#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lc2 s ASP 2 N 0.00 -0.06 0.08 1.61 2.15 -1.26 -4.84 116.67 114.35 1lc2 s ASP 2 Ca 0.00 -0.97 -0.33 0.00 0.43 0.00 0.00 52.55 51.68 1lc2 s ASP 2 Cb 0.00 0.56 -0.17 0.00 -0.30 0.00 0.00 42.92 43.01 1lc2 s ASP 2 CO 0.00 -1.09 1.61 0.58 -0.17 0.00 0.00 175.17 176.10 1lc2 h VAL 3 N 2.31 0.26 -0.75 1.11 2.07 -1.82 -0.55 116.25 118.87 1lc2 h VAL 3 Ca -0.27 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.21 1lc2 h VAL 3 Cb 1.25 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1lc2 h VAL 3 CO 0.38 0.00 0.32 -0.33 0.02 0.00 0.00 177.57 177.96 1lc2 h GLU 4 N -0.88 1.11 0.00 1.57 3.07 -1.97 0.22 114.58 117.69 1lc2 h GLU 4 Ca -0.07 -0.18 -0.04 0.00 -0.50 0.00 0.00 59.36 58.57 1lc2 h GLU 4 Cb 0.72 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.44 1lc2 h GLU 4 CO 0.06 0.89 -0.18 0.87 -1.40 0.00 0.00 179.01 179.25 1lc2 h LYS 5 N 1.09 0.00 0.09 2.33 1.79 -1.94 -3.27 116.57 116.66 1lc2 h LYS 5 Ca 0.25 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 58.40 1lc2 h LYS 5 Cb 0.18 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 1lc2 h LYS 5 CO -0.02 0.18 -1.75 0.78 -1.08 0.00 0.00 179.45 177.56 1lc2 h GLY 6 N 0.55 0.22 0.66 3.86 0.00 0.32 -3.27 103.07 105.40 1lc2 h GLY 6 Ca -0.00 -0.56 0.06 0.00 0.00 0.00 0.00 47.33 46.83 1lc2 h GLY 6 CO 0.02 0.49 0.35 0.07 0.00 0.00 0.00 176.54 177.47 1lc2 h LYS 7 N -0.27 0.62 -0.30 4.80 5.09 -0.76 0.45 116.57 126.19 1lc2 h LYS 7 Ca -0.40 -0.04 -0.11 0.00 0.09 0.00 0.00 60.65 60.20 1lc2 h LYS 7 Cb 1.81 -0.14 -0.01 0.00 0.10 0.00 0.00 32.23 33.98 1lc2 h LYS 7 CO -0.00 0.41 -0.25 1.57 -2.09 0.00 0.00 179.45 179.09 1lc2 h LYS 8 N 0.64 0.60 0.05 0.07 5.09 -1.71 0.25 116.57 121.55 1lc2 h LYS 8 Ca 0.29 -0.24 -0.23 0.00 0.09 0.00 0.00 60.65 60.56 1lc2 h LYS 8 Cb 0.20 -0.03 -0.01 0.00 0.10 0.00 0.00 32.23 32.49 1lc2 h LYS 8 CO -0.19 0.80 -1.03 0.97 -2.09 0.00 0.00 179.45 177.91 1lc2 h ILE 9 N 0.52 1.53 0.11 0.07 6.09 -1.55 -2.57 117.51 121.72 1lc2 h ILE 9 Ca 0.07 -2.92 0.01 0.00 -1.37 0.00 0.00 64.86 60.65 1lc2 h ILE 9 Cb 0.71 2.71 -0.02 0.00 0.47 0.00 0.00 36.82 40.68 1lc2 h ILE 9 CO 0.05 0.85 -0.17 0.15 -3.07 0.00 0.00 178.15 175.96 1lc2 h PHE 10 N 0.08 -0.45 0.00 2.19 3.04 -0.75 0.26 116.94 121.31 1lc2 h PHE 10 Ca -0.07 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.89 1lc2 h PHE 10 Cb 1.73 0.19 0.00 0.00 2.56 0.00 0.00 35.95 40.42 1lc2 h PHE 10 CO 0.04 -0.26 0.00 0.28 -2.02 0.00 0.00 178.31 176.35 1lc2 n VAL 11 N -5.30 1.28 -0.08 1.41 0.31 0.06 -0.17 118.33 115.84 1lc2 n VAL 11 Ca -0.07 0.32 -0.17 0.00 -0.01 0.00 0.00 64.34 64.41 1lc2 n VAL 11 Cb 0.22 -1.18 -0.13 0.00 -0.91 0.00 0.00 33.84 31.84 1lc2 n VAL 11 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1lc2 n GLN 12 N -1.45 0.68 0.00 5.55 7.27 -0.79 -4.51 117.38 124.13 1lc2 n GLN 12 Ca 0.03 0.16 0.00 0.00 0.07 0.00 0.00 57.00 57.26 1lc2 n GLN 12 Cb 0.09 -1.58 0.00 0.00 2.41 0.00 0.00 30.24 31.16 1lc2 n GLN 12 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1lc2 n LYS 13 N -3.22 3.80 -0.00 3.69 3.00 0.01 -4.74 118.16 120.70 1lc2 n LYS 13 Ca -0.39 0.00 -0.00 0.00 -0.00 0.00 0.00 58.31 57.92 1lc2 n LYS 13 Cb 1.03 -0.60 -0.00 0.00 0.00 0.00 0.00 35.03 35.46 1lc2 n LYS 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1lc2 h ALA 15 N 0.00 1.18 -0.09 0.00 0.00 -1.12 0.85 119.26 120.08 1lc2 h ALA 15 Ca -0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1lc2 