#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fy1 n VAL 2 N 0.00 0.15 0.00 2.03 3.14 -1.26 -5.06 118.33 117.33 2fy1 n VAL 2 Ca 0.00 -0.16 0.00 0.00 -2.96 0.00 0.00 64.34 61.22 2fy1 n VAL 2 Cb 0.00 0.89 0.00 0.00 -1.06 0.00 0.00 33.84 33.67 2fy1 n VAL 2 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2fy1 n GLU 3 N -0.08 0.00 -1.10 1.45 2.13 -1.26 -4.12 120.64 117.66 2fy1 n GLU 3 Ca 0.00 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.85 2fy1 n GLU 3 Cb 0.48 -0.71 0.03 0.00 0.27 0.00 0.00 31.44 31.51 2fy1 n GLU 3 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2fy1 n ALA 4 N 0.00 2.35 -0.77 4.31 0.00 -1.26 -4.99 120.51 120.15 2fy1 n ALA 4 Ca 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 53.44 51.40 2fy1 n ALA 4 Cb 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 18.82 2fy1 n ALA 4 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2fy1 n ASP 5 N 0.17 -3.07 0.00 0.00 2.03 -1.26 -3.32 116.55 111.10 2fy1 n ASP 5 Ca 0.06 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.37 2fy1 n ASP 5 Cb 0.97 -2.94 0.00 0.00 -0.72 0.00 0.00 41.12 38.43 2fy1 n ASP 5 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2fy1 n HIS 6 N -2.01 0.00 -2.12 -0.67 -0.00 -1.26 -4.99 115.22 104.16 2fy1 n HIS 6 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.38 2fy1 n HIS 6 Cb 0.25 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.20 2fy1 n HIS 6 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2fy1 n PRO 7 N 0.00 2.06 -1.64 1.57 -0.04 -1.21 -4.03 135.00 131.71 2fy1 n PRO 7 Ca 0.00 -2.64 -0.46 0.00 -0.04 0.00 0.00 63.50 60.36 2fy1 n PRO 7 Cb 0.00 -3.59 -0.04 0.00 -0.04 0.00 0.00 33.50 29.83 2fy1 n PRO 7 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2fy1 n GLY 8 N 5.52 1.36 3.03 0.55 0.00 -1.25 -4.89 105.19 109.51 2fy1 n GLY 8 Ca 0.47 0.85 -0.22 0.00 0.00 0.00 0.00 46.02 47.12 2fy1 n GLY 8 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fy1 s LYS 9 N 4.83 1.18 0.02 1.61 2.20 -1.26 -1.10 119.74 127.22 2fy1 s LYS 9 Ca 0.96 -0.38 0.09 0.00 -0.36 0.00 0.00 55.97 56.27 2fy1 s LYS 9 Cb -0.60 -1.07 -0.02 0.00 -1.51 0.00 0.00 37.83 34.63 2fy1 s LYS 9 CO 0.47 0.14 -0.25 -0.51 -0.36 0.00 0.00 175.35 174.83 2fy1 s LEU 10 N 0.18 2.12 -0.25 5.43 1.02 0.39 -0.21 118.68 127.36 2fy1 s LEU 10 Ca -0.04 -0.54 -0.08 0.00 0.02 0.00 0.00 54.13 53.49 2fy1 s LEU 10 Cb -0.10 -1.26 -0.04 0.00 0.02 0.00 0.00 46.19 44.82 2fy1 s LEU 10 CO 0.01 0.27 0.10 0.12 0.02 0.00 0.00 176.35 176.87 2fy1 s PHE 11 N -0.73 3.14 -0.16 0.29 5.36 0.30 -1.06 117.98 125.12 2fy1 s PHE 11 Ca 0.11 -0.21 -0.05 0.00 -0.96 0.00 0.00 56.93 55.82 2fy1 s PHE 11 Cb -0.10 -2.25 -0.03 0.00 -0.34 0.00 0.00 43.02 40.30 2fy1 s PHE 11 CO 0.01 -0.24 -0.01 0.42 -1.46 0.00 0.00 175.22 173.95 2fy1 s ILE 12 N 1.48 4.16 -0.22 3.12 1.09 0.69 -1.62 121.20 129.91 2fy1 s ILE 12 Ca 0.06 -0.26 -0.04 0.00 -1.10 0.00 0.00 60.65 59.31 2fy1 s ILE 12 Cb -0.15 -2.83 -0.01 0.00 -1.06 0.00 0.00 42.46 38.41 2fy1 s ILE 12 CO 0.05 0.49 -0.05 -0.83 -0.10 0.00 0.00 174.94 174.50 2fy1 s GLY 13 N 0.27 1.60 0.00 6.18 0.00 -0.03 -1.62 107.32 113.71 2fy1 s GLY 13 Ca -0.01 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.55 2fy1 s GLY 13 CO 0.02 0.40 0.00 0.61 0.00 0.00 0.00 173.10 174.13 2fy1 n GLY 14 N 4.75 -1.42 4.89 0.20 0.00 -1.26 -1.43 105.19 110.91 2fy1 n GLY 14 Ca -0.18 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.40 2fy1 n GLY 14 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fy1 n LEU 15 N 0.00 0.00 -1.50 0.99 7.99 -1.26 -4.66 117.00 118.56 2fy1 n LEU 15 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.00 2fy1 n LEU 