#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fy1 s VAL 2 N 0.00 0.06 -1.59 1.12 0.11 -1.26 -5.07 120.40 113.77 2fy1 s VAL 2 Ca 0.00 -0.48 0.26 0.00 -2.93 0.00 0.00 61.98 58.83 2fy1 s VAL 2 Cb 0.00 -0.51 0.54 0.00 -1.53 0.00 0.00 36.38 34.88 2fy1 s VAL 2 CO 0.00 -0.27 1.91 1.21 -3.33 0.00 0.00 175.10 174.62 2fy1 n GLU 3 N 1.58 0.50 0.00 1.54 2.13 -1.26 -4.74 120.64 120.40 2fy1 n GLU 3 Ca -0.21 0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.64 2fy1 n GLU 3 Cb 0.56 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.77 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 -1.21 0.00 0.00 4.31 0.00 -1.26 -5.11 120.51 117.25 2fy1 n ALA 4 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2fy1 n ALA 4 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.63 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 0.00 0.38 -2.71 0.00 2.03 -1.26 -5.02 116.55 109.96 2fy1 n ASP 5 Ca 0.00 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.27 2fy1 n ASP 5 Cb 0.00 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.43 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 -2.29 -2.07 1.46 -0.67 -0.00 -1.26 -4.97 115.22 105.42 2fy1 n HIS 6 Ca 0.00 -1.00 0.05 0.00 -0.00 0.00 0.00 57.72 56.78 2fy1 n HIS 6 Cb 0.13 1.27 0.32 0.00 -0.00 0.00 0.00 29.99 31.71 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 2.59 0.73 0.28 1.57 -0.04 -1.26 -4.54 135.00 134.33 2fy1 n PRO 7 Ca 0.13 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.71 2fy1 n PRO 7 Cb 0.62 -1.23 0.52 0.00 -0.04 0.00 0.00 33.50 33.37 2fy1 n PRO 7 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2fy1 h GLY 8 N 4.06 0.00 -4.98 0.55 0.00 -1.88 -3.40 103.07 97.43 2fy1 h GLY 8 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.65 2fy1 h GLY 8 CO 0.00 0.00 -0.88 1.25 0.00 0.00 0.00 176.54 176.91 2fy1 s LYS 9 N -4.13 2.49 0.02 4.80 2.20 -1.26 -1.52 119.74 122.34 2fy1 s LYS 9 Ca -0.02 -0.88 0.08 0.00 -0.36 0.00 0.00 55.97 54.79 2fy1 s LYS 9 Cb 0.07 -2.11 -0.03 0.00 -1.51 0.00 0.00 37.83 34.25 2fy1 s LYS 9 CO 0.22 0.37 -0.24 -0.51 -0.36 0.00 0.00 175.35 174.83 2fy1 s LEU 10 N -0.15 2.23 -0.24 5.43 1.02 0.48 -0.46 118.68 127.00 2fy1 s LEU 10 Ca -0.04 -0.51 -0.08 0.00 0.02 0.00 0.00 54.13 53.53 2fy1 s LEU 10 Cb -0.14 -1.35 -0.04 0.00 0.02 0.00 0.00 46.19 44.69 2fy1 s LEU 10 CO 0.04 0.28 0.09 0.12 0.02 0.00 0.00 176.35 176.89 2fy1 s PHE 11 N -0.76 3.15 -0.15 0.29 5.36 0.43 -1.08 117.98 125.21 2fy1 s PHE 11 Ca 0.12 -0.20 -0.04 0.00 -0.96 0.00 0.00 56.93 55.85 2fy1 s PHE 11 Cb -0.10 -2.22 -0.03 0.00 -0.34 0.00 0.00 43.02 40.33 2fy1 s PHE 11 CO 0.02 -0.19 -0.03 0.42 -1.46 0.00 0.00 175.22 173.98 2fy1 s ILE 12 N 1.31 4.00 -0.20 3.12 1.09 0.87 -1.48 121.20 129.91 2fy1 s ILE 12 Ca 0.05 -0.32 -0.04 0.00 -1.10 0.00 0.00 60.65 59.24 2fy1 s ILE 12 Cb -0.15 -2.75 -0.02 0.00 -1.06 0.00 0.00 42.46 38.49 2fy1 s ILE 12 CO 0.04 0.50 -0.02 -0.83 -0.10 0.00 0.00 174.94 174.53 2fy1 s GLY 13 N 0.22 1.68 0.00 6.18 0.00 0.31 -1.54 107.32 114.17 2fy1 s GLY 13 Ca -0.02 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.69 2fy1 s GLY 13 CO 0.03 0.23 0.00 0.61 0.00 0.00 0.00 173.10 173.97 2fy1 n GLY 14 N 4.28 -1.22 4.84 0.20 0.00 -1.26 -1.51 105.19 110.52 2fy1 n GLY 14 Ca -0.17 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.02 0.99 7.99 -1.26 -4.66 117.00 118.04 2fy1 n LEU 15 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 56.01 55.97 2fy1 n LEU 15 Cb 0.00 0.00 -0.01 0.00 -0.11 0.00 0.00 43.42 43.30 2fy1 n LEU 15 CO 0.00 0.00 -0.04 -3.20 -1.51 0.00 0.00 177.39 172.64 