#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ila s PHE 13 N 0.00 1.70 -0.10 1.08 0.08 -1.26 -2.05 117.98 117.42 3ila s PHE 13 Ca 0.00 -0.38 -0.30 0.00 0.12 0.00 0.00 56.93 56.37 3ila s PHE 13 Cb 0.00 -0.99 -0.02 0.00 -0.57 0.00 0.00 43.02 41.44 3ila s PHE 13 CO 0.00 0.11 1.22 -0.51 -0.10 0.00 0.00 175.22 175.94 3ila s LEU 14 N -1.36 4.24 0.40 -0.37 1.43 -0.23 -4.84 118.68 117.95 3ila s LEU 14 Ca 0.06 1.75 0.08 0.00 -1.03 0.00 0.00 54.13 54.99 3ila s LEU 14 Cb -0.09 -3.55 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 3ila s LEU 14 CO 0.02 -0.65 0.37 0.00 0.23 0.00 0.00 176.35 176.32 3ila s ARG 15 N 2.73 2.59 0.82 1.70 1.04 -1.26 -0.37 118.95 126.19 3ila s ARG 15 Ca 0.55 -1.47 -0.11 0.00 -1.04 0.00 0.00 55.73 53.66 3ila s ARG 15 Cb -0.23 -2.42 0.08 0.00 -2.04 0.00 0.00 34.95 30.34 3ila s ARG 15 CO 0.19 -0.14 1.09 0.95 -0.04 0.00 0.00 175.30 177.35 3ila s THR 16 N -2.43 3.07 -1.38 4.99 -4.23 0.92 -3.60 115.64 112.99 3ila s THR 16 Ca 0.47 0.35 0.00 0.00 -1.18 0.00 0.00 61.69 61.33 3ila s THR 16 Cb -0.04 -2.98 0.00 0.00 1.34 0.00 0.00 72.50 70.82 3ila s THR 16 CO 0.28 -0.45 0.00 0.47 -0.54 0.00 0.00 174.62 174.38 3ila n ASP 17 N -3.55 -5.56 -4.81 3.99 8.00 0.34 -4.68 116.55 110.28 3ila n ASP 17 Ca 0.07 0.32 -0.38 0.00 0.71 0.00 0.00 54.79 55.52 3ila n ASP 17 Cb 0.55 -4.20 -0.06 0.00 -0.02 0.00 0.00 41.12 37.39 3ila n ASP 17 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3ila s ASP 18 N -2.51 7.13 -0.30 -2.24 1.11 -1.24 -4.82 116.67 113.80 3ila s ASP 18 Ca 0.00 1.39 -0.18 0.00 0.18 0.00 0.00 52.55 53.94 3ila s ASP 18 Cb 0.00 -2.41 -0.02 0.00 1.07 0.00 0.00 42.92 41.57 3ila s ASP 18 CO 0.00 0.17 0.53 -1.61 1.18 0.00 0.00 175.17 175.44 3ila s GLU 19 N -1.47 3.91 0.13 8.23 2.02 -1.26 -1.82 118.70 128.44 3ila s GLU 19 Ca 0.36 0.17 0.07 0.00 0.02 0.00 0.00 54.97 55.59 3ila s GLU 19 Cb -0.19 -3.71 -0.04 0.00 0.10 0.00 0.00 34.13 30.29 3ila s GLU 19 CO 0.22 -0.47 -0.17 0.14 0.02 0.00 0.00 175.26 174.99 3ila s VAL 20 N 2.38 1.61 -0.20 2.63 -7.23 0.15 -4.19 120.40 115.54 3ila s VAL 20 Ca 0.21 -1.73 -0.04 0.00 -1.81 0.00 0.00 61.98 58.61 3ila s VAL 20 Cb -0.15 -1.64 -0.01 0.00 0.56 0.00 0.00 36.38 35.14 3ila s VAL 20 CO 0.11 -0.28 -0.04 0.68 -0.31 0.00 0.00 175.10 175.26 3ila s VAL 21 N -1.81 3.52 -0.38 1.32 -7.23 -0.92 -1.03 120.40 113.86 3ila s VAL 21 Ca 0.10 -0.46 -0.27 0.00 -1.81 0.00 0.00 61.98 59.55 3ila s VAL 21 Cb -0.07 -2.59 0.02 0.00 0.56 0.00 0.00 36.38 34.31 3ila s VAL 21 CO 0.05 0.44 0.97 -0.76 -0.31 0.00 0.00 175.10 175.48 3ila s LEU 22 N 1.20 3.95 0.09 1.32 1.02 -1.26 -2.99 118.68 122.01 3ila s LEU 22 Ca 0.03 0.58 0.09 0.00 0.02 0.00 0.00 54.13 54.85 3ila s LEU 22 Cb -0.14 -3.32 -0.03 0.00 0.02 0.00 0.00 46.19 42.71 3ila s LEU 22 CO -0.01 -0.92 -0.24 -1.10 0.02 0.00 0.00 176.35 174.10 3ila s GLN 23 N 3.63 1.41 0.07 1.70 -0.21 0.02 -0.44 119.66 125.84 3ila s GLN 23 Ca 0.40 -1.16 0.01 0.00 0.02 0.00 0.00 55.36 54.62 3ila s GLN 23 Cb -0.11 -1.70 -0.04 0.00 1.00 0.00 0.00 33.01 32.16 3ila s GLN 23 CO 0.20 0.42 -0.05 0.00 -2.12 0.00 0.00 175.29 173.74 3ila s SER 25 N -2.77 5.90 0.04 0.00 0.01 -1.26 -2.18 113.70 113.43 3ila s SER 25 Ca 0.06 0.04 0.09 0.00 1.31 0.00 0.00 55.95 57.45 3ila s SER 25 Cb 0.04 -2.07 -0.03 0.00 0.21 0.00 0.00 66.02 64.18 3ila s SER 25 CO -0.06 0.04 -0.24 0.00 0.41 0.00 0.00 173.24 173.38 3ila s ALA 26 N 1.21 2.33 -0.46 1.44 0.00 -0.73 -4.96 121.76 120.59 3ila s ALA 26 Ca 0.07 -1.24 -0.11 0.00 0.00 0.00 0.00 51.96 50.68 3ila s ALA 26 Cb -0.14 -0.55 0.10 0.00 0.00 0.00 0.00 23.12 22.52 3ila s ALA 26 CO 0.05 0.54 0.34 0.99 0.00 0.00 0.00 175.76 177.69 3ila s THR 27 N -0.82 4.53 -0.18 0.00 2.01 -1.26 -0.41 115.64 119.51 3ila s THR 27 Ca 0.12 -1.48 0.15 0.00 0.31 0.00 0.00 61.69 60.80 3ila s THR 27 Cb -0.10 -3.85 0.44 0.00 0.01 0.00 0.00 72.50 69.01 3ila s THR 27 CO 0.02 -0.66 1.19 0.55 -0.69 0.00 0.00 174.62 175.04 3ila n VAL 28 N 5.01 1.63 0.00 3.82 3.14 -1.26 -5.02 118.33 125.65 3ila n VAL 28 Ca -0.10 -2.89 0.11 0.00 -2.96 0.00 0.00 64.34 58.50 3ila n VAL 28 Cb 0.42 0.06 0.17 0.00 -1.06 0.00 0.00 33.84 33.44 3ila n VAL 28 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 3ila n LYS 30 N -0.57 0.01 -4.41 1.45 0.00 -1.26 -5.00 118.16 108.39 3ila n LYS 30 Ca 0.20 0.68 -0.26 0.00 -0.00 0.00 0.00 58.31 58.93 3ila n LYS 30 Cb 0.88 -1.74 -0.10 0.00 -0.00 0.00 0.00 35.03 34.07 3ila n LYS 30 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 3ila s GLU 31 N -3.41 1.72 0.15 -1.58 -1.05 -1.26 -5.12 118.70 108.14 3ila s GLU 31 Ca -0.01 -1.56 -0.28 0.00 -0.15 0.00 0.00 54.97 52.97 3ila s GLU 31 Cb 0.06 -1.89 -0.07 0.00 -0.44 0.00 0.00 34.13 31.78 3ila s GLU 31 CO 0.19 0.38 0.88 1.14 0.95 0.00 0.00 175.26 178.80 3ila s GLN 32 N -3.05 4.69 0.19 -4.83 1.03 -1.26 -4.61 119.66 111.81 3ila s GLN 32 Ca 0.25 1.33 0.11 0.00 0.04 0.00 0.00 55.36 57.10 3ila s GLN 32 Cb -0.07 -3.32 -0.04 0.00 0.03 0.00 0.00 33.01 29.61 3ila s GLN 32 CO 0.13 0.40 -0.23 -0.51 -2.54 0.00 0.00 175.29 172.54 3ila s LEU 33 N -0.63 2.44 -0.38 2.60 1.43 0.45 -4.97 118.68 119.62 3ila s LEU 33 Ca 0.41 -0.87 -0.05 0.00 -1.03 0.00 0.00 54.13 52.59 3ila s LEU 33 Cb -0.24 -1.13 0.08 0.00 0.03 0.00 0.00 46.19 44.94 3ila s LEU 33 CO 0.29 0.10 0.17 -1.59 0.23 0.00 0.00 176.35 175.55 3ila s LYS 34 N -2.70 2.32 0.16 1.70 0.00 -1.26 -1.78 119.74 118.18 3ila s LYS 34 Ca 0.20 -1.55 0.04 0.00 0.00 0.00 0.00 55.97 54.67 3ila s LYS 34 Cb -0.08 -3.55 -0.04 0.00 0.00 0.00 0.00 37.83 34.16 3ila s LYS 34 CO 0.10 -0.92 0.18 -0.51 0.00 0.00 0.00 175.35 174.20 3ila s LEU 35 N 1.27 3.95 -0.01 2.77 1.43 -0.93 -1.05 118.68 126.11 3ila s LEU 35 Ca 0.03 -0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.06 3ila s LEU 35 Cb -0.22 -2.54 -0.00 0.00 0.03 0.00 0.00 46.19 43.46 3ila s LEU 35 CO -0.01 0.06 0.04 0.00 0.23 0.00 0.00 176.35 176.67 3ila s LEU 37 N -0.42 4.37 0.03 0.00 2.96 0.42 -2.32 118.68 123.72 3ila s LEU 37 Ca -0.05 2.47 0.04 0.00 -0.22 0.00 0.00 54.13 56.37 3ila s LEU 37 Cb -0.03 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.10 3ila s LEU 37 CO -0.00 -0.96 -0.12 0.00 -1.32 0.00 0.00 176.35 173.95 3ila s ALA 38 N 3.68 0.99 0.12 5.97 0.00 0.23 -4.52 121.76 128.23 3ila s ALA 38 Ca 0.78 -0.71 -0.09 0.00 0.00 0.00 0.00 51.96 51.94 3ila s ALA 38 Cb -0.39 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 22.57 3ila s ALA 38 CO 0.34 0.18 0.23 0.00 0.00 0.00 0.00 175.76 176.51 3ila s ALA 39 N -0.77 -0.13 0.01 0.00 0.00 -0.93 -0.28 121.76 119.68 3ila s ALA 39 Ca 0.00 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.25 3ila s ALA 39 Cb -0.07 0.65 -0.01 0.00 0.00 0.00 0.00 23.12 23.69 3ila s ALA 39 CO 0.01 -0.57 -0.07 -1.21 0.00 0.00 0.00 175.76 173.92 3ila s GLU 40 N -3.91 0.53 0.16 0.00 2.02 -1.26 -4.77 118.70 111.48 3ila s GLU 40 Ca 0.10 -0.43 0.26 0.00 0.02 0.00 0.00 54.97 54.92 3ila s GLU 40 Cb 0.04 -0.45 0.92 0.00 0.10 0.00 0.00 34.13 34.75 3ila s GLU 40 CO -0.06 0.11 1.78 0.41 0.02 0.00 0.00 175.26 177.52 3ila n GLY 41 N 2.37 -1.55 0.12 -1.39 0.00 -1.26 -4.38 105.19 99.10 3ila n GLY 41 Ca -0.17 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 45.95 3ila n GLY 41 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3ila n PHE 42 N -2.05 0.82 0.00 1.61 -0.00 -1.26 -5.12 117.46 111.46 3ila n PHE 42 Ca 0.05 0.29 0.00 0.00 -0.00 0.00 0.00 57.45 57.79 3ila n PHE 42 Cb 0.36 -0.97 0.00 0.00 -0.00 0.00 0.00 39.48 38.88 3ila n PHE 42 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.76 178.23 3ila n LEU 46 N -2.22 -1.17 -4.77 5.98 -0.00 -1.26 -5.21 117.00 108.36 3ila n LEU 46 Ca 0.03 0.00 -0.36 0.00 -0.00 0.00 0.00 56.01 55.69 3ila n LEU 46 Cb 0.30 0.65 -0.08 0.00 -0.00 0.00 0.00 43.42 44.29 3ila n LEU 46 CO 0.24 0.00 -0.20 0.00 -0.00 0.00 0.00 177.39 177.42 3ila s PHE 48 N -0.37 2.12 -0.17 0.00 -0.12 0.62 -4.20 117.98 115.85 3ila s PHE 48 Ca 0.11 -0.58 -0.02 0.00 -0.05 0.00 0.00 56.93 56.38 3ila s PHE 48 Cb -0.12 -1.16 -0.01 0.00 -0.63 0.00 0.00 43.02 41.10 3ila s PHE 48 CO 0.01 0.43 -0.08 -0.51 -0.05 0.00 0.00 175.22 175.03 3ila s LEU 49 N -3.49 2.87 -0.22 -1.99 1.43 -0.97 -0.60 118.68 115.71 3ila s LEU 49 Ca 0.30 -0.32 -0.09 0.00 -1.03 0.00 0.00 54.13 52.98 3ila s LEU 49 Cb 0.02 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 3ila s LEU 49 CO 0.13 0.09 0.11 -1.83 0.23 0.00 0.00 176.35 175.08 3ila s GLU 50 N 0.84 4.00 0.07 1.70 1.03 -0.98 -4.86 118.70 120.50 3ila s GLU 50 Ca -0.02 -0.31 -0.31 0.00 0.03 0.00 0.00 54.97 54.36 3ila s GLU 50 Cb -0.15 -3.39 -0.07 0.00 -0.80 0.00 0.00 34.13 29.73 3ila s GLU 50 CO 0.01 0.13 1.33 -2.14 -1.33 0.00 0.00 175.26 173.26 3ila s PRO 51 N 0.81 4.34 0.47 -4.83 0.02 -1.26 -2.20 135.00 132.35 3ila s PRO 51 Ca 0.06 1.95 -0.21 0.00 0.02 0.00 0.00 61.00 62.81 3ila s PRO 51 Cb -0.13 -3.36 -0.09 0.00 0.02 0.00 0.00 34.50 30.94 3ila s PRO 51 CO 0.02 -0.42 1.04 0.95 -0.33 0.00 0.00 177.00 178.27 3ila s THR 52 N 1.43 3.76 -0.06 0.99 -4.23 -0.21 -4.89 115.64 112.44 3ila s THR 52 Ca 0.62 1.15 -0.21 0.00 -1.18 0.00 0.00 61.69 62.08 3ila s THR 52 Cb -0.33 -3.50 -0.16 0.00 1.34 0.00 0.00 72.50 69.86 3ila s THR 52 CO 0.29 -0.18 0.84 -1.28 -0.54 0.00 0.00 174.62 173.74 3ila h SER 53 N 1.76 -0.17 -0.10 3.99 0.87 -1.95 -3.46 113.55 114.49 3ila h SER 53 Ca -0.49 -0.37 0.00 0.00 -1.23 0.00 0.00 61.79 59.70 3ila h SER 53 Cb 1.22 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 3ila h SER 53 CO 0.60 0.40 0.00 -0.81 -0.53 0.00 0.00 176.83 176.49 3ila n PRO 60 N -4.91 0.00 -3.36 2.24 -0.04 -1.26 -5.16 135.00 122.51 3ila n PRO 60 Ca -0.08 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.27 3ila n PRO 60 Cb 0.26 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.73 3ila n PRO 60 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3ila n ASP 61 N 0.00 -6.58 0.17 3.54 8.00 -1.26 -4.92 116.55 115.50 3ila n ASP 61 Ca 0.00 -0.48 0.04 0.00 0.71 0.00 0.00 54.79 55.06 3ila n ASP 61 Cb 0.00 -3.98 0.22 0.00 -0.02 0.00 0.00 41.12 37.34 3ila n ASP 61 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3ila h LEU 62 N -0.09 0.00 -0.43 0.64 3.38 -2.03 -3.23 115.31 113.54 3ila h LEU 62 Ca -0.30 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.60 3ila h LEU 62 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 3ila h LEU 62 CO 0.35 0.45 -0.04 0.00 0.09 0.00 0.00 178.44 179.29 3ila h ALA 63 N 1.55 0.58 0.00 1.53 0.00 -1.97 -2.57 119.26 118.38 3ila h ALA 63 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3ila h ALA 63 Cb 1.09 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3ila h ALA 63 CO 0.06 0.41 0.00 0.44 0.00 0.00 0.00 179.25 180.16 3ila n ILE 64 N -4.36 0.34 0.87 0.00 -0.00 -1.23 -3.06 119.36 111.91 