15 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 2fy1 n LEU 15 CO 0.00 0.00 0.00 -3.20 -1.51 0.00 0.00 177.39 172.68 2fy1 n ASN 16 N 0.07 -0.48 -2.44 -1.43 5.15 -1.26 0.20 115.26 115.06 2fy1 n ASN 16 Ca 0.00 0.24 -0.10 0.00 -0.60 0.00 0.00 54.58 54.12 2fy1 n ASN 16 Cb 0.00 -0.56 -0.01 0.00 -0.53 0.00 0.00 39.78 38.69 2fy1 n ASN 16 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2fy1 n ARG 17 N -1.35 -2.35 0.01 1.20 3.00 -1.26 -4.84 116.66 111.07 2fy1 n ARG 17 Ca 0.00 0.50 0.00 0.00 -0.01 0.00 0.00 57.85 58.34 2fy1 n ARG 17 Cb 0.24 -5.08 0.00 0.00 0.00 0.00 0.00 32.46 27.63 2fy1 n ARG 17 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2fy1 n GLU 18 N -2.74 0.00 -4.20 5.56 4.07 0.13 -5.13 120.64 118.32 2fy1 n GLU 18 Ca -0.12 0.00 -0.26 0.00 -0.06 0.00 0.00 57.16 56.72 2fy1 n GLU 18 Cb 0.59 -0.42 -0.06 0.00 -0.06 0.00 0.00 31.44 31.49 2fy1 n GLU 18 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 2fy1 n THR 19 N -3.00 0.00 -0.86 6.31 5.66 -0.92 -5.13 114.28 116.36 2fy1 n THR 19 Ca 0.00 -2.03 0.00 0.00 -3.05 0.00 0.00 64.05 58.97 2fy1 n THR 19 Cb 0.36 0.50 0.00 0.00 -1.55 0.00 0.00 70.33 69.65 2fy1 n THR 19 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2fy1 n ASN 20 N -1.36 0.79 -0.51 1.09 3.02 -1.26 -4.79 115.26 112.24 2fy1 n ASN 20 Ca -0.14 0.00 0.43 0.00 -0.03 0.00 0.00 54.58 54.84 2fy1 n ASN 20 Cb 0.54 0.00 0.67 0.00 -0.61 0.00 0.00 39.78 40.38 2fy1 n ASN 20 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2fy1 h GLU 21 N 0.00 0.00 0.83 3.52 4.81 -1.98 0.96 114.58 122.71 2fy1 h GLU 21 Ca 0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 2fy1 h GLU 21 Cb 0.00 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.39 2fy1 h GLU 21 CO 0.00 0.00 -0.40 -0.22 -0.73 0.00 0.00 179.01 177.66 2fy1 h LYS 22 N 0.00 -1.07 -0.73 1.92 1.63 -2.00 -1.46 116.57 114.86 2fy1 h LYS 22 Ca 0.76 0.07 0.08 0.00 -0.85 0.00 0.00 60.65 60.72 2fy1 h LYS 22 Cb 3.43 0.24 -0.07 0.00 -0.60 0.00 0.00 32.23 35.24 2fy1 h LYS 22 CO -0.01 -0.70 0.39 0.00 -3.45 0.00 0.00 179.45 175.68 2fy1 h MET 23 N -1.21 0.65 0.18 1.90 -0.00 -1.25 -1.76 114.93 113.44 2fy1 h MET 23 Ca -0.11 -0.04 -0.01 0.00 -0.00 0.00 0.00 59.70 59.54 2fy1 h MET 23 Cb 0.86 -0.15 -0.01 0.00 -0.00 0.00 0.00 31.60 32.31 2fy1 h MET 23 CO 0.19 0.43 -0.16 -0.07 -0.00 0.00 0.00 176.91 177.30 2fy1 h LEU 24 N 0.67 -0.43 -1.35 -0.10 4.07 -0.58 0.34 115.31 117.94 2fy1 h LEU 24 Ca 0.35 0.03 0.12 0.00 0.08 0.00 0.00 57.88 58.46 2fy1 h LEU 24 Cb 0.32 0.14 -0.06 0.00 1.08 0.00 0.00 40.66 42.14 2fy1 h LEU 24 CO -0.24 -0.22 0.54 0.11 -1.08 0.00 0.00 178.44 177.55 2fy1 h LYS 25 N -0.33 0.66 0.00 1.13 1.57 -1.33 -1.50 116.57 116.77 2fy1 h LYS 25 Ca -0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2fy1 h LYS 25 Cb 0.28 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2fy1 h LYS 25 CO -0.01 0.44 0.00 0.00 -0.57 0.00 0.00 179.45 179.31 2fy1 n ALA 26 N -2.45 -0.15 0.06 3.86 0.00 -0.66 -0.67 120.51 120.50 2fy1 n ALA 26 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.46 2fy1 n ALA 26 Cb 0.40 0.10 -0.07 0.00 0.00 0.00 0.00 19.45 19.89 2fy1 n ALA 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2fy1 h VAL 27 N 0.00 0.15 0.24 0.00 2.07 -0.00 -0.05 116.25 118.66 2fy1 h VAL 27 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2fy1 h VAL 27 Cb 0.00 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.92 2fy1 h VAL 27 CO 0.00 0.00 -0.11 -0.26 0.02 0.00 0.00 177.57 177.22 2fy1 h PHE 28 N -0.57 -0.30 0.00 1.57 -1.00 -1.44 -3.14 116.94 112.06 2fy1 h PHE 28 Ca 0.05 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.82 2fy1 h PHE 28 