#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g90 s PRO 2 N 0.00 -0.65 -0.12 0.00 0.04 -1.26 -4.97 135.00 128.04 1g90 s PRO 2 Ca 0.00 0.97 0.14 0.00 0.04 0.00 0.00 61.00 62.16 1g90 s PRO 2 Cb 0.00 -1.58 0.38 0.00 0.04 0.00 0.00 34.50 33.34 1g90 s PRO 2 CO 0.00 -3.58 1.28 1.63 0.04 0.00 0.00 177.00 176.37 1g90 n LYS 3 N -4.83 2.53 0.08 4.56 4.01 -1.26 -4.53 118.16 118.71 1g90 n LYS 3 Ca 0.04 -2.50 0.19 0.00 -0.51 0.00 0.00 58.31 55.53 1g90 n LYS 3 Cb 0.54 -1.57 0.73 0.00 -0.51 0.00 0.00 35.03 34.21 1g90 n LYS 3 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 1g90 h ASP 4 N 1.23 0.00 -0.07 4.39 3.32 -1.84 -3.41 116.42 120.04 1g90 h ASP 4 Ca 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1g90 h ASP 4 Cb 1.11 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.62 1g90 h ASP 4 CO 0.11 0.00 1.05 -0.46 -1.72 0.00 0.00 179.24 178.22 1g90 n ASN 5 N -4.16 -0.68 -3.67 6.45 0.23 -1.20 -3.59 115.26 108.62 1g90 n ASN 5 Ca 0.07 -1.28 -0.10 0.00 -0.53 0.00 0.00 54.58 52.73 1g90 n ASN 5 Cb 0.51 -0.92 -0.04 0.00 -2.08 0.00 0.00 39.78 37.24 1g90 n ASN 5 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1g90 s THR 6 N 5.12 0.05 0.04 5.53 -4.23 -0.37 -4.95 115.64 116.84 1g90 s THR 6 Ca 0.75 -0.65 0.03 0.00 -1.18 0.00 0.00 61.69 60.63 1g90 s THR 6 Cb -0.33 -1.31 -0.02 0.00 1.34 0.00 0.00 72.50 72.17 1g90 s THR 6 CO 0.24 -0.25 -0.09 0.86 -0.54 0.00 0.00 174.62 174.85 1g90 s TRP 7 N -3.83 0.77 0.02 3.99 -0.11 -1.26 -1.34 118.94 117.18 1g90 s TRP 7 Ca 0.05 -0.47 0.02 0.00 1.22 0.00 0.00 56.10 56.93 1g90 s TRP 7 Cb 0.01 -0.46 -0.01 0.00 -1.50 0.00 0.00 33.47 31.51 1g90 s TRP 7 CO -0.09 -0.05 -0.08 0.71 -4.62 0.00 0.00 176.95 172.82 1g90 s TYR 8 N -1.28 0.69 -0.14 5.86 1.51 0.81 -0.40 117.35 124.39 1g90 s TYR 8 Ca -0.08 -0.29 -0.10 0.00 -1.01 0.00 0.00 57.07 55.59 1g90 s TYR 8 Cb -0.10 -0.42 0.04 0.00 -0.11 0.00 0.00 41.96 41.38 1g90 s TYR 8 CO 0.01 -0.03 0.36 0.99 -1.11 0.00 0.00 175.55 175.77 1g90 s THR 9 N -0.73 -0.01 0.00 -0.71 2.01 -0.02 -1.07 115.64 115.10 1g90 s THR 9 Ca -0.03 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.03 1g90 s THR 9 Cb -0.06 -0.53 0.00 0.00 0.01 0.00 0.00 72.50 71.92 1g90 s THR 9 CO 0.00 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 1g90 n GLY 10 N 3.55 1.64 3.15 4.40 0.00 0.52 -0.50 105.19 117.94 1g90 n GLY 10 Ca -0.18 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.24 1g90 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g90 s ALA 11 N -1.00 0.83 0.00 4.61 0.00 0.07 -0.38 121.76 125.90 1g90 s ALA 11 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.57 1g90 s ALA 11 Cb 0.00 0.55 -0.00 0.00 0.00 0.00 0.00 23.12 23.66 1g90 s ALA 11 CO 0.00 -0.40 -0.01 0.21 0.00 0.00 0.00 175.76 175.56 1g90 s LYS 12 N -3.96 0.12 -0.02 0.00 2.20 -0.13 -1.57 119.74 116.37 1g90 s LYS 12 Ca 0.17 -0.16 0.06 0.00 -0.36 0.00 0.00 55.97 55.68 1g90 s LYS 12 Cb 0.07 -0.03 -0.01 0.00 -1.51 0.00 0.00 37.83 36.35 1g90 s LYS 12 CO -0.02 0.00 -0.19 -0.51 -0.36 0.00 0.00 175.35 174.27 1g90 s LEU 13 N -0.34 2.02 0.05 5.43 1.02 0.53 -0.77 118.68 126.63 1g90 s LEU 13 Ca -0.03 -0.35 0.04 0.00 0.02 0.00 0.00 54.13 53.81 1g90 s LEU 13 Cb -0.02 -1.00 -0.02 0.00 0.02 0.00 0.00 46.19 45.16 1g90 s LEU 13 CO -0.00 0.23 -0.12 -0.83 0.02 0.00 0.00 176.35 175.64 1g90 s GLY 14 N -0.39 0.74 -0.03 -3.19 0.00 0.73 -0.79 107.32 104.39 1g90 s GLY 14 Ca 0.06 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1g90 s GLY 14 CO -0.00 -0.87 0.00 -1.36 0.00 0.00 0.00 173.10 170.86 1g90 s PHE 15 N -1.12 0.31 0.24 1.90 0.08 0.97 -0.62 117.98 119.75 1g90 s PHE 15 Ca -0.03 0.00 0.04 0.00 0.12 0.00 0.00 56.93 57.07 1g90 s PHE 15 Cb -0.09 -0.42 -0.01 0.00 -0.57 0.00 0.00 43.02 41.93 1g90 s PHE 15 CO 0.01 -0.13 0.24 0.45 -0.10 0.00 0.00 175.22 175.69 1g90 n SER 16 N 4.18 -0.62 -0.25 1.36 2.88 0.19 -0.33 113.62 121.03 1g90 n SER 16 Ca -0.26 -2.52 0.06 0.00 -1.33 0.00 0.00 58.87 54.82 1g90 n SER 16 Cb 0.50 1.34 0.19 0.00 -0.75 0.00 0.00 64.21 65.49 1g90 n SER 16 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1g90 h GLN 17 N 0.00 0.33 0.00 -1.46 4.20 -1.76 0.43 115.11 116.85 1g90 h GLN 17 Ca -0.17 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1g90 h GLN 17 Cb 0.86 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1g90 h GLN 17 CO 0.25 0.22 0.00 2.48 -0.67 0.00 0.00 178.83 181.10 1g90 n TYR 18 N -5.09 0.00 0.00 2.96 4.11 -1.26 -1.97 117.16 115.90 1g90 n TYR 18 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.04 1g90 n TYR 18 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.79 1g90 n TYR 18 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.86 178.44 1g90 n HIS 19 N -0.08 0.00 -0.07 -3.48 -0.00 -0.84 -4.40 115.22 106.36 1g90 n HIS 19 Ca 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 57.72 57.90 1g90 n HIS 19 Cb 0.00 0.00 0.60 0.00 -0.00 0.00 0.00 29.99 30.59 1g90 n HIS 19 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.34 176.72 1g90 h ASP 20 N 0.00 0.18 -5.47 0.26 2.03 -1.85 -3.43 116.42 108.14 1g90 h ASP 20 Ca 0.00 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 1g90 h ASP 20 Cb 0.00 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.47 1g90 h ASP 20 CO 0.00 0.10 -0.80 0.41 -1.03 0.00 0.00 179.24 177.91 1g90 n THR 21 N -4.42 -1.64 -0.70 1.15 -1.04 -1.26 -4.75 114.28 101.62 1g90 n THR 21 Ca 0.11 0.40 -0.13 0.00 -2.04 0.00 0.00 64.05 62.40 1g90 n THR 21 Cb 0.55 -2.49 -0.08 0.00 -1.82 0.00 0.00 70.33 66.49 1g90 n THR 21 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1g90 n GLY 22 N 1.20 2.57 0.00 3.41 0.00 -1.26 -4.88 105.19 106.23 1g90 n GLY 22 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1g90 n GLY 22 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1g90 n PHE 23 N 3.07 0.00 0.27 1.61 -1.74 -1.26 -0.59 117.46 118.83 1g90 n PHE 23 Ca 0.34 0.00 0.15 0.00 -0.56 0.00 0.00 