#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ofn n THR 2 N 0.00 0.00 -2.73 1.12 -1.04 -1.26 -4.99 114.28 105.38 2ofn n THR 2 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 2ofn n THR 2 Cb 0.00 -0.56 -0.03 0.00 -1.82 0.00 0.00 70.33 67.92 2ofn n THR 2 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2ofn s THR 3 N -1.97 4.47 0.15 12.58 -4.23 -1.26 -4.67 115.64 120.71 2ofn s THR 3 Ca 0.00 1.23 0.00 0.00 -1.18 0.00 0.00 61.69 61.74 2ofn s THR 3 Cb 0.00 -4.42 0.00 0.00 1.34 0.00 0.00 72.50 69.42 2ofn s THR 3 CO 0.00 -0.67 0.00 1.21 -0.54 0.00 0.00 174.62 174.62 2ofn n GLU 4 N 7.08 -2.58 -3.89 3.99 0.00 -1.26 -5.10 120.64 118.87 2ofn n GLU 4 Ca 0.09 1.95 -0.10 0.00 0.00 0.00 0.00 57.16 59.10 2ofn n GLU 4 Cb 0.48 -2.02 -0.09 0.00 0.00 0.00 0.00 31.44 29.81 2ofn n GLU 4 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 2ofn s GLN 5 N -2.61 0.57 -0.20 5.31 -1.52 -1.26 -5.03 119.66 114.92 2ofn s GLN 5 Ca 0.00 -0.61 -0.02 0.00 -1.95 0.00 0.00 55.36 52.78 2ofn s GLN 5 Cb 0.00 0.23 0.03 0.00 -0.22 0.00 0.00 33.01 33.05 2ofn s GLN 5 CO 0.00 -0.15 2.49 0.39 -0.25 0.00 0.00 175.29 177.77 2ofn n GLU 6 N 0.99 1.76 -2.04 2.91 1.02 -1.26 -4.93 120.64 119.09 2ofn n GLU 6 Ca -0.20 -1.22 -0.29 0.00 -0.02 0.00 0.00 57.16 55.43 2ofn n GLU 6 Cb 0.57 -1.64 0.05 0.00 -0.02 0.00 0.00 31.44 30.40 2ofn n GLU 6 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2ofn s PHE 7 N -0.78 3.26 0.24 -0.32 0.08 -1.26 -5.07 117.98 114.14 2ofn s PHE 7 Ca 0.36 0.89 -0.04 0.00 0.12 0.00 0.00 56.93 58.26 2ofn s PHE 7 Cb 0.23 -3.01 -0.05 0.00 -0.57 0.00 0.00 43.02 39.61 2ofn s PHE 7 CO -0.05 -1.13 0.48 -2.00 -0.10 0.00 0.00 175.22 172.42 2ofn s GLU 8 N -5.27 3.60 0.07 0.44 2.12 -1.26 -5.02 118.70 113.38 2ofn s GLU 8 Ca 0.57 -0.12 0.07 0.00 0.36 0.00 0.00 54.97 55.86 2ofn s GLU 8 Cb -0.11 -2.73 -0.04 0.00 0.26 0.00 0.00 34.13 31.51 2ofn s GLU 8 CO 0.49 0.31 -0.15 0.15 -0.54 0.00 0.00 175.26 175.53 2ofn s LYS 9 N -3.35 2.07 -0.41 4.30 3.01 -1.26 -3.87 119.74 120.22 2ofn s LYS 9 Ca 0.42 -1.01 -0.12 0.00 -1.01 0.00 0.00 55.97 54.24 2ofn s LYS 9 Cb -0.11 -2.24 0.04 0.00 -1.01 0.00 0.00 37.83 34.52 2ofn s LYS 9 CO 0.29 0.52 0.27 0.08 0.51 0.00 0.00 175.35 177.02 2ofn s VAL 10 N -1.06 4.79 -0.17 3.17 1.01 -0.73 -5.02 120.40 122.38 2ofn s VAL 10 Ca 0.17 -0.95 -0.21 0.00 0.00 0.00 0.00 61.98 61.00 2ofn s VAL 10 Cb -0.11 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 2ofn s VAL 10 CO 0.09 -0.37 0.61 -1.83 0.00 0.00 0.00 175.10 173.60 2ofn s GLU 11 N 1.58 4.25 -0.95 2.72 -1.05 -1.26 -3.02 118.70 120.96 2ofn s GLU 11 Ca 0.03 0.61 -0.08 0.00 -0.15 0.00 0.00 54.97 55.38 2ofn s GLU 11 Cb -0.21 -3.54 -0.02 0.00 -0.44 0.00 0.00 34.13 29.92 2ofn s GLU 11 CO 0.07 -0.15 0.78 -0.11 0.95 0.00 0.00 175.26 176.80 2ofn n LEU 12 N 4.71 -4.77 -4.67 1.83 7.94 -1.22 -4.92 117.00 115.91 2ofn n LEU 12 Ca -0.02 -0.63 -0.34 0.00 -1.11 0.00 0.00 56.01 53.92 2ofn n LEU 12 Cb 0.50 -2.82 0.13 0.00 0.53 0.00 0.00 43.42 41.75 2ofn n LEU 12 CO 0.44 -0.15 0.69 1.07 -1.11 0.00 0.00 177.39 178.33 2ofn n THR 13 N -2.97 1.90 0.29 1.96 5.66 -1.17 -4.59 114.28 115.36 2ofn n THR 13 Ca -0.08 -0.21 0.18 0.00 -3.05 0.00 0.00 64.05 60.89 2ofn n THR 13 Cb 0.58 -1.15 0.79 0.00 -1.55 0.00 0.00 70.33 69.00 2ofn n THR 13 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2ofn h ALA 14 N -0.93 1.00 -0.08 1.79 0.00 -1.94 0.21 119.26 119.31 2ofn h ALA 14 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2ofn h ALA 14 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2ofn h ALA 14 CO 0.45 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.45 2ofn n ASP 15 N -3.07 1.62 0.00 0.00 9.92 -1.26 -4.64 116.55 119.12 2ofn n ASP 15 Ca -0.00 -2.12 0.00 0.00 -0.53 0.00 0.00 54.79 52.14 2ofn n ASP 15 Cb 0.26 -0.52 0.00 0.00 -0.64 0.00 0.00 41.12 40.22 2ofn n ASP 15 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ofn n GLY 16 N 0.09 1.78 2.75 0.44 0.00 -1.10 -4.90 105.19 104.23 2ofn n GLY 16 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.37 2.92 -0.02 0.00 0.70 -4.95 105.19 101.47 2ofn n GLY 17 Ca 0.00 0.93 -0.12 0.00 0.00 0.00 0.00 46.02 46.83 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 -2.19 0.00 -0.37 1.61 1.01 -1.26 -4.80 120.40 114.40 2ofn s VAL 18 Ca 0.15 -0.01 -0.19 0.00 0.00 0.00 0.00 61.98 