#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 -0.52 0.13 0.00 0.04 -1.26 -4.97 135.00 128.43 1g90 s PRO 2 Ca 0.00 0.26 -0.33 0.00 0.04 0.00 0.00 61.00 60.97 1g90 s PRO 2 Cb 0.00 -1.65 -0.12 0.00 0.04 0.00 0.00 34.50 32.77 1g90 s PRO 2 CO 0.00 -3.31 1.71 1.17 0.04 0.00 0.00 177.00 176.61 1g90 n LYS 3 N -4.54 2.46 -2.18 4.56 0.00 -1.26 -4.94 118.16 112.26 1g90 n LYS 3 Ca 0.08 0.89 -0.41 0.00 0.00 0.00 0.00 58.31 58.87 1g90 n LYS 3 Cb 0.58 -2.72 -0.03 0.00 0.00 0.00 0.00 35.03 32.86 1g90 n LYS 3 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1g90 s ASP 4 N 1.82 6.85 0.16 3.14 1.01 -1.26 -4.65 116.67 123.74 1g90 s ASP 4 Ca 0.80 2.43 0.00 0.00 0.71 0.00 0.00 52.55 56.50 1g90 s ASP 4 Cb -0.59 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 40.73 1g90 s ASP 4 CO 0.38 -0.57 0.00 -3.20 0.21 0.00 0.00 175.17 171.99 1g90 n ASN 5 N 2.74 -5.79 -4.40 0.27 2.85 -0.27 -5.03 115.26 105.63 1g90 n ASN 5 Ca 0.07 0.71 -0.25 0.00 -0.11 0.00 0.00 54.58 55.00 1g90 n ASN 5 Cb 0.42 -2.61 -0.11 0.00 1.24 0.00 0.00 39.78 38.72 1g90 n ASN 5 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1g90 s THR 6 N -0.95 2.19 -0.10 -0.44 2.01 -0.28 -4.92 115.64 113.15 1g90 s THR 6 Ca 0.00 -2.04 0.04 0.00 0.31 0.00 0.00 61.69 59.99 1g90 s THR 6 Cb 0.00 -2.05 0.00 0.00 0.01 0.00 0.00 72.50 70.46 1g90 s THR 6 CO 0.00 -0.22 -0.22 0.26 -0.69 0.00 0.00 174.62 173.75 1g90 s TRP 7 N -1.91 2.40 -0.00 4.92 0.52 -1.26 -0.79 118.94 122.81 1g90 s TRP 7 Ca 0.20 -0.99 0.04 0.00 0.02 0.00 0.00 56.10 55.37 1g90 s TRP 7 Cb -0.07 -1.62 -0.03 0.00 -1.15 0.00 0.00 33.47 30.60 1g90 s TRP 7 CO 0.09 -0.41 -0.12 0.71 0.02 0.00 0.00 176.95 177.24 1g90 s TYR 8 N 0.43 2.75 0.08 -1.98 1.51 0.34 -0.38 117.35 120.10 1g90 s TYR 8 Ca -0.17 -0.13 -0.13 0.00 -1.01 0.00 0.00 57.07 55.63 1g90 s TYR 8 Cb -0.17 -1.58 0.02 0.00 -0.11 0.00 0.00 41.96 40.12 1g90 s TYR 8 CO 0.07 0.29 0.30 -0.08 -1.11 0.00 0.00 175.55 175.03 1g90 s THR 9 N -0.91 0.10 -0.32 -0.71 -1.32 -0.42 -0.48 115.64 111.59 1g90 s THR 9 Ca 0.15 -0.80 0.00 0.00 -1.21 0.00 0.00 61.69 59.83 1g90 s THR 9 Cb -0.11 -1.14 0.00 0.00 -1.51 0.00 0.00 72.50 69.74 1g90 s THR 9 CO 0.05 -0.44 0.00 0.61 -2.21 0.00 0.00 174.62 172.63 1g90 n GLY 10 N 0.11 -0.83 3.12 6.08 0.00 -0.22 -0.69 105.19 112.76 1g90 n GLY 10 Ca -0.17 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.04 0.05 4.61 0.00 -0.45 -0.93 121.76 124.00 1g90 s ALA 11 Ca 0.00 -0.59 -0.01 0.00 0.00 0.00 0.00 51.96 51.36 1g90 s ALA 11 Cb 0.00 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 1g90 s ALA 11 CO 0.00 -0.33 -0.02 -1.59 0.00 0.00 0.00 175.76 173.83 1g90 s LYS 12 N -2.72 0.62 0.24 0.00 0.00 0.22 -0.85 119.74 117.25 1g90 s LYS 12 Ca -0.04 -1.19 0.08 0.00 0.00 0.00 0.00 55.97 54.82 1g90 s LYS 12 Cb -0.00 0.22 -0.04 0.00 0.00 0.00 0.00 37.83 38.00 1g90 s LYS 12 CO -0.05 -0.12 0.08 -0.51 0.00 0.00 0.00 175.35 174.75 1g90 s LEU 13 N -2.89 3.47 0.24 2.77 1.02 0.51 -1.07 118.68 122.73 1g90 s LEU 13 Ca 0.06 -0.44 0.04 0.00 0.02 0.00 0.00 54.13 53.82 1g90 s LEU 13 Cb 0.07 -2.01 -0.05 0.00 0.02 0.00 0.00 46.19 44.22 1g90 s LEU 13 CO -0.10 0.00 -0.02 -0.83 0.02 0.00 0.00 176.35 175.43 1g90 s GLY 14 N -3.60 1.61 -0.03 -3.19 0.00 0.33 -0.66 107.32 101.79 1g90 s GLY 14 Ca 0.31 -1.79 -0.12 0.00 0.00 0.00 0.00 44.72 43.11 1g90 s GLY 14 CO 0.22 -1.71 0.27 -0.12 0.00 0.00 0.00 173.10 171.76 1g90 s PHE 15 N -3.32 -0.16 -0.33 1.90 2.19 -0.60 -0.53 117.98 117.13 1g90 s PHE 15 Ca 0.28 0.27 0.03 0.00 0.33 0.00 0.00 56.93 57.85 1g90 s PHE 15 Cb 0.05 0.07 0.19 0.00 -1.31 0.00 0.00 43.02 42.02 1g90 s PHE 15 CO 0.09 -0.33 0.69 0.45 1.83 0.00 0.00 175.22 177.95 1g90 s SER 16 N -1.10 -1.37 0.11 6.13 0.15 -0.66 -0.58 113.70 116.38 1g90 s SER 16 Ca -0.12 -0.13 -0.24 0.00 0.70 0.00 0.00 55.95 56.16 1g90 s SER 16 Cb -0.05 1.82 0.07 0.00 -1.71 0.00 0.00 66.02 66.14 1g90 s SER 16 CO 0.03 -0.22 0.59 -1.58 1.20 0.00 0.00 173.24 173.27 1g90 s GLN 17 N 2.50 1.21 0.00 5.44 0.74 -1.26 -0.27 119.66 128.03 1g90 s GLN 17 Ca 0.14 -0.35 0.00 0.00 0.05 0.00 0.00 55.36 55.20 1g90 s GLN 17 Cb -0.06 0.56 0.00 0.00 1.10 0.00 0.00 33.01 34.60 1g90 s GLN 17 CO -0.19 -0.50 0.00 0.98 -0.55 0.00 0.00 175.29 175.03 1g90 n TYR 18 N -0.10 0.00 -3.58 1.67 9.36 -1.26 -4.87 117.16 118.38 1g90 n TYR 18 Ca -0.17 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.05 1g90 n TYR 18 Cb 0.63 0.01 0.00 0.00 -0.63 0.00 0.00 39.34 39.36 1g90 n TYR 18 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69 1g90 n HIS 19 N -1.68 0.00 -1.51 2.98 1.44 -1.26 -5.05 115.22 110.14 1g90 n HIS 19 Ca 0.00 0.00 -0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1g90 n HIS 19 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 1g90 n HIS 19 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1g90 n ASP 20 N -0.71 -2.41 -3.49 4.39 9.92 -1.26 -4.81 116.55 118.19 1g90 n ASP 20 Ca 0.00 0.14 -0.37 0.00 -0.53 0.00 0.00 54.79 54.03 1g90 n ASP 20 Cb 0.00 -0.58 -0.04 0.00 -0.64 0.00 0.00 41.12 39.86 1g90 n ASP 20 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1g90 n THR 21 N 0.77 1.98 -0.29 -3.53 -2.24 -1.26 -4.25 114.28 105.45 1g90 n THR 21 Ca -0.00 -1.54 0.00 0.00 -2.27 0.00 0.00 64.05 60.24 1g90 n THR 21 Cb 0.19 -2.26 0.00 0.00 -2.10 0.00 0.00 70.33 66.16 1g90 n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1g90 n GLY 22 N 4.30 -0.89 3.36 3.38 0.00 -1.25 -4.08 105.19 110.01 1g90 n GLY 22 Ca 0.47 -0.95 -0.54 0.00 0.00 0.00 0.00 46.02 45.01 1g90 n GLY 22 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1g90 n PHE 23 N 1.65 1.29 0.28 1.61 7.35 -1.26 -4.23 117.46 124.16 1g90 n PHE 23 Ca 0.00 0.52 0.18 0.00 -0.76 0.00 0.00 57.45 57.38 1g90 n PHE 23 Cb 0.00 -2.41 0.96 0.00 0.35 0.00 0.00 39.48 38.39 1g90 n PHE 23 CO 0.00 0.00 0.00 -0.84 -0.76 0.00 0.00 176.76 175.16 1g90 h ILE 24 N 7.15 0.34 0.00 -2.13 -2.65 -1.92 0.36 117.51 118.65 1g90 h ILE 24 Ca -0.17 0.00 0.00 0.00 1.03 0.00 0.00 64.86 65.72 1g90 h ILE 24 Cb 1.37 0.93 0.00 0.00 -2.05 0.00 0.00 36.82 37.06 1g90 h ILE 24 CO 1.09 0.00 0.00 0.78 0.03 0.00 0.00 178.15 180.05 1g90 h ASN 25 N 0.00 0.00 0.00 2.16 4.21 -2.04 -3.24 115.58 116.67 1g90 h ASN 25 Ca 0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.54 1g90 h ASN 25 Cb 0.