57.45 57.38 1g90 n PHE 23 Cb 0.47 0.00 0.77 0.00 1.52 0.00 0.00 39.48 42.24 1g90 n PHE 23 CO 0.00 0.00 0.00 0.97 -0.56 0.00 0.00 176.76 177.17 1g90 h ILE 24 N 0.00 0.35 0.01 1.97 6.09 -1.87 0.29 117.51 124.35 1g90 h ILE 24 Ca 0.00 -0.51 -0.06 0.00 -1.37 0.00 0.00 64.86 62.92 1g90 h ILE 24 Cb 0.00 1.37 0.01 0.00 0.47 0.00 0.00 36.82 38.67 1g90 h ILE 24 CO 0.00 0.08 -0.25 0.78 -3.07 0.00 0.00 178.15 175.69 1g90 h ASN 25 N 0.00 0.20 0.00 2.19 2.35 -1.92 -3.45 115.58 114.96 1g90 h ASN 25 Ca -0.00 -0.81 0.00 0.00 -0.55 0.00 0.00 56.30 54.93 1g90 h ASN 25 Cb 0.36 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1g90 h ASN 25 CO 0.01 0.99 0.00 -0.46 -1.65 0.00 0.00 177.43 176.33 1g90 n ASN 26 N -4.50 0.00 0.00 5.81 6.94 0.24 -4.96 115.26 118.80 1g90 n ASN 26 Ca -0.10 -0.97 0.00 0.00 -0.02 0.00 0.00 54.58 53.49 1g90 n ASN 26 Cb 0.52 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 1g90 n ASN 26 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1g90 n ASN 27 N 0.00 0.04 0.00 0.53 4.05 -0.34 -4.95 115.26 114.60 1g90 n ASN 27 Ca 0.00 -0.31 0.00 0.00 0.45 0.00 0.00 54.58 54.72 1g90 n ASN 27 Cb 0.24 0.44 0.00 0.00 1.23 0.00 0.00 39.78 41.69 1g90 n ASN 27 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1g90 n GLY 28 N 0.44 -0.03 0.31 8.20 0.00 0.87 -4.86 105.19 110.12 1g90 n GLY 28 Ca 0.00 -1.30 0.09 0.00 0.00 0.00 0.00 46.02 44.81 1g90 n GLY 28 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1g90 h PRO 29 N 0.00 0.27 0.00 1.61 0.13 -1.86 -3.38 132.00 128.77 1g90 h PRO 29 Ca 0.00 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1g90 h PRO 29 Cb 0.00 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.07 1g90 h PRO 29 CO 0.00 0.18 0.00 2.41 -0.23 0.00 0.00 178.00 180.36 1g90 n THR 30 N -4.48 0.00 0.00 1.56 -1.04 -1.26 -4.79 114.28 104.27 1g90 n THR 30 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1g90 n THR 30 Cb 0.21 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 1g90 n THR 30 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1g90 n HIS 31 N 0.00 0.00 0.00 -1.42 1.44 -1.19 -4.89 115.22 109.15 1g90 n HIS 31 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1g90 n HIS 31 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 1g90 n HIS 31 CO 0.00 0.00 0.00 -0.85 -2.81 0.00 0.00 176.34 172.68 1g90 n GLU 32 N -0.77 0.00 0.00 -1.40 0.28 -0.83 -4.87 120.64 113.05 1g90 n GLU 32 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1g90 n GLU 32 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1g90 n GLU 32 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1g90 n ASN 33 N 0.00 0.00 -3.63 -1.84 0.23 0.05 -4.91 115.26 105.16 1g90 n ASN 33 Ca 0.00 0.00 -0.11 0.00 -0.53 0.00 0.00 54.58 53.94 1g90 n ASN 33 Cb 0.00 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 37.63 1g90 n ASN 33 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 1g90 s GLN 34 N 0.00 0.73 0.22 -3.83 0.74 -0.67 -4.73 119.66 112.13 1g90 s GLN 34 Ca 0.00 0.96 0.00 0.00 0.05 0.00 0.00 55.36 56.37 1g90 s GLN 34 Cb 0.00 0.31 0.00 0.00 1.10 0.00 0.00 33.01 34.42 1g90 s GLN 34 CO 0.00 -0.10 0.00 -0.11 -0.55 0.00 0.00 175.29 174.53 1g90 n LEU 35 N 2.98 -0.01 0.00 3.68 -0.00 0.21 -0.64 117.00 123.22 1g90 n LEU 35 Ca -0.15 0.37 0.00 0.00 -0.00 0.00 0.00 56.01 56.23 1g90 n LEU 35 Cb 0.56 0.26 0.00 0.00 -0.00 0.00 0.00 43.42 44.24 1g90 n LEU 35 CO 0.02 -0.73 0.00 0.61 -0.00 0.00 0.00 177.39 177.29 1g90 n GLY 36 N 1.77 -1.25 3.53 -3.96 0.00 -0.68 -4.75 105.19 99.85 1g90 n GLY 36 Ca 0.00 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.01 1g90 n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g90 s ALA 37 N -1.00 0.02 0.08 4.61 0.00 -1.26 -0.19 121.76 124.02 1g90 s ALA 37 Ca 0.00 -1.04 -0.23 0.00 0.00 0.00 0.00 51.96 50.70 1g90 s ALA 37 Cb 0.00 1.12 0.08 0.00 0.00 0.00 0.00 23.12 24.32 1g90 s ALA 37 CO 0.00 -0.81 1.06 0.41 0.00 0.00 0.00 175.76 176.42 1g90 n GLY 38 N -0.38 0.46 3.94 0.00 0.00 0.05 -4.97 105.19 104.29 1g90 n GLY 38 Ca -0.01 -1.09 -0.24 0.00 0.00 0.00 0.00 46.02 44.68 1g90 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g90 s ALA 39 N -1.95 3.71 0.05 4.61 0.00 0.14 -0.96 121.76 127.36 1g90 s ALA 39 Ca 0.24 -0.89 -0.06 0.00 0.00 0.00 0.00 51.96 51.26 1g90 s ALA 39 Cb -0.02 -2.10 -0.01 0.00 0.00 0.00 0.00 23.12 20.99 1g90 s ALA 39 CO 0.02 0.05 0.11 0.12 0.00 0.00 0.00 175.76 176.06 1g90 s PHE 40 N -2.24 0.22 0.22 0.00 5.36 0.49 -0.72 117.98 121.31 1g90 s PHE 40 Ca 0.40 -0.58 -0.23 0.00 -0.96 0.00 0.00 56.93 55.56 1g90 s PHE 40 Cb -0.10 -0.15 0.05 0.00 -0.34 0.00 0.00 43.02 42.48 1g90 s PHE 40 CO 0.35 -0.41 0.88 0.20 -1.46 0.00 0.00 175.22 174.78 1g90 s GLY 41 N -2.39 -0.09 0.07 13.12 0.00 0.07 -0.35 107.32 117.75 1g90 s GLY 41 Ca -0.01 -0.15 -0.27 0.00 0.00 0.00 0.00 44.72 44.29 1g90 s GLY 41 CO -0.07 0.20 0.98 -0.32 0.00 0.00 0.00 173.10 173.90 1g90 s GLY 42 N -3.00 -0.33 -0.13 0.20 0.00 -0.23 -0.08 107.32 103.75 1g90 s GLY 42 Ca 0.13 0.54 -0.08 0.00 0.00 0.00 0.00 44.72 45.30 1g90 s GLY 42 CO 0.05 0.15 0.32 -2.52 0.00 0.00 0.00 173.10 171.09 1g90 s TYR 43 N -3.10 -0.42 0.19 1.90 1.13 0.32 -0.13 117.35 117.23 1g90 s TYR 43 Ca 0.10 0.96 0.10 0.00 -1.41 0.00 0.00 57.07 56.82 1g90 s TYR 43 Cb -0.01 0.14 -0.04 0.00 -1.10 0.00 0.00 41.96 40.95 1g90 s TYR 43 CO -0.02 -0.24 -0.22 -0.65 -2.51 0.00 0.00 175.55 171.90 1g90 s GLN 44 N 0.94 1.44 0.22 -3.49 -0.21 -0.45 -0.62 119.66 117.49 1g90 s GLN 44 Ca -0.06 -1.50 0.00 0.00 0.02 0.00 0.00 55.36 53.82 1g90 s GLN 44 Cb -0.07 -1.66 0.00 0.00 1.00 0.00 0.00 33.01 32.28 1g90 s GLN 44 CO -0.07 0.35 0.00 1.55 -2.12 0.00 0.00 175.29 175.00 1g90 n VAL 45 N 0.23 0.00 -2.12 1.09 3.14 -1.24 -1.24 118.33 118.20 1g90 n VAL 45 Ca -0.12 0.00 -0.34 0.00 -2.96 0.00 0.00 64.34 60.92 1g90 n VAL 45 Cb 0.57 -0.12 0.01 0.00 -1.06 0.00 0.00 33.84 33.24 1g90 n VAL 45 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 