#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ofn s THR 2 N 0.00 4.83 -0.24 2.03 2.01 -1.26 -4.85 115.64 118.16 2ofn s THR 2 Ca 0.00 -1.70 -0.03 0.00 0.31 0.00 0.00 61.69 60.27 2ofn s THR 2 Cb 0.00 -4.12 -0.14 0.00 0.01 0.00 0.00 72.50 68.26 2ofn s THR 2 CO 0.00 -0.84 -0.25 0.41 -0.69 0.00 0.00 174.62 173.24 2ofn n THR 3 N 5.01 1.36 -3.85 -0.82 -1.04 -1.26 -4.99 114.28 108.69 2ofn n THR 3 Ca -0.10 -0.46 -0.13 0.00 -2.04 0.00 0.00 64.05 61.33 2ofn n THR 3 Cb 0.41 -1.52 -0.15 0.00 -1.82 0.00 0.00 70.33 67.25 2ofn n THR 3 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2ofn s GLU 4 N -2.47 -0.00 0.15 -2.82 2.12 -1.26 -5.14 118.70 109.27 2ofn s GLU 4 Ca -0.33 0.05 -0.20 0.00 0.36 0.00 0.00 54.97 54.85 2ofn s GLU 4 Cb 0.10 -0.08 -0.07 0.00 0.26 0.00 0.00 34.13 34.34 2ofn s GLU 4 CO 0.51 -0.05 0.66 -0.65 -0.54 0.00 0.00 175.26 175.19 2ofn s GLN 5 N 0.31 4.27 -0.83 4.30 1.11 -1.26 -5.01 119.66 122.56 2ofn s GLN 5 Ca -0.03 0.84 -0.20 0.00 0.01 0.00 0.00 55.36 55.99 2ofn s GLN 5 Cb -0.04 -3.10 0.12 0.00 -1.01 0.00 0.00 33.01 28.97 2ofn s GLN 5 CO -0.01 0.54 1.04 -2.00 0.01 0.00 0.00 175.29 174.87 2ofn s GLU 6 N -1.47 3.43 0.00 2.91 -6.30 -1.26 -4.99 118.70 111.02 2ofn s GLU 6 Ca 0.36 -1.51 0.08 0.00 -2.50 0.00 0.00 54.97 51.39 2ofn s GLU 6 Cb -0.19 -4.68 -0.02 0.00 0.00 0.00 0.00 34.13 29.24 2ofn s GLU 6 CO 0.21 -1.75 -0.25 -0.06 0.02 0.00 0.00 175.26 173.43 2ofn s PHE 7 N 2.96 2.36 0.24 5.30 0.08 -1.26 -5.11 117.98 122.55 2ofn s PHE 7 Ca 0.28 -0.40 -0.30 0.00 0.12 0.00 0.00 56.93 56.63 2ofn s PHE 7 Cb -0.10 -1.48 -0.09 0.00 -0.57 0.00 0.00 43.02 40.79 2ofn s PHE 7 CO -0.03 0.04 1.16 -2.00 -0.10 0.00 0.00 175.22 174.28 2ofn s GLU 8 N -0.84 4.55 -0.21 0.44 2.56 -1.26 -4.88 118.70 119.06 2ofn s GLU 8 Ca 0.11 1.86 -0.10 0.00 0.00 0.00 0.00 54.97 56.84 2ofn s GLU 8 Cb -0.10 -3.20 -0.05 0.00 2.00 0.00 0.00 34.13 32.78 2ofn s GLU 8 CO 0.00 0.05 0.13 0.15 -0.56 0.00 0.00 175.26 175.03 2ofn s LYS 9 N -0.93 4.14 -0.45 4.30 3.01 -1.26 -2.16 119.74 126.39 2ofn s LYS 9 Ca 0.48 -0.24 -0.13 0.00 -1.01 0.00 0.00 55.97 55.07 2ofn s LYS 9 Cb -0.33 -3.43 0.07 0.00 -1.01 0.00 0.00 37.83 33.14 2ofn s LYS 9 CO 0.40 0.24 0.35 0.08 0.51 0.00 0.00 175.35 176.93 2ofn s VAL 10 N 0.53 4.89 -0.56 3.17 1.01 0.13 -5.01 120.40 124.56 2ofn s VAL 10 Ca 0.07 -1.18 -0.21 0.00 0.00 0.00 0.00 61.98 60.67 2ofn s VAL 10 Cb -0.12 -3.94 0.06 0.00 0.00 0.00 0.00 36.38 32.38 2ofn s VAL 10 CO -0.00 -0.55 0.78 -1.61 0.00 0.00 0.00 175.10 173.71 2ofn s GLU 11 N 1.57 3.17 -0.48 2.72 2.02 -1.26 -1.90 118.70 124.52 2ofn s GLU 11 Ca 0.04 -0.77 -0.09 0.00 0.02 0.00 0.00 54.97 54.17 2ofn s GLU 11 Cb -0.24 -4.13 0.01 0.00 0.10 0.00 0.00 34.13 29.87 2ofn s GLU 11 CO 0.05 -1.44 0.57 -0.11 0.02 0.00 0.00 175.26 174.35 2ofn n LEU 12 N 6.80 -6.92 -4.87 1.80 7.94 -1.23 -4.99 117.00 115.53 2ofn n LEU 12 Ca -0.04 0.28 -0.31 0.00 -1.11 0.00 0.00 56.01 54.83 2ofn n LEU 12 Cb 0.46 -3.11 0.01 0.00 0.53 0.00 0.00 43.42 41.30 2ofn n LEU 12 CO 0.59 -1.70 0.68 0.28 -1.11 0.00 0.00 177.39 176.14 2ofn s THR 13 N -2.64 4.73 -1.49 1.96 -1.32 -1.23 -4.85 115.64 110.81 2ofn s THR 13 Ca 0.14 0.80 0.14 0.00 -1.21 0.00 0.00 61.69 61.56 2ofn s THR 13 Cb -0.04 -3.86 0.25 0.00 -1.51 0.00 0.00 72.50 67.34 2ofn s THR 13 CO 0.68 -1.10 1.34 0.00 -2.21 0.00 0.00 174.62 173.33 2ofn n ALA 14 N -2.65 1.81 0.87 11.08 0.00 -1.26 -1.25 120.51 129.10 2ofn n ALA 14 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2ofn n ALA 14 Cb 0.54 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.77 2ofn n ALA 14 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ofn n ASP 15 N -1.25 2.79 0.00 0.00 2.03 -1.26 -4.58 116.55 114.28 2ofn n ASP 15 Ca 0.07 -1.83 0.00 0.00 0.52 0.00 0.00 54.79 53.55 2ofn n ASP 15 Cb 0.10 -0.47 0.00 0.00 -0.72 0.00 0.00 41.12 40.03 2ofn n ASP 15 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ofn n GLY 16 N 0.58 1.12 0.37 0.27 0.00 -1.23 -4.64 105.19 101.67 2ofn n GLY 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ofn n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ofn n GLY 17 N 0.00 0.91 3.01 -0.02 0.00 -0.38 -5.03 105.19 103.67 2ofn n GLY 17 Ca 0.00 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.24 2ofn n GLY 17 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ofn s VAL 18 N -2.25 0.13 -0.24 1.61 1.01 -1.26 -4.87 120.40 114.53 2ofn s VAL 18 Ca 0.00 -1.10 -0.24 0.00 0.00 0.00 