#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fgv s GLN 2 N 0.00 3.76 -0.24 0.54 0.74 -1.26 -5.10 119.66 118.10 2fgv s GLN 2 Ca 0.00 -0.46 -0.03 0.00 0.05 0.00 0.00 55.36 54.92 2fgv s GLN 2 Cb 0.00 -3.07 0.01 0.00 1.10 0.00 0.00 33.01 31.05 2fgv s GLN 2 CO 0.00 0.18 -0.03 0.42 -0.55 0.00 0.00 175.29 175.31 2fgv s ILE 3 N 0.56 3.27 0.84 -2.34 -1.09 -1.26 -5.11 121.20 116.07 2fgv s ILE 3 Ca -0.00 -0.75 -0.11 0.00 -2.23 0.00 0.00 60.65 57.56 2fgv s ILE 3 Cb -0.14 -2.59 0.13 0.00 -1.58 0.00 0.00 42.46 38.28 2fgv s ILE 3 CO 0.02 0.27 1.18 0.42 -1.23 0.00 0.00 174.94 175.60 2fgv s THR 4 N 1.42 2.08 -0.13 2.92 -4.23 -1.26 -5.02 115.64 111.42 2fgv s THR 4 Ca 0.03 -0.14 0.15 0.00 -1.18 0.00 0.00 61.69 60.55 2fgv s THR 4 Cb -0.16 -2.94 0.26 0.00 1.34 0.00 0.00 72.50 71.00 2fgv s THR 4 CO -0.03 0.00 1.15 0.18 -0.54 0.00 0.00 174.62 175.38 2fgv n LEU 5 N -3.35 2.45 -0.20 4.79 4.77 -1.26 -4.62 117.00 119.58 2fgv n LEU 5 Ca 0.12 -2.83 0.02 0.00 -0.03 0.00 0.00 56.01 53.29 2fgv n LEU 5 Cb 0.60 -0.35 0.28 0.00 -2.33 0.00 0.00 43.42 41.62 2fgv n LEU 5 CO 0.50 0.66 1.23 -0.50 -1.33 0.00 0.00 177.39 177.95 2fgv h TRP 6 N 0.24 0.89 -1.87 -1.77 4.06 -2.06 -3.43 115.95 112.01 2fgv h TRP 6 Ca 0.00 0.02 -0.61 0.00 2.06 0.00 0.00 58.89 60.36 2fgv h TRP 6 Cb 0.94 -0.30 -0.13 0.00 -1.00 0.00 0.00 29.16 28.66 2fgv h TRP 6 CO 0.06 0.54 -0.62 0.15 -3.56 0.00 0.00 178.44 175.01 2fgv s LYS 7 N -5.80 1.89 0.16 0.49 1.02 -1.26 -5.10 119.74 111.14 2fgv s LYS 7 Ca -0.11 -2.05 -0.34 0.00 0.02 0.00 0.00 55.97 53.50 2fgv s LYS 7 Cb 0.18 -1.55 -0.15 0.00 -0.52 0.00 0.00 37.83 35.79 2fgv s LYS 7 CO 0.78 -0.03 1.42 0.54 -0.92 0.00 0.00 175.35 177.14 2fgv n ARG 8 N -0.90 1.71 -1.69 1.68 1.74 -1.26 -4.82 116.66 113.11 2fgv n ARG 8 Ca -0.05 0.61 -0.41 0.00 -0.77 0.00 0.00 57.85 57.23 2fgv n ARG 8 Cb 0.66 -2.28 -0.02 0.00 -1.02 0.00 0.00 32.46 29.79 2fgv n ARG 8 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2fgv n PRO 9 N 2.63 2.37 -3.23 5.56 -0.04 -1.26 -4.92 135.00 136.10 2fgv n PRO 9 Ca 0.16 -2.45 -0.39 0.00 -0.04 0.00 0.00 63.50 60.79 2fgv n PRO 9 Cb 0.26 -3.24 -0.06 0.00 -0.04 0.00 0.00 33.50 30.42 2fgv n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2fgv s LEU 10 N 2.91 4.25 0.26 1.53 1.43 -1.26 -1.21 118.68 126.60 2fgv s LEU 10 Ca 0.53 0.87 0.01 0.00 -1.03 0.00 0.00 54.13 54.51 2fgv s LEU 10 Cb 0.12 -2.79 -0.05 0.00 0.03 0.00 0.00 46.19 43.50 2fgv s LEU 10 CO 0.02 -0.07 0.10 0.68 0.23 0.00 0.00 176.35 177.31 2fgv s VAL 11 N 0.92 0.52 -0.01 -1.59 -7.23 0.11 -4.91 120.40 108.20 2fgv s VAL 11 Ca 0.28 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.25 2fgv s VAL 11 Cb -0.16 -2.62 -0.05 0.00 0.56 0.00 0.00 36.38 34.11 2fgv s VAL 11 CO 0.12 0.00 0.57 -0.89 -0.31 0.00 0.00 175.10 174.58 2fgv s THR 12 N -3.76 4.93 0.26 5.32 2.01 -1.26 -0.41 115.64 122.73 2fgv s THR 12 Ca 0.38 1.18 0.10 0.00 0.31 0.00 0.00 61.69 63.66 2fgv s THR 12 Cb 0.08 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.64 2fgv s THR 12 CO 0.14 0.43 -0.18 0.27 -0.69 0.00 0.00 174.62 174.59 2fgv s ILE 13 N -0.24 2.22 -0.14 1.82 -4.36 0.45 -1.71 121.20 119.24 2fgv s ILE 13 Ca 0.30 -2.33 0.02 0.00 -0.26 0.00 0.00 60.65 