#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ul9 s LEU 2 N 0.00 4.29 0.12 -0.89 2.96 -1.26 -0.37 118.68 123.53 1ul9 s LEU 2 Ca 0.00 0.39 0.04 0.00 -0.22 0.00 0.00 54.13 54.34 1ul9 s LEU 2 Cb 0.00 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1ul9 s LEU 2 CO 0.00 0.26 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.87 1ul9 s TYR 3 N -0.18 1.18 -0.34 5.38 1.51 0.57 -5.01 117.35 120.46 1ul9 s TYR 3 Ca 0.12 -0.68 0.04 0.00 -1.01 0.00 0.00 57.07 55.55 1ul9 s TYR 3 Cb -0.12 -0.62 0.10 0.00 -0.11 0.00 0.00 41.96 41.21 1ul9 s TYR 3 CO 0.02 0.05 0.05 -1.01 -1.11 0.00 0.00 175.55 173.54 1ul9 s HIS 4 N -2.70 3.73 -0.47 2.71 3.76 -1.26 -1.63 115.29 119.42 1ul9 s HIS 4 Ca 0.10 -2.98 -0.22 0.00 -0.15 0.00 0.00 55.06 51.80 1ul9 s HIS 4 Cb -0.01 -2.90 0.03 0.00 1.11 0.00 0.00 32.58 30.81 1ul9 s HIS 4 CO 0.01 -0.95 0.76 -1.17 -0.85 0.00 0.00 174.74 172.54 1ul9 s LEU 5 N 0.91 4.38 0.35 0.89 2.96 -0.93 -4.88 118.68 122.36 1ul9 s LEU 5 Ca 0.11 -0.31 -0.18 0.00 -0.22 0.00 0.00 54.13 53.52 1ul9 s LEU 5 Cb -0.19 -2.82 -0.10 0.00 0.50 0.00 0.00 46.19 43.59 1ul9 s LEU 5 CO -0.08 -0.94 0.82 -0.36 -1.32 0.00 0.00 176.35 174.47 1ul9 s PHE 6 N 3.22 3.39 0.55 5.38 0.40 -1.26 -0.88 117.98 128.77 1ul9 s PHE 6 Ca 0.26 1.39 -0.22 0.00 -0.60 0.00 0.00 56.93 57.77 1ul9 s PHE 6 Cb -0.14 -2.67 -0.05 0.00 0.51 0.00 0.00 43.02 40.68 1ul9 s PHE 6 CO 0.20 0.05 1.35 1.55 0.70 0.00 0.00 175.22 179.07 1ul9 n VAL 7 N -0.33 3.83 -3.89 -0.44 3.14 -1.26 -2.45 118.33 116.93 1ul9 n VAL 7 Ca 0.04 -0.50 -0.27 0.00 -2.96 0.00 0.00 64.34 60.65 1ul9 n VAL 7 Cb 0.53 -1.65 0.02 0.00 -1.06 0.00 0.00 33.84 31.67 1ul9 n VAL 7 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1ul9 n ASN 8 N -0.98 -2.84 -0.90 6.55 3.02 0.47 -4.92 115.26 115.65 1ul9 n ASN 8 Ca 0.10 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.80 1ul9 n ASN 8 Cb 0.45 -3.70 0.00 0.00 -0.61 0.00 0.00 39.78 35.92 1ul9 n ASN 8 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1ul9 n ASN 9 N -2.91 0.00 -3.02 6.41 4.05 -0.95 -5.01 115.26 113.84 1ul9 n ASN 9 Ca -0.11 -0.90 -0.12 0.00 0.45 0.00 0.00 54.58 53.90 1ul9 n ASN 9 Cb 0.59 0.00 -0.00 0.00 1.23 0.00 0.00 39.78 41.60 1ul9 n ASN 9 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1ul9 s GLN 10 N -1.70 2.12 -0.02 1.20 -2.07 -1.26 -1.65 119.66 116.28 1ul9 s GLN 10 Ca 0.00 -1.60 0.01 0.00 -1.82 0.00 0.00 55.36 51.95 1ul9 s GLN 10 Cb 0.00 0.55 0.01 0.00 -1.09 0.00 0.00 33.01 32.48 1ul9 s GLN 10 CO 0.00 -0.95 -0.02 0.14 -1.32 0.00 0.00 175.29 173.14 1ul9 s VAL 11 N -2.56 0.27 -0.21 3.63 -7.23 -0.66 -4.78 120.40 108.86 1ul9 s VAL 11 Ca 0.22 -0.04 -0.22 0.00 -1.81 0.00 0.00 61.98 60.12 1ul9 s VAL 11 Cb -0.03 -0.30 -0.02 0.00 0.56 0.00 0.00 36.38 36.59 1ul9 s VAL 11 CO 0.16 0.13 0.71 -0.75 -0.31 0.00 0.00 175.10 175.04 1ul9 s LYS 12 N 0.55 4.21 0.35 4.82 2.20 -1.26 -2.19 119.74 128.41 1ul9 s LYS 12 Ca -0.06 0.75 -0.27 0.00 -0.36 0.00 0.00 55.97 56.03 1ul9 s LYS 12 Cb -0.09 -3.60 -0.09 0.00 -1.51 0.00 0.00 37.83 32.54 1ul9 s LYS 12 CO -0.01 -0.34 1.10 -0.51 -0.36 0.00 0.00 175.35 175.23 1ul9 s LEU 13 N 2.24 4.33 0.33 5.43 1.43 -0.45 -4.93 118.68 127.05 1ul9 s LEU 13 Ca 0.31 2.22 0.07 0.00 -1.03 0.00 0.00 54.13 55.70 1ul9 s LEU 13 Cb -0.16 -3.91 0.57 0.00 0.03 0.00 0.00 46.19 42.73 1ul9 s LEU 13 CO 0.10 -0.39 1.79 1.56 0.23 0.00 0.00 176.35 179.63 1ul9 h GLN 14 N 3.09 0.29 -4.90 1.70 1.08 -1.96 -3.44 115.11 110.97 1ul9 h GLN 14 Ca -0.48 -0.10 -0.30 0.00 -1.45 0.00 0.00 58.65 56.32 1ul9 h GLN 14 Cb 1.22 -0.02 -0.17 0.00 -0.05 0.00 0.00 27.48 28.45 1ul9 h GLN 14 CO 0.64 0.54 -0.73 -0.80 -0.95 0.00 0.00 178.83 177.53 1ul9 s ASN 15 N -6.86 1.39 0.37 1.46 -0.87 -1.26 -5.13 114.94 104.04 1ul9 s ASN 15 Ca -0.05 -0.83 -0.28 0.00 -1.57 0.00 0.00 52.86 50.12 1ul9 s ASN 15 Cb 0.14 0.02 -0.11 0.00 -0.02 0.00 0.00 41.25 41.29 1ul9 s ASN 15 CO 0.76 -0.29 1.46 -1.81 -2.57 0.00 0.00 177.10 174.65 1ul9 s ASP 16 N -2.51 6.42 -0.33 -1.22 1.01 -1.26 -4.90 116.67 113.88 1ul9 s ASP 16 Ca 0.06 2.99 -0.25 0.00 0.71 0.00 0.00 52.55 56.06 1ul9 s ASP 16 Cb -0.02 -2.66 0.01 0.00 1.01 0.00 0.00 42.92 41.25 1ul9 s ASP 16 CO -0.01 -0.82 0.85 0.12 0.21 0.00 0.00 175.17 175.52 1ul9 s PHE 17 N -1.10 3.16 0.15 4.23 5.36 0.27 -4.92 117.98 125.13 1ul9 s PHE 17 Ca 0.52 0.82 0.01 0.00 -0.96 0.00 0.00 56.93 57.33 1ul9 s PHE 17 Cb -0.45 -3.37 -0.00 0.00 -0.34 0.00 0.00 43.02 38.85 1ul9 s PHE 17 CO 0.61 -0.66 0.17 0.36 -1.46 0.00 0.00 175.22 174.25 1ul9 n LYS 18 N 6.41 0.24 -1.54 10.12 2.85 -1.26 -1.86 118.16 133.12 1ul9 n LYS 18 Ca 0.05 -1.29 -0.49 0.00 -1.05 0.00 0.00 58.31 55.53 1ul9 n LYS 18 Cb 0.48 1.16 -0.04 0.00 -0.65 0.00 0.00 35.03 35.98 1ul9 n LYS 18 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1ul9 n PRO 19 N -0.26 0.87 0.00 -1.58 -0.02 -1.26 -0.15 135.00 132.60 1ul9 n PRO 19 Ca 0.02 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1ul9 n PRO 19 Cb 0.25 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1ul9 n PRO 19 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ul9 n GLU 20 N 1.48 0.00 -2.22 -0.52 -0.58 0.39 -4.96 120.64 114.23 