61.94 2ofn s VAL 18 Cb -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 36.38 36.27 2ofn s VAL 18 CO 0.74 -0.00 0.55 -0.63 0.00 0.00 0.00 175.10 175.76 2ofn s ILE 19 N 0.01 4.96 0.01 2.22 -1.09 -1.26 -3.06 121.20 122.98 2ofn s ILE 19 Ca -0.00 0.29 -0.02 0.00 -2.23 0.00 0.00 60.65 58.69 2ofn s ILE 19 Cb -0.00 -4.03 -0.01 0.00 -1.58 0.00 0.00 42.46 36.83 2ofn s ILE 19 CO 0.00 -0.32 0.02 -1.59 -1.23 0.00 0.00 174.94 171.82 2ofn s LYS 20 N 2.51 0.26 -0.08 2.79 -2.85 -1.17 -0.73 119.74 120.47 2ofn s LYS 20 Ca 0.20 -0.36 -0.00 0.00 -1.00 0.00 0.00 55.97 54.80 2ofn s LYS 20 Cb -0.15 0.10 -0.03 0.00 -2.06 0.00 0.00 37.83 35.69 2ofn s LYS 20 CO 0.15 -0.05 -0.05 0.99 0.10 0.00 0.00 175.35 176.48 2ofn s THR 21 N -0.99 3.83 -0.10 3.79 2.01 0.16 -1.78 115.64 122.56 2ofn s THR 21 Ca -0.11 -0.42 -0.17 0.00 0.31 0.00 0.00 61.69 61.30 2ofn s THR 21 Cb -0.07 -2.59 -0.05 0.00 0.01 0.00 0.00 72.50 69.81 2ofn s THR 21 CO -0.00 0.59 0.43 -0.51 -0.69 0.00 0.00 174.62 174.44 2ofn s ILE 22 N -0.67 5.17 -0.05 1.82 1.10 -1.25 -0.29 121.20 127.03 2ofn s ILE 22 Ca 0.10 0.86 -0.03 0.00 -0.51 0.00 0.00 60.65 61.07 2ofn s ILE 22 Cb -0.11 -3.76 -0.02 0.00 0.15 0.00 0.00 42.46 38.71 2ofn s ILE 22 CO 0.02 0.39 -0.08 0.18 -2.11 0.00 0.00 174.94 173.34 2ofn n LEU 23 N 3.23 0.57 -4.20 8.50 7.99 -0.77 -4.71 117.00 127.62 2ofn n LEU 23 Ca -0.09 0.09 -0.29 0.00 -0.01 0.00 0.00 56.01 55.71 2ofn n LEU 23 Cb 0.52 -0.22 -0.16 0.00 -0.11 0.00 0.00 43.42 43.44 2ofn n LEU 23 CO 0.41 0.01 -0.53 -0.75 -1.51 0.00 0.00 177.39 175.01 2ofn s LYS 24 N -2.13 2.20 0.01 3.23 2.20 -1.03 -4.99 119.74 119.23 2ofn s LYS 24 Ca -0.08 -0.76 -0.02 0.00 -0.36 0.00 0.00 55.97 54.74 2ofn s LYS 24 Cb 0.03 -1.87 -0.04 0.00 -1.51 0.00 0.00 37.83 34.44 2ofn s LYS 24 CO 0.11 0.31 0.20 0.21 -0.36 0.00 0.00 175.35 175.82 2ofn s LYS 25 N -0.04 3.46 0.96 4.03 2.20 -1.26 -1.98 119.74 127.10 2ofn s LYS 25 Ca -0.04 -0.32 -0.13 0.00 -0.36 0.00 0.00 55.97 55.11 2ofn s LYS 25 Cb -0.13 -3.07 0.17 0.00 -1.51 0.00 0.00 37.83 33.29 2ofn s LYS 25 CO 0.03 0.65 1.14 0.20 -0.36 0.00 0.00 175.35 177.01 2ofn s GLY 26 N -2.08 1.59 -0.06 5.54 0.00 -1.26 -4.75 107.32 106.30 2ofn s GLY 26 Ca 0.30 -0.59 -0.05 0.00 0.00 0.00 0.00 44.72 44.38 2ofn s GLY 26 CO 0.21 0.03 -0.09 1.22 0.00 0.00 0.00 173.10 174.47 2ofn n ASP 27 N -3.95 0.75 -3.71 1.64 8.00 -1.26 -5.05 116.55 112.96 2ofn n ASP 27 Ca 0.08 0.34 -0.13 0.00 0.71 0.00 0.00 54.79 55.79 2ofn n ASP 27 Cb 0.59 -0.64 -0.07 0.00 -0.02 0.00 0.00 41.12 40.98 2ofn n ASP 27 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2ofn s GLU 28 N -1.57 0.83 0.00 -1.24 2.12 -1.26 -5.13 118.70 112.45 2ofn s GLU 28 Ca -0.07 -0.31 0.00 0.00 0.36 0.00 0.00 54.97 54.95 2ofn s GLU 28 Cb 0.01 0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.77 2ofn s GLU 28 CO 0.11 -0.26 0.00 0.41 -0.54 0.00 0.00 175.26 174.98 2ofn n GLY 29 N 0.78 2.21 0.18 -1.50 0.00 -1.26 -4.90 105.19 100.70 2ofn n GLY 29 Ca -0.19 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 0.58 0.00 1.61 4.81 -2.02 -3.30 114.58 116.26 2ofn h GLU 30 Ca 0.00 -0.54 -0.07 0.00 -0.13 0.00 0.00 59.36 58.61 2ofn h GLU 30 Cb 0.00 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 2ofn h GLU 30 CO 0.00 1.17 -0.46 1.49 -0.73 0.00 0.00 179.01 180.48 2ofn h GLU 31 N 0.20 0.00 -5.07 1.92 4.81 -2.04 -3.37 114.58 111.02 2ofn h GLU 31 Ca -0.07 0.00 -0.66 0.00 -0.13 0.00 0.00 59.36 58.50 2ofn h GLU 31 Cb 1.36 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.69 2ofn h GLU 31 CO 0.14 0.31 2.47 0.09 -0.73 0.00 0.00 179.01 181.29 2ofn n ASN 32 N -3.13 4.27 -3.64 1.04 3.02 -1.24 -4.81 115.26 110.77 2ofn n ASN 32 Ca 0.02 -2.86 -0.14 0.00 -0.03 0.00 0.00 54.58 51.56 2ofn n ASN 32 Cb 0.67 -1.68 -0.13 0.00 -0.61 0.00 0.00 39.78 38.03 2ofn n ASN 32 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2ofn s ILE 33 N 4.40 -0.39 0.11 2.41 -1.09 -1.26 -4.42 121.20 120.96 2ofn s ILE 33 Ca 0.53 0.24 -0.31 0.00 -2.23 0.00 0.00 60.65 58.88 2ofn s ILE 33 Cb 0.08 -0.46 -0.10 0.00 -1.58 0.00 0.00 42.46 40.40 2ofn s ILE 33 CO 0.02 0.08 1.83 -2.16 -1.23 0.00 0.00 174.94 173.49 2ofn s PRO 34 N 2.40 4.14 0.11 2.79 0.04 -1.26 -4.95 135.00 138.27 2ofn s PRO 34 Ca 0.02 2.58 0.09 0.00 0.04 0.00 0.00 61.00 63.73 2ofn s PRO 34 Cb -0.12 -3.65 -0.04 0.00 0.04 0.00 0.00 34.50 