#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fy1 h VAL 2 N 0.00 0.56 -0.68 1.12 3.04 -2.02 -2.30 116.25 115.97 2fy1 h VAL 2 Ca 0.00 0.00 0.20 0.00 -1.01 0.00 0.00 66.70 65.89 2fy1 h VAL 2 Cb 0.00 0.63 -0.03 0.00 -2.01 0.00 0.00 31.29 29.89 2fy1 h VAL 2 CO 0.00 0.00 0.65 -0.08 -1.01 0.00 0.00 177.57 177.13 2fy1 h GLU 3 N 0.00 0.00 -0.13 4.17 4.81 -1.97 -1.32 114.58 120.14 2fy1 h GLU 3 Ca 0.31 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.37 2fy1 h GLU 3 Cb 1.32 0.00 -0.27 0.00 0.63 0.00 0.00 28.75 30.43 2fy1 h GLU 3 CO -0.00 0.00 -0.86 0.00 -0.73 0.00 0.00 179.01 177.42 2fy1 n ALA 4 N -2.44 3.06 0.00 2.92 0.00 -0.87 -4.48 120.51 118.71 2fy1 n ALA 4 Ca 0.14 -2.85 0.00 0.00 0.00 0.00 0.00 53.44 50.73 2fy1 n ALA 4 Cb 0.90 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.75 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 -0.28 0.44 0.00 0.00 2.03 -0.70 -4.83 116.55 113.20 2fy1 n ASP 5 Ca 0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.45 2fy1 n ASP 5 Cb 0.94 0.07 0.00 0.00 -0.72 0.00 0.00 41.12 41.41 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 -0.36 0.00 0.24 -0.67 8.25 -0.58 -4.87 115.22 117.23 2fy1 n HIS 6 Ca 0.00 -0.29 0.12 0.00 -0.26 0.00 0.00 57.72 57.30 2fy1 n HIS 6 Cb 0.02 -0.03 0.48 0.00 1.12 0.00 0.00 29.99 31.58 2fy1 n HIS 6 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2fy1 h PRO 7 N 0.00 0.00 -0.29 -0.41 0.13 -1.79 -3.44 132.00 126.21 2fy1 h PRO 7 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.01 2fy1 h PRO 7 Cb 0.61 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.69 2fy1 h PRO 7 CO 0.00 0.14 -0.11 0.41 -0.23 0.00 0.00 178.00 178.21 2fy1 n GLY 8 N 0.27 0.80 3.16 1.56 0.00 -1.26 -4.89 105.19 104.83 2fy1 n GLY 8 Ca 0.01 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.10 2.71 0.09 1.61 2.20 -1.26 -1.35 119.74 121.64 2fy1 s LYS 9 Ca 0.00 -0.76 0.08 0.00 -0.36 0.00 0.00 55.97 54.93 2fy1 s LYS 9 Cb 0.00 -2.10 -0.04 0.00 -1.51 0.00 0.00 37.83 34.19 2fy1 s LYS 9 CO 0.00 0.11 -0.14 -0.51 -0.36 0.00 0.00 175.35 174.45 2fy1 s LEU 10 N 0.49 2.85 -0.22 5.43 1.02 0.43 -1.22 118.68 127.45 2fy1 s LEU 10 Ca -0.16 -0.44 -0.08 0.00 0.02 0.00 0.00 54.13 53.47 2fy1 s LEU 10 Cb -0.17 -1.67 -0.04 0.00 0.02 0.00 0.00 46.19 44.33 2fy1 s LEU 10 CO 0.06 0.20 0.08 0.12 0.02 0.00 0.00 176.35 176.83 2fy1 s PHE 11 N -1.13 3.17 -0.14 0.29 5.36 0.47 -0.92 117.98 125.08 2fy1 s PHE 11 Ca 0.19 -0.13 -0.03 0.00 -0.96 0.00 0.00 56.93 56.00 2fy1 s PHE 11 Cb -0.11 -2.18 -0.03 0.00 -0.34 0.00 0.00 43.02 40.37 2fy1 s PHE 11 CO 0.11 -0.10 -0.06 0.42 -1.46 0.00 0.00 175.22 174.13 2fy1 s ILE 12 N 1.06 3.72 -0.22 3.12 1.09 0.69 -1.48 121.20 129.19 2fy1 s ILE 12 Ca 0.05 -0.42 -0.05 0.00 -1.10 0.00 0.00 60.65 59.12 2fy1 s ILE 12 Cb -0.14 -2.61 -0.02 0.00 -1.06 0.00 0.00 42.46 38.63 2fy1 s ILE 12 CO 0.03 0.51 0.01 -0.83 -0.10 0.00 0.00 174.94 174.56 2fy1 s GLY 13 N 0.25 1.70 0.00 6.18 0.00 -0.13 -1.62 107.32 113.70 2fy1 s GLY 13 Ca -0.04 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.59 2fy1 s GLY 13 CO 0.03 0.38 0.00 0.61 0.00 0.00 0.00 173.10 174.13 2fy1 n GLY 14 N 4.61 -1.09 4.88 0.20 0.00 -1.26 -1.40 105.19 111.13 2fy1 n GLY 14 Ca -0.17 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.29 0.99 7.99 -1.26 -4.70 117.00 118.72 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 0.18 -0.24 -4.00 -1.43 5.15 -1.26 -0.40 115.26 113.26 2fy1 n ASN 16 Ca 0.00 0.12 -0.31 0.00 -0.60 0.00 0.00 54.58 53.79 2fy1 n ASN 16 Cb 