#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ueb s ILE 2 N 0.00 0.42 0.33 2.02 -4.36 -0.26 -4.85 121.20 114.50 1ueb s ILE 2 Ca 0.00 -1.46 -0.26 0.00 -0.26 0.00 0.00 60.65 58.67 1ueb s ILE 2 Cb 0.00 -1.06 -0.09 0.00 1.25 0.00 0.00 42.46 42.56 1ueb s ILE 2 CO 0.00 -0.69 1.00 -0.55 0.24 0.00 0.00 174.94 174.93 1ueb s SER 3 N -2.29 7.18 0.63 4.36 0.15 -1.26 -0.74 113.70 121.73 1ueb s SER 3 Ca -0.01 1.97 0.41 0.00 0.70 0.00 0.00 55.95 59.02 1ueb s SER 3 Cb -0.01 -2.59 2.15 0.00 -1.71 0.00 0.00 66.02 63.86 1ueb s SER 3 CO -0.04 -0.19 2.28 -0.37 1.20 0.00 0.00 173.24 176.12 1ueb h VAL 4 N 2.59 0.06 0.00 4.45 -1.51 -1.47 0.21 116.25 120.58 1ueb h VAL 4 Ca -0.47 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 1ueb h VAL 4 Cb 1.20 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 31.48 1ueb h VAL 4 CO 0.65 0.01 0.00 0.35 -1.23 0.00 0.00 177.57 177.34 1ueb n THR 5 N -3.15 0.12 1.15 7.19 -2.24 -1.26 -2.63 114.28 113.45 1ueb n THR 5 Ca -0.02 0.03 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 1ueb n THR 5 Cb 0.13 -0.57 0.22 0.00 -2.10 0.00 0.00 70.33 68.01 1ueb n THR 5 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ueb n ASP 6 N -1.37 2.52 -4.77 3.42 8.00 0.06 -4.94 116.55 119.47 1ueb n ASP 6 Ca 0.11 -1.83 -0.37 0.00 0.71 0.00 0.00 54.79 53.40 1ueb n ASP 6 Cb 0.26 0.01 -0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1ueb n ASP 6 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ueb s LEU 7 N -2.02 3.97 0.05 0.64 1.43 -1.08 -5.01 118.68 116.66 1ueb s LEU 7 Ca 0.31 2.37 -0.23 0.00 -1.03 0.00 0.00 54.13 55.55 1ueb s LEU 7 Cb 0.20 -4.27 0.05 0.00 0.03 0.00 0.00 46.19 42.21 1ueb s LEU 7 CO 0.32 -1.04 0.53 -0.13 0.23 0.00 0.00 176.35 176.26 1ueb s ARG 8 N -2.76 1.05 0.04 1.70 1.81 -1.26 -4.98 118.95 114.55 1ueb s ARG 8 Ca 0.65 -0.23 -0.36 0.00 -1.72 0.00 0.00 55.73 54.08 1ueb s ARG 8 Cb -0.30 0.48 -0.15 0.00 -0.45 0.00 0.00 34.95 34.53 1ueb s ARG 8 CO 0.36 -0.38 1.57 -2.30 -0.68 0.00 0.00 175.30 173.88 1ueb n PRO 9 N 0.39 1.71 0.00 3.54 -0.02 -1.26 -1.05 135.00 138.32 1ueb n PRO 9 Ca -0.18 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1ueb n PRO 9 Cb 0.60 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1ueb n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ueb n GLY 10 N 3.39 2.59 3.72 -1.23 0.00 0.68 -4.97 105.19 109.36 1ueb n GLY 10 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1ueb n GLY 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ueb s THR 11 N -2.36 3.06 -0.17 2.61 2.01 -0.21 -4.70 115.64 115.88 1ueb s THR 11 Ca 0.00 0.79 -0.08 0.00 0.31 0.00 0.00 61.69 62.71 1ueb s THR 11 Cb 0.00 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 1ueb s THR 11 CO 0.00 0.07 0.09 -0.54 -0.69 0.00 0.00 174.62 173.56 1ueb s LYS 12 N 0.83 3.87 0.08 4.92 1.02 -1.26 -0.48 119.74 128.73 1ueb s LYS 12 Ca 0.64 -0.27 -0.01 0.00 0.02 0.00 0.00 55.97 56.35 1ueb s LYS 12 Cb -0.39 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.64 1ueb s LYS 12 CO 0.33 0.41 0.00 0.14 -0.92 0.00 0.00 175.35 175.31 1ueb s VAL 13 N 0.01 0.19 -0.21 3.17 -7.23 -0.13 -1.56 120.40 114.64 1ueb s VAL 13 Ca 0.07 -1.86 -0.04 0.00 -1.81 0.00 0.00 61.98 58.34 1ueb s VAL 13 Cb -0.12 -1.74 -0.02 0.00 0.56 0.00 0.00 36.38 35.07 1ueb s VAL 13 CO 0.00 -0.78 -0.02 -0.75 -0.31 0.00 0.00 175.10 173.25 1ueb s LYS 14 N -3.97 3.49 -0.02 4.82 2.20 0.17 -0.11 119.74 126.33 1ueb s LYS 14 Ca 0.14 -0.57 0.01 0.00 -0.36 0.00 0.00 55.97 55.19 1ueb s LYS 14 Cb 0.08 -3.05 0.01 0.00 -1.51 0.00 0.00 37.83 33.36 1ueb s LYS 14 CO -0.05 -0.10 -0.02 -1.64 -0.36 0.00 0.00 175.35 173.17 1ueb s MET 15 N 1.27 0.36 -1.58 4.03 -1.94 -0.03 -4.23 119.30 117.17 1ueb s MET 15 Ca 0.04 -0.04 -0.10 0.00 -1.71 0.00 0.00 55.69 53.87 1ueb s MET 15 Cb -0.14 -0.43 0.09 0.00 2.01 0.00 0.00 34.83 36.35 1ueb s MET 15 CO -0.00 -0.03 0.60 -0.25 -0.01 0.00 0.00 175.02 175.33 1ueb n ASP 16 N 3.59 -1.94 0.00 3.03 9.92 -1.26 0.07 116.55 129.96 1ueb n ASP 16 Ca -0.20 -1.02 0.00 0.00 -0.53 0.00 0.00 54.79 53.03 1ueb n ASP 16 Cb 0.54 -2.80 0.00 0.00 -0.64 0.00 0.00 41.12 38.22 1ueb n ASP 16 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ueb n GLY 17 N -1.70 1.13 3.82 0.44 0.00 -1.26 -5.00 105.19 102.62 1ueb n GLY 17 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1ueb n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ueb s GLY 18 N -2.00 1.56 -0.21 -0.02 0.00 0.11 -5.11 107.32 101.65 1ueb s GLY 18 Ca 0.00 -1.52 -0.06 0.00 0.00 0.00 0.00 44.72 43.14 1ueb s GLY 18 CO 0.00 -1.52 0.03 1.08 0.00 0.00 0.00 173.10 172.69 1ueb s LEU 19 N -3.88 3.40 0.23 0.66 1.43 -1.26 -0.86 118.68 118.41 1ueb s LEU 19 Ca 0.35 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.34 1ueb s LEU 19 Cb -0.07 -1.88 -0.05 0.00 0.03 0.00 0.00 46.19 44.22 1ueb s LEU 19 CO 0.25 0.05 -0.01 0.26 0.23 0.00 0.00 176.35 177.13 1ueb s TRP 20 N 1.07 1.60 -0.07 0.29 0.52 0.85 -1.10 118.94 122.11 1ueb s TRP 20 Ca 0.03 -0.89 0.01 0.00 0.02 0.00 0.00 56.10 55.28 1ueb s TRP 20 Cb -0.14 -0.93 0.02 0.00 -1.15 0.00 0.00 33.47 31.27 1ueb s TRP 20 CO 0.02 0.01 -0.09 -2.00 0.02 0.00 0.00 176.95 174.91 1ueb s GLU 21 N -3.84 1.46 0.25 4.98 2.12 -0.21 -0.96 118.70 122.50 1ueb s GLU 21 Ca 0.28 -0.30 -0.30 0.00 0.36 0.00 0.00 54.97 55.01 1ueb s GLU 21 Cb 0.05 -1.32 -0.09 0.00 0.26 0.00 0.00 34.13 33.03 1ueb s GLU 21 CO 0.09 -0.07 1.32 0.00 -0.54 0.00 0.00 175.26 176.06 1ueb n VAL 23 N 2.00 0.00 -3.83 0.00 0.24 0.89 -0.23 118.33 117.40 1ueb n VAL 23 Ca 0.04 -0.04 -0.12 0.00 -2.04 0.00 0.00 64.34 62.18 1ueb n VAL 23 Cb 0.42 0.50 -0.13 0.00 -1.47 0.00 0.00 33.84 33.16 1ueb n VAL 23 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1ueb s GLU 24 N -1.72 0.10 -0.02 7.34 2.02 -1.09 -4.75 118.70 120.59 1ueb s GLU 24 Ca 0.00 0.15 0.01 0.00 0.02 0.00 0.00 54.97 55.15 1ueb s GLU 24 Cb 0.00 0.03 0.01 0.00 0.10 0.00 0.00 34.13 34.27 1ueb s GLU 24 CO 0.00 -0.03 -0.03 -0.47 0.02 0.00 0.00 175.26 174.75 1ueb s TYR 25 N 0.15 0.38 -0.12 1.61 5.04 -1.26 -1.41 117.35 121.74 1ueb s TYR 25 Ca -0.01 -0.06 -0.05 0.00 -2.44 0.00 0.00 57.07 54.51 1ueb s TYR 25 Cb -0.02 -0.33 0.06 0.00 0.35 0.00 0.00 41.96 42.02 1ueb s