2fy1 n ASN 16 N 0.20 -1.52 -3.28 -1.43 5.15 -1.26 -0.08 115.26 113.04 2fy1 n ASN 16 Ca 0.00 0.30 -0.21 0.00 -0.60 0.00 0.00 54.58 54.07 2fy1 n ASN 16 Cb 0.00 -1.51 -0.01 0.00 -0.53 0.00 0.00 39.78 37.73 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 -2.13 -3.04 0.06 1.20 3.00 -1.26 -4.80 116.66 109.69 2fy1 n ARG 17 Ca -0.04 0.41 0.00 0.00 -0.01 0.00 0.00 57.85 58.22 2fy1 n ARG 17 Cb 0.39 -5.08 0.00 0.00 0.00 0.00 0.00 32.46 27.77 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 -3.54 0.00 -3.91 5.56 2.13 0.88 -5.11 120.64 116.66 2fy1 n GLU 18 Ca -0.02 0.00 -0.24 0.00 0.66 0.00 0.00 57.16 57.57 2fy1 n GLU 18 Cb 0.54 -0.22 -0.05 0.00 0.27 0.00 0.00 31.44 31.98 2fy1 n GLU 18 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 2fy1 s THR 19 N -2.00 2.31 0.00 6.31 -1.32 -0.38 -5.13 115.64 115.43 2fy1 s THR 19 Ca 0.00 -1.55 0.00 0.00 -1.21 0.00 0.00 61.69 58.93 2fy1 s THR 19 Cb 0.00 -2.86 0.00 0.00 -1.51 0.00 0.00 72.50 68.13 2fy1 s THR 19 CO 0.00 0.00 0.00 0.59 -2.21 0.00 0.00 174.62 173.00 2fy1 n ASN 20 N -1.43 0.00 0.15 8.08 4.13 -1.26 -4.81 115.26 120.13 2fy1 n ASN 20 Ca 0.00 0.00 0.06 0.00 1.68 0.00 0.00 54.58 56.33 2fy1 n ASN 20 Cb 0.64 0.00 0.34 0.00 -1.54 0.00 0.00 39.78 39.22 2fy1 n ASN 20 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 2fy1 n GLU 21 N 0.00 0.09 0.39 3.52 2.13 -1.26 0.32 120.64 125.83 2fy1 n GLU 21 Ca 0.00 0.55 -0.19 0.00 0.66 0.00 0.00 57.16 58.19 2fy1 n GLU 21 Cb 0.00 -2.06 -0.09 0.00 0.27 0.00 0.00 31.44 29.56 2fy1 n GLU 21 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2fy1 h LYS 22 N 0.00 -1.01 -1.01 5.31 3.64 -2.00 -1.28 116.57 120.22 2fy1 h LYS 22 Ca 0.00 0.07 0.11 0.00 -1.27 0.00 0.00 60.65 59.56 2fy1 h LYS 22 Cb 0.55 0.23 -0.08 0.00 -0.41 0.00 0.00 32.23 32.52 2fy1 h LYS 22 CO 0.00 -0.67 0.64 0.00 -2.27 0.00 0.00 179.45 177.14 2fy1 h MET 23 N -1.05 1.00 0.00 1.90 -0.00 -0.52 -1.79 114.93 114.47 2fy1 h MET 23 Ca -0.09 -0.06 0.00 0.00 -0.00 0.00 0.00 59.70 59.55 2fy1 h MET 23 Cb 0.83 -0.23 0.00 0.00 -0.00 0.00 0.00 31.60 32.21 2fy1 h MET 23 CO 0.12 0.66 0.00 1.28 -0.00 0.00 0.00 176.91 178.97 2fy1 n LEU 24 N -4.59 0.00 -0.13 -0.10 7.99 -0.58 0.11 117.00 119.70 2fy1 n LEU 24 Ca 0.18 0.84 0.13 0.00 -0.01 0.00 0.00 56.01 57.16 2fy1 n LEU 24 Cb 0.32 -0.34 0.49 0.00 -0.11 0.00 0.00 43.42 43.78 2fy1 n LEU 24 CO 0.28 -0.34 1.20 0.11 -1.51 0.00 0.00 177.39 177.13 2fy1 h LYS 25 N 0.00 0.42 0.00 3.23 1.57 -1.36 -1.67 116.57 118.76 2fy1 h LYS 25 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2fy1 h LYS 25 Cb 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2fy1 h LYS 25 CO 0.00 0.28 0.00 0.00 -0.57 0.00 0.00 179.45 179.16 2fy1 n ALA 26 N -2.51 0.00 -0.06 3.86 0.00 -0.67 -0.74 120.51 120.38 2fy1 n ALA 26 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.47 2fy1 n ALA 26 Cb 0.45 0.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 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 0.26 0.15 0.00 2.07 -0.12 -0.56 116.25 118.05 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 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 2fy1 h VAL 27 CO 0.00 0.00 -0.07 -0.26 0.02 0.00 0.00 177.57 177.26 2fy1 h PHE 28 N -0.32 -0.18 0.00 1.57 -1.00 -1.47 -3.17 116.94 112.37 2fy1 h PHE 28 Ca 0.13 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.91 2fy1 h PHE 28 Cb 0.54 0.06 0.00 0.00 3.61 0.00 0.00 35.95 40.16 2fy1 h PHE 28 CO -0.47 0.23 0.17 0.78 -1.61 0.00 0.00 178.31 177.41 2fy1 h GLY 29 N -0.67 0.00 -0.11 -1.45 0.00 -0.58 -3.12 103.07 97.15 2fy1 h GLY 29 Ca -0.02 0.00 