#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 4.55 0.77 2.03 -4.23 -1.26 -5.06 115.64 112.45 2ofn s THR 2 Ca 0.00 1.13 -0.11 0.00 -1.18 0.00 0.00 61.69 61.53 2ofn s THR 2 Cb 0.00 -3.74 0.05 0.00 1.34 0.00 0.00 72.50 70.15 2ofn s THR 2 CO 0.00 -0.79 1.08 0.42 -0.54 0.00 0.00 174.62 174.79 2ofn s THR 3 N -2.75 3.39 0.00 3.99 -4.23 -1.26 -4.85 115.64 109.93 2ofn s THR 3 Ca 0.58 0.45 0.00 0.00 -1.18 0.00 0.00 61.69 61.54 2ofn s THR 3 Cb -0.10 -3.11 0.00 0.00 1.34 0.00 0.00 72.50 70.62 2ofn s THR 3 CO 0.37 -0.59 0.00 -0.62 -0.54 0.00 0.00 174.62 173.24 2ofn n GLU 4 N -3.41 0.00 -3.90 3.99 1.02 -1.26 -4.78 120.64 112.30 2ofn n GLU 4 Ca 0.08 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.09 2ofn n GLU 4 Cb 0.55 0.00 -0.14 0.00 -0.02 0.00 0.00 31.44 31.82 2ofn n GLU 4 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2ofn s GLN 5 N 0.00 0.05 -0.61 3.49 -2.07 -1.26 -5.04 119.66 114.22 2ofn s GLN 5 Ca 0.00 -0.01 -0.00 0.00 -1.82 0.00 0.00 55.36 53.53 2ofn s GLN 5 Cb 0.00 -0.07 0.49 0.00 -1.09 0.00 0.00 33.01 32.34 2ofn s GLN 5 CO 0.00 -0.00 1.98 0.39 -1.32 0.00 0.00 175.29 176.34 2ofn n GLU 6 N 3.15 2.63 -3.55 9.60 -0.58 -1.26 -4.92 120.64 125.71 2ofn n GLU 6 Ca -0.13 -3.26 -0.41 0.00 -0.42 0.00 0.00 57.16 52.94 2ofn n GLU 6 Cb 0.59 -2.26 -0.11 0.00 -0.57 0.00 0.00 31.44 29.09 2ofn n GLU 6 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 2ofn s PHE 7 N -3.72 3.22 0.37 -0.32 0.08 -1.26 -5.08 117.98 111.28 2ofn s PHE 7 Ca 0.63 -0.43 -0.06 0.00 0.12 0.00 0.00 56.93 57.19 2ofn s PHE 7 Cb 0.50 -2.47 -0.05 0.00 -0.57 0.00 0.00 43.02 40.43 2ofn s PHE 7 CO 0.01 -0.45 0.67 -2.00 -0.10 0.00 0.00 175.22 173.35 2ofn s GLU 8 N 1.68 3.65 0.44 0.44 2.12 -1.26 -4.91 118.70 120.87 2ofn s GLU 8 Ca 0.05 0.17 -0.14 0.00 0.36 0.00 0.00 54.97 55.41 2ofn s GLU 8 Cb -0.18 -2.51 -0.08 0.00 0.26 0.00 0.00 34.13 31.63 2ofn s GLU 8 CO 0.09 0.05 0.86 0.15 -0.54 0.00 0.00 175.26 175.87 2ofn s LYS 9 N -3.93 3.90 -0.42 4.30 3.01 -1.26 -4.58 119.74 120.76 2ofn s LYS 9 Ca 0.47 0.72 -0.09 0.00 -1.01 0.00 0.00 55.97 56.06 2ofn s LYS 9 Cb -0.10 -2.28 0.08 0.00 -1.01 0.00 0.00 37.83 34.51 2ofn s LYS 9 CO 0.34 -0.11 0.27 0.08 0.51 0.00 0.00 175.35 176.43 2ofn s VAL 10 N -2.42 4.27 -0.25 3.17 1.01 -0.24 -5.02 120.40 120.93 2ofn s VAL 10 Ca 0.55 -1.39 -0.21 0.00 0.00 0.00 0.00 61.98 60.94 2ofn s VAL 10 Cb -0.10 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 2ofn s VAL 10 CO 0.29 -0.51 0.66 -1.61 0.00 0.00 0.00 175.10 173.93 2ofn s GLU 11 N 1.43 4.13 -0.91 2.72 2.02 -1.26 -2.29 118.70 124.54 2ofn s GLU 11 Ca 0.03 0.62 -0.04 0.00 0.02 0.00 0.00 54.97 55.60 2ofn s GLU 11 Cb -0.23 -3.64 -0.03 0.00 0.10 0.00 0.00 34.13 30.32 2ofn s GLU 11 CO 0.02 -0.42 0.80 1.28 0.02 0.00 0.00 175.26 176.97 2ofn n LEU 12 N 5.70 -5.85 -4.72 1.80 4.77 -1.16 -4.97 117.00 112.58 2ofn n LEU 12 Ca 0.00 -0.46 -0.31 0.00 -0.03 0.00 0.00 56.01 55.22 2ofn n LEU 12 Cb 0.49 -3.16 0.13 0.00 -2.33 0.00 0.00 43.42 38.55 2ofn n LEU 12 CO 0.44 -0.41 0.68 0.28 -1.33 0.00 0.00 177.39 177.05 2ofn s THR 13 N -3.21 2.72 -1.48 -5.08 -1.32 -1.09 -4.65 115.64 101.54 2ofn s THR 13 Ca 0.24 0.23 0.14 0.00 -1.21 0.00 0.00 61.69 61.10 2ofn s THR 13 Cb -0.04 -2.52 0.26 0.00 -1.51 0.00 0.00 72.50 68.69 2ofn s THR 13 CO 0.76 -0.31 1.37 0.00 -2.21 0.00 0.00 174.62 174.24 2ofn n ALA 14 N -3.89 1.83 1.09 11.08 0.00 -1.26 -0.80 120.51 128.55 2ofn n ALA 14 Ca 0.10 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.56 2ofn n ALA 14 Cb 0.53 -1.23 0.52 0.00 0.00 0.00 0.00 19.45 19.27 2ofn n ALA 14 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ofn n ASP 15 N -1.26 0.00 0.00 0.00 8.00 -1.26 -4.68 116.55 117.34 2ofn n ASP 15 Ca 0.07 -0.51 0.00 0.00 0.71 0.00 0.00 54.79 55.06 2ofn n ASP 15 Cb 0.11 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 2ofn n ASP 15 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ofn n GLY 16 N 0.11 1.80 1.94 0.44 0.00 -1.08 -4.80 105.19 103.60 2ofn n GLY 16 Ca 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.66 2.96 -0.02 0.00 0.02 -4.99 105.19 102.50 2ofn n GLY 17 Ca 0.00 0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.55 0.19 -0.45 1.61 1.01 -1.26 -4.84 120.40 114.11 2ofn s VAL 18 Ca 0.02 -0.61 -0.24 0.00 0.00 0.00 0.00 61.98 61.15 2ofn s VAL 