30.73 2ofn s PRO 34 CO -0.09 -0.85 -0.18 0.15 0.04 0.00 0.00 177.00 176.07 2ofn s LYS 35 N 2.89 1.80 0.35 4.56 -0.14 -1.26 -4.30 119.74 123.63 2ofn s LYS 35 Ca 0.81 -1.17 -0.26 0.00 -1.36 0.00 0.00 55.97 54.00 2ofn s LYS 35 Cb -0.45 -2.11 -0.09 0.00 -1.68 0.00 0.00 37.83 33.49 2ofn s LYS 35 CO 0.36 0.48 1.01 -1.59 -0.76 0.00 0.00 175.35 174.86 2ofn s LYS 36 N -2.07 4.41 0.00 1.68 0.00 -1.26 -3.08 119.74 119.41 2ofn s LYS 36 Ca 0.17 1.47 0.00 0.00 0.00 0.00 0.00 55.97 57.61 2ofn s LYS 36 Cb -0.11 -2.73 0.00 0.00 0.00 0.00 0.00 37.83 34.99 2ofn s LYS 36 CO 0.10 0.09 0.00 0.41 0.00 0.00 0.00 175.35 175.94 2ofn n GLY 37 N 0.54 3.37 4.01 0.59 0.00 -1.19 -5.03 105.19 107.48 2ofn n GLY 37 Ca 0.03 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.54 5.62 -0.15 1.61 0.01 -1.18 -5.06 114.94 115.25 2ofn s ASN 38 Ca 0.00 -0.38 -0.23 0.00 -0.71 0.00 0.00 52.86 51.54 2ofn s ASN 38 Cb 0.00 -0.69 -0.03 0.00 0.41 0.00 0.00 41.25 40.95 2ofn s ASN 38 CO 0.00 -0.80 0.71 -0.70 -1.51 0.00 0.00 177.10 174.80 2ofn s GLU 39 N -4.39 4.31 0.11 -0.60 2.12 -1.22 -4.46 118.70 114.57 2ofn s GLU 39 Ca 0.55 0.81 0.02 0.00 0.36 0.00 0.00 54.97 56.71 2ofn s GLU 39 Cb -0.10 -3.53 -0.04 0.00 0.26 0.00 0.00 34.13 30.71 2ofn s GLU 39 CO 0.34 -0.16 -0.07 0.14 -0.54 0.00 0.00 175.26 174.96 2ofn s VAL 40 N 1.62 0.77 -0.19 3.70 -7.23 -1.26 -0.92 120.40 116.88 2ofn s VAL 40 Ca 0.34 -1.96 -0.01 0.00 -1.81 0.00 0.00 61.98 58.54 2ofn s VAL 40 Cb -0.17 -1.73 0.05 0.00 0.56 0.00 0.00 36.38 35.10 2ofn s VAL 40 CO 0.13 -0.84 -0.02 -0.89 -0.31 0.00 0.00 175.10 173.18 2ofn s THR 41 N -3.58 0.97 0.16 5.32 2.01 0.91 -4.54 115.64 116.88 2ofn s THR 41 Ca 0.13 -0.74 0.09 0.00 0.31 0.00 0.00 61.69 61.48 2ofn s THR 41 Cb 0.05 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 2ofn s THR 41 CO -0.04 -0.07 -0.21 0.68 -0.69 0.00 0.00 174.62 174.30 2ofn s VAL 42 N 1.67 1.98 -0.12 3.82 -7.23 -1.26 -2.61 120.40 116.65 2ofn s VAL 42 Ca -0.02 -1.85 0.01 0.00 -1.81 0.00 0.00 61.98 58.31 2ofn s VAL 42 Cb -0.17 -1.87 -0.01 0.00 0.56 0.00 0.00 36.38 34.89 2ofn s VAL 42 CO -0.07 -0.17 -0.17 -2.28 -0.31 0.00 0.00 175.10 172.10 2ofn s HIS 43 N -1.66 2.72 0.03 2.82 2.46 -1.08 -4.06 115.29 116.52 2ofn s HIS 43 Ca 0.15 -0.77 0.06 0.00 0.47 0.00 0.00 55.06 54.96 2ofn s HIS 43 Cb -0.08 -1.79 -0.02 0.00 -0.13 0.00 0.00 32.58 30.56 2ofn s HIS 43 CO 0.07 -0.27 -0.17 1.52 -2.47 0.00 0.00 174.74 173.41 2ofn s TYR 44 N 0.32 1.52 -0.03 3.88 1.13 -1.25 -2.46 117.35 120.45 2ofn s TYR 44 Ca -0.13 -0.35 -0.29 0.00 -1.41 0.00 0.00 57.07 54.89 2ofn s TYR 44 Cb -0.17 -0.92 0.11 0.00 -1.10 0.00 0.00 41.96 39.88 2ofn s TYR 44 CO 0.07 0.05 0.92 0.54 -2.51 0.00 0.00 175.55 174.61 2ofn s VAL 45 N -0.74 0.00 0.00 -3.49 0.11 -1.12 -4.79 120.40 110.37 2ofn s VAL 45 Ca 0.05 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.10 2ofn s VAL 45 Cb -0.08 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.77 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 -0.13 -0.56 3.76 6.54 0.00 -1.25 0.52 105.19 114.08 2ofn n GLY 46 Ca -0.08 0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.03 1.87 -0.44 1.61 -2.85 -0.86 -2.58 119.74 116.46 2ofn s LYS 47 Ca 0.00 -1.23 -0.19 0.00 -1.00 0.00 0.00 55.97 53.55 2ofn s LYS 47 Cb 0.00 0.57 0.03 0.00 -2.06 0.00 0.00 37.83 36.37 2ofn s LYS 47 CO 0.00 -0.84 0.54 -1.17 0.10 0.00 0.00 175.35 173.98 2ofn s LEU 48 N -3.01 4.75 0.56 2.77 2.96 -0.08 -0.83 118.68 125.80 2ofn s LEU 48 Ca 0.16 -0.59 0.34 0.00 -0.22 0.00 0.00 54.13 53.82 2ofn s LEU 48 Cb -0.04 -2.52 1.50 0.00 0.50 0.00 0.00 46.19 45.62 2ofn s LEU 48 CO 0.10 -0.70 2.04 -0.08 -1.32 0.00 0.00 176.35 176.38 2ofn h GLU 49 N 8.82 0.00 -0.76 1.98 4.81 -1.67 -0.09 114.58 127.67 2ofn h GLU 49 Ca -0.26 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.06 2ofn h GLU 49 Cb 1.10 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.41 2ofn h GLU 49 CO 0.86 0.03 0.41 1.03 -0.73 0.00 0.00 179.01 180.61 2ofn h SER 50 N 0.00 0.57 0.00 1.04 0.87 -1.79 -3.15 113.55 111.08 2ofn h SER 50 Ca -0.00 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2ofn h SER 50 Cb 0.44 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2ofn h SER 50 CO 0.00 0.33 0.00 1.07 -0.53 0.00 0.00 176.83 177.70 2ofn n THR 51 N -4.80 0.26 -1.11 2.23 5.66 -1.14 -5.00 114.28 110.38 