#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yfl s LEU 2 N 0.00 3.47 0.23 4.03 1.02 -1.26 -4.59 118.68 121.57 1yfl s LEU 2 Ca 0.00 1.63 0.02 0.00 0.02 0.00 0.00 54.13 55.80 1yfl s LEU 2 Cb 0.00 -4.51 -0.03 0.00 0.02 0.00 0.00 46.19 41.67 1yfl s LEU 2 CO 0.00 -0.92 0.38 -0.83 0.02 0.00 0.00 176.35 175.01 1yfl s GLY 3 N -3.24 1.49 0.45 -3.19 0.00 -1.26 -4.66 107.32 96.92 1yfl s GLY 3 Ca 0.60 -1.03 0.11 0.00 0.00 0.00 0.00 44.72 44.40 1yfl s GLY 3 CO 0.39 -1.01 2.07 0.00 0.00 0.00 0.00 173.10 174.55 1yfl h ALA 4 N 1.52 1.78 -2.53 3.20 0.00 -1.60 -3.44 119.26 118.20 1yfl h ALA 4 Ca -0.50 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.25 1yfl h ALA 4 Cb 1.21 -0.08 -0.16 0.00 0.00 0.00 0.00 17.79 18.75 1yfl h ALA 4 CO 0.65 0.18 -0.48 0.96 0.00 0.00 0.00 179.25 180.55 1yfl s ILE 5 N -5.17 0.14 0.47 0.00 -4.36 -1.25 -4.33 121.20 106.69 1yfl s ILE 5 Ca -0.06 -1.15 -0.24 0.00 -0.26 0.00 0.00 60.65 58.94 1yfl s ILE 5 Cb 0.17 -1.06 -0.07 0.00 1.25 0.00 0.00 42.46 42.75 1yfl s ILE 5 CO 0.71 -0.63 1.29 0.00 0.24 0.00 0.00 174.94 176.54 1yfl s ALA 6 N -3.01 3.04 -0.25 2.27 0.00 -1.26 -4.84 121.76 117.72 1yfl s ALA 6 Ca -0.02 1.19 -0.18 0.00 0.00 0.00 0.00 51.96 52.95 1yfl s ALA 6 Cb 0.01 -3.49 0.07 0.00 0.00 0.00 0.00 23.12 19.71 1yfl s ALA 6 CO -0.06 -0.96 0.63 -0.47 0.00 0.00 0.00 175.76 174.89 1yfl s TYR 7 N -1.35 -0.83 -0.06 0.00 5.04 -1.26 -4.96 117.35 113.93 1yfl s TYR 7 Ca 0.63 1.82 -0.30 0.00 -2.44 0.00 0.00 57.07 56.78 1yfl s TYR 7 Cb -0.36 0.39 -0.05 0.00 0.35 0.00 0.00 41.96 42.29 1yfl s TYR 7 CO 0.45 -0.41 1.55 0.99 -1.34 0.00 0.00 175.55 176.79 1yfl s THR 8 N 0.96 3.68 0.00 4.34 2.01 -1.26 -1.43 115.64 123.94 1yfl s THR 8 Ca -0.05 0.88 0.00 0.00 0.31 0.00 0.00 61.69 62.83 1yfl s THR 8 Cb -0.05 -3.57 0.00 0.00 0.01 0.00 0.00 72.50 68.89 1yfl s THR 8 CO -0.09 -0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.39 1yfl n GLY 9 N 3.97 0.82 3.01 4.40 0.00 -1.26 -4.95 105.19 111.18 1yfl n GLY 9 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1yfl n GLY 9 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1yfl n ASN 10 N 0.00 -5.33 0.00 1.61 0.23 -0.51 -4.94 115.26 106.31 1yfl n ASN 10 Ca 0.00 0.14 0.00 0.00 -0.53 0.00 0.00 54.58 54.19 1yfl n ASN 10 Cb 0.00 -0.71 0.00 0.00 -2.08 0.00 0.00 39.78 36.99 1yfl n ASN 10 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1yfl n LYS 11 N 2.42 1.25 -0.04 -3.83 4.76 -1.26 -4.88 118.16 116.58 1yfl n LYS 11 Ca -0.02 -1.01 -0.00 0.00 -2.87 0.00 0.00 58.31 54.41 1yfl n LYS 11 Cb 0.60 -0.94 0.00 0.00 -1.84 0.00 0.00 35.03 32.85 1yfl n LYS 11 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1yfl n GLN 12 N -0.27 -0.03 0.03 1.97 6.02 -1.26 -0.38 117.38 123.47 1yfl n GLN 12 Ca 0.00 0.15 -0.13 0.00 -0.01 0.00 0.00 57.00 57.01 1yfl n GLN 12 Cb 0.18 -0.22 -0.09 0.00 1.02 0.00 0.00 30.24 31.13 1yfl n GLN 12 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1yfl h SER 13 N 0.00 -0.06 0.73 1.08 4.64 -1.89 -3.27 113.55 114.77 1yfl h SER 13 Ca 0.03 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1yfl h SER 13 Cb 0.05 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1yfl h SER 13 CO -0.09 0.28 0.00 0.18 -0.87 0.00 0.00 176.83 176.33 1yfl n LEU 14 N -4.96 0.31 -0.16 5.97 4.32 0.49 -3.75 117.00 119.22 1yfl n LEU 14 Ca -0.08 0.56 -0.03 0.00 -0.02 0.00 0.00 56.01 56.44 1yfl n LEU 14 Cb 0.20 -0.51 0.03 0.00 -1.62 0.00 0.00 43.42 41.52 1yfl n LEU 14 CO 0.33 -0.32 0.73 -0.07 -1.22 0.00 0.00 177.39 176.84 1yfl h LEU 15 N 0.00 -0.63 -0.13 2.23 3.38 -1.53 0.47 115.31 119.09 1yfl h LEU 15 Ca 0.00 0.17 0.02 0.00 0.09 0.00 0.00 57.88 58.15 1yfl h LEU 15 Cb 0.37 0.37 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 1yfl h LEU 15 CO 0.00 -0.21 -0.19 -0.65 0.09 0.00 0.00 178.44 177.48 1yfl h PRO 16 N -0.06 -0.14 -0.06 1.13 0.11 -1.81 0.73 132.00 131.91 1yfl h PRO 16 Ca 0.24 0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.38 1yfl h PRO 16 Cb 0.43 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.57 1yfl h PRO 16 CO -0.55 -0.09 0.13 1.49 -0.21 0.00 0.00 178.00 178.77 1yfl h GLU 17 N -0.14 0.00 0.00 1.05 4.57 -1.67 -1.16 114.58 117.23 1yfl h GLU 17 Ca 0.02 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.05 1yfl h GLU 17 Cb 0.21 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 1yfl h GLU 17 CO -0.20 0.00 -0.84 -0.07 -1.18 0.00 0.00 179.01 176.72 1yfl h LEU 18 N 0.00 0.00 -0.21 1.64 3.38 0.46 -3.29 115.31 117.28 1yfl h LEU 18 Ca 0.03 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.79 1yfl h LEU 18 Cb 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1yfl h LEU 18 CO -0.00 0.68 -0.92 0.11 0.09 0.00 0.00 178.44 178.40 1yfl h LYS 19 N 0.00 0.29 0.00 1.13 1.57 0.15 -3.12 116.57 116.59 1yfl h LYS 19 Ca -0.04 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1yfl h LYS 19 Cb 1.56 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.96 1yfl h LYS 19 CO 0.08 1.03 0.16 -1.13 -0.57 0.00 0.00 179.45 179.03 1yfl n SER 20 N -3.69 0.00 -0.00 0.86 3.41 -1.11 -0.32 113.62 112.77 1yfl n SER 20 Ca -0.05 0.24 0.01 0.00 -0.26 0.00 0.00 58.87 58.81 1yfl n SER 20 Cb 0.83 -0.24 -0.01 0.00 -0.26 0.00 0.00 64.21 64.53 1yfl n SER 20 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1yfl n HIS 21 N -1.20 0.00 -1.70 7.33 8.25 -1.18 -5.04 115.22 121.68 1yfl n HIS 21 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 1yfl n HIS 21 Cb 0.16 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 1yfl n HIS 21 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1yfl n PHE 22 N -1.14 2.67 -0.71 4.41 3.72 0.56 -4.99 117.46 121.97 1yfl n PHE 22 Ca 0.00 -0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1yfl n PHE 22 Cb 0.02 -2.69 0.00 0.00 -0.94 0.00 0.00 39.48 35.88 1yfl n PHE 22 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1yfl n PRO 23 N 4.61 -0.32 -3.19 -1.08 -0.04 -1.26 -5.06 135.00 128.67 1yfl n PRO 23 Ca 0.17 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.36 1yfl n PRO 23 Cb 0.35 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.79 1yfl n PRO 23 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1yfl s LYS 24 N -2.74 3.58 0.02 0.54 2.47 -1.26 -5.06 119.74 117.30 1yfl s LYS 24 Ca 0.00 -0.03 -0.28 0.00 -1.56 0.00 0.00 55.97 54.11 1yfl s LYS 24 Cb 0.00 -2.58 0.07 0.00 -1.46 0.00 0.00 37.83 33.85 1yfl s LYS 24 CO 0.00 0.10 0.64 1.52 0.16 0.00 0.00 175.35 177.77 1yfl s TYR 25 N -2.29 -0.60 -0.33 4.03 -0.85 -1.26 -4.69 117.35 111.35 1yfl s TYR 25 Ca 0.44 0.82 0.23 0.00 -0.52 0.00 0.00 57.07 58.03 1yfl s TYR 25 Cb -0.10 0.44 0.00 0.00 0.38 0.00 0.00 41.96 42.69 1yfl s TYR 25 CO 0.35 -0.68 1.00 0.09 -1.52 0.00 0.00 175.55 174.78 1yfl n ASN 26 N 0.48 0.67 -3.73 -0.18 3.02 0.72 -4.87 115.26 111.37 1yfl n ASN 26 Ca -0.18 0.15 -0.12 0.00 -0.03 0.00 0.00 54.58 54.39 1yfl n ASN 26 Cb 0.60 0.70 -0.11 0.00 -0.61 0.00 0.00 39.78 40.35 1yfl n ASN 