#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 1.76 -3.64 0.00 -2.24 -0.96 -3.56 114.28 105.64 2af2 n THR 2 Ca 0.00 -0.39 -0.05 0.00 -2.27 0.00 0.00 64.05 61.33 2af2 n THR 2 Cb 0.00 -1.39 -0.07 0.00 -2.10 0.00 0.00 70.33 66.77 2af2 n THR 2 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2af2 s LYS 3 N 0.04 0.41 0.36 -0.78 1.02 -1.24 -4.43 119.74 115.12 2af2 s LYS 3 Ca 0.00 0.59 0.05 0.00 0.02 0.00 0.00 55.97 56.63 2af2 s LYS 3 Cb 0.00 0.15 -0.03 0.00 -0.52 0.00 0.00 37.83 37.43 2af2 s LYS 3 CO 0.00 -0.07 0.18 0.00 -0.92 0.00 0.00 175.35 174.55 2af2 s ALA 4 N 0.76 2.40 -0.22 5.17 0.00 0.15 -3.25 121.76 126.77 2af2 s ALA 4 Ca -0.02 -1.59 -0.11 0.00 0.00 0.00 0.00 51.96 50.23 2af2 s ALA 4 Cb -0.04 1.07 0.08 0.00 0.00 0.00 0.00 23.12 24.22 2af2 s ALA 4 CO -0.11 -0.48 0.53 0.54 0.00 0.00 0.00 175.76 176.24 2af2 s VAL 5 N -3.36 -0.19 -0.11 0.00 0.11 0.63 -2.39 120.40 115.09 2af2 s VAL 5 Ca 0.31 0.06 0.03 0.00 -2.93 0.00 0.00 61.98 59.45 2af2 s VAL 5 Cb 0.03 -0.79 -0.00 0.00 -1.53 0.00 0.00 36.38 34.09 2af2 s VAL 5 CO 0.19 0.03 -0.21 0.00 -3.33 0.00 0.00 175.10 171.78 2af2 s ALA 6 N 1.78 2.29 -0.65 1.54 0.00 -0.00 -1.45 121.76 125.27 2af2 s ALA 6 Ca -0.08 -0.96 -0.13 0.00 0.00 0.00 0.00 51.96 50.79 2af2 s ALA 6 Cb -0.08 -0.92 0.17 0.00 0.00 0.00 0.00 23.12 22.28 2af2 s ALA 6 CO -0.16 0.26 0.57 0.08 0.00 0.00 0.00 175.76 176.52 2af2 s VAL 7 N 0.37 5.08 -0.18 0.00 1.01 -1.23 -3.28 120.40 122.17 2af2 s VAL 7 Ca -0.16 -2.04 -0.21 0.00 0.00 0.00 0.00 61.98 59.57 2af2 s VAL 7 Cb -0.17 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 31.96 2af2 s VAL 7 CO 0.08 -0.92 0.63 -0.76 0.00 0.00 0.00 175.10 174.13 2af2 s LEU 8 N 0.87 4.16 0.29 3.92 1.02 -0.87 -4.20 118.68 123.87 2af2 s LEU 8 Ca 0.10 0.86 0.00 0.00 0.02 0.00 0.00 54.13 55.12 2af2 s LEU 8 Cb -0.21 -2.90 -0.02 0.00 0.02 0.00 0.00 46.19 43.08 2af2 s LEU 8 CO -0.03 -0.25 0.31 -0.54 0.02 0.00 0.00 176.35 175.86 2af2 s LYS 9 N 1.76 1.61 0.00 1.70 1.02 -0.97 -1.40 119.74 123.47 2af2 s LYS 9 Ca 0.29 -1.75 0.00 0.00 0.02 0.00 0.00 55.97 54.53 2af2 s LYS 9 Cb -0.16 0.36 0.00 0.00 -0.52 0.00 0.00 37.83 37.51 2af2 s LYS 9 CO 0.11 -0.61 0.00 0.41 -0.92 0.00 0.00 175.35 174.34 2af2 n GLY 10 N -0.48 -1.16 2.91 -3.33 0.00 -1.25 -1.44 105.19 100.44 2af2 n GLY 10 Ca 0.03 0.48 -0.43 0.00 0.00 0.00 0.00 46.02 46.10 2af2 n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2af2 n ASP 11 N 0.00 5.88 0.00 1.61 9.92 -1.26 -4.96 116.55 127.74 2af2 n ASP 11 Ca 0.00 -3.28 0.00 0.00 -0.53 0.00 0.00 54.79 50.98 2af2 n ASP 11 Cb 0.00 -1.37 0.00 0.00 -0.64 0.00 0.00 41.12 39.11 2af2 n ASP 11 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2af2 n GLY 12 N 1.96 0.95 0.00 0.44 0.00 -1.26 -0.57 105.19 106.71 2af2 n GLY 12 Ca 0.34 0.78 0.07 0.00 0.00 0.00 0.00 46.02 47.21 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 0.00 0.18 -2.55 1.61 -0.04 -1.26 -4.68 135.00 128.25 2af2 n PRO 13 Ca 0.00 0.17 -0.41 0.00 -0.04 0.00 0.00 63.50 63.22 2af2 n PRO 13 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 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 -2.60 3.99 0.05 0.52 1.01 0.26 -4.50 120.40 119.14 2af2 s VAL 14 Ca 0.12 1.70 -0.04 0.00 0.00 0.00 0.00 61.98 63.76 2af2 s VAL 14 Cb 0.09 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 2af2 s VAL 14 CO 0.21 0.28 0.06 0.00 0.00 0.00 0.00 175.10 175.65 2af2 s GLN 15 N -0.26 0.61 -0.25 2.72 0.00 -0.87 -4.38 119.66 117.23 2af2 s GLN 15 Ca 0.49 -0.91 -0.02 0.00 -0.00 0.00 0.00 55.36 54.92 2af2 s GLN 15 Cb -0.28 0.23 0.08 0.00 0.00 0.00 0.00 33.01 33.04 2af2 s GLN 15 CO 0.34 -0.15 0.06 0.20 0.00 0.00 0.00 175.29 175.74 2af2 s GLY 16 N -2.42 0.90 -0.18 2.60 0.00 -0.49 -1.53 107.32 106.19 2af2 s GLY 16 Ca -0.01 -1.18 -0.16 0.00 0.00 0.00 0.00 44.72 43.38 2af2 s GLY 16 CO -0.07 1.48 0.39 -1.50 0.00 0.00 0.00 173.10 173.41 2af2 s ILE 17 N 1.73 5.22 -0.05 0.90 -1.16 -0.87 -2.05 121.20 124.92 2af2 s ILE 17 Ca 0.03 0.73 -0.01 0.00 -0.51 0.00 0.00 60.65 60.89 2af2 s ILE 17 Cb -0.17 -3.73 0.03 0.00 0.61 0.00 0.00 42.46 39.20 2af2 s ILE 17 CO -0.16 0.29 0.02 0.27 -2.81 0.00 0.00 174.94 172.55 2af2 s ILE 18 N 1.00 0.18 0.57 2.00 -5.25 -1.21 -0.52 121.20 117.98 2af2 s ILE 18 Ca 0.20 0.22 -0.08 0.00 -0.99 0.00 0.00 60.65 60.00 2af2 s ILE 18 Cb -0.14 -0.36 -0.03 0.00 2.95 0.00 0.00 42.46 44.88 2af2 s ILE 18 CO 0.07 0.21 0.93 0.20 -1.79 0.00 0.00 174.94 174.57 2af2 s ASN 19 N 1.87 6.08 -0.03 4.36 0.02 0.44 -0.82 114.94 126.86 2af2 s ASN 19 Ca 0.02 1.12 0.00 0.00 -1.02 0.00 0.00 52.86 52.98 2af2 s ASN 19 Cb -0.12 -2.23 0.03 0.00 0.02 0.00 0.00 41.25 38.94 2af2 s ASN 19 CO -0.04 -0.83 0.01 -0.36 0.02 0.00 0.00 177.10 175.89 2af2 s PHE 20 N -3.01 0.25 0.39 2.20 0.08 -1.00 -1.54 117.98 115.34 2af2 s PHE 20 Ca 0.52 0.03 -0.12 0.00 0.12 0.00 0.00 56.93 57.48 2af2 s PHE 20 Cb -0.11 -0.36 -0.07 0.00 -0.57 0.00 0.00 