1ul9 n GLU 20 Ca 0.15 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.51 1ul9 n GLU 20 Cb 0.24 -0.68 -0.01 0.00 -0.57 0.00 0.00 31.44 30.42 1ul9 n GLU 20 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1ul9 s SER 21 N -1.77 6.32 -0.04 1.62 0.01 0.78 -3.33 113.70 117.30 1ul9 s SER 21 Ca 0.00 2.41 0.02 0.00 1.31 0.00 0.00 55.95 59.69 1ul9 s SER 21 Cb 0.00 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.62 1ul9 s SER 21 CO 0.00 -0.82 -0.09 -0.69 0.41 0.00 0.00 173.24 172.05 1ul9 s VAL 22 N -1.42 0.79 -0.22 3.43 1.01 -0.64 -1.74 120.40 121.60 1ul9 s VAL 22 Ca 0.60 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 62.27 1ul9 s VAL 22 Cb -0.32 -0.73 0.04 0.00 0.00 0.00 0.00 36.38 35.38 1ul9 s VAL 22 CO 0.40 0.26 -0.14 0.00 0.00 0.00 0.00 175.10 175.61 1ul9 s ALA 23 N 0.43 2.42 -0.56 5.51 0.00 0.09 0.02 121.76 129.68 1ul9 s ALA 23 Ca -0.07 -1.50 -0.12 0.00 0.00 0.00 0.00 51.96 50.27 1ul9 s ALA 23 Cb -0.11 -1.40 0.14 0.00 0.00 0.00 0.00 23.12 21.75 1ul9 s ALA 23 CO 0.01 -0.83 0.47 0.00 0.00 0.00 0.00 175.76 175.42 1ul9 s ALA 24 N 1.21 3.61 -0.20 0.00 0.00 0.92 -1.62 121.76 125.68 1ul9 s ALA 24 Ca -0.03 -2.70 -0.17 0.00 0.00 0.00 0.00 51.96 49.06 1ul9 s ALA 24 Cb -0.17 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1ul9 s ALA 24 CO -0.08 -2.02 0.46 0.42 0.00 0.00 0.00 175.76 174.54 1ul9 s ILE 25 N 1.20 5.15 -0.01 0.00 1.01 -0.19 -1.44 121.20 126.91 1ul9 s ILE 25 Ca 0.07 0.84 0.04 0.00 0.00 0.00 0.00 60.65 61.60 1ul9 s ILE 25 Cb -0.25 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.42 1ul9 s ILE 25 CO -0.01 0.21 -0.12 -0.13 0.00 0.00 0.00 174.94 174.89 1ul9 s ARG 26 N 1.47 1.06 -0.01 2.79 0.52 0.17 -1.23 118.95 123.73 1ul9 s ARG 26 Ca 0.22 -0.44 -0.00 0.00 -0.52 0.00 0.00 55.73 54.99 1ul9 s ARG 26 Cb -0.15 -1.01 -0.04 0.00 0.52 0.00 0.00 34.95 34.27 1ul9 s ARG 26 CO 0.09 0.25 0.05 0.45 0.02 0.00 0.00 175.30 176.16 1ul9 s SER 27 N -0.20 5.49 0.00 0.23 0.15 -0.42 0.30 113.70 119.25 1ul9 s SER 27 Ca 0.03 0.10 0.14 0.00 0.70 0.00 0.00 55.95 56.93 1ul9 s SER 27 Cb -0.06 -1.54 0.49 0.00 -1.71 0.00 0.00 66.02 63.21 1ul9 s SER 27 CO -0.00 0.28 1.37 -1.54 1.20 0.00 0.00 173.24 174.56 1ul9 n SER 28 N 1.32 1.65 -3.66 5.45 3.41 -1.26 -3.97 113.62 116.57 1ul9 n SER 28 Ca -0.14 -1.87 -0.05 0.00 -0.26 0.00 0.00 58.87 56.55 1ul9 n SER 28 Cb 0.53 -0.17 -0.02 0.00 -0.26 0.00 0.00 64.21 64.29 1ul9 n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ul9 s ALA 29 N -1.66 -1.75 -0.23 7.33 0.00 -0.79 -4.79 121.76 119.87 1ul9 s ALA 29 Ca 0.26 0.48 -0.02 0.00 0.00 0.00 0.00 51.96 52.67 1ul9 s ALA 29 Cb 0.14 0.54 0.07 0.00 0.00 0.00 0.00 23.12 23.87 1ul9 s ALA 29 CO 0.19 -0.92 0.06 0.12 0.00 0.00 0.00 175.76 175.22 1ul9 s PHE 30 N -3.18 1.10 -0.89 0.00 5.36 -1.21 -3.89 117.98 115.28 1ul9 s PHE 30 Ca 0.10 -1.06 -0.19 0.00 -0.96 0.00 0.00 56.93 54.82 1ul9 s PHE 30 Cb -0.01 -1.17 0.13 0.00 -0.34 0.00 0.00 43.02 41.63 1ul9 s PHE 30 CO -0.02 -0.70 1.08 -0.80 -1.46 0.00 0.00 175.22 173.32 1ul9 s ASN 31 N 1.83 6.57 0.61 6.13 0.01 0.14 -4.88 114.94 125.34 1ul9 s ASN 31 Ca 0.03 -1.95 0.24 0.00 -0.71 0.00 0.00 52.86 50.47 1ul9 s ASN 31 Cb -0.17 -2.39 1.33 0.00 0.41 0.00 0.00 41.25 40.43 1ul9 s ASN 31 CO -0.15 -1.08 1.73 0.77 -1.51 0.00 0.00 177.10 176.86 1ul9 h SER 32 N 8.87 0.00 -0.54 -1.22 4.64 -1.93 0.14 113.55 123.51 1ul9 h SER 32 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1ul9 h SER 32 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1ul9 h SER 32 CO 1.10 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 177.35 1ul9 n LYS 33 N -2.71 4.39 -2.01 4.77 5.02 -1.26 -5.00 118.16 121.37 1ul9 n LYS 33 Ca -0.02 -3.06 -0.29 0.00 -2.02 0.00 0.00 58.31 52.92 1ul9 n LYS 33 Cb 0.42 -2.13 0.05 0.00 -0.02 0.00 0.00 35.03 33.35 1ul9 n LYS 33 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1ul9 s GLY 34 N -0.99 1.62 0.00 0.72 0.00 0.49 -5.05 107.32 104.11 1ul9 s GLY 34 Ca 0.52 -0.45 0.00 0.00 0.00 0.00 0.00 44.72 44.79 1ul9 s GLY 34 CO 0.16 -0.09 0.00 0.61 0.00 0.00 0.00 173.10 173.78 1ul9 n GLY 35 N -2.92 3.31 3.67 0.20 0.00 0.12 -4.80 105.19 104.76 1ul9 n GLY 35 Ca 0.06 -1.96 -0.47 0.00 0.00 0.00 0.00 46.02 43.65 1ul9 n GLY 35 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ul9 n THR 36 N 0.00 0.13 -4.48 2.61 -1.04 -1.26 -4.39 114.28 105.85 1ul9 n THR 36 Ca 0.00 -0.02 -0.28 0.00 -2.04 0.00 0.00 64.05 61.71 1ul9 n THR 36 Cb 0.00 -1.58 -0.17 0.00 -1.82 0.00 0.00 70.33 66.76 1ul9 n THR 36 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ul9 s THR 37 N 1.58 1.47 -0.04 12.58 2.01 0.30 -4.38 115.64 129.17 1ul9 s THR 37 Ca 0.82 -0.63 0.07 0.00 0.31 0.00 0.00 61.69 62.26 1ul9 s THR 37 Cb -0.69 -1.35 -0.02 0.00 0.01 0.00 0.00 72.50 70.45 1ul9 s THR 37 CO 0.41 0.44 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.85 1ul9 s VAL 38 N 0.96 2.24 -0.11 3.82 1.01 0.37 -0.66 120.40 128.03 1ul9 s VAL 38 Ca -0.07 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 60.90 1ul9 s VAL 38 Cb -0.15 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.44 1ul9 s VAL 38 CO -0.01 0.58 -0.15 -0.36 0.00 0.00 