#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 1.49 -0.08 0.00 0.04 -1.26 -5.10 135.00 130.10 1g90 s PRO 2 Ca 0.00 0.81 -0.11 0.00 0.04 0.00 0.00 61.00 61.74 1g90 s PRO 2 Cb 0.00 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.73 1g90 s PRO 2 CO 0.00 -2.08 0.28 -1.59 0.04 0.00 0.00 177.00 173.65 1g90 s LYS 3 N -4.97 0.43 -0.15 4.56 0.00 -1.26 -5.16 119.74 113.18 1g90 s LYS 3 Ca 0.63 0.18 -0.01 0.00 0.00 0.00 0.00 55.97 56.77 1g90 s LYS 3 Cb -0.17 0.20 0.04 0.00 0.00 0.00 0.00 37.83 37.90 1g90 s LYS 3 CO 0.56 -0.08 -0.03 -0.51 0.00 0.00 0.00 175.35 175.29 1g90 s ASP 4 N -0.34 2.60 0.15 0.03 1.11 -1.26 -5.02 116.67 113.94 1g90 s ASP 4 Ca -0.05 -0.57 -0.17 0.00 0.18 0.00 0.00 52.55 51.95 1g90 s ASP 4 Cb -0.03 -0.78 0.03 0.00 1.07 0.00 0.00 42.92 43.21 1g90 s ASP 4 CO 0.01 -0.20 0.45 0.54 1.18 0.00 0.00 175.17 177.15 1g90 s ASN 5 N 1.73 -0.25 0.32 0.27 6.03 -1.26 -4.60 114.94 117.17 1g90 s ASN 5 Ca 0.01 -0.37 -0.15 0.00 -1.03 0.00 0.00 52.86 51.32 1g90 s ASN 5 Cb -0.15 0.51 0.03 0.00 -3.03 0.00 0.00 41.25 38.61 1g90 s ASN 5 CO -0.07 -0.92 0.67 0.28 -2.03 0.00 0.00 177.10 175.03 1g90 s THR 6 N -3.83 0.00 0.24 0.54 -1.32 -0.26 -4.73 115.64 106.28 1g90 s THR 6 Ca 0.05 -1.15 0.02 0.00 -1.21 0.00 0.00 61.69 59.40 1g90 s THR 6 Cb 0.01 -2.44 -0.05 0.00 -1.51 0.00 0.00 72.50 68.50 1g90 s THR 6 CO -0.09 0.00 0.06 -1.66 -2.21 0.00 0.00 174.62 170.72 1g90 s TRP 7 N -3.23 1.51 0.04 9.09 -2.14 -1.26 -0.47 118.94 122.48 1g90 s TRP 7 Ca 0.17 -1.09 -0.00 0.00 2.66 0.00 0.00 56.10 57.84 1g90 s TRP 7 Cb -0.04 -0.89 -0.03 0.00 -3.10 0.00 0.00 33.47 29.41 1g90 s TRP 7 CO 0.11 -0.24 -0.04 0.71 -2.66 0.00 0.00 176.95 174.84 1g90 s TYR 8 N -3.64 0.46 -0.06 1.66 1.51 0.81 -0.31 117.35 117.79 1g90 s TYR 8 Ca 0.33 -0.83 0.01 0.00 -1.01 0.00 0.00 57.07 55.56 1g90 s TYR 8 Cb 0.07 -0.33 0.02 0.00 -0.11 0.00 0.00 41.96 41.61 1g90 s TYR 8 CO 0.11 -0.28 -0.05 0.95 -1.11 0.00 0.00 175.55 175.17 1g90 s THR 9 N -2.88 0.62 0.00 -0.71 -4.23 -0.01 -1.27 115.64 107.17 1g90 s THR 9 Ca -0.02 -0.13 0.00 0.00 -1.18 0.00 0.00 61.69 60.36 1g90 s THR 9 Cb 0.00 -0.66 0.00 0.00 1.34 0.00 0.00 72.50 73.18 1g90 s THR 9 CO -0.06 0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.89 1g90 n GLY 10 N 4.31 2.16 3.17 3.99 0.00 0.72 -0.29 105.19 119.25 1g90 n GLY 10 Ca -0.20 -0.68 -0.09 0.00 0.00 0.00 0.00 46.02 45.06 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 0.34 -0.01 4.61 0.00 0.00 -0.40 121.76 125.31 1g90 s ALA 11 Ca 0.00 -1.08 -0.02 0.00 0.00 0.00 0.00 51.96 50.85 1g90 s ALA 11 Cb 0.00 0.57 -0.00 0.00 0.00 0.00 0.00 23.12 23.69 1g90 s ALA 11 CO 0.00 -0.48 0.05 0.21 0.00 0.00 0.00 175.76 175.54 1g90 s LYS 12 N -3.95 0.18 -0.04 0.00 2.20 -0.31 -1.47 119.74 116.36 1g90 s LYS 12 Ca 0.13 -0.14 -0.08 0.00 -0.36 0.00 0.00 55.97 55.52 1g90 s LYS 12 Cb 0.06 0.07 0.01 0.00 -1.51 0.00 0.00 37.83 36.47 1g90 s LYS 12 CO -0.06 -0.03 0.19 -0.48 -0.36 0.00 0.00 175.35 174.61 1g90 s LEU 13 N -0.49 1.31 0.30 5.43 0.05 0.33 -0.45 118.68 125.15 1g90 s LEU 13 Ca -0.06 0.13 -0.07 0.00 0.05 0.00 0.00 54.13 54.18 1g90 s LEU 13 Cb -0.04 0.76 -0.00 0.00 -2.05 0.00 0.00 46.19 44.86 1g90 s LEU 13 CO 0.00 -0.23 0.47 -0.83 -0.55 0.00 0.00 176.35 175.21 1g90 s GLY 14 N -0.65 1.04 0.20 -3.48 0.00 0.61 -0.66 107.32 104.37 1g90 s GLY 14 Ca -0.07 -1.23 -0.11 0.00 0.00 0.00 0.00 44.72 43.31 1g90 s GLY 14 CO 0.01 -0.84 0.37 -0.11 0.00 0.00 0.00 173.10 172.53 1g90 s PHE 15 N -3.47 0.39 0.09 1.90 -0.71 0.01 -0.81 117.98 115.38 1g90 s PHE 15 Ca 0.27 -0.74 0.07 0.00 -1.04 0.00 0.00 56.93 55.50 1g90 s PHE 15 Cb -0.00 0.04 -0.03 0.00 -1.21 0.00 0.00 43.02 41.81 1g90 s PHE 15 CO 0.15 -0.83 -0.19 0.45 -1.34 0.00 0.00 175.22 173.46 1g90 s SER 16 N -2.99 2.25 0.97 1.98 0.15 0.51 -0.64 113.70 115.93 1g90 s SER 16 Ca 0.20 -0.66 -0.13 0.00 0.70 0.00 0.00 55.95 56.06 1g90 s SER 16 Cb 0.02 -0.11 0.17 0.00 -1.71 0.00 0.00 66.02 64.39 1g90 s SER 16 CO 0.04 0.01 1.12 -1.58 1.20 0.00 0.00 173.24 174.03 1g90 s GLN 17 N -1.85 0.65 0.65 5.44 2.00 -1.26 -1.46 119.66 123.83 1g90 s GLN 17 Ca 0.04 0.35 -0.17 0.00 -2.00 0.00 0.00 55.36 53.57 1g90 s GLN 17 Cb -0.10 -1.78 -0.01 0.00 0.80 0.00 0.00 33.01 31.93 1g90 s GLN 17 CO 0.04 -2.54 1.24 1.52 -0.50 0.00 0.00 175.29 175.04 1g90 s TYR 18 N -3.14 2.18 -0.46 1.67 -0.85 -1.15 -3.95 117.35 111.65 1g90 s TYR 18 Ca 0.65 1.53 -0.35 0.00 -0.52 0.00 0.00 57.07 58.37 1g90 s TYR 18 Cb -0.16 -3.56 0.05 0.00 0.38 0.00 0.00 41.96 38.67 1g90 s TYR 18 CO 0.55 -2.59 0.64 1.58 -1.52 0.00 0.00 175.55 174.22 1g90 n HIS 19 N -2.02 -2.53 -0.19 -3.49 -0.00 0.31 -4.71 115.22 102.59 1g90 n HIS 19 Ca 0.14 1.06 0.00 0.00 -0.00 0.00 0.00 57.72 58.93 1g90 n HIS 19 Cb 0.49 -1.75 0.00 0.00 -0.00 0.00 0.00 29.99 28.73 1g90 n HIS 19 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1g90 n ASP 20 N -0.33 -1.25 0.19 0.26 5.75 -1.26 -3.99 116.55 115.92 1g90 n ASP 20 Ca -0.11 -0.19 0.18 0.00 -0.01 0.00 0.00 54.79 54.66 1g90 n ASP 20 Cb 0.66 0.00 0.82 0.00 -1.03 0.00 0.00 41.12 41.58 1g90 n ASP 20 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1g90 h THR 21 N -1.58 0.45 -0.49 2.12 1.03 -1.76 -3.43 112.91 109.25 1g90 h THR 21 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 1g90 h THR 21 Cb 0.00 0.81 0.00 0.00 -1.07 0.00 0.00 68.15 67.89 1g90 h THR 21 CO 0.00 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.12 1g90 n GLY 22 N -1.41 -2.10 3.16 2.99 0.00 -1.26 -0.08 105.19 106.49 1g90 n GLY 22 Ca 0.02 -1.40 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 1g90 n GLY 22 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1g90 s PHE 23 N 0.00 0.92 0.68 1.61 5.36 -1.26 -4.70 117.98 120.60 1g90 s PHE 23 Ca 0.00 -1.26 -0.17 0.00 -0.96 0.00 0.00 56.93 54.55 1g90 s PHE 23 Cb 0.00 -0.50 0.01 0.00 -0.34 0.00 0.00 43.02 42.19 