3ila n ILE 64 Ca -0.00 0.09 0.10 0.00 -0.00 0.00 0.00 62.75 62.93 3ila n ILE 64 Cb 0.32 -0.68 -0.11 0.00 -0.00 0.00 0.00 39.64 39.18 3ila n ILE 64 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3ila s PHE 67 N 0.60 1.46 -0.15 0.00 0.08 -0.20 -1.24 117.98 118.53 3ila s PHE 67 Ca 0.51 -0.37 -0.09 0.00 0.12 0.00 0.00 56.93 57.10 3ila s PHE 67 Cb -0.23 -0.98 -0.05 0.00 -0.57 0.00 0.00 43.02 41.19 3ila s PHE 67 CO 0.29 -0.11 0.16 0.95 -0.10 0.00 0.00 175.22 176.42 3ila s THR 68 N -0.06 5.43 -1.07 0.64 -4.23 0.59 0.30 115.64 117.24 3ila s THR 68 Ca -0.01 0.26 -0.21 0.00 -1.18 0.00 0.00 61.69 60.55 3ila s THR 68 Cb -0.09 -3.46 0.06 0.00 1.34 0.00 0.00 72.50 70.35 3ila s THR 68 CO 0.01 0.53 1.48 -0.76 -0.54 0.00 0.00 174.62 175.34 3ila s LEU 69 N -0.34 3.72 0.00 4.79 1.43 -0.75 -1.48 118.68 126.05 3ila s LEU 69 Ca 0.13 -1.74 -0.25 0.00 -1.03 0.00 0.00 54.13 51.24 3ila s LEU 69 Cb -0.12 -2.56 -0.18 0.00 0.03 0.00 0.00 46.19 43.36 3ila s LEU 69 CO 0.02 -1.39 1.31 -0.08 0.23 0.00 0.00 176.35 176.44 3ila h GLU 70 N 9.21 -0.13 -4.13 1.70 4.81 -1.71 0.97 114.58 125.31 3ila h GLU 70 Ca 0.25 0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 59.32 3ila h GLU 70 Cb 0.98 0.03 -0.20 0.00 0.63 0.00 0.00 28.75 30.19 3ila h GLU 70 CO 1.41 0.24 -0.70 -0.65 -0.73 0.00 0.00 179.01 178.57 3ila s GLN 71 N -4.62 0.42 -0.13 1.92 -0.21 -1.26 -4.49 119.66 111.29 3ila s GLN 71 Ca -0.15 -0.78 -0.03 0.00 0.02 0.00 0.00 55.36 54.42 3ila s GLN 71 Cb 0.02 0.07 0.05 0.00 1.00 0.00 0.00 33.01 34.15 3ila s GLN 71 CO 0.62 -0.05 0.05 0.45 -2.12 0.00 0.00 175.29 174.24 3ila s SER 72 N -1.84 2.06 0.15 5.90 0.15 -1.26 -1.54 113.70 117.33 3ila s SER 72 Ca -0.09 -0.40 0.09 0.00 0.70 0.00 0.00 55.95 56.25 3ila s SER 72 Cb -0.06 -0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 63.86 3ila s SER 72 CO -0.03 -0.28 -0.20 -0.76 1.20 0.00 0.00 173.24 173.17 3ila s LEU 73 N 2.04 2.40 0.76 3.45 1.43 -0.19 -4.95 118.68 123.62 3ila s LEU 73 Ca 0.03 -0.82 -0.11 0.00 -1.03 0.00 0.00 54.13 52.20 3ila s LEU 73 Cb -0.15 -0.90 0.05 0.00 0.03 0.00 0.00 46.19 45.23 3ila s LEU 73 CO -0.07 0.01 1.08 -0.94 0.23 0.00 0.00 176.35 176.67 3ila s SER 74 N -2.47 4.77 0.17 2.29 1.04 -1.26 0.85 113.70 119.09 3ila s SER 74 Ca 0.14 1.42 -0.14 0.00 0.48 0.00 0.00 55.95 57.86 3ila s SER 74 Cb -0.07 -2.20 0.12 0.00 0.10 0.00 0.00 66.02 63.96 3ila s SER 74 CO 0.06 -1.81 1.77 1.62 0.98 0.00 0.00 173.24 175.87 3ila h VAL 75 N -0.98 0.93 -0.22 5.02 3.04 -1.95 -0.24 116.25 121.85 3ila h VAL 75 Ca -0.46 -0.14 -0.14 0.00 -1.01 0.00 0.00 66.70 64.94 3ila h VAL 75 Cb 1.25 0.47 -0.01 0.00 -2.01 0.00 0.00 31.29 30.99 3ila h VAL 75 CO 0.58 0.08 -0.46 0.08 -1.01 0.00 0.00 177.57 176.84 3ila h ARG 76 N 0.42 0.58 -0.58 4.17 -0.00 -1.96 -1.78 114.38 115.22 3ila h ARG 76 Ca 0.21 -0.32 -0.09 0.00 -0.00 0.00 0.00 59.98 59.77 3ila h ARG 76 Cb 0.15 0.02 -0.02 0.00 -0.00 0.00 0.00 29.97 30.11 3ila h ARG 76 CO -0.17 0.92 -0.00 0.00 -0.00 0.00 0.00 179.97 180.72 3ila h ALA 77 N 1.03 0.78 -0.45 0.08 0.00 -1.84 -2.01 119.26 116.86 3ila h ALA 77 Ca 0.03 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 3ila h ALA 77 Cb 0.98 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3ila h ALA 77 CO 0.09 0.62 -0.21 1.25 0.00 0.00 0.00 179.25 180.99 3ila h LEU 78 N 0.91 0.92 -1.22 0.00 5.85 -1.00 -1.55 115.31 119.22 3ila h LEU 78 Ca 0.16 -0.34 -0.08 0.00 0.84 0.00 0.00 57.88 58.47 3ila h LEU 78 Cb 0.55 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3ila h LEU 78 CO 0.03 1.09 -0.38 -0.61 -0.34 0.00 0.00 178.44 178.23 3ila h GLN 79 N 0.78 0.00 0.09 1.25 5.75 -1.18 -2.48 115.11 119.32 3ila h GLN 79 Ca 0.11 0.00 -0.30 0.00 -0.15 0.00 0.00 58.65 58.31 3ila h GLN 79 Cb 0.76 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.29 3ila h GLN 79 CO 0.06 0.38 -1.55 1.49 -2.65 0.00 0.00 178.83 176.56 3ila h GLU 80 N 0.00 0.19 -0.43 1.69 4.81 -1.31 -3.34 114.58 116.19 3ila h GLU 80 Ca -0.00 -0.32 -0.07 0.00 -0.13 0.00 0.00 59.36 58.83 3ila h GLU 80 Cb 0.71 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.19 3ila h GLU 80 CO 0.05 1.01 -0.04 0.52 -0.73 0.00 0.00 179.01 179.82 3ila h MET 81 N 0.05 0.73 -0.03 1.92 2.07 -1.15 -2.77 114.93 115.75 3ila h MET 81 Ca -0.24 -0.20 -0.10 0.00 -2.07 0.00 0.00 59.70 57.09 3ila h MET 81 Cb 1.99 -0.08 -0.01 0.00 -1.87 0.00 0.00 31.60 31.63 3ila h MET 81 CO 0.14 0.77 -0.44 -0.07 1.07 0.00 0.00 176.91 178.38 3ila h LEU 82 N 0.68 0.07 -0.04 1.22 3.38 -1.59 -3.12 115.31 115.91 3ila h LEU 82 Ca 0.13 -0.03 -0.26 0.00 0.09 0.00 0.00 57.88 57.81 3ila h LEU 82 Cb 0.47 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.22 3ila h LEU 82 CO 0.02 0.50 -1.06 0.00 0.09 0.00 0.00 178.44 177.99 3ila h ALA 83 N 1.50 0.19 -3.00 1.53 0.00 -1.64 -3.51 119.26 114.33 3ila h ALA 83 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 3ila h ALA 83 Cb 0.80 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3ila h ALA 83 CO 0.06 0.76 0.00 0.27 0.00 0.00 0.00 179.25 180.34 3ila n ASN 84 N -3.78 0.00 -0.08 0.00 2.04 -1.06 -5.14 115.26 107.24 3ila n ASN 84 Ca -0.10 0.00 0.01 0.00 -0.44 0.00 0.00 54.58 54.05 3ila n ASN 84 Cb 0.90 0.00 -0.00 0.00 -2.53 0.00 0.00 39.78 38.14 3ila n ASN 84 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3ila n GLY 97 N 2.92 -2.20 2.70 4.83 0.00 -1.26 -5.11 105.19 