2ofn n THR 51 Ca 0.12 -0.52 -0.04 0.00 -3.05 0.00 0.00 64.05 60.56 2ofn n THR 51 Cb 0.27 1.02 -0.02 0.00 -1.55 0.00 0.00 70.33 70.05 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 -0.13 0.66 3.75 1.09 0.00 -0.07 -4.99 105.19 105.50 2ofn n GLY 52 Ca 0.00 -0.38 -0.38 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.73 4.25 0.83 1.61 -0.14 -1.06 -4.93 119.74 118.57 2ofn s LYS 53 Ca 0.00 0.47 -0.12 0.00 -1.36 0.00 0.00 55.97 54.97 2ofn s LYS 53 Cb 0.00 -3.38 0.09 0.00 -1.68 0.00 0.00 37.83 32.86 2ofn s LYS 53 CO 0.00 0.31 1.12 0.54 -0.76 0.00 0.00 175.35 176.55 2ofn s VAL 54 N 0.12 2.68 -0.19 3.17 0.11 -1.26 -0.91 120.40 124.13 2ofn s VAL 54 Ca 0.26 0.22 -0.29 0.00 -2.93 0.00 0.00 61.98 59.24 2ofn s VAL 54 Cb -0.16 -3.01 -0.02 0.00 -1.53 0.00 0.00 36.38 31.66 2ofn s VAL 54 CO 0.12 -0.29 1.40 -0.36 -3.33 0.00 0.00 175.10 172.64 2ofn s PHE 55 N -3.25 2.53 -0.33 1.54 0.40 -1.06 -4.76 117.98 113.04 2ofn s PHE 55 Ca 0.62 0.75 -0.01 0.00 -0.60 0.00 0.00 56.93 57.69 2ofn s PHE 55 Cb -0.14 -3.75 0.12 0.00 0.51 0.00 0.00 43.02 39.76 2ofn s PHE 55 CO 0.53 -2.29 0.17 0.34 0.70 0.00 0.00 175.22 174.67 2ofn s ASP 56 N 2.80 3.40 0.24 1.36 -1.08 -1.26 -4.95 116.67 117.17 2ofn s ASP 56 Ca 0.61 -1.83 0.01 0.00 -0.52 0.00 0.00 52.55 50.82 2ofn s ASP 56 Cb -0.23 -0.51 -0.04 0.00 -1.46 0.00 0.00 42.92 40.67 2ofn s ASP 56 CO 0.22 -0.37 0.13 -0.44 0.52 0.00 0.00 175.17 175.23 2ofn s SER 57 N 1.44 0.81 0.25 -0.34 0.01 -1.26 -5.04 113.70 109.57 2ofn s SER 57 Ca 0.14 -1.43 0.03 0.00 1.31 0.00 0.00 55.95 55.99 2ofn s SER 57 Cb -0.20 0.32 0.29 0.00 0.21 0.00 0.00 66.02 66.64 2ofn s SER 57 CO -0.16 -0.82 1.60 0.77 0.41 0.00 0.00 173.24 175.04 2ofn h SER 58 N 2.45 0.37 0.22 2.44 4.64 -2.01 -3.33 113.55 118.32 2ofn h SER 58 Ca -0.36 -0.18 -0.35 0.00 -0.47 0.00 0.00 61.79 60.43 2ofn h SER 58 Cb 1.25 -0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 63.19 2ofn h SER 58 CO 0.55 0.81 -2.00 0.49 -0.87 0.00 0.00 176.83 175.80 2ofn n PHE 59 N -3.96 0.91 0.03 4.77 3.01 -1.26 -4.12 117.46 116.83 2ofn n PHE 59 Ca -0.02 0.24 0.03 0.00 1.01 0.00 0.00 57.45 58.71 2ofn n PHE 59 Cb 0.55 -1.14 0.39 0.00 -0.01 0.00 0.00 39.48 39.27 2ofn n PHE 59 CO 0.00 0.00 0.00 0.38 1.01 0.00 0.00 176.76 178.15 2ofn h ASP 60 N 0.03 0.43 0.87 4.37 2.03 -1.78 0.59 116.42 122.96 2ofn h ASP 60 Ca -0.41 -0.04 0.00 0.00 -0.73 0.00 0.00 57.03 55.85 2ofn h ASP 60 Cb 2.03 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 40.42 2ofn h ASP 60 CO 0.06 0.41 -0.35 -2.11 -1.03 0.00 0.00 179.24 176.22 2ofn n ARG 61 N -4.39 0.13 -0.00 4.15 1.85 -1.25 -4.53 116.66 112.62 2ofn n ARG 61 Ca 0.02 0.06 -0.03 0.00 -1.00 0.00 0.00 57.85 56.89 2ofn n ARG 61 Cb 0.15 -1.60 -0.01 0.00 -1.05 0.00 0.00 32.46 29.95 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 -1.79 1.29 -4.05 2.89 5.15 -0.06 -4.97 115.26 113.71 2ofn n ASN 62 Ca 0.05 0.19 -0.32 0.00 -0.60 0.00 0.00 54.58 53.90 2ofn n ASN 62 Cb 0.38 -0.46 -0.15 0.00 -0.53 0.00 0.00 39.78 39.02 2ofn n ASN 62 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2ofn s VAL 63 N -2.21 2.35 0.47 3.44 1.01 0.19 -5.10 120.40 120.54 2ofn s VAL 63 Ca -0.10 -2.03 -0.22 0.00 0.00 0.00 0.00 61.98 59.63 2ofn s VAL 63 Cb 0.01 -2.58 -0.08 0.00 0.00 0.00 0.00 36.38 33.73 2ofn s VAL 63 CO 0.15 -0.38 1.10 -2.84 0.00 0.00 0.00 175.10 173.13 2ofn s PRO 64 N 1.01 3.80 0.07 2.72 0.02 -1.26 -4.45 135.00 136.91 2ofn s PRO 64 Ca 0.03 1.58 0.01 0.00 0.02 0.00 0.00 61.00 62.64 2ofn s PRO 64 Cb -0.20 -2.29 -0.04 0.00 0.02 0.00 0.00 34.50 31.99 2ofn s PRO 64 CO -0.06 -0.47 0.17 0.12 -0.33 0.00 0.00 177.00 176.42 2ofn s PHE 65 N -1.72 3.40 -0.02 6.54 5.36 -1.26 -5.12 117.98 125.16 2ofn s PHE 65 Ca 0.65 0.18 -0.07 0.00 -0.96 0.00 0.00 56.93 56.72 2ofn s PHE 65 Cb -0.23 -1.70 0.01 0.00 -0.34 0.00 0.00 43.02 40.76 2ofn s PHE 65 CO 0.28 0.56 0.16 -1.59 -1.46 0.00 0.00 175.22 173.17 2ofn s LYS 66 N -2.52 0.40 0.34 10.12 0.00 -1.26 -4.27 119.74 122.54 2ofn s LYS 66 Ca 0.33 -0.15 0.02 0.00 0.00 0.00 0.00 55.97 56.17 2ofn s LYS 66 Cb -0.13 0.17 -0.01 0.00 0.00 0.00 0.00 37.83 37.87 2ofn s LYS 66 CO 0.26 -0.09 0.08 1.97 0.00 0.00 0.00 175.35 177.57 2ofn n PHE 67 N 1.99 0.33 -4.37 1.78 1.16 -1.26 -5.01 117.46 112.08 2ofn n PHE 67 Ca -0.19 -1.98 -0.29 0.00 -1.87 0.00 0.00 57.45 53.11 2ofn n PHE 67 Cb 