#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 2.93 -0.41 0.00 0.04 -1.26 -3.18 135.00 133.12 1g90 s PRO 2 Ca 0.00 1.12 -0.19 0.00 0.04 0.00 0.00 61.00 61.98 1g90 s PRO 2 Cb 0.00 -4.32 0.03 0.00 0.04 0.00 0.00 34.50 30.25 1g90 s PRO 2 CO 0.00 -2.35 0.55 1.63 0.04 0.00 0.00 177.00 176.87 1g90 n LYS 3 N 8.79 -2.36 -0.98 4.56 4.76 -1.26 -4.99 118.16 126.68 1g90 n LYS 3 Ca 0.23 2.03 -0.34 0.00 -2.87 0.00 0.00 58.31 57.37 1g90 n LYS 3 Cb 0.50 -4.88 0.11 0.00 -1.84 0.00 0.00 35.03 28.92 1g90 n LYS 3 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1g90 n ASP 4 N -0.15 -0.90 -4.76 4.39 9.92 -1.19 -4.98 116.55 118.87 1g90 n ASP 4 Ca 0.07 0.47 -0.38 0.00 -0.53 0.00 0.00 54.79 54.42 1g90 n ASP 4 Cb 0.46 -1.31 0.01 0.00 -0.64 0.00 0.00 41.12 39.65 1g90 n ASP 4 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1g90 s ASN 5 N -1.96 5.80 0.17 -2.24 2.20 -1.26 -4.76 114.94 112.89 1g90 s ASN 5 Ca 0.64 2.52 0.08 0.00 -0.94 0.00 0.00 52.86 55.16 1g90 s ASN 5 Cb -0.27 -2.62 -0.04 0.00 -2.00 0.00 0.00 41.25 36.32 1g90 s ASN 5 CO 0.60 -1.19 -0.04 0.42 -2.94 0.00 0.00 177.10 173.96 1g90 s THR 6 N -1.43 3.53 0.10 0.54 -4.23 -0.26 -4.91 115.64 108.99 1g90 s THR 6 Ca 0.67 -1.49 0.03 0.00 -1.18 0.00 0.00 61.69 59.71 1g90 s THR 6 Cb -0.34 -2.76 -0.04 0.00 1.34 0.00 0.00 72.50 70.70 1g90 s THR 6 CO 0.41 -0.10 -0.09 -1.66 -0.54 0.00 0.00 174.62 172.64 1g90 s TRP 7 N -1.70 0.99 0.03 3.99 1.48 -1.26 -0.37 118.94 122.10 1g90 s TRP 7 Ca 0.26 -0.73 0.02 0.00 -1.06 0.00 0.00 56.10 54.60 1g90 s TRP 7 Cb -0.09 -0.55 -0.02 0.00 -1.16 0.00 0.00 33.47 31.65 1g90 s TRP 7 CO 0.17 -0.05 -0.08 0.71 -4.06 0.00 0.00 176.95 173.65 1g90 s TYR 8 N -2.78 0.69 -0.04 1.66 2.02 0.23 -4.16 117.35 114.98 1g90 s TYR 8 Ca 0.07 -0.37 -0.15 0.00 -0.37 0.00 0.00 57.07 56.25 1g90 s TYR 8 Cb -0.01 -0.42 0.03 0.00 -0.40 0.00 0.00 41.96 41.16 1g90 s TYR 8 CO -0.01 -0.05 0.33 0.99 -1.57 0.00 0.00 175.55 175.24 1g90 s THR 9 N -0.99 0.04 -0.86 -0.71 2.01 -0.45 -1.28 115.64 113.41 1g90 s THR 9 Ca -0.05 -0.36 0.00 0.00 0.31 0.00 0.00 61.69 61.58 1g90 s THR 9 Cb -0.08 -0.61 0.00 0.00 0.01 0.00 0.00 72.50 71.83 1g90 s THR 9 CO 0.00 -0.20 0.00 0.61 -0.69 0.00 0.00 174.62 174.34 1g90 n GLY 10 N 1.58 -0.66 3.96 4.40 0.00 0.03 -0.67 105.19 113.83 1g90 n GLY 10 Ca -0.20 -0.35 -0.23 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 3.85 -0.06 4.61 0.00 0.75 -0.63 121.76 129.27 1g90 s ALA 11 Ca 0.00 -1.08 -0.11 0.00 0.00 0.00 0.00 51.96 50.77 1g90 s ALA 11 Cb 0.00 -1.88 0.02 0.00 0.00 0.00 0.00 23.12 21.26 1g90 s ALA 11 CO 0.00 0.18 0.27 0.21 0.00 0.00 0.00 175.76 176.43 1g90 s LYS 12 N -4.00 0.46 0.05 0.00 2.20 -0.08 -1.59 119.74 116.77 1g90 s LYS 12 Ca 0.36 0.11 0.03 0.00 -0.36 0.00 0.00 55.97 56.12 1g90 s LYS 12 Cb -0.09 0.21 -0.02 0.00 -1.51 0.00 0.00 37.83 36.41 1g90 s LYS 12 CO 0.31 -0.09 -0.10 -1.17 -0.36 0.00 0.00 175.35 173.94 1g90 s LEU 13 N -0.50 2.23 0.10 5.43 0.20 0.20 -0.60 118.68 125.74 1g90 s LEU 13 Ca -0.06 -0.52 0.03 0.00 0.69 0.00 0.00 54.13 54.27 1g90 s LEU 13 Cb -0.04 -0.34 -0.04 0.00 -0.43 0.00 0.00 46.19 45.34 1g90 s LEU 13 CO 0.02 -0.11 -0.08 -0.83 -0.29 0.00 0.00 176.35 175.06 1g90 s GLY 14 N -1.44 0.80 -0.14 7.98 0.00 0.06 -0.67 107.32 113.91 1g90 s GLY 14 Ca -0.05 -1.29 -0.20 0.00 0.00 0.00 0.00 44.72 43.18 1g90 s GLY 14 CO 0.01 -1.38 0.52 -0.12 0.00 0.00 0.00 173.10 172.13 1g90 s PHE 15 N -3.15 -0.53 -0.10 1.90 2.19 0.34 -0.72 117.98 117.90 1g90 s PHE 15 Ca 0.09 1.19 -0.10 0.00 0.33 0.00 0.00 56.93 58.44 1g90 s PHE 15 Cb 0.02 0.22 0.03 0.00 -1.31 0.00 0.00 43.02 41.97 1g90 s PHE 15 CO -0.03 -0.35 0.29 0.45 1.83 0.00 0.00 175.22 177.42 1g90 s SER 16 N -0.22 -0.29 -0.87 6.13 0.15 0.07 -0.44 113.70 118.24 1g90 s SER 16 Ca -0.04 0.54 -0.21 0.00 0.70 0.00 0.00 55.95 56.94 1g90 s SER 16 Cb -0.03 0.57 -0.13 0.00 -1.71 0.00 0.00 66.02 64.72 1g90 s SER 16 CO 0.03 -0.13 1.97 0.00 1.20 0.00 0.00 173.24 176.31 1g90 n GLN 17 N 2.77 1.70 0.18 5.44 10.64 -1.26 -0.67 117.38 136.18 1g90 n GLN 17 Ca -0.14 -1.95 0.03 0.00 -1.83 0.00 0.00 57.00 53.11 1g90 n GLN 17 Cb 0.58 -2.97 0.36 0.00 -0.86 0.00 0.00 30.24 27.36 1g90 n GLN 17 CO 0.00 0.00 0.00 -0.92 -1.83 0.00 0.00 177.06 174.31 1g90 h TYR 18 N 7.62 0.01 -3.32 2.61 3.20 -1.78 -3.38 116.97 121.94 1g90 h TYR 18 Ca 0.44 -0.00 -0.66 0.00 3.14 0.00 0.00 58.73 61.66 1g90 h TYR 18 Cb 0.66 -0.00 -0.12 0.00 1.54 0.00 0.00 36.73 38.81 1g90 h TYR 18 CO 1.28 0.36 -0.64 -1.01 -1.64 0.00 0.00 178.16 176.51 1g90 s HIS 19 N -4.23 3.07 0.17 -3.82 3.76 -0.99 -0.25 115.29 113.00 1g90 s HIS 19 Ca -0.03 0.05 0.09 0.00 -0.15 0.00 0.00 55.06 55.02 1g90 s HIS 19 Cb 0.14 -1.62 -0.04 0.00 1.11 0.00 0.00 32.58 32.17 1g90 s HIS 19 CO 0.73 0.48 -0.19 0.34 -0.85 0.00 0.00 174.74 175.24 1g90 s ASP 20 N -1.95 2.79 0.81 1.40 -1.08 -0.16 -4.36 116.67 114.12 1g90 s ASP 20 Ca 0.23 -0.86 0.00 0.00 -0.52 0.00 0.00 52.55 51.40 1g90 s ASP 20 Cb -0.12 -0.17 0.00 0.00 -1.46 0.00 0.00 42.92 41.17 1g90 s ASP 20 CO 0.15 -0.01 0.00 0.35 0.52 0.00 0.00 175.17 176.18 1g90 n THR 21 N 0.30 0.00 -0.06 1.71 -2.24 -1.26 -3.18 114.28 109.55 1g90 n THR 21 Ca -0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1g90 n THR 21 Cb 0.57 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 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 0.00 0.65 3.67 3.38 0.00 -1.26 -4.46 105.19 107.16 1g90 n GLY 22 Ca 0.00 -1.88 -0.47 0.00 0.00 0.00 0.00 46.02 43.67 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 -0.39 2.23 -3.87 1.61 7.35 -1.26 -1.53 117.46 121.60 1g90 n PHE 23 Ca 0.00 0.26 -0.31 0.00 -0.76 0.00 0.00 57.45 56.64 1g90 n PHE 23 Cb 0.00 -2.54 0.01 0.00 0.35 0.00 0.00 39.48 37.29 1g90 n PHE 23 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1g90 n ILE 