58.38 2fgv s ILE 13 Cb -0.18 -2.23 0.01 0.00 1.25 0.00 0.00 42.46 41.31 2fgv s ILE 13 CO 0.16 -0.46 -0.22 -0.60 0.24 0.00 0.00 174.94 174.07 2fgv s ARG 14 N -3.56 3.03 -0.03 0.37 3.52 0.73 -1.17 118.95 121.84 2fgv s ARG 14 Ca 0.28 -0.85 -0.01 0.00 -0.13 0.00 0.00 55.73 55.01 2fgv s ARG 14 Cb -0.03 -2.44 0.02 0.00 -1.56 0.00 0.00 34.95 30.95 2fgv s ARG 14 CO 0.12 -0.01 0.05 -1.50 -0.81 0.00 0.00 175.30 173.16 2fgv s ILE 15 N 0.80 -0.04 -1.70 4.11 2.07 -0.43 -1.09 121.20 124.93 2fgv s ILE 15 Ca -0.07 0.16 0.00 0.00 -1.41 0.00 0.00 60.65 59.32 2fgv s ILE 15 Cb -0.16 -0.11 0.00 0.00 0.13 0.00 0.00 42.46 42.33 2fgv s ILE 15 CO -0.02 0.06 0.00 0.61 -1.91 0.00 0.00 174.94 173.69 2fgv n GLY 16 N 3.91 0.24 3.07 1.50 0.00 -1.26 -1.78 105.19 110.85 2fgv n GLY 16 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2fgv n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fgv n GLY 17 N -0.75 1.33 3.71 -0.02 0.00 -1.26 -5.02 105.19 103.17 2fgv n GLY 17 Ca -0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.53 2fgv n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fgv s GLN 18 N -0.04 2.60 -0.06 1.61 -0.21 -0.74 -5.06 119.66 117.76 2fgv s GLN 18 Ca 0.00 -0.91 -0.13 0.00 0.02 0.00 0.00 55.36 54.34 2fgv s GLN 18 Cb 0.00 -2.52 -0.05 0.00 1.00 0.00 0.00 33.01 31.44 2fgv s GLN 18 CO 0.00 0.51 0.33 -0.51 -2.12 0.00 0.00 175.29 173.50 2fgv s LEU 19 N -2.65 4.40 0.11 2.90 1.43 -1.26 -1.31 118.68 122.29 2fgv s LEU 19 Ca 0.28 0.76 0.00 0.00 -1.03 0.00 0.00 54.13 54.14 2fgv s LEU 19 Cb -0.11 -2.44 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 2fgv s LEU 19 CO 0.20 0.28 -0.02 -0.54 0.23 0.00 0.00 176.35 176.50 2fgv s LYS 20 N -0.66 0.85 -0.11 1.70 1.02 -0.32 -4.98 119.74 117.23 2fgv s LYS 20 Ca 0.21 -1.36 -0.11 0.00 0.02 0.00 0.00 55.97 54.72 2fgv s LYS 20 Cb -0.15 -0.01 -0.05 0.00 -0.52 0.00 0.00 37.83 37.10 2fgv s LYS 20 CO 0.09 -0.12 0.24 -2.00 -0.92 0.00 0.00 175.35 172.65 2fgv s GLU 21 N -3.92 3.86 0.03 1.68 2.12 -1.26 -0.41 118.70 120.79 2fgv s GLU 21 Ca 0.15 0.04 -0.08 0.00 0.36 0.00 0.00 54.97 55.44 2fgv s GLU 21 Cb 0.07 -3.29 -0.00 0.00 0.26 0.00 0.00 34.13 31.17 2fgv s GLU 21 CO -0.03 0.56 0.16 0.00 -0.54 0.00 0.00 175.26 175.40 2fgv s ALA 22 N -0.47 -0.29 -0.24 6.30 0.00 0.45 -4.33 121.76 123.18 2fgv s ALA 22 Ca 0.16 -0.28 -0.16 0.00 0.00 0.00 0.00 51.96 51.68 2fgv s ALA 22 Cb -0.13 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 2fgv s ALA 22 CO 0.05 -0.30 0.43 -1.17 0.00 0.00 0.00 175.76 174.77 2fgv s LEU 23 N -1.85 4.09 -0.23 0.00 2.96 0.53 -0.72 118.68 123.47 2fgv s LEU 23 Ca -0.08 0.46 -0.29 0.00 -0.22 0.00 0.00 54.13 54.00 2fgv s LEU 23 Cb -0.03 -2.54 -0.01 0.00 0.50 0.00 0.00 46.19 44.11 2fgv s LEU 23 CO -0.02 -0.17 1.30 -0.76 -1.32 0.00 0.00 176.35 175.38 2fgv s LEU 24 N 1.81 4.02 -0.42 -0.68 1.43 -0.35 -0.44 118.68 124.06 2fgv s LEU 24 Ca 0.19 1.46 0.02 0.00 -1.03 0.00 0.00 54.13 54.76 2fgv s LEU 24 Cb -0.15 -3.54 0.13 0.00 0.03 0.00 0.00 46.19 42.66 2fgv s LEU 24 CO 0.09 -0.94 0.22 -0.62 0.23 0.00 0.00 176.35 175.32 2fgv s ASP 25 N 2.50 3.68 0.49 2.29 -1.08 -0.11 -4.78 116.67 119.66 2fgv s ASP 25 Ca 0.56 -2.47 0.32 0.00 -0.52 0.00 0.00 52.55 50.44 