175.93 1a5j s TRP 10 N 3.56 2.54 0.00 0.56 0.52 -1.26 -5.09 118.94 119.77 1a5j s TRP 10 Ca 0.55 0.67 0.00 0.00 0.02 0.00 0.00 56.10 57.34 1a5j s TRP 10 Cb -0.22 -3.62 0.00 0.00 -1.15 0.00 0.00 33.47 28.48 1a5j s TRP 10 CO 0.15 -2.10 0.00 0.25 0.02 0.00 0.00 176.95 175.27 1a5j n THR 11 N -3.51 0.00 0.17 2.01 -2.24 -1.26 -5.02 114.28 104.43 1a5j n THR 11 Ca 0.09 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.92 1a5j n THR 11 Cb 0.60 0.00 0.49 0.00 -2.10 0.00 0.00 70.33 69.33 1a5j n THR 11 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1a5j h LYS 12 N 0.00 0.16 0.00 -0.78 3.11 -1.98 -2.15 116.57 114.93 1a5j h LYS 12 Ca 0.00 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.82 1a5j h LYS 12 Cb 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.20 1a5j h LYS 12 CO 0.00 0.22 0.00 -1.91 -2.81 0.00 0.00 179.45 174.95 1a5j n GLU 13 N -4.39 0.00 -0.35 1.90 0.00 -1.26 0.22 120.64 116.76 1a5j n GLU 13 Ca -0.01 0.43 0.14 0.00 0.00 0.00 0.00 57.16 57.72 1a5j n GLU 13 Cb 0.18 -1.22 0.34 0.00 0.00 0.00 0.00 31.44 30.74 1a5j n GLU 13 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1a5j h GLU 14 N 0.00 0.69 0.00 5.31 3.07 -1.96 1.07 114.58 122.75 1a5j h GLU 14 Ca 0.00 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 58.78 1a5j h GLU 14 Cb 0.00 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.75 1a5j h GLU 14 CO 0.00 0.45 -0.19 -0.44 -1.40 0.00 0.00 179.01 177.43 1a5j h ASP 15 N 0.71 0.00 0.23 1.42 3.32 -0.99 -1.16 116.42 119.95 1a5j h ASP 15 Ca 0.60 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.61 1a5j h ASP 15 Cb 1.01 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1a5j h ASP 15 CO -0.41 0.19 -0.21 0.06 -1.72 0.00 0.00 179.24 177.15 1a5j h GLN 16 N 0.00 0.00 -0.12 3.56 -0.00 1.14 -2.49 115.11 117.21 1a5j h GLN 16 Ca -0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 58.60 1a5j h GLN 16 Cb 0.36 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.84 1a5j h GLN 16 CO 0.03 0.21 -0.13 -0.22 -0.00 0.00 0.00 178.83 178.71 1a5j h LYS 17 N 0.00 0.30 -0.96 0.06 3.64 -0.92 -2.19 116.57 116.50 1a5j h LYS 17 Ca -0.00 -0.16 0.17 0.00 -1.27 0.00 0.00 60.65 59.38 1a5j h LYS 17 Cb 0.38 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.13 1a5j h LYS 17 CO 0.03 0.72 0.61 0.28 -2.27 0.00 0.00 179.45 178.81 1a5j h VAL 18 N -0.10 0.77 -0.15 2.00 2.07 -1.33 0.71 116.25 120.22 1a5j h VAL 18 Ca 0.02 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.18 1a5j h VAL 18 Cb 0.67 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1a5j h VAL 18 CO 0.03 0.13 -0.39 0.40 0.02 0.00 0.00 177.57 177.77 1a5j h ILE 19 N 0.72 1.30 0.00 4.57 5.03 -1.31 0.57 117.51 128.39 1a5j h ILE 19 Ca 0.51 -1.50 -0.03 0.00 -0.12 0.00 0.00 64.86 63.73 1a5j h ILE 19 Cb 0.84 1.62 -0.00 0.00 -3.03 0.00 0.00 36.82 36.24 1a5j h ILE 19 CO -0.28 0.45 -0.15 -0.08 -0.68 0.00 0.00 178.15 177.41 1a5j h GLU 20 N 0.28 0.00 0.08 2.37 4.81 0.83 -2.09 114.58 120.85 1a5j h GLU 20 Ca 0.03 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.96 1a5j h GLU 20 Cb 0.81 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1a5j h GLU 20 CO 0.06 0.15 -1.58 -0.07 -0.73 0.00 0.00 179.01 176.84 1a5j h LEU 21 N 0.00 0.26 -1.54 1.64 3.38 0.34 -2.65 115.31 116.74 1a5j h LEU 21 Ca -0.00 -0.77 0.01 0.00 0.09 0.00 0.00 57.88 57.20 1a5j h LEU 21 Cb 0.91 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1a5j