0.23 0.00 0.00 0.00 0.00 47.33 47.54 2fy1 h GLY 29 CO 0.03 0.00 0.55 0.50 0.00 0.00 0.00 176.54 177.63 2fy1 h LYS 30 N 0.00 0.55 0.00 4.80 1.57 -1.08 -2.86 116.57 119.56 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 0.35 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.47 2fy1 h LYS 30 CO 0.00 0.37 -0.41 0.72 -0.57 0.00 0.00 179.45 179.56 2fy1 n HIS 31 N -4.90 0.00 -3.70 -1.35 8.25 -1.18 -5.06 115.22 107.28 2fy1 n HIS 31 Ca 0.25 -0.88 -0.01 0.00 -0.26 0.00 0.00 57.72 56.81 2fy1 n HIS 31 Cb 0.70 -0.16 -0.01 0.00 1.12 0.00 0.00 29.99 31.64 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 -2.50 -0.30 -0.12 -1.41 0.00 -1.08 -3.92 107.32 97.99 2fy1 s GLY 32 Ca 0.28 0.34 -0.29 0.00 0.00 0.00 0.00 44.72 45.05 2fy1 s GLY 32 CO -0.04 0.08 1.20 2.56 0.00 0.00 0.00 173.10 176.90 2fy1 s PRO 33 N -2.94 4.29 -0.32 2.90 0.04 -1.26 -4.32 135.00 133.40 2fy1 s PRO 33 Ca 0.13 1.62 -0.10 0.00 0.04 0.00 0.00 61.00 62.70 2fy1 s PRO 33 Cb 0.01 -3.66 -0.00 0.00 0.04 0.00 0.00 34.50 30.89 2fy1 s PRO 33 CO -0.00 -0.57 0.16 0.42 0.04 0.00 0.00 177.00 177.05 2fy1 s ILE 34 N 2.87 4.58 -0.28 0.56 1.09 -1.26 -1.76 121.20 127.00 2fy1 s ILE 34 Ca 0.54 -0.51 0.23 0.00 -1.10 0.00 0.00 60.65 59.80 2fy1 s ILE 34 Cb -0.22 -3.38 -0.03 0.00 -1.06 0.00 0.00 42.46 37.77 2fy1 s ILE 34 CO 0.17 0.01 1.03 -0.24 -0.10 0.00 0.00 174.94 175.81 2fy1 n SER 35 N 4.98 0.76 -3.72 3.58 2.88 0.48 -4.85 113.62 117.73 2fy1 n SER 35 Ca -0.13 0.25 -0.13 0.00 -1.33 0.00 0.00 58.87 57.53 2fy1 n SER 35 Cb 0.48 0.55 -0.09 0.00 -0.75 0.00 0.00 64.21 64.40 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 -3.35 0.55 -0.05 -1.46 -6.30 -0.47 -4.52 118.70 103.11 2fy1 s GLU 36 Ca -0.00 0.47 0.00 0.00 -2.50 0.00 0.00 54.97 52.94 2fy1 s GLU 36 Cb 0.10 0.26 0.02 0.00 0.00 0.00 0.00 34.13 34.52 2fy1 s GLU 36 CO 0.79 -0.09 -0.03 0.08 0.02 0.00 0.00 175.26 176.04 2fy1 s VAL 37 N -0.06 0.44 -0.01 3.70 1.01 -1.26 -0.99 120.40 123.23 2fy1 s VAL 37 Ca -0.02 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2fy1 s VAL 37 Cb -0.03 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.84 2fy1 s VAL 37 CO 0.02 0.22 -0.05 -0.22 0.00 0.00 0.00 175.10 175.07 2fy1 s LEU 38 N 1.21 1.81 -0.05 3.92 2.96 0.29 -4.62 118.68 124.20 2fy1 s LEU 38 Ca -0.07 -0.11 0.05 0.00 -0.22 0.00 0.00 54.13 53.78 2fy1 s LEU 38 Cb -0.14 -0.33 -0.00 0.00 0.50 0.00 0.00 46.19 46.22 2fy1 s LEU 38 CO -0.02 0.03 -0.18 -0.76 -1.32 0.00 0.00 176.35 174.11 2fy1 s LEU 39 N 0.16 1.94 -0.14 -0.68 2.01 -1.26 -0.52 118.68 120.20 2fy1 s LEU 39 Ca -0.02 -0.38 -0.05 0.00 0.01 0.00 0.00 54.13 53.70 2fy1 s LEU 39 Cb -0.06 -1.03 -0.04 0.00 0.01 0.00 0.00 46.19 45.07 2fy1 s LEU 39 CO -0.00 0.17 0.05 -0.63 1.01 0.00 0.00 176.35 176.94 2fy1 s ILE 40 N 0.01 4.67 0.00 -0.59 -1.09 0.15 -4.86 121.20 119.49 2fy1 s ILE 40 Ca -0.04 -0.10 0.00 0.00 -2.23 0.00 0.00 60.65 58.29 2fy1 s ILE 40 Cb -0.12 -3.04 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2fy1 s ILE 40 CO 0.02 0.54 0.00 0.29 -1.23 0.00 0.00 174.94 174.57 2fy1 n LYS 41 N 2.78 0.70 -3.61 2.79 5.02 -1.26 -1.74 118.16 122.85 2fy1 n LYS 41 Ca -0.18 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.02 2fy1 n LYS 41 Cb 0.53 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.49 2fy1 n LYS 41 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2fy1 s ASP 42 N 1.00 -0.34 0.00 4.39 -4.77 -1.26 -4.85 116.67 110.84 2fy1 s ASP 42 Ca 0.00 0.47 0.00 0.00 -3.30 0.00 0.00 52.55 49.72 2fy1 s ASP 42 Cb 0.00 0.42 0.00 0.00 -1.09 0.00 0.00 42.92 42.25 2fy1 s ASP 42 CO 0.00 -0.24 0.00 -1.14 0.70 0.00 0.00 175.17 174.49 2fy1 n ARG 43 N 1.17 0.00 -0.51 2.11 0.63 -1.26 0.27 116.66 119.08 2fy1 n ARG 43 Ca -0.10 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.83 2fy1 n ARG 43 Cb 0.57 -3.23 0.00 0.00 0.45 0.00 0.00 32.46 30.25 2fy1 n ARG 43 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 2fy1 n THR 44 N -1.48 0.00 0.00 5.15 5.66 -1.26 -4.78 114.28 117.57 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 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2fy1 n THR 44 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2fy1 n SER 45 N 0.00 0.00 -0.29 1.09 2.88 0.94 -4.98 113.62 113.26 2fy1 n SER 45 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 2fy1 n SER 45 Cb 0.00 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 63.69 2fy1 n SER 45 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2fy1 h LYS 46 N 0.00 0.55 -1.38 -1.46 1.57 -0.49 -3.48 116.57 111.88 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 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.19 2fy1 h LYS 46 CO 0.00 0.37 0.00 0.45 -0.57 0.00 0.00 179.45 179.70 2fy1 n SER 47 N -4.91 -0.92 -2.13 0.86 2.88 -1.24 -5.00 113.62 103.16 2fy1 n SER 47 Ca 0.18 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.70 2fy1 n SER 47 Cb 0.47 -0.46 -0.00 0.00 -0.75 0.00 0.00 64.21 63.47 2fy1 n SER 47 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 2fy1 n ARG 48 N 0.02 1.85 -3.72 -1.46 1.85 -1.26 -5.03 116.66 108.91 2fy1 n ARG 48 Ca 0.00 -0.17 -0.24 0.00 -1.00 0.00 0.00 57.85 56.44 2fy1 n ARG 48 Cb 0.00 0.04 -0.17 0.00 -1.05 0.00 0.00 32.46 31.28 2fy1 n ARG 48 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2fy1 s GLY 49 N -1.23 0.45 -0.02 2.89 0.00 -1.24 -4.57 107.32 103.60 2fy1 s GLY 49 Ca 0.00 -0.20 0.01 0.00 0.00 0.00 0.00 44.72 44.54 2fy1 s GLY 49 CO 0.00 1.33 -0.04 -0.11 0.00 0.00 0.00 173.10 174.28 2fy1 s PHE 50 N 2.01 0.53 -0.13 1.90 -0.71 -0.71 -4.60 117.98 116.27 2fy1 s PHE 50 Ca 0.03 -0.11 -0.05 0.00 -1.04 0.00 0.00 56.93 55.76 2fy1 s PHE 50 Cb -0.14 -0.42 -0.04 0.00 -1.21 0.00 0.00 43.02 41.21 2fy1 s PHE 50 CO -0.06 -0.07 0.06 0.00 -1.34 0.00 0.00 175.22 173.81 2fy1 s ALA 51 N 0.30 3.46 -0.08 1.99 0.00 -0.59 0.34 121.76 127.19 2fy1 s ALA 51 Ca -0.03 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.19 2fy1 s ALA 51 Cb -0.07 -1.77 0.02 0.00 0.00 0.00 0.00 23.12 21.30 2fy1 s ALA 51 CO -0.00 0.43 -0.09 -0.06 0.00 0.00 0.00 175.76 176.04 2fy1 s PHE 52 N -0.41 1.30 -0.02 0.00 0.08 0.33 -0.09 117.98 119.17 2fy1 s PHE 52 Ca 0.09 -0.53 0.01 0.00 0.12 0.00 0.00 56.93 56.62 2fy1 s PHE 52 Cb -0.12 -1.04 0.01 0.00 -0.57 0.00 0.00 43.02 41.29 2fy1 s PHE 52 CO 0.02 -0.35 -0.05 0.42 -0.10 0.00 0.00 175.22 175.16 2fy1 s ILE 53 N 1.15 0.46 -0.14 0.64 1.01 -0.24 -0.55 121.20 123.53 2fy1 s ILE 53 Ca -0.06 -0.17 -0.05 0.00 0.00 0.00 0.00 60.65 60.36 2fy1 s ILE 53 Cb -0.14 -0.43 -0.04 0.00 0.01 0.00 0.00 42.46 41.86 2fy1 s ILE 53 CO -0.02 0.16 0.05 -0.89 0.00 0.00 0.00 174.94 174.25 2fy1 s THR 54 N 0.32 4.70 -0.13 2.92 2.01 -0.16 -0.39 115.64 124.92 2fy1 s THR 54 Ca -0.04 -0.08 -0.05 0.00 0.31 0.00 0.00 61.69 61.83 2fy1 s THR 54 Cb -0.08 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 2fy1 s THR 54 CO -0.00 0.54 0.04 -0.36 -0.69 0.00 0.00 174.62 174.15 2fy1 s PHE 55 N -0.31 3.26 0.56 4.92 0.40 -0.57 -0.39 117.98 125.85 2fy1 s PHE 55 Ca 0.08 0.17 0.42 0.00 -0.60 0.00 0.00 56.93 57.00 2fy1 s PHE 55 Cb -0.12 -1.93 1.56 0.00 0.51 0.00 0.00 43.02 43.04 2fy1 s PHE 55 CO 0.02 0.37 1.64 0.93 0.70 0.00 0.00 175.22 178.88 2fy1 h GLU 