1g90 s PHE 23 CO 0.00 -0.53 1.24 0.96 -1.46 0.00 0.00 175.22 175.43 1g90 s ILE 24 N -4.06 2.22 -1.29 3.12 -4.36 -1.26 -4.88 121.20 110.69 1g90 s ILE 24 Ca 0.27 0.12 -0.19 0.00 -0.26 0.00 0.00 60.65 60.59 1g90 s ILE 24 Cb 0.07 -2.87 0.04 0.00 1.25 0.00 0.00 42.46 40.96 1g90 s ILE 24 CO 0.04 -0.04 1.79 -3.20 0.24 0.00 0.00 174.94 173.76 1g90 n ASN 25 N -2.29 4.61 0.00 4.36 5.15 -0.28 -4.82 115.26 121.99 1g90 n ASN 25 Ca 0.14 -2.88 0.00 0.00 -0.60 0.00 0.00 54.58 51.24 1g90 n ASN 25 Cb 0.49 -1.74 0.00 0.00 -0.53 0.00 0.00 39.78 38.00 1g90 n ASN 25 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1g90 n ASN 26 N 9.14 0.00 -0.12 1.20 3.02 -1.26 -1.76 115.26 125.47 1g90 n ASN 26 Ca 0.49 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 55.06 1g90 n ASN 26 Cb 0.46 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.63 1g90 n ASN 26 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1g90 n ASN 27 N 0.47 1.00 -3.80 6.41 4.05 -1.26 -5.06 115.26 117.06 1g90 n ASN 27 Ca 0.00 -1.00 -0.07 0.00 0.45 0.00 0.00 54.58 53.96 1g90 n ASN 27 Cb 0.00 0.32 -0.02 0.00 1.23 0.00 0.00 39.78 41.31 1g90 n ASN 27 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1g90 s GLY 28 N -0.70 -0.00 0.02 8.20 0.00 -0.72 -4.90 107.32 109.21 1g90 s GLY 28 Ca 0.04 -0.39 -0.26 0.00 0.00 0.00 0.00 44.72 44.11 1g90 s GLY 28 CO 0.09 -0.15 1.24 -0.56 0.00 0.00 0.00 173.10 173.72 1g90 h PRO 29 N 2.02 -0.58 0.00 2.90 0.13 -1.80 -0.74 132.00 133.93 1g90 h PRO 29 Ca -0.21 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1g90 h PRO 29 Cb 1.25 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1g90 h PRO 29 CO 0.25 -0.28 0.00 0.25 -0.23 0.00 0.00 178.00 177.99 1g90 n THR 30 N -5.24 0.00 -0.99 1.56 -2.24 0.00 -3.02 114.28 104.35 1g90 n THR 30 Ca -0.10 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.44 1g90 n THR 30 Cb 0.30 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.45 1g90 n THR 30 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1g90 n HIS 31 N 0.00 1.17 0.39 4.78 1.44 -1.26 -4.33 115.22 117.41 1g90 n HIS 31 Ca 0.00 -2.08 0.12 0.00 -2.01 0.00 0.00 57.72 53.75 1g90 n HIS 31 Cb 0.00 -1.86 0.14 0.00 0.12 0.00 0.00 29.99 28.39 1g90 n HIS 31 CO 0.00 0.00 0.00 1.05 -2.81 0.00 0.00 176.34 174.58 1g90 h GLU 32 N 4.63 0.00 -1.66 -1.40 4.11 -1.84 0.89 114.58 119.33 1g90 h GLU 32 Ca 0.49 0.00 0.24 0.00 0.07 0.00 0.00 59.36 60.16 1g90 h GLU 32 Cb 0.68 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.76 1g90 h GLU 32 CO 1.08 0.00 0.74 1.21 0.07 0.00 0.00 179.01 182.11 1g90 s ASN 33 N -4.86 -0.17 0.10 3.06 3.04 -1.25 -2.93 114.94 111.93 1g90 s ASN 33 Ca 0.05 -0.04 0.03 0.00 0.04 0.00 0.00 52.86 52.93 1g90 s ASN 33 Cb 0.11 0.21 -0.04 0.00 -1.54 0.00 0.00 41.25 39.99 1g90 s ASN 33 CO 0.72 -0.34 -0.08 -1.58 -3.04 0.00 0.00 177.10 172.77 1g90 s GLN 34 N -2.59 0.83 0.03 0.43 -0.44 -0.54 -4.92 119.66 112.47 1g90 s GLN 34 Ca 0.10 -1.22 -0.00 0.00 -2.50 0.00 0.00 55.36 51.73 1g90 s GLN 34 Cb -0.00 -0.39 -0.03 0.00 -1.64 0.00 0.00 33.01 30.96 1g90 s GLN 34 CO -0.05 0.04 -0.03 -1.17 0.50 0.00 0.00 175.29 174.58 1g90 s LEU 35 N -2.68 2.33 -0.07 3.68 1.98 -1.26 -0.37 118.68 122.29 1g90 s LEU 35 Ca 0.08 -0.68 -0.12 0.00 -2.89 0.00 0.00 54.13 50.52 1g90 s LEU 35 Cb 0.00 0.13 0.02 0.00 0.66 0.00 0.00 46.19 47.01 1g90 s LEU 35 CO -0.02 -0.40 0.29 -0.83 -1.89 0.00 0.00 176.35 173.50 1g90 s GLY 36 N -1.97 -0.18 -0.30 7.98 0.00 0.01 -4.90 107.32 107.96 1g90 s GLY 36 Ca -0.08 0.57 -0.12 0.00 0.00 0.00 0.00 44.72 45.10 1g90 s GLY 36 CO -0.04 0.42 0.73 0.00 0.00 0.00 0.00 173.10 174.20 1g90 s ALA 37 N -0.55 -2.15 0.19 3.20 0.00 -1.26 -0.29 121.76 120.90 1g90 s ALA 37 Ca -0.07 2.30 -0.24 0.00 0.00 0.00 0.00 51.96 53.96 1g90 s ALA 37 Cb -0.04 -1.78 0.05 0.00 0.00 0.00 0.00 23.12 21.35 1g90 s ALA 37 CO 0.02 -0.84 0.90 0.20 0.00 0.00 0.00 175.76 176.04 1g90 s GLY 38 N 2.60 -0.19 -0.03 0.00 0.00 0.40 -0.43 107.32 109.69 1g90 s GLY 38 Ca -0.06 0.01 -0.13 0.00 0.00 0.00 0.00 44.72 44.54 1g90 s GLY 38 CO -0.19 -0.02 0.35 0.00 0.00 0.00 0.00 173.10 173.25 1g90 s ALA 39 N -3.44 3.74 0.18 3.20 0.00 -0.29 -1.16 121.76 123.99 1g90 s ALA 39 Ca 0.12 -0.31 0.01 0.00 0.00 0.00 0.00 51.96 51.78 1g90 s ALA 39 Cb -0.03 -2.30 -0.05 0.00 0.00 0.00 0.00 23.12 20.75 1g90 s ALA 39 CO 0.04 0.51 0.03 -0.06 0.00 0.00 0.00 175.76 176.27 1g90 s PHE 40 N -1.06 1.21 0.10 0.00 0.40 0.47 -0.31 117.98 118.79 1g90 s PHE 40 Ca 0.22 -1.08 -0.00 0.00 -0.60 0.00 0.00 56.93 55.47 1g90 s PHE 40 Cb -0.16 -0.69 -0.04 0.00 0.51 0.00 0.00 43.02 42.65 1g90 s PHE 40 CO 0.11 -0.28 0.00 0.20 0.70 0.00 0.00 175.22 175.95 1g90 s GLY 41 N -3.17 0.80 0.13 4.36 0.00 0.89 -0.20 107.32 110.14 1g90 s GLY 41 Ca 0.26 -1.38 -0.01 0.00 0.00 0.00 0.00 44.72 43.60 1g90 s GLY 41 CO 0.05 -1.38 0.05 -0.32 0.00 0.00 0.00 173.10 171.50 1g90 s GLY 42 N -3.02 1.01 -0.09 0.20 0.00 -0.39 -1.08 107.32 103.94 1g90 s GLY 42 Ca 0.16 -1.48 -0.06 0.00 0.00 0.00 0.00 44.72 43.34 1g90 s GLY 42 CO -0.03 -1.37 0.23 -0.19 0.00 0.00 0.00 173.10 171.73 1g90 s TYR 43 N -4.02 -0.28 -0.17 1.90 1.51 0.78 -0.13 117.35 116.93 1g90 s TYR 43 Ca 0.24 0.68 0.01 0.00 -1.01 0.00 0.00 57.07 56.99 1g90 s TYR 43 Cb 0.07 0.05 0.03 0.00 -0.11 0.00 0.00 41.96 42.00 1g90 s TYR 43 CO 0.02 -0.18 -0.16 -1.14 -1.11 0.00 0.00 175.55 172.98 1g90 s GLN 44 N 0.75 2.60 0.00 -0.62 -0.44 0.38 -0.52 119.66 121.81 1g90 s GLN 44 Ca -0.05 -0.76 0.00 0.00 -2.50 0.00 0.00 55.36 52.05 1g90 s GLN 44 Cb -0.07 -2.40 0.00 0.00 -1.64 0.00 0.00 33.01 28.90 1g90 s GLN 44 CO -0.04 -0.26 0.00 1.55 0.50 0.00 0.00 175.29 177.03 1g90 n VAL 45 N 4.67 0.00 -4.14 1.34 3.14 -1.25 -1.10 118.33 120.99 1g90 n VAL 45 Ca -0.18 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.09 1g90 n VAL 45 Cb 0.49 1.33 -0.09 0.00 -1.06 0.00 0.00 33.84 34.50 