18 Cb -0.01 -0.26 0.03 0.00 0.00 0.00 0.00 36.38 36.14 2ofn s VAL 18 CO 0.22 -0.27 0.84 -0.63 0.00 0.00 0.00 175.10 175.26 2ofn s ILE 19 N -0.89 4.58 0.05 2.22 -1.09 -1.26 -2.66 121.20 122.15 2ofn s ILE 19 Ca -0.08 0.56 0.07 0.00 -2.23 0.00 0.00 60.65 58.97 2ofn s ILE 19 Cb -0.06 -4.37 -0.03 0.00 -1.58 0.00 0.00 42.46 36.43 2ofn s ILE 19 CO -0.00 -0.76 -0.20 -1.59 -1.23 0.00 0.00 174.94 171.16 2ofn s LYS 20 N 3.47 1.31 -0.13 2.79 -2.85 -0.97 -1.19 119.74 122.17 2ofn s LYS 20 Ca 0.33 -0.94 0.00 0.00 -1.00 0.00 0.00 55.97 54.35 2ofn s LYS 20 Cb -0.11 -1.43 0.02 0.00 -2.06 0.00 0.00 37.83 34.25 2ofn s LYS 20 CO 0.24 0.36 -0.12 0.99 0.10 0.00 0.00 175.35 176.92 2ofn s THR 21 N -0.85 1.41 0.38 3.79 2.01 0.12 -1.07 115.64 121.43 2ofn s THR 21 Ca 0.07 -0.53 -0.25 0.00 0.31 0.00 0.00 61.69 61.29 2ofn s THR 21 Cb -0.09 -1.34 -0.09 0.00 0.01 0.00 0.00 72.50 70.99 2ofn s THR 21 CO 0.02 0.43 1.03 -0.51 -0.69 0.00 0.00 174.62 174.91 2ofn s ILE 22 N 1.51 3.80 0.00 1.82 1.10 -1.26 -0.02 121.20 128.14 2ofn s ILE 22 Ca 0.04 1.41 0.00 0.00 -0.51 0.00 0.00 60.65 61.59 2ofn s ILE 22 Cb -0.13 -3.74 0.00 0.00 0.15 0.00 0.00 42.46 38.74 2ofn s ILE 22 CO -0.09 0.04 0.00 0.18 -2.11 0.00 0.00 174.94 172.96 2ofn n LEU 23 N 0.08 1.06 -3.61 8.50 7.99 -1.04 -4.82 117.00 125.16 2ofn n LEU 23 Ca 0.04 0.00 -0.10 0.00 -0.01 0.00 0.00 56.01 55.94 2ofn n LEU 23 Cb 0.49 0.00 -0.10 0.00 -0.11 0.00 0.00 43.42 43.70 2ofn n LEU 23 CO 0.45 0.18 -0.02 -0.75 -1.51 0.00 0.00 177.39 175.73 2ofn s LYS 24 N -1.73 0.29 0.14 3.23 2.20 0.51 -4.99 119.74 119.38 2ofn s LYS 24 Ca 0.00 0.89 0.03 0.00 -0.36 0.00 0.00 55.97 56.52 2ofn s LYS 24 Cb 0.00 0.11 -0.04 0.00 -1.51 0.00 0.00 37.83 36.39 2ofn s LYS 24 CO 0.00 -0.32 0.25 0.15 -0.36 0.00 0.00 175.35 175.06 2ofn s LYS 25 N 2.56 3.34 0.33 4.03 1.02 -1.26 -0.65 119.74 129.10 2ofn s LYS 25 Ca 0.01 -0.62 0.07 0.00 0.02 0.00 0.00 55.97 55.45 2ofn s LYS 25 Cb -0.13 -2.92 -0.02 0.00 -0.52 0.00 0.00 37.83 34.25 2ofn s LYS 25 CO -0.12 0.53 0.38 0.20 -0.92 0.00 0.00 175.35 175.41 2ofn s GLY 26 N -3.12 1.65 0.00 -3.33 0.00 -1.26 -4.81 107.32 96.46 2ofn s GLY 26 Ca 0.34 -1.53 0.00 0.00 0.00 0.00 0.00 44.72 43.53 2ofn s GLY 26 CO 0.27 -1.46 0.00 1.22 0.00 0.00 0.00 173.10 173.13 2ofn n ASP 27 N -1.50 0.00 -4.85 1.64 8.00 -1.26 -5.05 116.55 113.52 2ofn n ASP 27 Ca -0.02 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.14 2ofn n ASP 27 Cb 0.59 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.63 2ofn n ASP 27 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2ofn s GLU 28 N 0.51 3.90 0.00 -1.24 1.03 -1.26 -4.95 118.70 116.69 2ofn s GLU 28 Ca 0.00 0.38 0.00 0.00 0.03 0.00 0.00 54.97 55.38 2ofn s GLU 28 Cb 0.00 -2.93 0.00 0.00 -0.80 0.00 0.00 34.13 30.40 2ofn s GLU 28 CO 0.00 0.49 0.00 0.41 -1.33 0.00 0.00 175.26 174.83 2ofn n GLY 29 N 0.76 -1.79 0.33 -3.83 0.00 -1.26 -5.02 105.19 94.38 2ofn n GLY 29 Ca -0.06 0.67 0.05 0.00 0.00 0.00 0.00 46.02 46.68 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 0.64 -0.67 1.61 4.57 -2.05 -1.43 114.58 117.26 2ofn h GLU 30 Ca 0.00 -0.04 -0.26 0.00 -1.18 0.00 0.00 59.36 57.88 2ofn h GLU 30 Cb 0.00 -0.14 -0.15 0.00 -0.16 0.00 0.00 28.75 28.29 2ofn h GLU 30 CO 0.00 0.42 0.26 0.39 -1.18 0.00 0.00 179.01 178.90 2ofn n GLU 31 N -4.47 2.86 -3.52 1.92 1.02 -1.26 -4.61 120.64 112.59 2ofn n GLU 31 Ca 0.06 -3.07 -0.27 0.00 -0.02 0.00 0.00 57.16 53.87 2ofn n GLU 31 Cb 0.11 -2.08 -0.09 0.00 -0.02 0.00 0.00 31.44 29.36 2ofn n GLU 31 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2ofn n ASN 32 N -0.65 2.08 -3.68 1.62 5.03 -0.54 -5.00 115.26 114.12 2ofn n ASN 32 Ca 0.42 -3.04 -0.27 0.00 0.87 0.00 0.00 54.58 52.56 2ofn n ASN 32 Cb 1.33 -0.67 -0.16 0.00 -1.02 0.00 0.00 39.78 39.26 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 -1.47 0.29 -0.97 2.41 -1.09 -1.26 -4.09 121.20 115.02 2ofn s ILE 33 Ca 0.33 -0.47 -0.24 0.00 -2.23 0.00 0.00 60.65 58.04 2ofn s ILE 33 Cb 0.08 -0.90 -0.04 0.00 -1.58 0.00 0.00 42.46 40.02 2ofn s ILE 33 CO -0.11 -0.29 1.87 -2.16 -1.23 0.00 0.00 174.94 173.02 2ofn s PRO 34 N 1.96 2.73 0.27 2.79 0.04 -1.26 -4.91 135.00 136.63 2ofn s PRO 34 Ca 0.01 -0.59 0.03 0.00 0.04 0.00 0.00 61.00 60.49 2ofn s PRO 34 Cb -0.17 -5.14 -0.03 0.00 0.04 0.00 0.00 34.50 29.20 2ofn s PRO 34 