#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lc3 s VAL 17 N 0.00 5.20 -1.20 2.52 1.01 0.20 -4.11 120.40 124.02 3lc3 s VAL 17 Ca 0.00 0.88 -0.02 0.00 0.00 0.00 0.00 61.98 62.84 3lc3 s VAL 17 Cb 0.00 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.60 3lc3 s VAL 17 CO 0.00 0.35 0.23 0.61 0.00 0.00 0.00 175.10 176.29 3lc3 n GLY 18 N 3.19 -0.22 0.00 4.51 0.00 -1.26 -1.60 105.19 109.81 3lc3 n GLY 18 Ca -0.08 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.75 3lc3 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lc3 n GLY 19 N -1.17 2.17 3.14 -0.02 0.00 -1.26 -4.84 105.19 103.22 3lc3 n GLY 19 Ca -0.13 -2.00 -0.14 0.00 0.00 0.00 0.00 46.02 43.75 3lc3 n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3lc3 s GLU 20 N 3.19 0.75 0.17 1.61 2.02 -0.64 -4.92 118.70 120.88 3lc3 s GLU 20 Ca 0.00 -1.04 -0.32 0.00 0.02 0.00 0.00 54.97 53.63 3lc3 s GLU 20 Cb 0.00 -0.46 -0.12 0.00 0.10 0.00 0.00 34.13 33.65 3lc3 s GLU 20 CO 0.00 0.07 1.76 -0.25 0.02 0.00 0.00 175.26 176.87 3lc3 n ASP 21 N 0.84 3.97 -4.77 -0.19 8.00 -1.26 -1.07 116.55 122.07 3lc3 n ASP 21 Ca -0.18 1.03 -0.33 0.00 0.71 0.00 0.00 54.79 56.03 3lc3 n ASP 21 Cb 0.57 -1.55 0.06 0.00 -0.02 0.00 0.00 41.12 40.17 3lc3 n ASP 21 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3lc3 s ALA 22 N 1.76 2.40 0.40 2.24 0.00 0.78 -4.86 121.76 124.48 3lc3 s ALA 22 Ca 0.78 0.50 -0.15 0.00 0.00 0.00 0.00 51.96 53.10 3lc3 s ALA 22 Cb -0.51 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.21 3lc3 s ALA 22 CO 0.35 -1.42 0.83 0.15 0.00 0.00 0.00 175.76 175.66 3lc3 s LYS 23 N -4.26 3.95 0.22 0.00 1.02 -1.26 -4.85 119.74 114.57 3lc3 s LYS 23 Ca 0.66 0.72 -0.31 0.00 0.02 0.00 0.00 55.97 57.06 3lc3 s LYS 23 Cb -0.20 -2.33 -0.15 0.00 -0.52 0.00 0.00 37.83 34.64 3lc3 s LYS 23 CO 0.45 -0.02 1.20 -2.30 -0.92 0.00 0.00 175.35 173.76 3lc3 n PRO 24 N -0.95 1.48 -0.98 -1.68 -0.02 -1.26 -1.90 135.00 129.69 3lc3 n PRO 24 Ca 0.04 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3lc3 n PRO 24 Cb 0.54 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 3lc3 n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3lc3 n GLY 25 N 1.82 0.42 0.10 -1.23 0.00 -1.26 -4.87 105.19 100.16 3lc3 n GLY 25 Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 3lc3 n GLY 25 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3lc3 h GLN 26 N 0.94 0.09 -2.11 1.61 4.15 -1.74 -3.35 115.11 114.71 3lc3 h GLN 26 Ca 0.00 -0.12 -0.58 0.00 0.77 0.00 0.00 58.65 58.72 3lc3 h GLN 26 Cb 0.23 0.04 -0.41 0.00 0.21 0.00 0.00 27.48 27.56 3lc3 h GLN 26 CO 0.00 0.96 -0.84 1.19 -1.93 0.00 0.00 178.83 178.21 3lc3 n PHE 27 N -3.53 1.69 0.58 3.99 3.01 -1.26 -4.97 117.46 116.98 3lc3 n PHE 27 Ca -0.02 -3.87 0.07 0.00 1.01 0.00 0.00 57.45 54.64 3lc3 n PHE 27 Cb 0.86 -0.45 0.33 0.00 -0.01 0.00 0.00 39.48 40.21 3lc3 n PHE 27 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 3lc3 n PRO 28 N 1.14 0.12 0.00 -1.08 -0.04 -1.26 -1.25 135.00 132.64 3lc3 n PRO 28 Ca 0.26 0.20 0.12 0.00 -0.04 0.00 0.00 63.50 64.04 3lc3 n PRO 28 Cb 0.47 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.74 3lc3 n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3lc3 n TRP 29 N -1.37 0.01 -2.43 0.54 2.14 -1.02 -1.35 117.44 113.97 3lc3 n TRP 29 Ca 0.05 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.21 3lc3 n TRP 29 Cb 0.13 -0.30 -0.03 0.00 -0.81 0.00 0.00 31.31 30.30 3lc3 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 3lc3 s GLN 30 N -3.00 4.50 0.26 -2.67 2.00 -0.38 -0.66 119.66 119.71 3lc3 s GLN 30 Ca 0.11 1.79 0.10 0.00 -2.00 0.00 0.00 55.36 55.36 3lc3 s GLN 30 Cb 0.18 -3.29 -0.05 0.00 0.80 0.00 0.00 33.01 30.65 3lc3 s GLN 30 CO 0.67 -0.09 -0.16 0.14 -0.50 0.00 0.00 175.29 175.35 3lc3 s VAL 31 N 0.25 2.09 0.02 1.34 -7.23 -0.43 -4.35 120.40 112.09 3lc3 s VAL 31 Ca 0.54 -2.29 0.05 0.00 -1.81 0.00 0.00 61.98 58.47 3lc3 s VAL 31 Cb -0.31 -2.25 -0.03 0.00 0.56 0.00 0.00 36.38 34.36 3lc3 s VAL 31 CO 0.34 -0.45 -0.13 0.54 -0.31 0.00 0.00 175.10 175.09 3lc3 s VAL 32 N -2.75 3.16 -0.16 1.32 0.11 -0.71 -2.16 120.40 119.22 3lc3 s VAL 32 Ca 0.27 -0.98 -0.07 0.00 -2.93 0.00 0.00 61.98 58.28 3lc3 s VAL 32 Cb -0.02 -2.34 -0.04 0.00 -1.53 0.00 0.00 36.38 32.45 3lc3 s VAL 32 CO 0.12 0.38 0.07 -0.76 -3.33 0.00 0.00 175.10 171.57 3lc3 s LEU 33 N -1.37 3.88 0.05 2.54 1.43 -0.43 -1.32 118.68 123.44 3lc3 s LEU 33 Ca 0.15 0.16 0.06 0.00 -1.03 0.00 0.00 54.13 53.47 3lc3 s LEU 33 Cb -0.11 -1.96 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 3lc3 s LEU 33 CO 0.06 0.24 -0.18 0.20 0.23 0.00 0.00 176.35 176.91 3lc3 s ASN 34 N -0.06 2.13 0.00 2.29 0.01 0.22 -2.07 114.94 117.47 3lc3 s ASN 34 Ca 0.07 -0.52 0.00 0.00 -0.71 0.00 0.00 52.86 51.70 3lc3 s ASN 34 Cb -0.12 -0.15 0.00 0.00 0.41 0.00 0.00 41.25 41.39 3lc3 s ASN 34 CO 0.01 0.09 0.00 0.61 -1.51 0.00 0.00 177.10 176.30 3lc3 n GLY 35 N 1.76 2.00 0.30 0.66 0.00 -1.26 -0.34 105.19 108.31 3lc3 n GLY 35 Ca -0.18 0.24 0.16 0.00 0.00 0.00 0.00 46.02 46.25 3lc3 n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3lc3 h LYS 36 N 0.00 0.00 -5.33 1.61 1.57 -1.83 -3.40 116.57 109.19 3lc3 h LYS 36 Ca 0.00 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.38 3lc3 h LYS 36 Cb 0.00 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.13 3lc3 h LYS 36 CO 0.00 0.01 -0.75 0.08 -0.57 0.00 0.00 179.45 178.22 3lc3 s VAL 38 N -4.51 1.27 0.21 0.50 1.01 -1.26 -5.17 120.40 112.46 3lc3 s VAL 38 Ca -0.05 -1.73 -0.06 0.00 0.00 0.00 0.00 61.98 60.14 3lc3 s VAL 38 Cb 0.15 -1.53 -0.06 0.00 0.00 0.00 0.00 36.38 34.93 3lc3 s VAL 38 CO 0.53 -0.46 0.48 -1.81 0.00 0.00 0.00 175.10 173.84 3lc3 s ASP 39 N -2.51 6.52 -1.38 3.32 -0.00 -1.26 -4.42 116.67 116.94 3lc3 s ASP 39 Ca 0.09 0.73 -0.03 0.00 -0.00 0.00 0.00 52.55 53.35 3lc3 s ASP 39 Cb -0.04 -2.15 0.00 0.00 -0.00 0.00 0.00 42.92 40.73 3lc3 s ASP 39 CO 0.03 -0.06 0.44 0.00 -0.00 0.00 0.00 175.17 175.57 3lc3 n ALA 40 N -0.28 -2.08 0.65 5.23 0.00 -1.00 -4.87 120.51 118.17 3lc3 n ALA 40 Ca -0.01 -0.28 0.12 0.00 0.00 0.00 0.00 53.44 53.26 3lc3 n ALA 40 Cb 0.53 -1.70 0.17 0.00 0.00 0.00 0.00 19.45 18.44 3lc3 n ALA 40 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 3lc3 n PHE 41 N -4.41 0.41 -3.59 0.00 -1.74 -0.88 -4.86 117.46 102.39 3lc3 n PHE 41 Ca -0.29 0.12 -0.07 0.00 -0.56 0.00 0.00 57.45 56.65 3lc3 n PHE 41 Cb 0.68 -0.55 -0.02 0.00 1.52 0.00 0.00 39.48 41.10 3lc3 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3lc3 n GLY 43 N -0.35 2.58 3.84 0.00 0.00 0.11 -1.32 105.19 110.05 3lc3 n GLY 43 Ca -0.09 -2.25 -0.03 0.00 0.00 0.00 0.00 46.02 43.65 3lc3 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3lc3 s GLY 44 N -3.63 0.02 0.01 -0.02 0.00 -0.92 -3.56 107.32 99.22 3lc3 s GLY 44 Ca 0.29 -0.21 0.04 0.00 0.00 0.00 0.00 44.72 44.84 3lc3 s GLY 44 CO 0.18 1.55 -0.12 -0.56 0.00 0.00 0.00 173.10 174.16 3lc3 s SER 45 N -3.25 1.35 -0.24 1.64 0.01 0.04 -1.32 113.70 111.94 3lc3 s SER 45 Ca 0.19 -0.32 -0.29 0.00 1.31 0.00 0.00 55.95 56.84 3lc3 s SER 45 Cb -0.02 -0.11 -0.00 0.00 0.21 0.00 0.00 66.02 66.10 3lc3 s SER 45 CO 0.05 0.06 1.20 -0.63 0.41 0.00 0.00 173.24 174.33 3lc3 s ILE 46 N -0.56 4.36 -0.06 1.44 1.01 0.17 -0.88 121.20 126.68 3lc3 s ILE 46 Ca 0.02 1.60 -0.21 0.00 0.00 0.00 0.00 60.65 62.06 3lc3 s ILE 46 Cb -0.06 -4.17 -0.31 0.00 0.01 0.00 0.00 42.46 37.94 3lc3 s ILE 46 CO 0.00 -0.29 0.83 0.58 0.00 0.00 0.00 174.94 176.07 3lc3 h VAL 47 N 5.65 1.45 -2.07 2.92 2.07 -0.83 -1.56 116.25 123.87 3lc3 h VAL 47 Ca -0.24 -2.51 -0.00 0.00 0.82 0.00 0.00 66.70 64.77 3lc3 h VAL 47 Cb 1.09 3.13 0.00 0.00 -1.52 0.00 0.00 31.29 33.99 3lc3 h VAL 47 CO 1.00 0.71 0.03 -0.46 0.02 0.00 0.00 177.57 178.86 3lc3 n ASN 48 N -4.12 -0.21 0.30 0.57 0.23 -1.08 -4.66 115.26 106.30 