#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fn0 s ASP 5 N 0.00 7.25 0.72 -2.24 2.15 -1.26 -4.95 116.67 118.34 1fn0 s ASP 5 Ca 0.00 -3.43 -0.15 0.00 0.43 0.00 0.00 52.55 49.40 1fn0 s ASP 5 Cb 0.00 -2.24 0.04 0.00 -0.30 0.00 0.00 42.92 40.41 1fn0 s ASP 5 CO 0.00 -0.39 1.20 -1.81 -0.17 0.00 0.00 175.17 174.00 1fn0 s ASP 6 N 1.64 4.28 0.30 -0.34 1.01 -1.26 -3.00 116.67 119.31 1fn0 s ASP 6 Ca 0.32 2.31 -0.29 0.00 0.71 0.00 0.00 52.55 55.60 1fn0 s ASP 6 Cb -0.09 -2.58 -0.10 0.00 1.01 0.00 0.00 42.92 41.15 1fn0 s ASP 6 CO -0.07 -2.20 1.44 -0.76 0.21 0.00 0.00 175.17 173.79 1fn0 s LEU 7 N -5.13 4.38 0.01 1.23 1.43 -0.54 -4.89 118.68 115.16 1fn0 s LEU 7 Ca 0.73 2.80 0.08 0.00 -1.03 0.00 0.00 54.13 56.71 1fn0 s LEU 7 Cb -0.28 -3.64 -0.02 0.00 0.03 0.00 0.00 46.19 42.27 1fn0 s LEU 7 CO 0.45 -0.72 -0.25 -0.69 0.23 0.00 0.00 176.35 175.36 1fn0 s VAL 8 N -0.55 2.16 0.88 -1.59 1.01 -1.26 -0.94 120.40 120.11 1fn0 s VAL 8 Ca 0.56 -1.22 -0.11 0.00 0.00 0.00 0.00 61.98 61.21 1fn0 s VAL 8 Cb -0.43 -1.80 0.17 0.00 0.00 0.00 0.00 36.38 34.32 1fn0 s VAL 8 CO 0.51 0.48 1.22 1.51 0.00 0.00 0.00 175.10 178.81 1fn0 s ASP 9 N -0.92 3.56 0.30 3.32 3.84 0.29 -4.72 116.67 122.34 1fn0 s ASP 9 Ca 0.11 0.11 0.25 0.00 -0.00 0.00 0.00 52.55 53.02 1fn0 s ASP 9 Cb -0.10 -0.28 1.07 0.00 -1.38 0.00 0.00 42.92 42.23 1fn0 s ASP 9 CO 0.01 -2.43 1.74 0.00 -0.00 0.00 0.00 175.17 174.49 1fn0 h ALA 10 N -1.28 1.00 -0.61 2.11 0.00 -0.61 -2.04 119.26 117.83 1fn0 h ALA 10 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1fn0 h ALA 10 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1fn0 h ALA 10 CO 0.40 0.00 0.00 0.39 0.00 0.00 0.00 179.25 180.04 1fn0 n GLU 11 N -2.34 2.79 -0.60 0.00 1.02 -1.26 -4.88 120.64 115.37 1fn0 n GLU 11 Ca 0.01 -2.48 0.00 0.00 -0.02 0.00 0.00 57.16 54.68 1fn0 n GLU 11 Cb 0.21 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 1fn0 n GLU 11 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1fn0 n GLY 12 N 1.29 0.73 3.82 0.62 0.00 -0.77 -5.06 105.19 105.82 1fn0 n GLY 12 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1fn0 n GLY 12 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fn0 s ASN 13 N -2.33 5.86 0.33 1.61 0.01 -1.26 -4.81 114.94 114.36 1fn0 s ASN 13 Ca 0.00 0.17 -0.28 0.00 -0.71 0.00 0.00 52.86 52.03 1fn0 s ASN 13 Cb 0.00 -1.71 -0.12 0.00 0.41 0.00 0.00 41.25 39.83 1fn0 s ASN 13 CO 0.00 0.24 1.33 0.18 -1.51 0.00 0.00 177.10 177.34 1fn0 n LEU 14 N 0.87 3.67 -4.72 0.60 4.77 -1.26 -0.55 117.00 120.38 1fn0 n LEU 14 Ca -0.11 1.20 -0.42 0.00 -0.03 0.00 0.00 56.01 56.66 1fn0 n LEU 14 Cb 0.52 -1.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.08 1fn0 n LEU 14 CO 0.42 -0.39 0.97 -0.69 -1.33 0.00 0.00 177.39 176.37 1fn0 s VAL 15 N -0.96 3.63 0.00 4.08 1.01 -0.12 -4.75 120.40 123.30 1fn0 s VAL 15 Ca 0.57 1.19 -0.23 0.00 0.00 0.00 0.00 61.98 63.51 1fn0 s VAL 15 Cb -0.56 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.00 1fn0 s VAL 15 CO 0.61 0.11 0.69 -1.61 0.00 0.00 0.00 175.10 174.89 1fn0 s GLU 16 N 0.90 4.42 0.10 2.72 2.02 -1.26 -3.81 118.70 123.79 1fn0 s GLU 16 Ca 0.61 0.91 -0.31 0.00 0.02 0.00 0.00 54.97 56.19 1fn0 s GLU 16 Cb -0.33 -3.37 -0.07 0.00 0.10 0.00 0.00 34.13 30.45 1fn0 s GLU 16 CO 0.31 0.27 1.30 0.34 0.02 0.00 0.00 175.26 177.49 1fn0 s ASP 17 N 0.08 6.95 0.00 -0.19 -1.08 -0.30 -1.40 116.67 120.73 1fn0 s ASP 17 Ca 0.36 2.19 0.00 0.00 -0.52 0.00 0.00 52.55 54.58 1fn0 s ASP 17 Cb -0.19 -2.58 0.00 0.00 -1.46 0.00 0.00 42.92 38.68 1fn0 s ASP 17 CO 0.20 -0.56 0.00 0.61 0.52 0.00 0.00 175.17 175.94 1fn0 n GLY 18 N 3.28 0.89 3.89 2.66 0.00 0.14 -4.93 105.19 111.12 1fn0 n GLY 18 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1fn0 n GLY 18 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fn0 s GLY 19 N -1.89 1.57 -0.13 -0.02 0.00 -0.49 -4.74 107.32 101.63 1fn0 s GLY 19 Ca 0.00 -0.39 -0.07 0.00 0.00 0.00 0.00 44.72 44.26 1fn0 s GLY 19 CO 0.00 -0.16 0.12 -0.51 0.00 0.00 0.00 173.10 172.55 1fn0 s THR 20 N -2.96 5.33 0.01 0.90 -4.23 -1.26 -2.11 115.64 111.33 1fn0 s THR 20 Ca 0.52 0.15 -0.04 0.00 -1.18 0.00 0.00 61.69 61.14 1fn0 s THR 20 Cb -0.11 -3.34 -0.01 0.00 1.34 0.00 0.00 72.50 70.39 1fn0 s THR 20 CO 0.48 0.58 0.05 -0.31 -0.54 0.00 0.00 174.62 174.89 1fn0 s TYR 21 N -0.74 0.17 0.13 3.99 1.51 0.38 -0.77 117.35 122.03 1fn0 s TYR 21 Ca 0.13 -0.37 -0.23 0.00 -1.01 0.00 0.00 57.07 55.59 1fn0 s TYR 21 Cb -0.12 -0.13 -0.07 0.00 -0.11 0.00 0.00 41.96 41.53 1fn0 s TYR 21 CO 0.03 -0.25 0.71 0.71 -1.11 0.00 0.00 175.55 175.64 1fn0 s TYR 22 N -1.55 3.87 -0.66 2.71 1.51 0.10 -0.30 117.35 123.02 1fn0 s TYR 22 Ca -0.14 1.51 -0.13 0.00 -1.01 0.00 0.00 57.07 57.29 1fn0 s TYR 22 Cb -0.08 -2.69 0.17 0.00 -0.11 0.00 0.00 41.96 39.25 1fn0 s TYR 22 CO -0.00 0.52 0.59 -0.51 -1.11 0.00 0.00 175.55 175.05 1fn0 s LEU 23 N -1.07 6.31 0.00 -1.29 1.02 -1.26 -1.40 118.68 121.00 1fn0 s LEU 23 Ca 0.34 -2.28 0.00 0.00 0.02 0.00 0.00 54.13 52.21 1fn0 s LEU 23 Cb -0.22 -2.16 -0.04 0.00 0.02 0.00 0.00 46.19 43.79 1fn0 s LEU 23 CO 0.24 -0.68 0.06 -0.76 0.02 0.00 0.00 176.35 175.23 1fn0 s LEU 24 N 0.82 3.81 0.52 1.79 1.43 -0.77 -3.81 118.68 122.47 1fn0 s LEU 24 Ca 0.11 0.10 -0.21 0.00 -1.03 0.00 0.00 54.13 53.09 1fn0 s LEU 24 Cb -0.20 -2.24 -0.06 0.00 0.03 0.00 0.00 46.19 43.73 1fn0 s LEU 24 CO -0.03 0.26 1.23 -2.16 0.23 0.00 0.00 176.35 175.88 1fn0 s PRO 25 N -1.77 3.34 0.08 1.29 0.04 -1.26 -0.90 135.00 135.82 1fn0 s PRO 25 Ca 0.23 1.92 -0.28 0.00 0.04 0.00 0.00 61.00 62.91 1fn0 s PRO 25 Cb -0.12 -2.21 -0.17 0.00 0.04 0.00 0.00 34.50 32.04 1fn0 s PRO 25 CO 0.14 -0.93 1.68 1.25 0.04 0.00 0.00 177.00 179.18 1fn0 h HIS 26 N 1.52 -0.39 -3.30 0.56 -0.00 -1.54 -3.41 115.15 108.59 1fn0 h HIS 26 Ca -0.50 -0.01 -0.58 0.00 -0.00 0.00 0.00 60.37 59.28 1fn0 h HIS 26 Cb 1.28 0.13 -0.07 0.00 -0.00 0.00 0.00 27.41 28.74 1fn0 h HIS 26 CO 0.49 -0.24 