#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 3.24 -3.05 0.00 -2.24 -1.25 -4.42 114.28 106.56 2af2 n THR 2 Ca 0.00 -1.76 -0.00 0.00 -2.27 0.00 0.00 64.05 60.01 2af2 n THR 2 Cb 0.00 -2.18 -0.00 0.00 -2.10 0.00 0.00 70.33 66.05 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 1.61 0.80 0.46 -0.78 1.02 -1.25 -4.31 119.74 117.29 2af2 s LYS 3 Ca 0.63 -0.42 -0.18 0.00 0.02 0.00 0.00 55.97 56.02 2af2 s LYS 3 Cb 0.25 0.06 -0.09 0.00 -0.52 0.00 0.00 37.83 37.52 2af2 s LYS 3 CO -0.02 -1.11 0.93 0.00 -0.92 0.00 0.00 175.35 174.24 2af2 s ALA 4 N 1.62 3.10 -0.10 5.17 0.00 0.11 -0.46 121.76 131.19 2af2 s ALA 4 Ca 0.19 0.23 -0.30 0.00 0.00 0.00 0.00 51.96 52.08 2af2 s ALA 4 Cb -0.02 -3.07 0.07 0.00 0.00 0.00 0.00 23.12 20.10 2af2 s ALA 4 CO -0.07 -0.03 0.69 0.54 0.00 0.00 0.00 175.76 176.89 2af2 s VAL 5 N -2.38 0.00 -0.01 0.00 0.11 0.40 -1.03 120.40 117.49 2af2 s VAL 5 Ca 0.59 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.66 2af2 s VAL 5 Cb -0.10 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 33.75 2af2 s VAL 5 CO 0.23 0.00 -0.05 0.00 -3.33 0.00 0.00 175.10 171.95 2af2 s ALA 6 N -0.81 0.47 -0.88 1.54 0.00 -1.17 -0.59 121.76 120.32 2af2 s ALA 6 Ca -0.08 -0.22 -0.14 0.00 0.00 0.00 0.00 51.96 51.52 2af2 s ALA 6 Cb -0.01 -0.14 0.21 0.00 0.00 0.00 0.00 23.12 23.18 2af2 s ALA 6 CO 0.08 0.10 0.87 0.08 0.00 0.00 0.00 175.76 176.89 2af2 s VAL 7 N -0.05 5.52 -0.16 0.00 1.01 -1.26 -3.45 120.40 122.00 2af2 s VAL 7 Ca 0.01 -2.44 -0.26 0.00 0.00 0.00 0.00 61.98 59.29 2af2 s VAL 7 Cb -0.03 -4.54 -0.01 0.00 0.00 0.00 0.00 36.38 31.80 2af2 s VAL 7 CO -0.00 -1.13 0.86 -0.22 0.00 0.00 0.00 175.10 174.61 2af2 s LEU 8 N 0.41 4.18 0.02 3.92 0.20 -1.12 -4.77 118.68 121.51 2af2 s LEU 8 Ca 0.22 1.22 0.02 0.00 0.69 0.00 0.00 54.13 56.28 2af2 s LEU 8 Cb -0.09 -3.28 -0.01 0.00 -0.43 0.00 0.00 46.19 42.37 2af2 s LEU 8 CO -0.09 -0.41 -0.07 -0.75 -0.29 0.00 0.00 176.35 174.74 2af2 s LYS 9 N 2.17 0.50 0.27 1.98 2.20 -0.17 -1.74 119.74 124.95 2af2 s LYS 9 Ca 0.40 -0.44 0.08 0.00 -0.36 0.00 0.00 55.97 55.65 2af2 s LYS 9 Cb -0.17 -0.40 -0.04 0.00 -1.51 0.00 0.00 37.83 35.72 2af2 s LYS 9 CO 0.13 0.10 0.13 0.20 -0.36 0.00 0.00 175.35 175.54 2af2 s GLY 10 N -0.74 1.58 -1.14 5.54 0.00 -0.06 -1.39 107.32 111.12 2af2 s GLY 10 Ca -0.03 -1.57 -0.08 0.00 0.00 0.00 0.00 44.72 43.05 2af2 s GLY 10 CO 0.00 -1.59 2.77 1.22 0.00 0.00 0.00 173.10 175.50 2af2 n ASP 11 N -1.09 6.95 0.00 1.64 8.00 -1.26 -4.47 116.55 126.32 2af2 n ASP 11 Ca -0.06 -2.46 0.00 0.00 0.71 0.00 0.00 54.79 52.98 2af2 n ASP 11 Cb 0.59 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.32 2af2 n ASP 11 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2af2 n GLY 12 N 3.44 -0.59 1.59 0.44 0.00 -1.26 -5.02 105.19 103.80 2af2 n GLY 12 Ca 0.62 -0.94 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 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 1.16 -3.82 1.61 -0.04 -1.26 -4.74 135.00 127.91 2af2 n PRO 13 Ca 0.00 -0.17 -0.28 0.00 -0.04 0.00 0.00 63.50 63.01 2af2 n PRO 13 Cb 0.00 -1.18 -0.16 0.00 -0.04 0.00 0.00 33.50 32.12 2af2 n PRO 13 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2af2 s VAL 14 N 0.19 0.90 0.26 0.52 -7.23 -1.26 -3.96 120.40 109.82 2af2 s VAL 14 Ca 0.11 -0.69 -0.21 0.00 -1.81 0.00 0.00 61.98 59.38 2af2 s VAL 14 Cb 0.05 -1.25 0.03 0.00 0.56 0.00 0.00 36.38 35.77 2af2 s VAL 14 CO 0.00 -0.07 0.70 0.00 -0.31 0.00 0.00 175.10 175.41 2af2 s GLN 15 N 1.70 1.71 -0.23 4.82 0.00 -0.69 -0.88 119.66 126.09 2af2 s GLN 15 Ca -0.01 -0.93 -0.19 0.00 -0.00 0.00 0.00 55.36 54.22 2af2 s GLN 15 Cb -0.17 0.60 0.06 0.00 0.00 0.00 0.00 33.01 33.51 2af2 s GLN 15 CO -0.07 -0.78 0.61 0.20 0.00 0.00 0.00 175.29 175.25 2af2 s GLY 16 N -2.90 -0.48 0.04 2.60 0.00 -0.71 -0.64 107.32 105.23 2af2 s GLY 16 Ca 0.10 1.84 -0.26 0.00 0.00 0.00 0.00 44.72 46.41 2af2 s GLY 16 CO 0.04 1.67 0.80 -1.50 0.00 0.00 0.00 173.10 174.12 2af2 s ILE 17 N 0.64 4.73 -0.06 0.90 -1.16 -0.97 -2.80 121.20 122.48 2af2 s ILE 17 Ca -0.03 1.70 0.02 0.00 -0.51 0.00 0.00 60.65 61.83 2af2 s ILE 17 Cb -0.05 -4.15 0.02 0.00 0.61 0.00 0.00 42.46 38.89 2af2 s ILE 17 CO -0.04 0.34 -0.09 0.27 -2.81 0.00 0.00 174.94 172.61 2af2 s ILE 18 N 0.06 0.90 0.14 2.00 -5.25 -1.22 -1.68 121.20 116.14 2af2 s ILE 18 Ca 0.40 -0.34 0.03 0.00 -0.99 0.00 0.00 60.65 59.76 2af2 s ILE 18 Cb -0.21 -0.85 -0.04 0.00 2.95 0.00 0.00 42.46 44.32 2af2 s ILE 18 CO 0.24 0.30 0.18 0.20 -1.79 0.00 0.00 174.94 174.07 2af2 s ASN 19 N 0.76 5.88 -0.16 4.36 0.02 0.17 -3.04 114.94 122.92 2af2 s ASN 19 Ca -0.13 0.03 -0.04 0.00 -1.02 0.00 0.00 52.86 51.69 2af2 s ASN 19 Cb -0.15 -1.65 0.06 0.00 0.02 0.00 0.00 41.25 39.52 2af2 s ASN 19 CO 0.02 0.09 0.07 -0.36 0.02 0.00 0.00 177.10 176.94 2af2 s PHE 20 N -1.67 0.46 -1.02 2.20 0.40 -0.20 -2.17 117.98 