TYR 25 CO -0.00 -0.06 0.26 -1.14 -1.34 0.00 0.00 175.55 173.26 1ueb s GLN 26 N 0.35 0.16 -0.18 4.97 0.74 -0.30 -5.00 119.66 120.39 1ueb s GLN 26 Ca -0.04 0.70 -0.03 0.00 0.05 0.00 0.00 55.36 56.05 1ueb s GLN 26 Cb -0.07 -0.06 -0.01 0.00 1.10 0.00 0.00 33.01 33.97 1ueb s GLN 26 CO -0.01 -0.26 -0.07 -1.58 -0.55 0.00 0.00 175.29 172.82 1ueb s HIS 27 N 2.18 2.92 0.02 1.67 5.65 -1.26 -0.35 115.29 126.12 1ueb s HIS 27 Ca -0.01 -0.78 0.00 0.00 0.25 0.00 0.00 55.06 54.52 1ueb s HIS 27 Cb -0.12 -2.01 -0.02 0.00 -1.18 0.00 0.00 32.58 29.26 1ueb s HIS 27 CO -0.08 -0.39 -0.03 -1.14 -0.65 0.00 0.00 174.74 172.45 1ueb s GLN 28 N 0.99 0.28 -0.11 2.88 0.74 0.04 -4.99 119.66 119.49 1ueb s GLN 28 Ca -0.00 -0.47 -0.04 0.00 0.05 0.00 0.00 55.36 54.89 1ueb s GLN 28 Cb -0.15 -0.01 0.06 0.00 1.10 0.00 0.00 33.01 34.01 1ueb s GLN 28 CO -0.00 -0.01 0.23 0.21 -0.55 0.00 0.00 175.29 175.16 1ueb s LYS 29 N -1.08 0.13 -0.27 1.67 2.20 -1.26 -0.52 119.74 120.61 1ueb s LYS 29 Ca -0.10 0.64 -0.04 0.00 -0.36 0.00 0.00 55.97 56.10 1ueb s LYS 29 Cb -0.07 -0.12 0.01 0.00 -1.51 0.00 0.00 37.83 36.14 1ueb s LYS 29 CO -0.01 -0.26 0.00 -0.51 -0.36 0.00 0.00 175.35 174.22 1ueb s LEU 30 N 2.09 3.45 0.00 5.43 1.43 -1.26 -5.03 118.68 124.79 1ueb s LEU 30 Ca -0.01 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.34 1ueb s LEU 30 Cb -0.12 -1.77 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1ueb s LEU 30 CO -0.08 -0.14 0.00 0.61 0.23 0.00 0.00 176.35 176.97 1ueb n GLY 31 N 4.77 2.61 0.03 -3.19 0.00 -1.26 -1.64 105.19 106.51 1ueb n GLY 31 Ca -0.16 -0.35 0.12 0.00 0.00 0.00 0.00 46.02 45.63 1ueb n GLY 31 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ueb n ARG 32 N 13.54 1.04 -1.71 1.61 0.00 -1.26 -4.88 116.66 124.99 1ueb n ARG 32 Ca 0.00 -0.05 -0.33 0.00 -0.00 0.00 0.00 57.85 57.47 1ueb n ARG 32 Cb 0.00 -1.39 0.05 0.00 -0.00 0.00 0.00 32.46 31.13 1ueb n ARG 32 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1ueb s GLY 33 N -1.77 2.16 0.44 2.89 0.00 -0.65 -4.98 107.32 105.42 1ueb s GLY 33 Ca 0.37 0.58 -0.24 0.00 0.00 0.00 0.00 44.72 45.42 1ueb s GLY 33 CO 0.29 0.93 1.23 -0.32 0.00 0.00 0.00 173.10 175.23 1ueb s GLY 34 N -2.54 2.86 0.47 0.20 0.00 -1.26 -4.47 107.32 102.58 1ueb s GLY 34 Ca 0.68 1.09 -0.22 0.00 0.00 0.00 0.00 44.72 46.26 1ueb s GLY 34 CO 0.42 1.60 1.12 0.00 0.00 0.00 0.00 173.10 176.25 1ueb s ALA 35 N -1.40 2.93 0.13 3.20 0.00 -1.26 -4.73 121.76 120.63 1ueb s ALA 35 Ca 0.61 0.84 0.06 0.00 0.00 0.00 0.00 51.96 53.47 1ueb s ALA 35 Cb -0.33 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.40 1ueb s ALA 35 CO 0.42 -0.57 -0.14 0.15 0.00 0.00 0.00 175.76 175.62 1ueb s LYS 36 N -2.84 1.06 -0.10 0.00 -0.14 0.32 -1.58 119.74 116.46 1ueb s LYS 36 Ca 0.65 -1.29 0.02 0.00 -1.36 0.00 0.00 55.97 53.99 1ueb s LYS 36 Cb -0.25 -0.91 0.01 0.00 -1.68 0.00 0.00 37.83 35.00 1ueb s LYS 36 CO 0.30 0.17 -0.17 0.08 -0.76 0.00 0.00 175.35 174.97 1ueb s VAL 37 N -2.30 1.62 -0.19 3.17 1.01 0.13 -0.78 120.40 123.05 1ueb s VAL 37 Ca 0.11 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 1ueb s VAL 37 Cb -0.04 -1.45 0.01 0.00 0.00 0.00 0.00 36.38 34.89 1ueb s VAL 37 CO 0.03 0.46 -0.13 -0.69 0.00 0.00 0.00 175.10 174.78 1ueb s VAL 38 N 0.78 2.69 0.02 2.92 1.01 0.53 -0.26 120.40 128.08 1ueb s VAL 38 Ca -0.11 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1ueb s VAL 38 Cb -0.16 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 1ueb s VAL 38 CO 0.01 0.49 -0.06 0.00 0.00 0.00 0.00 175.10 175.54 1ueb s ALA 39 N 1.31 0.50 -0.05 5.51 0.00 -0.59 -1.15 121.76 127.29 1ueb s ALA 39 Ca 0.04 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 51.51 1ueb s ALA 39 Cb -0.14 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 1ueb s ALA 39 CO -0.07 0.04 -0.04 0.21 0.00 0.00 0.00 175.76 175.89 1ueb s LYS 40 N -0.88 2.77 0.09 0.00 2.20 -0.50 -1.33 119.74 122.08 1ueb s LYS 40 Ca -0.04 -0.56 0.05 0.00 -0.36 0.00 0.00 55.97 55.06 1ueb s LYS 40 Cb -0.06 -2.63 -0.03 0.00 -1.51 0.00 0.00 37.83 33.60 1ueb s LYS 40 CO 0.00 0.65 -0.14 -0.06 -0.36 0.00 0.00 175.35 175.45 1ueb s PHE 41 N -0.91 1.27 -0.04 4.03 0.40 0.34 -0.08 117.98 123.00 1ueb s PHE 41 Ca 0.15 -0.50 0.07 0.00 -0.60 0.00 0.00 56.93 56.04 1ueb s PHE 41 Cb -0.11 -0.70 -0.02 0.00 0.51 0.00 0.00 43.02 42.70 1ueb s PHE 41 CO 0.04 0.08 -0.24 -1.59 0.70 0.00 0.00 175.22 174.22 1ueb s LYS 42 N -2.07 2.30 0.46 0.44 -2.85 0.15 -1.43 119.74 116.74 1ueb s LYS 42 Ca 0.02 -0.88 -0.23 0.00 -1.00 0.00 0.00 55.97 53.88 1ueb s LYS 42 Cb -0.08 -2.14 -0.07 0.00 -2.06 0.00 0.00 37.83 33.48 1ueb s LYS 42 CO 0.02 0.52 1.16 1.21 0.10 0.00 0.00 175.35 178.37 1ueb s ASN 43 N -0.51 6.20 0.03 0.03 3.84 0.18 -1.04 114.94 123.66 1ueb s ASN 43 Ca 0.07 2.29 0.25 0.00 0.21 0.00 0.00 52.86 55.68 1ueb s ASN 43 Cb -0.11 -2.60 0.58 0.00 -0.55 0.00 0.00 41.25 38.57 1ueb s ASN 43 CO 0.00 -0.90 1.47 0.18 -2.79 0.00 0.00 177.10 175.07 1ueb n LEU 44 N -0.47 0.47 -0.01 3.21 4.77 -0.25 -4.42 117.00 120.29 1ueb n LEU 44 Ca 0.07 0.12 -0.01 0.00 -0.03 0.00 0.00 56.01 56.17 1ueb n LEU 44 Cb 0.48 -0.27 -0.01 0.00 -2.33 0.00 0.00 43.42 41.29 1ueb n LEU 44 CO 0.47 0.07 -0.54 -0.62 -1.33 0.00 0.00 177.39 175.44 1ueb n GLU 45 N -1.63 0.33 -2.25 3.23 1.02 -1.26 -4.68 120.64 115.40 1ueb n GLU 45 Ca 0.05 0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.10 1ueb n GLU 45 Cb 0.36 -1.03 0.01 0.00 -0.02 0.00 0.00 31.44 30.76 1ueb n GLU 45 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1ueb n THR 46 N -2.50 0.00 0.01 2.62 -2.24 -1.26 -5.02 114.28 105.89 1ueb n THR 46 Ca -0.02 -0.86 0.11 0.00 -2.27 0.00 0.00 64.05 61.01 1ueb n THR 46 Cb 0.53 -0.47 0.28 0.00 -2.10 0.00 0.00 70.33 68.57 1ueb n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ueb n GLY 47 N 2.22 2.01 3.79 3.38 0.00 -1.26 -4.44 105.19 110.88 1ueb n GLY 47 Ca 0.02 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 44.97 1ueb n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ueb s ALA 48 N -1.24 2.64 0.12 4.61 0.00 -1.26 -4.83 121.76 121.80 1ueb s ALA 48 Ca 0.43 0.53 0.03 0.00 0.00 0.00 0.00 51.96 52.96 1ueb s ALA 48 Cb 0.23 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 