1g90 s ASN 46 N -2.69 5.67 -0.07 6.55 0.01 -1.19 -3.53 114.94 119.70 1g90 s ASN 46 Ca 0.00 2.00 -0.32 0.00 -0.71 0.00 0.00 52.86 53.83 1g90 s ASN 46 Cb 0.00 -2.56 -0.10 0.00 0.41 0.00 0.00 41.25 39.00 1g90 s ASN 46 CO 0.00 -1.24 1.97 -0.81 -1.51 0.00 0.00 177.10 175.51 1g90 n PRO 47 N -1.72 2.38 -1.25 -0.60 -0.04 -1.26 -2.39 135.00 130.11 1g90 n PRO 47 Ca 0.10 0.85 -0.09 0.00 -0.04 0.00 0.00 63.50 64.32 1g90 n PRO 47 Cb 0.52 -2.84 -0.04 0.00 -0.04 0.00 0.00 33.50 31.10 1g90 n PRO 47 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1g90 n TYR 48 N 7.70 0.00 -3.81 0.54 4.01 -1.26 -4.98 117.16 119.36 1g90 n TYR 48 Ca 0.23 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.83 1g90 n TYR 48 Cb 0.35 -2.36 -0.15 0.00 -0.31 0.00 0.00 39.34 36.87 1g90 n TYR 48 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1g90 s VAL 49 N -1.87 -0.03 0.00 -0.72 1.01 -1.01 -1.01 120.40 116.77 1g90 s VAL 49 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1g90 s VAL 49 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 36.38 36.32 1g90 s VAL 49 CO 0.00 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1g90 n GLY 50 N 3.78 2.82 3.11 4.51 0.00 0.33 -3.15 105.19 116.59 1g90 n GLY 50 Ca -0.22 -0.79 -0.11 0.00 0.00 0.00 0.00 46.02 44.90 1g90 n GLY 50 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1g90 s PHE 51 N -3.82 0.75 -0.01 1.61 5.36 0.21 -0.97 117.98 121.10 1g90 s PHE 51 Ca 0.00 -0.76 -0.11 0.00 -0.96 0.00 0.00 56.93 55.10 1g90 s PHE 51 Cb 0.00 -0.45 0.01 0.00 -0.34 0.00 0.00 43.02 42.25 1g90 s PHE 51 CO 0.00 -0.15 0.24 -2.00 -1.46 0.00 0.00 175.22 171.85 1g90 s GLU 52 N -2.90 0.56 0.27 10.12 2.12 0.86 -0.52 118.70 129.21 1g90 s GLU 52 Ca 0.02 -0.23 -0.11 0.00 0.36 0.00 0.00 54.97 55.02 1g90 s GLU 52 Cb -0.01 0.24 -0.00 0.00 0.26 0.00 0.00 34.13 34.62 1g90 s GLU 52 CO -0.03 -0.14 0.48 -1.64 -0.54 0.00 0.00 175.26 173.39 1g90 s MET 53 N -1.22 1.63 0.25 4.30 -1.94 0.88 -0.40 119.30 122.81 1g90 s MET 53 Ca -0.13 -1.36 -0.20 0.00 -1.71 0.00 0.00 55.69 52.29 1g90 s MET 53 Cb -0.06 0.47 0.07 0.00 2.01 0.00 0.00 34.83 37.32 1g90 s MET 53 CO 0.03 -0.68 0.96 0.20 -0.01 0.00 0.00 175.02 175.51 1g90 s GLY 54 N -3.06 0.21 -0.01 -0.03 0.00 -0.43 -0.75 107.32 103.23 1g90 s GLY 54 Ca 0.24 -0.49 -0.13 0.00 0.00 0.00 0.00 44.72 44.35 1g90 s GLY 54 CO 0.11 1.56 0.27 -0.47 0.00 0.00 0.00 173.10 174.57 1g90 s TYR 55 N -2.19 -0.14 0.03 1.90 5.04 0.10 -1.04 117.35 121.05 1g90 s TYR 55 Ca 0.20 0.20 0.04 0.00 -2.44 0.00 0.00 57.07 55.06 1g90 s TYR 55 Cb -0.03 0.06 -0.02 0.00 0.35 0.00 0.00 41.96 42.32 1g90 s TYR 55 CO 0.07 -0.36 -0.11 0.34 -1.34 0.00 0.00 175.55 174.16 1g90 s ASP 56 N -1.28 1.30 -0.38 4.32 2.15 0.33 -0.69 116.67 122.42 1g90 s ASP 56 Ca -0.13 -0.43 0.02 0.00 0.43 0.00 0.00 52.55 52.43 1g90 s ASP 56 Cb -0.06 -0.06 0.15 0.00 -0.30 0.00 0.00 42.92 42.66 1g90 s ASP 56 CO 0.03 -0.03 0.28 0.12 -0.17 0.00 0.00 175.17 175.41 1g90 s PHE 57 N -0.89 0.70 0.20 -5.34 5.36 -1.26 -1.50 117.98 115.26 1g90 s PHE 57 Ca -0.01 -1.78 -0.32 0.00 -0.96 0.00 0.00 56.93 53.85 1g90 s PHE 57 Cb -0.08 -0.83 -0.13 0.00 -0.34 0.00 0.00 43.02 41.64 1g90 s PHE 57 CO 0.01 -0.85 1.52 -0.11 -1.46 0.00 0.00 175.22 174.33 1g90 n LEU 58 N 3.59 3.25 0.00 6.12 7.94 -1.01 -0.87 117.00 136.03 1g90 n LEU 58 Ca 0.19 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 56.20 1g90 n LEU 58 Cb 0.42 -1.45 0.00 0.00 0.53 0.00 0.00 43.42 42.92 1g90 n LEU 58 CO 0.11 -0.31 0.00 0.61 -1.11 0.00 0.00 177.39 176.69 1g90 n GLY 59 N 2.84 3.10 4.71 -3.96 0.00 -1.26 -3.91 105.19 106.71 1g90 n GLY 59 Ca 0.14 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1g90 n GLY 59 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1g90 n ARG 60 N 0.00 0.00 -1.67 1.61 0.00 -0.05 -4.92 116.66 111.63 1g90 n ARG 60 Ca 0.00 0.00 -0.44 0.00 -0.00 0.00 0.00 57.85 57.41 1g90 n ARG 60 Cb 0.00 -2.43 -0.04 0.00 0.00 0.00 0.00 32.46 29.99 1g90 n ARG 60 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.63 177.51 1g90 n MET 61 N -0.48 2.59 -1.09 -0.14 1.56 -1.26 -4.87 117.12 113.43 1g90 n MET 61 Ca 0.00 0.95 -0.31 0.00 -0.27 0.00 0.00 57.70 58.07 1g90 n MET 61 Cb 0.00 -2.84 -0.04 0.00 2.15 0.00 0.00 33.22 32.49 1g90 n MET 61 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1g90 n PRO 62 N 6.61 3.01 -1.78 2.12 -0.04 -1.26 -4.91 135.00 138.74 1g90 n PRO 62 Ca 0.20 -1.83 -0.42 0.00 -0.04 0.00 0.00 63.50 61.41 1g90 n PRO 62 Cb 0.36 -2.60 -0.03 0.00 -0.04 0.00 0.00 33.50 31.19 1g90 n PRO 62 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1g90 s TYR 63 N 2.44 1.44 0.06 0.54 6.14 -1.26 -4.93 117.35 121.79 1g90 s TYR 63 Ca 0.59 0.65 -0.11 0.00 0.64 0.00 0.00 57.07 58.85 1g90 s TYR 63 Cb 0.17 -3.99 0.01 0.00 0.42 0.00 0.00 41.96 38.56 1g90 s TYR 63 CO -0.05 -3.45 0.24 0.21 0.64 0.00 0.00 175.55 173.14 1g90 s LYS 64 N 6.21 0.79 0.00 4.97 2.20 -1.26 -4.89 119.74 127.77 1g90 s LYS 64 Ca 0.91 -0.69 0.00 0.00 -0.36 0.00 0.00 55.97 55.83 1g90 s LYS 64 Cb -0.27 0.33 0.00 0.00 -1.51 0.00 0.00 37.83 36.38 1g90 s LYS 64 CO 0.33 -0.25 0.00 0.41 -0.36 0.00 0.00 175.35 175.48 1g90 n GLY 65 N 0.39 0.53 3.84 5.54 0.00 -1.26 -4.99 105.19 109.25 1g90 n GLY 65 Ca -0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.78 1g90 n GLY 65 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1g90 s SER 66 N -2.01 0.01 0.44 1.61 0.01 -1.26 -5.19 113.70 107.31 1g90 s SER 66 Ca 0.00 -0.93 0.06 0.00 1.31 0.00 0.00 55.95 56.38 1g90 s SER 66 Cb 0.00 0.69 -0.06 0.00 0.21 0.00 0.00 66.02 66.87 1g90 s SER 66 CO 0.00 -1.37 0.05 0.68 0.41 0.00 0.00 173.24 173.00 1g90 s VAL 67 N -2.23 1.84 0.25 3.43 -7.23 -1.26 -5.09 120.40 110.10 1g90 s VAL 67 Ca 0.18 -1.94 -0.22 0.00 -1.81 0.00 0.00 61.98 58.20 1g90 s VAL 67 Cb -0.04 -2.78 0.04 0.00 0.56 0.00 0.00 36.38 34.16 1g90 s VAL 67 CO 0.09 0.00 0.81 -0.70 -0.31 0.00 