56 N 5.77 0.00 -4.95 0.44 5.08 -1.67 -3.40 114.58 115.85 2fy1 h GLU 56 Ca -0.45 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.58 2fy1 h GLU 56 Cb 1.19 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.24 2fy1 h GLU 56 CO 0.61 0.00 -0.75 -0.80 -1.00 0.00 0.00 179.01 177.07 2fy1 s ASN 57 N -4.37 1.31 0.24 1.42 0.01 -1.26 -5.05 114.94 107.25 2fy1 s ASN 57 Ca -0.05 -0.66 -0.05 0.00 -0.71 0.00 0.00 52.86 51.40 2fy1 s ASN 57 Cb 0.23 0.00 0.27 0.00 0.41 0.00 0.00 41.25 42.16 2fy1 s ASN 57 CO 0.79 -0.19 1.78 1.55 -1.51 0.00 0.00 177.10 179.53 2fy1 h PRO 58 N 4.11 1.00 -0.72 -0.60 0.13 -1.89 -2.49 132.00 131.55 2fy1 h PRO 58 Ca -0.38 -0.21 0.07 0.00 -0.87 0.00 0.00 66.00 64.61 2fy1 h PRO 58 Cb 1.19 -0.15 -0.09 0.00 0.13 0.00 0.00 31.00 32.08 2fy1 h PRO 58 CO 0.45 0.87 -0.48 0.00 -0.23 0.00 0.00 178.00 178.60 2fy1 h ALA 59 N 1.23 -0.52 -0.45 -0.56 0.00 -1.96 -1.39 119.26 115.62 2fy1 h ALA 59 Ca 0.21 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2fy1 h ALA 59 Cb 0.30 1.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 2fy1 h ALA 59 CO -0.00 -0.83 0.24 -0.44 0.00 0.00 0.00 179.25 178.21 2fy1 h ASP 60 N -0.08 0.54 0.26 0.00 3.32 -1.80 0.20 116.42 118.87 2fy1 h ASP 60 Ca 0.12 -0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.14 2fy1 h ASP 60 Cb 0.38 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 2fy1 h ASP 60 CO -0.72 0.45 -0.34 0.00 -1.72 0.00 0.00 179.24 176.91 2fy1 h ALA 61 N 1.64 -0.68 -0.92 3.45 0.00 -0.99 -1.38 119.26 120.38 2fy1 h ALA 61 Ca 0.16 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.07 2fy1 h ALA 61 Cb 0.03 0.52 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 2fy1 h ALA 61 CO -0.03 -0.93 0.57 -0.22 0.00 0.00 0.00 179.25 178.64 2fy1 h LYS 62 N -0.66 0.93 0.46 0.00 3.11 -0.72 0.12 116.57 119.81 2fy1 h LYS 62 Ca -0.00 -0.06 -0.02 0.00 -2.81 0.00 0.00 60.65 57.77 2fy1 h LYS 62 Cb 0.63 -0.21 -0.02 0.00 -1.00 0.00 0.00 32.23 31.63 2fy1 h LYS 62 CO -0.11 0.62 -0.42 -0.97 -2.81 0.00 0.00 179.45 175.76 2fy1 h ASN 63 N 0.96 -1.12 -0.88 4.20 -0.73 -0.50 0.85 115.58 118.36 2fy1 h ASN 63 Ca 0.43 0.08 0.11 0.00 1.87 0.00 0.00 56.30 58.80 2fy1 h ASN 63 Cb 0.33 0.36 -0.07 0.00 0.27 0.00 0.00 38.32 39.22 2fy1 h ASN 63 CO -0.23 -0.56 0.57 0.00 -0.37 0.00 0.00 177.43 176.84 2fy1 h ALA 64 N -1.11 1.72 0.55 1.57 0.00 -1.01 0.70 119.26 121.69 2fy1 h ALA 64 Ca -0.06 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2fy1 h ALA 64 Cb 0.74 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2fy1 h ALA 64 CO -0.02 0.08 -0.51 0.00 0.00 0.00 0.00 179.25 178.79 2fy1 h ALA 65 N 1.58 -1.18 -0.75 0.00 0.00 -0.81 -1.07 119.26 117.03 2fy1 h ALA 65 Ca 0.42 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.21 2fy1 h ALA 65 Cb 0.52 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 2fy1 h ALA 65 CO -0.18 -1.20 0.41 -0.22 0.00 0.00 0.00 179.25 178.06 2fy1 h LYS 66 N -1.05 0.69 0.44 0.00 3.64 -0.19 -2.10 116.57 118.00 2fy1 h LYS 66 Ca -0.07 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 2fy1 h LYS 66 Cb 0.90 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 2fy1 h LYS 66 CO -0.04 0.46 -0.44 0.22 -2.27 0.00 0.00 179.45 177.38 2fy1 h ASP 67 N 0.71 -1.19 0.00 4.20 3.58 -0.91 -3.42 116.42 119.38 2fy1 h ASP 67 Ca 0.36 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.90 2fy1 h ASP 67 Cb 0.31 0.39 0.00 0.00 1.72 0.00 0.00 39.33 41.76 2fy1 h ASP 67 CO -0.24 -0.58 0.00 0.23 -2.88 0.00 0.00 179.24 175.78 2fy1 n MET 68 N -5.06 0.00 -0.35 0.28 2.81 -0.41 -4.82 117.12 109.57 2fy1 n MET 68 Ca -0.10 