115.98 2af2 s PHE 20 Ca 0.32 -0.43 -0.13 0.00 -0.60 0.00 0.00 56.93 56.09 2af2 s PHE 20 Cb -0.11 -0.78 0.22 0.00 0.51 0.00 0.00 43.02 42.85 2af2 s PHE 20 CO 0.25 -0.51 1.07 -1.83 0.70 0.00 0.00 175.22 174.90 2af2 s GLU 21 N 2.05 3.90 0.04 0.44 -1.05 -1.07 -0.71 118.70 122.30 2af2 s GLU 21 Ca 0.01 -2.63 0.02 0.00 -0.15 0.00 0.00 54.97 52.22 2af2 s GLU 21 Cb -0.16 -4.67 -0.04 0.00 -0.44 0.00 0.00 34.13 28.82 2af2 s GLU 21 CO -0.08 -1.44 0.06 -1.14 0.95 0.00 0.00 175.26 173.61 2af2 s GLN 22 N 0.35 2.90 -0.00 -4.83 2.00 -1.26 -4.41 119.66 114.40 2af2 s GLN 22 Ca 0.29 -0.62 0.01 0.00 -2.00 0.00 0.00 55.36 53.04 2af2 s GLN 22 Cb -0.08 -2.74 -0.01 0.00 0.80 0.00 0.00 33.01 30.98 2af2 s GLN 22 CO -0.07 0.60 0.02 0.36 -0.50 0.00 0.00 175.29 175.70 2af2 n LYS 23 N 0.88 3.31 -4.51 1.67 0.00 -1.26 -3.84 118.16 114.41 2af2 n LYS 23 Ca -0.11 -0.00 -0.24 0.00 -0.00 0.00 0.00 58.31 57.95 2af2 n LYS 23 Cb 0.52 -0.78 -0.10 0.00 -0.00 0.00 0.00 35.03 34.67 2af2 n LYS 23 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2af2 s GLU 24 N -1.57 1.78 -0.06 -1.58 -6.30 -1.26 -5.05 118.70 104.66 2af2 s GLU 24 Ca -0.00 -2.02 0.18 0.00 -2.50 0.00 0.00 54.97 50.63 2af2 s GLU 24 Cb 0.00 -1.00 -0.22 0.00 0.00 0.00 0.00 34.13 32.91 2af2 s GLU 24 CO 0.03 -0.22 0.48 0.43 0.02 0.00 0.00 175.26 175.99 2af2 n SER 25 N -0.86 0.39 0.00 -1.70 7.64 -1.26 -3.59 113.62 114.24 2af2 n SER 25 Ca -0.04 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2af2 n SER 25 Cb 0.66 0.79 0.00 0.00 -1.01 0.00 0.00 64.21 64.66 2af2 n SER 25 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2af2 n ASN 26 N -2.73 3.02 -4.37 6.43 2.04 -1.26 -4.71 115.26 113.67 2af2 n ASN 26 Ca -0.17 -0.03 -0.29 0.00 -0.44 0.00 0.00 54.58 53.64 2af2 n ASN 26 Cb 0.92 0.67 0.19 0.00 -2.53 0.00 0.00 39.78 39.03 2af2 n ASN 26 CO 0.00 0.00 0.00 -0.83 -0.44 0.00 0.00 177.26 175.99 2af2 s GLY 27 N -1.27 1.60 0.81 4.83 0.00 -1.26 -4.90 107.32 107.13 2af2 s GLY 27 Ca 0.00 -0.72 -0.12 0.00 0.00 0.00 0.00 44.72 43.89 2af2 s GLY 27 CO 0.00 -0.01 1.17 2.56 0.00 0.00 0.00 173.10 176.82 2af2 s PRO 28 N -5.33 1.83 -0.01 2.90 0.04 -1.26 -4.77 135.00 128.39 2af2 s PRO 28 Ca 0.68 -0.02 -0.01 0.00 0.04 0.00 0.00 61.00 61.69 2af2 s PRO 28 Cb -0.13 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.45 2af2 s PRO 28 CO 0.55 -1.64 0.03 0.08 0.04 0.00 0.00 177.00 176.06 2af2 s VAL 29 N -3.56 -0.02 -0.03 -0.36 1.01 0.10 -4.92 120.40 112.61 2af2 s VAL 29 Ca 0.63 0.08 -0.29 0.00 0.00 0.00 0.00 61.98 62.40 2af2 s VAL 29 Cb -0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 36.38 36.19 2af2 s VAL 29 CO 0.49 0.03 0.95 -0.75 0.00 0.00 0.00 175.10 175.83 2af2 s LYS 30 N 0.43 4.51 0.03 2.72 2.36 -1.26 -1.15 119.74 127.38 2af2 s LYS 30 Ca -0.04 1.35 0.08 0.00 -2.55 0.00 0.00 55.97 54.82 2af2 s LYS 30 Cb -0.05 -3.48 -0.02 0.00 -1.05 0.00 0.00 37.83 33.23 2af2 s LYS 30 CO -0.01 -0.10 -0.24 0.08 1.55 0.00 0.00 175.35 176.63 2af2 s VAL 31 N 1.23 1.92 0.16 4.02 1.01 0.11 -2.60 120.40 126.25 2af2 s VAL 31 Ca 0.49 -1.23 -0.19 0.00 0.00 0.00 0.00 61.98 61.05 2af2 s VAL 31 Cb -0.20 -1.64 0.04 0.00 0.00 0.00 0.00 36.38 34.59 2af2 s VAL 31 CO 0.25 0.36 0.51 -1.66 0.00 0.00 0.00 175.10 174.56 2af2 s TRP 32 N -0.74 -0.30 0.00 5.22 -2.14 -0.92 -0.22 118.94 119.84 2af2 s TRP 32 Ca 0.10 0.01 0.00 0.00 2.66 0.00 0.00 56.10 58.86 2af2 s TRP 32 Cb -0.09 0.41 0.00 0.00 -3.10 0.00 0.00 33.47 30.69 2af2 s TRP 32 CO 0.01 -0.83 0.00 0.41 -2.66 0.00 0.00 176.95 173.89 2af2 n GLY 33 N -0.32 0.95 3.26 3.67 0.00 -0.16 -0.65 105.19 111.93 2af2 n GLY 33 Ca -0.14 -0.34 -0.38 0.00 0.00 0.00 0.00 46.02 45.16 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 0.00 5.33 0.17 1.61 1.04 -0.67 -0.42 113.70 120.76 2af2 s SER 34 Ca 0.00 -1.26 -0.23 0.00 0.48 0.00 0.00 55.95 54.94 2af2 s SER 34 Cb 0.00 -1.87 -0.08 0.00 0.10 0.00 0.00 66.02 64.17 2af2 s SER 34 CO 0.00 -0.37 0.74 -0.63 0.98 0.00 0.00 173.24 173.96 2af2 s ILE 35 N 1.38 4.47 -0.14 -1.02 1.01 0.48 -2.30 121.20 125.09 2af2 s ILE 35 Ca -0.01 1.52 -0.09 0.00 0.00 0.00 0.00 60.65 62.08 2af2 s ILE 35 Cb -0.20 -4.02 0.05 0.00 0.01 0.00 0.00 42.46 38.29 2af2 s ILE 35 CO 0.02 0.43 0.34 -0.54 0.00 0.00 0.00 174.94 175.19 2af2 s LYS 36 N -1.40 0.33 0.00 2.79 1.02 0.19 -0.81 119.74 121.86 2af2 s LYS 36 Ca 0.37 0.63 0.00 0.00 0.02 0.00 0.00 55.97 56.99 2af2 s LYS 36 Cb -0.21 -0.00 0.00 0.00 -0.52 0.00 0.00 37.83 37.10 2af2 s LYS 36 CO 0.24 -0.13 0.00 0.41 -0.92 0.00 0.00 175.35 174.94 2af2 n GLY 37 N 3.93 2.90 3.72 -3.33 0.00 0.27 -1.71 105.19 110.96 2af2 n GLY 37 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 4.37 0.64 0.99 1.02 -1.26 -4.83 118.68 119.61 2af2 s LEU 38 Ca 0.00 2.72 -0.17 0.00 0.02 0.00 0.00 54.13 56.70 2af2 s LEU 38 Cb 0.00 -3.60 -0.01 0.00 0.02 0.00 0.00 46.19 42.60 2af2 s