26 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1yfl s ARG 27 N -3.33 0.38 -0.24 3.52 3.52 -1.25 -4.30 118.95 117.25 1yfl s ARG 27 Ca 0.00 0.58 -0.11 0.00 -0.13 0.00 0.00 55.73 56.07 1yfl s ARG 27 Cb 0.12 0.10 -0.05 0.00 -1.56 0.00 0.00 34.95 33.56 1yfl s ARG 27 CO 0.80 -0.09 0.18 0.12 -0.81 0.00 0.00 175.30 175.50 1yfl s PHE 28 N 0.64 3.32 -0.22 5.12 2.19 0.26 -0.01 117.98 129.28 1yfl s PHE 28 Ca -0.04 0.25 -0.06 0.00 0.33 0.00 0.00 56.93 57.42 1yfl s PHE 28 Cb -0.05 -2.29 -0.02 0.00 -1.31 0.00 0.00 43.02 39.35 1yfl s PHE 28 CO -0.04 0.05 0.02 0.08 1.83 0.00 0.00 175.22 177.16 1yfl s VAL 29 N 1.10 3.99 -0.98 3.12 1.01 0.14 -0.06 120.40 128.72 1yfl s VAL 29 Ca 0.08 -0.29 -0.04 0.00 0.00 0.00 0.00 61.98 61.73 1yfl s VAL 29 Cb -0.14 -2.83 0.25 0.00 0.00 0.00 0.00 36.38 33.66 1yfl s VAL 29 CO 0.05 0.40 0.93 -0.67 0.00 0.00 0.00 175.10 175.80 1yfl n ASP 30 N 4.54 4.73 -0.26 3.32 -0.08 0.41 0.05 116.55 129.27 1yfl n ASP 30 Ca -0.17 -3.12 0.01 0.00 -1.51 0.00 0.00 54.79 50.01 1yfl n ASP 30 Cb 0.51 -1.17 0.08 0.00 2.34 0.00 0.00 41.12 42.89 1yfl n ASP 30 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1yfl h LEU 31 N 6.15 -0.71 -7.70 -2.67 5.85 -1.73 0.13 115.31 114.63 1yfl h LEU 31 Ca 0.17 0.22 -0.66 0.00 0.84 0.00 0.00 57.88 58.46 1yfl h LEU 31 Cb 0.82 0.47 -0.39 0.00 0.37 0.00 0.00 40.66 41.92 1yfl h LEU 31 CO 0.93 -0.25 -0.74 -0.36 -0.34 0.00 0.00 178.44 177.68 1yfl s PHE 32 N -6.23 3.47 -0.04 1.25 0.40 -1.18 -3.90 117.98 111.75 1yfl s PHE 32 Ca -0.14 -2.71 0.06 0.00 -0.60 0.00 0.00 56.93 53.54 1yfl s PHE 32 Cb 0.21 -2.55 -0.10 0.00 0.51 0.00 0.00 43.02 41.10 1yfl s PHE 32 CO 0.75 -0.92 0.08 0.00 0.70 0.00 0.00 175.22 175.83 1yfl n GLY 34 N 2.37 0.52 0.34 0.00 0.00 -1.26 -1.16 105.19 106.00 1yfl n GLY 34 Ca -0.07 0.49 0.17 0.00 0.00 0.00 0.00 46.02 46.61 1yfl n GLY 34 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1yfl h GLY 35 N 0.00 0.00 -0.77 -0.02 0.00 -1.92 -3.46 103.07 96.90 1yfl h GLY 35 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 1yfl h GLY 35 CO 0.00 0.00 -0.19 1.04 0.00 0.00 0.00 176.54 177.39 1yfl n LEU 36 N -3.93 -0.96 -0.07 3.11 4.77 -0.31 -1.94 117.00 117.68 1yfl n LEU 36 Ca 0.02 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1yfl n LEU 36 Cb 0.35 -1.51 0.29 0.00 -2.33 0.00 0.00 43.42 40.21 1yfl n LEU 36 CO 0.29 -0.31 1.04 0.28 -1.33 0.00 0.00 177.39 177.36 1yfl h SER 37 N 0.00 0.62 0.00 -1.43 0.02 -1.83 -2.55 113.55 108.38 1yfl h SER 37 Ca -0.19 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1yfl h SER 37 Cb 0.82 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.20 1yfl h SER 37 CO 0.26 0.58 0.00 0.52 -1.14 0.00 0.00 176.83 177.05 1yfl n VAL 38 N -4.34 0.00 -0.17 2.27 0.31 -1.26 -4.26 118.33 110.89 1yfl n VAL 38 Ca 0.03 0.38 -0.04 0.00 -0.01 0.00 0.00 64.34 64.70 1yfl n VAL 38 Cb 0.17 -1.25 -0.04 0.00 -0.91 0.00 0.00 33.84 31.81 1yfl n VAL 38 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1yfl n SER 39 N -1.91 -0.42 0.04 4.52 7.64 -1.25 0.29 113.62 122.53 1yfl n SER 39 Ca 0.00 0.89 0.02 0.00 1.01 0.00 0.00 58.87 60.79 1yfl n SER 39 Cb 0.00 -0.18 0.10 0.00 -1.01 0.00 0.00 64.21 63.11 1yfl n SER 39 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1yfl n LEU 40 N -4.05 0.09 -1.99 -3.43 4.77 -0.96 -2.56 117.00 108.88 1yfl n LEU 40 Ca 0.01 0.37 -0.05 0.00 -0.03 0.00 0.00 56.01 56.31 1yfl n LEU 40 Cb 0.10 -0.35 0.06 0.00 -2.33 0.00 0.00 43.42 40.90 1yfl n LEU 40 CO -0.06 -0.40 0.11 0.59 -1.33 0.00 0.00 177.39 176.30 1yfl n ASN 41 N -1.50 2.37 -4.28 -1.43 3.02 0.86 -4.88 115.26 109.41 1yfl n ASN 41 Ca -0.00 -2.77 -0.29 0.00 -0.03 0.00 0.00 54.58 51.48 1yfl n ASN 41 Cb 0.24 -0.41 -0.07 0.00 -0.61 0.00 0.00 39.78 38.92 1yfl n ASN 41 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1yfl s VAL 42 N -3.12 0.66 -0.12 2.41 -7.23 -1.06 -5.00 120.40 106.95 1yfl s VAL 42 Ca 0.37 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.34 1yfl s VAL 42 Cb 0.37 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.10 1yfl s VAL 42 CO -0.05 0.00 0.56 0.20 -0.31 0.00 0.00 175.10 175.50 1yfl s ASN 43 N -3.73 6.76 0.96 4.85 0.01 -1.26 -5.04 114.94 117.48 1yfl s ASN 43 Ca 0.14 0.91 -0.11 0.00 -0.71 0.00 0.00 52.86 53.09 1yfl s ASN 43 Cb 0.01 -2.33 0.15 0.00 0.41 0.00 0.00 41.25 39.49 1yfl s ASN 43 CO 0.10 -0.07 1.00 0.61 -1.51 0.00 0.00 177.10 177.23 1yfl n GLY 44 N 3.31 -0.85 3.82 0.66 0.00 -1.26 -4.60 105.19 106.27 1yfl n GLY 44 Ca -0.05 -0.78 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 1yfl n GLY 44 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1yfl s PRO 45 N -4.44 3.77 -0.09 1.61 0.04 -1.26 -4.88 135.00 129.75 1yfl s PRO 45 Ca 0.65 1.09 0.01 0.00 0.04 0.00 0.00 61.00 62.79 1yfl s PRO 45 Cb -0.23 -2.10 0.02 0.00 0.04 0.00 0.00 34.50 32.22 1yfl s PRO 45 CO 0.60 -0.43 -0.12 0.08 0.04 0.00 0.00 177.00 177.18 1yfl s VAL 46 N -2.47 1.22 -0.57 -0.36 1.01 -0.28 -0.58 120.40 118.37 1yfl s VAL 46 Ca 0.61 -0.48 -0.14 0.00 0.00 0.00 0.00 61.98 61.97 1yfl s VAL 46 Cb -0.12 -1.14 0.14 0.00 0.00 0.00 0.00 36.38 35.26 1yfl s VAL 46 CO 0.30 0.38 0.51 -0.22 0.00 0.00 0.00 175.10 176.07 1yfl s LEU 47 N 0.99 6.16 -0.41 3.92 2.96 0.92 0.37 118.68 133.59 1yfl s LEU 47 Ca -0.08 -1.97 -0.21 0.00 -0.22 0.00 0.00 54.13 51.65 1yfl s LEU 47 Cb -0.15 -2.16 0.02 0.00 0.50 0.00 0.00 46.19 44.39 1yfl s LEU 47 CO -0.01 -0.78 0.68 0.00 -1.32 0.00 0.00 176.35 174.93 1yfl s ALA 48 N 1.31 3.37 0.01 5.97 0.00 0.24 -0.45 121.76 132.20 1yfl s ALA 48 Ca 0.06 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 51.05 1yfl s ALA 48 Cb -0.26 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.52 1yfl s ALA 48 CO 0.00 -1.68 -0.17 1.21 0.00 0.00 0.00 175.76 175.12 1yfl s ASN 49 N 1.97 3.81 -0.09 0.00 2.47 0.45 0.49 114.94 124.04 1yfl s ASN 49 Ca 0.25 -0.35 -0.20 0.00 0.42 0.00 0.00 52.86 52.98 1yfl s ASN 49 Cb -0.14 -0.67 0.05 0.00 -1.45 0.00 0.00 41.25 39.04 1yfl s ASN 49 CO 0.19 0.29 0.48 -0.62 -3.72 0.00 0.00 177.10 173.72 1yfl s ASP 50 N -1.13 -0.44 0.27 -4.21 -1.08 0.24 -0.80 116.67 109.52 1yfl s ASP 50 Ca 0.13 0.61 0.10 0.00 -0.52 0.00 0.00 52.55 52.86 1yfl s ASP 50 Cb -0.10 0.64 0.37 0.00 -1.46 0.00 0.00 42.92 42.36 1yfl s ASP 50 CO 0.03 -0.39 1.62 -0.29 0.52 0.00 0.00 175.17 176.66 1yfl h ILE 51 N 3.81 1.42 -0.76 4.11 2.10 -1.85 -3.21 117.51 123.14 1yfl h ILE 51 Ca -0.28 -2.04 -0.41 0.00 1.08 0.00 0.00 64.86 63.22 1yfl h ILE 51 Cb 1.17 2.09 -0.06 0.00 -1.09 0.00 0.00 36.82 38.92 1yfl h ILE 51 CO 0.32 0.58 1.12 -1.10 -1.08 0.00 0.00 178.15 177.99 1yfl s GLN 52 N -3.68 2.91 0.35 2.19 -0.21 -1.26 -4.68 119.66 115.28 1yfl s GLN 52 Ca -0.02 -0.84 0.16 0.00 0.02 0.00 0.00 55.36 54.68 1yfl s GLN 52 Cb 0.13 -5.22 1.08 0.00 1.00 0.00 0.00 33.01 30.01 1yfl s GLN 52 CO 0.77 -3.16 1.69 1.49 -2.12 0.00 0.00 175.29 173.96 1yfl h GLU 53 N 10.24 0.35 0.30 2.91 4.81 -1.87 -0.72 114.58 130.60 