107.07 3ila n GLY 97 Ca 0.00 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 3ila n GLY 97 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ila n HIS 98 N -0.92 2.83 -2.45 1.61 -0.00 -1.26 -4.75 115.22 110.29 3ila n HIS 98 Ca 0.00 -2.83 -0.41 0.00 -0.00 0.00 0.00 57.72 54.48 3ila n HIS 98 Cb 0.03 -2.00 -0.04 0.00 -0.00 0.00 0.00 29.99 27.98 3ila n HIS 98 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 3ila s ARG 99 N 0.25 4.58 0.23 -0.41 1.81 -1.26 -4.56 118.95 119.59 3ila s ARG 99 Ca 0.47 1.81 -0.30 0.00 -1.72 0.00 0.00 55.73 55.98 3ila s ARG 99 Cb 0.13 -3.23 -0.09 0.00 -0.45 0.00 0.00 34.95 31.32 3ila s ARG 99 CO -0.04 0.08 1.04 0.99 -0.68 0.00 0.00 175.30 176.70 3ila s THR 100 N -0.60 3.83 0.08 0.02 2.01 -1.26 -0.05 115.64 119.67 3ila s THR 100 Ca 0.48 1.74 -0.30 0.00 0.31 0.00 0.00 61.69 63.92 3ila s THR 100 Cb -0.32 -4.11 -0.06 0.00 0.01 0.00 0.00 72.50 68.03 3ila s THR 100 CO 0.38 0.37 1.11 -0.76 -0.69 0.00 0.00 174.62 175.04 3ila s LEU 101 N -0.97 4.41 0.01 4.42 1.02 0.50 -4.93 118.68 123.14 3ila s LEU 101 Ca 0.45 1.94 0.08 0.00 0.02 0.00 0.00 54.13 56.62 3ila s LEU 101 Cb -0.29 -3.58 -0.02 0.00 0.02 0.00 0.00 46.19 42.31 3ila s LEU 101 CO 0.36 -0.34 -0.24 -0.76 0.02 0.00 0.00 176.35 175.39 3ila s LEU 102 N 0.62 2.11 0.20 1.79 1.43 -1.26 -0.39 118.68 123.17 3ila s LEU 102 Ca 0.54 -0.50 -0.31 0.00 -1.03 0.00 0.00 54.13 52.82 3ila s LEU 102 Cb -0.27 -1.21 -0.11 0.00 0.03 0.00 0.00 46.19 44.63 3ila s LEU 102 CO 0.30 0.26 1.60 -0.31 0.23 0.00 0.00 176.35 178.44 3ila s TYR 103 N -0.69 2.99 0.00 0.29 2.02 -0.36 -2.23 117.35 119.37 3ila s TYR 103 Ca 0.10 0.60 0.00 0.00 -0.37 0.00 0.00 57.07 57.40 3ila s TYR 103 Cb -0.09 -3.99 0.00 0.00 -0.40 0.00 0.00 41.96 37.48 3ila s TYR 103 CO 0.01 -3.61 0.00 0.41 -1.57 0.00 0.00 175.55 170.79 3ila n GLY 104 N 3.52 2.45 3.82 0.71 0.00 0.46 -1.02 105.19 115.14 3ila n GLY 104 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 3ila n GLY 104 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3ila s HIS 105 N -2.33 3.34 -0.01 1.61 3.76 -0.95 -4.37 115.29 116.34 3ila s HIS 105 Ca 0.00 1.58 -0.14 0.00 -0.15 0.00 0.00 55.06 56.34 3ila s HIS 105 Cb 0.00 -2.84 -0.06 0.00 1.11 0.00 0.00 32.58 30.79 3ila s HIS 105 CO 0.00 -0.19 0.39 0.00 -0.85 0.00 0.00 174.74 174.10 3ila s ALA 106 N -2.28 3.70 0.20 -1.40 0.00 0.25 -2.06 121.76 120.16 3ila s ALA 106 Ca 0.61 -0.24 0.11 0.00 0.00 0.00 0.00 51.96 52.44 3ila s ALA 106 Cb -0.09 -2.37 -0.04 0.00 0.00 0.00 0.00 23.12 20.61 3ila s ALA 106 CO 0.18 0.46 -0.22 0.96 0.00 0.00 0.00 175.76 177.13 3ila s ILE 107 N -0.98 2.26 -0.21 0.00 -4.36 0.20 -1.02 121.20 117.08 3ila s ILE 107 Ca 0.23 -2.05 -0.04 0.00 -0.26 0.00 0.00 60.65 58.53 3ila s ILE 107 Cb -0.16 -2.09 -0.01 0.00 1.25 0.00 0.00 42.46 41.45 3ila s ILE 107 CO 0.13 -0.18 -0.02 -0.22 0.24 0.00 0.00 174.94 174.88 3ila s LEU 108 N -2.76 3.03 -0.34 0.37 2.96 -0.59 -1.76 118.68 119.59 3ila s LEU 108 Ca 0.21 -0.32 -0.08 0.00 -0.22 0.00 0.00 54.13 53.71 3ila s LEU 108 Cb -0.07 -1.77 0.03 0.00 0.50 0.00 0.00 46.19 44.87 3ila s LEU 108 CO 0.10 0.01 0.14 -0.76 -1.32 0.00 0.00 176.35 174.52 3ila s LEU 109 N 1.33 4.38 -0.26 -0.68 1.43 -1.26 -1.86 118.68 121.76 3ila s LEU 109 Ca 0.04 -0.97 -0.08 0.00 -1.03 0.00 0.00 54.13 52.09 3ila s LEU 109 Cb -0.14 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.10 3ila s LEU 109 CO -0.01 -0.32 0.10 -0.60 0.23 0.00 0.00 176.35 175.76 3ila s ARG 110 N 1.49 3.68 0.09 1.70 3.52 -0.55 -1.15 118.95 127.74 3ila s ARG 110 Ca 0.01 -0.47 -0.31 0.00 -0.13 0.00 0.00 55.73 54.83 3ila s ARG 110 Cb -0.19 -3.42 -0.10 0.00 -1.56 0.00 0.00 34.95 29.68 3ila s ARG 110 CO 0.05 -0.21 1.82 -1.58 -0.81 0.00 0.00 175.30 174.57 3ila s HIS 111 N 1.65 2.01 0.13 5.12 5.65 0.41 -0.30 115.29 129.96 3ila s HIS 111 Ca 0.06 -0.05 -0.12 0.00 0.25 0.00 0.00 55.06 55.20 3ila s HIS 111 Cb -0.15 -4.15 -0.04 0.00 -1.18 0.00 0.00 32.58 27.06 3ila s HIS 111 CO 0.05 -4.83 1.49 0.00 -0.65 0.00 0.00 174.74 170.81 3ila h ALA 112 N 8.98 0.56 -0.11 1.58 0.00 -1.46 -0.41 119.26 128.40 3ila h ALA 112 Ca -0.46 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 53.96 3ila h ALA 112 Cb 1.22 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3ila h ALA 112 CO 0.94 0.57 -0.30 1.25 0.00 0.00 0.00 179.25 181.71 3ila h HIS 113 N 0.68 0.53 0.00 0.00 -0.00 -1.79 -3.32 115.15 111.25 3ila h HIS 113 Ca 0.08 -0.21 0.00 0.00 -0.00 0.00 0.00 60.37 60.24 3ila h HIS 113 Cb 0.83 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 28.15 3ila h HIS 113 CO 0.06 0.92 -0.82 -1.13 -0.00 0.00 0.00 177.93 176.96 3ila n SER 114 N -4.41 0.74 0.00 3.26 3.41 -1.25 -4.96 113.62 110.42 3ila n SER 114 Ca -0.07 -0.60 0.00 0.00 -0.26 0.00 0.00 58.87 57.94 3ila n SER 114 Cb 0.48 0.70 0.00 0.00 -0.26 0.00 0.00 64.21 65.13 3ila n SER 114 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3ila n ARG 115 N -1.57 -0.99 -2.70 4.33 -4.01 -0.16 -4.97 116.66 106.59 3ila n ARG 115 Ca 0.04 0.25 -0.26 0.00 -1.04 0.00 0.00 57.85 56.84 3ila n ARG 115 Cb 0.35 -4.43 0.01 0.00 -3.04 0.00 0.00 32.46 25.35 3ila n ARG 115 CO 0.00 0.00 0.00 -1.64 -3.04 0.00 0.00 177.63 172.95 3ila s MET 116 N -1.31 3.29 -0.15 2.89 -1.94 -1.24 -4.79 119.30 116.05 3ila s MET 116 Ca 0.00 -0.02 -0.07 0.00 -1.71 0.00 0.00 55.69 53.90 3ila s MET 116 Cb 0.00 -2.40 -0.04 0.00 2.01 0.00 0.00 34.83 34.40 3ila s MET 116 CO 0.00 -0.32 0.08 0.71 -0.01 0.00 0.00 175.02 175.48 3ila s TYR 117 N -2.74 3.34 -0.02 -0.03 2.02 0.10 -0.45 117.35 119.58 3ila s TYR 117 Ca 0.49 0.24 -0.30 0.00 -0.37 0.00 0.00 57.07 57.12 3ila s TYR 117 Cb -0.10 -2.00 -0.06 0.00 -0.40 0.00 0.00 41.96 39.40 3ila s TYR 117 CO 0.43 0.37 1.51 -1.17 -1.57 0.00 0.00 175.55 175.12 3ila s LEU 118 N -0.21 4.31 0.11 -1.29 2.96 -0.30 -0.34 118.68 123.93 3ila s LEU 118 Ca 0.08 2.17 -0.01 0.00 -0.22 0.00 0.00 54.13 56.16 3ila s LEU 118 Cb -0.12 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 3ila s LEU 118 CO 0.01 -0.82 0.03 -0.94 -1.32 0.00 0.00 176.35 173.32 3ila s SER 119 N 2.43 0.40 -0.45 3.68 1.04 -0.16 -4.56 113.70 116.08 3ila s SER 119 Ca 0.68 -1.15 -0.16 0.00 0.48 0.00 0.00 55.95 55.79 3ila s SER 119 Cb -0.32 0.26 0.05 0.00 0.10 0.00 0.00 66.02 66.11 3ila s SER 119 CO 0.27 -0.69 0.40 0.00 0.98 0.00 0.00 173.24 174.21 3ila s LEU 121 N 1.84 2.77 0.33 0.00 1.02 0.06 -4.83 118.68 119.87 3ila s LEU 121 Ca 0.07 1.24 0.25 0.00 0.02 0.00 0.00 54.13 55.71 3ila s LEU 121 Cb -0.21 -3.95 0.67 0.00 0.02 0.00 0.00 46.19 42.71 3ila s LEU 121 CO 0.09 -1.64 1.72 0.74 0.02 0.00 0.00 176.35 177.28 3ila h THR 122 N -0.86 0.00 -3.30 5.49 2.02 -1.98 -3.36 112.91 110.92 3ila h THR 122 Ca -0.46 -0.67 -0.53 0.00 0.77 0.00 0.00 66.41 65.52 3ila h THR 122 Cb 1.26 1.66 0.01 0.00 -1.74 0.00 0.00 68.15 69.33 3ila h THR 122 CO 0.61 0.00 0.55 0.42 0.37 0.00 0.00 175.52 177.47 3ila s THR 123 N -3.20 3.92 0.95 3.16 -4.23 -1.26 -4.91 115.64 110.07 3ila s THR 123 Ca 0.08 1.45 -0.15 0.00 -1.18 0.00 0.00 61.69 61.89 3ila s THR 123 Cb 0.09 -3.93 0.18 0.00 1.34 0.00 0.00 72.50 70.18 3ila s THR 123 CO 0.61 0.16 1.27 -0.44 -0.54 0.00 0.00 174.62 175.68 3ila s SER 124 N 0.72 3.24 0.00 3.99 0.01 -1.26 -0.55 113.70 119.85 3ila s SER 124 Ca 0.56 0.42 0.00 0.00 1.31 0.00 0.00 55.95 58.24 3ila s SER 124 Cb -0.30 -0.58 0.00 0.00 0.21 0.00 0.00 66.02 65.35 3ila s SER 124 CO 0.31 -2.67 0.00 -2.11 0.41 0.00 0.00 173.24 169.19 3ila n ARG 125 N -3.75 0.49 0.00 12.44 1.85 -1.26 -4.55 116.66 121.88 3ila n ARG 125 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.98 3ila n ARG 125 Cb 0.60 -0.71 0.00 0.00 -1.05 0.00 0.00 32.46 31.30 3ila n ARG 125 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 3ila n LEU 131 N -1.68 0.00 -3.99 2.89 -0.00 -1.26 -5.12 117.00 107.84 3ila n LEU 131 Ca 0.00 -0.11 -0.22 0.00 -0.00 0.00 0.00 56.01 55.69 3ila n LEU 131 Cb 0.21 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.47 3ila n LEU 131 CO 0.00 -0.30 -0.44 0.00 -0.00 0.00 0.00 177.39 176.65 3ila s ALA 132 N 0.65 0.95 0.18 1.96 0.00 -1.26 -4.64 121.76 119.60 3ila s ALA 132 Ca 0.00 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 51.69 3ila s ALA 132 Cb 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.68 3ila s ALA 132 CO 0.00 0.11 0.26 -0.06 0.00 0.00 0.00 175.76 176.07 3ila s PHE 133 N 0.44 3.37 0.47 0.00 0.08 -0.03 -4.40 117.98 117.90 3ila s PHE 133 Ca -0.08 0.04 -0.19 0.00 0.12 0.00 0.00 56.93 56.82 3ila s PHE 133 Cb -0.12 -1.59 -0.10 0.00 -0.57 0.00 0.00 43.02 40.65 3ila s PHE 133 CO 0.01 0.50 0.97 -0.51 -0.10 0.00 0.00 175.22 176.10 3ila s ASP 134 N -3.40 6.77 -0.17 1.36 1.01 0.29 -0.63 116.67 121.90 3ila s ASP 134 Ca 0.33 1.66 0.00 0.00 0.71 0.00 0.00 52.55 55.26 3ila s ASP 134 Cb -0.10 -2.53 0.03 0.00 1.01 0.00 0.00 42.92 41.33 3ila s ASP 134 CO 0.27 -0.48 -0.12 -0.69 0.21 0.00 0.00 175.17 174.36 3ila s VAL 135 N -2.33 1.54 0.11 -1.27 1.01 -1.26 -0.76 120.40 117.44 3ila s VAL 135 Ca 0.61 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.83 3ila s VAL 135 Cb -0.10 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.74 3ila s VAL 135 CO 0.20 0.31 0.13 0.61 0.00 0.00 0.00 175.10 176.35 3ila n GLY 136 N 4.75 3.24 3.87 4.51 0.00 -0.85 -4.11 105.19 116.60 3ila n GLY 136 Ca -0.15 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 43.97 3ila n GLY 136 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ila s LEU 137 N 0.00 3.63 -0.17 0.99 1.43 -1.26 -0.99 118.68 122.31 3ila s LEU 137 Ca 0.11 1.26 -0.06 0.00 -1.03 0.00 0.00 54.13 54.41 3ila s LEU 137 Cb 0.00 -4.20 0.08 0.00 0.03 0.00 0.00 46.19 42.10 3ila s LEU 137 CO 0.08 -0.56 0.36 -1.58 0.23 0.00 0.00 176.35 174.88 3ila s GLN 138 N -4.31 0.26 0.17 1.70 0.74 0.53 -4.86 119.66 113.90 3ila s GLN 138 Ca 0.53 0.92 -0.12 0.00 0.05 0.00 0.00 55.36 56.75 3ila s GLN 138 Cb -0.10 0.19 0.06 0.00 1.10 0.00 0.00 33.01 34.25 3ila s GLN 138 CO 0.38 -0.26 1.67 1.05 -0.55 0.00 0.00 175.29 177.58 3ila h GLU 139 N 8.15 0.92 -7.01 1.67 -0.00 -1.93 0.29 114.58 116.67 3ila h GLU 139 Ca -0.16 -0.22 -0.51 0.00 -0.00 0.00 0.00 59.36 58.46 3ila h GLU 139 Cb 1.11 -0.12 0.07 0.00 -0.00 0.00 0.00 28.75 29.81 3ila h GLU 139 CO 0.14 0.86 0.48 0.34 -0.00 0.00 0.00 179.01 180.82 3ila s ASP 140 N -6.26 6.09 0.00 3.06 2.15 -1.26 -4.73 116.67 115.72 3ila s ASP 140 Ca -0.13 2.30 0.03 0.00 0.43 0.00 0.00 52.55 55.18 3ila s ASP 140 Cb 0.13 -2.60 0.01 0.00 -0.30 0.00 0.00 42.92 40.15 3ila s ASP 140 CO 0.81 -0.97 0.43 0.00 -0.17 0.00 0.00 175.17 175.27 3ila n ALA 141 N -0.61 2.44 -1.86 3.66 0.00 -1.26 -4.72 120.51 118.16 3ila n ALA 141 Ca 0.08 -0.38 -0.34 0.00 0.00 0.00 0.00 53.44 52.80 3ila n ALA 141 Cb 0.48 -0.