#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2af2 n THR 2 N 0.00 3.02 -3.60 0.00 -2.24 -0.99 -4.14 114.28 106.32 2af2 n THR 2 Ca 0.00 -1.67 -0.11 0.00 -2.27 0.00 0.00 64.05 60.00 2af2 n THR 2 Cb 0.00 -2.16 -0.06 0.00 -2.10 0.00 0.00 70.33 66.01 2af2 n THR 2 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2af2 s LYS 3 N 1.94 0.63 0.10 -0.78 2.20 -1.26 -4.61 119.74 117.96 2af2 s LYS 3 Ca 0.57 0.44 -0.25 0.00 -0.36 0.00 0.00 55.97 56.37 2af2 s LYS 3 Cb 0.21 0.30 0.08 0.00 -1.51 0.00 0.00 37.83 36.91 2af2 s LYS 3 CO -0.02 -0.14 0.67 0.00 -0.36 0.00 0.00 175.35 175.50 2af2 s ALA 4 N -0.38 -1.66 -0.02 3.13 0.00 0.19 -1.71 121.76 121.32 2af2 s ALA 4 Ca -0.00 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.64 2af2 s ALA 4 Cb -0.03 0.69 0.02 0.00 0.00 0.00 0.00 23.12 23.81 2af2 s ALA 4 CO -0.01 -0.71 0.02 0.08 0.00 0.00 0.00 175.76 175.14 2af2 s VAL 5 N -3.34 -0.05 -0.25 0.00 1.01 0.32 -0.83 120.40 117.26 2af2 s VAL 5 Ca 0.00 0.17 -0.09 0.00 0.00 0.00 0.00 61.98 62.07 2af2 s VAL 5 Cb -0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 36.38 36.27 2af2 s VAL 5 CO -0.10 0.07 0.12 0.00 0.00 0.00 0.00 175.10 175.19 2af2 s ALA 6 N 0.85 3.34 -0.74 5.51 0.00 -0.12 -1.22 121.76 129.38 2af2 s ALA 6 Ca -0.07 -1.07 -0.07 0.00 0.00 0.00 0.00 51.96 50.75 2af2 s ALA 6 Cb -0.10 -2.23 0.19 0.00 0.00 0.00 0.00 23.12 20.98 2af2 s ALA 6 CO -0.02 -0.44 0.61 0.08 0.00 0.00 0.00 175.76 175.99 2af2 s VAL 7 N 1.53 4.53 -0.36 0.00 1.01 -0.92 -3.23 120.40 122.96 2af2 s VAL 7 Ca 0.06 -2.89 -0.12 0.00 0.00 0.00 0.00 61.98 59.04 2af2 s VAL 7 Cb -0.15 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.37 2af2 s VAL 7 CO 0.06 -0.96 0.22 -0.76 0.00 0.00 0.00 175.10 173.66 2af2 s LEU 8 N -0.14 4.61 -0.15 3.92 1.02 -0.44 -3.57 118.68 123.93 2af2 s LEU 8 Ca 0.19 -0.71 -0.16 0.00 0.02 0.00 0.00 54.13 53.47 2af2 s LEU 8 Cb -0.15 -2.08 0.04 0.00 0.02 0.00 0.00 46.19 44.02 2af2 s LEU 8 CO -0.06 -0.31 0.44 -0.54 0.02 0.00 0.00 176.35 175.89 2af2 s LYS 9 N 1.64 0.54 0.00 1.70 1.02 -1.16 -0.96 119.74 122.52 2af2 s LYS 9 Ca 0.04 0.53 0.00 0.00 0.02 0.00 0.00 55.97 56.57 2af2 s LYS 9 Cb -0.18 0.26 0.00 0.00 -0.52 0.00 0.00 37.83 37.39 2af2 s LYS 9 CO 0.08 -0.08 0.00 0.41 -0.92 0.00 0.00 175.35 174.84 2af2 n GLY 10 N 2.65 0.00 3.25 -3.33 0.00 -1.26 -4.73 105.19 101.77 2af2 n GLY 10 Ca -0.14 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.86 2af2 n GLY 10 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2af2 s ASP 11 N 0.00 -0.80 0.00 1.61 2.15 -1.26 -4.57 116.67 113.79 2af2 s ASP 11 Ca 0.00 0.94 0.00 0.00 0.43 0.00 0.00 52.55 53.92 2af2 s ASP 11 Cb 0.00 1.85 0.00 0.00 -0.30 0.00 0.00 42.92 44.47 2af2 s ASP 11 CO 0.00 -0.25 0.00 0.61 -0.17 0.00 0.00 175.17 175.36 2af2 n GLY 12 N 5.41 0.18 0.76 2.66 0.00 -1.26 -0.88 105.19 112.07 2af2 n GLY 12 Ca -0.06 0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.07 2af2 n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2af2 n PRO 13 N 0.74 1.96 -3.44 1.61 -0.04 -1.26 -4.98 135.00 129.59 2af2 n PRO 13 Ca 0.00 -1.49 -0.38 0.00 -0.04 0.00 0.00 63.50 61.59 2af2 n PRO 13 Cb 0.00 -1.33 -0.06 0.00 -0.04 0.00 0.00 33.50 32.07 2af2 n PRO 13 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2af2 s VAL 14 N -1.46 5.00 0.01 0.52 1.01 -0.06 -4.50 120.40 120.92 2af2 s VAL 14 Ca 0.28 0.92 0.04 0.00 0.00 0.00 0.00 61.98 63.22 2af2 s VAL 14 Cb 0.15 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 2af2 s VAL 14 CO 0.19 0.54 -0.13 -1.10 0.00 0.00 0.00 175.10 174.61 2af2 s GLN 15 N -0.85 0.93 -0.11 2.72 1.11 -0.02 -4.49 119.66 118.95 2af2 s GLN 15 Ca 0.25 -0.56 0.03 0.00 0.01 0.00 0.00 55.36 55.09 2af2 s GLN 15 Cb -0.17 -0.91 0.00 0.00 -1.01 0.00 0.00 33.01 30.92 2af2 s GLN 15 CO 0.14 0.24 -0.23 0.20 0.01 0.00 0.00 175.29 175.64 2af2 s GLY 16 N -0.65 1.34 -0.23 3.09 0.00 -0.14 -0.68 107.32 110.06 2af2 s GLY 16 Ca 0.03 -1.01 -0.03 0.00 0.00 0.00 0.00 44.72 43.71 2af2 s GLY 16 CO 0.00 -0.23 0.07 -1.50 0.00 0.00 0.00 173.10 171.44 2af2 s ILE 17 N 0.49 0.36 -0.04 0.90 1.10 -0.26 -1.32 121.20 122.43 2af2 s ILE 17 Ca -0.15 -0.66 0.01 0.00 -0.51 0.00 0.00 60.65 59.33 2af2 s ILE 17 Cb -0.17 -1.04 0.02 0.00 0.15 0.00 0.00 42.46 41.41 2af2 s ILE 17 CO 0.06 -0.40 -0.04 -0.63 -2.11 0.00 0.00 174.94 171.81 2af2 s ILE 18 N 1.92 0.47 0.14 2.00 -1.09 -1.20 -0.85 121.20 122.58 2af2 s ILE 18 Ca 0.03 -0.11 0.02 0.00 -2.23 0.00 0.00 60.65 58.36 2af2 s ILE 18 Cb -0.17 -0.49 -0.04 0.00 -1.58 0.00 0.00 42.46 40.19 2af2 s ILE 18 CO -0.17 0.20 0.28 0.20 -1.23 0.00 0.00 174.94 174.22 2af2 s ASN 19 N 0.77 6.34 -0.08 3.58 0.02 0.21 -0.95 114.94 124.84 2af2 s ASN 19 Ca -0.10 0.19 -0.01 0.00 -1.02 0.00 0.00 52.86 51.93 2af2 s ASN 19 Cb -0.13 -1.92 0.03 0.00 0.02 0.00 0.00 41.25 39.25 2af2 s ASN 19 CO -0.00 0.06 -0.04 -0.36 0.02 0.00 0.00 177.10 176.78 2af2 s PHE 20 N -1.72 1.02 -0.14 2.20 0.40 -0.01 -1.72 117.98 118.01 2af2 s PHE 20 Ca 0.35 -0.40 -0.06 0.00 -0.60 0.00 0.00 56.93 56.22 2af2 s PHE 20 Cb -0.11 -0.96 -0.04 0.00 0.51 0.00 0.00 43.02 42.42 2af2 s PHE 20 CO 0.28 -0.38 0.06 -1.83 0.70 0.00 0.00 175.22 174.05 2af2 s GLU 21 N 1.71 3.56 0.02 0.44 4.04 -0.36 0.57 118.70 128.67 2af2 s GLU 21 Ca 0.02 -0.31 0.02 0.00 0.04 0.00 0.00 54.97 54.74 2af2 s GLU 21 Cb -0.13 -3.08 -0.01 0.00 0.02 0.00 0.00 34.13 30.93 2af2 s GLU 21 CO -0.05 0.52 -0.07 -1.14 -1.84 0.00 0.00 175.26 172.68 2af2 s GLN 22 N -0.34 0.50 -0.05 -4.83 2.00 -1.26 -1.68 119.66 114.01 2af2 s GLN 22 Ca 0.09 -0.45 -0.14 0.00 -2.00 0.00 0.00 55.36 52.86 2af2 s GLN 22 Cb -0.12 -0.40 -0.31 0.00 0.80 0.00 0.00 33.01 32.98 2af2 s GLN 22 CO 0.02 0.10 0.70 1.57 -0.50 0.00 0.00 175.29 177.18 2af2 h LYS 23 N 5.34 0.38 -4.58 1.67 -0.00 -1.85 -2.64 116.57 114.88 2af2 h LYS 23 Ca -0.32 -0.65 -0.32 0.00 -0.00 0.00 0.00 60.65 59.37 2af2 h LYS 23 Cb 1.19 0.24 -0.13 0.00 -0.00 0.00 0.00 32.23 33.54 2af2 h LYS 23 CO 0.46 1.31 -0.48 -2.00 -0.00 0.00 0.00 179.45 178.73 2af2 s GLU 24 N -2.55 1.52 0.61 0.07 2.56 -1.26 -4.77 118.70 114.88 2af2 s GLU 24 Ca -0.16 -1.76 0.38 0.00 0.00 0.00 0.00 54.97 53.43 2af2 s GLU 24 Cb 0.05 0.33 1.93 0.00 2.00 0.00 0.00 34.13 38.43 2af2 s GLU 24 CO 0.85 -0.55 2.20 0.66 -0.56 0.00 0.00 175.26 177.86 2af2 h SER 25 N 2.35 0.00 -2.85 -1.70 4.64 -1.95 -3.39 113.55 110.66 2af2 h SER 25 Ca -0.30 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.44 2af2 h SER 25 Cb 1.24 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.94 2af2 h SER 25 CO 0.44 0.02 -0.81 0.20 -0.87 0.00 0.00 176.83 175.81 2af2 s ASN 26 N -5.52 3.30 -0.04 4.97 0.01 -1.26 -4.70 114.94 111.70 2af2 s ASN 26 Ca -0.03 -2.04 -0.29 0.00 -0.71 0.00 0.00 52.86 49.79 2af2 s ASN 26 Cb 0.12 -0.55 0.10 0.00 0.41 0.00 0.00 41.25 41.33 2af2 s ASN 26 CO 0.49 -0.34 1.31 0.61 -1.51 0.00 0.00 177.10 177.66 2af2 n GLY 27 N 4.27 0.17 3.76 0.66 0.00 -1.26 -5.05 105.19 107.73 2af2 n GLY 27 Ca 0.07 -1.04 -0.40 0.00 0.00 0.00 0.00 46.02 44.65 2af2 n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2af2 s PRO 28 N -2.01 4.75 -0.17 1.61 0.04 -1.26 -4.50 135.00 133.46 2af2 s PRO 28 Ca 0.31 1.38 -0.07 0.00 0.04 0.00 0.00 61.00 62.66 2af2 s PRO 28 Cb -0.01 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.26 2af2 s PRO 28 CO -0.01 0.52 0.06 0.08 0.04 0.00 0.00 177.00 177.68 2af2 s VAL 29 N -1.21 4.76 -0.27 -0.36 1.01 -0.95 -4.65 120.40 118.74 2af2 s VAL 29 Ca 0.40 -0.05 -0.14 0.00 0.00 0.00 0.00 61.98 62.19 2af2 s VAL 29 Cb -0.25 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2af2 s VAL 29 CO 0.30 0.48 0.34 -0.75 0.00 0.00 0.00 175.10 175.46 2af2 s LYS 30 N 0.25 4.02 -0.15 2.72 2.20 -0.68 -3.10 119.74 125.00 2af2 s LYS 30 Ca 0.04 -0.01 -0.06 0.00 -0.36 0.00 0.00 55.97 55.58 2af2 s LYS 30 Cb -0.12 -3.65 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 2af2 s LYS 30 CO 0.00 -0.24 0.05 0.08 -0.36 0.00 0.00 175.35 174.88 2af2 s VAL 31 N 1.96 4.68 0.11 4.02 1.01 0.16 -1.23 120.40 131.10 2af2 s VAL 31 Ca 0.14 -0.09 -0.08 0.00 0.00 0.00 0.00 61.98 61.95 2af2 s VAL 31 Cb -0.16 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 2af2 s VAL 31 CO 0.10 0.51 0.19 -1.66 0.00 0.00 0.00 175.10 174.25 2af2 s TRP 32 N -0.07 0.28 -5.00 5.22 -2.14 -0.70 -1.11 118.94 115.41 2af2 s TRP 32 Ca 0.06 -0.70 0.00 0.00 2.66 0.00 0.00 56.10 58.12 2af2 s TRP 32 Cb -0.12 -0.10 0.00 0.00 -3.10 0.00 0.00 33.47 30.14 2af2 s TRP 32 CO 0.01 -0.58 0.00 0.41 -2.66 0.00 0.00 176.95 174.13 2af2 n GLY 33 N -0.09 0.78 3.25 3.67 0.00 -0.46 -0.62 105.19 111.72 2af2 n GLY 33 Ca -0.12 -1.66 -0.11 0.00 0.00 0.00 0.00 46.02 44.12 2af2 n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2af2 s SER 34 N -4.00 -0.09 -0.19 1.61 1.04 -0.03 -0.59 113.70 111.46 2af2 s SER 34 Ca 0.00 -0.31 -0.00 0.00 0.48 0.00 0.00 55.95 56.12 2af2 s SER 34 Cb 0.00 0.37 0.05 0.00 0.10 0.00 0.00 66.02 66.54 2af2 s SER 34 CO 0.00 -0.67 -0.05 -0.63 0.98 0.00 0.00 173.24 172.86 2af2 s ILE 35 N -3.01 1.22 -0.19 -1.02 1.09 -0.29 -1.10 121.20 117.90 2af2 s ILE 35 Ca -0.02 -0.79 -0.07 0.00 -1.10 0.00 0.00 60.65 58.67 2af2 s ILE 35 Cb 0.01 -1.43 -0.04 0.00 -1.06 0.00 0.00 42.46 39.94 2af2 s ILE 35 CO -0.06 0.06 0.06 -0.75 -0.10 0.00 0.00 174.94 174.15 2af2 s LYS 36 N 1.57 3.93 0.00 2.79 2.47 0.14 -0.74 119.74 129.90 2af2 s LYS 36 Ca -0.01 -0.37 0.00 0.00 -1.56 0.00 0.00 55.97 54.03 2af2 s LYS 36 Cb -0.16 -3.20 0.00 0.00 -1.46 0.00 0.00 37.83 33.00 2af2 s LYS 36 CO -0.07 0.24 0.00 0.41 0.16 0.00 0.00 175.35 176.08 2af2 n GLY 37 N 3.64 0.06 3.42 5.54 0.00 -0.28 -0.84 105.19 116.74 2af2 n GLY 37 Ca -0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 2af2 n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2af2 n LEU 38 N 0.00 0.00 -4.62 0.99 4.32 -0.93 -4.76 117.00 112.00 2af2 n LEU 38 Ca 0.00 -1.46 -0.26 0.00 -0.02 0.00 0.00 56.01 54.28 2af2 n LEU 38 Cb 0.00 -0.81 -0.08 0.00 -1.62 0.00 0.00 43.42 40.91 2af2 n LEU 38 CO 0.00 -1.23 -0.37 0.28 -1.22 0.00 0.00 177.39 174.86 2af2 s THR 39 N -3.33 3.42 -0.73 -5.08 -1.32 -1.26 -3.90 115.64 