0.00 175.10 174.98 1g90 s GLU 68 N -3.80 1.64 0.94 4.82 -6.30 -1.26 -5.13 118.70 109.62 1g90 s GLU 68 Ca 0.29 -0.93 -0.12 0.00 -2.50 0.00 0.00 54.97 51.72 1g90 s GLU 68 Cb 0.07 0.54 0.15 0.00 0.00 0.00 0.00 34.13 34.90 1g90 s GLU 68 CO 0.15 -0.75 1.09 -0.80 0.02 0.00 0.00 175.26 174.97 1g90 s ASN 69 N -2.96 3.09 0.00 -1.70 0.01 -1.26 -5.09 114.94 107.03 1g90 s ASN 69 Ca 0.12 1.37 0.00 0.00 -0.71 0.00 0.00 52.86 53.64 1g90 s ASN 69 Cb -0.04 -2.05 0.00 0.00 0.41 0.00 0.00 41.25 39.57 1g90 s ASN 69 CO 0.06 -2.86 0.00 0.61 -1.51 0.00 0.00 177.10 173.40 1g90 n GLY 70 N -1.08 0.47 3.33 0.66 0.00 -1.26 -5.18 105.19 102.14 1g90 n GLY 70 Ca 0.06 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 1g90 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g90 s ALA 71 N -2.00 -0.93 0.43 4.61 0.00 -1.26 -5.16 121.76 117.45 1g90 s ALA 71 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.89 1g90 s ALA 71 Cb 0.00 0.71 0.00 0.00 0.00 0.00 0.00 23.12 23.83 1g90 s ALA 71 CO 0.00 -0.66 0.00 0.66 0.00 0.00 0.00 175.76 175.76 1g90 n TYR 72 N -0.24 -2.95 -3.85 0.00 4.01 -1.26 -5.12 117.16 107.74 1g90 n TYR 72 Ca -0.15 1.59 0.03 0.00 -0.16 0.00 0.00 57.90 59.21 1g90 n TYR 72 Cb 0.64 -2.69 0.01 0.00 -0.31 0.00 0.00 39.34 36.99 1g90 n TYR 72 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 1g90 s LYS 73 N -3.51 0.30 0.04 -0.72 -2.85 -0.63 -5.02 119.74 107.35 1g90 s LYS 73 Ca 0.00 -0.18 -0.00 0.00 -1.00 0.00 0.00 55.97 54.78 1g90 s LYS 73 Cb 0.00 0.09 -0.03 0.00 -2.06 0.00 0.00 37.83 35.83 1g90 s LYS 73 CO 0.00 -0.14 -0.03 0.00 0.10 0.00 0.00 175.35 175.28 1g90 s ALA 74 N -2.11 0.37 -0.01 0.59 0.00 -1.25 -0.24 121.76 119.11 1g90 s ALA 74 Ca 0.24 -0.96 -0.02 0.00 0.00 0.00 0.00 51.96 51.22 1g90 s ALA 74 Cb 0.02 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.35 1g90 s ALA 74 CO -0.02 -0.27 0.05 -0.65 0.00 0.00 0.00 175.76 174.87 1g90 s GLN 75 N -2.88 0.15 0.27 0.00 -0.21 -0.56 -2.40 119.66 114.03 1g90 s GLN 75 Ca -0.02 -0.08 -0.21 0.00 0.02 0.00 0.00 55.36 55.07 1g90 s GLN 75 Cb 0.00 0.06 0.04 0.00 1.00 0.00 0.00 33.01 34.12 1g90 s GLN 75 CO -0.06 -0.03 0.82 0.20 -2.12 0.00 0.00 175.29 174.10 1g90 s GLY 76 N -0.36 0.01 0.15 3.09 0.00 -0.56 -0.50 107.32 109.15 1g90 s GLY 76 Ca -0.04 -0.33 -0.07 0.00 0.00 0.00 0.00 44.72 44.28 1g90 s GLY 76 CO 0.00 0.09 0.23 -1.34 0.00 0.00 0.00 173.10 172.08 1g90 s VAL 77 N -3.25 0.08 0.07 1.40 -7.23 0.57 -0.52 120.40 111.54 1g90 s VAL 77 Ca 0.13 -1.46 0.10 0.00 -1.81 0.00 0.00 61.98 58.94 1g90 s VAL 77 Cb -0.05 -1.82 -0.03 0.00 0.56 0.00 0.00 36.38 35.04 1g90 s VAL 77 CO 0.07 -0.37 -0.26 -1.58 -0.31 0.00 0.00 175.10 172.65 1g90 s GLN 78 N -3.97 1.61 -0.14 4.82 0.74 -0.21 -0.25 119.66 122.25 1g90 s GLN 78 Ca 0.17 -1.17 -0.04 0.00 0.05 0.00 0.00 55.36 54.37 1g90 s GLN 78 Cb 0.04 -1.89 0.07 0.00 1.10 0.00 0.00 33.01 32.33 1g90 s GLN 78 CO -0.01 0.47 0.23 -0.48 -0.55 0.00 0.00 175.29 174.95 1g90 s LEU 79 N -1.52 -0.19 -0.06 3.68 2.34 -0.60 -1.32 118.68 121.01 1g90 s LEU 79 Ca 0.12 0.26 -0.13 0.00 0.06 0.00 0.00 54.13 54.44 1g90 s LEU 79 Cb -0.10 0.50 0.02 0.00 -0.56 0.00 0.00 46.19 46.06 1g90 s LEU 79 CO 0.03 -0.27 0.30 0.28 -1.06 0.00 0.00 176.35 175.63 1g90 s THR 80 N 2.36 0.03 0.40 5.48 -1.32 0.46 -1.48 115.64 121.58 1g90 s THR 80 Ca 0.04 -0.29 -0.13 0.00 -1.21 0.00 0.00 61.69 60.10 1g90 s THR 80 Cb -0.13 -0.53 -0.07 0.00 -1.51 0.00 0.00 72.50 70.26 1g90 s THR 80 CO -0.09 -0.16 0.80 0.00 -2.21 0.00 0.00 174.62 172.96 1g90 s ALA 81 N -0.69 3.29 -0.03 11.08 0.00 0.96 -0.10 121.76 136.28 1g90 s ALA 81 Ca -0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 51.96 51.78 1g90 s ALA 81 Cb -0.04 -2.79 0.01 0.00 0.00 0.00 0.00 23.12 20.30 1g90 s ALA 81 CO 0.02 0.04 0.08 0.21 0.00 0.00 0.00 175.76 176.12 1g90 s LYS 82 N -3.66 0.08 -0.01 0.00 2.20 -0.15 -1.48 119.74 116.73 1g90 s LYS 82 Ca 0.53 0.14 -0.04 0.00 -0.36 0.00 0.00 55.97 56.24 1g90 s LYS 82 Cb -0.10 0.00 -0.00 0.00 -1.51 0.00 0.00 37.83 36.22 1g90 s LYS 82 CO 0.28 -0.04 0.08 -0.48 -0.36 0.00 0.00 175.35 174.83 1g90 s LEU 83 N 0.23 1.75 0.00 5.43 2.34 -0.21 -0.51 118.68 127.70 1g90 s LEU 83 Ca -0.02 -0.14 0.00 0.00 0.06 0.00 0.00 54.13 54.03 1g90 s LEU 83 Cb -0.03 0.42 0.00 0.00 -0.56 0.00 0.00 46.19 46.02 1g90 s LEU 83 CO -0.01 -0.24 0.00 0.61 -1.06 0.00 0.00 176.35 175.65 1g90 n GLY 84 N 2.03 1.26 3.41 -3.48 0.00 -0.18 -0.24 105.19 107.97 1g90 n GLY 84 Ca -0.19 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.70 1g90 n GLY 84 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1g90 s TYR 85 N -2.00 -0.47 0.08 1.61 1.13 0.24 -4.34 117.35 113.60 1g90 s TYR 85 Ca 0.00 0.40 -0.30 0.00 -1.41 0.00 0.00 57.07 55.76 1g90 s TYR 85 Cb 0.00 0.43 -0.06 0.00 -1.10 0.00 0.00 41.96 41.23 1g90 s TYR 85 CO 0.00 -0.74 1.16 -1.25 -2.51 0.00 0.00 175.55 172.21 1g90 s PRO 86 N -3.05 4.47 0.00 -3.49 0.04 -1.26 -0.83 135.00 130.88 1g90 s PRO 86 Ca -0.02 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.74 1g90 s PRO 86 Cb -0.00 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.19 1g90 s PRO 86 CO -0.07 -0.17 1.26 0.44 0.04 0.00 0.00 177.00 178.50 1g90 n ILE 87 N 3.62 1.26 0.00 0.56 -5.35 -0.83 -4.74 119.36 113.88 1g90 n ILE 87 Ca 0.07 -0.29 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 1g90 n ILE 87 Cb 0.47 -1.26 0.00 0.00 -1.74 0.00 0.00 39.64 37.11 1g90 n ILE 87 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1g90 n THR 88 N 1.50 0.00 -1.14 7.28 -2.24 -1.26 -4.90 114.28 113.51 1g90 n THR 88 Ca 0.00 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.49 1g90 n THR 88 Cb 0.34 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 68.73 1g90 n THR 88 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1g90 s ASP 89 N 0.00 2.96 0.00 3.42 1.01 -1.26 -4.94 116.67 117.86 1g90 s ASP 89 Ca 0.00 1.38 0.00 0.00 0.71 0.00 0.00 52.55 54.64 1g90 s ASP 89 