43.02 41.91 2af2 s PHE 20 CO 0.49 -0.12 0.77 -1.83 -0.10 0.00 0.00 175.22 174.43 2af2 s GLU 21 N 1.00 3.83 -0.22 0.44 4.04 -0.06 0.34 118.70 128.07 2af2 s GLU 21 Ca -0.10 0.53 -0.23 0.00 0.04 0.00 0.00 54.97 55.22 2af2 s GLU 21 Cb -0.13 -2.39 0.06 0.00 0.02 0.00 0.00 34.13 31.69 2af2 s GLU 21 CO -0.02 -0.00 0.64 -1.14 -1.84 0.00 0.00 175.26 172.90 2af2 s GLN 22 N -3.66 0.77 -0.02 -4.83 -0.44 -1.23 -2.74 119.66 107.52 2af2 s GLN 22 Ca 0.52 0.83 -0.00 0.00 -2.50 0.00 0.00 55.36 54.21 2af2 s GLN 22 Cb -0.10 0.37 -0.00 0.00 -1.64 0.00 0.00 33.01 31.64 2af2 s GLN 22 CO 0.28 -0.11 -0.01 1.57 0.50 0.00 0.00 175.29 177.53 2af2 h LYS 23 N 4.96 0.00 -4.97 1.67 2.10 -1.84 0.25 116.57 118.73 2af2 h LYS 23 Ca -0.28 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.02 2af2 h LYS 23 Cb 1.16 0.00 -0.14 0.00 -0.90 0.00 0.00 32.23 32.35 2af2 h LYS 23 CO 0.12 0.00 -0.66 -1.21 -2.00 0.00 0.00 179.45 175.70 2af2 s GLU 24 N -1.11 1.24 0.55 0.07 8.01 -1.26 -2.04 118.70 124.16 2af2 s GLU 24 Ca -0.01 -1.62 0.25 0.00 0.01 0.00 0.00 54.97 53.61 2af2 s GLU 24 Cb 0.00 -0.47 1.44 0.00 -4.31 0.00 0.00 34.13 30.79 2af2 s GLU 24 CO 0.01 -0.11 2.04 0.77 0.01 0.00 0.00 175.26 177.98 2af2 h SER 25 N 2.56 0.00 -0.37 -0.19 0.02 -1.97 0.22 113.55 113.82 2af2 h SER 25 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2af2 h SER 25 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2af2 h SER 25 CO 0.64 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.92 2af2 n ASN 26 N -4.23 3.24 -4.91 3.07 5.03 -1.26 -4.76 115.26 111.43 2af2 n ASN 26 Ca 0.05 -1.96 -0.32 0.00 0.87 0.00 0.00 54.58 53.23 2af2 n ASN 26 Cb 0.45 -0.24 -0.04 0.00 -1.02 0.00 0.00 39.78 38.93 2af2 n ASN 26 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 2af2 s GLY 27 N -1.48 2.22 1.13 7.41 0.00 0.76 -5.09 107.32 112.26 2af2 s GLY 27 Ca 0.38 -0.68 -0.17 0.00 0.00 0.00 0.00 44.72 44.25 2af2 s GLY 27 CO 0.31 -0.62 1.10 2.56 0.00 0.00 0.00 173.10 176.45 2af2 s PRO 28 N -2.52 -0.64 0.08 2.90 0.04 -1.26 -4.59 135.00 128.99 2af2 s PRO 28 Ca 0.37 0.14 0.03 0.00 0.04 0.00 0.00 61.00 61.59 2af2 s PRO 28 Cb -0.13 -1.64 -0.03 0.00 0.04 0.00 0.00 34.50 32.74 2af2 s PRO 28 CO 0.25 -3.37 -0.10 0.08 0.04 0.00 0.00 177.00 173.90 2af2 s VAL 29 N -2.99 0.85 -0.24 -0.36 1.01 -0.19 -4.05 120.40 114.44 2af2 s VAL 29 Ca 0.69 -1.46 0.02 0.00 0.00 0.00 0.00 61.98 61.23 2af2 s VAL 29 Cb -0.13 -1.15 0.05 0.00 0.00 0.00 0.00 36.38 35.15 2af2 s VAL 29 CO 0.57 -0.48 -0.12 -0.54 0.00 0.00 0.00 175.10 174.52 2af2 s LYS 30 N -2.38 2.34 0.38 2.72 1.02 -1.11 -1.36 119.74 121.35 2af2 s LYS 30 Ca 0.01 -1.17 -0.22 0.00 0.02 0.00 0.00 55.97 54.61 2af2 s LYS 30 Cb -0.05 -2.76 -0.10 0.00 -0.52 0.00 0.00 37.83 34.39 2af2 s LYS 30 CO 0.00 -0.48 0.92 0.54 -0.92 0.00 0.00 175.35 175.40 2af2 s VAL 31 N 1.18 4.38 0.10 3.17 0.11 0.15 -0.88 120.40 128.60 2af2 s VAL 31 Ca -0.05 1.52 -0.21 0.00 -2.93 0.00 0.00 61.98 60.31 2af2 s VAL 31 Cb -0.18 -3.73 0.05 0.00 -1.53 0.00 0.00 36.38 30.99 2af2 s VAL 31 CO -0.07 -0.15 0.51 -1.66 -3.33 0.00 0.00 175.10 170.40 2af2 s TRP 32 N -1.96 -0.40 -5.00 1.54 -2.14 -0.59 -2.36 118.94 108.03 2af2 s TRP 32 Ca 0.57 0.27 0.00 0.00 2.66 0.00 0.00 56.10 59.60 2af2 s TRP 32 Cb -0.12 0.38 0.00 0.00 -3.10 0.00 0.00 33.47 30.63 2af2 s TRP 32 CO 0.17 -0.72 0.00 0.41 -2.66 0.00 0.00 176.95 174.15 2af2 n GLY 33 N 0.02 0.38 3.36 3.67 0.00 -0.82 -0.42 105.19 111.38 2af2 n GLY 33 Ca -0.17 -1.54 -0.09 0.00 0.00 0.00 0.00 46.02 44.21 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 -0.61 -0.28 1.61 1.04 0.32 -1.50 113.70 110.28 2af2 s SER 34 Ca 0.00 1.05 -0.04 0.00 0.48 0.00 0.00 55.95 57.44 2af2 s SER 34 Cb 0.00 0.98 0.02 0.00 0.10 0.00 0.00 66.02 67.12 2af2 s SER 34 CO 0.00 -0.21 0.02 -0.63 0.98 0.00 0.00 173.24 173.40 2af2 s ILE 35 N 1.57 3.44 0.30 -1.02 -1.09 0.07 -2.05 121.20 122.42 2af2 s ILE 35 Ca -0.09 -0.93 0.02 0.00 -2.23 0.00 0.00 60.65 57.42 2af2 s ILE 35 Cb -0.08 -2.81 -0.05 0.00 -1.58 0.00 0.00 42.46 37.95 2af2 s ILE 35 CO -0.15 0.08 0.11 -1.59 -1.23 0.00 0.00 174.94 172.16 2af2 s LYS 36 N 1.40 1.56 0.00 2.79 -2.85 -0.59 -0.49 119.74 121.57 2af2 s LYS 36 Ca 0.00 -1.88 0.00 0.00 -1.00 0.00 0.00 55.97 53.10 2af2 s LYS 36 Cb -0.17 -0.35 0.00 0.00 -2.06 0.00 0.00 37.83 35.24 2af2 s LYS 36 CO -0.00 -0.34 0.00 0.41 0.10 0.00 0.00 175.35 175.51 2af2 n GLY 37 N -0.58 0.60 3.95 0.59 0.00 -1.23 -2.06 105.19 106.46 2af2 n GLY 37 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 2af2 n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2af2 s LEU 38 N 0.00 2.90 0.58 0.99 1.43 -1.16 -4.80 118.68 118.62 2af2 s LEU 38 Ca 0.00 0.14 -0.07 0.00 -1.03 0.00 0.00 54.13 53.17 2af2 s LEU 38 Cb 0.00 -2.62 -0.01 0.00 0.03 0.00 0.00 46.19 43.59 2af2 s LEU 38 CO 0.00 -1.82 0.92 0.28 0.23 0.00 0.00 176.35 175.96 2af2 s THR 39 N -3.27 4.09 0.94 5.49 -1.32 -1.26 -4.14 115.64 116.16 