103.43 2af2 s THR 39 Ca 0.64 -1.63 -0.21 0.00 -1.21 0.00 0.00 61.69 59.29 2af2 s THR 39 Cb -0.02 -2.73 -0.20 0.00 -1.51 0.00 0.00 72.50 68.04 2af2 s THR 39 CO 0.45 -0.16 1.80 -1.84 -2.21 0.00 0.00 174.62 172.65 2af2 n GLU 40 N -0.19 0.06 -3.81 7.08 0.00 -1.17 -4.43 120.64 118.19 2af2 n GLU 40 Ca -0.10 -1.25 0.02 0.00 0.00 0.00 0.00 57.16 55.83 2af2 n GLU 40 Cb 0.56 -3.14 0.01 0.00 0.00 0.00 0.00 31.44 28.86 2af2 n GLU 40 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 2af2 s GLY 41 N 6.57 -0.25 0.37 -1.84 0.00 -1.13 -4.97 107.32 106.08 2af2 s GLY 41 Ca 0.62 0.32 -0.24 0.00 0.00 0.00 0.00 44.72 45.42 2af2 s GLY 41 CO 0.16 2.88 0.99 1.08 0.00 0.00 0.00 173.10 178.21 2af2 s LEU 42 N -3.40 4.18 -0.10 0.66 1.02 -1.26 -1.07 118.68 118.71 2af2 s LEU 42 Ca 0.22 1.89 -0.05 0.00 0.02 0.00 0.00 54.13 56.21 2af2 s LEU 42 Cb 0.02 -4.19 0.05 0.00 0.02 0.00 0.00 46.19 42.09 2af2 s LEU 42 CO -0.02 -0.29 0.23 -1.00 0.02 0.00 0.00 176.35 175.29 2af2 s HIS 43 N -1.75 -0.31 1.03 0.29 3.76 0.33 -3.16 115.29 115.47 2af2 s HIS 43 Ca 0.56 0.75 -0.15 0.00 -0.15 0.00 0.00 55.06 56.06 2af2 s HIS 43 Cb -0.18 0.02 0.21 0.00 1.11 0.00 0.00 32.58 33.74 2af2 s HIS 43 CO 0.23 -0.23 1.16 0.20 -0.85 0.00 0.00 174.74 175.25 2af2 s GLY 44 N 1.32 1.62 -0.28 -2.22 0.00 0.31 0.26 107.32 108.33 2af2 s GLY 44 Ca -0.09 -0.80 -0.21 0.00 0.00 0.00 0.00 44.72 43.63 2af2 s GLY 44 CO -0.08 -0.08 0.75 -0.11 0.00 0.00 0.00 173.10 173.57 2af2 s PHE 45 N -3.29 -0.87 0.15 1.90 -0.12 -1.26 0.09 117.98 114.58 2af2 s PHE 45 Ca 0.68 1.91 -0.19 0.00 -0.05 0.00 0.00 56.93 59.29 2af2 s PHE 45 Cb -0.11 0.44 0.05 0.00 -0.63 0.00 0.00 43.02 42.76 2af2 s PHE 45 CO 0.55 -0.43 0.51 -3.38 -0.05 0.00 0.00 175.22 172.41 2af2 s HIS 46 N 0.96 -0.31 -0.23 3.49 -3.43 -0.05 -3.94 115.29 111.78 2af2 s HIS 46 Ca -0.05 0.03 -0.10 0.00 -0.80 0.00 0.00 55.06 54.15 2af2 s HIS 46 Cb -0.05 0.41 -0.05 0.00 -1.43 0.00 0.00 32.58 31.46 2af2 s HIS 46 CO -0.09 -0.81 0.14 0.08 -2.00 0.00 0.00 174.74 172.05 2af2 s VAL 47 N -3.80 5.19 0.52 -5.38 1.01 0.93 -0.67 120.40 118.20 2af2 s VAL 47 Ca 0.04 0.12 -0.17 0.00 0.00 0.00 0.00 61.98 61.97 2af2 s VAL 47 Cb 0.00 -3.41 -0.07 0.00 0.00 0.00 0.00 36.38 32.90 2af2 s VAL 47 CO -0.10 0.37 1.00 -1.00 0.00 0.00 0.00 175.10 175.36 2af2 s HIS 48 N 0.95 3.37 -1.45 5.22 3.76 0.77 -4.52 115.29 123.39 2af2 s HIS 48 Ca 0.07 1.48 0.19 0.00 -0.15 0.00 0.00 55.06 56.65 2af2 s HIS 48 Cb -0.13 -2.83 0.99 0.00 1.11 0.00 0.00 32.58 31.71 2af2 s HIS 48 CO 0.03 -0.48 1.60 -0.85 -0.85 0.00 0.00 174.74 174.20 2af2 n GLU 49 N -1.60 0.29 -4.39 1.40 0.00 -1.26 -2.26 120.64 112.81 2af2 n GLU 49 Ca 0.07 0.10 -0.20 0.00 0.00 0.00 0.00 57.16 57.13 2af2 n GLU 49 Cb 0.54 -1.50 -0.10 0.00 0.00 0.00 0.00 31.44 30.38 2af2 n GLU 49 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 2af2 s PHE 50 N -2.55 1.82 -0.84 -1.84 0.08 -1.26 -4.80 117.98 108.59 2af2 s PHE 50 Ca 0.19 -0.75 0.08 0.00 0.12 0.00 0.00 56.93 56.57 2af2 s PHE 50 Cb 0.13 -1.03 0.12 0.00 -0.57 0.00 0.00 43.02 41.67 2af2 s PHE 50 CO 0.29 0.20 0.90 0.41 -0.10 0.00 0.00 175.22 176.93 2af2 n GLY 51 N -0.52 0.59 3.67 4.36 0.00 -0.97 -1.86 105.19 110.47 2af2 n GLY 51 Ca -0.06 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 2af2 n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2af2 s ASP 52 N -0.77 7.11 0.00 1.61 -1.08 -1.26 -4.88 116.67 117.40 2af2 s ASP 52 Ca 0.12 1.55 0.00 0.00 -0.52 0.00 0.00 52.55 53.70 2af2 s ASP 52 Cb 0.07 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.98 2af2 s ASP 52 CO 0.10 -0.60 0.00 -0.46 0.52 0.00 0.00 175.17 174.73 2af2 n ASN 53 N 5.78 0.00 0.00 -0.34 2.04 -1.26 -4.91 115.26 116.57 2af2 n ASN 53 Ca 0.11 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.25 2af2 n ASN 53 Cb 0.47 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.72 2af2 n ASN 53 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 2af2 n THR 54 N 0.00 0.00 1.12 5.53 -2.24 -1.26 -4.65 114.28 112.78 2af2 n THR 54 Ca 0.00 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.92 2af2 n THR 54 Cb 0.00 0.00 0.64 0.00 -2.10 0.00 0.00 70.33 68.87 2af2 n THR 54 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2af2 n ALA 55 N 0.00 2.33 -0.51 6.98 0.00 -1.26 -4.90 120.51 123.15 2af2 n ALA 55 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2af2 n ALA 55 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.00 2af2 n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2af2 n GLY 56 N 1.27 1.44 0.42 0.00 0.00 -1.26 -3.74 105.19 103.32 2af2 n GLY 56 Ca 0.09 0.10 0.22 0.00 0.00 0.00 0.00 46.02 46.44 2af2 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2af2 n THR 58 N -4.46 0.09 -0.07 0.00 5.66 -1.25 -4.38 114.28 109.87 2af2 n THR 58 Ca 0.20 -0.17 -0.10 0.00 -3.05 0.00 0.00 64.05 60.93 2af2 n THR 58 Cb 0.80 0.41 -0.15 0.00 -1.55 0.00 0.00 70.33 69.84 2af2 n THR 58 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2af2 n SER 59 N -1.80 0.42 -4.64 1.09 3.41 -0.63 -4.82 113.62 106.65 2af2 