CO -0.11 -3.28 0.43 0.15 0.04 0.00 0.00 177.00 174.23 2ofn s LYS 35 N 6.57 3.46 0.57 4.56 -0.14 -1.26 -3.92 119.74 129.58 2ofn s LYS 35 Ca 0.66 -0.57 -0.19 0.00 -1.36 0.00 0.00 55.97 54.51 2ofn s LYS 35 Cb -0.05 -2.81 -0.05 0.00 -1.68 0.00 0.00 37.83 33.25 2ofn s LYS 35 CO 0.00 0.33 1.16 0.21 -0.76 0.00 0.00 175.35 176.29 2ofn s LYS 36 N -4.03 3.16 0.00 1.68 2.20 -1.26 -3.68 119.74 117.82 2ofn s LYS 36 Ca 0.37 1.69 0.00 0.00 -0.36 0.00 0.00 55.97 57.66 2ofn s LYS 36 Cb -0.09 -1.97 0.00 0.00 -1.51 0.00 0.00 37.83 34.26 2ofn s LYS 36 CO 0.32 -1.02 0.00 0.41 -0.36 0.00 0.00 175.35 174.70 2ofn n GLY 37 N 0.27 2.60 3.68 5.54 0.00 -1.26 -5.05 105.19 110.97 2ofn n GLY 37 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.23 4.78 -0.78 1.61 0.01 -1.24 -5.06 114.94 114.04 2ofn s ASN 38 Ca 0.00 -0.50 -0.26 0.00 -0.71 0.00 0.00 52.86 51.38 2ofn s ASN 38 Cb 0.00 -0.99 0.02 0.00 0.41 0.00 0.00 41.25 40.69 2ofn s ASN 38 CO 0.00 0.02 1.44 -1.61 -1.51 0.00 0.00 177.10 175.44 2ofn s GLU 39 N -3.49 3.13 0.01 -0.60 8.01 -1.26 -4.51 118.70 119.98 2ofn s GLU 39 Ca 0.30 -0.25 -0.08 0.00 0.01 0.00 0.00 54.97 54.95 2ofn s GLU 39 Cb -0.07 -4.47 -0.05 0.00 -4.31 0.00 0.00 34.13 25.23 2ofn s GLU 39 CO 0.20 -2.32 0.29 0.14 0.01 0.00 0.00 175.26 173.58 2ofn s VAL 40 N 6.39 5.26 -0.29 2.63 -7.23 -1.26 -3.03 120.40 122.87 2ofn s VAL 40 Ca 0.44 0.28 -0.04 0.00 -1.81 0.00 0.00 61.98 60.84 2ofn s VAL 40 Cb -0.07 -3.58 0.02 0.00 0.56 0.00 0.00 36.38 33.31 2ofn s VAL 40 CO 0.11 0.40 0.03 -0.89 -0.31 0.00 0.00 175.10 174.43 2ofn s THR 41 N -1.27 3.45 0.16 5.32 2.01 0.12 -4.09 115.64 121.34 2ofn s THR 41 Ca 0.27 -0.95 0.04 0.00 0.31 0.00 0.00 61.69 61.36 2ofn s THR 41 Cb -0.14 -2.82 -0.05 0.00 0.01 0.00 0.00 72.50 69.51 2ofn s THR 41 CO 0.15 0.06 -0.09 0.68 -0.69 0.00 0.00 174.62 174.73 2ofn s VAL 42 N 1.40 1.14 0.18 3.82 -7.23 -1.20 -2.70 120.40 115.82 2ofn s VAL 42 Ca 0.00 -2.06 0.10 0.00 -1.81 0.00 0.00 61.98 58.22 2ofn s VAL 42 Cb -0.18 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 34.80 2ofn s VAL 42 CO -0.00 -0.69 -0.17 -1.00 -0.31 0.00 0.00 175.10 172.93 2ofn s HIS 43 N -3.35 2.47 0.01 2.82 3.76 -1.24 -2.67 115.29 117.10 2ofn s HIS 43 Ca 0.18 -0.29 0.01 0.00 -0.15 0.00 0.00 55.06 54.81 2ofn s HIS 43 Cb 0.03 -1.22 -0.01 0.00 1.11 0.00 0.00 32.58 32.49 2ofn s HIS 43 CO 0.02 0.50 -0.04 1.52 -0.85 0.00 0.00 174.74 175.88 2ofn s TYR 44 N -1.65 0.35 0.13 1.40 1.13 -1.23 -3.59 117.35 113.89 2ofn s TYR 44 Ca 0.22 -0.22 -0.24 0.00 -1.41 0.00 0.00 57.07 55.43 2ofn s TYR 44 Cb -0.08 -0.22 0.07 0.00 -1.10 0.00 0.00 41.96 40.63 2ofn s TYR 44 CO 0.12 -0.05 0.68 0.54 -2.51 0.00 0.00 175.55 174.34 2ofn s VAL 45 N -0.55 0.00 0.00 -3.49 0.11 -1.15 -4.52 120.40 110.80 2ofn s VAL 45 Ca -0.04 -0.07 0.00 0.00 -2.93 0.00 0.00 61.98 58.94 2ofn s VAL 45 Cb -0.04 -1.08 0.00 0.00 -1.53 0.00 0.00 36.38 33.73 2ofn s VAL 45 CO -0.00 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.38 2ofn n GLY 46 N -0.35 -0.65 3.80 6.54 0.00 -1.25 0.03 105.19 113.31 2ofn n GLY 46 Ca -0.14 -0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.85 1.85 -0.55 1.61 -2.85 -0.67 -3.50 119.74 114.78 2ofn s LYS 47 Ca 0.00 -1.14 -0.22 0.00 -1.00 0.00 0.00 55.97 53.61 2ofn s LYS 47 Cb 0.00 0.59 0.05 0.00 -2.06 0.00 0.00 37.83 36.41 2ofn s LYS 47 CO 0.00 -0.84 0.85 -1.17 0.10 0.00 0.00 175.35 174.29 2ofn s LEU 48 N -2.97 4.39 0.49 2.77 2.96 -0.27 -0.19 118.68 125.86 2ofn s LEU 48 Ca 0.14 -0.57 0.21 0.00 -0.22 0.00 0.00 54.13 53.69 2ofn s LEU 48 Cb -0.05 -2.68 1.25 0.00 0.50 0.00 0.00 46.19 45.20 2ofn s LEU 48 CO 0.09 -1.14 2.04 -0.08 -1.32 0.00 0.00 176.35 175.93 2ofn h GLU 49 N 9.23 0.00 -0.96 1.98 4.81 -1.81 0.25 114.58 128.09 2ofn h GLU 49 Ca -0.27 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.08 2ofn h GLU 49 Cb 1.08 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.38 2ofn h GLU 49 CO 1.06 0.15 0.59 1.03 -0.73 0.00 0.00 179.01 181.11 2ofn h SER 50 N 0.00 0.87 0.00 1.04 0.87 -1.81 -3.16 113.55 111.36 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 0.32 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 2ofn h SER 50 CO 0.02 0.47 -0.25 1.07 -0.53 0.00 0.00 176.83 177.61 2ofn n THR 51 N -4.65 0.00 -0.68 2.23 5.66 -1.09 -5.01 114.28 110.74 2ofn n THR 51 Ca 0.18 -0.38 