2af2 s THR 39 Ca 0.64 0.24 -0.10 0.00 -1.21 0.00 0.00 61.69 61.26 2af2 s THR 39 Cb -0.08 -3.62 0.16 0.00 -1.51 0.00 0.00 72.50 67.45 2af2 s THR 39 CO 0.45 -0.68 1.13 -1.83 -2.21 0.00 0.00 174.62 171.49 2af2 s GLU 40 N -5.01 0.84 0.09 7.08 -1.05 -1.17 -4.59 118.70 114.88 2af2 s GLU 40 Ca 0.53 1.46 0.00 0.00 -0.15 0.00 0.00 54.97 56.81 2af2 s GLU 40 Cb -0.11 -1.71 0.00 0.00 -0.44 0.00 0.00 34.13 31.87 2af2 s GLU 40 CO 0.47 -2.73 0.00 0.41 0.95 0.00 0.00 175.26 174.36 2af2 n GLY 41 N 0.23 -2.93 3.78 -3.83 0.00 -0.40 -4.85 105.19 97.19 2af2 n GLY 41 Ca 0.11 -1.98 -0.34 0.00 0.00 0.00 0.00 46.02 43.80 2af2 n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2af2 s LEU 42 N 0.00 3.72 -0.22 0.99 2.01 -1.26 -0.77 118.68 123.14 2af2 s LEU 42 Ca 0.00 2.04 -0.05 0.00 0.01 0.00 0.00 54.13 56.13 2af2 s LEU 42 Cb 0.00 -4.57 0.11 0.00 0.01 0.00 0.00 46.19 41.75 2af2 s LEU 42 CO 0.00 -1.11 0.42 -1.00 1.01 0.00 0.00 176.35 175.66 2af2 s HIS 43 N -1.97 -0.86 0.71 0.29 3.76 0.15 -3.46 115.29 113.90 2af2 s HIS 43 Ca 0.69 1.27 -0.16 0.00 -0.15 0.00 0.00 55.06 56.71 2af2 s HIS 43 Cb -0.20 0.21 0.02 0.00 1.11 0.00 0.00 32.58 33.72 2af2 s HIS 43 CO 0.27 -0.60 1.16 0.41 -0.85 0.00 0.00 174.74 175.13 2af2 n GLY 44 N 5.38 0.07 2.85 -2.22 0.00 -0.21 0.23 105.19 111.29 2af2 n GLY 44 Ca -0.06 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 2af2 n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2af2 s PHE 45 N -1.71 -0.72 -0.00 1.61 5.36 -0.17 -0.53 117.98 121.82 2af2 s PHE 45 Ca 0.77 0.28 -0.03 0.00 -0.96 0.00 0.00 56.93 56.99 2af2 s PHE 45 Cb -0.35 -0.23 -0.00 0.00 -0.34 0.00 0.00 43.02 42.09 2af2 s PHE 45 CO 0.46 -0.86 0.05 -1.01 -1.46 0.00 0.00 175.22 172.40 2af2 s HIS 46 N 2.46 0.07 -0.01 10.12 3.76 -0.49 -0.90 115.29 130.31 2af2 s HIS 46 Ca 0.10 -0.15 -0.09 0.00 -0.15 0.00 0.00 55.06 54.77 2af2 s HIS 46 Cb -0.14 -0.07 -0.05 0.00 1.11 0.00 0.00 32.58 33.43 2af2 s HIS 46 CO -0.26 -0.15 0.29 0.14 -0.85 0.00 0.00 174.74 173.91 2af2 s VAL 47 N -0.84 5.26 -0.16 -0.90 -7.23 -0.02 -0.44 120.40 116.06 2af2 s VAL 47 Ca -0.09 0.35 -0.01 0.00 -1.81 0.00 0.00 61.98 60.42 2af2 s VAL 47 Cb -0.06 -3.57 -0.00 0.00 0.56 0.00 0.00 36.38 33.31 2af2 s VAL 47 CO 0.00 0.45 -0.13 -1.00 -0.31 0.00 0.00 175.10 174.11 2af2 s HIS 48 N -1.21 2.82 -0.44 2.82 3.76 0.30 -4.37 115.29 118.97 2af2 s HIS 48 Ca 0.25 -0.96 0.00 0.00 -0.15 0.00 0.00 55.06 54.19 2af2 s HIS 48 Cb -0.14 -1.92 0.00 0.00 1.11 0.00 0.00 32.58 31.63 2af2 s HIS 48 CO 0.13 -0.45 0.09 -1.91 -0.85 0.00 0.00 174.74 171.76 2af2 n GLU 49 N 4.11 0.12 -3.69 1.40 4.07 -1.26 -1.41 120.64 123.97 2af2 n GLU 49 Ca -0.19 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 56.80 2af2 n GLU 49 Cb 0.52 -1.27 -0.12 0.00 -0.06 0.00 0.00 31.44 30.51 2af2 n GLU 49 CO 0.00 0.00 0.00 -0.06 -0.06 0.00 0.00 177.13 177.01 2af2 s PHE 50 N 0.05 -0.53 -0.43 4.31 0.08 -1.26 -4.98 117.98 115.21 2af2 s PHE 50 Ca 0.00 1.14 0.23 0.00 0.12 0.00 0.00 56.93 58.42 2af2 s PHE 50 Cb 0.00 0.16 0.32 0.00 -0.57 0.00 0.00 43.02 42.93 2af2 s PHE 50 CO 0.00 -0.34 1.56 0.78 -0.10 0.00 0.00 175.22 177.12 2af2 h GLY 51 N 7.52 0.00 -4.35 4.36 0.00 -1.61 -3.29 103.07 105.70 2af2 h GLY 51 Ca -0.30 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 46.81 2af2 h GLY 51 CO 0.26 0.00 0.35 1.22 0.00 0.00 0.00 176.54 178.37 2af2 n ASP 52 N -3.03 4.72 -0.21 0.19 8.00 -1.26 -3.20 116.55 121.76 2af2 n ASP 52 Ca 0.04 -2.32 -0.00 0.00 0.71 0.00 0.00 54.79 53.21 2af2 n ASP 52 Cb 0.53 -1.19 -0.00 0.00 -0.02 0.00 0.00 41.12 40.44 2af2 n ASP 52 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2af2 n ASN 53 N 2.80 -0.04 -2.05 -2.24 0.23 -1.26 -5.03 115.26 107.66 2af2 n ASN 53 Ca 0.40 -0.23 -0.02 0.00 -0.53 0.00 0.00 54.58 54.20 2af2 n ASN 53 Cb 0.66 0.01 -0.03 0.00 -2.08 0.00 0.00 39.78 38.34 2af2 n ASN 53 CO 0.00 0.00 0.00 1.07 -0.93 0.00 0.00 177.26 177.40 2af2 n THR 54 N 0.00 0.84 0.00 5.53 5.66 -1.19 -3.93 114.28 121.18 2af2 n THR 54 Ca -0.01 -0.32 0.00 0.00 -3.05 0.00 0.00 64.05 60.66 2af2 n THR 54 Cb 0.15 -1.39 0.00 0.00 -1.55 0.00 0.00 70.33 67.53 2af2 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2af2 n ALA 55 N 2.27 1.93 0.00 1.79 0.00 -1.25 -4.71 120.51 120.56 2af2 n ALA 55 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2af2 n ALA 55 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.69 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 1.12 -1.22 0.34 0.00 0.00 -0.83 -3.80 105.19 100.80 2af2 n GLY 56 Ca 0.00 -2.11 0.14 0.00 0.00 0.00 0.00 46.02 44.05 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 -2.94 0.77 0.00 0.00 5.66 -1.26 -4.21 114.28 112.30 2af2 n THR 58 Ca -0.01 0.19 0.00 0.00 -3.05 0.00 0.00 64.05 61.19 2af2 n THR 58 Cb 0.48 -0.98 0.00 0.00 -1.55 0.00 0.00 70.33 68.29 2af2 n THR 58 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2af2 n SER 59 N -1.34 0.00 -4.55 