2fgv s ASP 25 Cb -0.19 -0.99 1.36 0.00 -1.46 0.00 0.00 42.92 41.63 2fgv s ASP 25 CO 0.19 -0.29 1.94 0.71 0.52 0.00 0.00 175.17 178.25 2fgv h THR 26 N 5.42 0.00 -0.10 1.71 1.35 -1.93 -2.33 112.91 117.03 2fgv h THR 26 Ca -0.02 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 2fgv h THR 26 Cb 0.94 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 2fgv h THR 26 CO 0.47 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.35 2fgv n GLY 27 N -0.10 -0.08 3.53 5.82 0.00 -1.26 -4.81 105.19 108.29 2fgv n GLY 27 Ca 0.01 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 2fgv n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fgv s ALA 28 N -1.88 3.29 0.27 4.61 0.00 -0.88 -4.97 121.76 122.21 2fgv s ALA 28 Ca 0.33 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.29 2fgv s ALA 28 Cb 0.17 -2.06 0.37 0.00 0.00 0.00 0.00 23.12 21.60 2fgv s ALA 28 CO 0.27 -0.25 1.79 -0.44 0.00 0.00 0.00 175.76 177.14 2fgv h ASP 29 N 7.68 0.75 -1.91 0.00 3.32 -1.87 0.45 116.42 124.85 2fgv h ASP 29 Ca -0.37 -0.16 -0.59 0.00 0.02 0.00 0.00 57.03 55.93 2fgv h ASP 29 Cb 1.18 -0.20 -0.11 0.00 0.22 0.00 0.00 39.33 40.42 2fgv h ASP 29 CO 0.62 0.78 -0.62 -1.81 -1.72 0.00 0.00 179.24 176.49 2fgv s ASP 30 N -6.62 4.14 -0.25 6.45 1.01 -1.26 -3.19 116.67 116.94 2fgv s ASP 30 Ca -0.09 -1.02 -0.10 0.00 0.71 0.00 0.00 52.55 52.04 2fgv s ASP 30 Cb 0.15 -0.51 -0.04 0.00 1.01 0.00 0.00 42.92 43.53 2fgv s ASP 30 CO 0.80 -0.25 0.14 -0.89 0.21 0.00 0.00 175.17 175.18 2fgv s THR 31 N -2.53 5.05 -0.14 -1.27 2.01 -1.26 -3.09 115.64 114.40 2fgv s THR 31 Ca 0.35 0.07 0.00 0.00 0.31 0.00 0.00 61.69 62.42 2fgv s THR 31 Cb 0.01 -3.37 0.02 0.00 0.01 0.00 0.00 72.50 69.17 2fgv s THR 31 CO 0.19 0.32 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.64 2fgv s VAL 32 N 1.35 1.36 0.13 3.82 1.01 -0.50 -0.91 120.40 126.66 2fgv s VAL 32 Ca 0.06 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.58 2fgv s VAL 32 Cb -0.15 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 2fgv s VAL 32 CO 0.06 0.41 0.11 -0.76 0.00 0.00 0.00 175.10 174.93 2fgv s LEU 33 N 1.57 3.80 0.86 3.92 1.43 0.20 -0.58 118.68 129.87 2fgv s LEU 33 Ca 0.05 -0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 52.94 2fgv s LEU 33 Cb -0.13 -2.44 0.09 0.00 0.03 0.00 0.00 46.19 43.75 2fgv s LEU 33 CO -0.10 0.11 1.04 -0.62 0.23 0.00 0.00 176.35 177.01 2fgv n GLU 34 N -0.01 -0.08 -1.64 1.70 1.02 -1.26 -1.15 120.64 119.22 2fgv n GLU 34 Ca -0.08 0.05 -0.53 0.00 -0.02 0.00 0.00 57.16 56.57 2fgv n GLU 34 Cb 0.53 -2.30 -0.06 0.00 -0.02 0.00 0.00 31.44 29.59 2fgv n GLU 34 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2fgv n GLU 35 N -3.22 1.23 -3.66 3.49 4.07 -0.83 -4.56 120.64 117.16 2fgv n GLU 35 Ca 0.12 0.45 -0.14 0.00 -0.06 0.00 0.00 57.16 57.52 2fgv n GLU 35 Cb 0.51 -2.12 -0.08 0.00 -0.06 0.00 0.00 31.44 29.70 2fgv n GLU 35 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2fgv s MET 36 N 1.65 0.73 -1.17 5.31 0.23 -1.26 -5.04 119.30 119.75 2fgv s MET 36 Ca 0.89 0.71 -0.06 0.00 -1.03 0.00 0.00 55.69 56.20 2fgv s MET 36 Cb -0.97 0.35 0.24 0.00 -1.53 0.00 0.00 34.83 32.93 2fgv s MET 36 CO 0.53 -0.11 1.68 -1.71 -2.03 0.00 0.00 175.02 173.38 