LEU 38 CO 0.00 -0.86 1.15 -0.89 0.02 0.00 0.00 176.35 175.77 2af2 s THR 39 N 0.94 2.93 0.73 5.49 2.01 -1.26 -3.54 115.64 122.94 2af2 s THR 39 Ca 0.70 0.49 -0.16 0.00 0.31 0.00 0.00 61.69 63.03 2af2 s THR 39 Cb -0.46 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 68.96 2af2 s THR 39 CO 0.34 -0.21 0.73 -1.84 -0.69 0.00 0.00 174.62 172.95 2af2 n GLU 40 N -2.08 0.37 0.00 4.92 0.00 -1.26 -4.51 120.64 118.08 2af2 n GLU 40 Ca 0.12 0.17 0.00 0.00 0.00 0.00 0.00 57.16 57.45 2af2 n GLU 40 Cb 0.51 -2.01 0.00 0.00 0.00 0.00 0.00 31.44 29.94 2af2 n GLU 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2af2 n GLY 41 N 1.38 -2.92 3.73 -1.84 0.00 -0.59 -4.85 105.19 100.11 2af2 n GLY 41 Ca 0.11 -1.83 -0.34 0.00 0.00 0.00 0.00 46.02 43.96 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 3.36 -0.17 0.99 1.43 -1.26 -1.33 118.68 121.70 2af2 s LEU 42 Ca 0.00 2.31 -0.11 0.00 -1.03 0.00 0.00 54.13 55.30 2af2 s LEU 42 Cb 0.00 -4.58 0.05 0.00 0.03 0.00 0.00 46.19 41.69 2af2 s LEU 42 CO 0.00 -2.11 0.41 -1.00 0.23 0.00 0.00 176.35 173.89 2af2 s HIS 43 N -1.99 -0.56 0.42 0.29 3.76 0.11 -2.32 115.29 114.99 2af2 s HIS 43 Ca 0.74 1.24 -0.26 0.00 -0.15 0.00 0.00 55.06 56.63 2af2 s HIS 43 Cb -0.28 0.24 -0.08 0.00 1.11 0.00 0.00 32.58 33.56 2af2 s HIS 43 CO 0.43 -0.31 1.35 0.20 -0.85 0.00 0.00 174.74 175.56 2af2 s GLY 44 N 1.05 2.92 -0.28 -2.22 0.00 -1.18 -0.05 107.32 107.56 2af2 s GLY 44 Ca -0.07 1.31 -0.01 0.00 0.00 0.00 0.00 44.72 45.95 2af2 s GLY 44 CO -0.09 1.91 0.08 -0.12 0.00 0.00 0.00 173.10 174.88 2af2 s PHE 45 N -1.24 1.47 -0.01 1.90 2.19 -0.99 -1.23 117.98 120.06 2af2 s PHE 45 Ca 0.58 -1.46 0.00 0.00 0.33 0.00 0.00 56.93 56.39 2af2 s PHE 45 Cb -0.40 -1.48 0.01 0.00 -1.31 0.00 0.00 43.02 39.84 2af2 s PHE 45 CO 0.51 -0.81 0.00 -1.58 1.83 0.00 0.00 175.22 175.18 2af2 s HIS 46 N 1.70 0.05 -0.21 10.12 5.65 -0.93 -3.41 115.29 128.27 2af2 s HIS 46 Ca 0.06 0.03 -0.16 0.00 0.25 0.00 0.00 55.06 55.24 2af2 s HIS 46 Cb -0.17 -0.10 -0.04 0.00 -1.18 0.00 0.00 32.58 31.09 2af2 s HIS 46 CO -0.21 -0.03 0.42 0.14 -0.65 0.00 0.00 174.74 174.41 2af2 s VAL 47 N 0.32 5.18 0.94 0.89 -7.23 0.54 -1.02 120.40 120.02 2af2 s VAL 47 Ca -0.03 0.75 -0.16 0.00 -1.81 0.00 0.00 61.98 60.73 2af2 s VAL 47 Cb -0.04 -3.75 0.23 0.00 0.56 0.00 0.00 36.38 33.38 2af2 s VAL 47 CO -0.01 0.23 0.92 1.41 -0.31 0.00 0.00 175.10 177.34 2af2 n HIS 48 N 4.62 -3.78 -0.85 2.82 8.25 0.58 -3.93 115.22 122.92 2af2 n HIS 48 Ca -0.08 -0.83 -0.29 0.00 -0.26 0.00 0.00 57.72 56.27 2af2 n HIS 48 Cb 0.51 -0.89 0.20 0.00 1.12 0.00 0.00 29.99 30.92 2af2 n HIS 48 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2af2 s GLU 49 N -5.07 0.08 0.00 -0.41 2.12 0.11 -4.38 118.70 111.16 2af2 s GLU 49 Ca 0.58 0.85 0.00 0.00 0.36 0.00 0.00 54.97 56.76 2af2 s GLU 49 Cb -0.05 -1.67 0.00 0.00 0.26 0.00 0.00 34.13 32.67 2af2 s GLU 49 CO 0.43 -3.05 0.00 1.97 -0.54 0.00 0.00 175.26 174.07 2af2 n PHE 50 N -4.45 0.00 -3.68 5.30 -1.74 -1.26 -3.98 117.46 107.66 2af2 n PHE 50 Ca 0.05 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.94 2af2 n PHE 50 Cb 0.55 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.55 2af2 n PHE 50 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2af2 n GLY 51 N 5.00 -0.18 2.40 4.97 0.00 -1.24 -4.32 105.19 111.82 2af2 n GLY 51 Ca 0.00 -1.13 -0.30 0.00 0.00 0.00 0.00 46.02 44.59 2af2 n GLY 51 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2af2 n ASP 52 N 1.65 6.99 -0.43 1.61 5.75 -1.26 -4.85 116.55 126.01 2af2 n ASP 52 Ca 0.00 -3.02 0.00 0.00 -0.01 0.00 0.00 54.79 51.76 2af2 n ASP 52 Cb 0.00 -1.33 0.00 0.00 -1.03 0.00 0.00 41.12 38.76 2af2 n ASP 52 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2af2 n ASN 53 N 1.62 0.65 0.19 -1.12 0.23 -1.26 -4.41 115.26 111.16 2af2 n ASN 53 Ca 0.55 -1.52 0.08 0.00 -0.53 0.00 0.00 54.58 53.16 2af2 n ASN 53 Cb 0.48 -0.33 0.25 0.00 -2.08 0.00 0.00 39.78 38.11 2af2 n ASN 53 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 2af2 h THR 54 N 0.00 0.53 0.00 5.53 1.35 -1.96 -2.13 112.91 116.23 2af2 h THR 54 Ca 0.00 -1.48 0.00 0.00 -0.55 0.00 0.00 66.41 64.38 2af2 h THR 54 Cb 0.33 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 2af2 h THR 54 CO 0.00 0.27 0.00 0.00 -0.25 0.00 0.00 175.52 175.54 2af2 n ALA 55 N -2.19 2.09 -0.82 6.62 0.00 -1.26 -4.96 120.51 119.98 2af2 n ALA 55 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2af2 n ALA 55 Cb 0.56 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 0.33 1.72 0.51 0.00 0.00 -0.80 -3.25 105.19 103.70 2af2 n GLY 56 Ca 0.11 0.26 0.32 0.00 0.00 0.00 0.00 46.02 46.71 2af2 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2af2 h THR 58 N 0.00 0.00 0.00 0.00 2.02 -1.94 -3.41 112.91 109.58 2af2 h THR 58 Ca 0.50 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.73 2af2 h