#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 1.27 -1.10 2.03 2.07 -2.07 -3.47 116.25 114.97 2fy1 h VAL 2 Ca 0.00 -1.35 -0.25 0.00 0.82 0.00 0.00 66.70 65.91 2fy1 h VAL 2 Cb 0.00 1.17 -0.10 0.00 -1.52 0.00 0.00 31.29 30.84 2fy1 h VAL 2 CO 0.00 0.46 -0.23 1.21 0.02 0.00 0.00 177.57 179.03 2fy1 n GLU 3 N -4.11 -1.42 -0.98 1.57 2.13 -1.26 -4.86 120.64 111.71 2fy1 n GLU 3 Ca 0.00 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.60 2fy1 n GLU 3 Cb 0.44 -4.99 0.00 0.00 0.27 0.00 0.00 31.44 27.16 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 0.66 0.00 -0.19 4.31 0.00 -1.26 -5.09 120.51 118.95 2fy1 n ALA 4 Ca -0.12 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.38 2fy1 n ALA 4 Cb 0.46 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.09 2fy1 n ALA 4 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2fy1 n ASP 5 N -1.06 3.09 -4.33 0.00 9.92 -1.26 -5.01 116.55 117.89 2fy1 n ASP 5 Ca 0.00 -1.98 -0.33 0.00 -0.53 0.00 0.00 54.79 51.95 2fy1 n ASP 5 Cb 0.00 -0.27 -0.09 0.00 -0.64 0.00 0.00 41.12 40.12 2fy1 n ASP 5 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2fy1 n HIS 6 N 0.74 -1.28 1.21 1.24 1.44 -1.26 -4.88 115.22 112.43 2fy1 n HIS 6 Ca 0.14 0.64 0.11 0.00 -2.01 0.00 0.00 57.72 56.60 2fy1 n HIS 6 Cb 0.46 -2.70 0.61 0.00 0.12 0.00 0.00 29.99 28.48 2fy1 n HIS 6 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 2fy1 n PRO 7 N -4.48 0.48 -1.11 -1.40 -0.04 -1.26 -4.87 135.00 122.32 2fy1 n PRO 7 Ca -0.24 0.05 -0.04 0.00 -0.04 0.00 0.00 63.50 63.23 2fy1 n PRO 7 Cb 0.65 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.59 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 0.55 0.62 3.05 0.55 0.00 -1.26 -4.97 105.19 103.73 2fy1 n GLY 8 Ca 0.13 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.68 1.32 0.07 1.61 2.20 -1.26 -1.06 119.74 120.94 2fy1 s LYS 9 Ca 0.00 -0.43 0.09 0.00 -0.36 0.00 0.00 55.97 55.28 2fy1 s LYS 9 Cb 0.00 -1.18 -0.03 0.00 -1.51 0.00 0.00 37.83 35.11 2fy1 s LYS 9 CO 0.00 0.16 -0.25 -0.51 -0.36 0.00 0.00 175.35 174.39 2fy1 s LEU 10 N 0.17 2.21 -0.23 5.43 1.02 0.37 -1.28 118.68 126.37 2fy1 s LEU 10 Ca -0.04 -0.62 -0.08 0.00 0.02 0.00 0.00 54.13 53.41 2fy1 s LEU 10 Cb -0.10 -1.18 -0.04 0.00 0.02 0.00 0.00 46.19 44.89 2fy1 s LEU 10 CO 0.01 0.21 0.09 0.12 0.02 0.00 0.00 176.35 176.80 2fy1 s PHE 11 N -0.88 3.16 -0.17 0.29 5.36 0.47 -0.71 117.98 125.49 2fy1 s PHE 11 Ca 0.11 -0.17 -0.05 0.00 -0.96 0.00 0.00 56.93 55.86 2fy1 s PHE 11 Cb -0.10 -2.21 -0.03 0.00 -0.34 0.00 0.00 43.02 40.34 2fy1 s PHE 11 CO 0.03 -0.17 -0.01 0.42 -1.46 0.00 0.00 175.22 174.04 2fy1 s ILE 12 N 1.25 4.10 -0.23 3.12 1.09 0.94 -1.35 121.20 130.12 2fy1 s ILE 12 Ca 0.05 -0.28 -0.07 0.00 -1.10 0.00 0.00 60.65 59.25 2fy1 s ILE 12 Cb -0.14 -2.82 -0.03 0.00 -1.06 0.00 0.00 42.46 38.40 2fy1 s ILE 12 CO 0.04 0.47 0.07 -0.83 -0.10 0.00 0.00 174.94 174.59 2fy1 s GLY 13 N 0.52 1.80 0.00 6.18 0.00 -0.02 -1.75 107.32 114.05 2fy1 s GLY 13 Ca -0.01 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 43.68 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 4.55 -1.09 4.97 0.20 0.00 -1.26 -1.45 105.19 111.11 2fy1 n GLY 14 Ca -0.16 0.40 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 -1.84 0.99 7.99 -1.26 -4.66 117.00 118.22 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 -0.01 0.00 -0.11 0.00 0.00 43.42 43.30 2fy1 n LEU 15 CO 0.00 0.00 -0.07 -3.20 -1.51 0.00 0.00 177.39 172.61 2fy1 n ASN 16 N 0.07 -2.09 -2.93 -1.43 5.15 -1.26 -0.08 115.26 112.69 2fy1 n ASN 16 Ca 0.00 0.25 -0.18 0.00 -0.60 0.00 0.00 54.58 54.05 2fy1 n ASN 16 Cb 0.00 -2.01 -0.00 0.00 -0.53 0.00 0.00 39.78 37.23 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 -2.05 -2.99 0.03 1.20 3.00 -1.26 -4.82 116.66 109.76 2fy1 n ARG 17 Ca -0.07 0.53 0.00 0.00 -0.01 0.00 0.00 57.85 58.30 2fy1 n ARG 17 Cb 0.39 -5.20 0.00 0.00 0.00 0.00 0.00 32.46 27.65 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 -3.32 0.00 -3.90 5.56 2.13 0.88 -5.08 120.64 116.91 2fy1 n GLU 18 Ca -0.07 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.48 2fy1 n GLU 18 Cb 0.57 -0.27 -0.01 0.00 0.27 0.00 0.00 31.44 32.00 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 1.70 0.00 6.31 -1.32 -0.11 -5.13 115.64 115.09 2fy1 s THR 19 Ca 0.00 -1.50 0.00 0.00 -1.21 0.00 0.00 61.69 58.98 2fy1 s THR 19 Cb 0.00 -2.21 0.00 0.00 -1.51 0.00 0.00 72.50 68.78 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 -1.73 0.00 0.15 8.08 4.13 -1.26 -4.76 115.26 119.87 2fy1 n ASN 20 Ca -0.02 0.00 0.08 0.00 1.68 0.00 0.00 54.58 56.32 2fy1 n ASN 20 Cb 0.64 0.00 0.42 0.00 -1.54 0.00 0.00 39.78 39.30 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 0.10 0.34 3.52 0.00 -1.26 0.49 120.64 123.83 2fy1 n GLU 21 Ca 0.00 0.58 -0.19 0.00 0.00 0.00 0.00 57.16 57.55 2fy1 n GLU 21 Cb 0.00 -2.01 -0.10 0.00 0.00 0.00 0.00 31.44 29.33 2fy1 n GLU 21 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 2fy1 h LYS 22 N 0.00 -1.02 -0.95 5.31 1.63 -2.00 -0.82 116.57 118.72 2fy1 h LYS 22 Ca 0.00 0.07 0.11 0.00 -0.85 0.00 0.00 60.65 59.98 2fy1 h LYS 22 Cb 0.36 0.23 -0.07 0.00 -0.60 0.00 0.00 32.23 32.15 2fy1 h LYS 22 CO 0.00 -0.68 0.61 0.00 -3.45 0.00 0.00 179.45 175.92 2fy1 h MET 23 N -1.06 0.90 0.00 1.90 -0.00 -0.35 -1.83 114.93 114.49 2fy1 h MET 23 Ca -0.07 -0.05 0.00 0.00 -0.00 0.00 0.00 59.70 59.57 2fy1 h MET 23 Cb 0.90 -0.20 0.00 0.00 -0.00 0.00 0.00 31.60 32.29 2fy1 h MET 23 CO -0.01 0.60 0.00 1.28 -0.00 0.00 0.00 176.91 178.78 2fy1 n LEU 24 N -4.57 0.00 -0.16 -0.10 7.99 -0.42 0.09 117.00 119.84 2fy1 n LEU 24 Ca 0.17 0.94 0.13 0.00 -0.01 0.00 0.00 56.01 57.25 2fy1 n LEU 24 Cb 0.34 -0.44 0.47 0.00 -0.11 0.00 0.00 43.42 43.68 2fy1 n LEU 24 CO 0.29 -0.44 1.21 0.11 -1.51 0.00 0.00 177.39 177.05 2fy1 h LYS 25 N 0.00 0.46 0.00 3.23 1.57 -1.33 -1.62 116.57 118.88 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 0.31 0.00 0.00 -0.57 0.00 0.00 179.45 179.19 2fy1 n ALA 26 N -2.50 -0.05 0.08 3.86 0.00 -0.69 -0.70 120.51 120.51 2fy1 n ALA 26 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.45 2fy1 n ALA 26 Cb 0.45 0.09 -0.06 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 0.28 -0.06 0.00 2.07 -0.15 -0.24 116.25 118.15 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 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.05 2fy1 h VAL 27 CO 0.00 0.00 -0.00 -0.26 0.02 0.00 0.00 177.57 177.33 2fy1 h PHE 28 N -0.51 0.11 0.00 1.57 -1.00 -1.46 -2.95 116.94 112.70 2fy1 h PHE 28 Ca 0.05 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2fy1 h PHE 28 Cb 0.58 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.11 2fy1 h PHE 28 CO -0.34 0.40 0.15 0.41 -1.61 0.00 0.00 178.31 177.32 2fy1 n GLY 29 N -0.21 -0.74 0.32 -1.45 0.00 0.13 -2.69 105.19 100.54 2fy1 n GLY 29 Ca -0.07 0.16 0.19 0.00 0.00 0.00 0.00 46.02 46.30 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 0.23 0.00 1.61 1.79 -0.86 -3.13 116.57 116.21 2fy1 h