0.00 0.00 -3.05 0.00 0.00 64.05 60.80 2ofn n THR 51 Cb 0.33 0.88 0.00 0.00 -1.55 0.00 0.00 70.33 69.99 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 1.37 0.65 3.74 1.09 0.00 0.87 -5.03 105.19 107.88 2ofn n GLY 52 Ca 0.00 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.40 4.38 0.59 1.61 -0.14 -1.12 -4.90 119.74 119.76 2ofn s LYS 53 Ca 0.00 0.75 -0.10 0.00 -1.36 0.00 0.00 55.97 55.26 2ofn s LYS 53 Cb 0.00 -3.40 -0.04 0.00 -1.68 0.00 0.00 37.83 32.71 2ofn s LYS 53 CO 0.00 0.20 0.98 0.54 -0.76 0.00 0.00 175.35 176.31 2ofn s VAL 54 N 0.36 4.67 -0.29 3.17 0.11 -1.26 -1.11 120.40 126.04 2ofn s VAL 54 Ca 0.33 0.70 -0.29 0.00 -2.93 0.00 0.00 61.98 59.79 2ofn s VAL 54 Cb -0.17 -3.84 -0.00 0.00 -1.53 0.00 0.00 36.38 30.83 2ofn s VAL 54 CO 0.16 -1.05 1.37 -0.36 -3.33 0.00 0.00 175.10 171.90 2ofn s PHE 55 N -3.09 2.54 -0.43 1.54 0.08 -1.23 -4.88 117.98 112.51 2ofn s PHE 55 Ca 0.54 0.79 0.02 0.00 0.12 0.00 0.00 56.93 58.39 2ofn s PHE 55 Cb -0.11 -3.96 0.13 0.00 -0.57 0.00 0.00 43.02 38.52 2ofn s PHE 55 CO 0.52 -1.98 0.22 0.34 -0.10 0.00 0.00 175.22 174.22 2ofn s ASP 56 N 3.18 3.76 0.17 1.36 2.15 -1.26 -4.82 116.67 121.22 2ofn s ASP 56 Ca 0.60 -2.53 0.01 0.00 0.43 0.00 0.00 52.55 51.05 2ofn s ASP 56 Cb -0.18 -1.07 -0.00 0.00 -0.30 0.00 0.00 42.92 41.37 2ofn s ASP 56 CO 0.25 -0.28 0.02 -1.20 -0.17 0.00 0.00 175.17 173.79 2ofn n SER 57 N 3.67 1.97 -0.03 -0.34 7.64 -1.26 -5.07 113.62 120.20 2ofn n SER 57 Ca 0.07 -1.82 -0.14 0.00 1.01 0.00 0.00 58.87 57.99 2ofn n SER 57 Cb 0.35 0.23 -0.10 0.00 -1.01 0.00 0.00 64.21 63.68 2ofn n SER 57 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2ofn h SER 58 N 0.51 0.26 0.08 6.43 0.02 -2.00 -3.40 113.55 115.44 2ofn h SER 58 Ca -0.14 -0.63 -0.37 0.00 -0.84 0.00 0.00 61.79 59.80 2ofn h SER 58 Cb 0.47 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.88 2ofn h SER 58 CO 0.23 0.85 -2.22 0.49 -1.14 0.00 0.00 176.83 175.04 2ofn n PHE 59 N -4.56 0.62 -0.27 3.45 3.72 -1.26 -4.31 117.46 114.86 2ofn n PHE 59 Ca -0.08 0.14 -0.02 0.00 -0.05 0.00 0.00 57.45 57.43 2ofn n PHE 59 Cb 0.43 -1.08 0.09 0.00 -0.94 0.00 0.00 39.48 37.98 2ofn n PHE 59 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 2ofn h ASP 60 N 0.03 0.76 -0.39 4.37 2.03 -1.78 0.14 116.42 121.58 2ofn h ASP 60 Ca -0.49 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.81 2ofn h ASP 60 Cb 1.98 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 40.32 2ofn h ASP 60 CO 0.00 0.51 0.00 -2.11 -1.03 0.00 0.00 179.24 176.62 2ofn n ARG 61 N -4.65 2.08 -0.10 4.15 -4.01 -1.26 -3.74 116.66 109.14 2ofn n ARG 61 Ca 0.09 -1.48 -0.21 0.00 -1.04 0.00 0.00 57.85 55.21 2ofn n ARG 61 Cb 0.11 -1.39 -0.07 0.00 -3.04 0.00 0.00 32.46 28.07 2ofn n ARG 61 CO 0.00 0.00 0.00 -1.71 -3.04 0.00 0.00 177.63 172.88 2ofn n ASN 62 N 0.63 1.37 -3.67 2.89 5.15 0.22 -5.02 115.26 116.84 2ofn n ASN 62 Ca 0.14 0.24 -0.11 0.00 -0.60 0.00 0.00 54.58 54.24 2ofn n ASN 62 Cb 0.39 -0.57 -0.11 0.00 -0.53 0.00 0.00 39.78 38.96 2ofn n ASN 62 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2ofn s VAL 63 N -2.36 -0.44 0.64 3.44 0.11 0.24 -5.12 120.40 116.91 2ofn s VAL 63 Ca -0.27 0.21 -0.15 0.00 -2.93 0.00 0.00 61.98 58.83 2ofn s VAL 63 Cb 0.10 -0.54 -0.01 0.00 -1.53 0.00 0.00 36.38 34.40 2ofn s VAL 63 CO 0.34 0.09 1.10 -2.84 -3.33 0.00 0.00 175.10 170.46 2ofn s PRO 64 N 2.30 2.96 0.24 1.54 0.02 -1.25 -4.40 135.00 136.41 2ofn s PRO 64 Ca -0.02 1.36 -0.04 0.00 0.02 0.00 0.00 61.00 62.32 2ofn s PRO 64 Cb -0.11 -1.97 -0.05 0.00 0.02 0.00 0.00 34.50 32.38 2ofn s PRO 64 CO -0.11 -1.12 0.48 0.12 -0.33 0.00 0.00 177.00 176.05 2ofn s PHE 65 N -2.33 3.48 0.23 6.54 5.36 -1.26 -5.03 117.98 124.96 2ofn s PHE 65 Ca 0.66 0.55 0.08 0.00 -0.96 0.00 0.00 56.93 57.26 2ofn s PHE 65 Cb -0.20 -2.02 -0.05 0.00 -0.34 0.00 0.00 43.02 40.41 2ofn s PHE 65 CO 0.40 0.27 -0.12 -1.59 -1.46 0.00 0.00 175.22 172.71 2ofn s LYS 66 N -3.35 1.41 0.32 10.12 -2.85 -1.26 -3.54 119.74 120.60 2ofn s LYS 66 Ca 0.42 -1.66 -0.11 0.00 -1.00 0.00 0.00 55.97 53.63 2ofn s LYS 66 Cb -0.11 -1.16 0.02 0.00 -2.06 0.00 0.00 37.83 34.52 2ofn s LYS 66 CO 0.29 0.15 0.59 -0.59 0.10 0.00 0.00 175.35 175.88 2ofn s PHE 67 N -2.96 0.48 0.13 1.78 -0.71 -1.09 -5.02 117.98 110.59 2ofn s PHE 67 Ca 0.25 -0.89 0.10 0.00 -1.04 0.00 