Cb 0.65 0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.31 2fy1 h PHE 28 CO -0.43 0.01 0.16 0.41 -1.61 0.00 0.00 178.31 176.85 2fy1 n GLY 29 N -0.43 -0.72 0.36 -1.45 0.00 0.16 -2.45 105.19 100.66 2fy1 n GLY 29 Ca -0.09 0.15 0.21 0.00 0.00 0.00 0.00 46.02 46.29 2fy1 n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fy1 h LYS 30 N 0.00 0.45 0.00 1.61 1.57 -0.96 -3.13 116.57 116.11 2fy1 h LYS 30 Ca 0.00 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2fy1 h LYS 30 Cb 0.31 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.45 2fy1 h LYS 30 CO 0.00 0.30 -0.45 0.72 -0.57 0.00 0.00 179.45 179.44 2fy1 n HIS 31 N -4.88 0.00 -3.81 -1.35 8.25 -1.02 -5.05 115.22 107.35 2fy1 n HIS 31 Ca 0.28 -0.57 -0.09 0.00 -0.26 0.00 0.00 57.72 57.09 2fy1 n HIS 31 Cb 0.86 -0.12 0.03 0.00 1.12 0.00 0.00 29.99 31.87 2fy1 n HIS 31 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2fy1 s GLY 32 N -2.00 0.49 0.00 -1.41 0.00 -1.18 -3.86 107.32 99.35 2fy1 s GLY 32 Ca 0.20 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 44.07 2fy1 s GLY 32 CO -0.03 -0.37 0.38 -1.55 0.00 0.00 0.00 173.10 171.53 2fy1 n PRO 33 N -0.54 0.00 -0.63 2.90 -0.04 -1.26 -4.46 135.00 130.97 2fy1 n PRO 33 Ca -0.08 0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 2fy1 n PRO 33 Cb 0.60 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.95 2fy1 n PRO 33 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2fy1 n ILE 34 N -1.68 -1.26 0.25 0.52 -0.00 -1.26 -4.90 119.36 111.03 2fy1 n ILE 34 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 62.75 62.78 2fy1 n ILE 34 Cb 0.00 -1.63 -0.01 0.00 -0.00 0.00 0.00 39.64 38.00 2fy1 n ILE 34 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 2fy1 n SER 35 N 0.00 0.68 -3.80 4.38 2.88 -0.31 -4.90 113.62 112.55 2fy1 n SER 35 Ca 0.00 -0.84 -0.13 0.00 -1.33 0.00 0.00 58.87 56.57 2fy1 n SER 35 Cb 0.00 0.66 -0.14 0.00 -0.75 0.00 0.00 64.21 63.97 2fy1 n SER 35 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2fy1 s GLU 36 N -1.16 0.04 -0.07 -1.46 -6.30 -0.60 -4.98 118.70 104.18 2fy1 s GLU 36 Ca 0.04 0.18 -0.01 0.00 -2.50 0.00 0.00 54.97 52.68 2fy1 s GLU 36 Cb 0.04 -0.10 0.03 0.00 0.00 0.00 0.00 34.13 34.10 2fy1 s GLU 36 CO 0.17 -0.09 -0.01 0.08 0.02 0.00 0.00 175.26 175.43 2fy1 s VAL 37 N 0.61 0.43 -0.02 3.70 1.01 -1.26 -0.79 120.40 124.08 2fy1 s VAL 37 Ca -0.05 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.02 2fy1 s VAL 37 Cb -0.07 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.76 2fy1 s VAL 37 CO -0.02 0.26 -0.05 -0.22 0.00 0.00 0.00 175.10 175.07 2fy1 s LEU 38 N 1.84 1.73 -0.05 3.92 2.96 -0.03 -5.03 118.68 124.02 2fy1 s LEU 38 Ca 0.03 -0.11 0.05 0.00 -0.22 0.00 0.00 54.13 53.88 2fy1 s LEU 38 Cb -0.12 -0.35 -0.01 0.00 0.50 0.00 0.00 46.19 46.21 2fy1 s LEU 38 CO -0.05 0.02 -0.20 -0.22 -1.32 0.00 0.00 176.35 174.58 2fy1 s LEU 39 N 0.28 1.97 -0.13 -0.68 1.98 -1.26 -0.60 118.68 120.25 2fy1 s LEU 39 Ca -0.03 -0.42 -0.02 0.00 -2.89 0.00 0.00 54.13 50.77 2fy1 s LEU 39 Cb -0.07 -1.13 -0.03 0.00 0.66 0.00 0.00 46.19 45.62 2fy1 s LEU 39 CO -0.00 0.18 -0.06 -0.63 -1.89 0.00 0.00 176.35 173.96 2fy1 s ILE 40 N -0.01 3.76 0.00 6.68 -1.09 0.14 -4.89 121.20 125.80 2fy1 s ILE 40 Ca -0.05 -0.42 0.00 0.00 -2.23 0.00 0.00 60.65 57.95 2fy1 s ILE 40 Cb -0.13 -2.61 0.00 0.00 -1.58 0.00 0.00 42.46 38.14 2fy1 s ILE 40 CO 0.03 0.53 0.00 0.29 -1.23 0.00 0.00 174.94 174.56 2fy1 n LYS 41 N 3.16 0.77 -3.62 2.79 5.02 -1.25 -1.67 118.16 123.36 2fy1 n LYS 41 Ca -0.18 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.01 2fy1 n LYS 41 Cb 0.53 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.51 