0.00 175.10 175.16 1ul9 s PHE 39 N -0.48 1.95 -0.05 5.22 0.40 -0.60 -0.51 117.98 123.92 1ul9 s PHE 39 Ca 0.06 -0.91 0.06 0.00 -0.60 0.00 0.00 56.93 55.54 1ul9 s PHE 39 Cb -0.11 -1.41 -0.01 0.00 0.51 0.00 0.00 43.02 42.00 1ul9 s PHE 39 CO 0.01 -0.47 -0.24 -0.80 0.70 0.00 0.00 175.22 174.42 1ul9 s ASN 40 N 0.97 2.89 -0.35 1.36 0.01 -0.25 -0.85 114.94 118.72 1ul9 s ASN 40 Ca -0.07 -0.47 -0.12 0.00 -0.71 0.00 0.00 52.86 51.49 1ul9 s ASN 40 Cb -0.15 -0.70 0.01 0.00 0.41 0.00 0.00 41.25 40.81 1ul9 s ASN 40 CO -0.01 0.24 0.21 -0.36 -1.51 0.00 0.00 177.10 175.67 1ul9 s PHE 41 N -0.22 3.22 0.06 2.20 0.40 -0.19 0.11 117.98 123.55 1ul9 s PHE 41 Ca -0.01 -0.61 0.01 0.00 -0.60 0.00 0.00 56.93 55.72 1ul9 s PHE 41 Cb -0.13 -2.45 -0.04 0.00 0.51 0.00 0.00 43.02 40.92 1ul9 s PHE 41 CO 0.03 -0.52 0.13 -0.51 0.70 0.00 0.00 175.22 175.05 1ul9 s LEU 42 N 1.63 4.03 0.64 -0.37 1.43 0.10 -1.44 118.68 124.70 1ul9 s LEU 42 Ca 0.04 0.13 -0.02 0.00 -1.03 0.00 0.00 54.13 53.25 1ul9 s LEU 42 Cb -0.18 -2.62 0.06 0.00 0.03 0.00 0.00 46.19 43.49 1ul9 s LEU 42 CO 0.08 0.19 0.91 -0.94 0.23 0.00 0.00 176.35 176.82 1ul9 s SER 43 N -2.31 4.89 0.36 2.29 1.04 -0.75 0.11 113.70 119.33 1ul9 s SER 43 Ca 0.30 0.06 0.07 0.00 0.48 0.00 0.00 55.95 56.86 1ul9 s SER 43 Cb -0.12 -0.75 0.77 0.00 0.10 0.00 0.00 66.02 66.01 1ul9 s SER 43 CO 0.23 -1.47 1.93 0.00 0.98 0.00 0.00 173.24 174.90 1ul9 h ALA 44 N -0.30 1.76 -0.01 5.32 0.00 -1.91 0.18 119.26 124.30 1ul9 h ALA 44 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1ul9 h ALA 44 Cb 1.29 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1ul9 h ALA 44 CO 0.52 0.09 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1ul9 n GLY 45 N -1.44 -0.94 2.39 0.00 0.00 -1.26 -4.87 105.19 99.06 1ul9 n GLY 45 Ca 0.13 -0.06 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 1ul9 n GLY 45 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ul9 n GLU 46 N -0.58 -1.95 -3.20 1.61 1.02 0.64 -4.71 120.64 113.47 1ul9 n GLU 46 Ca 0.06 0.64 -0.39 0.00 -0.02 0.00 0.00 57.16 57.45 1ul9 n GLU 46 Cb 0.04 -4.88 -0.06 0.00 -0.02 0.00 0.00 31.44 26.52 1ul9 n GLU 46 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1ul9 s ASN 47 N -2.55 6.94 -0.82 1.62 0.01 -1.26 -3.87 114.94 115.01 1ul9 s ASN 47 Ca 0.08 1.12 -0.25 0.00 -0.71 0.00 0.00 52.86 53.11 1ul9 s ASN 47 Cb -0.04 -2.36 0.05 0.00 0.41 0.00 0.00 41.25 39.31 1ul9 s ASN 47 CO 0.10 0.07 1.28 -0.63 -1.51 0.00 0.00 177.10 176.41 1ul9 s ILE 48 N -0.02 3.93 0.13 0.60 1.01 0.12 -1.80 121.20 125.17 1ul9 s ILE 48 Ca 0.31 -0.17 -0.13 0.00 0.00 0.00 0.00 60.65 60.66 1ul9 s ILE 48 Cb -0.18 -4.92 -0.05 0.00 0.01 0.00 0.00 42.46 37.33 1ul9 s ILE 48 CO 0.16 -1.81 1.48 -0.07 0.00 0.00 0.00 174.94 174.71 1ul9 h LEU 49 N 12.56 0.87 -7.30 2.97 3.38 -1.51 -2.11 115.31 124.17 1ul9 h LEU 49 Ca -0.11 -0.43 -0.38 0.00 0.09 0.00 0.00 57.88 57.05 1ul9 h LEU 49 Cb 1.04 -0.24 -0.39 0.00 0.09 0.00 0.00 40.66 41.16 1ul9 h LEU 49 CO 1.30 1.12 -0.74 -0.22 0.09 0.00 0.00 178.44 179.99 1ul9 s LEU 50 N -9.03 0.18 -0.19 1.67 2.96 -1.18 -4.65 118.68 108.43 1ul9 s LEU 50 Ca -0.12 0.02 -0.03 0.00 -0.22 0.00 0.00 54.13 53.78 1ul9 s LEU 50 Cb 0.10 -0.16 -0.01 0.00 0.50 0.00 0.00 46.19 46.61 1ul9 s LEU 50 CO 0.85 -0.25 -0.06 -2.28 -1.32 0.00 0.00 176.35 173.29 1ul9 s HIS 51 N 2.16 2.94 -0.32 5.38 5.65 -0.11 -1.03 115.29 129.96 1ul9 s HIS 51 Ca 0.05 -0.76 0.02 0.00 0.25 0.00 0.00 55.06 54.61 1ul9 s HIS 51 Cb -0.12 -2.03 0.08 0.00 -1.18 0.00 0.00 32.58 29.33 1ul9 s HIS 51 CO -0.04 -0.39 0.02 0.42 -0.65 0.00 0.00 174.74 174.10 1ul9 s ILE 52 N 1.07 2.54 -0.44 0.89 1.01 -0.03 -1.84 121.20 124.40 1ul9 s ILE 52 Ca 0.01 -1.91 -0.09 0.00 0.00 0.00 0.00 60.65 58.66 1ul9 s ILE 52 Cb -0.15 -2.66 0.10 0.00 0.01 0.00 0.00 42.46 39.76 1ul9 s ILE 52 CO -0.00 -0.35 0.29 -0.55 0.00 0.00 0.00 174.94 174.33 1ul9 s SER 53 N 1.17 5.64 -0.36 3.58 0.15 0.86 -1.55 113.70 123.19 1ul9 s SER 53 Ca 0.02 -1.72 -0.23 0.00 0.70 0.00 0.00 55.95 54.72 1ul9 s SER 53 Cb -0.20 -1.99 0.01 0.00 -1.71 0.00 0.00 66.02 62.13 1ul9 s SER 53 CO -0.05 -0.61 0.79 -0.63 1.20 0.00 0.00 173.24 173.94 1ul9 s ILE 54 N 1.38 4.73 -0.52 6.45 1.01 0.17 -0.61 121.20 133.81 1ul9 s ILE 54 Ca 0.04 0.90 0.04 0.00 0.00 0.00 0.00 60.65 61.63 1ul9 s ILE 54 Cb -0.24 -4.21 0.13 0.00 0.01 0.00 0.00 42.46 38.15 1ul9 s ILE 54 CO 0.00 -0.43 0.26 -0.13 0.00 0.00 0.00 174.94 174.64 1ul9 s ARG 55 N 3.10 1.99 0.25 2.79 0.52 -0.21 -0.54 118.95 126.85 1ul9 s ARG 55 Ca 0.31 -2.59 -0.05 0.00 -0.52 0.00 0.00 55.73 52.88 1ul9 s ARG 55 Cb -0.13 -3.34 0.34 0.00 0.52 0.00 0.00 34.95 32.34 1ul9 s ARG 55 CO 0.17 -1.11 1.87 -1.00 0.02 0.00 0.00 175.30 175.25 1ul9 h PRO 56 N 6.57 1.04 -0.41 3.54 0.13 -1.82 0.36 132.00 141.41 1ul9 h PRO 56 Ca -0.07 -0.06 0.06 0.00 -0.87 0.00 0.00 66.00 65.05 1ul9 h PRO 56 Cb 0.90 -0.23 -0.02 0.00 0.13 0.00 0.00 31.00 31.77 1ul9 h PRO 56 CO 0.68 0.69 0.28 0.78 -0.23 0.00 0.00 178.00 180.20 1ul9 h GLY 57 N 1.07 0.36 -2.00 1.56 0.00 -1.93 0.36 103.07 102.48 1ul9 h GLY 57 Ca 0.39 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1ul9 h GLY 57 CO -0.16 0.09 