LYS 30 Ca 0.00 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.44 2fy1 h LYS 30 Cb 0.30 -0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 30.86 2fy1 h LYS 30 CO 0.00 0.15 -0.36 0.72 -1.08 0.00 0.00 179.45 178.88 2fy1 n HIS 31 N -5.17 0.00 -3.83 -1.35 8.25 -1.09 -5.02 115.22 107.00 2fy1 n HIS 31 Ca 0.27 -0.55 -0.10 0.00 -0.26 0.00 0.00 57.72 57.08 2fy1 n HIS 31 Cb 0.85 -0.11 0.01 0.00 1.12 0.00 0.00 29.99 31.86 2fy1 n HIS 31 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2fy1 n GLY 32 N -0.59 1.30 0.01 -1.41 0.00 -1.18 -4.02 105.19 99.30 2fy1 n GLY 32 Ca 0.08 -1.34 -0.00 0.00 0.00 0.00 0.00 46.02 44.76 2fy1 n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fy1 h PRO 33 N 0.00 -0.02 -1.31 1.61 0.13 -1.89 -3.39 132.00 127.14 2fy1 h PRO 33 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2fy1 h PRO 33 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2fy1 h PRO 33 CO 0.40 -0.01 0.00 -0.89 -0.23 0.00 0.00 178.00 177.27 2fy1 n ILE 34 N -2.11 -1.31 -0.06 -3.56 -0.00 -1.26 -4.87 119.36 106.19 2fy1 n ILE 34 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 2fy1 n ILE 34 Cb 0.01 -1.69 0.00 0.00 -0.00 0.00 0.00 39.64 37.96 2fy1 n ILE 34 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35 2fy1 n SER 35 N 0.00 1.30 -3.79 4.38 7.64 -0.14 -4.91 113.62 118.10 2fy1 n SER 35 Ca 0.00 -1.36 -0.13 0.00 1.01 0.00 0.00 58.87 58.39 2fy1 n SER 35 Cb 0.00 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.07 2fy1 n SER 35 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2fy1 s GLU 36 N -0.36 0.17 -0.06 1.43 -6.30 -0.58 -4.96 118.70 108.05 2fy1 s GLU 36 Ca 0.00 0.30 -0.00 0.00 -2.50 0.00 0.00 54.97 52.77 2fy1 s GLU 36 Cb 0.00 0.01 0.03 0.00 0.00 0.00 0.00 34.13 34.16 2fy1 s GLU 36 CO 0.00 -0.07 -0.01 0.08 0.02 0.00 0.00 175.26 175.27 2fy1 s VAL 37 N 0.47 0.43 -0.01 3.70 1.01 -1.26 -0.80 120.40 123.94 2fy1 s VAL 37 Ca -0.03 0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.00 2fy1 s VAL 37 Cb -0.05 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.79 2fy1 s VAL 37 CO -0.02 0.25 -0.06 -0.22 0.00 0.00 0.00 175.10 175.05 2fy1 s LEU 38 N 1.59 1.88 -0.04 3.92 2.96 -0.18 -5.03 118.68 123.78 2fy1 s LEU 38 Ca -0.01 -0.11 0.03 0.00 -0.22 0.00 0.00 54.13 53.83 2fy1 s LEU 38 Cb -0.13 -0.33 -0.00 0.00 0.50 0.00 0.00 46.19 46.23 2fy1 s LEU 38 CO -0.04 0.05 -0.13 -1.48 -1.32 0.00 0.00 176.35 173.43 2fy1 s LEU 39 N 0.06 1.85 -0.13 -0.68 2.34 -1.26 -0.67 118.68 120.19 2fy1 s LEU 39 Ca -0.00 -0.28 -0.04 0.00 0.06 0.00 0.00 54.13 53.87 2fy1 s LEU 39 Cb -0.05 -0.78 -0.03 0.00 -0.56 0.00 0.00 46.19 44.77 2fy1 s LEU 39 CO -0.00 0.11 0.02 -0.63 -1.06 0.00 0.00 176.35 174.79 2fy1 s ILE 40 N 0.11 4.48 0.00 1.48 -1.09 0.15 -4.87 121.20 121.47 2fy1 s ILE 40 Ca -0.04 -0.16 0.00 0.00 -2.23 0.00 0.00 60.65 58.22 2fy1 s ILE 40 Cb -0.10 -2.95 0.00 0.00 -1.58 0.00 0.00 42.46 37.83 2fy1 s ILE 40 CO 0.01 0.55 0.00 0.29 -1.23 0.00 0.00 174.94 174.56 2fy1 n LYS 41 N 2.76 1.27 -3.63 2.79 5.02 -1.26 -1.70 118.16 123.41 2fy1 n LYS 41 Ca -0.18 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.03 2fy1 n LYS 41 Cb 0.53 0.00 -0.07 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 -0.37 0.00 4.39 -4.77 -1.26 -4.83 116.67 110.83 2fy1 s ASP 42 Ca 0.00 0.67 0.00 0.00 -3.30 0.00 0.00 52.55 49.92 2fy1 s ASP 42 Cb 0.00 0.67 0.00 0.00 -1.09 0.00 0.00 42.92 42.50 2fy1 s ASP 42 CO 0.00 -0.15 0.00 -1.14 0.70 0.00 0.00 175.17 174.58 2fy1 n ARG 43 N 