#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 0.62 0.60 1.12 1.01 -1.26 -5.07 120.40 117.42 2fy1 s VAL 2 Ca 0.00 -0.30 0.31 0.00 0.00 0.00 0.00 61.98 61.99 2fy1 s VAL 2 Cb 0.00 -0.54 0.37 0.00 0.00 0.00 0.00 36.38 36.20 2fy1 s VAL 2 CO 0.00 0.19 2.16 -0.33 0.00 0.00 0.00 175.10 177.12 2fy1 h GLU 3 N 6.22 0.00 0.00 2.72 5.08 -2.04 -2.11 114.58 124.45 2fy1 h GLU 3 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 2fy1 h GLU 3 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2fy1 h GLU 3 CO 0.49 0.00 -0.27 0.00 -1.00 0.00 0.00 179.01 178.23 2fy1 n ALA 4 N -2.27 2.05 -3.05 3.43 0.00 -1.26 -5.06 120.51 114.36 2fy1 n ALA 4 Ca -0.00 -1.59 -0.15 0.00 0.00 0.00 0.00 53.44 51.69 2fy1 n ALA 4 Cb 0.24 -0.42 0.02 0.00 0.00 0.00 0.00 19.45 19.29 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 -0.56 -7.15 -3.46 0.00 2.03 -0.79 -4.42 116.55 102.19 2fy1 n ASP 5 Ca 0.06 0.45 -0.23 0.00 0.52 0.00 0.00 54.79 55.59 2fy1 n ASP 5 Cb 0.66 -4.01 0.06 0.00 -0.72 0.00 0.00 41.12 37.10 2fy1 n ASP 5 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2fy1 n HIS 6 N -0.00 -2.20 -0.89 -0.67 8.25 -1.26 -5.03 115.22 113.42 2fy1 n HIS 6 Ca 0.03 0.66 -0.22 0.00 -0.26 0.00 0.00 57.72 57.93 2fy1 n HIS 6 Cb 0.47 -3.78 0.19 0.00 1.12 0.00 0.00 29.99 27.98 2fy1 n HIS 6 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2fy1 n PRO 7 N -3.68 -2.63 0.00 -0.41 -0.04 -1.26 -4.69 135.00 122.30 2fy1 n PRO 7 Ca -0.08 -1.29 0.00 0.00 -0.04 0.00 0.00 63.50 62.09 2fy1 n PRO 7 Cb 0.60 -1.22 0.00 0.00 -0.04 0.00 0.00 33.50 32.85 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 -2.93 1.01 3.14 0.55 0.00 -1.26 -4.58 105.19 101.12 2fy1 n GLY 8 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 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 0.00 1.80 0.00 1.61 2.47 -1.26 -1.52 119.74 122.84 2fy1 s LYS 9 Ca 0.00 -0.62 0.06 0.00 -1.56 0.00 0.00 55.97 53.85 2fy1 s LYS 9 Cb 0.00 -1.57 -0.02 0.00 -1.46 0.00 0.00 37.83 34.79 2fy1 s LYS 9 CO 0.00 0.25 -0.18 -0.51 0.16 0.00 0.00 175.35 175.07 2fy1 s LEU 10 N 0.04 2.07 -0.24 5.43 1.02 -0.01 -1.07 118.68 125.91 2fy1 s LEU 10 Ca -0.04 -0.36 -0.08 0.00 0.02 0.00 0.00 54.13 53.67 2fy1 s LEU 10 Cb -0.12 -0.88 -0.04 0.00 0.02 0.00 0.00 46.19 45.18 2fy1 s LEU 10 CO 0.02 0.19 0.09 0.12 0.02 0.00 0.00 176.35 176.79 2fy1 s PHE 11 N -0.52 3.15 -0.14 0.29 5.36 0.40 -0.95 117.98 125.57 2fy1 s PHE 11 Ca 0.06 -0.18 -0.03 0.00 -0.96 0.00 0.00 56.93 55.82 2fy1 s PHE 11 Cb -0.07 -2.23 -0.03 0.00 -0.34 0.00 0.00 43.02 40.35 2fy1 s PHE 11 CO -0.00 -0.19 -0.03 0.42 -1.46 0.00 0.00 175.22 173.96 2fy1 s ILE 12 N 1.33 3.96 -0.19 3.12 1.09 0.72 -1.34 121.20 129.89 2fy1 s ILE 12 Ca 0.05 -0.34 -0.02 0.00 -1.10 0.00 0.00 60.65 59.24 2fy1 s ILE 12 Cb -0.15 -2.73 -0.00 0.00 -1.06 0.00 0.00 42.46 38.52 2fy1 s ILE 12 CO 0.04 0.51 -0.09 -0.83 -0.10 0.00 0.00 174.94 174.47 2fy1 s GLY 13 N 0.17 1.55 0.00 6.18 0.00 0.09 -1.66 107.32 113.65 2fy1 s GLY 13 Ca -0.01 -1.12 0.00 0.00 0.00 0.00 0.00 44.72 43.59 2fy1 s GLY 13 CO 0.03 0.27 0.00 0.61 0.00 0.00 0.00 173.10 174.01 2fy1 n GLY 14 N 4.50 -1.29 4.92 0.20 0.00 -1.26 -1.46 105.19 110.80 2fy1 n GLY 14 Ca -0.19 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.62 0.99 7.99 -1.26 -4.66 117.00 118.44 2fy1 n LEU 15 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 56.01 55.94 2fy1 n LEU 15 Cb 0.00 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.29 2fy1 n LEU 15 CO 