2fy1 n LYS 41 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2fy1 s ASP 42 N 1.00 -0.39 0.00 4.39 -1.08 -1.26 -4.80 116.67 114.54 2fy1 s ASP 42 Ca 0.00 -0.29 0.00 0.00 -0.52 0.00 0.00 52.55 51.74 2fy1 s ASP 42 Cb 0.00 0.60 0.00 0.00 -1.46 0.00 0.00 42.92 42.06 2fy1 s ASP 42 CO 0.00 -1.05 0.00 -1.14 0.52 0.00 0.00 175.17 173.50 2fy1 n ARG 43 N -0.37 -0.84 -1.45 4.34 0.00 -1.26 0.29 116.66 117.38 2fy1 n ARG 43 Ca -0.12 0.10 -0.11 0.00 -0.00 0.00 0.00 57.85 57.72 2fy1 n ARG 43 Cb 0.63 -3.12 -0.04 0.00 0.00 0.00 0.00 32.46 29.93 2fy1 n ARG 43 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 2fy1 n THR 44 N -0.67 -0.08 0.00 5.15 5.66 -1.26 -4.56 114.28 118.53 2fy1 n THR 44 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2fy1 n THR 44 Cb 0.10 -1.34 0.00 0.00 -1.55 0.00 0.00 70.33 67.54 2fy1 n THR 44 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2fy1 n SER 45 N 0.23 0.00 -0.30 1.09 7.64 0.15 -5.02 113.62 117.41 2fy1 n SER 45 Ca -0.11 0.00 0.20 0.00 1.01 0.00 0.00 58.87 59.97 2fy1 n SER 45 Cb 0.39 0.00 0.49 0.00 -1.01 0.00 0.00 64.21 64.08 2fy1 n SER 45 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2fy1 h LYS 46 N 0.00 0.43 -1.11 1.43 1.57 -0.68 -3.48 116.57 114.73 2fy1 h LYS 46 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2fy1 h LYS 46 Cb 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2fy1 h LYS 46 CO 0.00 0.28 0.00 0.43 -0.57 0.00 0.00 179.45 179.59 2fy1 n SER 47 N -4.59 -0.74 -4.00 0.86 7.64 -1.26 -4.99 113.62 106.55 2fy1 n SER 47 Ca 0.23 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 60.03 2fy1 n SER 47 Cb 0.78 -0.37 -0.09 0.00 -1.01 0.00 0.00 64.21 63.52 2fy1 n SER 47 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2fy1 s ARG 48 N -0.02 0.64 -0.13 1.43 3.00 -1.26 -4.99 118.95 117.61 2fy1 s ARG 48 Ca 0.00 -1.03 -0.02 0.00 -1.00 0.00 0.00 55.73 53.68 2fy1 s ARG 48 Cb 0.00 0.24 0.04 0.00 0.00 0.00 0.00 34.95 35.23 2fy1 s ARG 48 CO 0.00 -0.15 0.02 0.20 0.00 0.00 0.00 175.30 175.38 2fy1 s GLY 49 N -2.65 0.57 0.02 8.12 0.00 -1.20 -3.76 107.32 108.42 2fy1 s GLY 49 Ca 0.03 -0.39 0.02 0.00 0.00 0.00 0.00 44.72 44.37 2fy1 s GLY 49 CO -0.09 1.31 -0.06 -0.11 0.00 0.00 0.00 173.10 174.16 2fy1 s PHE 50 N 1.94 0.53 -0.13 1.90 -0.12 -0.67 -4.63 117.98 116.80 2fy1 s PHE 50 Ca 0.02 -0.33 -0.05 0.00 -0.05 0.00 0.00 56.93 56.52 2fy1 s PHE 50 Cb -0.15 -0.33 -0.04 0.00 -0.63 0.00 0.00 43.02 41.88 2fy1 s PHE 50 CO -0.07 -0.06 0.05 0.00 -0.05 0.00 0.00 175.22 175.09 2fy1 s ALA 51 N -0.87 3.42 -0.05 1.99 0.00 -0.64 0.29 121.76 125.89 2fy1 s ALA 51 Ca -0.06 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.19 2fy1 s ALA 51 Cb -0.07 -1.73 -0.00 0.00 0.00 0.00 0.00 23.12 21.32 2fy1 s ALA 51 CO 0.00 0.42 -0.18 -0.06 0.00 0.00 0.00 175.76 175.95 2fy1 s PHE 52 N -0.38 1.79 -0.02 0.00 0.08 0.23 -0.22 117.98 119.46 2fy1 s PHE 52 Ca 0.09 -0.56 0.02 0.00 0.12 0.00 0.00 56.93 56.59 2fy1 s PHE 52 Cb -0.12 -1.22 0.01 0.00 -0.57 0.00 0.00 43.02 41.12 2fy1 s PHE 52 CO 0.02 -0.21 -0.05 0.42 -0.10 0.00 0.00 175.22 175.30 2fy1 s ILE 53 N 0.14 0.48 -0.14 0.64 1.01 -0.23 -0.85 121.20 122.26 2fy1 s ILE 53 Ca -0.07 -0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.34 2fy1 s ILE 53 Cb -0.13 -0.45 -0.04 0.00 0.01 0.00 0.00 42.46 41.85 2fy1 s ILE 53 CO 0.03 0.17 0.05 -0.89 0.00 0.00 0.00 174.94 174.30 2fy1 s THR 54 N 0.31 4.68 -0.14 2.92 2.01 0.03 -0.46 115.64 124.98 2fy1 s THR 54 Ca -0.04 -0.09 -0.05 0.00 0.31 0.00 0.00 61.69 61.82 2fy1 s THR 54 Cb -0.08 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 2fy1 s THR 54 CO -0.00 0.53 0.05 -0.36 -0.69 0.00 0.00 174.62 174.14 