1yfl h GLU 53 Ca 0.18 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1yfl h GLU 53 Cb 0.98 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.25 1yfl h GLU 53 CO 1.29 0.23 -0.40 -1.35 -0.73 0.00 0.00 179.01 178.05 1yfl h PRO 54 N 0.36 -0.73 0.00 0.92 0.11 -1.98 0.53 132.00 131.22 1yfl h PRO 54 Ca 0.71 0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.85 1yfl h PRO 54 Cb 1.65 0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.93 1yfl h PRO 54 CO -0.51 -0.49 -0.06 0.82 -0.21 0.00 0.00 178.00 177.55 1yfl h ILE 55 N -0.76 0.69 0.05 4.15 2.04 -1.59 0.11 117.51 122.20 1yfl h ILE 55 Ca -0.01 -0.23 -0.23 0.00 1.00 0.00 0.00 64.86 65.38 1yfl h ILE 55 Cb 0.71 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1yfl h ILE 55 CO -0.12 0.06 -1.09 0.40 0.00 0.00 0.00 178.15 177.40 1yfl h ILE 56 N 0.00 1.61 -0.01 -0.67 1.08 -0.30 -2.98 117.51 116.24 1yfl h ILE 56 Ca -0.00 -3.21 -0.20 0.00 -0.39 0.00 0.00 64.86 61.06 1yfl h ILE 56 Cb 0.14 2.85 -0.01 0.00 -3.07 0.00 0.00 36.82 36.73 1yfl h ILE 56 CO 0.01 0.93 -0.87 -0.33 -0.69 0.00 0.00 178.15 177.19 1yfl h GLU 57 N 0.04 0.29 -0.50 2.37 4.39 0.89 -2.23 114.58 119.84 1yfl h GLU 57 Ca -0.06 -0.30 0.05 0.00 0.34 0.00 0.00 59.36 59.38 1yfl h GLU 57 Cb 1.83 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 30.53 1yfl h GLU 57 CO 0.16 1.00 0.33 1.98 -1.16 0.00 0.00 179.01 181.32 1yfl h MET 58 N 0.17 0.48 0.04 2.33 4.05 -0.82 0.16 114.93 121.35 1yfl h MET 58 Ca -0.05 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1yfl h MET 58 Cb 1.49 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 32.18 1yfl h MET 58 CO 0.14 0.32 -0.02 1.88 0.23 0.00 0.00 176.91 179.46 1yfl h TYR 59 N 0.50 -0.05 -0.85 1.39 0.05 -1.35 -1.14 116.97 115.51 1yfl h TYR 59 Ca 0.21 -0.00 0.21 0.00 0.05 0.00 0.00 58.73 59.20 1yfl h TYR 59 Cb 0.21 0.02 -0.13 0.00 1.01 0.00 0.00 36.73 37.84 1yfl h TYR 59 CO -0.00 0.61 0.28 0.87 -1.05 0.00 0.00 178.16 178.87 1yfl h LYS 60 N -0.85 0.28 0.00 4.88 1.57 -0.98 -2.41 116.57 119.06 1yfl h LYS 60 Ca -0.01 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1yfl h LYS 60 Cb 0.68 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1yfl h LYS 60 CO 0.01 0.19 0.00 -2.13 -0.57 0.00 0.00 179.45 176.95 1yfl n ARG 61 N -5.15 0.00 -0.12 3.15 3.00 0.53 -3.25 116.66 114.82 1yfl n ARG 61 Ca 0.20 0.19 0.10 0.00 -0.00 0.00 0.00 57.85 58.33 1yfl n ARG 61 Cb 0.62 -1.13 0.15 0.00 0.00 0.00 0.00 32.46 32.11 1yfl n ARG 61 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1yfl n LEU 62 N -1.07 0.03 -0.40 6.15 4.77 -0.44 -1.08 117.00 124.97 1yfl n LEU 62 Ca 0.00 0.26 0.34 0.00 -0.03 0.00 0.00 56.01 56.58 1yfl n LEU 62 Cb 0.00 -0.13 0.65 0.00 -2.33 0.00 0.00 43.42 41.61 1yfl n LEU 62 CO 0.00 -0.28 1.28 0.40 -1.33 0.00 0.00 177.39 177.47 1yfl h ILE 63 N 0.00 0.32 -0.00 -0.08 2.04 -1.44 -1.59 117.51 116.76 1yfl h ILE 63 Ca 0.19 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 66.00 1yfl h ILE 63 Cb 0.67 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1yfl h ILE 63 CO -0.06 0.03 -0.40 0.59 0.00 0.00 0.00 178.15 178.30 1yfl n ASN 64 N -4.46 0.72 -4.80 1.72 4.13 -0.24 -5.00 115.26 107.34 1yfl n ASN 64 Ca 0.31 -0.86 -0.29 0.00 1.68 0.00 0.00 54.58 55.42 1yfl n ASN 64 Cb 1.26 0.84 0.12 0.00 -1.54 0.00 0.00 39.78 40.46 1yfl n ASN 64 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1yfl s VAL 65 N -1.80 2.41 0.18 2.41 -7.23 -0.60 -5.07 120.40 110.70 1yfl s VAL 65 Ca 0.05 0.13 0.07 0.00 -1.81 0.00 0.00 61.98 60.43 1yfl s VAL 65 Cb 0.08 -2.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 1yfl s VAL 65 CO 0.37 -0.17 -0.14 -0.94 -0.31 0.00 0.00 175.10 173.91 1yfl s SER 66 N -4.00 2.35 0.45 4.85 1.04 -1.26 -4.99 113.70 112.14 1yfl s SER 66 Ca 0.63 -0.97 0.21 0.00 0.48 0.00 0.00 55.95 56.29 1yfl s SER 66 Cb -0.14 -0.10 1.18 0.00 0.10 0.00 0.00 66.02 67.05 1yfl s SER 66 CO 0.53 -0.19 1.86 -0.25 0.98 0.00 0.00 173.24 176.18 1yfl h TRP 67 N 2.80 0.42 -0.04 5.02 -0.00 -1.98 0.47 115.95 122.63 1yfl h TRP 67 Ca -0.38 0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 58.51 1yfl h TRP 67 Cb 1.21 -0.13 -0.00 0.00 -0.00 0.00 0.00 29.16 30.24 1yfl h TRP 67 CO 0.69 0.10 -0.02 0.22 -0.00 0.00 0.00 178.44 179.43 1yfl h ASP 68 N 0.31 0.10 -0.89 2.65 1.82 -1.98 0.23 116.42 118.65 1yfl h ASP 68 Ca 0.46 -0.42 0.16 0.00 -0.39 0.00 0.00 57.03 56.84 1yfl h ASP 68 Cb 1.30 -0.03 -0.16 0.00 0.68 0.00 0.00 39.33 41.12 1yfl h ASP 68 CO -0.14 0.50 -0.29 0.44 -1.61 0.00 0.00 179.24 178.14 1yfl h ASP 69 N -0.31 -1.05 0.59 2.28 3.32 -0.53 0.60 116.42 121.32 1yfl h ASP 69 Ca 0.01 0.28 -0.03 0.00 0.02 0.00 0.00 57.03 57.31 1yfl h ASP 69 Cb 0.46 0.62 -0.00 0.00 0.22 0.00 0.00 39.33 40.63 1yfl h ASP 69 CO 0.01 -0.30 -0.37 0.58 -1.72 0.00 0.00 179.24 177.44 1yfl h VAL 70 N -0.02 0.00 -0.95 -1.35 2.07 -0.63 -2.75 116.25 112.61 1yfl h VAL 70 Ca 0.39 0.00 0.22 0.00 0.82 0.00 0.00 66.70 68.12 1yfl h VAL 70 Cb 0.63 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.28 1yfl h VAL 70 CO -0.92 0.00 0.52 -0.07 0.02 0.00 0.00 177.57 177.12 1yfl h LEU 71 N -0.90 0.57 0.05 2.57 3.38 0.12 -2.08 115.31 119.02 1yfl h LEU 71 Ca -0.08 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1yfl h LEU 71 Cb 0.72 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1yfl h LEU 71 CO 0.07 0.11 -0.16 0.11 0.09 0.00 0.00 178.44 178.67 1yfl h LYS 72 N 0.56 -0.23 -1.44 1.13 1.57 0.34 -0.54 116.57 117.95 1yfl h LYS 72 Ca 0.59 0.02 0.42 0.00 -1.87 0.00 0.00 60.65 59.81 1yfl h LYS 72 Cb 1.05 0.05 -0.08 0.00 0.08 0.00 0.00 32.23 33.34 1yfl h LYS 72 CO -0.46 -0.15 1.01 0.28 -0.57 0.00 0.00 179.45 179.56 1yfl h VAL 73 N -0.24 0.25 0.41 0.50 2.07 -1.10 0.22 116.25 118.36 1yfl h VAL 73 Ca -0.00 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1yfl h VAL 73 Cb 0.23 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1yfl h VAL 73 CO -0.08 0.01 -0.20 0.40 0.02 0.00 0.00 177.57 177.73 1yfl h ILE 74 N 0.05 0.20 -0.49 4.57 2.04 -1.07 -2.45 117.51 120.35 1yfl h ILE 74 Ca 0.73 -0.64 0.10 0.00 1.00 0.00 0.00 64.86 66.05 1yfl h ILE 74 Cb 2.72 0.31 -0.10 0.00 -0.74 0.00 0.00 36.82 39.01 1yfl h ILE 74 CO -0.11 0.04 -0.26 0.11 0.00 0.00 0.00 178.15 177.94 1yfl h LYS 75 N -1.08 -0.15 -0.06 2.37 1.79 0.72 0.62 116.57 120.78 1yfl h LYS 75 Ca -0.06 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.44 1yfl h LYS 75 Cb 0.49 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.17 1yfl h LYS 75 CO 0.09 -0.10 0.33 0.37 -1.08 0.00 0.00 179.45 179.06 1yfl h GLN 76 N -0.15 0.00 -0.00 3.15 4.15 -0.70 0.21 115.11 121.77 1yfl h GLN 76 Ca 0.22 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.64 1yfl h GLN 76 Cb 0.50 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.19 1yfl h GLN 76 CO -0.58 0.00 -0.41 0.66 -1.93 0.00 0.00 178.83 176.56 1yfl n TYR 77 N -3.03 0.00 -3.73 3.99 4.02 0.13 -4.99 117.16 113.55 1yfl n TYR 77 Ca -0.01 