0.00 -2.21 0.00 0.00 0.00 176.54 174.26 1ul9 n GLU 58 N -4.47 2.36 -4.02 4.80 2.13 -0.71 -4.96 120.64 115.76 1ul9 n GLU 58 Ca 0.05 -2.00 -0.32 0.00 0.66 0.00 0.00 57.16 55.56 1ul9 n GLU 58 Cb 0.27 -1.47 0.00 0.00 0.27 0.00 0.00 31.44 30.51 1ul9 n GLU 58 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1ul9 n ASN 59 N 1.37 -3.57 -3.81 4.31 5.15 0.11 -4.95 115.26 113.88 1ul9 n ASN 59 Ca 0.15 -0.89 -0.09 0.00 -0.60 0.00 0.00 54.58 53.15 1ul9 n ASN 59 Cb 0.60 -3.38 -0.07 0.00 -0.53 0.00 0.00 39.78 36.40 1ul9 n ASN 59 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1ul9 s VAL 60 N -3.39 0.12 -0.17 3.44 0.11 -0.96 -1.95 120.40 117.61 1ul9 s VAL 60 Ca 0.59 -1.00 0.01 0.00 -2.93 0.00 0.00 61.98 58.64 1ul9 s VAL 60 Cb -0.31 -1.24 0.02 0.00 -1.53 0.00 0.00 36.38 33.33 1ul9 s VAL 60 CO 0.87 -0.55 -0.17 -0.63 -3.33 0.00 0.00 175.10 171.29 1ul9 s ILE 61 N -3.64 1.86 -0.11 7.04 1.01 0.16 -1.04 121.20 126.47 1ul9 s ILE 61 Ca 0.03 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 59.79 1ul9 s ILE 61 Cb 0.03 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 1ul9 s ILE 61 CO -0.10 0.48 0.11 -0.69 0.00 0.00 0.00 174.94 174.74 1ul9 s VAL 62 N 1.37 5.23 -0.04 2.92 1.01 0.22 -2.43 120.40 128.67 1ul9 s VAL 62 Ca 0.05 0.10 0.06 0.00 0.00 0.00 0.00 61.98 62.18 1ul9 s VAL 62 Cb -0.13 -3.26 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 1ul9 s VAL 62 CO -0.12 0.62 -0.21 -0.36 0.00 0.00 0.00 175.10 175.03 1ul9 s PHE 63 N -1.00 2.05 0.29 5.22 0.40 -0.20 -0.10 117.98 124.65 1ul9 s PHE 63 Ca 0.15 -0.55 -0.09 0.00 -0.60 0.00 0.00 56.93 55.83 1ul9 s PHE 63 Cb -0.12 -1.35 0.04 0.00 0.51 0.00 0.00 43.02 42.09 1ul9 s PHE 63 CO 0.04 -0.15 0.54 -1.71 0.70 0.00 0.00 175.22 174.63 1ul9 n ASN 64 N 2.92 -1.56 -3.68 1.36 2.85 -0.77 -1.78 115.26 114.61 1ul9 n ASN 64 Ca -0.17 -2.23 -0.13 0.00 -0.11 0.00 0.00 54.58 51.93 1ul9 n ASN 64 Cb 0.52 2.65 -0.07 0.00 1.24 0.00 0.00 39.78 44.12 1ul9 n ASN 64 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1ul9 s SER 65 N -2.55 -0.30 -0.21 1.20 0.01 -1.26 -0.94 113.70 109.65 1ul9 s SER 65 Ca 0.14 0.09 -0.28 0.00 1.31 0.00 0.00 55.95 57.22 1ul9 s SER 65 Cb -0.03 0.41 0.12 0.00 0.21 0.00 0.00 66.02 66.72 1ul9 s SER 65 CO 0.10 -0.60 0.97 0.00 0.41 0.00 0.00 173.24 174.12 1ul9 s ARG 66 N -2.05 0.61 0.81 12.44 1.70 -0.79 -2.98 118.95 128.69 1ul9 s ARG 66 Ca -0.08 0.40 -0.11 0.00 -0.47 0.00 0.00 55.73 55.47 1ul9 s ARG 66 Cb -0.02 0.29 0.08 0.00 -0.57 0.00 0.00 34.95 34.73 1ul9 s ARG 66 CO 0.01 -0.14 1.09 -0.51 -1.08 0.00 0.00 175.30 174.67 1ul9 s LEU 67 N -0.44 2.73 0.23 -1.89 1.43 -1.26 -0.70 118.68 118.78 1ul9 s LEU 67 Ca -0.00 1.65 -0.09 0.00 -1.03 0.00 0.00 54.13 54.66 1ul9 s LEU 67 Cb -0.03 -4.26 0.35 0.00 0.03 0.00 0.00 46.19 42.29 1ul9 s LEU 67 CO -0.01 -2.21 1.64 0.50 0.23 0.00 0.00 176.35 176.50 1ul9 h LYS 68 N -1.25 0.08 -0.49 1.70 3.64 -1.84 -1.41 116.57 117.00 1ul9 h LYS 68 Ca -0.46 -0.01 -0.32 0.00 -1.27 0.00 0.00 60.65 58.60 1ul9 h LYS 68 Cb 1.25 -0.02 -0.21 0.00 -0.41 0.00 0.00 32.23 32.84 1ul9 h LYS 68 CO 0.53 0.06 -0.27 0.09 -2.27 0.00 0.00 179.45 177.59 1ul9 n ASN 69 N -5.35 3.66 -4.84 4.20 3.02 -1.26 -5.03 115.26 109.66 1ul9 n ASN 69 Ca 0.11 -3.80 -0.28 0.00 -0.03 0.00 0.00 54.58 50.58 1ul9 n ASN 69 Cb 0.41 -0.57 -0.03 0.00 -0.61 0.00 0.00 39.78 38.98 1ul9 n ASN 69 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ul9 s GLY 70 N -2.90 2.56 0.18 7.41 0.00 -0.53 -5.13 107.32 108.90 1ul9 s GLY 70 Ca 0.48 -1.09 -0.06 0.00 0.00 0.00 0.00 44.72 44.04 1ul9 s GLY 70 CO -0.00 -2.01 0.44 0.00 0.00 0.00 0.00 173.10 171.52 1ul9 s ALA 71 N -2.78 3.71 0.57 3.20 0.00 -1.26 -4.60 121.76 120.61 1ul9 s ALA 71 Ca 0.26 -0.47 -0.20 0.00 0.00 0.00 0.00 51.96 51.56 1ul9 s ALA 71 Cb -0.00 -2.23 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 1ul9 s ALA 71 CO 0.16 0.61 1.26 -1.58 0.00 0.00 0.00 175.76 176.21 1ul9 s TRP 72 N -1.72 2.36 0.00 0.00 0.52 -1.26 -4.64 118.94 114.20 1ul9 s TRP 72 Ca 0.43 1.47 0.00 0.00 0.02 0.00 0.00 56.10 58.02 1ul9 s TRP 72 Cb -0.12 -3.60 0.00 0.00 -1.15 0.00 0.00 33.47 28.60 1ul9 s TRP 72 CO 0.24 -2.46 0.00 0.41 0.02 0.00 0.00 176.95 175.15 1ul9 n GLY 73 N 0.64 1.31 3.76 0.98 0.00 -1.16 -5.03 105.19 105.69 1ul9 n GLY 73 Ca 0.12 -2.00 -0.39 0.00 0.00 0.00 0.00 46.02 43.75 1ul9 n GLY 73 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ul9 s PRO 74 N -0.47 3.75 0.26 1.61 0.04 -1.26 -4.89 135.00 134.04 1ul9 s PRO 74 Ca 0.00 2.13 -0.13 0.00 0.04 0.00 0.00 61.00 63.04 1ul9 s PRO 74 Cb 0.00 -2.60 -0.08 0.00 0.04 0.00 0.00 34.50 31.86 1ul9 s PRO 74 CO 0.00 -0.66 0.65 -1.21 0.04 0.00 0.00 177.00 175.81 1ul9 s GLU 75 N -2.46 3.95 -0.05 4.56 2.02 -1.26 -4.82 118.70 120.64 1ul9 s GLU 75 Ca 0.61 0.52 0.05 0.00 0.02 0.00 0.00 54.97 56.17 1ul9 s GLU 75 Cb -0.37 -2.60 -0.02 0.00 0.10 0.00 0.00 34.13 31.24 1ul9 s GLU 75 CO 0.47 0.27 -0.18 -1.21 0.02 0.00 0.00 175.26 174.63 1ul9 s GLU 76 N -2.74 2.47 0.26 1.61 2.02 -0.73 -4.97 118.70 116.63 1ul9 s GLU 76 Ca 0.49 -0.76 0.06 0.00 0.02 0.00 0.00 54.97 54.78 1ul9 s GLU 76 Cb -0.12 -2.30 -0.06 0.00 0.10 0.00 0.00 34.13 