#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2af2 s THR 2 N 0.00 4.54 -0.07 0.00 2.01 -1.08 -4.42 115.64 116.61 2af2 s THR 2 Ca 0.00 -0.72 0.02 0.00 0.31 0.00 0.00 61.69 61.30 2af2 s THR 2 Cb 0.00 -4.64 0.01 0.00 0.01 0.00 0.00 72.50 67.89 2af2 s THR 2 CO 0.00 -1.36 -0.14 -1.59 -0.69 0.00 0.00 174.62 170.84 2af2 s LYS 3 N 3.44 1.93 0.16 4.92 -2.85 -1.26 -0.73 119.74 125.35 2af2 s LYS 3 Ca 0.20 -0.49 0.08 0.00 -1.00 0.00 0.00 55.97 54.76 2af2 s LYS 3 Cb -0.18 -1.56 -0.04 0.00 -2.06 0.00 0.00 37.83 33.99 2af2 s LYS 3 CO 0.06 0.05 -0.08 0.00 0.10 0.00 0.00 175.35 175.48 2af2 s ALA 4 N 0.63 3.00 0.02 0.59 0.00 -0.36 -1.48 121.76 124.16 2af2 s ALA 4 Ca -0.15 -1.39 0.08 0.00 0.00 0.00 0.00 51.96 50.49 2af2 s ALA 4 Cb -0.16 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 22.11 2af2 s ALA 4 CO 0.04 0.51 -0.23 0.54 0.00 0.00 0.00 175.76 176.63 2af2 s VAL 5 N -1.59 1.83 -0.15 0.00 0.11 0.92 -0.48 120.40 121.04 2af2 s VAL 5 Ca 0.25 -1.15 -0.05 0.00 -2.93 0.00 0.00 61.98 58.10 2af2 s VAL 5 Cb -0.09 -1.55 -0.04 0.00 -1.53 0.00 0.00 36.38 33.17 2af2 s VAL 5 CO 0.16 0.37 0.03 0.00 -3.33 0.00 0.00 175.10 172.33 2af2 s ALA 6 N -0.69 3.34 -0.28 1.54 0.00 0.21 0.01 121.76 125.90 2af2 s ALA 6 Ca 0.09 -0.76 0.01 0.00 0.00 0.00 0.00 51.96 51.30 2af2 s ALA 6 Cb -0.09 -1.75 0.06 0.00 0.00 0.00 0.00 23.12 21.34 2af2 s ALA 6 CO 0.01 0.33 -0.06 0.08 0.00 0.00 0.00 175.76 176.11 2af2 s VAL 7 N -0.07 2.45 -0.03 0.00 1.01 -0.57 -3.01 120.40 120.18 2af2 s VAL 7 Ca 0.05 -1.61 0.04 0.00 0.00 0.00 0.00 61.98 60.47 2af2 s VAL 7 Cb -0.12 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 2af2 s VAL 7 CO 0.01 -0.10 -0.15 -0.76 0.00 0.00 0.00 175.10 174.10 2af2 s LEU 8 N 1.14 2.69 0.19 3.92 1.02 -0.70 -2.00 118.68 124.94 2af2 s LEU 8 Ca -0.06 -0.24 -0.23 0.00 0.02 0.00 0.00 54.13 53.62 2af2 s LEU 8 Cb -0.20 -1.55 0.05 0.00 0.02 0.00 0.00 46.19 44.52 2af2 s LEU 8 CO -0.04 0.33 0.68 -0.54 0.02 0.00 0.00 176.35 176.80 2af2 s LYS 9 N -0.84 1.44 0.00 1.70 1.02 -0.66 -1.68 119.74 120.71 2af2 s LYS 9 Ca 0.12 -0.66 0.00 0.00 0.02 0.00 0.00 55.97 55.45 2af2 s LYS 9 Cb -0.11 0.57 0.00 0.00 -0.52 0.00 0.00 37.83 37.78 2af2 s LYS 9 CO 0.01 -0.64 0.00 0.41 -0.92 0.00 0.00 175.35 174.21 2af2 n GLY 10 N -0.41 -0.29 2.73 -3.33 0.00 -0.90 -2.93 105.19 100.06 2af2 n GLY 10 Ca -0.11 -0.23 -0.09 0.00 0.00 0.00 0.00 46.02 45.59 2af2 n GLY 10 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2af2 n ASP 11 N -0.75 -2.40 0.00 1.61 2.03 -1.26 -4.67 116.55 111.11 2af2 n ASP 11 Ca 0.00 -3.67 0.00 0.00 0.52 0.00 0.00 54.79 51.64 2af2 n ASP 11 Cb 0.30 1.93 0.00 0.00 -0.72 0.00 0.00 41.12 42.63 2af2 n ASP 11 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2af2 n GLY 12 N 0.48 -1.96 2.48 0.27 0.00 -1.26 -4.64 105.19 100.56 2af2 n GLY 12 Ca 0.06 -2.11 -0.24 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.03 2.37 -4.17 1.61 -0.04 -1.26 -4.82 135.00 128.65 2af2 n PRO 13 Ca 0.00 -1.53 -0.18 0.00 -0.04 0.00 0.00 63.50 61.75 2af2 n PRO 13 Cb 0.00 -2.45 -0.16 0.00 -0.04 0.00 0.00 33.50 30.85 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 2.89 0.49 0.16 0.52 1.01 -1.26 -4.15 120.40 120.07 2af2 s VAL 14 Ca 0.47 -0.16 -0.14 0.00 0.00 0.00 0.00 61.98 62.15 2af2 s VAL 14 Cb 0.13 -0.48 0.01 0.00 0.00 0.00 0.00 36.38 36.05 2af2 s VAL 14 CO -0.04 0.19 0.39 0.00 0.00 0.00 0.00 175.10 175.64 2af2 s GLN 15 N 0.50 1.20 -0.07 2.72 0.00 -0.37 -2.11 119.66 121.53 2af2 s GLN 15 Ca -0.06 -0.95 -0.24 0.00 -0.00 0.00 0.00 55.36 54.10 2af2 s GLN 15 Cb -0.10 0.45 0.05 0.00 0.00 0.00 0.00 33.01 33.41 2af2 s GLN 15 CO -0.00 -0.47 0.55 0.20 0.00 0.00 0.00 175.29 175.57 2af2 s GLY 16 N -2.89 -0.43 -0.03 2.60 0.00 -0.68 -0.36 107.32 105.54 2af2 s GLY 16 Ca 0.10 1.09 0.06 0.00 0.00 0.00 0.00 44.72 45.97 2af2 s GLY 16 CO -0.04 0.79 -0.21 -1.50 0.00 0.00 0.00 173.10 172.14 2af2 s ILE 17 N -0.97 1.72 -0.03 0.90 -1.16 -0.96 -1.71 121.20 118.98 2af2 s ILE 17 Ca -0.10 -0.91 -0.01 0.00 -0.51 0.00 0.00 60.65 59.12 2af2 s ILE 17 Cb -0.02 -1.44 0.03 0.00 0.61 0.00 0.00 42.46 41.64 2af2 s ILE 17 CO 0.07 0.49 0.06 -0.63 -2.81 0.00 0.00 174.94 172.11 2af2 s ILE 18 N -0.37 -0.08 0.16 2.00 -1.09 -1.16 -0.63 121.20 120.02 2af2 s ILE 18 Ca 0.05 0.27 -0.22 0.00 -2.23 0.00 0.00 60.65 58.52 2af2 s ILE 18 Cb -0.10 -0.13 -0.08 0.00 -1.58 0.00 0.00 42.46 40.58 2af2 s ILE 18 CO 0.00 0.11 0.71 0.20 -1.23 0.00 0.00 174.94 174.74 2af2 s ASN 19 N 1.41 7.22 -0.36 3.58 0.02 0.28 -0.61 114.94 126.48 2af2 s ASN 19 Ca -0.05 1.49 0.02 0.00 -1.02 0.00 0.00 52.86 53.31 2af2 s ASN 19 Cb -0.13 -2.44 0.11 0.00 0.02 0.00 0.00 41.25 38.81 2af2 s ASN 19 CO -0.03 0.18 0.11 -0.36 0.02 0.00 0.00 177.10 177.01 2af2 s PHE 20 N -1.24 2.95 -0.24 2.20 0.40 0.37 -2.19 117.98 120.23 2af2 s PHE 20 Ca 0.36 -2.62 -0.02 0.00 -0.60 0.00 0.00 56.93 54.05 2af2 s PHE 20 Cb -0.21 -2.48 0.02 0.00 0.51 0.00 0.00 43.02 40.87 2af2 s PHE 20 CO 0.23 -0.89 -0.06 -2.00 0.70 0.00 0.00 175.22 173.20 2af2 s GLU 21 N 0.90 2.96 0.07 0.44 2.12 -0.41 -1.23 118.70 123.55 2af2 s GLU 21 Ca 0.12 -0.90 0.04 0.00 0.36 0.00 0.00 54.97 54.60 2af2 s GLU 21 Cb -0.20 -2.98 -0.04 0.00 0.26 0.00 0.00 34.13 31.17 2af2 s GLU 21 CO -0.11 -0.35 -0.00 -1.14 -0.54 0.00 0.00 175.26 173.12 2af2 s GLN 22 N 1.36 2.59 0.06 4.30 0.74 0.09 -1.31 119.66 127.49 2af2 s GLN 22 Ca 0.02 -0.79 0.16 0.00 0.05 0.00 0.00 55.36 54.80 2af2 s GLN 22 Cb -0.16 -2.56 -0.13 0.00 1.10 0.00 0.00 33.01 31.25 2af2 s GLN 22 CO -0.05 0.56 0.85 1.57 -0.55 0.00 0.00 175.29 177.67 2af2 h LYS 23 N 3.63 0.00 0.00 1.67 -0.00 -1.84 -2.87 116.57 117.16 2af2 h LYS 23 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.17 2af2 h LYS 23 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.40 2af2 h LYS 23 CO 0.59 0.32 0.00 0.39 -0.00 0.00 0.00 179.45 180.76 2af2 n GLU 24 N -2.93 1.66 -0.00 0.07 4.71 -1.26 -4.82 120.64 118.07 2af2 n GLU 24 Ca -0.10 0.00 0.05 0.00 -0.01 0.00 0.00 57.16 57.10 2af2 n GLU 24 Cb 0.85 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 31.22 2af2 n GLU 24 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2af2 n SER 25 N 0.00 2.25 0.04 1.62 2.88 -1.26 -4.61 113.62 114.55 2af2 n SER 25 Ca 0.00 -0.18 0.03 0.00 -1.33 0.00 0.00 58.87 57.39 2af2 n SER 25 Cb 0.00 1.32 -0.07 0.00 -0.75 0.00 0.00 64.21 64.72 2af2 n SER 25 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2af2 n ASN 26 N -1.68 0.81 -4.24 -3.46 6.94 -1.26 -4.44 115.26 107.94 2af2 n ASN 26 Ca -0.01 0.35 -0.30 0.00 -0.02 0.00 0.00 54.58 54.60 2af2 n ASN 26 Cb 0.22 0.30 0.18 0.00 -2.36 0.00 0.00 39.78 38.13 2af2 n ASN 26 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2af2 s GLY 27 N -4.70 1.67 0.54 4.83 0.00 -1.26 -5.05 107.32 103.35 2af2 s GLY 27 Ca -0.03 -0.95 -0.18 0.00 0.00 0.00 0.00 44.72 43.56 2af2 s GLY 27 CO 0.81 -0.21 1.06 2.56 0.00 0.00 0.00 173.10 177.32 2af2 s PRO 28 N -5.61 3.50 -0.20 2.90 0.04 -1.26 -4.83 135.00 129.55 2af2 s PRO 28 Ca 0.70 1.35 -0.11 0.00 0.04 0.00 0.00 61.00 62.98 2af2 s PRO 28 Cb -0.08 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.36 2af2 s PRO 28 CO 0.54 -0.68 0.19 0.08 0.04 0.00 0.00 177.00 177.16 2af2 s VAL 29 N -2.13 5.37 -0.26 -0.36 1.01 0.07 -4.35 120.40 119.74 2af2 s VAL 29 Ca 0.67 0.29 -0.21 0.00 0.00 0.00 0.00 61.98 62.73 2af2 s VAL 29 Cb -0.18 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 2af2 s VAL 29 CO 0.28 0.40 0.66 -0.75 0.00 0.00 0.00 175.10 175.69 2af2 s LYS 30 N 0.58 4.08 -0.11 2.72 2.20 -0.43 -1.57 119.74 127.21 2af2 s LYS 30 Ca 0.10 0.56 0.00 0.00 -0.36 0.00 0.00 55.97 56.28 2af2 s LYS 30 Cb -0.12 -3.67 -0.02 0.00 -1.51 0.00 0.00 37.83 32.51 2af2 s LYS 30 CO 0.01 -0.47 -0.12 0.14 -0.36 0.00 0.00 175.35 174.56 2af2 s VAL 31 N 2.59 3.20 0.08 4.02 -7.23 0.85 -1.29 120.40 122.62 2af2 s VAL 31 Ca 0.27 -0.63 -0.21 0.00 -1.81 0.00 0.00 61.98 59.61 2af2 s VAL 31 Cb -0.15 -2.33 0.05 0.00 0.56 0.00 0.00 36.38 34.51 2af2 s VAL 31 CO 0.09 0.54 0.50 -1.66 -0.31 0.00 0.00 175.10 174.26 2af2 s TRP 32 N -0.01 -0.38 -3.63 2.82 -2.14 -0.93 -0.29 118.94 114.37 2af2 s TRP 32 Ca -0.03 0.31 0.00 0.00 2.66 0.00 0.00 56.10 59.05 2af2 s TRP 32 Cb -0.14 0.35 0.00 0.00 -3.10 0.00 0.00 33.47 30.58 2af2 s TRP 32 CO 0.04 -0.68 0.00 0.41 -2.66 0.00 0.00 176.95 174.06 2af2 n GLY 33 N 0.18 -0.58 3.23 3.67 0.00 -0.56 -0.56 105.19 110.57 2af2 n GLY 33 Ca -0.18 -0.64 -0.04 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.58 -0.18 1.61 1.04 0.19 -1.05 113.70 110.73 2af2 s SER 34 Ca 0.00 0.89 -0.18 0.00 0.48 0.00 0.00 55.95 57.14 2af2 s SER 34 Cb 0.00 1.68 -0.03 0.00 0.10 0.00 0.00 66.02 67.77 2af2 s SER 34 CO 0.00 -0.25 0.49 -0.63 0.98 0.00 0.00 173.24 173.83 2af2 s ILE 35 N 2.71 5.13 -0.01 -1.02 1.09 -0.87 -2.26 121.20 125.97 2af2 s ILE 35 Ca 0.06 0.92 0.06 0.00 -1.10 0.00 0.00 60.65 60.60 2af2 s ILE 35 Cb -0.14 -3.82 -0.02 0.00 -1.06 0.00 0.00 42.46 37.43 2af2 s ILE 35 CO -0.17 0.21 -0.20 -0.75 -0.10 0.00 0.00 174.94 173.94 2af2 s LYS 36 N 1.40 1.58 0.00 2.79 2.20 0.52 -0.19 119.74 128.04 2af2 s LYS 36 Ca 0.24 -0.74 0.00 0.00 -0.36 0.00 0.00 55.97 55.11 2af2 s LYS 36 Cb -0.15 -1.55 0.00 0.00 -1.51 0.00 0.00 37.83 34.62 2af2 s LYS 36 CO 0.09 0.42 0.00 0.41 -0.36 0.00 0.00 175.35 175.92 2af2 n GLY 37 N 2.49 1.01 3.13 5.54 0.00 0.29 -1.24 105.19 116.41 2af2 n GLY 37 Ca -0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.12 0.99 7.99 -0.60 -4.74 117.00 120.53 2af2 n LEU 38 Ca 0.00 -1.03 -0.18 0.00 -0.01 0.00 0.00 56.01 54.79 2af2 n LEU 38 Cb 0.00 -0.90 -0.10 0.00 -0.11 0.00 0.00 43.42 42.31 2af2 n LEU 38 CO 0.00 -2.09 -1.26 1.07 -1.51 0.00 0.00 177.39 