THR 58 Cb 2.18 1.63 -0.00 0.00 -1.74 0.00 0.00 68.15 70.21 2af2 h THR 58 CO -0.01 0.00 -1.01 -1.20 0.37 0.00 0.00 175.52 173.67 2af2 n SER 59 N -2.76 2.50 -4.58 4.18 7.64 -0.56 -4.96 113.62 115.09 2af2 n SER 59 Ca 0.02 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.52 2af2 n SER 59 Cb 0.53 -0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 2af2 n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2af2 s ALA 60 N -2.00 2.77 -0.15 -0.43 0.00 0.16 -4.90 121.76 117.20 2af2 s ALA 60 Ca -0.00 -2.61 -0.39 0.00 0.00 0.00 0.00 51.96 48.96 2af2 s ALA 60 Cb 0.00 -4.65 -0.16 0.00 0.00 0.00 0.00 23.12 18.31 2af2 s ALA 60 CO 0.00 -3.97 1.62 0.41 0.00 0.00 0.00 175.76 173.83 2af2 n GLY 61 N 5.63 0.76 3.66 0.00 0.00 -1.26 -4.52 105.19 109.47 2af2 n GLY 61 Ca 0.47 0.85 -0.42 0.00 0.00 0.00 0.00 46.02 46.92 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 2.58 4.15 -0.68 1.61 0.04 -1.26 0.06 135.00 141.50 2af2 s PRO 62 Ca 0.94 2.41 -0.08 0.00 0.04 0.00 0.00 61.00 64.31 2af2 s PRO 62 Cb -1.02 -4.08 0.01 0.00 0.04 0.00 0.00 34.50 29.45 2af2 s PRO 62 CO 0.59 -0.92 0.45 -2.39 0.04 0.00 0.00 177.00 174.76 2af2 n HIS 63 N 7.41 -1.30 0.00 0.56 1.44 -1.25 -4.64 115.22 117.44 2af2 n HIS 63 Ca 0.19 0.42 0.00 0.00 -2.01 0.00 0.00 57.72 56.32 2af2 n HIS 63 Cb 0.42 -1.96 0.00 0.00 0.12 0.00 0.00 29.99 28.57 2af2 n HIS 63 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2af2 n PHE 64 N -2.61 0.00 -1.78 -1.40 7.35 -1.24 -4.40 117.46 113.37 2af2 n PHE 64 Ca -0.19 0.00 -0.24 0.00 -0.76 0.00 0.00 57.45 56.27 2af2 n PHE 64 Cb 0.47 0.00 0.06 0.00 0.35 0.00 0.00 39.48 40.36 2af2 n PHE 64 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 2af2 n ASN 65 N 0.00 5.21 0.13 -2.13 6.94 -1.26 -1.18 115.26 122.98 2af2 n ASN 65 Ca 0.00 -3.77 0.12 0.00 -0.02 0.00 0.00 54.58 50.91 2af2 n ASN 65 Cb 0.00 -0.53 0.50 0.00 -2.36 0.00 0.00 39.78 37.40 2af2 n ASN 65 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 2af2 n PRO 66 N -0.82 0.18 0.00 -0.53 -0.04 -1.26 -1.08 135.00 131.45 2af2 n PRO 66 Ca 0.47 0.46 0.12 0.00 -0.04 0.00 0.00 63.50 64.51 2af2 n PRO 66 Cb 0.90 -1.88 0.61 0.00 -0.04 0.00 0.00 33.50 33.08 2af2 n PRO 66 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2af2 n LEU 67 N -2.23 0.00 -2.17 1.53 4.77 -1.26 -4.95 117.00 112.68 2af2 n LEU 67 Ca 0.01 0.34 -0.07 0.00 -0.03 0.00 0.00 56.01 56.26 2af2 n LEU 67 Cb 0.19 -0.34 0.04 0.00 -2.33 0.00 0.00 43.42 40.98 2af2 n LEU 67 CO 0.18 -0.06 0.04 -0.24 -1.33 0.00 0.00 177.39 175.98 2af2 n SER 68 N -1.34 -2.78 -4.17 -1.43 2.88 -0.24 -5.06 113.62 101.48 2af2 n SER 68 Ca 0.10 -0.30 -0.22 0.00 -1.33 0.00 0.00 58.87 57.13 2af2 n SER 68 Cb 0.22 -2.62 -0.09 0.00 -0.75 0.00 0.00 64.21 60.97 2af2 n SER 68 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2af2 s ARG 69 N -4.26 1.72 0.62 -1.46 0.52 -1.26 -5.18 118.95 109.65 2af2 s ARG 69 Ca 0.08 -2.00 0.06 0.00 -0.52 0.00 0.00 55.73 53.34 2af2 s ARG 69 Cb -0.01 -0.48 0.10 0.00 0.52 0.00 0.00 34.95 35.07 2af2 s ARG 69 CO 0.33 -0.39 0.85 0.15 0.02 0.00 0.00 175.30 176.26 2af2 s LYS 70 N -3.81 2.12 0.48 3.54 -0.14 -1.26 -4.96 119.74 115.71 2af2 s LYS 70 Ca 0.31 -1.43 -0.15 0.00 -1.36 0.00 0.00 55.97 53.35 2af2 s LYS 70 Cb 0.05 -2.54 -0.08 0.00 -1.68 0.00 0.00 37.83 33.58 2af2 s LYS 70 CO 0.16 -1.03 0.93 -1.58 -0.76 0.00 0.00 175.35 173.06 2af2 s HIS 71 N -2.81 3.45 -5.00 3.18 2.46 -1.25 -3.99 115.29 111.31 2af2 s HIS 71 Ca 0.63 1.37 0.00 0.00 0.47 0.00 0.00 55.06 57.53 2af2 s HIS 71 Cb -0.06 -2.71 0.00 0.00 -0.13 0.00 0.00 32.58 29.69 2af2 s HIS 71 CO 0.40 -0.28 0.00 0.41 -2.47 0.00 0.00 174.74 172.81 2af2 n GLY 72 N -1.42 -1.19 0.00 1.59 0.00 -1.26 -2.65 105.19 100.26 2af2 n GLY 72 Ca 0.06 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.01 0.45 -0.02 0.00 -1.26 -4.33 105.19 98.02 2af2 n GLY 73 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 46.02 46.72 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 0.45 0.00 1.61 -0.04 -1.26 -1.66 135.00 134.10 2af2 n PRO 74 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2af2 n PRO 74 Cb 0.00 -1.20 0.00 0.00 -0.04 0.00 0.00 33.50 32.26 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 0.20 0.00 -4.57 0.54 -0.00 -1.26 -5.15 118.16 107.92 2af2 n LYS 75 Ca 0.00 -0.03 -0.27 0.00 -0.00 0.00 0.00 58.31 58.01 2af2 n LYS 75 Cb 0.10 -0.05 -0.09 0.00 -0.00 0.00 0.00 35.03 34.99 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 0.00 3.14 0.00 -5.58 2.15 -0.66 -5.08 116.67 110.64 2af2 s ASP 76 Ca 0.00 -1.58 0.00 0.00 0.43 0.00 0.00 52.55 51.40 2af2 s ASP 76 Cb 0.00 0.30 0.00 0.00 -0.30 0.00 0.00 42.92 42.92 2af2 s ASP 76 CO 0.00 -0.80 0.00 -0.62 -0.17 0.00 0.00 175.17 173.58 2af2 n GLU 77 N -0.96 3.23 0.00 4.34 1.02 -1.26 -4.77 120.64 122.24 2af2 n GLU 77 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 