0.00 61.98 60.64 2ofn s VAL 18 Cb 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.84 2ofn s VAL 18 CO 0.00 -0.61 0.80 -0.63 0.00 0.00 0.00 175.10 174.66 2ofn s ILE 19 N -1.99 4.86 -0.00 2.22 -1.09 -1.26 -3.47 121.20 120.46 2ofn s ILE 19 Ca -0.11 1.50 -0.04 0.00 -2.23 0.00 0.00 60.65 59.77 2ofn s ILE 19 Cb -0.06 -4.09 -0.00 0.00 -1.58 0.00 0.00 42.46 36.73 2ofn s ILE 19 CO -0.03 -0.06 0.08 -1.59 -1.23 0.00 0.00 174.94 172.11 2ofn s LYS 20 N 2.78 0.33 -0.14 2.79 -2.85 -0.80 -0.77 119.74 121.08 2ofn s LYS 20 Ca 0.33 -0.31 -0.06 0.00 -1.00 0.00 0.00 55.97 54.94 2ofn s LYS 20 Cb -0.15 0.13 -0.04 0.00 -2.06 0.00 0.00 37.83 35.71 2ofn s LYS 20 CO 0.07 -0.07 0.07 0.99 0.10 0.00 0.00 175.35 176.52 2ofn s THR 21 N -0.99 4.89 -0.38 3.79 2.01 0.15 -0.70 115.64 124.41 2ofn s THR 21 Ca -0.11 -0.01 -0.20 0.00 0.31 0.00 0.00 61.69 61.68 2ofn s THR 21 Cb -0.06 -3.15 0.01 0.00 0.01 0.00 0.00 72.50 69.31 2ofn s THR 21 CO 0.00 0.54 0.59 -0.51 -0.69 0.00 0.00 174.62 174.55 2ofn s ILE 22 N -0.34 4.92 -0.24 1.82 1.10 -0.92 -1.51 121.20 126.03 2ofn s ILE 22 Ca 0.09 0.30 -0.16 0.00 -0.51 0.00 0.00 60.65 60.37 2ofn s ILE 22 Cb -0.12 -4.08 -0.11 0.00 0.15 0.00 0.00 42.46 38.30 2ofn s ILE 22 CO 0.02 -0.38 -0.24 0.18 -2.11 0.00 0.00 174.94 172.40 2ofn n LEU 23 N 5.99 1.93 -4.51 8.50 7.99 -1.24 -4.18 117.00 131.47 2ofn n LEU 23 Ca -0.03 0.37 -0.28 0.00 -0.01 0.00 0.00 56.01 56.06 2ofn n LEU 23 Cb 0.48 -0.83 -0.11 0.00 -0.11 0.00 0.00 43.42 42.85 2ofn n LEU 23 CO 0.49 0.27 -0.47 -0.54 -1.51 0.00 0.00 177.39 175.63 2ofn s LYS 24 N -2.55 1.86 -0.27 3.23 1.02 -1.08 -5.06 119.74 116.89 2ofn s LYS 24 Ca -0.33 -1.24 0.00 0.00 0.02 0.00 0.00 55.97 54.41 2ofn s LYS 24 Cb 0.10 -2.11 0.05 0.00 -0.52 0.00 0.00 37.83 35.36 2ofn s LYS 24 CO 0.48 0.46 -0.06 0.15 -0.92 0.00 0.00 175.35 175.46 2ofn s LYS 25 N -2.44 2.43 1.01 1.68 1.02 -1.26 -4.50 119.74 117.68 2ofn s LYS 25 Ca 0.21 -1.25 -0.11 0.00 0.02 0.00 0.00 55.97 54.84 2ofn s LYS 25 Cb -0.10 -3.03 0.18 0.00 -0.52 0.00 0.00 37.83 34.37 2ofn s LYS 25 CO 0.12 -0.56 0.98 0.41 -0.92 0.00 0.00 175.35 175.38 2ofn n GLY 26 N 4.56 -1.14 0.00 -3.33 0.00 -1.26 -5.05 105.19 98.97 2ofn n GLY 26 Ca -0.14 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2ofn n GLY 26 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ofn n ASP 27 N -4.08 0.00 -4.69 1.61 2.03 -1.26 -5.02 116.55 105.15 2ofn n ASP 27 Ca 0.08 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.96 2ofn n ASP 27 Cb 0.53 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.90 2ofn n ASP 27 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2ofn n GLU 28 N 0.00 2.74 -2.69 -0.67 2.13 -1.26 -4.85 120.64 116.04 2ofn n GLU 28 Ca 0.00 1.00 -0.06 0.00 0.66 0.00 0.00 57.16 58.76 2ofn n GLU 28 Cb 0.00 -2.89 0.07 0.00 0.27 0.00 0.00 31.44 28.90 2ofn n GLU 28 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ofn n GLY 29 N 4.21 0.32 0.30 8.31 0.00 -1.26 -4.99 105.19 112.08 2ofn n GLY 29 Ca 0.18 0.03 0.03 0.00 0.00 0.00 0.00 46.02 46.26 2ofn n GLY 29 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2ofn h GLU 30 N 1.90 0.50 -0.63 1.61 4.81 -2.05 -0.88 114.58 119.85 2ofn h GLU 30 Ca -0.35 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 2ofn h GLU 30 Cb 1.25 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2ofn h GLU 30 CO -0.08 0.38 0.00 -1.91 -0.73 0.00 0.00 179.01 176.67 2ofn n GLU 31 N -4.43 4.30 -3.61 1.92 2.13 -1.26 -4.57 120.64 115.11 2ofn n GLU 31 Ca 0.02 -2.86 -0.27 0.00 0.66 0.00 0.00 57.16 54.71 2ofn n GLU 31 Cb 0.10 -2.10 -0.10 0.00 0.27 0.00 0.00 31.44 29.61 2ofn n GLU 31 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2ofn n ASN 32 N 0.74 2.14 -3.91 4.31 5.03 -0.33 -4.96 115.26 118.28 2ofn n ASN 32 Ca 0.25 -3.03 -0.27 0.00 0.87 0.00 0.00 54.58 52.40 2ofn n ASN 32 Cb 1.04 -0.68 -0.17 0.00 -1.02 0.00 0.00 39.78 38.95 2ofn n ASN 32 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2ofn s ILE 33 N -1.34 1.07 -0.65 2.41 -1.09 -1.26 -4.56 121.20 115.77 2ofn s ILE 33 Ca 0.31 -0.32 -0.23 0.00 -2.23 0.00 0.00 60.65 58.18 2ofn s ILE 33 Cb 0.04 -1.08 0.06 0.00 -1.58 0.00 0.00 42.46 39.90 2ofn s ILE 33 CO -0.13 0.37 0.99 -2.16 -1.23 0.00 0.00 174.94 172.78 2ofn s PRO 34 N 1.69 3.14 0.36 2.79 0.05 -1.26 -4.81 135.00 136.97 2ofn s PRO 34 Ca 0.05 -0.70 0.05 0.00 0.05 0.00 0.00 61.00 60.45 2ofn s PRO 34 Cb -0.13 -4.20 -0.03 0.00 0.05 0.00 0.00 34.50 30.20 2ofn