3lc3 n ASN 48 Ca -0.16 -1.14 0.19 0.00 -0.53 0.00 0.00 54.58 52.94 3lc3 n ASN 48 Cb 0.82 0.35 1.03 0.00 -2.08 0.00 0.00 39.78 39.90 3lc3 n ASN 48 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3lc3 h GLU 49 N 0.00 0.00 -0.00 -3.83 4.11 -1.96 -2.85 114.58 110.05 3lc3 h GLU 49 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 3lc3 h GLU 49 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3lc3 h GLU 49 CO 0.04 0.00 -0.38 1.63 0.07 0.00 0.00 179.01 180.37 3lc3 n LYS 50 N -3.47 3.62 -4.49 1.06 4.76 -1.26 -1.09 118.16 117.29 3lc3 n LYS 50 Ca -0.02 -0.12 -0.23 0.00 -2.87 0.00 0.00 58.31 55.06 3lc3 n LYS 50 Cb 0.13 -0.96 -0.16 0.00 -1.84 0.00 0.00 35.03 32.20 3lc3 n LYS 50 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 3lc3 s TRP 51 N -1.74 1.26 -0.07 2.13 0.52 -1.08 -0.65 118.94 119.30 3lc3 s TRP 51 Ca 0.04 -0.42 0.02 0.00 0.02 0.00 0.00 56.10 55.76 3lc3 s TRP 51 Cb 0.07 -0.93 -0.03 0.00 -1.15 0.00 0.00 33.47 31.43 3lc3 s TRP 51 CO 0.35 -0.22 -0.11 0.42 0.02 0.00 0.00 176.95 177.40 3lc3 s ILE 52 N 0.60 3.32 -0.14 2.03 -1.09 -0.26 -0.12 121.20 125.54 3lc3 s ILE 52 Ca -0.12 -0.62 -0.05 0.00 -2.23 0.00 0.00 60.65 57.64 3lc3 s ILE 52 Cb -0.14 -2.34 -0.04 0.00 -1.58 0.00 0.00 42.46 38.36 3lc3 s ILE 52 CO 0.02 0.58 0.03 0.54 -1.23 0.00 0.00 174.94 174.89 3lc3 s VAL 53 N -0.59 4.54 0.00 2.92 0.11 -0.06 -0.31 120.40 127.00 3lc3 s VAL 53 Ca 0.09 -0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.00 3lc3 s VAL 53 Cb -0.11 -2.99 0.00 0.00 -1.53 0.00 0.00 36.38 31.75 3lc3 s VAL 53 CO 0.01 0.53 0.00 1.07 -3.33 0.00 0.00 175.10 173.38 3lc3 n THR 54 N 2.94 0.00 -3.37 5.04 5.66 0.10 -0.78 114.28 123.87 3lc3 n THR 54 Ca -0.18 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.44 3lc3 n THR 54 Cb 0.53 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.25 3lc3 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3lc3 s ALA 55 N -1.71 3.60 0.28 1.79 0.00 -1.26 -1.20 121.76 123.27 3lc3 s ALA 55 Ca 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.83 3lc3 s ALA 55 Cb 0.00 -2.54 0.46 0.00 0.00 0.00 0.00 23.12 21.04 3lc3 s ALA 55 CO 0.00 0.33 1.91 0.00 0.00 0.00 0.00 175.76 178.00 3lc3 h ALA 56 N 5.15 1.45 0.00 0.00 0.00 -1.70 -2.16 119.26 121.99 3lc3 h ALA 56 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3lc3 h ALA 56 Cb 1.21 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3lc3 h ALA 56 CO 0.66 0.43 0.00 1.12 0.00 0.00 0.00 179.25 181.45 3lc3 h HIS 57 N 1.12 0.00 0.00 0.00 2.07 -1.93 -1.86 115.15 114.56 3lc3 h HIS 57 Ca 0.40 0.00 -0.07 0.00 -2.85 0.00 0.00 60.37 57.84 3lc3 h HIS 57 Cb 0.14 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.11 3lc3 h HIS 57 CO -0.00 0.00 -0.36 0.00 -3.07 0.00 0.00 177.93 174.50 3lc3 n VAL 59 N -3.56 1.16 0.13 0.00 0.24 -0.71 -4.73 118.33 110.86 3lc3 n VAL 59 Ca -0.00 -2.34 0.14 0.00 -2.04 0.00 0.00 64.34 60.10 3lc3 n VAL 59 Cb 0.49 0.42 0.67 0.00 -1.47 0.00 0.00 33.84 33.95 3lc3 n VAL 59 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 3lc3 h GLU 60 N 1.36 0.00 -6.39 7.34 5.08 -1.72 -3.40 114.58 116.84 3lc3 h GLU 60 Ca -0.08 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.66 3lc3 h GLU 60 Cb 1.48 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.59 3lc3 h GLU 60 CO 0.15 0.00 -0.73 0.95 -1.00 0.00 0.00 179.01 178.38 3lc3 s THR 60 N -5.04 2.95 -0.06 1.13 -4.23 -1.26 -5.06 115.64 104.07 3lc3 s THR 60 Ca -0.05 -1.91 0.08 0.00 -1.18 0.00 0.00 61.69 58.63 3lc3 s THR 60 Cb 0.18 -2.49 0.13 0.00 1.34 0.00 0.00 72.50 71.66 3lc3 s THR 60 CO 0.70 -0.21 1.01 0.61 -0.54 0.00 0.00 174.62 176.19 3lc3 n GLY 61 N -0.21 2.72 3.71 3.99 0.00 -1.26 -4.97 105.19 109.16 3lc3 n GLY 61 Ca -0.09 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 3lc3 n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3lc3 s VAL 62 N -1.54 3.52 -1.55 1.61 1.01 -1.26 -3.10 120.40 119.10 3lc3 s VAL 62 Ca 0.14 1.06 -0.18 0.00 0.00 0.00 0.00 61.98 63.00 3lc3 s VAL 62 Cb 0.12 -3.68 0.17 0.00 0.00 0.00 0.00 36.38 32.99 3lc3 s VAL 62 CO 0.01 0.06 0.58 1.17 0.00 0.00 0.00 175.10 176.92 3lc3 n LYS 63 N 4.32 -2.04 -2.46 2.72 4.81 -1.26 -4.54 118.16 119.71 3lc3 n LYS 63 Ca 0.12 0.24 -0.42 0.00 -0.87 0.00 0.00 58.31 57.37 3lc3 n LYS 63 Cb 0.43 -4.87 -0.03 0.00 0.02 0.00 0.00 35.03 30.58 3lc3 n LYS 63 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 3lc3 s ILE 64 N -3.08 4.23 0.13 3.15 2.07 -1.18 -4.28 121.20 122.24 3lc3 s ILE 64 Ca 0.66 1.57 0.08 0.00 -1.41 0.00 0.00 60.65 61.56 3lc3 s ILE 64 Cb -0.38 -4.01 -0.04 0.00 0.13 0.00 0.00 42.46 38.17 3lc3 s ILE 64 CO 0.82 0.04 -0.19 0.28 -1.91 0.00 0.00 174.94 173.98 3lc3 s THR 65 N 1.85 1.69 -0.08 4.00 -1.32 0.54 -3.21 115.64 119.10 3lc3 s THR 65 Ca 0.56 -1.70 0.03 0.00 -1.21 0.00 0.00 61.69 59.37 3lc3 s THR 65 Cb -0.26 -1.65 -0.02 0.00 -1.51 0.00 0.00 72.50 69.07 3lc3 s THR 65 CO 0.24 -0.21 -0.16 -0.69 -2.21 0.00 0.00 174.62 171.59 3lc3 s VAL 66 N -1.63 2.85 -0.20 5.08 1.01 -0.12 -0.61 120.40 126.78 3lc3 s VAL 66 Ca 0.10 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.32 3lc3 s VAL 66 Cb -0.08 -2.13 0.03 0.00 0.00 0.00 0.00 36.38 34.21 3lc3 s VAL 66 CO 0.05 0.57 -0.17 -0.69 0.00 0.00 0.00 175.10 174.85 3lc3 s VAL 67 N -0.27 2.11 0.46 2.92 1.01 -0.44 -0.51 120.40 125.68 3lc3 s VAL 67 Ca 0.01 -1.15 0.03 0.00 0.00 0.00 0.00 61.98 60.87 3lc3 s VAL 67 Cb -0.13 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.26 3lc3 s VAL 67 CO 0.03 0.36 0.66 0.00 0.00 0.00 0.00 175.10 176.15 3lc3 s ALA 68 N 1.23 3.99 -1.89 5.51 0.00 -0.21 -1.74 121.76 128.65 3lc3 s ALA 68 Ca 0.01 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.67 3lc3 s ALA 68 Cb -0.15 -1.97 0.00 0.00 0.00 0.00 0.00 23.12 21.00 3lc3 s ALA 68 CO -0.10 -0.43 0.00 0.41 0.00 0.00 0.00 175.76 175.63 3lc3 n GLY 69 N -2.07 0.31 3.86 0.00 0.00 -1.25 -0.67 105.19 105.36 3lc3 n GLY 69 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 3lc3 n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3lc3 s GLU 70 N -4.61 3.86 0.20 1.61 2.56 -1.26 -3.37 118.70 117.69 3lc3 s GLU 70 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 54.97 55.30 3lc3 s GLU 70 Cb 0.00 -2.93 0.00 0.00 2.00 0.00 0.00 34.13 33.20 3lc3 s GLU 70 CO 0.00 0.50 0.00 1.58 -0.56 0.00 0.00 175.26 176.78 3lc3 n HIS 71 N 0.74 -1.61 -3.90 5.30 -0.00 -1.26 -4.95 115.22 109.54 3lc3 n HIS 71 Ca -0.06 0.28 -0.35 0.00 -0.00 0.00 0.00 57.72 57.60 3lc3 n HIS 71 Cb 0.52 0.45 -0.14 0.00 -0.00 0.00 0.00 29.99 30.82 3lc3 n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 3lc3 s ASN 72 N -5.01 4.36 0.39 0.26 3.84 -1.26 -1.53 114.94 115.98 3lc3 s ASN 72 Ca 0.00 -0.42 0.28 0.00 0.21 0.00 0.00 52.86 52.92 3lc3 s ASN 72 Cb 0.00 -1.75 0.98 0.00 -0.55 0.00 0.00 41.25 39.93 3lc3 s ASN 72 CO 0.00 -0.03 1.81 -0.29 -2.79 0.00 0.00 177.10 175.79 3lc3 h ILE 73 N 5.73 0.00 -0.06 -5.21 6.09 -1.37 -2.85 117.51 119.85 3lc3 h ILE 73 Ca -0.41 -0.52 0.00 0.00 -1.37 0.00 0.00 64.86 62.57 3lc3 h ILE 73 Cb 1.16 1.44 0.00 0.00 0.47 0.00 0.00 36.82 39.89 3lc3 h ILE 73 CO 0.60 0.00 0.00 -1.84 -3.07 0.00 0.00 178.15 173.84 3lc3 n GLU 74 N -2.72 1.35 -4.52 2.19 0.28 -1.26 -4.98 120.64 110.97 3lc3 n GLU 74 Ca 0.02 -1.52 -0.25 0.00 -0.16 0.00 0.00 57.16 55.26 3lc3 n GLU 74 Cb 0.35 -1.31 -0.11 0.00 1.43 0.00 0.00 31.44 31.80 3lc3 n GLU 74 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 3lc3 s GLU 75 N -1.30 1.77 -0.22 3.44 2.02 -1.08 -5.13 118.70 118.20 3lc3 s GLU 75 Ca 0.20 -1.95 -0.08 0.00 0.02 0.00 0.00 54.97 53.16 3lc3 s GLU 75 Cb 0.14 -1.40 -0.04 0.00 0.10 0.00 0.00 34.13 32.93 3lc3 s GLU 75 CO 0.20 -0.00 0.08 0.99 0.02 0.00 0.00 175.26 176.55 3lc3 s THR 76 N -2.86 4.64 -0.27 3.63 2.01 -1.26 -4.76 115.64 116.76 3lc3 s THR 76 Ca 0.33 -0.07 0.19 0.00 0.31 0.00 0.00 61.69 62.45 3lc3 s THR 76 Cb 0.06 -3.14 -0.27 0.00 0.01 0.00 0.00 72.50 69.16 3lc3 s THR 76 CO 0.16 0.38 0.53 -0.62 -0.69 0.00 0.00 174.62 174.38 3lc3 n GLU 77 N 4.30 0.65 -1.27 4.92 4.71 -1.26 -4.99 120.64 127.70 3lc3 n GLU 77 Ca -0.16 -0.13 -0.09 0.00 -0.01 0.00 0.00 57.16 56.77 3lc3 n GLU 77 Cb 0.52 -1.44 -0.04 0.00 -1.01 0.00 0.00 31.44 29.47 3lc3 n GLU 77 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 3lc3 n HIS 78 N -1.96 0.00 0.72 -0.32 8.25 -1.26 -4.85 115.22 115.80 3lc3 n HIS 78 Ca -0.02 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.52 3lc3 n HIS 78 Cb 0.44 -2.24 -0.07 0.00 1.12 0.00 0.00 29.99 29.24 3lc3 n HIS 78 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3lc3 n THR 79 N -2.41 0.00 -2.41 1.59 -2.24 -1.26 -5.02 114.28 102.53 3lc3 n THR 79 Ca -0.09 -0.18 -0.41 0.00 -2.27 0.00 0.00 64.05 61.09 3lc3 n THR 79 Cb 0.46 1.