2fy1 s PHE 55 N -0.21 3.26 0.53 4.92 0.40 -0.26 -1.16 117.98 125.47 2fy1 s PHE 55 Ca 0.07 0.16 0.45 0.00 -0.60 0.00 0.00 56.93 57.01 2fy1 s PHE 55 Cb -0.12 -1.94 1.66 0.00 0.51 0.00 0.00 43.02 43.12 2fy1 s PHE 55 CO 0.02 0.35 1.61 0.93 0.70 0.00 0.00 175.22 178.83 2fy1 h GLU 56 N 5.86 0.01 -4.48 0.44 5.08 -1.87 -3.32 114.58 116.30 2fy1 h GLU 56 Ca -0.44 -0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.68 2fy1 h GLU 56 Cb 1.19 -0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.24 2fy1 h GLU 56 CO 0.62 0.01 -0.72 -0.80 -1.00 0.00 0.00 179.01 177.12 2fy1 s ASN 57 N -4.17 0.80 0.34 1.42 0.01 -1.26 -3.96 114.94 108.12 2fy1 s ASN 57 Ca -0.06 -0.69 0.04 0.00 -0.71 0.00 0.00 52.86 51.45 2fy1 s ASN 57 Cb 0.27 0.07 0.63 0.00 0.41 0.00 0.00 41.25 42.63 2fy1 s ASN 57 CO 0.87 -0.31 1.90 1.55 -1.51 0.00 0.00 177.10 179.60 2fy1 h PRO 58 N 4.05 0.55 -0.48 -0.60 0.13 -1.79 -2.57 132.00 131.29 2fy1 h PRO 58 Ca -0.35 -0.10 0.05 0.00 -0.87 0.00 0.00 66.00 64.73 2fy1 h PRO 58 Cb 1.19 -0.09 -0.07 0.00 0.13 0.00 0.00 31.00 32.16 2fy1 h PRO 58 CO 0.48 0.54 -0.45 0.00 -0.23 0.00 0.00 178.00 178.34 2fy1 h ALA 59 N 1.53 -0.60 -0.53 -0.56 0.00 -1.95 -1.20 119.26 115.95 2fy1 h ALA 59 Ca 0.12 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2fy1 h ALA 59 Cb 0.26 1.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 2fy1 h ALA 59 CO 0.00 -0.85 0.31 -0.44 0.00 0.00 0.00 179.25 178.27 2fy1 h ASP 60 N -0.21 0.63 0.09 0.00 3.32 -1.80 0.52 116.42 118.97 2fy1 h ASP 60 Ca 0.08 -0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.12 2fy1 h ASP 60 Cb 0.42 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.78 2fy1 h ASP 60 CO -0.56 0.49 -0.25 0.00 -1.72 0.00 0.00 179.24 177.20 2fy1 h ALA 61 N 1.62 -0.41 -0.79 3.45 0.00 -1.16 -1.21 119.26 120.77 2fy1 h ALA 61 Ca 0.19 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.15 2fy1 h ALA 61 Cb -0.02 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 2fy1 h ALA 61 CO -0.04 -0.78 0.45 -0.22 0.00 0.00 0.00 179.25 178.66 2fy1 h LYS 62 N -0.44 0.76 0.47 0.00 3.64 -0.64 0.61 116.57 120.96 2fy1 h LYS 62 Ca 0.04 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 2fy1 h LYS 62 Cb 0.48 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2fy1 h LYS 62 CO -0.16 0.50 -0.43 -0.97 -2.27 0.00 0.00 179.45 176.12 2fy1 h ASN 63 N 0.78 -1.16 -0.85 4.20 -1.24 -0.73 0.13 115.58 116.72 2fy1 h ASN 63 Ca 0.37 0.09 0.11 0.00 0.71 0.00 0.00 56.30 57.58 2fy1 h ASN 63 Cb 0.29 0.37 -0.06 0.00 0.73 0.00 0.00 38.32 39.66 2fy1 h ASN 63 CO -0.22 -0.58 0.55 0.00 -1.29 0.00 0.00 177.43 175.89 2fy1 h ALA 64 N -1.09 1.76 0.36 1.57 0.00 -1.04 0.66 119.26 121.49 2fy1 h ALA 64 Ca -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2fy1 h ALA 64 Cb 0.76 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2fy1 h ALA 64 CO -0.03 0.05 -0.34 0.00 0.00 0.00 0.00 179.25 178.93 2fy1 h ALA 65 N 1.59 -1.04 -0.98 0.00 0.00 -0.70 -1.31 119.26 116.83 2fy1 h ALA 65 Ca 0.40 -0.13 0.11 0.00 0.00 0.00 0.00 54.91 55.29 2fy1 h ALA 65 Cb 0.53 0.57 -0.08 0.00 0.00 0.00 0.00 17.79 18.81 2fy1 h ALA 65 CO -0.17 -1.05 0.62 -0.22 0.00 0.00 0.00 179.25 178.43 2fy1 h LYS 66 N -0.69 0.96 0.39 0.00 3.64 -0.13 -0.45 116.57 120.30 2fy1 h LYS 66 Ca -0.05 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 2fy1 h LYS 66 Cb 0.60 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 2fy1 h LYS 66 CO -0.03 0.64 -0.38 0.22 -2.27 0.00 0.00 179.45 177.63 2fy1 h ASP 67 N 0.99 -1.03 0.00 4.20 3.58 -0.93 -3.43 116.42 119.80 2fy1 h ASP 67 Ca 0.46 0.08 0.00 0.00 0.42 0.00 0.00 57.03 58.00 2fy1 h ASP 67 Cb 0.42 0.34 0.00 0.00 1.72 0.00 