0.40 0.42 -0.00 0.00 0.00 177.93 179.01 1fn0 s ILE 27 N -6.11 4.87 0.16 6.26 -1.09 -1.26 -4.94 121.20 119.09 1fn0 s ILE 27 Ca -0.15 1.61 -0.20 0.00 -2.23 0.00 0.00 60.65 59.67 1fn0 s ILE 27 Cb 0.05 -4.13 0.06 0.00 -1.58 0.00 0.00 42.46 36.86 1fn0 s ILE 27 CO 0.64 0.00 1.64 -0.50 -1.23 0.00 0.00 174.94 175.50 1fn0 h TRP 28 N 7.42 -0.47 0.00 3.97 6.55 -1.92 -1.58 115.95 129.91 1fn0 h TRP 28 Ca -0.28 0.04 0.00 0.00 0.95 0.00 0.00 58.89 59.60 1fn0 h TRP 28 Cb 1.12 0.26 0.00 0.00 -0.86 0.00 0.00 29.16 29.68 1fn0 h TRP 28 CO 0.73 -0.26 0.30 0.00 -1.05 0.00 0.00 178.44 178.15 1fn0 h ALA 29 N 1.06 1.23 -0.29 1.49 0.00 -1.96 -3.11 119.26 117.69 1fn0 h ALA 29 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1fn0 h ALA 29 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1fn0 h ALA 29 CO -0.41 -0.23 0.00 0.72 0.00 0.00 0.00 179.25 179.32 1fn0 n HIS 30 N -2.32 0.92 0.00 0.00 8.25 -0.60 -4.99 115.22 116.49 1fn0 n HIS 30 Ca -0.01 -0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 1fn0 n HIS 30 Cb 0.33 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.18 1fn0 n HIS 30 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fn0 n GLY 31 N 0.40 -0.49 0.00 -1.41 0.00 -1.18 -4.97 105.19 97.55 1fn0 n GLY 31 Ca 0.13 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 44.06 1fn0 n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fn0 n GLY 32 N 0.00 6.27 1.10 -0.02 0.00 -0.42 -4.36 105.19 107.77 1fn0 n GLY 32 Ca 0.00 -1.86 -0.08 0.00 0.00 0.00 0.00 46.02 44.08 1fn0 n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fn0 n GLY 33 N 4.56 -1.34 3.83 -0.02 0.00 -0.84 -4.28 105.19 107.09 1fn0 n GLY 33 Ca 0.00 -1.66 -0.38 0.00 0.00 0.00 0.00 46.02 43.98 1fn0 n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fn0 s ILE 34 N -1.82 5.19 0.00 -0.61 -1.09 -1.25 -0.77 121.20 120.85 1fn0 s ILE 34 Ca 0.22 0.65 0.00 0.00 -2.23 0.00 0.00 60.65 59.29 1fn0 s ILE 34 Cb -0.01 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.25 1fn0 s ILE 34 CO 0.15 0.56 0.00 -1.84 -1.23 0.00 0.00 174.94 172.58 1fn0 n GLU 35 N 2.13 0.00 -4.45 2.79 0.28 0.34 0.06 120.64 121.78 1fn0 n GLU 35 Ca -0.15 0.00 -0.25 0.00 -0.16 0.00 0.00 57.16 56.60 1fn0 n GLU 35 Cb 0.53 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.30 1fn0 n GLU 35 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 1fn0 s THR 36 N -1.91 2.52 0.06 3.84 -4.23 -1.26 -1.43 115.64 113.24 1fn0 s THR 36 Ca 0.00 -2.20 -0.05 0.00 -1.18 0.00 0.00 61.69 58.26 1fn0 s THR 36 Cb 0.00 -2.58 -0.02 0.00 1.34 0.00 0.00 72.50 71.24 1fn0 s THR 36 CO 0.00 -0.29 0.07 0.00 -0.54 0.00 0.00 174.62 173.87 1fn0 s ALA 37 N -2.53 0.14 -0.43 3.99 0.00 -0.33 -4.88 121.76 117.72 1fn0 s ALA 37 Ca 0.32 -0.89 -0.15 0.00 0.00 0.00 0.00 51.96 51.24 1fn0 s ALA 37 Cb -0.02 0.36 0.03 0.00 0.00 0.00 0.00 23.12 23.49 1fn0 s ALA 37 CO 0.17 -0.42 0.34 0.21 0.00 0.00 0.00 175.76 176.06 1fn0 s LYS 38 N -3.73 2.98 0.43 0.00 2.20 -1.26 -1.59 119.74 118.77 1fn0 s LYS 38 Ca 0.05 -1.08 0.06 0.00 -0.36 0.00 0.00 55.97 54.63 1fn0 s LYS 38 Cb 0.06 -4.02 -0.07 0.00 -1.51 0.00 0.00 37.83 32.29 1fn0 s LYS 38 CO -0.10 -0.83 0.02 0.95 -0.36 0.00 0.00 175.35 175.03 1fn0 s THR 39 N 1.71 1.85 0.00 3.43 -4.23 -1.26 -4.99 115.64 112.16 1fn0 s THR 39 Ca 0.05 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1fn0 s THR 39 Cb -0.20 -2.83 0.00 0.00 1.34 0.00 0.00 72.50 70.80 1fn0 s THR 39 CO 0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 1fn0 n GLY 40 N -1.04 3.04 1.06 3.99 0.00 -1.26 -1.76 105.19 109.22 1fn0 n GLY 40 Ca -0.08 0.13 0.09 0.00 0.00 0.00 0.00 46.02 46.16 1fn0 n GLY 40 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fn0 n ASN 41 N 3.93 3.65 -4.73 1.61 3.02 -1.26 -5.00 115.26 116.48 1fn0 n ASN 41 Ca 0.00 -2.15 -0.42 0.00 -0.03 0.00 0.00 54.58 51.98 1fn0 n ASN 41 Cb 0.00 -0.40 -0.02 0.00 -0.61 0.00 0.00 39.78 38.75 1fn0 n ASN 41 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1fn0 n GLU 42 N 0.93 2.57 0.00 3.52 1.02 -0.72 -4.89 120.64 123.06 1fn0 n GLU 42 Ca 0.19 0.91 0.09 0.00 -0.02 0.00 0.00 57.16 58.33 1fn0 n GLU 42 Cb 0.60 -2.67 0.49 0.00 -0.02 0.00 0.00 31.44 29.85 1fn0 n GLU 42 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1fn0 n PRO 43 N 2.04 0.36 -3.62 3.49 -0.04 -1.26 -4.78 135.00 131.19 1fn0 n PRO 43 Ca 0.09 0.08 -0.01 0.00 -0.04 0.00 0.00 63.50 63.62 1fn0 n PRO 43 Cb 0.36 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.31 1fn0 n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fn0 s PRO 45 N -2.53 2.56 0.00 0.00 0.02 -1.26 -4.59 135.00 129.20 1fn0 s PRO 45 Ca 0.13 1.35 0.00 0.00 0.02 0.00 0.00 61.00 62.49 1fn0 s PRO 45 Cb 0.03 -4.45 0.00 0.00 0.02 0.00 0.00 34.50 30.09 1fn0 s PRO 45 CO -0.04 -2.76 0.50 1.28 -0.33 0.00 0.00 177.00 175.65 1fn0 n LEU 46 N 13.73 0.97 -4.70 -5.54 4.77 -1.04 -4.74 117.00 120.45 1fn0 n LEU 46 Ca 0.30 -0.97 -0.37 0.00 -0.03 0.00 0.00 56.01 54.94 1fn0 n LEU 46 Cb 0.51 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.53 1fn0 n LEU 46 CO 0.70 0.24 0.04 -0.89 -1.33 0.00 0.00 177.39 176.15 1fn0 s THR 47 N -0.15 5.25 -0.13 -5.08 2.01 -0.62 -0.64 115.64 116.27 1fn0 s THR 47 Ca 0.00 0.64 -0.22 0.00 0.31 0.00 0.00 61.69 62.42 1fn0 s THR 47 Cb 0.00 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 1fn0 s THR 47 CO 0.00 0.32 0.67 -0.69 -0.69 0.00 0.00 174.62 174.23 1fn0 s VAL 48 N 0.89 5.03 0.14 3.82 1.01 -1.16 -1.19 120.40 128.94 1fn0 s VAL 48 Ca 0.18 1.33 -0.00 0.00 0.00 0.00 0.00 61.98 63.49 1fn0 s VAL 48 Cb -0.14 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1fn0 s VAL 48 CO 0.06 0.18 0.04 0.68 0.00 0.00 0.00 175.10 176.06 1fn0 s VAL 49 N 1.37 0.28 -0.16 2.92 -7.23 -0.51 -1.96 120.40 115.10 1fn0 s VAL 49 Ca 0.33 -1.93 -0.17 0.00 -1.81 0.00 0.00 61.98 58.40 1fn0 s VAL 49 Cb -0.17 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.68 1fn0 s VAL 49 CO 0.14 -0.49 