2af2 n GLU 77 Cb 0.66 -0.52 0.00 0.00 -0.02 0.00 0.00 31.44 31.56 2af2 n GLU 77 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2af2 n GLU 78 N -0.64 0.00 -1.43 3.49 1.02 -1.26 -5.11 120.64 116.70 2af2 n GLU 78 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2af2 n GLU 78 Cb 0.00 -0.21 0.00 0.00 -0.02 0.00 0.00 31.44 31.21 2af2 n GLU 78 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2af2 n ARG 79 N -0.48 -2.08 -1.12 3.49 0.63 -1.26 -5.00 116.66 110.84 2af2 n ARG 79 Ca 0.00 1.80 -0.29 0.00 -0.92 0.00 0.00 57.85 58.44 2af2 n ARG 79 Cb 0.00 -2.04 0.18 0.00 0.45 0.00 0.00 32.46 31.05 2af2 n ARG 79 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 2af2 s HIS 80 N -0.23 2.06 -1.83 -0.14 3.76 -1.26 -4.94 115.29 112.72 2af2 s HIS 80 Ca 0.00 1.05 0.01 0.00 -0.15 0.00 0.00 55.06 55.97 2af2 s HIS 80 Cb 0.00 -3.24 0.03 0.00 1.11 0.00 0.00 32.58 30.48 2af2 s HIS 80 CO 0.00 -2.91 0.94 1.55 -0.85 0.00 0.00 174.74 173.47 2af2 n VAL 81 N -4.20 0.05 -0.32 -0.90 3.14 -0.32 -2.80 118.33 112.98 2af2 n VAL 81 Ca 0.05 -0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.39 2af2 n VAL 81 Cb 0.57 -0.07 0.00 0.00 -1.06 0.00 0.00 33.84 33.28 2af2 n VAL 81 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2af2 n GLY 82 N 0.46 1.26 3.34 7.55 0.00 -1.24 -4.85 105.19 111.71 2af2 n GLY 82 Ca 0.01 -0.02 -0.45 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.74 7.28 0.00 1.61 1.01 -1.12 -0.34 116.67 124.37 2af2 s ASP 83 Ca 0.00 -3.52 -0.05 0.00 0.71 0.00 0.00 52.55 49.69 2af2 s ASP 83 Cb 0.00 -2.21 -0.23 0.00 1.01 0.00 0.00 42.92 41.50 2af2 s ASP 83 CO 0.00 -0.31 3.30 0.18 0.21 0.00 0.00 175.17 178.55 2af2 n LEU 84 N 2.82 5.04 0.00 1.23 4.77 -1.22 -4.89 117.00 124.75 2af2 n LEU 84 Ca 0.23 -2.97 0.00 0.00 -0.03 0.00 0.00 56.01 53.24 2af2 n LEU 84 Cb 0.40 -1.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 2af2 n LEU 84 CO 0.46 1.53 0.00 0.61 -1.33 0.00 0.00 177.39 178.65 2af2 n GLY 85 N 2.39 3.41 3.76 -0.72 0.00 -1.23 -4.73 105.19 108.07 2af2 n GLY 85 Ca 0.36 0.25 -0.08 0.00 0.00 0.00 0.00 46.02 46.54 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 -0.07 -0.06 1.61 2.20 -1.26 -2.36 114.94 111.00 2af2 s ASN 86 Ca 0.00 -0.88 0.00 0.00 -0.94 0.00 0.00 52.86 51.04 2af2 s ASN 86 Cb 0.00 0.72 0.02 0.00 -2.00 0.00 0.00 41.25 39.99 2af2 s ASN 86 CO 0.00 -1.38 -0.04 0.54 -2.94 0.00 0.00 177.10 173.28 2af2 s VAL 87 N -3.50 0.60 -0.10 3.54 0.11 0.93 -4.77 120.40 117.21 2af2 s VAL 87 Ca 0.16 -0.09 -0.09 0.00 -2.93 0.00 0.00 61.98 59.03 2af2 s VAL 87 Cb -0.04 -0.66 -0.04 0.00 -1.53 0.00 0.00 36.38 34.11 2af2 s VAL 87 CO 0.10 0.27 0.21 -0.89 -3.33 0.00 0.00 175.10 171.45 2af2 s THR 88 N 1.36 5.38 0.25 5.04 2.01 -1.26 0.05 115.64 128.46 2af2 s THR 88 Ca -0.04 0.38 0.09 0.00 0.31 0.00 0.00 61.69 62.43 2af2 s THR 88 Cb -0.13 -3.49 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2af2 s THR 88 CO -0.03 0.59 0.03 0.00 -0.69 0.00 0.00 174.62 174.52 2af2 s ALA 89 N -0.93 3.23 0.34 7.40 0.00 -0.44 -4.61 121.76 126.75 2af2 s ALA 89 Ca 0.17 -1.57 -0.08 0.00 0.00 0.00 0.00 51.96 50.48 2af2 s ALA 89 Cb -0.13 -0.89 -0.06 0.00 0.00 0.00 0.00 23.12 22.04 2af2 s ALA 89 CO 0.06 0.30 0.65 -0.51 0.00 0.00 0.00 175.76 176.27 2af2 s ASP 90 N -3.57 6.48 0.31 0.00 1.01 0.01 -1.55 116.67 119.36 2af2 s ASP 90 Ca 0.31 0.91 0.20 0.00 0.71 0.00 0.00 52.55 54.68 2af2 s ASP 90 Cb -0.07 -2.23 1.10 0.00 1.01 0.00 0.00 42.92 42.73 2af2 s ASP 90 CO 0.20 -0.29 1.61 2.29 0.21 0.00 0.00 175.17 179.19 2af2 n LYS 91 N -1.10 0.13 0.00 8.23 -0.00 -1.26 -0.54 118.16 123.62 2af2 n LYS 91 Ca 0.00 0.63 0.07 0.00 -0.00 0.00 0.00 58.31 59.01 2af2 n LYS 91 Cb 0.54 -1.95 0.39 0.00 -0.00 0.00 0.00 35.03 34.01 2af2 n LYS 91 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2af2 n ASP 92 N -2.21 0.00 -0.44 -5.58 8.00 -1.26 -4.91 116.55 110.14 2af2 n ASP 92 Ca -0.01 -1.52 0.00 0.00 0.71 0.00 0.00 54.79 53.96 2af2 n ASP 92 Cb 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.15 2af2 n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2af2 n GLY 93 N 0.67 0.94 3.43 0.44 0.00 0.29 -4.94 105.19 106.01 2af2 n GLY 93 Ca 0.10 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.83 0.02 -0.29 1.61 0.11 -1.12 -0.57 120.40 117.33 2af2 s VAL 94 Ca 0.00 -0.13 -0.02 0.00 -2.93 0.00 0.00 61.98 58.90 2af2 s VAL 94 Cb 0.00 -0.83 0.10 0.00 -1.53 0.00 0.00 36.38 34.12 2af2 s VAL 94 CO 0.00 -0.07 0.10 0.00 -3.33 0.00 0.00 175.10 171.80 2af2 s ALA 95 N -0.76 1.17 -1.06 1.54 0.00 0.01 -0.81 121.76 121.85 2af2 s ALA 95 Ca -0.08 -1.37 -0.07 0.00 0.00 0.00 0.00 51.96 50.44 2af2 s ALA 95 Cb -0.03 -1.50 0.27 0.00 0.00 0.00 0.00 23.12 21.87 2af2 s ALA 95 CO 0.05 -1.60 1.07 -3.47 0.00 0.00 0.00 175.76 171.81 2af2 n ASP 96 N 5.00 5.28 -4.88 0.00 -0.08 -1.26 -0.38 