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 1g90 h ASN 25 CO -0.00 0.00 -0.40 -0.46 -1.29 0.00 0.00 177.43 175.28 1g90 n ASN 26 N -2.89 1.99 -0.46 5.81 6.94 -0.14 -4.97 115.26 121.53 1g90 n ASN 26 Ca -0.02 0.00 0.02 0.00 -0.02 0.00 0.00 54.58 54.56 1g90 n ASN 26 Cb 0.09 0.28 -0.01 0.00 -2.36 0.00 0.00 39.78 37.78 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 -0.90 -2.78 0.00 0.53 2.85 0.11 -0.40 115.26 114.68 1g90 n ASN 27 Ca 0.00 0.18 0.00 0.00 -0.11 0.00 0.00 54.58 54.65 1g90 n ASN 27 Cb 0.12 -0.59 0.00 0.00 1.24 0.00 0.00 39.78 40.55 1g90 n ASN 27 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1g90 n GLY 28 N -0.57 -0.19 1.20 8.20 0.00 -1.26 -3.28 105.19 109.28 1g90 n GLY 28 Ca 0.00 0.22 -0.10 0.00 0.00 0.00 0.00 46.02 46.14 1g90 n GLY 28 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1g90 n PRO 29 N 0.00 -1.20 -3.71 1.61 -0.04 -1.26 -3.83 135.00 126.57 1g90 n PRO 29 Ca 0.00 -0.62 -0.12 0.00 -0.04 0.00 0.00 63.50 62.73 1g90 n PRO 29 Cb 0.00 -0.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.89 1g90 n PRO 29 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1g90 s THR 30 N -1.78 0.08 0.43 0.52 2.01 -1.26 -4.37 115.64 111.27 1g90 s THR 30 Ca 0.24 -0.62 0.40 0.00 0.31 0.00 0.00 61.69 62.02 1g90 s THR 30 Cb -0.02 -1.00 0.42 0.00 0.01 0.00 0.00 72.50 71.91 1g90 s THR 30 CO 0.18 -0.34 2.21 1.12 -0.69 0.00 0.00 174.62 177.10 1g90 h HIS 31 N 3.01 0.00 -3.46 4.92 2.07 -1.95 -3.18 115.15 116.56 1g90 h HIS 31 Ca -0.32 0.00 -0.57 0.00 -2.85 0.00 0.00 60.37 56.63 1g90 h HIS 31 Cb 1.21 0.00 -0.39 0.00 2.57 0.00 0.00 27.41 30.80 1g90 h HIS 31 CO 0.42 0.00 -0.77 -1.21 -3.07 0.00 0.00 177.93 173.29 1g90 s GLU 32 N -3.96 1.15 -0.17 5.12 2.02 -1.26 -4.62 118.70 116.97 1g90 s GLU 32 Ca -0.03 -0.73 -0.13 0.00 0.02 0.00 0.00 54.97 54.10 1g90 s GLU 32 Cb 0.11 -2.36 0.05 0.00 0.10 0.00 0.00 34.13 32.04 1g90 s GLU 32 CO 0.44 -0.63 0.44 -0.80 0.02 0.00 0.00 175.26 174.73 1g90 s ASN 33 N 1.62 -0.50 0.00 -0.19 0.02 -1.20 -4.59 114.94 110.10 1g90 s ASN 33 Ca -0.03 0.91 0.00 0.00 -1.02 0.00 0.00 52.86 52.72 1g90 s ASN 33 Cb -0.18 0.87 0.00 0.00 0.02 0.00 0.00 41.25 41.96 1g90 s ASN 33 CO -0.07 -0.17 0.00 1.67 0.02 0.00 0.00 177.10 178.55 1g90 n GLN 34 N 3.42 0.00 -4.04 -0.60 7.27 0.63 -4.67 117.38 119.39 1g90 n GLN 34 Ca -0.17 0.00 -0.25 0.00 0.07 0.00 0.00 57.00 56.65 1g90 n GLN 34 Cb 0.56 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 33.15 1g90 n GLN 34 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1g90 s LEU 35 N 0.00 3.09 0.34 1.69 2.01 -1.26 -1.65 118.68 122.89 1g90 s LEU 35 Ca 0.00 -1.07 -0.18 0.00 0.01 0.00 0.00 54.13 52.90 1g90 s LEU 35 Cb 0.00 -1.48 0.04 0.00 0.01 0.00 0.00 46.19 44.76 1g90 s LEU 35 CO 0.00 -0.63 0.77 -0.83 1.01 0.00 0.00 176.35 176.67 1g90 s GLY 36 N -3.98 0.20 0.23 -3.19 0.00 0.31 -4.49 107.32 96.40 1g90 s GLY 36 Ca 0.40 -0.58 -0.20 0.00 0.00 0.00 0.00 44.72 44.34 1g90 s GLY 36 CO 0.22 -0.19 0.62 0.00 0.00 0.00 0.00 173.10 173.75 1g90 s ALA 37 N -2.87 -1.14 0.09 3.20 0.00 -1.26 -0.52 121.76 119.27 1g90 s ALA 37 Ca 0.14 -0.16 -0.26 0.00 0.00 0.00 0.00 51.96 51.68 1g90 s ALA 37 Cb -0.05 0.88 0.09 0.00 0.00 0.00 0.00 23.12 24.03 1g90 s ALA 37 CO 0.10 -0.90 1.13 0.20 0.00 0.00 0.00 175.76 176.29 1g90 s GLY 38 N -2.88 -0.11 0.19 0.00 0.00 -0.24 -0.81 107.32 103.48 1g90 s GLY 38 Ca 0.09 0.04 0.04 0.00 0.00 0.00 0.00 44.72 44.89 1g90 s GLY 38 CO 0.00 2.26 0.30 0.00 0.00 0.00 0.00 173.10 175.66 1g90 s ALA 39 N -2.38 3.90 0.20 3.20 0.00 0.24 -0.61 121.76 126.30 1g90 s ALA 39 Ca 0.20 -1.15 -0.13 0.00 0.00 0.00 0.00 51.96 50.88 1g90 s ALA 39 Cb -0.00 -1.70 0.01 0.00 0.00 0.00 0.00 23.12 21.42 1g90 s ALA 39 CO 0.02 0.39 0.42 -0.59 0.00 0.00 0.00 175.76 176.00 1g90 s PHE 40 N -1.87 0.21 0.22 0.00 -0.71 -0.10 -0.59 117.98 115.13 1g90 s PHE 40 Ca 0.34 -0.56 -0.23 0.00 -1.04 0.00 0.00 56.93 55.44 1g90 s PHE 40 Cb -0.10 0.16 0.05 0.00 -1.21 0.00 0.00 43.02 41.92 1g90 s PHE 40 CO 0.28 -0.86 0.88 0.20 -1.34 0.00 0.00 175.22 174.39 1g90 s GLY 41 N -2.95 -0.09 0.08 1.99 0.00 -0.19 -1.05 107.32 105.10 1g90 s GLY 41 Ca 0.16 -0.14 -0.27 0.00 0.00 0.00 0.00 44.72 44.47 1g90 s GLY 41 CO 0.01 0.21 0.96 -0.32 0.00 0.00 0.00 173.10 173.96 1g90 s GLY 42 N -3.00 -0.33 -0.17 0.20 0.00 0.37 -0.04 107.32 104.35 1g90 s GLY 42 Ca 0.13 0.51 0.01 0.00 0.00 0.00 0.00 44.72 45.37 1g90 s GLY 42 CO 0.05 0.14 -0.18 -2.52 0.00 0.00 0.00 173.10 170.58 1g90 s TYR 43 N -3.15 2.64 0.26 1.90 -0.85 0.28 -0.50 117.35 117.93 1g90 s TYR 43 Ca 0.10 -1.56 0.10 0.00 -0.52 0.00 0.00 57.07 55.19 1g90 s TYR 43 Cb -0.01 -1.84 -0.05 0.00 0.38 0.00 0.00 41.96 40.44 1g90 s TYR 43 CO -0.02 -0.78 -0.17 1.14 -1.52 0.00 0.00 175.55 174.19 1g90 s GLN 44 N 1.33 1.58 0.39 -3.49 1.03 0.03 -0.76 119.66 119.77 1g90 s GLN 44 Ca 0.05 -1.72 0.17 0.00 0.04 0.00 0.00 55.36 53.90 1g90 s GLN 44 Cb -0.13 -1.55 0.81 0.00 0.03 0.00 0.00 33.01 32.16 1g90 s GLN 44 CO -0.12 0.27 1.82 0.28 -2.54 0.00 0.00 175.29 175.00 1g90 h VAL 45 N 2.35 1.02 0.00 3.63 2.07 -1.02 -0.73 116.25 123.57 1g90 h VAL 45 Ca -0.39 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 65.82 1g90 h VAL 45 Cb 1.25 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 1g90 h VAL 45 CO 0.61 0.34 0.00 0.59 0.02 0.00 0.00 177.57 179.13 1g90 n ASN 46 N -3.79 0.00 0.00 0.57 3.02 -1.26 -1.11 115.26 112.69 1g90 n ASN 46 