1.88 -0.78 -0.84 2.11 0.00 -1.26 0.23 116.66 118.01 2fy1 n ARG 43 Ca -0.12 0.13 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 2fy1 n ARG 43 Cb 0.56 -3.62 0.00 0.00 0.00 0.00 0.00 32.46 29.40 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 -4.56 114.28 118.18 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 0.13 -0.15 0.00 0.00 -1.55 0.00 0.00 70.33 68.75 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 -0.34 1.09 2.88 0.48 -4.98 113.62 112.75 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 0.24 0.00 -0.75 0.00 0.00 64.21 63.70 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 0.83 -0.32 -1.46 1.57 -0.46 -3.49 116.57 113.24 2fy1 h LYS 46 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2fy1 h LYS 46 Cb 0.00 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.12 2fy1 h LYS 46 CO 0.00 0.55 0.00 0.45 -0.57 0.00 0.00 179.45 179.88 2fy1 n SER 47 N -4.71 -0.21 -3.21 0.86 2.88 -1.25 -5.01 113.62 102.97 2fy1 n SER 47 Ca 0.19 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.54 2fy1 n SER 47 Cb 0.40 -0.11 -0.06 0.00 -0.75 0.00 0.00 64.21 63.70 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 0.06 0.52 -3.75 -1.46 1.85 -1.26 -5.02 116.66 107.60 2fy1 n ARG 48 Ca 0.00 -2.80 -0.24 0.00 -1.00 0.00 0.00 57.85 53.81 2fy1 n ARG 48 Cb 0.00 1.80 -0.17 0.00 -1.05 0.00 0.00 32.46 33.04 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 -3.00 0.51 -0.01 2.89 0.00 -1.23 -4.29 107.32 102.18 2fy1 s GLY 49 Ca 0.23 -0.26 0.01 0.00 0.00 0.00 0.00 44.72 44.69 2fy1 s GLY 49 CO 0.16 1.26 -0.02 -0.11 0.00 0.00 0.00 173.10 174.39 2fy1 s PHE 50 N 1.96 0.31 -0.06 1.90 -0.71 -0.69 -4.35 117.98 116.34 2fy1 s PHE 50 Ca 0.03 -0.04 0.06 0.00 -1.04 0.00 0.00 56.93 55.95 2fy1 s PHE 50 Cb -0.14 -0.28 -0.01 0.00 -1.21 0.00 0.00 43.02 41.38 2fy1 s PHE 50 CO -0.06 -0.06 -0.25 0.00 -1.34 0.00 0.00 175.22 173.51 2fy1 s ALA 51 N 0.38 2.17 -0.12 1.99 0.00 -0.72 0.30 121.76 125.76 2fy1 s ALA 51 Ca -0.04 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 50.84 2fy1 s ALA 51 Cb -0.06 -0.67 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 2fy1 s ALA 51 CO -0.01 0.42 0.01 -0.06 0.00 0.00 0.00 175.76 176.13 2fy1 s PHE 52 N -0.19 3.16 -0.03 0.00 0.40 0.15 -0.04 117.98 121.42 2fy1 s PHE 52 Ca -0.03 0.05 0.03 0.00 -0.60 0.00 0.00 56.93 56.39 2fy1 s PHE 52 Cb -0.13 -1.90 0.00 0.00 0.51 0.00 0.00 43.02 41.50 2fy1 s PHE 52 CO 0.03 0.28 -0.13 0.42 0.70 0.00 0.00 175.22 176.53 2fy1 s ILE 53 N -0.31 1.10 -0.15 0.64 1.01 0.11 -1.01 121.20 122.59 2fy1 s ILE 53 Ca 0.07 -0.54 -0.06 0.00 0.00 0.00 0.00 60.65 60.12 2fy1 s ILE 53 Cb -0.12 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 2fy1 s ILE 53 CO 0.02 0.33 0.05 -0.89 0.00 0.00 0.00 174.94 174.45 2fy1 s THR 54 N 0.12 4.68 -0.15 2.92 2.01 0.02 -0.48 115.64 124.76 2fy1 s THR 54 Ca -0.03 -0.09 -0.06 0.00 0.31 0.00 0.00 61.69 61.82 2fy1 s THR 54 Cb -0.10 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.31 2fy1 s THR 54 CO 0.01 0.52 0.05 -0.36 -0.69 0.00 0.00 174.62 174.15 2fy1 s PHE 55 N -0.09 3.26 0.60 4.92 0.40 -0.23 -0.97 117.98 125.87 2fy1 s PHE 55 Ca 0.06 0.13 0.30 0.00 -0.60 0.00 0.00 56.93 56.82 2fy1 s PHE 55 Cb -0.12 -1.97 1.23 0.00 0.51 0.00 0.00 43.02 42.66 2fy1 s PHE 55 CO 0.01 0.30 1.58 0.93 0.70 0.00 0.00 175.22 178.75 2fy1 h GLU 56 N 6.05 0.00 -4.44 0.44 5.08 -1.91 -3.41 114.58 116.39 2fy1 h GLU 56 Ca -0.42 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.69 