31.76 1ul9 s GLU 76 CO 0.19 0.57 -0.05 1.03 0.02 0.00 0.00 175.26 177.02 1ul9 s ARG 77 N -0.60 1.47 -0.25 1.61 0.52 -1.26 -1.03 118.95 119.41 1ul9 s ARG 77 Ca 0.09 -1.74 -0.25 0.00 -0.52 0.00 0.00 55.73 53.31 1ul9 s ARG 77 Cb -0.11 -1.01 0.07 0.00 0.52 0.00 0.00 34.95 34.42 1ul9 s ARG 77 CO 0.01 0.01 0.70 -1.50 0.02 0.00 0.00 175.30 174.54 1ul9 s ILE 78 N -3.11 0.00 0.50 1.52 2.07 -1.02 -4.99 121.20 116.17 1ul9 s ILE 78 Ca 0.28 -0.00 -0.22 0.00 -1.41 0.00 0.00 60.65 59.30 1ul9 s ILE 78 Cb 0.04 -0.98 -0.07 0.00 0.13 0.00 0.00 42.46 41.58 1ul9 s ILE 78 CO 0.11 -0.00 1.19 -2.65 -1.91 0.00 0.00 174.94 171.67 1ul9 n PRO 79 N 2.61 1.52 0.04 3.50 -0.02 -1.26 -0.67 135.00 140.71 1ul9 n PRO 79 Ca -0.14 0.55 -0.21 0.00 -2.02 0.00 0.00 63.50 61.68 1ul9 n PRO 79 Cb 0.55 -2.34 -0.14 0.00 -0.02 0.00 0.00 33.50 31.55 1ul9 n PRO 79 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1ul9 h TYR 80 N 1.41 0.52 -2.77 6.00 3.20 -1.66 -3.42 116.97 120.26 1ul9 h TYR 80 Ca -0.48 -0.38 -0.59 0.00 3.14 0.00 0.00 58.73 60.41 1ul9 h TYR 80 Cb 1.32 -0.02 0.11 0.00 1.54 0.00 0.00 36.73 39.67 1ul9 h TYR 80 CO 0.44 1.42 0.33 0.00 -1.64 0.00 0.00 178.16 178.71 1ul9 n ALA 81 N -2.80 0.44 -3.54 1.82 0.00 -1.26 -2.82 120.51 112.35 1ul9 n ALA 81 Ca -0.19 0.39 -0.21 0.00 0.00 0.00 0.00 53.44 53.43 1ul9 n ALA 81 Cb 0.87 -2.13 0.08 0.00 0.00 0.00 0.00 19.45 18.26 1ul9 n ALA 81 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ul9 n GLU 82 N 0.86 -6.99 0.00 0.00 1.02 -1.26 -4.90 120.64 109.37 1ul9 n GLU 82 Ca 0.08 0.82 0.00 0.00 -0.02 0.00 0.00 57.16 58.04 1ul9 n GLU 82 Cb 0.33 -5.81 0.00 0.00 -0.02 0.00 0.00 31.44 25.94 1ul9 n GLU 82 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ul9 n LYS 83 N -4.51 2.88 -4.69 3.49 4.76 -1.13 -4.40 118.16 114.57 1ul9 n LYS 83 Ca -0.16 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 54.95 1ul9 n LYS 83 Cb 0.62 -0.97 -0.12 0.00 -1.84 0.00 0.00 35.03 32.72 1ul9 n LYS 83 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1ul9 s PHE 84 N -1.94 2.80 -0.39 2.13 0.40 -1.26 -0.66 117.98 119.06 1ul9 s PHE 84 Ca 0.00 -0.09 -0.07 0.00 -0.60 0.00 0.00 56.93 56.17 1ul9 s PHE 84 Cb 0.00 -1.63 0.07 0.00 0.51 0.00 0.00 43.02 41.97 1ul9 s PHE 84 CO 0.00 0.28 0.20 0.50 0.70 0.00 0.00 175.22 176.90 1ul9 s ARG 85 N -0.99 2.51 0.75 0.44 3.52 -1.26 -4.95 118.95 118.96 1ul9 s ARG 85 Ca 0.13 -1.43 -0.11 0.00 -0.13 0.00 0.00 55.73 54.19 1ul9 s ARG 85 Cb -0.11 -3.64 0.04 0.00 -1.56 0.00 0.00 34.95 29.69 1ul9 s ARG 85 CO 0.03 -0.88 1.09 -1.25 -0.81 0.00 0.00 175.30 173.48 1ul9 s PRO 86 N 1.37 2.40 0.00 5.12 0.04 -1.26 -2.61 135.00 140.06 1ul9 s PRO 86 Ca 0.02 1.17 0.24 0.00 0.04 0.00 0.00 61.00 62.47 1ul9 s PRO 86 Cb -0.22 -1.91 0.83 0.00 0.04 0.00 0.00 34.50 33.23 1ul9 s PRO 86 CO 0.01 -1.53 1.61 -0.35 0.04 0.00 0.00 177.00 176.78 1ul9 n PRO 87 N -3.34 1.79 -3.35 0.56 -0.04 -1.26 -4.88 135.00 124.47 1ul9 n PRO 87 Ca 0.09 -1.17 -0.27 0.00 -0.04 0.00 0.00 63.50 62.11 1ul9 n PRO 87 Cb 0.53 -1.45 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 1ul9 n PRO 87 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ul9 n ASN 88 N 0.40 3.56 -4.75 3.54 5.03 -1.15 -1.88 115.26 120.01 1ul9 n ASN 88 Ca 0.17 -3.41 -0.34 0.00 0.87 0.00 0.00 54.58 51.87 1ul9 n ASN 88 Cb 0.38 -0.66 0.05 0.00 -1.02 0.00 0.00 39.78 38.53 1ul9 n ASN 88 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1ul9 s PRO 89 N -2.49 2.74 0.13 3.52 0.04 -1.07 -4.70 135.00 133.17 1ul9 s PRO 89 Ca 0.41 1.62 -0.03 0.00 0.04 0.00 0.00 61.00 63.04 1ul9 s PRO 89 Cb 0.17 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.75 1ul9 s PRO 89 CO -0.03 -1.34 0.11 -1.54 0.04 0.00 0.00 177.00 174.23 1ul9 s SER 90 N -2.08 0.26 -0.02 6.66 1.04 -1.26 -1.30 113.70 116.99 1ul9 s SER 90 Ca 0.72 -1.10 -0.00 0.00 0.48 0.00 0.00 55.95 56.06 1ul9 s SER 90 Cb -0.26 0.32 0.03 0.00 0.10 0.00 0.00 66.02 66.22 1ul9 s SER 90 CO 0.38 -0.76 0.03 -0.63 0.98 0.00 0.00 173.24 173.25 1ul9 s ILE 91 N -4.01 -0.06 -0.14 -1.02 1.01 -0.36 -4.07 121.20 112.55 1ul9 s ILE 91 Ca 0.20 0.23 0.01 0.00 0.00 0.00 0.00 60.65 61.09 1ul9 s ILE 91 Cb 0.06 -0.08 0.02 0.00 0.01 0.00 0.00 42.46 42.47 1ul9 s ILE 91 CO -0.00 0.09 -0.16 -0.89 0.00 0.00 0.00 174.94 173.98 1ul9 s THR 92 N 1.12 1.67 -0.12 2.92 2.01 0.52 -1.02 115.64 122.74 1ul9 s THR 92 Ca -0.08 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.21 1ul9 s THR 92 Cb -0.13 -1.53 -0.01 0.00 0.01 0.00 0.00 72.50 70.84 1ul9 s THR 92 CO -0.03 0.47 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.53 1ul9 s VAL 93 N 1.23 2.82 -0.06 3.82 1.01 -0.64 -0.81 120.40 127.77 1ul9 s VAL 93 Ca -0.00 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.26 1ul9 s VAL 93 Cb -0.14 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 34.09 1ul9 s VAL 93 CO -0.07 0.53 -0.15 -0.63 0.00 0.00 0.00 175.10 174.78 1ul9 s ILE 94 N 0.34 1.31 -0.31 2.22 1.01 -0.20 -0.73 121.20 124.84 1ul9 s ILE 94 Ca -0.13 -0.61 -0.21 0.00 0.00 0.00 0.00 60.65 59.70 1ul9 s ILE 94 Cb -0.16 -1.16 -0.01 0.00 0.01 0.00 0.00 42.46 41.14 1ul9 s ILE 94 CO 0.06 0.39 0.65 -0.62 0.00 0.00 0.00 