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.54 1g90 n ASN 46 Cb 0.43 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 1g90 n ASN 46 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1g90 n PRO 47 N 0.00 0.00 -0.51 3.52 -0.04 -1.26 -4.96 135.00 131.75 1g90 n PRO 47 Ca 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1g90 n PRO 47 Cb 0.00 -0.32 -0.00 0.00 -0.04 0.00 0.00 33.50 33.14 1g90 n PRO 47 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1g90 n TYR 48 N -0.12 0.00 -4.55 0.54 0.18 -1.26 -5.12 117.16 106.83 1g90 n TYR 48 Ca 0.00 -0.01 -0.22 0.00 1.88 0.00 0.00 57.90 59.55 1g90 n TYR 48 Cb 0.00 0.16 -0.14 0.00 -0.38 0.00 0.00 39.34 38.97 1g90 n TYR 48 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1g90 s VAL 49 N 0.00 1.16 -0.72 -3.48 1.01 -1.26 -2.39 120.40 114.72 1g90 s VAL 49 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.20 1g90 s VAL 49 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.39 1g90 s VAL 49 CO -0.00 0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.91 1g90 n GLY 50 N 2.39 -0.71 3.30 4.51 0.00 0.01 -0.44 105.19 114.25 1g90 n GLY 50 Ca -0.16 -0.71 -0.20 0.00 0.00 0.00 0.00 46.02 44.95 1g90 n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1g90 s PHE 51 N -3.00 1.66 0.08 1.61 0.40 0.06 -0.48 117.98 118.31 1g90 s PHE 51 Ca 0.00 -0.51 -0.12 0.00 -0.60 0.00 0.00 56.93 55.71 1g90 s PHE 51 Cb 0.00 -0.84 0.01 0.00 0.51 0.00 0.00 43.02 42.70 1g90 s PHE 51 CO 0.00 0.26 0.27 -2.00 0.70 0.00 0.00 175.22 174.45 1g90 s GLU 52 N -2.81 0.87 0.02 0.44 2.12 0.14 -0.56 118.70 118.92 1g90 s GLU 52 Ca 0.14 -0.75 -0.09 0.00 0.36 0.00 0.00 54.97 54.63 1g90 s GLU 52 Cb -0.05 0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.71 1g90 s GLU 52 CO 0.05 -0.29 0.18 -1.64 -0.54 0.00 0.00 175.26 173.02 1g90 s MET 53 N -3.37 0.61 0.08 4.30 -1.94 0.95 -0.23 119.30 119.69 1g90 s MET 53 Ca 0.01 -0.51 0.01 0.00 -1.71 0.00 0.00 55.69 53.49 1g90 s MET 53 Cb 0.02 0.25 -0.04 0.00 2.01 0.00 0.00 34.83 37.08 1g90 s MET 53 CO -0.08 -0.16 -0.06 0.20 -0.01 0.00 0.00 175.02 174.90 1g90 s GLY 54 N -1.76 0.65 -0.12 -0.03 0.00 0.12 -1.03 107.32 105.16 1g90 s GLY 54 Ca -0.09 -1.18 -0.02 0.00 0.00 0.00 0.00 44.72 43.42 1g90 s GLY 54 CO -0.01 -1.28 0.03 -0.19 0.00 0.00 0.00 173.10 171.65 1g90 s TYR 55 N -3.16 0.63 0.12 1.90 2.02 0.24 -0.58 117.35 118.52 1g90 s TYR 55 Ca 0.06 -0.33 0.09 0.00 -0.37 0.00 0.00 57.07 56.52 1g90 s TYR 55 Cb 0.02 -0.81 -0.04 0.00 -0.40 0.00 0.00 41.96 40.73 1g90 s TYR 55 CO -0.05 -0.42 -0.23 -0.51 -1.57 0.00 0.00 175.55 172.78 1g90 s ASP 56 N 1.99 2.86 0.51 2.29 1.11 0.32 -0.60 116.67 125.15 1g90 s ASP 56 Ca 0.03 -0.73 0.00 0.00 0.18 0.00 0.00 52.55 52.03 1g90 s ASP 56 Cb -0.14 -0.17 0.00 0.00 1.07 0.00 0.00 42.92 43.68 1g90 s ASP 56 CO -0.06 0.10 0.00 0.33 1.18 0.00 0.00 175.17 176.71 1g90 n PHE 57 N 0.94 -3.21 1.05 4.23 7.35 0.01 -4.49 117.46 123.34 1g90 n PHE 57 Ca -0.18 1.32 0.12 0.00 -0.76 0.00 0.00 57.45 57.95 1g90 n PHE 57 Cb 0.54 -2.37 0.24 0.00 0.35 0.00 0.00 39.48 38.24 1g90 n PHE 57 CO 0.00 0.00 0.00 1.47 -0.76 0.00 0.00 176.76 177.47 1g90 n LEU 58 N 0.00 2.60 0.00 -2.13 -0.00 -1.26 -4.89 117.00 111.32 1g90 n LEU 58 Ca 0.01 -0.92 0.00 0.00 -0.00 0.00 0.00 56.01 55.10 1g90 n LEU 58 Cb 0.48 -0.04 0.00 0.00 -0.00 0.00 0.00 43.42 43.86 1g90 n LEU 58 CO 0.01 0.46 0.00 0.61 -0.00 0.00 0.00 177.39 178.47 1g90 n GLY 59 N 1.31 0.50 0.62 1.47 0.00 -1.26 -0.24 105.19 107.59 1g90 n GLY 59 Ca 0.16 0.33 0.03 0.00 0.00 0.00 0.00 46.02 46.54 1g90 n GLY 59 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1g90 n ARG 60 N 0.00 0.41 -0.07 1.61 -4.01 -1.26 -4.10 116.66 109.24 1g90 n ARG 60 Ca 0.00 -1.74 -0.07 0.00 -1.04 0.00 0.00 57.85 55.00 1g90 n ARG 60 Cb 0.00 -0.71 -0.01 0.00 -3.04 0.00 0.00 32.46 28.71 1g90 n ARG 60 CO 0.00 0.00 0.00 0.52 -3.04 0.00 0.00 177.63 175.11 1g90 h MET 61 N 0.29 0.10 -4.06 2.89 2.86 -0.75 -3.24 114.93 113.02 1g90 h MET 61 Ca -0.05 -0.01 -0.69 0.00 -2.06 0.00 0.00 59.70 56.90 1g90 h MET 61 Cb 1.38 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 33.00 1g90 h MET 61 CO 0.02 0.07 2.97 -0.35 1.06 0.00 0.00 176.91 180.68 1g90 n PRO 62 N -5.14 2.57 0.00 -0.22 -0.04 -1.26 -4.56 135.00 126.35 1g90 n PRO 62 Ca -0.00 -2.40 0.00 0.00 -0.04 0.00 0.00 63.50 61.05 1g90 n PRO 62 Cb 0.14 -3.18 0.00 0.00 -0.04 0.00 0.00 33.50 30.42 1g90 n PRO 62 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1g90 n TYR 63 N 6.29 0.00 -3.29 0.54 4.01 -1.26 -4.71 117.16 118.75 1g90 n TYR 63 Ca 0.52 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.26 1g90 n TYR 63 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1g90 n TYR 63 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 1g90 n LYS 64 N 0.00 0.00 0.00 -0.72 2.85 -1.22 -5.00 118.16 114.07 1g90 n LYS 64 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1g90 n LYS 64 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1g90 n LYS 64 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1g90 n GLY 65 N 0.00 0.73 3.70 2.58 0.00 -1.26 -4.03 105.19 106.90 1g90 n GLY 65 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1g90 n GLY 65 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1g90 s SER 66 N -1.00 2.27 0.49 1.61 1.04 -1.26 -4.95 113.70 111.90 1g90 s SER 66 Ca 0.00 0.85 0.24 0.00 0.48 0.00 0.00 55.95 57.53 1g90 s SER 66 Cb 0.00 -1.30 1.29 0.00 0.10 0.00 0.00 66.02 66.12 1g90 s SER 66 CO 0.00 -3.31 2.02 -0.37 0.98 0.00 0.00 173.24 172.56 1g90 h VAL 67 N -2.02 0.69 0.00 5.02 -1.51 -1.96 -3.35 116.25 113.11 1g90 h VAL 67 Ca -0.50 -0.66 -0.00 0.00 -1.23 0.00 0.00 66.70 64.31 1g90 h VAL 67 Cb 1.31 1.41 -0.00 0.00 -2.13 0.00 0.00 31.29 31.88 1g90 h VAL 67 CO 0.49 0.15 -0.02 1.05 -1.23 0.00 0.00 177.57 178.02 1g90 h GLU 68 N 0.00 0.00 -4.87 5.19 9.09 -1.89 -3.46 