2fy1 h GLU 56 Cb 1.18 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.23 2fy1 h GLU 56 CO 0.64 0.00 -0.72 -0.80 -1.00 0.00 0.00 179.01 177.13 2fy1 s ASN 57 N -4.25 0.75 0.36 1.42 0.01 -1.26 -5.05 114.94 106.91 2fy1 s ASN 57 Ca -0.04 -0.61 0.07 0.00 -0.71 0.00 0.00 52.86 51.58 2fy1 s ASN 57 Cb 0.16 0.06 0.68 0.00 0.41 0.00 0.00 41.25 42.56 2fy1 s ASN 57 CO 0.54 -0.27 1.88 1.55 -1.51 0.00 0.00 177.10 179.29 2fy1 h PRO 58 N 4.30 0.36 -0.50 -0.60 0.13 -1.89 -2.52 132.00 131.28 2fy1 h PRO 58 Ca -0.35 -0.08 0.05 0.00 -0.87 0.00 0.00 66.00 64.75 2fy1 h PRO 58 Cb 1.20 -0.05 -0.08 0.00 0.13 0.00 0.00 31.00 32.20 2fy1 h PRO 58 CO 0.44 0.47 -0.52 0.00 -0.23 0.00 0.00 178.00 178.17 2fy1 h ALA 59 N 1.56 -0.68 -0.51 -0.56 0.00 -1.96 -1.08 119.26 116.02 2fy1 h ALA 59 Ca 0.07 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2fy1 h ALA 59 Cb 0.39 1.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 2fy1 h ALA 59 CO 0.02 -0.96 0.22 -0.44 0.00 0.00 0.00 179.25 178.09 2fy1 h ASP 60 N -0.27 0.65 0.02 0.00 3.32 -1.77 0.30 116.42 118.67 2fy1 h ASP 60 Ca 0.09 -0.07 0.03 0.00 0.02 0.00 0.00 57.03 57.09 2fy1 h ASP 60 Cb 0.50 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 2fy1 h ASP 60 CO -0.62 0.58 -0.21 0.00 -1.72 0.00 0.00 179.24 177.27 2fy1 h ALA 61 N 1.52 -0.29 -0.68 3.45 0.00 -1.16 -0.74 119.26 121.37 2fy1 h ALA 61 Ca 0.18 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.16 2fy1 h ALA 61 Cb 0.12 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 2fy1 h ALA 61 CO -0.02 -0.71 0.36 -0.22 0.00 0.00 0.00 179.25 178.65 2fy1 h LYS 62 N -0.35 0.62 0.55 0.00 3.64 -0.68 0.18 116.57 120.53 2fy1 h LYS 62 Ca 0.05 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2fy1 h LYS 62 Cb 0.41 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 2fy1 h LYS 62 CO -0.18 0.41 -0.48 -0.97 -2.27 0.00 0.00 179.45 175.96 2fy1 h ASN 63 N 0.63 -1.30 -0.88 4.20 -1.24 -0.74 0.15 115.58 116.40 2fy1 h ASN 63 Ca 0.32 0.10 0.11 0.00 0.71 0.00 0.00 56.30 57.54 2fy1 h ASN 63 Cb 0.27 0.42 -0.07 0.00 0.73 0.00 0.00 38.32 39.68 2fy1 h ASN 63 CO -0.22 -0.66 0.57 0.00 -1.29 0.00 0.00 177.43 175.82 2fy1 h ALA 64 N -1.01 1.71 0.33 1.57 0.00 -1.00 0.40 119.26 121.26 2fy1 h ALA 64 Ca -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2fy1 h ALA 64 Cb 0.86 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2fy1 h ALA 64 CO -0.02 0.10 -0.31 0.00 0.00 0.00 0.00 179.25 179.01 2fy1 h ALA 65 N 1.57 -1.02 -1.00 0.00 0.00 -0.74 -1.22 119.26 116.86 2fy1 h ALA 65 Ca 0.42 -0.12 0.11 0.00 0.00 0.00 0.00 54.91 55.31 2fy1 h ALA 65 Cb 0.50 0.53 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 2fy1 h ALA 65 CO -0.18 -1.03 0.64 -0.22 0.00 0.00 0.00 179.25 178.45 2fy1 h LYS 66 N -0.64 1.01 0.33 0.00 3.64 -0.17 -0.50 116.57 120.24 2fy1 h LYS 66 Ca -0.04 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 2fy1 h LYS 66 Cb 0.55 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2fy1 h LYS 66 CO -0.03 0.67 -0.32 0.22 -2.27 0.00 0.00 179.45 177.72 2fy1 h ASP 67 N 1.04 -0.87 0.00 4.20 1.82 -0.99 -3.43 116.42 118.19 2fy1 h ASP 67 Ca 0.48 0.07 0.00 0.00 -0.39 0.00 0.00 57.03 57.19 2fy1 h ASP 67 Cb 0.41 0.28 0.00 0.00 0.68 0.00 0.00 39.33 40.70 2fy1 h ASP 67 CO -0.24 -0.43 0.00 0.23 -1.61 0.00 0.00 179.24 177.20 2fy1 n MET 68 N -4.31 0.00 -4.21 0.28 2.81 -0.26 -4.87 117.12 106.56 2fy1 n MET 68 Ca -0.08 0.00 -0.29 0.00 -1.81 0.00 0.00 57.70 55.52 2fy1 n MET 68 Cb 0.29 -0.40 -0.09 