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.79 2fy1 n MET 68 Cb 0.40 -0.48 0.00 0.00 -0.71 0.00 0.00 33.22 32.43 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 -0.24 0.00 0.00 7.83 0.23 -1.00 -1.86 115.26 120.23 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 -1.77 0.00 0.00 -2.08 0.00 0.00 39.78 35.93 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 -1.13 0.00 0.14 4.83 0.00 -1.05 -4.57 105.19 103.41 2fy1 n GLY 70 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2fy1 n GLY 70 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2fy1 h LYS 71 N 0.00 0.06 -1.51 1.61 1.63 -1.58 -3.44 116.57 113.34 2fy1 h LYS 71 Ca 0.00 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2fy1 h LYS 71 Cb 0.00 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.62 2fy1 h LYS 71 CO 0.00 0.04 0.00 0.45 -3.45 0.00 0.00 179.45 176.49 2fy1 n SER 72 N -5.19 -1.42 0.00 4.20 2.88 -1.26 -4.97 113.62 107.85 2fy1 n SER 72 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2fy1 n SER 72 Cb 0.17 -0.71 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 2fy1 n SER 72 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2fy1 n LEU 73 N 0.00 0.00 -2.47 2.46 -0.00 -0.71 -4.92 117.00 111.36 2fy1 n LEU 73 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 56.01 55.73 2fy1 n LEU 73 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.43 2fy1 n LEU 73 CO 0.00 0.05 0.34 0.00 -0.00 0.00 0.00 177.39 177.77 2fy1 n HIS 74 N 0.00 3.30 -1.48 1.47 1.44 -1.26 -4.85 115.22 113.84 2fy1 n HIS 74 Ca 0.00 -2.94 -0.17 0.00 -2.01 0.00 0.00 57.72 52.61 2fy1 n HIS 74 Cb 0.07 -0.24 -0.07 0.00 0.12 0.00 0.00 29.99 29.88 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 -0.52 1.58 3.46 -1.39 0.00 -1.26 -4.90 105.19 102.15 2fy1 n GLY 75 Ca 0.41 -0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.31 2fy1 n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fy1 s LYS 76 N -3.40 1.12 0.56 1.61 1.02 -1.26 -5.16 119.74 114.23 2fy1 s LYS 76 Ca 0.00 -0.28 -0.17 0.00 0.02 0.00 0.00 55.97 55.54 2fy1 s LYS 76 Cb 0.00 0.52 -0.05 0.00 -0.52 0.00 0.00 37.83 37.78 2fy1 s LYS 76 CO 0.00 -0.46 1.07 0.00 -0.92 0.00 0.00 175.35 175.03 2fy1 s ALA 77 N -3.04 2.75 -0.08 5.17 0.00 -1.26 -1.74 121.76 123.56 2fy1 s ALA 77 Ca -0.01 0.52 -0.03 0.00 0.00 0.00 0.00 51.96 52.44 2fy1 s ALA 77 Cb -0.01 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 2fy1 s ALA 77 CO -0.07 -0.71 0.06 0.96 0.00 0.00 0.00 175.76 175.99 2fy1 s ILE 78 N -2.23 4.73 -0.21 0.00 -4.36 -1.26 -4.76 121.20 113.10 2fy1 s ILE 78 Ca 0.66 -0.15 -0.08 0.00 -0.26 0.00 0.00 60.65 60.82 2fy1 s ILE 78 Cb -0.17 -3.04 -0.04 0.00 1.25 0.00 0.00 42.46 40.45 2fy1 s ILE 78 CO 0.31 0.56 0.07 -0.75 0.24 0.00 0.00 174.94 175.38 2fy1 s LYS 79 N -1.09 3.86 -0.20 0.37 2.36 -0.57 -2.54 119.74 121.93 2fy1 s LYS 79 Ca 0.16 -0.39 -0.01 0.00 -2.55 0.00 0.00 55.97 53.17 2fy1 s LYS 79 Cb -0.12 -3.28 0.00 0.00 -1.05 0.00 0.00 37.83 33.39 2fy1 s LYS 79 CO 0.05 0.09 -0.12 0.08 1.55 0.00 0.00 175.35 177.00 2fy1 s VAL 80 N 0.89 2.75 0.06 4.02 1.01 -1.26 -0.53 120.40 127.34 2fy1 s VAL 80 Ca 0.04 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2fy1 s VAL 80 Cb -0.14 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 2fy1 s VAL 80 CO 0.03 0.48 -0.08 -0.70 0.00 0.00 0.00 175.10 174.83 2fy1 s GLU 81 N 1.31 0.63 -0.16 2.72 2.56 -0.55 -4.72 118.70 120.49 2fy1 s GLU 81 Ca 0.04 -0.92 -0.08 0.00 0.00 0.00 0.00 54.97 54.01 2fy1 s GLU 81 Cb -0.14 -0.32 -0.04 0.00 2.00 0.00 0.00 34.13 35.63 2fy1 s GLU 81 CO -0.07 0.05 0.11 1.14 -0.56 