h ALA 15 Cb 1.01 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1lc2 h ALA 15 CO -0.00 -0.16 0.44 0.37 0.00 0.00 0.00 179.25 179.90 1lc2 h GLN 16 N 0.00 0.00 0.00 0.00 -0.00 -1.82 -3.33 115.11 109.96 1lc2 h GLN 16 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1lc2 h GLN 16 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.79 1lc2 h GLN 16 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.83 178.83 1lc2 n HIS 18 N -0.44 0.00 -2.74 0.00 8.25 0.17 -0.60 115.22 119.85 1lc2 n HIS 18 Ca 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.29 1lc2 n HIS 18 Cb 0.00 -0.59 0.02 0.00 1.12 0.00 0.00 29.99 30.54 1lc2 n HIS 18 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1lc2 n THR 19 N -4.18 -2.29 0.02 1.59 -1.04 -1.25 -3.40 114.28 103.73 1lc2 n THR 19 Ca -0.26 0.19 -0.00 0.00 -2.04 0.00 0.00 64.05 61.94 1lc2 n THR 19 Cb 0.60 -2.48 0.29 0.00 -1.82 0.00 0.00 70.33 66.92 1lc2 n THR 19 CO 0.00 0.00 0.00 1.62 -0.64 0.00 0.00 175.07 176.05 1lc2 h VAL 20 N 2.18 1.21 -2.97 12.58 3.04 -1.87 -1.43 116.25 128.99 1lc2 h VAL 20 Ca -0.25 -0.87 -0.53 0.00 -1.01 0.00 0.00 66.70 64.04 1lc2 h VAL 20 Cb 0.93 1.06 -0.01 0.00 -2.01 0.00 0.00 31.29 31.26 1lc2 h VAL 20 CO 0.10 0.29 -0.26 -0.70 -1.01 0.00 0.00 177.57 175.99 1lc2 s GLU 21 N -4.84 3.56 4.39 4.17 2.12 -1.26 -4.48 118.70 122.36 1lc2 s GLU 21 Ca -0.07 -0.22 0.00 0.00 0.36 0.00 0.00 54.97 55.04 1lc2 s GLU 21 Cb 0.15 -2.76 0.00 0.00 0.26 0.00 0.00 34.13 31.78 1lc2 s GLU 21 CO 0.76 0.32 0.00 1.63 -0.54 0.00 0.00 175.26 177.44 1lc2 n LYS 22 N -0.80 0.00 -1.23 4.30 5.02 -1.26 -2.50 118.16 121.69 1lc2 n LYS 22 Ca -0.04 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.90 1lc2 n LYS 22 Cb 0.54 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.53 1lc2 n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lc2 n GLY 23 N 0.00 3.87 3.76 0.72 0.00 -1.26 -4.98 105.19 107.30 1lc2 n GLY 23 Ca 0.00 -1.34 -0.36 0.00 0.00 0.00 0.00 46.02 44.32 1lc2 n GLY 23 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1lc2 s GLY 24 N 2.87 2.74 -0.30 -0.02 0.00 -1.04 -5.05 107.32 106.52 1lc2 s GLY 24 Ca 0.58 0.99 0.00 0.00 0.00 0.00 0.00 44.72 46.28 1lc2 s GLY 24 CO -0.05 1.39 0.67 0.54 0.00 0.00 0.00 173.10 175.65 1lc2 s LYS 25 N -3.17 0.50 -0.58 2.90 1.02 -0.54 -5.00 119.74 114.87 1lc2 s LYS 25 Ca 0.74 0.71 -0.24 0.00 0.02 0.00 0.00 55.97 57.19 1lc2 s LYS 25 Cb -0.30 0.37 -0.21 0.00 -0.52 0.00 0.00 37.83 37.17 1lc2 s LYS 25 CO 0.33 -0.73 1.84 -2.39 -0.92 0.00 0.00 175.35 173.49 1lc2 n HIS 26 N 5.41 1.40 -0.04 3.18 1.44 -1.22 -4.19 115.22 121.20 1lc2 n HIS 26 Ca 0.02 -1.46 -0.14 0.00 -2.01 0.00 0.00 57.72 54.12 1lc2 n HIS 26 Cb 0.53 -1.48 -0.03 0.00 0.12 0.00 0.00 29.99 29.13 1lc2 n HIS 26 CO 0.00 0.00 0.00 -0.22 -2.81 0.00 0.00 176.34 173.31 1lc2 h LYS 27 N 8.47 0.77 0.00 -1.40 3.64 -1.74 -3.43 116.57 122.88 1lc2 h LYS 27 Ca 0.38 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1lc2 h LYS 27 Cb 0.68 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1lc2 h LYS 27 CO 1.97 1.16 0.00 2.41 -2.27 0.00 0.00 179.45 182.72 1lc2 n THR 28 N -3.96 0.00 -4.46 1.00 -1.04 0.23 -5.05 114.28 101.00 1lc2 n THR 28 Ca -0.05 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.74 1lc2 n THR 28 Cb 0.67 0.34 -0.10 0.00 -1.82 0.00 0.00 70.33 69.42 1lc2 n THR 28 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1lc2 s GLY 29 N 0.00 2.18 0.83 3.41 