24 N 3.60 -4.13 -1.00 -2.13 5.41 -1.26 -0.86 119.36 118.99 1g90 n ILE 24 Ca 0.18 -0.71 -0.05 0.00 1.00 0.00 0.00 62.75 63.17 1g90 n ILE 24 Cb 0.28 -3.27 -0.02 0.00 -0.71 0.00 0.00 39.64 35.92 1g90 n ILE 24 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1g90 n ASN 25 N -2.75 -4.79 0.00 4.38 2.04 -0.58 -4.29 115.26 109.27 1g90 n ASN 25 Ca -0.20 0.11 0.00 0.00 -0.44 0.00 0.00 54.58 54.06 1g90 n ASN 25 Cb 0.63 -3.25 0.00 0.00 -2.53 0.00 0.00 39.78 34.63 1g90 n ASN 25 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1g90 n ASN 26 N -0.45 0.00 0.00 0.53 2.85 -0.04 -4.41 115.26 113.75 1g90 n ASN 26 Ca -0.05 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.42 1g90 n ASN 26 Cb 0.45 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.47 1g90 n ASN 26 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1g90 n ASN 27 N 2.67 0.00 -4.41 1.20 3.02 -1.26 -4.89 115.26 111.58 1g90 n ASN 27 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.26 1g90 n ASN 27 Cb 0.00 -0.14 0.15 0.00 -0.61 0.00 0.00 39.78 39.18 1g90 n ASN 27 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1g90 s GLY 28 N -0.89 1.73 0.53 7.41 0.00 -1.26 -5.07 107.32 109.77 1g90 s GLY 28 Ca 0.00 -1.12 -0.19 0.00 0.00 0.00 0.00 44.72 43.41 1g90 s GLY 28 CO 0.00 -0.45 1.08 2.56 0.00 0.00 0.00 173.10 176.28 1g90 s PRO 29 N -5.70 3.53 -0.93 2.90 0.04 -1.26 -4.93 135.00 128.65 1g90 s PRO 29 Ca 0.70 1.43 -0.24 0.00 0.04 0.00 0.00 61.00 62.92 1g90 s PRO 29 Cb -0.06 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 1g90 s PRO 29 CO 0.51 -0.67 1.94 -0.08 0.04 0.00 0.00 177.00 178.73 1g90 s THR 30 N -1.99 3.47 0.00 1.26 -1.32 -1.26 -4.53 115.64 111.26 1g90 s THR 30 Ca 0.69 -0.42 0.00 0.00 -1.21 0.00 0.00 61.69 60.74 1g90 s THR 30 Cb -0.19 -4.07 0.00 0.00 -1.51 0.00 0.00 72.50 66.73 1g90 s THR 30 CO 0.26 -0.97 0.17 1.41 -2.21 0.00 0.00 174.62 173.28 1g90 n HIS 31 N 13.91 0.00 -0.62 9.09 8.25 -1.26 -4.92 115.22 139.67 1g90 n HIS 31 Ca 0.40 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.81 1g90 n HIS 31 Cb 0.47 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.50 1g90 n HIS 31 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1g90 n GLU 32 N -0.09 1.24 -0.66 -0.41 1.02 -1.26 -4.87 120.64 115.61 1g90 n GLU 32 Ca 0.00 -0.46 -0.30 0.00 -0.02 0.00 0.00 57.16 56.38 1g90 n GLU 32 Cb 0.11 -1.56 0.19 0.00 -0.02 0.00 0.00 31.44 30.16 1g90 n GLU 32 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1g90 s ASN 33 N 2.12 2.40 0.18 1.62 2.20 -1.26 -2.34 114.94 119.87 1g90 s ASN 33 Ca 0.31 2.01 0.06 0.00 -0.94 0.00 0.00 52.86 54.30 1g90 s ASN 33 Cb 0.15 -2.50 -0.05 0.00 -2.00 0.00 0.00 41.25 36.85 1g90 s ASN 33 CO 0.00 -3.40 -0.12 -1.10 -2.94 0.00 0.00 177.10 169.54 1g90 s GLN 34 N -4.60 1.20 0.18 3.55 1.11 0.16 -4.81 119.66 116.44 1g90 s GLN 34 Ca 0.67 -1.53 -0.08 0.00 0.01 0.00 0.00 55.36 54.43 1g90 s GLN 34 Cb -0.23 -0.88 -0.01 0.00 -1.01 0.00 0.00 33.01 30.88 1g90 s GLN 34 CO 0.60 0.13 0.29 -0.48 0.01 0.00 0.00 175.29 175.83 1g90 s LEU 35 N -3.25 0.92 0.16 2.90 0.05 -1.26 -0.75 118.68 117.45 1g90 s LEU 35 Ca 0.20 -0.94 0.07 0.00 0.05 0.00 0.00 54.13 53.50 1g90 s LEU 35 Cb 0.01 1.16 -0.04 0.00 -2.05 0.00 0.00 46.19 45.26 1g90 s LEU 35 CO 0.04 -0.92 -0.14 -0.83 -0.55 0.00 0.00 176.35 173.95 1g90 s GLY 36 N -3.00 1.23 -0.29 -3.48 0.00 0.10 -4.92 107.32 96.96 1g90 s GLY 36 Ca 0.20 -1.46 -0.11 0.00 0.00 0.00 0.00 44.72 43.36 1g90 s GLY 36 CO 0.03 -1.53 0.65 0.00 0.00 0.00 0.00 173.10 172.24 1g90 s ALA 37 N -2.52 -1.98 0.00 3.20 0.00 -1.26 -0.76 121.76 118.44 1g90 s ALA 37 Ca 0.15 2.33 0.00 0.00 0.00 0.00 0.00 51.96 54.44 1g90 s ALA 37 Cb -0.03 -1.69 0.00 0.00 0.00 0.00 0.00 23.12 21.40 1g90 s ALA 37 CO 0.04 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.40 1g90 n GLY 38 N 5.22 -0.26 3.31 0.00 0.00 0.23 -0.57 105.19 113.12 1g90 n GLY 38 Ca -0.14 0.42 -0.16 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.00 1.72 0.01 4.61 0.00 -0.19 -0.90 121.76 126.00 1g90 s ALA 39 Ca 0.00 -1.86 -0.09 0.00 0.00 0.00 0.00 51.96 50.02 1g90 s ALA 39 Cb 0.00 1.01 0.00 0.00 0.00 0.00 0.00 23.12 24.13 1g90 s ALA 39 CO 0.00 -0.45 0.17 0.12 0.00 0.00 0.00 175.76 175.60 1g90 s PHE 40 N -3.74 0.03 0.09 0.00 2.19 0.20 -0.31 117.98 116.44 1g90 s PHE 40 Ca 0.37 -0.14 -0.24 0.00 0.33 0.00 0.00 56.93 57.25 1g90 s PHE 40 Cb 0.08 -0.03 0.06 0.00 -1.31 0.00 0.00 43.02 41.82 1g90 s PHE 40 CO 0.13 -0.34 0.59 0.20 1.83 0.00 0.00 175.22 177.63 1g90 s GLY 41 N -1.59 -0.55 0.06 13.12 0.00 -0.56 -0.79 107.32 117.01 1g90 s GLY 41 Ca -0.12 0.66 -0.27 0.00 0.00 0.00 0.00 44.72 44.99 1g90 s GLY 41 CO 0.00 0.34 0.98 -0.32 0.00 0.00 0.00 173.10 174.10 1g90 s GLY 42 N -2.26 -0.33 -0.05 0.20 0.00 -0.40 -0.13 107.32 104.34 1g90 s GLY 42 Ca -0.03 0.56 0.05 0.00 0.00 0.00 0.00 44.72 45.30 1g90 s GLY 42 CO -0.06 0.16 -0.20 -0.47 0.00 0.00 0.00 173.10 172.53 1g90 s TYR 43 N -3.10 2.01 -0.18 1.90 5.04 0.30 -0.60 117.35 122.72 1g90 s TYR 43 Ca 0.10 -0.61 0.01 0.00 -2.44 0.00 0.00 57.07 54.12 1g90 s TYR 43 Cb -0.01 -1.34 0.03 0.00 0.35 0.00 0.00 41.96 40.99 1g90 s TYR 43 CO -0.03 -0.21 -0.15 -1.14 -1.34 0.00 0.00 175.55 172.68 1g90 s GLN 44 N 0.02 2.51 -1.28 4.97 0.74 0.50 -0.64 119.66 126.48 1g90 s GLN 44 Ca -0.05 -0.77 -0.19 0.00 0.05 0.00 0.00 55.36 54.40 1g90 s GLN 44 Cb -0.13 -2.39 0.04 0.00 1.10 0.00 0.00 33.01 31.63 1g90 s GLN 44 CO 0.03 -0.28 1.78 1.55 -0.55 0.00 0.00 175.29 177.82 1g90 n VAL 45 N 4.67 3.59 -4.81 1.34 3.14 0.51 -1.10 118.33 125.69 1g90 n VAL 45 Ca -0.18 -3.73 0.00 0.00 -2.96 0.00 0.00 64.34 57.47 1g90 n VAL 45 Cb 0.49 -2.32 0.00 0.00 -1.06 0.00 0.00 33.84 30.94 1g90 n VAL 45 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1g90 n ASN 46 N 9.35 -3.31 -3.33 6.55 4.13 -1.26 -3.89 115.26 123.51 1g90 n ASN 46 Ca 0.48 0.00 -0.39 0.00 1.68 0.00 0.00 54.58 56.35 1g90 n ASN 46 Cb 0.46 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.67 1g90 n ASN 46 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1g90 n PRO 47 N -0.60 3.71 0.00 3.52 -0.04 -1.26 -4.17 135.00 136.17 1g90 n PRO 47 Ca 0.00 -2.25 0.00 0.00 -0.04 0.00 0.00 63.50 61.21 1g90 n PRO 47 Cb 0.00 -2.81 0.00 0.00 -0.04 0.00 0.00 33.50 30.65 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 3.60 -0.11 -3.90 0.54 4.01 -1.14 -4.76 117.16 115.40 1g90 n TYR 48 Ca 0.78 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 58.42 1g90 n TYR 48 Cb 0.24 0.14 -0.06 0.00 -0.31 0.00 0.00 39.34 39.35 1g90 n TYR 48 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1g90 s VAL 49 N -0.28 0.04 0.04 -0.72 0.11 -1.25 -1.12 120.40 117.22 1g90 s VAL 49 Ca 0.00 -1.21 -0.13 0.00 -2.93 0.00 0.00 61.98 57.71 1g90 s VAL 49 Cb 0.00 -1.81 0.04 0.00 -1.53 0.00 0.00 36.38 33.08 1g90 s VAL 49 CO 0.00 -0.20 0.61 0.61 -3.33 0.00 0.00 175.10 172.79 1g90 n GLY 50 N -0.28 0.67 2.98 6.54 0.00 0.11 -0.36 105.19 114.85 1g90 n GLY 50 Ca -0.07 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.86 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 -3.21 0.19 0.07 1.61 2.19 0.19 -0.59 117.98 118.42 1g90 s PHE 51 Ca 0.14 -0.38 -0.06 0.00 0.33 0.00 0.00 56.93 56.95 1g90 s PHE 51 Cb -0.01 -0.14 -0.01 0.00 -1.31 0.00 0.00 43.02 41.55 1g90 s PHE 51 CO 0.01 -0.17 0.12 -1.21 1.83 0.00 0.00 175.22 175.81 1g90 s GLU 52 N -1.19 0.73 0.17 10.12 2.02 0.72 -0.54 118.70 130.74 1g90 s GLU 52 Ca -0.13 -0.96 0.06 0.00 0.02 0.00 0.00 54.97 53.96 1g90 s GLU 52 Cb -0.08 0.29 -0.04 0.00 0.10 0.00 0.00 34.13 34.39 1g90 s GLU 52 CO -0.01 -0.20 -0.13 -1.64 0.02 0.00 0.00 175.26 173.30 1g90 s MET 53 N -3.57 1.17 0.32 1.61 -1.94 0.82 -0.51 119.30 117.19 1g90 s MET 53 Ca 0.03 -1.47 0.07 0.00 -1.71 0.00 0.00 55.69 52.61 1g90 s MET 53 Cb 0.04 -0.88 -0.06 0.00 2.01 0.00 0.00 34.83 35.94 1g90 s MET 53 CO -0.09 0.14 -0.06 0.20 -0.01 0.00 0.00 175.02 175.20 1g90 s GLY 54 N -3.11 2.03 -0.01 -0.03 0.00 -0.17 -1.49 107.32 104.53 1g90 s GLY 54 Ca 0.18 -2.01 -0.15 0.00 0.00 0.00 0.00 44.72 42.73 1g90 s GLY 54 CO 0.04 -1.93 0.32 -0.47 0.00 0.00 0.00 173.10 171.06 1g90 s TYR 55 N -2.87 -0.19 0.01 1.90 6.14 0.58 -0.31 117.35 122.61 1g90 s TYR 55 Ca 0.32 0.28 0.06 0.00 0.64 0.00 0.00 57.07 58.37 1g90 s TYR 55 Cb 0.04 0.10 -0.02 0.00 0.42 0.00 0.00 41.96 42.51 1g90 s TYR 55 CO 0.14 -0.40 -0.18 -0.51 0.64 0.00 0.00 175.55 175.24 1g90 s ASP 56 N -1.33 2.17 0.00 4.32 1.01 0.04 -1.03 116.67 121.84 1g90 s ASP 56 Ca -0.13 -0.41 0.00 0.00 0.71 0.00 0.00 52.55 52.71 1g90 s ASP 56 Cb -0.05 -0.20 0.00 0.00 1.01 0.00 0.00 42.92 43.68 1g90 s ASP 56 CO 0.04 0.17 0.55 0.49 0.21 0.00 0.00 175.17 176.63 1g90 n PHE 57 N 2.25 0.00 -1.58 4.23 3.72 0.26 -4.65 117.46 121.69 1g90 n PHE 57 Ca -0.16 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 1g90 n PHE 57 Cb 0.54 -0.40 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 1g90 n PHE 57 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1g90 n LEU 58 N -1.69 0.00 0.00 4.37 4.32 -1.26 -4.63 117.00 118.10 1g90 n LEU 58 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1g90 n LEU 58 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1g90 n LEU 58 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 1g90 n GLY 59 N 0.00 1.27 2.64 -0.72 0.00 -1.18 -4.77 105.19 102.42 1g90 n GLY 59 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 2.87 -0.70 1.61 0.00 -1.26 -4.56 116.66 114.62 1g90 n ARG 60 Ca 0.00 -2.27 -0.30 0.00 -0.00 0.00 0.00 57.85 55.28 1g90 n ARG 60 Cb 0.00 -3.01 0.20 0.00 0.00 0.00 0.00 32.46 29.65 1g90 n ARG 60 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.63 175.99 1g90 s MET 61 N 3.14 0.24 0.28 -0.14 -1.94 -1.26 -4.96 119.30 114.66 1g90 s MET 61 Ca 0.55 1.17 -0.02 0.00 -1.71 0.00 0.00 55.69 55.67 1g90 s MET 61 Cb 0.15 -1.67 0.38 0.00 2.01 0.00 0.00 34.83 35.70 1g90 s MET 61 CO -0.05 -3.04 1.85 -1.00 -0.01 0.00 0.00 175.02 172.78 1g90 h PRO 62 N -2.14 0.94 0.00 2.03 0.13 -1.99 -3.45 132.00 127.51 1g90 h PRO 62 Ca -0.52 -0.15 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1g90 h PRO 62 Cb 1.30 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1g90 h PRO 62 CO 0.47 0.77 0.00 0.66 -0.23 0.00 0.00 178.00 179.67 1g90 n TYR 63 N -4.31 0.00 -2.52 1.56 4.01 -1.26 -4.74 117.16 109.90 1g90 n TYR 63 Ca 0.06 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.63 1g90 n TYR 63 Cb 0.17 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.20 1g90 n TYR 63 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1g90 n LYS 64 N 0.00 -2.29 0.00 -0.72 4.81 -1.26 -4.67 118.16 114.03 1g90 n LYS 64 Ca 0.00 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.21 1g90 n LYS 64 Cb 0.00 -5.42 0.00 0.00 0.02 0.00 0.00 35.03 29.63 1g90 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1g90 n GLY 65 N -0.96 -0.53 2.53 3.14 0.00 -1.26 -5.12 105.19 102.98 1g90 n GLY 65 Ca -0.17 0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1g90 n GLY 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1g90 n SER 66 N 0.00 -2.84 -4.69 1.61 3.41 -1.26 -5.03 113.62 104.83 1g90 n SER 66 Ca 0.00 -0.82 -0.32 0.00 -0.26 0.00 0.00 58.87 57.47 1g90 n SER 66 Cb 0.00 -0.76 0.15 0.00 -0.26 0.00 0.00 64.21 63.34 1g90 n SER 66 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1g90 s VAL 67 N -2.14 2.08 -0.02 -3.33 -7.23 -1.26 -4.78 120.40 103.71 1g90 s VAL 67 Ca 0.52 0.03 -0.14 0.00 -1.81 0.00 0.00 61.98 60.58 1g90 s VAL 67 Cb -0.07 -2.22 0.02 0.00 0.56 0.00 0.00 36.38 34.67 1g90 s VAL 67 CO 0.42 -0.03 0.31 -0.70 -0.31 0.00 0.00 175.10 174.79 1g90 s GLU 68 N -4.44 0.64 0.00 