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.64 1yfl n TYR 77 Cb 0.40 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.76 1yfl n TYR 77 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 1yfl n LYS 78 N -0.84 -5.99 -2.80 -0.72 0.00 0.17 -4.82 118.16 103.17 1yfl n LYS 78 Ca 0.03 0.68 -0.35 0.00 -0.00 0.00 0.00 58.31 58.67 1yfl n LYS 78 Cb 0.20 -5.53 -0.07 0.00 -0.00 0.00 0.00 35.03 29.64 1yfl n LYS 78 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1yfl s LEU 79 N -7.00 4.18 -0.18 -5.58 1.43 -1.15 -4.90 118.68 105.48 1yfl s LEU 79 Ca 0.37 1.78 -0.34 0.00 -1.03 0.00 0.00 54.13 54.90 1yfl s LEU 79 Cb -0.18 -4.22 0.14 0.00 0.03 0.00 0.00 46.19 41.96 1yfl s LEU 79 CO 0.79 -0.18 1.19 -0.55 0.23 0.00 0.00 176.35 177.83 1yfl s SER 80 N -1.84 -0.15 0.00 2.29 0.15 -1.26 -4.94 113.70 107.95 1yfl s SER 80 Ca 0.55 0.02 0.00 0.00 0.70 0.00 0.00 55.95 57.22 1yfl s SER 80 Cb -0.15 0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 1yfl s SER 80 CO 0.19 -0.25 0.00 2.29 1.20 0.00 0.00 173.24 176.68 1yfl n LYS 81 N -0.02 0.00 0.00 5.44 0.00 -1.26 0.33 118.16 122.64 1yfl n LYS 81 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 1yfl n LYS 81 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.61 1yfl n LYS 81 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1yfl n THR 82 N -2.27 0.70 -2.15 0.58 -2.24 -1.26 -3.29 114.28 104.35 1yfl n THR 82 Ca 0.00 -0.83 -0.42 0.00 -2.27 0.00 0.00 64.05 60.52 1yfl n THR 82 Cb 0.00 0.66 -0.00 0.00 -2.10 0.00 0.00 70.33 68.89 1yfl n THR 82 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1yfl n SER 83 N -0.35 4.37 -0.15 3.42 3.41 0.98 -4.80 113.62 120.49 1yfl n SER 83 Ca 0.00 -2.87 -0.10 0.00 -0.26 0.00 0.00 58.87 55.63 1yfl n SER 83 Cb 0.19 -1.70 -0.01 0.00 -0.26 0.00 0.00 64.21 62.44 1yfl n SER 83 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1yfl h LYS 84 N 6.90 0.82 0.02 4.33 3.11 -1.91 -2.56 116.57 127.27 1yfl h LYS 84 Ca 0.50 -0.28 -0.24 0.00 -2.81 0.00 0.00 60.65 57.82 1yfl h LYS 84 Cb 0.76 -0.06 0.01 0.00 -1.00 0.00 0.00 32.23 31.94 1yfl h LYS 84 CO 1.66 0.89 -1.01 0.93 -2.81 0.00 0.00 179.45 179.12 1yfl h GLU 85 N 0.66 0.46 -0.79 1.90 4.39 -1.99 -2.15 114.58 117.05 1yfl h GLU 85 Ca 0.12 -0.52 0.02 0.00 0.34 0.00 0.00 59.36 59.32 1yfl h GLU 85 Cb 0.55 0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 29.31 1yfl h GLU 85 CO 0.03 1.17 0.52 0.93 -1.16 0.00 0.00 179.01 180.50 1yfl h GLU 86 N 0.24 1.01 0.18 2.33 3.07 -1.87 -1.74 114.58 117.80 1yfl h GLU 86 Ca -0.10 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.69 1yfl h GLU 86 Cb 1.66 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 29.34 1yfl h GLU 86 CO 0.18 0.67 -0.09 0.35 -1.40 0.00 0.00 179.01 178.72 1yfl h PHE 87 N 1.04 -0.22 -1.90 4.33 3.57 -1.37 -2.65 116.94 119.73 1yfl h PHE 87 Ca 0.30 -0.01 0.55 0.00 3.53 0.00 0.00 57.97 62.34 1yfl h PHE 87 Cb -0.08 0.07 -0.08 0.00 2.79 0.00 0.00 35.95 38.66 1yfl h PHE 87 CO -0.00 -0.14 1.37 -0.07 -2.23 0.00 0.00 178.31 177.24 1yfl h LEU 88 N -0.27 0.00 0.32 0.59 3.38 -1.16 0.22 115.31 118.40 1yfl h LEU 88 Ca -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1yfl h LEU 88 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1yfl h LEU 88 CO 0.04 -0.00 -0.16 0.11 0.09 0.00 0.00 178.44 178.52 1yfl h LYS 89 N 0.00 -0.42 -1.25 1.13 1.57 -1.22 -2.51 116.57 113.87 1yfl h LYS 89 Ca 0.90 0.03 0.36 0.00 -1.87 0.00 0.00 60.65 60.07 1yfl h LYS 89 Cb 3.63 0.10 -0.06 0.00 0.08 0.00 0.00 32.23 35.97 1yfl h LYS 89 CO -0.01 -0.24 0.88 1.25 -0.57 0.00 0.00 179.45 180.76 1yfl h LEU 90 N -1.10 0.09 0.41 2.94 5.85 -0.28 0.27 115.31 123.49 1yfl h LEU 90 Ca -0.04 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1yfl h LEU 90 Cb 0.38 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1yfl h LEU 90 CO 0.07 0.00 -0.20 -0.09 -0.34 0.00 0.00 178.44 177.89 1yfl h ARG 91 N 0.07 -0.53 -0.85 1.25 2.43 -1.00 -2.09 114.38 113.65 1yfl h ARG 91 Ca 0.62 0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.95 1yfl h ARG 91 Cb 2.31 0.12 -0.14 0.00 -0.42 0.00 0.00 29.97 31.84 1yfl h ARG 91 CO -0.08 -0.35 -0.41 1.49 -1.51 0.00 0.00 179.97 179.11 1yfl h GLU 92 N -0.73 -0.07 -0.64 0.20 4.81 -0.13 0.44 114.58 118.46 1yfl h GLU 92 Ca -0.06 0.00 0.13 0.00 -0.13 0.00 0.00 59.36 59.31 1yfl h GLU 92 Cb 0.42 0.02 -0.11 0.00 0.63 0.00 0.00 28.75 29.71 1yfl h GLU 92 CO 0.09 -0.04 0.02 -0.44 -0.73 0.00 0.00 179.01 177.91 1yfl h ASP 93 N -0.07 -0.24 0.69 1.04 3.32 -0.96 0.82 116.42 121.02 1yfl h ASP 93 Ca 0.28 0.15 -0.03 0.00 0.02 0.00 0.00 57.03 57.45 1yfl h ASP 93 Cb 0.56 0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.38 1yfl h ASP 93 CO -0.88 -0.11 -0.36 0.22 -1.72 0.00 0.00 179.24 176.39 1yfl h TYR 94 N 0.13 -0.95 -1.30 4.55 3.20 0.48 0.42 116.97 123.50 1yfl h TYR 94 Ca 0.34 -0.02 0.39 0.00 3.14 0.00 0.00 58.73 62.58 1yfl h TYR 94 Cb 0.55 0.32 -0.10 0.00 1.54 0.00 0.00 36.73 39.04 1yfl h TYR 94 CO -0.36 -0.57 0.87 -0.91 -1.64 0.00 0.00 178.16 175.55 1yfl h ASN 95 N -0.97 0.23 0.00 -2.11 2.35 0.40 1.18 115.58 116.65 1yfl h ASN 95 Ca -0.09 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1yfl h ASN 95 Cb 0.76 0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.20 1yfl h ASN 95 CO 0.13 -0.07 -0.21 0.11 -1.65 0.00 0.00 177.43 175.74 1yfl h LYS 96 N 0.14 0.00 -0.04 0.81 1.57 -0.35 -3.40 116.57 115.31 1yfl h LYS 96 Ca 0.74 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 59.40 1yfl h LYS 96 Cb 2.39 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.68 1yfl h LYS 96 CO -0.29 0.00 -0.53 1.79 -0.57 0.00 0.00 179.45 179.86 1yfl h THR 97 N -0.94 1.37 -3.28 -0.16 1.35 -0.58 -3.47 112.91 107.21 1yfl h THR 97 Ca 0.00 -1.80 -0.37 0.00 -0.55 0.00 0.00 66.41 63.68 1yfl h THR 97 Cb 0.21 1.93 0.01 0.00 -1.73 0.00 0.00 68.15 68.58 1yfl h THR 97 CO 0.00 0.52 -0.51 0.54 -0.25 0.00 0.00 175.52 175.82 1yfl n ARG 98 N -3.92 -2.74 -2.61 4.72 5.12 0.40 -4.92 116.66 112.72 1yfl n ARG 98 Ca -0.02 0.88 -0.42 0.00 -1.93 0.00 0.00 57.85 56.37 1yfl n ARG 98 Cb 0.55 -5.49 -0.03 0.00 -1.16 0.00 0.00 32.46 26.33 1yfl n ARG 98 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1yfl s ASP 99 N -2.39 6.33 0.23 0.55 2.15 -1.26 -4.94 116.67 117.34 1yfl s ASP 99 Ca 0.11 -0.17 -0.07 0.00 0.43 0.00 0.00 52.55 52.85 1yfl s ASP 99 Cb -0.05 -2.54 0.38 0.00 -0.30 0.00 0.00 42.92 40.41 1yfl s ASP 99 CO 0.14 -1.58 1.31 -2.65 -0.17 0.00 0.00 175.17 172.22 1yfl n PRO 100 N 8.65 -0.08 -0.25 4.34 -0.02 -1.26 -0.61 135.00 145.76 1yfl n PRO 100 Ca 0.05 1.31 0.16 0.00 -2.02 0.00 0.00 63.50 63.01 1yfl n PRO 100 Cb 0.49 -1.96 0.46 0.00 -0.02 0.00 0.00 33.50 32.47 1yfl n PRO 100 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1yfl h LEU 101 N 0.00 0.50 -0.46 2.45 7.12 -1.92 -0.45 115.31 122.55 1yfl h LEU 101 Ca 0.40 0.05 -0.12 0.00 0.13 0.00 0.00 57.88 58.33 1yfl h LEU 101 Cb 0.61 