1ueb s ALA 48 CO 0.31 -0.94 -0.09 0.95 0.00 0.00 0.00 175.76 175.99 1ueb s THR 49 N -2.27 0.94 -0.13 0.00 -4.23 -1.26 -0.65 115.64 108.04 1ueb s THR 49 Ca 0.66 -1.89 -0.20 0.00 -1.18 0.00 0.00 61.69 59.08 1ueb s THR 49 Cb -0.19 -1.64 0.05 0.00 1.34 0.00 0.00 72.50 72.06 1ueb s THR 49 CO 0.36 -0.74 0.51 0.54 -0.54 0.00 0.00 174.62 174.75 1ueb s VAL 50 N -3.16 0.01 -0.10 2.29 0.11 -0.51 -4.98 120.40 114.06 1ueb s VAL 50 Ca 0.12 -0.10 0.03 0.00 -2.93 0.00 0.00 61.98 59.10 1ueb s VAL 50 Cb 0.02 -0.75 -0.01 0.00 -1.53 0.00 0.00 36.38 34.11 1ueb s VAL 50 CO -0.01 -0.06 -0.21 -0.70 -3.33 0.00 0.00 175.10 170.79 1ueb s GLU 51 N -0.35 3.01 0.10 1.54 2.12 -1.26 -0.50 118.70 123.35 1ueb s GLU 51 Ca -0.05 -0.83 0.05 0.00 0.36 0.00 0.00 54.97 54.50 1ueb s GLU 51 Cb -0.03 -2.35 -0.03 0.00 0.26 0.00 0.00 34.13 31.97 1ueb s GLU 51 CO 0.03 0.25 -0.13 1.03 -0.54 0.00 0.00 175.26 175.90 1ueb s ARG 52 N 0.20 0.91 -0.15 4.30 0.52 -0.44 -4.99 118.95 119.31 1ueb s ARG 52 Ca -0.13 -1.13 0.01 0.00 -0.52 0.00 0.00 55.73 53.97 1ueb s ARG 52 Cb -0.16 -0.79 0.00 0.00 0.52 0.00 0.00 34.95 34.52 1ueb s ARG 52 CO 0.07 0.15 -0.18 0.99 0.02 0.00 0.00 175.30 176.35 1ueb s THR 53 N -1.94 2.44 0.27 0.02 2.01 -1.26 -1.55 115.64 115.63 1ueb s THR 53 Ca 0.05 -0.85 0.11 0.00 0.31 0.00 0.00 61.69 61.30 1ueb s THR 53 Cb -0.06 -2.01 -0.05 0.00 0.01 0.00 0.00 72.50 70.39 1ueb s THR 53 CO 0.02 0.53 -0.17 -0.36 -0.69 0.00 0.00 174.62 173.95 1ueb s PHE 54 N 0.77 2.16 0.26 4.92 0.08 0.64 -4.96 117.98 121.85 1ueb s PHE 54 Ca -0.07 -0.42 -0.22 0.00 0.12 0.00 0.00 56.93 56.34 1ueb s PHE 54 Cb -0.16 -1.00 -0.09 0.00 -0.57 0.00 0.00 43.02 41.21 1ueb s PHE 54 CO 0.00 0.60 0.80 -0.80 -0.10 0.00 0.00 175.22 175.72 1ueb s ASN 55 N -3.48 7.15 0.60 1.36 0.01 -1.26 -0.70 114.94 118.63 1ueb s ASN 55 Ca 0.29 1.56 0.28 0.00 -0.71 0.00 0.00 52.86 54.28 1ueb s ASN 55 Cb -0.03 -2.47 1.36 0.00 0.41 0.00 0.00 41.25 40.51 1ueb s ASN 55 CO 0.13 -0.00 1.76 0.77 -1.51 0.00 0.00 177.10 178.25 1ueb h SER 56 N 3.34 0.00 0.18 -1.22 4.64 -1.60 -1.16 113.55 117.72 1ueb h SER 56 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1ueb h SER 56 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1ueb h SER 56 CO 0.65 0.00 -0.12 0.61 -0.87 0.00 0.00 176.83 177.10 1ueb n GLY 57 N -1.52 -0.54 3.75 -0.77 0.00 -1.26 -4.34 105.19 100.51 1ueb n GLY 57 Ca 0.10 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1ueb n GLY 57 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ueb s GLU 58 N -2.30 1.76 0.16 1.61 2.02 -0.44 -4.88 118.70 116.62 1ueb s GLU 58 Ca 0.31 0.87 0.07 0.00 0.02 0.00 0.00 54.97 56.24 1ueb s GLU 58 Cb 0.20 -1.86 -0.04 0.00 0.10 0.00 0.00 34.13 32.53 1ueb s GLU 58 CO 0.44 -1.91 -0.14 0.15 0.02 0.00 0.00 175.26 173.82 1ueb s LYS 59 N -4.98 1.15 0.11 1.61 1.02 -1.26 -1.44 119.74 115.96 1ueb s LYS 59 Ca 0.62 -1.41 0.04 0.00 0.02 0.00 0.00 55.97 55.25 1ueb s LYS 59 Cb -0.17 -0.97 -0.04 0.00 -0.52 0.00 0.00 37.83 36.13 1ueb s LYS 59 CO 0.56 0.17 -0.11 -0.51 -0.92 0.00 0.00 175.35 174.54 1ueb s LEU 60 N -2.87 2.42 -0.63 3.17 1.43 0.08 -4.89 118.68 117.38 1ueb s LEU 60 Ca 0.15 -0.84 -0.25 0.00 -1.03 0.00 0.00 54.13 52.16 1ueb s LEU 60 Cb -0.02 -0.35 0.04 0.00 0.03 0.00 0.00 46.19 45.89 1ueb s LEU 60 CO 0.04 -0.25 1.09 -0.70 0.23 0.00 0.00 176.35 176.76 1ueb s GLU 61 N -2.90 3.28 0.40 1.70 2.12 -1.26 -1.10 118.70 120.94 1ueb s GLU 61 Ca 0.08 -0.27 -0.24 0.00 0.36 0.00 0.00 54.97 54.89 1ueb s GLU 61 Cb -0.02 -4.12 -0.09 0.00 0.26 0.00 0.00 34.13 30.16 1ueb s GLU 61 CO 0.01 -1.78 1.05 0.16 -0.54 0.00 0.00 175.26 174.16 1ueb s ASP 62 N 3.29 6.74 0.19 -1.70 -4.77 -1.26 -0.65 116.67 118.51 1ueb s ASP 62 Ca 0.32 2.04 0.07 0.00 -3.30 0.00 0.00 52.55 51.68 1ueb s ASP 62 Cb -0.11 -2.58 -0.05 0.00 -1.09 0.00 0.00 42.92 39.09 1ueb s ASP 62 CO 0.17 -0.51 -0.13 0.27 0.70 0.00 0.00 175.17 175.68 1ueb s ILE 63 N -1.67 1.58 -0.23 2.11 -4.36 -0.60 -4.78 121.20 113.25 1ueb s ILE 63 Ca 0.58 -2.17 -0.06 0.00 -0.26 0.00 0.00 60.65 58.74 1ueb s ILE 63 Cb -0.22 -2.00 -0.03 0.00 1.25 0.00 0.00 42.46 41.46 1ueb s ILE 63 CO 0.27 -0.63 0.04 -0.47 0.24 0.00 0.00 174.94 174.39 1ueb s TYR 64 N -3.07 3.07 -0.08 1.37 5.04 -1.26 -4.63 117.35 117.78 1ueb s TYR 64 Ca 0.21 -0.46 0.00 0.00 -2.44 0.00 0.00 57.07 54.39 1ueb s TYR 64 Cb 0.00 -2.16 0.02 0.00 0.35 0.00 0.00 41.96 40.17 1ueb s TYR 64 CO 0.05 -0.31 -0.07 0.08 -1.34 0.00 0.00 175.55 173.96 1ueb s VAL 65 N 1.33 0.89 -0.01 3.14 1.01 -1.26 -4.53 120.40 120.96 1ueb s VAL 65 Ca 0.05 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 61.79 1ueb s VAL 65 Cb -0.15 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 1ueb s VAL 65 CO 0.02 0.33 -0.05 -0.70 0.00 0.00 0.00 175.10 174.70 1ueb s GLU 66 N 1.34 2.66 -0.23 2.72 2.12 -0.72 -4.88 118.70 121.70 1ueb s GLU 66 Ca -0.03 -0.66 -0.08 0.00 0.36 0.00 0.00 54.97 54.57 1ueb s GLU 66 Cb -0.14 -2.57 -0.04 0.00 0.26 0.00 0.00 34.13 31.65 1ueb s GLU 66 CO -0.03 0.62 0.08 0.99 -0.54 0.00 0.00 175.26 176.38 1ueb s THR 67 N -1.00 4.58 0.16 -1.70 2.01 -1.26 0.48 115.64 118.90 1ueb s THR 67 Ca 0.17 -0.09 0.07 0.00 0.31 0.00 0.00 61.69 62.15 1ueb s THR 67 Cb -0.11 -3.12 -0.04 0.00 0.01 0.00 0.00 72.50 69.24 1ueb s THR 67 CO 0.07 0.37 -0.15 -0.13 -0.69 0.00 0.00 174.62 174.09 1ueb s ARG 68 N 1.22 1.18 -0.07 4.92 0.52 -0.47 -4.93 118.95 121.32 1ueb s ARG 68 Ca 0.05 -1.38 -0.27 0.00 -0.52 0.00 0.00 55.73 53.60 1ueb s ARG 68 Cb -0.14 -1.08 -0.03 0.00 0.52 0.00 0.00 34.95 34.22 1ueb s ARG 68 CO 0.04 0.20 0.89 -1.21 0.02 0.00 0.00 175.30 175.24 1ueb s GLU 69 N -2.99 4.45 -0.04 3.54 2.02 -1.26 -0.56 118.70 123.87 1ueb s GLU 69 Ca 0.15 1.20 0.06 0.00 0.02 0.00 0.00 54.97 56.40 1ueb s GLU 69 Cb -0.04 -3.49 -0.01 0.00 0.10 0.00 0.00 34.13 30.69 1ueb s GLU 69 CO 0.05 -0.12 -0.22 -0.51 0.02 0.00 0.00 175.26 174.48 1ueb s LEU 70 N 1.35 2.02 -0.21 1.80 1.43 0.45 -1.98 118.68 123.55 1ueb s LEU 70 Ca 0.45 -0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 53.04 1ueb s LEU 70 Cb -0.19 -1.19 -0.04 0.00 0.03 0.00 0.00 46.19 44.80 1ueb s LEU 70 CO 0.21 0.23 0.06 -1.58 0.23 0.00 0.00 176.35 175.50 1ueb s GLN 71 N -0.24 3.83 0.05 1.70 0.74 0.06 -0.26 119.66 125.55 1ueb s GLN 71 Ca 0.01 -0.41 -0.31 0.00 0.05 0.00 0.00 55.36 54.70 1ueb s GLN 71 Cb -0.11 -3.25 -0.07 0.00 1.10 0.00 0.00 33.01 30.68 1ueb s GLN 71 CO 0.02 0.08 1.40 -0.47 -0.55 0.00 0.00 175.29 175.77 1ueb s TYR 72 N 0.89 3.00 -0.22 1.67 5.04 0.03 -1.08 117.35 126.68 1ueb s TYR 72 Ca 0.04 0.86 -0.14 0.00 -2.44 0.00 0.00 57.07 55.38 1ueb s TYR 72 Cb -0.14 -3.68 -0.09 0.00 0.35 0.00 0.00 41.96 38.40 1ueb s TYR 72 CO 0.03 -2.47 -0.33 1.28 -1.34 0.00 0.00 175.55 172.72 1ueb n LEU 73 N 4.77 1.84 -3.59 6.97 4.77 0.35 -0.35 117.00 131.75 1ueb n LEU 73 Ca 0.12 0.32 -0.05 0.00 -0.03 0.00 0.00 56.01 56.37 1ueb n LEU 73 Cb 0.43 -0.74 -0.02 0.00 -2.33 0.00 0.00 43.42 40.76 1ueb n LEU 73 CO 0.59 0.22 0.87 -0.72 -1.33 0.00 0.00 177.39 177.02 1ueb s TYR 74 N -2.61 -0.19 0.35 -1.77 1.13 -1.20 -4.62 117.35 108.43 1ueb s TYR 74 Ca -0.33 0.06 -0.09 0.00 -1.41 0.00 0.00 57.07 55.31 1ueb s TYR 74 Cb 0.10 0.54 -0.06 0.00 -1.10 0.00 0.00 41.96 41.44 1ueb s TYR 74 CO 0.43 -0.41 0.68 -1.25 -2.51 0.00 0.00 175.55 172.50 1ueb s PRO 75 N -2.76 3.76 -0.34 -3.49 0.04 -1.26 -1.08 135.00 129.86 1ueb s PRO 75 Ca 0.09 0.34 0.02 0.00 0.04 0.00 0.00 61.00 61.49 1ueb s PRO 75 Cb -0.00 -2.49 0.15 0.00 0.04 0.00 0.00 34.50 32.20 1ueb s PRO 75 CO -0.05 0.09 0.36 -2.00 0.04 0.00 0.00 177.00 175.44 1ueb s GLU 76 N -3.58 0.53 7.63 4.56 2.12 0.46 -4.90 118.70 125.53 1ueb s GLU 76 Ca 0.49 -0.55 0.00 0.00 0.36 0.00 0.00 54.97 55.27 1ueb s GLU 76 Cb -0.10 -0.64 0.00 0.00 0.26 0.00 0.00 34.13 33.64 1ueb s GLU 76 CO 0.28 -1.13 0.00 0.41 -0.54 0.00 0.00 175.26 174.28 1ueb n GLY 77 N 4.66 2.96 1.38 -1.50 0.00 -1.26 -1.49 105.19 109.93 1ueb n GLY 77 Ca 0.06 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.95 1ueb n GLY 77 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ueb n GLU 78 N 13.19 3.32 -4.44 1.61 -0.58 -1.26 -4.92 120.64 127.55 1ueb n GLU 78 Ca 0.00 -2.36 -0.23 0.00 -0.42 0.00 0.00 57.16 54.15 1ueb n GLU 78 Cb 0.00 -1.81 -0.10 0.00 -0.57 0.00 0.00 31.44 28.96 1ueb n GLU 78 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1ueb s GLU 79 N -1.84 1.61 -0.11 3.49 2.02 -0.56 -1.27 118.70 122.05 1ueb s GLU 79 Ca 0.42 -1.73 0.03 0.00 0.02 0.00 0.00 54.97 53.71 1ueb s GLU 79 Cb 0.28 -1.64 0.01 0.00 0.10 0.00 0.00 34.13 32.87 1ueb s GLU 79 CO 0.20 0.30 -0.19 -1.64 0.02 0.00 0.00 175.26 173.95 1ueb s MET 80 N -3.53 2.61 -0.18 1.61 -1.94 0.16 -0.41 119.30 117.62 1ueb s MET 80 Ca 0.28 -0.72 -0.17 0.00 -1.71 0.00 0.00 55.69 53.37 1ueb s MET 80 Cb -0.04 -2.09 -0.04 0.00 2.01 0.00 0.00 34.83 34.67 1ueb s MET 80 CO 0.13 0.04 0.46 0.08 -0.01 0.00 0.00 175.02 175.73 1ueb s VAL 81 N 0.69 5.16 0.25 -6.03 1.01 -0.24 -0.09 120.40 121.15 1ueb s VAL 81 Ca -0.12 0.86 0.12 0.00 0.00 0.00 0.00 61.98 62.84 1ueb s VAL 81 Cb -0.16 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 1ueb s VAL 81 CO 0.03 0.24 -0.21 -0.36 0.00 0.00 0.00 175.10 174.79 1ueb s PHE 82 N 1.28 2.28 -0.11 5.22 0.40 0.56 -0.50 117.98 127.12 1ueb s PHE 82 Ca 0.23 -0.34 0.03 0.00 -0.60 0.00 0.00 56.93 56.25 1ueb s PHE 82 Cb -0.15 -1.03 -0.00 0.00 0.51 0.00 0.00 43.02 42.35 1ueb s PHE 82 CO 0.09 0.65 -0.22 1.41 0.70 0.00 0.00 175.22 177.85 1ueb s MET 83 N -3.26 3.10 -0.12 0.44 1.75 -0.24 -1.03 119.30 119.93 1ueb s MET 83 Ca 0.27 -0.85 -0.30 0.00 -1.25 0.00 0.00 55.69 53.57 1ueb s MET 83 Cb -0.06 -2.37 -0.02 0.00 2.84 0.00 0.00 34.83 35.22 1ueb s MET 83 CO 0.13 0.16 1.20 0.34 -0.65 0.00 0.00 175.02 176.20 1ueb s ASP 84 N 0.41 7.03 0.00 1.11 -1.08 -0.55 -0.76 116.67 122.82 1ueb s ASP 84 Ca -0.16 1.70 0.26 0.00 -0.52 0.00 0.00 52.55 53.83 1ueb s ASP 84 Cb -0.17 -2.55 1.52 0.00 -1.46 0.00 0.00 42.92 40.26 1ueb s ASP 84 CO 0.07 -0.65 1.90 0.18 0.52 0.00 0.00 175.17 177.19 1ueb n LEU 85 N 5.87 0.00 -0.05 -1.34 4.77 -0.84 -0.73 117.00 124.68 1ueb n LEU 85 Ca 0.12 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 1ueb n LEU 85 Cb 0.46 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 1ueb n LEU 85 CO 0.55 0.00 -0.86 1.21 -1.33 0.00 0.00 177.39 176.96 1ueb n GLU 86 N -0.97 0.23 0.02 3.23 4.07 -1.26 -4.78 120.64 121.17 1ueb n GLU 86 Ca 0.19 0.09 0.11 0.00 -0.06 0.00 0.00 57.16 57.49 1ueb n GLU 86 Cb 0.09 -0.96 -0.06 0.00 -0.06 0.00 0.00 31.44 30.45 1ueb n GLU 86 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1ueb n THR 87 N -3.32 0.13 -2.26 6.31 -2.24 -1.25 -4.99 114.28 106.67 1ueb n THR 87 Ca -0.20 -0.31 -0.19 0.00 -2.27 0.00 0.00 64.05 61.08 1ueb n THR 87 Cb 0.66 0.22 -0.02 0.00 -2.10 0.00 0.00 70.33 69.09 1ueb n THR 87 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1ueb n TYR 88 N -2.04 -0.79 -3.35 4.78 4.02 0.09 -4.99 117.16 114.88 1ueb n TYR 88 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.51 1ueb n TYR 88 Cb 0.47 -3.64 -0.06 0.00 -0.02 0.00 0.00 39.34 36.09 1ueb n TYR 88 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1ueb s GLU 89 N -4.77 4.11 -0.04 -0.72 2.12 -1.26 -4.78 118.70 113.36 1ueb s GLU 89 Ca 0.00 0.61 -0.14 0.00 0.36 0.00 0.00 54.97 55.80 1ueb s GLU 89 Cb 0.00 -3.24 -0.05 0.00 0.26 0.00 0.00 34.13 31.09 1ueb s GLU 89 CO 0.00 0.63 0.37 -1.14 -0.54 0.00 0.00 175.26 174.58 1ueb s GLN 90 N -1.00 3.94 -0.04 4.30 0.74 -1.26 -1.48 119.66 124.86 1ueb s GLN 90 Ca 0.27 0.32 0.04 0.00 0.05 0.00 0.00 55.36 56.03 1ueb s GLN 90 Cb -0.18 -3.26 0.00 0.00 1.10 0.00 0.00 33.01 30.67 1ueb s GLN 90 CO 0.17 0.60 -0.14 -0.06 -0.55 0.00 0.00 175.29 175.31 1ueb s PHE 91 N -0.75 1.44 -0.41 1.67 0.08 -0.20 -4.98 117.98 114.83 1ueb s PHE 91 Ca 0.22 -0.41 -0.13 0.00 0.12 0.00 0.00 56.93 56.73 1ueb s PHE 91 Cb -0.16 -0.99 0.04 0.00 -0.57 0.00 0.00 43.02 41.34 1ueb s PHE 91 CO 0.11 -0.15 0.28 0.00 -0.10 0.00 0.00 175.22 175.36 1ueb s ALA 92 N 0.13 3.39 -0.18 5.36 0.00 -1.26 -0.32 121.76 128.88 1ueb s ALA 92 Ca -0.04 -1.85 -0.06 0.00 0.00 0.00 0.00 51.96 50.01 1ueb s ALA 92 Cb -0.11 -2.79 -0.03 0.00 0.00 0.00 0.00 23.12 20.19 1ueb s ALA 92 CO 0.02 -1.51 0.02 0.08 0.00 0.00 0.00 175.76 174.36 1ueb s VAL 93 N 1.59 4.31 0.33 0.00 1.01 0.87 -4.87 120.40 123.65 1ueb s VAL 93 Ca 0.03 -0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.52 1ueb s VAL 93 Cb -0.21 -2.93 -0.12 0.00 0.00 0.00 0.00 36.38 33.13 1ueb s VAL 93 CO 0.07 0.46 1.48 -2.65 0.00 0.00 0.00 175.10 174.46 1ueb n PRO 94 N 3.76 2.53 0.04 2.72 -0.02 -1.26 0.35 135.00 143.12 1ueb n PRO 94 Ca -0.17 0.89 0.18 0.00 -2.02 0.00 0.00 63.50 62.38 1ueb n PRO 94 Cb 0.52 -2.61 0.67 0.00 -0.02 0.00 0.00 33.50 32.06 1ueb n PRO 94 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ueb h ARG 95 N 3.61 0.03 0.00 -0.52 3.08 -1.51 -0.93 114.38 118.14 1ueb h ARG 95 Ca -0.48 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 1ueb h ARG 95 Cb 1.25 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.29 1ueb h ARG 95 CO 0.70 0.02 0.00 -1.13 -1.07 0.00 0.00 179.97 178.49 1ueb n SER 96 N -4.41 0.55 -0.89 7.04 3.41 -1.26 -1.32 113.62 116.74 1ueb n SER 96 Ca 0.08 0.67 0.12 0.00 -0.26 0.00 0.00 58.87 59.48 1ueb n SER 96 Cb 0.50 -0.78 0.23 0.00 -0.26 0.00 0.00 64.21 63.91 1ueb n SER 96 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ueb n ARG 97 N -2.15 2.21 -3.81 4.33 1.74 -0.35 -4.87 116.66 113.75 1ueb n ARG 97 Ca 0.01 -1.78 -0.36 0.00 -0.77 0.00 0.00 57.85 54.95 1ueb n ARG 97 Cb 0.16 -1.47 -0.13 0.00 -1.02 0.00 0.00 32.46 30.00 1ueb n ARG 97 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ueb s VAL 98 N -1.84 3.92 0.11 1.55 1.01 -0.43 -1.05 120.40 123.67 1ueb s VAL 98 Ca 0.33 -0.32 -0.31 0.00 0.00 0.00 0.00 61.98 61.68 1ueb s VAL 98 Cb 0.21 -2.82 -0.07 0.00 0.00 0.00 0.00 36.38 33.69 1ueb s VAL 98 CO 0.31 0.36 1.33 -0.69 0.00 0.00 0.00 175.10 176.41 1ueb s VAL 99 N 1.56 3.50 -1.43 2.92 1.01 -0.17 -3.23 120.40 124.56 1ueb s VAL 99 Ca 0.06 1.09 -0.10 0.00 0.00 0.00 0.00 61.98 63.03 1ueb s VAL 99 Cb -0.15 -3.70 0.04 0.00 0.00 0.00 0.00 36.38 32.57 1ueb s VAL 99 CO 0.01 0.09 1.05 0.61 0.00 0.00 0.00 175.10 176.86 1ueb n GLY 100 N 3.30 -0.53 0.37 4.51 0.00 -1.25 -4.40 105.19 107.19 1ueb n GLY 100 Ca 0.10 0.22 0.19 0.00 0.00 0.00 0.00 46.02 46.53 1ueb n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ueb h ALA 101 N 1.00 1.95 0.00 4.61 0.00 -1.86 -0.16 119.26 124.80 1ueb h ALA 101 Ca -0.57 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1ueb h ALA 101 Cb 1.37 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1ueb h ALA 101 CO 0.60 -0.37 0.00 -0.85 0.00 0.00 0.00 179.25 178.63 1ueb n GLU 102 N -4.75 0.25 -0.31 0.00 0.00 -1.26 -2.45 120.64 112.13 1ueb n GLU 102 Ca 0.25 0.12 0.07 0.00 0.00 0.00 0.00 57.16 57.61 1ueb n GLU 102 Cb 0.75 -1.50 0.22 0.00 0.00 0.00 0.00 31.44 30.92 1ueb n GLU 102 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1ueb n PHE 103 N -1.27 0.76 -2.98 -1.84 3.72 -0.07 -4.32 117.46 111.46 1ueb n PHE 103 Ca 0.08 -0.58 -0.41 0.00 -0.05 0.00 0.00 57.45 56.49 1ueb n PHE 103 Cb 0.13 -0.10 -0.05 0.00 -0.94 0.00 0.00 39.48 38.51 1ueb n PHE 103 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1ueb s PHE 104 N -1.44 3.27 -0.03 1.38 0.40 -1.03 -5.02 117.98 115.52 1ueb s PHE 104 Ca 0.34 0.93 -0.13 0.00 -0.60 0.00 0.00 56.93 57.47 1ueb s PHE 104 Cb 0.21 -3.03 -0.05 0.00 0.51 0.00 0.00 43.02 40.66 1ueb s PHE 104 CO 0.18 -0.42 0.35 0.21 0.70 0.00 0.00 175.22 176.23 1ueb s LYS 105 N 2.76 3.80 0.21 0.44 2.20 -1.26 -4.90 119.74 122.99 1ueb s LYS 105 Ca 0.31 0.28 -0.32 0.00 -0.36 0.00 0.00 55.97 55.88 1ueb s LYS 105 Cb -0.15 -3.21 -0.13 0.00 -1.51 0.00 0.00 37.83 32.83 1ueb s LYS 105 CO 0.09 0.71 1.60 0.39 -0.36 0.00 0.00 175.35 177.79 1ueb n GLU 106 N 1.85 2.42 0.00 4.03 1.02 -1.26 -1.38 120.64 127.32 1ueb n GLU 106 Ca -0.15 0.87 0.00 0.00 -0.02 0.00 0.00 57.16 57.86 1ueb n GLU 106 Cb 0.53 -2.65 0.00 0.00 -0.02 0.00 0.00 31.44 29.30 1ueb n GLU 106 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ueb n GLY 107 N 3.22 1.97 3.78 0.62 0.00 0.52 -5.03 105.19 110.27 1ueb n GLY 107 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 1ueb n GLY 107 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1ueb s MET 108 N -0.88 3.63 -0.04 1.61 0.23 -0.48 -4.67 119.30 118.71 1ueb s MET 108 Ca 0.00 1.56 -0.02 0.00 -1.03 0.00 0.00 55.69 56.20 1ueb s MET 108 Cb 0.00 -2.15 -0.04 0.00 -1.53 0.00 0.00 34.83 31.11 1ueb s MET 108 CO 0.00 -0.61 0.10 0.95 -2.03 0.00 0.00 175.02 173.43 1ueb s THR 109 N -1.78 4.97 0.21 3.16 -4.23 -1.26 -0.78 115.64 115.93 1ueb s THR 109 Ca 0.68 -0.22 -0.00 0.00 -1.18 0.00 0.00 61.69 60.97 1ueb s THR 109 Cb -0.22 -3.24 -0.04 0.00 1.34 0.00 0.00 72.50 70.34 1ueb s THR 109 CO 0.26 0.43 0.14 0.00 -0.54 0.00 0.00 174.62 174.91 1ueb s ALA 110 N -1.15 1.27 -0.22 3.99 0.00 0.64 -4.59 121.76 121.70 1ueb s ALA 110 Ca 0.21 -1.74 -0.08 0.00 0.00 0.00 0.00 51.96 50.35 1ueb s ALA 110 Cb -0.12 1.37 -0.04 0.00 0.00 0.00 0.00 23.12 24.34 1ueb s ALA 110 CO 0.12 -0.59 0.08 -0.51 0.00 0.00 0.00 175.76 174.86 1ueb s LEU 111 N -3.19 3.70 -0.12 0.00 1.43 -0.17 -0.41 118.68 119.92 1ueb s LEU 111 Ca 0.39 -0.03 -0.03 0.00 -1.03 0.00 0.00 54.13 53.42 1ueb s LEU 111 Cb 0.07 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 1ueb s LEU 111 CO 0.13 0.07 -0.01 -0.83 0.23 0.00 0.00 176.35 175.94 1ueb s GLY 112 N 0.99 1.80 -0.29 -3.19 0.00 0.28 -0.62 107.32 106.29 1ueb s GLY 112 Ca 0.04 -0.81 -0.19 0.00 0.00 0.00 0.00 44.72 43.77 1ueb s GLY 112 CO 0.03 -0.30 0.57 0.99 0.00 0.00 0.00 173.10 174.39 1ueb s ASP 113 N -0.23 6.46 -0.21 1.64 1.01 0.08 -1.36 116.67 124.06 1ueb s ASP 113 Ca 0.05 0.44 -0.08 0.00 0.71 0.00 0.00 52.55 53.68 1ueb s ASP 113 Cb -0.13 -2.30 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 1ueb s ASP 113 CO 0.02 -0.39 0.08 -0.04 0.21 0.00 0.00 175.17 175.05 1ueb s MET 114 N 2.45 3.87 -0.10 8.23 -1.94 0.18 -0.37 119.30 131.62 1ueb s MET 114 Ca 0.23 -0.38 0.01 0.00 -1.71 0.00 0.00 55.69 53.84 1ueb s MET 114 Cb -0.15 -3.30 0.02 0.00 2.01 0.00 0.00 34.83 33.40 1ueb s MET 114 CO 0.11 0.08 -0.14 -0.47 -0.01 0.00 0.00 175.02 174.59 1ueb s TYR 115 N 0.91 1.84 -1.45 -0.03 5.04 -0.25 -1.76 117.35 121.64 1ueb s TYR 115 Ca 0.04 -0.85 -0.07 0.00 -2.44 0.00 0.00 57.07 53.75 1ueb s TYR 115 Cb -0.14 -1.35 0.03 0.00 0.35 0.00 0.00 41.96 40.86 1ueb s TYR 115 CO 0.03 -0.45 0.61 0.39 -1.34 0.00 0.00 175.55 174.78 1ueb n GLU 116 N 4.24 -4.54 -0.98 4.97 1.02 -1.26 -1.99 120.64 122.09 1ueb n GLU 116 Ca -0.19 0.74 