0.57 -0.08 -0.12 0.00 -1.61 0.00 0.00 39.48 38.24 2ofn n PHE 67 CO 0.00 0.00 0.00 -1.01 -1.87 0.00 0.00 176.76 173.88 2ofn s HIS 68 N -2.63 2.40 -0.25 2.97 3.76 -1.26 -4.02 115.29 116.26 2ofn s HIS 68 Ca 0.11 -0.33 -0.29 0.00 -0.15 0.00 0.00 55.06 54.40 2ofn s HIS 68 Cb 0.01 -1.29 -0.00 0.00 1.11 0.00 0.00 32.58 32.40 2ofn s HIS 68 CO 0.08 0.35 1.27 -1.17 -0.85 0.00 0.00 174.74 174.42 2ofn s LEU 69 N -2.07 4.00 -0.72 0.89 2.96 -1.26 -3.74 118.68 118.74 2ofn s LEU 69 Ca 0.15 1.39 -0.01 0.00 -0.22 0.00 0.00 54.13 55.45 2ofn s LEU 69 Cb -0.10 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.05 2ofn s LEU 69 CO 0.07 -0.94 0.60 -0.62 -1.32 0.00 0.00 176.35 174.14 2ofn n GLU 70 N 7.01 -3.99 -0.02 1.98 -0.58 -1.26 -3.15 120.64 120.63 2ofn n GLU 70 Ca 0.14 0.50 0.13 0.00 -0.42 0.00 0.00 57.16 57.51 2ofn n GLU 70 Cb 0.46 -4.48 0.41 0.00 -0.57 0.00 0.00 31.44 27.26 2ofn n GLU 70 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ofn n GLN 71 N -2.88 1.84 0.00 3.49 0.00 -1.25 -4.61 117.38 113.98 2ofn n GLN 71 Ca -0.15 -1.22 0.00 0.00 0.00 0.00 0.00 57.00 55.63 2ofn n GLN 71 Cb 0.59 -1.47 0.00 0.00 0.00 0.00 0.00 30.24 29.36 2ofn n GLN 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2ofn n GLY 72 N 1.22 0.68 0.05 2.61 0.00 -1.26 -4.96 105.19 103.53 2ofn n GLY 72 Ca 0.18 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.56 0.67 -3.81 1.61 -0.58 -1.26 -4.90 120.64 110.81 2ofn n GLU 73 Ca 0.00 -0.09 -0.36 0.00 -0.42 0.00 0.00 57.16 56.29 2ofn n GLU 73 Cb 0.00 -1.55 -0.11 0.00 -0.57 0.00 0.00 31.44 29.21 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 -3.08 4.72 -0.12 2.62 -7.23 -1.26 -4.96 120.40 111.09 2ofn s VAL 74 Ca -0.08 -0.04 -0.11 0.00 -1.81 0.00 0.00 61.98 59.94 2ofn s VAL 74 Cb 0.10 -3.19 -0.04 0.00 0.56 0.00 0.00 36.38 33.82 2ofn s VAL 74 CO 0.87 0.36 -0.22 2.30 -0.31 0.00 0.00 175.10 178.10 2ofn n ILE 75 N 4.45 1.07 0.08 -0.62 -0.00 -1.26 -4.77 119.36 118.30 2ofn n ILE 75 Ca -0.16 0.26 0.00 0.00 -0.00 0.00 0.00 62.75 62.85 2ofn n ILE 75 Cb 0.52 -2.13 0.00 0.00 -0.00 0.00 0.00 39.64 38.03 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 -3.94 0.00 -0.01 6.28 4.76 -1.19 -4.65 118.16 119.41 2ofn n LYS 76 Ca -0.09 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.26 2ofn n LYS 76 Cb 0.32 -0.22 -0.03 0.00 -1.84 0.00 0.00 35.03 33.27 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 -0.22 1.43 0.72 0.00 -1.71 -1.78 103.07 101.52 2ofn h GLY 77 Ca 0.00 0.28 -0.23 0.00 0.00 0.00 0.00 47.33 47.38 2ofn h GLY 77 CO 0.00 -0.19 -0.91 1.49 0.00 0.00 0.00 176.54 176.92 2ofn h TRP 78 N -0.28 0.76 -0.23 5.60 6.55 -1.92 -3.07 115.95 123.37 2ofn h TRP 78 Ca 0.11 -0.39 0.06 0.00 0.95 0.00 0.00 58.89 59.61 2ofn h TRP 78 Cb 0.44 -0.09 -0.06 0.00 -0.86 0.00 0.00 29.16 28.58 2ofn h TRP 78 CO -0.34 1.21 -0.18 0.22 -1.05 0.00 0.00 178.44 178.29 2ofn h ASP 79 N 0.31 -0.59 -0.08 -3.49 3.58 -1.62 0.18 116.42 114.72 2ofn h ASP 79 Ca -0.08 0.12 -0.19 0.00 0.42 0.00 0.00 57.03 57.29 2ofn h ASP 79 Cb 1.54 0.29 0.01 0.00 1.72 0.00 0.00 39.33 42.90 2ofn h ASP 79 CO 0.17 -0.22 -0.71 0.40 -2.88 0.00 0.00 179.24 176.00 2ofn h ILE 80 N -0.18 1.33 0.10 2.25 5.03 -1.50 -3.22 117.51 121.32 2ofn h ILE 80 Ca 0.13 -1.99 -0.01 0.00 -0.12 0.00 0.00 64.86 62.88 2ofn h ILE 80 Cb 0.38 2.22 0.00 0.00 -3.03 0.00 0.00 36.82 36.39 2ofn h ILE 80 CO -0.34 0.61 -0.05 0.00 -0.68 0.00 0.00 178.15 177.69 2ofn h VAL 82 N -0.16 1.28 0.00 0.00 -1.51 -1.11 -2.73 116.25 112.03 2ofn h VAL 82 Ca -0.01 -1.20 0.00 0.00 -1.23 0.00 0.00 66.70 64.26 2ofn h VAL 82 Cb 0.12 1.31 0.00 0.00 -2.13 0.00 0.00 31.29 30.59 2ofn h VAL 82 CO 0.02 0.39 0.00 -1.20 -1.23 0.00 0.00 177.57 175.56 2ofn n SER 83 N -4.37 0.71 -2.03 4.19 7.64 -1.20 -2.12 113.62 116.44 2ofn n SER 83 Ca -0.02 0.67 -0.08 0.00 1.01 0.00 0.00 58.87 60.45 2ofn n SER 83 Cb 0.36 -0.82 0.29 0.00 -1.01 0.00 0.00 64.21 63.03 2ofn n SER 83 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2ofn n SER 84 N -2.28 4.70 -3.00 6.43 2.88 -0.92 -4.52 113.62 116.91 2ofn n SER 84 Ca 0.02 -3.24 -0.12 0.00 -1.33 0.00 0.00 58.87 54.20 2ofn n SER 84 Cb 0.24 -0.76 -0.02 0.00 -0.75 0.00 0.00 64.21 62.92 2ofn n SER 84 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2ofn n MET 85 N -0.24 1.50 -4.20 -1.46 2.81 -0.90 -5.04 117.12 109.59 2ofn n MET 