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.78 3ila n ALA 141 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3ila s THR 142 N -0.54 4.39 0.00 0.00 -4.23 -1.26 -4.85 115.64 109.14 3ila s THR 142 Ca 0.02 1.50 0.00 0.00 -1.18 0.00 0.00 61.69 62.03 3ila s THR 142 Cb 0.02 -3.70 0.00 0.00 1.34 0.00 0.00 72.50 70.16 3ila s THR 142 CO 0.05 -0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.56 3ila n GLY 143 N -0.29 1.95 0.18 3.99 0.00 -1.26 -4.77 105.19 104.99 3ila n GLY 143 Ca 0.05 -1.94 0.01 0.00 0.00 0.00 0.00 46.02 44.14 3ila n GLY 143 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ila h GLU 144 N 0.00 0.05 -0.73 1.61 5.08 -1.96 -3.31 114.58 115.31 3ila h GLU 144 Ca 0.00 -0.02 0.21 0.00 -1.00 0.00 0.00 59.36 58.55 3ila h GLU 144 Cb 0.00 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 3ila h GLU 144 CO 0.00 0.46 0.62 0.00 -1.00 0.00 0.00 179.01 179.09 3ila h ALA 145 N 1.54 2.58 -0.01 3.43 0.00 -1.88 0.21 119.26 125.13 3ila h ALA 145 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ila h ALA 145 Cb 0.76 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3ila h ALA 145 CO 0.06 -0.99 -0.24 0.00 0.00 0.00 0.00 179.25 178.08 3ila s TRP 147 N -2.54 3.41 -0.05 0.00 0.52 0.74 -4.35 118.94 116.67 3ila s TRP 147 Ca 0.24 0.37 0.01 0.00 0.02 0.00 0.00 56.10 56.74 3ila s TRP 147 Cb 0.19 -1.90 0.02 0.00 -1.15 0.00 0.00 33.47 30.63 3ila s TRP 147 CO 0.52 0.59 -0.05 -1.58 0.02 0.00 0.00 176.95 176.45 3ila s TRP 148 N -0.83 0.84 0.08 -1.98 0.52 -0.72 -2.06 118.94 114.79 3ila s TRP 148 Ca 0.13 -0.26 -0.13 0.00 0.02 0.00 0.00 56.10 55.86 3ila s TRP 148 Cb -0.12 -0.74 -0.06 0.00 -1.15 0.00 0.00 33.47 31.40 3ila s TRP 148 CO 0.03 -0.23 0.46 0.95 0.02 0.00 0.00 176.95 178.18 3ila s THR 149 N 1.03 4.97 -0.22 2.01 -4.23 0.84 0.58 115.64 120.61 3ila s THR 149 Ca -0.09 0.75 -0.10 0.00 -1.18 0.00 0.00 61.69 61.07 3ila s THR 149 Cb -0.14 -3.71 -0.05 0.00 1.34 0.00 0.00 72.50 69.93 3ila s THR 149 CO -0.00 0.38 0.14 -0.04 -0.54 0.00 0.00 174.62 174.56 3ila s MET 150 N -1.61 4.08 0.01 3.99 -1.94 -0.88 -1.47 119.30 121.49 3ila s MET 150 Ca 0.31 -0.27 0.04 0.00 -1.71 0.00 0.00 55.69 54.07 3ila s MET 150 Cb -0.16 -3.47 -0.02 0.00 2.01 0.00 0.00 34.83 33.20 3ila s MET 150 CO 0.17 0.14 -0.14 -1.01 -0.01 0.00 0.00 175.02 174.18 3ila s HIS 151 N 0.81 1.23 0.44 -0.03 3.76 0.43 -0.40 115.29 121.53 3ila s HIS 151 Ca 0.07 -0.28 -0.02 0.00 -0.15 0.00 0.00 55.06 54.68 3ila s HIS 151 Cb -0.13 -0.76 -0.02 0.00 1.11 0.00 0.00 32.58 32.78 3ila s HIS 151 CO 0.02 0.01 0.70 -1.25 -0.85 0.00 0.00 174.74 173.36 3ila s PRO 152 N -0.68 3.35 0.14 8.40 0.04 -1.26 0.68 135.00 145.66 3ila s PRO 152 Ca 0.04 -0.15 -0.07 0.00 0.04 0.00 0.00 61.00 60.86 3ila s PRO 152 Cb -0.06 -2.50 -0.06 0.00 0.04 0.00 0.00 34.50 31.92 3ila s PRO 152 CO 0.00 -0.16 1.36 0.00 0.04 0.00 0.00 177.00 178.24 3ila h ALA 153 N 0.39 0.44 -1.25 8.56 0.00 -1.93 -3.45 119.26 122.01 3ila h ALA 153 Ca -0.47 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 53.82 3ila h ALA 153 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3ila h ALA 153 CO 0.60 0.73 0.00 0.43 0.00 0.00 0.00 179.25 181.02 3ila n SER 154 N -3.87 -3.75 -3.78 0.00 7.64 -1.26 -5.18 113.62 103.42 3ila n SER 154 Ca -0.06 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.69 3ila n SER 154 Cb 0.75 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.82 3ila n SER 154 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3ila s GLU 159 N 0.00 0.20 0.00 1.43 2.56 -1.26 -5.29 118.70 116.34 3ila s GLU 159 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 54.97 55.33 3ila s GLU 159 Cb 0.00 0.01 0.00 0.00 2.00 0.00 0.00 34.13 36.14 3ila s GLU 159 CO 0.00 -0.08 0.00 0.41 -0.56 0.00 0.00 175.26 175.03 3ila n GLY 160 N 3.49 0.54 3.84 -1.50 0.00 -0.19 -4.99 105.19 106.39 3ila n GLY 160 Ca -0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 3ila n GLY 160 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ila s GLU 161 N -0.82 3.33 0.27 1.61 2.02 -1.26 -4.65 118.70 119.20 3ila s GLU 161 Ca 0.00 0.89 -0.29 0.00 0.02 0.00 0.00 54.97 55.59 3ila s GLU 161 Cb 0.00 -2.04 -0.09 0.00 0.10 0.00 0.00 34.13 32.09 3ila s GLU 161 CO 0.00 -0.79 1.11 0.15 0.02 0.00 0.00 175.26 175.76 3ila s LYS 162 N -4.94 4.62 -0.24 1.61 1.02 -1.26 -1.23 119.74 119.32 3ila s LYS 162 Ca 0.57 1.82 -0.27 0.00 0.02 0.00 0.00 55.97 58.12 3ila s LYS 162 Cb -0.13 -3.19 0.00 0.00 -0.52 0.00 0.00 37.83 34.00 3ila s LYS 162 CO 0.51 0.17 0.94 0.08 -0.92 0.00 0.00 175.35 176.14 3ila s VAL 163 N -1.07 4.75 0.45 3.17 1.01 0.48 -4.87 120.40 124.32 3ila s VAL 163 Ca 0.45 1.81 -0.06 0.00 0.00 0.00 0.00 61.98 64.18 3ila s VAL 163 Cb -0.32 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.79 3ila s VAL 163 CO 0.41 -0.14 0.76 -0.13 0.00 0.00 0.00 175.10 176.01 3ila s ARG 164 N 3.04 3.60 -0.01 2.72 0.52 -1.26 -1.06 118.95 126.50 3ila s ARG 164 Ca 0.40 0.24 -0.30 0.00 -0.52 0.00 0.00 55.73 55.54 3ila s ARG 164 Cb -0.15 -2.40 -0.05 0.00 0.52 0.00 0.00 34.95 32.86 3ila s ARG 164 CO 0.07 -0.13 1.39 0.08 0.02 0.00 0.00 175.30 176.73 3ila s VAL 165 N -2.60 3.76 0.00 3.52 1.01 -0.87 -2.90 120.40 122.32 3ila s VAL 165 Ca 0.48 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.59 3ila s VAL 165 Cb -0.10 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.55 3ila s VAL 165 CO 0.40 