0.00 -0.71 0.00 0.00 33.22 32.31 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 -0.25 0.83 0.00 7.83 2.04 -0.79 -2.30 115.26 122.62 2fy1 n ASN 69 Ca 0.00 -1.20 0.00 0.00 -0.44 0.00 0.00 54.58 52.94 2fy1 n ASN 69 Cb 0.00 -1.49 0.00 0.00 -2.53 0.00 0.00 39.78 35.76 2fy1 n ASN 69 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2fy1 n GLY 70 N -2.45 1.72 1.08 4.83 0.00 -1.12 -4.89 105.19 104.35 2fy1 n GLY 70 Ca -0.30 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.59 0.10 -3.65 1.61 4.81 -0.97 -4.89 118.16 114.57 2fy1 n LYS 71 Ca 0.00 -0.68 -0.09 0.00 -0.87 0.00 0.00 58.31 56.67 2fy1 n LYS 71 Cb 0.00 -0.26 -0.08 0.00 0.02 0.00 0.00 35.03 34.71 2fy1 n LYS 71 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2fy1 s SER 72 N -2.22 -0.82 0.00 3.14 0.15 -1.26 -1.52 113.70 111.16 2fy1 s SER 72 Ca 0.19 1.38 0.00 0.00 0.70 0.00 0.00 55.95 58.22 2fy1 s SER 72 Cb -0.01 1.28 0.00 0.00 -1.71 0.00 0.00 66.02 65.59 2fy1 s SER 72 CO 0.13 -0.23 0.00 0.00 1.20 0.00 0.00 173.24 174.34 2fy1 n LEU 73 N 3.93 0.00 -2.07 3.45 -0.00 -0.74 -4.93 117.00 116.64 2fy1 n LEU 73 Ca -0.19 0.00 -0.21 0.00 -0.00 0.00 0.00 56.01 55.61 2fy1 n LEU 73 Cb 0.58 0.00 0.15 0.00 -0.00 0.00 0.00 43.42 44.14 2fy1 n LEU 73 CO 0.01 0.00 1.19 0.00 -0.00 0.00 0.00 177.39 178.59 2fy1 n HIS 74 N 0.00 2.65 -1.13 1.47 1.44 -1.26 -4.75 115.22 113.64 2fy1 n HIS 74 Ca 0.00 -1.73 -0.05 0.00 -2.01 0.00 0.00 57.72 53.93 2fy1 n HIS 74 Cb 0.00 -0.88 -0.02 0.00 0.12 0.00 0.00 29.99 29.21 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 -0.89 0.67 3.48 -1.39 0.00 -1.26 -4.90 105.19 100.90 2fy1 n GLY 75 Ca 0.52 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.81 1.05 0.47 1.61 1.02 -1.26 -5.17 119.74 115.65 2fy1 s LYS 76 Ca 0.00 -0.40 -0.19 0.00 0.02 0.00 0.00 55.97 55.40 2fy1 s LYS 76 Cb 0.00 0.48 -0.09 0.00 -0.52 0.00 0.00 37.83 37.69 2fy1 s LYS 76 CO 0.00 -0.46 0.97 0.00 -0.92 0.00 0.00 175.35 174.94 2fy1 s ALA 77 N -3.42 3.03 -0.12 5.17 0.00 -1.26 -1.79 121.76 123.37 2fy1 s ALA 77 Ca 0.04 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.29 2fy1 s ALA 77 Cb -0.01 -3.15 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 2fy1 s ALA 77 CO -0.10 -0.08 0.02 0.96 0.00 0.00 0.00 175.76 176.57 2fy1 s ILE 78 N -2.34 4.49 -0.17 0.00 -4.36 -0.58 -4.72 121.20 113.52 2fy1 s ILE 78 Ca 0.61 -0.17 -0.07 0.00 -0.26 0.00 0.00 60.65 60.77 2fy1 s ILE 78 Cb -0.10 -2.94 -0.04 0.00 1.25 0.00 0.00 42.46 40.63 2fy1 s ILE 78 CO 0.21 0.56 0.04 -0.75 0.24 0.00 0.00 174.94 175.25 2fy1 s LYS 79 N -0.48 3.90 -0.18 0.37 2.36 -0.53 -2.81 119.74 122.37 2fy1 s LYS 79 Ca 0.09 -0.37 0.01 0.00 -2.55 0.00 0.00 55.97 53.15 2fy1 s LYS 79 Cb -0.12 -3.15 0.02 0.00 -1.05 0.00 0.00 37.83 33.53 2fy1 s LYS 79 CO 0.02 0.29 -0.20 0.08 1.55 0.00 0.00 175.35 177.09 2fy1 s VAL 80 N 0.31 2.12 0.05 4.02 1.01 -1.26 -0.84 120.40 125.81 2fy1 s VAL 80 Ca 0.02 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2fy1 s VAL 80 Cb -0.13 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 2fy1 s VAL 80 CO 0.01 0.54 -0.08 -0.70 0.00 0.00 0.00 175.10 174.86 2fy1 s GLU 81 N 1.23 0.60 -0.23 2.72 2.56 -0.46 -4.69 118.70 120.43 2fy1 s GLU 81 Ca 0.03 -0.86 -0.10 0.00 0.00 0.00 0.00 54.97 54.05 2fy1 s GLU 81 Cb -0.13 -0.34 -0.05 0.00 2.00 0.00 0.00 34.13 35.61 2fy1 s GLU 81 CO -0.11 0.06 0.14 -1.14 -0.56 0.00 0.00 175.26 173.64 2fy1 s GLN 82 N -1.91 4.02 0.62 4.30 0.74 -1.26 -0.40 119.66 125.78 2fy1 s GLN 82 Ca -0.06 -0.30 -0.18 0.00 0.05 0.00 0.00 55.36 54.87 2fy1 s GLN 82 Cb -0.08 -3.47 -0.03 0.00 1.10 0.00 0.00 33.01 30.53 2fy1 s GLN 82 CO -0.00 0.08 1.09 0.00 -0.55 0.00 0.00 175.29 175.91 2fy1 n ALA 83 N 4.20 0.56 -0.47 1.58 0.00 -0.40 -4.84 120.51 121.14 2fy1 n ALA 83 Ca -0.15 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2fy1 n ALA 83 Cb 0.52 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 -1.39 0.00 -3.63 0.00 3.00 -1.26 -4.56 118.16 110.32 2fy1 n LYS 84 Ca 0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.44 2fy1 n LYS 84 Cb 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.44 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 -0.53 0.32 0.06 1.64 2.20 -1.26 -5.02 119.74 117.15 2fy1 s LYS 85 Ca 0.00 0.56 -0.07 0.00 -0.36 0.00 0.00 55.97 56.10 2fy1 s LYS 85 Cb 0.00 0.08 -0.30 0.00 -1.51 0.00 0.00 37.83 36.10 2fy1 s LYS 85 CO 0.00 -0.07 1.09 -1.00 -0.36 0.00 0.00 175.35 175.01 2fy1 h PRO 86 N 5.99 0.34 -3.61 4.03 0.13 -2.00 -3.42 132.00 133.46 2fy1 h PRO 86 Ca -0.27 -0.59 -0.08 0.00 -0.87 0.00 0.00 66.00 64.19 2fy1 h PRO 86 Cb 1.18 0.22 -0.15 0.00 0.13 0.00 0.00 31.00 32.38 2fy1 h PRO 86 CO 0.20 1.28 -0.30 -1.12 -0.23 0.00 0.00 178.00 177.82 2fy1 s SER 87 N -7.26 0.01 0.04 1.44 0.01 -1.26 -1.20 113.70 105.47 2fy1 s SER 87 Ca -0.05 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.73 2fy1 s SER 87 Cb 0.06 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.65 2fy1 s SER 87 CO 0.90 -0.70 0.00 0.33 0.41 0.00 0.00 173.24 174.18 2fy1 n PHE 88 N 0.14 -2.00 0.00 2.43 7.35 -1.26 -4.96 117.46 119.16 2fy1 n PHE 88 Ca -0.16 0.12 0.00 0.00 -0.76 0.00 0.00 57.45 56.65 2fy1 n PHE 88 Cb 0.62 0.74 0.00 0.00 0.35 0.00 0.00 39.48 41.18 2fy1 n PHE 88 CO 0.00 0.00 0.00 0.94 -0.76 0.00 0.00 176.76 176.94 2fy1 n GLN 89 N -2.59 1.32 -3.96 -4.13 7.27 -1.26 -5.11 117.38 108.92 2fy1 n GLN 89 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 57.00 56.93 2fy1 n GLN 89 Cb 0.00 -0.70 -0.02 0.00 2.41 0.00 0.00 30.24 31.93 2fy1 n GLN 89 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2fy1 n SER 90 N -1.25 -1.52 -4.75 1.69 2.88 -1.26 -5.11 113.62 104.29 2fy1 n SER 90 Ca 0.00 -2.86 -0.37 0.00 -1.33 0.00 0.00 58.87 54.32 2fy1 n SER 90 Cb 0.20 2.77 0.04 0.00 -0.75 0.00 0.00 64.21 66.48 2fy1 n SER 90 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2fy1 s GLY 91 N -3.17 2.82 0.55 0.46 0.00 -1.26 -4.47 107.32 102.25 2fy1 s GLY 91 Ca 0.27 1.15 0.29 0.00 0.00 0.00 0.00 44.72 46.43 2fy1 s GLY 91 CO 0.19 1.59 1.92 -1.33 0.00 0.00 0.00 173.10 175.47 2fy1 h GLY 92 N 0.97 0.00 1.90 0.20 0.00 -1.41 -2.17 103.07 102.57 2fy1 h GLY 92 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2fy1 h GLY 92 CO 0.55 0.00 0.05 -0.09 0.00 0.00 0.00 176.54 177.05 2fy1 h ARG 93 N 0.00 0.00 -4.22 4.80 2.43 -1.91 -3.44 114.38 112.03 2fy1 h ARG 93 Ca 0.33 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.36 2fy1 h ARG 93 Cb 1.41 0.00 -0.17 0.00 -0.42 0.00 0.00 29.97 30.79 2fy1 h ARG 93 CO -0.00 0.00 -0.69 -0.98 -1.51 0.00 0.00 179.97 176.79 2fy1 s ARG 94 N -4.19 0.56 -0.12 0.20 1.70 -0.82 -5.19 118.95 111.10 2fy1 s ARG 94 Ca -0.05 -1.08 -0.09 0.00 -0.47 0.00 0.00 55.73 54.04 2fy1 s ARG 94 Cb 0.13 0.14 0.04 0.00 -0.57 0.00 0.00 34.95 34.68 2fy1 s ARG 94 CO 0.40 -0.08 0.31 0.50 -1.08 0.00 0.00 175.30 175.35 2fy1 s ARG 95 N -3.29 0.33 0.84 3.89 6.06 -1.26 -4.64 118.95 120.87 2fy1 s ARG 95 Ca 0.02 0.51 -0.11 0.00 -2.50 0.00 0.00 55.73 53.64 2fy1 s ARG 