n SER 59 Ca 0.02 0.13 -0.43 0.00 -0.26 0.00 0.00 58.87 58.33 2af2 n SER 59 Cb 0.41 0.56 -0.02 0.00 -0.26 0.00 0.00 64.21 64.89 2af2 n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2af2 s ALA 60 N -2.53 3.44 0.12 7.33 0.00 -0.68 -4.96 121.76 124.47 2af2 s ALA 60 Ca -0.10 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.18 2af2 s ALA 60 Cb 0.07 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2af2 s ALA 60 CO 0.82 -1.63 0.00 0.41 0.00 0.00 0.00 175.76 175.36 2af2 n GLY 61 N 4.18 1.30 3.70 0.00 0.00 -1.26 -4.92 105.19 108.19 2af2 n GLY 61 Ca 0.15 -1.53 -0.21 0.00 0.00 0.00 0.00 46.02 44.43 2af2 n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2af2 n PRO 62 N 0.00 0.06 -2.67 1.61 -0.04 -1.26 -5.06 135.00 127.64 2af2 n PRO 62 Ca 0.00 -2.66 -0.43 0.00 -0.04 0.00 0.00 63.50 60.37 2af2 n PRO 62 Cb 0.00 -0.55 -0.03 0.00 -0.04 0.00 0.00 33.50 32.88 2af2 n PRO 62 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2af2 s HIS 63 N -2.83 2.95 0.24 0.54 3.76 -1.26 -4.96 115.29 113.73 2af2 s HIS 63 Ca 0.62 0.80 -0.30 0.00 -0.15 0.00 0.00 55.06 56.02 2af2 s HIS 63 Cb -0.04 -4.08 -0.10 0.00 1.11 0.00 0.00 32.58 29.47 2af2 s HIS 63 CO 0.41 -1.06 1.52 0.12 -0.85 0.00 0.00 174.74 174.88 2af2 s PHE 64 N 4.03 2.96 -0.39 1.40 5.36 -1.26 -4.97 117.98 125.10 2af2 s PHE 64 Ca 0.44 0.84 0.09 0.00 -0.96 0.00 0.00 56.93 57.35 2af2 s PHE 64 Cb -0.09 -3.92 0.44 0.00 -0.34 0.00 0.00 43.02 39.10 2af2 s PHE 64 CO 0.25 -3.14 1.07 0.27 -1.46 0.00 0.00 175.22 172.21 2af2 n ASN 65 N 2.74 3.75 0.28 6.13 6.94 -1.26 -4.43 115.26 129.41 2af2 n ASN 65 Ca 0.09 -3.40 0.15 0.00 -0.02 0.00 0.00 54.58 51.40 2af2 n ASN 65 Cb 0.39 -0.47 0.82 0.00 -2.36 0.00 0.00 39.78 38.15 2af2 n ASN 65 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 2af2 h PRO 66 N 2.67 0.00 0.00 -0.53 0.13 -1.96 0.14 132.00 132.46 2af2 h PRO 66 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2af2 h PRO 66 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2af2 h PRO 66 CO 0.73 0.08 0.00 1.28 -0.23 0.00 0.00 178.00 179.86 2af2 n LEU 67 N -3.50 0.00 -2.51 1.56 7.99 -1.26 -4.97 117.00 114.31 2af2 n LEU 67 Ca -0.02 0.12 -0.10 0.00 -0.01 0.00 0.00 56.01 56.00 2af2 n LEU 67 Cb 0.21 -0.12 0.05 0.00 -0.11 0.00 0.00 43.42 43.45 2af2 n LEU 67 CO 0.28 -0.00 0.04 -0.24 -1.51 0.00 0.00 177.39 175.96 2af2 n SER 68 N -1.12 -3.42 -3.42 -1.43 2.88 0.49 -5.03 113.62 102.58 2af2 n SER 68 Ca 0.19 -0.40 -0.11 0.00 -1.33 0.00 0.00 58.87 57.22 2af2 n SER 68 Cb 0.16 -3.33 -0.03 0.00 -0.75 0.00 0.00 64.21 60.27 2af2 n SER 68 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2af2 s ARG 69 N -4.33 1.89 0.83 -1.46 1.70 -1.26 -5.17 118.95 111.14 2af2 s ARG 69 Ca 0.14 -1.49 -0.11 0.00 -0.47 0.00 0.00 55.73 53.80 2af2 s ARG 69 Cb -0.02 0.51 0.09 0.00 -0.57 0.00 0.00 34.95 34.96 2af2 s ARG 69 CO 0.44 -0.82 1.09 0.15 -1.08 0.00 0.00 175.30 175.09 2af2 s LYS 70 N -3.19 1.81 0.38 3.89 3.01 -1.26 -4.79 119.74 119.59 2af2 s LYS 70 Ca 0.23 0.92 -0.20 0.00 -1.01 0.00 0.00 55.97 55.91 2af2 s LYS 70 Cb -0.02 -1.86 -0.10 0.00 -1.01 0.00 0.00 37.83 34.83 2af2 s LYS 70 CO 0.14 -1.88 0.88 -1.58 0.51 0.00 0.00 175.35 173.42 2af2 s HIS 71 N -2.96 3.37 0.00 3.18 5.65 -0.08 -2.73 115.29 121.72 2af2 s HIS 71 Ca 0.62 1.51 0.00 0.00 0.25 0.00 0.00 55.06 57.44 2af2 s HIS 71 Cb -0.17 -2.76 0.00 0.00 -1.18 0.00 0.00 32.58 28.47 2af2 s HIS 71 CO 0.56 -0.01 0.00 0.41 -0.65 0.00 0.00 174.74 175.05 2af2 n GLY 72 N -0.40 0.92 0.00 1.59 0.00 -1.26 -1.56 105.19 104.48 2af2 n GLY 72 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2af2 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2af2 n GLY 73 N 0.00 1.56 0.07 -0.02 0.00 -1.15 -4.52 105.19 101.13 2af2 n GLY 73 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 2af2 n GLY 73 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2af2 n PRO 74 N -0.02 0.68 0.00 1.61 -0.04 -1.26 -4.56 135.00 131.40 2af2 n PRO 74 Ca 0.00 -0.05 0.01 0.00 -0.04 0.00 0.00 63.50 63.43 2af2 n PRO 74 Cb 0.00 -1.54 -0.01 0.00 -0.04 0.00 0.00 33.50 31.91 2af2 n PRO 74 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2af2 n LYS 75 N -2.62 5.33 -4.05 0.54 -0.00 -1.26 -4.97 118.16 111.12 2af2 n LYS 75 Ca -0.23 -0.08 -0.36 0.00 -0.00 0.00 0.00 58.31 57.64 2af2 n LYS 75 Cb 0.97 -0.68 -0.07 0.00 -0.00 0.00 0.00 35.03 35.25 2af2 n LYS 75 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2af2 s ASP 76 N -1.14 5.99 0.45 -5.58 2.15 -1.18 -4.94 116.67 112.40 2af2 s ASP 76 Ca 0.01 0.35 0.25 0.00 0.43 0.00 0.00 52.55 53.58 2af2 s ASP 76 Cb 0.02 -1.86 0.58 0.00 -0.30 0.00 0.00 42.92 41.36 2af2 s ASP 76 CO 0.10 0.39 1.69 -0.33 -0.17 0.00 0.00 175.17 176.85 2af2 h GLU 77 N 4.95 0.00 0.00 4.34 3.07 -1.92 -3.05 114.58 121.98 2af2 h GLU 77 Ca -0.53 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.33 2af2 h GLU 77 Cb 1.