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.70 3lc3 n THR 79 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3lc3 s GLU 80 N -2.33 4.50 -0.20 -0.78 8.01 -1.22 -4.30 118.70 122.38 3lc3 s GLU 80 Ca 0.08 1.82 0.01 0.00 0.01 0.00 0.00 54.97 56.89 3lc3 s GLU 80 Cb 0.12 -3.27 0.04 0.00 -4.31 0.00 0.00 34.13 26.71 3lc3 s GLU 80 CO 0.58 -0.10 -0.13 -0.65 0.01 0.00 0.00 175.26 174.97 3lc3 s GLN 81 N 0.02 2.36 -0.13 1.61 -0.21 0.15 -4.97 119.66 118.49 3lc3 s GLN 81 Ca 0.53 -0.93 -0.09 0.00 0.02 0.00 0.00 55.36 54.89 3lc3 s GLN 81 Cb -0.31 -2.54 -0.04 0.00 1.00 0.00 0.00 33.01 31.11 3lc3 s GLN 81 CO 0.35 -0.39 0.18 0.15 -2.12 0.00 0.00 175.29 173.46 3lc3 s LYS 82 N 1.31 3.76 0.05 2.91 1.02 -1.26 -1.04 119.74 126.49 3lc3 s LYS 82 Ca -0.01 -0.08 0.02 0.00 0.02 0.00 0.00 55.97 55.92 3lc3 s LYS 82 Cb -0.16 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 33.84 3lc3 s LYS 82 CO -0.09 0.59 -0.06 1.03 -0.92 0.00 0.00 175.35 175.90 3lc3 s ARG 83 N -0.52 0.58 0.34 1.68 1.81 0.33 -5.00 118.95 118.17 3lc3 s ARG 83 Ca 0.14 -0.92 -0.10 0.00 -1.72 0.00 0.00 55.73 53.13 3lc3 s ARG 83 Cb -0.12 -0.18 -0.07 0.00 -0.45 0.00 0.00 34.95 34.13 3lc3 s ARG 83 CO 0.03 0.01 0.68 -0.80 -0.68 0.00 0.00 175.30 174.54 3lc3 s ASN 84 N -2.04 6.56 -0.27 0.23 0.01 -1.26 -0.94 114.94 117.23 3lc3 s ASN 84 Ca -0.04 1.03 -0.10 0.00 -0.71 0.00 0.00 52.86 53.04 3lc3 s ASN 84 Cb -0.05 -2.28 -0.05 0.00 0.41 0.00 0.00 41.25 39.29 3lc3 s ASN 84 CO -0.02 -0.27 0.17 -0.69 -1.51 0.00 0.00 177.10 174.78 3lc3 s VAL 85 N -2.15 5.21 -0.55 1.60 1.01 -1.20 -0.66 120.40 123.66 3lc3 s VAL 85 Ca 0.49 0.13 0.20 0.00 0.00 0.00 0.00 61.98 62.81 3lc3 s VAL 85 Cb -0.10 -3.47 -0.26 0.00 0.00 0.00 0.00 36.38 32.55 3lc3 s VAL 85 CO 0.27 0.28 0.68 2.30 0.00 0.00 0.00 175.10 178.63 3lc3 n ILE 86 N 4.87 0.00 -3.70 2.22 -5.35 0.28 -4.91 119.36 112.77 3lc3 n ILE 86 Ca -0.14 -0.21 -0.11 0.00 -0.27 0.00 0.00 62.75 62.01 3lc3 n ILE 86 Cb 0.52 0.59 -0.10 0.00 -1.74 0.00 0.00 39.64 38.91 3lc3 n ILE 86 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 3lc3 s ARG 87 N -3.10 0.44 -0.13 6.28 3.52 -1.20 -4.99 118.95 119.76 3lc3 s ARG 87 Ca 0.01 0.75 0.02 0.00 -0.13 0.00 0.00 55.73 56.38 3lc3 s ARG 87 Cb 0.14 0.06 0.01 0.00 -1.56 0.00 0.00 34.95 33.60 3lc3 s ARG 87 CO 0.83 -0.13 -0.20 0.42 -0.81 0.00 0.00 175.30 175.41 3lc3 s ILE 88 N 1.07 1.89 -0.39 4.11 1.01 -1.26 -0.66 121.20 126.97 3lc3 s ILE 88 Ca -0.07 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 59.75 3lc3 s ILE 88 Cb -0.07 -1.69 0.11 0.00 0.01 0.00 0.00 42.46 40.82 3lc3 s ILE 88 CO -0.09 0.52 0.11 -0.63 0.00 0.00 0.00 174.94 174.84 3lc3 s ILE 89 N 0.92 2.33 0.45 2.92 1.01 0.64 -4.97 121.20 124.50 3lc3 s ILE 89 Ca -0.06 -2.59 -0.23 0.00 0.00 0.00 0.00 60.65 57.77 3lc3 s ILE 89 Cb -0.15 -2.70 -0.08 0.00 0.01 0.00 0.00 42.46 39.54 3lc3 s ILE 89 CO -0.03 -0.66 1.12 -2.16 0.00 0.00 0.00 174.94 173.22 3lc3 s PRO 90 N 0.59 3.84 0.22 2.79 0.04 -1.26 -0.95 135.00 140.27 3lc3 s PRO 90 Ca 0.13 1.67 -0.31 0.00 0.04 0.00 0.00 61.00 62.52 3lc3 s PRO 90 Cb -0.21 -2.39 -0.14 0.00 0.04 0.00 0.00 34.50 31.79 3lc3 s PRO 90 CO -0.06 -0.46 1.22 1.58 0.04 0.00 0.00 177.00 179.33 3lc3 n HIS 91 N -0.47 1.62 0.27 0.56 -0.00 -0.23 -4.84 115.22 112.15 3lc3 n HIS 91 Ca 0.07 0.59 0.18 0.00 -0.00 0.00 0.00 57.72 58.56 3lc3 n HIS 91 Cb 0.49 -2.34 0.94 0.00 -0.00 0.00 0.00 29.99 29.08 3lc3 n HIS 91 CO 0.00 0.00 0.00 1.12 -0.00 0.00 0.00 176.34 177.46 3lc3 h HIS 92 N 3.39 0.00 -0.21 1.57 2.07 -1.92 -1.26 115.15 118.77 3lc3 h HIS 92 Ca -0.43 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.09 3lc3 h HIS 92 Cb 1.32 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.30 3lc3 h HIS 92 CO 0.54 0.00 0.00 0.09 -3.07 0.00 0.00 177.93 175.49 3lc3 n ASN 93 N -3.52 3.14 -4.77 3.10 3.02 -1.26 -4.91 115.26 110.05 3lc3 n ASN 93 Ca -0.01 -1.97 -0.41 0.00 -0.03 0.00 0.00 54.58 52.16 3lc3 n ASN 93 Cb 0.22 -0.13 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 3lc3 n ASN 93 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3lc3 s TYR 94 N -1.74 3.13 -0.35 3.10 5.04 -0.48 -4.58 117.35 121.47 3lc3 s TYR 94 Ca 0.34 1.46 -0.08 0.00 -2.44 0.00 0.00 57.07 56.35 3lc3 s TYR 94 Cb 0.21 -3.62 0.01 0.00 0.35 0.00 0.00 41.96 38.92 3lc3 s TYR 94 CO 0.31 -1.66 0.43 0.09 -1.34 0.00 0.00 175.55 173.38 3lc3 n ASN 95 N 0.84 -6.06 -0.87 4.32 3.02 -1.26 -4.98 115.26 110.27 3lc3 n ASN 95 Ca -0.00 0.27 -0.09 0.00 -0.03 0.00 0.00 54.58 54.73 3lc3 n ASN 95 Cb 0.42 -4.01 -0.01 0.00 -0.61 0.00 0.00 39.78 35.58 3lc3 n ASN 95 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3lc3 n ALA 95 N -0.64 -1.41 -1.88 5.41 0.00 -1.26 -5.02 120.51 115.71 3lc3 n ALA 95 Ca 0.06 0.08 -0.41 0.00 0.00 0.00 0.00 53.44 53.17 3lc3 n ALA 95 Cb 0.36 -0.32 -0.03 0.00 0.00 0.00 0.00 19.45 19.46 3lc3 n ALA 95 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3lc3 s ILE 96 N -0.22 3.22 -1.14 0.00 2.07 -1.26 -3.90 121.20 119.98 3lc3 s ILE 96 Ca 0.13 1.12 -0.03 0.00 -1.41 0.00 0.00 60.65 60.46 3lc3 s ILE 96 Cb -0.18 -3.71 0.02 0.00 0.13 0.00 0.00 42.46 38.72 3lc3 s ILE 96 CO 0.11 0.23 0.19 0.59 -1.91 0.00 0.00 174.94 174.15 3lc3 n ASN 97 N 1.71 -3.95 -0.06 4.50 3.02 -1.26 -4.87 115.26 114.34 3lc3 n ASN 97 Ca 0.02 -0.01 -0.11 0.00 -0.03 0.00 0.00 54.58 54.45 3lc3 n ASN 97 Cb 0.43 -3.32 -0.15 0.00 -0.61 0.00 0.00 39.78 36.14 3lc3 n ASN 97 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3lc3 n LYS 98 N -3.16 0.67 -1.22 3.52 4.01 -1.25 -4.99 118.16 115.73 3lc3 n LYS 98 Ca -0.10 0.14 -0.08 0.00 -0.51 0.00 0.00 58.31 57.77 3lc3 n LYS 98 Cb 0.59 -1.64 -0.03 0.00 -0.51 0.00 0.00 35.03 33.44 3lc3 n LYS 98 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 3lc3 n TYR 99 N -2.97 0.00 -2.22 2.13 4.02 -1.26 -4.98 117.16 111.88 3lc3 n TYR 99 Ca -0.28 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.20 3lc3 n TYR 99 Cb 1.09 -2.40 -0.03 0.00 -0.02 0.00 0.00 39.34 37.99 3lc3 n TYR 99 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 3lc3 s ASN 100 N -2.31 6.89 -1.20 7.72 3.04 -1.26 -3.07 114.94 124.73 3lc3 s ASN 100 Ca 0.00 2.56 -0.07 0.00 0.04 0.00 0.00 52.86 55.38 3lc3 s ASN 100 Cb 0.00 -2.64 0.01 0.00 -1.54 0.00 0.00 41.25 37.08 3lc3 s ASN 100 CO 0.00 -0.44 1.05 1.41 -3.04 0.00 0.00 177.10 176.08 3lc3 n HIS 101 N 0.85 -2.54 -2.52 0.43 8.25 -1.26 -4.46 115.22 113.98 3lc3 n HIS 101 Ca -0.00 0.91 -0.43 0.00 -0.26 0.00 0.00 57.72 57.94 3lc3 n HIS 101 Cb 0.43 -4.64 0.00 0.00 1.12 0.00 0.00 29.99 26.90 3lc3 n HIS 101 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3lc3 n ASP 102 N -2.58 4.85 -3.64 0.41 2.03 -1.18 -4.33 116.55 112.11 3lc3 n ASP 102 Ca -0.02 -2.93 -0.15 0.00 0.52 0.00 0.00 54.79 52.22 3lc3 n ASP 102 Cb 0.56 -1.70 -0.08 0.00 -0.72 0.00 0.00 41.12 39.19 3lc3 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3lc3 