85 Ca 0.43 -1.37 -0.15 0.00 -1.81 0.00 0.00 57.70 54.79 2ofn n MET 85 Cb 1.41 0.34 -0.08 0.00 -0.71 0.00 0.00 33.22 34.19 2ofn n MET 85 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2ofn s ARG 86 N -2.70 1.59 0.44 0.03 0.52 -1.26 -4.20 118.95 113.37 2ofn s ARG 86 Ca 0.01 -1.79 0.30 0.00 -0.52 0.00 0.00 55.73 53.73 2ofn s ARG 86 Cb -0.00 0.34 1.56 0.00 0.52 0.00 0.00 34.95 37.37 2ofn s ARG 86 CO 0.01 -0.59 1.92 -0.22 0.02 0.00 0.00 175.30 176.44 2ofn h LYS 87 N 2.30 0.00 0.00 3.54 3.64 -1.81 -1.97 116.57 122.28 2ofn h LYS 87 Ca -0.29 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 58.96 2ofn h LYS 87 Cb 1.24 0.00 -0.28 0.00 -0.41 0.00 0.00 32.23 32.78 2ofn h LYS 87 CO 0.42 0.00 -0.88 0.09 -2.27 0.00 0.00 179.45 176.81 2ofn n ASN 88 N -2.59 1.13 -4.58 4.20 3.02 -1.26 -4.67 115.26 110.51 2ofn n ASN 88 Ca -0.01 -2.44 -0.27 0.00 -0.03 0.00 0.00 54.58 51.83 2ofn n ASN 88 Cb 0.10 -0.35 -0.09 0.00 -0.61 0.00 0.00 39.78 38.83 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 -0.75 2.10 -0.07 3.52 2.12 -0.74 -4.33 118.70 120.55 2ofn s GLU 89 Ca 0.33 -1.23 -0.03 0.00 0.36 0.00 0.00 54.97 54.41 2ofn s GLU 89 Cb 0.37 -2.19 0.04 0.00 0.26 0.00 0.00 34.13 32.60 2ofn s GLU 89 CO -0.14 0.44 0.15 0.21 -0.54 0.00 0.00 175.26 175.39 2ofn s LYS 90 N -2.77 0.08 0.10 4.30 2.36 -0.84 -4.00 119.74 118.97 2ofn s LYS 90 Ca 0.25 0.43 0.07 0.00 -2.55 0.00 0.00 55.97 54.16 2ofn s LYS 90 Cb -0.09 -0.20 -0.03 0.00 -1.05 0.00 0.00 37.83 36.45 2ofn s LYS 90 CO 0.15 -0.20 -0.17 0.00 1.55 0.00 0.00 175.35 176.68 2ofn s LEU 92 N -2.04 3.45 -0.04 0.00 1.43 0.60 -1.64 118.68 120.44 2ofn s LEU 92 Ca 0.05 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.83 2ofn s LEU 92 Cb -0.09 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 2ofn s LEU 92 CO 0.04 -0.07 -0.05 0.54 0.23 0.00 0.00 176.35 177.04 2ofn s VAL 93 N 1.58 3.84 -0.31 -1.59 0.11 -0.56 0.39 120.40 123.85 2ofn s VAL 93 Ca 0.06 -0.55 -0.13 0.00 -2.93 0.00 0.00 61.98 58.43 2ofn s VAL 93 Cb -0.15 -2.63 -0.03 0.00 -1.53 0.00 0.00 36.38 32.04 2ofn s VAL 93 CO 0.02 0.51 0.25 -0.13 -3.33 0.00 0.00 175.10 172.42 2ofn s ARG 94 N -1.10 3.71 -0.50 1.54 1.81 0.09 -1.57 118.95 122.94 2ofn s ARG 94 Ca 0.15 -0.44 -0.17 0.00 -1.72 0.00 0.00 55.73 53.54 2ofn s ARG 94 Cb -0.11 -3.74 0.07 0.00 -0.45 0.00 0.00 34.95 30.72 2ofn s ARG 94 CO 0.05 -0.34 0.53 0.42 -0.68 0.00 0.00 175.30 175.27 2ofn s ILE 95 N 1.80 5.04 0.75 1.52 1.09 -0.12 -4.46 121.20 126.82 2ofn s ILE 95 Ca 0.08 -0.80 -0.09 0.00 -1.10 0.00 0.00 60.65 58.74 2ofn s ILE 95 Cb -0.17 -4.24 0.08 0.00 -1.06 0.00 0.00 42.46 37.08 2ofn s ILE 95 CO 0.11 -0.73 1.08 -0.70 -0.10 0.00 0.00 174.94 174.60 2ofn s GLU 96 N 2.17 2.00 0.19 2.79 2.12 -1.26 -1.11 118.70 125.60 2ofn s GLU 96 Ca 0.10 -0.20 -0.15 0.00 0.36 0.00 0.00 54.97 55.08 2ofn s GLU 96 Cb -0.22 -2.09 0.17 0.00 0.26 0.00 0.00 34.13 32.25 2ofn s GLU 96 CO 0.09 -1.43 1.65 0.66 -0.54 0.00 0.00 175.26 175.68 2ofn h SER 97 N -0.80 -0.47 1.12 -1.70 4.64 -1.72 -0.27 113.55 114.35 2ofn h SER 97 Ca -0.45 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2ofn h SER 97 Cb 1.31 0.32 0.00 0.00 -0.31 0.00 0.00 62.40 63.72 2ofn h SER 97 CO 0.60 -0.17 0.00 1.15 -0.87 0.00 0.00 176.83 177.54 2ofn n MET 98 N -5.37 0.18 0.00 4.77 0.00 -1.26 -2.45 117.12 112.99 2ofn n MET 98 Ca 0.05 0.23 0.14 0.00 0.00 0.00 0.00 57.70 58.12 2ofn n MET 98 Cb 0.28 -1.74 0.58 0.00 0.00 0.00 0.00 33.22 32.33 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 -2.06 0.00 -3.12 3.17 4.01 -0.13 -4.82 117.16 114.21 2ofn n TYR 99 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 2ofn n TYR 99 Cb 0.34 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 2ofn n TYR 99 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ofn n GLY 100 N 1.33 5.23 1.80 2.72 0.00 -1.03 -1.84 105.19 113.40 2ofn n GLY 100 Ca 0.13 -1.50 -0.16 0.00 0.00 0.00 0.00 46.02 44.49 2ofn n GLY 100 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ofn n TYR 101 N 0.00 1.99 0.12 1.61 4.01 -1.26 -4.42 117.16 119.21 2ofn n TYR 101 Ca 0.00 -1.41 0.02 0.00 -0.16 0.00 0.00 57.90 56.35 2ofn n TYR 101 Cb 0.00 -0.72 0.38 0.00 -0.31 0.00 0.00 39.34 38.69 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 2.08 0.24 1.45 2.72 0.00 -1.77 0.20 103.07 107.99 2ofn h GLY 102 Ca 0.41 