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 2af2 h GLU 77 CO 0.57 0.07 0.00 0.39 -1.40 0.00 0.00 179.01 178.65 2af2 n GLU 78 N -3.13 0.00 -0.00 2.33 1.02 -1.26 -4.94 120.64 114.65 2af2 n GLU 78 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2af2 n GLU 78 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.92 2af2 n GLU 78 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2af2 n ARG 79 N 0.00 0.00 -0.59 3.49 1.85 -1.11 -4.70 116.66 115.60 2af2 n ARG 79 Ca 0.00 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.56 2af2 n ARG 79 Cb 0.00 0.00 0.22 0.00 -1.05 0.00 0.00 32.46 31.63 2af2 n ARG 79 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 2af2 s HIS 80 N -0.10 1.44 -0.81 2.89 3.76 -1.22 -4.90 115.29 116.34 2af2 s HIS 80 Ca 0.00 1.48 -0.25 0.00 -0.15 0.00 0.00 55.06 56.14 2af2 s HIS 80 Cb 0.00 -3.21 -0.02 0.00 1.11 0.00 0.00 32.58 30.46 2af2 s HIS 80 CO 0.00 -3.43 1.77 0.54 -0.85 0.00 0.00 174.74 172.77 2af2 s VAL 81 N -2.53 3.52 0.00 -0.90 0.11 -1.26 -2.56 120.40 116.78 2af2 s VAL 81 Ca 0.68 -0.16 0.00 0.00 -2.93 0.00 0.00 61.98 59.57 2af2 s VAL 81 Cb -0.24 -4.25 0.00 0.00 -1.53 0.00 0.00 36.38 30.35 2af2 s VAL 81 CO 0.62 -1.19 0.00 0.61 -3.33 0.00 0.00 175.10 171.80 2af2 n GLY 82 N 6.33 1.47 3.46 6.54 0.00 -1.26 -4.88 105.19 116.84 2af2 n GLY 82 Ca 0.29 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.91 2af2 n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2af2 s ASP 83 N -1.51 5.81 0.36 1.61 1.11 -1.06 -0.05 116.67 122.94 2af2 s ASP 83 Ca 0.00 -0.62 0.08 0.00 0.18 0.00 0.00 52.55 52.19 2af2 s ASP 83 Cb 0.00 -2.07 -0.03 0.00 1.07 0.00 0.00 42.92 41.90 2af2 s ASP 83 CO 0.00 -0.27 0.30 -0.76 1.18 0.00 0.00 175.17 175.62 2af2 s LEU 84 N 1.65 3.49 1.09 1.23 2.01 -1.25 -4.89 118.68 122.00 2af2 s LEU 84 Ca 0.05 -0.61 -0.18 0.00 0.01 0.00 0.00 54.13 53.40 2af2 s LEU 84 Cb -0.18 -2.11 0.24 0.00 0.01 0.00 0.00 46.19 44.16 2af2 s LEU 84 CO 0.08 -0.44 1.20 -0.83 1.01 0.00 0.00 176.35 177.37 2af2 s GLY 85 N -4.02 1.67 0.82 -3.19 0.00 -1.26 -4.70 107.32 96.63 2af2 s GLY 85 Ca 0.43 -1.04 -0.12 0.00 0.00 0.00 0.00 44.72 43.99 2af2 s GLY 85 CO 0.26 -0.22 1.13 0.54 0.00 0.00 0.00 173.10 174.82 2af2 s ASN 86 N -4.32 4.38 0.47 1.64 2.20 -1.26 -4.03 114.94 114.01 2af2 s ASN 86 Ca 0.72 1.03 0.07 0.00 -0.94 0.00 0.00 52.86 53.73 2af2 s ASN 86 Cb -0.07 -1.66 0.00 0.00 -2.00 0.00 0.00 41.25 37.52 2af2 s ASN 86 CO 0.55 -2.01 0.36 0.54 -2.94 0.00 0.00 177.10 173.59 2af2 s VAL 87 N -3.35 2.14 -0.07 3.54 0.11 0.14 -4.93 120.40 117.99 2af2 s VAL 87 Ca 0.62 -1.47 -0.06 0.00 -2.93 0.00 0.00 61.98 58.14 2af2 s VAL 87 Cb -0.13 -2.61 0.02 0.00 -1.53 0.00 0.00 36.38 32.13 2af2 s VAL 87 CO 0.52 0.00 0.18 -0.89 -3.33 0.00 0.00 175.10 171.58 2af2 s THR 88 N -2.63 -0.01 0.21 5.04 2.01 -1.26 -0.52 115.64 118.48 2af2 s THR 88 Ca 0.41 0.03 0.05 0.00 0.31 0.00 0.00 61.69 62.50 2af2 s THR 88 Cb -0.01 -0.27 -0.03 0.00 0.01 0.00 0.00 72.50 72.19 2af2 s THR 88 CO 0.24 0.01 0.23 0.00 -0.69 0.00 0.00 174.62 174.42 2af2 s ALA 89 N 0.33 3.73 0.79 7.40 0.00 -0.23 -3.85 121.76 129.93 2af2 s ALA 89 Ca -0.02 -1.26 -0.04 0.00 0.00 0.00 0.00 51.96 50.64 2af2 s ALA 89 Cb -0.03 -1.50 0.10 0.00 0.00 0.00 0.00 23.12 21.69 2af2 s ALA 89 CO -0.01 0.36 0.62 -0.40 0.00 0.00 0.00 175.76 176.32 2af2 n ASP 90 N -0.92 0.38 0.25 0.00 5.75 -0.26 -2.82 116.55 118.94 2af2 n ASP 90 Ca -0.08 -1.43 0.16 0.00 -0.01 0.00 0.00 54.79 53.44 2af2 n ASP 90 Cb 0.56 -0.44 0.66 0.00 -1.03 0.00 0.00 41.12 40.87 2af2 n ASP 90 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 2af2 h LYS 91 N 0.00 0.00 0.00 0.11 5.09 -1.92 -0.73 116.57 119.12 2af2 h LYS 91 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.54 2af2 h LYS 91 Cb 0.63 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.96 2af2 h LYS 91 CO 0.17 0.00 0.00 -3.47 -2.09 0.00 0.00 179.45 174.06 2af2 n ASP 92 N -2.93 0.00 -0.15 7.07 2.03 -1.26 -4.90 116.55 116.41 2af2 n ASP 92 Ca 0.01 0.49 -0.02 0.00 0.52 0.00 0.00 54.79 55.79 2af2 n ASP 92 Cb 0.29 -0.50 -0.00 0.00 -0.72 0.00 0.00 41.12 40.19 2af2 n ASP 92 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2af2 n GLY 93 N 1.47 0.39 3.63 0.27 0.00 -0.29 -4.64 105.19 106.03 2af2 n GLY 93 Ca 0.07 -0.91 -0.38 0.00 0.00 0.00 0.00 46.02 44.80 2af2 n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2af2 s VAL 94 N -2.07 5.26 0.03 1.61 0.11 -1.26 -1.12 120.40 122.97 2af2 s VAL 94 Ca 0.00 0.40 -0.20 0.00 -2.93 0.00 0.00 61.98 59.25 2af2 s VAL 94 Cb 0.00 -3.61 -0.06 0.00 -1.53 0.00 0.00 36.38 31.18 2af2 s VAL 94 CO 0.00 0.25 0.58 0.00 -3.33 0.00 0.00 175.10 172.60 2af2 s ALA 95 N 1.54 3.54 -0.15 1.54 0.00 0.08 -1.10 121.76 127.21 2af2 s ALA 95 Ca 0.12 0.03 -0.07 0.00 0.00 0.00 0.00 51.96 52.03 2af2 s ALA 95 Cb -0.15 -2.69 -0.04 0.00 0.00 0.00 0.00 23.12 20.24 2af2 s ALA 95 CO 0.08 0.28 0.11 0.34 0.00 0.00 0.00 175.76 176.57 2af2 s ASP 96 N -0.65 6.06 -0.15 0.00 2.15 -1.25 -1.13 116.67 121.69 2af2 s ASP 96 Ca 0.30 0.29 -0.01 0.00 0.43 0.00 0.00 52.55 53.55 2af2 s ASP 96 Cb -0.19 -1.99 -0.02 0.00 -0.30 0.00 0.00 42.92 40.43 2af2 s ASP 96 CO 0.18 0.29 -0.10 -0.69 -0.17 0.00 0.00 