2fgv n ASN 37 N 2.48 5.90 -4.77 -1.18 2.85 -1.26 -5.00 115.26 114.28 2fgv n ASN 37 Ca -0.15 -3.29 -0.40 0.00 -0.11 0.00 0.00 54.58 50.64 2fgv n ASN 37 Cb 0.56 -1.36 -0.00 0.00 1.24 0.00 0.00 39.78 40.22 2fgv n ASN 37 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2fgv s LEU 38 N -1.68 4.22 0.75 1.20 1.43 -1.26 -4.99 118.68 118.36 2fgv s LEU 38 Ca 0.35 2.78 -0.12 0.00 -1.03 0.00 0.00 54.13 56.11 2fgv s LEU 38 Cb 0.08 -3.85 0.05 0.00 0.03 0.00 0.00 46.19 42.49 2fgv s LEU 38 CO 0.06 -0.91 1.11 -2.16 0.23 0.00 0.00 176.35 174.68 2fgv s PRO 39 N -2.23 2.29 0.00 1.29 0.04 -1.26 -4.96 135.00 130.17 2fgv s PRO 39 Ca 0.57 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.92 2fgv s PRO 39 Cb -0.41 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.24 2fgv s PRO 39 CO 0.53 -1.64 0.00 0.41 0.04 0.00 0.00 177.00 176.34 2fgv n GLY 40 N -0.74 -3.11 3.81 0.56 0.00 -1.26 -4.99 105.19 99.46 2fgv n GLY 40 Ca 0.10 -2.10 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 2fgv n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fgv s LYS 41 N -0.59 3.86 0.13 1.61 1.02 -1.26 -5.07 119.74 119.45 2fgv s LYS 41 Ca 0.00 1.22 -0.07 0.00 0.02 0.00 0.00 55.97 57.14 2fgv s LYS 41 Cb 0.00 -2.11 -0.01 0.00 -0.52 0.00 0.00 37.83 35.18 2fgv s LYS 41 CO 0.00 -0.36 0.21 1.67 -0.92 0.00 0.00 175.35 175.94 2fgv s TRP 42 N -2.20 0.42 0.02 3.18 1.48 -1.26 -4.69 118.94 115.90 2fgv s TRP 42 Ca 0.64 -0.81 0.07 0.00 -1.06 0.00 0.00 56.10 54.94 2fgv s TRP 42 Cb -0.13 -0.15 -0.02 0.00 -1.16 0.00 0.00 33.47 32.01 2fgv s TRP 42 CO 0.22 -0.63 -0.22 0.15 -4.06 0.00 0.00 176.95 172.42 2fgv s LYS 43 N -3.95 1.57 0.45 3.25 -0.14 -0.59 -4.89 119.74 115.44 2fgv s LYS 43 Ca 0.15 -0.89 -0.24 0.00 -1.36 0.00 0.00 55.97 53.63 2fgv s LYS 43 Cb 0.05 -1.62 -0.08 0.00 -1.68 0.00 0.00 37.83 34.50 2fgv s LYS 43 CO -0.03 0.43 1.30 -2.14 -0.76 0.00 0.00 175.35 174.15 2fgv s PRO 44 N -0.91 3.72 0.02 -1.68 0.02 -1.26 -0.30 135.00 134.61 2fgv s PRO 44 Ca 0.08 2.13 -0.10 0.00 0.02 0.00 0.00 61.00 63.13 2fgv s PRO 44 Cb -0.09 -2.58 0.01 0.00 0.02 0.00 0.00 34.50 31.86 2fgv s PRO 44 CO 0.01 -0.68 0.20 0.21 -0.33 0.00 0.00 177.00 176.40 2fgv s LYS 45 N -2.49 0.63 -0.12 5.54 2.20 -0.63 -4.87 119.74 120.01 2fgv s LYS 45 Ca 0.62 -0.50 0.02 0.00 -0.36 0.00 0.00 55.97 55.74 2fgv s LYS 45 Cb -0.37 0.27 -0.00 0.00 -1.51 0.00 0.00 37.83 36.21 2fgv s LYS 45 CO 0.47 -0.17 -0.19 -1.64 -0.36 0.00 0.00 175.35 173.45 2fgv s MET 46 N -2.06 3.17 0.14 4.03 -1.94 -1.26 -0.98 119.30 120.39 2fgv s MET 46 Ca -0.09 -0.80 0.09 0.00 -1.71 0.00 0.00 55.69 53.17 2fgv s MET 46 Cb -0.03 -2.45 -0.04 0.00 2.01 0.00 0.00 34.83 34.31 2fgv s MET 46 CO -0.01 0.15 -0.20 0.96 -0.01 0.00 0.00 175.02 175.91 2fgv s ILE 47 N 0.46 1.81 0.21 2.53 -4.36 -0.71 -4.94 121.20 116.20 2fgv s ILE 47 Ca -0.14 -1.77 0.03 0.00 -0.26 0.00 0.00 60.65 58.51 2fgv s ILE 47 Cb -0.17 -1.75 -0.05 0.00 1.25 0.00 0.00 42.46 41.74 2fgv s ILE 47 CO 0.06 -0.20 -0.01 -0.83 0.24 0.00 0.00 174.94 174.20 2fgv s GLY 48 N -2.36 1.46 0.00 6.27 0.00 -1.26 -0.65 107.32 110.78 2fgv s GLY 48 Ca 0.12 -1.71 0.00 0.00 0.00 0.00 0.00 44.72 43.13 2fgv s GLY 48 CO 0.06 -1.63 0.00 0.61 0.00 0.00 0.00 173.10 