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.11 3ila n GLY 166 N 3.63 1.48 3.75 4.51 0.00 -1.26 -4.93 105.19 112.38 3ila n GLY 166 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 3ila n GLY 166 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ila s ASP 167 N -1.60 6.72 0.01 1.61 1.11 -1.14 -4.93 116.67 118.45 3ila s ASP 167 Ca 0.00 2.65 -0.30 0.00 0.18 0.00 0.00 52.55 55.08 3ila s ASP 167 Cb 0.00 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.32 3ila s ASP 167 CO 0.00 -0.63 1.05 -1.81 1.18 0.00 0.00 175.17 174.97 3ila s ASP 168 N 0.04 7.27 0.32 0.27 1.01 -1.26 -4.38 116.67 119.93 3ila s ASP 168 Ca 0.55 1.76 0.09 0.00 0.71 0.00 0.00 52.55 55.65 3ila s ASP 168 Cb -0.41 -2.57 -0.06 0.00 1.01 0.00 0.00 42.92 40.89 3ila s ASP 168 CO 0.47 -0.35 -0.10 -0.76 0.21 0.00 0.00 175.17 174.65 3ila s LEU 169 N 1.15 2.64 -0.16 1.23 1.43 0.25 -3.87 118.68 121.35 3ila s LEU 169 Ca 0.54 -1.18 0.00 0.00 -1.03 0.00 0.00 54.13 52.46 3ila s LEU 169 Cb -0.23 -0.89 0.00 0.00 0.03 0.00 0.00 46.19 45.09 3ila s LEU 169 CO 0.27 -0.22 -0.16 -0.63 0.23 0.00 0.00 176.35 175.84 3ila s ILE 170 N -2.73 2.57 -0.29 -0.59 -1.09 0.21 -1.30 121.20 117.98 3ila s ILE 170 Ca 0.31 -0.80 -0.07 0.00 -2.23 0.00 0.00 60.65 57.87 3ila s ILE 170 Cb 0.02 -2.08 0.01 0.00 -1.58 0.00 0.00 42.46 38.82 3ila s ILE 170 CO 0.15 0.52 0.08 -0.76 -1.23 0.00 0.00 174.94 173.69 3ila s LEU 171 N 0.89 3.80 -0.16 2.97 1.02 -1.26 -0.43 118.68 125.52 3ila s LEU 171 Ca -0.04 -0.67 -0.03 0.00 0.02 0.00 0.00 54.13 53.40 3ila s LEU 171 Cb -0.15 -1.88 -0.02 0.00 0.02 0.00 0.00 46.19 44.16 3ila s LEU 171 CO -0.02 -0.18 -0.05 -0.69 0.02 0.00 0.00 176.35 175.44 3ila s VAL 172 N 1.50 3.77 0.27 -1.59 1.01 -0.54 -0.28 120.40 124.56 3ila s VAL 172 Ca 0.03 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.32 3ila s VAL 172 Cb -0.17 -2.65 -0.09 0.00 0.00 0.00 0.00 36.38 33.46 3ila s VAL 172 CO 0.02 0.49 1.20 -0.55 0.00 0.00 0.00 175.10 176.26 3ila s SER 173 N 0.46 7.05 0.16 3.32 0.15 -0.56 -0.12 113.70 124.16 3ila s SER 173 Ca -0.04 2.41 -0.06 0.00 0.70 0.00 0.00 55.95 58.95 3ila s SER 173 Cb -0.14 -2.63 0.01 0.00 -1.71 0.00 0.00 66.02 61.54 3ila s SER 173 CO 0.03 -0.33 1.43 0.58 1.20 0.00 0.00 173.24 176.14 3ila h VAL 174 N 3.24 1.31 -0.05 4.45 2.07 -1.61 -1.55 116.25 124.11 3ila h VAL 174 Ca -0.47 -1.90 -0.17 0.00 0.82 0.00 0.00 66.70 64.99 3ila h VAL 174 Cb 1.22 1.86 0.01 0.00 -1.52 0.00 0.00 31.29 32.86 3ila h VAL 174 CO 0.69 0.59 -0.62 0.77 0.02 0.00 0.00 177.57 179.02 3ila h SER 175 N 0.47 0.63 0.00 0.57 4.64 -1.83 -3.38 113.55 114.65 3ila h SER 175 Ca -0.01 -0.70 0.00 0.00 -0.47 0.00 0.00 61.79 60.61 3ila h SER 175 Cb 1.22 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 3ila h SER 175 CO 0.12 1.24 -1.88 -1.54 -0.87 0.00 0.00 176.83 173.91 3ila n SER 176 N -4.17 0.46 0.00 4.97 3.41 -1.25 -4.98 113.62 112.06 3ila n SER 176 Ca -0.09 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 3ila n SER 176 Cb 0.67 1.88 0.00 0.00 -0.26 0.00 0.00 64.21 66.50 3ila n SER 176 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3ila n GLU 177 N -2.17 -0.43 -3.48 4.33 1.02 -0.58 -5.01 120.64 114.31 3ila n GLU 177 Ca -0.03 0.11 -0.36 0.00 -0.02 0.00 0.00 57.16 56.86 3ila n GLU 177 Cb 0.51 -3.56 -0.06 0.00 -0.02 0.00 0.00 31.44 28.31 3ila n GLU 177 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3ila s ARG 178 N -0.61 3.87 0.53 3.49 0.52 -1.26 -4.72 118.95 120.77 3ila s ARG 178 Ca 0.00 0.34 -0.19 0.00 -0.52 0.00 0.00 55.73 55.36 3ila s ARG 178 Cb 0.00 -3.04 -0.07 0.00 0.52 0.00 0.00 34.95 32.37 3ila s ARG 178 CO 0.00 0.57 1.05 0.71 0.02 0.00 0.00 175.30 177.65 3ila s TYR 179 N -1.34 2.96 -0.30 -0.53 2.02 0.54 -1.50 117.35 119.20 3ila s TYR 179 Ca 0.32 1.55 -0.29 0.00 -0.37 0.00 0.00 57.07 58.29 3ila s TYR 179 Cb -0.15 -3.07 -0.01 0.00 -0.40 0.00 0.00 41.96 38.33 3ila s TYR 179 CO 0.17 -1.01 1.55 -1.17 -1.57 0.00 0.00 175.55 173.52 3ila s LEU 180 N -3.85 3.75 0.02 -1.29 2.96 0.62 -2.31 118.68 118.59 3ila s LEU 180 Ca 0.67 1.30 0.08 0.00 -0.22 0.00 0.00 54.13 55.96 3ila s LEU 180 Cb -0.17 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 42.96 3ila s LEU 180 CO 0.26 -1.35 -0.24 -2.28 -1.32 0.00 0.00 176.35 171.42 3ila s HIS 181 N 5.41 2.14 -0.34 5.38 5.65 0.12 -3.80 115.29 129.85 3ila s HIS 181 Ca 0.68 -0.40 -0.21 0.00 0.25 0.00 0.00 55.06 55.38 3ila s HIS 181 Cb -0.20 -1.31 -0.00 0.00 -1.18 0.00 0.00 32.58 29.88 3ila s HIS 181 CO 0.30 0.06 0.66 -1.17 -0.65 0.00 0.00 174.74 173.94 3ila s LEU 182 N -1.00 4.20 -0.10 8.88 2.96 -1.26 -0.54 118.68 131.81 3ila s LEU 182 Ca 0.10 0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 54.27 3ila s LEU 182 Cb -0.09 -2.84 -0.03 0.00 0.50 0.00 0.00 46.19 43.73 3ila s LEU 182 CO 0.01 -0.57 0.03 -0.94 -1.32 0.00 0.00 176.35 173.56 3ila s SER 183 N 1.74 5.50 -0.04 3.68 1.04 -0.25 -4.98 113.70 120.39 3ila s SER 183 Ca 0.26 0.21 0.08 0.00 0.48 0.00 0.00 55.95 56.97 3ila s SER 183 Cb -0.14 -1.64 0.17 0.00 0.10 0.00 0.00 66.02 64.51 3ila s SER 183 CO 0.14 0.37 1.12 0.35 0.98 0.00 0.00 173.24 176.20 3ila n THR 184 N 2.20 1.30 -1.14 2.02 -2.24 -1.26 -1.98 114.28 113.18 3ila n THR 184 Ca -0.19 -1.34 -0.32 0.00 -2.27 0.00 0.00 64.05 59.93 3ila n THR 184 Cb 0.54 0.28 0.12 0.00 -2.10 0.00 0.00 70.33 69.17 3ila n THR 184 