0.00 -0.58 0.01 0.00 -0.53 0.00 0.00 39.78 38.67 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 -1.28 -4.58 0.08 1.20 3.00 -1.26 -4.84 116.66 108.98 2fy1 n ARG 17 Ca 0.00 0.51 0.00 0.00 -0.01 0.00 0.00 57.85 58.35 2fy1 n ARG 17 Cb 0.12 -5.27 0.00 0.00 0.00 0.00 0.00 32.46 27.31 2fy1 n ARG 17 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2fy1 n GLU 18 N -4.54 0.00 -4.53 5.56 -0.58 0.47 -5.14 120.64 111.87 2fy1 n GLU 18 Ca -0.00 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.44 2fy1 n GLU 18 Cb 0.54 -0.32 -0.08 0.00 -0.57 0.00 0.00 31.44 31.01 2fy1 n GLU 18 CO 0.00 0.00 0.00 -0.08 -0.48 0.00 0.00 177.13 176.57 2fy1 s THR 19 N -1.95 1.61 0.00 2.62 -1.32 -0.31 -5.12 115.64 111.17 2fy1 s THR 19 Ca 0.00 -1.90 0.00 0.00 -1.21 0.00 0.00 61.69 58.58 2fy1 s THR 19 Cb 0.00 -2.51 0.00 0.00 -1.51 0.00 0.00 72.50 68.48 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 -1.24 0.00 -0.45 8.08 3.02 -1.26 -4.81 115.26 118.60 2fy1 n ASN 20 Ca -0.11 -0.80 0.41 0.00 -0.03 0.00 0.00 54.58 54.05 2fy1 n ASN 20 Cb 0.66 0.00 0.77 0.00 -0.61 0.00 0.00 39.78 40.60 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 0.18 3.52 4.22 -1.98 0.26 114.58 120.77 2fy1 h GLU 21 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2fy1 h GLU 21 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2fy1 h GLU 21 CO 0.00 0.00 -0.38 1.57 -2.18 0.00 0.00 179.01 178.02 2fy1 h LYS 22 N 0.00 -0.58 -0.92 1.92 -0.00 -2.00 -1.69 116.57 113.30 2fy1 h LYS 22 Ca 0.69 0.04 0.10 0.00 -0.00 0.00 0.00 60.65 61.47 2fy1 h LYS 22 Cb 2.80 0.13 -0.08 0.00 -0.00 0.00 0.00 32.23 35.09 2fy1 h LYS 22 CO -0.01 -0.39 0.56 0.00 -0.00 0.00 0.00 179.45 179.61 2fy1 h MET 23 N -0.61 0.91 0.49 0.07 -0.00 -0.93 -0.95 114.93 113.91 2fy1 h MET 23 Ca -0.02 -0.05 -0.01 0.00 -0.00 0.00 0.00 59.70 59.61 2fy1 h MET 23 Cb 0.58 -0.21 -0.02 0.00 -0.00 0.00 0.00 31.60 31.95 2fy1 h MET 23 CO -0.16 0.60 -0.49 -0.07 -0.00 0.00 0.00 176.91 176.80 2fy1 h LEU 24 N 0.94 -1.33 -1.21 -0.10 4.07 -0.80 0.31 115.31 117.19 2fy1 h LEU 24 Ca 0.44 0.11 0.12 0.00 0.08 0.00 0.00 57.88 58.62 2fy1 h LEU 24 Cb 0.36 0.44 -0.07 0.00 1.08 0.00 0.00 40.66 42.47 2fy1 h LEU 24 CO -0.24 -0.64 0.58 0.11 -1.08 0.00 0.00 178.44 177.17 2fy1 h LYS 25 N -0.97 0.79 0.00 1.13 1.57 -1.25 -1.59 116.57 116.25 2fy1 h LYS 25 Ca -0.06 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 2fy1 h LYS 25 Cb 0.84 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.97 2fy1 h LYS 25 CO -0.06 0.53 0.00 0.00 -0.57 0.00 0.00 179.45 179.35 2fy1 n ALA 26 N -2.41 -0.20 0.27 3.86 0.00 -0.37 -0.57 120.51 121.10 2fy1 n ALA 26 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.43 2fy1 n ALA 26 Cb 0.38 0.09 -0.10 0.00 0.00 0.00 0.00 19.45 19.82 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 0.02 0.23 0.00 2.07 -0.27 0.15 116.25 118.45 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 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 29.79 2fy1 h VAL 27 CO 0.00 0.00 -0.13 -0.26 0.02 0.00 0.00 177.57 177.20 2fy1 h PHE 28 N -0.97 -0.35 0.00 1.57 -1.00 -1.46 -2.77 116.94 111.97 2fy1 h PHE 28 Ca -0.05 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.72 2fy1 h PHE 28 Cb 0.86 0.12 0.00 0.00 3.61 0.00 0.00 35.95 40.54 2fy1 h PHE 28 CO -0.28 -0.21 0.16 0.41 -1.61 0.00 0.00 178.31 176.78 2fy1 n GLY 29 N -1.25 -0.74 0.32 -1.45 0.00 0.27 -3.14 105.19 99.20 2fy1 n GLY 29 Ca -0.09 0.16 0.19 0.00 0.00 0.00 0.00 46.02 46.28 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 