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 0.00 0.19 0.27 6.55 0.01 -1.04 -4.81 114.94 116.11 1g90 s ASN 46 Ca 0.00 -1.23 -0.30 0.00 -0.71 0.00 0.00 52.86 50.61 1g90 s ASN 46 Cb 0.00 0.37 -0.11 0.00 0.41 0.00 0.00 41.25 41.91 1g90 s ASN 46 CO 0.00 -0.82 1.60 -2.16 -1.51 0.00 0.00 177.10 174.21 1g90 s PRO 47 N -4.09 4.14 0.00 -0.60 0.04 -1.26 -3.48 135.00 129.75 1g90 s PRO 47 Ca 0.30 2.55 0.00 0.00 0.04 0.00 0.00 61.00 63.89 1g90 s PRO 47 Cb 0.06 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.56 1g90 s PRO 47 CO 0.06 -0.63 0.00 0.66 0.04 0.00 0.00 177.00 177.13 1g90 n TYR 48 N 2.59 0.00 -3.65 0.56 4.02 -1.26 -4.90 117.16 114.52 1g90 n TYR 48 Ca 0.10 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.70 1g90 n TYR 48 Cb 0.37 -0.86 -0.16 0.00 -0.02 0.00 0.00 39.34 38.68 1g90 n TYR 48 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1g90 s VAL 49 N -1.34 0.32 0.00 -0.72 1.01 -1.23 -0.81 120.40 117.63 1g90 s VAL 49 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1g90 s VAL 49 Cb 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1g90 s VAL 49 CO 0.00 -0.52 0.00 0.61 0.00 0.00 0.00 175.10 175.19 1g90 n GLY 50 N 5.10 2.30 3.29 4.51 0.00 0.69 -2.49 105.19 118.60 1g90 n GLY 50 Ca -0.06 -2.12 -0.09 0.00 0.00 0.00 0.00 46.02 43.74 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 0.92 0.20 0.08 1.61 2.19 0.33 -0.42 117.98 122.90 1g90 s PHE 51 Ca 0.00 -0.59 -0.15 0.00 0.33 0.00 0.00 56.93 56.52 1g90 s PHE 51 Cb 0.00 0.00 0.03 0.00 -1.31 0.00 0.00 43.02 41.74 1g90 s PHE 51 CO 0.00 -0.66 0.34 -1.83 1.83 0.00 0.00 175.22 174.91 1g90 s GLU 52 N -3.90 0.94 0.02 10.12 4.04 0.51 -0.15 118.70 130.28 1g90 s GLU 52 Ca 0.10 -0.64 -0.10 0.00 0.04 0.00 0.00 54.97 54.38 1g90 s GLU 52 Cb 0.04 0.41 0.01 0.00 0.02 0.00 0.00 34.13 34.60 1g90 s GLU 52 CO -0.06 -0.34 0.19 -1.64 -1.84 0.00 0.00 175.26 171.58 1g90 s MET 53 N -3.28 0.63 0.11 -4.83 -1.94 -0.24 -0.81 119.30 108.93 1g90 s MET 53 Ca -0.00 -0.51 -0.26 0.00 -1.71 0.00 0.00 55.69 53.21 1g90 s MET 53 Cb 0.01 0.26 0.08 0.00 2.01 0.00 0.00 34.83 37.20 1g90 s MET 53 CO -0.08 -0.17 1.09 0.20 -0.01 0.00 0.00 175.02 176.04 1g90 s GLY 54 N -1.78 -0.18 -0.17 -0.03 0.00 0.15 -0.08 107.32 105.23 1g90 s GLY 54 Ca -0.09 0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.77 1g90 s GLY 54 CO -0.01 1.08 -0.09 -0.19 0.00 0.00 0.00 173.10 173.89 1g90 s TYR 55 N -2.68 2.03 0.33 1.90 2.02 0.58 -0.46 117.35 121.08 1g90 s TYR 55 Ca 0.17 -1.27 -0.18 0.00 -0.37 0.00 0.00 57.07 55.42 1g90 s TYR 55 Cb -0.00 -1.48 -0.09 0.00 -0.40 0.00 0.00 41.96 39.99 1g90 s TYR 55 CO 0.01 -0.66 0.79 -0.51 -1.57 0.00 0.00 175.55 173.61 1g90 s ASP 56 N 1.52 6.89 -0.12 2.29 1.01 0.24 -1.13 116.67 127.38 1g90 s ASP 56 Ca 0.01 1.42 -0.04 0.00 0.71 0.00 0.00 52.55 54.66 1g90 s ASP 56 Cb -0.15 -2.43 0.06 0.00 1.01 0.00 0.00 42.92 41.41 1g90 s ASP 56 CO -0.08 -0.19 0.21 0.12 0.21 0.00 0.00 175.17 175.44 1g90 s PHE 57 N -1.92 -0.29 0.36 4.23 5.36 0.43 -0.68 117.98 125.48 1g90 s PHE 57 Ca 0.54 0.71 0.03 0.00 -0.96 0.00 0.00 56.93 57.25 1g90 s PHE 57 Cb -0.12 -0.18 0.68 0.00 -0.34 0.00 0.00 43.02 43.06 1g90 s PHE 57 CO 0.17 -0.34 2.01 1.25 -1.46 0.00 0.00 175.22 176.85 1g90 h LEU 58 N 8.33 0.65 -7.00 6.12 6.46 -1.19 -3.43 115.31 125.25 1g90 h LEU 58 Ca -0.14 -0.03 0.16 0.00 -0.12 0.00 0.00 57.88 57.75 1g90 h LEU 58 Cb 1.12 -0.16 -0.25 0.00 -0.73 0.00 0.00 40.66 40.64 1g90 h LEU 58 CO 0.15 0.49 0.73 -0.83 -0.62 0.00 0.00 178.44 178.37 1g90 s GLY 59 N -3.56 -0.11 -0.19 3.75 0.00 -1.26 -5.00 107.32 100.95 1g90 s GLY 59 Ca -0.09 2.36 -0.29 0.00 0.00 0.00 0.00 44.72 46.70 1g90 s GLY 59 CO 0.76 1.04 1.38 0.50 0.00 0.00 0.00 173.10 176.78 1g90 s ARG 60 N -1.12 4.09 0.59 2.90 0.52 -1.26 -5.00 118.95 119.65 1g90 s ARG 60 Ca 0.03 1.63 -0.20 0.00 -0.52 0.00 0.00 55.73 56.67 1g90 s ARG 60 Cb -0.01 -3.86 -0.03 0.00 0.52 0.00 0.00 34.95 31.57 1g90 s ARG 60 CO -0.03 -0.91 1.33 -1.64 0.02 0.00 0.00 175.30 174.07 1g90 s MET 61 N 3.90 2.91 -1.01 3.54 -1.94 -1.26 -4.88 119.30 120.56 1g90 s MET 61 Ca 0.60 2.17 -0.19 0.00 -1.71 0.00 0.00 55.69 56.56 1g90 s MET 61 Cb -0.22 -2.09 -0.09 0.00 2.01 0.00 0.00 34.83 34.43 1g90 s MET 61 CO 0.21 -1.35 2.05 -0.35 -0.01 0.00 0.00 175.02 175.56 1g90 n PRO 62 N -1.38 2.00 0.26 2.03 -0.04 -1.26 -4.77 135.00 131.83 1g90 n PRO 62 Ca 0.13 -2.08 0.09 0.00 -0.04 0.00 0.00 63.50 61.60 1g90 n PRO 62 Cb 0.46 -3.02 0.66 0.00 -0.04 0.00 0.00 33.50 31.57 1g90 n PRO 62 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1g90 h TYR 63 N 7.17 0.00 0.00 0.54 3.20 -2.03 -3.46 116.97 122.40 1g90 h TYR 63 Ca 0.48 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.35 1g90 h TYR 63 Cb 0.63 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.90 1g90 h TYR 63 CO 1.35 0.09 0.00 1.17 -1.64 0.00 0.00 178.16 179.13 1g90 n LYS 64 N -4.16 0.00 0.00 1.82 0.00 -1.26 -1.37 118.16 113.18 1g90 n LYS 64 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.28 1g90 n LYS 64 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.20 1g90 n LYS 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1g90 n GLY 65 N 0.00 0.00 3.71 3.14 0.00 -1.26 -5.18 105.19 105.61 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 -0.56 0.00 0.00 0.00 173.32 172.76 1g90 s SER 66 N 0.00 3.14 0.30 1.61 0.01 -0.47 -5.11 113.70 113.18 1g90 s SER 66 Ca 0.00 1.25 0.03 0.00 1.31 0.00 0.00 55.95 58.54 1g90 s SER 66 Cb 0.00 -1.91 -0.06 0.00 0.21 0.00 0.00 66.02 64.26 1g90 s SER 66 CO 0.00 -2.81 0.08 0.68 0.41 0.00 0.00 173.24 171.59 1g90 s VAL 67 N -3.02 0.90 0.00 3.43 -7.23 -1.26 -4.90 120.40 108.33 1g90 s VAL 67 Ca 0.64 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.81 1g90 s VAL 67 Cb -0.17 -2.71 0.00 0.00 0.56 0.00 0.00 36.38 34.05 1g90 s VAL 67 CO 0.56 0.00 0.00 -1.84 -0.31 0.00 0.00 