4.82 2.56 -1.26 -4.87 118.70 116.15 1g90 s GLU 68 Ca 0.69 -0.14 0.00 0.00 0.00 0.00 0.00 54.97 55.52 1g90 s GLU 68 Cb -0.25 0.28 0.00 0.00 2.00 0.00 0.00 34.13 36.16 1g90 s GLU 68 CO 0.55 -0.17 0.00 -1.71 -0.56 0.00 0.00 175.26 173.37 1g90 n ASN 69 N 1.42 0.00 0.00 -1.70 2.85 -1.26 -4.64 115.26 111.93 1g90 n ASN 69 Ca -0.21 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.26 1g90 n ASN 69 Cb 0.56 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.58 1g90 n ASN 69 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1g90 n GLY 70 N 0.00 1.38 2.51 8.20 0.00 -1.26 -5.00 105.19 111.01 1g90 n GLY 70 Ca 0.00 -0.91 -0.31 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.50 5.90 -1.47 4.61 0.00 -1.26 -4.85 120.51 122.93 1g90 n ALA 71 Ca 0.00 -2.76 -0.40 0.00 0.00 0.00 0.00 53.44 50.28 1g90 n ALA 71 Cb 0.00 -3.20 -0.02 0.00 0.00 0.00 0.00 19.45 16.23 1g90 n ALA 71 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1g90 n TYR 72 N 4.13 2.67 -2.07 0.00 4.01 -1.26 -4.82 117.16 119.81 1g90 n TYR 72 Ca 0.60 -3.05 -0.30 0.00 -0.16 0.00 0.00 57.90 54.99 1g90 n TYR 72 Cb 0.19 -2.44 -0.05 0.00 -0.31 0.00 0.00 39.34 36.73 1g90 n TYR 72 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1g90 s LYS 73 N 2.05 2.61 0.68 -0.72 2.36 -1.26 -3.11 119.74 122.35 1g90 s LYS 73 Ca 0.63 -0.16 -0.17 0.00 -2.55 0.00 0.00 55.97 53.73 1g90 s LYS 73 Cb 0.17 -4.94 0.01 0.00 -1.05 0.00 0.00 37.83 32.02 1g90 s LYS 73 CO -0.07 -3.20 1.25 0.00 1.55 0.00 0.00 175.35 174.88 1g90 n ALA 74 N 13.52 0.82 -2.60 3.13 0.00 -1.26 -4.91 120.51 129.20 1g90 n ALA 74 Ca 0.36 -0.07 -0.43 0.00 0.00 0.00 0.00 53.44 53.30 1g90 n ALA 74 Cb 0.48 -2.29 -0.02 0.00 0.00 0.00 0.00 19.45 17.62 1g90 n ALA 74 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1g90 s GLN 75 N -3.50 4.24 -0.28 0.00 -0.21 -0.22 -4.88 119.66 114.81 1g90 s GLN 75 Ca 0.80 1.42 0.01 0.00 0.02 0.00 0.00 55.36 57.62 1g90 s GLN 75 Cb -0.36 -3.68 0.16 0.00 1.00 0.00 0.00 33.01 30.13 1g90 s GLN 75 CO 0.43 -0.66 0.41 0.20 -2.12 0.00 0.00 175.29 173.55 1g90 s GLY 76 N 1.42 -0.58 0.13 3.09 0.00 -1.26 -0.37 107.32 109.75 1g90 s GLY 76 Ca 0.47 0.38 -0.01 0.00 0.00 0.00 0.00 44.72 45.56 1g90 s GLY 76 CO 0.09 3.02 0.06 -1.34 0.00 0.00 0.00 173.10 174.92 1g90 s VAL 77 N 2.56 0.10 0.13 1.40 -7.23 -0.69 -0.78 120.40 115.89 1g90 s VAL 77 Ca 0.10 -1.91 0.07 0.00 -1.81 0.00 0.00 61.98 58.43 1g90 s VAL 77 Cb -0.13 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.72 1g90 s VAL 77 CO -0.28 -0.45 -0.16 -1.10 -0.31 0.00 0.00 175.10 172.81 1g90 s GLN 78 N -4.05 1.08 -0.02 4.82 1.11 0.58 -0.53 119.66 122.65 1g90 s GLN 78 Ca 0.24 -1.26 -0.02 0.00 0.01 0.00 0.00 55.36 54.33 1g90 s GLN 78 Cb 0.07 -1.04 0.01 0.00 -1.01 0.00 0.00 33.01 31.05 1g90 s GLN 78 CO 0.02 0.21 0.06 -0.48 0.01 0.00 0.00 175.29 175.10 1g90 s LEU 79 N -2.44 1.73 -0.20 2.90 2.34 0.00 -1.00 118.68 122.01 1g90 s LEU 79 Ca 0.10 0.12 -0.14 0.00 0.06 0.00 0.00 54.13 54.27 1g90 s LEU 79 Cb -0.06 0.19 0.06 0.00 -0.56 0.00 0.00 46.19 45.82 1g90 s LEU 79 CO 0.04 -0.03 0.51 0.42 -1.06 0.00 0.00 176.35 176.24 1g90 s THR 80 N 0.09 -0.01 0.35 5.48 -4.23 0.34 -0.68 115.64 116.98 1g90 s THR 80 Ca -0.01 0.04 -0.15 0.00 -1.18 0.00 0.00 61.69 60.39 1g90 s THR 80 Cb -0.01 -0.74 -0.09 0.00 1.34 0.00 0.00 72.50 73.00 1g90 s THR 80 CO -0.00 0.02 0.77 0.00 -0.54 0.00 0.00 174.62 174.87 1g90 s ALA 81 N 1.07 3.28 -0.05 3.99 0.00 0.62 -0.20 121.76 130.48 1g90 s ALA 81 Ca -0.06 0.06 0.02 0.00 0.00 0.00 0.00 51.96 51.98 1g90 s ALA 81 Cb -0.06 -2.82 0.01 0.00 0.00 0.00 0.00 23.12 20.26 1g90 s ALA 81 CO -0.10 0.25 -0.09 0.21 0.00 0.00 0.00 175.76 176.03 1g90 s LYS 82 N -3.15 1.22 0.05 0.00 2.36 0.25 -0.83 119.74 119.65 1g90 s LYS 82 Ca 0.55 -0.28 0.02 0.00 -2.55 0.00 0.00 55.97 53.71 1g90 s LYS 82 Cb -0.10 -1.09 -0.04 0.00 -1.05 0.00 0.00 37.83 35.55 1g90 s LYS 82 CO 0.19 0.01 0.08 -1.17 1.55 0.00 0.00 175.35 176.01 1g90 s LEU 83 N 0.63 3.82 0.00 5.43 2.96 0.73 0.06 118.68 132.31 1g90 s LEU 83 Ca -0.11 0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.84 1g90 s LEU 83 Cb -0.14 -2.42 0.00 0.00 0.50 0.00 0.00 46.19 44.14 1g90 s LEU 83 CO 0.02 0.20 0.00 0.61 -1.32 0.00 0.00 176.35 175.86 1g90 n GLY 84 N 0.69 0.84 3.16 7.98 0.00 -0.27 -0.61 105.19 116.98 1g90 n GLY 84 Ca -0.10 -0.90 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.00 -0.40 0.21 1.61 5.04 -0.54 -2.90 117.35 118.37 1g90 s TYR 85 Ca 0.00 0.93 -0.30 0.00 -2.44 0.00 0.00 57.07 55.26 1g90 s TYR 85 Cb 0.00 0.13 -0.09 0.00 0.35 0.00 0.00 41.96 42.35 1g90 s TYR 85 CO 0.00 -0.23 1.25 -1.25 -1.34 0.00 0.00 175.55 173.97 1g90 s PRO 86 N 0.89 4.45 0.51 4.97 0.04 -1.26 -0.57 135.00 144.03 1g90 s PRO 86 Ca -0.06 1.97 0.20 0.00 0.04 0.00 0.00 61.00 63.15 1g90 s PRO 86 Cb -0.07 -3.21 1.29 0.00 0.04 0.00 0.00 34.50 32.56 1g90 s PRO 86 CO -0.06 -0.15 2.06 0.97 0.04 0.00 0.00 177.00 179.86 1g90 h ILE 87 N 3.66 0.87 0.00 0.56 6.09 -1.16 -3.42 117.51 124.11 1g90 h ILE 87 Ca -0.45 -0.02 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 1g90 h ILE 87 Cb 1.21 0.81 0.00 0.00 0.47 0.00 0.00 36.82 39.31 1g90 h ILE 87 CO 0.75 0.01 0.00 0.41 -3.07 0.00 0.00 178.15 176.25 1g90 n THR 88 N -4.46 0.00 -4.01 2.19 -1.04 -1.26 -5.10 114.28 100.60 1g90 n THR 88 Ca 0.04 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.92 1g90 n THR 88 Cb 0.36 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.84 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 -2.23 -1.35 0.00 8.00 2.03 -1.26 -5.03 116.55 116.71 1g90 n ASP 89 Ca 0.00 -2.77 0.00 0.00 0.52 0.00 0.00 54.79 52.54 1g90 n ASP 89 Cb 0.00 2.49 0.00 0.00 -0.72 0.00 0.00 41.12 42.89 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 -1.64 0.00 -4.38 1.67 2.03 -1.26 -4.76 