0.00 0.00 -0.06 -3.20 -1.51 0.00 0.00 177.39 172.62 2fy1 n ASN 16 N 0.15 -1.85 -4.30 -1.43 5.15 -1.26 -0.02 115.26 111.69 2fy1 n ASN 16 Ca 0.00 0.22 -0.35 0.00 -0.60 0.00 0.00 54.58 53.84 2fy1 n ASN 16 Cb 0.00 -1.87 -0.06 0.00 -0.53 0.00 0.00 39.78 37.32 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 -1.83 -1.99 0.02 1.20 3.00 -1.26 -4.79 116.66 111.01 2fy1 n ARG 17 Ca -0.06 0.25 0.00 0.00 -0.01 0.00 0.00 57.85 58.03 2fy1 n ARG 17 Cb 0.32 -4.57 0.00 0.00 0.00 0.00 0.00 32.46 28.21 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 -4.34 0.00 -3.36 5.56 2.13 0.97 -5.11 120.64 116.51 2fy1 n GLU 18 Ca -0.06 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 57.57 2fy1 n GLU 18 Cb 0.55 -0.12 -0.00 0.00 0.27 0.00 0.00 31.44 32.15 2fy1 n GLU 18 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2fy1 s THR 19 N -2.00 3.96 0.00 6.31 2.01 -0.06 -5.12 115.64 120.74 2fy1 s THR 19 Ca 0.00 -0.93 0.00 0.00 0.31 0.00 0.00 61.69 61.07 2fy1 s THR 19 Cb 0.00 -3.38 0.00 0.00 0.01 0.00 0.00 72.50 69.13 2fy1 s THR 19 CO 0.00 -0.16 0.00 0.59 -0.69 0.00 0.00 174.62 174.36 2fy1 n ASN 20 N -1.73 0.00 -0.29 3.53 4.13 -1.26 -4.86 115.26 114.78 2fy1 n ASN 20 Ca 0.01 -0.36 0.30 0.00 1.68 0.00 0.00 54.58 56.21 2fy1 n ASN 20 Cb 0.58 0.00 0.46 0.00 -1.54 0.00 0.00 39.78 39.28 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 0.01 0.33 3.52 2.13 -1.26 -0.36 120.64 125.01 2fy1 n GLU 21 Ca 0.00 0.94 -0.15 0.00 0.66 0.00 0.00 57.16 58.61 2fy1 n GLU 21 Cb 0.00 -2.31 -0.08 0.00 0.27 0.00 0.00 31.44 29.33 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 -0.82 -0.69 5.31 1.63 -2.00 -1.45 116.57 118.55 2fy1 h LYS 22 Ca 0.53 0.06 0.08 0.00 -0.85 0.00 0.00 60.65 60.47 2fy1 h LYS 22 Cb 2.83 0.19 -0.06 0.00 -0.60 0.00 0.00 32.23 34.58 2fy1 h LYS 22 CO -0.01 -0.51 0.36 0.00 -3.45 0.00 0.00 179.45 175.85 2fy1 h MET 23 N -1.12 0.62 0.14 1.90 -0.00 -1.10 -1.64 114.93 113.72 2fy1 h MET 23 Ca -0.09 -0.04 -0.00 0.00 -0.00 0.00 0.00 59.70 59.57 2fy1 h MET 23 Cb 0.70 -0.14 -0.00 0.00 -0.00 0.00 0.00 31.60 32.15 2fy1 h MET 23 CO 0.14 0.41 -0.12 -0.07 -0.00 0.00 0.00 176.91 177.27 2fy1 h LEU 24 N 0.64 -0.33 -1.36 -0.10 4.07 -0.81 0.33 115.31 117.74 2fy1 h LEU 24 Ca 0.33 0.03 0.12 0.00 0.08 0.00 0.00 57.88 58.44 2fy1 h LEU 24 Cb 0.29 0.11 -0.06 0.00 1.08 0.00 0.00 40.66 42.08 2fy1 h LEU 24 CO -0.23 -0.17 0.54 0.11 -1.08 0.00 0.00 178.44 177.61 2fy1 h LYS 25 N -0.26 0.64 0.00 1.13 1.57 -1.32 -1.22 116.57 117.12 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 0.22 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2fy1 h LYS 25 CO -0.01 0.43 0.00 0.00 -0.57 0.00 0.00 179.45 179.30 2fy1 n ALA 26 N -2.45 -0.30 0.16 3.86 0.00 -0.62 -0.59 120.51 120.57 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 0.41 0.12 -0.08 0.00 0.00 0.00 0.00 19.45 19.91 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 0.00 0.23 0.00 2.07 0.07 0.51 116.25 119.12 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 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 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 -0.69 -0.28 0.00 1.57 -1.00 -1.40 -2.87 116.94 112.27 2fy1 h PHE 28 Ca -0.03 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.74 2fy1 h PHE 28 Cb 0.63 0.09 0.00 0.00 3.61 0.00 0.00 35.95 40.28 2fy1 h PHE 28 CO -0.30 -0.16 0.15 0.41 -1.61 0.00 0.00 178.31 176.81 2fy1 n GLY 29 N -1.15 -0.72 0.34 -1.45 0.00 0.24 -2.75 105.19 99.70 2fy1 n