175.10 173.51 1g90 n GLU 68 N -0.60 0.00 -1.98 4.82 0.28 -1.26 -4.83 120.64 117.06 1g90 n GLU 68 Ca -0.01 0.00 -0.26 0.00 -0.16 0.00 0.00 57.16 56.73 1g90 n GLU 68 Cb 0.66 -1.66 -0.07 0.00 1.43 0.00 0.00 31.44 31.81 1g90 n GLU 68 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1g90 s ASN 69 N -0.34 4.78 0.10 -1.84 2.47 -1.26 -4.85 114.94 114.00 1g90 s ASN 69 Ca 0.00 -1.34 0.01 0.00 0.42 0.00 0.00 52.86 51.95 1g90 s ASN 69 Cb 0.00 -2.58 -0.00 0.00 -1.45 0.00 0.00 41.25 37.21 1g90 s ASN 69 CO 0.00 -3.29 0.04 0.61 -3.72 0.00 0.00 177.10 170.74 1g90 n GLY 70 N 6.07 3.88 1.48 1.21 0.00 -1.26 -5.06 105.19 111.50 1g90 n GLY 70 Ca 0.44 -1.93 0.19 0.00 0.00 0.00 0.00 46.02 44.72 1g90 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g90 n ALA 71 N -2.51 -3.84 -2.31 4.61 0.00 -1.26 -4.89 120.51 110.30 1g90 n ALA 71 Ca -0.04 0.66 -0.42 0.00 0.00 0.00 0.00 53.44 53.64 1g90 n ALA 71 Cb 0.15 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.13 1g90 n ALA 71 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1g90 s TYR 72 N -3.04 3.42 0.07 0.00 2.02 -1.26 -5.04 117.35 113.53 1g90 s TYR 72 Ca 0.00 1.30 -0.13 0.00 -0.37 0.00 0.00 57.07 57.87 1g90 s TYR 72 Cb 0.00 -3.44 0.02 0.00 -0.40 0.00 0.00 41.96 38.14 1g90 s TYR 72 CO 0.00 -1.34 0.29 0.15 -1.57 0.00 0.00 175.55 173.08 1g90 s LYS 73 N 0.77 0.88 -1.20 -0.62 3.01 -1.26 -5.02 119.74 116.29 1g90 s LYS 73 Ca 0.58 -0.67 -0.34 0.00 -1.01 0.00 0.00 55.97 54.53 1g90 s LYS 73 Cb -0.31 0.37 0.04 0.00 -1.01 0.00 0.00 37.83 36.93 1g90 s LYS 73 CO 0.31 -0.30 0.69 0.00 0.51 0.00 0.00 175.35 176.56 1g90 n ALA 74 N 0.23 -2.62 -3.88 5.17 0.00 -1.14 -4.85 120.51 113.42 1g90 n ALA 74 Ca -0.17 -0.56 -0.06 0.00 0.00 0.00 0.00 53.44 52.65 1g90 n ALA 74 Cb 0.61 -2.70 0.00 0.00 0.00 0.00 0.00 19.45 17.37 1g90 n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1g90 n GLN 75 N -4.96 0.93 -3.34 0.00 10.64 0.08 -0.73 117.38 120.00 1g90 n GLN 75 Ca -0.11 -2.42 -0.07 0.00 -1.83 0.00 0.00 57.00 52.57 1g90 n GLN 75 Cb 0.57 2.68 0.02 0.00 -0.86 0.00 0.00 30.24 32.65 1g90 n GLN 75 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1g90 n GLY 76 N -0.54 1.12 2.94 2.61 0.00 0.14 -0.33 105.19 111.13 1g90 n GLY 76 Ca -0.05 -1.21 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 1g90 n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g90 s VAL 77 N -2.24 0.07 0.06 1.61 0.11 0.69 -0.59 120.40 120.10 1g90 s VAL 77 Ca 0.14 -0.54 0.05 0.00 -2.93 0.00 0.00 61.98 58.69 1g90 s VAL 77 Cb -0.04 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.62 1g90 s VAL 77 CO 0.10 -0.30 -0.14 -1.10 -3.33 0.00 0.00 175.10 170.32 1g90 s GLN 78 N -0.88 0.89 -0.16 1.54 -0.21 0.40 -0.81 119.66 120.43 1g90 s GLN 78 Ca -0.10 -0.86 -0.07 0.00 0.02 0.00 0.00 55.36 54.35 1g90 s GLN 78 Cb -0.06 -0.91 0.07 0.00 1.00 0.00 0.00 33.01 33.11 1g90 s GLN 78 CO -0.01 0.22 0.37 -0.48 -2.12 0.00 0.00 175.29 173.27 1g90 s LEU 79 N -1.43 -0.21 0.03 2.90 2.34 -0.08 -0.68 118.68 121.56 1g90 s LEU 79 Ca 0.00 0.83 -0.03 0.00 0.06 0.00 0.00 54.13 54.99 1g90 s LEU 79 Cb -0.09 1.17 -0.02 0.00 -0.56 0.00 0.00 46.19 46.69 1g90 s LEU 79 CO 0.02 -0.21 0.04 0.42 -1.06 0.00 0.00 176.35 175.56 1g90 s THR 80 N 1.87 0.14 0.21 5.48 -4.23 0.01 -1.03 115.64 118.09 1g90 s THR 80 Ca -0.06 -1.15 -0.22 0.00 -1.18 0.00 0.00 61.69 59.08 1g90 s THR 80 Cb -0.10 -0.80 -0.08 0.00 1.34 0.00 0.00 72.50 72.86 1g90 s THR 80 CO -0.12 -0.63 0.77 0.00 -0.54 0.00 0.00 174.62 174.10 1g90 s ALA 81 N -2.44 3.41 -0.36 3.99 0.00 0.37 -0.36 121.76 126.37 1g90 s ALA 81 Ca -0.07 0.27 -0.01 0.00 0.00 0.00 0.00 51.96 52.16 1g90 s ALA 81 Cb -0.02 -2.91 0.09 0.00 0.00 0.00 0.00 23.12 20.28 1g90 s ALA 81 CO -0.04 0.30 0.10 0.21 0.00 0.00 0.00 175.76 176.33 1g90 s LYS 82 N -1.67 2.00 -0.48 0.00 2.20 0.44 -1.03 119.74 121.20 1g90 s LYS 82 Ca 0.41 -1.67 -0.20 0.00 -0.36 0.00 0.00 55.97 54.14 1g90 s LYS 82 Cb -0.19 -3.37 0.04 0.00 -1.51 0.00 0.00 37.83 32.80 1g90 s LYS 82 CO 0.23 -0.91 0.65 -0.51 -0.36 0.00 0.00 175.35 174.45 1g90 s LEU 83 N 1.11 4.71 0.06 5.43 1.02 0.42 -0.22 118.68 131.21 1g90 s LEU 83 Ca 0.05 -0.64 -0.28 0.00 0.02 0.00 0.00 54.13 53.28 1g90 s LEU 83 Cb -0.21 -2.58 0.09 0.00 0.02 0.00 0.00 46.19 43.51 1g90 s LEU 83 CO -0.04 -0.86 1.02 -0.83 0.02 0.00 0.00 176.35 175.66 1g90 s GLY 84 N 2.39 -0.33 0.10 -3.19 0.00 0.01 -0.33 107.32 105.98 1g90 s GLY 84 Ca 0.19 0.56 -0.22 0.00 0.00 0.00 0.00 44.72 45.24 1g90 s GLY 84 CO 0.15 0.14 0.54 -2.52 0.00 0.00 0.00 173.10 171.42 1g90 s TYR 85 N -3.02 -0.45 0.02 1.90 1.13 -0.23 -4.14 117.35 112.56 1g90 s TYR 85 Ca 0.11 0.35 -0.30 0.00 -1.41 0.00 0.00 57.07 55.82 1g90 s TYR 85 Cb -0.00 0.42 -0.06 0.00 -1.10 0.00 0.00 41.96 41.23 1g90 s TYR 85 CO -0.02 -0.74 1.38 -1.25 -2.51 0.00 0.00 175.55 172.41 1g90 s PRO 86 N -3.16 4.30 0.11 -3.49 0.04 -1.26 -0.91 135.00 130.63 1g90 s PRO 86 Ca -0.01 1.96 -0.19 0.00 0.04 0.00 0.00 61.00 62.80 1g90 s PRO 86 Cb -0.00 -3.52 -0.07 0.00 0.04 0.00 0.00 34.50 30.95 1g90 s PRO 86 CO -0.08 -0.54 1.68 0.82 0.04 0.00 0.00 177.00 178.92 1g90 h ILE 87 N 4.82 1.14 -3.08 0.56 1.08 -1.12 -3.48 117.51 117.43 1g90 h ILE 87 Ca -0.38 -0.41 -0.05 0.00 -0.39 0.00 0.00 64.86 63.63 1g90 h ILE 87 Cb 1.18 0.98 0.00 0.00 -3.07 0.00 0.00 36.82 35.91 1g90 h ILE 87 CO 0.89 0.14 0.24 0.28 -0.69 0.00 0.00 178.15 179.02 1g90 s THR 88 N -5.71 0.00 0.00 -0.27 -1.32 -1.26 -5.05 115.64 102.03 1g90 s THR 88 Ca -0.13 -1.04 0.00 0.00 -1.21 0.00 0.00 61.69 59.30 1g90 s THR 88 Cb 0.08 -2.93 0.00 0.00 -1.51 0.00 0.00 72.50 68.14 1g90 s THR 88 CO 0.71 0.00 0.00 0.47 -2.21 0.00 0.00 174.62 173.59 1g90 n ASP 89 N -1.49 0.00 -3.47 8.08 9.92 -1.26 -2.30 116.55 126.03 1g90 n ASP 89 Ca -0.08 0.00 -0.26 0.00 -0.53 0.00 0.00 54.79 53.92 1g90 n ASP 89 Cb 0.60 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.96 