116.55 108.22 1g90 n ASP 90 Ca -0.00 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.88 1g90 n ASP 90 Cb 0.56 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.87 1g90 n ASP 90 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1g90 s LEU 91 N 0.00 5.42 -0.23 -2.67 1.02 -1.26 -3.88 118.68 117.08 1g90 s LEU 91 Ca 0.00 -1.27 -0.10 0.00 0.02 0.00 0.00 54.13 52.78 1g90 s LEU 91 Cb 0.00 -2.14 -0.05 0.00 0.02 0.00 0.00 46.19 44.03 1g90 s LEU 91 CO 0.00 -0.58 0.13 -0.62 0.02 0.00 0.00 176.35 175.30 1g90 s ASP 92 N 2.32 5.93 -0.31 2.29 -1.08 -0.30 -0.47 116.67 125.05 1g90 s ASP 92 Ca 0.04 0.08 -0.20 0.00 -0.52 0.00 0.00 52.55 51.95 1g90 s ASP 92 Cb -0.23 -2.06 -0.01 0.00 -1.46 0.00 0.00 42.92 39.16 1g90 s ASP 92 CO 0.06 0.08 0.61 -0.63 0.52 0.00 0.00 175.17 175.82 1g90 s ILE 93 N 0.96 4.95 -0.07 4.11 1.01 0.26 -0.39 121.20 132.04 1g90 s ILE 93 Ca 0.07 0.82 -0.08 0.00 0.00 0.00 0.00 60.65 61.46 1g90 s ILE 93 Cb -0.13 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.31 1g90 s ILE 93 CO 0.03 -0.13 0.21 -0.31 0.00 0.00 0.00 174.94 174.74 1g90 s TYR 94 N 2.57 3.62 -0.14 3.97 1.51 0.48 -1.47 117.35 127.89 1g90 s TYR 94 Ca 0.24 0.61 -0.02 0.00 -1.01 0.00 0.00 57.07 56.89 1g90 s TYR 94 Cb -0.15 -2.00 0.04 0.00 -0.11 0.00 0.00 41.96 39.74 1g90 s TYR 94 CO 0.12 0.70 0.01 0.99 -1.11 0.00 0.00 175.55 176.25 1g90 s THR 95 N -1.10 0.56 0.06 -0.71 2.01 0.22 -0.68 115.64 116.00 1g90 s THR 95 Ca 0.19 -0.28 0.05 0.00 0.31 0.00 0.00 61.69 61.97 1g90 s THR 95 Cb -0.13 -0.86 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 1g90 s THR 95 CO 0.08 0.05 -0.15 0.00 -0.69 0.00 0.00 174.62 173.92 1g90 s ARG 96 N 1.87 0.88 -0.04 4.92 1.70 0.43 -0.19 118.95 128.52 1g90 s ARG 96 Ca 0.02 -0.91 -0.17 0.00 -0.47 0.00 0.00 55.73 54.20 1g90 s ARG 96 Cb -0.15 -0.90 0.03 0.00 -0.57 0.00 0.00 34.95 33.36 1g90 s ARG 96 CO -0.07 0.21 0.38 -0.48 -1.08 0.00 0.00 175.30 174.26 1g90 s LEU 97 N -1.57 0.56 0.00 -1.89 0.05 -0.01 -0.35 118.68 115.48 1g90 s LEU 97 Ca -0.00 0.31 0.00 0.00 0.05 0.00 0.00 54.13 54.48 1g90 s LEU 97 Cb -0.09 1.47 0.00 0.00 -2.05 0.00 0.00 46.19 45.52 1g90 s LEU 97 CO 0.02 -0.42 0.00 0.61 -0.55 0.00 0.00 176.35 176.01 1g90 n GLY 98 N 1.50 -0.51 3.71 -3.48 0.00 0.16 -0.27 105.19 106.30 1g90 n GLY 98 Ca -0.20 0.18 -0.08 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 -0.14 0.08 -0.02 0.00 0.14 -1.15 107.32 106.23 1g90 s GLY 99 Ca 0.00 -0.19 0.01 0.00 0.00 0.00 0.00 44.72 44.54 1g90 s GLY 99 CO 0.00 -0.11 0.19 1.06 0.00 0.00 0.00 173.10 174.24 1g90 s MET 100 N -3.89 3.30 -0.01 2.90 -1.94 0.71 -0.82 119.30 119.55 1g90 s MET 100 Ca 0.10 -0.53 0.02 0.00 -1.71 0.00 0.00 55.69 53.56 1g90 s MET 100 Cb -0.04 -2.95 0.00 0.00 2.01 0.00 0.00 34.83 33.85 1g90 s MET 100 CO 0.02 0.58 -0.05 0.14 -0.01 0.00 0.00 175.02 175.70 1g90 s VAL 101 N -1.52 0.47 -0.14 -6.03 -7.23 0.31 -0.96 120.40 105.30 1g90 s VAL 101 Ca 0.34 -0.21 -0.08 0.00 -1.81 0.00 0.00 61.98 60.21 1g90 s VAL 101 Cb -0.12 -0.43 0.05 0.00 0.56 0.00 0.00 36.38 36.44 1g90 s VAL 101 CO 0.27 0.15 0.35 0.12 -0.31 0.00 0.00 175.10 175.68 1g90 s PHE 102 N 0.12 -0.49 -0.17 2.82 5.36 -0.58 -1.70 117.98 123.35 1g90 s PHE 102 Ca -0.01 1.09 -0.04 0.00 -0.96 0.00 0.00 56.93 57.01 1g90 s PHE 102 Cb -0.05 0.18 0.06 0.00 -0.34 0.00 0.00 43.02 42.86 1g90 s PHE 102 CO -0.00 -0.29 0.06 0.50 -1.46 0.00 0.00 175.22 174.03 1g90 s ARG 103 N 1.22 0.29 -0.13 10.12 3.00 0.50 -0.61 118.95 133.34 1g90 s ARG 103 Ca -0.08 -0.17 0.02 0.00 -1.00 0.00 0.00 55.73 54.50 1g90 s ARG 103 Cb -0.08 -1.82 0.01 0.00 0.00 0.00 0.00 34.95 33.06 1g90 s ARG 103 CO -0.10 -0.62 -0.19 0.00 0.00 0.00 0.00 175.30 174.39 1g90 s ALA 104 N 2.03 2.02 -0.24 6.12 0.00 -1.26 -1.06 121.76 129.37 1g90 s ALA 104 Ca 0.01 -0.96 -0.29 0.00 0.00 0.00 0.00 51.96 50.73 1g90 s ALA 104 Cb -0.16 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 21.99 1g90 s ALA 104 CO -0.08 -0.09 1.52 0.16 0.00 0.00 0.00 175.76 177.26 1g90 s ASP 105 N 0.96 6.47 -1.23 0.00 -4.77 -1.26 -4.90 116.67 111.95 1g90 s ASP 105 Ca -0.05 1.50 -0.11 0.00 -3.30 0.00 0.00 52.55 50.59 1g90 s ASP 105 Cb -0.15 -2.53 -0.06 0.00 -1.09 0.00 0.00 42.92 39.08 1g90 s ASP 105 CO -0.03 -1.20 2.39 0.35 0.70 0.00 0.00 175.17 177.39 1g90 n THR 106 N 6.33 3.16 -0.40 2.11 -2.24 -1.26 -4.83 114.28 117.15 1g90 n THR 106 Ca 0.17 -2.12 -0.04 0.00 -2.27 0.00 0.00 64.05 59.79 1g90 n THR 106 Cb 0.46 -2.41 -0.06 0.00 -2.10 0.00 0.00 70.33 66.22 1g90 n THR 106 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1g90 n LYS 107 N 4.73 0.80 -3.55 -0.78 2.85 -1.26 -4.73 118.16 116.22 1g90 n LYS 107 Ca 0.58 -0.35 -0.10 0.00 -1.05 0.00 0.00 58.31 57.40 1g90 n LYS 107 Cb 0.25 -1.62 -0.02 0.00 -0.65 0.00 0.00 35.03 32.99 1g90 n LYS 107 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1g90 s SER 108 N 2.41 -0.46 -1.22 -5.58 0.01 -1.26 -5.06 113.70 102.54 1g90 s SER 108 Ca 0.23 -0.17 -0.19 0.00 1.31 0.00 0.00 55.95 57.13 1g90 s SER 108 Cb 0.11 0.61 -0.02 0.00 0.21 0.00 0.00 66.02 66.93 1g90 s SER 108 CO 0.00 -1.03 1.90 -3.20 0.41 0.00 0.00 173.24 171.32 1g90 n ASN 109 N -0.39 3.85 -4.31 2.44 5.15 -1.26 -4.88 115.26 115.86 1g90 n ASN 109 Ca -0.13 -2.80 -0.16 0.00 -0.60 0.00 0.00 54.58 50.89 1g90 n ASN 109 Cb 0.63 -1.65 -0.10 0.00 -0.53 0.00 0.00 39.78 38.13 1g90 n ASN 109 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1g90 s VAL 110 N 6.35 0.70 -0.47 3.44 -7.23 -1.26 -5.05 120.40 116.88 1g90 s VAL 110 Ca 0.58 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.75 1g90 s VAL 110 Cb 0.06 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.54 1g90 s VAL 110 CO 0.08 -0.18 0.29 -1.22 -0.31 0.00 0.00 175.10 173.75 1g90 n TYR 111 N -0.41 0.00 0.00 2.82 4.01 -1.26 -4.80 117.16 117.52 1g90 n TYR 