Cb 0.00 -2.05 0.00 0.00 1.01 0.00 0.00 42.92 41.88 1g90 s ASP 89 CO 0.00 -2.94 0.55 -0.90 0.21 0.00 0.00 175.17 172.09 1g90 n ASP 90 N -4.07 0.50 -4.62 0.27 5.75 -1.26 -4.73 116.55 108.39 1g90 n ASP 90 Ca 0.06 -1.60 -0.36 0.00 -0.01 0.00 0.00 54.79 52.88 1g90 n ASP 90 Cb 0.56 -0.25 -0.10 0.00 -1.03 0.00 0.00 41.12 40.30 1g90 n ASP 90 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1g90 s LEU 91 N -0.38 3.92 -0.34 -2.12 2.96 -1.26 -4.83 118.68 116.63 1g90 s LEU 91 Ca 0.00 0.05 -0.08 0.00 -0.22 0.00 0.00 54.13 53.87 1g90 s LEU 91 Cb 0.00 -2.04 0.02 0.00 0.50 0.00 0.00 46.19 44.68 1g90 s LEU 91 CO 0.00 0.08 0.14 -0.62 -1.32 0.00 0.00 176.35 174.63 1g90 s ASP 92 N 0.97 5.44 -0.01 3.68 2.15 -0.65 -1.97 116.67 126.29 1g90 s ASP 92 Ca 0.06 -0.91 0.02 0.00 0.43 0.00 0.00 52.55 52.15 1g90 s ASP 92 Cb -0.14 -1.94 -0.03 0.00 -0.30 0.00 0.00 42.92 40.51 1g90 s ASP 92 CO 0.03 -0.30 -0.04 0.27 -0.17 0.00 0.00 175.17 174.96 1g90 s ILE 93 N 1.50 3.85 0.07 4.11 -4.36 -0.01 -0.12 121.20 126.25 1g90 s ILE 93 Ca 0.01 -0.67 0.00 0.00 -0.26 0.00 0.00 60.65 59.74 1g90 s ILE 93 Cb -0.19 -2.68 -0.04 0.00 1.25 0.00 0.00 42.46 40.80 1g90 s ILE 93 CO 0.04 0.41 -0.05 -0.31 0.24 0.00 0.00 174.94 175.28 1g90 s TYR 94 N -1.01 0.68 0.07 1.37 2.02 0.35 -0.59 117.35 120.24 1g90 s TYR 94 Ca 0.17 -0.94 0.08 0.00 -0.37 0.00 0.00 57.07 56.02 1g90 s TYR 94 Cb -0.11 -0.44 -0.03 0.00 -0.40 0.00 0.00 41.96 40.98 1g90 s TYR 94 CO 0.08 -0.25 -0.21 0.99 -1.57 0.00 0.00 175.55 174.59 1g90 s THR 95 N -3.50 1.73 -0.03 -0.71 2.01 0.66 -0.60 115.64 115.20 1g90 s THR 95 Ca 0.07 -1.37 -0.06 0.00 0.31 0.00 0.00 61.69 60.64 1g90 s THR 95 Cb 0.05 -1.53 0.01 0.00 0.01 0.00 0.00 72.50 71.04 1g90 s THR 95 CO -0.07 0.10 0.14 -0.60 -0.69 0.00 0.00 174.62 173.51 1g90 s ARG 96 N -1.50 0.30 -0.04 4.92 3.00 0.22 -1.04 118.95 124.80 1g90 s ARG 96 Ca 0.07 -0.05 -0.13 0.00 -1.00 0.00 0.00 55.73 54.62 1g90 s ARG 96 Cb -0.09 0.13 0.02 0.00 0.00 0.00 0.00 34.95 35.01 1g90 s ARG 96 CO 0.03 -0.06 0.30 -1.17 0.00 0.00 0.00 175.30 174.40 1g90 s LEU 97 N -0.54 0.88 0.00 -0.88 0.20 -0.55 -0.54 118.68 117.25 1g90 s LEU 97 Ca -0.06 0.21 0.00 0.00 0.69 0.00 0.00 54.13 54.96 1g90 s LEU 97 Cb -0.04 1.18 0.00 0.00 -0.43 0.00 0.00 46.19 46.91 1g90 s LEU 97 CO 0.01 -0.36 0.00 0.61 -0.29 0.00 0.00 176.35 176.32 1g90 n GLY 98 N 1.69 -0.19 3.55 7.98 0.00 0.26 -0.03 105.19 118.45 1g90 n GLY 98 Ca -0.20 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 1g90 n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1g90 s GLY 99 N 0.00 1.14 0.04 -0.02 0.00 -0.55 -0.70 107.32 107.23 1g90 s GLY 99 Ca 0.00 -1.28 -0.01 0.00 0.00 0.00 0.00 44.72 43.43 1g90 s GLY 99 CO 0.00 -0.84 -0.03 -3.16 0.00 0.00 0.00 173.10 169.07 1g90 s MET 100 N -3.20 0.53 -0.07 2.90 0.23 -0.04 -1.56 119.30 118.10 1g90 s MET 100 Ca 0.27 -1.06 0.02 0.00 -1.03 0.00 0.00 55.69 53.88 1g90 s MET 100 Cb -0.01 0.18 0.02 0.00 -1.53 0.00 0.00 34.83 33.49 1g90 s MET 100 CO 0.16 -0.09 -0.10 0.08 -2.03 0.00 0.00 175.02 173.04 1g90 s VAL 101 N -3.29 0.97 -0.24 5.16 1.01 0.65 -0.73 120.40 123.93 1g90 s VAL 101 Ca 0.01 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 1g90 s VAL 101 Cb 0.03 -0.92 0.13 0.00 0.00 0.00 0.00 36.38 35.62 1g90 s VAL 101 CO -0.08 0.33 0.36 0.12 0.00 0.00 0.00 175.10 175.83 1g90 s PHE 102 N 0.89 -0.77 -0.44 5.22 5.36 0.20 -0.31 117.98 128.13 1g90 s PHE 102 Ca -0.11 0.78 -0.12 0.00 -0.96 0.00 0.00 56.93 56.53 1g90 s PHE 102 Cb -0.15 -0.01 0.08 0.00 -0.34 0.00 0.00 43.02 42.59 1g90 s PHE 102 CO 0.01 -0.71 0.32 0.50 -1.46 0.00 0.00 175.22 173.89 1g90 s ARG 103 N 2.53 2.79 -0.41 10.12 3.00 0.35 -0.65 118.95 136.66 1g90 s ARG 103 Ca 0.12 -1.40 -0.24 0.00 -1.00 0.00 0.00 55.73 53.20 1g90 s ARG 103 Cb -0.15 -3.95 0.02 0.00 0.00 0.00 0.00 34.95 30.87 1g90 s ARG 103 CO -0.15 -0.99 0.85 0.00 0.00 0.00 0.00 175.30 175.01 1g90 s ALA 104 N 1.53 3.34 -0.62 6.12 0.00 -1.26 -1.49 121.76 129.38 1g90 s ALA 104 Ca 0.03 -0.73 -0.26 0.00 0.00 0.00 0.00 51.96 51.01 1g90 s ALA 104 Cb -0.24 -3.50 0.04 0.00 0.00 0.00 0.00 23.12 19.42 1g90 s ALA 104 CO 0.04 -1.77 1.09 0.34 0.00 0.00 0.00 175.76 175.46 1g90 s ASP 105 N 2.04 6.30 -0.13 0.00 2.15 0.67 -4.84 116.67 122.86 1g90 s ASP 105 Ca 0.34 -0.36 0.16 0.00 0.43 0.00 0.00 52.55 53.12 1g90 s ASP 105 Cb -0.12 -2.49 0.60 0.00 -0.30 0.00 0.00 42.92 40.61 1g90 s ASP 105 CO 0.21 -1.47 1.51 0.35 -0.17 0.00 0.00 175.17 175.61 1g90 n THR 106 N 6.32 1.93 0.00 1.71 -2.24 -1.26 -1.60 114.28 119.14 1g90 n THR 106 Ca 0.03 -1.39 0.00 0.00 -2.27 0.00 0.00 64.05 60.42 1g90 n THR 106 Cb 0.48 0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1g90 n THR 106 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1g90 n LYS 107 N 0.47 0.00 -3.84 -0.78 0.00 -1.26 -4.70 118.16 108.05 1g90 n LYS 107 Ca 0.22 0.00 -0.09 0.00 0.00 0.00 0.00 58.31 58.44 1g90 n LYS 107 Cb 0.84 -1.90 0.02 0.00 0.00 0.00 0.00 35.03 33.99 1g90 n LYS 107 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1g90 s SER 108 N -0.10 0.11 -1.13 3.14 0.01 -1.26 -5.07 113.70 109.40 1g90 s SER 108 Ca 0.00 -1.19 -0.22 0.00 1.31 0.00 0.00 55.95 55.85 1g90 s SER 108 Cb 0.00 0.83 -0.03 0.00 0.21 0.00 0.00 66.02 67.03 1g90 s SER 108 CO 0.00 -1.65 1.85 0.20 0.41 0.00 0.00 173.24 174.05 1g90 s ASN 109 N -3.09 5.55 1.17 2.44 0.01 -1.26 -4.96 114.94 114.80 1g90 s ASN 109 Ca 0.17 -1.58 -0.18 0.00 -0.71 0.00 0.00 52.86 50.56 1g90 s ASN 109 Cb -0.05 -2.58 0.25 0.00 0.41 0.00 0.00 41.25 39.29 1g90 s ASN 109 CO 0.12 -2.48 1.02 0.55 -1.51 0.00 0.00 177.10 174.81 1g90 n VAL 110 N 7.46 0.00 0.00 1.60 3.14 -1.26 -4.90 118.33 124.36 1g90 n VAL 110 Ca 0.43 -0.53 0.00 0.00 -2.96 0.00 0.00 64.34 61.28 1g90 n VAL 110 Cb 0.47 -1.30 0.00 0.00 -1.06 0.00 0.00 33.84 31.95 1g90 n VAL 110 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1g90 n TYR 111 N -4.37 0.00 -0.75 1.45 9.36 -1.26 -4.86 117.16 116.72 1g90 n TYR 111 Ca 0.14 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 61.04 1g90 n TYR 111 Cb 0.52 -0.05 0.14 0.00 -0.63 0.00 0.00 39.34 39.32 1g90 n TYR 111 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1g90 n GLY 112 N 0.76 -1.58 0.00 2.98 0.00 -1.26 -5.05 105.19 101.04 1g90 n GLY 112 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1g90 n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1g90 n LYS 113 N -2.49 3.10 0.00 1.61 5.02 -1.26 -5.01 118.16 119.13 1g90 n LYS 113 Ca 0.08 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.45 1g90 n LYS 113 Cb 0.53 0.00 0.47 0.00 -0.02 0.00 0.00 35.03 36.01 1g90 n LYS 113 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1g90 n ASN 114 N 0.00 0.00 -4.45 4.39 3.02 -1.26 -4.78 115.26 112.18 1g90 n ASN 114 Ca 0.00 -0.76 -0.29 0.00 -0.03 0.00 0.00 54.58 53.50 1g90 n ASN 114 Cb 0.00 0.00 0.19 0.00 -0.61 0.00 0.00 39.78 39.36 1g90 n ASN 114 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 1g90 s HIS 115 N -2.00 1.68 0.38 3.10 -3.43 -1.26 -4.91 115.29 108.84 1g90 s HIS 115 Ca 0.24 0.83 -0.26 0.00 -0.80 0.00 0.00 55.06 55.06 1g90 s HIS 115 Cb 0.11 -3.34 -0.11 0.00 -1.43 0.00 0.00 32.58 27.81 1g90 s HIS 115 CO 0.18 -3.17 1.08 -0.25 -2.00 0.00 0.00 174.74 170.58 1g90 n ASP 116 N -4.33 1.64 -2.75 7.38 9.92 -1.26 -4.93 116.55 122.21 1g90 n ASP 116 Ca 0.07 1.10 -0.03 0.00 -0.53 0.00 0.00 54.79 55.40 1g90 n ASP 116 Cb 0.58 -1.38 0.06 0.00 -0.64 0.00 0.00 41.12 39.75 1g90 n ASP 116 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 1g90 n THR 117 N -0.19 0.88 0.00 -3.53 5.66 -1.24 -4.75 114.28 111.11 1g90 n THR 117 Ca 0.08 -2.52 0.00 0.00 -3.05 0.00 0.00 64.05 58.56 1g90 n THR 117 Cb 0.37 1.07 0.00 0.00 -1.55 0.00 0.00 70.33 70.22 1g90 n THR 117 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1g90 n GLY 118 N -0.61 -0.67 3.17 1.09 0.00 0.17 -4.88 105.19 103.46 1g90 n GLY 118 Ca 0.03 0.26 -0.10 0.00 0.00 0.00 0.00 46.02 46.20 1g90 n GLY 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g90 s VAL 119 N 0.00 0.11 0.06 1.61 0.11 -1.26 -0.62 120.40 120.40 1g90 s VAL 119 Ca 0.00 -0.90 -0.08 0.00 -2.93 0.00 0.00 61.98 58.07 1g90 s VAL 119 Cb 0.00 -0.90 -0.00 0.00 -1.53 0.00 0.00 36.38 33.95 1g90 s VAL 119 CO 0.00 -0.50 0.15 -0.94 -3.33 0.00 0.00 175.10 170.49 1g90 s SER 120 N -2.07 0.13 0.59 3.54 1.04 0.09 -4.91 113.70 112.10 1g90 s SER 120 Ca -0.05 -0.54 -0.15 0.00 0.48 0.00 0.00 55.95 55.69 1g90 s SER 120 Cb -0.01 0.28 -0.04 0.00 0.10 0.00 0.00 66.02 66.35 1g90 s SER 120 CO -0.04 -0.60 1.03 -2.16 0.98 0.00 0.00 173.24 172.45 1g90 s PRO 121 N -3.08 3.47 -0.13 4.02 0.04 -1.26 -0.86 135.00 137.19 1g90 s PRO 121 Ca -0.01 1.06 -0.06 0.00 0.04 0.00 0.00 61.00 62.04 1g90 s PRO 121 Cb 0.01 -2.06 0.06 0.00 0.04 0.00 0.00 34.50 32.56 1g90 s PRO 121 CO -0.07 -0.68 0.29 0.14 0.04 0.00 0.00 177.00 176.72 1g90 s VAL 122 N -2.64 -0.27 0.03 -0.36 -7.23 0.13 -4.77 120.40 105.29 1g90 s VAL 122 Ca 0.61 0.20 0.03 0.00 -1.81 0.00 0.00 61.98 61.01 1g90 s VAL 122 Cb -0.14 -0.46 -0.02 0.00 0.56 0.00 0.00 36.38 36.32 1g90 s VAL 122 CO 0.39 0.08 -0.10 0.72 -0.31 0.00 0.00 175.10 175.89 1g90 s PHE 123 N 1.93 0.87 0.28 2.82 -0.12 -1.26 -0.58 117.98 121.92 1g90 s PHE 123 Ca -0.04 -0.34 -0.18 0.00 -0.05 0.00 0.00 56.93 56.32 1g90 s PHE 123 Cb -0.11 -0.52 0.02 0.00 -0.63 0.00 0.00 43.02 41.77 1g90 s PHE 123 CO -0.09 -0.01 0.66 0.00 -0.05 0.00 0.00 175.22 175.73 1g90 s ALA 124 N -0.86 -0.92 0.28 1.99 0.00 0.30 -4.35 121.76 118.19 1g90 s ALA 124 Ca -0.02 -0.49 0.06 0.00 0.00 0.00 0.00 51.96 51.50 1g90 s ALA 124 Cb -0.07 0.89 -0.06 0.00 0.00 0.00 0.00 23.12 23.88 1g90 s ALA 124 CO 0.01 -0.99 -0.05 0.20 0.00 0.00 0.00 175.76 174.93 1g90 s GLY 125 N -2.96 1.82 0.14 0.00 0.00 -0.32 -0.61 107.32 105.39 1g90 s GLY 125 Ca 0.14 -1.90 -0.24 0.00 0.00 0.00 0.00 44.72 42.72 1g90 s GLY 125 CO 0.08 -1.82 1.06 -0.32 0.00 0.00 0.00 173.10 172.10 1g90 s GLY 126 N -3.43 -0.05 -0.00 0.20 0.00 0.23 -0.22 107.32 104.04 1g90 s GLY 126 Ca 0.30 -0.07 0.03 0.00 0.00 0.00 0.00 44.72 44.97 1g90 s GLY 126 CO 0.12 1.72 -0.09 -1.34 0.00 0.00 0.00 173.10 173.51 1g90 s VAL 127 N -2.50 0.68 0.03 1.40 -7.23 0.30 -0.50 120.40 112.58 1g90 s VAL 127 Ca 0.19 -0.42 0.02 0.00 -1.81 0.00 0.00 61.98 59.96 1g90 s VAL 127 Cb -0.01 -0.58 -0.02 0.00 0.56 0.00 0.00 36.38 36.33 1g90 s VAL 127 CO 0.03 0.16 -0.07 -1.61 -0.31 0.00 0.00 175.10 173.30 1g90 s GLU 128 N -0.29 0.47 0.19 4.82 2.02 0.82 -0.69 118.70 126.04 1g90 s GLU 128 Ca 0.03 -0.62 -0.11 0.00 0.02 0.00 0.00 54.97 54.28 1g90 s GLU 128 Cb -0.04 -0.25 -0.00 0.00 0.10 0.00 0.00 34.13 33.94 1g90 s GLU 128 CO -0.00 0.05 0.37 -0.47 0.02 0.00 0.00 175.26 175.22 1g90 s TYR 129 N -1.14 0.30 0.03 1.61 5.04 0.05 -1.64 117.35 121.60 1g90 s TYR 129 Ca -0.08 -0.65 0.06 0.00 -2.44 0.00 0.00 57.07 53.95 1g90 s TYR 129 Cb -0.08 0.08 -0.02 0.00 0.35 0.00 0.00 41.96 42.28 1g90 s TYR 129 CO 0.00 -0.81 -0.17 0.00 -1.34 0.00 0.00 175.55 173.23 1g90 s ALA 130 N -3.96 1.38 0.27 3.97 0.00 -1.26 -0.69 121.76 121.47 1g90 s ALA 130 Ca 0.17 -0.85 0.19 0.00 0.00 0.00 0.00 51.96 51.47 1g90 s ALA 130 Cb 0.02 -0.27 0.84 0.00 0.00 0.00 0.00 23.12 23.71 1g90 s ALA 130 CO 0.01 0.30 1.82 0.82 0.00 0.00 0.00 175.76 178.72 1g90 h ILE 131 N 4.53 0.91 0.00 0.00 5.03 -1.24 -3.48 117.51 123.27 1g90 h ILE 131 Ca -0.39 -1.27 0.00 0.00 -0.12 0.00 0.00 64.86 63.09 1g90 h ILE 131 Cb 1.17 1.75 0.00 0.00 -3.03 0.00 0.00 36.82 36.71 1g90 h ILE 131 CO 0.45 0.32 0.00 0.41 -0.68 0.00 0.00 178.15 178.65 1g90 n THR 132 N -3.69 0.00 -0.85 -0.27 -1.04 -1.26 -5.06 114.28 102.10 1g90 n THR 132 Ca -0.01 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.69 1g90 n THR 132 Cb 0.43 0.00 0.27 0.00 -1.82 0.00 0.00 70.33 69.21 1g90 n THR 132 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1g90 s PRO 133 N 0.00 -2.09 