0.29 0.00 1.61 1.79 -0.66 -2.99 116.57 116.60 2fy1 h LYS 30 Ca 0.00 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2fy1 h LYS 30 Cb 0.32 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.90 2fy1 h LYS 30 CO 0.00 0.19 -0.20 1.58 -1.08 0.00 0.00 179.45 179.94 2fy1 n HIS 31 N -5.11 0.00 -3.92 -1.35 -0.00 -1.19 -5.04 115.22 98.61 2fy1 n HIS 31 Ca 0.27 -0.67 -0.11 0.00 0.46 0.00 0.00 57.72 57.67 2fy1 n HIS 31 Cb 0.83 -0.12 -0.01 0.00 -0.12 0.00 0.00 29.99 30.58 2fy1 n HIS 31 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 2fy1 s GLY 32 N -2.24 0.71 0.00 1.57 0.00 -1.13 -4.20 107.32 102.03 2fy1 s GLY 32 Ca 0.21 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 43.96 2fy1 s GLY 32 CO 0.01 -0.54 0.43 -1.55 0.00 0.00 0.00 173.10 171.45 2fy1 n PRO 33 N -0.52 0.00 -0.63 2.90 -0.04 -1.26 -4.50 135.00 130.95 2fy1 n PRO 33 Ca -0.04 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.88 2fy1 n PRO 33 Cb 0.60 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.88 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 -1.90 -1.25 0.34 0.52 -0.00 -1.26 -4.90 119.36 110.91 2fy1 n ILE 34 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 62.75 62.79 2fy1 n ILE 34 Cb 0.00 -1.61 -0.06 0.00 -0.00 0.00 0.00 39.64 37.97 2fy1 n ILE 34 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 2fy1 n SER 35 N 0.00 0.96 -3.77 4.38 3.41 -0.19 -4.89 113.62 113.52 2fy1 n SER 35 Ca 0.00 -0.56 -0.13 0.00 -0.26 0.00 0.00 58.87 57.92 2fy1 n SER 35 Cb 0.00 1.10 -0.14 0.00 -0.26 0.00 0.00 64.21 64.91 2fy1 n SER 35 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2fy1 s GLU 36 N -2.05 0.11 -0.10 4.33 -6.30 -0.61 -4.98 118.70 109.10 2fy1 s GLU 36 Ca 0.02 0.32 -0.01 0.00 -2.50 0.00 0.00 54.97 52.80 2fy1 s GLU 36 Cb 0.07 -0.10 0.03 0.00 0.00 0.00 0.00 34.13 34.12 2fy1 s GLU 36 CO 0.38 -0.12 -0.06 0.08 0.02 0.00 0.00 175.26 175.56 2fy1 s VAL 37 N 0.84 0.89 -0.02 3.70 1.01 -1.26 -0.77 120.40 124.78 2fy1 s VAL 37 Ca -0.06 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.73 2fy1 s VAL 37 Cb -0.08 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.37 2fy1 s VAL 37 CO -0.04 0.34 -0.05 -0.22 0.00 0.00 0.00 175.10 175.13 2fy1 s LEU 38 N 1.77 1.70 -0.03 3.92 2.96 -0.13 -4.11 118.68 124.76 2fy1 s LEU 38 Ca 0.05 -0.11 0.04 0.00 -0.22 0.00 0.00 54.13 53.89 2fy1 s LEU 38 Cb -0.12 -0.35 -0.00 0.00 0.50 0.00 0.00 46.19 46.21 2fy1 s LEU 38 CO -0.08 0.02 -0.15 -1.48 -1.32 0.00 0.00 176.35 173.34 2fy1 s LEU 39 N 0.32 1.91 -0.16 -0.68 2.34 -1.26 -0.56 118.68 120.59 2fy1 s LEU 39 Ca -0.04 -0.30 -0.07 0.00 0.06 0.00 0.00 54.13 53.78 2fy1 s LEU 39 Cb -0.08 -0.85 -0.04 0.00 -0.56 0.00 0.00 46.19 44.66 2fy1 s LEU 39 CO -0.00 0.14 0.06 -0.63 -1.06 0.00 0.00 176.35 174.86 2fy1 s ILE 40 N -0.02 4.77 0.00 1.48 -1.09 0.15 -4.85 121.20 121.64 2fy1 s ILE 40 Ca -0.02 -0.05 0.00 0.00 -2.23 0.00 0.00 60.65 58.36 2fy1 s ILE 40 Cb -0.10 -3.12 0.00 0.00 -1.58 0.00 0.00 42.46 37.66 2fy1 s ILE 40 CO 0.01 0.50 0.00 0.29 -1.23 0.00 0.00 174.94 174.51 2fy1 n LYS 41 N 3.19 1.40 -3.58 2.79 5.02 -1.25 -1.63 118.16 124.10 2fy1 n LYS 41 Ca -0.17 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 55.97 2fy1 n LYS 41 Cb 0.53 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.47 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 -0.64 0.00 4.39 -4.77 -1.26 -4.87 116.67 110.51 2fy1 s ASP 42 Ca 0.00 0.96 0.00 0.00 -3.30 0.00 0.00 52.55 50.21 2fy1 s ASP 42 Cb 0.00 0.88 0.00 0.00 -1.09 0.00 