1.09 2.88 -0.75 -5.07 113.62 105.88 2af2 n SER 59 Ca 0.05 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.17 2af2 n SER 59 Cb 0.12 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.51 2af2 n SER 59 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2af2 s ALA 60 N -0.69 3.39 0.00 -1.46 0.00 -0.93 -4.89 121.76 117.19 2af2 s ALA 60 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 50.98 2af2 s ALA 60 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2af2 s ALA 60 CO 0.00 -1.59 0.00 0.41 0.00 0.00 0.00 175.76 174.58 2af2 n GLY 61 N 4.83 0.76 3.98 0.00 0.00 -1.26 -4.56 105.19 108.94 2af2 n GLY 61 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 2af2 n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2af2 s PRO 62 N 0.93 2.12 -0.35 1.61 0.04 -1.26 -5.08 135.00 133.00 2af2 s PRO 62 Ca 0.00 -0.92 -0.17 0.00 0.04 0.00 0.00 61.00 59.94 2af2 s PRO 62 Cb 0.00 -2.40 -0.00 0.00 0.04 0.00 0.00 34.50 32.13 2af2 s PRO 62 CO 0.00 -1.08 0.46 -3.38 0.04 0.00 0.00 177.00 173.04 2af2 s HIS 63 N -2.96 3.19 0.54 0.56 -3.43 -1.26 -4.92 115.29 107.00 2af2 s HIS 63 Ca 0.62 0.07 -0.22 0.00 -0.80 0.00 0.00 55.06 54.73 2af2 s HIS 63 Cb -0.08 -2.86 -0.06 0.00 -1.43 0.00 0.00 32.58 28.16 2af2 s HIS 63 CO 0.41 -0.53 1.29 1.19 -2.00 0.00 0.00 174.74 175.10 2af2 n PHE 64 N 5.63 2.05 -3.76 0.38 3.72 -1.26 -4.97 117.46 119.26 2af2 n PHE 64 Ca -0.06 0.44 -0.29 0.00 -0.05 0.00 0.00 57.45 57.49 2af2 n PHE 64 Cb 0.49 -2.33 -0.12 0.00 -0.94 0.00 0.00 39.48 36.57 2af2 n PHE 64 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2af2 s ASN 65 N -0.91 3.77 0.37 4.37 4.22 -1.26 -4.51 114.94 120.99 2af2 s ASN 65 Ca 0.71 -3.12 0.06 0.00 -2.14 0.00 0.00 52.86 48.37 2af2 s ASN 65 Cb -0.43 -1.22 0.73 0.00 1.28 0.00 0.00 41.25 41.61 2af2 s ASN 65 CO 0.50 -0.19 1.98 1.55 -2.04 0.00 0.00 177.10 178.89 2af2 h PRO 66 N 6.14 0.55 0.00 3.55 0.13 -1.96 0.09 132.00 140.49 2af2 h PRO 66 Ca 0.07 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2af2 h PRO 66 Cb 0.87 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2af2 h PRO 66 CO 0.57 0.46 0.00 1.28 -0.23 0.00 0.00 178.00 180.07 2af2 n LEU 67 N -4.39 0.00 -3.10 1.56 7.99 -1.26 -4.93 117.00 112.87 2af2 n LEU 67 Ca 0.03 0.25 -0.16 0.00 -0.01 0.00 0.00 56.01 56.11 2af2 n LEU 67 Cb 0.14 -0.25 0.07 0.00 -0.11 0.00 0.00 43.42 43.28 2af2 n LEU 67 CO 0.37 -0.04 0.13 -0.24 -1.51 0.00 0.00 177.39 176.10 2af2 n SER 68 N -1.25 -3.07 -4.76 -1.43 2.88 0.02 -5.03 113.62 100.98 2af2 n SER 68 Ca 0.13 -0.51 -0.31 0.00 -1.33 0.00 0.00 58.87 56.86 2af2 n SER 68 Cb 0.19 -4.45 -0.07 0.00 -0.75 0.00 0.00 64.21 59.13 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 -5.43 2.17 0.75 -1.46 1.70 -1.26 -5.13 118.95 110.29 2af2 s ARG 69 Ca 0.14 -2.26 -0.11 0.00 -0.47 0.00 0.00 55.73 53.04 2af2 s ARG 69 Cb -0.06 -1.67 0.04 0.00 -0.57 0.00 0.00 34.95 32.69 2af2 s ARG 69 CO 0.63 -0.34 1.09 0.15 -1.08 0.00 0.00 175.30 175.74 2af2 s LYS 70 N -3.92 2.40 -0.06 3.89 1.02 -1.26 -4.88 119.74 116.93 2af2 s LYS 70 Ca 0.17 1.15 -0.30 0.00 0.02 0.00 0.00 55.97 57.01 2af2 s LYS 70 Cb 0.02 -1.92 -0.05 0.00 -0.52 0.00 0.00 37.83 35.37 2af2 s LYS 70 CO 0.09 -1.53 1.59 -1.58 -0.92 0.00 0.00 175.35 173.00 2af2 s HIS 71 N -2.89 2.17 0.00 3.18 5.65 -0.44 -3.66 115.29 119.30 2af2 s HIS 71 Ca 0.61 0.35 0.00 0.00 0.25 0.00 0.00 55.06 56.26 2af2 s HIS 71 Cb -0.17 -3.85 0.00 0.00 -1.18 0.00 0.00 32.58 27.38 2af2 s HIS 71 CO 0.55 -3.49 0.00 0.41 -0.65 0.00 0.00 174.74 171.56 2af2 n GLY 72 N 4.02 2.69 0.00 1.59 0.00 -1.26 -1.80 105.19 110.43 2af2 n GLY 72 Ca 0.16 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 1.88 1.99 -0.02 0.00 -1.26 -4.27 105.19 103.51 2af2 n GLY 73 Ca 0.00 -0.80 -0.06 0.00 0.00 0.00 0.00 46.02 45.16 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 0.00 1.24 0.00 1.61 -0.04 -1.26 -1.32 135.00 135.23 2af2 n PRO 74 Ca 0.00 -0.51 0.00 0.00 -0.04 0.00 0.00 63.50 62.95 2af2 n PRO 74 Cb 0.00 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.81 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 2.34 0.00 -4.40 0.54 2.85 -1.26 -5.06 118.16 113.17 2af2 n LYS 75 Ca 0.22 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 57.26 2af2 n LYS 75 Cb 0.58 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.88 2af2 n LYS 75 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2af2 s ASP 76 N 0.00 2.13 0.00 -5.58 -1.08 -0.43 -5.09 116.67 106.62 2af2 s ASP 76 Ca 0.00 -1.67 0.12 0.00 -0.52 0.00 0.00 52.55 50.48 2af2 s ASP 76 Cb 0.00 0.49 -0.01 0.00 -1.46 0.00 0.00 42.92 41.95 2af2 s ASP 76 CO 0.00 -0.96 0.69 1.21 0.52 0.00 0.00 175.17 176.63 2af2 n GLU 77 N -0.74 2.00 0.00 4.34 2.13 -1.26 -4.24 120.64 122.86 2af2 n GLU 77 Ca -0.00 -0.65 0.00 0.00 0.66 0.00 0.00 57.16 57.17 2af2 n GLU 77 Cb 0.64 -1.13 0.00 0.00 0.27 0.00 0.00 31.44 31.22 2af2 n GLU 77 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2af2 