GLY 29 Ca -0.09 0.15 0.20 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 0.46 0.00 1.61 1.57 -0.66 -3.10 116.57 116.44 2fy1 h LYS 30 Ca 0.00 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 2fy1 h LYS 30 Cb 0.31 -0.10 -0.09 0.00 0.08 0.00 0.00 32.23 32.42 2fy1 h LYS 30 CO 0.00 0.30 -0.50 0.72 -0.57 0.00 0.00 179.45 179.40 2fy1 n HIS 31 N -4.95 0.00 -3.88 -1.35 8.25 -1.11 -5.04 115.22 107.15 2fy1 n HIS 31 Ca 0.29 -0.60 -0.10 0.00 -0.26 0.00 0.00 57.72 57.05 2fy1 n HIS 31 Cb 0.85 -0.13 0.01 0.00 1.12 0.00 0.00 29.99 31.84 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 -2.06 0.61 -0.02 -1.41 0.00 -1.17 -3.91 107.32 99.37 2fy1 s GLY 32 Ca 0.22 -0.91 -0.05 0.00 0.00 0.00 0.00 44.72 43.98 2fy1 s GLY 32 CO -0.04 -0.46 0.39 -0.56 0.00 0.00 0.00 173.10 172.42 2fy1 h PRO 33 N 2.03 -0.16 -1.26 2.90 0.13 -1.90 -3.39 132.00 130.35 2fy1 h PRO 33 Ca -0.31 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2fy1 h PRO 33 Cb 1.25 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2fy1 h PRO 33 CO 0.39 -0.11 0.00 -0.89 -0.23 0.00 0.00 178.00 177.17 2fy1 n ILE 34 N -3.17 -1.26 0.32 -3.56 -0.00 -1.26 -4.90 119.36 105.53 2fy1 n ILE 34 Ca -0.02 0.00 0.09 0.00 -0.00 0.00 0.00 62.75 62.82 2fy1 n ILE 34 Cb 0.07 -1.61 -0.13 0.00 -0.00 0.00 0.00 39.64 37.96 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 0.79 -3.71 4.38 2.88 0.56 -4.85 113.62 113.67 2fy1 n SER 35 Ca 0.00 -0.35 -0.14 0.00 -1.33 0.00 0.00 58.87 57.04 2fy1 n SER 35 Cb 0.00 1.52 -0.08 0.00 -0.75 0.00 0.00 64.21 64.90 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 -3.06 0.71 -0.06 -1.46 -6.30 -0.56 -4.97 118.70 102.98 2fy1 s GLU 36 Ca -0.02 0.04 -0.01 0.00 -2.50 0.00 0.00 54.97 52.49 2fy1 s GLU 36 Cb 0.13 0.32 0.03 0.00 0.00 0.00 0.00 34.13 34.60 2fy1 s GLU 36 CO 0.76 -0.19 -0.02 0.08 0.02 0.00 0.00 175.26 175.92 2fy1 s VAL 37 N -1.00 0.44 -0.02 3.70 1.01 -1.26 -0.79 120.40 122.48 2fy1 s VAL 37 Ca -0.10 0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.92 2fy1 s VAL 37 Cb -0.04 -0.55 0.01 0.00 0.00 0.00 0.00 36.38 35.80 2fy1 s VAL 37 CO 0.05 0.25 -0.05 -0.22 0.00 0.00 0.00 175.10 175.12 2fy1 s LEU 38 N 1.60 1.72 -0.07 3.92 2.96 0.03 -5.03 118.68 123.82 2fy1 s LEU 38 Ca -0.00 -0.11 0.04 0.00 -0.22 0.00 0.00 54.13 53.84 2fy1 s LEU 38 Cb -0.13 -0.35 -0.00 0.00 0.50 0.00 0.00 46.19 46.21 2fy1 s LEU 38 CO -0.04 0.02 -0.22 -0.22 -1.32 0.00 0.00 176.35 174.58 2fy1 s LEU 39 N 0.29 1.99 -0.13 -0.68 1.98 -1.26 -0.62 118.68 120.26 2fy1 s LEU 39 Ca -0.03 -0.47 -0.03 0.00 -2.89 0.00 0.00 54.13 50.70 2fy1 s LEU 39 Cb -0.07 -1.24 -0.03 0.00 0.66 0.00 0.00 46.19 45.50 2fy1 s LEU 39 CO -0.00 0.17 -0.00 -0.63 -1.89 0.00 0.00 176.35 173.99 2fy1 s ILE 40 N 0.17 4.25 0.00 6.68 -1.09 0.12 -4.89 121.20 126.44 2fy1 s ILE 40 Ca -0.11 -0.25 0.00 0.00 -2.23 0.00 0.00 60.65 58.06 2fy1 s ILE 40 Cb -0.15 -2.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.89 2fy1 s ILE 40 CO 0.05 0.54 0.00 0.29 -1.23 0.00 0.00 174.94 174.60 2fy1 n LYS 41 N 2.85 0.00 -3.65 2.79 5.02 -1.25 -1.60 118.16 122.32 2fy1 n LYS 41 Ca -0.18 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.08 2fy1 n LYS 41 Cb 0.53 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.48 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 -0.05 0.00 4.39 -4.77 -1.26 -4.74 116.67 111.24 2fy1 s ASP 42 Ca 0.00 0.09 0.00 0.00 -3.30 0.00 0.00 52.55 49.34 2fy1 s ASP 42 Cb 0.00 0.09 0.00 0.00 -1.09 0.00 0.00 