172.14 2fgv n GLY 49 N -0.37 2.49 3.74 0.20 0.00 -0.84 -4.99 105.19 105.42 2fgv n GLY 49 Ca -0.06 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 2fgv n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fgv s ILE 50 N -1.14 2.06 0.00 -0.61 -1.09 -1.26 -2.37 121.20 116.79 2fgv s ILE 50 Ca 0.00 0.05 0.00 0.00 -2.23 0.00 0.00 60.65 58.47 2fgv s ILE 50 Cb 0.00 -3.03 0.00 0.00 -1.58 0.00 0.00 42.46 37.85 2fgv s ILE 50 CO 0.00 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.33 2fgv n GLY 51 N 2.75 1.54 0.00 6.18 0.00 -1.26 -4.96 105.19 109.44 2fgv n GLY 51 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2fgv n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fgv n GLY 52 N -2.00 0.56 3.81 -0.02 0.00 -1.00 -5.06 105.19 101.47 2fgv n GLY 52 Ca 0.00 -2.26 -0.31 0.00 0.00 0.00 0.00 46.02 43.45 2fgv n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fgv s PHE 53 N -0.15 3.28 0.13 1.61 0.40 -1.26 -1.99 117.98 119.99 2fgv s PHE 53 Ca 0.00 0.15 0.06 0.00 -0.60 0.00 0.00 56.93 56.54 2fgv s PHE 53 Cb 0.00 -1.68 -0.04 0.00 0.51 0.00 0.00 43.02 41.81 2fgv s PHE 53 CO 0.00 0.55 -0.14 0.96 0.70 0.00 0.00 175.22 177.28 2fgv s ILE 54 N -1.36 1.37 -0.05 0.64 -4.36 0.18 -4.97 121.20 112.65 2fgv s ILE 54 Ca 0.29 -1.75 -0.21 0.00 -0.26 0.00 0.00 60.65 58.72 2fgv s ILE 54 Cb -0.12 -1.58 -0.05 0.00 1.25 0.00 0.00 42.46 41.96 2fgv s ILE 54 CO 0.21 -0.42 0.59 -0.54 0.24 0.00 0.00 174.94 175.01 2fgv s LYS 55 N -2.74 4.35 0.15 0.37 1.02 -1.26 -1.73 119.74 119.89 2fgv s LYS 55 Ca 0.10 0.69 0.02 0.00 0.02 0.00 0.00 55.97 56.79 2fgv s LYS 55 Cb -0.05 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.82 2fgv s LYS 55 CO 0.03 0.23 -0.02 0.14 -0.92 0.00 0.00 175.35 174.81 2fgv s VAL 56 N 0.30 0.66 -0.21 3.17 -7.23 -0.16 -4.73 120.40 112.21 2fgv s VAL 56 Ca 0.31 -1.96 -0.08 0.00 -1.81 0.00 0.00 61.98 58.44 2fgv s VAL 56 Cb -0.17 -1.96 -0.04 0.00 0.56 0.00 0.00 36.38 34.77 2fgv s VAL 56 CO 0.15 -0.61 0.08 -0.13 -0.31 0.00 0.00 175.10 174.28 2fgv s ARG 57 N -3.89 3.91 -0.27 4.82 0.52 -0.50 -1.60 118.95 121.94 2fgv s ARG 57 Ca 0.20 -0.37 -0.12 0.00 -0.52 0.00 0.00 55.73 54.92 2fgv s ARG 57 Cb 0.06 -3.30 -0.05 0.00 0.52 0.00 0.00 34.95 32.18 2fgv s ARG 57 CO 0.01 0.12 0.25 -1.14 0.02 0.00 0.00 175.30 174.56 2fgv s GLN 58 N 0.82 3.99 -0.11 3.54 0.74 0.58 -0.60 119.66 128.62 2fgv s GLN 58 Ca 0.04 -0.19 0.01 0.00 0.05 0.00 0.00 55.36 55.28 2fgv s GLN 58 Cb -0.13 -3.64 -0.02 0.00 1.10 0.00 0.00 33.01 30.32 2fgv s GLN 58 CO 0.02 -0.18 -0.15 0.71 -0.55 0.00 0.00 175.29 175.14 2fgv s TYR 59 N 1.78 2.75 0.12 1.67 1.51 -0.14 -1.54 117.35 123.50 2fgv s TYR 59 Ca 0.10 -0.59 0.02 0.00 -1.01 0.00 0.00 57.07 55.59 2fgv s TYR 59 Cb -0.16 -1.78 -0.04 0.00 -0.11 0.00 0.00 41.96 39.88 2fgv s TYR 59 CO 0.10 -0.15 0.25 -0.51 -1.11 0.00 0.00 175.55 174.12 2fgv s ASP 60 N 0.12 6.26 -1.34 2.29 1.01 -1.26 -0.72 116.67 123.03 2fgv s ASP 60 Ca -0.07 0.17 -0.02 0.00 0.71 0.00 0.00 52.55 53.34 2fgv s ASP 60 Cb -0.15 -1.88 -0.00 0.00 1.01 0.00 0.00 42.92 41.90 2fgv s ASP 60 CO 0.05 0.09 0.56 0.00 0.21 0.00 0.00 175.17 176.08 2fgv n GLN 61 N -0.27 -3.64 -3.55 8.23 1.13 -1.10 -4.89 117.38 113.29 2fgv n GLN 