174.94 175.42 1ul9 s ASP 95 N 0.36 6.51 -0.30 3.58 -1.08 -0.71 -0.93 116.67 124.10 1ul9 s ASP 95 Ca -0.10 0.44 0.10 0.00 -0.52 0.00 0.00 52.55 52.46 1ul9 s ASP 95 Cb -0.14 -2.34 0.59 0.00 -1.46 0.00 0.00 42.92 39.57 1ul9 s ASP 95 CO 0.03 -0.50 1.61 1.41 0.52 0.00 0.00 175.17 178.24 1ul9 n HIS 96 N 5.93 1.69 0.00 -5.34 8.25 0.02 -0.46 115.22 125.30 1ul9 n HIS 96 Ca -0.00 -1.40 0.00 0.00 -0.26 0.00 0.00 57.72 56.05 1ul9 n HIS 96 Cb 0.49 -0.57 0.00 0.00 1.12 0.00 0.00 29.99 31.02 1ul9 n HIS 96 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ul9 n GLY 97 N -0.79 2.16 0.18 -1.41 0.00 -1.26 -4.19 105.19 99.87 1ul9 n GLY 97 Ca 0.37 -0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1ul9 n GLY 97 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ul9 n ASP 98 N 4.05 1.05 -3.81 1.61 5.75 -1.26 -4.93 116.55 119.00 1ul9 n ASP 98 Ca 0.00 -0.83 -0.06 0.00 -0.01 0.00 0.00 54.79 53.89 1ul9 n ASP 98 Cb 0.00 0.37 -0.02 0.00 -1.03 0.00 0.00 41.12 40.45 1ul9 n ASP 98 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ul9 s ARG 99 N -2.73 1.60 -0.03 0.11 1.70 -1.26 -2.35 118.95 115.99 1ul9 s ARG 99 Ca 0.17 -0.89 0.01 0.00 -0.47 0.00 0.00 55.73 54.55 1ul9 s ARG 99 Cb 0.18 0.54 -0.03 0.00 -0.57 0.00 0.00 34.95 35.07 1ul9 s ARG 99 CO 0.64 -0.73 -0.02 -0.06 -1.08 0.00 0.00 175.30 174.04 1ul9 s PHE 100 N -3.68 3.03 -0.19 5.89 0.40 0.64 -0.80 117.98 123.27 1ul9 s PHE 100 Ca 0.12 0.07 -0.03 0.00 -0.60 0.00 0.00 56.93 56.49 1ul9 s PHE 100 Cb -0.04 -1.69 -0.01 0.00 0.51 0.00 0.00 43.02 41.78 1ul9 s PHE 100 CO 0.06 0.42 -0.06 -1.14 0.70 0.00 0.00 175.22 175.20 1ul9 s GLN 101 N -1.25 3.43 -0.18 0.44 0.74 -0.10 -0.93 119.66 121.80 1ul9 s GLN 101 Ca 0.16 -0.62 0.01 0.00 0.05 0.00 0.00 55.36 54.97 1ul9 s GLN 101 Cb -0.11 -2.92 0.02 0.00 1.10 0.00 0.00 33.01 31.10 1ul9 s GLN 101 CO 0.06 -0.04 -0.19 0.42 -0.55 0.00 0.00 175.29 175.00 1ul9 s ILE 102 N 1.05 2.04 -0.07 -2.34 1.09 0.46 -1.03 121.20 122.40 1ul9 s ILE 102 Ca 0.01 -0.97 0.04 0.00 -1.10 0.00 0.00 60.65 58.63 1ul9 s ILE 102 Cb -0.15 -1.87 -0.02 0.00 -1.06 0.00 0.00 42.46 39.37 1ul9 s ILE 102 CO -0.00 0.49 -0.20 -0.13 -0.10 0.00 0.00 174.94 175.01 1ul9 s ARG 103 N 1.29 2.72 0.00 2.79 0.52 0.01 -0.72 118.95 125.56 1ul9 s ARG 103 Ca 0.04 -0.80 0.00 0.00 -0.52 0.00 0.00 55.73 54.45 1ul9 s ARG 103 Cb -0.13 -2.32 0.00 0.00 0.52 0.00 0.00 34.95 33.01 1ul9 s ARG 103 CO -0.12 0.41 0.00 1.19 0.02 0.00 0.00 175.30 176.80 1ul9 n PHE 104 N 2.90 0.00 -0.02 -0.53 3.01 -1.26 -0.35 117.46 121.20 1ul9 n PHE 104 Ca -0.17 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.18 1ul9 n PHE 104 Cb 0.52 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.85 1ul9 n PHE 104 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1ul9 n ASP 105 N 0.00 1.06 -4.47 4.37 8.00 0.17 -4.84 116.55 120.85 1ul9 n ASP 105 Ca 0.00 0.37 -0.25 0.00 0.71 0.00 0.00 54.79 55.62 1ul9 n ASP 105 Cb 0.00 -0.17 -0.10 0.00 -0.02 0.00 0.00 41.12 40.83 1ul9 n ASP 105 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1ul9 s TYR 106 N -2.59 2.05 0.22 1.24 1.51 -0.89 -4.95 117.35 113.94 1ul9 s TYR 106 Ca -0.08 -0.95 0.00 0.00 -1.01 0.00 0.00 57.07 55.03 1ul9 s TYR 106 Cb 0.08 -1.41 0.00 0.00 -0.11 0.00 0.00 41.96 40.52 1ul9 s TYR 106 CO 0.82 0.08 0.00 0.41 -1.11 0.00 0.00 175.55 175.74 1ul9 n GLY 107 N -0.85 -2.11 3.87 0.71 0.00 -1.26 -4.77 105.19 100.78 1ul9 n GLY 107 Ca -0.05 -1.32 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 1ul9 n GLY 107 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ul9 s THR 108 N -2.36 4.10 0.80 2.61 -4.23 -1.26 -4.87 115.64 110.43 1ul9 s THR 108 Ca 0.00 0.68 -0.12 0.00 -1.18 0.00 0.00 61.69 61.07 1ul9 s THR 108 Cb 0.00 -3.66 0.08 0.00 1.34 0.00 0.00 72.50 70.26 1ul9 s THR 108 CO 0.00 -0.89 1.16 -0.44 -0.54 0.00 0.00 174.62 173.91 1ul9 s SER 109 N -4.25 3.78 -0.11 3.99 0.01 -1.26 -4.86 113.70 111.00 1ul9 s SER 109 Ca 0.57 2.20 -0.01 0.00 1.31 0.00 0.00 55.95 60.01 1ul9 s SER 109 Cb -0.11 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.52 1ul9 s SER 109 CO 0.53 -2.53 -0.06 -0.63 0.41 0.00 0.00 173.24 170.96 1ul9 s ILE 110 N -2.40 3.78 -0.13 1.44 1.09 0.10 -4.94 121.20 120.14 1ul9 s ILE 110 Ca 0.69 -0.43 -0.00 0.00 -1.10 0.00 0.00 60.65 59.81 1ul9 s ILE 110 Cb -0.24 -2.59 -0.01 0.00 -1.06 0.00 0.00 42.46 38.55 1ul9 s ILE 110 CO 0.52 0.56 -0.13 -0.31 -0.10 0.00 0.00 174.94 175.47 1ul9 s TYR 111 N -0.32 2.80 -0.20 3.97 1.51 -1.26 -0.40 117.35 123.46 1ul9 s TYR 111 Ca 0.05 -0.71 0.01 0.00 -1.01 0.00 0.00 57.07 55.41 1ul9 s TYR 111 Cb -0.12 -1.85 0.04 0.00 -0.11 0.00 0.00 41.96 39.92 1ul9 s TYR 111 CO 0.02 -0.26 -0.10 -0.47 -1.11 0.00 0.00 175.55 173.63 1ul9 s TYR 112 N 0.43 2.45 0.23 2.71 5.04 -0.11 -4.96 117.35 123.14 1ul9 s TYR 112 Ca -0.10 -1.62 -0.30 0.00 -2.44 0.00 0.00 57.07 52.61 1ul9 s TYR 112 Cb -0.16 -1.65 -0.10 0.00 0.35 0.00 0.00 41.96 40.40 1ul9 s TYR 112 CO 0.05 -0.75 1.42 -0.80 -1.34 0.00 0.00 175.55 174.13 1ul9 s ASN 113 N 1.38 6.70 0.35 4.32 0.02 -1.26 -0.26 114.94 126.19 1ul9 s ASN 113 Ca -0.01 2.61 -0.29 0.00 -1.02 0.00 0.00 52.86 54.15 1ul9 s ASN 113 Cb -0.16 -2.62 -0.11 0.00 0.02 0.00 0.00 41.25 38.38 1ul9 s ASN 113 CO -0.08 -0.67 1.46 -0.54 0.02 0.00 0.00 177.10 177.29 1ul9 s LYS 114 N -0.21 4.17 -0.05 -0.60 1.02 -0.99 -4.88 119.74 118.18 1ul9 s LYS 114 Ca 0.59 2.49 0.06 0.00 0.02 0.00 0.00 55.97 59.13 1ul9 s LYS 114 Cb -0.41 -3.00 -0.08 0.00 -0.52 0.00 0.00 37.83 33.82 1ul9 s LYS 114 CO 0.41 -0.47 0.04 0.54 -0.92 0.00 0.00 175.35 174.95 1ul9 n ARG 115 N 0.84 2.48 -3.93 1.68 1.74 -1.26 -4.88 116.66 113.33 1ul9 n ARG 115 Ca 0.02 -0.01 -0.33 0.00 -0.77 0.00 0.00 57.85 56.76 1ul9 n ARG 115 Cb 0.40 -1.16 -0.14 0.00 -1.02 0.00 0.00 32.46 30.54 1ul9 n ARG 115 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ul9 s ILE 116 N -2.21 2.66 -1.01 0.55 1.01 -1.26 -5.04 121.20 115.90 1ul9 s ILE 116 Ca -0.03 -2.24 -0.24 0.00 0.00 0.00 0.00 60.65 58.14 1ul9 s ILE 116 Cb 0.02 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 39.55 1ul9 s ILE 116 CO 0.26 -0.64 1.88 -1.59 0.00 0.00 0.00 174.94 174.86 1ul9 s LYS 117 N 0.99 2.71 -0.03 2.79 -2.85 -1.26 -4.81 119.74 117.28 1ul9 s LYS 117 Ca 0.10 -0.69 -0.30 0.00 -1.00 0.00 0.00 55.97 54.09 1ul9 s LYS 117 Cb -0.20 -5.16 0.08 0.00 -2.06 0.00 0.00 37.83 30.48 1ul9 s LYS 117 CO -0.07 -3.37 0.71 -2.00 0.10 0.00 0.00 175.35 170.73 1ul9 s GLU 118 N 6.53 1.03 0.45 1.78 2.12 -1.26 -5.17 118.70 124.18 1ul9 s GLU 118 Ca 0.66 0.12 -0.07 0.00 0.36 0.00 0.00 54.97 56.04 1ul9 s GLU 118 Cb -0.04 0.48 -0.05 0.00 0.26 0.00 0.00 34.13 34.79 1ul9 s GLU 118 CO 0.02 -0.35 0.78 -0.80 -0.54 0.00 0.00 175.26 174.37 1ul9 s ASN 119 N -1.46 6.34 0.17 -1.70 0.01 -1.26 -5.02 114.94 112.02 1ul9 s ASN 119 Ca -0.08 0.99 -0.14 0.00 -0.71 0.00 0.00 52.86 52.92 1ul9 s ASN 119 Cb -0.00 -2.27 -0.07 0.00 0.41 0.00 0.00 41.25 39.32 1ul9 s ASN 119 CO 0.05 -0.52 0.57 0.00 -1.51 0.00 0.00 177.10 175.69 1ul9 s ALA 120 N -2.61 3.55 -0.08 0.60 0.00 -0.78 -4.41 121.76 118.03 1ul9 s ALA 120 Ca 0.48 -0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.36 1ul9 s ALA 120 Cb -0.10 -2.54 -0.04 0.00 0.00 0.00 0.00 23.12 20.43 1ul9 s ALA 120 CO 0.40 0.45 0.10 0.00 0.00 0.00 0.00 175.76 176.72 1ul9 n ALA 121 N 0.64 2.28 -3.08 0.00 0.00 0.30 -0.56 120.51 120.08 1ul9 n ALA 121 Ca -0.04 -0.08 -0.11 0.00 0.00 0.00 0.00 53.44 53.21 1ul9 n ALA 121 Cb 0.52 -0.11 -0.04 0.00 0.00 0.00 0.00 19.45 19.82 1ul9 n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ul9 s ALA 122 N -1.70 -1.00 -0.09 0.00 0.00 -0.80 -1.35 121.76 116.83 1ul9 s ALA 122 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 51.96 51.97 1ul9 s ALA 122 Cb 0.02 0.74 0.01 0.00 0.00 0.00 0.00 23.12 23.89 1ul9 s ALA 122 CO 0.13 -0.68 -0.17 0.42 0.00 0.00 0.00 175.76 175.46 1ul9 s ILE 123 N -3.81 1.54 0.19 0.00 1.01 -0.93 0.01 121.20 119.22 1ul9 s ILE 123 Ca 0.04 -0.70 0.08 0.00 0.00 0.00 0.00 60.65 60.07 1ul9 s ILE 123 Cb 0.01 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 1ul9 s ILE 123 CO -0.11 0.45 -0.01 0.00 0.00 0.00 0.00 174.94 175.26 1ul9 s ALA 124 N 0.65 3.16 -0.08 9.38 0.00 0.12 -1.66 121.76 133.32 1ul9 s ALA 124 Ca -0.14 -1.44 -0.02 0.00 0.00 0.00 0.00 51.96 50.36 1ul9 s ALA 124 Cb -0.16 -0.91 0.04 0.00 0.00 0.00 0.00 23.12 22.08 1ul9 s ALA 124 CO 0.04 0.43 0.05 -0.47 0.00 0.00 0.00 175.76 175.81 1ul9 s TYR 125 N -1.84 0.28 0.02 0.00 5.04 -0.66 -1.08 117.35 119.10 1ul9 s TYR 125 Ca 0.28 -0.01 0.05 0.00 -2.44 0.00 0.00 57.07 54.95 1ul9 s TYR 125 Cb -0.09 -0.62 -0.02 0.00 0.35 0.00 0.00 41.96 41.58 1ul9 s TYR 125 CO 0.18 -0.31 -0.15 -0.80 -1.34 0.00 0.00 175.55 173.13 1ul9 s ASN 126 N 2.10 1.81 -0.30 4.32 0.01 0.34 0.18 114.94 123.40 1ul9 s ASN 126 Ca 0.04 -0.39 -0.27 0.00 -0.71 0.00 0.00 52.86 51.54 1ul9 s ASN 126 Cb -0.13 -0.16 0.20 0.00 0.41 0.00 0.00 41.25 41.57 1ul9 s ASN 126 CO -0.05 0.12 1.45 0.00 -1.51 0.00 0.00 177.10 177.10 1ul9 s ALA 127 N -0.63 -2.20 -0.05 0.60 0.00 -1.26 -0.48 121.76 117.74 1ul9 s ALA 127 Ca 0.04 1.77 0.13 0.00 0.00 0.00 0.00 51.96 53.90 1ul9 s ALA 127 Cb -0.07 -1.73 -0.23 0.00 0.00 0.00 0.00 23.12 21.09 1ul9 s ALA 127 CO 0.01 -0.15 0.64 0.39 0.00 0.00 0.00 175.76 176.65 1ul9 n GLU 128 N 1.07 0.63 -3.01 0.00 1.02 -1.26 -4.57 120.64 114.52 1ul9 n GLU 128 Ca -0.05 0.29 -0.17 0.00 -0.02 0.00 0.00 57.16 57.20 1ul9 n GLU 128 Cb 0.58 -1.79 -0.02 0.00 -0.02 0.00 0.00 31.44 30.19 1ul9 n GLU 128 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1ul9 n ASN 129 N -3.03 -1.13 -4.60 1.62 5.15 -1.26 -5.05 115.26 106.96 1ul9 n ASN 129 Ca -0.17 -2.94 -0.43 0.00 -0.60 0.00 0.00 54.58 50.43 1ul9 n ASN 129 Cb 1.06 0.39 -0.01 0.00 -0.53 0.00 0.00 39.78 40.69 1ul9 n ASN 129 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1ul9 n SER 130 N 1.55 1.34 0.14 1.20 2.88 -1.26 0.11 113.62 119.57 1ul9 n SER 130 Ca 0.16 1.13 0.13 0.00 -1.33 0.00 0.00 58.87 58.97 1ul9 n SER 130 Cb 0.57 -1.32 0.45 0.00 -0.75 0.00 0.00 64.21 63.17 1ul9 n SER 130 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1ul9 h LEU 131 N 1.88 0.00 -9.91 2.46 -0.00 -1.80 -3.42 115.31 104.51 1ul9 h LEU 131 Ca -0.41 0.00 -0.62 0.00 -0.00 0.00 0.00 57.88 56.84 1ul9 h LEU 131 Cb 1.34 0.00 -0.11 0.00 -0.00 0.00 0.00 