0.00 -0.01 -4.95 107.32 108.78 1lc2 s GLY 29 Ca 0.00 -1.81 -0.11 0.00 0.00 0.00 0.00 44.72 42.79 1lc2 s GLY 29 CO 0.00 -1.80 1.09 2.56 0.00 0.00 0.00 173.10 174.95 1lc2 s PRO 30 N -3.87 1.82 0.00 2.90 0.04 -1.26 -4.44 135.00 130.19 1lc2 s PRO 30 Ca 0.33 0.85 0.04 0.00 0.04 0.00 0.00 61.00 62.26 1lc2 s PRO 30 Cb 0.07 -1.87 0.26 0.00 0.04 0.00 0.00 34.50 33.00 1lc2 s PRO 30 CO 0.15 -1.86 0.81 0.27 0.04 0.00 0.00 177.00 176.41 1lc2 n ASN 31 N -3.63 0.00 -3.69 6.66 0.23 -1.26 -4.68 115.26 108.89 1lc2 n ASN 31 Ca 0.07 -1.07 -0.30 0.00 -0.53 0.00 0.00 54.58 52.75 1lc2 n ASN 31 Cb 0.55 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.26 1lc2 n ASN 31 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1lc2 n LEU 32 N -0.61 -2.11 0.00 -4.53 4.32 -1.26 -3.24 117.00 109.57 1lc2 n LEU 32 Ca 0.03 -0.68 0.00 0.00 -0.02 0.00 0.00 56.01 55.35 1lc2 n LEU 32 Cb 0.01 -1.62 0.00 0.00 -1.62 0.00 0.00 43.42 40.20 1lc2 n LEU 32 CO 0.02 0.24 0.00 1.41 -1.22 0.00 0.00 177.39 177.85 1lc2 n HIS 33 N -1.73 -0.97 -0.24 -1.77 8.25 -1.26 -4.72 115.22 112.79 1lc2 n HIS 33 Ca -0.24 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.16 1lc2 n HIS 33 Cb 0.69 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.79 1lc2 n HIS 33 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lc2 n GLY 34 N 0.00 2.04 0.25 -1.41 0.00 -1.26 -4.69 105.19 100.12 1lc2 n GLY 34 Ca 0.00 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 1lc2 n GLY 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1lc2 h LEU 35 N 8.98 0.86 -8.43 0.99 5.85 -1.85 -3.42 115.31 118.29 1lc2 h LEU 35 Ca 0.15 -0.39 -0.36 0.00 0.84 0.00 0.00 57.88 58.11 1lc2 h LEU 35 Cb 0.08 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 1lc2 h LEU 35 CO 1.06 1.15 1.06 -0.36 -0.34 0.00 0.00 178.44 181.01 1lc2 s PHE 36 N -4.33 1.49 0.00 1.25 0.40 -1.25 -1.03 117.98 114.51 1lc2 s PHE 36 Ca -0.10 1.10 0.00 0.00 -0.60 0.00 0.00 56.93 57.34 1lc2 s PHE 36 Cb 0.12 -3.87 0.00 0.00 0.51 0.00 0.00 43.02 39.78 1lc2 s PHE 36 CO 0.86 -2.10 0.00 0.41 0.70 0.00 0.00 175.22 175.09 1lc2 n GLY 37 N 6.23 1.48 2.35 4.36 0.00 0.36 -4.96 105.19 115.01 1lc2 n GLY 37 Ca 0.33 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.26 1lc2 n GLY 37 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1lc2 n ARG 38 N -0.63 0.53 -1.54 1.61 1.85 -0.20 -4.96 116.66 113.33 1lc2 n ARG 38 Ca 0.00 -1.85 -0.31 0.00 -1.00 0.00 0.00 57.85 54.70 1lc2 n ARG 38 Cb 0.00 1.86 0.07 0.00 -1.05 0.00 0.00 32.46 33.33 1lc2 n ARG 38 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1lc2 s LYS 39 N -2.46 2.57 0.02 2.89 -0.14 -1.26 -1.19 119.74 120.17 1lc2 s LYS 39 Ca 0.18 0.86 -0.01 0.00 -1.36 0.00 0.00 55.97 55.63 1lc2 s LYS 39 Cb -0.01 -1.96 -0.27 0.00 -1.68 0.00 0.00 37.83 33.91 1lc2 s LYS 39 CO 0.13 -1.33 0.93 0.00 -0.76 0.00 0.00 175.35 174.32 1lc2 h THR 40 N -0.89 1.24 -0.16 2.17 1.03 -1.92 -3.42 112.91 110.97 1lc2 h THR 40 Ca -0.45 -2.89 -0.70 0.00 -0.01 0.00 0.00 66.41 62.36 1lc2 h THR 40 Cb 1.23 2.78 -0.04 0.00 -1.07 0.00 0.00 68.15 71.05 1lc2 h THR 40 CO 0.57 0.82 2.90 0.61 -0.01 0.00 0.00 175.52 180.41 1lc2 n GLY 41 N 1.61 3.94 0.00 2.99 0.00 -1.26 -4.49 105.19 107.98 1lc2 n GLY 41 Ca -0.14 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.35 1lc2 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lc2 n GLN 42 N 6.59 0.00 -2.37 1.61 0.00 -1.26 -5.11 117.38 116.84 1lc2 n GLN 42 Ca 0.51 0.00 -0.43 0.00 