s ILE 103 N 3.51 0.01 0.08 5.18 2.07 -1.26 -4.01 121.20 126.77 3lc3 s ILE 103 Ca 0.51 -0.06 -0.18 0.00 -1.41 0.00 0.00 60.65 59.51 3lc3 s ILE 103 Cb 0.04 -0.86 0.04 0.00 0.13 0.00 0.00 42.46 41.82 3lc3 s ILE 103 CO 0.04 -0.03 0.43 0.00 -1.91 0.00 0.00 174.94 173.47 3lc3 s ALA 104 N -0.27 -1.05 -0.02 1.50 0.00 -0.34 -1.06 121.76 120.51 3lc3 s ALA 104 Ca -0.05 0.23 0.08 0.00 0.00 0.00 0.00 51.96 52.22 3lc3 s ALA 104 Cb -0.03 0.50 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 3lc3 s ALA 104 CO 0.04 -0.55 -0.26 -0.51 0.00 0.00 0.00 175.76 174.48 3lc3 s LEU 105 N -2.33 2.05 -0.14 0.00 1.43 -0.13 -0.72 118.68 118.84 3lc3 s LEU 105 Ca -0.02 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 52.63 3lc3 s LEU 105 Cb 0.00 -1.34 0.01 0.00 0.03 0.00 0.00 46.19 44.89 3lc3 s LEU 105 CO -0.06 0.32 -0.21 -0.76 0.23 0.00 0.00 176.35 175.87 3lc3 s LEU 106 N -0.61 2.18 -0.17 1.79 1.43 0.57 -0.26 118.68 123.61 3lc3 s LEU 106 Ca 0.10 -0.58 -0.14 0.00 -1.03 0.00 0.00 54.13 52.48 3lc3 s LEU 106 Cb -0.10 -1.47 -0.05 0.00 0.03 0.00 0.00 46.19 44.61 3lc3 s LEU 106 CO -0.01 0.08 0.31 -0.70 0.23 0.00 0.00 176.35 176.26 3lc3 s GLU 107 N 0.79 4.23 0.33 1.70 2.12 0.17 -1.10 118.70 126.94 3lc3 s GLU 107 Ca -0.07 0.09 -0.12 0.00 0.36 0.00 0.00 54.97 55.23 3lc3 s GLU 107 Cb -0.16 -3.46 -0.08 0.00 0.26 0.00 0.00 34.13 30.70 3lc3 s GLU 107 CO -0.01 0.17 0.69 -0.51 -0.54 0.00 0.00 175.26 175.06 3lc3 s LEU 108 N 0.68 4.01 0.14 2.70 1.43 0.17 -0.56 118.68 127.25 3lc3 s LEU 108 Ca 0.16 1.11 -0.12 0.00 -1.03 0.00 0.00 54.13 54.25 3lc3 s LEU 108 Cb -0.13 -3.93 -0.02 0.00 0.03 0.00 0.00 46.19 42.14 3lc3 s LEU 108 CO 0.05 -0.24 1.53 -2.24 0.23 0.00 0.00 176.35 175.68 3lc3 h ASP 109 N 1.96 0.88 -4.08 2.29 2.03 -1.23 -3.44 116.42 114.84 3lc3 h ASP 109 Ca -0.47 -0.38 -0.41 0.00 -0.73 0.00 0.00 57.03 55.03 3lc3 h ASP 109 Cb 1.18 -0.24 -0.29 0.00 -0.83 0.00 0.00 39.33 39.15 3lc3 h ASP 109 CO 0.66 1.06 -0.79 -0.70 -1.03 0.00 0.00 179.24 178.44 3lc3 s GLU 110 N -4.73 0.82 0.41 4.15 2.56 -1.26 -5.06 118.70 115.59 3lc3 s GLU 110 Ca -0.12 -0.37 -0.26 0.00 0.00 0.00 0.00 54.97 54.22 3lc3 s GLU 110 Cb 0.11 -0.79 -0.10 0.00 2.00 0.00 0.00 34.13 35.34 3lc3 s GLU 110 CO 0.84 0.22 1.24 -0.35 -0.56 0.00 0.00 175.26 176.65 3lc3 n PRO 111 N 2.81 1.89 -2.08 4.30 -0.04 -1.26 -4.92 135.00 135.70 3lc3 n PRO 111 Ca -0.14 0.67 -0.34 0.00 -0.04 0.00 0.00 63.50 63.65 3lc3 n PRO 111 Cb 0.56 -2.33 0.02 0.00 -0.04 0.00 0.00 33.50 31.71 3lc3 n PRO 111 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3lc3 s LEU 112 N -1.45 3.62 -0.41 1.53 1.43 -0.25 -5.01 118.68 118.14 3lc3 s LEU 112 Ca 0.60 2.12 -0.17 0.00 -1.03 0.00 0.00 54.13 55.66 3lc3 s LEU 112 Cb -0.52 -4.57 0.02 0.00 0.03 0.00 0.00 46.19 41.14 3lc3 s LEU 112 CO 0.58 -1.37 0.39 -0.69 0.23 0.00 0.00 176.35 175.50 3lc3 s VAL 113 N -1.96 5.14 0.24 -1.59 1.01 -1.26 -4.81 120.40 117.17 3lc3 s VAL 113 Ca 0.71 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.98 3lc3 s VAL 113 Cb -0.23 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.07 3lc3 s VAL 113 CO 0.32 -0.37 1.24 -0.76 0.00 0.00 0.00 175.10 175.53 3lc3 s LEU 114 N 2.00 4.46 0.00 3.92 1.43 -1.26 -4.79 118.68 124.43 3lc3 s LEU 114 Ca 0.10 2.40 -0.03 0.00 -1.03 0.00 0.00 54.13 55.57 3lc3 s LEU 114 Cb -0.18 -3.62 0.01 0.00 0.03 0.00 0.00 46.19 42.44 3lc3 s LEU 114 CO 0.12 -0.41 0.18 -0.46 0.23 0.00 0.00 176.35 176.02 3lc3 n ASN 115 N 1.88 -0.53 0.33 2.29 0.23 -0.19 -4.97 115.26 114.30 3lc3 n ASN 115 Ca 0.03 -1.36 0.22 0.00 -0.53 0.00 0.00 54.58 52.94 3lc3 n ASN 115 Cb 0.43 0.88 1.15 0.00 -2.08 0.00 0.00 39.78 40.16 3lc3 n ASN 115 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 3lc3 h SER 116 N 0.45 0.00 0.00 0.53 0.02 -2.00 -1.77 113.55 110.79 3lc3 h SER 116 Ca -0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 3lc3 h SER 116 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 3lc3 h SER 116 CO 0.10 0.00 -0.98 -1.22 -1.14 0.00 0.00 176.83 173.59 3lc3 n TYR 117 N -3.12 0.00 -3.62 3.45 4.01 -1.26 -4.80 117.16 111.82 3lc3 n TYR 117 Ca -0.03 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.42 3lc3 n TYR 117 Cb 0.10 -0.05 -0.13 0.00 -0.31 0.00 0.00 39.34 38.95 3lc3 n TYR 117 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3lc3 s VAL 118 N -2.80 0.72 -0.01 -0.72 1.01 -0.66 -3.86 120.40 114.08 3lc3 s VAL 118 Ca 0.05 -1.78 -0.00 0.00 0.00 0.00 0.00 61.98 60.25 3lc3 s VAL 118 Cb 0.14 -1.53 0.01 0.00 0.00 0.00 0.00 36.38 35.01 3lc3 s VAL 118 CO 0.76 -0.85 0.02 -0.89 0.00 0.00 0.00 175.10 174.14 3lc3 s THR 119 N 1.11 -0.03 0.83 3.92 2.01 -0.45 -1.02 115.64 122.00 3lc3 s THR 119 Ca 0.15 0.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.13 3lc3 s THR 119 Cb -0.21 -0.06 0.09 0.00 0.01 0.00 0.00 72.50 72.34 3lc3 s THR 119 CO -0.11 0.04 1.17 -2.84 -0.69 0.00 0.00 174.62 172.19 3lc3 s PRO 120 N 0.52 1.59 0.11 4.92 0.02 -1.26 -2.42 135.00 138.48 3lc3 s PRO 120 Ca -0.04 1.59 -0.16 0.00 0.02 0.00 0.00 61.00 62.41 3lc3 s PRO 120 Cb -0.06 -1.79 -0.07 0.00 0.02 0.00 0.00 34.50 32.60 3lc3 s PRO 120 CO -0.02 -2.22 0.54 -1.50 -0.33 0.00 0.00 177.00 173.48 3lc3 s ILE 121 N -2.42 4.84 0.38 2.83 1.10 -0.59 -4.77 121.20 122.58 3lc3 s ILE 121 Ca 0.69 0.93 -0.26 0.00 -0.51 0.00 0.00 60.65 61.50 3lc3 s ILE 121 Cb -0.25 -3.78 -0.09 0.00 0.15 0.00 0.00 42.46 38.50 3lc3 s ILE 121 CO 0.53 0.36 1.14 0.00 -2.11 0.00 0.00 174.94 174.86 3lc3 s ILE 123 N -1.42 1.46 0.98 0.00 1.01 -1.26 -1.36 121.20 120.61 3lc3 s ILE 123 Ca 0.55 -0.74 -0.16 0.00 0.00 0.00 0.00 60.65 60.30 3lc3 s ILE 123 Cb -0.29 -1.49 0.21 0.00 0.01 0.00 0.00 42.46 40.90 3lc3 s ILE 123 CO 0.37 0.28 1.33 0.00 0.00 0.00 0.00 174.94 176.92 3lc3 s ALA 124 N 1.50 2.15 0.96 9.38 0.00 -1.26 -5.04 121.76 129.45 3lc3 s ALA 124 Ca 0.02 -1.23 -0.14 0.00 0.00 0.00 0.00 51.96 50.61 3lc3 s ALA 124 Cb -0.14 -2.77 0.17 0.00 0.00 0.00 0.00 23.12 20.38 3lc3 s ALA 124 CO -0.09 -2.53 1.18 0.16 0.00 0.00 0.00 175.76 174.48 3lc3 s ASP 125 N -4.88 3.05 0.18 0.00 3.84 -1.26 -4.73 116.67 112.88 3lc3 s ASP 125 Ca 0.75 0.72 -0.18 0.00 -0.00 0.00 0.00 52.55 53.83 3lc3 s ASP 125 Cb -0.04 -1.09 0.13 0.00 -1.38 0.00 0.00 42.92 40.55 3lc3 s ASP 125 CO 0.53 -2.81 1.62 0.50 -0.00 0.00 0.00 175.17 175.01 3lc3 h LYS 126 N -1.68 -0.11 0.44 2.11 3.64 -1.96 -1.32 116.57 117.68 3lc3 h LYS 126 Ca -0.48 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.89 3lc3 h LYS 126 Cb 1.30 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 3lc3 h LYS 126 CO 0.52 -0.08 -0.21 1.49 -2.27 0.00 0.00 179.45 178.90 3lc3 h GLU 127 N -0.12 -0.57 -0.01 1.90 4.81 -1.93 -3.01 114.58 115.64 3lc3 h GLU 127 Ca 0.23 0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.39 3lc3 h GLU 127 Cb 0.47 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 3lc3 h GLU 127 CO -0.56 -0.37 -0.50 1.88 -0.73 0.00 0.00 179.01 178.73 3lc3 h TYR 128 N -0.62 0.04 -0.55 0.92 -1.99 -1.90 -2.31 116.97 110.57 3lc3 h TYR 128 Ca -0.06 -0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.69 3lc3 h TYR 128 Cb 0.47 -0.01 -0.04 0.00 2.00 0.00 0.00 36.73 39.15 3lc3 h TYR 128 CO -0.04 0.53 0.31 1.15 -0.00 0.00 0.00 178.16 180.11 3lc3 h THR 129 N 0.03 1.02 -0.57 -2.88 2.02 -1.21 -0.11 112.91 111.22 3lc3 h THR 129 Ca -0.00 -0.21 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 3lc3 h THR 129 Cb 0.89 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 3lc3 h THR 129 CO 0.07 0.11 0.22 -1.13 0.37 0.00 0.00 175.52 175.16 3lc3 h ASN 129 N 0.62 0.79 -0.42 4.18 -0.00 -1.38 -0.38 115.58 118.98 3lc3 h ASN 129 Ca 0.23 -0.17 0.02 0.00 -0.00 0.00 0.00 56.30 56.38 3lc3 h ASN 129 Cb 0.07 -0.20 -0.03 0.00 -0.00 0.00 0.00 38.32 38.16 3lc3 h ASN 129 CO -0.12 0.75 0.24 0.40 -0.00 0.00 0.00 177.43 178.70 