40.66 41.89 1ul9 h LEU 131 CO 0.59 0.00 -0.51 -0.36 -0.00 0.00 0.00 178.44 178.16 1ul9 s PHE 132 N -3.25 2.26 0.82 1.13 2.99 -1.26 0.24 117.98 120.90 1ul9 s PHE 132 Ca 0.07 -0.75 -0.11 0.00 0.00 0.00 0.00 56.93 56.14 1ul9 s PHE 132 Cb 0.10 -1.80 0.08 0.00 0.00 0.00 0.00 43.02 41.41 1ul9 s PHE 132 CO 0.50 0.21 1.09 -1.54 -0.00 0.00 0.00 175.22 175.48 1ul9 s SER 133 N -3.88 4.21 -0.14 1.36 1.04 -1.25 -4.87 113.70 110.17 1ul9 s SER 133 Ca 0.28 1.45 -0.01 0.00 0.48 0.00 0.00 55.95 58.15 1ul9 s SER 133 Cb 0.04 -2.18 0.04 0.00 0.10 0.00 0.00 66.02 64.03 1ul9 s SER 133 CO 0.15 -2.17 -0.03 -0.55 0.98 0.00 0.00 173.24 171.62 1ul9 s SER 134 N -3.67 2.52 0.86 7.02 0.15 -1.26 -3.89 113.70 115.43 1ul9 s SER 134 Ca 0.61 -0.53 -0.08 0.00 0.70 0.00 0.00 55.95 56.66 1ul9 s SER 134 Cb -0.16 -0.77 0.15 0.00 -1.71 0.00 0.00 66.02 63.53 1ul9 s SER 134 CO 0.55 -0.19 0.96 -0.81 1.20 0.00 0.00 173.24 174.95 1ul9 n PRO 135 N 4.96 -0.58 -4.25 5.44 -0.04 -1.26 -4.93 135.00 134.34 1ul9 n PRO 135 Ca -0.11 -1.90 -0.31 0.00 -0.04 0.00 0.00 63.50 61.14 1ul9 n PRO 135 Cb 0.48 -0.86 -0.09 0.00 -0.04 0.00 0.00 33.50 32.99 1ul9 n PRO 135 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ul9 s VAL 136 N -2.97 3.86 0.16 0.52 -7.23 -0.06 -4.70 120.40 109.98 1ul9 s VAL 136 Ca 0.58 -0.91 -0.29 0.00 -1.81 0.00 0.00 61.98 59.55 1ul9 s VAL 136 Cb -0.02 -2.77 -0.07 0.00 0.56 0.00 0.00 36.38 34.07 1ul9 s VAL 136 CO 0.40 0.23 0.91 -0.89 -0.31 0.00 0.00 175.10 175.44 1ul9 s THR 137 N -1.18 4.34 -0.12 5.32 2.01 0.15 -2.18 115.64 123.98 1ul9 s THR 137 Ca 0.22 1.99 -0.03 0.00 0.31 0.00 0.00 61.69 64.18 1ul9 s THR 137 Cb -0.11 -4.28 0.05 0.00 0.01 0.00 0.00 72.50 68.16 1ul9 s THR 137 CO 0.14 0.42 0.05 -0.69 -0.69 0.00 0.00 174.62 173.85 1ul9 s VAL 138 N -0.59 0.12 -0.22 3.82 1.01 -0.64 0.45 120.40 124.35 1ul9 s VAL 138 Ca 0.42 -0.03 -0.07 0.00 0.00 0.00 0.00 61.98 62.31 1ul9 s VAL 138 Cb -0.24 -0.55 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 1ul9 s VAL 138 CO 0.30 -0.04 0.05 -1.81 0.00 0.00 0.00 175.10 173.59 1ul9 s ASP 139 N 2.06 5.17 -0.14 3.32 1.11 -0.52 -0.31 116.67 127.35 1ul9 s ASP 139 Ca 0.03 -0.13 -0.01 0.00 0.18 0.00 0.00 52.55 52.62 1ul9 s ASP 139 Cb -0.14 -1.90 -0.02 0.00 1.07 0.00 0.00 42.92 41.93 1ul9 s ASP 139 CO -0.06 0.05 -0.11 -0.69 1.18 0.00 0.00 175.17 175.54 1ul9 s VAL 140 N 1.08 3.19 0.11 -1.27 1.01 0.50 -0.05 120.40 124.97 1ul9 s VAL 140 Ca 0.04 -0.61 0.08 0.00 0.00 0.00 0.00 61.98 61.48 1ul9 s VAL 140 Cb -0.14 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 1ul9 s VAL 140 CO 0.03 0.51 -0.12 -1.00 0.00 0.00 0.00 175.10 174.52 1ul9 s HIS 141 N 0.43 2.69 -0.76 5.22 3.76 0.10 -0.35 115.29 126.38 1ul9 s HIS 141 Ca -0.09 -0.18 0.26 0.00 -0.15 0.00 0.00 55.06 54.90 1ul9 s HIS 141 Cb -0.16 -1.41 0.78 0.00 1.11 0.00 0.00 32.58 32.91 1ul9 s HIS 141 CO 0.05 0.42 1.71 0.41 -0.85 0.00 0.00 174.74 176.47 1ul9 n GLY 142 N 0.72 -1.62 3.52 -2.22 0.00 -1.26 -1.63 105.19 102.70 1ul9 n GLY 142 Ca -0.14 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 1ul9 n GLY 142 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ul9 s LEU 143 N -4.23 -0.34 -0.05 0.99 2.34 -1.21 -3.78 118.68 112.40 1ul9 s LEU 143 Ca 0.10 0.02 -0.36 0.00 0.06 0.00 0.00 54.13 53.96 1ul9 s LEU 143 Cb 0.14 1.95 -0.14 0.00 -0.56 0.00 0.00 46.19 47.58 1ul9 s LEU 143 CO 0.61 -0.57 1.73 0.18 -1.06 0.00 0.00 176.35 177.24 1ul9 n LEU 144 N -0.18 2.96 -4.90 1.48 4.77 -1.25 -4.84 117.00 115.04 1ul9 n LEU 144 Ca -0.08 1.03 -0.29 0.00 -0.03 0.00 0.00 56.01 56.65 1ul9 n LEU 144 Cb 0.61 -1.32 0.06 0.00 -2.33 0.00 0.00 43.42 40.44 1ul9 n LEU 144 CO 0.11 -0.29 0.71 -2.16 -1.33 0.00 0.00 177.39 174.43 1ul9 s PRO 145 N 2.89 2.52 0.62 3.23 0.04 -1.26 -5.00 135.00 138.05 1ul9 s PRO 145 Ca 0.90 0.20 -0.18 0.00 0.04 0.00 0.00 61.00 61.96 1ul9 s PRO 145 Cb -0.79 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.64 1ul9 s PRO 145 CO 0.51 -1.18 0.90 -2.30 0.04 0.00 0.00 177.00 174.97 1ul9 n PRO 146 N -3.02 0.77 -4.48 0.56 -0.02 -1.26 -4.98 135.00 122.57 1ul9 n PRO 146 Ca 0.07 0.31 -0.34 0.00 -2.02 0.00 0.00 63.50 61.52 1ul9 n PRO 146 Cb 0.59 -2.11 -0.11 0.00 -0.02 0.00 0.00 33.50 31.84 1ul9 n PRO 146 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ul9 s LEU 147 N -1.82 3.28 0.75 2.45 1.43 -1.26 -5.11 118.68 118.40 1ul9 s LEU 147 Ca 0.75 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.71 1ul9 s LEU 147 Cb -0.41 -1.75 0.04 0.00 0.03 0.00 0.00 46.19 44.10 1ul9 s LEU 147 CO 0.48 0.28 1.08 -2.16 0.23 0.00 0.00 176.35 176.26 1ul9 s PRO 148 N -0.30 2.42 0.56 1.29 0.04 -1.26 -4.88 135.00 132.88 1ul9 s PRO 148 Ca 0.05 1.06 0.31 0.00 0.04 0.00 0.00 61.00 62.46 1ul9 s PRO 148 Cb -0.13 -1.92 1.45 0.00 0.04 0.00 0.00 34.50 33.94 1ul9 s PRO 148 CO 0.02 -1.49 1.84 -1.35 0.04 0.00 0.00 177.00 176.06 1ul9 h PRO 149 N -1.01 0.00 0.00 0.56 0.11 -2.06 -3.56 132.00 126.03 1ul9 h PRO 149 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1ul9 h PRO 149 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1ul9 h PRO 149 CO 0.54 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.33