0.00 0.00 0.00 57.00 57.08 1lc2 n GLN 42 Cb 0.40 -0.23 -0.02 0.00 0.00 0.00 0.00 30.24 30.39 1lc2 n GLN 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1lc2 s ALA 43 N 0.00 3.27 -1.14 2.61 0.00 -1.26 -4.94 121.76 120.30 1lc2 s ALA 43 Ca 0.00 0.08 -0.09 0.00 0.00 0.00 0.00 51.96 51.95 1lc2 s ALA 43 Cb 0.00 -3.83 -0.13 0.00 0.00 0.00 0.00 23.12 19.16 1lc2 s ALA 43 CO 0.00 -1.95 3.06 -0.35 0.00 0.00 0.00 175.76 176.52 1lc2 n PRO 44 N 7.55 3.11 0.00 0.00 -0.04 -1.26 -4.11 135.00 140.25 1lc2 n PRO 44 Ca 0.16 -1.81 0.00 0.00 -0.04 0.00 0.00 63.50 61.80 1lc2 n PRO 44 Cb 0.47 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.38 1lc2 n PRO 44 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lc2 n GLY 45 N 3.30 0.46 3.40 0.55 0.00 -1.26 -5.12 105.19 106.52 1lc2 n GLY 45 Ca 0.66 -0.65 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 1lc2 n GLY 45 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1lc2 s PHE 46 N 0.00 1.28 -0.20 1.61 5.36 -1.26 -4.95 117.98 119.82 1lc2 s PHE 46 Ca 0.00 -1.40 -0.08 0.00 -0.96 0.00 0.00 56.93 54.48 1lc2 s PHE 46 Cb 0.00 -0.32 0.08 0.00 -0.34 0.00 0.00 43.02 42.44 1lc2 s PHE 46 CO 0.00 -1.01 0.44 -0.08 -1.46 0.00 0.00 175.22 173.12 1lc2 s THR 47 N -3.30 -0.43 0.30 0.12 -1.32 -1.26 -5.09 115.64 104.66 1lc2 s THR 47 Ca 0.34 0.13 -0.17 0.00 -1.21 0.00 0.00 61.69 60.78 1lc2 s THR 47 Cb 0.01 -0.68 0.02 0.00 -1.51 0.00 0.00 72.50 70.34 1lc2 s THR 47 CO 0.22 0.05 0.66 -0.72 -2.21 0.00 0.00 174.62 172.62 1lc2 s TYR 48 N 2.18 0.10 -0.49 9.09 -0.85 -1.26 -5.02 117.35 121.09 1lc2 s TYR 48 Ca -0.05 -0.56 -0.28 0.00 -0.52 0.00 0.00 57.07 55.65 1lc2 s TYR 48 Cb -0.10 0.56 0.01 0.00 0.38 0.00 0.00 41.96 42.80 1lc2 s TYR 48 CO -0.13 -1.25 1.47 0.95 -1.52 0.00 0.00 175.55 175.07 1lc2 s THR 49 N -3.54 3.79 -1.15 -3.49 -4.23 -1.26 -4.95 115.64 100.81 1lc2 s THR 49 Ca 0.16 0.73 -0.21 0.00 -1.18 0.00 0.00 61.69 61.19 1lc2 s THR 49 Cb -0.04 -4.26 -0.00 0.00 1.34 0.00 0.00 72.50 69.54 1lc2 s THR 49 CO 0.09 -0.93 1.78 -0.62 -0.54 0.00 0.00 174.62 174.40 1lc2 s ASP 50 N 4.57 5.95 0.00 3.99 2.15 -1.26 -3.81 116.67 128.26 1lc2 s ASP 50 Ca 0.59 -1.76 0.00 0.00 0.43 0.00 0.00 52.55 51.81 1lc2 s ASP 50 Cb -0.13 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 1lc2 s ASP 50 CO 0.28 -2.08 0.00 0.00 -0.17 0.00 0.00 175.17 173.21 1lc2 n ALA 51 N 11.23 2.62 -0.05 3.66 0.00 -1.26 -4.72 120.51 131.99 1lc2 n ALA 51 Ca 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.83 1lc2 n ALA 51 Cb 0.47 0.02 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 1lc2 n ALA 51 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1lc2 h ASN 52 N 0.00 -0.56 -0.21 0.00 -1.24 -1.85 -1.83 115.58 109.90 1lc2 h ASN 52 Ca 0.00 0.07 0.03 0.00 0.71 0.00 0.00 56.30 57.12 1lc2 h ASN 52 Cb 0.04 0.23 -0.03 0.00 0.73 0.00 0.00 38.32 39.29 1lc2 h ASN 52 CO 0.00 -0.12 0.01 0.11 -1.29 0.00 0.00 177.43 176.14 1lc2 h LYS 53 N -0.11 0.08 0.00 6.67 6.56 -1.88 -0.94 116.57 126.95 1lc2 h LYS 53 Ca 0.02 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1lc2 h LYS 53 Cb 0.17 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.82 1lc2 h LYS 53 CO -0.18 0.05 0.23 -0.97 -2.06 0.00 0.00 179.45 176.52 1lc2 h ASN 54 N 0.08 0.00 0.00 0.86 -0.73 -1.84 -3.33 115.58 110.62 1lc2 h ASN 54 Ca 0.10 0.00 -0.23 0.00 1.87 0.00 0.00 56.30 58.04 1lc2 h ASN 54 Cb 0.12 0.00 -0.15 0.00 0.27 0.00 0.00 38.32 38.56 1lc2 h ASN 54 CO -0.16 0.00 -0.41 0.29 -0.37 0.00 0.00 177.43 176.79 1lc2 n LYS 55 N -2.52 0.96 0.00 6.67 4.76 -0.47 -5.04 118.16 122.52 1lc2 n LYS 55 Ca -0.02 -1.85 0.00 0.00 -2.87 0.00 0.00 58.31 53.58 1lc2 n LYS 55 Cb 0.27 -0.97 0.00 0.00 -1.84 0.00 0.00 35.03 32.48 1lc2 n LYS 55 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1lc2 n GLY 56 N 0.38 -1.84 0.00 0.72 0.00 -0.51 -4.75 105.19 99.18 1lc2 n GLY 56 Ca 0.05 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1lc2 n GLY 56 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1lc2 n ILE 57 N -0.47 0.00 -2.05 -0.61 -6.64 -1.26 -5.12 119.36 103.21 1lc2 n ILE 57 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 1lc2 n ILE 57 Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 1lc2 n ILE 57 CO 0.00 0.00 0.00 0.41 -1.77 0.00 0.00 176.55 175.19 1lc2 n THR 58 N 0.00-11.33 -2.15 7.28 -1.04 -1.26 -4.92 114.28 100.86 1lc2 n THR 58 Ca 0.00 2.86 -0.42 0.00 -2.04 0.00 0.00 64.05 64.44 1lc2 n THR 58 Cb 0.20 -4.76 -0.03 0.00 -1.82 0.00 0.00 70.33 63.92 1lc2 n THR 58 CO 0.00 0.00 0.00 0.26 -0.64 0.00 0.00 175.07 174.69 1lc2 s TRP 59 N -0.44 2.45 0.11 -1.42 0.23 -0.34 -4.77 118.94 114.76 1lc2 s TRP 59 Ca 0.00 0.55 -0.22 0.00 -2.03 0.00 0.00 56.10 54.41 1lc2 s TRP 59 Cb 0.00 -3.76 0.07 0.00 0.03 0.00 0.00 33.47 29.81 1lc2 s TRP 59 CO 0.00 -3.01 1.01 0.36 0.96 0.00 0.00 176.95 176.28 1lc2 n LYS 60 N 6.37 0.47 0.00 4.98 2.85 -1.26 -0.49 118.16 131.08 1lc2 n LYS 60 Ca 0.15 -1.16 0.00 0.00 -1.05 0.00 0.00 58.31 56.25 1lc2 n LYS 60 Cb 0.43 1.64 0.00 0.00 -0.65 0.00 0.00 35.03 36.45 1lc2 n LYS 60 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1lc2 n GLU 61 N -0.72 0.10 0.00 -1.58 2.13 -1.26 -2.24 120.64 117.07 1lc2 n GLU 61 Ca -0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1lc2 n GLU 61 Cb 0.53 -1.36 0.00 0.00 0.27 0.00 0.00 31.44 30.88 1lc2 n GLU 61 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1lc2 n GLU 62 N 0.84 0.00 0.00 5.31 1.02 -1.26 -4.96 120.64 121.59 1lc2 n GLU 62 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1lc2 n GLU 62 Cb 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.47 1lc2 n GLU 62 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1lc2 n THR 63 N 0.00 0.00 0.13 2.62 -2.24 -0.95 -4.77 114.28 109.07 1lc2 n THR 63 Ca 0.00 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1lc2 n THR 63 Cb 0.48 0.00 0.14 0.00 -2.10 0.00 0.00 70.33 68.85 1lc2 n THR 63 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1lc2 h LEU 64 N 0.00 0.00 0.38 3.22 4.07 -1.83 -1.42 115.31 119.73 1lc2 h LEU 64 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 1lc2 h LEU 64 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1lc2 h LEU 64 CO 0.00 0.62 -0.18 0.24 -1.08 0.00 0.00 178.44 178.04 1lc2 h MET 65 N 0.00 -0.49 -0.62 1.13 2.86 -1.88 0.15 114.93 116.08 1lc2 h MET 65 Ca -0.01 0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.62 1lc2 h MET 65 Cb 1.22 0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.96 1lc2 h MET 65 CO 0.08 -0.25 0.19 1.49 1.06 0.00 0.00 176.91 179.48 1lc2 h GLU 66 N -0.64 0.97 -0.10 1.72 4.57 -1.86 -1.25 114.58 117.98 1lc2 h GLU 66 Ca -0.05 -0.21 -0.01 0.00 -1.18 0.00 0.00 59.36 57.91 1lc2 h GLU 66 Cb 0.47 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 1lc2 h GLU 66 CO 0.09 0.86 0.02 -0.92 -1.18 0.00 0.00 179.01 177.88 1lc2 h TYR 67 N 0.90 0.17 0.35 0.92 3.20 -1.20 -0.35 116.97 120.96 1lc2 h TYR 67 Ca 0.20 