0.00 42.92 42.71 2fy1 s ASP 42 CO 0.00 -0.41 0.00 -1.14 0.70 0.00 0.00 175.17 174.32 2fy1 n ARG 43 N 1.64 -1.72 -1.07 2.11 0.00 -1.26 0.00 116.66 116.37 2fy1 n ARG 43 Ca -0.16 0.25 -0.02 0.00 -0.00 0.00 0.00 57.85 57.92 2fy1 n ARG 43 Cb 0.56 -3.82 -0.01 0.00 0.00 0.00 0.00 32.46 29.20 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 -1.10 0.00 0.00 5.15 5.66 -1.26 -4.51 114.28 118.22 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 0.25 -0.72 0.00 0.00 -1.55 0.00 0.00 70.33 68.31 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 -0.46 0.00 -0.34 1.09 2.88 0.77 -5.01 113.62 112.56 2fy1 n SER 45 Ca -0.02 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.68 2fy1 n SER 45 Cb 0.31 0.00 0.38 0.00 -0.75 0.00 0.00 64.21 64.15 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 0.62 -0.33 -1.46 1.57 -0.65 -3.48 116.57 112.84 2fy1 h LYS 46 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2fy1 h LYS 46 Cb 0.00 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.17 2fy1 h LYS 46 CO 0.00 0.41 0.00 0.45 -0.57 0.00 0.00 179.45 179.74 2fy1 n SER 47 N -4.74 -0.22 -4.02 0.86 2.88 -1.25 -5.01 113.62 102.12 2fy1 n SER 47 Ca 0.24 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.69 2fy1 n SER 47 Cb 0.66 -0.11 -0.08 0.00 -0.75 0.00 0.00 64.21 63.93 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 0.91 -0.18 -1.46 3.00 -1.26 -5.01 118.95 114.94 2fy1 s ARG 48 Ca 0.00 -1.21 -0.03 0.00 -1.00 0.00 0.00 55.73 53.49 2fy1 s ARG 48 Cb 0.00 0.30 0.06 0.00 0.00 0.00 0.00 34.95 35.30 2fy1 s ARG 48 CO 0.00 -0.28 0.04 0.20 0.00 0.00 0.00 175.30 175.26 2fy1 s GLY 49 N -2.96 0.62 -0.00 8.12 0.00 -1.14 -3.84 107.32 108.12 2fy1 s GLY 49 Ca 0.15 -0.57 0.01 0.00 0.00 0.00 0.00 44.72 44.30 2fy1 s GLY 49 CO -0.04 1.44 -0.02 -0.11 0.00 0.00 0.00 173.10 174.38 2fy1 s PHE 50 N 1.91 0.17 -0.13 1.90 -0.71 -0.65 -4.41 117.98 116.07 2fy1 s PHE 50 Ca 0.00 -0.02 -0.05 0.00 -1.04 0.00 0.00 56.93 55.82 2fy1 s PHE 50 Cb -0.16 -0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.48 2fy1 s PHE 50 CO -0.08 -0.01 0.05 0.00 -1.34 0.00 0.00 175.22 173.84 2fy1 s ALA 51 N 0.05 3.42 -0.07 1.99 0.00 -0.64 0.31 121.76 126.83 2fy1 s ALA 51 Ca -0.00 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.25 2fy1 s ALA 51 Cb -0.02 -1.73 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 2fy1 s ALA 51 CO -0.00 0.43 -0.20 -0.06 0.00 0.00 0.00 175.76 175.93 2fy1 s PHE 52 N -0.40 2.59 -0.02 0.00 0.08 0.28 -0.22 117.98 120.29 2fy1 s PHE 52 Ca 0.09 -0.57 0.02 0.00 0.12 0.00 0.00 56.93 56.58 2fy1 s PHE 52 Cb -0.12 -1.66 0.01 0.00 -0.57 0.00 0.00 43.02 40.67 2fy1 s PHE 52 CO 0.02 -0.12 -0.05 0.42 -0.10 0.00 0.00 175.22 175.39 2fy1 s ILE 53 N -0.18 0.47 -0.14 0.64 1.01 -0.10 -0.95 121.20 121.95 2fy1 s ILE 53 Ca -0.02 -0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.39 2fy1 s ILE 53 Cb -0.14 -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 0.30 4.73 -0.14 2.92 2.01 0.05 -0.43 115.64 125.07 2fy1 s THR 54 Ca -0.03 -0.07 -0.05 0.00 0.31 0.00 0.00 61.69 61.84 2fy1 s THR 54 Cb -0.07 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.33 2fy1 s THR 54 CO -0.00 0.54 0.05 -0.36 -0.69 0.00 0.00 174.62 174.16 2fy1 s PHE 55 N -0.32 3.26 0.57 4.92 0.40 -0.46 -1.02 117.98 125.34 2fy1 s PHE 55 Ca 0.08 0.15 0.36 0.00 -0.60 0.00 0.00 56.93 56.93 2fy1 s PHE 55 Cb -0.12 -1.95 1.41 0.00 0.51 0.00 0.00 43.02 42.87 2fy1 s PHE 55 CO 0.02 0.34 1.62 0.93 0.70 0.00 0.00 175.22 178.82 2fy1 h GLU 56 N 5.91 