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 1ueb n GLU 116 Cb 0.51 -5.57 0.00 0.00 -0.02 0.00 0.00 31.44 26.37 1ueb n GLU 116 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ueb n GLY 117 N -1.43 0.91 3.23 0.62 0.00 -1.26 -5.03 105.19 102.22 1ueb n GLY 117 Ca -0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 1ueb n GLY 117 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ueb s GLN 118 N -0.02 1.08 0.15 1.61 -1.52 -0.84 -5.07 119.66 115.05 1ueb s GLN 118 Ca 0.00 -1.00 -0.31 0.00 -1.95 0.00 0.00 55.36 52.11 1ueb s GLN 118 Cb 0.00 -1.21 -0.08 0.00 -0.22 0.00 0.00 33.01 31.50 1ueb s GLN 118 CO 0.00 0.29 1.34 -2.14 -0.25 0.00 0.00 175.29 174.53 1ueb s PRO 119 N -1.58 4.36 -0.01 2.91 0.02 -1.26 -1.09 135.00 138.35 1ueb s PRO 119 Ca 0.04 2.04 0.14 0.00 0.02 0.00 0.00 61.00 63.24 1ueb s PRO 119 Cb -0.09 -3.23 -0.17 0.00 0.02 0.00 0.00 34.50 31.02 1ueb s PRO 119 CO 0.03 -0.34 0.46 0.44 -0.33 0.00 0.00 177.00 177.26 1ueb n ILE 120 N 3.32 0.00 -3.60 2.83 -5.35 0.50 -4.92 119.36 112.14 1ueb n ILE 120 Ca 0.09 -0.24 -0.13 0.00 -0.27 0.00 0.00 62.75 62.20 1ueb n ILE 120 Cb 0.43 0.66 -0.06 0.00 -1.74 0.00 0.00 39.64 38.92 1ueb n ILE 120 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1ueb s LYS 121 N -2.56 0.75 -0.09 6.28 2.20 -1.24 -4.77 119.74 120.30 1ueb s LYS 121 Ca 0.01 0.57 0.01 0.00 -0.36 0.00 0.00 55.97 56.19 1ueb s LYS 121 Cb 0.10 0.36 0.02 0.00 -1.51 0.00 0.00 37.83 36.79 1ueb s LYS 121 CO 0.56 -0.15 -0.10 0.08 -0.36 0.00 0.00 175.35 175.38 1ueb s VAL 122 N -0.27 1.08 -0.13 4.02 1.01 -0.21 -0.74 120.40 125.16 1ueb s VAL 122 Ca -0.02 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1ueb s VAL 122 Cb -0.03 -1.05 0.02 0.00 0.00 0.00 0.00 36.38 35.32 1ueb s VAL 122 CO 0.01 0.36 -0.15 -0.89 0.00 0.00 0.00 175.10 174.44 1ueb s THR 123 N 1.26 1.53 0.81 3.92 2.01 0.21 -1.00 115.64 124.38 1ueb s THR 123 Ca -0.03 -0.63 -0.10 0.00 0.31 0.00 0.00 61.69 61.23 1ueb s THR 123 Cb -0.14 -1.42 0.11 0.00 0.01 0.00 0.00 72.50 71.07 1ueb s THR 123 CO -0.03 0.45 1.15 -2.16 -0.69 0.00 0.00 174.62 173.33 1ueb s PRO 124 N 1.22 1.64 0.74 4.92 0.04 -1.26 -1.00 135.00 141.30 1ueb s PRO 124 Ca -0.01 -0.28 -0.15 0.00 0.04 0.00 0.00 61.00 60.60 1ueb s PRO 124 Cb -0.14 -2.03 0.04 0.00 0.04 0.00 0.00 34.50 32.41 1ueb s PRO 124 CO -0.06 -1.69 1.24 -2.14 0.04 0.00 0.00 177.00 174.39 1ueb s PRO 125 N -5.51 2.04 0.34 0.56 0.02 -1.26 -4.87 135.00 126.32 1ueb s PRO 125 Ca 0.65 1.89 0.05 0.00 0.02 0.00 0.00 61.00 63.61 1ueb s PRO 125 Cb -0.08 -1.81 0.69 0.00 0.02 0.00 0.00 34.50 33.31 1ueb s PRO 125 CO 0.48 -1.94 1.92 1.79 -0.33 0.00 0.00 177.00 178.92 1ueb h THR 126 N -0.26 0.99 -3.31 0.99 1.35 -1.95 -3.40 112.91 107.32 1ueb h THR 126 Ca -0.48 -0.29 -0.62 0.00 -0.55 0.00 0.00 66.41 64.47 1ueb h THR 126 Cb 1.31 0.08 -0.34 0.00 -1.73 0.00 0.00 68.15 67.48 1ueb h THR 126 CO 0.49 0.15 -0.85 -0.69 -0.25 0.00 0.00 175.52 174.37 1ueb s VAL 127 N -5.76 1.71 0.21 6.82 1.01 -1.26 -0.15 120.40 122.98 1ueb s VAL 127 Ca -0.10 -0.79 0.09 0.00 0.00 0.00 0.00 61.98 61.17 1ueb s VAL 127 Cb 0.20 -1.52 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 1ueb s VAL 127 CO 0.79 0.48 -0.17 0.68 0.00 0.00 0.00 175.10 176.88 1ueb s VAL 128 N 0.67 1.93 -0.19 2.92 -7.23 -0.57 -4.93 120.40 113.00 1ueb s VAL 128 Ca -0.13 -2.15 -0.06 0.00 -1.81 0.00 0.00 61.98 57.83 1ueb s VAL 128 Cb -0.16 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.71 1ueb s VAL 128 CO 0.03 -0.45 0.04 -1.61 -0.31 0.00 0.00 175.10 172.80 1ueb s GLU 129 N -3.32 3.83 0.03 4.82 2.02 -1.26 -0.80 118.70 124.03 1ueb s GLU 129 Ca 0.22 -0.41 0.02 0.00 0.02 0.00 0.00 54.97 54.82 1ueb s GLU 129 Cb -0.03 -3.17 -0.02 0.00 0.10 0.00 0.00 34.13 31.01 1ueb s GLU 129 CO 0.08 0.17 -0.08 -0.51 0.02 0.00 0.00 175.26 174.94 1ueb s LEU 130 N 0.64 2.20 0.10 1.80 1.43 -0.31 -4.95 118.68 119.60 1ueb s LEU 130 Ca 0.02 -0.46 -0.22 0.00 -1.03 0.00 0.00 54.13 52.44 1ueb s LEU 130 Cb -0.13 -0.22 -0.07 0.00 0.03 0.00 0.00 46.19 45.80 1ueb s LEU 130 CO 0.02 -0.14 0.65 -0.75 0.23 0.00 0.00 176.35 176.36 1ueb s LYS 131 N -1.28 4.35 -0.17 1.70 2.20 -1.26 -0.22 119.74 125.07 1ueb s LYS 131 Ca -0.07 0.89 -0.25 0.00 -0.36 0.00 0.00 55.97 56.18 1ueb s LYS 131 Cb -0.08 -3.26 -0.01 0.00 -1.51 0.00 0.00 37.83 32.96 1ueb s LYS 131 CO 0.00 0.58 0.84 0.08 -0.36 0.00 0.00 175.35 176.49 1ueb s VAL 132 N -1.02 4.88 -0.04 4.02 1.01 -0.05 -0.76 120.40 128.45 1ueb s VAL 132 Ca 0.32 1.64 0.18 0.00 0.00 0.00 0.00 61.98 64.12 1ueb s VAL 132 Cb -0.21 -4.14 -0.27 0.00 0.00 0.00 0.00 36.38 31.76 1ueb s VAL 132 CO 0.21 0.03 0.39 1.33 0.00 0.00 0.00 175.10 177.06 1ueb n VAL 133 N 4.72 0.00 -3.67 2.92 0.24 -0.18 0.64 118.33 123.01 1ueb n VAL 133 Ca 0.04 -0.40 -0.08 0.00 -2.04 0.00 0.00 64.34 61.87 1ueb n VAL 133 Cb 0.49 0.11 -0.09 0.00 -1.47 0.00 0.00 33.84 32.89 1ueb n VAL 133 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1ueb s ASP 134 N -4.00 -0.56 -0.15 -1.34 2.15 -1.07 -4.72 116.67 106.98 1ueb s ASP 134 Ca -0.06 1.13 -0.29 0.00 0.43 0.00 0.00 52.55 53.75 1ueb s ASP 134 Cb 0.11 1.33 0.10 0.00 -0.30 0.00 0.00 42.92 44.16 1ueb s ASP 134 CO 0.73 -0.22 0.88 0.28 -0.17 0.00 0.00 175.17 176.67 1ueb s THR 135 N 2.16 0.00 0.23 1.71 -1.32 -1.26 -0.06 115.64 117.10 1ueb s THR 135 Ca -0.06 0.00 -0.32 0.00 -1.21 0.00 0.00 61.69 60.10 1ueb s THR 135 Cb -0.10 -1.00 -0.13 0.00 -1.51 0.00 0.00 72.50 69.77 1ueb s THR 135 CO -0.15 0.00 1.61 -2.65 -2.21 0.00 0.00 174.62 171.22 1ueb n PRO 136 N 1.10 2.51 -2.19 7.08 -0.02 -1.26 -4.64 135.00 137.57 1ueb n PRO 136 Ca -0.14 0.90 -0.38 0.00 -2.02 0.00 0.00 63.50 61.86 1ueb n PRO 136 Cb 0.57 -2.68 -0.01 0.00 -0.02 0.00 0.00 33.50 31.37 1ueb n PRO 136 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1ueb s PRO 137 N 0.37 3.79 3.61 0.52 0.02 -1.26 -4.64 135.00 137.41 1ueb s PRO 137 Ca 0.71 1.89 0.00 0.00 0.02 0.00 0.00 61.00 63.63 1ueb s PRO 137 Cb -0.56 -2.51 0.00 0.00 0.02 0.00 0.00 34.50 31.45 1ueb s PRO 137 CO 0.41 -0.56 0.00 0.41 -0.33 0.00 0.00 177.00 176.93 1ueb n GLY 138 N 0.55 0.62 1.86 0.52 0.00 -1.26 -3.62 105.19 103.87 1ueb n GLY 138 Ca 0.06 -0.76 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 