61 Ca -0.07 0.49 -0.38 0.00 -1.94 0.00 0.00 57.00 55.11 2fgv n GLN 61 Cb 0.53 -4.73 -0.10 0.00 0.11 0.00 0.00 30.24 26.06 2fgv n GLN 61 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2fgv s ILE 62 N -3.80 5.28 0.18 5.09 -1.09 -0.04 -4.74 121.20 122.09 2fgv s ILE 62 Ca 0.06 0.33 -0.32 0.00 -2.23 0.00 0.00 60.65 58.49 2fgv s ILE 62 Cb -0.02 -3.58 -0.11 0.00 -1.58 0.00 0.00 42.46 37.17 2fgv s ILE 62 CO 0.86 0.27 1.62 -2.84 -1.23 0.00 0.00 174.94 173.61 2fgv s PRO 63 N 1.50 4.19 -0.08 2.79 0.02 -1.26 -1.89 135.00 140.26 2fgv s PRO 63 Ca 0.11 2.44 -0.01 0.00 0.02 0.00 0.00 61.00 63.55 2fgv s PRO 63 Cb -0.15 -3.13 0.03 0.00 0.02 0.00 0.00 34.50 31.27 2fgv s PRO 63 CO 0.08 -0.65 -0.02 0.08 -0.33 0.00 0.00 177.00 176.16 2fgv s VAL 64 N 1.14 0.57 -0.20 3.83 1.01 -0.30 -4.41 120.40 122.04 2fgv s VAL 64 Ca 0.71 -0.00 -0.10 0.00 0.00 0.00 0.00 61.98 62.60 2fgv s VAL 64 Cb -0.46 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 2fgv s VAL 64 CO 0.32 0.29 0.12 -0.70 0.00 0.00 0.00 175.10 175.13 2fgv s GLU 65 N 1.86 4.13 -0.26 2.72 2.12 -0.25 -0.84 118.70 128.18 2fgv s GLU 65 Ca 0.04 -0.25 0.02 0.00 0.36 0.00 0.00 54.97 55.14 2fgv s GLU 65 Cb -0.12 -3.40 0.05 0.00 0.26 0.00 0.00 34.13 30.92 2fgv s GLU 65 CO -0.06 0.25 -0.10 0.42 -0.54 0.00 0.00 175.26 175.24 2fgv s ILE 66 N 0.48 2.33 -1.59 -3.70 1.01 0.56 -0.19 121.20 120.10 2fgv s ILE 66 Ca 0.07 -1.51 -0.12 0.00 0.00 0.00 0.00 60.65 59.10 2fgv s ILE 66 Cb -0.12 -2.33 0.10 0.00 0.01 0.00 0.00 42.46 40.12 2fgv s ILE 66 CO -0.01 0.02 0.64 0.00 0.00 0.00 0.00 174.94 175.59 2fgv n GLY 68 N -1.66 0.95 3.54 0.00 0.00 -1.26 -5.01 105.19 101.75 2fgv n GLY 68 Ca -0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 2fgv n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2fgv s HIS 69 N -3.78 3.17 0.11 1.61 4.02 0.15 -5.07 115.29 115.51 2fgv s HIS 69 Ca 0.00 -0.07 -0.27 0.00 1.02 0.00 0.00 55.06 55.74 2fgv s HIS 69 Cb 0.00 -2.32 -0.07 0.00 -1.02 0.00 0.00 32.58 29.17 2fgv s HIS 69 CO 0.00 -0.22 0.84 0.15 1.02 0.00 0.00 174.74 176.53 2fgv s LYS 70 N 1.68 4.61 0.22 1.40 1.02 -1.26 -0.32 119.74 127.09 2fgv s LYS 70 Ca 0.07 1.24 0.01 0.00 0.02 0.00 0.00 55.97 57.30 2fgv s LYS 70 Cb -0.16 -3.33 -0.05 0.00 -0.52 0.00 0.00 37.83 33.77 2fgv s LYS 70 CO 0.08 0.36 0.08 0.00 -0.92 0.00 0.00 175.35 174.96 2fgv s ALA 71 N -0.44 1.50 -0.21 5.17 0.00 -0.02 -4.75 121.76 123.00 2fgv s ALA 71 Ca 0.40 -1.76 -0.12 0.00 0.00 0.00 0.00 51.96 50.49 2fgv s ALA 71 Cb -0.22 1.00 0.07 0.00 0.00 0.00 0.00 23.12 23.96 2fgv s ALA 71 CO 0.27 -0.46 0.51 -1.50 0.00 0.00 0.00 175.76 174.58 2fgv s ILE 72 N -3.82 -0.04 -0.59 0.00 2.07 -1.26 -1.15 121.20 116.40 2fgv s ILE 72 Ca 0.34 0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.65 2fgv s ILE 72 Cb 0.07 -0.75 0.00 0.00 0.13 0.00 0.00 42.46 41.91 2fgv s ILE 72 CO 0.11 0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.77 2fgv n GLY 73 N 4.32 -0.70 3.73 1.50 0.00 -0.79 -4.86 105.19 108.39 2fgv n GLY 73 Ca -0.22 -0.69 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 2fgv n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fgv s THR 74 N -3.00 4.26 -0.01 2.61 2.01 -1.26 -0.86 115.64 119.40 2fgv s THR 