95 Cb 0.03 0.07 0.09 0.00 0.06 0.00 0.00 34.95 35.21 2fy1 s ARG 95 CO -0.07 -0.09 1.10 -1.25 -2.50 0.00 0.00 175.30 172.49 2fy1 s PRO 96 N 0.61 1.74 0.59 5.12 0.04 -1.26 -5.03 135.00 136.80 2fy1 s PRO 96 Ca -0.04 1.12 -0.17 0.00 0.04 0.00 0.00 61.00 61.95 2fy1 s PRO 96 Cb -0.05 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 2fy1 s PRO 96 CO -0.04 -1.99 1.10 -1.25 0.04 0.00 0.00 177.00 174.86 2fy1 s PRO 97 N -4.86 3.20 0.29 0.56 0.04 -1.26 -5.08 135.00 127.89 2fy1 s PRO 97 Ca 0.63 1.45 -0.16 0.00 0.04 0.00 0.00 61.00 62.96 2fy1 s PRO 97 Cb -0.18 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.37 2fy1 s PRO 97 CO 0.57 -0.94 0.63 0.00 0.04 0.00 0.00 177.00 177.29 2fy1 s ALA 98 N -2.09 -0.63 -0.23 8.56 0.00 -1.26 -5.17 121.76 120.95 2fy1 s ALA 98 Ca 0.69 -0.69 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 2fy1 s ALA 98 Cb -0.21 0.92 0.12 0.00 0.00 0.00 0.00 23.12 23.96 2fy1 s ALA 98 CO 0.33 -0.94 0.37 0.45 0.00 0.00 0.00 175.76 175.96 2fy1 s SER 99 N -3.01 0.20 0.00 0.00 0.15 -1.26 -5.07 113.70 104.72 2fy1 s SER 99 Ca 0.17 0.37 0.12 0.00 0.70 0.00 0.00 55.95 57.31 2fy1 s SER 99 Cb -0.03 1.11 0.53 0.00 -1.71 0.00 0.00 66.02 65.91 2fy1 s SER 99 CO 0.10 -0.28 1.35 -1.20 1.20 0.00 0.00 173.24 174.40 2fy1 n SER 100 N 5.37 0.00 -3.50 5.45 7.64 -1.26 -4.83 113.62 122.49 2fy1 n SER 100 Ca -0.05 0.39 -0.30 0.00 1.01 0.00 0.00 58.87 59.91 2fy1 n SER 100 Cb 0.50 -0.44 0.28 0.00 -1.01 0.00 0.00 64.21 63.54 2fy1 n SER 100 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fy1 s ARG 101 N -2.87 -2.59 0.94 1.43 1.04 -1.26 -5.01 118.95 110.63 2fy1 s ARG 101 Ca 0.07 0.07 -0.13 0.00 -1.04 0.00 0.00 55.73 54.70 2fy1 s ARG 101 Cb 0.08 -1.42 0.01 0.00 -2.04 0.00 0.00 34.95 31.58 2fy1 s ARG 101 CO 0.20 -4.64 0.28 -1.71 -0.04 0.00 0.00 175.30 169.39 2fy1 n ASN 102 N -5.45 -2.49 -0.88 -2.89 5.15 -1.26 -4.82 115.26 102.62 2fy1 n ASN 102 Ca 0.13 0.33 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 2fy1 n ASN 102 Cb 0.60 -1.16 0.00 0.00 -0.53 0.00 0.00 39.78 38.69 2fy1 n ASN 102 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 2fy1 n ARG 103 N -1.18 0.34 -1.22 1.20 0.63 -1.26 -4.89 116.66 110.28 2fy1 n ARG 103 Ca 0.06 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.66 2fy1 n ARG 103 Cb 0.54 -1.29 0.11 0.00 0.45 0.00 0.00 32.46 32.27 2fy1 n ARG 103 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2fy1 s SER 104 N 0.60 3.85 0.91 6.15 1.04 -1.26 -5.04 113.70 119.94 2fy1 s SER 104 Ca 0.00 2.31 -0.12 0.00 0.48 0.00 0.00 55.95 58.62 2fy1 s SER 104 Cb 0.00 -2.58 0.14 0.00 0.10 0.00 0.00 66.02 63.68 2fy1 s SER 104 CO 0.00 -2.49 1.09 -2.16 0.98 0.00 0.00 173.24 170.66 2fy1 s PRO 105 N -4.14 1.11 0.19 4.02 0.04 -1.26 -5.10 135.00 129.86 2fy1 s PRO 105 Ca 0.72 0.81 -0.11 0.00 0.04 0.00 0.00 61.00 62.46 2fy1 s PRO 105 Cb -0.27 -1.79 -0.00 0.00 0.04 0.00 0.00 34.50 32.47 2fy1 s PRO 105 CO 0.49 -2.34 0.36 0.45 0.04 0.00 0.00 177.00 176.01 2fy1 s SER 106 N -3.38 -0.04 0.00 6.66 0.15 -1.26 -5.19 113.70 110.64 2fy1 s SER 106 Ca 0.64 -0.81 0.00 0.00 0.70 0.00 0.00 55.95 56.47 2fy1 s SER 106 Cb -0.18 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 2fy1 s SER 106 CO 0.57 -0.97 0.00 0.61 1.20 0.00 0.00 173.24 174.66 2fy1 n GLY 107 N -0.27 -1.33 0.00 9.45 0.00 -1.26 -5.28 105.19 106.50 2fy1 n GLY 107 Ca -0.07 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2fy1 n GLY 107 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06