0.00 -2.82 0.04 -1.26 -4.88 135.00 123.99 1g90 s PRO 133 Ca 0.00 -0.13 0.00 0.00 0.04 0.00 0.00 61.00 60.91 1g90 s PRO 133 Cb 0.00 -1.50 0.00 0.00 0.04 0.00 0.00 34.50 33.04 1g90 s PRO 133 CO 0.00 -4.27 0.51 0.39 0.04 0.00 0.00 177.00 173.67 1g90 n GLU 134 N -5.14 0.00 -3.16 4.56 4.71 -1.26 -4.70 120.64 115.64 1g90 n GLU 134 Ca 0.15 0.12 -0.39 0.00 -0.01 0.00 0.00 57.16 57.03 1g90 n GLU 134 Cb 0.60 -1.57 -0.06 0.00 -1.01 0.00 0.00 31.44 29.41 1g90 n GLU 134 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1g90 s ILE 135 N -2.03 4.71 0.15 -3.67 1.01 -1.26 -0.37 121.20 119.75 1g90 s ILE 135 Ca 0.00 1.37 0.03 0.00 0.00 0.00 0.00 60.65 62.05 1g90 s ILE 135 Cb 0.00 -3.98 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 1g90 s ILE 135 CO 0.00 0.49 -0.06 0.00 0.00 0.00 0.00 174.94 175.37 1g90 s ALA 136 N -0.76 1.39 0.04 9.38 0.00 0.63 -0.63 121.76 131.81 1g90 s ALA 136 Ca 0.32 -1.52 0.03 0.00 0.00 0.00 0.00 51.96 50.79 1g90 s ALA 136 Cb -0.20 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 1g90 s ALA 136 CO 0.20 -0.18 -0.08 0.99 0.00 0.00 0.00 175.76 176.69 1g90 s THR 137 N -3.46 0.60 0.03 0.00 2.01 0.14 -0.39 115.64 114.57 1g90 s THR 137 Ca 0.19 -1.02 0.02 0.00 0.31 0.00 0.00 61.69 61.19 1g90 s THR 137 Cb 0.04 -0.64 -0.02 0.00 0.01 0.00 0.00 72.50 71.89 1g90 s THR 137 CO 0.01 -0.31 -0.08 -0.13 -0.69 0.00 0.00 174.62 173.43 1g90 s ARG 138 N -1.44 0.54 -0.09 4.92 0.52 0.44 -0.77 118.95 123.07 1g90 s ARG 138 Ca -0.08 -0.56 0.01 0.00 -0.52 0.00 0.00 55.73 54.58 1g90 s ARG 138 Cb -0.09 -0.41 0.02 0.00 0.52 0.00 0.00 34.95 34.99 1g90 s ARG 138 CO 0.01 0.09 -0.11 -0.51 0.02 0.00 0.00 175.30 174.80 1g90 s LEU 139 N -1.04 1.49 -0.03 2.53 1.43 0.14 -0.76 118.68 122.44 1g90 s LEU 139 Ca -0.05 -0.32 -0.01 0.00 -1.03 0.00 0.00 54.13 52.72 1g90 s LEU 139 Cb -0.07 -0.86 0.03 0.00 0.03 0.00 0.00 46.19 45.32 1g90 s LEU 139 CO 0.00 -0.03 0.05 -0.70 0.23 0.00 0.00 176.35 175.91 1g90 s GLU 140 N 1.10 -0.07 -0.03 1.70 2.12 -0.13 -0.54 118.70 122.84 1g90 s GLU 140 Ca -0.06 0.31 0.07 0.00 0.36 0.00 0.00 54.97 55.65 1g90 s GLU 140 Cb -0.14 -0.42 -0.02 0.00 0.26 0.00 0.00 34.13 33.81 1g90 s GLU 140 CO -0.02 -0.27 -0.25 -0.47 -0.54 0.00 0.00 175.26 173.71 1g90 s TYR 141 N 1.78 2.30 -0.17 5.30 5.04 0.69 -0.07 117.35 132.22 1g90 s TYR 141 Ca -0.00 -0.54 -0.01 0.00 -2.44 0.00 0.00 57.07 54.08 1g90 s TYR 141 Cb -0.12 -1.49 0.04 0.00 0.35 0.00 0.00 41.96 40.74 1g90 s TYR 141 CO -0.03 -0.11 -0.05 -1.14 -1.34 0.00 0.00 175.55 172.88 1g90 s GLN 142 N -0.40 1.41 0.17 4.97 -0.44 0.69 -1.18 119.66 124.89 1g90 s GLN 142 Ca 0.04 -0.52 0.04 0.00 -2.50 0.00 0.00 55.36 52.41 1g90 s GLN 142 Cb -0.11 -2.02 -0.05 0.00 -1.64 0.00 0.00 33.01 29.19 1g90 s GLN 142 CO 0.01 -0.44 -0.06 0.12 0.50 0.00 0.00 175.29 175.42 1g90 s PHE 143 N 1.63 1.33 0.00 1.67 5.36 -1.26 -0.91 117.98 125.80 1g90 s PHE 143 Ca 0.00 -0.85 0.00 0.00 -0.96 0.00 0.00 56.93 55.13 1g90 s PHE 143 Cb -0.15 -0.72 0.00 0.00 -0.34 0.00 0.00 43.02 41.81 1g90 s PHE 143 CO -0.08 -0.00 0.00 2.41 -1.46 0.00 0.00 175.22 176.09 1g90 n THR 144 N -0.26 0.00 -1.64 0.12 -1.04 -1.26 -4.89 114.28 105.32 1g90 n THR 144 Ca -0.08 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.50 1g90 n THR 144 Cb 0.62 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.10 1g90 n THR 144 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1g90 n ASN 145 N 0.35 3.81 -3.23 8.00 5.15 -1.26 -4.89 115.26 123.18 1g90 n ASN 145 Ca 0.00 0.64 -0.09 0.00 -0.60 0.00 0.00 54.58 54.53 1g90 n ASN 145 Cb 0.00 -1.53 0.00 0.00 -0.53 0.00 0.00 39.78 37.72 1g90 n ASN 145 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1g90 s ASN 146 N 5.89 0.03 0.37 1.20 3.84 -1.26 -4.84 114.94 120.16 1g90 s ASN 146 Ca 0.94 -1.04 0.17 0.00 0.21 0.00 0.00 52.86 53.13 1g90 s ASN 146 Cb -0.41 0.79 1.09 0.00 -0.55 0.00 0.00 41.25 42.17 1g90 s ASN 146 CO 0.40 -1.55 1.71 0.40 -2.79 0.00 0.00 177.10 175.27 1g90 h ILE 147 N 2.02 0.41 0.00 -5.21 2.04 -1.91 -3.46 117.51 111.41 1g90 h ILE 147 Ca -0.28 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.44 1g90 h ILE 147 Cb 1.25 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1g90 h ILE 147 CO 0.36 0.07 0.00 0.61 0.00 0.00 0.00 178.15 179.19 1g90 n GLY 148 N -1.39 1.62 3.69 5.37 0.00 -1.26 -5.12 105.19 108.11 1g90 n GLY 148 Ca 0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 1g90 n GLY 148 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1g90 s ASP 149 N -1.62 7.22 0.00 1.61 2.15 -1.26 -4.83 116.67 119.94 1g90 s ASP 149 Ca 0.00 1.65 0.03 0.00 0.43 0.00 0.00 52.55 54.66 1g90 s ASP 149 Cb 0.00 -2.56 0.05 0.00 -0.30 0.00 0.00 42.92 40.11 1g90 s ASP 149 CO 0.00 -0.43 0.92 0.00 -0.17 0.00 0.00 175.17 175.49 1g90 n ALA 150 N 4.72 2.12 0.96 3.66 0.00 -1.26 -5.02 120.51 125.69 1g90 n ALA 150 Ca 0.09 -0.96 0.13 0.00 0.00 0.00 0.00 53.44 52.70 1g90 n ALA 150 Cb 0.49 -0.42 0.58 0.00 0.00 0.00 0.00 19.45 20.09 1g90 n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1g90 n HIS 151 N 0.06 0.00 -4.03 0.00 8.25 -1.26 -4.88 115.22 113.36 1g90 n HIS 151 Ca -0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 1g90 n HIS 151 Cb 0.72 -0.47 -0.07 0.00 1.12 0.00 0.00 29.99 31.29 1g90 n HIS 151 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1g90 s THR 152 N -2.94 0.02 0.21 1.59 -4.23 -1.26 -5.17 115.64 103.87 1g90 s THR 152 Ca 0.15 -1.52 0.06 0.00 -1.18 0.00 0.00 61.69 59.20 1g90 s THR 152 Cb 0.17 -2.16 -0.05 0.00 1.34 0.00 0.00 72.50 71.81 1g90 s THR 152 CO 0.47 -0.08 -0.10 0.27 -0.54 0.00 0.00 174.62 174.63 1g90 s ILE 153 N -4.03 1.54 -5.00 2.99 -4.36 -1.26 -5.10 121.20 105.98 1g90 s ILE 153 Ca 0.24 -2.15 0.00 0.00 -0.26 0.00 0.00 60.65 58.49 1g90 s ILE 153 Cb 0.02 -2.14 0.00 0.00 1.25 0.00 0.00 42.46 41.59 1g90 s ILE 153 CO 0.07 -0.52 0.00 0.61 0.24 0.00 0.00 174.94 175.34 1g90 n GLY 154 N -0.40 0.61 3.55 