173.59 2af2 n THR 39 N -4.69 1.31 0.00 -5.08 5.66 -1.26 -3.99 114.28 106.23 2af2 n THR 39 Ca 0.14 -0.46 0.00 0.00 -3.05 0.00 0.00 64.05 60.68 2af2 n THR 39 Cb 0.53 -1.43 0.00 0.00 -1.55 0.00 0.00 70.33 67.88 2af2 n THR 39 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 2af2 n GLU 40 N -3.39 0.00 -1.25 1.09 2.13 -1.26 -4.06 120.64 113.91 2af2 n GLU 40 Ca -0.42 0.00 -0.40 0.00 0.66 0.00 0.00 57.16 57.01 2af2 n GLU 40 Cb 0.91 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.62 2af2 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2af2 n GLY 41 N 0.00 -2.91 1.94 8.31 0.00 -1.26 -1.01 105.19 110.27 2af2 n GLY 41 Ca 0.00 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 2af2 n GLY 41 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2af2 n LEU 42 N 2.36 -0.47 -4.09 0.99 -0.00 -1.26 -4.60 117.00 109.93 2af2 n LEU 42 Ca 0.09 0.64 -0.21 0.00 -0.00 0.00 0.00 56.01 56.54 2af2 n LEU 42 Cb 0.42 -0.53 -0.15 0.00 -0.00 0.00 0.00 43.42 43.17 2af2 n LEU 42 CO 0.53 -1.49 -0.46 -1.00 -0.00 0.00 0.00 177.39 174.97 2af2 s HIS 43 N -0.38 1.13 0.68 1.47 3.76 0.57 -1.83 115.29 120.70 2af2 s HIS 43 Ca 0.41 -0.23 -0.14 0.00 -0.15 0.00 0.00 55.06 54.96 2af2 s HIS 43 Cb -0.59 -0.72 0.01 0.00 1.11 0.00 0.00 32.58 32.39 2af2 s HIS 43 CO 0.32 -0.02 1.10 0.20 -0.85 0.00 0.00 174.74 175.49 2af2 s GLY 44 N -0.37 2.00 -0.28 -2.22 0.00 -0.13 -0.47 107.32 105.85 2af2 s GLY 44 Ca 0.05 0.43 0.01 0.00 0.00 0.00 0.00 44.72 45.20 2af2 s GLY 44 CO -0.00 0.78 0.48 -0.12 0.00 0.00 0.00 173.10 174.24 2af2 s PHE 45 N -2.54 -1.27 -0.03 1.90 2.19 -1.11 -0.69 117.98 116.44 2af2 s PHE 45 Ca 0.65 0.99 -0.03 0.00 0.33 0.00 0.00 56.93 58.87 2af2 s PHE 45 Cb -0.19 0.18 0.01 0.00 -1.31 0.00 0.00 43.02 41.71 2af2 s PHE 45 CO 0.45 -0.90 0.07 -1.01 1.83 0.00 0.00 175.22 175.67 2af2 s HIS 46 N 2.68 -0.08 0.14 10.12 0.09 -0.49 -3.59 115.29 124.16 2af2 s HIS 46 Ca 0.14 0.19 -0.30 0.00 -0.00 0.00 0.00 55.06 55.09 2af2 s HIS 46 Cb -0.14 0.03 -0.07 0.00 -0.00 0.00 0.00 32.58 32.41 2af2 s HIS 46 CO -0.23 -0.04 1.02 0.14 -0.00 0.00 0.00 174.74 175.64 2af2 s VAL 47 N 0.03 4.24 0.51 -0.90 -7.23 -1.26 -0.57 120.40 115.22 2af2 s VAL 47 Ca -0.00 1.88 0.05 0.00 -1.81 0.00 0.00 61.98 62.10 2af2 s VAL 47 Cb -0.01 -4.20 0.01 0.00 0.56 0.00 0.00 36.38 32.74 2af2 s VAL 47 CO 0.00 0.30 0.27 -1.00 -0.31 0.00 0.00 175.10 174.36 2af2 s HIS 48 N -0.07 1.89 0.11 2.82 3.76 0.46 -3.77 115.29 120.49 2af2 s HIS 48 Ca 0.48 -0.81 -0.30 0.00 -0.15 0.00 0.00 55.06 54.28 2af2 s HIS 48 Cb -0.26 -1.86 -0.06 0.00 1.11 0.00 0.00 32.58 31.51 2af2 s HIS 48 CO 0.32 -0.18 1.16 -2.00 -0.85 0.00 0.00 174.74 173.19 2af2 s GLU 49 N -4.11 4.49 0.90 1.40 2.56 0.48 -3.83 118.70 120.58 2af2 s GLU 49 Ca 0.29 1.76 -0.15 0.00 0.00 0.00 0.00 54.97 56.86 2af2 s GLU 49 Cb -0.00 -3.31 0.21 0.00 2.00 0.00 0.00 34.13 33.03 2af2 s GLU 49 CO 0.17 -0.12 1.11 1.97 -0.56 0.00 0.00 175.26 177.83 2af2 n PHE 50 N 3.23 -3.95 0.00 5.30 1.16 -1.26 -1.82 117.46 120.11 2af2 n PHE 50 Ca 0.06 -0.98 0.00 0.00 -1.87 0.00 0.00 57.45 54.66 2af2 n PHE 50 Cb 0.46 -0.91 0.00 0.00 -1.61 0.00 0.00 39.48 37.42 2af2 n PHE 50 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2af2 n GLY 51 N -2.81 0.37 2.58 4.97 0.00 -1.26 -4.80 105.19 104.23 2af2 n GLY 51 Ca 0.14 -1.21 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 2af2 n GLY 51 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2af2 n ASP 52 N 0.00 7.08 -2.90 1.61 2.03 -1.26 -4.84 116.55 118.27 2af2 n ASP 52 Ca 0.00 -3.03 -0.26 0.00 0.52 0.00 0.00 54.79 52.02 2af2 n ASP 52 Cb 0.00 -1.44 -0.06 0.00 -0.72 0.00 0.00 41.12 38.90 2af2 n ASP 52 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2af2 n ASN 53 N 2.87 6.61 0.00 1.67 2.04 -1.26 -3.82 115.26 123.36 2af2 n ASN 53 Ca 0.58 -2.44 0.00 0.00 -0.44 0.00 0.00 54.58 52.28 2af2 n ASN 53 Cb 0.28 -1.35 0.00 0.00 -2.53 0.00 0.00 39.78 36.18 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 3.41 0.00 1.19 5.53 -2.24 -1.26 -4.66 114.28 116.25 2af2 n THR 54 Ca 0.58 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.36 2af2 n THR 54 Cb 0.38 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.80 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 -2.56 2.10 -0.61 6.98 0.00 -1.26 -5.00 120.51 120.16 2af2 n ALA 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2af2 n ALA 55 Cb 0.38 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.83 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 0.12 0.44 0.00 0.00 0.00 -1.26 -4.06 105.19 100.43 2af2 n GLY 56 Ca 0.00 -0.81 0.01 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.36 0.22 0.00 0.00 5.66 -1.26 -4.41 114.28 113.12 2af2 n THR 58 Ca 0.01 -0.17 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 2af2 n THR 58 Cb 0.02 -0.02 