74 Ca 0.00 1.83 0.06 0.00 0.31 0.00 0.00 61.69 63.89 2fgv s THR 74 Cb 0.00 -4.17 -0.02 0.00 0.01 0.00 0.00 72.50 68.32 2fgv s THR 74 CO 0.00 0.26 -0.19 0.68 -0.69 0.00 0.00 174.62 174.68 2fgv s VAL 75 N 0.16 1.50 -0.10 3.82 -7.23 0.11 -4.46 120.40 114.20 2fgv s VAL 75 Ca 0.50 -0.86 -0.01 0.00 -1.81 0.00 0.00 61.98 59.80 2fgv s VAL 75 Cb -0.26 -1.26 -0.03 0.00 0.56 0.00 0.00 36.38 35.40 2fgv s VAL 75 CO 0.31 0.38 -0.07 -0.76 -0.31 0.00 0.00 175.10 174.66 2fgv s LEU 76 N -0.55 3.13 -0.15 1.32 1.43 -0.09 -0.97 118.68 122.80 2fgv s LEU 76 Ca 0.07 -0.09 -0.02 0.00 -1.03 0.00 0.00 54.13 53.06 2fgv s LEU 76 Cb -0.07 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 2fgv s LEU 76 CO -0.00 0.28 -0.09 -0.69 0.23 0.00 0.00 176.35 176.08 2fgv s VAL 77 N -0.31 3.34 0.10 -1.59 1.01 0.23 0.59 120.40 123.77 2fgv s VAL 77 Ca 0.04 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.48 2fgv s VAL 77 Cb -0.13 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.81 2fgv s VAL 77 CO 0.02 0.50 0.13 0.61 0.00 0.00 0.00 175.10 176.36 2fgv n GLY 78 N 3.77 3.13 1.16 4.51 0.00 -0.30 -1.41 105.19 116.05 2fgv n GLY 78 Ca -0.18 -1.55 0.06 0.00 0.00 0.00 0.00 46.02 44.36 2fgv n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2fgv n PRO 79 N -0.18 2.84 -2.07 1.61 -0.04 -1.26 -1.96 135.00 133.95 2fgv n PRO 79 Ca 0.01 -1.92 -0.34 0.00 -0.04 0.00 0.00 63.50 61.21 2fgv n PRO 79 Cb 0.18 -1.69 0.02 0.00 -0.04 0.00 0.00 33.50 31.97 2fgv n PRO 79 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2fgv s ASN 80 N -0.76 5.59 0.34 3.54 4.22 -1.26 -4.96 114.94 121.65 2fgv s ASN 80 Ca 0.34 2.00 0.26 0.00 -2.14 0.00 0.00 52.86 53.32 2fgv s ASN 80 Cb 0.22 -2.56 0.75 0.00 1.28 0.00 0.00 41.25 40.95 2fgv s ASN 80 CO 0.17 -1.30 1.74 1.55 -2.04 0.00 0.00 177.10 177.22 2fgv h PRO 81 N 0.65 0.00 -4.46 3.55 0.13 -1.97 -3.41 132.00 126.49 2fgv h PRO 81 Ca -0.48 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.35 2fgv h PRO 81 Cb 1.24 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.13 2fgv h PRO 81 CO 0.56 0.00 -0.74 0.54 -0.23 0.00 0.00 178.00 178.13 2fgv s VAL 82 N -3.25 0.49 0.14 1.56 0.11 -1.26 -5.00 120.40 113.20 2fgv s VAL 82 Ca 0.07 -0.67 -0.30 0.00 -2.93 0.00 0.00 61.98 58.15 2fgv s VAL 82 Cb 0.09 -0.49 -0.07 0.00 -1.53 0.00 0.00 36.38 34.38 2fgv s VAL 82 CO 0.58 -0.14 1.06 0.20 -3.33 0.00 0.00 175.10 173.48 2fgv s ASN 83 N -0.88 7.33 -0.07 3.54 0.01 -1.26 -4.43 114.94 119.18 2fgv s ASN 83 Ca -0.04 1.98 0.04 0.00 -0.71 0.00 0.00 52.86 54.13 2fgv s ASN 83 Cb -0.06 -2.60 -0.00 0.00 0.41 0.00 0.00 41.25 39.00 2fgv s ASN 83 CO 0.00 -0.19 -0.21 0.27 -1.51 0.00 0.00 177.10 175.46 2fgv s ILE 84 N -0.03 1.81 -0.35 0.60 -4.36 0.25 -0.34 121.20 118.77 2fgv s ILE 84 Ca 0.49 -0.90 -0.13 0.00 -0.26 0.00 0.00 60.65 59.85 2fgv s ILE 84 Cb -0.27 -1.56 -0.01 0.00 1.25 0.00 0.00 42.46 41.87 2fgv s ILE 84 CO 0.33 0.51 0.26 -0.63 0.24 0.00 0.00 174.94 175.64 2fgv s ILE 85 N 0.20 5.28 0.26 8.37 -1.09 0.41 -1.41 121.20 133.22 2fgv s ILE 85 Ca -0.12 -0.26 0.04 0.00 -2.23 0.00 0.00 60.65 58.09 2fgv s ILE 85 Cb -0.15 -3.75 0.04 0.00 -1.58 0.00 0.00 42.46 37.02 2fgv s ILE 85 CO 0.06 -0.05 0.35 0.61 -1.23 0.00 0.00 