0.00 0.00 175.26 175.93 2fy1 s GLN 82 N -2.15 3.81 0.81 4.30 0.00 -1.26 -0.43 119.66 124.74 2fy1 s GLN 82 Ca -0.04 -0.22 -0.14 0.00 -0.00 0.00 0.00 55.36 54.96 2fy1 s GLN 82 Cb -0.06 -3.26 0.07 0.00 0.00 0.00 0.00 33.01 29.75 2fy1 s GLN 82 CO -0.01 0.49 1.08 0.00 0.00 0.00 0.00 175.29 176.86 2fy1 n ALA 83 N 2.89 -0.32 0.01 2.60 0.00 0.39 -4.83 120.51 121.25 2fy1 n ALA 83 Ca -0.18 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2fy1 n ALA 83 Cb 0.53 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.80 2fy1 n ALA 83 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2fy1 n LYS 84 N -2.88 0.00 -3.53 0.00 3.00 -1.26 -4.97 118.16 108.52 2fy1 n LYS 84 Ca 0.13 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.29 2fy1 n LYS 84 Cb 0.50 -0.01 -0.05 0.00 0.00 0.00 0.00 35.03 35.47 2fy1 n LYS 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2fy1 s LYS 85 N -1.06 0.89 0.37 1.64 0.00 -1.26 -5.19 119.74 115.13 2fy1 s LYS 85 Ca 0.00 0.15 0.03 0.00 0.00 0.00 0.00 55.97 56.15 2fy1 s LYS 85 Cb 0.00 0.42 -0.01 0.00 0.00 0.00 0.00 37.83 38.23 2fy1 s LYS 85 CO 0.00 -0.29 0.54 -1.25 0.00 0.00 0.00 175.35 174.35 2fy1 s PRO 86 N -1.40 3.19 0.00 1.78 0.04 -1.26 -5.03 135.00 132.32 2fy1 s PRO 86 Ca -0.06 -0.69 0.29 0.00 0.04 0.00 0.00 61.00 60.58 2fy1 s PRO 86 Cb -0.00 -2.71 1.46 0.00 0.04 0.00 0.00 34.50 33.29 2fy1 s PRO 86 CO 0.05 -0.00 2.00 0.43 0.04 0.00 0.00 177.00 179.52 2fy1 n SER 87 N -1.79 0.00 -3.91 6.66 7.64 -1.26 -4.90 113.62 116.06 2fy1 n SER 87 Ca -0.01 -0.13 -0.09 0.00 1.01 0.00 0.00 58.87 59.64 2fy1 n SER 87 Cb 0.58 -0.28 -0.07 0.00 -1.01 0.00 0.00 64.21 63.42 2fy1 n SER 87 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2fy1 s PHE 88 N -2.56 0.26 0.82 1.43 5.36 -1.26 -5.17 117.98 116.85 2fy1 s PHE 88 Ca 0.28 -0.68 -0.13 0.00 -0.96 0.00 0.00 56.93 55.44 2fy1 s PHE 88 Cb 0.19 -0.09 0.08 0.00 -0.34 0.00 0.00 43.02 42.87 2fy1 s PHE 88 CO 0.44 -0.59 1.15 1.04 -1.46 0.00 0.00 175.22 175.80 2fy1 n GLN 89 N -0.10 0.13 -4.04 10.12 6.02 -1.26 -5.07 117.38 123.18 2fy1 n GLN 89 Ca -0.12 0.12 -0.10 0.00 -0.01 0.00 0.00 57.00 56.89 2fy1 n GLN 89 Cb 0.63 -2.39 -0.06 0.00 1.02 0.00 0.00 30.24 29.43 2fy1 n GLN 89 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2fy1 s SER 90 N -2.12 -0.03 0.00 1.08 0.15 -1.26 -5.09 113.70 106.43 2fy1 s SER 90 Ca 0.72 -1.02 0.02 0.00 0.70 0.00 0.00 55.95 56.37 2fy1 s SER 90 Cb -0.29 0.53 0.03 0.00 -1.71 0.00 0.00 66.02 64.58 2fy1 s SER 90 CO 0.52 -1.06 0.86 0.61 1.20 0.00 0.00 173.24 175.37 2fy1 n GLY 91 N -0.35 0.69 3.65 9.45 0.00 -1.26 -5.16 105.19 112.21 2fy1 n GLY 91 Ca -0.01 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 2fy1 n GLY 91 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fy1 s GLY 92 N -0.76 1.65 0.06 -0.02 0.00 -1.26 -5.08 107.32 101.91 2fy1 s GLY 92 Ca 0.02 0.33 -0.01 0.00 0.00 0.00 0.00 44.72 45.07 2fy1 s GLY 92 CO -0.01 0.81 -0.02 0.50 0.00 0.00 0.00 173.10 174.38 2fy1 s ARG 93 N -4.67 0.66 0.00 2.90 0.52 -1.26 -5.07 118.95 112.03 2fy1 s ARG 93 Ca 0.66 -1.25 -0.05 0.00 -0.52 0.00 0.00 55.73 54.57 2fy1 s ARG 93 Cb -0.22 0.18 -0.21 0.00 0.52 0.00 0.00 34.95 35.23 2fy1 s ARG 93 CO 0.59 -0.12 3.10 -2.13 0.02 0.00 0.00 175.30 176.76 2fy1 n ARG 94 N 0.07 1.67 -3.67 3.54 0.63 -1.26 -4.66 116.66 112.99 2fy1 n ARG 94 Ca -0.13 -0.76 -0.08 0.00 -0.92 0.00 0.00 57.85 55.96 2fy1 n ARG 94 Cb 0.61 -1.81 -0.09 0.00 0.45 0.00 0.00 32.46 31.63 2fy1 n ARG 94 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 2fy1 s ARG 95 N 1.02 0.48 0.33 -0.14 3.52 -1.26 -4.85 118.95 118.06 