1g90 n ASP 89 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1g90 s ASP 90 N -1.19 2.75 -0.30 -2.24 2.15 -1.26 -5.04 116.67 111.54 1g90 s ASP 90 Ca 0.00 -1.59 -0.02 0.00 0.43 0.00 0.00 52.55 51.37 1g90 s ASP 90 Cb 0.00 -0.13 0.19 0.00 -0.30 0.00 0.00 42.92 42.68 1g90 s ASP 90 CO 0.00 -0.36 0.72 -0.22 -0.17 0.00 0.00 175.17 175.14 1g90 s LEU 91 N 1.66 -1.20 0.11 -1.34 1.98 -0.97 -4.86 118.68 114.05 1g90 s LEU 91 Ca 0.14 0.48 -0.22 0.00 -2.89 0.00 0.00 54.13 51.63 1g90 s LEU 91 Cb -0.18 1.90 -0.07 0.00 0.66 0.00 0.00 46.19 48.50 1g90 s LEU 91 CO -0.18 -0.22 0.66 -0.62 -1.89 0.00 0.00 176.35 174.10 1g90 s ASP 92 N 2.88 7.20 -0.00 3.68 -1.08 0.03 -0.46 116.67 128.91 1g90 s ASP 92 Ca 0.15 1.42 0.08 0.00 -0.52 0.00 0.00 52.55 53.68 1g90 s ASP 92 Cb -0.11 -2.42 -0.02 0.00 -1.46 0.00 0.00 42.92 38.90 1g90 s ASP 92 CO -0.21 0.23 -0.26 -0.51 0.52 0.00 0.00 175.17 174.94 1g90 s ILE 93 N -1.05 2.07 0.24 4.11 2.07 -0.08 -0.75 121.20 127.81 1g90 s ILE 93 Ca 0.32 -1.19 -0.08 0.00 -1.41 0.00 0.00 60.65 58.29 1g90 s ILE 93 Cb -0.21 -1.73 -0.02 0.00 0.13 0.00 0.00 42.46 40.63 1g90 s ILE 93 CO 0.22 0.52 0.37 -0.72 -1.91 0.00 0.00 174.94 173.41 1g90 s TYR 94 N -0.67 0.66 -0.04 3.50 -0.85 0.08 -1.06 117.35 118.98 1g90 s TYR 94 Ca 0.10 -0.97 0.00 0.00 -0.52 0.00 0.00 57.07 55.68 1g90 s TYR 94 Cb -0.10 -0.07 0.03 0.00 0.38 0.00 0.00 41.96 42.20 1g90 s TYR 94 CO -0.00 -0.89 0.00 0.99 -1.52 0.00 0.00 175.55 174.13 1g90 s THR 95 N -3.99 0.21 0.02 -3.49 2.01 0.55 -1.33 115.64 109.61 1g90 s THR 95 Ca 0.28 0.10 0.01 0.00 0.31 0.00 0.00 61.69 62.39 1g90 s THR 95 Cb 0.02 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.17 1g90 s THR 95 CO 0.11 0.17 0.08 0.00 -0.69 0.00 0.00 174.62 174.28 1g90 s ARG 96 N 1.19 3.00 -0.13 4.92 1.70 0.77 -0.44 118.95 129.97 1g90 s ARG 96 Ca -0.07 -0.54 -0.12 0.00 -0.47 0.00 0.00 55.73 54.52 1g90 s ARG 96 Cb -0.13 -2.81 0.04 0.00 -0.57 0.00 0.00 34.95 31.47 1g90 s ARG 96 CO -0.02 0.62 0.35 -1.17 -1.08 0.00 0.00 175.30 174.01 1g90 s LEU 97 N -1.89 0.61 0.00 -1.89 0.20 -0.20 -1.23 118.68 114.28 1g90 s LEU 97 Ca 0.24 0.72 0.00 0.00 0.69 0.00 0.00 54.13 55.78 1g90 s LEU 97 Cb -0.12 1.21 0.00 0.00 -0.43 0.00 0.00 46.19 46.85 1g90 s LEU 97 CO 0.16 -0.13 0.00 0.61 -0.29 0.00 0.00 176.35 176.70 1g90 n GLY 98 N 2.97 -0.50 3.50 7.98 0.00 0.22 -0.48 105.19 118.88 1g90 n GLY 98 Ca -0.14 0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 1.10 0.14 -0.02 0.00 -0.20 -1.00 107.32 107.34 1g90 s GLY 99 Ca 0.00 -1.28 -0.12 0.00 0.00 0.00 0.00 44.72 43.32 1g90 s GLY 99 CO 0.00 -0.89 0.32 -3.16 0.00 0.00 0.00 173.10 169.37 1g90 s MET 100 N -3.52 1.07 -0.01 2.90 0.23 0.39 -0.91 119.30 119.45 1g90 s MET 100 Ca 0.28 -0.93 0.01 0.00 -1.03 0.00 0.00 55.69 54.02 1g90 s MET 100 Cb 0.00 0.41 0.00 0.00 -1.53 0.00 0.00 34.83 33.72 1g90 s MET 100 CO 0.15 -0.40 -0.03 0.08 -2.03 0.00 0.00 175.02 172.79 1g90 s VAL 101 N -3.88 0.29 0.13 5.16 1.01 0.01 -0.79 120.40 122.34 1g90 s VAL 101 Ca 0.08 -0.11 0.04 0.00 0.00 0.00 0.00 61.98 62.00 1g90 s VAL 101 Cb 0.03 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 1g90 s VAL 101 CO -0.07 0.10 -0.11 -0.36 0.00 0.00 0.00 175.10 174.67 1g90 s PHE 102 N 0.19 1.23 -0.24 5.22 0.40 0.07 -0.22 117.98 124.62 1g90 s PHE 102 Ca -0.02 -0.71 -0.04 0.00 -0.60 0.00 0.00 56.93 55.56 1g90 s PHE 102 Cb -0.05 -0.64 0.09 0.00 0.51 0.00 0.00 43.02 42.93 1g90 s PHE 102 CO -0.00 0.07 0.12 0.50 0.70 0.00 0.00 175.22 176.61 1g90 s ARG 103 N -3.41 0.15 -0.43 0.44 3.52 0.55 -0.70 118.95 119.06 1g90 s ARG 103 Ca 0.13 -0.32 -0.14 0.00 -0.13 0.00 0.00 55.73 55.26 1g90 s ARG 103 Cb 0.01 -1.39 0.05 0.00 -1.56 0.00 0.00 34.95 32.05 1g90 s ARG 103 CO 0.01 -0.88 0.32 0.00 -0.81 0.00 0.00 175.30 173.94 1g90 s ALA 104 N 2.13 3.47 -0.58 6.12 0.00 -1.26 -0.75 121.76 130.90 1g90 s ALA 104 Ca 0.06 -1.92 -0.27 0.00 0.00 0.00 0.00 51.96 49.83 1g90 s ALA 104 Cb -0.16 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.06 1g90 s ALA 104 CO -0.26 -1.58 1.56 -0.51 0.00 0.00 0.00 175.76 174.98 1g90 s ASP 105 N 2.07 5.87 0.17 0.00 1.11 -1.26 -4.84 116.67 119.79 1g90 s ASP 105 Ca 0.04 0.30 -0.24 0.00 0.18 0.00 0.00 52.55 52.83 1g90 s ASP 105 Cb -0.21 -2.54 0.06 0.00 1.07 0.00 0.00 42.92 41.30 1g90 s ASP 105 CO 0.08 -1.91 0.96 0.28 1.18 0.00 0.00 175.17 175.75 1g90 s THR 106 N 6.94 0.00 -1.28 -1.27 -1.32 -1.26 -4.96 115.64 112.49 1g90 s THR 106 Ca 0.57 -0.67 -0.18 0.00 -1.21 0.00 0.00 61.69 60.20 1g90 s THR 106 Cb -0.12 -2.13 0.02 0.00 -1.51 0.00 0.00 72.50 68.76 1g90 s THR 106 CO 0.23 0.00 1.91 0.29 -2.21 0.00 0.00 174.62 174.85 1g90 n LYS 107 N -0.50 2.75 -1.55 7.08 5.02 -1.26 -4.92 118.16 124.78 1g90 n LYS 107 Ca -0.06 -2.87 -0.38 0.00 -2.02 0.00 0.00 58.31 52.98 1g90 n LYS 107 Cb 0.60 -3.43 -0.04 0.00 -0.02 0.00 0.00 35.03 32.14 1g90 n LYS 107 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1g90 n SER 108 N 8.54 2.22 -0.58 4.39 2.88 -1.26 -4.81 113.62 125.00 1g90 n SER 108 Ca 0.49 -0.32 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 1g90 n SER 108 Cb 0.44 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 1g90 n SER 108 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1g90 n ASN 109 N 14.65 0.00 -3.11 -3.46 2.85 -1.26 -5.06 115.26 119.86 1g90 n ASN 109 Ca 0.39 -0.58 -0.03 0.00 -0.11 0.00 0.00 54.58 54.26 1g90 n ASN 109 Cb 0.47 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.50 1g90 n ASN 109 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1g90 n VAL 110 N 0.00 -9.76 0.20 3.44 0.31 -1.26 -4.73 118.33 106.53 1g90 n VAL 110 Ca 0.00 -0.32 0.01 0.00 -0.01 0.00 0.00 64.34 64.02 1g90 n VAL 110 Cb 0.00 -6.70 0.04 0.00 -0.91 0.00 0.00 33.84 26.27 1g90 n VAL 110 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1g90 n TYR 111 N -1.94 0.00 0.41 