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.68 1yfl h LEU 101 CO -0.86 0.22 -0.19 -0.07 -0.13 0.00 0.00 178.44 177.40 1yfl h LEU 102 N 0.51 0.96 -0.60 2.25 3.38 -1.28 -2.76 115.31 117.77 1yfl h LEU 102 Ca 0.47 -0.39 0.04 0.00 0.09 0.00 0.00 57.88 58.09 1yfl h LEU 102 Cb 1.01 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.45 1yfl h LEU 102 CO -0.20 1.14 0.34 0.25 0.09 0.00 0.00 178.44 180.06 1yfl h LEU 103 N 0.78 0.53 -1.38 1.67 5.85 -1.08 -0.98 115.31 120.69 1yfl h LEU 103 Ca 0.11 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.98 1yfl h LEU 103 Cb 0.76 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 1yfl h LEU 103 CO 0.06 0.36 0.54 0.22 -0.34 0.00 0.00 178.44 179.28 1yfl h TYR 104 N 0.66 0.72 0.05 1.25 3.20 -1.10 -1.61 116.97 120.13 1yfl h TYR 104 Ca 0.26 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.15 1yfl h TYR 104 Cb 0.11 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.15 1yfl h TYR 104 CO -0.07 0.28 -0.02 0.28 -1.64 0.00 0.00 178.16 176.98 1yfl h VAL 105 N 0.62 1.29 -0.73 1.81 2.07 -1.11 -3.34 116.25 116.87 1yfl h VAL 105 Ca 0.41 -1.59 0.11 0.00 0.82 0.00 0.00 66.70 66.45 1yfl h VAL 105 Cb 0.70 2.28 -0.13 0.00 -1.52 0.00 0.00 31.29 32.62 1yfl h VAL 105 CO -0.17 0.37 -0.39 -0.07 0.02 0.00 0.00 177.57 177.34 1yfl h LEU 106 N -0.83 -1.38 -1.02 2.57 3.38 -0.86 0.33 115.31 117.51 1yfl h LEU 106 Ca -0.01 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1yfl h LEU 106 Cb 0.66 0.67 -0.00 0.00 0.09 0.00 0.00 40.66 42.09 1yfl h LEU 106 CO 0.01 -0.30 0.66 -0.74 0.09 0.00 0.00 178.44 178.16 1yfl h HIS 107 N -0.12 0.00 0.00 1.13 -0.00 -1.42 1.23 115.15 115.97 1yfl h HIS 107 Ca 0.25 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.62 1yfl h HIS 107 Cb 0.56 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.97 1yfl h HIS 107 CO -0.75 0.00 -0.38 0.74 -0.00 0.00 0.00 177.93 177.55 1yfl h PHE 108 N 0.00 0.00 -0.01 5.26 0.04 -0.48 -3.35 116.94 118.40 1yfl h PHE 108 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1yfl h PHE 108 Cb 1.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.48 1yfl h PHE 108 CO 0.00 0.01 -0.03 0.72 -0.60 0.00 0.00 178.31 178.41 1yfl n HIS 109 N -2.95 0.00 -1.77 -0.55 8.25 0.41 -3.61 115.22 115.00 1yfl n HIS 109 Ca 0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.16 1yfl n HIS 109 Cb 0.54 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.70 1yfl n HIS 109 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1yfl s GLY 110 N -0.66 2.09 -0.25 -1.41 0.00 -0.55 -0.17 107.32 106.38 1yfl s GLY 110 Ca 0.07 0.47 -0.28 0.00 0.00 0.00 0.00 44.72 44.99 1yfl s GLY 110 CO 0.10 0.82 2.25 -0.12 0.00 0.00 0.00 173.10 176.14 1yfl s PHE 111 N -2.44 1.14 -1.46 1.90 2.19 -0.03 -0.86 117.98 118.43 1yfl s PHE 111 Ca 0.65 0.65 -0.06 0.00 0.33 0.00 0.00 56.93 58.51 1yfl s PHE 111 Cb -0.19 -3.89 0.01 0.00 -1.31 0.00 0.00 43.02 37.64 1yfl s PHE 111 CO 0.42 -3.94 0.73 0.43 1.83 0.00 0.00 175.22 174.69 1yfl n SER 112 N 12.17 -6.08 -2.53 6.13 7.64 -1.26 -2.48 113.62 127.22 1yfl n SER 112 Ca 0.31 -0.34 -0.10 0.00 1.01 0.00 0.00 58.87 59.74 1yfl n SER 112 Cb 0.46 -4.84 -0.00 0.00 -1.01 0.00 0.00 64.21 58.81 1yfl n SER 112 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1yfl n ASN 113 N -2.50 -3.19 -4.74 6.43 3.02 -0.04 -4.90 115.26 109.34 1yfl n ASN 113 Ca -0.08 0.22 -0.41 0.00 -0.03 0.00 0.00 54.58 54.29 1yfl n ASN 113 Cb 0.60 -2.74 -0.04 0.00 -0.61 0.00 0.00 39.78 36.99 1yfl n ASN 113 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1yfl s MET 114 N -5.10 4.64 -0.87 3.52 1.75 -1.04 -4.87 119.30 117.33 1yfl s MET 114 Ca 0.03 1.70 -0.00 0.00 -1.25 0.00 0.00 55.69 56.16 1yfl s MET 114 Cb -0.02 -3.26 0.23 0.00 2.84 0.00 0.00 34.83 34.62 1yfl s MET 114 CO 0.04 0.16 0.85 -0.89 -0.65 0.00 0.00 175.02 174.52 1yfl n ILE 115 N 2.04 3.12 -3.43 10.11 5.41 -1.26 -4.72 119.36 130.63 1yfl n ILE 115 Ca 0.01 -5.21 -0.38 0.00 1.00 0.00 0.00 62.75 58.17 1yfl n ILE 115 Cb 0.46 -2.29 -0.06 0.00 -0.71 0.00 0.00 39.64 37.03 1yfl n ILE 115 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1yfl s ARG 116 N -1.72 4.16 0.00 0.38 3.52 -1.26 -5.03 118.95 119.01 1yfl s ARG 116 Ca 0.30 0.37 0.04 0.00 -0.13 0.00 0.00 55.73 56.30 1yfl s ARG 116 Cb -0.02 -3.35 -0.01 0.00 -1.56 0.00 0.00 34.95 30.01 1yfl s ARG 116 CO -0.09 0.38 -0.12 0.42 -0.81 0.00 0.00 175.30 175.09 1yfl s ILE 117 N -0.07 0.93 0.40 4.11 1.01 -1.26 -2.01 121.20 124.30 1yfl s ILE 117 Ca 0.23 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 60.29 1yfl s ILE 117 Cb -0.15 -0.80 0.08 0.00 0.01 0.00 0.00 42.46 41.60 1yfl s ILE 117 CO 0.10 0.18 0.55 -0.46 0.00 0.00 0.00 174.94 175.31 1yfl n ASN 118 N 2.57 0.93 -0.07 3.58 0.23 -0.42 -4.84 115.26 117.25 1yfl n ASN 118 Ca -0.15 -1.74 -0.11 0.00 -0.53 0.00 0.00 54.58 52.05 1yfl n ASN 118 Cb 0.56 -0.34 -0.05 0.00 -2.08 0.00 0.00 39.78 37.87 1yfl n ASN 118 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 1yfl h ASP 119 N -0.22 -1.36 0.02 0.53 -0.00 -2.02 0.83 116.42 114.20 1yfl h ASP 119 Ca -0.18 0.20 0.00 0.00 -0.00 0.00 0.00 57.03 57.04 1yfl h ASP 119 Cb 0.72 0.58 0.00 0.00 -0.00 0.00 0.00 39.33 40.62 1yfl h ASP 119 CO 0.21 -0.39 0.00 0.29 -0.00 0.00 0.00 179.24 179.35 1yfl n LYS 120 N -5.42 0.22 -2.29 4.15 5.02 -1.26 -4.80 118.16 113.78 1yfl n LYS 120 Ca -0.02 0.04 -0.04 0.00 -2.02 0.00 0.00 58.31 56.26 1yfl n LYS 120 Cb 0.35 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 1yfl n LYS 120 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1yfl n GLY 121 N -0.54 0.35 3.73 0.72 0.00 0.29 -5.04 105.19 104.70 1yfl n GLY 121 Ca 0.05 -0.64 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 1yfl n GLY 121 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1yfl s ASN 122 N -2.90 5.39 -0.14 1.61 0.01 -1.25 -4.74 114.94 112.92 1yfl s ASN 122 Ca 0.04 0.07 -0.29 0.00 -0.71 0.00 0.00 52.86 51.96 1yfl s ASN 122 Cb -0.02 -1.48 -0.02 0.00 0.41 0.00 0.00 41.25 40.14 1yfl s ASN 122 CO 0.05 0.28 1.32 0.12 -1.51 0.00 0.00 177.10 177.36 1yfl s PHE 123 N -1.13 2.72 0.00 2.20 2.19 -1.26 -1.30 117.98 121.41 1yfl s PHE 123 Ca 0.21 0.88 0.00 0.00 0.33 0.00 0.00 56.93 58.35 1yfl s PHE 123 Cb -0.12 -3.57 0.00 0.00 -1.31 0.00 0.00 43.02 38.02 1yfl s PHE 123 CO 0.12 -2.04 0.87 0.25 1.83 0.00 0.00 175.22 176.25 1yfl n THR 124 N 5.35 0.75 -1.98 0.12 -2.24 -0.85 -4.96 114.28 110.45 1yfl n THR 124 Ca 0.14 -0.75 -0.41 0.00 -2.27 0.00 0.00 64.05 60.77 1yfl n THR 124 Cb 0.45 0.63 -0.02 0.00 -2.10 0.00 0.00 70.33 69.29 1yfl n THR 124 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1yfl s THR 125 N -0.75 2.49 0.85 4.28 2.01 -1.26 -4.98 115.64 118.28 1yfl s THR 125 Ca 0.00 0.46 -0.11 0.00 0.31 0.00 0.00 61.69 62.34 1yfl s THR 125 Cb 0.00 -3.29 0.10 0.00 0.01 0.00 0.00 72.50 69.32 1yfl s THR 125 CO 0.00 0.10 1.09 -2.84 -0.69 0.00 0.00 174.62 172.28 1yfl s PRO 126 N -1.36 1.66 0.70 4.92 0.02 -1.26 -4.79 