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 1lc2 h TYR 67 Cb 0.30 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.52 1lc2 h TYR 67 CO 0.02 0.34 -0.20 -0.07 -1.64 0.00 0.00 178.16 176.61 1lc2 h LEU 68 N -0.04 -0.49 -1.37 2.82 -0.00 -0.58 -1.07 115.31 114.57 1lc2 h LEU 68 Ca 0.03 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 1lc2 h LEU 68 Cb 0.25 0.14 0.00 0.00 -0.00 0.00 0.00 40.66 41.05 1lc2 h LEU 68 CO 0.00 -0.33 0.00 -0.33 -0.00 0.00 0.00 178.44 177.78 1lc2 h GLU 69 N -0.52 0.00 0.00 1.13 4.39 -1.23 -2.34 114.58 116.01 1lc2 h GLU 69 Ca -0.04 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.44 1lc2 h GLU 69 Cb 0.42 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 28.93 1lc2 h GLU 69 CO 0.05 0.00 -0.44 0.09 -1.16 0.00 0.00 179.01 177.55 1lc2 n ASN 70 N -2.87 -2.66 0.20 1.42 5.03 -0.14 -4.10 115.26 112.14 1lc2 n ASN 70 Ca 0.01 -3.30 -0.08 0.00 0.87 0.00 0.00 54.58 52.08 1lc2 n ASN 70 Cb 0.27 1.79 -0.04 0.00 -1.02 0.00 0.00 39.78 40.78 1lc2 n ASN 70 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 1lc2 h PRO 71 N 3.69 -0.52 0.00 3.52 0.13 -1.35 0.16 132.00 137.62 1lc2 h PRO 71 Ca -0.15 0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1lc2 h PRO 71 Cb 1.06 0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1lc2 h PRO 71 CO 0.25 -0.35 -0.01 0.87 -0.23 0.00 0.00 178.00 178.53 1lc2 h LYS 72 N -0.75 0.00 0.03 0.86 1.57 -1.75 -1.07 116.57 115.46 1lc2 h LYS 72 Ca -0.06 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1lc2 h LYS 72 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1lc2 h LYS 72 CO 0.09 0.01 -0.01 -0.22 -0.57 0.00 0.00 179.45 178.75 1lc2 h LYS 73 N 0.00 -0.04 -0.54 3.15 3.11 -1.87 -3.38 116.57 117.00 1lc2 h LYS 73 Ca -0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1lc2 h LYS 73 Cb 0.19 0.01 -0.03 0.00 -1.00 0.00 0.00 32.23 31.40 1lc2 h LYS 73 CO 0.00 0.66 0.35 -0.92 -2.81 0.00 0.00 179.45 176.73 1lc2 h TYR 74 N -0.83 0.69 -3.64 1.91 3.20 0.28 -3.43 116.97 115.15 1lc2 h TYR 74 Ca -0.00 0.01 -0.37 0.00 3.14 0.00 0.00 58.73 61.50 1lc2 h TYR 74 Cb 0.72 -0.23 -0.32 0.00 1.54 0.00 0.00 36.73 38.43 1lc2 h TYR 74 CO 0.18 0.45 -0.76 0.96 -1.64 0.00 0.00 178.16 177.35 1lc2 s ILE 75 N -6.09 0.45 -1.44 1.81 -4.36 -0.50 -5.08 121.20 106.00 1lc2 s ILE 75 Ca -0.13 -0.14 -0.14 0.00 -0.26 0.00 0.00 60.65 59.99 1lc2 s ILE 75 Cb 0.12 -0.45 -0.00 0.00 1.25 0.00 0.00 42.46 43.38 1lc2 s ILE 75 CO 0.75 0.18 2.36 -0.81 0.24 0.00 0.00 174.94 177.65 1lc2 n PRO 76 N 3.64 2.92 0.00 0.37 -0.04 -1.26 -4.22 135.00 136.41 1lc2 n PRO 76 Ca -0.21 -2.44 0.00 0.00 -0.04 0.00 0.00 63.50 60.81 1lc2 n PRO 76 Cb 0.53 -3.15 0.00 0.00 -0.04 0.00 0.00 33.50 30.85 1lc2 n PRO 76 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lc2 n GLY 77 N 4.02 -0.64 0.94 0.55 0.00 -1.26 -4.71 105.19 104.08 1lc2 n GLY 77 Ca 0.57 0.64 0.06 0.00 0.00 0.00 0.00 46.02 47.29 1lc2 n GLY 77 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1lc2 n THR 78 N 0.00 -1.11 -1.96 2.61 -1.04 -1.26 -4.32 114.28 107.20 1lc2 n THR 78 Ca 0.00 0.73 0.00 0.00 -2.04 0.00 0.00 64.05 62.74 1lc2 n THR 78 Cb 0.00 -1.16 0.00 0.00 -1.82 0.00 0.00 70.33 67.35 1lc2 n THR 78 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1lc2 n LYS 79 N -2.95 0.00 -1.96 -2.82 4.76 -1.26 -4.91 118.16 109.02 1lc2 n LYS 79 Ca -0.04 -0.95 -0.25 0.00 -2.87 0.00 0.00 58.31 54.20 1lc2 n LYS 79 Cb 0.38 -0.48 -0.07 0.00 -1.84 0.00 0.00 