175.17 174.69 2af2 s VAL 97 N -0.34 3.27 -0.50 1.11 1.01 0.25 -4.67 120.40 120.53 2af2 s VAL 97 Ca 0.10 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.57 2af2 s VAL 97 Cb -0.12 -2.40 0.20 0.00 0.00 0.00 0.00 36.38 34.06 2af2 s VAL 97 CO 0.01 0.50 0.70 -1.20 0.00 0.00 0.00 175.10 175.12 2af2 n SER 98 N 3.70 -2.90 -4.05 3.32 7.64 -1.25 -1.36 113.62 118.71 2af2 n SER 98 Ca -0.18 -2.90 -0.10 0.00 1.01 0.00 0.00 58.87 56.70 2af2 n SER 98 Cb 0.52 1.41 -0.11 0.00 -1.01 0.00 0.00 64.21 65.02 2af2 n SER 98 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2af2 s ILE 99 N 0.68 0.32 -0.08 0.44 1.01 -0.27 -5.03 121.20 118.27 2af2 s ILE 99 Ca 0.31 -1.30 -0.10 0.00 0.00 0.00 0.00 60.65 59.56 2af2 s ILE 99 Cb 0.04 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 41.71 2af2 s ILE 99 CO -0.10 -0.63 0.27 -0.70 0.00 0.00 0.00 174.94 173.78 2af2 s GLU 100 N -2.37 0.38 -0.07 2.79 2.12 -1.26 0.37 118.70 120.67 2af2 s GLU 100 Ca -0.06 0.25 -0.19 0.00 0.36 0.00 0.00 54.97 55.34 2af2 s GLU 100 Cb -0.04 0.18 0.04 0.00 0.26 0.00 0.00 34.13 34.57 2af2 s GLU 100 CO -0.03 -0.06 0.44 0.34 -0.54 0.00 0.00 175.26 175.40 2af2 s ASP 101 N -0.16 -0.38 -0.77 -1.70 2.15 -1.18 -4.99 116.67 109.64 2af2 s ASP 101 Ca -0.03 0.46 0.00 0.00 0.43 0.00 0.00 52.55 53.41 2af2 s ASP 101 Cb -0.03 0.53 0.36 0.00 -0.30 0.00 0.00 42.92 43.49 2af2 s ASP 101 CO 0.01 -0.41 1.73 -1.54 -0.17 0.00 0.00 175.17 174.80 2af2 n SER 102 N 1.61 6.71 -0.33 -0.34 3.41 -1.26 -2.23 113.62 121.19 2af2 n SER 102 Ca -0.19 -3.78 0.00 0.00 -0.26 0.00 0.00 58.87 54.64 2af2 n SER 102 Cb 0.56 -0.92 0.00 0.00 -0.26 0.00 0.00 64.21 63.59 2af2 n SER 102 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2af2 n VAL 103 N -0.44 0.00 -3.94 -3.33 0.24 -1.26 -4.85 118.33 104.75 2af2 n VAL 103 Ca 0.48 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.69 2af2 n VAL 103 Cb 0.34 0.36 -0.07 0.00 -1.47 0.00 0.00 33.84 33.00 2af2 n VAL 103 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2af2 s ILE 104 N 0.00 0.09 0.22 1.34 -0.00 -1.26 -4.97 121.20 116.62 2af2 s ILE 104 Ca 0.00 -1.35 -0.18 0.00 -0.00 0.00 0.00 60.65 59.12 2af2 s ILE 104 Cb 0.00 -1.70 0.02 0.00 -0.00 0.00 0.00 42.46 40.79 2af2 s ILE 104 CO 0.00 -0.42 0.56 -0.44 -0.00 0.00 0.00 174.94 174.65 2af2 s SER 105 N -2.94 -0.25 -1.14 4.36 0.01 -1.26 -4.35 113.70 108.13 2af2 s SER 105 Ca 0.14 -0.54 -0.21 0.00 1.31 0.00 0.00 55.95 56.64 2af2 s SER 105 Cb 0.04 0.61 0.04 0.00 0.21 0.00 0.00 66.02 66.93 2af2 s SER 105 CO -0.03 -1.12 1.63 -0.76 0.41 0.00 0.00 173.24 173.37 2af2 s LEU 106 N -2.90 3.59 0.00 2.44 1.02 -1.26 -1.68 118.68 119.90 2af2 s LEU 106 Ca 0.11 -1.83 0.00 0.00 0.02 0.00 0.00 54.13 52.43 2af2 s LEU 106 Cb -0.02 -2.57 0.00 0.00 0.02 0.00 0.00 46.19 43.62 2af2 s LEU 106 CO 0.00 -1.55 0.18 -0.24 0.02 0.00 0.00 176.35 174.77 2af2 n SER 107 N 9.36 0.00 0.00 2.29 2.88 0.09 -4.75 113.62 123.48 2af2 n SER 107 Ca 0.41 -1.00 0.00 0.00 -1.33 0.00 0.00 58.87 56.95 2af2 n SER 107 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 2af2 n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2af2 n GLY 108 N 0.00 1.40 0.16 0.46 0.00 0.17 -4.19 105.19 103.18 2af2 n GLY 108 Ca 0.00 -0.68 -0.14 0.00 0.00 0.00 0.00 46.02 45.21 2af2 n GLY 108 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2af2 h ASP 109 N 0.00 -0.28 0.09 1.61 1.82 -1.87 -3.05 116.42 114.74 2af2 h ASP 109 Ca 0.00 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 2af2 h ASP 109 Cb 0.00 0.08 0.00 0.00 0.68 0.00 0.00 39.33 40.09 2af2 h ASP 109 CO 0.00 -0.19 0.00 1.41 -1.61 0.00 0.00 179.24 178.85 2af2 n HIS 110 N -5.23 0.00 0.00 0.28 -0.00 -1.26 -4.77 115.22 104.24 2af2 n HIS 110 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.63 2af2 n HIS 110 Cb 0.15 -0.05 0.00 0.00 -0.00 0.00 0.00 29.99 30.09 2af2 n HIS 110 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2af2 n SER 111 N -1.05 0.00 -4.37 0.41 7.64 -1.15 -4.83 113.62 110.27 2af2 n SER 111 Ca 0.20 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.89 2af2 n SER 111 Cb 0.12 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.22 2af2 n SER 111 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2af2 s ILE 112 N 0.91 0.89 0.00 0.44 -4.36 -0.67 -4.75 121.20 113.65 2af2 s ILE 112 Ca 0.00 -2.01 0.00 0.00 -0.26 0.00 0.00 60.65 58.38 2af2 s ILE 112 Cb 0.00 -2.64 0.00 0.00 1.25 0.00 0.00 42.46 41.07 2af2 s ILE 112 CO 0.00 -0.06 0.00 -0.38 0.24 0.00 0.00 174.94 174.74 2af2 n ILE 113 N -0.54 -0.26 -0.72 8.37 2.08 -1.26 -0.65 119.36 126.37 2af2 n ILE 113 Ca -0.02 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.29 2af2 n ILE 113 Cb 0.66 -0.11 0.00 0.00 -0.75 0.00 0.00 39.64 39.44 2af2 n ILE 113 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2af2 n GLY 114 N 1.57 0.44 3.99 7.39 0.00 0.02 -4.11 105.19 114.49 2af2 n GLY 114 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2af2 n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2af2 s ARG 115 N -0.56 1.63 -0.14 1.61 