n GLU 78 N -0.24 0.00 -0.23 5.31 -0.58 -1.26 -4.97 120.64 118.68 2af2 n GLU 78 Ca 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 2af2 n GLU 78 Cb 0.24 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.11 2af2 n GLU 78 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2af2 n ARG 79 N 0.00 0.00 -0.79 3.49 0.63 -1.25 -4.61 116.66 114.13 2af2 n ARG 79 Ca 0.00 0.21 -0.32 0.00 -0.92 0.00 0.00 57.85 56.82 2af2 n ARG 79 Cb 0.00 -0.02 0.14 0.00 0.45 0.00 0.00 32.46 33.04 2af2 n ARG 79 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 2af2 n HIS 80 N 1.75 0.05 -0.53 -0.14 8.25 -1.24 -4.87 115.22 118.50 2af2 n HIS 80 Ca 0.00 0.34 0.43 0.00 -0.26 0.00 0.00 57.72 58.23 2af2 n HIS 80 Cb 0.00 -1.94 0.72 0.00 1.12 0.00 0.00 29.99 29.90 2af2 n HIS 80 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 2af2 h VAL 81 N -1.60 0.11 -2.91 1.59 3.04 -1.94 -3.32 116.25 111.21 2af2 h VAL 81 Ca -0.44 -0.01 -0.21 0.00 -1.01 0.00 0.00 66.70 65.03 2af2 h VAL 81 Cb 1.28 0.06 -0.32 0.00 -2.01 0.00 0.00 31.29 30.30 2af2 h VAL 81 CO 0.39 0.01 -0.52 -0.83 -1.01 0.00 0.00 177.57 175.62 2af2 s GLY 82 N -4.04 -0.12 -0.33 3.17 0.00 -1.26 -4.72 107.32 100.01 2af2 s GLY 82 Ca -0.06 0.96 0.06 0.00 0.00 0.00 0.00 44.72 45.67 2af2 s GLY 82 CO 0.85 1.75 0.56 0.99 0.00 0.00 0.00 173.10 177.25 2af2 s ASP 83 N 2.07 -1.15 -0.79 1.64 1.01 -1.25 -0.84 116.67 117.36 2af2 s ASP 83 Ca -0.02 -0.29 -0.03 0.00 0.71 0.00 0.00 52.55 52.93 2af2 s ASP 83 Cb -0.11 1.80 0.23 0.00 1.01 0.00 0.00 42.92 45.84 2af2 s ASP 83 CO -0.09 -0.27 2.28 0.18 0.21 0.00 0.00 175.17 177.48 2af2 n LEU 84 N 5.04 7.22 0.00 1.23 7.99 -0.08 -4.92 117.00 133.49 2af2 n LEU 84 Ca 0.06 -4.67 0.00 0.00 -0.01 0.00 0.00 56.01 51.39 2af2 n LEU 84 Cb 0.54 -1.16 0.00 0.00 -0.11 0.00 0.00 43.42 42.68 2af2 n LEU 84 CO -0.03 1.82 0.00 0.61 -1.51 0.00 0.00 177.39 178.29 2af2 n GLY 85 N 0.20 2.11 3.00 -0.72 0.00 -1.24 -4.44 105.19 104.09 2af2 n GLY 85 Ca 0.52 0.44 -0.19 0.00 0.00 0.00 0.00 46.02 46.80 2af2 n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2af2 s ASN 86 N -4.00 1.02 0.10 1.61 2.20 -1.26 -0.99 114.94 113.62 2af2 s ASN 86 Ca 0.00 -0.16 -0.14 0.00 -0.94 0.00 0.00 52.86 51.62 2af2 s ASN 86 Cb 0.00 -0.17 -0.07 0.00 -2.00 0.00 0.00 41.25 39.01 2af2 s ASN 86 CO 0.00 0.08 0.51 0.68 -2.94 0.00 0.00 177.10 175.43 2af2 s VAL 87 N -0.04 4.90 -0.14 3.54 -7.23 0.14 -4.78 120.40 116.79 2af2 s VAL 87 Ca 0.01 0.82 0.02 0.00 -1.81 0.00 0.00 61.98 61.02 2af2 s VAL 87 Cb -0.05 -3.74 0.01 0.00 0.56 0.00 0.00 36.38 33.16 2af2 s VAL 87 CO -0.00 0.34 -0.18 -0.89 -0.31 0.00 0.00 175.10 174.06 2af2 s THR 88 N -1.35 1.80 0.26 5.32 2.01 -1.26 0.29 115.64 122.72 2af2 s THR 88 Ca 0.34 -0.81 0.03 0.00 0.31 0.00 0.00 61.69 61.56 2af2 s THR 88 Cb -0.16 -1.63 -0.03 0.00 0.01 0.00 0.00 72.50 70.69 2af2 s THR 88 CO 0.18 0.50 0.41 0.00 -0.69 0.00 0.00 174.62 175.02 2af2 s ALA 89 N 1.05 3.86 0.86 7.40 0.00 0.05 -4.25 121.76 130.73 2af2 s ALA 89 Ca -0.03 -1.09 -0.11 0.00 0.00 0.00 0.00 51.96 50.72 2af2 s ALA 89 Cb -0.15 -1.86 0.15 0.00 0.00 0.00 0.00 23.12 21.26 2af2 s ALA 89 CO -0.05 0.20 1.20 0.34 0.00 0.00 0.00 175.76 177.45 2af2 s ASP 90 N -3.88 3.82 0.34 0.00 2.15 -0.20 -1.28 116.67 117.62 2af2 s ASP 90 Ca 0.36 0.29 0.27 0.00 0.43 0.00 0.00 52.55 53.90 2af2 s ASP 90 Cb -0.09 -0.56 1.05 0.00 -0.30 0.00 0.00 42.92 43.01 2af2 s ASP 90 CO 0.31 -2.27 1.79 0.07 -0.17 0.00 0.00 175.17 174.90 2af2 h LYS 91 N -1.20 0.00 0.00 4.34 -0.00 -1.91 -0.85 116.57 116.95 2af2 h LYS 91 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.22 2af2 h LYS 91 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.50 2af2 h LYS 91 CO 0.47 0.00 0.00 -0.40 -0.00 0.00 0.00 179.45 179.52 2af2 n ASP 92 N -2.51 0.50 0.00 7.07 5.75 -1.26 -4.83 116.55 121.27 2af2 n ASP 92 Ca 0.02 0.60 0.00 0.00 -0.01 0.00 0.00 54.79 55.40 2af2 n ASP 92 Cb 0.28 -0.72 0.00 0.00 -1.03 0.00 0.00 41.12 39.66 2af2 n ASP 92 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2af2 n GLY 93 N 0.36 0.34 3.70 6.12 0.00 -0.33 -4.71 105.19 110.67 2af2 n GLY 93 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.06 5.15 -0.27 1.61 0.11 -1.26 -2.99 120.40 120.70 2af2 s VAL 94 Ca 0.00 0.97 -0.17 0.00 -2.93 0.00 0.00 61.98 59.85 2af2 s VAL 94 Cb 0.00 -3.83 -0.03 0.00 -1.53 0.00 0.00 36.38 30.99 2af2 s VAL 94 CO 0.00 0.27 0.48 0.00 -3.33 0.00 0.00 175.10 172.52 2af2 s ALA 95 N 1.02 3.58 0.11 1.54 0.00 0.36 -1.04 121.76 127.33 2af2 s ALA 95 Ca 0.26 -0.66 -0.21 0.00 0.00 0.00 0.00 51.96 51.34 2af2 s ALA 95 Cb -0.15 -2.86 -0.07 0.00 0.00 0.00 0.00 23.12 20.04 2af2 s ALA 95 CO 0.10 -0.74 0.64 0.34 0.00 0.00 0.00 175.76 176.10 2af2 s ASP 96 N 1.57 7.15 -0.04 0.00 2.15 -1.26 -0.75 116.67 125.49 2af2 s ASP 96 Ca 0.20 1.38 0.01 0.00 0.43 0.00 0.00 52.55 54.57 2af2 s ASP 96 Cb -0.16 -2.40 0.02 0.00 -0.30 0.00 0.00 42.92 40.08 