0.00 -4.78 0.44 5.08 -1.90 -3.40 114.58 115.93 2fy1 h GLU 56 Ca -0.44 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 57.61 2fy1 h GLU 56 Cb 1.19 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.23 2fy1 h GLU 56 CO 0.63 0.00 -0.74 -0.80 -1.00 0.00 0.00 179.01 177.09 2fy1 s ASN 57 N -4.34 1.09 0.33 1.42 0.01 -1.26 -5.05 114.94 107.14 2fy1 s ASN 57 Ca -0.04 -0.59 0.06 0.00 -0.71 0.00 0.00 52.86 51.58 2fy1 s ASN 57 Cb 0.20 0.01 0.59 0.00 0.41 0.00 0.00 41.25 42.47 2fy1 s ASN 57 CO 0.69 -0.18 1.82 1.55 -1.51 0.00 0.00 177.10 179.47 2fy1 h PRO 58 N 4.37 0.36 -0.61 -0.60 0.13 -1.85 -2.72 132.00 131.07 2fy1 h PRO 58 Ca -0.37 -0.11 0.06 0.00 -0.87 0.00 0.00 66.00 64.71 2fy1 h PRO 58 Cb 1.20 -0.04 -0.09 0.00 0.13 0.00 0.00 31.00 32.20 2fy1 h PRO 58 CO 0.41 0.54 -0.51 0.00 -0.23 0.00 0.00 178.00 178.22 2fy1 h ALA 59 N 1.48 -0.61 -0.37 -0.56 0.00 -1.95 -1.10 119.26 116.16 2fy1 h ALA 59 Ca 0.06 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2fy1 h ALA 59 Cb 0.52 1.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 2fy1 h ALA 59 CO 0.03 -0.91 0.08 -0.44 0.00 0.00 0.00 179.25 178.01 2fy1 h ASP 60 N -0.18 0.49 -0.07 0.00 3.32 -1.81 0.35 116.42 118.52 2fy1 h ASP 60 Ca 0.10 -0.07 0.03 0.00 0.02 0.00 0.00 57.03 57.12 2fy1 h ASP 60 Cb 0.45 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 2fy1 h ASP 60 CO -0.67 0.50 -0.15 0.00 -1.72 0.00 0.00 179.24 177.20 2fy1 h ALA 61 N 1.57 -0.12 -0.58 3.45 0.00 -1.22 -0.94 119.26 121.41 2fy1 h ALA 61 Ca 0.12 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.13 2fy1 h ALA 61 Cb 0.21 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 2fy1 h ALA 61 CO -0.00 -0.62 0.27 -0.22 0.00 0.00 0.00 179.25 178.67 2fy1 h LYS 62 N -0.22 0.48 0.36 0.00 3.11 -0.59 -0.47 116.57 119.23 2fy1 h LYS 62 Ca 0.08 -0.03 -0.00 0.00 -2.81 0.00 0.00 60.65 57.88 2fy1 h LYS 62 Cb 0.32 -0.11 -0.03 0.00 -1.00 0.00 0.00 32.23 31.42 2fy1 h LYS 62 CO -0.20 0.32 -0.39 -0.97 -2.81 0.00 0.00 179.45 175.39 2fy1 h ASN 63 N 0.50 -1.08 -0.85 4.20 -1.24 -0.70 0.28 115.58 116.68 2fy1 h ASN 63 Ca 0.28 0.10 0.09 0.00 0.71 0.00 0.00 56.30 57.47 2fy1 h ASN 63 Cb 0.26 0.37 -0.07 0.00 0.73 0.00 0.00 38.32 39.60 2fy1 h ASN 63 CO -0.23 -0.53 0.50 0.00 -1.29 0.00 0.00 177.43 175.88 2fy1 h ALA 64 N -0.38 1.20 -0.34 1.57 0.00 -1.03 0.74 119.26 121.02 2fy1 h ALA 64 Ca -0.02 0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.96 2fy1 h ALA 64 Cb 0.71 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2fy1 h ALA 64 CO -0.09 0.14 0.04 0.00 0.00 0.00 0.00 179.25 179.35 2fy1 h ALA 65 N 1.45 0.34 -0.00 0.00 0.00 -0.77 -0.45 119.26 119.83 2fy1 h ALA 65 Ca 0.40 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.42 2fy1 h ALA 65 Cb 0.34 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2fy1 h ALA 65 CO -0.23 -0.36 -0.17 -0.22 0.00 0.00 0.00 179.25 178.26 2fy1 h LYS 66 N 0.15 -0.26 0.14 0.00 3.64 0.05 -3.26 116.57 117.03 2fy1 h LYS 66 Ca 0.16 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2fy1 h LYS 66 Cb 0.20 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2fy1 h LYS 66 CO -0.24 -0.18 -0.13 0.22 -2.27 0.00 0.00 179.45 176.85 2fy1 h ASP 67 N -0.27 -0.36 0.00 4.20 1.82 -0.75 -3.43 116.42 117.63 2fy1 h ASP 67 Ca 0.06 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.72 2fy1 h ASP 67 Cb 0.34 0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.47 2fy1 h ASP 67 CO -0.16 -0.18 0.00 0.23 -1.61 0.00 0.00 179.24 177.52 2fy1 n MET 68 N -3.10 0.00 -0.34 0.28 