114.58 118.63 1g90 h GLU 68 Ca -0.00 0.00 -0.44 0.00 0.05 0.00 0.00 59.36 58.96 1g90 h GLU 68 Cb 0.39 0.00 -0.13 0.00 -1.65 0.00 0.00 28.75 27.36 1g90 h GLU 68 CO 0.02 0.02 -0.52 -0.80 0.05 0.00 0.00 179.01 177.78 1g90 s ASN 69 N -5.51 1.57 0.25 3.06 0.02 -1.26 -5.04 114.94 108.04 1g90 s ASN 69 Ca -0.02 -1.69 0.01 0.00 -1.02 0.00 0.00 52.86 50.15 1g90 s ASN 69 Cb 0.11 0.52 -0.04 0.00 0.02 0.00 0.00 41.25 41.86 1g90 s ASN 69 CO 0.49 -1.01 0.15 -0.83 0.02 0.00 0.00 177.10 175.92 1g90 s GLY 70 N -3.37 1.75 0.00 0.66 0.00 -1.26 -4.89 107.32 100.21 1g90 s GLY 70 Ca 0.38 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 43.31 1g90 s GLY 70 CO 0.23 -1.48 0.00 0.00 0.00 0.00 0.00 173.10 171.85 1g90 n ALA 71 N -0.42 0.00 -2.56 3.20 0.00 -1.26 -4.80 120.51 114.67 1g90 n ALA 71 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.44 1g90 n ALA 71 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1g90 n ALA 71 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1g90 n TYR 72 N 0.00 -3.30 -2.02 0.00 4.19 -1.26 -5.01 117.16 109.77 1g90 n TYR 72 Ca 0.00 1.43 -0.34 0.00 3.31 0.00 0.00 57.90 62.30 1g90 n TYR 72 Cb 0.00 -3.67 0.02 0.00 0.49 0.00 0.00 39.34 36.19 1g90 n TYR 72 CO 0.00 0.00 0.00 0.21 0.91 0.00 0.00 176.86 177.98 1g90 s LYS 73 N -1.66 3.09 0.24 2.98 2.20 -1.26 -4.85 119.74 120.48 1g90 s LYS 73 Ca 0.06 1.49 -0.14 0.00 -0.36 0.00 0.00 55.97 57.02 1g90 s LYS 73 Cb -0.02 -1.98 0.00 0.00 -1.51 0.00 0.00 37.83 34.33 1g90 s LYS 73 CO 0.66 -1.04 0.50 0.00 -0.36 0.00 0.00 175.35 175.11 1g90 s ALA 74 N -2.06 -0.42 0.08 3.13 0.00 -1.26 -2.39 121.76 118.83 1g90 s ALA 74 Ca 0.70 -0.73 -0.09 0.00 0.00 0.00 0.00 51.96 51.84 1g90 s ALA 74 Cb -0.22 1.00 0.00 0.00 0.00 0.00 0.00 23.12 23.90 1g90 s ALA 74 CO 0.34 -0.85 0.20 -0.65 0.00 0.00 0.00 175.76 174.80 1g90 s GLN 75 N -3.98 0.82 -0.36 0.00 -0.21 -0.15 -4.83 119.66 110.95 1g90 s GLN 75 Ca 0.19 -0.88 -0.04 0.00 0.02 0.00 0.00 55.36 54.65 1g90 s GLN 75 Cb -0.01 0.34 0.23 0.00 1.00 0.00 0.00 33.01 34.57 1g90 s GLN 75 CO 0.07 -0.26 1.10 0.41 -2.12 0.00 0.00 175.29 174.49 1g90 n GLY 76 N 0.08 -1.56 3.20 3.09 0.00 -1.21 -0.76 105.19 108.03 1g90 n GLY 76 Ca -0.16 1.11 -0.09 0.00 0.00 0.00 0.00 46.02 46.88 1g90 n GLY 76 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1g90 s VAL 77 N 0.73 0.13 0.05 1.61 -7.23 -0.25 -0.52 120.40 114.92 1g90 s VAL 77 Ca 0.25 -1.60 -0.10 0.00 -1.81 0.00 0.00 61.98 58.72 1g90 s VAL 77 Cb 0.14 -1.73 0.01 0.00 0.56 0.00 0.00 36.38 35.36 1g90 s VAL 77 CO -0.10 -0.58 0.21 0.00 -0.31 0.00 0.00 175.10 174.32 1g90 s GLN 78 N -3.96 0.75 -0.02 4.82 -2.07 0.25 -0.38 119.66 119.04 1g90 s GLN 78 Ca 0.15 -0.68 -0.05 0.00 -1.82 0.00 0.00 55.36 52.95 1g90 s GLN 78 Cb 0.06 0.31 0.01 0.00 -1.09 0.00 0.00 33.01 32.29 1g90 s GLN 78 CO -0.04 -0.22 0.12 -0.48 -1.32 0.00 0.00 175.29 173.35 1g90 s LEU 79 N -2.26 1.58 0.02 2.60 0.05 -0.15 -0.70 118.68 119.83 1g90 s LEU 79 Ca -0.03 0.03 -0.20 0.00 0.05 0.00 0.00 54.13 53.98 1g90 s LEU 79 Cb 0.00 0.50 0.04 0.00 -2.05 0.00 0.00 46.19 44.69 1g90 s LEU 79 CO -0.05 -0.18 0.45 0.28 -0.55 0.00 0.00 176.35 176.29 1g90 s THR 80 N -0.59 0.04 0.37 5.48 -1.32 0.68 -0.47 115.64 119.84 1g90 s THR 80 Ca -0.07 -0.36 -0.15 0.00 -1.21 0.00 0.00 61.69 59.91 1g90 s THR 80 Cb -0.04 -0.90 -0.08 0.00 -1.51 0.00 0.00 72.50 69.97 1g90 s THR 80 CO 0.01 -0.20 0.79 0.00 -2.21 0.00 0.00 174.62 173.01 1g90 s ALA 81 N -2.07 3.27 -0.02 11.08 0.00 0.59 -0.69 121.76 133.93 1g90 s ALA 81 Ca -0.08 0.03 0.01 0.00 0.00 0.00 0.00 51.96 51.93 1g90 s ALA 81 Cb -0.02 -2.83 0.01 0.00 0.00 0.00 0.00 23.12 20.29 1g90 s ALA 81 CO 0.01 0.17 -0.04 0.21 0.00 0.00 0.00 175.76 176.10 1g90 s LYS 82 N -3.34 0.53 0.24 0.00 2.36 0.37 -1.59 119.74 118.32 1g90 s LYS 82 Ca 0.55 -0.13 0.02 0.00 -2.55 0.00 0.00 55.97 53.86 1g90 s LYS 82 Cb -0.10 -0.55 -0.05 0.00 -1.05 0.00 0.00 37.83 36.08 1g90 s LYS 82 CO 0.22 0.02 0.06 -1.17 1.55 0.00 0.00 175.35 176.03 1g90 s LEU 83 N 0.35 1.85 0.00 5.43 2.96 0.74 -0.81 118.68 129.20 1g90 s LEU 83 Ca -0.04 -1.32 -0.16 0.00 -0.22 0.00 0.00 54.13 52.40 1g90 s LEU 83 Cb -0.08 -0.07 0.05 0.00 0.50 0.00 0.00 46.19 46.60 1g90 s LEU 83 CO -0.00 -0.66 0.74 0.61 -1.32 0.00 0.00 176.35 175.72 1g90 n GLY 84 N -0.43 0.75 3.03 7.98 0.00 -1.01 -1.57 105.19 113.95 1g90 n GLY 84 Ca -0.02 -1.07 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 1g90 n GLY 84 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1g90 s TYR 85 N -3.17 -0.10 0.64 1.61 5.04 -0.18 -4.93 117.35 116.26 1g90 s TYR 85 Ca 0.17 0.24 -0.13 0.00 -2.44 0.00 0.00 57.07 54.90 1g90 s TYR 85 Cb -0.02 0.02 -0.02 0.00 0.35 0.00 0.00 41.96 42.30 1g90 s TYR 85 CO 0.03 -0.12 1.05 -1.25 -1.34 0.00 0.00 175.55 173.93 1g90 s PRO 86 N -0.26 3.20 0.00 4.97 0.04 -1.26 -1.64 135.00 140.06 1g90 s PRO 86 Ca -0.03 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.04 1g90 s PRO 86 Cb -0.03 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.49 1g90 s PRO 86 CO 0.00 -0.89 0.00 -0.89 0.04 0.00 0.00 177.00 175.26 1g90 n ILE 87 N -2.57 0.00 -1.50 0.56 -0.00 -1.21 -4.74 119.36 109.89 1g90 n ILE 87 Ca 0.08 0.00 -0.30 0.00 -0.00 0.00 0.00 62.75 62.53 1g90 n ILE 87 Cb 0.53 0.00 -0.06 0.00 -0.00 0.00 0.00 39.64 40.11 1g90 n ILE 87 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.55 176.96 1g90 n THR 88 N -0.46 3.98 -1.78 1.39 -1.04 0.68 -4.70 114.28 112.34 1g90 n THR 88 Ca 0.00 -2.99 0.00 0.00 -2.04 0.00 0.00 64.05 59.02 1g90 n THR 88 Cb 0.00 -1.99 0.00 0.00 -1.82 0.00 0.00 70.33 66.52 1g90 n THR 88 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1g90 n ASP 89 N 1.92 -9.25 0.00 8.00 2.03 -1.26 -4.71 116.55 113.28 1g90 n ASP 89 Ca 0.57 1.33 0.00 0.00 0.52 0.00 0.00 54.79 57.20 1g90 n ASP 89 Cb 0.49 -5.04 0.00 0.00 -0.72 0.00 0.00 41.12 35.85 1g90 n ASP 89 