2af2 s ASP 96 CO 0.09 0.24 -0.06 -0.69 -0.17 0.00 0.00 175.17 174.58 2af2 s VAL 97 N -1.16 0.62 -0.45 1.11 1.01 -0.56 -4.81 120.40 116.16 2af2 s VAL 97 Ca 0.32 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.17 2af2 s VAL 97 Cb -0.20 -0.61 0.32 0.00 0.00 0.00 0.00 36.38 35.89 2af2 s VAL 97 CO 0.21 0.23 1.06 -1.54 0.00 0.00 0.00 175.10 175.06 2af2 n SER 98 N 3.82 -1.92 -4.87 3.32 3.41 -1.26 -1.94 113.62 114.19 2af2 n SER 98 Ca -0.23 -3.60 -0.36 0.00 -0.26 0.00 0.00 58.87 54.41 2af2 n SER 98 Cb 0.52 1.58 -0.06 0.00 -0.26 0.00 0.00 64.21 65.99 2af2 n SER 98 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2af2 s ILE 99 N -0.09 5.21 -0.06 -1.33 1.09 -1.00 -4.94 121.20 120.08 2af2 s ILE 99 Ca 0.25 0.44 0.05 0.00 -1.10 0.00 0.00 60.65 60.28 2af2 s ILE 99 Cb 0.30 -3.60 -0.02 0.00 -1.06 0.00 0.00 42.46 38.08 2af2 s ILE 99 CO -0.06 0.46 -0.20 -0.70 -0.10 0.00 0.00 174.94 174.34 2af2 s GLU 100 N -1.46 2.60 -0.09 2.79 2.12 -1.26 0.30 118.70 123.70 2af2 s GLU 100 Ca 0.25 -0.80 -0.20 0.00 0.36 0.00 0.00 54.97 54.58 2af2 s GLU 100 Cb -0.14 -2.29 0.04 0.00 0.26 0.00 0.00 34.13 32.00 2af2 s GLU 100 CO 0.13 0.47 0.47 0.34 -0.54 0.00 0.00 175.26 176.14 2af2 s ASP 101 N -0.35 -0.43 -0.54 -1.70 -1.08 -0.46 -5.01 116.67 107.10 2af2 s ASP 101 Ca 0.02 0.60 0.05 0.00 -0.52 0.00 0.00 52.55 52.70 2af2 s ASP 101 Cb -0.12 0.64 0.38 0.00 -1.46 0.00 0.00 42.92 42.35 2af2 s ASP 101 CO 0.02 -0.38 1.09 -0.24 0.52 0.00 0.00 175.17 176.18 2af2 n SER 102 N 1.77 4.79 0.00 -0.34 2.88 -1.26 -1.02 113.62 120.44 2af2 n SER 102 Ca -0.18 -3.71 0.00 0.00 -1.33 0.00 0.00 58.87 53.65 2af2 n SER 102 Cb 0.56 -0.55 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 2af2 n SER 102 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2af2 n VAL 103 N -0.36 0.00 -3.68 2.46 3.14 -1.26 -4.98 118.33 113.65 2af2 n VAL 103 Ca 0.36 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.51 2af2 n VAL 103 Cb 0.51 -0.03 -0.02 0.00 -1.06 0.00 0.00 33.84 33.24 2af2 n VAL 103 CO 0.00 0.00 0.00 0.27 -6.46 0.00 0.00 176.83 170.64 2af2 s ILE 104 N -1.03 5.19 0.18 1.55 -0.00 -1.26 -4.95 121.20 120.88 2af2 s ILE 104 Ca 0.00 -0.70 -0.19 0.00 -0.00 0.00 0.00 60.65 59.76 2af2 s ILE 104 Cb 0.00 -3.85 0.04 0.00 -0.00 0.00 0.00 42.46 38.65 2af2 s ILE 104 CO 0.00 -0.42 0.54 -0.94 -0.00 0.00 0.00 174.94 174.12 2af2 s SER 105 N -3.94 -0.34 -1.37 4.36 1.04 -1.26 -4.11 113.70 108.08 2af2 s SER 105 Ca 0.37 -0.34 -0.14 0.00 0.48 0.00 0.00 55.95 56.32 2af2 s SER 105 Cb -0.09 0.58 0.08 0.00 0.10 0.00 0.00 66.02 66.69 2af2 s SER 105 CO 0.32 -1.03 1.98 0.18 0.98 0.00 0.00 173.24 175.67 2af2 n LEU 106 N -0.35 6.21 -4.20 2.42 4.77 -1.26 -1.69 117.00 122.90 2af2 n LEU 106 Ca -0.12 -4.20 -0.14 0.00 -0.03 0.00 0.00 56.01 51.52 2af2 n LEU 106 Cb 0.63 -1.65 -0.10 0.00 -2.33 0.00 0.00 43.42 39.97 2af2 n LEU 106 CO 0.15 0.88 -0.41 -0.55 -1.33 0.00 0.00 177.39 176.13 2af2 s SER 107 N 3.03 1.54 -0.38 -1.43 0.15 -1.26 -4.68 113.70 110.67 2af2 s SER 107 Ca 0.47 -0.92 0.05 0.00 0.70 0.00 0.00 55.95 56.26 2af2 s SER 107 Cb 0.09 0.01 0.45 0.00 -1.71 0.00 0.00 66.02 64.87 2af2 s SER 107 CO -0.02 -0.32 1.31 0.61 1.20 0.00 0.00 173.24 176.02 2af2 n GLY 108 N 0.19 6.25 0.00 9.45 0.00 -1.26 -1.48 105.19 118.33 2af2 n GLY 108 Ca -0.13 -2.64 0.00 0.00 0.00 0.00 0.00 46.02 43.25 2af2 n GLY 108 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2af2 n ASP 109 N -0.69 0.00 -0.11 1.61 5.68 -1.26 -4.92 116.55 116.86 2af2 n ASP 109 Ca 0.46 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.78 2af2 n ASP 109 Cb 0.86 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.90 2af2 n ASP 109 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2af2 n HIS 110 N -0.18 0.08 -1.29 2.11 8.25 -1.26 -5.03 115.22 117.90 2af2 n HIS 110 Ca 0.00 -0.64 0.00 0.00 -0.26 0.00 0.00 57.72 56.82 2af2 n HIS 110 Cb 0.00 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.03 2af2 n HIS 110 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2af2 n SER 111 N -0.64 0.00 0.02 0.41 2.88 -1.26 -4.98 113.62 110.05 2af2 n SER 111 Ca 0.06 -0.08 0.11 0.00 -1.33 0.00 0.00 58.87 57.63 2af2 n SER 111 Cb 0.39 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.89 2af2 n SER 111 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2af2 n ILE 112 N -0.11 0.13 -2.35 2.46 -5.35 -0.68 -4.66 119.36 108.79 2af2 n ILE 112 Ca 0.00 -0.18 -0.42 0.00 -0.27 0.00 0.00 62.75 61.87 2af2 n ILE 112 Cb 0.00 0.29 -0.03 0.00 -1.74 0.00 0.00 39.64 38.17 2af2 n ILE 112 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2af2 s ILE 113 N -3.15 3.97 0.00 7.28 -1.09 -0.55 -1.93 121.20 125.73 2af2 s ILE 113 Ca 0.05 1.34 0.00 0.00 -2.23 0.00 0.00 60.65 59.81 2af2 s ILE 113 Cb 0.15 -3.86 0.00 0.00 -1.58 0.00 0.00 42.46 37.17 2af2 s ILE 113 CO 0.79 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 175.13 2af2 n GLY 114 N 3.47 1.12 3.96 