6.27 0.00 -1.26 -5.03 105.19 108.93 1g90 n GLY 154 Ca -0.07 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 43.89 1g90 n GLY 154 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g90 s THR 155 N -2.87 3.38 -0.54 2.61 2.01 -1.26 -4.93 115.64 114.04 1g90 s THR 155 Ca 0.00 0.01 -0.08 0.00 0.31 0.00 0.00 61.69 61.94 1g90 s THR 155 Cb 0.00 -3.96 0.14 0.00 0.01 0.00 0.00 72.50 68.69 1g90 s THR 155 CO 0.00 -0.92 0.40 -0.13 -0.69 0.00 0.00 174.62 173.28 1g90 s ARG 156 N 7.04 2.58 0.22 4.92 0.52 -1.26 -4.75 118.95 128.22 1g90 s ARG 156 Ca 0.68 -2.04 0.15 0.00 -0.52 0.00 0.00 55.73 54.01 1g90 s ARG 156 Cb -0.11 -3.91 0.01 0.00 0.52 0.00 0.00 34.95 31.47 1g90 s ARG 156 CO 0.14 -1.19 1.30 -1.00 0.02 0.00 0.00 175.30 174.56 1g90 h PRO 157 N 7.99 0.00 -6.54 3.54 0.13 -1.90 -3.48 132.00 131.74 1g90 h PRO 157 Ca -0.12 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.59 1g90 h PRO 157 Cb 1.04 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.04 1g90 h PRO 157 CO 0.80 0.47 -0.68 -0.25 -0.23 0.00 0.00 178.00 178.11 1g90 n ASP 158 N -3.15 0.16 -0.28 1.44 9.92 -1.26 -4.84 116.55 118.54 1g90 n ASP 158 Ca -0.01 -0.89 0.08 0.00 -0.53 0.00 0.00 54.79 53.45 1g90 n ASP 158 Cb 0.76 -1.10 0.32 0.00 -0.64 0.00 0.00 41.12 40.46 1g90 n ASP 158 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 1g90 h ASN 159 N -0.92 0.77 0.00 -2.24 4.21 -1.93 -3.48 115.58 111.98 1g90 h ASN 159 Ca -0.46 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.08 1g90 h ASN 159 Cb 0.97 -0.13 0.00 0.00 -1.12 0.00 0.00 38.32 38.04 1g90 h ASN 159 CO 0.47 0.43 0.00 0.61 -1.29 0.00 0.00 177.43 177.65 1g90 n GLY 160 N -1.41 1.69 3.34 2.83 0.00 -1.26 -4.72 105.19 105.66 1g90 n GLY 160 Ca 0.16 -0.42 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 1g90 n GLY 160 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1g90 s MET 161 N 0.00 0.57 0.19 1.61 1.75 -0.09 -4.35 119.30 118.98 1g90 s MET 161 Ca 0.00 0.50 0.11 0.00 -1.25 0.00 0.00 55.69 55.04 1g90 s MET 161 Cb 0.00 0.27 -0.04 0.00 2.84 0.00 0.00 34.83 37.90 1g90 s MET 161 CO 0.00 -0.09 -0.21 -1.17 -0.65 0.00 0.00 175.02 172.90 1g90 s LEU 162 N -0.04 2.55 0.15 4.11 2.96 0.56 -0.22 118.68 128.74 1g90 s LEU 162 Ca -0.02 -0.81 -0.16 0.00 -0.22 0.00 0.00 54.13 52.92 1g90 s LEU 162 Cb -0.03 -1.27 0.03 0.00 0.50 0.00 0.00 46.19 45.42 1g90 s LEU 162 CO 0.02 0.12 0.43 -0.94 -1.32 0.00 0.00 176.35 174.65 1g90 s SER 163 N -2.71 -0.22 0.06 3.68 1.04 0.90 -0.02 113.70 116.43 1g90 s SER 163 Ca 0.22 -0.42 0.04 0.00 0.48 0.00 0.00 55.95 56.26 1g90 s SER 163 Cb -0.08 0.51 -0.03 0.00 0.10 0.00 0.00 66.02 66.52 1g90 s SER 163 CO 0.11 -0.93 -0.12 -0.22 0.98 0.00 0.00 173.24 173.07 1g90 s LEU 164 N -2.84 2.27 0.11 2.42 0.20 0.03 -0.96 118.68 119.91 1g90 s LEU 164 Ca 0.06 -0.59 -0.05 0.00 0.69 0.00 0.00 54.13 54.25 1g90 s LEU 164 Cb 0.01 -0.40 -0.02 0.00 -0.43 0.00 0.00 46.19 45.35 1g90 s LEU 164 CO -0.08 -0.12 0.14 -0.83 -0.29 0.00 0.00 176.35 175.18 1g90 s GLY 165 N -1.66 0.50 0.01 7.98 0.00 0.07 -0.35 107.32 113.86 1g90 s GLY 165 Ca -0.05 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 43.65 1g90 s GLY 165 CO 0.02 -1.05 -0.01 0.14 0.00 0.00 0.00 173.10 172.19 1g90 s VAL 166 N -3.95 0.05 0.22 1.40 1.01 -0.61 -0.42 120.40 118.11 1g90 s VAL 166 Ca 0.13 -0.26 -0.13 0.00 0.00 0.00 0.00 61.98 61.73 1g90 s VAL 166 Cb 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 36.34 1g90 s VAL 166 CO -0.05 -0.13 0.44 -0.55 0.00 0.00 0.00 175.10 174.81 1g90 s SER 167 N -0.41 -0.09 -0.14 3.32 0.15 0.47 -0.75 113.70 116.25 1g90 s SER 167 Ca -0.04 -0.84 0.00 0.00 0.70 0.00 0.00 55.95 55.78 1g90 s SER 167 Cb -0.03 0.55 -0.01 0.00 -1.71 0.00 0.00 66.02 64.82 1g90 s SER 167 CO -0.00 -1.07 -0.15 -0.47 1.20 0.00 0.00 173.24 172.75 1g90 s TYR 168 N -3.98 2.77 0.03 3.44 5.04 0.34 -0.27 117.35 124.72 1g90 s TYR 168 Ca 0.19 -0.88 -0.19 0.00 -2.44 0.00 0.00 57.07 53.75 1g90 s TYR 168 Cb 0.00 -1.85 -0.06 0.00 0.35 0.00 0.00 41.96 40.40 1g90 s TYR 168 CO 0.05 -0.36 0.56 -0.98 -1.34 0.00 0.00 175.55 173.47 1g90 s ARG 169 N 0.58 4.23 -0.11 4.97 1.04 0.51 -0.84 118.95 129.32 1g90 s ARG 169 Ca -0.09 0.69 -0.29 0.00 -1.04 0.00 0.00 55.73 55.00 1g90 s ARG 169 Cb -0.16 -3.29 -0.06 0.00 -2.04 0.00 0.00 34.95 29.41 1g90 s ARG 169 CO 0.03 0.52 1.92 -0.06 -0.04 0.00 0.00 175.30 177.68 1g90 s PHE 170 N -0.67 1.51 -1.71 5.89 0.40 0.46 -4.79 117.98 119.07 1g90 s PHE 170 Ca 0.29 0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.74 1g90 s PHE 170 Cb -0.19 -4.06 0.00 0.00 0.51 0.00 0.00 43.02 39.28 1g90 s PHE 170 CO 0.17 -4.36 0.00 0.41 0.70 0.00 0.00 175.22 172.15 1g90 n GLY 171 N 4.88 -1.68 0.00 4.36 0.00 -1.26 -4.75 105.19 106.74 1g90 n GLY 171 Ca 0.22 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1g90 n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g90 n GLN 172 N -0.31 0.00 0.00 1.61 10.64 -1.26 -5.02 117.38 123.04 1g90 n GLN 172 Ca 0.00 -0.01 0.00 0.00 -1.83 0.00 0.00 57.00 55.16 1g90 n GLN 172 Cb 0.00 -0.27 0.00 0.00 -0.86 0.00 0.00 30.24 29.11 1g90 n GLN 172 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1g90 n GLY 173 N 0.00 1.10 3.70 2.61 0.00 -1.26 -4.91 105.19 106.42 1g90 n GLY 173 Ca 0.00 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1g90 n GLY 173 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1g90 s GLU 174 N 0.00 1.73 -0.01 1.61 2.56 -1.26 -5.00 118.70 118.33 1g90 s GLU 174 Ca 0.00 1.76 0.09 0.00 0.00 0.00 0.00 54.97 56.82 1g90 s GLU 174 Cb 0.00 -1.79 -0.12 0.00 2.00 0.00 0.00 34.13 34.22 1g90 s GLU 174 CO 0.00 -2.15 0.26 0.00 -0.56 0.00 0.00 175.26 172.81 1g90 n ALA 175 N -3.18 2.61 0.46 6.30 0.00 -1.26 -5.14 120.51 120.29 1g90 n ALA 175 Ca 0.14 -0.22 0.04 0.00 0.00 0.00 0.00 53.44 53.39 1g90 n ALA 175 Cb 0.50 -0.31 0.22 0.00 0.00 0.00 0.00 19.45 19.87 1g90 n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50