116.55 120.23 2af2 n ASP 96 Ca -0.04 -3.09 -0.33 0.00 -1.51 0.00 0.00 54.79 49.82 2af2 n ASP 96 Cb 0.43 -1.29 -0.05 0.00 2.34 0.00 0.00 41.12 42.54 2af2 n ASP 96 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2af2 s VAL 97 N -1.43 5.05 -0.20 5.18 1.01 0.44 -4.97 120.40 125.48 2af2 s VAL 97 Ca 0.30 0.38 -0.05 0.00 0.00 0.00 0.00 61.98 62.61 2af2 s VAL 97 Cb -0.08 -3.64 0.10 0.00 0.00 0.00 0.00 36.38 32.76 2af2 s VAL 97 CO -0.08 0.11 0.37 -0.55 0.00 0.00 0.00 175.10 174.95 2af2 s SER 98 N -2.11 0.09 0.19 3.32 0.15 -1.26 -0.99 113.70 113.09 2af2 s SER 98 Ca 0.40 0.63 -0.01 0.00 0.70 0.00 0.00 55.95 57.66 2af2 s SER 98 Cb -0.13 1.11 -0.04 0.00 -1.71 0.00 0.00 66.02 65.25 2af2 s SER 98 CO 0.21 -0.26 0.12 -0.63 1.20 0.00 0.00 173.24 173.88 2af2 s ILE 99 N 2.54 0.02 -0.01 6.45 1.01 0.69 -4.99 121.20 126.91 2af2 s ILE 99 Ca 0.04 -1.97 0.01 0.00 0.00 0.00 0.00 60.65 58.72 2af2 s ILE 99 Cb -0.13 -2.40 0.01 0.00 0.01 0.00 0.00 42.46 39.95 2af2 s ILE 99 CO -0.13 -0.10 -0.04 -1.83 0.00 0.00 0.00 174.94 172.84 2af2 s GLU 100 N -4.13 0.44 0.02 2.79 1.03 -1.26 0.07 118.70 117.66 2af2 s GLU 100 Ca 0.36 -0.11 -0.10 0.00 0.03 0.00 0.00 54.97 55.14 2af2 s GLU 100 Cb 0.07 -0.47 0.01 0.00 -0.80 0.00 0.00 34.13 32.94 2af2 s GLU 100 CO 0.10 0.03 0.21 0.34 -1.33 0.00 0.00 175.26 174.61 2af2 s ASP 101 N 0.26 -0.02 -0.56 0.83 -1.08 -0.30 -4.97 116.67 110.83 2af2 s ASP 101 Ca -0.03 -0.25 0.07 0.00 -0.52 0.00 0.00 52.55 51.82 2af2 s ASP 101 Cb -0.06 0.28 0.25 0.00 -1.46 0.00 0.00 42.92 41.94 2af2 s ASP 101 CO -0.00 -0.51 0.69 -1.54 0.52 0.00 0.00 175.17 174.32 2af2 n SER 102 N 0.91 2.68 0.00 -0.34 3.41 -1.26 -0.72 113.62 118.30 2af2 n SER 102 Ca -0.20 -3.23 0.00 0.00 -0.26 0.00 0.00 58.87 55.19 2af2 n SER 102 Cb 0.58 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 2af2 n SER 102 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 2af2 n VAL 103 N 0.96 0.00 -3.32 -3.33 3.14 -1.26 -5.01 118.33 109.50 2af2 n VAL 103 Ca 0.27 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.42 2af2 n VAL 103 Cb 0.45 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.22 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 -0.97 4.72 0.37 1.55 -0.00 -1.26 -4.98 121.20 120.63 2af2 s ILE 104 Ca 0.00 -0.56 -0.14 0.00 -0.00 0.00 0.00 60.65 59.95 2af2 s ILE 104 Cb 0.00 -3.72 0.04 0.00 -0.00 0.00 0.00 42.46 38.78 2af2 s ILE 104 CO 0.00 -0.45 0.73 -0.94 -0.00 0.00 0.00 174.94 174.28 2af2 s SER 105 N -4.09 0.11 -0.88 4.36 1.04 -1.26 -4.63 113.70 108.35 2af2 s SER 105 Ca 0.42 -1.14 -0.01 0.00 0.48 0.00 0.00 55.95 55.71 2af2 s SER 105 Cb -0.10 0.81 0.22 0.00 0.10 0.00 0.00 66.02 67.05 2af2 s SER 105 CO 0.36 -1.59 0.75 -0.76 0.98 0.00 0.00 173.24 172.98 2af2 s LEU 106 N -3.08 5.48 0.00 2.42 1.02 -1.24 -0.86 118.68 122.43 2af2 s LEU 106 Ca 0.17 -3.74 -0.00 0.00 0.02 0.00 0.00 54.13 50.58 2af2 s LEU 106 Cb -0.04 -1.88 0.00 0.00 0.02 0.00 0.00 46.19 44.28 2af2 s LEU 106 CO 0.12 -0.17 0.05 -0.24 0.02 0.00 0.00 176.35 176.13 2af2 n SER 107 N 2.29 -0.13 -3.75 2.29 2.88 -1.26 -4.69 113.62 111.24 2af2 n SER 107 Ca 0.21 -1.20 -0.29 0.00 -1.33 0.00 0.00 58.87 56.26 2af2 n SER 107 Cb 0.37 0.25 -0.13 0.00 -0.75 0.00 0.00 64.21 63.95 2af2 n SER 107 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2af2 s GLY 108 N -1.23 1.93 0.03 0.46 0.00 -1.26 -4.42 107.32 102.83 2af2 s GLY 108 Ca 0.03 -2.86 0.00 0.00 0.00 0.00 0.00 44.72 41.89 2af2 s GLY 108 CO 0.02 1.44 0.00 1.22 0.00 0.00 0.00 173.10 175.78 2af2 n ASP 109 N 3.21 -0.26 0.00 1.64 8.00 -1.26 -4.99 116.55 122.89 2af2 n ASP 109 Ca 0.11 0.24 0.00 0.00 0.71 0.00 0.00 54.79 55.85 2af2 n ASP 109 Cb 0.35 0.46 0.00 0.00 -0.02 0.00 0.00 41.12 41.91 2af2 n ASP 109 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2af2 n HIS 110 N -2.49 0.00 -0.09 1.24 8.25 -1.26 -5.07 115.22 115.80 2af2 n HIS 110 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2af2 n HIS 110 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2af2 n HIS 110 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2af2 n SER 111 N 0.00 -0.10 -0.53 0.41 3.41 -1.26 -4.87 113.62 110.68 2af2 n SER 111 Ca 0.00 -0.09 0.06 0.00 -0.26 0.00 0.00 58.87 58.58 2af2 n SER 111 Cb 0.45 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.47 2af2 n SER 111 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2af2 n ILE 112 N -0.63 0.11 -1.81 -1.33 -5.35 -0.04 -4.82 119.36 105.49 2af2 n ILE 112 Ca 0.00 -0.55 -0.42 0.00 -0.27 0.00 0.00 62.75 61.51 2af2 n ILE 112 Cb 0.00 1.18 -0.03 0.00 -1.74 0.00 0.00 39.64 39.05 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 -1.05 2.64 -0.63 7.28 -1.09 -1.25 -2.34 121.20 124.76 2af2 s ILE 113 Ca 0.16 0.23 0.00 0.00 -2.23 0.00 0.00 60.65 58.81 2af2 s ILE 113 Cb 0.11 -3.15 0.00 0.00 -1.58 0.00 0.00 42.46 37.84 2af2 s ILE 113 CO 