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1g90 n ASP 90 N -0.03 0.00 -4.41 1.67 2.03 -1.26 -4.78 116.55 109.77 1g90 n ASP 90 Ca 0.00 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.11 1g90 n ASP 90 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 1g90 n ASP 90 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 1g90 s LEU 91 N 0.00 2.26 0.27 -2.67 0.05 -1.26 -4.85 118.68 112.48 1g90 s LEU 91 Ca 0.00 -1.29 -0.15 0.00 0.05 0.00 0.00 54.13 52.74 1g90 s LEU 91 Cb 0.00 -0.41 -0.08 0.00 -2.05 0.00 0.00 46.19 43.64 1g90 s LEU 91 CO 0.00 -0.51 0.69 -1.81 -0.55 0.00 0.00 176.35 174.16 1g90 s ASP 92 N -3.42 6.82 0.12 1.48 1.11 0.10 -0.23 116.67 122.64 1g90 s ASP 92 Ca 0.33 1.24 -0.14 0.00 0.18 0.00 0.00 52.55 54.15 1g90 s ASP 92 Cb 0.07 -2.35 -0.07 0.00 1.07 0.00 0.00 42.92 41.64 1g90 s ASP 92 CO 0.13 -0.10 0.52 -0.51 1.18 0.00 0.00 175.17 176.38 1g90 s ILE 93 N -1.81 4.89 -0.02 0.77 1.10 -0.65 -0.62 121.20 124.86 1g90 s ILE 93 Ca 0.49 0.82 0.01 0.00 -0.51 0.00 0.00 60.65 61.46 1g90 s ILE 93 Cb -0.12 -3.74 0.01 0.00 0.15 0.00 0.00 42.46 38.76 1g90 s ILE 93 CO 0.19 0.31 -0.02 -0.47 -2.11 0.00 0.00 174.94 172.83 1g90 s TYR 94 N -1.39 0.37 0.02 3.50 5.04 0.27 -1.01 117.35 124.15 1g90 s TYR 94 Ca 0.35 -0.05 0.01 0.00 -2.44 0.00 0.00 57.07 54.94 1g90 s TYR 94 Cb -0.15 -0.34 -0.02 0.00 0.35 0.00 0.00 41.96 41.80 1g90 s TYR 94 CO 0.19 -0.07 -0.05 0.99 -1.34 0.00 0.00 175.55 175.26 1g90 s THR 95 N 0.45 0.33 -0.12 4.34 2.01 -0.61 -0.19 115.64 121.86 1g90 s THR 95 Ca -0.05 -0.76 -0.16 0.00 0.31 0.00 0.00 61.69 61.04 1g90 s THR 95 Cb -0.08 -0.40 0.04 0.00 0.01 0.00 0.00 72.50 72.08 1g90 s THR 95 CO -0.01 -0.29 0.41 0.00 -0.69 0.00 0.00 174.62 174.04 1g90 s ARG 96 N -1.12 0.56 -0.02 4.92 1.70 -0.03 -0.19 118.95 124.78 1g90 s ARG 96 Ca -0.09 0.39 -0.02 0.00 -0.47 0.00 0.00 55.73 55.55 1g90 s ARG 96 Cb -0.08 0.27 0.01 0.00 -0.57 0.00 0.00 34.95 34.58 1g90 s ARG 96 CO -0.00 -0.10 0.06 -0.51 -1.08 0.00 0.00 175.30 173.66 1g90 s LEU 97 N -0.20 1.79 0.00 -1.89 1.02 -0.62 -0.91 118.68 117.86 1g90 s LEU 97 Ca -0.04 0.10 0.00 0.00 0.02 0.00 0.00 54.13 54.21 1g90 s LEU 97 Cb -0.03 0.20 0.00 0.00 0.02 0.00 0.00 46.19 46.38 1g90 s LEU 97 CO 0.02 -0.03 0.00 0.61 0.02 0.00 0.00 176.35 176.97 1g90 n GLY 98 N 3.01 1.32 3.23 -3.19 0.00 0.35 -0.30 105.19 109.60 1g90 n GLY 98 Ca -0.12 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.02 1.05 0.01 -0.02 0.00 0.37 -0.54 107.32 108.18 1g90 s GLY 99 Ca 0.00 -1.49 -0.02 0.00 0.00 0.00 0.00 44.72 43.20 1g90 s GLY 99 CO 0.00 -1.54 0.03 -3.16 0.00 0.00 0.00 173.10 168.43 1g90 s MET 100 N -3.83 0.36 -0.04 2.90 0.23 0.52 -0.97 119.30 118.47 1g90 s MET 100 Ca 0.18 -0.52 -0.01 0.00 -1.03 0.00 0.00 55.69 54.31 1g90 s MET 100 Cb 0.05 0.14 0.03 0.00 -1.53 0.00 0.00 34.83 33.52 1g90 s MET 100 CO 0.00 -0.07 0.07 0.08 -2.03 0.00 0.00 175.02 173.08 1g90 s VAL 101 N -1.39 -0.09 -0.01 5.16 1.01 0.48 -0.78 120.40 124.78 1g90 s VAL 101 Ca -0.15 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1g90 s VAL 101 Cb -0.09 -0.15 0.01 0.00 0.00 0.00 0.00 36.38 36.15 1g90 s VAL 101 CO -0.00 0.11 -0.01 0.12 0.00 0.00 0.00 175.10 175.32 1g90 s PHE 102 N 1.43 0.20 0.02 5.22 5.36 -0.67 -1.09 117.98 128.45 1g90 s PHE 102 Ca -0.05 -0.00 -0.05 0.00 -0.96 0.00 0.00 56.93 55.86 1g90 s PHE 102 Cb -0.12 -0.22 -0.01 0.00 -0.34 0.00 0.00 43.02 42.33 1g90 s PHE 102 CO -0.04 -0.05 0.09 0.50 -1.46 0.00 0.00 175.22 174.26 1g90 s ARG 103 N 0.42 0.50 0.17 10.12 3.52 0.06 -0.99 118.95 132.75 1g90 s ARG 103 Ca -0.04 -0.59 -0.10 0.00 -0.13 0.00 0.00 55.73 54.87 1g90 s ARG 103 Cb -0.06 0.20 -0.00 0.00 -1.56 0.00 0.00 34.95 33.52 1g90 s ARG 103 CO -0.01 -0.12 0.32 0.00 -0.81 0.00 0.00 175.30 174.68 1g90 s ALA 104 N -1.95 -0.13 -0.32 6.12 0.00 -1.26 -0.98 121.76 123.24 1g90 s ALA 104 Ca -0.11 -0.79 -0.16 0.00 0.00 0.00 0.00 51.96 50.90 1g90 s ALA 104 Cb -0.05 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 23.91 1g90 s ALA 104 CO -0.02 -0.67 0.41 0.34 0.00 0.00 0.00 175.76 175.82 1g90 s ASP 105 N -2.96 6.24 0.00 0.00 -1.08 -1.01 -4.24 116.67 113.63 1g90 s ASP 105 Ca 0.16 -0.02 0.00 0.00 -0.52 0.00 0.00 52.55 52.17 1g90 s ASP 105 Cb 0.03 -2.22 0.00 0.00 -1.46 0.00 0.00 42.92 39.27 1g90 s ASP 105 CO -0.00 -0.33 0.00 0.41 0.52 0.00 0.00 175.17 175.77 1g90 n THR 106 N 5.25 0.00 -0.45 1.71 -1.04 -1.26 -4.60 114.28 113.90 1g90 n THR 106 Ca -0.08 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 61.99 1g90 n THR 106 Cb 0.50 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.98 1g90 n THR 106 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1g90 n LYS 107 N 0.00 -1.01 -1.96 -2.82 5.02 -1.26 -4.70 118.16 111.43 1g90 n LYS 107 Ca 0.00 0.79 -0.30 0.00 -2.02 0.00 0.00 58.31 56.78 1g90 n LYS 107 Cb 0.00 -1.19 -0.04 0.00 -0.02 0.00 0.00 35.03 33.77 1g90 n LYS 107 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1g90 s SER 108 N -5.36 5.00 -0.99 4.39 1.04 -1.26 -4.83 113.70 111.68 1g90 s SER 108 Ca 0.00 -0.13 -0.20 0.00 0.48 0.00 0.00 55.95 56.11 1g90 s SER 108 Cb 0.00 -2.54 -0.10 0.00 0.10 0.00 0.00 66.02 63.48 1g90 s SER 108 CO 0.00 -2.76 2.00 -3.20 0.98 0.00 0.00 173.24 170.26 1g90 n ASN 109 N 14.22 2.97 -4.63 7.02 5.15 -1.26 -2.55 115.26 136.17 1g90 n ASN 109 Ca 0.34 -2.73 -0.29 0.00 -0.60 0.00 0.00 54.58 51.30 1g90 n ASN 109 Cb 0.49 -1.31 0.18 0.00 -0.53 0.00 0.00 39.78 38.60 1g90 n ASN 109 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1g90 s VAL 110 N 4.94 1.97 0.34 3.44 0.11 -1.26 -4.88 120.40 125.07 1g90 s VAL 110 Ca 0.55 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.64 1g90 s VAL 110 Cb 0.13 -2.54 0.28 0.00 -1.53 0.00 0.00 36.38 32.72 1g90 s VAL 110 CO 0.07 0.00 1.95 0.22 -3.33 0.00 0.00 175.10 174.01 1g90 h TYR 111 N -1.90 0.86 -0.19 1.54 3.20 -1.81 0.51 116.97 