2.81 -0.19 -4.87 117.12 111.72 2fy1 n MET 68 Ca -0.03 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 2fy1 n MET 68 Cb 0.12 -0.70 0.00 0.00 -0.71 0.00 0.00 33.22 31.93 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 -0.43 0.00 0.00 7.83 0.23 -1.23 -3.13 115.26 118.53 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 -1.72 0.00 0.00 -2.08 0.00 0.00 39.78 35.98 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 -1.09 0.00 2.36 4.83 0.00 -1.19 -4.53 105.19 105.57 2fy1 n GLY 70 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.44 -3.66 1.61 0.00 -1.19 -4.90 118.16 109.58 2fy1 n LYS 71 Ca 0.00 -1.40 -0.07 0.00 0.00 0.00 0.00 58.31 56.83 2fy1 n LYS 71 Cb 0.00 -0.68 -0.08 0.00 0.00 0.00 0.00 35.03 34.27 2fy1 n LYS 71 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2fy1 s SER 72 N -3.79 -0.76 0.00 3.14 1.04 -1.26 -1.62 113.70 110.45 2fy1 s SER 72 Ca 0.44 1.26 0.00 0.00 0.48 0.00 0.00 55.95 58.13 2fy1 s SER 72 Cb -0.02 1.31 0.00 0.00 0.10 0.00 0.00 66.02 67.41 2fy1 s SER 72 CO 0.30 -0.22 0.30 0.00 0.98 0.00 0.00 173.24 174.60 2fy1 n LEU 73 N 4.58 0.00 -0.67 2.42 -0.00 -1.26 -4.94 117.00 117.12 2fy1 n LEU 73 Ca -0.19 -0.37 0.00 0.00 -0.00 0.00 0.00 56.01 55.46 2fy1 n LEU 73 Cb 0.55 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.97 2fy1 n LEU 73 CO 0.01 0.32 0.23 0.00 -0.00 0.00 0.00 177.39 177.96 2fy1 n HIS 74 N 0.00 0.00 -0.85 1.47 1.44 -1.26 -5.02 115.22 111.00 2fy1 n HIS 74 Ca 0.00 -0.10 0.00 0.00 -2.01 0.00 0.00 57.72 55.61 2fy1 n HIS 74 Cb 0.51 0.05 0.00 0.00 0.12 0.00 0.00 29.99 30.68 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 0.07 0.47 1.94 -1.39 0.00 -1.26 -4.80 105.19 100.23 2fy1 n GLY 75 Ca -0.01 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.09 2fy1 n GLY 75 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2fy1 n LYS 76 N -2.85 0.00 0.00 1.61 4.81 -1.26 -5.17 118.16 115.30 2fy1 n LYS 76 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2fy1 n LYS 76 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2fy1 n LYS 76 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2fy1 n ALA 77 N -2.46 0.00 -2.51 3.14 0.00 -1.26 -4.94 120.51 112.48 2fy1 n ALA 77 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 2fy1 n ALA 77 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.29 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 -2.00 1.91 -0.05 0.00 -5.25 -0.64 -4.45 121.20 110.72 2fy1 s ILE 78 Ca 0.00 -1.02 0.06 0.00 -0.99 0.00 0.00 60.65 58.71 2fy1 s ILE 78 Cb 0.00 -1.60 -0.01 0.00 2.95 0.00 0.00 42.46 43.80 2fy1 s ILE 78 CO 0.00 0.54 -0.25 -0.75 -1.79 0.00 0.00 174.94 172.69 2fy1 s LYS 79 N -0.39 2.47 -0.19 0.37 2.36 -0.50 -3.16 119.74 120.70 2fy1 s LYS 79 Ca 0.04 -0.89 -0.01 0.00 -2.55 0.00 0.00 55.97 52.57 2fy1 s LYS 79 Cb -0.11 -2.11 0.01 0.00 -1.05 0.00 0.00 37.83 34.57 2fy1 s LYS 79 CO 0.01 0.38 -0.13 0.08 1.55 0.00 0.00 175.35 177.24 2fy1 s VAL 80 N -0.18 2.63 0.04 4.02 1.01 -1.26 -0.95 120.40 125.70 2fy1 s VAL 80 Ca -0.03 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.23 2fy1 s VAL 80 Cb -0.13 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 2fy1 s VAL 80 CO 0.03 0.49 -0.08 -0.70 0.00 0.00 0.00 175.10 174.85 2fy1 s GLU 81 N 1.30 0.55 -0.21 2.72 2.56 -0.55 -4.76 118.70 120.30 2fy1 s GLU 81 Ca 0.04 -0.66 -0.17 0.00 0.00 0.00 0.00 54.97 54.17 2fy1 s GLU 81 Cb -0.14 -0.38 -0.03 0.00 2.00 0.00 0.00 34.13 35.58 2fy1 s GLU 81 CO -0.08 0.08 0.47 -1.14 -0.56 0.00 0.00 175.26 174.04 