135.00 134.89 1yfl s PRO 126 Ca 0.54 0.83 -0.16 0.00 0.02 0.00 0.00 61.00 62.23 1yfl s PRO 126 Cb -0.43 -1.85 0.02 0.00 0.02 0.00 0.00 34.50 32.26 1yfl s PRO 126 CO 0.52 -1.97 1.26 0.12 -0.33 0.00 0.00 177.00 176.61 1yfl s PHE 127 N -2.99 1.99 -0.07 6.54 5.36 -1.26 -0.85 117.98 126.70 1yfl s PHE 127 Ca 0.62 1.55 0.10 0.00 -0.96 0.00 0.00 56.93 58.24 1yfl s PHE 127 Cb -0.17 -3.62 0.15 0.00 -0.34 0.00 0.00 43.02 39.05 1yfl s PHE 127 CO 0.56 -2.89 1.07 0.41 -1.46 0.00 0.00 175.22 172.91 1yfl n GLY 128 N 0.75 3.85 3.97 13.12 0.00 0.77 -3.81 105.19 123.83 1yfl n GLY 128 Ca 0.15 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1yfl n GLY 128 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yfl n LYS 129 N -0.98 -2.27 -3.76 1.61 5.02 -1.26 -4.68 118.16 111.83 1yfl n LYS 129 Ca 0.09 0.33 -0.08 0.00 -2.02 0.00 0.00 58.31 56.63 1yfl n LYS 129 Cb 0.47 -4.12 -0.02 0.00 -0.02 0.00 0.00 35.03 31.35 1yfl n LYS 129 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1yfl s ARG 130 N -6.67 1.61 0.00 1.97 3.03 -1.21 -4.83 118.95 112.86 1yfl s ARG 130 Ca 0.13 -0.84 0.00 0.00 2.03 0.00 0.00 55.73 57.05 1yfl s ARG 130 Cb -0.06 0.58 0.00 0.00 -1.03 0.00 0.00 34.95 34.44 1yfl s ARG 130 CO 0.91 -0.73 0.00 -2.37 -1.13 0.00 0.00 175.30 171.98 1yfl n THR 131 N -0.44 0.00 -0.88 4.99 5.66 -1.24 -4.28 114.28 118.09 1yfl n THR 131 Ca -0.07 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.64 1yfl n THR 131 Cb 0.60 0.00 0.19 0.00 -1.55 0.00 0.00 70.33 69.57 1yfl n THR 131 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1yfl s ILE 132 N -2.32 2.26 0.28 1.09 -4.36 -1.26 -4.87 121.20 112.03 1yfl s ILE 132 Ca 0.00 0.09 -0.09 0.00 -0.26 0.00 0.00 60.65 60.38 1yfl s ILE 132 Cb 0.00 -2.34 0.04 0.00 1.25 0.00 0.00 42.46 41.41 1yfl s ILE 132 CO 0.00 -0.11 0.54 -0.46 0.24 0.00 0.00 174.94 175.15 1yfl n ASN 133 N -4.35 -1.57 0.00 4.36 2.04 -1.26 -5.01 115.26 109.47 1yfl n ASN 133 Ca 0.06 -2.20 0.00 0.00 -0.44 0.00 0.00 54.58 52.00 1yfl n ASN 133 Cb 0.55 2.64 0.00 0.00 -2.53 0.00 0.00 39.78 40.44 1yfl n ASN 133 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1yfl n LYS 134 N -0.39 0.00 -0.14 -3.83 5.02 -1.26 -0.01 118.16 117.54 1yfl n LYS 134 Ca -0.05 0.72 0.28 0.00 -2.02 0.00 0.00 58.31 57.24 1yfl n LYS 134 Cb 0.43 -1.12 0.66 0.00 -0.02 0.00 0.00 35.03 34.98 1yfl n LYS 134 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1yfl h ASN 135 N 0.00 0.00 -0.43 4.39 -0.26 -1.99 -2.73 115.58 114.56 1yfl h ASN 135 Ca 0.00 0.00 0.06 0.00 -0.56 0.00 0.00 56.30 55.80 1yfl h ASN 135 Cb 0.00 0.00 -0.09 0.00 -1.06 0.00 0.00 38.32 37.17 1yfl h ASN 135 CO 0.00 0.00 -0.53 0.28 -1.06 0.00 0.00 177.43 176.12 1yfl h SER 136 N 0.00 -1.79 0.28 5.81 0.02 -0.83 0.52 113.55 117.56 1yfl h SER 136 Ca 0.41 0.24 -0.13 0.00 -0.84 0.00 0.00 61.79 61.48 1yfl h SER 136 Cb 2.06 0.74 -0.01 0.00 0.14 0.00 0.00 62.40 65.33 1yfl h SER 136 CO -0.00 -0.39 -0.50 -0.08 -1.14 0.00 0.00 176.83 174.71 1yfl h GLU 137 N -0.37 0.25 -0.02 3.45 4.81 -1.61 0.92 114.58 122.01 1yfl h GLU 137 Ca 0.09 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1yfl h GLU 137 Cb 0.59 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 1yfl h GLU 137 CO -0.61 0.70 0.01 0.87 -0.73 0.00 0.00 179.01 179.26 1yfl h LYS 138 N 0.20 0.03 0.00 1.92 1.57 -1.35 0.75 116.57 119.68 1yfl h LYS 138 Ca 0.01 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1yfl h LYS 138 Cb 0.96 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.25 1yfl h LYS 138 CO 0.08 0.05 -0.07 0.00 -0.57 0.00 0.00 179.45 178.94 1yfl h ARG 139 N -0.00 -0.12 -0.30 3.15 3.08 0.17 -0.66 114.38 119.69 1yfl h ARG 139 Ca 0.01 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.11 1yfl h ARG 139 Cb 0.03 0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.03 1yfl h ARG 139 CO -0.00 -0.08 -0.53 0.35 -1.07 0.00 0.00 179.97 178.64 1yfl h PHE 140 N -0.13 -1.59 0.02 3.04 3.57 -0.05 -2.08 116.94 119.72 1yfl h PHE 140 Ca 0.03 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1yfl h PHE 140 Cb 0.16 0.73 -0.00 0.00 2.79 0.00 0.00 35.95 39.63 1yfl h PHE 140 CO -0.14 -0.50 -0.05 -0.91 -2.23 0.00 0.00 178.31 174.47 1yfl h ASN 141 N -0.46 -0.16 -0.97 0.41 -0.26 0.69 -2.33 115.58 112.50 1yfl h ASN 141 Ca 0.07 0.02 0.38 0.00 -0.56 0.00 0.00 56.30 56.21 1yfl h ASN 141 Cb 0.63 0.06 -0.15 0.00 -1.06 0.00 0.00 38.32 37.80 1yfl h ASN 141 CO -0.53 -0.06 0.56 1.57 -1.06 0.00 0.00 177.43 177.91 1yfl n HIS 142 N -2.74 0.90 0.43 1.19 -0.00 -0.27 0.52 115.22 115.24 1yfl n HIS 142 Ca -0.01 0.91 -0.18 0.00 0.46 0.00 0.00 57.72 58.90 1yfl n HIS 142 Cb 0.04 -1.32 -0.09 0.00 -0.12 0.00 0.00 29.99 28.50 1yfl n HIS 142 CO 0.00 0.00 0.00 0.35 0.46 0.00 0.00 176.34 177.15 1yfl h PHE 143 N 0.00 -1.00 -0.20 1.57 3.57 -0.84 -2.91 116.94 117.13 1yfl h PHE 143 Ca 0.75 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 62.28 1yfl h PHE 143 Cb 2.12 0.33 -0.01 0.00 2.79 0.00 0.00 35.95 41.19 1yfl h PHE 143 CO -0.01 -0.61 0.23 0.87 -2.23 0.00 0.00 178.31 176.56 1yfl h LYS 144 N -1.19 0.00 0.00 1.11 1.57 0.41 0.20 116.57 118.67 1yfl h LYS 144 Ca -0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1yfl h LYS 144 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.15 1yfl h LYS 144 CO 0.18 0.00 -0.51 1.04 -0.57 0.00 0.00 179.45 179.59 1yfl n GLN 145 N -3.75 0.11 0.00 3.15 6.02 -0.58 -4.41 117.38 117.93 1yfl n GLN 145 Ca 0.02 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 1yfl n GLN 145 Cb 0.35 -1.57 0.00 0.00 1.02 0.00 0.00 30.24 30.04 1yfl n GLN 145 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1yfl n ASN 146 N -1.73 3.50 0.21 1.08 4.13 -0.50 -4.77 115.26 117.18 1yfl n ASN 146 Ca 0.05 -0.09 0.14 0.00 1.68 0.00 0.00 54.58 56.37 1yfl n ASN 146 Cb 0.38 0.87 0.77 0.00 -1.54 0.00 0.00 39.78 40.26 1yfl n ASN 146 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1yfl n ASP 148 N -2.49 0.19 -1.73 0.00 5.75 -1.26 -1.74 116.55 115.27 1yfl n ASP 148 Ca -0.02 0.54 0.08 0.00 -0.01 0.00 0.00 54.79 55.38 1yfl n ASP 148 Cb 0.05 -0.58 0.38 0.00 -1.03 0.00 0.00 41.12 39.93 1yfl n ASP 148 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1yfl n LYS 149 N -1.71 4.29 -4.50 0.11 2.85 -0.82 -4.93 118.16 113.45 1yfl n LYS 149 Ca 0.04 -2.96 -0.26 0.00 -1.05 0.00 0.00 58.31 54.08 1yfl n LYS 149 Cb 0.23 -2.08 -0.13 0.00 -0.65 0.00 0.00 35.03 32.39 1yfl n LYS 149 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1yfl s ILE 150 N -2.30 1.77 -0.13 0.58 1.01 -0.71 -1.13 121.20 120.29 1yfl s ILE 150 Ca 0.52 -1.40 0.02 0.00 0.00 0.00 0.00 60.65 59.80 1yfl s ILE 150 Cb 0.37 -1.57 0.01 0.00 0.01 0.00 0.00 42.46 41.28 1yfl s ILE 150 CO 0.20 0.11 -0.20 -0.63 0.00 0.00 0.00 174.94 174.41 1yfl s ILE 151 N -0.96 1.90 -0.04 2.92 -1.09 0.16 -4.92 121.20 119.16 1yfl s ILE 151 Ca 0.08 -0.89 -0.18 0.00 -2.23 0.00 0.00 60.65 57.43 1yfl s ILE 151 Cb -0.09 -1.68 -0.05 0.00 -1.58 0.00 