119.18 1g90 h TYR 111 Ca -0.54 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.36 1g90 h TYR 111 Cb 1.33 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.32 1g90 h TYR 111 CO 0.11 0.47 0.00 0.41 -1.64 0.00 0.00 178.16 177.51 1g90 n GLY 112 N -1.43 1.06 1.60 1.82 0.00 0.47 -5.00 105.19 103.70 1g90 n GLY 112 Ca 0.11 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 1.12 -4.03 -1.89 1.61 4.01 0.17 -4.68 118.16 114.47 1g90 n LYS 113 Ca 0.17 3.03 -0.23 0.00 -0.51 0.00 0.00 58.31 60.77 1g90 n LYS 113 Cb 0.54 -3.56 -0.08 0.00 -0.51 0.00 0.00 35.03 31.42 1g90 n LYS 113 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 1g90 s ASN 114 N -3.80 4.46 0.34 4.39 3.04 -1.06 -4.39 114.94 117.92 1g90 s ASN 114 Ca 0.00 -1.21 0.27 0.00 0.04 0.00 0.00 52.86 51.95 1g90 s ASN 114 Cb 0.00 -2.59 0.97 0.00 -1.54 0.00 0.00 41.25 38.10 1g90 s ASN 114 CO 0.00 -3.63 1.78 0.45 -3.04 0.00 0.00 177.10 172.66 1g90 h HIS 115 N 10.71 0.00 0.00 0.43 3.86 -1.83 -3.41 115.15 124.90 1g90 h HIS 115 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1g90 h HIS 115 Cb 0.97 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.44 1g90 h HIS 115 CO 1.15 0.00 0.00 -0.40 0.86 0.00 0.00 177.93 179.54 1g90 n ASP 116 N -2.56 0.15 -4.81 2.45 5.75 -1.26 -4.81 116.55 111.46 1g90 n ASP 116 Ca 0.03 -0.52 -0.33 0.00 -0.01 0.00 0.00 54.79 53.95 1g90 n ASP 116 Cb 0.32 -0.07 -0.04 0.00 -1.03 0.00 0.00 41.12 40.30 1g90 n ASP 116 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1g90 s THR 117 N -1.43 4.07 0.00 2.12 -1.32 -1.26 -4.73 115.64 113.08 1g90 s THR 117 Ca 0.00 1.20 0.00 0.00 -1.21 0.00 0.00 61.69 61.68 1g90 s THR 117 Cb 0.00 -3.52 0.00 0.00 -1.51 0.00 0.00 72.50 67.47 1g90 s THR 117 CO 0.00 -0.37 0.00 0.61 -2.21 0.00 0.00 174.62 172.65 1g90 n GLY 118 N -0.66 -0.56 2.96 6.08 0.00 -0.16 -4.93 105.19 107.91 1g90 n GLY 118 Ca 0.08 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 1g90 n GLY 118 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g90 s VAL 119 N -2.00 1.47 0.06 1.61 1.01 -1.26 -1.67 120.40 119.62 1g90 s VAL 119 Ca 0.00 -0.89 -0.07 0.00 0.00 0.00 0.00 61.98 61.02 1g90 s VAL 119 Cb 0.00 -1.58 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 1g90 s VAL 119 CO 0.00 0.15 0.13 -0.94 0.00 0.00 0.00 175.10 174.44 1g90 s SER 120 N 1.47 0.19 0.90 3.32 1.04 0.04 -5.02 113.70 115.65 1g90 s SER 120 Ca -0.01 -0.65 -0.12 0.00 0.48 0.00 0.00 55.95 55.65 1g90 s SER 120 Cb -0.16 0.28 0.13 0.00 0.10 0.00 0.00 66.02 66.38 1g90 s SER 120 CO -0.08 -0.64 1.10 -2.16 0.98 0.00 0.00 173.24 172.45 1g90 s PRO 121 N -3.44 1.21 0.03 4.02 0.04 -1.26 -0.35 135.00 135.25 1g90 s PRO 121 Ca 0.02 0.58 -0.10 0.00 0.04 0.00 0.00 61.00 61.54 1g90 s PRO 121 Cb 0.03 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.76 1g90 s PRO 121 CO -0.09 -2.21 0.22 0.54 0.04 0.00 0.00 177.00 175.50 1g90 s VAL 122 N -3.07 0.09 0.02 -0.36 0.11 0.30 -4.18 120.40 113.32 1g90 s VAL 122 Ca 0.63 -0.77 -0.05 0.00 -2.93 0.00 0.00 61.98 58.87 1g90 s VAL 122 Cb -0.17 -0.79 -0.01 0.00 -1.53 0.00 0.00 36.38 33.89 1g90 s VAL 122 CO 0.56 -0.42 0.09 0.72 -3.33 0.00 0.00 175.10 172.71 1g90 s PHE 123 N -2.17 0.16 0.19 1.54 -0.71 -1.26 -0.50 117.98 115.22 1g90 s PHE 123 Ca -0.08 -0.39 -0.24 0.00 -1.04 0.00 0.00 56.93 55.19 1g90 s PHE 123 Cb -0.03 -0.12 0.05 0.00 -1.21 0.00 0.00 43.02 41.71 1g90 s PHE 123 CO -0.02 -0.31 0.85 0.00 -1.34 0.00 0.00 175.22 174.41 1g90 s ALA 124 N -1.99 -1.51 0.19 1.99 0.00 -0.09 -4.71 121.76 115.64 1g90 s ALA 124 Ca -0.10 0.06 -0.18 0.00 0.00 0.00 0.00 51.96 51.73 1g90 s ALA 124 Cb -0.05 0.71 0.03 0.00 0.00 0.00 0.00 23.12 23.82 1g90 s ALA 124 CO -0.02 -1.00 0.53 0.20 0.00 0.00 0.00 175.76 175.48 1g90 s GLY 125 N -2.89 -0.13 0.00 0.00 0.00 -0.63 -0.85 107.32 102.81 1g90 s GLY 125 Ca 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.66 1g90 s GLY 125 CO 0.02 -0.22 0.00 0.61 0.00 0.00 0.00 173.10 173.51 1g90 n GLY 126 N -0.35 -0.63 3.18 0.20 0.00 0.73 -0.06 105.19 108.26 1g90 n GLY 126 Ca -0.10 0.03 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 1g90 n GLY 126 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1g90 s VAL 127 N -1.28 0.53 0.01 1.61 -7.23 -0.14 -0.57 120.40 113.33 1g90 s VAL 127 Ca 0.00 -1.93 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 1g90 s VAL 127 Cb 0.00 -1.85 -0.01 0.00 0.56 0.00 0.00 36.38 35.08 1g90 s VAL 127 CO 0.00 -0.70 -0.01 -0.70 -0.31 0.00 0.00 175.10 173.37 1g90 s GLU 128 N -3.90 0.15 0.18 4.82 2.12 0.21 -1.22 118.70 121.05 1g90 s GLU 128 Ca 0.17 -0.28 -0.15 0.00 0.36 0.00 0.00 54.97 55.07 1g90 s GLU 128 Cb 0.06 0.04 0.02 0.00 0.26 0.00 0.00 34.13 34.51 1g90 s GLU 128 CO -0.02 -0.02 0.45 -0.47 -0.54 0.00 0.00 175.26 174.66 1g90 s TYR 129 N -0.67 0.03 0.01 5.30 5.04 0.20 -0.72 117.35 126.55 1g90 s TYR 129 Ca -0.07 -0.38 0.02 0.00 -2.44 0.00 0.00 57.07 54.19 1g90 s TYR 129 Cb -0.05 0.25 -0.01 0.00 0.35 0.00 0.00 41.96 42.51 1g90 s TYR 129 CO -0.00 -0.85 -0.05 0.00 -1.34 0.00 0.00 175.55 173.30 1g90 s ALA 130 N -3.90 0.43 -0.84 3.97 0.00 -1.26 -0.32 121.76 119.84 1g90 s ALA 130 Ca 0.11 -0.37 0.08 0.00 0.00 0.00 0.00 51.96 51.78 1g90 s ALA 130 Cb 0.00 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.10 1g90 s ALA 130 CO -0.02 0.06 0.63 1.51 0.00 0.00 0.00 175.76 177.93 1g90 n ILE 131 N 2.51 0.00 -3.63 0.00 0.13 -1.26 -4.93 119.36 112.17 1g90 n ILE 131 Ca -0.16 -0.45 -0.11 0.00 -1.10 0.00 0.00 62.75 60.93 1g90 n ILE 131 Cb 0.57 1.12 -0.07 0.00 -0.84 0.00 0.00 39.64 40.42 1g90 n ILE 131 CO 0.00 0.00 0.00 -0.89 2.80 0.00 0.00 176.55 178.46 1g90 s THR 132 N -0.99 0.00 0.46 9.51 2.01 -1.26 -5.08 115.64 120.29 1g90 s THR 132 Ca 0.08 0.00 0.30 0.00 0.31 0.00 0.00 61.69 62.38 1g90 s THR 132 Cb 0.07 -1.00 0.33 0.00 0.01 0.00 0.00 72.50 71.91 1g90 s THR 132 CO 0.16 0.00 2.14 