3.52 4.01 -1.26 -0.90 117.16 121.00 1g90 n TYR 111 Ca -0.02 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.85 1g90 n TYR 111 Cb 0.52 0.00 0.37 0.00 -0.31 0.00 0.00 39.34 39.91 1g90 n TYR 111 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1g90 h GLY 112 N 0.57 0.00 -2.42 2.72 0.00 -1.86 -3.44 103.07 98.64 1g90 h GLY 112 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1g90 h GLY 112 CO 0.00 0.00 -0.48 1.25 0.00 0.00 0.00 176.54 177.31 1g90 s LYS 113 N -3.24 2.57 0.02 4.80 2.47 -0.08 -0.82 119.74 125.47 1g90 s LYS 113 Ca 0.07 -1.41 -0.07 0.00 -1.56 0.00 0.00 55.97 53.00 1g90 s LYS 113 Cb 0.09 -2.35 -0.00 0.00 -1.46 0.00 0.00 37.83 34.11 1g90 s LYS 113 CO 0.59 0.09 0.14 1.21 0.16 0.00 0.00 175.35 177.54 1g90 s ASN 114 N -3.94 0.08 -0.38 1.43 2.47 -1.26 -4.81 114.94 108.53 1g90 s ASN 114 Ca 0.40 -0.36 -0.00 0.00 0.42 0.00 0.00 52.86 53.32 1g90 s ASN 114 Cb -0.04 0.24 0.26 0.00 -1.45 0.00 0.00 41.25 40.25 1g90 s ASN 114 CO 0.25 -0.47 1.13 0.00 -3.72 0.00 0.00 177.10 174.29 1g90 n HIS 115 N 1.01 -1.37 0.08 0.43 -0.00 -1.26 -5.09 115.22 109.01 1g90 n HIS 115 Ca -0.20 -1.00 -0.10 0.00 -0.00 0.00 0.00 57.72 56.42 1g90 n HIS 115 Cb 0.57 1.23 -0.06 0.00 -0.00 0.00 0.00 29.99 31.74 1g90 n HIS 115 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.34 175.90 1g90 h ASP 116 N 3.45 -0.91 -3.95 4.39 5.19 -1.97 -3.44 116.42 119.19 1g90 h ASP 116 Ca -0.20 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.30 1g90 h ASP 116 Cb 1.15 0.33 0.00 0.00 0.18 0.00 0.00 39.33 40.99 1g90 h ASP 116 CO -0.04 -0.33 -0.71 0.41 -3.12 0.00 0.00 179.24 175.45 1g90 n THR 117 N -4.18 -2.87 0.00 0.35 -1.04 -1.26 -4.94 114.28 100.34 1g90 n THR 117 Ca -0.05 1.33 0.00 0.00 -2.04 0.00 0.00 64.05 63.29 1g90 n THR 117 Cb 0.24 -2.03 0.00 0.00 -1.82 0.00 0.00 70.33 66.72 1g90 n THR 117 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1g90 n GLY 118 N -1.84 -0.47 3.85 3.41 0.00 0.12 -4.92 105.19 105.33 1g90 n GLY 118 Ca 0.00 -2.25 -0.33 0.00 0.00 0.00 0.00 46.02 43.44 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 -0.44 4.79 0.01 1.61 0.11 -1.26 -0.75 120.40 124.47 1g90 s VAL 119 Ca 0.00 0.78 -0.19 0.00 -2.93 0.00 0.00 61.98 59.64 1g90 s VAL 119 Cb 0.00 -3.65 0.04 0.00 -1.53 0.00 0.00 36.38 31.23 1g90 s VAL 119 CO 0.00 -0.04 0.42 -0.55 -3.33 0.00 0.00 175.10 171.60 1g90 s SER 120 N -2.16 -0.31 0.83 3.54 0.15 0.03 -4.97 113.70 110.81 1g90 s SER 120 Ca 0.48 0.12 -0.11 0.00 0.70 0.00 0.00 55.95 57.15 1g90 s SER 120 Cb -0.12 0.41 0.09 0.00 -1.71 0.00 0.00 66.02 64.69 1g90 s SER 120 CO 0.19 -0.60 1.10 -2.16 1.20 0.00 0.00 173.24 172.97 1g90 s PRO 121 N -1.98 1.77 -0.07 5.44 0.04 -1.26 -0.46 135.00 138.48 1g90 s PRO 121 Ca -0.08 1.13 -0.12 0.00 0.04 0.00 0.00 61.00 61.96 1g90 s PRO 121 Cb -0.02 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.70 1g90 s PRO 121 CO 0.01 -1.97 0.29 0.54 0.04 0.00 0.00 177.00 175.92 1g90 s VAL 122 N -2.87 0.03 0.02 -0.36 0.11 -0.17 -4.67 120.40 112.49 1g90 s VAL 122 Ca 0.63 -0.22 -0.12 0.00 -2.93 0.00 0.00 61.98 59.33 1g90 s VAL 122 Cb -0.18 -0.49 0.01 0.00 -1.53 0.00 0.00 36.38 34.19 1g90 s VAL 122 CO 0.57 -0.12 0.25 0.72 -3.33 0.00 0.00 175.10 173.19 1g90 s PHE 123 N -0.48 -0.06 0.24 1.54 -0.12 -1.26 -0.61 117.98 117.22 1g90 s PHE 123 Ca -0.06 -0.05 -0.18 0.00 -0.05 0.00 0.00 56.93 56.59 1g90 s PHE 123 Cb -0.04 0.04 0.02 0.00 -0.63 0.00 0.00 43.02 42.41 1g90 s PHE 123 CO 0.02 -0.43 0.60 0.00 -0.05 0.00 0.00 175.22 175.36 1g90 s ALA 124 N -2.11 -0.95 0.41 1.99 0.00 -0.36 -4.39 121.76 116.35 1g90 s ALA 124 Ca -0.08 -0.35 0.08 0.00 0.00 0.00 0.00 51.96 51.61 1g90 s ALA 124 Cb -0.03 0.90 -0.03 0.00 0.00 0.00 0.00 23.12 23.96 1g90 s ALA 124 CO -0.01 -0.91 0.32 0.20 0.00 0.00 0.00 175.76 175.36 1g90 s GLY 125 N -2.91 2.17 0.00 0.00 0.00 0.45 -0.16 107.32 106.87 1g90 s GLY 125 Ca 0.12 -1.94 0.00 0.00 0.00 0.00 0.00 44.72 42.91 1g90 s GLY 125 CO 0.03 -1.75 0.00 0.61 0.00 0.00 0.00 173.10 171.99 1g90 n GLY 126 N -1.45 -1.43 3.11 0.20 0.00 -0.44 -0.22 105.19 104.96 1g90 n GLY 126 Ca 0.02 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.62 0.52 0.06 1.61 -7.23 -0.58 -0.74 120.40 111.42 1g90 s VAL 127 Ca 0.00 -1.62 0.03 0.00 -1.81 0.00 0.00 61.98 58.58 1g90 s VAL 127 Cb 0.00 -1.28 -0.03 0.00 0.56 0.00 0.00 36.38 35.63 1g90 s VAL 127 CO 0.00 -0.75 -0.09 -1.61 -0.31 0.00 0.00 175.10 172.33 1g90 s GLU 128 N -3.12 0.66 -0.22 4.82 2.02 0.07 -0.31 118.70 122.63 1g90 s GLU 128 Ca 0.03 -0.91 -0.04 0.00 0.02 0.00 0.00 54.97 54.08 1g90 s GLU 128 Cb 0.01 -0.44 0.10 0.00 0.10 0.00 0.00 34.13 33.90 1g90 s GLU 128 CO -0.04 0.08 0.23 -0.47 0.02 0.00 0.00 175.26 175.08 1g90 s TYR 129 N -1.69 -0.29 -1.25 1.61 6.14 0.12 -0.79 117.35 121.20 1g90 s TYR 129 Ca -0.04 0.16 -0.19 0.00 0.64 0.00 0.00 57.07 57.64 1g90 s TYR 129 Cb -0.08 -0.38 0.05 0.00 0.42 0.00 0.00 41.96 41.97 1g90 s TYR 129 CO 0.00 -0.65 1.73 0.00 0.64 0.00 0.00 175.55 177.27 1g90 s ALA 130 N 2.33 3.05 0.33 3.97 0.00 -1.26 -0.19 121.76 129.99 1g90 s ALA 130 Ca 0.07 -2.74 0.08 0.00 0.00 0.00 0.00 51.96 49.38 1g90 s ALA 130 Cb -0.16 -4.64 0.81 0.00 0.00 0.00 0.00 23.12 19.14 1g90 s ALA 130 CO -0.15 -3.58 1.79 0.82 0.00 0.00 0.00 175.76 174.64 1g90 h ILE 131 N 5.81 0.69 -3.89 0.00 1.08 -1.85 -3.39 117.51 115.96 1g90 h ILE 131 Ca 0.39 -0.24 -0.28 0.00 -0.39 0.00 0.00 64.86 64.34 1g90 h ILE 131 Cb 0.90 -0.06 -0.15 0.00 -3.07 0.00 0.00 36.82 34.44 1g90 h ILE 131 CO 1.43 0.13 -0.65 0.42 -0.69 0.00 0.00 178.15 178.78 1g90 s THR 132 N -5.77 0.56 0.00 -0.27 -4.23 -0.50 -4.99 115.64 100.43 1g90 s THR 132 Ca -0.11 -1.97 -0.01 0.00 -1.18 0.00 0.00 61.69 58.41 1g90 s THR 132 Cb 0.25 -2.21 -0.06 0.00 1.34 0.00 0.00 72.50 71.81 1g90 s THR 132 CO 0.80 -0.38 1.72 -0.81 -0.54 0.00 0.00 174.62 175.41 1g90 n PRO 133 N -0.26 0.87 