0.00 42.46 39.05 1yfl s ILE 151 CO 0.03 0.52 0.49 -0.36 -1.23 0.00 0.00 174.94 174.39 1yfl s PHE 152 N 0.80 3.64 -0.01 3.97 0.08 -1.26 -0.59 117.98 124.61 1yfl s PHE 152 Ca -0.08 1.02 0.03 0.00 0.12 0.00 0.00 56.93 58.02 1yfl s PHE 152 Cb -0.16 -2.49 -0.01 0.00 -0.57 0.00 0.00 43.02 39.80 1yfl s PHE 152 CO -0.01 0.38 -0.10 0.45 -0.10 0.00 0.00 175.22 175.84 1yfl s SER 153 N -0.18 1.19 -0.54 1.36 0.15 0.18 -4.94 113.70 110.92 1yfl s SER 153 Ca 0.27 -0.18 0.07 0.00 0.70 0.00 0.00 55.95 56.80 1yfl s SER 153 Cb -0.17 -0.13 0.30 0.00 -1.71 0.00 0.00 66.02 64.30 1yfl s SER 153 CO 0.13 0.12 0.78 -1.54 1.20 0.00 0.00 173.24 173.93 1yfl n SER 154 N 2.84 2.97 -4.43 5.45 3.41 -1.25 -0.59 113.62 122.02 1yfl n SER 154 Ca -0.14 -3.34 -0.22 0.00 -0.26 0.00 0.00 58.87 54.92 1yfl n SER 154 Cb 0.56 -0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 63.79 1yfl n SER 154 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1yfl s LEU 155 N -2.59 2.58 0.20 1.04 1.43 -1.21 -4.76 118.68 115.37 1yfl s LEU 155 Ca 0.42 -1.06 -0.31 0.00 -1.03 0.00 0.00 54.13 52.15 1yfl s LEU 155 Cb 0.23 -0.91 -0.10 0.00 0.03 0.00 0.00 46.19 45.43 1yfl s LEU 155 CO -0.08 -0.09 1.51 -2.28 0.23 0.00 0.00 176.35 175.64 1yfl s HIS 156 N -2.71 3.04 0.35 0.29 5.65 -1.26 -4.01 115.29 116.64 1yfl s HIS 156 Ca 0.28 0.81 0.17 0.00 0.25 0.00 0.00 55.06 56.57 1yfl s HIS 156 Cb -0.02 -3.88 1.21 0.00 -1.18 0.00 0.00 32.58 28.71 1yfl s HIS 156 CO 0.12 -3.08 1.61 0.27 -0.65 0.00 0.00 174.74 173.02 1yfl h PHE 157 N 6.00 0.82 0.00 3.88 -5.15 -1.96 0.71 116.94 121.25 1yfl h PHE 157 Ca -0.44 0.04 0.00 0.00 -0.20 0.00 0.00 57.97 57.37 1yfl h PHE 157 Cb 1.21 -0.19 0.00 0.00 0.22 0.00 0.00 35.95 37.19 1yfl h PHE 157 CO 0.63 -0.35 0.00 0.36 -2.00 0.00 0.00 178.31 176.95 1yfl n LYS 158 N -5.19 0.26 0.00 6.09 2.85 -1.26 -2.21 118.16 118.71 1yfl n LYS 158 Ca 0.35 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.61 1yfl n LYS 158 Cb 1.13 -1.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.51 1yfl n LYS 158 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1yfl n ASP 159 N -0.50 2.74 -4.72 -5.58 8.00 0.25 -4.98 116.55 111.75 1yfl n ASP 159 Ca 0.00 -0.01 -0.42 0.00 0.71 0.00 0.00 54.79 55.07 1yfl n ASP 159 Cb 0.00 0.57 -0.03 0.00 -0.02 0.00 0.00 41.12 41.64 1yfl n ASP 159 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1yfl s VAL 160 N -1.12 2.10 -0.16 2.53 1.01 -0.94 -4.91 120.40 118.91 1yfl s VAL 160 Ca 0.00 0.07 -0.16 0.00 0.00 0.00 0.00 61.98 61.88 1yfl s VAL 160 Cb 0.00 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 1yfl s VAL 160 CO 0.00 0.00 0.39 -1.59 0.00 0.00 0.00 175.10 173.91 1yfl s LYS 161 N 1.21 4.27 -0.10 2.72 0.00 -1.26 -5.03 119.74 121.55 1yfl s LYS 161 Ca 0.74 0.26 -0.18 0.00 0.00 0.00 0.00 55.97 56.80 1yfl s LYS 161 Cb -0.49 -3.46 -0.04 0.00 0.00 0.00 0.00 37.83 33.83 1yfl s LYS 161 CO 0.32 0.13 0.46 0.42 0.00 0.00 0.00 175.35 176.68 1yfl s ILE 162 N 0.78 5.17 0.48 3.79 -1.09 -1.26 -5.08 121.20 123.99 1yfl s ILE 162 Ca 0.21 0.93 -0.02 0.00 -2.23 0.00 0.00 60.65 59.54 1yfl s ILE 162 Cb -0.14 -3.80 -0.01 0.00 -1.58 0.00 0.00 42.46 36.93 1yfl s ILE 162 CO 0.07 0.36 0.73 -0.76 -1.23 0.00 0.00 174.94 174.11 1yfl s LEU 163 N 0.42 3.59 -0.07 2.97 1.43 -1.26 -5.03 118.68 120.73 1yfl s LEU 163 Ca 0.25 0.52 -0.29 0.00 -1.03 0.00 0.00 54.13 53.58 1yfl s LEU 163 Cb -0.15 -3.39 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 1yfl s LEU 163 CO 0.10 -0.72 0.99 -1.81 0.23 0.00 0.00 176.35 175.14 1yfl s ASP 164 N -4.20 7.28 0.00 2.29 1.01 -1.26 -3.65 116.67 118.14 1yfl s ASP 164 Ca 0.49 1.56 0.00 0.00 0.71 0.00 0.00 52.55 55.31 1yfl s ASP 164 Cb -0.10 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.27 1yfl s ASP 164 CO 0.41 -0.37 0.00 0.61 0.21 0.00 0.00 175.17 176.02 1yfl n GLY 165 N 3.03 0.95 3.84 0.21 0.00 -1.26 -5.03 105.19 106.93 1yfl n GLY 165 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 1yfl n GLY 165 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1yfl s ASP 166 N -1.59 5.32 -0.17 1.61 1.47 -1.24 -0.20 116.67 121.87 1yfl s ASP 166 Ca 0.00 -0.45 -0.05 0.00 1.18 0.00 0.00 52.55 53.23 1yfl s ASP 166 Cb 0.00 -1.05 -0.03 0.00 -0.34 0.00 0.00 42.92 41.50 1yfl s ASP 166 CO 0.00 -0.29 -0.01 0.12 0.68 0.00 0.00 175.17 175.67 1yfl s PHE 167 N -2.27 3.06 -0.20 2.11 5.36 0.99 -4.54 117.98 122.49 1yfl s PHE 167 Ca 0.39 -0.30 -0.12 0.00 -0.96 0.00 0.00 56.93 55.94 1yfl s PHE 167 Cb -0.06 -2.01 -0.05 0.00 -0.34 0.00 0.00 43.02 40.56 1yfl s PHE 167 CO 0.26 -0.07 0.22 0.54 -1.46 0.00 0.00 175.22 174.71 1yfl s VAL 168 N 0.55 5.34 -0.31 3.12 0.11 -1.08 0.29 120.40 128.42 1yfl s VAL 168 Ca -0.02 0.37 -0.04 0.00 -2.93 0.00 0.00 61.98 59.36 1yfl s VAL 168 Cb -0.14 -3.56 0.04 0.00 -1.53 0.00 0.00 36.38 31.19 1yfl s VAL 168 CO 0.02 0.37 0.04 -0.47 -3.33 0.00 0.00 175.10 171.74 1yfl s TYR 169 N 0.70 3.24 -0.18 1.54 5.04 0.11 -0.48 117.35 127.32 1yfl s TYR 169 Ca 0.12 -1.64 -0.08 0.00 -2.44 0.00 0.00 57.07 53.03 1yfl s TYR 169 Cb -0.13 -2.17 -0.04 0.00 0.35 0.00 0.00 41.96 39.97 1yfl s TYR 169 CO 0.03 -0.76 0.08 0.08 -1.34 0.00 0.00 175.55 173.64 1yfl s VAL 170 N 1.33 4.99 -0.46 3.14 1.01 0.27 -2.83 120.40 127.85 1yfl s VAL 170 Ca -0.03 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.05 1yfl s VAL 170 Cb -0.19 -3.25 0.24 0.00 0.00 0.00 0.00 36.38 33.18 1yfl s VAL 170 CO 0.00 0.47 0.75 -0.67 0.00 0.00 0.00 175.10 175.66 1yfl n ASP 171 N 3.36 -1.84 -3.51 3.32 2.03 -1.26 -0.91 116.55 117.74 1yfl n ASP 171 Ca -0.17 -3.08 -0.18 0.00 0.52 0.00 0.00 54.79 51.88 1yfl n ASP 171 Cb 0.52 0.96 0.11 0.00 -0.72 0.00 0.00 41.12 42.00 1yfl n ASP 171 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1yfl n PRO 172 N 1.60 -0.40 -1.83 -0.67 -0.04 -1.26 -4.77 135.00 127.62 1yfl n PRO 172 Ca 0.13 -1.63 -0.41 0.00 -0.04 0.00 0.00 63.50 61.56 1yfl n PRO 172 Cb 0.59 -0.70 -0.01 0.00 -0.04 0.00 0.00 33.50 33.34 1yfl n PRO 172 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1yfl s PRO 173 N -4.63 4.14 -0.37 0.54 0.02 -1.26 -4.91 135.00 128.52 1yfl s PRO 173 Ca 0.49 2.53 -0.27 0.00 0.02 0.00 0.00 61.00 63.77 1yfl s PRO 173 Cb -0.02 -2.99 0.02 0.00 0.02 0.00 0.00 34.50 31.53 1yfl s PRO 173 CO 0.33 -0.51 0.99 0.71 -0.33 0.00 0.00 177.00 178.19 1yfl s TYR 174 N -0.93 3.06 0.03 6.54 2.02 -1.26 -4.96 117.35 121.86 1yfl s TYR 174 Ca 0.54 0.86 -0.08 0.00 -0.37 0.00 0.00 57.07 58.03 1yfl s TYR 174 Cb -0.46 -3.77 -0.02 0.00 -0.40 0.00 0.00 41.96 37.31 1yfl s TYR 174 CO 0.59 -0.87 1.13 -0.07 -1.57 0.00 0.00 175.55 174.76 1yfl h LEU 175 N 10.23 -0.48 -1.89 -1.29 3.38 -1.91 -1.41 115.31 121.95 1yfl h LEU 175 Ca -0.22 0.07 0.26 0.00 0.09 0.00 0.00 57.88 58.07 1yfl h LEU 175 Cb 1.07 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.98 1yfl h LEU 175 CO 1.01 -0.08 0.66 0.16 0.09 0.00 0.00 178.44 180.28 1yfl h ILE 176 N -0.05 0.56 -2.65 1.22 3.07 -1.93 -3.42 117.51 