1.55 -0.69 0.00 0.00 174.62 177.78 1g90 h PRO 133 N 5.45 0.00 -0.00 4.92 0.13 -2.02 -1.35 132.00 139.13 1g90 h PRO 133 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1g90 h PRO 133 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1g90 h PRO 133 CO 0.09 0.07 -0.02 0.39 -0.23 0.00 0.00 178.00 178.31 1g90 n GLU 134 N -3.57 0.88 -4.38 0.86 4.71 -1.26 -4.81 120.64 113.08 1g90 n GLU 134 Ca -0.02 -0.13 -0.19 0.00 -0.01 0.00 0.00 57.16 56.81 1g90 n GLU 134 Cb 0.19 -1.50 -0.10 0.00 -1.01 0.00 0.00 31.44 29.02 1g90 n GLU 134 CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 1g90 s ILE 135 N -2.21 1.52 0.19 -3.67 -4.36 -0.51 -1.58 121.20 110.59 1g90 s ILE 135 Ca 0.40 -2.12 -0.02 0.00 -0.26 0.00 0.00 60.65 58.64 1g90 s ILE 135 Cb 0.21 -2.28 -0.04 0.00 1.25 0.00 0.00 42.46 41.60 1g90 s ILE 135 CO 0.40 -0.41 0.14 0.00 0.24 0.00 0.00 174.94 175.31 1g90 s ALA 136 N -3.10 1.05 -0.13 2.27 0.00 0.60 -4.46 121.76 117.98 1g90 s ALA 136 Ca 0.27 -1.62 -0.11 0.00 0.00 0.00 0.00 51.96 50.49 1g90 s ALA 136 Cb 0.03 1.29 0.04 0.00 0.00 0.00 0.00 23.12 24.47 1g90 s ALA 136 CO 0.09 -0.59 0.34 0.99 0.00 0.00 0.00 175.76 176.60 1g90 s THR 137 N -4.13 -0.00 0.02 0.00 2.01 0.56 -1.07 115.64 113.02 1g90 s THR 137 Ca 0.36 0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.38 1g90 s THR 137 Cb 0.07 -0.48 -0.01 0.00 0.01 0.00 0.00 72.50 72.08 1g90 s THR 137 CO 0.10 0.01 -0.04 -0.13 -0.69 0.00 0.00 174.62 173.86 1g90 s ARG 138 N 0.33 0.34 -0.09 4.92 0.52 -0.10 -0.63 118.95 124.25 1g90 s ARG 138 Ca -0.01 -0.44 -0.09 0.00 -0.52 0.00 0.00 55.73 54.67 1g90 s ARG 138 Cb -0.03 -0.15 0.02 0.00 0.52 0.00 0.00 34.95 35.31 1g90 s ARG 138 CO -0.01 0.03 0.25 -0.48 0.02 0.00 0.00 175.30 175.10 1g90 s LEU 139 N -0.92 1.05 0.11 2.53 2.34 -0.36 -0.53 118.68 122.90 1g90 s LEU 139 Ca -0.07 0.49 0.01 0.00 0.06 0.00 0.00 54.13 54.62 1g90 s LEU 139 Cb -0.06 0.85 -0.04 0.00 -0.56 0.00 0.00 46.19 46.38 1g90 s LEU 139 CO -0.00 -0.09 -0.04 -1.83 -1.06 0.00 0.00 176.35 173.32 1g90 s GLU 140 N 0.11 0.86 0.05 1.48 1.03 -0.27 -0.96 118.70 121.00 1g90 s GLU 140 Ca -0.00 -1.36 0.02 0.00 0.03 0.00 0.00 54.97 53.65 1g90 s GLU 140 Cb -0.02 -0.14 -0.03 0.00 -0.80 0.00 0.00 34.13 33.15 1g90 s GLU 140 CO 0.00 -0.06 -0.07 0.71 -1.33 0.00 0.00 175.26 174.51 1g90 s TYR 141 N -3.69 0.67 0.01 4.83 1.51 0.91 -0.84 117.35 120.74 1g90 s TYR 141 Ca 0.14 -0.61 -0.03 0.00 -1.01 0.00 0.00 57.07 55.57 1g90 s TYR 141 Cb 0.06 -0.40 -0.01 0.00 -0.11 0.00 0.00 41.96 41.50 1g90 s TYR 141 CO -0.03 -0.12 0.04 -1.14 -1.11 0.00 0.00 175.55 173.19 1g90 s GLN 142 N -2.10 0.33 0.07 -0.62 0.74 0.49 -1.61 119.66 116.96 1g90 s GLN 142 Ca -0.06 -0.43 0.00 0.00 0.05 0.00 0.00 55.36 54.93 1g90 s GLN 142 Cb -0.06 0.13 -0.04 0.00 1.10 0.00 0.00 33.01 34.13 1g90 s GLN 142 CO -0.01 -0.06 -0.05 -0.06 -0.55 0.00 0.00 175.29 174.56 1g90 s PHE 143 N -1.19 0.68 0.95 1.67 0.40 -1.26 -0.74 117.98 118.49 1g90 s PHE 143 Ca -0.13 -1.00 -0.15 0.00 -0.60 0.00 0.00 56.93 55.05 1g90 s PHE 143 Cb -0.08 -0.44 0.19 0.00 0.51 0.00 0.00 43.02 43.20 1g90 s PHE 143 CO 0.00 -0.28 1.31 0.95 0.70 0.00 0.00 175.22 177.90 1g90 s THR 144 N -3.76 2.00 -2.00 0.64 -4.23 -0.76 -4.95 115.64 102.58 1g90 s THR 144 Ca 0.09 -0.02 0.12 0.00 -1.18 0.00 0.00 61.69 60.70 1g90 s THR 144 Cb 0.07 -2.98 0.34 0.00 1.34 0.00 0.00 72.50 71.26 1g90 s THR 144 CO -0.08 0.00 1.21 -0.46 -0.54 0.00 0.00 174.62 174.76 1g90 n ASN 145 N -3.72 0.00 -3.52 3.99 6.94 -1.26 -4.93 115.26 112.75 1g90 n ASN 145 Ca 0.15 -0.94 -0.17 0.00 -0.02 0.00 0.00 54.58 53.60 1g90 n ASN 145 Cb 0.59 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 38.02 1g90 n ASN 145 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1g90 n ASN 146 N -0.78 -5.97 -3.72 0.53 5.15 -1.26 -4.86 115.26 104.35 1g90 n ASN 146 Ca 0.09 -0.66 -0.42 0.00 -0.60 0.00 0.00 54.58 52.99 1g90 n ASN 146 Cb 0.04 -3.22 -0.06 0.00 -0.53 0.00 0.00 39.78 36.01 1g90 n ASN 146 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1g90 n ILE 147 N -2.60 1.82 0.00 -1.44 3.06 -1.26 -4.54 119.36 114.40 1g90 n ILE 147 Ca -0.17 -1.62 0.00 0.00 -2.50 0.00 0.00 62.75 58.46 1g90 n ILE 147 Cb 0.61 -2.30 0.00 0.00 0.54 0.00 0.00 39.64 38.49 1g90 n ILE 147 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1g90 n GLY 148 N 4.66 0.83 6.17 4.50 0.00 -1.26 -4.90 105.19 115.19 1g90 n GLY 148 Ca 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.50 1g90 n GLY 148 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1g90 n ASP 149 N 2.09 0.00 -3.97 1.61 2.03 -1.26 -4.48 116.55 112.57 1g90 n ASP 149 Ca 0.00 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.90 1g90 n ASP 149 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1g90 n ASP 149 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1g90 n ALA 150 N 7.14 4.17 -1.35 -1.67 0.00 -1.26 -4.87 120.51 122.68 1g90 n ALA 150 Ca 0.00 -3.64 -0.40 0.00 0.00 0.00 0.00 53.44 49.39 1g90 n ALA 150 Cb 0.00 -3.57 -0.06 0.00 0.00 0.00 0.00 19.45 15.82 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 7.82 2.07 -3.23 0.00 8.25 -1.26 -4.68 115.22 124.18 1g90 n HIS 151 Ca 0.50 -1.75 -0.08 0.00 -0.26 0.00 0.00 57.72 56.13 1g90 n HIS 151 Cb 0.42 -1.89 -0.04 0.00 1.12 0.00 0.00 29.99 29.59 1g90 n HIS 151 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1g90 s THR 152 N 6.20 -0.67 0.00 1.59 2.01 -1.26 -5.14 115.64 118.38 1g90 s THR 152 Ca 0.60 -0.63 0.00 0.00 0.31 0.00 0.00 61.69 61.97 1g90 s THR 152 Cb 0.11 -0.32 0.00 0.00 0.01 0.00 0.00 72.50 72.30 1g90 s THR 152 CO 0.12 -0.29 0.00 -0.38 -0.69 0.00 0.00 174.62 173.38 1g90 n ILE 153 N 4.12 0.00 -0.30 1.82 5.41 -1.26 -3.38 119.36 125.76 1g90 n ILE 153 Ca 0.13 0.00 -0.00 0.00 1.00 0.00 0.00 62.75 63.88 1g90 n ILE 153 Cb 0.52 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 39.45 1g90 n ILE 