2fy1 s GLN 82 N -1.30 4.16 0.73 4.30 0.74 -1.26 -0.40 119.66 126.64 2fy1 s GLN 82 Ca -0.07 0.32 -0.15 0.00 0.05 0.00 0.00 55.36 55.51 2fy1 s GLN 82 Cb -0.08 -3.57 0.04 0.00 1.10 0.00 0.00 33.01 30.50 2fy1 s GLN 82 CO 0.00 -0.15 1.21 0.00 -0.55 0.00 0.00 175.29 175.81 2fy1 s ALA 83 N 1.65 2.10 0.49 1.58 0.00 -0.36 -4.81 121.76 122.40 2fy1 s ALA 83 Ca 0.22 0.90 0.02 0.00 0.00 0.00 0.00 51.96 53.10 2fy1 s ALA 83 Cb -0.15 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.50 2fy1 s ALA 83 CO 0.09 -1.92 0.13 1.63 0.00 0.00 0.00 175.76 175.70 2fy1 n LYS 84 N -2.74 0.80 -1.94 0.00 4.76 -1.26 -4.58 118.16 113.20 2fy1 n LYS 84 Ca 0.14 -3.41 -0.37 0.00 -2.87 0.00 0.00 58.31 51.80 2fy1 n LYS 84 Cb 0.50 0.73 0.03 0.00 -1.84 0.00 0.00 35.03 34.45 2fy1 n LYS 84 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2fy1 s LYS 85 N -3.86 3.19 0.55 1.97 1.02 -1.26 -5.00 119.74 116.35 2fy1 s LYS 85 Ca 0.10 2.02 -0.18 0.00 0.02 0.00 0.00 55.97 57.93 2fy1 s LYS 85 Cb -0.01 -2.18 -0.06 0.00 -0.52 0.00 0.00 37.83 35.07 2fy1 s LYS 85 CO 0.06 -1.09 1.08 -1.25 -0.92 0.00 0.00 175.35 173.24 2fy1 s PRO 86 N -3.00 3.44 0.00 -1.68 0.04 -1.26 -4.94 135.00 127.60 2fy1 s PRO 86 Ca 0.72 1.40 0.19 0.00 0.04 0.00 0.00 61.00 63.36 2fy1 s PRO 86 Cb -0.35 -2.04 1.15 0.00 0.04 0.00 0.00 34.50 33.30 2fy1 s PRO 86 CO 0.41 -0.74 1.62 0.43 0.04 0.00 0.00 177.00 178.75 2fy1 n SER 87 N -1.48 0.00 -3.72 6.66 7.64 -1.26 -4.68 113.62 116.79 2fy1 n SER 87 Ca 0.10 -1.00 -0.15 0.00 1.01 0.00 0.00 58.87 58.83 2fy1 n SER 87 Cb 0.52 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.57 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 -2.00 -0.18 0.00 1.43 5.36 -1.26 -5.05 117.98 116.28 2fy1 s PHE 88 Ca 0.29 0.54 0.00 0.00 -0.96 0.00 0.00 56.93 56.80 2fy1 s PHE 88 Cb 0.13 -0.14 0.00 0.00 -0.34 0.00 0.00 43.02 42.67 2fy1 s PHE 88 CO 0.22 -0.21 0.17 1.04 -1.46 0.00 0.00 175.22 174.98 2fy1 n GLN 89 N 4.63 1.11 0.25 10.12 6.02 -1.26 -4.54 117.38 133.71 2fy1 n GLN 89 Ca -0.18 -0.17 0.14 0.00 -0.01 0.00 0.00 57.00 56.78 2fy1 n GLN 89 Cb 0.51 -0.58 0.54 0.00 1.02 0.00 0.00 30.24 31.73 2fy1 n GLN 89 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 2fy1 h SER 90 N 0.00 0.00 0.00 1.08 0.02 -2.00 -3.38 113.55 109.27 2fy1 h SER 90 Ca 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2fy1 h SER 90 Cb 0.14 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.63 2fy1 h SER 90 CO 0.00 0.09 -0.11 0.61 -1.14 0.00 0.00 176.83 176.29 2fy1 n GLY 91 N 0.18 0.56 3.73 -3.77 0.00 -1.26 -5.16 105.19 99.47 2fy1 n GLY 91 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.37 2.21 0.17 -0.02 0.00 -1.26 -5.06 107.32 102.99 2fy1 s GLY 92 Ca 0.00 0.75 0.07 0.00 0.00 0.00 0.00 44.72 45.54 2fy1 s GLY 92 CO 0.00 1.15 -0.14 0.50 0.00 0.00 0.00 173.10 174.61 2fy1 s ARG 93 N -4.07 1.20 0.16 2.90 0.52 -1.26 -5.09 118.95 113.31 2fy1 s ARG 93 Ca 0.71 -1.47 -0.20 0.00 -0.52 0.00 0.00 55.73 54.26 2fy1 s ARG 93 Cb -0.26 -0.97 0.05 0.00 0.52 0.00 0.00 34.95 34.28 2fy1 s ARG 93 CO 0.46 0.16 0.53 0.50 0.02 0.00 0.00 175.30 176.97 2fy1 s ARG 94 N -3.39 1.26 0.00 3.54 6.06 -1.26 -5.12 118.95 120.04 2fy1 s ARG 94 Ca 0.18 -0.65 0.00 0.00 -2.50 0.00 0.00 55.73 52.76 2fy1 s ARG 94 Cb -0.01 0.54 0.00 0.00 0.06 0.00 0.00 34.95 35.54 2fy1 s ARG 94 CO 0.04 -0.53 0.00 0.54 -2.50 0.00 0.00 175.30 172.85 2fy1 n ARG 95 N -0.33 0.00 -1.59 5.12 1.74 -1.26 -5.11 116.66 115.24 2fy1 n ARG 95 Ca -0.15 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.62 