0.00 39.33 41.81 2fy1 h ASP 67 CO -0.22 -0.51 0.00 0.23 -2.88 0.00 0.00 179.24 175.86 2fy1 n MET 68 N -4.70 0.00 -0.32 0.28 2.81 -0.23 -4.88 117.12 110.08 2fy1 n MET 68 Ca -0.09 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 2fy1 n MET 68 Cb 0.35 -0.39 0.00 0.00 -0.71 0.00 0.00 33.22 32.47 2fy1 n MET 68 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2fy1 n ASN 69 N -0.28 0.00 0.00 7.83 0.23 -0.86 -2.96 115.26 119.22 2fy1 n ASN 69 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 2fy1 n ASN 69 Cb 0.00 -1.60 0.00 0.00 -2.08 0.00 0.00 39.78 36.10 2fy1 n ASN 69 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2fy1 n GLY 70 N -0.94 0.00 0.96 4.83 0.00 -1.19 -4.56 105.19 104.29 2fy1 n GLY 70 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2fy1 n GLY 70 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2fy1 n LYS 71 N 0.00 0.00 -3.64 1.61 3.00 -1.16 -4.85 118.16 113.12 2fy1 n LYS 71 Ca 0.00 -0.58 -0.10 0.00 -0.00 0.00 0.00 58.31 57.63 2fy1 n LYS 71 Cb 0.00 -0.26 -0.07 0.00 0.00 0.00 0.00 35.03 34.69 2fy1 n LYS 71 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2fy1 s SER 72 N -2.12 -0.83 0.00 3.14 0.15 -1.26 -1.22 113.70 111.56 2fy1 s SER 72 Ca 0.18 1.43 0.00 0.00 0.70 0.00 0.00 55.95 58.26 2fy1 s SER 72 Cb -0.01 1.36 0.00 0.00 -1.71 0.00 0.00 66.02 65.67 2fy1 s SER 72 CO 0.12 -0.24 0.01 0.00 1.20 0.00 0.00 173.24 174.33 2fy1 n LEU 73 N 3.63 0.00 -0.02 3.45 -0.00 -1.26 -4.97 117.00 117.82 2fy1 n LEU 73 Ca -0.18 -0.11 0.00 0.00 -0.00 0.00 0.00 56.01 55.72 2fy1 n LEU 73 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.00 2fy1 n LEU 73 CO 0.01 0.29 0.35 0.00 -0.00 0.00 0.00 177.39 178.04 2fy1 n HIS 74 N 0.00 0.00 -0.78 1.47 1.44 -1.26 -4.97 115.22 111.12 2fy1 n HIS 74 Ca 0.00 -0.21 0.00 0.00 -2.01 0.00 0.00 57.72 55.50 2fy1 n HIS 74 Cb 0.31 -0.02 0.00 0.00 0.12 0.00 0.00 29.99 30.40 2fy1 n HIS 74 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2fy1 n GLY 75 N -0.22 0.57 3.30 -1.39 0.00 -1.26 -4.85 105.19 101.33 2fy1 n GLY 75 Ca 0.00 -0.36 0.03 0.00 0.00 0.00 0.00 46.02 45.70 2fy1 n GLY 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fy1 s LYS 76 N -0.77 0.37 0.45 1.61 2.20 -1.26 -5.12 119.74 117.21 2fy1 s LYS 76 Ca 0.00 0.78 -0.16 0.00 -0.36 0.00 0.00 55.97 56.23 2fy1 s LYS 76 Cb 0.00 0.45 -0.13 0.00 -1.51 0.00 0.00 37.83 36.64 2fy1 s LYS 76 CO 0.00 -0.28 -0.11 0.00 -0.36 0.00 0.00 175.35 174.60 2fy1 n ALA 77 N 5.30 -2.91 -2.79 3.13 0.00 -1.26 -4.53 120.51 117.44 2fy1 n ALA 77 Ca -0.07 -0.04 -0.35 0.00 0.00 0.00 0.00 53.44 52.98 2fy1 n ALA 77 Cb 0.52 -1.26 -0.09 0.00 0.00 0.00 0.00 19.45 18.62 2fy1 n ALA 77 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2fy1 s ILE 78 N -1.79 4.67 -0.13 0.00 -4.36 -0.36 -4.60 121.20 114.63 2fy1 s ILE 78 Ca 0.51 -0.10 -0.05 0.00 -0.26 0.00 0.00 60.65 60.75 2fy1 s ILE 78 Cb -0.44 -3.03 -0.04 0.00 1.25 0.00 0.00 42.46 40.20 2fy1 s ILE 78 CO 0.59 0.55 0.04 -0.75 0.24 0.00 0.00 174.94 175.61 2fy1 s LYS 79 N -0.37 3.49 -0.14 0.37 2.36 -0.52 -3.17 119.74 121.77 2fy1 s LYS 79 Ca 0.09 -0.36 0.00 0.00 -2.55 0.00 0.00 55.97 53.15 2fy1 s LYS 79 Cb -0.12 -3.01 0.02 0.00 -1.05 0.00 0.00 37.83 33.67 2fy1 s LYS 79 CO 0.02 0.50 -0.12 0.08 1.55 0.00 0.00 175.35 177.38 2fy1 s VAL 80 N -0.30 1.38 0.01 4.02 1.01 -1.26 -0.85 120.40 124.41 2fy1 s VAL 80 Ca 0.08 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.56 2fy1 s VAL 80 Cb -0.12 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.92 2fy1 s VAL 80 CO 0.02 0.43 -0.07 -0.70 0.00 0.00 0.00 175.10 174.78 2fy1 s GLU 81 N 1.56 0.52 -0.14 2.72 2.12 -0.64 -4.68 118.70 120.16 2fy1 