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1g90 n GLY 154 N 0.00 1.69 3.77 7.39 0.00 -1.26 -4.90 105.19 111.88 1g90 n GLY 154 Ca 0.00 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1g90 n GLY 154 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1g90 s THR 155 N 0.82 3.30 -0.39 2.61 -1.32 -1.22 -5.02 115.64 114.43 1g90 s THR 155 Ca 0.00 0.47 -0.17 0.00 -1.21 0.00 0.00 61.69 60.78 1g90 s THR 155 Cb 0.00 -2.97 0.01 0.00 -1.51 0.00 0.00 72.50 68.03 1g90 s THR 155 CO 0.00 -0.51 0.46 -0.13 -2.21 0.00 0.00 174.62 172.23 1g90 s ARG 156 N -4.67 3.34 0.92 7.08 3.00 -1.26 -4.99 118.95 122.37 1g90 s ARG 156 Ca 0.63 -0.51 -0.12 0.00 0.00 0.00 0.00 55.73 55.73 1g90 s ARG 156 Cb -0.18 -3.89 0.14 0.00 0.00 0.00 0.00 34.95 31.02 1g90 s ARG 156 CO 0.52 -0.75 1.10 -1.25 0.00 0.00 0.00 175.30 174.92 1g90 s PRO 157 N 2.23 1.03 -0.27 3.54 0.04 -1.26 -5.00 135.00 135.32 1g90 s PRO 157 Ca 0.14 0.61 -0.25 0.00 0.04 0.00 0.00 61.00 61.54 1g90 s PRO 157 Cb -0.16 -1.80 0.07 0.00 0.04 0.00 0.00 34.50 32.65 1g90 s PRO 157 CO 0.14 -2.34 0.74 0.34 0.04 0.00 0.00 177.00 175.91 1g90 s ASP 158 N -3.58 -0.73 -0.33 6.66 2.15 -1.26 -5.04 116.67 114.54 1g90 s ASP 158 Ca 0.64 1.40 0.07 0.00 0.43 0.00 0.00 52.55 55.08 1g90 s ASP 158 Cb -0.17 1.41 0.19 0.00 -0.30 0.00 0.00 42.92 44.05 1g90 s ASP 158 CO 0.56 -0.25 0.59 0.54 -0.17 0.00 0.00 175.17 176.45 1g90 s ASN 159 N 0.34 -1.51 0.29 -0.34 2.20 -1.26 -4.59 114.94 110.07 1g90 s ASN 159 Ca -0.00 -0.17 -0.14 0.00 -0.94 0.00 0.00 52.86 51.61 1g90 s ASN 159 Cb -0.05 1.97 0.05 0.00 -2.00 0.00 0.00 41.25 41.22 1g90 s ASN 159 CO 0.01 -0.26 0.71 0.61 -2.94 0.00 0.00 177.10 175.23 1g90 n GLY 160 N 5.07 1.04 3.12 0.45 0.00 -1.26 -1.83 105.19 111.78 1g90 n GLY 160 Ca 0.07 -1.19 -0.11 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.07 0.53 0.09 1.61 0.00 0.08 -4.21 119.30 115.33 1g90 s MET 161 Ca 0.15 -0.51 -0.01 0.00 0.00 0.00 0.00 55.69 55.32 1g90 s MET 161 Cb -0.04 0.22 -0.04 0.00 0.00 0.00 0.00 34.83 34.97 1g90 s MET 161 CO 0.09 -0.13 0.01 -0.48 0.00 0.00 0.00 175.02 174.50 1g90 s LEU 162 N -1.65 2.17 0.05 4.11 0.05 0.25 -0.38 118.68 123.28 1g90 s LEU 162 Ca -0.11 -1.09 -0.00 0.00 0.05 0.00 0.00 54.13 52.97 1g90 s LEU 162 Cb -0.05 0.22 -0.03 0.00 -2.05 0.00 0.00 46.19 44.28 1g90 s LEU 162 CO -0.00 -0.65 -0.04 -0.44 -0.55 0.00 0.00 176.35 174.67 1g90 s SER 163 N -2.99 0.52 -0.17 1.48 0.01 -0.02 -1.56 113.70 110.97 1g90 s SER 163 Ca 0.15 -0.80 -0.06 0.00 1.31 0.00 0.00 55.95 56.55 1g90 s SER 163 Cb 0.08 0.14 0.08 0.00 0.21 0.00 0.00 66.02 66.53 1g90 s SER 163 CO -0.04 -0.45 0.35 -0.22 0.41 0.00 0.00 173.24 173.29 1g90 s LEU 164 N -2.35 -0.50 0.27 2.44 2.96 0.17 -1.12 118.68 120.55 1g90 s LEU 164 Ca -0.01 0.78 -0.13 0.00 -0.22 0.00 0.00 54.13 54.55 1g90 s LEU 164 Cb 0.00 1.07 0.00 0.00 0.50 0.00 0.00 46.19 47.77 1g90 s LEU 164 CO -0.06 -0.24 0.52 -0.83 -1.32 0.00 0.00 176.35 174.43 1g90 s GLY 165 N 2.53 0.54 0.22 7.98 0.00 0.31 -0.36 107.32 118.53 1g90 s GLY 165 Ca 0.00 -0.86 0.08 0.00 0.00 0.00 0.00 44.72 43.94 1g90 s GLY 165 CO -0.11 -0.58 -0.14 -1.34 0.00 0.00 0.00 173.10 170.93 1g90 s VAL 166 N -3.83 1.78 0.14 1.40 -7.23 -0.03 -0.92 120.40 111.71 1g90 s VAL 166 Ca 0.21 -2.22 -0.14 0.00 -1.81 0.00 0.00 61.98 58.02 1g90 s VAL 166 Cb -0.02 -2.09 0.02 0.00 0.56 0.00 0.00 36.38 34.85 1g90 s VAL 166 CO 0.10 -0.56 0.39 -0.44 -0.31 0.00 0.00 175.10 174.28 1g90 s SER 167 N -3.34 -0.16 0.15 4.85 0.01 -0.23 -1.34 113.70 113.64 1g90 s SER 167 Ca 0.24 -0.48 -0.01 0.00 1.31 0.00 0.00 55.95 57.00 1g90 s SER 167 Cb -0.01 0.48 -0.04 0.00 0.21 0.00 0.00 66.02 66.66 1g90 s SER 167 CO 0.08 -0.90 0.34 -0.47 0.41 0.00 0.00 173.24 172.70 1g90 s TYR 168 N -3.85 3.49 -0.24 2.43 5.04 0.13 -0.29 117.35 124.07 1g90 s TYR 168 Ca 0.07 0.35 -0.01 0.00 -2.44 0.00 0.00 57.07 55.04 1g90 s TYR 168 Cb 0.02 -1.85 0.02 0.00 0.35 0.00 0.00 41.96 40.50 1g90 s TYR 168 CO -0.08 0.45 -0.08 -0.98 -1.34 0.00 0.00 175.55 173.52 1g90 s ARG 169 N -2.97 2.88 0.83 4.97 1.04 -0.61 -1.30 118.95 123.79 1g90 s ARG 169 Ca 0.38 -0.94 -0.13 0.00 -1.04 0.00 0.00 55.73 54.00 1g90 s ARG 169 Cb -0.12 -2.92 0.07 0.00 -2.04 0.00 0.00 34.95 29.94 1g90 s ARG 169 CO 0.28 -0.36 0.99 0.34 -0.04 0.00 0.00 175.30 176.51 1g90 n PHE 170 N 4.66 0.56 0.00 5.89 7.35 0.48 -4.43 117.46 131.97 1g90 n PHE 170 Ca -0.17 0.37 0.00 0.00 -0.76 0.00 0.00 57.45 56.89 1g90 n PHE 170 Cb 0.48 -2.03 0.00 0.00 0.35 0.00 0.00 39.48 38.28 1g90 n PHE 170 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1g90 n GLY 171 N 0.81 2.01 3.77 7.13 0.00 -1.26 -4.64 105.19 113.01 1g90 n GLY 171 Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.06 1g90 n GLY 171 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1g90 s GLN 172 N -0.28 1.82 -1.21 1.61 -2.07 -1.26 -5.00 119.66 113.26 1g90 s GLN 172 Ca 0.00 -1.16 -0.07 0.00 -1.82 0.00 0.00 55.36 52.31 1g90 s GLN 172 Cb 0.00 0.57 0.01 0.00 -1.09 0.00 0.00 33.01 32.50 1g90 s GLN 172 CO 0.00 -0.82 1.05 0.41 -1.32 0.00 0.00 175.29 174.62 1g90 n GLY 173 N -0.46 -0.39 3.04 2.60 0.00 -1.26 -4.95 105.19 103.77 1g90 n GLY 173 Ca -0.04 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 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 -6.01 0.51 0.32 1.61 2.12 -1.26 -5.08 118.70 110.91 1g90 s GLU 174 Ca 0.43 -0.66 -0.17 0.00 0.36 0.00 0.00 54.97 54.93 1g90 s GLU 174 Cb -0.19 -0.31 0.03 0.00 0.26 0.00 0.00 34.13 33.92 1g90 s GLU 174 CO 0.67 0.06 0.71 0.00 -0.54 0.00 0.00 175.26 176.16 1g90 s ALA 175 N -1.16 -0.83 0.00 6.30 0.00 -1.26 -5.16 121.76 119.65 1g90 s ALA 175 Ca -0.08 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.28 1g90 s ALA 175 Cb -0.09 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.85 1g90 s ALA 175 CO 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 175.76 174.77