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 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 -1.87 3.47 -4.57 1.09 2.88 -0.37 -4.88 113.62 109.37 2af2 n SER 59 Ca 0.04 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.32 2af2 n SER 59 Cb 0.40 0.15 -0.06 0.00 -0.75 0.00 0.00 64.21 63.95 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 -1.80 1.62 -0.26 -1.46 0.00 0.16 -4.71 121.76 115.32 2af2 s ALA 60 Ca 0.00 -1.66 -0.40 0.00 0.00 0.00 0.00 51.96 49.90 2af2 s ALA 60 Cb 0.00 -4.60 -0.16 0.00 0.00 0.00 0.00 23.12 18.37 2af2 s ALA 60 CO 0.00 -5.05 1.71 0.41 0.00 0.00 0.00 175.76 172.83 2af2 n GLY 61 N 6.53 0.80 3.70 0.00 0.00 -0.76 -4.48 105.19 110.98 2af2 n GLY 61 Ca 0.42 0.92 -0.42 0.00 0.00 0.00 0.00 46.02 46.93 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 3.27 4.25 -1.02 1.61 0.04 -1.26 -0.39 135.00 141.50 2af2 s PRO 62 Ca 0.98 2.17 -0.06 0.00 0.04 0.00 0.00 61.00 64.12 2af2 s PRO 62 Cb -1.08 -3.49 -0.06 0.00 0.04 0.00 0.00 34.50 29.91 2af2 s PRO 62 CO 0.65 -0.62 0.89 0.72 0.04 0.00 0.00 177.00 178.69 2af2 n HIS 63 N 5.08 -2.50 -1.34 0.56 8.25 -1.26 -4.82 115.22 119.18 2af2 n HIS 63 Ca 0.14 0.87 -0.55 0.00 -0.26 0.00 0.00 57.72 57.92 2af2 n HIS 63 Cb 0.42 -4.10 -0.10 0.00 1.12 0.00 0.00 29.99 27.33 2af2 n HIS 63 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2af2 n PHE 64 N -3.12 1.37 -2.89 4.41 7.35 -1.23 -4.80 117.46 118.54 2af2 n PHE 64 Ca -0.06 0.53 -0.17 0.00 -0.76 0.00 0.00 57.45 56.99 2af2 n PHE 64 Cb 0.61 -2.40 -0.01 0.00 0.35 0.00 0.00 39.48 38.03 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 8.63 1.90 0.20 -2.13 6.94 -1.26 -0.73 115.26 128.82 2af2 n ASN 65 Ca 0.49 -3.06 0.14 0.00 -0.02 0.00 0.00 54.58 52.13 2af2 n ASN 65 Cb 0.09 -0.56 0.70 0.00 -2.36 0.00 0.00 39.78 37.65 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 2.95 0.00 0.00 -0.53 0.13 -2.00 0.11 132.00 132.67 2af2 h PRO 66 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2af2 h PRO 66 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2af2 h PRO 66 CO 0.58 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.63 2af2 n LEU 67 N -2.48 0.00 -2.82 1.56 4.77 -1.26 -4.97 117.00 111.80 2af2 n LEU 67 Ca -0.01 0.36 -0.12 0.00 -0.03 0.00 0.00 56.01 56.21 2af2 n LEU 67 Cb 0.10 -0.36 0.06 0.00 -2.33 0.00 0.00 43.42 40.89 2af2 n LEU 67 CO 0.15 -0.04 0.05 -0.24 -1.33 0.00 0.00 177.39 175.98 2af2 n SER 68 N -1.36 -4.18 -4.65 -1.43 2.88 0.40 -5.02 113.62 100.26 2af2 n SER 68 Ca 0.11 -0.51 -0.29 0.00 -1.33 0.00 0.00 58.87 56.85 2af2 n SER 68 Cb 0.25 -4.02 -0.10 0.00 -0.75 0.00 0.00 64.21 59.59 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 -4.42 2.01 0.54 -1.46 0.52 -1.26 -5.15 118.95 109.74 2af2 s ARG 69 Ca 0.21 -2.18 -0.17 0.00 -0.52 0.00 0.00 55.73 53.07 2af2 s ARG 69 Cb -0.03 -1.57 -0.06 0.00 0.52 0.00 0.00 34.95 33.82 2af2 s ARG 69 CO 0.55 -0.15 1.04 0.21 0.02 0.00 0.00 175.30 176.97 2af2 s LYS 70 N -3.76 3.59 0.52 3.54 2.20 -1.26 -4.90 119.74 119.66 2af2 s LYS 70 Ca 0.27 1.20 -0.19 0.00 -0.36 0.00 0.00 55.97 56.89 2af2 s LYS 70 Cb 0.08 -2.07 -0.07 0.00 -1.51 0.00 0.00 37.83 34.25 2af2 s LYS 70 CO 0.14 -0.59 1.05 -1.58 -0.36 0.00 0.00 175.35 174.01 2af2 s HIS 71 N -2.34 2.97 0.00 4.03 5.65 -0.65 -3.52 115.29 121.42 2af2 s HIS 71 Ca 0.64 1.56 0.00 0.00 0.25 0.00 0.00 55.06 57.50 2af2 s HIS 71 Cb -0.15 -3.07 0.00 0.00 -1.18 0.00 0.00 32.58 28.19 2af2 s HIS 71 CO 0.30 -0.96 0.00 0.41 -0.65 0.00 0.00 174.74 173.85 2af2 n GLY 72 N -0.42 0.42 0.00 1.59 0.00 -1.26 -1.35 105.19 104.17 2af2 n GLY 72 Ca 0.09 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 3.43 0.49 -0.02 0.00 -1.24 -4.55 105.19 103.31 2af2 n GLY 73 Ca 0.00 -1.02 0.05 0.00 0.00 0.00 0.00 46.02 45.05 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 1.62 0.00 1.61 -0.04 -1.26 -4.43 135.00 132.50 2af2 n PRO 74 Ca 0.00 -0.96 0.00 0.00 -0.04 0.00 0.00 63.50 62.50 2af2 n PRO 74 Cb 0.00 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 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 0.27 0.00 -2.23 0.54 2.85 -1.26 -5.12 118.16 113.20 2af2 n LYS 75 Ca 0.10 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 57.07 2af2 n LYS 75 Cb 0.23 0.00 0.01 0.00 -0.65 0.00 0.00 35.03 34.63 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 -0.52 6.08 0.06 -5.58 2.15 -1.20 -5.03 116.67 112.62 2af2 s ASP 76 Ca 0.00 1.11 0.22 0.00 0.43 0.00 0.00 52.55 54.32 2af2 s ASP 76 Cb 0.00 -2.23 -0.13 0.00 -0.30 0.00 0.00 42.92 40.26 2af2 s ASP 76 CO 0.00 -0.83 0.81 -0.62 -0.17 0.00 0.00 175.17 174.35 2af2 n GLU 77 N -2.57 0.51 -0.01 4.34 4.71 -1.26 -3.67 120.64 122.68 2af2 n GLU 77 Ca 0.04 -0.05 -0.01 0.00 -0.01 0.00 0.00 57.16 57.13 2af2 n GLU 77 Cb 0.55 -1.62 -0.00 0.00 -1.01 0.00 0.00 31.44 29.35 2af2 n GLU 77 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2af2 