0.00 3.99 -0.04 -1.26 -2.93 135.00 135.37 1g90 n PRO 133 Ca -0.05 -0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.17 1g90 n PRO 133 Cb 0.64 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 1g90 n PRO 133 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1g90 n GLU 134 N 2.07 0.00 -4.04 0.54 4.07 -1.26 -5.00 120.64 117.02 1g90 n GLU 134 Ca 0.10 0.00 -0.13 0.00 -0.06 0.00 0.00 57.16 57.08 1g90 n GLU 134 Cb 0.42 -0.13 -0.13 0.00 -0.06 0.00 0.00 31.44 31.54 1g90 n GLU 134 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1g90 s ILE 135 N -1.52 0.31 -0.04 6.31 2.07 -1.15 -1.14 121.20 126.04 1g90 s ILE 135 Ca 0.00 -0.59 -0.03 0.00 -1.41 0.00 0.00 60.65 58.62 1g90 s ILE 135 Cb 0.00 -0.35 0.02 0.00 0.13 0.00 0.00 42.46 42.26 1g90 s ILE 135 CO 0.00 -0.19 0.10 0.00 -1.91 0.00 0.00 174.94 172.94 1g90 s ALA 136 N -0.76 -0.22 0.23 1.50 0.00 0.80 -1.41 121.76 121.89 1g90 s ALA 136 Ca -0.06 0.34 -0.04 0.00 0.00 0.00 0.00 51.96 52.20 1g90 s ALA 136 Cb -0.06 -0.21 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 1g90 s ALA 136 CO -0.00 -0.07 0.47 0.99 0.00 0.00 0.00 175.76 177.15 1g90 s THR 137 N 0.30 5.09 0.10 0.00 2.01 0.73 0.06 115.64 123.93 1g90 s THR 137 Ca -0.02 0.01 0.09 0.00 0.31 0.00 0.00 61.69 62.07 1g90 s THR 137 Cb -0.03 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.75 1g90 s THR 137 CO -0.01 -0.17 -0.22 -0.13 -0.69 0.00 0.00 174.62 173.40 1g90 s ARG 138 N -3.19 1.23 0.01 4.92 0.52 0.62 -0.70 118.95 122.36 1g90 s ARG 138 Ca 0.42 -1.16 0.01 0.00 -0.52 0.00 0.00 55.73 54.48 1g90 s ARG 138 Cb -0.11 -1.51 -0.01 0.00 0.52 0.00 0.00 34.95 33.84 1g90 s ARG 138 CO 0.27 0.36 -0.04 -1.17 0.02 0.00 0.00 175.30 174.74 1g90 s LEU 139 N -1.81 2.11 -0.02 2.53 1.98 0.58 -0.72 118.68 123.33 1g90 s LEU 139 Ca 0.08 -0.25 -0.07 0.00 -2.89 0.00 0.00 54.13 51.01 1g90 s LEU 139 Cb -0.10 -0.09 0.01 0.00 0.66 0.00 0.00 46.19 46.66 1g90 s LEU 139 CO 0.04 -0.09 0.14 -0.70 -1.89 0.00 0.00 176.35 173.85 1g90 s GLU 140 N -0.68 0.39 -0.06 1.98 2.12 0.33 -1.53 118.70 121.26 1g90 s GLU 140 Ca -0.05 -0.22 -0.01 0.00 0.36 0.00 0.00 54.97 55.05 1g90 s GLU 140 Cb -0.05 0.17 0.03 0.00 0.26 0.00 0.00 34.13 34.54 1g90 s GLU 140 CO -0.00 -0.09 0.02 0.71 -0.54 0.00 0.00 175.26 175.36 1g90 s TYR 141 N -0.94 0.46 0.26 5.30 1.51 0.70 -0.89 117.35 123.74 1g90 s TYR 141 Ca -0.10 -0.03 0.05 0.00 -1.01 0.00 0.00 57.07 55.98 1g90 s TYR 141 Cb -0.06 -0.67 -0.06 0.00 -0.11 0.00 0.00 41.96 41.07 1g90 s TYR 141 CO 0.01 -0.27 -0.02 -1.14 -1.11 0.00 0.00 175.55 173.03 1g90 s GLN 142 N 1.92 1.46 0.64 -0.62 0.74 0.79 -0.41 119.66 124.18 1g90 s GLN 142 Ca 0.03 -1.75 -0.08 0.00 0.05 0.00 0.00 55.36 53.61 1g90 s GLN 142 Cb -0.12 -0.86 0.01 0.00 1.10 0.00 0.00 33.01 33.13 1g90 s GLN 142 CO -0.04 -0.06 0.98 -0.06 -0.55 0.00 0.00 175.29 175.57 1g90 s PHE 143 N -3.24 3.31 -0.32 1.67 0.40 -1.26 -1.19 117.98 117.34 1g90 s PHE 143 Ca 0.30 0.85 0.03 0.00 -0.60 0.00 0.00 56.93 57.50 1g90 s PHE 143 Cb 0.05 -2.86 0.16 0.00 0.51 0.00 0.00 43.02 40.88 1g90 s PHE 143 CO 0.11 -0.95 0.41 0.99 0.70 0.00 0.00 175.22 176.48 1g90 s THR 144 N -3.14 -0.56 0.14 0.64 2.01 -1.26 -4.19 115.64 109.27 1g90 s THR 144 Ca 0.55 -0.48 0.00 0.00 0.31 0.00 0.00 61.69 62.08 1g90 s THR 144 Cb -0.11 -0.81 0.00 0.00 0.01 0.00 0.00 72.50 71.60 1g90 s THR 144 CO 0.48 -0.36 0.00 0.59 -0.69 0.00 0.00 174.62 174.64 1g90 n ASN 145 N 4.95 -5.26 -3.63 3.53 3.02 -1.26 -4.34 115.26 112.28 1g90 n ASN 145 Ca 0.04 0.67 -0.15 0.00 -0.03 0.00 0.00 54.58 55.11 1g90 n ASN 145 Cb 0.49 -1.97 -0.07 0.00 -0.61 0.00 0.00 39.78 37.62 1g90 n ASN 145 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1g90 s ASN 146 N -4.79 -0.59 -0.88 6.41 2.47 -1.26 -4.95 114.94 111.36 1g90 s ASN 146 Ca 0.00 0.92 -0.05 0.00 0.42 0.00 0.00 52.86 54.15 1g90 s ASN 146 Cb 0.00 0.89 0.00 0.00 -1.45 0.00 0.00 41.25 40.70 1g90 s ASN 146 CO 0.00 -0.38 0.65 -0.38 -3.72 0.00 0.00 177.10 173.27 1g90 n ILE 147 N 1.92 -4.99 0.00 -5.21 5.41 -1.26 -4.95 119.36 110.28 1g90 n ILE 147 Ca -0.17 -0.21 0.00 0.00 1.00 0.00 0.00 62.75 63.37 1g90 n ILE 147 Cb 0.56 -3.87 0.00 0.00 -0.71 0.00 0.00 39.64 35.62 1g90 n ILE 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1g90 n GLY 148 N -1.72 -0.06 0.00 7.39 0.00 -1.24 -4.72 105.19 104.84 1g90 n GLY 148 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1g90 n GLY 148 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1g90 n ASP 149 N -1.06 0.00 -3.67 1.61 5.75 0.89 -2.97 116.55 117.10 1g90 n ASP 149 Ca 0.00 0.03 -0.43 0.00 -0.01 0.00 0.00 54.79 54.38 1g90 n ASP 149 Cb 0.00 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.05 1g90 n ASP 149 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1g90 n ALA 150 N -2.72 4.02 -1.68 2.12 0.00 -1.26 -4.92 120.51 116.08 1g90 n ALA 150 Ca 0.00 -3.50 -0.48 0.00 0.00 0.00 0.00 53.44 49.46 1g90 n ALA 150 Cb 0.00 -3.61 -0.05 0.00 0.00 0.00 0.00 19.45 15.80 1g90 n ALA 150 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1g90 n HIS 151 N 7.10 2.31 -0.58 0.00 -0.00 -1.16 -0.31 115.22 122.59 1g90 n HIS 151 Ca 0.50 0.05 0.00 0.00 0.46 0.00 0.00 57.72 58.73 1g90 n HIS 151 Cb 0.40 -2.64 0.00 0.00 -0.12 0.00 0.00 29.99 27.63 1g90 n HIS 151 CO 0.00 0.00 0.00 0.25 0.46 0.00 0.00 176.34 177.05 1g90 n THR 152 N 4.86 0.00 -0.09 3.57 -2.24 -1.26 -4.75 114.28 114.36 1g90 n THR 152 Ca 0.22 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.88 1g90 n THR 152 Cb 0.29 -0.31 -0.12 0.00 -2.10 0.00 0.00 70.33 68.10 1g90 n THR 152 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1g90 n ILE 153 N -2.00 1.19 -3.83 2.28 5.41 0.58 -5.08 119.36 117.91 1g90 n ILE 153 Ca 0.00 -0.60 -0.06 0.00 1.00 0.00 0.00 62.75 63.09 1g90 n ILE 153 Cb 0.00 -0.88 0.01 0.00 -0.71 0.00 0.00 39.64 38.06 1g90 n ILE 153 