0.16 0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.48 2af2 n GLY 114 N 4.07 0.81 3.97 6.18 0.00 -0.86 -4.88 105.19 114.47 2af2 n GLY 114 Ca 0.16 -0.44 -0.18 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.13 2.74 -0.14 1.61 3.52 -0.99 -3.68 118.95 119.88 2af2 s ARG 115 Ca 0.00 -1.33 0.01 0.00 -0.13 0.00 0.00 55.73 54.28 2af2 s ARG 115 Cb 0.00 -2.64 0.02 0.00 -1.56 0.00 0.00 34.95 30.77 2af2 s ARG 115 CO 0.00 -0.23 -0.16 -0.08 -0.81 0.00 0.00 175.30 174.02 2af2 s THR 116 N -2.38 1.68 -0.03 4.11 -1.32 -1.26 -0.56 115.64 115.87 2af2 s THR 116 Ca 0.52 -0.72 -0.16 0.00 -1.21 0.00 0.00 61.69 60.13 2af2 s THR 116 Cb -0.08 -1.54 -0.05 0.00 -1.51 0.00 0.00 72.50 69.32 2af2 s THR 116 CO 0.31 0.48 0.42 -0.22 -2.21 0.00 0.00 174.62 173.40 2af2 s LEU 117 N 1.27 4.42 -0.05 9.08 1.98 -0.75 -0.31 118.68 134.32 2af2 s LEU 117 Ca 0.01 0.92 0.02 0.00 -2.89 0.00 0.00 54.13 52.19 2af2 s LEU 117 Cb -0.14 -2.61 0.01 0.00 0.66 0.00 0.00 46.19 44.12 2af2 s LEU 117 CO -0.08 0.24 -0.11 -0.69 -1.89 0.00 0.00 176.35 173.82 2af2 s VAL 118 N -0.62 1.03 -0.10 1.68 1.01 -0.19 -1.59 120.40 121.63 2af2 s VAL 118 Ca 0.24 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 2af2 s VAL 118 Cb -0.16 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.24 2af2 s VAL 118 CO 0.12 0.33 0.01 0.68 0.00 0.00 0.00 175.10 176.25 2af2 s VAL 119 N 0.58 4.42 0.12 2.92 -7.23 -0.14 -2.20 120.40 118.86 2af2 s VAL 119 Ca -0.12 -0.20 -0.06 0.00 -1.81 0.00 0.00 61.98 59.79 2af2 s VAL 119 Cb -0.14 -2.88 -0.06 0.00 0.56 0.00 0.00 36.38 33.87 2af2 s VAL 119 CO 0.03 0.59 0.38 -1.00 -0.31 0.00 0.00 175.10 174.79 2af2 s HIS 120 N -0.75 3.51 -0.08 2.82 3.76 -0.36 -0.65 115.29 123.54 2af2 s HIS 120 Ca 0.12 0.62 0.26 0.00 -0.15 0.00 0.00 55.06 55.91 2af2 s HIS 120 Cb -0.12 -2.05 0.82 0.00 1.11 0.00 0.00 32.58 32.34 2af2 s HIS 120 CO 0.02 0.47 1.78 1.05 -0.85 0.00 0.00 174.74 177.21 2af2 h GLU 121 N 3.13 0.00 -5.94 1.40 -0.00 -1.39 -3.38 114.58 108.41 2af2 h GLU 121 Ca -0.47 0.00 -0.56 0.00 -0.00 0.00 0.00 59.36 58.33 2af2 h GLU 121 Cb 1.17 0.00 -0.08 0.00 -0.00 0.00 0.00 28.75 29.84 2af2 h GLU 121 CO 0.70 0.11 -0.50 0.15 -0.00 0.00 0.00 179.01 179.48 2af2 s LYS 122 N -3.45 2.25 0.75 1.06 1.02 -0.90 -4.98 119.74 115.49 2af2 s LYS 122 Ca 0.03 -1.80 -0.15 0.00 0.02 0.00 0.00 55.97 54.07 2af2 s LYS 122 Cb 0.08 -2.02 0.02 0.00 -0.52 0.00 0.00 37.83 35.39 2af2 s LYS 122 CO 0.62 -0.10 0.97 0.00 -0.92 0.00 0.00 175.35 175.93 2af2 n ALA 123 N -1.24 -0.38 -2.46 5.17 0.00 -0.98 -3.11 120.51 117.51 2af2 n ALA 123 Ca -0.01 -0.24 -0.26 0.00 0.00 0.00 0.00 53.44 52.93 2af2 n ALA 123 Cb 0.64 -2.12 -0.11 0.00 0.00 0.00 0.00 19.45 17.87 2af2 n ALA 123 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2af2 s ASP 124 N -1.75 3.60 -0.10 0.00 -4.77 -1.26 -4.31 116.67 108.08 2af2 s ASP 124 Ca 0.72 -0.87 -0.04 0.00 -3.30 0.00 0.00 52.55 49.06 2af2 s ASP 124 Cb -0.33 -0.34 -0.26 0.00 -1.09 0.00 0.00 42.92 40.91 2af2 s ASP 124 CO 0.52 0.09 0.45 -0.78 0.70 0.00 0.00 175.17 176.15 2af2 h ASP 125 N 2.88 0.36 -4.94 2.11 1.82 -1.62 -3.49 116.42 113.53 2af2 h ASP 125 Ca -0.45 -0.78 -0.31 0.00 -0.39 0.00 0.00 57.03 55.10 2af2 h ASP 125 Cb 1.22 -0.12 0.12 0.00 0.68 0.00 0.00 39.33 41.24 2af2 h ASP 125 CO 0.52 1.70 -0.57 0.18 -1.61 0.00 0.00 179.24 179.46 2af2 n LEU 126 N -3.41 -3.28 0.00 2.28 7.99 -1.26 -4.45 117.00 114.87 2af2 n LEU 126 Ca -0.29 -0.46 0.00 0.00 -0.01 0.00 0.00 56.01 55.26 2af2 n LEU 126 Cb 1.05 -2.58 0.00 0.00 -0.11 0.00 0.00 43.42 41.78 2af2 n LEU 126 CO 0.44 0.47 0.00 0.61 -1.51 0.00 0.00 177.39 177.40 2af2 n GLY 127 N -1.56 1.74 2.39 -0.72 0.00 -1.08 -4.16 105.19 101.80 2af2 n GLY 127 Ca -0.06 -0.43 -0.16 0.00 0.00 0.00 0.00 46.02 45.37 2af2 n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2af2 n LYS 128 N 0.00 0.93 0.00 1.61 4.76 -1.26 -3.11 118.16 121.09 2af2 n LYS 128 Ca 0.00 -2.82 0.00 0.00 -2.87 0.00 0.00 58.31 52.62 2af2 n LYS 128 Cb 0.00 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 31.76 2af2 n LYS 128 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2af2 n GLY 129 N 0.57 -1.18 0.00 0.72 0.00 -1.26 -4.87 105.19 99.17 2af2 n GLY 129 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 0.83 1.40 0.00 -0.02 0.00 -1.26 -5.12 105.19 101.03 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 0.47 -0.01 1.61 6.94 -1.26 -5.01 115.26 118.00 2af2 n ASN 131 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 54.58 54.43 2af2 n ASN 131 Cb 0.00 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.32 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 0.01 -0.94 -3.83 4.57 -2.00 -3.19 114.58 109.20 2af2 h GLU 132 Ca 0.00 -0.00 0.27 0.00 -1.18 0.00 0.00 59.36 58.45 2af2 h GLU 132 Cb 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 2af2 h GLU 132 