0.46 -0.60 -0.31 0.00 0.00 175.10 174.30 1fn0 s ARG 50 N -4.00 4.26 0.35 4.82 3.52 -0.00 -0.51 118.95 127.38 1fn0 s ARG 50 Ca 0.23 0.36 -0.29 0.00 -0.13 0.00 0.00 55.73 55.91 1fn0 s ARG 50 Cb 0.07 -3.49 -0.11 0.00 -1.56 0.00 0.00 34.95 29.87 1fn0 s ARG 50 CO 0.02 0.05 1.50 0.45 -0.81 0.00 0.00 175.30 176.51 1fn0 s SER 51 N 0.82 6.39 0.00 -2.12 0.15 0.05 -4.30 113.70 114.69 1fn0 s SER 51 Ca 0.23 2.99 0.29 0.00 0.70 0.00 0.00 55.95 60.16 1fn0 s SER 51 Cb -0.15 -2.66 1.64 0.00 -1.71 0.00 0.00 66.02 63.15 1fn0 s SER 51 CO 0.09 -0.85 2.07 -0.81 1.20 0.00 0.00 173.24 174.94 1fn0 n PRO 52 N 0.99 1.10 -3.12 5.44 -0.04 -1.26 -1.29 135.00 136.81 1fn0 n PRO 52 Ca 0.03 -0.15 -0.43 0.00 -0.04 0.00 0.00 63.50 62.91 1fn0 n PRO 52 Cb 0.39 -1.46 -0.07 0.00 -0.04 0.00 0.00 33.50 32.32 1fn0 n PRO 52 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1fn0 s ASN 53 N -1.92 6.34 0.57 3.54 3.84 -1.26 -4.71 114.94 121.34 1fn0 s ASN 53 Ca 0.43 -0.24 0.35 0.00 0.21 0.00 0.00 52.86 53.62 1fn0 s ASN 53 Cb 0.20 -2.31 1.66 0.00 -0.55 0.00 0.00 41.25 40.25 1fn0 s ASN 53 CO 0.34 -0.72 2.10 -0.33 -2.79 0.00 0.00 177.10 175.70 1fn0 h GLU 54 N 8.77 0.00 0.00 0.43 3.07 -1.88 0.19 114.58 125.16 1fn0 h GLU 54 Ca -0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.60 1fn0 h GLU 54 Cb 1.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 1fn0 h GLU 54 CO 0.87 0.04 -0.37 -0.24 -1.40 0.00 0.00 179.01 177.91 1fn0 h VAL 55 N 0.00 0.00 -3.20 3.13 3.04 -1.91 -3.43 116.25 113.88 1fn0 h VAL 55 Ca -0.00 -0.80 -0.54 0.00 -1.01 0.00 0.00 66.70 64.35 1fn0 h VAL 55 Cb 0.35 1.60 -0.00 0.00 -2.01 0.00 0.00 31.29 31.22 1fn0 h VAL 55 CO 0.00 0.00 0.56 -0.55 -1.01 0.00 0.00 177.57 176.58 1fn0 s SER 56 N -5.30 7.11 0.02 3.17 0.15 0.67 -4.91 113.70 114.62 1fn0 s SER 56 Ca 0.06 1.94 0.28 0.00 0.70 0.00 0.00 55.95 58.93 1fn0 s SER 56 Cb 0.09 -2.57 1.18 0.00 -1.71 0.00 0.00 66.02 63.01 1fn0 s SER 56 CO 0.70 -0.46 1.90 0.29 1.20 0.00 0.00 173.24 176.86 1fn0 n LYS 57 N 4.15 0.03 0.00 5.44 5.02 -1.26 -1.99 118.16 129.54 1fn0 n LYS 57 Ca 0.09 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1fn0 n LYS 57 Cb 0.47 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 1fn0 n LYS 57 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1fn0 n GLY 58 N 1.44 -0.48 3.87 0.72 0.00 -1.26 -4.06 105.19 105.42 1fn0 n GLY 58 Ca 0.07 -1.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.66 1fn0 n GLY 58 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fn0 s GLU 59 N 0.00 3.76 0.16 1.61 0.41 0.11 -4.87 118.70 119.88 1fn0 s GLU 59 Ca 0.00 0.17 -0.31 0.00 -0.41 0.00 0.00 54.97 54.42 1fn0 s GLU 59 Cb 0.00 -2.85 -0.09 0.00 -1.78 0.00 0.00 34.13 29.41 1fn0 s GLU 59 CO 0.00 0.46 1.40 -2.14 -0.49 0.00 0.00 175.26 174.48 1fn0 s PRO 60 N -2.37 4.32 -0.09 0.39 0.02 -1.26 -4.62 135.00 131.38 1fn0 s PRO 60 Ca 0.40 2.13 0.04 0.00 0.02 0.00 0.00 61.00 63.59 1fn0 s PRO 60 Cb -0.13 -3.20 -0.00 0.00 0.02 0.00 0.00 34.50 31.18 1fn0 s PRO 60 CO 0.21 -0.41 -0.23 0.42 -0.33 0.00 0.00 177.00 176.67 1fn0 s ILE 61 N 0.70 2.21 -0.05 2.83 1.01 0.58 -1.45 121.20 127.03 1fn0 s ILE 61 Ca 0.62 -0.98 -0.21 0.00 0.00 0.00 0.00 60.65 60.09 1fn0 s ILE 61 Cb -0.38 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 1fn0 s ILE 61 CO 0.34 0.56 0.59 -0.60 0.00 0.00 0.00 174.94 175.83 1fn0 s ARG 62 N 0.21 4.35 -0.29 2.79 3.52 0.13 -0.47 118.95 129.19 1fn0 s ARG 62 Ca -0.14 0.70 -0.05 0.00 -0.13 0.00 0.00 55.73 56.11 1fn0 s ARG 62 Cb -0.17 -3.39 0.02 0.00 -1.56 0.00 0.00 34.95 29.85 1fn0 s ARG 62 CO 0.07 0.23 0.04 0.42 -0.81 0.00 0.00 175.30 175.26 1fn0 s ILE 63 N 0.29 3.57 -0.10 4.11 1.01 -0.89 -1.12 121.20 128.07 1fn0 s ILE 63 Ca 0.32 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 60.06 1fn0 s ILE 63 Cb -0.17 -2.90 0.01 0.00 0.01 0.00 0.00 42.46 39.41 1fn0 s ILE 63 CO 0.16 0.03 -0.19 -0.44 0.00 0.00 0.00 174.94 174.50 1fn0 s SER 64 N 1.41 2.62 0.61 3.58 0.01 -0.46 0.28 113.70 121.75 1fn0 s SER 64 Ca 0.00 -0.47 -0.08 0.00 1.31 0.00 0.00 55.95 56.71 1fn0 s SER 64 Cb -0.18 -1.20 -0.00 0.00 0.21 0.00 0.00 66.02 64.85 1fn0 s SER 64 CO 0.01 0.09 0.96 -0.94 0.41 0.00 0.00 173.24 173.77 1fn0 s SER 65 N 0.59 5.76 0.43 2.44 1.04 -1.26 -0.98 113.70 121.71 1fn0 s SER 65 Ca -0.14 0.98 0.30 0.00 0.48 0.00 0.00 55.95 57.57 1fn0 s SER 65 Cb -0.17 -1.98 1.35 0.00 0.10 0.00 0.00 66.02 65.32 1fn0 s SER 65 CO 0.05 -1.03 1.90 0.06 0.98 0.00 0.00 173.24 175.19 1fn0 h GLN 66 N -0.27 0.00 -6.27 4.02 3.07 -1.84 -3.45 115.11 110.37 1fn0 h GLN 66 Ca -0.45 0.00 -0.45 0.00 0.09 0.00 0.00 58.65 57.84 1fn0 h GLN 66 Cb 1.24 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.80 1fn0 h GLN 66 CO 0.62 0.00 -0.37 -0.06 0.09 0.00 0.00 178.83 179.11 1fn0 s PHE 67 N -3.59 3.26 -0.22 0.06 0.08 -1.26 -5.01 117.98 111.30 1fn0 s PHE 67 Ca 0.01 -0.12 0.01 0.00 0.12 0.00 0.00 56.93 56.94 1fn0 s PHE 67 Cb 0.09 -1.82 0.24 0.00 -0.57 0.00 0.00 43.02 40.96 1fn0 s PHE 67 CO 0.42 0.17 1.62 -0.11 -0.10 0.00 0.00 175.22 177.23 1fn0 n LEU 68 N -1.55 5.23 -4.91 -0.37 0.00 -1.26 -5.01 117.00 109.12 1fn0 n LEU 68 Ca -0.04 -2.68 -0.27 0.00 0.00 0.00 0.00 56.01 53.02 1fn0 n LEU 68 Cb 0.58 -0.80 -0.01 0.00 0.00 0.00 0.00 43.42 43.18 1fn0 n LEU 68 CO 0.43 0.91 0.32 -0.44 0.00 0.00 0.00 177.39 178.61 1fn0 s SER 69 N 0.19 6.32 0.43 1.96 0.01 -1.26 -4.97 113.70 116.38 1fn0 s SER 69 Ca 0.25 0.76 0.24 0.00 1.31 0.00 0.00 55.95 58.51 1fn0 s SER 69 Cb 0.20 -2.17 0.74 0.00 0.21 0.00 0.00 66.02 65.01 1fn0 s SER 69 CO 0.03 -0.41 1.75 -0.07 0.41 0.00 0.00 173.24 174.94 1fn0 h LEU 70 N 0.71 0.00 0.00 2.44 3.38 -1.94 -3.42 115.31 116.48 1fn0 h LEU 70 Ca -0.48 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.28 1fn0 h LEU 70 Cb 1.21 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 1fn0 h LEU 70 CO 0.62 0.20 -0.16 0.49 0.09 0.00 0.00 178.44 179.68 1fn0 n PHE 71 N -3.26 0.26 -3.87 