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1g90 s GLY 154 N -5.53 0.09 -0.29 7.39 0.00 0.35 -5.06 107.32 104.27 1g90 s GLY 154 Ca -0.18 -0.39 -0.01 0.00 0.00 0.00 0.00 44.72 44.14 1g90 s GLY 154 CO 0.60 0.43 0.08 -1.08 0.00 0.00 0.00 173.10 173.13 1g90 s THR 155 N -2.82 0.81 -0.36 0.90 -1.32 -1.26 -4.22 115.64 107.38 1g90 s THR 155 Ca 0.15 -1.23 0.01 0.00 -1.21 0.00 0.00 61.69 59.41 1g90 s THR 155 Cb -0.04 -1.54 0.11 0.00 -1.51 0.00 0.00 72.50 69.52 1g90 s THR 155 CO 0.07 -0.57 0.14 -0.13 -2.21 0.00 0.00 174.62 171.92 1g90 s ARG 156 N 1.66 0.95 1.00 7.08 0.52 -1.26 -4.92 118.95 123.98 1g90 s ARG 156 Ca 0.07 -1.45 -0.17 0.00 -0.52 0.00 0.00 55.73 53.67 1g90 s ARG 156 Cb -0.17 -2.16 0.21 0.00 0.52 0.00 0.00 34.95 33.35 1g90 s ARG 156 CO -0.22 -1.05 1.30 -1.25 0.02 0.00 0.00 175.30 174.11 1g90 s PRO 157 N 1.13 0.38 0.03 3.54 0.04 -1.26 -3.77 135.00 135.08 1g90 s PRO 157 Ca 0.13 -0.39 -0.27 0.00 0.04 0.00 0.00 61.00 60.51 1g90 s PRO 157 Cb -0.20 -1.81 -0.17 0.00 0.04 0.00 0.00 34.50 32.36 1g90 s PRO 157 CO -0.15 -2.60 1.35 0.22 0.04 0.00 0.00 177.00 175.87 1g90 h ASP 158 N -1.77 -0.48 -5.03 6.66 3.58 -1.84 -3.47 116.42 114.07 1g90 h ASP 158 Ca -0.44 -0.09 -0.13 0.00 0.42 0.00 0.00 57.03 56.79 1g90 h ASP 158 Cb 1.24 0.13 -0.19 0.00 1.72 0.00 0.00 39.33 42.22 1g90 h ASP 158 CO 0.37 -0.18 -0.45 0.21 -2.88 0.00 0.00 179.24 176.31 1g90 s ASN 159 N -4.84 0.03 0.81 2.28 2.47 -1.26 -5.14 114.94 109.30 1g90 s ASN 159 Ca -0.15 -0.28 0.00 0.00 0.42 0.00 0.00 52.86 52.85 1g90 s ASN 159 Cb 0.03 0.24 0.00 0.00 -1.45 0.00 0.00 41.25 40.07 1g90 s ASN 159 CO 0.56 -0.45 0.00 0.61 -3.72 0.00 0.00 177.10 174.09 1g90 n GLY 160 N 1.10 -2.44 3.76 1.21 0.00 -1.26 -4.20 105.19 103.36 1g90 n GLY 160 Ca -0.21 -1.43 -0.40 0.00 0.00 0.00 0.00 46.02 43.98 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 -2.44 4.53 0.03 1.61 -2.45 -0.33 -4.27 119.30 115.97 1g90 s MET 161 Ca 0.00 1.90 0.01 0.00 -1.25 0.00 0.00 55.69 56.34 1g90 s MET 161 Cb 0.00 -3.11 -0.03 0.00 1.25 0.00 0.00 34.83 32.94 1g90 s MET 161 CO 0.00 0.08 -0.04 -0.48 1.05 0.00 0.00 175.02 175.62 1g90 s LEU 162 N -1.62 2.30 0.11 4.11 2.34 0.19 -0.15 118.68 125.95 1g90 s LEU 162 Ca 0.47 -0.61 -0.02 0.00 0.06 0.00 0.00 54.13 54.02 1g90 s LEU 162 Cb -0.34 0.04 -0.03 0.00 -0.56 0.00 0.00 46.19 45.30 1g90 s LEU 162 CO 0.43 -0.33 0.07 -0.44 -1.06 0.00 0.00 176.35 175.02 1g90 s SER 163 N -1.79 0.32 0.20 1.48 0.01 -0.07 -0.81 113.70 113.03 1g90 s SER 163 Ca -0.10 -1.08 0.01 0.00 1.31 0.00 0.00 55.95 56.10 1g90 s SER 163 Cb -0.07 0.29 -0.05 0.00 0.21 0.00 0.00 66.02 66.41 1g90 s SER 163 CO -0.02 -0.71 0.05 -1.48 0.41 0.00 0.00 173.24 171.49 1g90 s LEU 164 N -2.99 1.83 0.31 2.44 2.34 0.16 -0.51 118.68 122.26 1g90 s LEU 164 Ca 0.17 -1.26 -0.18 0.00 0.06 0.00 0.00 54.13 52.92 1g90 s LEU 164 Cb 0.07 0.06 0.03 0.00 -0.56 0.00 0.00 46.19 45.78 1g90 s LEU 164 CO -0.02 -0.67 0.71 -0.83 -1.06 0.00 0.00 176.35 174.48 1g90 s GLY 165 N -3.20 0.17 -0.01 -3.48 0.00 0.10 -0.52 107.32 100.39 1g90 s GLY 165 Ca 0.30 -0.54 -0.03 0.00 0.00 0.00 0.00 44.72 44.44 1g90 s GLY 165 CO 0.07 -0.24 0.07 0.14 0.00 0.00 0.00 173.10 173.14 1g90 s VAL 166 N -3.41 0.06 -0.22 1.40 1.01 -0.54 -0.28 120.40 118.41 1g90 s VAL 166 Ca 0.14 -0.46 -0.04 0.00 0.00 0.00 0.00 61.98 61.62 1g90 s VAL 166 Cb -0.05 -0.25 0.12 0.00 0.00 0.00 0.00 36.38 36.20 1g90 s VAL 166 CO 0.09 -0.25 0.38 -0.44 0.00 0.00 0.00 175.10 174.88 1g90 s SER 167 N -0.80 0.12 0.03 3.32 0.01 0.11 -0.82 113.70 115.68 1g90 s SER 167 Ca -0.09 0.45 -0.27 0.00 1.31 0.00 0.00 55.95 57.35 1g90 s SER 167 Cb -0.05 1.15 -0.05 0.00 0.21 0.00 0.00 66.02 67.28 1g90 s SER 167 CO 0.00 -0.28 0.85 -0.47 0.41 0.00 0.00 173.24 173.76 1g90 s TYR 168 N 2.55 3.70 0.05 2.43 5.04 0.60 -0.14 117.35 131.59 1g90 s TYR 168 Ca 0.08 1.56 -0.08 0.00 -2.44 0.00 0.00 57.07 56.19 1g90 s TYR 168 Cb -0.14 -2.95 -0.05 0.00 0.35 0.00 0.00 41.96 39.17 1g90 s TYR 168 CO -0.15 0.15 0.34 -0.98 -1.34 0.00 0.00 175.55 173.58 1g90 s ARG 169 N 0.39 3.68 0.46 4.97 1.04 -0.29 -0.83 118.95 128.36 1g90 s ARG 169 Ca 0.44 0.05 -0.21 0.00 -1.04 0.00 0.00 55.73 54.97 1g90 s ARG 169 Cb -0.21 -3.02 -0.09 0.00 -2.04 0.00 0.00 34.95 29.59 1g90 s ARG 169 CO 0.25 0.59 1.00 0.12 -0.04 0.00 0.00 175.30 177.22 1g90 s PHE 170 N -1.38 3.14 0.18 5.89 5.36 0.58 -4.94 117.98 126.81 1g90 s PHE 170 Ca 0.31 1.59 -0.24 0.00 -0.96 0.00 0.00 56.93 57.64 1g90 s PHE 170 Cb -0.13 -2.98 0.06 0.00 -0.34 0.00 0.00 43.02 39.62 1g90 s PHE 170 CO 0.18 -0.53 0.78 0.20 -1.46 0.00 0.00 175.22 174.38 1g90 s GLY 171 N -2.04 -0.31 -0.14 13.12 0.00 -1.26 -4.65 107.32 112.04 1g90 s GLY 171 Ca 0.65 0.19 0.24 0.00 0.00 0.00 0.00 44.72 45.79 1g90 s GLY 171 CO 0.18 0.06 1.14 -0.18 0.00 0.00 0.00 173.10 174.29 1g90 n GLN 172 N -0.41 0.99 0.00 2.90 7.27 -1.26 -4.98 117.38 121.89 1g90 n GLN 172 Ca -0.08 -2.85 0.00 0.00 0.07 0.00 0.00 57.00 54.14 1g90 n GLN 172 Cb 0.61 -0.91 0.00 0.00 2.41 0.00 0.00 30.24 32.36 1g90 n GLN 172 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1g90 n GLY 173 N -0.12 1.59 3.73 1.69 0.00 -1.26 -4.85 105.19 105.96 1g90 n GLY 173 Ca 0.07 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 1g90 n GLY 173 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1g90 s GLU 174 N 0.00 0.58 0.00 1.61 -1.05 -1.26 -5.00 118.70 113.58 1g90 s GLU 174 Ca 0.00 0.32 0.28 0.00 -0.15 0.00 0.00 54.97 55.43 1g90 s GLU 174 Cb 0.00 -1.77 1.11 0.00 -0.44 0.00 0.00 34.13 33.03 1g90 s GLU 174 CO 0.00 -2.58 1.78 0.00 0.95 0.00 0.00 175.26 175.41 1g90 n ALA 175 N -4.04 2.80 -0.24 -0.84 0.00 -1.26 -4.73 120.51 112.20 1g90 n ALA 175 Ca 0.07 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1g90 n ALA 175 Cb 0.58 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1g90 n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50