h LEU 21 CO 0.02 1.67 0.32 0.58 0.09 0.00 0.00 178.44 181.12 1a5j h VAL 22 N -0.40 1.11 0.04 1.22 2.07 0.10 1.09 116.25 121.47 1a5j h VAL 22 Ca -0.37 -0.22 -0.27 0.00 0.82 0.00 0.00 66.70 66.67 1a5j h VAL 22 Cb 1.71 0.43 0.02 0.00 -1.52 0.00 0.00 31.29 31.93 1a5j h VAL 22 CO -0.02 0.11 -1.06 0.07 0.02 0.00 0.00 177.57 176.69 1a5j h LYS 23 N 0.63 0.66 0.00 1.57 5.09 -1.51 1.35 116.57 124.36 1a5j h LYS 23 Ca 0.18 -0.75 0.00 0.00 0.09 0.00 0.00 60.65 60.16 1a5j h LYS 23 Cb -0.05 0.23 0.00 0.00 0.10 0.00 0.00 32.23 32.51 1a5j h LYS 23 CO -0.04 1.33 0.00 -0.22 -2.09 0.00 0.00 179.45 178.43 1a5j h LYS 24 N 0.31 0.00 0.00 0.07 3.64 -0.92 -3.29 116.57 116.39 1a5j h LYS 24 Ca -0.14 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 58.89 1a5j h LYS 24 Cb 1.73 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.50 1a5j h LYS 24 CO 0.21 0.00 -2.13 0.66 -2.27 0.00 0.00 179.45 175.91 1a5j n TYR 25 N -2.32 0.00 0.00 1.91 4.02 0.37 -5.03 117.16 116.10 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 0.32 -0.86 0.00 0.00 -0.02 0.00 0.00 39.34 38.78 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 1.33 1.19 2.13 2.72 0.00 0.45 -4.73 105.19 108.28 1a5j n GLY 26 Ca -0.44 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.52 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 -3.56 0.00 2.61 -1.04 -0.20 -4.98 114.28 107.11 1a5j n THR 27 Ca 0.00 -0.40 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 1a5j n THR 27 Cb 0.00 -4.05 0.00 0.00 -1.82 0.00 0.00 70.33 64.46 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 -2.27 0.00 -2.89 -2.82 3.00 -1.26 -4.85 118.16 107.07 1a5j n LYS 28 Ca -0.07 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.80 1a5j n LYS 28 Cb 0.56 -0.73 0.01 0.00 0.00 0.00 0.00 35.03 34.87 1a5j n LYS 28 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1a5j n GLN 29 N -2.63 3.92 0.27 1.64 3.00 -1.26 -4.76 117.38 117.56 1a5j n GLN 29 Ca 0.00 -4.17 0.16 0.00 -0.01 0.00 0.00 57.00 52.98 1a5j n GLN 29 Cb 0.45 -2.70 0.88 0.00 0.00 0.00 0.00 30.24 28.86 1a5j n GLN 29 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.06 175.57 1a5j h TRP 30 N 5.98 0.00 0.00 1.08 4.06 -1.98 0.20 115.95 125.29 1a5j h TRP 30 Ca 0.26 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.20 1a5j h TRP 30 Cb 0.70 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.86 1a5j h TRP 30 CO 1.04 0.00 -0.06 1.15 -3.56 0.00 0.00 178.44 177.01 1a5j h THR 31 N 0.00 1.00 0.48 1.49 2.02 -1.96 -2.52 112.91 113.42 1a5j h THR 31 Ca 0.00 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.94 1a5j h THR 31 Cb 0.16 1.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 1a5j h THR 31 CO 0.00 0.06 -0.23 0.17 0.37 0.00 0.00 175.52 175.89 1a5j h LEU 32 N 0.00 -0.54 -0.39 2.58 8.10 -1.00 1.51 115.31 125.57 1a5j h LEU 32 Ca -0.00 -0.03 0.05 0.00 0.11 0.00 0.00 57.88 58.01 1a5j h LEU 32 Cb 0.11 0.14 -0.07 0.00 -0.44 0.00 0.00 40.66 40.40 1a5j h LEU 32 CO 0.01 -0.32 -0.49 0.40 -4.11 0.00 0.00 178.44 173.93 1a5j h ILE 33 N -0.73 0.00 0.64 0.15 5.03 -1.59 2.45 117.51 123.44 1a5j h ILE 33 Ca -0.07 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 64.64 1a5j h ILE 33 Cb 0.54 0.00 0.01 0.00 -3.03 0.00 0.00 36.82 34.33 1a5j h ILE 33 CO 0.11 0.00 -0.31 0.00 -0.68 0.00 0.00 178.15 177.27 1a5j h ALA 34 N -0.18 -1.15 -1.40 1.87 0.00 -1.47 1.60 119.26 118.53 