6.18 0.00 -0.48 -4.26 105.19 115.18 2af2 n GLY 114 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 2af2 n GLY 114 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2af2 s ARG 115 N -0.01 2.73 0.31 1.61 3.52 -0.81 -1.97 118.95 124.34 2af2 s ARG 115 Ca 0.00 -0.58 0.09 0.00 -0.13 0.00 0.00 55.73 55.11 2af2 s ARG 115 Cb 0.00 -2.47 -0.05 0.00 -1.56 0.00 0.00 34.95 30.87 2af2 s ARG 115 CO 0.00 -0.59 0.05 0.99 -0.81 0.00 0.00 175.30 174.93 2af2 s THR 116 N -2.74 3.04 -0.04 4.11 2.01 -0.50 -0.68 115.64 120.83 2af2 s THR 116 Ca 0.54 -1.87 -0.00 0.00 0.31 0.00 0.00 61.69 60.67 2af2 s THR 116 Cb -0.10 -2.86 0.03 0.00 0.01 0.00 0.00 72.50 69.57 2af2 s THR 116 CO 0.39 -0.26 0.01 -0.22 -0.69 0.00 0.00 174.62 173.85 2af2 s LEU 117 N -3.74 0.90 -0.12 4.42 2.96 0.34 -0.54 118.68 122.91 2af2 s LEU 117 Ca 0.35 -0.03 -0.07 0.00 -0.22 0.00 0.00 54.13 54.16 2af2 s LEU 117 Cb -0.03 -0.28 -0.04 0.00 0.50 0.00 0.00 46.19 46.34 2af2 s LEU 117 CO 0.21 -0.14 0.14 0.54 -1.32 0.00 0.00 176.35 175.77 2af2 s VAL 118 N 1.39 5.47 -0.03 1.68 0.11 0.41 -1.39 120.40 128.04 2af2 s VAL 118 Ca -0.04 0.18 0.00 0.00 -2.93 0.00 0.00 61.98 59.19 2af2 s VAL 118 Cb -0.13 -3.39 -0.03 0.00 -1.53 0.00 0.00 36.38 31.30 2af2 s VAL 118 CO -0.03 0.61 0.01 0.54 -3.33 0.00 0.00 175.10 172.90 2af2 s VAL 119 N -1.04 4.25 0.29 2.04 0.11 0.10 -1.39 120.40 124.77 2af2 s VAL 119 Ca 0.15 -0.46 0.09 0.00 -2.93 0.00 0.00 61.98 58.84 2af2 s VAL 119 Cb -0.12 -2.86 -0.06 0.00 -1.53 0.00 0.00 36.38 31.81 2af2 s VAL 119 CO 0.04 0.46 -0.12 -1.00 -3.33 0.00 0.00 175.10 171.15 2af2 s HIS 120 N -1.02 2.17 0.01 1.54 3.76 0.31 -1.75 115.29 120.31 2af2 s HIS 120 Ca 0.18 -0.51 0.12 0.00 -0.15 0.00 0.00 55.06 54.69 2af2 s HIS 120 Cb -0.11 -1.13 0.04 0.00 1.11 0.00 0.00 32.58 32.48 2af2 s HIS 120 CO 0.08 0.52 1.42 1.49 -0.85 0.00 0.00 174.74 177.39 2af2 h GLU 121 N 2.23 0.00 0.00 1.40 4.22 -0.82 -3.00 114.58 118.60 2af2 h GLU 121 Ca -0.40 0.00 -0.33 0.00 0.08 0.00 0.00 59.36 58.71 2af2 h GLU 121 Cb 1.24 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.42 2af2 h GLU 121 CO 0.66 0.69 -0.28 1.63 -2.18 0.00 0.00 179.01 179.53 2af2 n LYS 122 N -3.34 0.73 -1.50 1.92 4.76 -0.33 -4.43 118.16 115.98 2af2 n LYS 122 Ca 0.01 -2.04 -0.35 0.00 -2.87 0.00 0.00 58.31 53.06 2af2 n LYS 122 Cb 0.79 1.11 0.09 0.00 -1.84 0.00 0.00 35.03 35.17 2af2 n LYS 122 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2af2 s ALA 123 N -2.65 2.17 -0.18 7.82 0.00 -1.22 -1.05 121.76 126.64 2af2 s ALA 123 Ca 0.12 0.92 -0.08 0.00 0.00 0.00 0.00 51.96 52.92 2af2 s ALA 123 Cb 0.01 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 2af2 s ALA 123 CO 0.09 -1.81 0.09 0.34 0.00 0.00 0.00 175.76 174.47 2af2 s ASP 124 N -1.95 5.86 0.12 0.00 2.15 -1.26 -4.13 116.67 117.47 2af2 s ASP 124 Ca 0.75 0.17 0.03 0.00 0.43 0.00 0.00 52.55 53.93 2af2 s ASP 124 Cb -0.30 -1.99 -0.16 0.00 -0.30 0.00 0.00 42.92 40.17 2af2 s ASP 124 CO 0.44 0.21 1.28 -0.78 -0.17 0.00 0.00 175.17 176.15 2af2 h ASP 125 N 6.43 0.17 -5.72 -0.34 3.58 -1.10 -3.49 116.42 115.94 2af2 h ASP 125 Ca -0.41 -0.17 -0.24 0.00 0.42 0.00 0.00 57.03 56.63 2af2 h ASP 125 Cb 1.17 -0.06 0.10 0.00 1.72 0.00 0.00 39.33 42.27 2af2 h ASP 125 CO 0.70 1.08 -0.66 0.18 -2.88 0.00 0.00 179.24 177.67 2af2 n LEU 126 N -3.49 -4.98 0.00 2.28 7.99 -1.26 -4.46 117.00 113.09 2af2 n LEU 126 Ca -0.03 -0.63 0.00 0.00 -0.01 0.00 0.00 56.01 55.34 2af2 n LEU 126 Cb 0.92 -2.92 0.00 0.00 -0.11 0.00 0.00 43.42 41.31 2af2 n LEU 126 CO 0.49 -0.12 0.00 0.61 -1.51 0.00 0.00 177.39 176.86 2af2 n GLY 127 N -1.53 0.75 0.00 -0.72 0.00 -0.25 -4.74 105.19 98.70 2af2 n GLY 127 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2af2 n GLY 127 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2af2 n LYS 128 N -2.50 0.00 0.00 1.61 -0.00 -1.25 -4.60 118.16 111.43 2af2 n LYS 128 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2af2 n LYS 128 Cb 0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 35.03 34.90 2af2 n LYS 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2af2 n GLY 129 N 0.00 1.24 4.10 2.58 0.00 -1.26 -4.83 105.19 107.02 2af2 n GLY 129 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.57 2.53 3.97 -0.02 0.00 -1.26 -4.87 105.19 106.11 2af2 n GLY 130 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 2af2 n GLY 130 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2af2 s ASN 131 N -0.63 5.82 0.13 1.61 0.01 -1.26 -4.99 114.94 115.62 2af2 s ASN 131 Ca 0.00 0.06 -0.30 0.00 -0.71 0.00 0.00 52.86 51.91 2af2 s ASN 131 Cb 0.00 -1.33 -0.08 0.00 0.41 0.00 0.00 41.25 40.25 2af2 s ASN 131 CO 0.00 -0.65 1.58 -0.08 -1.51 0.00 0.00 177.10 176.43 2af2 h GLU 132 N 0.55 -0.52 -0.99 -0.60 4.22 -2.00 -2.31 114.58 112.93 2af2 h GLU 132 Ca -0.45 0.04 0.21 0.00 0.08 0.00 0.00 59.36 59.23 2af2 h GLU 132 Cb 1.26 0.12 -0.10 0.00 0.50 0.00 0.00 28.75 30.53 2af2 h GLU 