s GLU 81 Ca 0.05 -0.38 -0.29 0.00 0.36 0.00 0.00 54.97 54.71 2fy1 s GLU 81 Cb -0.13 -0.45 -0.03 0.00 0.26 0.00 0.00 34.13 33.79 2fy1 s GLU 81 CO -0.10 0.11 1.40 -1.14 -0.54 0.00 0.00 175.26 174.99 2fy1 s GLN 82 N -0.55 4.18 1.05 4.30 2.00 -1.26 -0.54 119.66 128.84 2fy1 s GLN 82 Ca -0.01 1.80 -0.12 0.00 -2.00 0.00 0.00 55.36 55.03 2fy1 s GLN 82 Cb -0.04 -3.85 0.22 0.00 0.80 0.00 0.00 33.01 30.13 2fy1 s GLN 82 CO 0.00 -0.79 1.07 0.00 -0.50 0.00 0.00 175.29 175.07 2fy1 s ALA 83 N 3.78 0.45 0.21 1.58 0.00 0.70 -4.89 121.76 123.58 2fy1 s ALA 83 Ca 0.61 0.03 -0.00 0.00 0.00 0.00 0.00 51.96 52.60 2fy1 s ALA 83 Cb -0.25 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 2fy1 s ALA 83 CO 0.20 -3.25 0.10 0.15 0.00 0.00 0.00 175.76 172.96 2fy1 s LYS 84 N -4.63 1.23 0.62 0.00 -0.14 -1.26 -4.94 119.74 110.62 2fy1 s LYS 84 Ca 0.67 -1.64 -0.19 0.00 -1.36 0.00 0.00 55.97 53.45 2fy1 s LYS 84 Cb -0.23 0.05 -0.03 0.00 -1.68 0.00 0.00 37.83 35.94 2fy1 s LYS 84 CO 0.61 -0.32 1.18 1.63 -0.76 0.00 0.00 175.35 177.69 2fy1 n LYS 85 N -0.31 1.10 -0.09 1.68 5.02 -1.26 -4.95 118.16 119.35 2fy1 n LYS 85 Ca -0.00 0.43 -0.10 0.00 -2.02 0.00 0.00 58.31 56.62 2fy1 n LYS 85 Cb 0.66 -2.40 0.04 0.00 -0.02 0.00 0.00 35.03 33.31 2fy1 n LYS 85 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2fy1 h PRO 86 N 0.62 0.82 0.00 1.97 0.13 -2.03 -3.45 132.00 130.06 2fy1 h PRO 86 Ca -0.50 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.25 2fy1 h PRO 86 Cb 1.34 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2fy1 h PRO 86 CO 0.53 1.01 0.00 0.45 -0.23 0.00 0.00 178.00 179.76 2fy1 n SER 87 N -4.08 0.00 -3.96 1.44 2.88 -1.26 -5.14 113.62 103.51 2fy1 n SER 87 Ca -0.01 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.44 2fy1 n SER 87 Cb 0.49 0.02 -0.08 0.00 -0.75 0.00 0.00 64.21 63.89 2fy1 n SER 87 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2fy1 s PHE 88 N -1.08 0.37 -0.10 0.66 5.36 -1.26 -5.18 117.98 116.74 2fy1 s PHE 88 Ca 0.00 -0.78 -0.06 0.00 -0.96 0.00 0.00 56.93 55.13 2fy1 s PHE 88 Cb 0.00 -0.15 0.04 0.00 -0.34 0.00 0.00 43.02 42.57 2fy1 s PHE 88 CO 0.00 -0.58 0.25 -1.14 -1.46 0.00 0.00 175.22 172.29 2fy1 s GLN 89 N -3.93 0.23 0.26 10.12 2.00 -1.26 -5.00 119.66 122.08 2fy1 s GLN 89 Ca 0.11 0.50 0.03 0.00 -2.00 0.00 0.00 55.36 54.00 2fy1 s GLN 89 Cb 0.05 -0.07 0.34 0.00 0.80 0.00 0.00 33.01 34.14 2fy1 s GLN 89 CO -0.06 -0.14 1.65 1.03 -0.50 0.00 0.00 175.29 177.27 2fy1 h SER 90 N 6.91 0.39 0.00 6.67 0.87 -2.08 -3.49 113.55 122.82 2fy1 h SER 90 Ca -0.38 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 2fy1 h SER 90 Cb 1.16 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 2fy1 h SER 90 CO 0.37 0.77 0.00 0.61 -0.53 0.00 0.00 176.83 178.05 2fy1 n GLY 91 N -0.08 -0.10 0.00 5.77 0.00 -1.26 -5.19 105.19 104.33 2fy1 n GLY 91 Ca -0.02 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2fy1 n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fy1 n GLY 92 N -0.78 2.13 3.61 -0.02 0.00 -1.26 -5.19 105.19 103.68 2fy1 n GLY 92 Ca 0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.33 2fy1 n GLY 92 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2fy1 s ARG 93 N -2.00 0.77 -0.12 1.61 3.52 -1.26 -4.88 118.95 116.59 2fy1 s ARG 93 Ca 0.00 1.04 -0.08 0.00 -0.13 0.00 0.00 55.73 56.56 2fy1 s ARG 93 Cb 0.00 0.31 0.05 0.00 -1.56 0.00 0.00 34.95 33.74 2fy1 s ARG 93 CO 0.00 -0.11 0.30 1.03 -0.81 0.00 0.00 175.30 175.71 2fy1 s ARG 94 N 0.77 0.29 -0.27 5.12 1.81 -1.26 -4.96 118.95 120.45 2fy1 s ARG 94 Ca -0.03 0.57 -0.24 0.00 -1.72 0.00 0.00 55.73 54.30 2fy1 s ARG 94 Cb -0.05 -0.02 0.07 0.00 -0.45 0.00 0.00 34.95 