0.52 -1.26 -2.29 118.95 118.46 2af2 s ARG 115 Ca 0.00 -1.12 -0.01 0.00 -0.52 0.00 0.00 55.73 54.08 2af2 s ARG 115 Cb 0.00 -2.32 0.04 0.00 0.52 0.00 0.00 34.95 33.19 2af2 s ARG 115 CO 0.00 -1.49 -0.02 0.99 0.02 0.00 0.00 175.30 174.80 2af2 s THR 116 N -3.16 0.79 -0.15 0.02 2.01 -0.77 -1.44 115.64 112.93 2af2 s THR 116 Ca 0.67 -0.39 -0.25 0.00 0.31 0.00 0.00 61.69 62.03 2af2 s THR 116 Cb -0.05 -1.02 -0.02 0.00 0.01 0.00 0.00 72.50 71.42 2af2 s THR 116 CO 0.45 0.11 0.80 -0.22 -0.69 0.00 0.00 174.62 175.07 2af2 s LEU 117 N 1.77 4.20 -0.01 4.42 2.96 0.18 -0.16 118.68 132.05 2af2 s LEU 117 Ca 0.02 1.17 -0.01 0.00 -0.22 0.00 0.00 54.13 55.09 2af2 s LEU 117 Cb -0.15 -3.20 -0.04 0.00 0.50 0.00 0.00 46.19 43.31 2af2 s LEU 117 CO -0.07 -0.34 0.10 0.54 -1.32 0.00 0.00 176.35 175.26 2af2 s VAL 118 N 1.87 4.88 -0.15 1.68 0.11 0.15 -0.83 120.40 128.11 2af2 s VAL 118 Ca 0.38 -0.34 -0.05 0.00 -2.93 0.00 0.00 61.98 59.04 2af2 s VAL 118 Cb -0.17 -3.23 -0.04 0.00 -1.53 0.00 0.00 36.38 31.41 2af2 s VAL 118 CO 0.14 0.36 0.02 -0.69 -3.33 0.00 0.00 175.10 171.60 2af2 s VAL 119 N -1.21 4.46 0.14 2.04 1.01 0.35 -0.87 120.40 126.33 2af2 s VAL 119 Ca 0.23 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 2af2 s VAL 119 Cb -0.12 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 2af2 s VAL 119 CO 0.14 0.51 0.33 -1.00 0.00 0.00 0.00 175.10 175.08 2af2 s HIS 120 N 0.06 3.49 -0.05 5.22 3.76 0.11 -1.78 115.29 126.10 2af2 s HIS 120 Ca 0.03 0.38 -0.24 0.00 -0.15 0.00 0.00 55.06 55.08 2af2 s HIS 120 Cb -0.13 -1.87 -0.23 0.00 1.11 0.00 0.00 32.58 31.46 2af2 s HIS 120 CO 0.02 0.46 1.04 1.49 -0.85 0.00 0.00 174.74 176.89 2af2 h GLU 121 N 2.56 0.20 -7.44 1.40 4.22 -1.15 0.89 114.58 115.26 2af2 h GLU 121 Ca -0.47 -0.21 -0.46 0.00 0.08 0.00 0.00 59.36 58.30 2af2 h GLU 121 Cb 1.17 0.06 0.12 0.00 0.50 0.00 0.00 28.75 30.61 2af2 h GLU 121 CO 0.72 0.94 0.25 0.15 -2.18 0.00 0.00 179.01 178.88 2af2 s LYS 122 N -3.14 1.02 0.43 1.92 3.01 -0.87 -4.30 119.74 117.80 2af2 s LYS 122 Ca -0.16 -0.97 -0.25 0.00 -1.01 0.00 0.00 55.97 53.59 2af2 s LYS 122 Cb 0.01 -2.12 -0.10 0.00 -1.01 0.00 0.00 37.83 34.61 2af2 s LYS 122 CO 0.75 -2.00 1.13 0.00 0.51 0.00 0.00 175.35 175.73 2af2 n ALA 123 N -3.30 0.67 -2.70 5.17 0.00 -1.19 -1.03 120.51 118.14 2af2 n ALA 123 Ca 0.17 0.24 -0.41 0.00 0.00 0.00 0.00 53.44 53.44 2af2 n ALA 123 Cb 0.60 -2.16 -0.04 0.00 0.00 0.00 0.00 19.45 17.84 2af2 n ALA 123 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2af2 s ASP 124 N -0.67 7.04 0.18 0.00 -1.08 -1.26 -4.25 116.67 116.63 2af2 s ASP 124 Ca 0.63 1.26 0.08 0.00 -0.52 0.00 0.00 52.55 53.99 2af2 s ASP 124 Cb -0.53 -2.45 0.04 0.00 -1.46 0.00 0.00 42.92 38.51 2af2 s ASP 124 CO 0.57 -0.25 1.42 -0.78 0.52 0.00 0.00 175.17 176.65 2af2 h ASP 125 N 6.99 0.04 -4.95 -0.34 3.58 -1.07 -3.46 116.42 117.21 2af2 h ASP 125 Ca -0.36 -0.03 -0.24 0.00 0.42 0.00 0.00 57.03 56.82 2af2 h ASP 125 Cb 1.18 -0.01 0.15 0.00 1.72 0.00 0.00 39.33 42.36 2af2 h ASP 125 CO 0.78 0.85 -0.65 0.18 -2.88 0.00 0.00 179.24 177.53 2af2 n LEU 126 N -3.57 -4.17 0.00 2.28 4.77 -1.26 -4.32 117.00 110.74 2af2 n LEU 126 Ca -0.01 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 2af2 n LEU 126 Cb 0.80 -2.64 0.00 0.00 -2.33 0.00 0.00 43.42 39.24 2af2 n LEU 126 CO 0.45 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 2af2 n GLY 127 N -1.18 2.27 3.13 -0.72 0.00 -0.60 -3.12 105.19 104.97 2af2 n GLY 127 Ca -0.16 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.09 2af2 n GLY 127 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2af2 s LYS 128 N 0.00 0.28 0.00 1.61 -0.14 -1.26 -1.09 119.74 119.14 2af2 s LYS 128 Ca 0.00 0.48 0.00 0.00 -1.36 0.00 0.00 55.97 55.09 2af2 s LYS 128 Cb 0.00 0.03 0.00 0.00 -1.68 0.00 0.00 37.83 36.18 2af2 s LYS 128 CO 0.00 -0.10 0.00 0.41 -0.76 0.00 0.00 175.35 174.90 2af2 n GLY 129 N 3.57 -1.17 0.00 -3.33 0.00 -1.26 -5.08 105.19 97.93 2af2 n GLY 129 Ca -0.19 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2af2 n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2af2 n GLY 130 N -0.26 0.44 0.00 -0.02 0.00 -1.26 -5.10 105.19 98.99 2af2 n GLY 130 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2af2 n GLY 130 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2af2 n ASN 131 N 0.00 0.00 -0.04 1.61 6.94 -1.26 -5.01 115.26 117.50 2af2 n ASN 131 Ca 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 54.58 54.42 2af2 n ASN 131 Cb 0.00 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.34 2af2 n ASN 131 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2af2 h GLU 132 N 0.00 0.27 -0.57 -3.83 4.81 -1.99 -3.22 114.58 110.07 2af2 h GLU 132 Ca 0.00 -0.17 0.16 0.00 -0.13 0.00 0.00 59.36 59.23 2af2 h GLU 132 Cb 0.00 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 2af2 h GLU 132 CO 0.00 0.74 0.75 0.93 -0.73 0.00 0.00 179.01 180.71 2af2 h GLU 133 N -0.17 0.00 -0.41 1.92 3.07 -1.96 0.23 114.58 117.25 2af2 h GLU 133 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2af2 