132 CO 0.55 -0.35 0.62 0.93 -2.18 0.00 0.00 179.01 178.58 2af2 h GLU 133 N -0.54 0.63 -0.18 1.92 4.39 -1.97 -0.29 114.58 118.54 2af2 h GLU 133 Ca 0.06 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.69 2af2 h GLU 133 Cb 0.65 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2af2 h GLU 133 CO -0.39 0.42 -0.02 0.77 -1.16 0.00 0.00 179.01 178.63 2af2 h SER 134 N 0.65 0.23 0.00 1.42 0.02 -1.73 0.17 113.55 114.31 2af2 h SER 134 Ca 0.57 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.49 2af2 h SER 134 Cb 1.04 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.52 2af2 h SER 134 CO -0.35 0.30 -0.15 1.07 -1.14 0.00 0.00 176.83 176.56 2af2 n THR 135 N -4.37 0.00 -0.02 -2.27 5.66 -0.78 -1.10 114.28 111.41 2af2 n THR 135 Ca -0.00 -0.43 -0.14 0.00 -3.05 0.00 0.00 64.05 60.43 2af2 n THR 135 Cb 0.19 0.97 -0.14 0.00 -1.55 0.00 0.00 70.33 69.79 2af2 n THR 135 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 2af2 n LYS 136 N -1.08 0.68 0.00 1.09 -0.00 -0.19 -1.33 118.16 117.33 2af2 n LYS 136 Ca 0.00 0.27 0.00 0.00 -0.00 0.00 0.00 58.31 58.58 2af2 n LYS 136 Cb 0.03 -1.75 0.00 0.00 -0.00 0.00 0.00 35.03 33.32 2af2 n LYS 136 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2af2 n THR 137 N -3.21 0.00 -0.17 0.58 -2.24 -0.87 -4.50 114.28 103.86 2af2 n THR 137 Ca -0.24 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2af2 n THR 137 Cb 1.05 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.74 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 1.20 0.91 3.14 3.38 0.00 0.44 -4.45 105.19 109.81 2af2 n GLY 138 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 0.09 -4.44 -0.02 1.61 4.05 -0.29 -0.47 115.26 115.78 2af2 n ASN 139 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 2af2 n ASN 139 Cb 0.00 -3.02 0.00 0.00 1.23 0.00 0.00 39.78 37.99 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 1.00 1.48 0.00 5.20 0.00 -1.26 -4.84 120.51 122.10 2af2 n ALA 140 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2af2 n ALA 140 Cb 0.35 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 -0.44 -1.65 3.62 0.00 0.00 -1.26 -1.18 105.19 104.27 2af2 n GLY 141 Ca 0.00 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 44.10 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 0.03 0.90 -4.71 1.61 2.88 -1.26 -4.64 113.62 108.42 2af2 n SER 142 Ca 0.00 0.84 -0.38 0.00 -1.33 0.00 0.00 58.87 58.00 2af2 n SER 142 Cb 0.00 -1.39 -0.06 0.00 -0.75 0.00 0.00 64.21 62.01 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 -2.68 4.31 0.00 -1.46 3.00 -1.26 -0.57 118.95 120.29 2af2 s ARG 143 Ca 0.74 0.44 0.00 0.00 0.00 0.00 0.00 55.73 56.91 2af2 s ARG 143 Cb -0.43 -3.46 0.00 0.00 0.00 0.00 0.00 34.95 31.06 2af2 s ARG 143 CO 0.48 0.10 0.00 1.47 0.00 0.00 0.00 175.30 177.36 2af2 n LEU 144 N 3.87 0.00 -4.76 2.53 -0.00 -0.72 -4.68 117.00 113.24 2af2 n LEU 144 Ca -0.07 0.00 -0.35 0.00 -0.00 0.00 0.00 56.01 55.60 2af2 n LEU 144 Cb 0.51 0.00 0.03 0.00 -0.00 0.00 0.00 43.42 43.96 2af2 n LEU 144 CO 0.43 0.00 0.78 0.00 -0.00 0.00 0.00 177.39 178.60 2af2 s ALA 145 N -2.44 2.55 -0.14 1.47 0.00 -1.25 -2.93 121.76 119.02 2af2 s ALA 145 Ca 0.00 0.78 -0.19 0.00 0.00 0.00 0.00 51.96 52.55 2af2 s ALA 145 Cb 0.00 -3.37 0.05 0.00 0.00 0.00 0.00 23.12 19.79 2af2 s ALA 145 CO 0.00 -1.10 0.50 0.00 0.00 0.00 0.00 175.76 175.17 2af2 s GLY 147 N -0.23 -0.41 0.55 0.00 0.00 -0.49 -2.28 107.32 104.46 2af2 s GLY 147 Ca -0.04 0.81 -0.15 0.00 0.00 0.00 0.00 44.72 45.34 2af2 s GLY 147 CO 0.03 0.51 1.00 0.54 0.00 0.00 0.00 173.10 175.18 2af2 s VAL 148 N -1.65 4.53 -0.37 1.40 0.11 -1.26 -0.51 120.40 122.65 2af2 s VAL 148 Ca -0.10 1.09 -0.12 0.00 -2.93 0.00 0.00 61.98 59.92 2af2 s VAL 148 Cb -0.02 -3.73 0.02 0.00 -1.53 0.00 0.00 36.38 31.12 2af2 s VAL 148 CO 0.05 -0.81 0.22 -0.63 -3.33 0.00 0.00 175.10 170.59 2af2 s ILE 149 N -2.79 4.77 0.27 7.04 -1.09 0.14 -3.55 121.20 125.98 2af2 s ILE 149 Ca 0.58 -0.73 0.10 0.00 -2.23 0.00 0.00 60.65 58.37 2af2 s ILE 149 Cb -0.11 -3.62 -0.05 0.00 -1.58 0.00 0.00 42.46 37.11 2af2 s ILE 149 CO 0.39 -0.20 -0.06 -0.83 -1.23 0.00 0.00 174.94 173.00 2af2 s GLY 150 N 1.60 1.72 0.12 6.18 0.00 -0.53 -1.38 107.32 115.03 2af2 s GLY 150 Ca 0.03 -1.72 -0.24 0.00 0.00 0.00 0.00 44.72 42.80 2af2 s GLY 150 CO 0.08 -1.79 0.72 -0.26 0.00 0.00 0.00 173.10 171.85 2af2 s ILE 151 N -2.37 4.51 0.00 0.90 -5.25 -1.26 -0.27 121.20 117.46 2af2 s ILE 151 Ca 0.31 1.57 0.00 0.00 -0.99 0.00 0.00 60.65 61.54 2af2 s ILE 151 Cb -0.06 -4.07 0.00 0.00 2.95 0.00 0.00 42.46 41.28 2af2 s ILE 151 CO 0.18 0.51 0.00 0.00 -1.79 0.00 0.00 174.94 173.84 2af2 n ALA 152 N 1.80 0.00 -0.52 2.27 0.00 -1.20 -4.86 120.51 118.01 2af2 n ALA 152 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2af2 n ALA 152 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2af2 n ALA 152 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44