1a5j h ALA 34 Ca 0.07 -0.19 0.41 0.00 0.00 0.00 0.00 54.91 55.20 1a5j h ALA 34 Cb 0.50 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 1a5j h ALA 34 CO -0.54 -1.09 1.10 -0.22 0.00 0.00 0.00 179.25 178.51 1a5j h LYS 35 N -0.91 0.00 0.00 0.00 3.64 0.25 0.82 116.57 120.38 1a5j h LYS 35 Ca -0.09 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1a5j h LYS 35 Cb 0.65 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.47 1a5j h LYS 35 CO 0.14 0.00 -0.21 0.45 -2.27 0.00 0.00 179.45 177.56 1a5j h HIS 36 N 0.00 0.00 -3.43 1.91 3.86 0.49 -3.42 115.15 114.57 1a5j h HIS 36 Ca 0.66 0.00 -0.76 0.00 -1.16 0.00 0.00 60.37 59.11 1a5j h HIS 36 Cb 2.87 0.00 -0.24 0.00 1.06 0.00 0.00 27.41 31.10 1a5j h HIS 36 CO 0.00 0.00 0.18 -0.51 0.86 0.00 0.00 177.93 178.46 1a5j s LEU 37 N -8.42 6.30 0.00 2.43 1.43 0.54 -5.03 118.68 115.94 1a5j s LEU 37 Ca -0.06 -2.37 0.00 0.00 -1.03 0.00 0.00 54.13 50.67 1a5j s LEU 37 Cb 0.01 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 43.98 1a5j s LEU 37 CO 0.09 -0.73 0.00 1.17 0.23 0.00 0.00 176.35 177.11 1a5j n LYS 38 N 4.75 1.01 0.00 1.70 3.00 -1.07 -4.44 118.16 123.11 1a5j n LYS 38 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.41 1a5j n LYS 38 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.49 1a5j n LYS 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1a5j n GLY 39 N 5.00 1.61 0.94 3.14 0.00 -1.26 -4.84 105.19 109.78 1a5j n GLY 39 Ca 0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 1a5j n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a5j n ARG 40 N 0.00 1.17 -2.75 1.61 3.00 -1.26 -5.02 116.66 113.40 1a5j n ARG 40 Ca 0.00 -0.97 -0.36 0.00 -0.01 0.00 0.00 57.85 56.51 1a5j n ARG 40 Cb 0.00 0.42 -0.06 0.00 0.00 0.00 0.00 32.46 32.81 1a5j n ARG 40 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1a5j s LEU 41 N 0.00 4.26 -0.02 0.55 2.01 -1.26 -4.93 118.68 119.28 1a5j s LEU 41 Ca 0.03 1.84 0.06 0.00 0.01 0.00 0.00 54.13 56.08 1a5j s LEU 41 Cb 0.00 -4.11 0.22 0.00 0.01 0.00 0.00 46.19 42.31 1a5j s LEU 41 CO 0.02 -0.17 1.07 0.61 1.01 0.00 0.00 176.35 178.90 1a5j n GLY 42 N 0.35 0.71 0.00 -3.19 0.00 -1.26 -4.78 105.19 97.02 1a5j n GLY 42 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 0.17 3.50 -3.71 1.61 3.00 -1.26 -4.58 118.16 116.88 1a5j n LYS 43 Ca 0.08 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.12 1a5j n LYS 43 Cb 0.31 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.35 1a5j n LYS 43 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1a5j n GLN 44 N 0.00 -0.88 0.00 1.64 0.00 -1.26 -4.63 117.38 112.24 1a5j n GLN 44 Ca 0.00 0.32 0.00 0.00 -0.00 0.00 0.00 57.00 57.32 1a5j n GLN 44 Cb 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 30.24 28.54 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 -1.66 -0.03 -0.73 0.00 1.74 -1.26 -1.49 116.66 113.24 1a5j n ARG 46 Ca 0.00 1.04 -0.18 0.00 -0.77 0.00 0.00 57.85 57.94 1a5j n ARG 46 Cb 0.00 -2.10 -0.05 0.00 -1.02 0.00 0.00 32.46 29.29 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 -4.28 1.90 0.00 5.56 2.13 -1.26 -0.05 120.64 124.64 1a5j n GLU 47 Ca 0.35 -1.21 0.00 0.00 0.66 0.00 0.00 57.16 56.95 1a5j n GLU 47 Cb 1.39 -2.25 0.00 0.00 0.27 0.00 0.00 31.44 30.85 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 3.64 0.00 -0.01 5.31 0.00 -0.55 -4.80 116.66 120.25 1a5j n ARG 48 Ca 0.40 0.00 0.08 0.00 -0.00 0.00 0.00 