42.92 41.92 2fy1 s ASP 42 CO 0.00 -0.02 0.00 -1.14 0.70 0.00 0.00 175.17 174.71 2fy1 n ARG 43 N 1.36 -1.15 -1.02 2.11 0.00 -1.26 -0.00 116.66 116.70 2fy1 n ARG 43 Ca -0.08 0.16 -0.01 0.00 -0.00 0.00 0.00 57.85 57.93 2fy1 n ARG 43 Cb 0.57 -3.54 -0.00 0.00 0.00 0.00 0.00 32.46 29.49 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 -0.96 0.00 0.00 5.15 5.66 -1.26 -4.52 114.28 118.35 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 0.16 -0.57 0.00 0.00 -1.55 0.00 0.00 70.33 68.37 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 -0.48 0.00 -0.26 1.09 2.88 0.73 -5.00 113.62 112.58 2fy1 n SER 45 Ca -0.01 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.70 2fy1 n SER 45 Cb 0.27 0.00 0.45 0.00 -0.75 0.00 0.00 64.21 64.18 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 0.51 -0.59 -1.46 1.57 -0.66 -3.48 116.57 112.46 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 0.34 0.00 0.45 -0.57 0.00 0.00 179.45 179.67 2fy1 n SER 47 N -4.56 -0.39 -4.08 0.86 2.88 -1.25 -5.02 113.62 102.05 2fy1 n SER 47 Ca 0.19 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.65 2fy1 n SER 47 Cb 0.62 -0.20 -0.09 0.00 -0.75 0.00 0.00 64.21 63.79 2fy1 n SER 47 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2fy1 s ARG 48 N -0.01 0.83 -0.19 -1.46 3.00 -1.26 -5.01 118.95 114.84 2fy1 s ARG 48 Ca 0.00 -1.29 -0.04 0.00 -1.00 0.00 0.00 55.73 53.41 2fy1 s ARG 48 Cb 0.00 0.25 0.06 0.00 0.00 0.00 0.00 34.95 35.27 2fy1 s ARG 48 CO 0.00 -0.22 0.06 0.20 0.00 0.00 0.00 175.30 175.34 2fy1 s GLY 49 N -2.98 0.57 0.01 8.12 0.00 -1.19 -3.92 107.32 107.94 2fy1 s GLY 49 Ca 0.15 -0.61 0.00 0.00 0.00 0.00 0.00 44.72 44.27 2fy1 s GLY 49 CO -0.04 1.58 -0.03 -0.11 0.00 0.00 0.00 173.10 174.51 2fy1 s PHE 50 N 1.97 0.22 -0.13 1.90 -0.71 -0.63 -4.54 117.98 116.06 2fy1 s PHE 50 Ca 0.01 -0.30 -0.05 0.00 -1.04 0.00 0.00 56.93 55.55 2fy1 s PHE 50 Cb -0.17 -0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 41.46 2fy1 s PHE 50 CO -0.11 -0.10 0.05 0.00 -1.34 0.00 0.00 175.22 173.73 2fy1 s ALA 51 N -0.82 3.43 -0.05 1.99 0.00 -0.66 0.13 121.76 125.77 2fy1 s ALA 51 Ca -0.08 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.18 2fy1 s ALA 51 Cb -0.06 -1.74 -0.01 0.00 0.00 0.00 0.00 23.12 21.32 2fy1 s ALA 51 CO -0.00 0.43 -0.22 -0.06 0.00 0.00 0.00 175.76 175.90 2fy1 s PHE 52 N -0.41 2.20 -0.02 0.00 0.08 0.21 -0.20 117.98 119.84 2fy1 s PHE 52 Ca 0.09 -0.66 0.02 0.00 0.12 0.00 0.00 56.93 56.50 2fy1 s PHE 52 Cb -0.12 -1.45 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 2fy1 s PHE 52 CO 0.02 -0.21 -0.06 0.42 -0.10 0.00 0.00 175.22 175.30 2fy1 s ILE 53 N -0.08 0.49 -0.17 0.64 1.01 -0.13 -0.79 121.20 122.18 2fy1 s ILE 53 Ca -0.04 -0.21 -0.06 0.00 0.00 0.00 0.00 60.65 60.33 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 0.16 0.05 -0.89 0.00 0.00 0.00 174.94 174.29 2fy1 s THR 54 N 0.18 4.66 -0.13 2.92 2.01 0.03 -0.83 115.64 124.47 2fy1 s THR 54 Ca -0.02 -0.09 -0.05 0.00 0.31 0.00 0.00 61.69 61.84 2fy1 s THR 54 Cb -0.06 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 2fy1 s THR 54 CO -0.00 0.48 0.05 -0.36 -0.69 0.00 0.00 174.62 174.10 2fy1 s PHE 55 N 0.20 3.26 0.55 4.92 0.40 -0.58 -0.32 117.98 126.41 2fy1 s PHE 55 Ca 0.03 0.17 0.45 0.00 -0.60 0.00 0.00 56.93 56.98 2fy1 s PHE 55 Cb -0.12 -1.93 1.66 0.00 0.51 0.00 0.00 43.02 43.14 2fy1 s PHE 55 CO 0.01 0.36 1.66 0.93 0.70 0.00 0.00 175.22 178.89 2fy1 h GLU 56 N 5.80 0.00 -4.37 0.44 5.08 -1.89 -3.41 114.58 116.24 2fy1 h GLU 56 Ca -0.45 -0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.70 2fy1 h GLU 56 Cb 1.19 -0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.25 2fy1 h GLU 56 CO 0.62 0.00 -0.71 -0.80 -1.00 0.00 0.00 179.01 177.12 2fy1 s ASN 57 N -4.39 0.68 0.35 1.42 0.01 -1.26 -4.98 114.94 106.77 2fy1 s ASN 57 Ca -0.05 -0.70 0.05 0.00 -0.71 0.00 0.00 52.86 51.45 2fy1 s ASN 57 Cb 0.25 0.09 0.66 0.00 0.41 0.00 0.00 41.25 42.67 2fy1 s ASN 57 CO 0.86 -0.35 1.91 1.55 -1.51 0.00 0.00 177.10 179.57 2fy1 h PRO 58 N 4.01 0.52 -0.41 -0.60 0.13 -1.81 -2.45 132.00 131.39 2fy1 h PRO 58 Ca -0.34 -0.09 0.05 0.00 -0.87 0.00 0.00 66.00 64.74 2fy1 h PRO 58 Cb 1.19 -0.08 -0.08 0.00 0.13 0.00 0.00 31.00 32.16 2fy1 h PRO 58 CO 0.50 0.51 -0.50 0.00 -0.23 0.00 0.00 178.00 178.28 2fy1 h ALA 59 N 1.56 -0.71 -0.55 -0.56 0.00 -1.96 -1.26 119.26 115.78 2fy1 h ALA 59 Ca 0.12 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2fy1 h ALA 59 Cb 0.25 1.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2fy1 h ALA 59 CO 0.00 -0.96 0.31 -0.44 0.00 0.00 0.00 179.25 178.16 2fy1 h ASP 60 N -0.32 0.67 0.01 0.00 3.32 -1.77 0.50 116.42 118.83 2fy1 h ASP 60 Ca 0.07 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.10 2fy1 h ASP 60 Cb 0.51 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 2fy1 h ASP 60 CO -0.56 0.54 -0.20 0.00 -1.72 0.00 0.00 179.24 177.29 2fy1 h ALA 61 N 1.58 -0.27 -0.62 3.45 0.00 -1.08 -0.92 119.26 121.40 2fy1 h ALA 61 Ca 0.20 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.18 2fy1 h ALA 61 Cb 0.01 0.35 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 2fy1 h ALA 61 CO -0.03 -0.70 0.30 -0.22 0.00 0.00 0.00 179.25 178.59 2fy1 h LYS 62 N -0.33 0.53 0.53 0.00 3.64 -0.72 0.05 116.57 120.26 2fy1 h LYS 62 Ca 0.05 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2fy1 h LYS 62 Cb 0.40 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 2fy1 h LYS 62 CO -0.18 0.35 -0.49 -0.97 -2.27 0.00 0.00 179.45 175.89 2fy1 h ASN 63 N 0.54 -1.34 -0.92 4.20 -0.73 -0.70 0.12 115.58 116.76 2fy1 h ASN 63 Ca 0.29 0.10 0.10 0.00 1.87 0.00 0.00 56.30 58.67 2fy1 h ASN 63 Cb 0.26 0.44 -0.07 0.00 0.27 0.00 0.00 38.32 39.22 2fy1 h ASN 63 CO -0.22 -0.67 0.59 0.00 -0.37 0.00 0.00 177.43 176.76 2fy1 h ALA 64 N -0.97 1.62 0.53 1.57 0.00 -1.07 0.26 119.26 121.20 2fy1 h ALA 64 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2fy1 h ALA 64 Cb 0.87 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2fy1 h ALA 64 CO -0.04 0.18 -0.51 0.00 0.00 0.00 0.00 179.25 178.88 2fy1 h ALA 65 N 1.55 -1.17 -0.71 0.00 0.00 -0.67 -1.29 119.26 116.97 2fy1 h ALA 65 Ca 0.43 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.23 2fy1 h ALA 65 Cb 0.44 0.73 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 2fy1 h ALA 65 CO -0.20 -1.19 0.37 -0.22 0.00 0.00 0.00 179.25 178.02 2fy1 h LYS 66 N -1.03 0.64 0.34 0.00 3.64 -0.36 -2.51 116.57 117.29 2fy1 h LYS 66 Ca -0.07 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 2fy1 h LYS 66 Cb 0.88 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2fy1 h LYS 66 CO -0.05 0.42 -0.34 0.22 -2.27 0.00 0.00 179.45 177.43 2fy1 h ASP 67 N 0.66 -0.94 0.00 4.20 1.82 -0.97 -3.43 116.42 117.76 2fy1 h ASP 67 Ca 0.33 0.07 0.00 0.00 -0.39 0.00 0.00 57.03 57.05 2fy1 h ASP 67 Cb 0.29 0.31 0.00 0.00 0.68 0.00 0.00 39.33 40.61 2fy1 h ASP 67 CO -0.23 -0.45 0.00 0.23 -1.61 0.00 0.00 179.24 177.18 2fy1 n MET 68 