35.03 33.01 1lc2 n LYS 79 CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 1lc2 n MET 80 N 0.00 1.30 -1.96 1.97 0.00 -1.26 -4.89 117.12 112.28 1lc2 n MET 80 Ca 0.00 -2.32 -0.33 0.00 -0.00 0.00 0.00 57.70 55.06 1lc2 n MET 80 Cb 0.69 -3.78 -0.05 0.00 0.00 0.00 0.00 33.22 30.08 1lc2 n MET 80 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 175.97 175.08 1lc2 n ILE 81 N 8.06 2.15 0.00 1.12 5.41 -1.26 -2.95 119.36 131.89 1lc2 n ILE 81 Ca 0.44 -2.17 0.00 0.00 1.00 0.00 0.00 62.75 62.02 1lc2 n ILE 81 Cb 0.47 -2.22 0.00 0.00 -0.71 0.00 0.00 39.64 37.17 1lc2 n ILE 81 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 1lc2 n PHE 82 N 12.42 -0.11 0.00 1.39 7.35 -1.26 -5.16 117.46 132.09 1lc2 n PHE 82 Ca 0.46 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.15 1lc2 n PHE 82 Cb 0.45 0.02 0.00 0.00 0.35 0.00 0.00 39.48 40.30 1lc2 n PHE 82 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1lc2 n ALA 83 N -1.36 0.00 -1.28 3.13 0.00 -1.15 -4.89 120.51 114.96 1lc2 n ALA 83 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1lc2 n ALA 83 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.56 1lc2 n ALA 83 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1lc2 s GLY 84 N 0.00 1.64 0.00 0.00 0.00 -0.88 -4.64 107.32 103.44 1lc2 s GLY 84 Ca 0.00 0.05 0.20 0.00 0.00 0.00 0.00 44.72 44.97 1lc2 s GLY 84 CO 0.00 0.47 1.73 4.51 0.00 0.00 0.00 173.10 179.81 1lc2 n ILE 85 N -3.66 0.02 -0.59 0.90 0.13 -1.26 -4.89 119.36 110.00 1lc2 n ILE 85 Ca 0.08 -0.03 0.00 0.00 -1.10 0.00 0.00 62.75 61.70 1lc2 n ILE 85 Cb 0.54 -0.25 0.00 0.00 -0.84 0.00 0.00 39.64 39.10 1lc2 n ILE 85 CO 0.00 0.00 0.00 0.29 2.80 0.00 0.00 176.55 179.64 1lc2 n LYS 86 N -0.71 -0.11 0.00 9.51 5.02 -1.26 -4.63 118.16 125.97 1lc2 n LYS 86 Ca 0.15 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1lc2 n LYS 86 Cb 0.09 -4.29 0.00 0.00 -0.02 0.00 0.00 35.03 30.81 1lc2 n LYS 86 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1lc2 n LYS 87 N -1.84 0.00 0.00 1.97 5.02 -1.26 -5.16 118.16 116.89 1lc2 n LYS 87 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1lc2 n LYS 87 Cb 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.04 1lc2 n LYS 87 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1lc2 n LYS 88 N 0.00 0.00 -0.02 1.97 4.81 -1.26 -4.84 118.16 118.82 1lc2 n LYS 88 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 1lc2 n LYS 88 Cb 0.00 0.00 0.35 0.00 0.02 0.00 0.00 35.03 35.40 1lc2 n LYS 88 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1lc2 h THR 89 N 0.00 1.15 0.00 3.15 2.02 -2.01 -0.09 112.91 117.14 1lc2 h THR 89 Ca 0.00 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.71 1lc2 h THR 89 Cb 0.00 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 1lc2 h THR 89 CO 0.00 0.18 0.00 -1.84 0.37 0.00 0.00 175.52 174.23 1lc2 n GLU 90 N -4.38 0.43 0.14 6.66 0.00 -1.26 -1.55 120.64 120.67 1lc2 n GLU 90 Ca 0.03 0.05 -0.09 0.00 0.00 0.00 0.00 57.16 57.15 1lc2 n GLU 90 Cb 0.14 -1.50 -0.05 0.00 0.00 0.00 0.00 31.44 30.03 1lc2 n GLU 90 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 1lc2 h ARG 91 N 0.00 -0.41 0.00 3.44 9.65 -1.33 -3.33 114.38 122.40 1lc2 h ARG 91 Ca 0.00 0.03 -0.16 0.00 -1.10 0.00 0.00 59.98 58.75 1lc2 h ARG 91 Cb 0.17 0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.82 1lc2 h ARG 91 CO 0.00 -0.16 -0.76 1.05 2.80 0.00 0.00 179.97 182.90 1lc2 h GLU 92 N -1.05 0.00 -0.54 0.20 4.11 -1.58 -3.18 