111 Ca -0.03 -0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1g90 n TYR 111 Cb 0.65 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.58 1g90 n TYR 111 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1g90 n GLY 112 N 0.58 1.17 4.93 2.72 0.00 -1.26 -4.79 105.19 108.53 1g90 n GLY 112 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1g90 n GLY 112 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1g90 n LYS 113 N 0.00 0.00 -1.55 1.61 3.00 -1.26 -4.87 118.16 115.09 1g90 n LYS 113 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.00 1g90 n LYS 113 Cb 0.00 -3.81 -0.04 0.00 0.00 0.00 0.00 35.03 31.18 1g90 n LYS 113 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1g90 n ASN 114 N 0.00 2.13 0.23 3.14 4.13 -1.26 -4.82 115.26 118.80 1g90 n ASN 114 Ca 0.00 -0.72 0.16 0.00 1.68 0.00 0.00 54.58 55.70 1g90 n ASN 114 Cb 0.00 -1.58 0.77 0.00 -1.54 0.00 0.00 39.78 37.42 1g90 n ASN 114 CO 0.00 0.00 0.00 0.45 0.28 0.00 0.00 177.26 177.99 1g90 h HIS 115 N 17.87 0.00 -3.51 3.10 3.86 -1.99 -3.34 115.15 131.14 1g90 h HIS 115 Ca -0.18 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.53 1g90 h HIS 115 Cb 1.21 0.00 -0.33 0.00 1.06 0.00 0.00 27.41 29.35 1g90 h HIS 115 CO 1.01 0.00 -0.81 0.34 0.86 0.00 0.00 177.93 179.33 1g90 s ASP 116 N -4.78 1.65 0.10 2.45 2.15 -1.26 -5.10 116.67 111.87 1g90 s ASP 116 Ca -0.01 -0.27 -0.17 0.00 0.43 0.00 0.00 52.55 52.53 1g90 s ASP 116 Cb 0.09 -0.71 0.04 0.00 -0.30 0.00 0.00 42.92 42.04 1g90 s ASP 116 CO 0.38 0.04 0.41 0.28 -0.17 0.00 0.00 175.17 176.11 1g90 s THR 117 N 0.58 0.06 0.00 1.71 -1.32 -1.26 -4.75 115.64 110.67 1g90 s THR 117 Ca -0.12 -0.52 0.00 0.00 -1.21 0.00 0.00 61.69 59.84 1g90 s THR 117 Cb -0.14 -1.10 0.00 0.00 -1.51 0.00 0.00 72.50 69.74 1g90 s THR 117 CO 0.03 -0.29 0.00 0.61 -2.21 0.00 0.00 174.62 172.76 1g90 n GLY 118 N -0.03 1.19 3.04 6.08 0.00 0.22 -4.70 105.19 110.98 1g90 n GLY 118 Ca -0.17 0.28 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 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 0.04 -0.03 1.61 0.11 -1.26 -1.52 120.40 119.34 1g90 s VAL 119 Ca 0.00 -0.32 0.00 0.00 -2.93 0.00 0.00 61.98 58.73 1g90 s VAL 119 Cb 0.00 -0.28 0.03 0.00 -1.53 0.00 0.00 36.38 34.60 1g90 s VAL 119 CO 0.00 -0.18 0.01 -0.44 -3.33 0.00 0.00 175.10 171.16 1g90 s SER 120 N -0.57 0.52 0.40 3.54 0.01 -0.13 -4.99 113.70 112.48 1g90 s SER 120 Ca -0.06 -0.02 -0.25 0.00 1.31 0.00 0.00 55.95 56.93 1g90 s SER 120 Cb -0.04 -0.21 -0.08 0.00 0.21 0.00 0.00 66.02 65.89 1g90 s SER 120 CO 0.01 -0.12 1.15 -2.16 0.41 0.00 0.00 173.24 172.53 1g90 s PRO 121 N 1.17 4.06 0.14 12.44 0.04 -1.26 -0.21 135.00 151.38 1g90 s PRO 121 Ca -0.08 1.80 -0.07 0.00 0.04 0.00 0.00 61.00 62.69 1g90 s PRO 121 Cb -0.13 -2.65 -0.01 0.00 0.04 0.00 0.00 34.50 31.74 1g90 s PRO 121 CO -0.02 -0.31 0.22 0.14 0.04 0.00 0.00 177.00 177.07 1g90 s VAL 122 N -1.45 0.09 0.17 -0.36 -7.23 -0.30 -4.82 120.40 106.50 1g90 s VAL 122 Ca 0.57 -1.46 -0.09 0.00 -1.81 0.00 0.00 61.98 59.20 1g90 s VAL 122 Cb -0.30 -1.79 -0.01 0.00 0.56 0.00 0.00 36.38 34.84 1g90 s VAL 122 CO 0.37 -0.40 0.29 0.72 -0.31 0.00 0.00 175.10 175.77 1g90 s PHE 123 N -3.96 0.41 0.13 2.82 -0.71 -1.26 -0.66 117.98 114.74 1g90 s PHE 123 Ca 0.16 -0.77 -0.16 0.00 -1.04 0.00 0.00 56.93 55.12 1g90 s PHE 123 Cb 0.04 -0.06 0.03 0.00 -1.21 0.00 0.00 43.02 41.83 1g90 s PHE 123 CO -0.02 -0.73 0.41 0.00 -1.34 0.00 0.00 175.22 173.54 1g90 s ALA 124 N -3.97 -0.92 0.24 1.99 0.00 0.53 -4.53 121.76 115.09 1g90 s ALA 124 Ca 0.18 -0.07 0.08 0.00 0.00 0.00 0.00 51.96 52.15 1g90 s ALA 124 Cb 0.03 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.82 1g90 s ALA 124 CO 0.01 -0.66 0.09 0.20 0.00 0.00 0.00 175.76 175.40 1g90 s GLY 125 N -2.81 1.56 0.00 0.00 0.00 0.14 -0.42 107.32 105.79 1g90 s GLY 125 Ca 0.04 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.26 1g90 s GLY 125 CO -0.11 -1.54 0.00 0.61 0.00 0.00 0.00 173.10 172.06 1g90 n GLY 126 N -0.89 -1.23 3.01 0.20 0.00 0.14 -0.30 105.19 106.12 1g90 n GLY 126 Ca -0.08 -0.90 -0.14 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.61 0.45 0.09 1.61 -7.23 -0.35 -0.39 120.40 111.97 1g90 s VAL 127 Ca 0.00 -0.65 0.02 0.00 -1.81 0.00 0.00 61.98 59.54 1g90 s VAL 127 Cb 0.00 -0.46 -0.04 0.00 0.56 0.00 0.00 36.38 36.44 1g90 s VAL 127 CO 0.00 -0.15 0.15 -1.61 -0.31 0.00 0.00 175.10 173.18 1g90 s GLU 128 N -0.87 3.13 0.16 4.82 2.02 0.48 -1.62 118.70 126.83 1g90 s GLU 128 Ca -0.04 -0.61 -0.07 0.00 0.02 0.00 0.00 54.97 54.27 1g90 s GLU 128 Cb -0.06 -2.85 -0.02 0.00 0.10 0.00 0.00 34.13 31.30 1g90 s GLU 128 CO 0.00 0.57 0.22 1.52 0.02 0.00 0.00 175.26 177.59 1g90 s TYR 129 N -1.50 0.54 -0.45 1.61 1.13 -0.33 -1.15 117.35 117.20 1g90 s TYR 129 Ca 0.32 -0.90 0.02 0.00 -1.41 0.00 0.00 57.07 55.10 1g90 s TYR 129 Cb -0.12 -0.18 0.14 0.00 -1.10 0.00 0.00 41.96 40.70 1g90 s TYR 129 CO 0.25 -0.67 0.26 0.00 -2.51 0.00 0.00 175.55 172.88 1g90 s ALA 130 N -3.99 2.08 0.53 9.51 0.00 -1.25 -0.94 121.76 127.70 1g90 s ALA 130 Ca 0.19 -2.59 0.25 0.00 0.00 0.00 0.00 51.96 49.81 1g90 s ALA 130 Cb 0.04 -1.86 1.40 0.00 0.00 0.00 0.00 23.12 22.71 1g90 s ALA 130 CO 0.01 -2.06 2.01 0.82 0.00 0.00 0.00 175.76 176.53 1g90 h ILE 131 N 5.13 0.73 -3.70 0.00 2.04 -1.94 -3.37 117.51 116.40 1g90 h ILE 131 Ca 0.03 0.00 -0.18 0.00 1.00 0.00 0.00 64.86 65.71 1g90 h ILE 131 Cb 0.92 0.76 -0.23 0.00 -0.74 0.00 0.00 36.82 37.52 1g90 h ILE 131 CO 0.47 0.00 -0.62 0.28 0.00 0.00 0.00 178.15 178.28 1g90 s THR 132 N -4.99 0.06 -0.18 -0.27 -1.32 -1.26 -5.07 115.64 102.61 1g90 s THR 132 Ca -0.05 -0.50 0.25 0.00 -1.21 0.00 0.00 61.69 60.18 1g90 s THR 132 Cb 0.19 -0.25 0.26 0.00 -1.51 0.00 0.00 72.50 71.19 1g90 s THR 132 CO 0.71 -0.28 1.76 1.55 -2.21 0.00 0.00 174.62 176.16 