1ueb n GLY 138 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ueb n VAL 139 N 0.00 2.63 -2.59 1.61 0.24 -1.26 -4.71 118.33 114.24 1ueb n VAL 139 Ca 0.00 -1.42 -0.42 0.00 -2.04 0.00 0.00 64.34 60.46 1ueb n VAL 139 Cb 0.00 -1.55 0.01 0.00 -1.47 0.00 0.00 33.84 30.82 1ueb n VAL 139 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1ueb n ARG 140 N 1.22 4.13 -1.48 7.34 1.74 -1.24 -5.01 116.66 123.35 1ueb n ARG 140 Ca 0.25 -3.99 -0.31 0.00 -0.77 0.00 0.00 57.85 53.03 1ueb n ARG 140 Cb 0.61 -2.72 0.07 0.00 -1.02 0.00 0.00 32.46 29.40 1ueb n ARG 140 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1ueb s GLY 141 N -0.36 1.77 0.29 -0.13 0.00 -1.26 -4.72 107.32 102.90 1ueb s GLY 141 Ca 0.37 0.25 0.26 0.00 0.00 0.00 0.00 44.72 45.60 1ueb s GLY 141 CO 0.03 0.58 1.75 1.29 0.00 0.00 0.00 173.10 176.76 1ueb h ASP 142 N -0.73 0.00 -1.88 1.64 2.03 -1.96 -3.44 116.42 112.09 1ueb h ASP 142 Ca -0.44 0.00 -0.57 0.00 -0.73 0.00 0.00 57.03 55.29 1ueb h ASP 142 Cb 1.23 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 39.63 1ueb h ASP 142 CO 0.54 0.00 -0.58 0.42 -1.03 0.00 0.00 179.24 178.59 1ueb s THR 143 N -3.22 2.74 0.04 1.15 -4.23 -1.26 -5.06 115.64 105.80 1ueb s THR 143 Ca 0.08 -1.85 -0.20 0.00 -1.18 0.00 0.00 61.69 58.55 1ueb s THR 143 Cb 0.10 -2.88 -0.14 0.00 1.34 0.00 0.00 72.50 70.92 1ueb s THR 143 CO 0.55 -0.17 1.33 0.58 -0.54 0.00 0.00 174.62 176.37 1ueb h VAL 144 N 1.68 1.35 -0.01 2.29 2.07 -2.00 -3.37 116.25 118.27 1ueb h VAL 144 Ca -0.43 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 65.70 1ueb h VAL 144 Cb 1.25 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.92 1ueb h VAL 144 CO 0.66 0.41 -0.09 -1.20 0.02 0.00 0.00 177.57 177.37 1ueb n SER 145 N -4.49 1.56 -4.64 0.57 7.64 -1.26 -5.02 113.62 107.98 1ueb n SER 145 Ca -0.06 -1.28 -0.30 0.00 1.01 0.00 0.00 58.87 58.24 1ueb n SER 145 Cb 0.40 0.21 0.18 0.00 -1.01 0.00 0.00 64.21 63.98 1ueb n SER 145 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1ueb s GLY 146 N -1.06 1.64 -0.03 0.23 0.00 -1.26 -4.95 107.32 101.89 1ueb s GLY 146 Ca 0.10 0.26 0.15 0.00 0.00 0.00 0.00 44.72 45.23 1ueb s GLY 146 CO 0.18 0.76 1.37 0.61 0.00 0.00 0.00 173.10 176.02 1ueb n GLY 147 N 0.00 2.82 3.24 0.20 0.00 -1.26 -4.94 105.19 105.25 1ueb n GLY 147 Ca 0.08 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.40 1ueb n GLY 147 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ueb s SER 148 N -1.07 0.84 0.05 1.61 1.04 -1.26 -2.62 113.70 112.29 1ueb s SER 148 Ca 0.33 -1.28 -0.04 0.00 0.48 0.00 0.00 55.95 55.44 1ueb s SER 148 Cb 0.19 0.21 -0.02 0.00 0.10 0.00 0.00 66.02 66.50 1ueb s SER 148 CO 0.20 -0.70 0.06 -1.59 0.98 0.00 0.00 173.24 172.20 1ueb s LYS 149 N -4.02 0.65 0.36 4.02 -2.85 0.44 -4.05 119.74 114.29 1ueb s LYS 149 Ca 0.31 -0.98 -0.26 0.00 -1.00 0.00 0.00 55.97 54.03 1ueb s LYS 149 Cb 0.07 0.24 -0.09 0.00 -2.06 0.00 0.00 37.83 35.99 1ueb s LYS 149 CO 0.08 -0.16 1.11 -2.14 0.10 0.00 0.00 175.35 174.34 1ueb s PRO 150 N -3.38 4.28 -0.03 1.78 0.02 -1.26 -0.55 135.00 135.87 1ueb s PRO 150 Ca 0.02 1.74 -0.00 0.00 0.02 0.00 0.00 61.00 62.77 1ueb s PRO 150 Cb 0.03 -2.81 0.03 0.00 0.02 0.00 0.00 34.50 31.78 1ueb s PRO 150 CO -0.08 -0.09 0.03 0.00 -0.33 0.00 0.00 177.00 176.53 1ueb s ALA 151 N -1.40 0.18 -0.09 -1.55 0.00 0.24 -4.31 121.76 114.83 1ueb s ALA 151 Ca 0.53 0.24 -0.23 0.00 0.00 0.00 0.00 51.96 52.51 1ueb s ALA 151 Cb -0.29 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1ueb s ALA 151 CO 0.36 -0.19 0.67 0.99 0.00 0.00 0.00 175.76 177.59 1ueb s THR 152 N 1.33 5.06 0.53 0.00 2.01 0.91 -1.52 115.64 123.95 1ueb s THR 152 Ca -0.06 1.36 0.01 0.00 0.31 0.00 0.00 61.69 63.31 1ueb s THR 152 Cb -0.13 -4.01 0.03 0.00 0.01 0.00 0.00 72.50 68.40 1ueb s THR 152 CO -0.03 0.24 0.75 -0.76 -0.69 0.00 0.00 174.62 174.13 1ueb s LEU 153 N 0.95 3.36 0.55 4.42 1.43 0.14 -1.01 118.68 128.52 1ueb s LEU 153 Ca 0.35 0.04 0.34 0.00 -1.03 0.00 0.00 54.13 53.84 1ueb s LEU 153 Cb -0.17 -2.93 1.87 0.00 0.03 0.00 0.00 46.19 45.00 1ueb s LEU 153 CO 0.16 -1.05 2.05 1.05 0.23 0.00 0.00 176.35 178.79 1ueb h GLU 154 N 0.15 0.00 -0.00 1.70 4.11 -1.26 -0.17 114.58 119.10 1ueb h GLU 154 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1ueb h GLU 154 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1ueb h GLU 154 CO 0.53 0.00 -0.39 0.25 0.07 0.00 0.00 179.01 179.47 1ueb n THR 155 N -2.76 0.00 0.00 -1.06 -2.24 -1.26 -4.93 114.28 102.02 1ueb n THR 155 Ca -0.02 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1ueb n THR 155 Cb 0.12 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 1ueb n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ueb n GLY 156 N 1.42 2.47 3.76 3.38 0.00 -0.08 -4.98 105.19 111.17 1ueb n GLY 156 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 1ueb n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ueb s ALA 157 N -2.68 2.58 -0.10 4.61 0.00 -1.26 -4.67 121.76 120.24 1ueb s ALA 157 Ca 0.00 0.84 0.03 0.00 0.00 0.00 0.00 51.96 52.84 1ueb s ALA 157 Cb 0.00 -3.39 0.01 0.00 0.00 0.00 0.00 23.12 19.74 1ueb s ALA 157 CO 0.00 -1.03 -0.20 0.08 0.00 0.00 0.00 175.76 174.61 1ueb s VAL 158 N -1.81 1.78 0.07 0.00 1.01 -1.26 0.24 120.40 120.43 1ueb s VAL 158 Ca 0.73 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1ueb s VAL 158 Cb -0.26 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 1ueb s VAL 158 CO 0.32 0.50 -0.05 0.68 0.00 0.00 0.00 175.10 176.55 1ueb s VAL 159 N 0.51 0.46 0.13 2.92 -7.23 -0.57 -4.92 120.40 111.69 1ueb s VAL 159 Ca -0.16 -1.76 -0.29 0.00 -1.81 0.00 0.00 61.98 57.95 1ueb s VAL 159 Cb -0.17 -1.46 -0.06 0.00 0.56 0.00 0.00 36.38 35.25 1ueb s VAL 159 CO 0.06 -0.87 0.93 -1.10 -0.31 0.00 0.00 175.10 173.81 1ueb s GLN 160 N -3.57 4.70 0.11 4.82 -1.52 -1.26 -0.59 119.66 122.36 1ueb s GLN 160 Ca 0.07 1.40 0.05 0.00 -1.95 0.00 0.00 55.36 54.92 1ueb s GLN 160 Cb 0.04 -3.35 -0.04 0.00 -0.22 0.00 0.00 33.01 29.44 1ueb s GLN 160 CO -0.06 0.29 -0.11 0.14 -0.25 0.00 0.00 175.29 175.30 1ueb s VAL 161 N -0.27 1.11 0.85 1.09 -7.23 0.29 -4.37 120.40 111.87 1ueb s VAL 161 Ca 0.44 -1.74 -0.12 0.00 -1.81 0.00 0.00 61.98 58.75 1ueb s VAL 161 