174.94 174.68 2fgv n GLY 86 N 5.11 1.98 0.25 6.18 0.00 -1.18 -0.93 105.19 116.59 2fgv n GLY 86 Ca -0.12 -2.18 0.10 0.00 0.00 0.00 0.00 46.02 43.83 2fgv n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2fgv h ARG 87 N 0.00 0.00 -0.53 1.61 3.08 -0.94 -1.41 114.38 116.19 2fgv h ARG 87 Ca -0.12 0.00 0.07 0.00 0.07 0.00 0.00 59.98 59.99 2fgv h ARG 87 Cb 0.56 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 2fgv h ARG 87 CO 0.18 0.16 0.36 -2.95 -1.07 0.00 0.00 179.97 176.64 2fgv h ASN 88 N 0.00 0.40 0.01 7.04 -1.07 -1.81 -2.16 115.58 117.99 2fgv h ASN 88 Ca -0.00 0.00 -0.37 0.00 0.07 0.00 0.00 56.30 56.00 2fgv h ASN 88 Cb 0.37 -0.08 -0.07 0.00 -2.07 0.00 0.00 38.32 36.46 2fgv h ASN 88 CO 0.02 0.26 -2.39 0.18 0.07 0.00 0.00 177.43 175.57 2fgv n LEU 89 N -4.47 0.34 -0.22 6.14 4.77 -0.89 -4.36 117.00 118.31 2fgv n LEU 89 Ca 0.07 -0.01 0.03 0.00 -0.03 0.00 0.00 56.01 56.07 2fgv n LEU 89 Cb 0.26 0.34 0.27 0.00 -2.33 0.00 0.00 43.42 41.97 2fgv n LEU 89 CO 0.34 0.55 1.24 -0.07 -1.33 0.00 0.00 177.39 178.11 2fgv h LEU 90 N 0.00 0.82 -1.18 2.23 3.38 -1.10 -1.61 115.31 117.85 2fgv h LEU 90 Ca -0.55 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.37 2fgv h LEU 90 Cb 2.21 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.75 2fgv h LEU 90 CO 0.02 0.57 0.09 0.71 0.09 0.00 0.00 178.44 179.91 2fgv h THR 91 N 0.95 1.20 0.00 0.22 1.35 -1.61 -2.35 112.91 112.67 2fgv h THR 91 Ca 0.30 -0.74 -0.05 0.00 -0.55 0.00 0.00 66.41 65.37 2fgv h THR 91 Cb 0.03 0.78 -0.01 0.00 -1.73 0.00 0.00 68.15 67.22 2fgv h THR 91 CO -0.09 0.27 -0.25 1.56 -0.25 0.00 0.00 175.52 176.76 2fgv h GLN 92 N 0.64 0.00 -0.57 4.72 4.20 -1.49 -2.54 115.11 120.07 2fgv h GLN 92 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 2fgv h GLN 92 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 2fgv h GLN 92 CO 0.00 0.25 0.00 0.44 -0.67 0.00 0.00 178.83 178.85 2fgv n ILE 93 N -3.70 0.75 -2.02 2.54 -5.35 -1.08 -4.93 119.36 105.56 2fgv n ILE 93 Ca -0.01 -0.86 -0.05 0.00 -0.27 0.00 0.00 62.75 61.56 2fgv n ILE 93 Cb 0.37 0.72 -0.00 0.00 -1.74 0.00 0.00 39.64 38.98 2fgv n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2fgv n GLY 94 N 1.59 0.21 3.72 3.28 0.00 -0.96 -4.99 105.19 108.04 2fgv n GLY 94 Ca 0.22 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 2fgv n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fgv s THR 96 N 0.54 1.55 -0.07 0.00 -4.23 -1.26 -4.76 115.64 107.42 2fgv s THR 96 Ca 0.49 -2.09 -0.13 0.00 -1.18 0.00 0.00 61.69 58.78 2fgv s THR 96 Cb -0.22 -1.92 -0.05 0.00 1.34 0.00 0.00 72.50 71.65 2fgv s THR 96 CO 0.29 -0.59 0.32 -0.76 -0.54 0.00 0.00 174.62 173.34 2fgv s LEU 97 N -3.12 4.40 -0.03 4.79 1.43 -1.26 -5.10 118.68 119.78 2fgv s LEU 97 Ca 0.19 0.74 0.01 0.00 -1.03 0.00 0.00 54.13 54.04 2fgv s LEU 97 Cb -0.01 -2.42 0.02 0.00 0.03 0.00 0.00 46.19 43.81 2fgv s LEU 97 CO 0.05 0.28 -0.02 0.20 0.23 0.00 0.00 176.35 177.09 2fgv s ASN 98 N -0.66 0.61 0.00 2.29 -0.87 -1.26 -5.30 114.94 109.75 2fgv s ASN 98 Ca 0.20 -0.07 0.00 0.00 -1.57 0.00 0.00 52.86 51.42 2fgv s ASN 98 Cb -0.15 -0.29 0.00 0.00 -0.02 0.00 0.00 41.25 40.79 2fgv s ASN 98 CO 0.09 -0.07 0.00 2.22 -2.57 0.00 0.00 177.10 176.77