1.13 3.01 -1.26 -1.15 117.46 112.32 1fn0 n PHE 71 Ca 0.01 -0.85 -0.30 0.00 1.01 0.00 0.00 57.45 57.33 1fn0 n PHE 71 Cb 0.48 -0.07 -0.16 0.00 -0.01 0.00 0.00 39.48 39.72 1fn0 n PHE 71 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1fn0 s ILE 72 N -1.78 1.23 0.63 4.37 1.01 -1.25 -4.58 121.20 120.83 1fn0 s ILE 72 Ca 0.03 -1.14 -0.19 0.00 0.00 0.00 0.00 60.65 59.35 1fn0 s ILE 72 Cb 0.00 -1.64 -0.02 0.00 0.01 0.00 0.00 42.46 40.81 1fn0 s ILE 72 CO 0.02 -0.23 1.29 -2.65 0.00 0.00 0.00 174.94 173.36 1fn0 n PRO 73 N 4.77 1.21 -0.09 2.79 -0.02 -1.26 -1.47 135.00 140.93 1fn0 n PRO 73 Ca -0.09 0.47 -0.02 0.00 -2.02 0.00 0.00 63.50 61.83 1fn0 n PRO 73 Cb 0.44 -2.52 -0.02 0.00 -0.02 0.00 0.00 33.50 31.38 1fn0 n PRO 73 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1fn0 n ARG 74 N -1.69 -0.10 -0.91 -0.52 0.63 -1.16 -1.29 116.66 111.62 1fn0 n ARG 74 Ca 0.15 0.93 -0.11 0.00 -0.92 0.00 0.00 57.85 57.90 1fn0 n ARG 74 Cb 0.47 -1.39 0.21 0.00 0.45 0.00 0.00 32.46 32.20 1fn0 n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1fn0 n GLY 75 N -1.06 3.60 3.73 5.14 0.00 -1.26 -4.60 105.19 110.74 1fn0 n GLY 75 Ca 0.00 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 1fn0 n GLY 75 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fn0 s SER 76 N -0.79 7.18 0.54 1.61 0.15 -0.42 -5.03 113.70 116.94 1fn0 s SER 76 Ca 0.46 2.05 -0.21 0.00 0.70 0.00 0.00 55.95 58.94 1fn0 s SER 76 Cb 0.37 -2.59 -0.05 0.00 -1.71 0.00 0.00 66.02 62.04 1fn0 s SER 76 CO 0.10 -0.33 1.22 -0.76 1.20 0.00 0.00 173.24 174.67 1fn0 s LEU 77 N 0.28 3.82 0.14 3.45 1.43 -1.26 -4.64 118.68 121.91 1fn0 s LEU 77 Ca 0.53 2.43 0.02 0.00 -1.03 0.00 0.00 54.13 56.08 1fn0 s LEU 77 Cb -0.29 -4.42 -0.04 0.00 0.03 0.00 0.00 46.19 41.47 1fn0 s LEU 77 CO 0.32 -1.35 -0.03 0.68 0.23 0.00 0.00 176.35 176.21 1fn0 s VAL 78 N -1.53 0.71 0.06 -1.59 -7.23 0.12 -2.36 120.40 108.59 1fn0 s VAL 78 Ca 0.72 -1.97 0.07 0.00 -1.81 0.00 0.00 61.98 58.99 1fn0 s VAL 78 Cb -0.31 -1.95 -0.03 0.00 0.56 0.00 0.00 36.38 34.65 1fn0 s VAL 78 CO 0.36 -0.63 -0.18 0.00 -0.31 0.00 0.00 175.10 174.34 1fn0 s ALA 79 N -3.63 2.62 -0.07 1.32 0.00 -0.15 -2.57 121.76 119.29 1fn0 s ALA 79 Ca 0.19 -1.23 0.03 0.00 0.00 0.00 0.00 51.96 50.96 1fn0 s ALA 79 Cb 0.06 -0.72 0.00 0.00 0.00 0.00 0.00 23.12 22.46 1fn0 s ALA 79 CO 0.01 0.58 -0.17 -0.51 0.00 0.00 0.00 175.76 175.67 1fn0 s LEU 80 N -1.60 1.85 0.00 0.00 1.43 -1.26 -1.35 118.68 117.75 1fn0 s LEU 80 Ca 0.15 -0.38 -0.04 0.00 -1.03 0.00 0.00 54.13 52.83 1fn0 s LEU 80 Cb -0.11 -1.02 -0.01 0.00 0.03 0.00 0.00 46.19 45.09 1fn0 s LEU 80 CO 0.06 0.11 0.07 -0.83 0.23 0.00 0.00 176.35 175.99 1fn0 s GLY 81 N 0.36 0.10 0.21 -3.19 0.00 -0.28 -0.77 107.32 103.75 1fn0 s GLY 81 Ca -0.12 -0.24 -0.30 0.00 0.00 0.00 0.00 44.72 44.06 1fn0 s GLY 81 CO 0.04 -0.34 1.31 -1.36 0.00 0.00 0.00 173.10 172.75 1fn0 s PHE 82 N -1.19 3.25 0.32 1.90 0.40 -0.21 0.21 117.98 122.65 1fn0 s PHE 82 Ca -0.13 1.24 0.16 0.00 -0.60 0.00 0.00 56.93 57.60 1fn0 s PHE 82 Cb -0.07 -3.61 0.78 0.00 0.51 0.00 0.00 43.02 40.63 1fn0 s PHE 82 CO 0.00 -1.87 1.82 0.00 0.70 0.00 0.00 175.22 175.88 1fn0 h ALA 83 N 5.20 1.23 -2.57 5.36 0.00 -1.61 -3.31 119.26 123.57 1fn0 h ALA 83 Ca -0.45 -0.33 -0.60 0.00 0.00 0.00 0.00 54.91 53.53 1fn0 h ALA 83 Cb 1.22 -0.06 -0.40 0.00 0.00 0.00 0.00 17.79 18.55 1fn0 h ALA 83 CO 0.76 0.45 -0.79 0.09 0.00 0.00 0.00 179.25 179.76 1fn0 n ASN 84 N -3.86 1.48 -4.79 0.00 4.13 -1.26 -5.10 115.26 105.85 1fn0 n ASN 84 Ca -0.01 -2.87 -0.33 0.00 1.68 0.00 0.00 54.58 53.05 1fn0 n ASN 84 Cb 0.43 -0.66 0.03 0.00 -1.54 0.00 0.00 39.78 38.04 1fn0 n ASN 84 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1fn0 s PRO 85 N -1.00 3.06 0.43 3.52 0.04 -1.25 -4.95 135.00 134.85 1fn0 s PRO 85 Ca 0.31 1.27 -0.24 0.00 0.04 0.00 0.00 61.00 62.37 1fn0 s PRO 85 Cb 0.04 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.49 1fn0 s PRO 85 CO -0.15 -1.03 1.12 -2.30 0.04 0.00 0.00 177.00 174.68 1fn0 n PRO 86 N -2.28 1.56 0.11 0.56 -0.02 -1.26 -4.85 135.00 128.82 1fn0 n PRO 86 Ca 0.09 0.56 0.20 0.00 -2.02 0.00 0.00 63.50 62.33 1fn0 n PRO 86 Cb 0.52 -2.19 0.76 0.00 -0.02 0.00 0.00 33.50 32.57 1fn0 n PRO 86 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1fn0 h SER 87 N 1.71 0.00 0.57 2.55 0.87 -1.96 -2.73 113.55 114.56 1fn0 h SER 87 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 1fn0 h SER 87 Cb 1.32 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 1fn0 h SER 87 CO 0.58 0.00 -0.46 0.00 -0.53 0.00 0.00 176.83 176.42 1fn0 s ALA 89 N -3.01 3.09 0.22 0.00 0.00 -1.03 -4.54 121.76 116.49 1fn0 s ALA 89 Ca 0.11 0.74 0.09 0.00 0.00 0.00 0.00 51.96 52.90 1fn0 s ALA 89 Cb 0.17 -3.29 0.15 0.00 0.00 0.00 0.00 23.12 20.16 1fn0 s ALA 89 CO 0.68 -0.26 1.49 0.00 0.00 0.00 0.00 175.76 177.68 1fn0 h ALA 90 N 2.51 0.75 -2.59 0.00 0.00 -0.02 -3.46 119.26 116.45 1fn0 h ALA 90 Ca -0.48 -0.68 -0.12 0.00 0.00 0.00 0.00 54.91 53.62 1fn0 h ALA 90 Cb 1.22 -0.12 -0.13 0.00 0.00 0.00 0.00 17.79 18.76 1fn0 h ALA 90 CO 0.62 0.94 -0.40 -1.54 0.00 0.00 0.00 179.25 178.87 1fn0 s SER 91 N -6.81 0.10 0.00 0.00 1.04 -1.26 -4.81 113.70 101.97 1fn0 s SER 91 Ca -0.01 -0.94 0.27 0.00 0.48 0.00 0.00 55.95 55.75 1fn0 s SER 91 Cb 0.12 0.40 1.43 0.00 0.10 0.00 0.00 66.02 68.07 1fn0 s SER 91 CO 0.78 -0.85 1.93 -0.81 0.98 0.00 0.00 173.24 175.27 1fn0 n PRO 92 N -0.18 0.52 -3.14 4.02 -0.04 -1.26 -4.71 135.00 130.21 1fn0 n PRO 92 Ca -0.07 0.03 -0.37 0.00 -0.04 0.00 0.00 63.50 63.05 1fn0 n PRO 92 Cb 0.63 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.53 1fn0 n PRO 92 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1fn0 s TRP 93 N -2.40 3.70 0.56 0.54 0.52 -1.26 -1.04 118.94 119.55 1fn0 s TRP 93 Ca 0.30 1.37 -0.15 0.00 0.02 0.00 0.00 56.10 57.64 1fn0 s TRP 93 Cb 0.18 -2.59 -0.06 0.00 -1.15 0.00 0.00 33.47 29.85 1fn0 s TRP 93 CO 0.38 0.40 1.01 -1.58 0.02 0.00 0.00 176.95 177.18 1fn0 s TRP 94 N -1.41 3.37 0.16 -1.98 0.52 0.05 -4.52 118.94 115.13 1fn0 s TRP 94 Ca 0.40 1.44 -0.09 0.00 0.02 0.00 0.00 56.10 57.87 1fn0 s TRP 94 Cb -0.18 -2.83 -0.01 0.00 -1.15 0.00 0.00 33.47 29.31 1fn0 s TRP 94 CO 0.21 -0.62 0.29 -0.08 0.02 0.00 0.00 176.95 176.77 1fn0 s THR 95 N -2.70 0.07 -0.15 2.01 -1.32 -0.16 -4.61 115.64 108.77 1fn0 s THR 95 Ca 0.59 -1.36 -0.01 0.00 -1.21 0.00 0.00 61.69 59.70 1fn0 s THR 95 Cb -0.12 -1.82 -0.02 0.00 -1.51 0.00 0.00 72.50 69.04 1fn0 s THR 95 CO 0.37 -0.30 -0.10 -0.69 -2.21 0.00 0.00 174.62 171.70 1fn0 s VAL 96 N -3.96 3.29 -0.13 5.08 1.01 -1.26 -0.73 120.40 123.69 1fn0 s VAL 96 Ca 0.17 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.56 1fn0 s VAL 96 Cb 0.03 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 1fn0 s VAL 96 CO -0.00 0.50 -0.09 -0.69 0.00 0.00 0.00 175.10 174.82 1fn0 s VAL 97 N 0.50 3.46 0.84 2.92 1.01 0.80 -4.90 120.40 125.03 1fn0 s VAL 97 Ca -0.07 -0.52 -0.11 0.00 0.00 0.00 0.00 61.98 61.28 1fn0 s VAL 97 Cb -0.15 -2.48 0.10 0.00 0.00 0.00 0.00 36.38 33.85 1fn0 s VAL 97 CO 0.04 0.52 1.10 -1.81 0.00 0.00 0.00 175.10 174.95 1fn0 s ASP 98 N 0.25 3.81 0.18 3.32 -0.00 -1.26 -0.63 116.67 122.33 1fn0 s ASP 98 Ca -0.06 1.82 -0.24 0.00 -0.00 0.00 0.00 52.55 54.08 1fn0 s ASP 98 Cb -0.15 -2.45 0.07 0.00 -0.00 0.00 0.00 42.92 40.39 1fn0 s ASP 98 CO 0.04 -2.48 0.98 -0.94 -0.00 0.00 0.00 175.17 172.77 1fn0 s SER 99 N -3.21 -0.11 0.12 0.27 1.04 -1.17 -4.82 113.70 105.82 1fn0 s SER 99 Ca 0.63 -0.53 -0.19 0.00 0.48 0.00 0.00 55.95 56.34 1fn0 s SER 99 Cb -0.19 0.51 -0.06 0.00 0.10 0.00 0.00 66.02 66.38 1fn0 s SER 99 CO 0.57 -0.98 1.74 -0.65 0.98 0.00 0.00 173.24 174.90 1fn0 h PRO 100 N 2.00 0.32 0.00 4.02 0.11 -2.02 -2.40 132.00 134.02 1fn0 h PRO 100 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1fn0 h PRO 100 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1fn0 h PRO 100 CO 0.30 0.27 0.00 0.37 -0.21 0.00 0.00 178.00 178.72 1fn0 h GLN 101 N 0.29 0.00 0.00 1.05 5.75 -2.01 -3.49 115.11 116.70 1fn0 h GLN 101 Ca 0.08 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 1fn0 h GLN 101 Cb 0.03 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.58 1fn0 h GLN 101 CO -0.02 0.00 0.00 0.41 -2.65 0.00 0.00 178.83 176.57 1fn0 n GLY 102 N -0.40 1.67 3.77 2.39 0.00 -0.91 -5.09 105.19 106.62 1fn0 n GLY 102 Ca 0.01 -2.19 -0.39 0.00 0.00 0.00 0.00 46.02 43.45 1fn0 n GLY 102 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1fn0 s PRO 103 N -1.44 4.02 0.12 1.61 0.02 -1.26 -3.06 135.00 135.02 1fn0 s PRO 103 Ca 0.00 2.10 0.05 0.00 0.02 0.00 0.00 61.00 63.17 1fn0 s PRO 103 Cb 0.00 -2.77 -0.04 0.00 0.02 0.00 0.00 34.50 31.71 1fn0 s PRO 103 CO 0.00 -0.43 -0.12 0.00 -0.33 0.00 0.00 177.00 176.12 1fn0 s ALA 104 N -1.28 1.42 -0.18 -1.55 0.00 0.19 -1.60 121.76 118.76 1fn0 s ALA 104 Ca 0.56 -1.31 -0.19 0.00 0.00 0.00 0.00 51.96 51.02 1fn0 s ALA 104 Cb -0.37 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 1fn0 s ALA 104 CO 0.47 0.04 0.55 0.08 0.00 0.00 0.00 175.76 176.90 1fn0 s VAL 105 N -2.43 5.09 0.22 0.00 1.01 -0.83 -0.14 120.40 123.32 1fn0 s VAL 105 Ca 0.10 1.04 -0.00 0.00 0.00 0.00 0.00 61.98 63.11 1fn0 s VAL 105 Cb -0.03 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1fn0 s VAL 105 CO 0.02 0.19 0.11 -0.54 0.00 0.00 0.00 175.10 174.88 1fn0 s LYS 106 N 1.51 1.26 0.60 2.72 -0.14 0.09 -2.97 119.74 122.82 1fn0 s LYS 106 Ca 0.26 -1.67 0.06 0.00 -1.36 0.00 0.00 55.97 53.26 1fn0 s LYS 106 Cb -0.16 0.05 0.09 0.00 -1.68 0.00 0.00 37.83 36.13 1fn0 s LYS 106 CO 0.10 -0.34 0.83 -0.51 -0.76 0.00 0.00 175.35 174.68 1fn0 s LEU 107 N -3.21 3.13 0.04 3.17 1.02 0.18 -0.99 118.68 122.03 1fn0 s LEU 107 Ca 0.37 -0.59 0.03 0.00 0.02 0.00 0.00 54.13 53.95 1fn0 s LEU 107 Cb 0.07 -1.93 -0.02 0.00 0.02 0.00 0.00 46.19 44.33 1fn0 s LEU 107 CO 0.12 -1.44 -0.09 -0.55 0.02 0.00 0.00 176.35 174.41 1fn0 s SER 108 N -4.64 0.95 0.00 2.29 0.15 -1.26 -4.91 113.70 106.28 1fn0 s SER 108 Ca 0.62 -0.54 0.29 0.00 0.70 0.00 0.00 55.95 57.02 1fn0 s SER 108 Cb -0.06 0.02 1.26 0.00 -1.71 0.00 0.00 66.02 65.53 1fn0 s SER 108 CO 0.40 -0.18 1.87 0.00 1.20 0.00 0.00 173.24 176.53 1fn0 n GLN 109 N 1.49 1.22 -4.29 5.44 6.02 -1.26 0.57 117.38 126.57 1fn0 n GLN 109 Ca -0.22 -0.54 -0.17 0.00 -0.01 0.00 0.00 57.00 56.06 1fn0 n GLN 109 Cb 0.55 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 30.22 1fn0 n GLN 109 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 1fn0 s GLN 110 N -2.15 1.17 0.35 -1.09 -2.07 -1.26 -4.08 119.66 110.53 1fn0 s GLN 110 Ca 0.37 -1.48 -0.29 0.00 -1.82 0.00 0.00 55.36 52.15 1fn0 s GLN 110 Cb 0.21 -0.89 -0.12 0.00 -1.09 0.00 0.00 33.01 31.13 1fn0 s GLN 110 CO 0.39 0.14 1.47 1.63 -1.32 0.00 0.00 175.29 177.60 1fn0 n LYS 111 N -0.16 2.55 -4.39 9.60 4.01 -1.26 -4.66 118.16 123.86 1fn0 n LYS 111 Ca -0.10 0.90 -0.25 0.00 -0.51 0.00 0.00 58.31 58.35 1fn0 n LYS 111 Cb 0.60 -2.61 -0.10 0.00 -0.51 0.00 0.00 35.03 32.41 1fn0 n LYS 111 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1fn0 s LEU 112 N -1.46 2.76 0.70 -0.35 1.43 -1.26 -5.11 118.68 115.39 1fn0 s LEU 112 Ca 0.56 -0.82 -0.13 0.00 -1.03 0.00 0.00 54.13 52.71 1fn0 s LEU 112 Cb -0.50 -1.36 0.02 0.00 0.03 0.00 0.00 46.19 44.38 1fn0 s LEU 112 CO 0.60 0.06 1.10 -2.84 0.23 0.00 0.00 176.35 175.51 1fn0 s PRO 113 N -3.22 2.61 0.43 1.29 0.02 -1.26 -4.92 135.00 129.96 1fn0 s PRO 113 Ca 0.27 1.32 0.10 0.00 0.02 0.00 0.00 61.00 62.71 1fn0 s PRO 113 Cb -0.07 -1.93 0.96 0.00 0.02 0.00 0.00 34.50 33.48 1fn0 s PRO 113 CO 0.15 -1.39 2.07 0.93 -0.33 0.00 0.00 177.00 178.43 1fn0 h GLU 114 N -0.36 0.42 0.00 5.54 5.08 -2.00 -0.73 114.58 122.53 1fn0 h GLU 114 Ca -0.46 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1fn0 h GLU 114 Cb 1.24 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1fn0 h GLU 114 CO 0.53 0.28 0.00 0.36 -1.00 