3lc3 h ILE 129 N 0.78 1.03 -0.52 2.57 2.04 -0.90 0.20 117.51 122.72 3lc3 h ILE 129 Ca 0.19 -0.17 -0.10 0.00 1.00 0.00 0.00 64.86 65.78 3lc3 h ILE 129 Cb 0.21 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 3lc3 h ILE 129 CO -0.01 0.09 -0.08 -0.26 0.00 0.00 0.00 178.15 177.89 3lc3 h PHE 130 N 0.49 1.03 -0.59 1.37 0.04 -0.84 -2.01 116.94 116.43 3lc3 h PHE 130 Ca 0.17 -0.19 0.04 0.00 2.80 0.00 0.00 57.97 60.79 3lc3 h PHE 130 Cb 0.02 -0.26 -0.04 0.00 2.20 0.00 0.00 35.95 37.86 3lc3 h PHE 130 CO -0.08 0.96 0.33 1.25 -0.60 0.00 0.00 178.31 180.18 3lc3 h LEU 131 N 0.85 0.51 -0.05 1.54 6.46 -0.64 -2.77 115.31 121.21 3lc3 h LEU 131 Ca 0.14 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 3lc3 h LEU 131 Cb 0.61 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.45 3lc3 h LEU 131 CO 0.04 0.35 0.00 0.29 -0.62 0.00 0.00 178.44 178.50 3lc3 n LYS 132 N -4.80 0.02 0.32 1.25 5.02 0.68 -0.99 118.16 119.66 3lc3 n LYS 132 Ca 0.06 0.25 0.20 0.00 -2.02 0.00 0.00 58.31 56.80 3lc3 n LYS 132 Cb 0.12 -1.53 1.10 0.00 -0.02 0.00 0.00 35.03 34.70 3lc3 n LYS 132 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 3lc3 h PHE 133 N 0.00 0.00 0.00 2.13 0.04 -1.08 -3.46 116.94 114.57 3lc3 h PHE 133 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3lc3 h PHE 133 Cb 0.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.42 3lc3 h PHE 133 CO 0.00 0.01 0.00 0.41 -0.60 0.00 0.00 178.31 178.13 3lc3 n GLY 134 N -1.06 0.74 2.97 -1.45 0.00 -0.16 -5.01 105.19 101.23 3lc3 n GLY 134 Ca -0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 3lc3 n GLY 134 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3lc3 s SER 135 N -2.32 0.39 0.15 1.61 0.15 -1.26 -1.08 113.70 111.34 3lc3 s SER 135 Ca 0.00 0.53 0.00 0.00 0.70 0.00 0.00 55.95 57.19 3lc3 s SER 135 Cb 0.00 0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 64.85 3lc3 s SER 135 CO 0.00 -0.24 0.02 -0.83 1.20 0.00 0.00 173.24 173.39 3lc3 s GLY 136 N 2.31 1.06 -0.09 9.45 0.00 -1.09 -4.72 107.32 114.24 3lc3 s GLY 136 Ca 0.01 -1.51 0.00 0.00 0.00 0.00 0.00 44.72 43.22 3lc3 s GLY 136 CO -0.08 -1.45 -0.08 -0.19 0.00 0.00 0.00 173.10 171.31 3lc3 s TYR 137 N -3.83 2.92 0.15 1.90 1.51 0.11 -0.73 117.35 119.39 3lc3 s TYR 137 Ca 0.22 -0.12 0.11 0.00 -1.01 0.00 0.00 57.07 56.27 3lc3 s TYR 137 Cb 0.07 -1.76 -0.04 0.00 -0.11 0.00 0.00 41.96 40.11 3lc3 s TYR 137 CO 0.02 0.20 -0.24 0.08 -1.11 0.00 0.00 175.55 174.49 3lc3 s VAL 138 N -0.47 2.39 0.08 0.71 1.01 -0.20 -0.69 120.40 123.24 3lc3 s VAL 138 Ca 0.07 -1.83 -0.13 0.00 0.00 0.00 0.00 61.98 60.09 3lc3 s VAL 138 Cb -0.12 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.18 3lc3 s VAL 138 CO 0.02 0.01 0.31 -0.94 0.00 0.00 0.00 175.10 174.50 3lc3 s SER 139 N -2.32 -0.11 0.00 3.32 1.04 -1.23 -1.12 113.70 113.28 3lc3 s SER 139 Ca 0.17 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.27 3lc3 s SER 139 Cb -0.09 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.42 3lc3 s SER 139 CO 0.08 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.19 3lc3 n GLY 140 N 0.16 -0.12 1.29 7.32 0.00 -0.68 -4.50 105.19 108.65 3lc3 n GLY 140 Ca -0.17 -1.17 0.02 0.00 0.00 0.00 0.00 46.02 44.70 3lc3 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3lc3 n TRP 141 N -0.73 1.43 -0.85 1.61 8.01 -1.26 -1.80 117.44 123.85 3lc3 n TRP 141 Ca 0.00 -1.13 0.00 0.00 -1.31 0.00 0.00 57.50 55.06 3lc3 n TRP 141 Cb 0.00 -0.47 0.00 0.00 -2.01 0.00 0.00 31.31 28.83 3lc3 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3lc3 n GLY 142 N -0.53 -1.52 3.77 6.99 0.00 -1.25 -1.96 105.19 110.69 3lc3 n GLY 142 Ca 0.30 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 3lc3 n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3lc3 s ARG 143 N -2.99 4.20 0.00 1.61 0.52 0.15 -2.46 118.95 119.98 3lc3 s ARG 143 Ca 0.00 2.43 0.23 0.00 -0.52 0.00 0.00 55.73 57.87 3lc3 s ARG 143 Cb 0.00 -3.01 0.08 0.00 0.52 0.00 0.00 34.95 32.54 3lc3 s ARG 143 CO 0.00 -0.41 1.12 1.33 0.02 0.00 0.00 175.30 177.37 3lc3 n VAL 144 N 0.72 0.00 -4.01 3.52 0.24 0.20 -1.22 118.33 117.78 3lc3 n VAL 144 Ca 0.01 -0.08 -0.08 0.00 -2.04 0.00 0.00 64.34 62.15 3lc3 n VAL 144 Cb 0.40 0.85 -0.09 0.00 -1.47 0.00 0.00 33.84 33.53 3lc3 n VAL 144 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 3lc3 s PHE 145 N -2.81 0.38 0.15 6.34 0.08 -1.26 -4.20 117.98 116.67 3lc3 s PHE 145 Ca 0.13 -0.88 -0.31 0.00 0.12 0.00 0.00 56.93 55.99 3lc3 s PHE 145 Cb 0.17 -0.27 -0.11 0.00 -0.57 0.00 0.00 43.02 42.24 3lc3 s PHE 145 CO 0.72 -0.42 1.74 -1.58 -0.10 0.00 0.00 175.22 175.57 3lc3 s HIS 147 N -3.76 2.57 -1.45 0.36 5.65 -1.26 -0.65 115.29 116.75 3lc3 s HIS 147 Ca 0.05 0.24 -0.07 0.00 0.25 0.00 0.00 55.06 55.53 3lc3 s HIS 147 Cb 0.06 -4.11 0.03 0.00 -1.18 0.00 0.00 32.58 27.39 3lc3 s HIS 147 CO -0.10 -4.36 0.58 1.17 -0.65 0.00 0.00 174.74 171.38 3lc3 n LYS 148 N 4.83 -4.40 -1.18 2.88 4.81 -1.26 -4.96 118.16 118.88 3lc3 n LYS 148 Ca 0.16 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 3lc3 n LYS 148 Cb 0.37 -5.55 0.00 0.00 0.02 0.00 0.00 35.03 29.87 3lc3 n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3lc3 n GLY 149 N -1.40 5.62 3.75 3.14 0.00 0.18 -5.13 105.19 111.35 3lc3 n GLY 149 Ca -0.07 -2.10 -0.33 0.00 0.00 0.00 0.00 46.02 43.52 3lc3 n GLY 149 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3lc3 s ARG 150 N -0.77 2.49 0.37 1.61 1.70 -1.26 -4.71 118.95 118.38 3lc3 s ARG 150 Ca 0.00 1.52 -0.10 0.00 -0.47 0.00 0.00 55.73 56.69 3lc3 s ARG 150 Cb 0.00 -1.90 -0.06 0.00 -0.57 0.00 0.00 34.95 32.42 3lc3 s ARG 150 CO 0.00 -1.51 0.72 0.45 -1.08 0.00 0.00 175.30 173.88 3lc3 s SER 151 N -2.40 6.53 0.42 -2.89 0.15 -1.26 -0.62 113.70 113.61 3lc3 s SER 151 Ca 0.69 1.06 -0.23 0.00 0.70 0.00 0.00 55.95 58.17 3lc3 s SER 151 Cb -0.24 -2.29 -0.09 0.00 -1.71 0.00 0.00 66.02 61.69 3lc3 s SER 151 CO 0.44 -0.34 1.01 0.00 1.20 0.00 0.00 173.24 175.55 3lc3 s ALA 152 N -2.27 3.04 -0.24 5.45 0.00 -0.83 -4.83 121.76 122.08 3lc3 s ALA 152 Ca 0.50 0.58 -0.15 0.00 0.00 0.00 0.00 51.96 52.89 3lc3 s ALA 152 Cb -0.10 -3.23 -0.16 0.00 0.00 0.00 0.00 23.12 19.63 3lc3 s ALA 152 CO 0.30 -0.10 -0.06 1.28 0.00 0.00 0.00 175.76 177.18 3lc3 n LEU 153 N -0.32 2.04 -4.79 0.00 4.77 -1.26 -4.84 117.00 112.59 3lc3 n LEU 153 Ca 0.06 0.33 -0.38 0.00 -0.03 0.00 0.00 56.01 55.99 3lc3 n LEU 153 Cb 0.51 -0.91 -0.06 0.00 -2.33 0.00 0.00 43.42 40.63 3lc3 n LEU 153 CO 0.42 0.50 0.17 -0.69 -1.33 0.00 0.00 177.39 176.46 3lc3 s VAL 154 N -2.45 5.00 0.06 4.08 1.01 -1.26 -0.90 120.40 125.93 3lc3 s VAL 154 Ca -0.33 0.98 -0.37 0.00 0.00 0.00 0.00 61.98 62.26 3lc3 s VAL 154 Cb 0.10 -3.80 -0.16 0.00 0.00 0.00 0.00 36.38 32.52 3lc3 s VAL 154 CO 0.56 0.49 1.42 -0.11 0.00 0.00 0.00 175.10 177.46 3lc3 n LEU 155 N 2.37 1.94 -4.81 3.92 7.94 -0.58 -4.84 117.00 122.92 3lc3 n LEU 155 Ca -0.11 1.11 -0.28 0.00 -1.11 0.00 0.00 56.01 55.62 3lc3 n LEU 155 Cb 0.52 -1.22 -0.05 0.00 0.53 0.00 0.00 43.42 43.19 3lc3 n LEU 155 CO 0.40 -0.87 -0.22 -1.10 -1.11 0.00 0.00 177.39 174.49 3lc3 s GLN 156 N 0.88 2.98 0.05 1.96 -1.52 -0.75 -0.16 119.66 123.10 3lc3 s GLN 156 Ca 0.85 -0.77 -0.01 0.00 -1.95 0.00 0.00 55.36 53.48 3lc3 s GLN 156 Cb -0.92 -2.72 -0.04 0.00 -0.22 0.00 0.00 33.01 29.11 3lc3 s GLN 156 CO 0.47 0.52 -0.02 1.52 -0.25 0.00 0.00 175.29 177.53 3lc3 s TYR 157 N -1.63 0.50 -0.23 0.91 -0.85 -0.23 -1.68 117.35 114.14 3lc3 s TYR 157 Ca 0.31 -1.04 -0.17 0.00 -0.52 0.00 0.00 57.07 55.65 3lc3 s TYR 157 Cb -0.11 -0.37 0.06 0.00 0.38 0.00 0.00 41.96 41.92 3lc3 s TYR 157 CO 0.24 -0.39 0.58 -1.17 -1.52 0.00 0.00 175.55 173.29 3lc3 s LEU 158 N -2.92 -0.41 -0.15 -3.49 2.96 -0.28 -1.62 118.68 112.78 3lc3 s LEU 158 Ca 0.07 1.22 -0.25 0.00 -0.22 0.00 0.00 54.13 54.94 3lc3 s LEU 158 Cb 0.08 1.98 -0.02 0.00 0.50 0.00 0.00 46.19 48.73 3lc3 s LEU 158 CO -0.10 -0.21 0.82 -0.60 -1.32 0.00 0.00 176.35 174.94 3lc3 s ARG 159 N 0.91 4.33 -0.12 1.98 3.52 -1.26 -1.03 118.95 127.28 3lc3 s ARG 159 Ca -0.05 1.02 0.03 0.00 -0.13 0.00 0.00 55.73 56.60 3lc3 s ARG 159 Cb -0.05 -3.55 0.01 0.00 -1.56 0.00 0.00 34.95 29.79 3lc3 s ARG 159 CO -0.08 -0.26 -0.22 0.14 -0.81 0.00 0.00 175.30 174.07 3lc3 s VAL 160 N 1.90 2.01 0.39 7.11 -7.23 0.09 -4.99 120.40 119.69 3lc3 s VAL 160 Ca 0.39 -0.97 -0.26 0.00 -1.81 0.00 0.00 61.98 59.33 3lc3 s VAL 160 Cb -0.17 -1.75 -0.09 0.00 0.56 0.00 0.00 36.38 34.93 3lc3 s VAL 160 CO 0.14 0.54 1.28 -2.84 -0.31 0.00 0.00 175.10 173.92 3lc3 s PRO 161 N 0.57 4.03 0.36 4.82 0.02 -1.26 -2.67 135.00 140.87 3lc3 s PRO 161 Ca -0.13 2.12 -0.28 0.00 0.02 0.00 0.00 61.00 62.73 3lc3 s PRO 161 Cb -0.17 -2.79 -0.10 0.00 0.02 0.00 0.00 34.50 31.46 3lc3 s PRO 161 CO 0.04 -0.43 1.32 -1.17 -0.33 0.00 0.00 177.00 176.43 3lc3 s LEU 162 N -2.35 4.36 -0.10 -5.54 2.96 -0.24 -1.19 118.68 116.58 3lc3 s LEU 162 Ca 0.56 2.70 0.01 0.00 -0.22 0.00 0.00 54.13 57.17 3lc3 s LEU 162 Cb -0.37 -3.73 -0.02 0.00 0.50 0.00 0.00 46.19 42.57 3lc3 s LEU 162 CO 0.48 -0.65 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.06 3lc3 s VAL 163 N -1.18 3.28 0.51 1.68 1.01 -0.44 -4.87 120.40 120.40 3lc3 s VAL 163 Ca 0.51 -0.61 -0.22 0.00 0.00 0.00 0.00 61.98 61.67 3lc3 s VAL 163 Cb -0.40 -2.36 -0.06 0.00 0.00 0.00 0.00 36.38 33.57 3lc3 s VAL 163 CO 0.52 0.55 1.27 -0.62 0.00 0.00 0.00 175.10 176.82 3lc3 s ASP 164 N -0.15 5.63 0.25 3.32 2.15 -1.26 -4.49 116.67 122.12 3lc3 s ASP 164 Ca 0.00 2.55 -0.04 0.00 0.43 0.00 0.00 52.55 55.49 3lc3 s ASP 164 Cb -0.13 -2.62 0.38 0.00 -0.30 0.00 0.00 42.92 40.25 3lc3 s ASP 164 CO 0.03 -1.30 1.85 -0.09 -0.17 0.00 0.00 175.17 175.48 3lc3 h ARG 165 N 1.66 0.95 -0.06 4.34 2.43 -1.98 -2.12 114.38 119.58 3lc3 h ARG 165 Ca -0.50 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 58.61 3lc3 h ARG 165 Cb 1.28 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3lc3 h ARG 165 CO 0.58 0.63 0.03 0.00 -1.51 0.00 0.00 179.97 179.70 3lc3 h ALA 166 N 1.44 0.08 -1.00 2.80 0.00 -1.99 0.59 119.26 121.17 3lc3 h ALA 166 Ca 0.40 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.39 3lc3 h ALA 166 Cb 0.24 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.91 3lc3 h ALA 166 CO -0.20 -0.37 0.63 1.15 0.00 0.00 0.00 179.25 180.46 3lc3 h THR 167 N 0.00 0.88 -0.05 0.00 2.02 -1.88 -1.81 112.91 112.07 3lc3 h THR 167 Ca 0.02 -0.33 -0.03 0.00 0.77 0.00 0.00 66.41 66.84 3lc3 h THR 167 Cb 0.09 -0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.35 3lc3 h THR 167 CO -0.00 0.17 -0.11 0.00 0.37 0.00 0.00 175.52 175.95 3lc3 h LEU 169 N -0.37 -0.02 -1.08 0.00 4.07 -0.75 -0.94 115.31 116.23 3lc3 h LEU 169 Ca -0.00 0.15 0.00 0.00 0.08 0.00 0.00 57.88 58.11 3lc3 h LEU 169 Cb 0.71 0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.65 3lc3 h LEU 169 CO 0.02 -0.05 0.00 0.03 -1.08 0.00 0.00 178.44 177.37 3lc3 h ARG 170 N 0.25 0.00 0.00 1.13 3.08 -1.25 -3.22 114.38 114.38 3lc3 h ARG 170 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 3lc3 h ARG 170 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.74 3lc3 h ARG 170 CO -0.51 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.05 3lc3 h SER 171 N 0.00 0.00 -5.01 7.04 4.64 -0.62 -3.47 113.55 116.14 3lc3 h SER 171 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 3lc3 h SER 171 Cb 0.43 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 62.32 3lc3 h SER 171 CO 0.00 0.00 -0.40 0.28 -0.87 0.00 0.00 176.83 175.84 3lc3 s THR 172 N -3.20 0.08 0.01 2.95 -1.32 -1.22 -4.75 115.64 108.19 3lc3 s THR 172 Ca 0.08 -0.67 0.28 0.00 -1.21 0.00 0.00 61.69 60.18 3lc3 s THR 172 Cb 0.10 -0.60 0.32 0.00 -1.51 0.00 0.00 72.50 70.81 3lc3 s THR 172 CO 0.59 -0.37 1.85 0.07 -2.21 0.00 0.00 174.62 174.55 3lc3 h LYS 173 N 3.95 0.00 -7.20 7.08 2.10 -1.90 -3.46 116.57 117.14 3lc3 h LYS 173 Ca -0.31 0.00 -0.48 0.00 -2.00 0.00 0.00 60.65 57.86 3lc3 h LYS 173 Cb 1.19 0.00 0.04 0.00 -0.90 0.00 0.00 32.23 32.56 3lc3 h LYS 173 CO 0.42 0.09 0.38 -0.06 -2.00 0.00 0.00 179.45 178.28 3lc3 s PHE 174 N -3.55 3.19 0.08 0.07 0.08 -1.26 -5.00 117.98 111.59 3lc3 s PHE 174 Ca 0.02 1.49 -0.31 0.00 0.12 0.00 0.00 56.93 58.25 3lc3 s PHE 174 Cb 0.09 -2.91 -0.08 0.00 -0.57 0.00 0.00 43.02 39.55 3lc3 s PHE 174 CO 0.60 -0.80 1.48 0.99 -0.10 0.00 0.00 175.22 177.39 3lc3 s THR 175 N -2.54 3.24 -0.26 0.64 2.01 -1.26 -5.01 115.64 112.45 3lc3 s THR 175 Ca 0.61 0.79 -0.05 0.00 0.31 0.00 0.00 61.69 63.36 3lc3 s THR 175 Cb -0.13 -3.51 0.01 0.00 0.01 0.00 0.00 72.50 68.87 3lc3 s THR 175 CO 0.35 0.03 0.01 -0.63 -0.69 0.00 0.00 174.62 173.70 3lc3 s ILE 176 N 1.80 3.57 0.83 1.82 -1.09 -1.26 -5.05 121.20 121.83 3lc3 s ILE 176 Ca 0.67 -0.69 -0.09 0.00 -2.23 0.00 0.00 60.65 58.32 3lc3 s ILE 176 Cb -0.37 -2.77 0.15 0.00 -1.58 0.00 0.00 42.46 37.89 3lc3 s ILE 176 CO 0.30 0.21 1.15 -0.31 -1.23 0.00 0.00 174.94 175.06 3lc3 s TYR 177 N 1.46 1.77 -0.99 3.97 1.51 -1.26 -4.97 117.35 118.83 3lc3 s TYR 177 Ca 0.03 0.10 0.21 0.00 -1.01 0.00 0.00 57.07 56.40 3lc3 s TYR 177 Cb -0.16 -3.55 0.88 0.00 -0.11 0.00 0.00 41.96 39.02 3lc3 s TYR 177 CO -0.01 -2.11 1.66 0.27 -1.11 0.00 0.00 175.55 174.25 3lc3 n ASN 178 N -3.29 0.02 -0.80 2.29 6.94 -1.26 -2.32 115.26 116.85 3lc3 n ASN 178 Ca 0.14 0.50 0.06 0.00 -0.02 0.00 0.00 54.58 55.27 3lc3 n ASN 178 Cb 0.60 -0.51 0.18 0.00 -2.36 0.00 0.00 39.78 37.70 3lc3 n ASN 178 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 3lc3 n ASN 179 N -1.52 2.31 -4.25 0.53 5.03 -1.26 -4.91 115.26 111.19 3lc3 n ASN 179 Ca 0.05 -2.04 -0.17 0.00 0.87 0.00 0.00 54.58 53.28 3lc3 n ASN 179 Cb 0.24 -0.30 -0.11 0.00 -1.02 0.00 0.00 39.78 38.59 3lc3 n ASN 179 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 3lc3 s MET 180 N -1.50 1.05 0.16 3.52 -1.94 -0.98 -0.61 119.30 119.00 3lc3 s MET 180 Ca 0.28 -1.30 0.00 0.00 -1.71 0.00 0.00 55.69 52.96 3lc3 s MET 180 Cb 0.15 -0.87 -0.04 0.00 2.01 0.00 0.00 34.83 36.08 3lc3 s MET 180 CO 0.18 0.16 0.04 -0.59 -0.01 0.00 0.00 175.02 174.79 3lc3 s PHE 181 N -2.39 1.05 0.10 -0.03 -0.12 -0.35 -4.79 117.98 111.45 3lc3 s PHE 181 Ca 0.11 -1.14 0.08 0.00 -0.05 0.00 0.00 56.93 55.93 3lc3 s PHE 181 Cb -0.03 -0.59 -0.04 0.00 -0.63 0.00 0.00 43.02 41.72 3lc3 s PHE 181 CO 0.03 -0.38 -0.16 0.00 -0.05 0.00 0.00 175.22 174.66 3lc3 s ALA 183 N -1.14 -1.02 0.00 0.00 0.00 -0.91 -1.32 121.76 117.37 3lc3 s ALA 183 Ca 0.18 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.70 3lc3 s ALA 183 Cb -0.11 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.08 3lc3 s ALA 183 CO 0.10 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.98 3lc3 n GLY 184 N 1.16 -0.01 3.40 0.00 0.00 -0.33 -1.45 105.19 107.96 3lc3 n GLY 184 Ca -0.21 -1.70 -0.33 0.00 0.00 0.00 0.00 46.02 43.78 3lc3 n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3lc3 s PHE 184 N -1.94 2.76 0.42 1.61 0.40 -1.26 -4.10 117.98 115.86 3lc3 s PHE 184 Ca 0.00 -0.47 0.14 0.00 -0.60 0.00 0.00 56.93 56.00 3lc3 s PHE 184 Cb 0.00 -1.75 1.00 0.00 0.51 0.00 0.00 43.02 42.78 3lc3 s PHE 184 CO 0.00 -0.07 1.93 0.45 0.70 0.00 0.00 175.22 178.24 3lc3 h HIS 185 N 6.18 0.53 0.00 0.36 3.86 -1.98 0.12 115.15 124.21 3lc3 h HIS 185 Ca -0.33 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.89 3lc3 h HIS 185 Cb 1.19 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.49 3lc3 h HIS 185 CO 0.50 0.22 0.00 0.39 0.86 0.00 0.00 177.93 179.90 3lc3 n GLU 186 N -4.48 0.14 0.00 2.45 4.71 -1.26 -3.13 120.64 119.07 3lc3 n GLU 186 Ca 0.13 0.25 0.00 0.00 -0.01 0.00 0.00 57.16 57.53 3lc3 n GLU 186 Cb 0.46 -1.71 0.00 0.00 -1.01 0.00 0.00 31.44 29.18 3lc3 n GLU 186 