114.58 112.54 1lc2 h GLU 92 Ca -0.04 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.33 1lc2 h GLU 92 Cb 0.44 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1lc2 h GLU 92 CO 0.07 0.76 0.10 0.38 0.07 0.00 0.00 179.01 180.38 1lc2 h ASP 93 N 0.00 0.85 -0.36 3.06 3.04 -1.47 0.11 116.42 121.64 1lc2 h ASP 93 Ca -0.01 -0.25 0.05 0.00 -3.24 0.00 0.00 57.03 53.58 1lc2 h ASP 93 Cb 1.36 -0.22 -0.05 0.00 -1.04 0.00 0.00 39.33 39.38 1lc2 h ASP 93 CO 0.10 0.89 0.06 -0.07 -2.04 0.00 0.00 179.24 178.18 1lc2 h LEU 94 N 0.77 -0.00 -0.17 0.15 4.07 -1.67 0.19 115.31 118.64 1lc2 h LEU 94 Ca 0.16 0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.18 1lc2 h LEU 94 Cb 0.39 0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 1lc2 h LEU 94 CO 0.01 0.04 0.09 0.40 -1.08 0.00 0.00 178.44 177.90 1lc2 h ILE 95 N 0.18 1.10 -0.69 1.22 1.08 -1.49 0.71 117.51 119.62 1lc2 h ILE 95 Ca 0.17 -0.28 0.03 0.00 -0.39 0.00 0.00 64.86 64.39 1lc2 h ILE 95 Cb 0.20 0.97 -0.04 0.00 -3.07 0.00 0.00 36.82 34.88 1lc2 h ILE 95 CO -0.23 0.10 0.44 0.00 -0.69 0.00 0.00 178.15 177.77 1lc2 h ALA 96 N 0.99 0.90 0.79 1.87 0.00 -0.39 0.10 119.26 123.52 1lc2 h ALA 96 Ca 0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1lc2 h ALA 96 Cb 0.07 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.63 1lc2 h ALA 96 CO -0.01 0.23 -0.38 -0.92 0.00 0.00 0.00 179.25 178.17 1lc2 h TYR 97 N 0.87 -0.99 -0.82 0.00 3.20 -0.52 -3.12 116.97 115.58 1lc2 h TYR 97 Ca 0.27 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.09 1lc2 h TYR 97 Cb -0.01 0.33 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 1lc2 h TYR 97 CO -0.04 -0.62 0.38 -0.07 -1.64 0.00 0.00 178.16 176.17 1lc2 h LEU 98 N -1.10 1.09 -1.36 2.82 3.38 -0.70 0.11 115.31 119.55 1lc2 h LEU 98 Ca -0.11 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1lc2 h LEU 98 Cb 0.82 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1lc2 h LEU 98 CO 0.18 0.93 0.00 0.50 0.09 0.00 0.00 178.44 180.14 1lc2 h LYS 99 N 1.18 0.00 0.00 1.13 3.11 -0.88 0.18 116.57 121.28 1lc2 h LYS 99 Ca 0.28 0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 58.09 1lc2 h LYS 99 Cb 0.14 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.37 1lc2 h LYS 99 CO -0.03 0.00 -0.57 0.87 -2.81 0.00 0.00 179.45 176.91 1lc2 h LYS 100 N 0.00 0.00 0.00 1.90 1.79 -1.34 -3.42 116.57 115.50 1lc2 h LYS 100 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1lc2 h LYS 100 Cb 0.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1lc2 h LYS 100 CO 0.00 0.16 0.08 0.00 -1.08 0.00 0.00 179.45 178.61 1lc2 h ALA 101 N -0.92 1.08 0.00 3.86 0.00 0.08 0.44 119.26 123.80 1lc2 h ALA 101 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1lc2 h ALA 101 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1lc2 h ALA 101 CO -0.03 -0.08 0.00 0.25 0.00 0.00 0.00 179.25 179.39 1lc2 n THR 102 N -2.89 1.29 -0.31 0.00 -2.24 0.54 -4.26 114.28 106.41 1lc2 n THR 102 Ca -0.03 0.38 0.00 0.00 -2.27 0.00 0.00 64.05 62.14 1lc2 n THR 102 Cb 0.14 -1.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.10 1lc2 n THR 102 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1lc2 n ASN 103 N -1.70 0.00 0.00 3.42 6.94 0.86 -4.48 115.26 120.31 1lc2 n ASN 103 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.58 1lc2 n ASN 103 Cb 0.11 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 1lc2 n ASN 103 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44