n GLU 78 N -2.25 0.08 -1.28 3.49 1.02 -1.26 -4.97 120.64 115.46 2af2 n GLU 78 Ca -0.01 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 2af2 n GLU 78 Cb 0.51 -0.78 0.00 0.00 -0.02 0.00 0.00 31.44 31.16 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 -2.74 -3.29 -0.89 3.49 0.63 -1.23 -4.90 116.66 107.73 2af2 n ARG 79 Ca -0.02 2.44 -0.28 0.00 -0.92 0.00 0.00 57.85 59.07 2af2 n ARG 79 Cb 0.07 -2.56 0.21 0.00 0.45 0.00 0.00 32.46 30.63 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 -1.01 1.75 -0.00 -0.14 3.76 -1.25 -4.90 115.29 113.49 2af2 s HIS 80 Ca 0.00 1.04 -0.25 0.00 -0.15 0.00 0.00 55.06 55.69 2af2 s HIS 80 Cb 0.00 -3.19 -0.19 0.00 1.11 0.00 0.00 32.58 30.30 2af2 s HIS 80 CO 0.00 -3.40 1.32 0.28 -0.85 0.00 0.00 174.74 172.10 2af2 h VAL 81 N -2.27 1.27 -2.25 -0.90 2.07 -1.25 -3.29 116.25 109.63 2af2 h VAL 81 Ca -0.58 -0.93 -0.66 0.00 0.82 0.00 0.00 66.70 65.34 2af2 h VAL 81 Cb 1.34 1.89 -0.15 0.00 -1.52 0.00 0.00 31.29 32.84 2af2 h VAL 81 CO 0.55 0.24 0.88 -0.83 0.02 0.00 0.00 177.57 178.42 2af2 s GLY 82 N -3.00 1.65 -0.16 2.17 0.00 -0.32 -4.94 107.32 102.71 2af2 s GLY 82 Ca -0.15 -2.42 -0.24 0.00 0.00 0.00 0.00 44.72 41.91 2af2 s GLY 82 CO 0.66 2.15 0.61 0.99 0.00 0.00 0.00 173.10 177.51 2af2 s ASP 83 N 3.87 -0.61 0.32 1.64 1.01 -1.24 -3.51 116.67 118.15 2af2 s ASP 83 Ca 0.32 1.00 0.06 0.00 0.71 0.00 0.00 52.55 54.64 2af2 s ASP 83 Cb -0.07 0.98 -0.03 0.00 1.01 0.00 0.00 42.92 44.81 2af2 s ASP 83 CO -0.04 -0.35 0.24 -0.76 0.21 0.00 0.00 175.17 174.47 2af2 s LEU 84 N -0.25 1.68 0.00 1.23 1.43 -1.25 -4.76 118.68 116.76 2af2 s LEU 84 Ca -0.04 -1.69 0.00 0.00 -1.03 0.00 0.00 54.13 51.36 2af2 s LEU 84 Cb -0.03 0.46 0.00 0.00 0.03 0.00 0.00 46.19 46.65 2af2 s LEU 84 CO 0.04 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.21 2af2 n GLY 85 N -0.59 0.82 3.25 -3.19 0.00 -1.24 -4.65 105.19 99.58 2af2 n GLY 85 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.00 0.16 -0.05 1.61 4.22 -1.26 -2.73 114.94 115.89 2af2 s ASN 86 Ca 0.00 -0.96 -0.01 0.00 -2.14 0.00 0.00 52.86 49.75 2af2 s ASN 86 Cb 0.00 0.36 0.03 0.00 1.28 0.00 0.00 41.25 42.92 2af2 s ASN 86 CO 0.00 -0.80 0.00 0.68 -2.04 0.00 0.00 177.10 174.94 2af2 s VAL 87 N -3.98 0.29 -0.07 3.54 -7.23 0.38 -4.94 120.40 108.39 2af2 s VAL 87 Ca 0.17 0.12 -0.08 0.00 -1.81 0.00 0.00 61.98 60.39 2af2 s VAL 87 Cb 0.05 -0.43 -0.04 0.00 0.56 0.00 0.00 36.38 36.52 2af2 s VAL 87 CO -0.01 0.22 0.21 -0.89 -0.31 0.00 0.00 175.10 174.31 2af2 s THR 88 N 1.65 5.39 0.22 5.32 2.01 -1.26 -0.31 115.64 128.66 2af2 s THR 88 Ca -0.00 0.27 0.01 0.00 0.31 0.00 0.00 61.69 62.27 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 0.54 0.39 0.00 -0.69 0.00 0.00 174.62 174.83 2af2 s ALA 89 N -1.11 3.84 0.56 7.40 0.00 -0.18 -4.16 121.76 128.12 2af2 s ALA 89 Ca 0.20 -0.92 -0.11 0.00 0.00 0.00 0.00 51.96 51.13 2af2 s ALA 89 Cb -0.13 -1.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.99 2af2 s ALA 89 CO 0.09 0.36 0.97 0.34 0.00 0.00 0.00 175.76 177.51 2af2 s ASP 90 N -3.39 6.33 0.64 0.00 -1.08 0.10 -4.07 116.67 115.19 2af2 s ASP 90 Ca 0.38 1.35 0.24 0.00 -0.52 0.00 0.00 52.55 54.00 2af2 s ASP 90 Cb -0.11 -2.43 1.28 0.00 -1.46 0.00 0.00 42.92 40.20 2af2 s ASP 90 CO 0.30 -0.74 1.72 0.07 0.52 0.00 0.00 175.17 177.04 2af2 h LYS 91 N 0.11 0.00 0.00 4.34 5.09 -1.89 0.20 116.57 124.43 2af2 h LYS 91 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.29 2af2 h LYS 91 Cb 1.19 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.52 2af2 h LYS 91 CO 0.62 0.00 0.00 -0.25 -2.09 0.00 0.00 179.45 177.73 2af2 n ASP 92 N -3.04 0.00 0.00 7.07 8.00 -1.26 -4.88 116.55 122.44 2af2 n ASP 92 Ca 0.02 -1.29 0.00 0.00 0.71 0.00 0.00 54.79 54.24 2af2 n ASP 92 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.72 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 0.64 0.50 3.49 0.44 0.00 0.71 -4.73 105.19 106.24 2af2 n GLY 93 Ca 0.13 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.00 4.40 -0.74 1.61 0.11 -1.19 -0.55 120.40 122.04 2af2 s VAL 94 Ca 0.00 -0.15 -0.19 0.00 -2.93 0.00 0.00 61.98 58.71 2af2 s VAL 94 Cb 0.00 -3.03 0.12 0.00 -1.53 0.00 0.00 36.38 31.93 2af2 s VAL 94 CO 0.00 0.37 0.91 0.00 -3.33 0.00 0.00 175.10 173.05 2af2 s ALA 95 N 1.29 3.39 -0.06 1.54 0.00 0.73 -0.73 121.76 127.93 2af2 s ALA 95 Ca 0.05 -2.41 -0.30 0.00 0.00 0.00 0.00 51.96 49.30 2af2 s ALA 95 Cb -0.15 -3.78 -0.02 0.00 0.00 0.00 0.00 23.12 19.18 2af2 s ALA 95 CO 0.03 -2.65 1.02 0.34 0.00 0.00 0.00 175.76 174.50 2af2 s ASP 96 N 3.51 7.27 0.02 0.00 2.15 -1.26 -2.06 116.67 126.30 2af2 s ASP 96 Ca 0.21 1.62 0.03 0.00 0.43 0.00 0.00 52.55 54.84 2af2 s ASP 96 Cb -0.15 -2.56 -0.01 0.00 -0.30 0.00 0.00 42.92 39.89 2af2 s ASP 96 CO 0.01 -0.39 -0.08 0.54 -0.17 0.00 0.00 175.17 