0.00 0.00 179.01 179.18 1fn0 n LYS 115 N -4.49 0.19 0.00 2.33 2.85 -1.26 -1.03 118.16 116.75 1fn0 n LYS 115 Ca 0.03 0.15 0.09 0.00 -1.05 0.00 0.00 58.31 57.53 1fn0 n LYS 115 Cb 0.11 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 32.94 1fn0 n LYS 115 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1fn0 n ASP 116 N -1.31 1.43 -0.02 -5.58 10.43 -0.28 -4.44 116.55 116.78 1fn0 n ASP 116 Ca 0.07 -1.21 0.00 0.00 2.57 0.00 0.00 54.79 56.22 1fn0 n ASP 116 Cb 0.13 0.70 -0.05 0.00 1.84 0.00 0.00 41.12 43.74 1fn0 n ASP 116 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 1fn0 n ILE 117 N -0.66 0.20 -2.30 0.53 -5.35 -0.83 -4.51 119.36 106.43 1fn0 n ILE 117 Ca 0.06 -0.20 -0.42 0.00 -0.27 0.00 0.00 62.75 61.92 1fn0 n ILE 117 Cb 0.36 -0.22 0.00 0.00 -1.74 0.00 0.00 39.64 38.04 1fn0 n ILE 117 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 1fn0 n LEU 118 N -1.97 7.11 -0.66 7.28 7.94 -0.20 -4.23 117.00 132.27 1fn0 n LEU 118 Ca -0.05 -4.81 0.04 0.00 -1.11 0.00 0.00 56.01 50.08 1fn0 n LEU 118 Cb 0.43 -1.41 0.07 0.00 0.53 0.00 0.00 43.42 43.04 1fn0 n LEU 118 CO 0.13 1.66 0.30 1.33 -1.11 0.00 0.00 177.39 179.70 1fn0 n VAL 119 N 2.48 0.81 -4.31 1.96 0.24 -1.20 -4.76 118.33 113.55 1fn0 n VAL 119 Ca 0.46 -1.31 -0.22 0.00 -2.04 0.00 0.00 64.34 61.23 1fn0 n VAL 119 Cb 0.32 0.33 -0.11 0.00 -1.47 0.00 0.00 33.84 32.90 1fn0 n VAL 119 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1fn0 s PHE 120 N -1.21 1.75 -0.14 6.34 0.08 -1.06 -0.75 117.98 122.99 1fn0 s PHE 120 Ca 0.22 -0.47 -0.13 0.00 0.12 0.00 0.00 56.93 56.67 1fn0 s PHE 120 Cb 0.22 -0.89 0.04 0.00 -0.57 0.00 0.00 43.02 41.82 1fn0 s PHE 120 CO -0.05 0.28 0.38 0.21 -0.10 0.00 0.00 175.22 175.94 1fn0 s LYS 121 N -2.61 0.45 0.01 0.44 2.20 -0.97 0.14 119.74 119.40 1fn0 s LYS 121 Ca 0.13 0.52 -0.17 0.00 -0.36 0.00 0.00 55.97 56.09 1fn0 s LYS 121 Cb -0.06 0.22 -0.06 0.00 -1.51 0.00 0.00 37.83 36.42 1fn0 s LYS 121 CO 0.06 -0.05 0.47 -0.06 -0.36 0.00 0.00 175.35 175.40 1fn0 s PHE 122 N 0.19 3.74 -0.22 4.03 0.08 -1.26 -0.12 117.98 124.41 1fn0 s PHE 122 Ca -0.00 1.09 0.00 0.00 0.12 0.00 0.00 56.93 58.14 1fn0 s PHE 122 Cb -0.03 -2.39 0.06 0.00 -0.57 0.00 0.00 43.02 40.09 1fn0 s PHE 122 CO 0.01 0.58 -0.06 -2.00 -0.10 0.00 0.00 175.22 173.65 1fn0 s GLU 123 N -0.93 1.62 0.38 0.44 2.12 -0.58 -4.83 118.70 116.93 1fn0 s GLU 123 Ca 0.26 -0.91 -0.27 0.00 0.36 0.00 0.00 54.97 54.41 1fn0 s GLU 123 Cb -0.18 -2.50 -0.11 0.00 0.26 0.00 0.00 34.13 31.60 1fn0 s GLU 123 CO 0.15 -0.56 1.31 1.17 -0.54 0.00 0.00 175.26 176.79 1fn0 n LYS 124 N 4.71 2.13 -3.90 4.30 4.81 -1.26 -0.53 118.16 128.41 1fn0 n LYS 124 Ca -0.12 0.75 -0.37 0.00 -0.87 0.00 0.00 58.31 57.70 1fn0 n LYS 124 Cb 0.45 -2.40 -0.06 0.00 0.02 0.00 0.00 35.03 33.04 1fn0 n LYS 124 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1fn0 s VAL 125 N -1.14 5.45 0.79 3.15 1.01 -0.72 -4.82 120.40 124.12 1fn0 s VAL 125 Ca 0.57 0.19 -0.09 0.00 0.00 0.00 0.00 61.98 62.65 1fn0 s VAL 125 Cb -0.53 -3.37 0.11 0.00 0.00 0.00 0.00 36.38 32.58 1fn0 s VAL 125 CO 0.61 0.61 1.12 -0.44 0.00 0.00 0.00 175.10 177.00 1fn0 s SER 126 N -0.98 4.26 -0.97 3.32 0.01 -1.26 -4.55 113.70 113.52 1fn0 s SER 126 Ca 0.15 0.35 -0.07 0.00 1.31 0.00 0.00 55.95 57.69 1fn0 s SER 126 Cb -0.12 -0.78 -0.04 0.00 0.21 0.00 0.00 66.02 65.29 1fn0 s SER 126 CO 0.04 -1.98 0.82 1.57 0.41 0.00 0.00 173.24 174.10 1fn0 n HIS 127 N -3.20 -2.48 -3.57 2.43 -0.00 -1.26 -5.02 115.22 102.13 1fn0 n HIS 127 Ca 0.11 0.85 -0.15 0.00 0.46 0.00 0.00 57.72 58.99 1fn0 n HIS 127 Cb 0.60 -3.93 -0.06 0.00 -0.12 0.00 0.00 29.99 26.48 1fn0 n HIS 127 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1fn0 s SER 128 N -3.28 -0.62 -0.09 0.26 0.15 -1.26 -5.05 113.70 103.80 1fn0 s SER 128 Ca 0.32 0.88 -0.13 0.00 0.70 0.00 0.00 55.95 57.72 1fn0 s SER 128 Cb -0.06 0.78 -0.28 0.00 -1.71 0.00 0.00 66.02 64.75 1fn0 s SER 128 CO 0.77 -0.43 0.55 0.78 1.20 0.00 0.00 173.24 176.12 1fn0 h ASN 129 N 3.58 0.45 -4.05 5.45 2.35 -1.96 -3.47 115.58 117.93 1fn0 h ASN 129 Ca -0.26 -0.89 -0.49 0.00 -0.55 0.00 0.00 56.30 54.11 1fn0 h ASN 129 Cb 1.15 -0.15 0.03 0.00 0.05 0.00 0.00 38.32 39.40 1fn0 h ASN 129 CO 0.26 1.71 0.30 -0.51 -1.65 0.00 0.00 177.43 177.54 1fn0 s ILE 130 N -2.52 4.68 -0.28 2.81 1.10 -1.26 -4.99 121.20 120.75 1fn0 s ILE 130 Ca -0.19 0.87 -0.29 0.00 -0.51 0.00 0.00 60.65 60.52 1fn0 s ILE 130 Cb 0.05 -3.78 0.00 0.00 0.15 0.00 0.00 42.46 38.88 1fn0 s ILE 130 CO 0.79 -0.80 1.21 -1.00 -2.11 0.00 0.00 174.94 173.03 1fn0 s HIS 131 N -2.74 2.88 -0.01 3.50 3.76 -1.26 -4.99 115.29 116.43 1fn0 s HIS 131 Ca 0.55 1.02 0.05 0.00 -0.15 0.00 0.00 55.06 56.52 1fn0 s HIS 131 Cb -0.10 -3.74 -0.01 0.00 1.11 0.00 0.00 32.58 29.84 1fn0 s HIS 131 CO 0.39 -1.37 -0.16 0.08 -0.85 0.00 0.00 174.74 172.83 1fn0 s VAL 132 N 3.94 1.24 0.06 -0.90 1.01 -1.26 -4.58 120.40 119.90 1fn0 s VAL 132 Ca 0.52 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1fn0 s VAL 132 Cb -0.16 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1fn0 s VAL 132 CO 0.18 0.35 -0.11 -0.31 0.00 0.00 0.00 175.10 175.21 1fn0 s TYR 133 N -0.34 0.98 0.54 5.22 2.02 -0.38 -1.76 117.35 123.63 1fn0 s TYR 133 Ca 0.06 -0.47 -0.07 0.00 -0.37 0.00 0.00 57.07 56.22 1fn0 s TYR 133 Cb -0.06 -0.56 -0.03 0.00 -0.40 0.00 0.00 41.96 40.91 1fn0 s TYR 133 CO -0.00 -0.00 0.87 0.15 -1.57 0.00 0.00 175.55 174.99 1fn0 s LYS 134 N -1.62 3.39 -0.31 -0.62 1.02 0.31 -0.18 119.74 121.72 1fn0 s LYS 134 Ca -0.05 0.27 -0.04 0.00 0.02 0.00 0.00 55.97 56.17 1fn0 s LYS 134 Cb -0.10 -2.28 0.04 0.00 -0.52 0.00 0.00 37.83 34.97 1fn0 s LYS 134 CO 0.01 -0.42 0.04 -1.17 -0.92 0.00 0.00 175.35 172.90 1fn0 s LEU 135 N -4.91 3.98 0.13 3.17 2.96 -1.26 -1.52 118.68 121.23 1fn0 s LEU 135 Ca 0.51 -1.10 -0.08 0.00 -0.22 0.00 0.00 54.13 53.23 1fn0 s LEU 135 Cb -0.10 -1.79 -0.06 0.00 0.50 0.00 0.00 46.19 44.73 1fn0 s LEU 