57.85 58.34 1a5j n ARG 48 Cb 0.28 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 32.59 1a5j n ARG 48 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 1a5j n TRP 49 N -0.93 0.12 -0.09 -0.14 8.01 -1.00 -4.25 117.44 119.16 1a5j n TRP 49 Ca 0.00 0.04 -0.09 0.00 -1.31 0.00 0.00 57.50 56.13 1a5j n TRP 49 Cb 0.00 -0.62 -0.13 0.00 -2.01 0.00 0.00 31.31 28.55 1a5j n TRP 49 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 1a5j n HIS 50 N -2.37 0.00 -3.44 -5.99 8.25 0.93 -4.67 115.22 107.93 1a5j n HIS 50 Ca -0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.03 1a5j n HIS 50 Cb 0.64 -0.86 -0.05 0.00 1.12 0.00 0.00 29.99 30.84 1a5j n HIS 50 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1a5j n ASN 51 N -2.70 4.64 0.15 0.41 5.03 -1.08 -4.62 115.26 117.10 1a5j n ASN 51 Ca -0.30 -3.26 0.00 0.00 0.87 0.00 0.00 54.58 51.89 1a5j n ASN 51 Cb 1.05 -1.02 0.00 0.00 -1.02 0.00 0.00 39.78 38.79 1a5j n ASN 51 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 1a5j n HIS 52 N 1.76 -3.93 -1.66 3.10 -0.00 -1.26 -4.14 115.22 109.09 1a5j n HIS 52 Ca 0.25 1.05 -0.65 0.00 0.46 0.00 0.00 57.72 58.83 1a5j n HIS 52 Cb 0.37 2.78 -0.09 0.00 -0.12 0.00 0.00 29.99 32.93 1a5j n HIS 52 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 1a5j n LEU 53 N -3.11 0.79 0.00 0.27 0.00 -1.26 -4.81 117.00 108.88 1a5j n LEU 53 Ca 0.00 1.18 0.00 0.00 0.00 0.00 0.00 56.01 57.19 1a5j n LEU 53 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 43.42 42.53 1a5j n LEU 53 CO 0.00 -1.20 0.00 -3.20 0.00 0.00 0.00 177.39 172.99 1a5j n ASN 54 N 3.14 0.00 -3.25 1.96 5.15 -1.26 -5.13 115.26 115.87 1a5j n ASN 54 Ca 0.27 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.25 1a5j n ASN 54 Cb -0.01 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.24 1a5j n ASN 54 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1a5j n PRO 55 N 0.00 1.39 -1.77 1.20 -0.04 -1.26 -5.11 135.00 129.42 1a5j n PRO 55 Ca 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.45 1a5j n PRO 55 Cb 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1a5j n PRO 55 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1a5j n GLU 56 N 0.00 1.63 0.19 0.54 1.02 -1.26 -4.80 120.64 117.95 1a5j n GLU 56 Ca 0.00 -0.15 0.05 0.00 -0.02 0.00 0.00 57.16 57.05 1a5j n GLU 56 Cb 0.00 0.02 0.34 0.00 -0.02 0.00 0.00 31.44 31.79 1a5j n GLU 56 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1a5j h VAL 57 N 0.67 0.91 0.00 2.62 2.07 -1.24 -3.39 116.25 117.89 1a5j h VAL 57 Ca -0.02 -1.50 -0.03 0.00 0.82 0.00 0.00 66.70 65.97 1a5j h VAL 57 Cb 0.05 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1a5j h VAL 57 CO 0.02 0.37 -0.05 1.17 0.02 0.00 0.00 177.57 179.10 1a5j n LYS 58 N -3.57 0.14 -2.30 1.57 4.81 -1.26 -4.93 118.16 112.63 1a5j n LYS 58 Ca -0.00 -0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.22 1a5j n LYS 58 Cb 0.50 0.27 0.00 0.00 0.02 0.00 0.00 35.03 35.82 1a5j n LYS 58 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1a5j n LYS 59 N -0.16 -4.36 0.00 1.64 3.00 -1.26 -4.08 118.16 112.93 1a5j n LYS 59 Ca -0.04 3.15 0.00 0.00 -0.00 0.00 0.00 58.31 61.42 1a5j n LYS 59 Cb 0.46 -4.02 0.00 0.00 0.00 0.00 0.00 35.03 31.47 1a5j n LYS 59 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1a5j n SER 60 N 1.89 0.00 -3.62 3.14 2.88 -1.26 -4.94 113.62 111.70 1a5j n SER 60 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1a5j