34.50 2fy1 s ARG 94 CO -0.06 -0.13 0.74 0.50 -0.68 0.00 0.00 175.30 175.67 2fy1 s ARG 95 N 1.02 0.81 0.72 3.54 3.52 -1.25 -3.74 118.95 123.56 2fy1 s ARG 95 Ca -0.07 0.98 -0.11 0.00 -0.13 0.00 0.00 55.73 56.41 2fy1 s ARG 95 Cb -0.08 0.38 0.02 0.00 -1.56 0.00 0.00 34.95 33.72 2fy1 s ARG 95 CO -0.07 -0.10 1.07 -1.25 -0.81 0.00 0.00 175.30 174.14 2fy1 s PRO 96 N 0.45 2.71 1.09 5.12 0.04 -1.26 -5.01 135.00 138.14 2fy1 s PRO 96 Ca -0.00 1.05 -0.17 0.00 0.04 0.00 0.00 61.00 61.91 2fy1 s PRO 96 Cb -0.05 -1.96 0.24 0.00 0.04 0.00 0.00 34.50 32.77 2fy1 s PRO 96 CO -0.01 -1.28 1.17 -1.25 0.04 0.00 0.00 177.00 175.67 2fy1 s PRO 97 N -4.94 -0.37 0.59 0.56 0.04 -1.26 -4.97 135.00 124.65 2fy1 s PRO 97 Ca 0.59 -0.09 0.37 0.00 0.04 0.00 0.00 61.00 61.91 2fy1 s PRO 97 Cb -0.15 -1.70 1.84 0.00 0.04 0.00 0.00 34.50 34.53 2fy1 s PRO 97 CO 0.54 -3.14 2.17 0.00 0.04 0.00 0.00 177.00 176.62 2fy1 h ALA 98 N -2.17 1.08 -3.05 8.56 0.00 -2.09 -3.45 119.26 118.14 2fy1 h ALA 98 Ca -0.46 -0.03 -0.55 0.00 0.00 0.00 0.00 54.91 53.87 2fy1 h ALA 98 Cb 1.28 -0.00 0.15 0.00 0.00 0.00 0.00 17.79 19.22 2fy1 h ALA 98 CO 0.40 0.04 0.57 -1.12 0.00 0.00 0.00 179.25 179.14 2fy1 s SER 99 N -5.60 4.99 0.35 0.00 0.01 -1.26 -5.06 113.70 107.13 2fy1 s SER 99 Ca -0.02 2.71 -0.11 0.00 1.31 0.00 0.00 55.95 59.83 2fy1 s SER 99 Cb 0.12 -2.63 0.03 0.00 0.21 0.00 0.00 66.02 63.75 2fy1 s SER 99 CO 0.50 -1.76 0.64 -0.55 0.41 0.00 0.00 173.24 172.48 2fy1 s SER 100 N -1.14 0.32 -0.07 2.44 0.15 -1.26 -5.13 113.70 109.01 2fy1 s SER 100 Ca 0.76 -1.22 -0.08 0.00 0.70 0.00 0.00 55.95 56.12 2fy1 s SER 100 Cb -0.39 0.75 0.02 0.00 -1.71 0.00 0.00 66.02 64.69 2fy1 s SER 100 CO 0.44 -1.47 0.22 -0.60 1.20 0.00 0.00 173.24 173.03 2fy1 s ARG 101 N -2.85 0.29 0.14 5.44 3.52 -1.26 -5.18 118.95 119.05 2fy1 s ARG 101 Ca 0.21 0.22 -0.14 0.00 -0.13 0.00 0.00 55.73 55.89 2fy1 s ARG 101 Cb -0.03 0.14 0.02 0.00 -1.56 0.00 0.00 34.95 33.52 2fy1 s ARG 101 CO 0.14 -0.04 0.38 1.21 -0.81 0.00 0.00 175.30 176.18 2fy1 s ASN 102 N -0.07 -0.16 0.03 -2.12 2.47 -1.26 -5.19 114.94 108.64 2fy1 s ASN 102 Ca -0.02 -0.45 -0.12 0.00 0.42 0.00 0.00 52.86 52.68 2fy1 s ASN 102 Cb -0.02 0.47 0.01 0.00 -1.45 0.00 0.00 41.25 40.26 2fy1 s ASN 102 CO 0.01 -0.87 0.27 -0.60 -3.72 0.00 0.00 177.10 172.18 2fy1 s ARG 103 N -3.84 0.74 0.09 0.43 3.00 -1.26 -5.19 118.95 112.91 2fy1 s ARG 103 Ca 0.06 -0.49 0.03 0.00 -1.00 0.00 0.00 55.73 54.33 2fy1 s ARG 103 Cb 0.02 0.32 -0.04 0.00 0.00 0.00 0.00 34.95 35.25 2fy1 s ARG 103 CO -0.09 -0.22 -0.08 -1.12 0.00 0.00 0.00 175.30 173.78 2fy1 s SER 104 N -1.92 1.25 0.23 -2.12 0.01 -1.26 -5.13 113.70 104.76 2fy1 s SER 104 Ca -0.07 -0.84 -0.31 0.00 1.31 0.00 0.00 55.95 56.04 2fy1 s SER 104 Cb -0.02 0.04 -0.11 0.00 0.21 0.00 0.00 66.02 66.15 2fy1 s SER 104 CO -0.02 -0.32 1.56 -2.16 0.41 0.00 0.00 173.24 172.71 2fy1 s PRO 105 N -2.97 4.19 0.45 12.44 0.04 -1.26 -4.95 135.00 142.95 2fy1 s PRO 105 Ca 0.05 2.45 -0.25 0.00 0.04 0.00 0.00 61.00 63.30 2fy1 s PRO 105 Cb -0.01 -3.09 -0.08 0.00 0.04 0.00 0.00 34.50 31.36 2fy1 s PRO 105 CO -0.02 -0.59 1.34 -1.12 0.04 0.00 0.00 177.00 176.66 2fy1 s SER 106 N 0.73 5.94 0.00 6.66 0.01 -1.26 -5.00 113.70 120.78 2fy1 s SER 106 Ca 0.66 2.73 0.00 0.00 1.31 0.00 0.00 55.95 60.65 2fy1 s SER 106 Cb -0.45 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.14 2fy1 s SER 106 CO 0.40 -1.11 0.00 0.61 0.41 0.00 0.00 173.24 173.54 2fy1 n GLY 107 N 0.63 -0.72 0.00 3.44 0.00 -1.26 -5.36 105.19 101.91 2fy1 n GLY 107 Ca 0.06 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2fy1 n GLY 107 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18