0.00 56.93 55.35 2ofn s PHE 67 Cb 0.00 0.33 -0.04 0.00 -1.21 0.00 0.00 43.02 42.11 2ofn s PHE 67 CO 0.09 -1.23 -0.23 -1.01 -1.34 0.00 0.00 175.22 171.50 2ofn s HIS 68 N -3.20 2.41 0.10 3.49 3.76 -1.26 -3.21 115.29 117.38 2ofn s HIS 68 Ca 0.22 -0.33 -0.31 0.00 -0.15 0.00 0.00 55.06 54.49 2ofn s HIS 68 Cb -0.02 -1.28 -0.08 0.00 1.11 0.00 0.00 32.58 32.30 2ofn s HIS 68 CO 0.13 0.38 1.55 -1.17 -0.85 0.00 0.00 174.74 174.78 2ofn s LEU 69 N -2.18 4.36 -1.45 0.89 2.96 -1.26 -2.23 118.68 119.77 2ofn s LEU 69 Ca 0.17 2.45 -0.12 0.00 -0.22 0.00 0.00 54.13 56.40 2ofn s LEU 69 Cb -0.10 -3.58 0.09 0.00 0.50 0.00 0.00 46.19 43.10 2ofn s LEU 69 CO 0.08 -0.81 0.69 -0.62 -1.32 0.00 0.00 176.35 174.38 2ofn n GLU 70 N 4.79 -4.02 0.00 1.98 1.02 -1.26 -4.55 120.64 118.60 2ofn n GLU 70 Ca 0.14 0.51 0.09 0.00 -0.02 0.00 0.00 57.16 57.88 2ofn n GLU 70 Cb 0.41 -5.29 0.45 0.00 -0.02 0.00 0.00 31.44 26.99 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 -4.13 0.24 0.00 3.49 7.27 -0.95 -4.85 117.38 118.45 2ofn n GLN 71 Ca 0.01 0.12 0.00 0.00 0.07 0.00 0.00 57.00 57.20 2ofn n GLN 71 Cb 0.53 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.68 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 0.28 3.13 0.09 1.69 0.00 -1.26 -4.82 105.19 104.30 2ofn n GLY 72 Ca 0.08 0.00 0.12 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 -2.00 0.51 -4.36 1.61 -0.58 -1.26 -4.79 120.64 109.77 2ofn n GLU 73 Ca 0.00 0.10 -0.28 0.00 -0.42 0.00 0.00 57.16 56.56 2ofn n GLU 73 Cb 0.00 -1.77 -0.17 0.00 -0.57 0.00 0.00 31.44 28.93 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 -3.31 1.35 -0.17 2.62 -7.23 -1.26 -5.01 120.40 107.39 2ofn s VAL 74 Ca 0.01 -0.55 -0.15 0.00 -1.81 0.00 0.00 61.98 59.49 2ofn s VAL 74 Cb 0.11 -1.26 -0.06 0.00 0.56 0.00 0.00 36.38 35.73 2ofn s VAL 74 CO 0.78 0.41 -0.26 2.30 -0.31 0.00 0.00 175.10 178.02 2ofn n ILE 75 N 4.29 1.47 0.01 -0.62 -0.00 -1.26 -4.15 119.36 119.09 2ofn n ILE 75 Ca -0.19 0.13 0.00 0.00 -0.00 0.00 0.00 62.75 62.69 2ofn n ILE 75 Cb 0.51 -2.32 0.00 0.00 -0.00 0.00 0.00 39.64 37.83 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 -4.50 0.00 -0.02 6.28 4.76 -1.22 -4.59 118.16 118.87 2ofn n LYS 76 Ca -0.15 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.20 2ofn n LYS 76 Cb 0.46 -0.05 -0.02 0.00 -1.84 0.00 0.00 35.03 33.57 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 -0.11 1.69 0.72 0.00 -1.39 -1.37 103.07 102.61 2ofn h GLY 77 Ca 0.00 0.24 -0.21 0.00 0.00 0.00 0.00 47.33 47.36 2ofn h GLY 77 CO 0.00 -0.18 -0.90 1.49 0.00 0.00 0.00 176.54 176.96 2ofn h TRP 78 N -0.22 0.42 -0.24 5.60 6.55 -1.91 -3.18 115.95 122.97 2ofn h TRP 78 Ca 0.12 -0.23 0.06 0.00 0.95 0.00 0.00 58.89 59.79 2ofn h TRP 78 Cb 0.39 -0.05 -0.06 0.00 -0.86 0.00 0.00 29.16 28.58 2ofn h TRP 78 CO -0.33 1.04 -0.16 0.22 -1.05 0.00 0.00 178.44 178.16 2ofn h ASP 79 N 0.16 -0.52 -0.10 -3.49 3.58 -1.61 0.47 116.42 114.89 2ofn h ASP 79 Ca -0.06 0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 2ofn h ASP 79 Cb 1.53 0.27 -0.00 0.00 1.72 0.00 0.00 39.33 42.84 2ofn h ASP 79 CO 0.14 -0.20 0.01 0.40 -2.88 0.00 0.00 179.24 176.71 2ofn h ILE 80 N -0.15 1.24 -0.17 2.25 5.03 -1.39 -2.80 117.51 121.51 2ofn h ILE 80 Ca 0.13 -0.76 0.00 0.00 -0.12 0.00 0.00 64.86 64.12 2ofn h ILE 80 Cb 0.35 1.54 -0.01 0.00 -3.03 0.00 0.00 36.82 35.67 2ofn h ILE 80 CO -0.33 0.22 0.11 0.00 -0.68 0.00 0.00 178.15 177.47 2ofn h VAL 82 N 0.21 1.33 0.00 0.00 -1.51 -1.01 -2.49 116.25 112.79 2ofn h VAL 82 Ca 0.06 -1.69 0.00 0.00 -1.23 0.00 0.00 66.70 63.84 2ofn h VAL 82 Cb 0.01 1.77 0.00 0.00 -2.13 0.00 0.00 31.29 30.94 2ofn h VAL 82 CO -0.01 0.51 0.00 -0.24 -1.23 0.00 0.00 177.57 176.60 2ofn n SER 83 N -3.97 0.00 -0.68 4.19 2.88 -1.01 -2.62 113.62 112.41 2ofn n SER 83 Ca -0.02 -0.98 0.06 0.00 -1.33 0.00 0.00 58.87 56.60 2ofn n SER 83 Cb 0.54 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 64.16 2ofn n SER 83 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2ofn n SER 84 N -0.99 3.02 -3.03 -3.46 7.64 -0.89 -4.78 113.62 111.14 2ofn n SER 84 Ca 0.22 -2.06 -0.07 0.00 1.01 0.00 0.00 58.87 57.97 2ofn n SER 84 Cb 0.10 -0.26 0.02 0.00 -1.01 0.00 0.00 64.21 63.06 2ofn n SER 84 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2ofn n MET 85 N 0.49 0.94 -3.67 1.43 