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ila s ALA 185 N -1.55 1.93 -0.12 6.98 0.00 -1.24 -3.04 121.76 124.72 3ila s ALA 185 Ca 0.15 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.72 3ila s ALA 185 Cb 0.11 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.83 3ila s ALA 185 CO 0.05 -2.14 0.00 0.45 0.00 0.00 0.00 175.76 174.12 3ila n SER 186 N -3.44 -4.86 0.00 0.00 2.88 -1.26 -0.70 113.62 106.24 3ila n SER 186 Ca 0.12 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 3ila n SER 186 Cb 0.52 -3.02 0.00 0.00 -0.75 0.00 0.00 64.21 60.96 3ila n SER 186 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ila n GLY 187 N 0.74 2.51 3.72 0.46 0.00 -1.17 -5.02 105.19 106.43 3ila n GLY 187 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3ila n GLY 187 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ila s GLU 188 N -0.21 4.61 -0.95 1.61 8.01 0.12 -5.00 118.70 126.88 3ila s GLU 188 Ca 0.00 1.47 -0.16 0.00 0.01 0.00 0.00 54.97 56.29 3ila s GLU 188 Cb 0.00 -3.41 0.17 0.00 -4.31 0.00 0.00 34.13 26.58 3ila s GLU 188 CO 0.00 0.04 1.06 -0.51 0.01 0.00 0.00 175.26 175.87 3ila s LEU 189 N 0.56 5.63 0.34 1.80 2.01 -1.26 -3.70 118.68 124.07 3ila s LEU 189 Ca 0.50 -2.47 0.09 0.00 0.01 0.00 0.00 54.13 52.26 3ila s LEU 189 Cb -0.23 -2.33 -0.07 0.00 0.01 0.00 0.00 46.19 43.57 3ila s LEU 189 CO 0.29 -0.83 -0.07 -1.10 1.01 0.00 0.00 176.35 175.65 3ila s GLN 190 N 1.54 1.79 -0.06 1.70 1.11 -0.84 -2.30 119.66 122.61 3ila s GLN 190 Ca 0.30 -1.94 -0.01 0.00 0.01 0.00 0.00 55.36 53.72 3ila s GLN 190 Cb -0.06 -1.59 -0.03 0.00 -1.01 0.00 0.00 33.01 30.32 3ila s GLN 190 CO -0.08 0.09 0.01 0.54 0.01 0.00 0.00 175.29 175.85 3ila s VAL 191 N -2.71 4.30 0.33 1.09 0.11 -1.26 -1.09 120.40 121.17 3ila s VAL 191 Ca 0.33 -0.35 -0.00 0.00 -2.93 0.00 0.00 61.98 59.03 3ila s VAL 191 Cb 0.04 -2.84 0.00 0.00 -1.53 0.00 0.00 36.38 32.05 3ila s VAL 191 CO 0.16 0.53 0.43 -0.90 -3.33 0.00 0.00 175.10 172.00 3ila n ASP 192 N 1.90 -1.20 -4.16 3.54 5.75 0.29 -4.17 116.55 118.51 3ila n ASP 192 Ca -0.17 -2.85 -0.34 0.00 -0.01 0.00 0.00 54.79 51.42 3ila n ASP 192 Cb 0.53 2.29 -0.15 0.00 -1.03 0.00 0.00 41.12 42.77 3ila n ASP 192 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ila s ALA 193 N -2.81 2.65 0.34 2.12 0.00 0.20 0.11 121.76 124.37 3ila s ALA 193 Ca 0.29 -1.54 0.05 0.00 0.00 0.00 0.00 51.96 50.76 3ila s ALA 193 Cb -0.00 -1.65 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 3ila s ALA 193 CO 0.21 -0.91 0.35 -1.54 0.00 0.00 0.00 175.76 173.87 3ila s SER 194 N 1.26 1.51 0.00 0.00 1.04 -0.98 -0.85 113.70 115.69 3ila s SER 194 Ca -0.02 -1.70 0.22 0.00 0.48 0.00 0.00 55.95 54.93 3ila s SER 194 Cb -0.17 0.60 0.82 0.00 0.10 0.00 0.00 66.02 67.37 3ila s SER 194 CO -0.05 -1.16 1.59 0.49 0.98 0.00 0.00 173.24 175.09 3ila n PHE 195 N -0.62 0.17 -3.35 5.02 3.72 -1.26 -0.34 117.46 120.79 3ila n PHE 195 Ca 0.06 -0.08 -0.39 0.00 -0.05 0.00 0.00 57.45 56.98 3ila n PHE 195 Cb 0.62 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 39.08 3ila n PHE 195 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 3ila s MET 196 N -1.83 4.10 0.61 -1.08 -1.94 -1.26 -4.92 119.30 112.97 3ila s MET 196 Ca 0.33 0.19 -0.11 0.00 -1.71 0.00 0.00 55.69 54.38 3ila s MET 196 Cb 0.18 -3.60 -0.04 0.00 2.01 0.00 0.00 34.83 33.37 3ila s MET 196 CO 0.27 -0.19 1.02 1.14 -0.01 0.00 0.00 175.02 177.25 3ila s GLN 197 N 1.80 3.63 -0.04 2.03 -2.07 -1.26 -4.65 119.66 119.10 3ila s GLN 197 Ca 0.18 0.76 -0.01 0.00 -1.82 0.00 0.00 55.36 54.47 3ila s GLN 197 Cb -0.15 -2.09 0.03 0.00 -1.09 0.00 0.00 33.01 29.71 3ila s GLN 197 CO 0.09 -0.54 0.08 0.99 -1.32 0.00 0.00 175.29 174.59 3ila s THR 198 N -3.13 -0.07 0.15 3.63 2.01 -1.25 -4.87 115.64 112.11 3ila s THR 198 Ca 0.55 0.22 -0.30 0.00 0.31 0.00 0.00 61.69 62.47 3ila s THR 198 Cb -0.11 -0.16 -0.07 0.00 0.01 0.00 0.00 72.50 72.17 3ila s THR 198 CO 0.52 0.09 1.22 -0.76 -0.69 0.00 0.00 174.62 175.01 3ila s LEU 199 N 1.23 4.42 0.02 4.42 1.43 -1.26 -4.61 118.68 124.33 3ila s LEU 199 Ca -0.08 2.20 0.08 0.00 -1.03 0.00 0.00 54.13 55.31 3ila s LEU 199 Cb -0.12 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 3ila s LEU 199 CO -0.04 -0.43 -0.25 0.26 0.23 0.00 0.00 176.35 176.12 3ila s TRP 200 N 0.33 2.19 -0.10 0.29 0.52 -0.42 -4.42 118.94 117.34 3ila s TRP 200 Ca 0.56 -0.41 -0.02 0.00 0.02 0.00 0.00 56.10 56.25 3ila s TRP 200 Cb -0.33 -1.36 -0.03 0.00 -1.15 0.00 0.00 33.47 30.61 3ila s TRP 200 CO 0.34 0.05 -0.01 -0.80 0.02 0.00 0.00 176.95 176.55 3ila s ASN 201 N -0.94 5.11 -0.20 2.95 0.01 0.20 -0.58 114.94 121.49 3ila s ASN 201 Ca 0.10 0.08 0.01 0.00 -0.71 0.00 0.00 52.86 52.35 3ila s ASN 201 Cb -0.10 -1.48 0.03 0.00 0.41 0.00 0.00 41.25 40.11 3ila s ASN 201 CO 0.01 0.34 -0.16 -0.04 -1.51 0.00 0.00 177.10 175.73 3ila s MET 202 N -0.67 2.67 -0.10 -0.60 -1.94 -1.26 -0.80 119.30 116.60 3ila s MET 202 Ca 0.11 -0.94 0.02 0.00 -1.71 0.00 0.00 55.69 53.16 3ila s MET 202 Cb -0.12 -2.61 0.01 0.00 2.01 0.00 0.00 34.83 34.13 3ila s MET 202 CO 0.02 -0.32 -0.15 -0.80 -0.01 0.00 0.00 175.02 173.76 3ila s ASN 203 N 1.26 2.37 0.00 3.03 0.01 -1.16 -4.02 114.94 116.44 3ila s ASN 203 Ca 0.01 -0.41 0.30 0.00 -0.71 0.00 0.00 52.86 52.04 3ila s ASN 203 Cb -0.15 -1.06 1.37 0.00 0.41 0.00 0.00 41.25 41.82 3ila s ASN 203 CO -0.10 0.02 1.93 -0.81 -1.51 0.00 0.00 177.10 176.63