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3lc3 n GLY 187 N 0.66 -0.51 3.76 0.62 0.00 0.41 -4.32 105.19 105.80 3lc3 n GLY 187 Ca 0.04 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.96 3lc3 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lc3 n GLY 188 N 0.00 2.48 2.98 -0.02 0.00 0.10 -4.79 105.19 105.95 3lc3 n GLY 188 Ca 0.00 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3lc3 n GLY 188 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3lc3 s ARG 188 N 0.00 1.38 -0.13 1.61 0.52 -1.26 -4.04 118.95 117.03 3lc3 s ARG 188 Ca 0.00 -0.32 -0.33 0.00 -0.52 0.00 0.00 55.73 54.56 3lc3 s ARG 188 Cb 0.00 -1.19 0.13 0.00 0.52 0.00 0.00 34.95 34.40 3lc3 s ARG 188 CO 0.00 0.01 1.16 0.34 0.02 0.00 0.00 175.30 176.83 3lc3 s ASP 189 N 0.68 -0.16 0.81 0.23 -1.08 -0.63 -4.47 116.67 112.05 3lc3 s ASP 189 Ca -0.13 -0.03 -0.11 0.00 -0.52 0.00 0.00 52.55 51.76 3lc3 s ASP 189 Cb -0.15 0.19 0.08 0.00 -1.46 0.00 0.00 42.92 41.58 3lc3 s ASP 189 CO 0.02 -0.32 1.09 -0.94 0.52 0.00 0.00 175.17 175.55 3lc3 s SER 190 N -2.34 4.30 0.34 -0.34 1.04 -1.26 0.62 113.70 116.06 3lc3 s SER 190 Ca 0.09 1.46 -0.02 0.00 0.48 0.00 0.00 55.95 57.97 3lc3 s SER 190 Cb -0.00 -2.20 0.01 0.00 0.10 0.00 0.00 66.02 63.93 3lc3 s SER 190 CO -0.05 -2.11 0.48 0.00 0.98 0.00 0.00 173.24 172.54 3lc3 n GLN 192 N -0.57 2.68 0.00 0.00 7.27 -1.26 -0.90 117.38 124.60 3lc3 n GLN 192 Ca 0.01 0.94 0.00 0.00 0.07 0.00 0.00 57.00 58.02 3lc3 n GLN 192 Cb 0.57 -2.69 0.00 0.00 2.41 0.00 0.00 30.24 30.53 3lc3 n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3lc3 n GLY 193 N 1.08 3.21 0.10 1.69 0.00 -1.26 0.31 105.19 110.32 3lc3 n GLY 193 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.19 3lc3 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3lc3 n ASP 194 N 0.07 0.79 -4.66 1.61 8.00 -0.08 -3.73 116.55 118.54 3lc3 n ASP 194 Ca 0.00 0.47 -0.41 0.00 0.71 0.00 0.00 54.79 55.56 3lc3 n ASP 194 Cb 0.00 -0.57 0.02 0.00 -0.02 0.00 0.00 41.12 40.55 3lc3 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3lc3 n SER 195 N -2.23 1.89 0.00 -2.24 7.64 -1.26 -2.06 113.62 115.36 3lc3 n SER 195 Ca 0.05 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.97 3lc3 n SER 195 Cb 0.43 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 3lc3 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3lc3 n GLY 196 N 1.00 3.19 3.78 0.23 0.00 0.20 0.07 105.19 113.65 3lc3 n GLY 196 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 3lc3 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3lc3 s GLY 197 N -2.02 1.62 0.18 -0.02 0.00 -0.88 -3.36 107.32 102.84 3lc3 s GLY 197 Ca 0.00 -0.75 -0.28 0.00 0.00 0.00 0.00 44.72 43.69 3lc3 s GLY 197 CO 0.00 -0.08 0.89 2.56 0.00 0.00 0.00 173.10 176.47 3lc3 s PRO 198 N -5.43 4.73 -0.28 2.90 0.04 -1.26 -1.02 135.00 134.68 3lc3 s PRO 198 Ca 0.67 1.37 -0.10 0.00 0.04 0.00 0.00 61.00 62.98 3lc3 s PRO 198 Cb -0.11 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.09 3lc3 s PRO 198 CO 0.54 0.46 0.16 -1.58 0.04 0.00 0.00 177.00 176.62 3lc3 s HIS 199 N -0.89 3.18 0.09 0.56 2.46 -0.47 -3.53 115.29 116.69 3lc3 s HIS 199 Ca 0.40 -0.12 0.05 0.00 0.47 0.00 0.00 55.06 55.86 3lc3 s HIS 199 Cb -0.24 -2.34 -0.03 0.00 -0.13 0.00 0.00 32.58 29.83 3lc3 s HIS 199 CO 0.29 -0.26 -0.13 0.14 -2.47 0.00 0.00 174.74 172.32 3lc3 s VAL 200 N 1.70 1.11 -0.13 0.89 -7.23 0.14 -1.15 120.40 115.73 3lc3 s VAL 200 Ca 0.07 -1.48 0.02 0.00 -1.81 0.00 0.00 61.98 58.78 3lc3 s VAL 200 Cb -0.16 -1.24 0.01 0.00 0.56 0.00 0.00 36.38 35.55 3lc3 s VAL 200 CO 0.08 -0.36 -0.21 -0.89 -0.31 0.00 0.00 175.10 173.41 3lc3 s THR 201 N -1.77 1.99 -0.14 5.32 2.01 -0.12 0.08 115.64 123.01 3lc3 s THR 201 Ca 0.02 -0.94 -0.19 0.00 0.31 0.00 0.00 61.69 60.90 3lc3 s THR 201 Cb -0.07 -1.76 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 3lc3 s THR 201 CO 0.02 0.54 0.51 -0.70 -0.69 0.00 0.00 174.62 174.30 3lc3 s GLU 202 N 0.82 4.31 -0.26 4.92 2.12 -1.26 -0.92 118.70 128.42 3lc3 s GLU 202 Ca -0.07 0.49 -0.00 0.00 0.36 0.00 0.00 54.97 55.74 3lc3 s GLU 202 Cb -0.16 -3.47 0.08 0.00 0.26 0.00 0.00 34.13 30.84 3lc3 s GLU 202 CO -0.02 0.06 0.04 0.08 -0.54 0.00 0.00 175.26 174.88 3lc3 s VAL 203 N 0.92 1.09 -1.35 3.70 1.01 0.10 -4.77 120.40 121.11 3lc3 s VAL 203 Ca 0.27 -1.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.02 3lc3 s VAL 203 Cb -0.15 -1.63 0.00 0.00 0.00 0.00 0.00 36.38 34.60 3lc3 s VAL 203 CO 0.11 -0.39 0.61 -0.62 0.00 0.00 0.00 175.10 174.80 3lc3 n GLU 204 N 4.80 -4.34 -0.88 2.72 -0.58 -1.26 -1.01 120.64 120.09 3lc3 n GLU 204 Ca -0.06 0.54 0.00 0.00 -0.42 0.00 0.00 57.16 57.22 3lc3 n GLU 204 Cb 0.44 -4.96 0.00 0.00 -0.57 0.00 0.00 31.44 26.35 3lc3 n GLU 204 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3lc3 n GLY 205 N -1.72 0.71 3.29 0.62 0.00 -1.26 -4.99 105.19 101.83 3lc3 n GLY 205 Ca -0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 3lc3 n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lc3 s THR 206 N -3.09 3.13 0.02 2.61 2.01 -0.18 -5.09 115.64 115.05 3lc3 s THR 206 Ca 0.00 -0.58 -0.23 0.00 0.31 0.00 0.00 61.69 61.19 3lc3 s THR 206 Cb 0.00 -2.40 -0.05 0.00 0.01 0.00 0.00 72.50 70.06 3lc3 s THR 206 CO 0.00 0.45 0.68 -0.44 -0.69 0.00 0.00 174.62 174.63 3lc3 s SER 207 N 1.31 7.10 0.07 3.53 0.01 -1.26 0.01 113.70 124.47 3lc3 s SER 207 Ca 0.04 1.31 0.10 0.00 1.31 0.00 0.00 55.95 58.70 3lc3 s SER 207 Cb -0.14 -2.42 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 3lc3 s SER 207 CO -0.04 0.06 -0.26 -0.36 0.41 0.00 0.00 173.24 173.05 3lc3 s PHE 208 N -0.14 2.27 -0.26 2.43 0.40 -0.10 -2.75 117.98 119.83 3lc3 s PHE 208 Ca 0.35 -0.40 -0.28 0.00 -0.60 0.00 0.00 56.93 55.99 3lc3 s PHE 208 Cb -0.19 -1.32 0.01 0.00 0.51 0.00 0.00 43.02 42.02 3lc3 s PHE 208 CO 0.20 0.18 1.01 -1.17 0.70 0.00 0.00 175.22 176.14 3lc3 s LEU 209 N -1.47 4.06 -0.00 -0.37 2.96 -0.46 -0.94 118.68 122.45 3lc3 s LEU 209 Ca 0.12 1.22 0.05 0.00 -0.22 0.00 0.00 54.13 55.30 3lc3 s LEU 209 Cb -0.10 -3.47 -0.07 0.00 0.50 0.00 0.00 46.19 43.05 3lc3 s LEU 209 CO 0.03 -0.70 0.13 0.35 -1.32 0.00 0.00 176.35 174.85 3lc3 n THR 210 N 5.46 0.00 -3.80 3.68 -2.24 -0.30 -4.77 114.28 112.31 3lc3 n THR 210 Ca 0.11 -0.19 -0.08 0.00 -2.27 0.00 0.00 64.05 61.62 3lc3 n THR 210 Cb 0.47 0.56 -0.02 0.00 -2.10 0.00 0.00 70.33 69.24 3lc3 n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3lc3 s GLY 211 N -2.25 -0.14 -0.14 3.38 0.00 -0.72 -3.23 107.32 104.22 3lc3 s GLY 211 Ca -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 44.72 44.49 3lc3 s GLY 211 CO 0.20 -0.08 -0.12 -0.42 0.00 0.00 0.00 173.10 172.68 3lc3 s ILE 212 N -3.90 3.07 0.05 0.90 -1.09 -0.75 -1.37 121.20 118.11 3lc3 s ILE 212 Ca 0.10 -0.65 -0.32 0.00 -2.23 0.00 0.00 60.65 57.56 3lc3 s ILE 212 Cb -0.05 -2.30 -0.11 0.00 -1.58 0.00 0.00 42.46 38.42 3lc3 s ILE 212 CO 0.04 0.52 1.88 -0.38 -1.23 0.00 0.00 174.94 175.77 3lc3 n ILE 213 N 3.67 0.54 0.00 2.92 5.41 -0.19 -0.76 119.36 130.95 3lc3 n ILE 213 Ca -0.18 -0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.47 3lc3 n ILE 213 Cb 0.52 -2.10 0.00 0.00 -0.71 0.00 0.00 39.64 37.35 3lc3 n ILE 213 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 3lc3 n SER 214 N 6.42 0.00 -2.77 4.38 2.88 -0.73 -0.63 113.62 123.18 3lc3 n SER 214 Ca 0.20 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.62 3lc3 n SER 214 Cb 0.36 -0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 63.79 3lc3 n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 3lc3 n TRP 215 N -2.41 -1.74 -0.10 0.66 4.27 -0.81 -4.84 117.44 112.47 3lc3 n TRP 215 Ca 0.00 -2.00 0.00 0.00 -3.89 0.00 0.00 57.50 51.61 3lc3 n TRP 215 Cb 0.00 0.65 0.00 0.00 -1.36 0.00 0.00 31.31 30.60 3lc3 n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 3lc3 n GLY 216 