2.81 -1.08 -5.04 117.12 113.00 2ofn n MET 85 Ca 0.13 -1.13 -0.15 0.00 -1.81 0.00 0.00 57.70 54.74 2ofn n MET 85 Cb 0.46 -0.04 -0.06 0.00 -0.71 0.00 0.00 33.22 32.88 2ofn n MET 85 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2ofn n ARG 86 N -1.33 0.34 0.26 0.03 1.74 -1.25 -4.27 116.66 112.18 2ofn n ARG 86 Ca 0.04 -2.50 0.13 0.00 -0.77 0.00 0.00 57.85 54.75 2ofn n ARG 86 Cb 0.21 2.09 0.69 0.00 -1.02 0.00 0.00 32.46 34.43 2ofn n ARG 86 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2ofn h LYS 87 N 0.00 0.00 0.00 5.56 3.64 -1.84 -2.95 116.57 120.98 2ofn h LYS 87 Ca -0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 2ofn h LYS 87 Cb 0.92 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 2ofn h LYS 87 CO 0.26 0.12 -0.13 0.09 -2.27 0.00 0.00 179.45 177.52 2ofn n ASN 88 N -3.44 1.52 -4.44 4.20 3.02 -1.26 -4.72 115.26 110.14 2ofn n ASN 88 Ca -0.01 -2.51 -0.33 0.00 -0.03 0.00 0.00 54.58 51.70 2ofn n ASN 88 Cb 0.29 -0.28 -0.13 0.00 -0.61 0.00 0.00 39.78 39.04 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 -1.66 3.33 -0.02 3.52 2.12 -1.11 -4.47 118.70 120.41 2ofn s GLU 89 Ca 0.17 -0.62 0.02 0.00 0.36 0.00 0.00 54.97 54.89 2ofn s GLU 89 Cb 0.15 -2.69 0.01 0.00 0.26 0.00 0.00 34.13 31.86 2ofn s GLU 89 CO 0.02 0.30 -0.05 0.21 -0.54 0.00 0.00 175.26 175.20 2ofn s LYS 90 N 0.14 0.64 0.26 4.30 2.36 0.17 -3.79 119.74 123.83 2ofn s LYS 90 Ca -0.05 -0.16 0.02 0.00 -2.55 0.00 0.00 55.97 53.23 2ofn s LYS 90 Cb -0.14 -0.64 -0.04 0.00 -1.05 0.00 0.00 37.83 35.95 2ofn s LYS 90 CO 0.04 0.03 0.15 0.00 1.55 0.00 0.00 175.35 177.12 2ofn s LEU 92 N -3.29 2.12 0.00 0.00 0.20 0.97 -1.46 118.68 117.23 2ofn s LEU 92 Ca 0.38 -0.45 0.08 0.00 0.69 0.00 0.00 54.13 54.83 2ofn s LEU 92 Cb 0.06 -1.36 -0.02 0.00 -0.43 0.00 0.00 46.19 44.44 2ofn s LEU 92 CO 0.16 0.32 -0.24 0.54 -0.29 0.00 0.00 176.35 176.84 2ofn s VAL 93 N -0.63 1.94 -0.39 1.68 0.11 -0.58 0.12 120.40 122.65 2ofn s VAL 93 Ca 0.10 -1.14 -0.15 0.00 -2.93 0.00 0.00 61.98 57.86 2ofn s VAL 93 Cb -0.10 -1.63 0.01 0.00 -1.53 0.00 0.00 36.38 33.13 2ofn s VAL 93 CO -0.01 0.46 0.33 -0.13 -3.33 0.00 0.00 175.10 172.42 2ofn s ARG 94 N -0.80 3.17 -0.44 1.54 3.00 -0.33 -2.81 118.95 122.28 2ofn s ARG 94 Ca 0.10 -0.82 -0.20 0.00 0.00 0.00 0.00 55.73 54.82 2ofn s ARG 94 Cb -0.09 -3.92 0.03 0.00 0.00 0.00 0.00 34.95 30.96 2ofn s ARG 94 CO 0.00 -0.69 0.58 0.42 0.00 0.00 0.00 175.30 175.61 2ofn s ILE 95 N 1.84 4.90 0.64 1.52 1.09 -1.19 -4.38 121.20 125.62 2ofn s ILE 95 Ca 0.08 -0.07 -0.07 0.00 -1.10 0.00 0.00 60.65 59.49 2ofn s ILE 95 Cb -0.18 -4.17 0.02 0.00 -1.06 0.00 0.00 42.46 37.08 2ofn s ILE 95 CO 0.11 -0.57 0.97 -0.70 -0.10 0.00 0.00 174.94 174.65 2ofn s GLU 96 N 2.61 2.72 0.30 2.79 2.12 -1.26 -3.04 118.70 124.94 2ofn s GLU 96 Ca 0.19 0.02 0.05 0.00 0.36 0.00 0.00 54.97 55.59 2ofn s GLU 96 Cb -0.15 -2.20 0.71 0.00 0.26 0.00 0.00 34.13 32.75 2ofn s GLU 96 CO 0.17 -0.90 1.77 0.66 -0.54 0.00 0.00 175.26 176.41 2ofn h SER 97 N -0.38 0.70 1.40 -1.70 4.64 -1.80 1.00 113.55 117.41 2ofn h SER 97 Ca -0.45 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2ofn h SER 97 Cb 1.27 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2ofn h SER 97 CO 0.61 0.24 0.00 0.00 -0.87 0.00 0.00 176.83 176.81 2ofn h MET 98 N 0.70 0.00 0.00 4.77 -0.00 -1.96 -2.98 114.93 115.47 2ofn h MET 98 Ca 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.26 2ofn h MET 98 Cb 0.88 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.48 2ofn h MET 98 CO -0.39 0.00 -1.03 0.66 -0.00 0.00 0.00 176.91 176.14 2ofn n TYR 99 N -2.50 0.45 -2.78 -0.10 4.01 0.28 -4.92 117.16 111.61 2ofn n TYR 99 Ca 0.04 0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 2ofn n TYR 99 Cb 0.40 -0.60 0.00 0.00 -0.31 0.00 0.00 39.34 38.84 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 1.31 6.41 1.88 2.72 0.00 -0.82 -0.93 105.19 115.76 2ofn n GLY 100 Ca 0.01 -2.03 -0.16 0.00 0.00 0.00 0.00 46.02 43.83 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 2.21 0.23 1.61 4.01 -1.26 -4.45 117.16 119.50 2ofn n TYR 101 Ca 0.00 -1.44 0.07 0.00 -0.16 0.00 0.00 57.90 56.37 2ofn n TYR 101 Cb 0.00 -0.74 0.55 0.00 -0.31 0.00 0.00 39.34 38.84 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 1.93 0.00 1.85 2.72 0.00 -1.74 0.21 103.07 108.04 