n SER 60 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1a5j n SER 60 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1a5j n SER 61 N 2.08 0.00 -3.83 -3.46 7.64 -1.26 -4.94 113.62 109.85 1a5j n SER 61 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 1a5j n SER 61 Cb 0.00 0.00 0.27 0.00 -1.01 0.00 0.00 64.21 63.47 1a5j n SER 61 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1a5j s TRP 62 N 0.00 0.16 0.00 1.43 0.52 -1.26 -4.73 118.94 115.06 1a5j s TRP 62 Ca 0.00 0.74 0.00 0.00 0.02 0.00 0.00 56.10 56.86 1a5j s TRP 62 Cb 0.00 -3.03 0.00 0.00 -1.15 0.00 0.00 33.47 29.29 1a5j s TRP 62 CO 0.00 -4.50 0.00 0.25 0.02 0.00 0.00 176.95 172.72 1a5j n THR 63 N -5.30 0.00 0.00 2.01 -2.24 -1.26 -0.87 114.28 106.63 1a5j n THR 63 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1a5j n THR 63 Cb 0.58 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1a5j n THR 63 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1a5j n GLU 64 N 0.00 0.00 -0.48 -0.78 -0.58 -1.26 -2.56 120.64 114.98 1a5j n GLU 64 Ca 0.00 0.00 0.43 0.00 -0.42 0.00 0.00 57.16 57.17 1a5j n GLU 64 Cb 0.00 -0.38 0.77 0.00 -0.57 0.00 0.00 31.44 31.26 1a5j n GLU 64 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 1a5j h GLU 65 N 0.00 0.00 -0.40 3.49 4.11 -2.00 1.58 114.58 121.36 1a5j h GLU 65 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.31 1a5j h GLU 65 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1a5j h GLU 65 CO 0.00 0.00 -0.23 0.93 0.07 0.00 0.00 179.01 179.78 1a5j h GLU 66 N 0.00 0.87 -0.15 1.06 5.08 -1.98 -0.67 114.58 118.79 1a5j h GLU 66 Ca 0.72 -0.40 -0.03 0.00 -1.00 0.00 0.00 59.36 58.66 1a5j h GLU 66 Cb 2.95 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 32.18 1a5j h GLU 66 CO -0.01 1.04 -0.02 0.22 -1.00 0.00 0.00 179.01 179.24 1a5j h ASP 67 N 0.68 0.27 0.55 1.42 3.58 0.25 -2.84 116.42 120.34 1a5j h ASP 67 Ca 0.08 -0.35 -0.02 0.00 0.42 0.00 0.00 57.03 57.17 1a5j h ASP 67 Cb 0.80 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.77 1a5j h ASP 67 CO 0.07 0.56 -0.43 0.03 -2.88 0.00 0.00 179.24 176.58 1a5j h ARG 68 N -0.01 -0.91 -0.38 0.28 3.08 -1.14 0.27 114.38 115.57 1a5j h ARG 68 Ca 0.04 0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.19 1a5j h ARG 68 Cb 0.43 0.21 -0.05 0.00 0.08 0.00 0.00 29.97 30.64 1a5j h ARG 68 CO 0.01 -0.61 -0.22 -0.89 -1.07 0.00 0.00 179.97 177.19 1a5j n ILE 69 N -5.07 -0.26 -0.23 2.04 5.41 -0.26 0.24 119.36 121.22 1a5j n ILE 69 Ca -0.11 1.65 0.03 0.00 1.00 0.00 0.00 62.75 65.32 1a5j n ILE 69 Cb 0.41 -2.11 0.15 0.00 -0.71 0.00 0.00 39.64 37.38 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 0.64 0.00 1.39 2.04 -1.40 2.33 117.51 122.50 1a5j h ILE 70 Ca 0.06 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1a5j h ILE 70 Cb 0.15 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1a5j h ILE 70 CO -0.35 0.06 0.00 0.33 0.00 0.00 0.00 178.15 178.19 1a5j n PHE 71 N -5.07 0.68 -1.45 1.37 7.35 0.34 -1.78 117.46 118.90 1a5j n PHE 71 Ca 0.12 0.29 0.06 0.00 -0.76 0.00 0.00 57.45 57.17 1a5j n PHE 71 Cb 0.38 -0.97 0.10 0.00 0.35 0.00 0.00 39.48 39.34 1a5j n PHE 71 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 1a5j n GLU 72 N -2.15 0.87 -0.01 -4.13 0.28 0.65 -4.68 120.64 111.46 1a5j n GLU 72 Ca 0.01 -2.14 -0.01 0.00 -0.16 0.00 0.00 57.16 54.86 1a5j n GLU 72 Cb 0.16 -1.15 -0.02 0.00 