s PRO 34 CO -0.08 -1.81 0.21 0.15 0.05 0.00 0.00 177.00 175.52 2ofn s LYS 35 N 4.22 1.81 0.37 4.56 -0.14 -1.26 -4.15 119.74 125.14 2ofn s LYS 35 Ca 0.24 -2.07 -0.28 0.00 -1.36 0.00 0.00 55.97 52.50 2ofn s LYS 35 Cb -0.15 -0.05 -0.11 0.00 -1.68 0.00 0.00 37.83 35.83 2ofn s LYS 35 CO 0.12 -0.57 1.50 0.21 -0.76 0.00 0.00 175.35 175.84 2ofn s LYS 36 N -3.58 4.11 0.00 1.68 2.47 -1.26 -2.64 119.74 120.52 2ofn s LYS 36 Ca 0.34 2.57 0.00 0.00 -1.56 0.00 0.00 55.97 57.32 2ofn s LYS 36 Cb 0.03 -2.97 0.00 0.00 -1.46 0.00 0.00 37.83 33.42 2ofn s LYS 36 CO 0.22 -0.54 0.00 0.41 0.16 0.00 0.00 175.35 175.59 2ofn n GLY 37 N 0.63 1.93 3.65 5.54 0.00 -1.26 -4.98 105.19 110.69 2ofn n GLY 37 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 2ofn n GLY 37 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ofn s ASN 38 N -1.51 4.43 -0.53 1.61 0.01 -1.08 -4.67 114.94 113.19 2ofn s ASN 38 Ca 0.00 -0.77 -0.19 0.00 -0.71 0.00 0.00 52.86 51.19 2ofn s ASN 38 Cb 0.00 -0.72 0.07 0.00 0.41 0.00 0.00 41.25 41.01 2ofn s ASN 38 CO 0.00 -0.10 0.64 -1.61 -1.51 0.00 0.00 177.10 174.52 2ofn s GLU 39 N -3.70 3.09 -0.17 -0.60 2.02 -1.26 -4.79 118.70 113.30 2ofn s GLU 39 Ca 0.33 -1.03 -0.07 0.00 0.02 0.00 0.00 54.97 54.22 2ofn s GLU 39 Cb -0.04 -4.15 -0.04 0.00 0.10 0.00 0.00 34.13 30.00 2ofn s GLU 39 CO 0.20 -1.31 0.08 0.14 0.02 0.00 0.00 175.26 174.39 2ofn s VAL 40 N 2.61 4.95 -0.35 2.63 -7.23 -1.26 -3.08 120.40 118.67 2ofn s VAL 40 Ca 0.14 0.02 -0.07 0.00 -1.81 0.00 0.00 61.98 60.25 2ofn s VAL 40 Cb -0.21 -3.21 0.04 0.00 0.56 0.00 0.00 36.38 33.56 2ofn s VAL 40 CO 0.10 0.49 0.13 -0.89 -0.31 0.00 0.00 175.10 174.62 2ofn s THR 41 N 0.07 3.96 -0.01 5.32 2.01 0.11 -4.18 115.64 122.92 2ofn s THR 41 Ca 0.06 -1.08 0.07 0.00 0.31 0.00 0.00 61.69 61.04 2ofn s THR 41 Cb -0.12 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.13 2ofn s THR 41 CO 0.00 -0.20 -0.21 0.68 -0.69 0.00 0.00 174.62 174.20 2ofn s VAL 42 N 1.43 1.64 -0.08 3.82 -7.23 -1.22 -2.35 120.40 116.43 2ofn s VAL 42 Ca -0.01 -0.92 -0.02 0.00 -1.81 0.00 0.00 61.98 59.22 2ofn s VAL 42 Cb -0.20 -1.37 -0.03 0.00 0.56 0.00 0.00 36.38 35.34 2ofn s VAL 42 CO 0.04 0.44 0.03 -2.28 -0.31 0.00 0.00 175.10 173.02 2ofn s HIS 43 N -0.52 3.24 0.02 2.82 2.46 -0.75 -2.69 115.29 119.87 2ofn s HIS 43 Ca 0.08 0.25 0.07 0.00 0.47 0.00 0.00 55.06 55.93 2ofn s HIS 43 Cb -0.08 -1.80 -0.02 0.00 -0.13 0.00 0.00 32.58 30.54 2ofn s HIS 43 CO -0.01 0.52 -0.22 1.52 -2.47 0.00 0.00 174.74 174.09 2ofn s TYR 44 N -0.95 1.90 -0.16 3.88 1.13 -1.26 -1.47 117.35 120.43 2ofn s TYR 44 Ca 0.15 -0.37 -0.30 0.00 -1.41 0.00 0.00 57.07 55.14 2ofn s TYR 44 Cb -0.11 -1.18 0.12 0.00 -1.10 0.00 0.00 41.96 39.69 2ofn s TYR 44 CO 0.04 0.04 0.94 0.54 -2.51 0.00 0.00 175.55 174.60 2ofn s VAL 45 N -0.67 0.00 0.00 -3.49 0.11 -1.00 -4.83 120.40 110.52 2ofn s VAL 45 Ca 0.08 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.13 2ofn s VAL 45 Cb -0.09 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.76 2ofn s VAL 45 CO 0.01 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.39 2ofn n GLY 46 N 0.97 0.64 3.78 6.54 0.00 -1.26 0.23 105.19 116.08 2ofn n GLY 46 Ca -0.12 0.26 -0.08 0.00 0.00 0.00 0.00 46.02 46.08 2ofn n GLY 46 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ofn s LYS 47 N 4.26 1.80 -0.77 1.61 -2.85 -1.12 -3.71 119.74 118.95 2ofn s LYS 47 Ca 0.00 -1.13 -0.25 0.00 -1.00 0.00 0.00 55.97 53.59 2ofn s LYS 47 Cb 0.00 0.58 0.04 0.00 -2.06 0.00 0.00 37.83 36.39 2ofn s LYS 47 CO 0.00 -0.81 1.24 -1.17 0.10 0.00 0.00 175.35 174.72 2ofn s LEU 48 N -2.97 3.49 0.55 2.77 2.96 0.46 -2.76 118.68 123.18 2ofn s LEU 48 Ca 0.15 -0.75 0.22 0.00 -0.22 0.00 0.00 54.13 53.53 2ofn s LEU 48 Cb -0.05 -2.53 1.52 0.00 0.50 0.00 0.00 46.19 45.64 2ofn s LEU 48 CO 0.08 -1.69 2.19 -0.08 -1.32 0.00 0.00 176.35 175.53 2ofn h GLU 49 N 9.87 0.00 -0.33 1.98 4.81 -1.76 0.41 114.58 129.56 2ofn h GLU 49 Ca -0.19 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2ofn h GLU 49 Cb 1.05 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 2ofn h GLU 49 CO 1.28 0.01 0.31 1.03 -0.73 0.00 0.00 179.01 180.90 2ofn h SER 50 N 0.00 0.00 0.00 1.04 0.87 -1.71 -2.86 113.55 110.89 2ofn h SER 50 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2ofn h SER 50 Cb 0.01 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2ofn h SER 50 CO 0.00 0.00 0.00 1.07 -0.53 0.00 0.00 176.83 177.37 2ofn n THR 51 N -3.99 0.00 -1.09 2.23 5.66 -0.93 -5.00 114.28 111.16 2ofn n THR 51 Ca 0.05 -0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 61.02 2ofn n THR 51 Cb 0.47 1.54 -0.01 0.00 -1.55 0.00 0.00 70.33 70.78 2ofn n THR 51 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2ofn n GLY 52 N -0.00 0.55 3.65 1.09 0.00 0.14 -4.97 105.19 105.65 2ofn n GLY 52 Ca 0.00 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.36 2ofn n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ofn s LYS 53 N -1.48 4.15 0.66 1.61 -0.14 -0.89 -4.84 119.74 118.81 2ofn s LYS 53 Ca 0.00 1.37 -0.11 0.00 -1.36 0.00 0.00 55.97 55.87 2ofn s LYS 53 Cb 0.00 -3.74 -0.01 0.00 -1.68 0.00 0.00 37.83 32.40 2ofn s LYS 53 CO 0.00 -0.80 1.05 0.54 -0.76 0.00 0.00 175.35 175.38 2ofn s VAL 54 N 3.60 4.28 -0.75 3.17 0.11 -1.26 -0.40 120.40 129.14 2ofn s VAL 54 Ca 0.50 0.75 -0.27 0.00 -2.93 0.00 0.00 61.98 60.03 2ofn s VAL 54 Cb -0.17 -3.57 0.03 0.00 -1.53 0.00 0.00 36.38 31.14 2ofn s VAL 54 CO 0.14 -0.95 1.28 -0.36 -3.33 0.00 0.00 175.10 171.87 2ofn s PHE 55 N -3.07 2.31 -0.57 1.54 0.08 -1.24 -4.86 117.98 112.16 2ofn s PHE 55 Ca 0.57 -0.11 0.04 0.00 0.12 0.00 0.00 56.93 57.55 2ofn s PHE 55 Cb -0.13 -4.62 0.15 0.00 -0.57 0.00 0.00 43.02 37.85 2ofn s PHE 55 CO 0.54 -2.06 0.36 0.16 -0.10 0.00 0.00 175.22 174.12 2ofn s ASP 56 N 3.81 4.04 0.30 1.36 -4.77 -1.26 -4.65 116.67 115.49 2ofn s ASP 56 Ca 0.35 -3.29 0.06 0.00 -3.30 0.00 0.00 52.55 46.37 2ofn s ASP 56 Cb -0.08 -1.36 -0.02 0.00 -1.09 0.00 0.00 42.92 40.37 2ofn s ASP 56 CO 0.13 -0.17 0.20 -1.20 0.70 0.00 0.00 175.17 174.83 2ofn n SER 57 N 2.70 -0.01 -0.11 2.11 7.64 -1.26 -5.03 113.62 119.65 2ofn n SER 57 Ca 0.15 -2.84 -0.11 0.00 1.01 0.00 0.00 58.87 57.07 2ofn n SER 57 Cb 0.36 1.23 -0.03 0.00 -1.01 0.00 0.00 64.21 64.76 2ofn n SER 57 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2ofn h SER 58 N 1.61 0.61 0.07 6.43 4.64 -1.99 -3.04 113.55 121.88 2ofn h SER 58 Ca -0.22 -0.36 -0.00 0.00 -0.47 0.00 0.00 61.79 60.73 2ofn h SER 58 Cb 1.02 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2ofn h SER 58 CO 0.33 0.83 -0.03 -0.26 -0.87 0.00 0.00 176.83 176.83 2ofn h PHE 59 N 0.39 -0.09 -0.89 4.77 0.04 -1.97 -3.03 116.94 116.16 2ofn h PHE 59 Ca 0.08 -0.00 0.24 0.00 2.80 0.00 0.00 57.97 61.09 2ofn h PHE 59 Cb 0.56 0.03 -0.14 0.00 2.20 0.00 0.00 35.95 38.60 2ofn h PHE 59 CO 0.05 0.42 0.29 -0.44 -0.60 0.00 0.00 178.31 178.03 2ofn h ASP 60 N -0.66 0.10 0.33 2.17 5.19 -1.88 -0.57 116.42 121.11 2ofn h ASP 60 Ca -0.01 0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.59 2ofn h ASP 60 Cb 0.55 0.23 0.00 0.00 0.18 0.00 0.00 39.33 40.29 2ofn h ASP 60 CO 0.02 -0.13 -0.86 -2.11 -3.12 0.00 0.00 179.24 173.04 2ofn n ARG 61 N -5.18 0.12 -0.05 3.56 1.85 -1.15 -4.61 116.66 111.20 2ofn n ARG 61 Ca 0.22 -0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 57.01 2ofn n ARG 61 Cb 0.70 -1.54 -0.02 0.00 -1.05 0.00 0.00 32.46 30.56 2ofn n ARG 61 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 2ofn n ASN 62 N -1.69 1.44 -4.67 2.89 5.15 -0.34 -4.98 115.26 113.07 2ofn n ASN 62 Ca 0.04 0.24 -0.41 0.00 -0.60 0.00 0.00 54.58 53.84 2ofn n ASN 62 Cb 0.38 -0.61 -0.05 0.00 -0.53 0.00 0.00 39.78 38.97 2ofn n ASN 62 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2ofn s VAL 63 N -2.40 4.94 -0.58 3.44 -7.23 -0.52 -5.01 120.40 113.03 2ofn s VAL 63 Ca -0.19 1.48 -0.23 0.00 -1.81 0.00 0.00 61.98 61.23 2ofn s VAL 63 Cb 0.03 -4.07 0.05 0.00 0.56 0.00 0.00 36.38 32.95 2ofn s VAL 63 CO 0.28 0.07 0.93 -2.16 -0.31 0.00 0.00 175.10 173.91 2ofn s PRO 64 N 1.97 3.25 0.14 4.82 0.05 -1.26 -4.82 135.00 139.15 2ofn s PRO 64 Ca 0.35 -0.47 -0.06 0.00 0.05 0.00 0.00 61.00 60.87 2ofn s PRO 64 Cb -0.16 -4.11 -0.06 0.00 0.05 0.00 0.00 34.50 30.22 2ofn s PRO 64 CO 0.12 -1.58 0.40 0.12 0.05 0.00 0.00 177.00 176.11 2ofn s PHE 65 N 3.93 3.49 0.14 0.56 5.36 -1.26 -5.10 117.98 125.10 2ofn s PHE 65 Ca 0.27 0.63 -0.02 0.00 -0.96 0.00 0.00 56.93 56.84 2ofn s PHE 65 Cb -0.14 -2.06 -0.03 0.00 -0.34 0.00 0.00 43.02 40.45 2ofn s PHE 65 CO 0.16 0.43 0.11 -1.59 -1.46 0.00 0.00 175.22 172.87 2ofn s LYS 66 N -2.55 1.00 0.25 10.12 0.00 -1.26 -3.99 119.74 123.32 2ofn s LYS 66 Ca 0.40 -1.41 -0.02 0.00 0.00 0.00 0.00 55.97 54.94 2ofn s LYS 66 Cb -0.12 0.27 0.01 0.00 0.00 0.00 0.00 37.83 37.99 2ofn s LYS 66 CO 0.23 -0.31 0.37 1.97 0.00 0.00 0.00 175.35 177.62 2ofn n PHE 67 N -0.14 -1.25 -4.40 1.78 -1.74 -1.09 -4.99 117.46 105.64 2ofn n PHE 67 Ca -0.05 -1.64 -0.29 0.00 -0.56 0.00 0.00 57.45 54.91 2ofn n PHE 67 Cb 0.64 0.42 -0.13 0.00 1.52 0.00 0.00 39.48 41.93 2ofn n PHE 67 CO 0.00 0.00 0.00 -1.01 -0.56 0.00 0.00 176.76 175.19 2ofn s HIS 68 N -3.59 2.31 0.22 2.97 3.76 -1.26 -3.39 115.29 116.31 2ofn s HIS 68 Ca 0.20 -0.38 -0.30 0.00 -0.15 0.00 0.00 55.06 54.43 2ofn s HIS 68 Cb -0.01 -1.22 -0.09 0.00 1.11 0.00 0.00 32.58 32.36 2ofn s HIS 68 CO 0.14 0.37 1.33 -1.17 -0.85 0.00 0.00 174.74 174.56 2ofn s LEU 69 N -2.19 4.41 -1.23 0.89 2.96 -1.26 -2.43 118.68 119.82 2ofn s LEU 69 Ca 0.15 2.46 -0.02 0.00 -0.22 0.00 0.00 54.13 56.51 2ofn s LEU 69 Cb -0.10 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 42.99 2ofn s LEU 69 CO 0.07 -0.55 0.12 -0.62 -1.32 0.00 0.00 176.35 174.05 2ofn n GLU 70 N 2.43 -2.54 0.06 1.98 1.02 -1.26 -4.83 120.64 117.49 2ofn n GLU 70 Ca 0.06 0.66 0.09 0.00 -0.02 0.00 0.00 57.16 57.95 2ofn n GLU 70 Cb 0.42 -5.31 0.38 0.00 -0.02 0.00 0.00 31.44 26.92 2ofn n GLU 70 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 2ofn n GLN 71 N -3.07 0.08 0.00 3.49 7.27 -1.02 -4.84 117.38 119.29 2ofn n GLN 71 Ca -0.14 0.33 0.00 0.00 0.07 0.00 0.00 57.00 57.26 2ofn n GLN 71 Cb 0.61 -1.66 0.00 0.00 2.41 0.00 0.00 30.24 31.60 2ofn n GLN 71 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2ofn n GLY 72 N -0.05 1.56 0.77 1.69 0.00 -1.26 -4.88 105.19 103.01 2ofn n GLY 72 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.14 2ofn n GLY 72 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ofn n GLU 73 N -1.65 1.66 -4.07 1.61 -0.58 -1.26 -4.90 120.64 111.45 2ofn n GLU 73 Ca 0.00 -1.64 -0.23 0.00 -0.42 0.00 0.00 57.16 54.86 2ofn n GLU 73 Cb 0.00 -1.37 -0.17 0.00 -0.57 0.00 0.00 31.44 29.33 2ofn n GLU 73 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2ofn s VAL 74 N -1.59 0.74 -0.15 2.62 -7.23 -1.26 -5.00 120.40 108.52 2ofn s VAL 74 Ca 0.22 -0.17 -0.14 0.00 -1.81 0.00 0.00 61.98 60.08 2ofn s VAL 74 Cb 0.16 -0.77 -0.05 0.00 0.56 0.00 0.00 36.38 36.28 2ofn s VAL 74 CO 0.24 0.30 -0.26 2.30 -0.31 0.00 0.00 175.10 177.36 2ofn n ILE 75 N 4.52 1.36 0.00 -0.62 -0.00 -1.26 -4.54 119.36 118.82 2ofn n ILE 75 Ca -0.17 0.19 0.00 0.00 -0.00 0.00 0.00 62.75 62.78 2ofn n ILE 75 Cb 0.51 -2.30 0.00 0.00 -0.00 0.00 0.00 39.64 37.84 2ofn n ILE 75 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 2ofn n LYS 76 N -4.36 0.00 -0.05 6.28 4.76 -1.26 -4.66 118.16 118.87 2ofn n LYS 76 Ca -0.11 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.25 2ofn n LYS 76 Cb 0.39 -0.32 -0.02 0.00 -1.84 0.00 0.00 35.03 33.25 2ofn n LYS 76 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 2ofn h GLY 77 N 0.00 -0.07 1.75 0.72 0.00 -1.76 -1.98 103.07 101.73 2ofn h GLY 77 Ca 0.00 0.24 -0.21 0.00 0.00 0.00 0.00 47.33 47.37 2ofn h GLY 77 CO 0.00 -0.18 -0.91 1.49 0.00 0.00 0.00 176.54 176.93 2ofn h TRP 78 N -0.20 0.33 -0.17 5.60 6.55 -1.91 -3.35 115.95 122.79 2ofn h TRP 78 Ca 0.13 -0.19 0.05 0.00 0.95 0.00 0.00 58.89 59.84 2ofn h TRP 78 Cb 0.40 -0.03 -0.06 0.00 -0.86 0.00 0.00 29.16 28.61 2ofn h TRP 78 CO -0.36 1.02 -0.24 0.22 -1.05 0.00 0.00 178.44 178.03 2ofn h ASP 79 N 0.11 -0.75 0.12 -3.49 3.58 -1.64 0.52 116.42 114.88 2ofn h ASP 79 Ca -0.05 0.13 -0.10 0.00 0.42 0.00 0.00 57.03 57.42 2ofn h ASP 79 Cb 1.56 0.34 -0.01 0.00 1.72 0.00 0.00 39.33 42.94 2ofn h ASP 79 CO 0.14 -0.28 -0.34 0.40 -2.88 0.00 0.00 179.24 176.27 2ofn h ILE 80 N -0.28 1.28 0.02 2.25 5.03 -1.63 -1.60 117.51 122.59 2ofn h ILE 80 Ca 0.11 -1.39 -0.27 0.00 -0.12 0.00 0.00 64.86 63.20 2ofn h ILE 80 Cb 0.45 1.55 0.02 0.00 -3.03 0.00 0.00 36.82 35.81 2ofn h ILE 80 CO -0.34 0.42 -1.07 0.00 -0.68 0.00 0.00 178.15 176.49 2ofn h VAL 82 N 0.36 1.51 -0.86 0.00 -1.51 -0.86 -3.25 116.25 111.64 2ofn h VAL 82 Ca -0.13 -3.16 -0.01 0.00 -1.23 0.00 0.00 66.70 62.16 2ofn h VAL 82 Cb 1.72 2.86 -0.04 0.00 -2.13 0.00 0.00 31.29 33.70 2ofn h VAL 82 CO 0.21 0.90 0.50 0.28 -1.23 0.00 0.00 177.57 178.22 2ofn h SER 83 N 0.04 1.06 -2.52 4.19 0.02 -1.39 -2.94 113.55 112.01 2ofn h SER 83 Ca -0.10 -0.08 -0.79 0.00 -0.84 0.00 0.00 61.79 59.97 2ofn h SER 83 Cb 1.90 -0.27 -0.28 0.00 0.14 0.00 0.00 62.40 63.89 2ofn h SER 83 CO 0.16 0.84 0.82 -1.20 -1.14 0.00 0.00 176.83 176.31 2ofn n SER 84 N -4.39 6.77 -4.63 3.07 7.64 -1.18 -4.54 113.62 116.37 2ofn n SER 84 Ca 0.09 -3.57 -0.29 0.00 1.01 0.00 0.00 58.87 56.11 2ofn n SER 84 Cb 