2ofn h GLY 102 Ca 0.44 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.65 2ofn h GLY 102 CO 0.79 0.00 -0.53 -0.55 0.00 0.00 0.00 176.54 176.24 2ofn h ASP 103 N 0.00 0.18 0.50 0.19 3.32 -1.78 -3.22 116.42 115.61 2ofn h ASP 103 Ca -0.00 -0.09 -0.29 0.00 0.02 0.00 0.00 57.03 56.66 2ofn h ASP 103 Cb 0.34 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.80 2ofn h ASP 103 CO 0.02 0.68 -1.64 -0.08 -1.72 0.00 0.00 179.24 176.50 2ofn h GLU 104 N 0.13 0.07 0.00 3.56 4.81 -1.58 -3.48 114.58 118.08 2ofn h GLU 104 Ca 0.00 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2ofn h GLU 104 Cb 0.98 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.41 2ofn h GLU 104 CO 0.08 0.73 0.00 0.41 -0.73 0.00 0.00 179.01 179.50 2ofn n GLY 105 N 1.60 0.53 3.84 1.92 0.00 0.61 -5.08 105.19 108.61 2ofn n GLY 105 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.01 -0.32 -0.00 0.00 0.00 -1.26 -4.40 107.32 99.33 2ofn s GLY 107 Ca 0.48 0.45 -0.00 0.00 0.00 0.00 0.00 44.72 45.65 2ofn s GLY 107 CO 0.19 0.08 -0.00 0.83 0.00 0.00 0.00 173.10 174.20 2ofn h GLU 108 N 2.00 0.00 0.00 2.90 4.39 -2.01 -3.47 114.58 118.39 2ofn h GLU 108 Ca -0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.44 2ofn h GLU 108 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2ofn h GLU 108 CO 0.27 0.00 0.00 0.43 -1.16 0.00 0.00 179.01 178.55 2ofn n SER 109 N -2.15 0.00 -3.46 1.42 7.64 -1.26 -4.97 113.62 110.84 2ofn n SER 109 Ca -0.00 0.15 -0.20 0.00 1.01 0.00 0.00 58.87 59.83 2ofn n SER 109 Cb 0.00 -0.33 -0.12 0.00 -1.01 0.00 0.00 64.21 62.76 2ofn n SER 109 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2ofn s ILE 110 N -0.66 -0.31 0.00 0.44 -0.00 -1.26 -5.07 121.20 114.34 2ofn s ILE 110 Ca 0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 60.65 60.24 2ofn s ILE 110 Cb 0.00 -0.88 0.00 0.00 -0.00 0.00 0.00 42.46 41.58 2ofn s ILE 110 CO 0.00 -0.43 0.00 -0.81 -0.00 0.00 0.00 174.94 173.70 2ofn n PRO 111 N 5.30 0.00 0.00 0.37 -0.04 -1.26 -5.00 135.00 134.38 2ofn n PRO 111 Ca -0.04 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 2ofn n PRO 111 Cb 0.47 -0.79 0.00 0.00 -0.04 0.00 0.00 33.50 33.13 2ofn n PRO 111 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ofn n GLY 112 N 2.20 2.91 0.48 0.55 0.00 -1.26 -3.60 105.19 106.47 2ofn n GLY 112 Ca 0.00 -0.31 0.03 0.00 0.00 0.00 0.00 46.02 45.75 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 3.43 0.81 -4.96 1.61 4.13 -1.26 -4.55 115.26 114.47 2ofn n ASN 113 Ca 0.00 -2.38 -0.24 0.00 1.68 0.00 0.00 54.58 53.64 2ofn n ASN 113 Cb 0.00 -0.29 0.03 0.00 -1.54 0.00 0.00 39.78 37.98 2ofn n ASN 113 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2ofn s SER 114 N -1.71 4.80 -0.09 6.41 0.01 -1.24 -4.54 113.70 117.35 2ofn s SER 114 Ca 0.14 -1.11 -0.10 0.00 1.31 0.00 0.00 55.95 56.18 2ofn s SER 114 Cb 0.13 0.44 -0.05 0.00 0.21 0.00 0.00 66.02 66.75 2ofn s SER 114 CO -0.01 -1.24 0.24 0.54 0.41 0.00 0.00 173.24 173.17 2ofn s VAL 115 N -2.75 5.33 0.36 3.43 0.11 -1.26 -4.28 120.40 121.35 2ofn s VAL 115 Ca 0.45 0.44 0.08 0.00 -2.93 0.00 0.00 61.98 60.02 2ofn s VAL 115 Cb -0.04 -3.52 -0.07 0.00 -1.53 0.00 0.00 36.38 31.22 2ofn s VAL 115 CO 0.28 0.58 -0.05 -0.76 -3.33 0.00 0.00 175.10 171.82 2ofn s LEU 116 N -0.84 2.76 -0.29 2.54 1.02 -1.17 -2.31 118.68 120.40 2ofn s LEU 116 Ca 0.18 -1.26 -0.00 0.00 0.02 0.00 0.00 54.13 53.06 2ofn s LEU 116 Cb -0.14 -0.94 0.05 0.00 0.02 0.00 0.00 46.19 45.19 2ofn s LEU 116 CO 0.07 -0.30 -0.03 -0.76 0.02 0.00 0.00 176.35 175.34 2ofn s LEU 117 N -3.63 3.74 -0.16 1.79 1.43 0.74 -3.19 118.68 119.41 2ofn s LEU 117 Ca 0.33 -1.29 0.01 0.00 -1.03 0.00 0.00 54.13 52.15 2ofn s LEU 117 Cb 0.05 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.61 2ofn s LEU 117 CO 0.17 -0.24 -0.17 -0.36 0.23 0.00 0.00 176.35 175.98 2ofn s PHE 118 N 1.22 2.75 -0.17 0.29 0.08 -1.12 -1.67 117.98 119.35 2ofn s PHE 118 Ca -0.06 -1.19 -0.18 0.00 0.12 0.00 0.00 56.93 55.62 2ofn s PHE 118 Cb -0.20 -1.88 -0.04 0.00 -0.57 0.00 0.00 43.02 40.34 2ofn s PHE 118 CO -0.02 -0.55 0.49 -1.21 -0.10 0.00 0.00 175.22 173.82 2ofn s GLU 119 N 0.89 4.24 -0.09 0.44 2.02 0.10 -1.52 118.70 124.79 2ofn s GLU 119 Ca -0.04 0.40 0.05 0.00 0.02 0.00 0.00 54.97 55.39 2ofn s GLU 119 Cb -0.15 -3.52 -0.00 0.00 0.10 0.00 0.00 34.13 