2fy1 n ARG 95 Cb 0.64 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 32.13 2fy1 n ARG 95 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2fy1 s PRO 96 N -4.14 2.91 0.99 5.56 0.04 -1.26 -4.86 135.00 134.23 2fy1 s PRO 96 Ca 0.00 1.00 -0.12 0.00 0.04 0.00 0.00 61.00 61.92 2fy1 s PRO 96 Cb 0.00 -1.98 0.18 0.00 0.04 0.00 0.00 34.50 32.74 2fy1 s PRO 96 CO 0.00 -1.13 1.10 -1.25 0.04 0.00 0.00 177.00 175.77 2fy1 s PRO 97 N -4.93 0.52 -0.04 0.56 0.04 -1.26 -5.05 135.00 124.85 2fy1 s PRO 97 Ca 0.59 0.43 -0.01 0.00 0.04 0.00 0.00 61.00 62.05 2fy1 s PRO 97 Cb -0.15 -1.75 0.03 0.00 0.04 0.00 0.00 34.50 32.67 2fy1 s PRO 97 CO 0.53 -2.65 0.07 0.00 0.04 0.00 0.00 177.00 174.99 2fy1 s ALA 98 N -3.05 -0.07 0.22 8.56 0.00 -1.26 -5.10 121.76 121.07 2fy1 s ALA 98 Ca 0.65 0.43 -0.10 0.00 0.00 0.00 0.00 51.96 52.94 2fy1 s ALA 98 Cb -0.18 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 2fy1 s ALA 98 CO 0.57 -0.12 0.39 -1.12 0.00 0.00 0.00 175.76 175.47 2fy1 s SER 99 N 1.00 -0.03 0.11 0.00 0.01 -1.26 -5.19 113.70 108.33 2fy1 s SER 99 Ca -0.08 -0.99 -0.08 0.00 1.31 0.00 0.00 55.95 56.11 2fy1 s SER 99 Cb -0.11 0.52 -0.01 0.00 0.21 0.00 0.00 66.02 66.64 2fy1 s SER 99 CO -0.04 -1.04 0.20 -0.55 0.41 0.00 0.00 173.24 172.22 2fy1 s SER 100 N -3.03 0.12 -0.01 2.44 0.15 -1.26 -5.07 113.70 107.04 2fy1 s SER 100 Ca 0.24 -0.75 0.01 0.00 0.70 0.00 0.00 55.95 56.16 2fy1 s SER 100 Cb 0.01 0.36 0.02 0.00 -1.71 0.00 0.00 66.02 64.70 2fy1 s SER 100 CO 0.08 -0.77 0.86 -1.14 1.20 0.00 0.00 173.24 173.46 2fy1 n ARG 101 N -0.10 0.18 -1.76 5.44 0.00 -1.26 -5.12 116.66 114.05 2fy1 n ARG 101 Ca -0.12 -0.96 -0.36 0.00 -0.00 0.00 0.00 57.85 56.40 2fy1 n ARG 101 Cb 0.63 -0.58 0.07 0.00 0.00 0.00 0.00 32.46 32.57 2fy1 n ARG 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2fy1 s ASN 102 N -0.81 4.65 -1.25 6.15 2.20 -1.26 -3.72 114.94 120.90 2fy1 s ASN 102 Ca 0.02 2.56 -0.09 0.00 -0.94 0.00 0.00 52.86 54.41 2fy1 s ASN 102 Cb 0.02 -2.61 0.01 0.00 -2.00 0.00 0.00 41.25 36.67 2fy1 s ASN 102 CO 0.00 -1.97 0.16 -1.14 -2.94 0.00 0.00 177.10 171.22 2fy1 n ARG 103 N -1.94 -0.77 -1.61 3.55 0.00 -1.26 -4.85 116.66 109.78 2fy1 n ARG 103 Ca 0.15 0.05 -0.48 0.00 -0.00 0.00 0.00 57.85 57.57 2fy1 n ARG 103 Cb 0.49 -2.76 -0.04 0.00 0.00 0.00 0.00 32.46 30.14 2fy1 n ARG 103 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2fy1 n SER 104 N -2.23 1.89 -4.77 6.15 2.88 -1.24 -4.94 113.62 111.36 2fy1 n SER 104 Ca -0.23 1.13 -0.32 0.00 -1.33 0.00 0.00 58.87 58.12 2fy1 n SER 104 Cb 0.57 -1.28 0.06 0.00 -0.75 0.00 0.00 64.21 62.80 2fy1 n SER 104 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2fy1 s PRO 105 N -0.16 2.66 0.23 -1.46 0.04 -1.26 -5.08 135.00 129.96 2fy1 s PRO 105 Ca 0.74 1.28 -0.14 0.00 0.04 0.00 0.00 61.00 62.92 2fy1 s PRO 105 Cb -0.80 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 31.80 2fy1 s PRO 105 CO 0.50 -1.35 0.48 -1.54 0.04 0.00 0.00 177.00 175.13 2fy1 s SER 106 N -2.95 -0.12 0.00 6.66 1.04 -1.26 -5.19 113.70 111.88 2fy1 s SER 106 Ca 0.64 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 56.27 2fy1 s SER 106 Cb -0.19 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2fy1 s SER 106 CO 0.47 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 174.19 2fy1 n GLY 107 N -0.36 -1.26 0.00 7.32 0.00 -1.26 -5.34 105.19 104.29 2fy1 n GLY 107 Ca -0.04 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.04 2fy1 n GLY 107 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06