175.08 2af2 s VAL 97 N 1.61 0.61 -0.27 1.11 0.11 -0.22 -4.89 120.40 118.47 2af2 s VAL 97 Ca 0.51 -0.69 -0.06 0.00 -2.93 0.00 0.00 61.98 58.81 2af2 s VAL 97 Cb -0.20 -0.58 0.14 0.00 -1.53 0.00 0.00 36.38 34.20 2af2 s VAL 97 CO 0.22 -0.08 0.54 -0.55 -3.33 0.00 0.00 175.10 171.90 2af2 s SER 98 N -0.85 -0.77 0.05 3.54 0.15 -1.26 -1.50 113.70 113.06 2af2 s SER 98 Ca -0.02 1.04 -0.01 0.00 0.70 0.00 0.00 55.95 57.66 2af2 s SER 98 Cb -0.06 1.85 -0.04 0.00 -1.71 0.00 0.00 66.02 66.06 2af2 s SER 98 CO 0.00 -0.25 -0.03 -0.63 1.20 0.00 0.00 173.24 173.53 2af2 s ILE 99 N 2.76 0.25 -0.02 6.45 1.01 0.60 -5.00 121.20 127.26 2af2 s ILE 99 Ca 0.05 -1.69 0.01 0.00 0.00 0.00 0.00 60.65 59.02 2af2 s ILE 99 Cb -0.13 -1.35 0.01 0.00 0.01 0.00 0.00 42.46 40.99 2af2 s ILE 99 CO -0.17 -0.91 -0.05 -0.70 0.00 0.00 0.00 174.94 173.11 2af2 s GLU 100 N -3.55 0.55 -0.13 2.79 2.12 -1.26 -0.10 118.70 119.12 2af2 s GLU 100 Ca 0.04 -0.15 -0.09 0.00 0.36 0.00 0.00 54.97 55.13 2af2 s GLU 100 Cb 0.05 -0.56 0.04 0.00 0.26 0.00 0.00 34.13 33.93 2af2 s GLU 100 CO -0.08 0.04 0.31 0.34 -0.54 0.00 0.00 175.26 175.34 2af2 s ASP 101 N 0.26 -0.35 -0.64 -1.70 -1.08 -0.61 -4.99 116.67 107.56 2af2 s ASP 101 Ca -0.03 0.66 0.01 0.00 -0.52 0.00 0.00 52.55 52.67 2af2 s ASP 101 Cb -0.07 0.59 0.41 0.00 -1.46 0.00 0.00 42.92 42.39 2af2 s ASP 101 CO -0.00 -0.15 1.73 -1.54 0.52 0.00 0.00 175.17 175.72 2af2 n SER 102 N 3.70 6.64 -0.41 -0.34 3.41 -1.26 -0.75 113.62 124.61 2af2 n SER 102 Ca -0.20 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 54.62 2af2 n SER 102 Cb 0.56 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 2af2 n SER 102 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2af2 n VAL 103 N -0.66 0.00 -3.84 -3.33 0.31 -1.26 -4.96 118.33 104.60 2af2 n VAL 103 Ca 0.52 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.75 2af2 n VAL 103 Cb 0.54 0.45 -0.08 0.00 -0.91 0.00 0.00 33.84 33.84 2af2 n VAL 103 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 2af2 s ILE 104 N 0.00 0.11 0.17 2.52 -0.00 -1.26 -4.99 121.20 117.74 2af2 s ILE 104 Ca 0.00 -0.89 -0.20 0.00 -0.00 0.00 0.00 60.65 59.56 2af2 s ILE 104 Cb 0.00 -0.92 0.05 0.00 -0.00 0.00 0.00 42.46 41.59 2af2 s ILE 104 CO 0.00 -0.49 0.55 -0.94 -0.00 0.00 0.00 174.94 174.06 2af2 s SER 105 N -2.11 -0.41 -1.05 4.36 1.04 -1.26 -4.19 113.70 110.09 2af2 s SER 105 Ca -0.05 -0.22 -0.17 0.00 0.48 0.00 0.00 55.95 55.99 2af2 s SER 105 Cb -0.01 0.58 0.13 0.00 0.10 0.00 0.00 66.02 66.82 2af2 s SER 105 CO -0.04 -0.99 1.30 -0.76 0.98 0.00 0.00 173.24 173.73 2af2 s LEU 106 N -2.80 4.83 0.00 2.42 1.02 -1.26 -0.41 118.68 122.48 2af2 s LEU 106 Ca 0.04 -2.32 0.07 0.00 0.02 0.00 0.00 54.13 51.94 2af2 s LEU 106 Cb -0.01 -2.43 0.00 0.00 0.02 0.00 0.00 46.19 43.78 2af2 s LEU 106 CO -0.09 -1.01 0.55 -0.24 0.02 0.00 0.00 176.35 175.58 2af2 n SER 107 N 6.59 1.08 0.00 2.29 2.88 -0.87 -4.82 113.62 120.78 2af2 n SER 107 Ca 0.31 -1.04 0.00 0.00 -1.33 0.00 0.00 58.87 56.81 2af2 n SER 107 Cb 0.47 0.42 0.00 0.00 -0.75 0.00 0.00 64.21 64.35 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 0.73 2.82 2.00 0.46 0.00 -1.15 -4.61 105.19 105.44 2af2 n GLY 108 Ca 0.03 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 1.82 -0.08 0.00 1.61 5.75 -1.26 -4.54 116.55 119.85 2af2 n ASP 109 Ca 0.00 0.07 0.14 0.00 -0.01 0.00 0.00 54.79 54.98 2af2 n ASP 109 Cb 0.00 0.15 0.63 0.00 -1.03 0.00 0.00 41.12 40.86 2af2 n ASP 109 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2af2 n HIS 110 N -2.62 0.00 0.00 2.11 8.25 -1.26 -4.70 115.22 116.99 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 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 30.67 2af2 n HIS 110 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2af2 n SER 111 N -1.44 0.00 -4.67 0.41 7.64 -1.26 -5.03 113.62 109.27 2af2 n SER 111 Ca 0.09 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.70 2af2 n SER 111 Cb 0.30 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.40 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 1.97 2.15 0.00 0.44 -4.36 0.46 -4.87 121.20 116.98 2af2 s ILE 112 Ca 0.00 -1.87 0.00 0.00 -0.26 0.00 0.00 60.65 58.52 2af2 s ILE 112 Cb 0.00 -2.99 0.00 0.00 1.25 0.00 0.00 42.46 40.72 2af2 s ILE 112 CO 0.00 -0.01 0.00 -0.38 0.24 0.00 0.00 174.94 174.79 2af2 n ILE 113 N -1.08 0.00 -0.41 8.37 2.08 -1.26 -2.04 119.36 125.02 2af2 n ILE 113 Ca -0.03 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.28 2af2 n ILE 113 Cb 0.66 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.55 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 1.62 0.33 3.88 7.39 0.00 -1.22 -4.53 105.19 112.65 2af2 n GLY 114 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.54 1.52 0.31 1.61 3.52 -1.26 -4.58 118.95 119.52 2af2 s ARG 115 Ca 0.00 0.04 0.10 