135 CO 0.47 -0.26 0.42 -0.76 -1.32 0.00 0.00 176.35 174.90 1fn0 s LEU 136 N 1.35 4.29 -0.19 -0.68 1.43 0.82 -0.39 118.68 125.32 1fn0 s LEU 136 Ca -0.02 0.76 -0.09 0.00 -1.03 0.00 0.00 54.13 53.76 1fn0 s LEU 136 Cb -0.19 -3.21 -0.05 0.00 0.03 0.00 0.00 46.19 42.77 1fn0 s LEU 136 CO 0.01 0.09 0.10 -0.47 0.23 0.00 0.00 176.35 176.31 1fn0 s TYR 137 N -1.55 3.36 -0.37 0.29 5.04 0.28 -2.30 117.35 122.09 1fn0 s TYR 137 Ca 0.38 0.24 -0.05 0.00 -2.44 0.00 0.00 57.07 55.20 1fn0 s TYR 137 Cb -0.13 -2.11 0.07 0.00 0.35 0.00 0.00 41.96 40.15 1fn0 s TYR 137 CO 0.21 0.27 0.15 0.00 -1.34 0.00 0.00 175.55 174.84 1fn0 s GLN 139 N 1.28 3.73 0.73 0.00 -2.07 -0.88 -4.65 119.66 117.80 1fn0 s GLN 139 Ca 0.02 0.85 -0.15 0.00 -1.82 0.00 0.00 55.36 54.27 1fn0 s GLN 139 Cb -0.21 -2.10 0.04 0.00 -1.09 0.00 0.00 33.01 29.64 1fn0 s GLN 139 CO -0.01 -0.45 1.19 -1.58 -1.32 0.00 0.00 175.29 173.12 1fn0 s HIS 140 N -2.92 2.14 -0.33 9.60 5.65 -1.26 -0.67 115.29 127.50 1fn0 s HIS 140 Ca 0.57 1.60 0.06 0.00 0.25 0.00 0.00 55.06 57.54 1fn0 s HIS 140 Cb -0.11 -3.41 0.45 0.00 -1.18 0.00 0.00 32.58 28.34 1fn0 s HIS 140 CO 0.44 -2.45 1.21 -3.47 -0.65 0.00 0.00 174.74 169.82 1fn0 n ASP 141 N -2.74 5.00 0.00 9.88 4.64 -0.86 -4.63 116.55 127.84 1fn0 n ASP 141 Ca 0.13 -3.75 0.00 0.00 -1.38 0.00 0.00 54.79 49.79 1fn0 n ASP 141 Cb 0.51 -0.39 0.00 0.00 -1.04 0.00 0.00 41.12 40.20 1fn0 n ASP 141 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 1fn0 n GLU 142 N -0.67 0.00 0.00 -0.67 4.71 -1.26 -3.34 120.64 119.40 1fn0 n GLU 142 Ca 0.44 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.59 1fn0 n GLU 142 Cb 0.90 -4.03 0.00 0.00 -1.01 0.00 0.00 31.44 27.30 1fn0 n GLU 142 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1fn0 n GLU 143 N -2.00 0.00 0.00 3.49 4.07 -1.26 -5.12 120.64 119.82 1fn0 n GLU 143 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1fn0 n GLU 143 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1fn0 n GLU 143 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1fn0 n ASP 144 N -1.53 0.00 -3.62 4.31 4.64 -1.21 -5.16 116.55 113.98 1fn0 n ASP 144 Ca 0.00 0.00 -0.08 0.00 -1.38 0.00 0.00 54.79 53.33 1fn0 n ASP 144 Cb 0.00 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.02 1fn0 n ASP 144 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 1fn0 s VAL 145 N 3.69 0.00 -0.10 5.18 0.11 -1.26 -2.02 120.40 126.00 1fn0 s VAL 145 Ca 0.00 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 1fn0 s VAL 145 Cb 0.00 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.88 1fn0 s VAL 145 CO 0.00 0.00 -0.04 -0.75 -3.33 0.00 0.00 175.10 170.98 1fn0 s LYS 146 N -0.30 1.16 -1.10 1.54 2.47 0.16 -4.81 119.74 118.86 1fn0 s LYS 146 Ca 0.03 -0.11 -0.19 0.00 -1.56 0.00 0.00 55.97 54.14 1fn0 s LYS 146 Cb -0.03 -1.34 0.10 0.00 -1.46 0.00 0.00 37.83 35.09 1fn0 s LYS 146 CO -0.06 -0.28 1.43 0.00 0.16 0.00 0.00 175.35 176.60 1fn0 n ASP 148 N 7.47 1.12 -4.22 0.00 3.85 -1.23 -4.96 116.55 118.60 1fn0 n ASP 148 Ca 0.35 -1.64 -0.21 0.00 -0.71 0.00 0.00 54.79 52.58 1fn0 n ASP 148 Cb 0.48 -0.03 -0.12 0.00 -1.35 0.00 0.00 41.12 40.09 1fn0 n ASP 148 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 1fn0 s GLN 149 N -0.64 0.98 0.22 0.11 -0.21 -1.22 -5.05 119.66 113.85 1fn0 s GLN 149 Ca 0.02 -1.01 0.07 0.00 0.02 0.00 0.00 55.36 54.46 1fn0 s GLN 149 Cb 0.01 -1.09 -0.04 0.00 1.00 0.00 0.00 33.01 32.89 1fn0 s GLN 149 CO 0.00 0.25 0.11 0.71 -2.12 0.00 0.00 175.29 174.24 1fn0 s TYR 150 N -1.15 2.99 -0.11 0.91 1.51 -1.26 -0.56 117.35 119.68 1fn0 s TYR 150 Ca 0.02 -0.12 -0.13 0.00 -1.01 0.00 0.00 57.07 55.83 1fn0 s TYR 150 Cb -0.10 -1.38 -0.05 0.00 -0.11 0.00 0.00 41.96 40.32 1fn0 s TYR 150 CO 0.03 0.54 0.31 0.42 -1.11 0.00 0.00 175.55 175.74 1fn0 s ILE 151 N -2.01 5.26 0.00 2.71 -1.09 0.47 -0.27 121.20 126.27 1fn0 s ILE 151 Ca 0.31 0.60 0.00 0.00 -2.23 0.00 0.00 60.65 59.33 1fn0 s ILE 151 Cb -0.08 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.16 1fn0 s ILE 151 CO 0.22 0.46 0.00 0.61 -1.23 0.00 0.00 174.94 175.01 1fn0 n GLY 152 N 2.80 5.64 3.23 6.18 0.00 0.67 -1.99 105.19 121.73 1fn0 n GLY 152 Ca -0.13 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.06 1fn0 n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fn0 s ILE 153 N 0.96 1.84 -0.10 -0.61 -1.09 -1.26 -1.85 121.20 119.10 1fn0 s ILE 153 Ca 0.00 -0.96 -0.01 0.00 -2.23 0.00 0.00 60.65 57.45 1fn0 s ILE 153 Cb 0.00 -1.56 0.03 0.00 -1.58 0.00 0.00 42.46 39.35 1fn0 s ILE 153 CO 0.00 0.52 -0.02 -2.28 -1.23 0.00 0.00 174.94 171.93 1fn0 s HIS 154 N -0.19 0.99 -0.41 3.97 5.65 -0.20 -4.94 115.29 120.16 1fn0 s HIS 154 Ca -0.01 -0.46 -0.27 0.00 0.25 0.00 0.00 55.06 54.57 1fn0 s HIS 154 Cb -0.12 -0.98 0.02 0.00 -1.18 0.00 0.00 32.58 30.32 1fn0 s HIS 154 CO 0.02 -0.43 0.99 0.50 -0.65 0.00 0.00 174.74 175.17 1fn0 s ARG 155 N 1.87 3.75 0.86 2.88 3.52 -1.26 -1.89 118.95 128.67 1fn0 s ARG 155 Ca 0.04 0.50 -0.12 0.00 -0.13 0.00 0.00 55.73 56.02 1fn0 s ARG 155 Cb -0.13 -3.86 0.11 0.00 -1.56 0.00 0.00 34.95 29.51 1fn0 s ARG 155 CO -0.06 -1.12 1.12 0.16 -0.81 0.00 0.00 175.30 174.58 1fn0 s ASP 156 N 2.10 3.95 0.00 -2.12 1.47 -0.76 -4.79 116.67 116.53 1fn0 s ASP 156 Ca 0.41 1.14 0.00 0.00 1.18 0.00 0.00 52.55 55.27 1fn0 s ASP 156 Cb -0.10 -1.79 0.00 0.00 -0.34 0.00 0.00 42.92 40.68 1fn0 s ASP 156 CO 0.23 -2.29 0.51 -2.11 0.68 0.00 0.00 175.17 172.19 1fn0 n ARG 157 N -3.62 0.00 0.00 2.11 1.85 -1.26 0.16 116.66 115.90 1fn0 n ARG 157 Ca 0.07 0.08 0.06 0.00 -1.00 0.00 0.00 57.85 57.06 1fn0 n ARG 157 Cb 0.58 -1.52 0.01 0.00 -1.05 0.00 0.00 32.46 30.48 1fn0 n ARG 157 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1fn0 n ASN 158 N -1.01 1.59 0.00 2.89 5.03 -1.26 -4.97 115.26 117.53 1fn0 n ASN 158 Ca 0.00 -1.29 0.00 0.00 0.87 0.00 0.00 54.58 54.16 1fn0 n ASN 158 Cb 0.02 0.34 0.00 0.00 -1.02 0.00 0.00 39.78 39.12 1fn0 n ASN 158 