Cb -0.23 -1.50 0.09 0.00 0.56 0.00 0.00 36.38 35.29 1ueb s VAL 161 CO 0.29 -0.55 1.05 -2.65 -0.31 0.00 0.00 175.10 172.93 1ueb n PRO 162 N 0.41 -0.07 0.29 4.82 -0.02 -1.26 -0.42 135.00 138.75 1ueb n PRO 162 Ca -0.15 0.05 0.16 0.00 -2.02 0.00 0.00 63.50 61.54 1ueb n PRO 162 Cb 0.58 -2.31 0.87 0.00 -0.02 0.00 0.00 33.50 32.62 1ueb n PRO 162 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1ueb h LEU 163 N -1.26 0.00 -0.01 2.45 3.38 -1.83 -2.36 115.31 115.68 1ueb h LEU 163 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1ueb h LEU 163 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1ueb h LEU 163 CO 0.43 0.06 -0.00 2.22 0.09 0.00 0.00 178.44 181.23 1ueb n PHE 164 N -3.51 0.00 -2.93 1.13 1.16 -1.26 -4.37 117.46 107.68 1ueb n PHE 164 Ca -0.02 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.16 1ueb n PHE 164 Cb 0.18 -0.21 -0.05 0.00 -1.61 0.00 0.00 39.48 37.79 1ueb n PHE 164 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1ueb s VAL 165 N -2.42 4.69 0.32 1.97 1.01 -0.89 -5.03 120.40 120.04 1ueb s VAL 165 Ca 0.33 1.72 0.11 0.00 0.00 0.00 0.00 61.98 64.14 1ueb s VAL 165 Cb 0.21 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.37 1ueb s VAL 165 CO 0.44 0.35 -0.13 -1.61 0.00 0.00 0.00 175.10 174.14 1ueb s GLU 166 N -0.01 1.78 0.31 2.72 0.41 -1.26 -4.76 118.70 117.88 1ueb s GLU 166 Ca 0.40 -1.85 -0.29 0.00 -0.41 0.00 0.00 54.97 52.82 1ueb s GLU 166 Cb -0.21 -1.75 -0.12 0.00 -1.78 0.00 0.00 34.13 30.27 1ueb s GLU 166 CO 0.24 0.22 1.39 -2.30 -0.49 0.00 0.00 175.26 174.33 1ueb n PRO 167 N -0.73 2.25 0.00 0.39 -0.02 -1.26 -1.87 135.00 133.76 1ueb n PRO 167 Ca -0.05 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1ueb n PRO 167 Cb 0.62 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1ueb n PRO 167 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ueb n GLY 168 N 1.39 1.66 3.76 -1.23 0.00 0.21 -5.01 105.19 105.97 1ueb n GLY 168 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1ueb n GLY 168 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ueb s GLU 169 N -0.69 4.72 -0.13 1.61 2.12 -0.78 -4.69 118.70 120.86 1ueb s GLU 169 Ca 0.00 1.50 -0.19 0.00 0.36 0.00 0.00 54.97 56.65 1ueb s GLU 169 Cb 0.00 -3.11 -0.04 0.00 0.26 0.00 0.00 34.13 31.24 1ueb s GLU 169 CO 0.00 0.38 0.50 0.08 -0.54 0.00 0.00 175.26 175.67 1ueb s VAL 170 N -1.31 5.17 0.39 3.70 1.01 -1.26 -0.87 120.40 127.23 1ueb s VAL 170 Ca 0.45 0.98 0.08 0.00 0.00 0.00 0.00 61.98 63.48 1ueb s VAL 170 Cb -0.25 -3.83 -0.07 0.00 0.00 0.00 0.00 36.38 32.23 1ueb s VAL 170 CO 0.31 0.29 0.03 0.27 0.00 0.00 0.00 175.10 176.01 1ueb s ILE 171 N 0.83 2.20 -0.16 2.22 -4.36 0.70 -1.20 121.20 121.42 1ueb s ILE 171 Ca 0.26 -1.95 -0.06 0.00 -0.26 0.00 0.00 60.65 58.63 1ueb s ILE 171 Cb -0.15 -2.92 -0.04 0.00 1.25 0.00 0.00 42.46 40.60 1ueb s ILE 171 CO 0.11 -0.06 0.06 -0.54 0.24 0.00 0.00 174.94 174.75 1ueb s LYS 172 N -3.74 3.77 -0.06 0.37 1.02 0.13 -1.16 119.74 120.08 1ueb s LYS 172 Ca 0.36 -0.33 0.04 0.00 0.02 0.00 0.00 55.97 56.06 1ueb s LYS 172 Cb 0.06 -3.14 0.00 0.00 -0.52 0.00 0.00 37.83 34.23 1ueb s LYS 172 CO 0.19 0.39 -0.17 0.08 -0.92 0.00 0.00 175.35 174.92 1ueb s VAL 173 N 0.03 1.46 -0.31 3.17 1.01 0.02 -1.20 120.40 124.58 1ueb s VAL 173 Ca 0.06 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 61.05 1ueb s VAL 173 Cb -0.12 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 35.00 1ueb s VAL 173 CO 0.01 0.42 1.00 -0.62 0.00 0.00 0.00 175.10 175.91 1ueb s ASP 174 N 0.23 6.88 0.34 3.32 -1.08 -0.03 -1.51 116.67 124.82 1ueb s ASP 174 Ca -0.09 0.97 0.27 0.00 -0.52 0.00 0.00 52.55 53.18 1ueb s ASP 174 Cb -0.14 -2.51 1.00 0.00 -1.46 0.00 0.00 42.92 39.81 1ueb s ASP 174 CO 0.04 -0.80 1.79 0.71 0.52 0.00 0.00 175.17 177.43 1ueb h THR 175 N 5.68 0.00 0.15 1.71 1.35 -0.78 0.51 112.91 121.53 1ueb h THR 175 Ca -0.21 -0.42 -0.22 0.00 -0.55 0.00 0.00 66.41 65.01 1ueb h THR 175 Cb 1.07 1.30 0.03 0.00 -1.73 0.00 0.00 68.15 68.81 1ueb h THR 175 CO 0.99 0.00 -0.96 0.03 -0.25 0.00 0.00 175.52 175.33 1ueb h ARG 176 N 0.00 0.38 0.00 4.72 2.47 -1.91 -3.34 114.38 116.71 1ueb h ARG 176 Ca 0.00 -0.61 0.00 0.00 -1.26 0.00 0.00 59.98 58.11 1ueb h ARG 176 Cb 0.53 0.22 0.00 0.00 -1.65 0.00 0.00 29.97 29.07 1ueb h ARG 176 CO 0.00 1.28 -1.75 0.25 0.56 0.00 0.00 179.97 180.32 1ueb n THR 177 N -4.03 0.03 -2.32 2.04 -2.24 -1.19 -4.96 114.28 101.60 1ueb n THR 177 Ca -0.14 -0.40 -0.09 0.00 -2.27 0.00 0.00 64.05 61.15 1ueb n THR 177 Cb 0.88 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1ueb n THR 177 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ueb n GLY 178 N 1.30 0.10 3.37 3.38 0.00 0.18 -5.04 105.19 108.49 1ueb n GLY 178 Ca -0.02 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.28 1ueb n GLY 178 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ueb s GLU 179 N -4.64 1.39 0.24 1.61 2.02 -1.16 -4.89 118.70 113.27 1ueb s GLU 179 Ca 0.05 -1.52 -0.30 0.00 0.02 0.00 0.00 54.97 53.22 1ueb s GLU 179 Cb -0.02 -1.44 -0.10 0.00 0.10 0.00 0.00 34.13 32.67 1ueb s GLU 179 CO 0.06 0.28 1.36 -0.47 0.02 0.00 0.00 175.26 176.51 1ueb s TYR 180 N -2.25 3.13 0.00 1.61 5.04 -1.26 -0.85 117.35 122.77 1ueb s TYR 180 Ca 0.20 1.19 0.00 0.00 -2.44 0.00 0.00 57.07 56.02 1ueb s TYR 180 Cb -0.05 -3.69 0.00 0.00 0.35 0.00 0.00 41.96 38.57 1ueb s TYR 180 CO 0.09 -2.16 0.20 1.33 -1.34 0.00 0.00 175.55 173.67 1ueb n VAL 181 N 2.15 0.00 0.00 3.14 0.24 -0.34 -4.88 118.33 118.64 1ueb n VAL 181 Ca 0.05 -0.39 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 1ueb n VAL 181 Cb 0.42 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.90 1ueb n VAL 181 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ueb n GLY 182 N 0.37 0.06 3.86 7.63 0.00 -1.23 -4.98 105.19 110.90 1ueb n GLY 182 Ca 0.00 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.33 1ueb n GLY 182 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ueb s ARG 183 N -1.91 3.83 0.00 1.61 0.52 -1.26 0.22 118.95 121.96 1ueb s ARG 183 Ca 0.00 0.28 0.26 0.00 -0.52 0.00 0.00 55.73 55.75 1ueb s ARG 183 Cb 0.00 -2.91 1.53 0.00 0.52 0.00 0.00 34.95 34.09 1ueb s ARG 183 CO 0.00 0.49 1.89 0.00 0.02 0.00 0.00 175.30 177.69