1.43 0.00 0.00 31.44 31.87 1a5j n GLU 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1a5j n ALA 73 N -0.90 1.95 0.39 -1.84 0.00 0.70 -4.49 120.51 116.31 1a5j n ALA 73 Ca 0.11 -0.13 0.12 0.00 0.00 0.00 0.00 53.44 53.54 1a5j n ALA 73 Cb 0.68 0.30 0.49 0.00 0.00 0.00 0.00 19.45 20.92 1a5j n ALA 73 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1a5j n HIS 74 N -2.27 0.80 -0.41 0.00 -0.00 -0.87 -1.13 115.22 111.34 1a5j n HIS 74 Ca -0.04 0.32 0.10 0.00 0.46 0.00 0.00 57.72 58.55 1a5j n HIS 74 Cb 0.56 -1.01 0.29 0.00 -0.12 0.00 0.00 29.99 29.71 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 -2.23 3.01 -0.03 1.57 2.85 -1.26 -3.51 118.16 118.56 1a5j n LYS 75 Ca 0.02 -2.58 -0.04 0.00 -1.05 0.00 0.00 58.31 54.66 1a5j n LYS 75 Cb 0.22 -1.58 -0.04 0.00 -0.65 0.00 0.00 35.03 32.99 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 1.15 0.38 0.00 0.58 0.31 -0.29 -4.97 118.33 115.50 1a5j n VAL 76 Ca 0.22 -0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1a5j n VAL 76 Cb 0.65 -0.79 0.00 0.00 -0.91 0.00 0.00 33.84 32.79 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 -2.50 0.00 0.00 7.52 4.32 -0.80 -5.11 117.00 120.43 1a5j n LEU 77 Ca -0.11 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.88 1a5j n LEU 77 Cb 0.65 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.45 1a5j n LEU 77 CO 0.09 -0.34 0.00 0.61 -1.22 0.00 0.00 177.39 176.53 1a5j n GLY 78 N 3.20 -0.53 1.39 -0.72 0.00 -1.23 -4.90 105.19 102.40 1a5j n GLY 78 Ca 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 46.02 45.83 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 3.30 -2.79 1.61 0.23 -1.26 -4.41 115.26 111.94 1a5j n ASN 79 Ca 0.00 -2.62 -0.17 0.00 -0.53 0.00 0.00 54.58 51.26 1a5j n ASN 79 Cb 0.00 -0.63 -0.05 0.00 -2.08 0.00 0.00 39.78 37.02 1a5j n ASN 79 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1a5j n ARG 80 N -0.02 1.84 -0.29 -3.83 3.00 -1.26 -4.50 116.66 111.59 1a5j n ARG 80 Ca 0.22 -1.16 0.19 0.00 -0.01 0.00 0.00 57.85 57.09 1a5j n ARG 80 Cb 0.90 -2.21 0.48 0.00 0.00 0.00 0.00 32.46 31.63 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 5.36 0.66 -0.32 -1.55 4.06 -1.88 1.67 115.95 123.95 1a5j h TRP 81 Ca 0.37 0.02 0.09 0.00 2.06 0.00 0.00 58.89 61.43 1a5j h TRP 81 Cb 0.48 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.43 1a5j h TRP 81 CO 1.76 0.13 0.24 0.00 -3.56 0.00 0.00 178.44 177.02 1a5j h ALA 82 N 1.61 2.23 0.07 1.49 0.00 -1.86 -0.38 119.26 122.42 1a5j h ALA 82 Ca 0.53 -0.01 -0.37 0.00 0.00 0.00 0.00 54.91 55.05 1a5j h ALA 82 Cb 1.25 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 1a5j h ALA 82 CO -0.25 -0.40 -2.21 0.39 0.00 0.00 0.00 179.25 176.78 1a5j n GLU 83 N -4.31 0.71 -0.18 0.00 -0.58 0.52 -3.37 120.64 113.42 1a5j n GLU 83 Ca 0.05 0.21 -0.01 0.00 -0.42 0.00 0.00 57.16 56.99 1a5j n GLU 83 Cb 0.41 -1.63 0.08 0.00 -0.57 0.00 0.00 31.44 29.73 1a5j n GLU 83 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1a5j h ILE 84 N 0.04 0.53 -0.26 -3.67 1.08 0.80 -0.22 117.51 115.81 1a5j h ILE 84 Ca -0.49 -0.03 -0.05 0.00 -0.39 0.00 0.00 64.86 63.89 1a5j h ILE 84 Cb 1.98 0.42 -0.01 0.00 -3.07 0.00 0.00 36.82 36.14 1a5j h ILE 84 CO 0.01 0.02 -0.04 0.00 -0.69 0.00 0.00 178.15 177.45 1a5j h ALA 85 N 1.52 0.35 -1.63 1.87 0.00 -1.28 -2.50 119.26 117.58 1a5j h ALA 85 Ca 0.29 -0.25 0.47 0.00 0.00 0.00 0.00 54.91 55.42 1a5j h ALA 85 