N -4.45 0.00 -0.34 0.28 2.81 -0.49 -4.86 117.12 110.07 2fy1 n MET 68 Ca -0.08 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.81 2fy1 n MET 68 Cb 0.31 -0.50 0.00 0.00 -0.71 0.00 0.00 33.22 32.32 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 -1.09 -2.27 115.26 119.69 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 -1.75 0.00 0.00 -2.08 0.00 0.00 39.78 35.95 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 0.19 4.83 0.00 -1.04 -4.54 105.19 103.49 2fy1 n GLY 70 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 0.58 -1.52 1.61 1.63 -1.65 -3.45 116.57 113.77 2fy1 h LYS 71 Ca 0.00 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 2fy1 h LYS 71 Cb 0.00 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.52 2fy1 h LYS 71 CO 0.00 0.47 0.00 0.45 -3.45 0.00 0.00 179.45 176.92 2fy1 n SER 72 N -4.72 -1.46 0.00 4.20 2.88 -1.26 -4.97 113.62 108.29 2fy1 n SER 72 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2fy1 n SER 72 Cb 0.08 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 62.81 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 -0.62 2.46 -0.00 -0.77 -4.91 117.00 113.16 2fy1 n LEU 73 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 56.01 56.06 2fy1 n LEU 73 Cb 0.00 0.00 0.20 0.00 -0.00 0.00 0.00 43.42 43.62 2fy1 n LEU 73 CO 0.00 0.15 0.46 0.00 -0.00 0.00 0.00 177.39 178.01 2fy1 n HIS 74 N 0.00 0.22 -1.06 1.47 1.44 -1.26 -4.87 115.22 111.15 2fy1 n HIS 74 Ca 0.00 -1.42 -0.02 0.00 -2.01 0.00 0.00 57.72 54.27 2fy1 n HIS 74 Cb 0.23 -0.28 -0.01 0.00 0.12 0.00 0.00 29.99 30.06 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 -1.15 0.56 3.35 -1.39 0.00 -1.26 -5.01 105.19 100.28 2fy1 n GLY 75 Ca 0.21 -0.52 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.47 0.99 0.58 1.61 3.01 -1.26 -5.16 119.74 118.05 2fy1 s LYS 76 Ca 0.00 -0.37 -0.17 0.00 -1.01 0.00 0.00 55.97 54.42 2fy1 s LYS 76 Cb 0.00 0.45 -0.04 0.00 -1.01 0.00 0.00 37.83 37.23 2fy1 s LYS 76 CO 0.00 -0.36 1.09 0.00 0.51 0.00 0.00 175.35 176.59 2fy1 s ALA 77 N -2.69 2.67 -0.13 5.17 0.00 -1.26 -1.85 121.76 123.66 2fy1 s ALA 77 Ca -0.04 0.59 -0.05 0.00 0.00 0.00 0.00 51.96 52.46 2fy1 s ALA 77 Cb -0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 2fy1 s ALA 77 CO -0.04 -0.87 0.05 0.96 0.00 0.00 0.00 175.76 175.87 2fy1 s ILE 78 N -2.16 4.71 -0.22 0.00 -4.36 -1.26 -4.66 121.20 113.25 2fy1 s ILE 78 Ca 0.68 -0.08 -0.07 0.00 -0.26 0.00 0.00 60.65 60.91 2fy1 s ILE 78 Cb -0.20 -3.06 -0.04 0.00 1.25 0.00 0.00 42.46 40.42 2fy1 s ILE 78 CO 0.33 0.55 0.07 -0.75 0.24 0.00 0.00 174.94 175.38 2fy1 s LYS 79 N -0.38 3.83 -0.22 0.37 2.36 -0.53 -2.51 119.74 122.65 2fy1 s LYS 79 Ca 0.09 -0.41 -0.05 0.00 -2.55 0.00 0.00 55.97 53.06 2fy1 s LYS 79 Cb -0.12 -3.28 -0.02 0.00 -1.05 0.00 0.00 37.83 33.36 2fy1 s LYS 79 CO 0.02 0.05 -0.02 0.08 1.55 0.00 0.00 175.35 177.03 2fy1 s VAL 80 N 0.99 3.65 0.06 4.02 1.01 -1.26 -0.73 120.40 128.14 2fy1 s VAL 80 Ca 0.04 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.64 2fy1 s VAL 80 Cb -0.14 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 2fy1 s VAL 80 CO 0.03 0.41 -0.08 -0.70 0.00 0.00 0.00 175.10 174.76 2fy1 s GLU 81 N 1.38 0.62 -0.30 2.72 2.56 -0.45 -4.78 118.70 120.46 2fy1 s GLU 81 Ca 0.05 -0.90 -0.09 0.00 0.00 0.00 0.00 54.97 54.02 2fy1 s GLU 81 Cb -0.14 -0.33 -0.02 0.00 2.00 0.00 0.00 34.13 35.63 2fy1 s GLU 81 CO -0.01 0.05 0.14 -0.65 -0.56 0.00 0.00 175.26 174.24 2fy1 s GLN 82 N -2.06 3.48 0.85 4.30 -0.21 -1.26 -0.46 119.66 124.30 2fy1 s GLN 82 Ca -0.05 -0.62 -0.13 0.00 0.02 0.00 0.00 55.36 54.59 2fy1 s GLN 82 Cb -0.07 -3.54 0.09 0.00 1.00 0.00 0.00 33.01 30.49 2fy1 s GLN 82 CO -0.00 -0.34 1.07 0.00 -2.12 0.00 0.00 175.29 173.89 2fy1 n ALA 83 N 4.98 -0.59 0.03 6.09 0.00 -0.23 -4.90 120.51 125.89 2fy1 n ALA 83 Ca -0.14 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 52.88 2fy1 n ALA 83 Cb 0.50 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 -3.22 0.00 -3.65 0.00 3.00 -1.26 -4.85 118.16 108.18 2fy1 n LYS 84 Ca 0.12 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.38 2fy1 n LYS 84 Cb 0.51 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 35.47 2fy1 n LYS 84 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2fy1 s LYS 85 N -1.17 0.60 0.05 1.64 2.20 -1.26 -1.37 119.74 120.42 2fy1 s LYS 85 Ca 0.00 1.23 0.13 0.00 -0.36 0.00 0.00 55.97 56.97 2fy1 s LYS 85 Cb 0.00 0.37 -0.17 0.00 -1.51 0.00 0.00 37.83 36.52 2fy1 s LYS 85 CO 0.00 -0.18 0.91 -1.00 -0.36 0.00 0.00 175.35 174.72 2fy1 h PRO 86 N 7.43 0.00 0.00 4.03 0.13 -1.96 -3.47 132.00 138.16 2fy1 h PRO 86 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2fy1 h PRO 86 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2fy1 h PRO 86 CO 0.15 0.53 0.00 -1.13 -0.23 0.00 0.00 178.00 177.33 2fy1 n SER 87 N -3.08 0.00 0.08 1.44 3.41 -1.26 -5.06 113.62 109.16 2fy1 n SER 87 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 2fy1 n SER 87 Cb 0.94 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.89 2fy1 n SER 87 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2fy1 n PHE 88 N -0.73 -1.18 -3.54 7.33 7.35 -1.26 -5.16 117.46 120.26 2fy1 n PHE 88 Ca 0.00 0.21 -0.08 0.00 -0.76 0.00 0.00 57.45 56.82 2fy1 n PHE 88 Cb 0.00 0.35 -0.03 0.00 0.35 0.00 0.00 39.48 40.15 2fy1 n PHE 88 CO 0.00 0.00 0.00 1.14 -0.76 0.00 0.00 176.76 177.14 2fy1 s GLN 89 N -1.73 0.64 0.35 -4.13 -2.07 -1.26 -4.94 119.66 106.52 2fy1 s GLN 89 Ca 0.00 -0.15 -0.16 0.00 -1.82 0.00 0.00 55.36 53.23 2fy1 s GLN 89 Cb 0.00 0.30 0.04 0.00 -1.09 0.00 0.00 33.01 32.25 2fy1 s GLN 89 CO 0.00 -0.26 0.73 0.45 -1.32 0.00 0.00 175.29 174.88 2fy1 s SER 90 N -2.08 0.00 0.00 12.60 0.15 -0.47 -4.72 113.70 119.18 2fy1 s SER 90 Ca 0.05 -1.02 0.00 0.00 0.70 0.00 0.00 55.95 55.68 2fy1 s SER 90 Cb -0.01 0.79 0.00 0.00 -1.71 0.00 0.00 66.02 65.09 2fy1 s SER 90 CO -0.06 -1.53 0.00 0.61 1.20 0.00 0.00 173.24 173.46 2fy1 n GLY 91 N -0.51 -0.67 3.64 9.45 0.00 -1.26 -4.43 105.19 111.41 2fy1 n GLY 91 Ca -0.06 -0.51 -0.09 0.00 0.00 0.00 0.00 46.02 45.36 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 0.00 -0.16 0.00 -0.02 0.00 -1.26 -4.68 107.32 101.19 2fy1 s GLY 92 Ca 0.00 2.66 0.00 0.00 0.00 0.00 0.00 44.72 47.38 2fy1 s GLY 92 CO 0.00 1.83 0.00 -2.13 0.00 0.00 0.00 173.10 172.80 2fy1 n ARG 93 N 2.22 0.00 -3.89 2.90 0.63 -1.26 -4.27 116.66 112.99 2fy1 n ARG 93 Ca -0.12 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.72 2fy1 n ARG 93 Cb 0.56 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 33.45 2fy1 n ARG 93 CO 0.00 0.00 0.00 -0.98 -2.51 0.00 0.00 177.63 174.14 2fy1 s ARG 94 N 0.00 1.86 -0.17 -0.14 1.70 -1.26 -5.04 118.95 115.90 2fy1 s ARG 94 Ca 0.00 -1.19 -0.32 0.00 -0.47 0.00 0.00 55.73 53.75 2fy1 s ARG 94 Cb 0.00 0.58 -0.09 0.00 -0.57 0.00 0.00 34.95 34.87 2fy1 s ARG 94 CO 0.00 -0.84 2.07 -2.13 -1.08 0.00 0.00 175.30 173.31 2fy1 n ARG 95 N -0.47 1.98 -1.12 3.89 0.63 -1.26 -4.71 116.66 115.61 2fy1 n ARG 95 Ca -0.04 0.65 -0.34 0.00 -0.92 0.00 0.00 57.85 57.20 2fy1 n ARG 95 Cb 0.60 -2.84 0.12 0.00 0.45 0.00 0.00 32.46 30.79 2fy1 n ARG 95 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2fy1 n PRO 96 N 7.75 0.19 -1.31 -0.14 -0.02 -1.26 -5.05 135.00 135.17 2fy1 n PRO 96 Ca 0.28 0.14 -0.29 0.00 -2.02 0.00 0.00 63.50 61.61 2fy1 n PRO 96 Cb 0.34 -2.36 0.18 0.00 -0.02 0.00 0.00 33.50 31.65 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 -3.95 0.17 0.05 0.52 0.04 -1.26 -5.12 135.00 125.46 2fy1 s PRO 97 Ca 0.72 0.21 -0.03 0.00 0.04 0.00 0.00 61.00 61.94 2fy1 s PRO 97 Cb -0.29 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 2fy1 s PRO 97 CO 0.52 -2.84 0.03 0.00 0.04 0.00 0.00 177.00 174.75 2fy1 s ALA 98 N -3.14 0.22 0.11 8.56 0.00 -1.26 -5.18 121.76 121.07 2fy1 s ALA 98 Ca 0.67 -0.89 -0.03 0.00 0.00 0.00 0.00 51.96 51.71 2fy1 s ALA 98 Cb -0.14 0.28 0.01 0.00 0.00 0.00 0.00 23.12 23.27 2fy1 s ALA 98 CO 0.56 -0.35 0.20 0.45 0.00 0.00 0.00 175.76 176.62 2fy1 n SER 99 N 0.43 -0.58 -4.11 0.00 2.88 -1.26 -5.20 113.62 105.78 2fy1 n SER 99 Ca -0.17 -1.46 -0.10 0.00 -1.33 0.00 0.00 58.87 55.81 2fy1 n SER 99 Cb 0.60 0.99 -0.09 0.00 -0.75 0.00 0.00 64.21 64.95 2fy1 n SER 99 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2fy1 s SER 100 N -1.58 0.23 -0.06 -3.46 0.15 -1.26 -5.09 113.70 102.63 2fy1 s SER 100 Ca 0.05 -1.14 0.12 0.00 0.70 0.00 0.00 55.95 55.68 2fy1 s SER 100 Cb -0.01 0.34 0.23 0.00 -1.71 0.00 0.00 66.02 64.87 2fy1 s SER 100 CO 0.04 -0.78 1.11 -1.14 1.20 0.00 0.00 173.24 173.66 2fy1 n ARG 101 N -0.14 0.53 0.30 5.44 0.00 -1.26 -4.93 116.66 116.61 2fy1 n ARG 101 Ca -0.05 -1.94 0.19 0.00 -0.00 0.00 0.00 57.85 56.05 2fy1 n ARG 101 Cb 0.64 -0.78 1.02 0.00 0.00 0.00 0.00 32.46 33.34 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 0.38 0.00 -0.50 6.15 -1.24 -2.10 -3.40 115.58 114.88 2fy1 h ASN 102 Ca -0.05 0.00 -0.24 0.00 0.71 0.00 0.00 56.30 56.71 2fy1 h ASN 102 Cb 1.36 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.38 2fy1 h ASN 102 CO 0.02 0.00 0.71 -0.60 -1.29 0.00 0.00 177.43 176.28 2fy1 s ARG 103 N -4.01 2.25 0.91 6.67 3.00 -1.26 -4.98 118.95 121.52 2fy1 s ARG 103 Ca -0.04 -0.60 -0.11 0.00 -1.00 0.00 0.00 55.73 53.98 2fy1 s ARG 103 Cb 0.11 -5.10 0.14 0.00 0.00 0.00 0.00 34.95 30.09 2fy1 s ARG 103 CO 0.34 -4.03 1.11 -1.54 0.00 0.00 0.00 175.30 171.18 2fy1 s SER 104 N 7.74 3.20 0.00 -2.12 1.04 -1.26 -4.95 113.70 117.34 2fy1 s SER 104 Ca 0.73 1.86 0.24 0.00 0.48 0.00 0.00 55.95 59.27 2fy1 s SER 104 Cb -0.05 -2.44 1.33 0.00 0.10 0.00 0.00 66.02 64.96 2fy1 s SER 104 CO 0.08 -2.87 1.81 -0.81 0.98 0.00 0.00 173.24 172.43 2fy1 n PRO 105 N -4.06 0.55 0.00 4.02 -0.04 -1.26 -4.93 135.00 129.27 2fy1 n PRO 105 Ca 0.09 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2fy1 n PRO 105 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2fy1 n PRO 105 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2fy1 n SER 106 N -1.15 0.00 0.00 3.54 3.41 -1.26 -2.59 113.62 115.58 2fy1 n SER 106 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 2fy1 n SER 106 Cb 0.14 -0.86 0.00 0.00 -0.26 0.00 0.00 64.21 63.22 2fy1 n SER 106 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fy1 n GLY 107 N -1.25 0.07 0.00 5.00 0.00 -1.26 -5.34 105.19 102.41 2fy1 n GLY 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2fy1 n GLY 107 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76