0.00 -0.13 0.00 0.00 55.73 55.74 2af2 s ARG 115 Cb 0.00 -1.91 -0.05 0.00 -1.56 0.00 0.00 34.95 31.43 2af2 s ARG 115 CO 0.00 -1.89 -0.05 -0.08 -0.81 0.00 0.00 175.30 172.47 2af2 s THR 116 N -3.58 2.77 -0.09 4.11 -1.32 -1.25 -0.58 115.64 115.71 2af2 s THR 116 Ca 0.65 -2.08 -0.05 0.00 -1.21 0.00 0.00 61.69 58.99 2af2 s THR 116 Cb -0.10 -2.67 0.04 0.00 -1.51 0.00 0.00 72.50 68.26 2af2 s THR 116 CO 0.51 -0.30 0.22 -0.22 -2.21 0.00 0.00 174.62 172.62 2af2 s LEU 117 N -3.65 0.58 -0.09 9.08 2.96 -0.19 -0.41 118.68 126.96 2af2 s LEU 117 Ca 0.33 0.47 0.03 0.00 -0.22 0.00 0.00 54.13 54.74 2af2 s LEU 117 Cb -0.03 0.67 -0.02 0.00 0.50 0.00 0.00 46.19 47.32 2af2 s LEU 117 CO 0.18 -0.15 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.20 2af2 s VAL 118 N 1.07 2.70 0.16 1.68 1.01 0.26 -1.20 120.40 126.09 2af2 s VAL 118 Ca -0.08 -0.82 0.04 0.00 0.00 0.00 0.00 61.98 61.12 2af2 s VAL 118 Cb -0.09 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 2af2 s VAL 118 CO -0.07 0.56 0.20 0.68 0.00 0.00 0.00 175.10 176.47 2af2 s VAL 119 N -0.07 4.85 -0.05 2.92 -7.23 -0.99 -1.40 120.40 118.44 2af2 s VAL 119 Ca -0.04 -0.92 0.02 0.00 -1.81 0.00 0.00 61.98 59.23 2af2 s VAL 119 Cb -0.14 -3.49 0.02 0.00 0.56 0.00 0.00 36.38 33.32 2af2 s VAL 119 CO 0.04 -0.11 -0.08 -1.00 -0.31 0.00 0.00 175.10 173.65 2af2 s HIS 120 N -1.76 0.99 0.42 2.82 3.76 0.13 -1.72 115.29 119.94 2af2 s HIS 120 Ca 0.33 -0.31 0.35 0.00 -0.15 0.00 0.00 55.06 55.28 2af2 s HIS 120 Cb -0.10 -0.78 1.91 0.00 1.11 0.00 0.00 32.58 34.72 2af2 s HIS 120 CO 0.26 -0.20 2.07 1.49 -0.85 0.00 0.00 174.74 177.51 2af2 h GLU 121 N 6.97 0.00 -5.22 1.40 4.22 -1.49 -0.33 114.58 120.13 2af2 h GLU 121 Ca -0.35 0.00 -0.45 0.00 0.08 0.00 0.00 59.36 58.64 2af2 h GLU 121 Cb 1.17 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.28 2af2 h GLU 121 CO 0.48 0.00 -0.63 0.15 -2.18 0.00 0.00 179.01 176.83 2af2 s LYS 122 N -3.95 1.55 0.21 1.92 -0.14 -1.14 -4.57 119.74 113.61 2af2 s LYS 122 Ca -0.04 -1.83 -0.31 0.00 -1.36 0.00 0.00 55.97 52.43 2af2 s LYS 122 Cb 0.10 -0.83 -0.15 0.00 -1.68 0.00 0.00 37.83 35.27 2af2 s LYS 122 CO 0.32 -0.13 1.10 0.00 -0.76 0.00 0.00 175.35 175.88 2af2 n ALA 123 N -0.59 -0.68 -2.44 5.17 0.00 -0.76 -2.34 120.51 118.87 2af2 n ALA 123 Ca -0.03 0.44 -0.27 0.00 0.00 0.00 0.00 53.44 53.58 2af2 n ALA 123 Cb 0.65 -2.01 -0.14 0.00 0.00 0.00 0.00 19.45 17.95 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 -0.19 2.82 0.21 0.00 -4.77 -1.26 -4.37 116.67 109.10 2af2 s ASP 124 Ca 0.69 -0.62 0.10 0.00 -3.30 0.00 0.00 52.55 49.41 2af2 s ASP 124 Cb -0.81 -0.21 0.07 0.00 -1.09 0.00 0.00 42.92 40.88 2af2 s ASP 124 CO 0.54 0.16 1.44 -0.78 0.70 0.00 0.00 175.17 177.24 2af2 h ASP 125 N 4.47 0.00 -7.01 2.11 1.82 -0.98 -3.48 116.42 113.35 2af2 h ASP 125 Ca -0.46 0.00 -0.46 0.00 -0.39 0.00 0.00 57.03 55.72 2af2 h ASP 125 Cb 1.16 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 41.13 2af2 h ASP 125 CO 0.42 0.78 -0.77 0.18 -1.61 0.00 0.00 179.24 178.24 2af2 n LEU 126 N -3.50 -0.17 0.00 2.28 4.77 -1.26 -3.87 117.00 115.25 2af2 n LEU 126 Ca -0.00 -0.99 0.00 0.00 -0.03 0.00 0.00 56.01 54.98 2af2 n LEU 126 Cb 0.78 -1.20 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2af2 n LEU 126 CO 0.44 0.59 0.00 0.61 -1.33 0.00 0.00 177.39 177.70 2af2 n GLY 127 N -1.89 0.32 3.49 -0.72 0.00 -0.46 -3.26 105.19 102.67 2af2 n GLY 127 Ca -0.11 -0.13 -0.05 0.00 0.00 0.00 0.00 46.02 45.73 2af2 n GLY 127 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2af2 s LYS 128 N 0.00 0.49 0.00 1.61 2.36 -1.25 -3.02 119.74 119.94 2af2 s LYS 128 Ca 0.00 1.24 0.00 0.00 -2.55 0.00 0.00 55.97 54.66 2af2 s LYS 128 Cb 0.00 0.54 0.00 0.00 -1.05 0.00 0.00 37.83 37.32 2af2 s LYS 128 CO 0.00 -0.21 0.00 0.41 1.55 0.00 0.00 175.35 177.10 2af2 n GLY 129 N 5.20 0.38 0.00 5.54 0.00 -1.26 -5.03 105.19 110.02 2af2 n GLY 129 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 4.39 -0.16 3.48 -0.02 0.00 -1.26 -5.13 105.19 106.50 2af2 n GLY 130 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.01 3.49 0.07 1.61 0.01 -1.26 -5.04 114.94 113.81 2af2 s ASN 131 Ca 0.00 -1.09 -0.32 0.00 -0.71 0.00 0.00 52.86 50.74 2af2 s ASN 131 Cb 0.00 -0.29 -0.18 0.00 0.41 0.00 0.00 41.25 41.18 2af2 s ASN 131 CO 0.00 -0.08 1.63 -0.08 -1.51 0.00 0.00 177.10 177.05 2af2 h GLU 132 N 2.22 -0.77 0.00 -0.60 4.81 -2.02 -2.83 114.58 115.39 2af2 h GLU 132 Ca -0.40 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 2af2 h GLU 132 Cb 1.25 0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.81 2af2 h GLU 132 CO 0.64 -0.51 0.04 0.39 -0.73 0.00 0.00 179.01 178.85 2af2 n GLU 133 N -5.43 0.00 -0.03 1.92 -0.58 -1.26 -2.06 120.64 113.21 2af2 n GLU 133 Ca -0.13 0.33 -0.13 0.00 -0.42 0.00 0.00 57.16 56.81 2af2 n GLU 133 Cb 0.33 -1.54 -0.08 0.00 -0.57 0.00 0.00 31.44 29.58 2af2 n GLU 133 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2af2 h SER 134 N 0.00 0.15 1.08 1.62 4.64 -1.81 0.31 113.55 119.55 2af2 h SER 134 Ca 0.00 -0.40 -0.16 0.00 -0.47 0.00 0.00 61.79 60.76 2af2 h SER 134 Cb 0.08 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 2af2 h SER 134 CO 0.00 0.52 -0.96 0.71 -0.87 0.00 0.00 176.83 176.22 2af2 h THR 135 N -0.21 0.97 0.21 2.95 1.35 -1.32 -3.05 112.91 113.82 2af2 h THR 135 Ca 0.02 -2.50 -0.01 0.00 -0.55 0.00 0.00 66.41 63.37 2af2 h THR 135 Cb 0.46 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.31 2af2 h THR 135 CO 0.01 0.56 -0.10 0.11 -0.25 0.00 0.00 175.52 175.84 2af2 h LYS 136 N 0.00 -0.28 0.00 4.72 1.57 -1.57 -1.74 116.57 119.27 2af2 h LYS 136 Ca -0.07 0.02 -0.34 0.00 -1.87 0.00 0.00 60.65 58.39 2af2 h LYS 136 Cb 1.59 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 33.91 2af2 h LYS 136 CO 0.08 -0.18 -2.19 0.25 -0.57 0.00 0.00 179.45 176.83 2af2 n THR 137 N -4.81 1.18 0.00 -0.16 -2.24 -0.87 -4.63 114.28 102.74 2af2 n THR 137 Ca -0.04 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 2af2 n THR 137 Cb 0.11 -1.52 0.00 0.00 -2.10 0.00 0.00 70.33 66.82 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 2.06 0.77 2.37 3.38 0.00 -0.02 -4.85 105.19 108.90 2af2 n GLY 138 Ca -0.40 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.45 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 -4.78 -0.82 1.61 4.05 -0.47 -0.37 115.26 114.48 2af2 n ASN 139 Ca 0.00 0.38 0.00 0.00 0.45 0.00 0.00 54.58 55.41 2af2 n ASN 139 Cb 0.00 -4.24 0.00 0.00 1.23 0.00 0.00 39.78 36.77 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 0.51 1.76 0.00 5.20 0.00 -1.26 -4.67 120.51 122.04 2af2 n ALA 140 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2af2 n ALA 140 Cb 0.60 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.05 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 0.63 0.99 0.00 0.00 0.00 -1.26 -2.88 105.19 102.67 2af2 n GLY 141 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2af2 n GLY 141 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2af2 n SER 142 N 1.97 0.00 -0.69 1.61 7.64 -1.26 -4.99 113.62 117.90 2af2 n SER 142 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2af2 n SER 142 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2af2 n SER 142 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2af2 n ARG 143 N 0.00 3.03 0.00 1.43 0.00 -1.26 -4.51 116.66 115.35 2af2 n ARG 143 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2af2 n ARG 143 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.46 2af2 n ARG 143 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2af2 n LEU 144 N 0.00 0.00 -4.68 2.89 0.00 -0.70 -1.70 117.00 112.81 2af2 n LEU 144 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 56.01 55.62 2af2 n LEU 144 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 43.42 43.45 2af2 n LEU 144 CO 0.00 0.00 0.79 0.00 0.00 0.00 0.00 177.39 178.18 2af2 n ALA 145 N -3.00 0.96 -2.61 1.96 0.00 -1.26 -4.69 120.51 111.87 2af2 n ALA 145 Ca 0.00 0.14 -0.21 0.00 0.00 0.00 0.00 53.44 53.36 2af2 n ALA 145 Cb 0.00 -2.24 -0.13 0.00 0.00 0.00 0.00 19.45 17.09 2af2 n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2af2 s GLY 147 N -1.46 0.65 0.03 0.00 0.00 -0.34 -1.66 107.32 104.55 2af2 s GLY 147 Ca 0.03 -0.93 -0.05 0.00 0.00 0.00 0.00 44.72 43.77 2af2 s GLY 147 CO 0.02 -0.56 0.08 0.14 0.00 0.00 0.00 173.10 172.78 2af2 s VAL 148 N -3.27 0.13 -0.32 1.40 1.01 -0.85 -1.03 120.40 117.48 2af2 s VAL 148 Ca 0.21 -1.09 -0.21 0.00 0.00 0.00 0.00 61.98 60.89 2af2 s VAL 148 Cb -0.03 -0.84 -0.00 0.00 0.00 0.00 0.00 36.38 35.51 2af2 s VAL 148 CO 0.12 -0.60 0.67 -0.63 0.00 0.00 0.00 175.10 174.66 2af2 s ILE 149 N -2.50 4.89 0.56 2.22 1.01 0.25 -1.51 121.20 126.13 2af2 s ILE 149 Ca -0.06 0.87 0.08 0.00 0.00 0.00 0.00 60.65 61.54 2af2 s ILE 149 Cb -0.02 -4.05 0.10 0.00 0.01 0.00 0.00 42.46 38.49 2af2 s ILE 149 CO -0.04 -0.21 0.77 0.61 0.00 0.00 0.00 174.94 176.07 2af2 n GLY 150 N 4.43 1.78 3.04 6.18 0.00 0.10 -3.44 105.19 117.29 2af2 n GLY 150 Ca 0.00 -2.19 -0.13 0.00 0.00 0.00 0.00 46.02 43.70 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 -2.42 -0.01 -0.17 -0.61 -5.25 -1.26 -0.06 121.20 111.42 2af2 s ILE 151 Ca 0.57 0.02 0.07 0.00 -0.99 0.00 0.00 60.65 60.33 2af2 s ILE 151 Cb -0.04 -0.25 -0.15 0.00 2.95 0.00 0.00 42.46 44.96 2af2 s ILE 151 CO 0.37 0.01 -0.07 0.00 -1.79 0.00 0.00 174.94 173.45 2af2 n ALA 152 N 3.15 1.60 -0.26 2.27 0.00 -0.55 -4.95 120.51 121.77 2af2 n ALA 152 Ca -0.14 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.39 2af2 n ALA 152 Cb 0.58 -0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 2af2 n ALA 152 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54