Cb 0.45 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 1a5j h ALA 85 CO -0.49 0.13 1.28 0.87 0.00 0.00 0.00 179.25 181.04 1a5j h LYS 86 N 0.23 0.00 0.05 0.00 1.57 -1.07 1.46 116.57 118.82 1a5j h LYS 86 Ca 0.07 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1a5j h LYS 86 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1a5j h LYS 86 CO 0.02 0.00 -0.02 -0.07 -0.57 0.00 0.00 179.45 178.81 1a5j h LEU 87 N 0.00 -0.06 -8.56 2.94 3.38 -0.94 -3.41 115.31 108.66 1a5j h LEU 87 Ca 0.77 -0.59 -0.70 0.00 0.09 0.00 0.00 57.88 57.45 1a5j h LEU 87 Cb 3.33 0.01 -0.20 0.00 0.09 0.00 0.00 40.66 43.90 1a5j h LEU 87 CO -0.01 0.61 -0.36 -0.76 0.09 0.00 0.00 178.44 178.01 1a5j s LEU 88 N -8.82 4.90 -0.06 1.67 2.01 0.50 -5.04 118.68 113.84 1a5j s LEU 88 Ca -0.15 -0.71 -0.30 0.00 0.01 0.00 0.00 54.13 52.98 1a5j s LEU 88 Cb -0.00 -2.24 -0.03 0.00 0.01 0.00 0.00 46.19 43.93 1a5j s LEU 88 CO 0.60 -0.45 1.23 -2.16 1.01 0.00 0.00 176.35 176.58 1a5j s PRO 89 N 1.84 4.33 0.00 1.29 0.04 -1.25 -3.75 135.00 137.50 1a5j s PRO 89 Ca 0.08 1.70 0.00 0.00 0.04 0.00 0.00 61.00 62.81 1a5j s PRO 89 Cb -0.18 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 30.77 1a5j s PRO 89 CO 0.11 -0.49 0.00 0.41 0.04 0.00 0.00 177.00 177.07 1a5j n GLY 90 N 3.42 3.73 3.92 0.56 0.00 -1.26 -5.11 105.19 110.45 1a5j n GLY 90 Ca 0.11 -0.67 -0.26 0.00 0.00 0.00 0.00 46.02 45.20 1a5j n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a5j s ARG 91 N 0.00 3.51 0.00 1.61 1.81 -1.25 -5.11 118.95 119.53 1a5j s ARG 91 Ca 0.00 0.04 0.00 0.00 -1.72 0.00 0.00 55.73 54.05 1a5j s ARG 91 Cb 0.00 -2.45 0.00 0.00 -0.45 0.00 0.00 34.95 32.05 1a5j s ARG 91 CO 0.00 -0.12 0.00 0.25 -0.68 0.00 0.00 175.30 174.75 1a5j n THR 92 N -2.14 0.00 -0.02 0.02 -2.24 -1.26 -4.78 114.28 103.87 1a5j n THR 92 Ca -0.01 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.61 1a5j n THR 92 Cb 0.55 -0.64 -0.10 0.00 -2.10 0.00 0.00 70.33 68.05 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 0.00 0.50 0.26 3.42 2.03 -1.91 -2.64 116.42 118.08 1a5j h ASP 93 Ca 0.00 -0.68 0.00 0.00 -0.73 0.00 0.00 57.03 55.62 1a5j h ASP 93 Cb 0.00 -0.15 0.00 0.00 -0.83 0.00 0.00 39.33 38.35 1a5j h ASP 93 CO 0.00 1.10 0.00 0.59 -1.03 0.00 0.00 179.24 179.90 1a5j n ASN 94 N -4.31 0.51 -0.02 4.15 3.02 -1.26 -0.47 115.26 116.87 1a5j n ASN 94 Ca -0.09 0.69 -0.00 0.00 -0.03 0.00 0.00 54.58 55.15 1a5j n ASN 94 Cb 0.58 -0.77 -0.00 0.00 -0.61 0.00 0.00 39.78 38.98 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 2.11 0.00 -0.17 5.41 0.00 -1.89 -3.13 119.26 121.59 1a5j h ALA 95 Ca 0.00 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1a5j h ALA 95 Cb 0.13 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1a5j h ALA 95 CO 0.00 0.03 -0.12 0.28 0.00 0.00 0.00 179.25 179.44 1a5j h VAL 96 N -0.37 0.66 -0.78 0.00 2.07 -1.32 0.42 116.25 116.93 1a5j h VAL 96 Ca 0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 1a5j h VAL 96 Cb 0.03 0.66 -0.11 0.00 -1.52 0.00 0.00 31.29 30.35 1a5j h VAL 96 CO 0.00 0.00 -0.57 0.50 0.02 0.00 0.00 177.57 177.52 1a5j h LYS 97 N -0.12 -0.14 -0.59 1.57 3.64 -0.96 0.43 116.57 120.40 1a5j h LYS 97 Ca 0.10 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1a5j h LYS 97 Cb 0.27 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 1a5j h LYS 97 CO -0.24 -0.10 0.38 -0.97 -2.27 0.00 0.00 179.45 176.25 1a5j h ASN 98 N -0.15 0.69 -0.41 4.20 -0.73 -1.37 -0.20 115.58 117.61 1a5j h ASN 98 Ca 0.14 -0.03 0.12 0.00 1.87 0.00 0.00 56.30 58.39 1a5j h ASN 98 Cb 0.49 -0.17 -0.02 0.00 0.27 0.00 0.00 38.32 38.89 1a5j h ASN 98 CO -0.81 0.51 0.65 -0.74 -0.37 0.00 0.00 177.43 176.67 1a5j h HIS 99 N 0.80 0.00 0.18 0.67 2.76 0.41 1.67 115.15 121.65 1a5j h HIS 99 Ca 0.21 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.38 1a5j h HIS 99 Cb -0.07 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.89 1a5j h HIS 99 CO -0.03 0.00 -0.09 2.35 -1.30 0.00 0.00 177.93 178.86 1a5j h TRP 100 N 0.00 -0.23 -0.00 5.26 -0.00 0.10 -1.37 115.95 119.71 1a5j h TRP 100 Ca 0.19 -0.01 0.00 0.00 -0.00 0.00 0.00 58.89 59.08 1a5j h TRP 100 Cb 1.50 0.08 0.00 0.00 -0.00 0.00 0.00 29.16 30.73 1a5j h TRP 100 CO 0.00 0.15 -0.08 0.09 -0.00 0.00 0.00 178.44 178.60 1a5j n ASN 101 N -5.01 0.36 0.00 2.65 3.02 0.21 0.37 115.26 116.85 1a5j n ASN 101 Ca -0.09 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 53.92 1a5j n ASN 101 Cb 0.25 -0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.31 1a5j n ASN 101 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1a5j n SER 102 N -1.00 0.00 0.00 6.41 7.64 0.51 -4.77 113.62 122.41 1a5j n SER 102 Ca 0.15 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.34 1a5j n SER 102 Cb 0.26 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 1a5j n SER 102 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1a5j n THR 103 N -0.92 0.00 -1.30 0.44 -1.04 -1.04 -4.75 114.28 105.67 1a5j n THR 103 Ca 0.00 -0.19 -0.30 0.00 -2.04 0.00 0.00 64.05 61.52 1a5j n THR 103 Cb 0.00 1.20 0.13 0.00 -1.82 0.00 0.00 70.33 69.83 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 -0.26 3.42 -2.04 12.58 2.08 -0.54 -4.37 119.36 130.23 1a5j n ILE 104 Ca 0.00 -2.50 -0.23 0.00 0.56 0.00 0.00 62.75 60.57 1a5j n ILE 104 Cb 0.05 -0.84 0.02 0.00 -0.75 0.00 0.00 39.64 38.12 1a5j n ILE 104 CO 0.00 0.00 0.00 2.29 0.56 0.00 0.00 176.55 179.40 1a5j n LYS 105 N -1.02 3.56 0.23 0.38 -0.00 0.16 -4.63 118.16 116.84 1a5j n LYS 105 Ca 0.61 -4.15 -0.10 0.00 -0.00 0.00 0.00 58.31 54.67 1a5j n LYS 105 Cb 1.12 -2.26 -0.05 0.00 -0.00 0.00 0.00 35.03 33.84 1a5j n LYS 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1a5j h ARG 106 N 2.19 -0.61 -5.41 -1.58 3.08 -1.84 -3.38 114.38 106.82 1a5j h ARG 106 Ca 0.36 0.04 -0.14 0.00 0.07 0.00 0.00 59.98 60.30 1a5j h ARG 106 Cb 1.53 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 31.70 1a5j h ARG 106 CO 0.74 -0.41 0.40 0.21 -1.07 0.00 0.00 179.97 179.84 1a5j s LYS 107 N -3.72 1.90 0.00 0.04 2.36 -1.26 -3.52 119.74 115.54 1a5j s LYS 107 Ca -0.09 -0.22 0.00 0.00 -2.55 0.00 0.00 55.97 53.11 1a5j s LYS 107 Cb 0.01 -4.98 0.00 0.00 -1.05 0.00 0.00 37.83 31.81 1a5j s LYS 107 CO 0.28 -4.34 0.00 0.28 1.55 0.00 0.00 175.35 173.11 1a5j n VAL 108 N 8.44 0.00 -0.60 4.02 0.31 -1.26 -4.89 118.33 124.35 1a5j n VAL 108 Ca 0.43 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.59 1a5j n VAL 108 Cb 0.46 -0.07 0.09 0.00 -0.91 0.00 0.00 33.84 33.41 1a5j n VAL 108 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1a5j n ASP 109 N -2.18 4.64 0.00 4.52 9.92 -1.23 -5.26 116.55 126.96 1a5j n ASP 109 Ca 0.00 -3.09 0.00 0.00 -0.53 0.00 0.00 54.79 51.17 1a5j n ASP 109 Cb 0.00 -0.82 0.00 0.00 -0.64 0.00 0.00 41.12 39.66 1a5j n ASP 109 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40