1g90 h PRO 133 N 5.08 0.00 -0.78 7.08 0.13 -2.01 0.25 132.00 141.76 1g90 h PRO 133 Ca -0.29 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 1g90 h PRO 133 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 1g90 h PRO 133 CO 0.43 0.00 0.47 1.49 -0.23 0.00 0.00 178.00 180.16 1g90 h GLU 134 N 0.00 1.06 -6.13 0.86 4.81 -1.93 -3.46 114.58 109.80 1g90 h GLU 134 Ca 0.00 -0.10 -0.54 0.00 -0.13 0.00 0.00 59.36 58.59 1g90 h GLU 134 Cb 0.13 -0.22 -0.07 0.00 0.63 0.00 0.00 28.75 29.22 1g90 h GLU 134 CO 0.00 0.76 -0.54 0.96 -0.73 0.00 0.00 179.01 179.46 1g90 s ILE 135 N -5.96 3.27 0.08 2.32 -4.36 0.08 -0.90 121.20 115.73 1g90 s ILE 135 Ca -0.13 -1.66 0.01 0.00 -0.26 0.00 0.00 60.65 58.61 1g90 s ILE 135 Cb 0.15 -3.02 -0.04 0.00 1.25 0.00 0.00 42.46 40.81 1g90 s ILE 135 CO 0.80 -0.22 -0.06 0.00 0.24 0.00 0.00 174.94 175.69 1g90 s ALA 136 N -2.37 0.82 0.03 2.27 0.00 0.12 -4.30 121.76 118.33 1g90 s ALA 136 Ca 0.37 -1.24 -0.02 0.00 0.00 0.00 0.00 51.96 51.06 1g90 s ALA 136 Cb -0.04 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.23 1g90 s ALA 136 CO 0.23 -0.24 0.02 -0.08 0.00 0.00 0.00 175.76 175.69 1g90 s THR 137 N -3.41 0.13 0.07 0.00 -1.32 -0.11 -0.32 115.64 110.68 1g90 s THR 137 Ca 0.08 -1.07 0.02 0.00 -1.21 0.00 0.00 61.69 59.51 1g90 s THR 137 Cb 0.04 -0.64 -0.03 0.00 -1.51 0.00 0.00 72.50 70.36 1g90 s THR 137 CO -0.05 -0.59 -0.08 0.00 -2.21 0.00 0.00 174.62 171.69 1g90 s ARG 138 N -2.13 0.68 -0.01 7.08 1.70 -0.27 -1.19 118.95 124.81 1g90 s ARG 138 Ca -0.09 -1.01 0.02 0.00 -0.47 0.00 0.00 55.73 54.17 1g90 s ARG 138 Cb -0.05 -0.32 0.00 0.00 -0.57 0.00 0.00 34.95 34.02 1g90 s ARG 138 CO -0.03 0.04 -0.05 -0.51 -1.08 0.00 0.00 175.30 173.67 1g90 s LEU 139 N -2.18 1.82 0.03 -1.89 1.02 -0.64 -1.44 118.68 115.40 1g90 s LEU 139 Ca -0.00 -0.10 -0.07 0.00 0.02 0.00 0.00 54.13 53.97 1g90 s LEU 139 Cb -0.04 -0.32 -0.00 0.00 0.02 0.00 0.00 46.19 45.85 1g90 s LEU 139 CO -0.01 0.03 0.13 -1.61 0.02 0.00 0.00 176.35 174.91 1g90 s GLU 140 N 0.15 0.60 -0.07 1.70 2.02 0.60 -1.21 118.70 122.48 1g90 s GLU 140 Ca -0.01 -0.67 -0.16 0.00 0.02 0.00 0.00 54.97 54.15 1g90 s GLU 140 Cb -0.05 0.24 0.03 0.00 0.10 0.00 0.00 34.13 34.45 1g90 s GLU 140 CO -0.00 -0.16 0.38 1.52 0.02 0.00 0.00 175.26 177.02 1g90 s TYR 141 N -2.42 -0.32 -0.14 1.61 -0.85 0.59 -1.42 117.35 114.39 1g90 s TYR 141 Ca -0.06 0.66 -0.01 0.00 -0.52 0.00 0.00 57.07 57.13 1g90 s TYR 141 Cb -0.02 0.14 0.04 0.00 0.38 0.00 0.00 41.96 42.50 1g90 s TYR 141 CO -0.03 -0.34 -0.02 -1.14 -1.52 0.00 0.00 175.55 172.50 1g90 s GLN 142 N -0.71 1.03 0.62 -3.49 0.74 0.80 -0.68 119.66 117.98 1g90 s GLN 142 Ca -0.08 -0.31 -0.08 0.00 0.05 0.00 0.00 55.36 54.94 1g90 s GLN 142 Cb -0.04 -1.74 0.01 0.00 1.10 0.00 0.00 33.01 32.34 1g90 s GLN 142 CO 0.03 -0.44 0.96 0.12 -0.55 0.00 0.00 175.29 175.41 1g90 s PHE 143 N 1.78 3.31 0.04 1.67 5.36 -1.26 -0.73 117.98 128.15 1g90 s PHE 143 Ca 0.02 0.81 0.00 0.00 -0.96 0.00 0.00 56.93 56.79 1g90 s PHE 143 Cb -0.15 -2.81 0.00 0.00 -0.34 0.00 0.00 43.02 39.72 1g90 s PHE 143 CO -0.07 -0.90 0.00 -2.37 -1.46 0.00 0.00 175.22 170.42 1g90 n THR 144 N -2.70 0.00 -3.88 0.12 5.66 -0.14 -4.83 114.28 108.50 1g90 n THR 144 Ca 0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 1g90 n THR 144 Cb 0.57 -0.05 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 1g90 n THR 144 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1g90 n ASN 145 N -3.26 -2.62 -3.11 1.09 5.15 -1.26 -3.31 115.26 107.93 1g90 n ASN 145 Ca 0.00 0.00 -0.17 0.00 -0.60 0.00 0.00 54.58 53.81 1g90 n ASN 145 Cb 0.07 0.00 0.07 0.00 -0.53 0.00 0.00 39.78 39.39 1g90 n ASN 145 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1g90 n ASN 146 N -3.22 -3.65 -4.06 1.20 3.02 -1.26 -2.69 115.26 104.60 1g90 n ASN 146 Ca 0.00 -0.50 -0.08 0.00 -0.03 0.00 0.00 54.58 53.97 1g90 n ASN 146 Cb 0.00 -4.43 -0.10 0.00 -0.61 0.00 0.00 39.78 34.63 1g90 n ASN 146 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1g90 s ILE 147 N -3.29 0.19 0.00 2.41 2.07 -1.26 -4.25 121.20 117.06 1g90 s ILE 147 Ca 0.22 -1.56 0.00 0.00 -1.41 0.00 0.00 60.65 57.90 1g90 s ILE 147 Cb -0.10 -1.17 0.00 0.00 0.13 0.00 0.00 42.46 41.32 1g90 s ILE 147 CO 0.63 -0.86 0.00 0.61 -1.91 0.00 0.00 174.94 173.41 1g90 n GLY 148 N 0.52 0.30 3.26 1.50 0.00 0.66 -5.01 105.19 106.41 1g90 n GLY 148 Ca -0.17 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 -0.27 -0.37 1.61 -1.08 -1.23 -4.99 116.67 110.34 1g90 s ASP 149 Ca 0.00 0.29 -0.03 0.00 -0.52 0.00 0.00 52.55 52.29 1g90 s ASP 149 Cb 0.00 0.44 0.19 0.00 -1.46 0.00 0.00 42.92 42.09 1g90 s ASP 149 CO 0.00 -0.38 0.91 0.00 0.52 0.00 0.00 175.17 176.22 1g90 s ALA 150 N -0.95 -3.65 -1.23 3.66 0.00 -1.19 -0.99 121.76 117.41 1g90 s ALA 150 Ca -0.10 0.74 -0.20 0.00 0.00 0.00 0.00 51.96 52.40 1g90 s ALA 150 Cb -0.04 -2.91 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 1g90 s ALA 150 CO 0.04 -2.40 1.86 0.72 0.00 0.00 0.00 175.76 175.97 1g90 n HIS 151 N 3.70 3.61 0.00 0.00 8.25 -1.26 -4.53 115.22 124.99 1g90 n HIS 151 Ca 0.09 -2.16 0.00 0.00 -0.26 0.00 0.00 57.72 55.39 1g90 n HIS 151 Cb 0.61 -2.59 0.00 0.00 1.12 0.00 0.00 29.99 29.13 1g90 n HIS 151 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1g90 n THR 152 N 6.99 0.00 -4.52 1.59 -1.04 -1.26 -4.74 114.28 111.30 1g90 n THR 152 Ca 0.47 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 62.23 1g90 n THR 152 Cb 0.46 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.88 1g90 n THR 152 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 1g90 s ILE 153 N -0.02 0.91 0.00 12.58 -4.36 -1.26 -5.07 121.20 123.99 1g90 s ILE 153 Ca 0.00 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 1g90 s ILE 153 Cb 0.00 -2.51 0.00 0.00 1.25 0.00 0.00 42.46 41.20 