N -0.52 -1.86 0.00 -1.67 0.00 -1.26 -0.29 105.19 99.59 3lc3 n GLY 216 Ca -0.03 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.85 3lc3 n GLY 216 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3lc3 n GLU 217 N -0.41 3.95 -1.70 1.61 1.02 -1.26 -4.98 120.64 118.86 3lc3 n GLU 217 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 3lc3 n GLU 217 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 3lc3 n GLU 217 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 3lc3 n GLU 219 N 0.00 2.77 -1.97 3.49 0.00 -1.26 -4.81 120.64 118.86 3lc3 n GLU 219 Ca 0.00 1.00 -0.42 0.00 0.00 0.00 0.00 57.16 57.75 3lc3 n GLU 219 Cb 0.00 -2.88 -0.02 0.00 0.00 0.00 0.00 31.44 28.54 3lc3 n GLU 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3lc3 n ALA 221 N 2.83 -0.23 -2.39 0.00 0.00 -1.26 -4.55 120.51 114.91 3lc3 n ALA 221 Ca 0.09 0.25 -0.42 0.00 0.00 0.00 0.00 53.44 53.36 3lc3 n ALA 221 Cb 0.39 -1.85 -0.03 0.00 0.00 0.00 0.00 19.45 17.96 3lc3 n ALA 221 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3lc3 s MET 221 N -3.26 4.41 0.22 0.00 0.00 -1.09 0.03 119.30 119.61 3lc3 s MET 221 Ca 0.00 1.81 -0.32 0.00 0.00 0.00 0.00 55.69 57.18 3lc3 s MET 221 Cb 0.00 -3.34 -0.13 0.00 0.00 0.00 0.00 34.83 31.35 3lc3 s MET 221 CO 0.00 -0.29 1.45 1.17 0.00 0.00 0.00 175.02 177.35 3lc3 n LYS 222 N 3.97 2.06 -0.55 4.11 4.81 -1.26 -1.82 118.16 129.49 3lc3 n LYS 222 Ca 0.09 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.27 3lc3 n LYS 222 Cb 0.46 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.09 3lc3 n LYS 222 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3lc3 n GLY 223 N 2.44 1.34 3.56 3.14 0.00 -1.18 -4.95 105.19 109.53 3lc3 n GLY 223 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3lc3 n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lc3 s LYS 224 N -0.21 2.04 0.13 1.61 -0.14 -0.75 -4.68 119.74 117.73 3lc3 s LYS 224 Ca 0.00 -1.12 0.03 0.00 -1.36 0.00 0.00 55.97 53.52 3lc3 s LYS 224 Cb 0.00 -2.23 -0.04 0.00 -1.68 0.00 0.00 37.83 33.88 3lc3 s LYS 224 CO 0.00 0.48 -0.09 0.71 -0.76 0.00 0.00 175.35 175.69 3lc3 s TYR 225 N -1.33 1.13 0.41 3.18 2.02 -1.26 -4.70 117.35 116.80 3lc3 s TYR 225 Ca 0.22 -0.81 -0.23 0.00 -0.37 0.00 0.00 57.07 55.87 3lc3 s TYR 225 Cb -0.10 -0.60 -0.10 0.00 -0.40 0.00 0.00 41.96 40.76 3lc3 s TYR 225 CO 0.13 0.00 1.00 0.20 -1.57 0.00 0.00 175.55 175.32 3lc3 s GLY 226 N -3.13 2.61 -0.07 0.71 0.00 -0.53 -4.62 107.32 102.31 3lc3 s GLY 226 Ca 0.15 0.57 0.02 0.00 0.00 0.00 0.00 44.72 45.46 3lc3 s GLY 226 CO -0.01 0.94 -0.12 -0.42 0.00 0.00 0.00 173.10 173.48 3lc3 s ILE 227 N -1.85 3.21 0.03 0.90 1.09 0.60 -2.14 121.20 123.04 3lc3 s ILE 227 Ca 0.59 -0.66 0.04 0.00 -1.10 0.00 0.00 60.65 59.53 3lc3 s ILE 227 Cb -0.17 -2.28 -0.02 0.00 -1.06 0.00 0.00 42.46 38.93 3lc3 s ILE 227 CO 0.21 0.58 -0.13 -0.31 -0.10 0.00 0.00 174.94 175.19 3lc3 s TYR 228 N -0.59 1.18 0.08 3.97 1.51 0.23 -1.77 117.35 121.97 3lc3 s TYR 228 Ca 0.08 -0.32 -0.30 0.00 -1.01 0.00 0.00 57.07 55.52 3lc3 s TYR 228 Cb -0.11 -0.71 -0.06 0.00 -0.11 0.00 0.00 41.96 40.97 3lc3 s TYR 228 CO 0.01 0.02 1.11 0.99 -1.11 0.00 0.00 175.55 176.57 3lc3 s THR 229 N -0.73 4.19 -0.70 -0.71 2.01 0.06 -1.21 115.64 118.56 3lc3 s THR 229 Ca 0.02 1.67 -0.26 0.00 0.31 0.00 0.00 61.69 63.42 3lc3 s THR 229 Cb -0.07 -4.07 0.04 0.00 0.01 0.00 0.00 72.50 68.41 3lc3 s THR 229 CO 0.01 0.18 1.20 -0.75 -0.69 0.00 0.00 174.62 174.57 3lc3 s LYS 230 N 0.58 3.22 0.38 4.92 2.20 0.22 -1.82 119.74 129.45 3lc3 s LYS 230 Ca 0.54 -0.29 0.13 0.00 -0.36 0.00 0.00 55.97 55.99 3lc3 s LYS 230 Cb -0.27 -4.16 0.77 0.00 -1.51 0.00 0.00 37.83 32.65 3lc3 s LYS 230 CO 0.31 -2.01 1.86 0.28 -0.36 0.00 0.00 175.35 175.42 3lc3 h VAL 231 N 6.04 1.24 -1.01 4.02 2.07 -1.87 -2.55 116.25 124.18 3lc3 h VAL 231 Ca -0.28 -1.14 0.23 0.00 0.82 0.00 0.00 66.70 66.33 3lc3 h VAL 231 Cb 1.06 1.60 -0.11 0.00 -1.52 0.00 0.00 31.29 32.32 3lc3 h VAL 231 CO 1.24 0.33 0.61 0.77 0.02 0.00 0.00 177.57 180.55 3lc3 h SER 232 N 0.02 0.66 0.61 0.57 4.64 -1.88 0.32 113.55 118.48 3lc3 h SER 232 Ca -0.00 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3lc3 h SER 232 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3lc3 h SER 232 CO 0.04 0.15 0.00 0.54 -0.87 0.00 0.00 176.83 176.70 3lc3 n ARG 233 N -4.79 0.15 0.00 4.77 5.12 -0.96 -3.52 116.66 117.43 3lc3 n ARG 233 Ca 0.25 0.41 0.00 0.00 -1.93 0.00 0.00 57.85 56.58 3lc3 n ARG 233 Cb 0.72 -1.79 0.00 0.00 -1.16 0.00 0.00 32.46 30.22 3lc3 n ARG 233 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 3lc3 n TYR 234 N -2.07 0.00 -0.30 -1.55 4.01 0.11 -4.76 117.16 112.60 3lc3 n TYR 234 Ca 0.02 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.79 3lc3 n TYR 234 Cb 0.20 0.00 0.17 0.00 -0.31 0.00 0.00 39.34 39.40 3lc3 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3lc3 h VAL 235 N 0.02 0.92 -0.53 -0.72 2.07 -1.43 -0.45 116.25 116.13 3lc3 h VAL 235 Ca 0.00 -0.28 -0.08 0.00 0.82 0.00 0.00 66.70 67.15 3lc3 h VAL 235 Cb 0.01 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.79 3lc3 h VAL 235 CO 0.00 0.15 0.01 0.78 0.02 0.00 0.00 177.57 178.53 3lc3 h ASN 236 N 0.83 0.91 -0.70 0.57 -0.26 -1.86 -0.58 115.58 114.49 3lc3 h ASN 236 Ca 0.40 -0.30 -0.01 0.00 -0.56 0.00 0.00 56.30 55.83 3lc3 h ASN 236 Cb 0.35 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 37.34 3lc3 h ASN 236 CO -0.24 0.99 0.39 -0.25 -1.06 0.00 0.00 177.43 177.26 3lc3 h TRP 237 N 0.81 0.96 0.16 1.19 7.01 -1.68 -0.19 115.95 124.21 3lc3 h TRP 237 Ca 0.15 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 3lc3 h TRP 237 Cb 0.52 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 27.27 3lc3 h TRP 237 CO 0.04 0.68 -0.08 0.82 -2.79 0.00 0.00 178.44 177.11 3lc3 h ILE 238 N 0.96 0.97 -0.63 2.65 2.04 -0.68 -2.07 117.51 120.76 3lc3 h ILE 238 Ca 0.25 -0.65 0.09 0.00 1.00 0.00 0.00 64.86 65.55 3lc3 h ILE 238 Cb 0.03 1.36 -0.07 0.00 -0.74 0.00 0.00 36.82 37.41 3lc3 h ILE 238 CO -0.04 0.15 0.26 0.11 0.00 0.00 0.00 178.15 178.63 3lc3 h LYS 239 N -0.53 0.44 -0.82 2.37 6.56 -1.05 -1.76 116.57 121.79 3lc3 h LYS 239 Ca -0.02 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.53 3lc3 h LYS 239 Cb 0.41 -0.10 -0.04 0.00 -0.57 0.00 0.00 32.23 31.93 3lc3 h LYS 239 CO 0.04 0.29 0.46 1.49 -2.06 0.00 0.00 179.45 179.67 3lc3 h GLU 240 N 0.46 1.13 0.00 3.15 4.81 -0.96 -3.26 114.58 119.91 3lc3 h GLU 240 Ca 0.31 -0.13 -0.10 0.00 -0.13 0.00 0.00 59.36 59.32 3lc3 h GLU 240 Cb 0.36 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 3lc3 h GLU 240 CO -0.29 0.83 -0.77 0.87 -0.73 0.00 0.00 179.01 178.92 3lc3 h LYS 241 N 1.13 0.00 -0.53 1.92 1.79 -0.86 -3.37 116.57 116.65 3lc3 h LYS 241 Ca 0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.76 3lc3 h LYS 241 Cb 0.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 3lc3 h LYS 241 CO -0.05 0.31 0.00 0.25 -1.08 0.00 0.00 179.45 178.88 3lc3 n THR 242 N -3.04 2.10 -1.79 -0.16 -2.24 -0.71 -5.00 114.28 103.44 3lc3 n THR 242 Ca -0.01 -1.37 -0.41 0.00 -2.27 0.00 0.00 64.05 59.98 3lc3 n THR 242 Cb 0.71 -0.02 -0.01 0.00 -2.10 0.00 0.00 70.33 68.92 3lc3 n THR 242 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3lc3 s LYS 243 N -2.21 4.11 0.07 -0.78 1.02 -1.24 -4.95 119.74 115.76 3lc3 s LYS 243 Ca 0.48 2.58 -0.12 0.00 0.02 0.00 0.00 55.97 58.93 3lc3 s LYS 243 Cb 0.34 -2.98 -0.06 0.00 -0.52 0.00 0.00 37.83 34.60 3lc3 s LYS 243 CO 0.19 -0.58 0.43 -0.51 -0.92 0.00 0.00 175.35 173.96 3lc3 s LEU 244 N -1.55 4.38 0.00 3.17 1.43 -1.26 -5.15 118.68 119.70 3lc3 s LEU 244 Ca 0.56 0.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.56 3lc3 s LEU 244 Cb -0.47 -2.93 0.00 0.00 0.03 0.00 0.00 46.19 42.82 3lc3 s LEU 244 CO 0.58 0.20 0.33 0.35 0.23 0.00 0.00 176.35 178.05