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.59 2ofn h GLY 102 CO 0.73 0.14 0.36 -0.55 0.00 0.00 0.00 176.54 177.22 2ofn h ASP 103 N 0.21 0.64 0.13 0.19 5.19 -1.77 -3.08 116.42 117.92 2ofn h ASP 103 Ca 0.04 -0.02 -0.36 0.00 -0.62 0.00 0.00 57.03 56.07 2ofn h ASP 103 Cb 0.42 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.76 2ofn h ASP 103 CO 0.03 0.47 -1.92 -0.08 -3.12 0.00 0.00 179.24 174.61 2ofn h GLU 104 N 0.75 0.27 0.00 3.56 4.81 -1.69 -3.49 114.58 118.80 2ofn h GLU 104 Ca 0.20 -0.47 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 2ofn h GLU 104 Cb -0.07 0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.48 2ofn h GLU 104 CO -0.04 1.22 0.00 0.41 -0.73 0.00 0.00 179.01 179.87 2ofn n GLY 105 N 1.95 1.22 3.59 1.92 0.00 0.62 -5.07 105.19 109.42 2ofn n GLY 105 Ca -0.31 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 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 4.48 0.16 0.02 0.00 0.00 -1.26 -4.36 107.32 106.36 2ofn s GLY 107 Ca 0.62 -0.03 -0.21 0.00 0.00 0.00 0.00 44.72 45.11 2ofn s GLY 107 CO 0.31 0.11 1.26 0.83 0.00 0.00 0.00 173.10 175.61 2ofn h GLU 108 N 6.43 0.32 0.00 2.90 5.08 -2.02 -3.43 114.58 123.86 2ofn h GLU 108 Ca -0.31 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 2ofn h GLU 108 Cb 1.18 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2ofn h GLU 108 CO 0.50 0.80 0.00 0.45 -1.00 0.00 0.00 179.01 179.76 2ofn n SER 109 N -4.52 0.00 -3.63 1.42 2.88 -1.26 -5.06 113.62 103.45 2ofn n SER 109 Ca -0.07 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.29 2ofn n SER 109 Cb 0.42 -0.14 -0.15 0.00 -0.75 0.00 0.00 64.21 63.58 2ofn n SER 109 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2ofn s ILE 110 N -0.62 -0.25 -0.02 2.46 -0.00 -1.26 -5.05 121.20 116.45 2ofn s ILE 110 Ca 0.00 0.21 -0.00 0.00 -0.00 0.00 0.00 60.65 60.86 2ofn s ILE 110 Cb 0.00 -0.39 -0.00 0.00 -0.00 0.00 0.00 42.46 42.07 2ofn s ILE 110 CO 0.00 0.04 -0.00 1.55 -0.00 0.00 0.00 174.94 176.52 2ofn h PRO 111 N 8.36 0.00 0.00 0.37 0.14 -1.90 -3.48 132.00 135.50 2ofn h PRO 111 Ca -0.14 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.00 2ofn h PRO 111 Cb 1.13 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.27 2ofn h PRO 111 CO 0.19 0.00 0.00 0.41 0.14 0.00 0.00 178.00 178.74 2ofn n GLY 112 N 1.95 0.37 2.43 1.56 0.00 -1.26 -2.55 105.19 107.68 2ofn n GLY 112 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2ofn n GLY 112 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ofn n ASN 113 N -0.08 -5.67 -0.74 1.61 4.13 -1.26 -4.97 115.26 108.29 2ofn n ASN 113 Ca 0.00 0.10 0.00 0.00 1.68 0.00 0.00 54.58 56.36 2ofn n ASN 113 Cb 0.04 -4.75 0.00 0.00 -1.54 0.00 0.00 39.78 33.53 2ofn n ASN 113 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2ofn n SER 114 N -1.70 1.97 -4.52 6.41 3.41 -1.06 -4.36 113.62 113.77 2ofn n SER 114 Ca -0.23 -0.37 -0.34 0.00 -0.26 0.00 0.00 58.87 57.67 2ofn n SER 114 Cb 0.68 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.51 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 0.28 4.04 0.29 -3.33 0.11 -1.25 -2.86 120.40 117.68 2ofn s VAL 115 Ca 0.00 -0.30 0.09 0.00 -2.93 0.00 0.00 61.98 58.84 2ofn s VAL 115 Cb 0.00 -2.78 -0.04 0.00 -1.53 0.00 0.00 36.38 32.03 2ofn s VAL 115 CO 0.00 0.49 0.04 -0.76 -3.33 0.00 0.00 175.10 171.54 2ofn s LEU 116 N 0.35 3.19 -0.23 2.54 1.02 -0.27 -1.94 118.68 123.35 2ofn s LEU 116 Ca -0.03 -0.72 -0.01 0.00 0.02 0.00 0.00 54.13 53.40 2ofn s LEU 116 Cb -0.14 -1.68 0.02 0.00 0.02 0.00 0.00 46.19 44.41 2ofn s LEU 116 CO 0.02 -0.10 -0.10 -0.76 0.02 0.00 0.00 176.35 175.43 2ofn s LEU 117 N -3.73 2.89 -0.17 1.79 1.02 -0.01 -0.94 118.68 119.53 2ofn s LEU 117 Ca 0.33 -0.78 -0.01 0.00 0.02 0.00 0.00 54.13 53.69 2ofn s LEU 117 Cb -0.05 -1.62 -0.01 0.00 0.02 0.00 0.00 46.19 44.54 2ofn s LEU 117 CO 0.21 -0.08 -0.10 -0.36 0.02 0.00 0.00 176.35 176.03 2ofn s PHE 118 N 1.32 2.87 -0.38 0.29 0.08 -0.61 -2.04 117.98 119.52 2ofn s PHE 118 Ca 0.02 -0.87 -0.29 0.00 0.12 0.00 0.00 56.93 55.91 2ofn s PHE 118 Cb -0.16 -1.95 0.02 0.00 -0.57 0.00 0.00 43.02 40.36 2ofn s PHE 118 CO -0.07 -0.41 1.09 -1.21 -0.10 0.00 0.00 175.22 174.53 2ofn s GLU 119 N 0.89 3.93 -0.21 0.44 2.02 0.19 -1.50 118.70 124.45 2ofn s GLU 119 Ca -0.03 0.87 -0.06 0.00 0.02 0.00 0.00 54.97 55.77 2ofn s GLU 119 Cb -0.15 -3.80 -0.03 0.00 0.10 0.00 0.00 34.13 30.25 2ofn s GLU 119 CO -0.00 -1.09 0.01 0.42 0.02 0.00 0.00 175.26 174.63 2ofn s ILE 120 N 3.95 4.05 -0.07 -1.63 1.01 -0.65 -2.78 121.20 125.08 2ofn s ILE 120 Ca 0.46 -0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.86 2ofn s ILE 120 Cb -0.10 -2.84 0.01 0.00 0.01 0.00 0.00 42.46 39.54 2ofn s ILE 120 CO 0.22 0.41 -0.13 -1.61 0.00 0.00 0.00 174.94 173.83 2ofn s GLU 121 N 1.09 1.82 -0.61 2.79 2.02 -1.03 -2.76 118.70 122.01 2ofn s GLU 121 Ca 0.03 -0.46 -0.21 0.00 0.02 0.00 0.00 54.97 54.35 2ofn s GLU 121 Cb -0.14 -1.49 0.09 0.00 0.10 0.00 0.00 34.13 32.69 2ofn s GLU 121 CO 0.02 0.05 0.81 -1.17 0.02 0.00 0.00 175.26 174.99 2ofn s LEU 122 N 0.60 4.93 -0.04 1.80 2.96 -1.26 -2.62 118.68 125.06 2ofn s LEU 122 Ca -0.14 -1.21 0.12 0.00 -0.22 0.00 0.00 54.13 52.68 2ofn s LEU 122 Cb -0.16 -2.37 -0.23 0.00 0.50 0.00 0.00 46.19 43.93 2ofn s LEU 122 CO 0.04 -1.24 0.68 0.17 -1.32 0.00 0.00 176.35 174.68 2ofn h LEU 123 N 10.55 0.01 -7.44 -0.68 -0.00 -1.81 -3.40 115.31 112.53 2ofn h LEU 123 Ca -0.29 -0.02 -0.12 0.00 -0.00 0.00 0.00 57.88 57.45 2ofn h LEU 123 Cb 1.08 -0.00 -0.21 0.00 -0.00 0.00 0.00 40.66 41.53 2ofn h LEU 123 CO 1.13 1.02 -0.25 -0.44 -0.00 0.00 0.00 178.44 179.90 2ofn s SER 124 N -6.13 -0.26 0.04 0.17 0.01 -1.07 -5.03 113.70 101.41 2ofn s SER 124 Ca -0.05 0.27 -0.27 0.00 1.31 0.00 0.00 55.95 57.22 2ofn s SER 124 Cb 0.08 0.43 0.09 0.00 0.21 0.00 0.00 66.02 66.83 2ofn s SER 124 CO 0.82 -0.39 0.80 0.72 0.41 0.00 0.00 173.24 175.61 2ofn s PHE 125 N -0.98 -0.41 -0.29 2.43 -0.71 -1.26 -0.06 117.98 116.70 2ofn s PHE 125 Ca -0.10 0.27 -0.04 0.00 -1.04 0.00 0.00 56.93 56.01 2ofn s PHE 125 Cb -0.04 0.54 0.16 0.00 -1.21 0.00 0.00 43.02 42.47 2ofn s PHE 125 CO 0.04 -0.63 0.58 -0.98 -1.34 0.00 0.00 175.22 172.89 2ofn s ARG 126 N -3.22 0.54 0.13 1.99 1.70 -0.10 -4.98 118.95 115.00 2ofn s ARG 126 Ca 0.03 1.10 -0.23 0.00 -0.47 0.00 0.00 55.73 56.17 2ofn s ARG 126 Cb -0.01 0.54 -0.07 0.00 -0.57 0.00 0.00 34.95 34.84 2ofn s ARG 126 CO -0.10 -0.47 0.69 -1.21 -1.08 0.00 0.00 175.30 173.14 2ofn s GLU 127 N 2.83 4.42 -0.34 3.89 2.02 -1.26 -3.40 118.70 126.86 2ofn s GLU 127 Ca 0.10 0.99 0.16 0.00 0.02 0.00 0.00 54.97 56.25 2ofn s GLU 127 Cb -0.14 -3.25 0.43 0.00 0.10 0.00 0.00 34.13 31.26 2ofn s GLU 127 CO -0.19 0.60 0.89 1.28 0.02 0.00 0.00 175.26 177.86 2ofn n LEU 128 N 1.66 1.21 0.00 1.80 4.77 -1.26 -5.07 117.00 120.11 2ofn n LEU 128 Ca -0.07 -4.08 0.02 0.00 -0.03 0.00 0.00 56.01 51.85 2ofn n LEU 128 Cb 0.49 0.51 -0.01 0.00 -2.33 0.00 0.00 43.42 42.09 2ofn n LEU 128 CO 0.44 1.77 -0.03 1.21 -1.33 0.00 0.00 177.39 179.45 2ofn n GLU 129 N 0.03 -0.34 0.00 3.23 0.00 -1.26 -4.95 120.64 117.36 2ofn n GLU 129 Ca 0.13 0.22 0.00 0.00 0.00 0.00 0.00 57.16 57.52 2ofn n GLU 129 Cb 0.77 -0.41 0.00 0.00 0.00 0.00 0.00 31.44 31.80 2ofn n GLU 129 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2ofn n HIS 130 N -1.13 0.00 -3.86 4.31 8.25 -1.26 -4.88 115.22 116.65 2ofn n HIS 130 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 2ofn n HIS 130 Cb 0.08 0.09 -0.15 0.00 1.12 0.00 0.00 29.99 31.12 2ofn n HIS 130 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2ofn s HIS 131 N -1.99 2.54 -1.26 4.41 3.76 -1.26 -5.02 115.29 116.47 2ofn s HIS 131 Ca 0.00 -2.21 -0.07 0.00 -0.15 0.00 0.00 55.06 52.62 2ofn s HIS 131 Cb 0.00 -2.16 0.18 0.00 1.11 0.00 0.00 32.58 31.71 2ofn s HIS 131 CO 0.00 -0.89 1.96 0.72 -0.85 0.00 0.00 174.74 175.68 2ofn n HIS 132 N 4.61 2.75 -3.39 1.40 -0.00 -1.26 -4.69 115.22 114.63 2ofn n HIS 132 Ca -0.01 -2.76 -0.14 0.00 -0.00 0.00 0.00 57.72 54.82 2ofn n HIS 132 Cb 0.42 -1.82 0.01 0.00 -0.00 0.00 0.00 29.99 28.61 2ofn n HIS 132 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2ofn n HIS 133 N 2.91 -2.49 -3.75 4.41 8.25 -1.26 -5.02 115.22 118.26 2ofn n HIS 133 Ca 0.44 0.91 -0.12 0.00 -0.26 0.00 0.00 57.72 58.68 2ofn n HIS 133 Cb 0.33 -3.62 -0.12 0.00 1.12 0.00 0.00 29.99 27.69 2ofn n HIS 133 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2ofn s HIS 134 N -3.11 -0.31 -2.21 4.41 5.04 -1.26 -5.31 115.29 112.54 2ofn s HIS 134 Ca 0.12 0.74 0.18 0.00 -1.54 0.00 0.00 55.06 54.56 2ofn s HIS 134 Cb -0.04 0.07 0.14 0.00 0.04 0.00 0.00 32.58 32.79 2ofn s HIS 134 CO 0.81 -0.19 1.06 1.58 -2.34 0.00 0.00 174.74 175.66