CO 0.00 0.49 0.85 0.93 -1.18 0.00 0.00 179.01 180.10 2af2 h GLU 133 N -0.47 0.00 -0.30 1.92 3.07 -1.97 0.22 114.58 117.04 2af2 h GLU 133 Ca 0.00 0.00 0.09 0.00 -0.50 0.00 0.00 59.36 58.95 2af2 h GLU 133 Cb 0.49 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 2af2 h GLU 133 CO 0.00 0.00 0.48 0.77 -1.40 0.00 0.00 179.01 178.86 2af2 h SER 134 N 0.00 0.00 0.03 1.42 0.02 -1.79 0.50 113.55 113.74 2af2 h SER 134 Ca 0.45 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 61.15 2af2 h SER 134 Cb 2.15 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 64.64 2af2 h SER 134 CO -0.00 0.00 -2.23 0.35 -1.14 0.00 0.00 176.83 173.80 2af2 n THR 135 N -3.37 0.97 0.03 -2.27 -2.24 0.78 -3.09 114.28 105.09 2af2 n THR 135 Ca 0.05 -0.75 0.02 0.00 -2.27 0.00 0.00 64.05 61.10 2af2 n THR 135 Cb 0.61 -0.34 -0.08 0.00 -2.10 0.00 0.00 70.33 68.42 2af2 n THR 135 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2af2 n LYS 136 N -2.61 0.63 0.00 -0.78 5.02 -0.74 -3.97 118.16 115.71 2af2 n LYS 136 Ca -0.23 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2af2 n LYS 136 Cb 0.97 -1.76 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 2af2 n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2af2 n THR 137 N -2.79 0.00 0.00 -0.18 -2.24 0.09 -4.86 114.28 104.30 2af2 n THR 137 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2af2 n THR 137 Cb 0.80 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 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 3.08 1.28 4.07 3.38 0.00 -0.81 -4.73 105.19 111.46 2af2 n GLY 138 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 -0.32 1.61 4.05 -1.21 -1.54 115.26 117.85 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 -2.22 0.00 0.00 1.23 0.00 0.00 39.78 38.79 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 0.99 1.57 -0.14 5.20 0.00 -1.26 -4.89 120.51 121.98 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 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 0.15 0.92 0.00 0.00 0.00 -1.26 -2.11 105.19 102.89 2af2 n GLY 141 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 6.96 0.40 -4.81 1.61 2.88 -1.26 -4.93 113.62 114.48 2af2 n SER 142 Ca 0.00 -0.82 -0.33 0.00 -1.33 0.00 0.00 58.87 56.38 2af2 n SER 142 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2af2 n SER 142 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2af2 s ARG 143 N -1.18 3.83 -0.01 -1.46 1.04 -1.26 -1.65 118.95 118.26 2af2 s ARG 143 Ca 0.00 1.23 -0.02 0.00 -1.04 0.00 0.00 55.73 55.89 2af2 s ARG 143 Cb 0.00 -2.11 -0.01 0.00 -2.04 0.00 0.00 34.95 30.79 2af2 s ARG 143 CO 0.00 -0.38 -0.05 -0.11 -0.04 0.00 0.00 175.30 174.72 2af2 n LEU 144 N -1.16 0.47 -4.24 -1.89 0.00 0.18 -4.37 117.00 106.00 2af2 n LEU 144 Ca 0.08 0.07 -0.14 0.00 0.00 0.00 0.00 56.01 56.02 2af2 n LEU 144 Cb 0.53 -0.31 -0.10 0.00 0.00 0.00 0.00 43.42 43.54 2af2 n LEU 144 CO 0.41 -0.52 -0.41 0.00 0.00 0.00 0.00 177.39 176.87 2af2 s ALA 145 N -2.42 1.39 -0.01 1.96 0.00 -1.18 -4.16 121.76 117.36 2af2 s ALA 145 Ca -0.04 -1.43 -0.24 0.00 0.00 0.00 0.00 51.96 50.25 2af2 s ALA 145 Cb 0.01 0.04 0.05 0.00 0.00 0.00 0.00 23.12 23.22 2af2 s ALA 145 CO 0.06 -0.07 0.54 0.00 0.00 0.00 0.00 175.76 176.28 2af2 s GLY 147 N -1.51 -0.43 -0.10 0.00 0.00 -0.62 -1.00 107.32 103.66 2af2 s GLY 147 Ca -0.09 0.29 -0.02 0.00 0.00 0.00 0.00 44.72 44.89 2af2 s GLY 147 CO 0.04 0.10 -0.01 0.14 0.00 0.00 0.00 173.10 173.37 2af2 s VAL 148 N -3.71 4.19 -0.08 1.40 1.01 -1.26 -1.81 120.40 120.14 2af2 s VAL 148 Ca 0.05 -0.28 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 2af2 s VAL 148 Cb -0.02 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 2af2 s VAL 148 CO -0.06 0.58 0.94 -0.63 0.00 0.00 0.00 175.10 175.93 2af2 s ILE 149 N -0.58 4.85 0.00 2.22 1.01 0.27 -4.73 121.20 124.25 2af2 s ILE 149 Ca 0.09 1.93 0.00 0.00 0.00 0.00 0.00 60.65 62.67 2af2 s ILE 149 Cb -0.12 -4.26 0.00 0.00 0.01 0.00 0.00 42.46 38.09 2af2 s ILE 149 CO 0.02 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.65 2af2 n GLY 150 N 3.09 6.29 3.12 6.18 0.00 0.24 -2.04 105.19 122.09 2af2 n GLY 150 Ca 0.06 -1.91 -0.19 0.00 0.00 0.00 0.00 46.02 43.99 2af2 n GLY 150 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2af2 s ILE 151 N 1.56 1.00 -0.09 -0.61 -5.25 -1.26 -0.46 121.20 116.09 2af2 s ILE 151 Ca 0.00 -0.98 -0.27 0.00 -0.99 0.00 0.00 60.65 58.41 2af2 s ILE 151 Cb 0.00 -0.92 -0.25 0.00 2.95 0.00 0.00 42.46 44.24 2af2 s ILE 151 CO 0.00 -0.05 0.92 0.00 -1.79 0.00 0.00 174.94 174.02 2af2 h ALA 152 N 4.91 0.00 0.00 2.27 0.00 -1.09 -3.47 119.26 121.88 2af2 h ALA 152 Ca -0.37 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.07 2af2 h ALA 152 Cb 1.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2af2 h ALA 152 CO 0.44 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.73