30.56 2ofn s GLU 119 CO -0.02 -0.03 -0.24 0.42 0.02 0.00 0.00 175.26 175.40 2ofn s ILE 120 N 1.26 2.05 0.01 -1.63 1.01 -0.53 -2.94 121.20 120.43 2ofn s ILE 120 Ca 0.24 -1.03 0.02 0.00 0.00 0.00 0.00 60.65 59.88 2ofn s ILE 120 Cb -0.15 -1.76 -0.01 0.00 0.01 0.00 0.00 42.46 40.54 2ofn s ILE 120 CO 0.10 0.56 -0.06 -0.70 0.00 0.00 0.00 174.94 174.84 2ofn s GLU 121 N 0.19 0.44 -0.28 2.79 2.12 -1.24 -2.48 118.70 120.24 2ofn s GLU 121 Ca -0.14 -0.38 -0.19 0.00 0.36 0.00 0.00 54.97 54.61 2ofn s GLU 121 Cb -0.17 -0.34 -0.02 0.00 0.26 0.00 0.00 34.13 33.87 2ofn s GLU 121 CO 0.07 0.08 0.59 -1.17 -0.54 0.00 0.00 175.26 174.29 2ofn s LEU 122 N -0.65 4.10 -0.10 2.70 2.96 -1.26 -3.63 118.68 122.80 2ofn s LEU 122 Ca -0.03 0.51 0.12 0.00 -0.22 0.00 0.00 54.13 54.51 2ofn s LEU 122 Cb -0.05 -2.77 -0.17 0.00 0.50 0.00 0.00 46.19 43.71 2ofn s LEU 122 CO -0.00 -0.39 0.10 0.00 -1.32 0.00 0.00 176.35 174.74 2ofn n LEU 123 N 5.72 0.00 -3.71 -0.68 -0.00 -1.18 -4.65 117.00 112.50 2ofn n LEU 123 Ca -0.02 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.85 2ofn n LEU 123 Cb 0.49 0.25 -0.08 0.00 -0.00 0.00 0.00 43.42 44.08 2ofn n LEU 123 CO 0.43 0.25 0.11 -0.44 -0.00 0.00 0.00 177.39 177.74 2ofn s SER 124 N -4.37 -0.29 0.01 1.45 0.01 -1.10 -5.05 113.70 104.37 2ofn s SER 124 Ca -0.06 0.23 -0.28 0.00 1.31 0.00 0.00 55.95 57.15 2ofn s SER 124 Cb 0.05 0.37 0.10 0.00 0.21 0.00 0.00 66.02 66.74 2ofn s SER 124 CO 0.54 -0.47 0.83 0.72 0.41 0.00 0.00 173.24 175.26 2ofn s PHE 125 N -1.27 -0.40 -0.12 2.43 -0.71 -1.26 0.11 117.98 116.75 2ofn s PHE 125 Ca -0.13 0.33 0.01 0.00 -1.04 0.00 0.00 56.93 56.10 2ofn s PHE 125 Cb -0.04 0.53 0.02 0.00 -1.21 0.00 0.00 43.02 42.31 2ofn s PHE 125 CO 0.05 -0.59 -0.14 1.03 -1.34 0.00 0.00 175.22 174.23 2ofn s ARG 126 N -2.95 2.18 -0.33 1.99 0.52 -1.17 -4.98 118.95 114.21 2ofn s ARG 126 Ca 0.03 -0.53 -0.11 0.00 -0.52 0.00 0.00 55.73 54.59 2ofn s ARG 126 Cb -0.01 -1.92 -0.00 0.00 0.52 0.00 0.00 34.95 33.54 2ofn s ARG 126 CO -0.08 -0.13 0.19 -1.21 0.02 0.00 0.00 175.30 174.09 2ofn s GLU 127 N 1.19 3.27 0.05 3.54 2.02 -1.26 -4.52 118.70 122.99 2ofn s GLU 127 Ca -0.02 -0.77 0.03 0.00 0.02 0.00 0.00 54.97 54.22 2ofn s GLU 127 Cb -0.14 -3.67 -0.03 0.00 0.10 0.00 0.00 34.13 30.39 2ofn s GLU 127 CO -0.05 -0.49 -0.10 -1.17 0.02 0.00 0.00 175.26 173.48 2ofn s LEU 128 N 1.63 2.27 -0.18 1.80 2.96 -1.26 -5.14 118.68 120.76 2ofn s LEU 128 Ca 0.05 -0.58 -0.08 0.00 -0.22 0.00 0.00 54.13 53.30 2ofn s LEU 128 Cb -0.18 -0.27 -0.04 0.00 0.50 0.00 0.00 46.19 46.20 2ofn s LEU 128 CO 0.08 -0.17 0.08 -0.70 -1.32 0.00 0.00 176.35 174.31 2ofn s GLU 129 N -1.68 3.99 -0.39 1.98 2.12 -1.26 -4.99 118.70 118.47 2ofn s GLU 129 Ca -0.07 -0.31 -0.26 0.00 0.36 0.00 0.00 54.97 54.70 2ofn s GLU 129 Cb -0.10 -3.26 0.02 0.00 0.26 0.00 0.00 34.13 31.05 2ofn s GLU 129 CO 0.01 0.31 0.92 -1.58 -0.54 0.00 0.00 175.26 174.38 2ofn s HIS 130 N 0.29 3.04 0.21 5.30 5.65 -1.26 -5.03 115.29 123.49 2ofn s HIS 130 Ca 0.05 0.67 0.08 0.00 0.25 0.00 0.00 55.06 56.11 2ofn s HIS 130 Cb -0.12 -3.72 -0.04 0.00 -1.18 0.00 0.00 32.58 27.52 2ofn s HIS 130 CO -0.00 -0.89 -0.01 -1.01 -0.65 0.00 0.00 174.74 172.18 2ofn s HIS 131 N 3.53 2.77 0.39 3.88 3.76 -1.26 -5.14 115.29 123.22 2ofn s HIS 131 Ca 0.38 -0.18 0.08 0.00 -0.15 0.00 0.00 55.06 55.19 2ofn s HIS 131 Cb -0.11 -1.31 -0.04 0.00 1.11 0.00 0.00 32.58 32.23 2ofn s HIS 131 CO 0.21 0.55 0.20 -1.01 -0.85 0.00 0.00 174.74 173.84 2ofn s HIS 132 N -1.93 2.66 -0.08 1.40 3.76 -1.26 -5.15 115.29 114.69 2ofn s HIS 132 Ca 0.28 -0.50 -0.03 0.00 -0.15 0.00 0.00 55.06 54.66 2ofn s HIS 132 Cb -0.08 -1.89 0.05 0.00 1.11 0.00 0.00 32.58 31.77 2ofn s HIS 132 CO 0.19 0.19 0.17 -1.58 -0.85 0.00 0.00 174.74 172.85 2ofn s HIS 133 N -2.52 -0.20 0.29 1.40 2.46 -1.26 -5.15 115.29 110.31 2ofn s HIS 133 Ca 0.41 0.60 0.06 0.00 0.47 0.00 0.00 55.06 56.60 2ofn s HIS 133 Cb 0.00 -0.17 -0.02 0.00 -0.13 0.00 0.00 32.58 32.26 2ofn s HIS 133 CO 0.23 -0.24 0.21 -2.39 -2.47 0.00 0.00 174.74 170.09 2ofn n HIS 134 N 4.90 -0.51 0.39 3.88 1.44 -1.26 -5.39 115.22 118.67 2ofn n HIS 134 Ca -0.13 -2.33 0.03 0.00 -2.01 0.00 0.00 57.72 53.28 2ofn n HIS 134 Cb 0.51 0.20 0.19 0.00 0.12 0.00 0.00 29.99 31.00 2ofn n HIS 134 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11