1g90 s ILE 153 CO 0.00 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.79 1g90 n GLY 154 N -0.86 -0.60 3.77 6.27 0.00 -1.26 -4.68 105.19 107.83 1g90 n GLY 154 Ca -0.06 -1.60 -0.32 0.00 0.00 0.00 0.00 46.02 44.04 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 0.00 3.27 0.76 2.61 2.01 -1.26 -5.03 115.64 118.01 1g90 s THR 155 Ca 0.00 0.47 -0.12 0.00 0.31 0.00 0.00 61.69 62.35 1g90 s THR 155 Cb 0.00 -2.96 0.05 0.00 0.01 0.00 0.00 72.50 69.60 1g90 s THR 155 CO 0.00 -0.49 1.10 -0.13 -0.69 0.00 0.00 174.62 174.42 1g90 s ARG 156 N -4.64 2.24 0.00 4.92 0.52 -1.26 -4.87 118.95 115.87 1g90 s ARG 156 Ca 0.63 1.27 0.00 0.00 -0.52 0.00 0.00 55.73 57.11 1g90 s ARG 156 Cb -0.18 -1.89 0.00 0.00 0.52 0.00 0.00 34.95 33.40 1g90 s ARG 156 CO 0.51 -1.67 0.80 -0.35 0.02 0.00 0.00 175.30 174.62 1g90 n PRO 157 N -3.34 0.55 -3.23 3.54 -0.04 -1.26 -4.22 135.00 127.00 1g90 n PRO 157 Ca 0.10 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.53 1g90 n PRO 157 Cb 0.53 -1.22 -0.03 0.00 -0.04 0.00 0.00 33.50 32.73 1g90 n PRO 157 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1g90 s ASP 158 N 1.45 -0.60 0.00 3.54 2.15 -1.26 -4.93 116.67 117.02 1g90 s ASP 158 Ca 0.00 -0.19 0.00 0.00 0.43 0.00 0.00 52.55 52.79 1g90 s ASP 158 Cb 0.00 1.55 0.00 0.00 -0.30 0.00 0.00 42.92 44.17 1g90 s ASP 158 CO 0.00 -0.32 0.00 -3.20 -0.17 0.00 0.00 175.17 171.48 1g90 n ASN 159 N 5.29 0.00 0.00 -0.34 5.15 -1.09 -4.81 115.26 119.46 1g90 n ASN 159 Ca 0.04 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 1g90 n ASN 159 Cb 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.77 1g90 n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1g90 n GLY 160 N 4.64 -0.56 3.09 8.20 0.00 -1.21 -0.97 105.19 118.38 1g90 n GLY 160 Ca 0.00 -0.95 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.00 0.57 0.14 1.61 1.75 0.09 -4.46 119.30 117.00 1g90 s MET 161 Ca 0.00 -0.91 0.03 0.00 -1.25 0.00 0.00 55.69 53.55 1g90 s MET 161 Cb 0.00 0.21 -0.04 0.00 2.84 0.00 0.00 34.83 37.84 1g90 s MET 161 CO 0.00 -0.13 -0.05 -0.51 -0.65 0.00 0.00 175.02 173.68 1g90 s LEU 162 N -2.36 2.37 0.18 4.11 1.02 0.42 -0.14 118.68 124.28 1g90 s LEU 162 Ca -0.02 -1.08 -0.09 0.00 0.02 0.00 0.00 54.13 52.97 1g90 s LEU 162 Cb 0.01 -0.15 -0.01 0.00 0.02 0.00 0.00 46.19 46.06 1g90 s LEU 162 CO -0.06 -0.47 0.29 -0.94 0.02 0.00 0.00 176.35 175.19 1g90 s SER 163 N -3.13 0.04 0.18 2.29 1.04 -0.51 -0.51 113.70 113.10 1g90 s SER 163 Ca 0.18 -0.94 -0.11 0.00 0.48 0.00 0.00 55.95 55.56 1g90 s SER 163 Cb 0.05 0.45 -0.00 0.00 0.10 0.00 0.00 66.02 66.62 1g90 s SER 163 CO 0.00 -0.92 0.36 -1.48 0.98 0.00 0.00 173.24 172.18 1g90 s LEU 164 N -3.00 0.70 0.25 2.42 0.05 0.15 -0.29 118.68 118.96 1g90 s LEU 164 Ca 0.20 -0.80 -0.21 0.00 0.05 0.00 0.00 54.13 53.37 1g90 s LEU 164 Cb 0.03 1.45 0.06 0.00 -2.05 0.00 0.00 46.19 45.68 1g90 s LEU 164 CO 0.03 -0.95 0.90 -0.83 -0.55 0.00 0.00 176.35 174.94 1g90 s GLY 165 N -2.95 0.06 0.03 -3.48 0.00 -0.52 -0.62 107.32 99.83 1g90 s GLY 165 Ca 0.16 -0.32 0.03 0.00 0.00 0.00 0.00 44.72 44.59 1g90 s GLY 165 CO 0.01 0.65 -0.09 0.14 0.00 0.00 0.00 173.10 173.80 1g90 s VAL 166 N -2.77 0.65 0.33 1.40 1.01 -0.62 -1.12 120.40 119.28 1g90 s VAL 166 Ca 0.16 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 61.13 1g90 s VAL 166 Cb -0.03 -0.65 0.03 0.00 0.00 0.00 0.00 36.38 35.72 1g90 s VAL 166 CO 0.06 -0.18 0.66 -0.44 0.00 0.00 0.00 175.10 175.21 1g90 s SER 167 N -1.15 0.08 0.16 3.32 0.01 0.56 -0.18 113.70 116.50 1g90 s SER 167 Ca -0.04 -1.03 -0.05 0.00 1.31 0.00 0.00 55.95 56.14 1g90 s SER 167 Cb -0.08 0.74 -0.03 0.00 0.21 0.00 0.00 66.02 66.87 1g90 s SER 167 CO 0.01 -1.44 0.18 -0.72 0.41 0.00 0.00 173.24 171.68 1g90 s TYR 168 N -3.16 0.68 0.23 2.43 -0.85 0.16 0.11 117.35 116.95 1g90 s TYR 168 Ca 0.18 -1.03 0.07 0.00 -0.52 0.00 0.00 57.07 55.77 1g90 s TYR 168 Cb -0.04 -0.28 -0.04 0.00 0.38 0.00 0.00 41.96 41.99 1g90 s TYR 168 CO 0.11 -0.64 0.16 1.03 -1.52 0.00 0.00 175.55 174.70 1g90 s ARG 169 N -4.03 2.85 0.78 -3.49 0.52 -0.08 -1.34 118.95 114.16 1g90 s ARG 169 Ca 0.23 -1.05 -0.15 0.00 -0.52 0.00 0.00 55.73 54.24 1g90 s ARG 169 Cb 0.05 -2.54 0.00 0.00 0.52 0.00 0.00 34.95 32.99 1g90 s ARG 169 CO 0.03 0.42 0.71 1.97 0.02 0.00 0.00 175.30 178.44 1g90 n PHE 170 N -0.95 -0.26 -0.74 -0.53 -1.74 -1.26 -3.24 117.46 108.73 1g90 n PHE 170 Ca -0.08 0.35 0.00 0.00 -0.56 0.00 0.00 57.45 57.16 1g90 n PHE 170 Cb 0.57 -1.96 0.00 0.00 1.52 0.00 0.00 39.48 39.61 1g90 n PHE 170 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1g90 n GLY 171 N 1.32 0.56 3.68 4.97 0.00 -1.26 -5.03 105.19 109.44 1g90 n GLY 171 Ca 0.11 -0.58 -0.49 0.00 0.00 0.00 0.00 46.02 45.05 1g90 n GLY 171 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1g90 n GLN 172 N -2.74 1.99 -0.51 1.61 7.27 -1.20 -0.60 117.38 123.20 1g90 n GLN 172 Ca 0.00 0.73 0.00 0.00 0.07 0.00 0.00 57.00 57.80 1g90 n GLN 172 Cb 0.00 -2.53 0.00 0.00 2.41 0.00 0.00 30.24 30.12 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 4.15 0.75 7.00 1.69 0.00 -1.26 -4.89 105.19 112.63 1g90 n GLY 173 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1g90 n GLY 173 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1g90 n GLU 174 N -2.18 0.00 0.00 1.61 2.13 0.23 -4.89 120.64 117.53 1g90 n GLU 174 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1g90 n GLU 174 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1g90 n GLU 174 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1g90 n ALA 175 N 2.07 0.00 -0.20 4.31 0.00 -1.26 -4.89 120.51 120.54 1g90 n ALA 175 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1g90 n ALA 175 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1g90 n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50