h GLU 133 Cb 0.72 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.61 2af2 h GLU 133 CO 0.04 0.00 0.27 0.77 -1.40 0.00 0.00 179.01 178.69 2af2 h SER 134 N 0.00 0.48 0.26 1.42 0.02 -1.79 0.11 113.55 114.05 2af2 h SER 134 Ca 0.27 -0.02 -0.32 0.00 -0.84 0.00 0.00 61.79 60.87 2af2 h SER 134 Cb 1.77 -0.12 0.03 0.00 0.14 0.00 0.00 62.40 64.23 2af2 h SER 134 CO -0.00 0.36 -1.40 0.71 -1.14 0.00 0.00 176.83 175.35 2af2 h THR 135 N 0.56 1.30 -0.08 -2.27 1.35 0.11 -1.64 112.91 112.23 2af2 h THR 135 Ca 0.15 -2.67 -0.00 0.00 -0.55 0.00 0.00 66.41 63.34 2af2 h THR 135 Cb -0.05 2.94 -0.00 0.00 -1.73 0.00 0.00 68.15 69.31 2af2 h THR 135 CO -0.03 0.80 0.05 0.50 -0.25 0.00 0.00 175.52 176.59 2af2 h LYS 136 N 0.18 0.11 0.00 4.72 3.64 -1.41 -0.17 116.57 123.64 2af2 h LYS 136 Ca -0.23 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 2af2 h LYS 136 Cb 2.09 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.89 2af2 h LYS 136 CO 0.26 0.12 0.00 0.25 -2.27 0.00 0.00 179.45 177.81 2af2 n THR 137 N -5.01 0.00 -0.27 1.00 -2.24 0.16 -4.51 114.28 103.41 2af2 n THR 137 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2af2 n THR 137 Cb 0.05 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 2af2 n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2af2 n GLY 138 N 0.00 0.84 2.77 3.38 0.00 0.05 -4.46 105.19 107.77 2af2 n GLY 138 Ca 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 46.02 45.76 2af2 n GLY 138 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2af2 n ASN 139 N 0.41 -5.07 -0.19 1.61 4.05 -0.49 -0.43 115.26 115.16 2af2 n ASN 139 Ca 0.00 0.09 0.00 0.00 0.45 0.00 0.00 54.58 55.12 2af2 n ASN 139 Cb 0.00 -3.30 0.00 0.00 1.23 0.00 0.00 39.78 37.71 2af2 n ASN 139 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2af2 n ALA 140 N 0.89 1.51 0.00 5.20 0.00 -1.26 -4.85 120.51 122.01 2af2 n ALA 140 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2af2 n ALA 140 Cb 0.46 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.91 2af2 n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2af2 n GLY 141 N -0.05 1.01 0.00 0.00 0.00 -1.26 -2.05 105.19 102.84 2af2 n GLY 141 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2af2 n GLY 141 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2af2 n SER 142 N 2.36 0.00 -4.36 1.61 2.88 -1.26 -4.94 113.62 109.91 2af2 n SER 142 Ca 0.00 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.36 2af2 n SER 142 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 2af2 n SER 142 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2af2 s ARG 143 N 1.22 1.44 0.00 -1.46 0.52 -1.26 -1.07 118.95 118.34 2af2 s ARG 143 Ca 0.00 -1.76 0.00 0.00 -0.52 0.00 0.00 55.73 53.45 2af2 s ARG 143 Cb 0.00 -0.63 0.00 0.00 0.52 0.00 0.00 34.95 34.84 2af2 s ARG 143 CO 0.00 -0.15 0.00 1.47 0.02 0.00 0.00 175.30 176.64 2af2 n LEU 144 N -0.50 0.00 -4.77 2.53 -0.00 -0.74 -4.41 117.00 109.12 2af2 n LEU 144 Ca -0.03 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.67 2af2 n LEU 144 Cb 0.65 0.00 0.10 0.00 -0.00 0.00 0.00 43.42 44.17 2af2 n LEU 144 CO 0.38 0.00 0.69 0.00 -0.00 0.00 0.00 177.39 178.47 2af2 s ALA 145 N -2.00 2.13 -0.22 1.47 0.00 -1.26 -4.64 121.76 117.24 2af2 s ALA 145 Ca 0.00 0.05 -0.16 0.00 0.00 0.00 0.00 51.96 51.85 2af2 s ALA 145 Cb 0.00 -3.20 0.06 0.00 0.00 0.00 0.00 23.12 19.99 2af2 s ALA 145 CO 0.00 -1.82 0.57 0.00 0.00 0.00 0.00 175.76 174.50 2af2 s GLY 147 N 1.03 -0.55 0.41 0.00 0.00 -0.01 -3.01 107.32 105.18 2af2 s GLY 147 Ca -0.06 0.76 -0.15 0.00 0.00 0.00 0.00 44.72 45.28 2af2 s GLY 147 CO -0.09 0.43 0.83 0.14 0.00 0.00 0.00 173.10 174.41 2af2 s VAL 148 N -2.62 4.64 -0.30 1.40 1.01 -1.23 -0.64 120.40 122.65 2af2 s VAL 148 Ca -0.04 0.97 -0.10 0.00 0.00 0.00 0.00 61.98 62.80 2af2 s VAL 148 Cb -0.01 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 2af2 s VAL 148 CO -0.03 -0.43 0.16 -0.63 0.00 0.00 0.00 175.10 174.17 2af2 s ILE 149 N -2.29 4.76 0.22 2.22 -1.09 -0.52 -2.16 121.20 122.33 2af2 s ILE 149 Ca 0.55 -0.26 0.09 0.00 -2.23 0.00 0.00 60.65 58.80 2af2 s ILE 149 Cb -0.10 -3.37 -0.04 0.00 -1.58 0.00 0.00 42.46 37.36 2af2 s ILE 149 CO 0.25 0.13 -0.04 -0.83 -1.23 0.00 0.00 174.94 173.21 2af2 s GLY 150 N 1.65 1.70 -0.30 6.18 0.00 -0.36 -0.80 107.32 115.39 2af2 s GLY 150 Ca 0.05 -1.54 -0.21 0.00 0.00 0.00 0.00 44.72 43.02 2af2 s GLY 150 CO 0.07 -1.59 0.64 -0.26 0.00 0.00 0.00 173.10 171.97 2af2 s ILE 151 N -1.99 4.93 0.52 0.90 -5.25 -1.26 -0.52 121.20 118.51 2af2 s ILE 151 Ca 0.28 0.90 0.07 0.00 -0.99 0.00 0.00 60.65 60.90 2af2 s ILE 151 Cb -0.08 -4.01 0.03 0.00 2.95 0.00 0.00 42.46 41.35 2af2 s ILE 151 CO 0.18 -0.14 0.45 0.00 -1.79 0.00 0.00 174.94 173.64 2af2 s ALA 152 N 2.63 4.37 0.00 2.27 0.00 -0.69 -4.90 121.76 125.45 2af2 s ALA 152 Ca 0.26 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.66 2af2 s ALA 152 Cb -0.15 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.08 2af2 s ALA 152 CO 0.12 -0.46 0.00 1.04 0.00 0.00 0.00 175.76 176.46