2fy1 s ARG 95 Ca 0.51 1.05 -0.28 0.00 -0.13 0.00 0.00 55.73 56.88 2fy1 s ARG 95 Cb 0.24 0.21 -0.13 0.00 -1.56 0.00 0.00 34.95 33.72 2fy1 s ARG 95 CO 0.00 -0.18 1.14 -2.30 -0.81 0.00 0.00 175.30 173.14 2fy1 n PRO 96 N 4.68 1.70 -1.60 5.12 -0.02 -1.26 -4.94 135.00 138.69 2fy1 n PRO 96 Ca -0.18 0.60 -0.29 0.00 -2.02 0.00 0.00 63.50 61.61 2fy1 n PRO 96 Cb 0.54 -2.09 0.11 0.00 -0.02 0.00 0.00 33.50 32.04 2fy1 n PRO 96 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2fy1 s PRO 97 N -1.76 1.67 0.68 0.52 0.04 -1.26 -5.05 135.00 129.84 2fy1 s PRO 97 Ca 0.58 0.40 -0.16 0.00 0.04 0.00 0.00 61.00 61.86 2fy1 s PRO 97 Cb -0.62 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.04 2fy1 s PRO 97 CO 0.61 -1.85 1.22 0.00 0.04 0.00 0.00 177.00 177.01 2fy1 s ALA 98 N -3.27 2.28 0.15 8.56 0.00 -1.26 -5.07 121.76 123.15 2fy1 s ALA 98 Ca 0.62 0.96 -0.15 0.00 0.00 0.00 0.00 51.96 53.39 2fy1 s ALA 98 Cb -0.14 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.53 2fy1 s ALA 98 CO 0.53 -1.64 0.40 0.45 0.00 0.00 0.00 175.76 175.51 2fy1 s SER 99 N -1.83 -0.16 0.18 0.00 0.15 -1.26 -5.16 113.70 105.61 2fy1 s SER 99 Ca 0.76 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.91 2fy1 s SER 99 Cb -0.31 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 2fy1 s SER 99 CO 0.41 -0.92 0.00 -1.54 1.20 0.00 0.00 173.24 172.39 2fy1 n SER 100 N -0.25 -2.80 -1.54 5.45 3.41 -1.26 -4.86 113.62 111.76 2fy1 n SER 100 Ca -0.12 0.41 -0.12 0.00 -0.26 0.00 0.00 58.87 58.78 2fy1 n SER 100 Cb 0.63 -1.40 -0.04 0.00 -0.26 0.00 0.00 64.21 63.14 2fy1 n SER 100 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2fy1 n ARG 101 N -1.54 -1.44 0.14 4.33 3.00 -1.26 -4.84 116.66 115.04 2fy1 n ARG 101 Ca 0.00 0.67 0.16 0.00 -0.00 0.00 0.00 57.85 58.68 2fy1 n ARG 101 Cb 0.17 -4.96 0.72 0.00 0.00 0.00 0.00 32.46 28.39 2fy1 n ARG 101 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.63 176.66 2fy1 h ASN 102 N 0.00 0.00 -5.19 6.15 -0.73 -2.02 -3.41 115.58 110.38 2fy1 h ASN 102 Ca -0.25 0.00 -0.12 0.00 1.87 0.00 0.00 56.30 57.80 2fy1 h ASN 102 Cb 0.85 0.00 -0.16 0.00 0.27 0.00 0.00 38.32 39.28 2fy1 h ASN 102 CO 0.35 0.00 -0.61 -0.13 -0.37 0.00 0.00 177.43 176.67 2fy1 s ARG 103 N -4.92 0.63 0.10 6.67 1.81 -1.26 -5.14 118.95 116.84 2fy1 s ARG 103 Ca -0.05 -1.08 -0.31 0.00 -1.72 0.00 0.00 55.73 52.58 2fy1 s ARG 103 Cb 0.18 0.23 -0.10 0.00 -0.45 0.00 0.00 34.95 34.81 2fy1 s ARG 103 CO 0.66 -0.14 1.88 -1.12 -0.68 0.00 0.00 175.30 175.90 2fy1 s SER 104 N -2.71 6.43 0.54 0.23 0.01 -1.26 -4.97 113.70 111.95 2fy1 s SER 104 Ca 0.04 2.74 -0.19 0.00 1.31 0.00 0.00 55.95 59.84 2fy1 s SER 104 Cb 0.05 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.66 2fy1 s SER 104 CO -0.09 -1.02 1.09 -2.16 0.41 0.00 0.00 173.24 171.47 2fy1 s PRO 105 N 3.28 3.47 0.25 12.44 0.04 -1.26 -5.07 135.00 148.15 2fy1 s PRO 105 Ca 0.83 1.47 -0.20 0.00 0.04 0.00 0.00 61.00 63.14 2fy1 s PRO 105 Cb -0.45 -2.04 0.03 0.00 0.04 0.00 0.00 34.50 32.08 2fy1 s PRO 105 CO 0.38 -0.73 0.65 0.45 0.04 0.00 0.00 177.00 177.80 2fy1 s SER 106 N -1.99 -0.29 0.00 6.66 0.15 -1.26 -5.06 113.70 111.91 2fy1 s SER 106 Ca 0.70 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.81 2fy1 s SER 106 Cb -0.20 0.68 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 2fy1 s SER 106 CO 0.26 -1.24 0.00 0.61 1.20 0.00 0.00 173.24 174.07 2fy1 n GLY 107 N -0.43 0.27 0.00 9.45 0.00 -1.26 -5.31 105.19 107.91 2fy1 n GLY 107 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2fy1 n GLY 107 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18