0.08 -1.17 -0.10 0.00 -1.01 0.00 0.00 64.21 62.01 2ofn n SER 84 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2ofn s MET 85 N -3.63 2.00 0.11 1.43 -1.94 -1.11 -4.91 119.30 111.24 2ofn s MET 85 Ca 0.36 -2.18 -0.04 0.00 -1.71 0.00 0.00 55.69 52.12 2ofn s MET 85 Cb 0.14 -1.52 -0.03 0.00 2.01 0.00 0.00 34.83 35.43 2ofn s MET 85 CO -0.03 -0.16 0.11 1.03 -0.01 0.00 0.00 175.02 175.96 2ofn s ARG 86 N -3.77 0.87 0.53 2.03 0.52 -1.26 -4.35 118.95 113.53 2ofn s ARG 86 Ca 0.27 -1.23 0.23 0.00 -0.52 0.00 0.00 55.73 54.48 2ofn s ARG 86 Cb 0.07 0.28 1.39 0.00 0.52 0.00 0.00 34.95 37.22 2ofn s ARG 86 CO 0.14 -0.26 2.04 -0.22 0.02 0.00 0.00 175.30 177.02 2ofn h LYS 87 N 2.85 0.00 -0.03 3.54 3.11 -1.84 -0.66 116.57 123.54 2ofn h LYS 87 Ca -0.34 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.50 2ofn h LYS 87 Cb 1.19 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.42 2ofn h LYS 87 CO 0.58 0.00 0.00 0.09 -2.81 0.00 0.00 179.45 177.31 2ofn n ASN 88 N -4.36 2.45 -4.82 4.20 3.02 -1.26 -4.76 115.26 109.73 2ofn n ASN 88 Ca 0.06 -2.88 -0.24 0.00 -0.03 0.00 0.00 54.58 51.50 2ofn n ASN 88 Cb 0.46 -0.36 -0.05 0.00 -0.61 0.00 0.00 39.78 39.22 2ofn n ASN 88 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2ofn s GLU 89 N -2.52 2.95 -0.19 3.52 2.12 -0.26 -4.82 118.70 119.50 2ofn s GLU 89 Ca 0.27 -0.96 -0.08 0.00 0.36 0.00 0.00 54.97 54.56 2ofn s GLU 89 Cb 0.24 -2.62 0.08 0.00 0.26 0.00 0.00 34.13 32.09 2ofn s GLU 89 CO 0.03 0.44 0.43 0.21 -0.54 0.00 0.00 175.26 175.83 2ofn s LYS 90 N -3.57 0.36 0.18 4.30 2.36 -1.26 -4.43 119.74 117.69 2ofn s LYS 90 Ca 0.32 0.96 0.06 0.00 -2.55 0.00 0.00 55.97 54.75 2ofn s LYS 90 Cb -0.09 0.20 -0.05 0.00 -1.05 0.00 0.00 37.83 36.85 2ofn s LYS 90 CO 0.25 -0.21 -0.11 0.00 1.55 0.00 0.00 175.35 176.83 2ofn s LEU 92 N -3.24 3.92 -0.13 0.00 2.01 -0.57 -3.45 118.68 117.21 2ofn s LEU 92 Ca 0.20 -0.27 -0.07 0.00 0.01 0.00 0.00 54.13 54.00 2ofn s LEU 92 Cb 0.02 -2.03 -0.04 0.00 0.01 0.00 0.00 46.19 44.15 2ofn s LEU 92 CO 0.04 -0.11 0.13 0.54 1.01 0.00 0.00 176.35 177.96 2ofn s VAL 93 N 1.67 5.38 -0.34 -1.59 0.11 -0.90 0.34 120.40 125.08 2ofn s VAL 93 Ca 0.06 0.17 -0.08 0.00 -2.93 0.00 0.00 61.98 59.19 2ofn s VAL 93 Cb -0.16 -3.36 0.03 0.00 -1.53 0.00 0.00 36.38 31.36 2ofn s VAL 93 CO 0.07 0.59 0.13 -0.13 -3.33 0.00 0.00 175.10 172.43 2ofn s ARG 94 N -0.77 2.83 -0.41 1.54 1.81 0.05 -1.70 118.95 122.31 2ofn s ARG 94 Ca 0.13 -1.05 -0.11 0.00 -1.72 0.00 0.00 55.73 52.98 2ofn s ARG 94 Cb -0.12 -3.53 0.06 0.00 -0.45 0.00 0.00 34.95 30.91 2ofn s ARG 94 CO 0.03 -0.61 0.27 0.42 -0.68 0.00 0.00 175.30 174.72 2ofn s ILE 95 N 1.48 4.59 0.86 1.52 1.09 0.11 -4.30 121.20 126.55 2ofn s ILE 95 Ca 0.01 -1.10 -0.11 0.00 -1.10 0.00 0.00 60.65 58.35 2ofn s ILE 95 Cb -0.19 -3.69 0.15 0.00 -1.06 0.00 0.00 42.46 37.67 2ofn s ILE 95 CO 0.04 -0.41 1.19 -0.70 -0.10 0.00 0.00 174.94 174.96 2ofn s GLU 96 N 1.53 1.23 0.50 2.79 2.12 -1.26 -0.86 118.70 124.73 2ofn s GLU 96 Ca 0.03 -0.50 0.16 0.00 0.36 0.00 0.00 54.97 55.02 2ofn s GLU 96 Cb -0.22 -2.01 1.21 0.00 0.26 0.00 0.00 34.13 33.37 2ofn s GLU 96 CO 0.05 -1.95 2.09 0.77 -0.54 0.00 0.00 175.26 175.68 2ofn h SER 97 N -1.18 0.11 0.84 -1.70 0.02 -1.80 0.05 113.55 109.89 2ofn h SER 97 Ca -0.43 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2ofn h SER 97 Cb 1.26 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.78 2ofn h SER 97 CO 0.44 0.08 0.00 1.15 -1.14 0.00 0.00 176.83 177.36 2ofn n MET 98 N -4.49 0.06 0.00 3.45 0.00 -1.26 -2.83 117.12 112.05 2ofn n MET 98 Ca 0.02 0.04 0.06 0.00 0.00 0.00 0.00 57.70 57.82 2ofn n MET 98 Cb 0.21 -1.50 0.04 0.00 0.00 0.00 0.00 33.22 31.97 2ofn n MET 98 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2ofn n TYR 99 N -1.46 0.00 -3.42 3.17 4.01 -0.03 -4.93 117.16 114.50 2ofn n TYR 99 Ca 0.07 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.60 2ofn n TYR 99 Cb 0.29 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.34 2ofn n TYR 99 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2ofn s GLY 100 N -1.13 2.04 -0.16 2.72 0.00 -1.00 -2.01 107.32 107.79 2ofn s GLY 100 Ca 0.14 -1.76 0.01 0.00 0.00 0.00 0.00 44.72 43.11 2ofn s GLY 100 CO 0.18 -1.75 1.46 -1.72 0.00 0.00 0.00 173.10 171.26 2ofn n TYR 101 N -1.91 1.02 0.18 1.90 4.01 -1.26 -4.15 117.16 116.94 2ofn n TYR 101 Ca 0.07 -1.10 0.04 0.00 -0.16 0.00 0.00 57.90 56.75 2ofn n TYR 101 Cb 0.62 -0.55 0.31 0.00 -0.31 0.00 0.00 39.34 39.41 2ofn n TYR 101 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2ofn h GLY 102 N 2.94 0.00 0.85 2.72 0.00 -1.79 0.90 103.07 108.69 2ofn h GLY 102 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.53 2ofn h GLY 102 CO 0.40 0.00 -0.25 -1.80 0.00 0.00 0.00 176.54 174.89 2ofn h ASP 103 N 0.00 -0.64 -0.51 0.19 3.58 -1.86 -2.86 116.42 114.33 2ofn h ASP 103 Ca -0.00 0.04 -0.06 0.00 0.42 0.00 0.00 57.03 57.43 2ofn h ASP 103 Cb 0.92 0.20 -0.02 0.00 1.72 0.00 0.00 39.33 42.15 2ofn h ASP 103 CO 0.05 -0.39 0.10 -0.08 -2.88 0.00 0.00 179.24 176.04 2ofn h GLU 104 N -0.61 0.84 0.00 0.28 4.57 -1.88 -3.47 114.58 114.31 2ofn h GLU 104 Ca -0.04 -0.22 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 2ofn h GLU 104 Cb 0.51 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 2ofn h GLU 104 CO 0.02 0.82 0.00 0.41 -1.18 0.00 0.00 179.01 179.08 2ofn n GLY 105 N -0.56 1.49 3.64 1.92 0.00 0.19 -5.09 105.19 106.78 2ofn n GLY 105 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2ofn n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ofn s GLY 107 N 1.36 1.73 0.00 0.00 0.00 -1.26 -4.53 107.32 104.62 2ofn s GLY 107 Ca 0.23 -1.17 0.00 0.00 0.00 0.00 0.00 44.72 43.78 2ofn s GLY 107 CO 0.09 0.52 0.00 -2.21 0.00 0.00 0.00 173.10 171.50 2ofn n GLU 108 N 4.89 0.00 0.00 2.90 0.00 -1.26 -4.98 120.64 122.19 2ofn n GLU 108 Ca -0.16 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.01 2ofn n GLU 108 Cb 0.51 -0.45 0.00 0.00 0.00 0.00 0.00 31.44 31.50 2ofn n GLU 108 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 2ofn n SER 109 N -2.33 0.00 -2.85 4.31 7.64 -1.26 -4.98 113.62 114.16 2ofn n SER 109 Ca 0.00 0.05 -0.10 0.00 1.01 0.00 0.00 58.87 59.82 2ofn n SER 109 Cb 0.00 -0.22 0.02 0.00 -1.01 0.00 0.00 64.21 63.00 2ofn n SER 109 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2ofn n ILE 110 N -1.77 -0.16 -3.15 0.44 -0.00 -1.26 -5.10 119.36 108.35 2ofn n ILE 110 Ca 0.00 -1.84 -0.44 0.00 -0.00 0.00 0.00 62.75 60.47 2ofn n ILE 110 Cb 0.00 0.74 -0.05 0.00 -0.00 0.00 0.00 39.64 40.32 2ofn n ILE 110 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2ofn s PRO 111 N 0.44 3.08 -0.53 6.28 0.05 -1.26 -4.90 135.00 138.16 2ofn s PRO 111 Ca 0.32 -1.13 0.06 0.00 0.05 0.00 0.00 61.00 60.30 2ofn s PRO 111 Cb 0.16 -4.18 0.22 0.00 0.05 0.00 0.00 34.50 30.75 2ofn s PRO 111 CO -0.18 -1.37 0.56 0.41 0.05 0.00 0.00 177.00 176.47 2ofn n GLY 112 N 5.23 3.56 2.74 0.56 0.00 -1.26 -4.86 105.19 111.16 2ofn n GLY 112 Ca -0.08 -2.08 -0.08 0.00 0.00 0.00 0.00 46.02 43.77 2ofn n GLY 112 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ofn n ASN 113 N 1.55 -1.85 -4.19 1.61 6.94 -1.26 -4.91 115.26 113.16 2ofn n ASN 113 Ca 0.25 0.21 -0.17 0.00 -0.02 0.00 0.00 54.58 54.86 2ofn n ASN 113 Cb 0.45 -1.67 0.03 0.00 -2.36 0.00 0.00 39.78 36.24 2ofn n ASN 113 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2ofn n SER 114 N -1.71 1.91 -4.38 0.53 3.41 -1.26 -4.73 113.62 107.40 2ofn n SER 114 Ca -0.02 -2.28 -0.32 0.00 -0.26 0.00 0.00 58.87 55.99 2ofn n SER 114 Cb 0.52 -0.20 -0.15 0.00 -0.26 0.00 0.00 64.21 64.13 2ofn n SER 114 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2ofn s VAL 115 N -1.87 2.60 0.18 -3.33 0.11 -1.26 -2.68 120.40 114.15 2ofn s VAL 115 Ca 0.36 -0.88 0.09 0.00 -2.93 0.00 0.00 61.98 58.62 2ofn s VAL 115 Cb -0.03 -1.99 -0.04 0.00 -1.53 0.00 0.00 36.38 32.79 2ofn s VAL 115 CO 0.23 0.58 -0.18 -0.76 -3.33 0.00 0.00 175.10 171.64 2ofn s LEU 116 N -0.44 2.47 -0.14 2.54 1.43 -0.04 -1.90 118.68 122.60 2ofn s LEU 116 Ca 0.05 -0.90 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 2ofn s LEU 116 Cb -0.12 -0.85 0.02 0.00 0.03 0.00 0.00 46.19 45.28 2ofn s LEU 116 CO 0.02 -0.04 -0.13 -1.48 0.23 0.00 0.00 176.35 174.95 2ofn s LEU 117 N -2.85 1.61 -0.06 1.79 0.05 -1.11 0.05 118.68 118.15 2ofn s LEU 117 Ca 0.18 -0.47 0.03 0.00 0.05 0.00 0.00 54.13 53.92 2ofn s LEU 117 Cb -0.05 -1.11 -0.02 0.00 -2.05 0.00 0.00 46.19 42.96 2ofn s LEU 117 CO 0.08 -0.07 -0.15 -0.36 -0.55 0.00 0.00 176.35 175.29 2ofn s PHE 118 N 1.53 2.70 -0.33 3.48 0.08 -0.69 -2.79 117.98 121.97 2ofn s PHE 118 Ca 0.05 -0.28 -0.22 0.00 0.12 0.00 0.00 56.93 56.60 2ofn s PHE 118 Cb -0.13 -1.66 -0.00 0.00 -0.57 0.00 0.00 43.02 40.66 2ofn s PHE 118 CO -0.10 0.09 0.69 -1.21 -0.10 0.00 0.00 175.22 174.59 2ofn s GLU 119 N -0.50 3.83 -0.18 0.44 2.02 0.13 -2.11 118.70 122.32 2ofn s GLU 119 