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1fn0 n GLY 159 N 0.94 0.16 3.74 7.41 0.00 0.41 -5.05 105.19 112.81 1fn0 n GLY 159 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1fn0 n GLY 159 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fn0 s ASN 160 N -2.18 6.37 -1.18 1.61 0.01 -1.26 -4.72 114.94 113.60 1fn0 s ASN 160 Ca 0.00 2.93 -0.12 0.00 -0.71 0.00 0.00 52.86 54.96 1fn0 s ASN 160 Cb 0.00 -2.62 0.20 0.00 0.41 0.00 0.00 41.25 39.24 1fn0 s ASN 160 CO 0.00 -0.94 1.34 -0.13 -1.51 0.00 0.00 177.10 175.86 1fn0 s ARG 161 N -0.02 4.13 0.15 -0.60 3.00 -1.26 -1.82 118.95 122.52 1fn0 s ARG 161 Ca 0.67 -2.77 -0.30 0.00 0.00 0.00 0.00 55.73 53.32 1fn0 s ARG 161 Cb -0.48 -4.91 -0.08 0.00 0.00 0.00 0.00 34.95 29.48 1fn0 s ARG 161 CO 0.43 -1.61 1.25 1.03 0.00 0.00 0.00 175.30 176.40 1fn0 s ARG 162 N 0.73 4.44 -0.24 3.54 0.52 -0.79 -0.82 118.95 126.32 1fn0 s ARG 162 Ca 0.39 1.92 -0.26 0.00 -0.52 0.00 0.00 55.73 57.26 1fn0 s ARG 162 Cb -0.05 -3.25 -0.00 0.00 0.52 0.00 0.00 34.95 32.17 1fn0 s ARG 162 CO -0.02 -0.20 0.89 -0.51 0.02 0.00 0.00 175.30 175.48 1fn0 s LEU 163 N 0.22 4.09 0.15 2.53 1.02 -0.83 -1.04 118.68 124.83 1fn0 s LEU 163 Ca 0.56 1.14 -0.06 0.00 0.02 0.00 0.00 54.13 55.80 1fn0 s LEU 163 Cb -0.33 -3.29 -0.02 0.00 0.02 0.00 0.00 46.19 42.56 1fn0 s LEU 163 CO 0.35 -0.56 0.19 0.68 0.02 0.00 0.00 176.35 177.03 1fn0 s VAL 164 N 2.94 0.08 0.40 -1.59 -7.23 -0.77 -1.96 120.40 112.27 1fn0 s VAL 164 Ca 0.38 -1.62 -0.27 0.00 -1.81 0.00 0.00 61.98 58.66 1fn0 s VAL 164 Cb -0.15 -1.96 -0.09 0.00 0.56 0.00 0.00 36.38 34.74 1fn0 s VAL 164 CO 0.07 -0.34 1.35 -0.69 -0.31 0.00 0.00 175.10 175.18 1fn0 s VAL 165 N -4.01 2.46 0.18 1.32 1.01 -0.63 -0.23 120.40 120.50 1fn0 s VAL 165 Ca 0.21 0.43 0.07 0.00 0.00 0.00 0.00 61.98 62.69 1fn0 s VAL 165 Cb 0.05 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1fn0 s VAL 165 CO 0.01 0.08 -0.15 0.28 0.00 0.00 0.00 175.10 175.32 1fn0 s THR 166 N -1.21 1.65 -0.10 3.92 -1.32 0.62 -4.74 115.64 114.47 1fn0 s THR 166 Ca 0.56 -2.07 0.03 0.00 -1.21 0.00 0.00 61.69 59.00 1fn0 s THR 166 Cb -0.40 -1.91 -0.08 0.00 -1.51 0.00 0.00 72.50 68.60 1fn0 s THR 166 CO 0.53 -0.53 -0.05 1.21 -2.21 0.00 0.00 174.62 173.57 1fn0 n GLU 167 N -0.09 1.06 0.00 7.08 2.13 -1.26 -3.99 120.64 125.57 1fn0 n GLU 167 Ca -0.10 0.04 0.00 0.00 0.66 0.00 0.00 57.16 57.76 1fn0 n GLU 167 Cb 0.59 -1.21 0.00 0.00 0.27 0.00 0.00 31.44 31.09 1fn0 n GLU 167 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1fn0 n GLU 168 N -2.64 0.00 -3.32 5.31 -0.58 -1.26 -4.93 120.64 113.22 1fn0 n GLU 168 Ca -0.17 0.00 -0.47 0.00 -0.42 0.00 0.00 57.16 56.11 1fn0 n GLU 168 Cb 0.72 -0.06 -0.03 0.00 -0.57 0.00 0.00 31.44 31.50 1fn0 n GLU 168 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1fn0 s ASN 169 N -1.00 6.54 0.68 1.62 -0.87 -1.26 -5.07 114.94 115.59 1fn0 s ASN 169 Ca 0.00 -2.34 -0.16 0.00 -1.57 0.00 0.00 52.86 48.79 1fn0 s ASN 169 Cb 0.00 -2.21 0.01 0.00 -0.02 0.00 0.00 41.25 39.03 1fn0 s ASN 169 CO 0.00 -0.69 1.17 -2.16 -2.57 0.00 0.00 177.10 172.85 1fn0 s PRO 170 N 0.73 2.53 0.61 -0.60 0.04 -1.26 -4.50 135.00 132.55 1fn0 s PRO 170 Ca 0.12 1.62 -0.10 0.00 0.04 0.00 0.00 61.00 62.69 1fn0 s PRO 170 Cb -0.18 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 1fn0 s PRO 170 CO -0.04 -1.50 1.00 -0.48 0.04 0.00 0.00 177.00 176.01 1fn0 s LEU 171 N -4.86 3.25 -0.06 -3.56 0.05 -0.84 -4.95 118.68 107.71 1fn0 s LEU 171 Ca 0.72 1.29 -0.00 0.00 0.05 0.00 0.00 54.13 56.19 1fn0 s LEU 171 Cb -0.26 -4.29 0.03 0.00 -2.05 0.00 0.00 46.19 39.62 1fn0 s LEU 171 CO 0.42 -0.88 -0.01 -1.61 -0.55 0.00 0.00 176.35 173.71 1fn0 s GLU 172 N -5.13 0.67 0.24 1.48 2.02 -1.26 -4.07 118.70 112.65 1fn0 s GLU 172 Ca 0.54 0.03 0.11 0.00 0.02 0.00 0.00 54.97 55.67 1fn0 s GLU 172 Cb -0.11 -0.89 -0.05 0.00 0.10 0.00 0.00 34.13 33.18 1fn0 s GLU 172 CO 0.52 -0.21 -0.19 -0.51 0.02 0.00 0.00 175.26 174.88 1fn0 s LEU 173 N 1.53 2.54 0.03 1.80 1.43 0.74 -1.42 118.68 125.33 1fn0 s LEU 173 Ca -0.02 -0.98 0.09 0.00 -1.03 0.00 0.00 54.13 52.19 1fn0 s LEU 173 Cb -0.13 -1.00 -0.03 0.00 0.03 0.00 0.00 46.19 45.06 1fn0 s LEU 173 CO -0.03 0.01 -0.25 0.68 0.23 0.00 0.00 176.35 176.98 1fn0 s VAL 174 N -2.38 2.01 -0.37 -1.59 -7.23 -0.08 -1.25 120.40 109.52 1fn0 s VAL 174 Ca 0.25 -1.27 -0.10 0.00 -1.81 0.00 0.00 61.98 59.05 1fn0 s VAL 174 Cb -0.05 -1.71 0.03 0.00 0.56 0.00 0.00 36.38 35.21 1fn0 s VAL 174 CO 0.11 0.39 0.18 -0.76 -0.31 0.00 0.00 175.10 174.72 1fn0 s LEU 175 N -1.06 4.64 -0.25 1.32 1.43 -1.26 -1.84 118.68 121.66 1fn0 s LEU 175 Ca 0.10 -1.06 -0.10 0.00 -1.03 0.00 0.00 54.13 52.05 1fn0 s LEU 175 Cb -0.10 -1.98 -0.05 0.00 0.03 0.00 0.00 46.19 44.09 1fn0 s LEU 175 CO 0.01 -0.38 0.16 -0.22 0.23 0.00 0.00 176.35 176.15 1fn0 s LEU 176 N 1.51 4.00 0.30 1.79 2.96 -0.49 0.14 118.68 128.89 1fn0 s LEU 176 Ca 0.01 0.04 -0.29 0.00 -0.22 0.00 0.00 54.13 53.66 1fn0 s LEU 176 Cb -0.19 -2.09 -0.11 0.00 0.50 0.00 0.00 46.19 44.30 1fn0 s LEU 176 CO 0.06 0.02 1.52 -0.75 -1.32 0.00 0.00 176.35 175.87 1fn0 s LYS 177 N 1.33 4.16 0.48 1.98 2.47 -1.26 0.02 119.74 128.92 1fn0 s LYS 177 Ca 0.07 2.50 -0.13 0.00 -1.56 0.00 0.00 55.97 56.84 1fn0 s LYS 177 Cb -0.15 -3.03 -0.07 0.00 -1.46 0.00 0.00 37.83 33.13 1fn0 s LYS 177 CO 0.07 -0.54 0.90 0.00 0.16 0.00 0.00 175.35 175.94 1fn0 s ALA 178 N -0.33 3.19 0.63 3.13 0.00 0.05 -4.78 121.76 123.65 1fn0 s ALA 178 Ca 0.59 -0.02 -0.17 0.00 0.00 0.00 0.00 51.96 52.36 1fn0 s ALA 178 Cb -0.46 -2.93 -0.12 0.00 0.00 0.00 0.00 23.12 19.61 1fn0 s ALA 178 CO 0.51 -0.20 0.03 1.63 0.00 0.00 0.00 175.76 177.73 1fn0 n LYS 179 N -1.61 0.15 0.00 0.00 4.76 -1.26 -4.93 118.16 115.27 1fn0 n LYS 179 Ca 0.05 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 1fn0 n LYS 179 Cb 0.54 -1.30 0.00 0.00 -1.84 0.00 0.00 35.03 32.43 1fn0 n LYS 179 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48