Ca 0.07 0.30 -0.06 0.00 0.02 0.00 0.00 54.97 55.30 2ofn s GLU 119 Cb -0.12 -3.76 -0.03 0.00 0.10 0.00 0.00 34.13 30.32 2ofn s GLU 119 CO 0.02 -0.69 0.02 0.42 0.02 0.00 0.00 175.26 175.04 2ofn s ILE 120 N 2.80 4.26 -0.14 -1.63 1.01 -1.22 -2.38 121.20 123.90 2ofn s ILE 120 Ca 0.28 -0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.73 2ofn s ILE 120 Cb -0.14 -2.91 0.01 0.00 0.01 0.00 0.00 42.46 39.42 2ofn s ILE 120 CO 0.14 0.45 -0.21 -0.70 0.00 0.00 0.00 174.94 174.62 2ofn s GLU 121 N 0.63 3.06 -0.91 2.79 -6.30 -0.54 -4.12 118.70 113.30 2ofn s GLU 121 Ca 0.00 -0.84 -0.18 0.00 -2.50 0.00 0.00 54.97 51.46 2ofn s GLU 121 Cb -0.14 -2.45 0.15 0.00 0.00 0.00 0.00 34.13 31.69 2ofn s GLU 121 CO 0.02 0.02 1.05 -1.17 0.02 0.00 0.00 175.26 175.20 2ofn s LEU 122 N 0.75 5.44 0.07 2.70 2.96 -1.26 -1.82 118.68 127.52 2ofn s LEU 122 Ca -0.08 -2.21 -0.09 0.00 -0.22 0.00 0.00 54.13 51.53 2ofn s LEU 122 Cb -0.16 -2.36 -0.26 0.00 0.50 0.00 0.00 46.19 43.91 2ofn s LEU 122 CO -0.00 -0.95 1.14 0.17 -1.32 0.00 0.00 176.35 175.39 2ofn h LEU 123 N 9.80 0.62 -7.67 -0.68 -0.00 -1.76 -3.44 115.31 112.18 2ofn h LEU 123 Ca 0.15 -0.61 -0.13 0.00 -0.00 0.00 0.00 57.88 57.29 2ofn h LEU 123 Cb 1.03 -0.20 -0.19 0.00 -0.00 0.00 0.00 40.66 41.29 2ofn h LEU 123 CO 1.03 1.45 -0.40 -0.44 -0.00 0.00 0.00 178.44 180.09 2ofn s SER 124 N -7.28 -0.04 0.20 0.17 0.01 -1.20 -5.04 113.70 100.51 2ofn s SER 124 Ca -0.06 -0.17 -0.15 0.00 1.31 0.00 0.00 55.95 56.88 2ofn s SER 124 Cb 0.06 0.26 0.06 0.00 0.21 0.00 0.00 66.02 66.61 2ofn s SER 124 CO 0.90 -0.45 0.75 2.22 0.41 0.00 0.00 173.24 177.07 2ofn n PHE 125 N 1.17 -1.46 -3.83 2.43 -1.74 -1.26 0.07 117.46 112.84 2ofn n PHE 125 Ca -0.21 -1.14 -0.06 0.00 -0.56 0.00 0.00 57.45 55.48 2ofn n PHE 125 Cb 0.57 0.56 -0.01 0.00 1.52 0.00 0.00 39.48 42.12 2ofn n PHE 125 CO 0.00 0.00 0.00 -0.98 -0.56 0.00 0.00 176.76 175.22 2ofn s ARG 126 N -2.05 1.69 -0.07 3.97 1.70 -1.18 -4.98 118.95 118.04 2ofn s ARG 126 Ca 0.16 -0.98 -0.01 0.00 -0.47 0.00 0.00 55.73 54.43 2ofn s ARG 126 Cb -0.03 0.54 0.03 0.00 -0.57 0.00 0.00 34.95 34.92 2ofn s ARG 126 CO 0.06 -0.78 -0.01 -1.21 -1.08 0.00 0.00 175.30 172.28 2ofn s GLU 127 N -3.31 0.67 0.27 3.89 2.02 -1.26 -4.47 118.70 116.50 2ofn s GLU 127 Ca 0.13 0.06 0.05 0.00 0.02 0.00 0.00 54.97 55.23 2ofn s GLU 127 Cb -0.04 -0.96 -0.06 0.00 0.10 0.00 0.00 34.13 33.17 2ofn s GLU 127 CO 0.07 -0.26 -0.01 -0.51 0.02 0.00 0.00 175.26 174.56 2ofn s LEU 128 N 1.78 2.29 0.16 1.80 1.43 -1.26 -5.09 118.68 119.78 2ofn s LEU 128 Ca 0.02 -1.25 -0.29 0.00 -1.03 0.00 0.00 54.13 51.58 2ofn s LEU 128 Cb -0.13 -0.42 -0.07 0.00 0.03 0.00 0.00 46.19 45.60 2ofn s LEU 128 CO -0.05 -0.48 0.92 -1.83 0.23 0.00 0.00 176.35 175.15 2ofn s GLU 129 N -3.82 4.73 -0.21 1.70 -1.05 -1.26 -4.84 118.70 113.94 2ofn s GLU 129 Ca 0.31 1.40 -0.04 0.00 -0.15 0.00 0.00 54.97 56.49 2ofn s GLU 129 Cb 0.06 -3.33 -0.01 0.00 -0.44 0.00 0.00 34.13 30.40 2ofn s GLU 129 CO 0.11 0.36 -0.03 -3.38 0.95 0.00 0.00 175.26 173.27 2ofn s HIS 130 N -0.53 2.97 -0.21 4.83 -3.43 -1.26 -5.07 115.29 112.59 2ofn s HIS 130 Ca 0.43 -0.80 -0.06 0.00 -0.80 0.00 0.00 55.06 53.83 2ofn s HIS 130 Cb -0.24 -2.09 -0.03 0.00 -1.43 0.00 0.00 32.58 28.79 2ofn s HIS 130 CO 0.30 -0.46 0.03 -3.38 -2.00 0.00 0.00 174.74 169.23 2ofn s HIS 131 N 1.33 3.08 -0.07 0.38 -3.43 -1.26 -5.08 115.29 110.24 2ofn s HIS 131 Ca 0.04 -0.35 -0.03 0.00 -0.80 0.00 0.00 55.06 53.92 2ofn s HIS 131 Cb -0.14 -2.12 0.04 0.00 -1.43 0.00 0.00 32.58 28.92 2ofn s HIS 131 CO -0.01 -0.20 0.09 -1.58 -2.00 0.00 0.00 174.74 171.03 2ofn s HIS 132 N 1.05 0.02 -0.11 0.38 2.46 -1.26 -5.13 115.29 112.71 2ofn s HIS 132 Ca 0.03 0.26 0.00 0.00 0.47 0.00 0.00 55.06 55.82 2ofn s HIS 132 Cb -0.14 -0.46 0.02 0.00 -0.13 0.00 0.00 32.58 31.87 2ofn s HIS 132 CO 0.02 -0.25 -0.09 -1.58 -2.47 0.00 0.00 174.74 170.38 2ofn s HIS 133 N 2.19 1.49 -0.11 3.88 5.04 -1.26 -5.03 115.29 121.49 2ofn s HIS 133 Ca 0.04 -0.72 -0.09 0.00 -1.54 0.00 0.00 55.06 52.75 2ofn s HIS 133 Cb -0.13 -1.21 -0.03 0.00 0.04 0.00 0.00 32.58 31.25 2ofn s HIS 133 CO -0.04 -0.48 -0.18 1.58 -2.34 0.00 0.00 174.74 173.28 2ofn n HIS 134 N 4.74 0.39 -1.85 3.88 -0.00 -1.26 -5.38 115.22 115.75 2ofn n HIS 134 Ca -0.15 0.17 0.00 0.00 0.46 0.00 0.00 57.72 58.20 2ofn n HIS 134 Cb 0.50 -0.52 0.00 0.00 -0.12 0.00 0.00 29.99 29.86 2ofn n HIS 134 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38