114.31 1yfl h ILE 176 Ca 0.03 -0.03 -0.45 0.00 1.55 0.00 0.00 64.86 65.96 1yfl h ILE 176 Cb 0.12 0.47 0.06 0.00 -0.27 0.00 0.00 36.82 37.20 1yfl h ILE 176 CO -0.18 0.01 0.06 0.42 -1.05 0.00 0.00 178.15 177.41 1yfl s THR 177 N -5.07 2.44 -0.33 0.16 -4.23 -0.53 -4.93 115.64 103.15 1yfl s THR 177 Ca -0.06 -0.57 -0.01 0.00 -1.18 0.00 0.00 61.69 59.88 1yfl s THR 177 Cb 0.22 -2.87 0.13 0.00 1.34 0.00 0.00 72.50 71.32 1yfl s THR 177 CO 0.78 0.00 0.23 -0.69 -0.54 0.00 0.00 174.62 174.40 1yfl s VAL 178 N -2.97 -0.10 0.63 2.29 1.01 -1.26 -4.76 120.40 115.24 1yfl s VAL 178 Ca 0.61 -1.11 0.04 0.00 0.00 0.00 0.00 61.98 61.51 1yfl s VAL 178 Cb -0.09 -0.97 0.10 0.00 0.00 0.00 0.00 36.38 35.42 1yfl s VAL 178 CO 0.41 -0.76 0.87 0.00 0.00 0.00 0.00 175.10 175.63 1yfl s ALA 179 N 1.63 4.15 0.05 5.51 0.00 -1.26 -5.02 121.76 126.83 1yfl s ALA 179 Ca 0.14 -1.85 -0.27 0.00 0.00 0.00 0.00 51.96 49.98 1yfl s ALA 179 Cb -0.18 -1.78 -0.17 0.00 0.00 0.00 0.00 23.12 20.99 1yfl s ALA 179 CO -0.16 -1.10 1.53 0.22 0.00 0.00 0.00 175.76 176.25 1yfl h ASP 180 N -0.14 -0.34 0.00 0.00 3.58 -1.99 -3.06 116.42 114.47 1yfl h ASP 180 Ca -0.35 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.03 1yfl h ASP 180 Cb 1.28 0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.42 1yfl h ASP 180 CO 0.42 -0.13 0.01 0.00 -2.88 0.00 0.00 179.24 176.65 1yfl n TYR 181 N -5.21 0.00 0.75 0.28 0.18 -1.26 -2.10 117.16 109.80 1yfl n TYR 181 Ca -0.10 0.00 0.06 0.00 1.88 0.00 0.00 57.90 59.74 1yfl n TYR 181 Cb 0.22 -0.08 0.36 0.00 -0.38 0.00 0.00 39.34 39.46 1yfl n TYR 181 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 1yfl n ASN 182 N -1.02 0.00 0.18 9.48 5.03 -1.16 -0.87 115.26 126.90 1yfl n ASN 182 Ca 0.00 -0.33 0.14 0.00 0.87 0.00 0.00 54.58 55.26 1yfl n ASN 182 Cb 0.01 -0.03 0.53 0.00 -1.02 0.00 0.00 39.78 39.26 1yfl n ASN 182 CO 0.00 0.00 0.00 0.07 -1.83 0.00 0.00 177.26 175.50 1yfl h LYS 183 N 0.00 0.00 -0.02 3.52 2.10 -1.69 -0.81 116.57 119.67 1yfl h LYS 183 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1yfl h LYS 183 Cb 0.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 1yfl h LYS 183 CO 0.00 0.00 -0.07 1.19 -2.00 0.00 0.00 179.45 178.57 1yfl n PHE 184 N -2.57 0.00 -4.28 0.07 3.72 -0.05 -4.96 117.46 109.39 1yfl n PHE 184 Ca 0.02 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.19 1yfl n PHE 184 Cb 0.30 -0.01 -0.07 0.00 -0.94 0.00 0.00 39.48 38.76 1yfl n PHE 184 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 1yfl s TRP 185 N -2.08 2.73 0.14 1.38 -0.00 -0.31 -5.01 118.94 115.78 1yfl s TRP 185 Ca 0.30 -0.21 -0.25 0.00 -0.00 0.00 0.00 56.10 55.94 1yfl s TRP 185 Cb 0.20 -1.23 0.08 0.00 -0.00 0.00 0.00 33.47 32.52 1yfl s TRP 185 CO 0.35 0.60 1.03 -1.54 -0.00 0.00 0.00 176.95 177.39 1yfl s SER 186 N -3.55 -0.10 0.16 5.86 1.04 -1.26 -4.99 113.70 110.87 1yfl s SER 186 Ca 0.31 -0.46 -0.11 0.00 0.48 0.00 0.00 55.95 56.17 1yfl s SER 186 Cb -0.07 0.44 0.04 0.00 0.10 0.00 0.00 66.02 66.53 1yfl s SER 186 CO 0.20 -0.84 1.61 -0.33 0.98 0.00 0.00 173.24 174.85 1yfl h GLU 187 N 2.00 0.99 -0.49 4.02 5.08 -2.00 0.35 114.58 124.53 1yfl h GLU 187 Ca -0.26 -0.33 0.14 0.00 -1.00 0.00 0.00 59.36 57.91 1yfl h GLU 187 Cb 1.22 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 1yfl h GLU 187 CO 0.29 1.01 0.35 -0.44 -1.00 0.00 0.00 179.01 179.22 1yfl h ASP 188 N 0.86 0.00 0.13 1.42 3.32 -1.99 0.32 116.42 120.49 1yfl h ASP 188 Ca 0.15 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.02 1yfl h ASP 188 Cb 0.59 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.16 1yfl h ASP 188 CO 0.04 0.00 -0.82 -0.33 -1.72 0.00 0.00 179.24 176.40 1yfl h GLU 189 N 0.00 0.28 -1.00 3.56 4.39 -1.62 -2.80 114.58 117.39 1yfl h GLU 189 Ca 0.23 -0.48 0.15 0.00 0.34 0.00 0.00 59.36 59.60 1yfl h GLU 189 Cb 0.93 0.18 -0.09 0.00 -0.10 0.00 0.00 28.75 29.67 1yfl h GLU 189 CO -0.00 1.23 0.62 1.49 -1.16 0.00 0.00 179.01 181.19 1yfl h GLU 190 N -0.40 0.87 0.43 2.33 4.57 0.69 -1.45 114.58 121.61 1yfl h GLU 190 Ca -0.15 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 57.96 1yfl h GLU 190 Cb 1.62 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 30.02 1yfl h GLU 190 CO 0.14 0.57 -0.21 0.87 -1.18 0.00 0.00 179.01 179.20 1yfl h LYS 191 N 0.89 -0.56 -0.92 1.92 6.56 -0.46 -0.47 116.57 123.53 1yfl h LYS 191 Ca 0.53 0.04 0.20 0.00 -1.06 0.00 0.00 60.65 60.36 1yfl h LYS 191 Cb 0.66 0.13 -0.12 0.00 -0.57 0.00 0.00 32.23 32.33 1yfl h LYS 191 CO -0.30 -0.37 0.48 -0.44 -2.06 0.00 0.00 179.45 176.75 1yfl h ASP 192 N -0.62 0.51 0.15 0.86 3.32 -1.27 0.52 116.42 119.89 1yfl h ASP 192 Ca -0.06 0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1yfl h ASP 192 Cb 0.45 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1yfl h ASP 192 CO 0.10 0.11 -0.07 0.25 -1.72 0.00 0.00 179.24 177.91 1yfl h LEU 193 N 0.54 -0.17 -0.71 1.55 5.85 -1.21 0.13 115.31 121.29 1yfl h LEU 193 Ca 0.56 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 59.22 1yfl h LEU 193 Cb 0.98 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 1yfl h LEU 193 CO -0.46 -0.10 0.26 -0.07 -0.34 0.00 0.00 178.44 177.73 1yfl h LEU 194 N -0.21 1.00 0.36 2.25 3.38 0.89 0.42 115.31 123.40 1yfl h LEU 194 Ca -0.02 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1yfl h LEU 194 Cb 0.17 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1yfl h LEU 194 CO 0.03 0.92 -0.18 0.78 0.09 0.00 0.00 178.44 180.09 1yfl h ASN 195 N 1.03 -0.41 -0.28 -0.43 2.35 0.06 -1.92 115.58 115.98 1yfl h ASN 195 Ca 0.24 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1yfl h ASN 195 Cb 0.24 0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1yfl h ASN 195 CO -0.02 -0.10 0.18 0.25 -1.65 0.00 0.00 177.43 176.09 1yfl h LEU 196 N -0.75 0.34 -1.88 1.61 6.46 -0.68 0.40 115.31 120.81 1yfl h LEU 196 Ca -0.05 -0.01 0.01 0.00 -0.12 0.00 0.00 57.88 57.71 1yfl h LEU 196 Cb 0.51 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.35 1yfl h LEU 196 CO 0.08 0.26 0.11 -0.07 -0.62 0.00 0.00 178.44 178.19 1yfl h LEU 197 N 0.40 0.14 0.76 2.25 3.38 0.09 -0.68 115.31 121.64 1yfl h LEU 197 Ca 0.11 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1yfl h LEU 197 Cb -0.03 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.70 1yfl h LEU 197 CO -0.02 0.10 -0.36 0.44 0.09 0.00 0.00 178.44 178.69 1yfl h ASP 198 N 0.17 -0.86 -0.96 -0.43 3.32 0.58 -3.01 116.42 115.22 1yfl h ASP 198 Ca 0.06 0.03 0.22 0.00 0.02 0.00 0.00 57.03 57.36 1yfl h ASP 198 Cb 0.05 0.22 -0.18 0.00 0.22 0.00 0.00 39.33 39.64 1yfl h ASP 198 CO -0.01 -0.49 -0.15 -1.20 -1.72 0.00 0.00 179.24 175.66 1yfl n SER 199 N -5.41 -0.26 0.05 6.45 7.64 -0.62 0.19 113.62 121.66 1yfl n SER 199 Ca -0.13 1.64 0.09 0.00 1.01 0.00 0.00 58.87 61.48 1yfl n SER 199 Cb 0.40 -0.53 0.54 0.00 -1.01 0.00 0.00 64.21 63.61 1yfl n SER 199 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1yfl h LEU 200 N 0.00 0.26 -0.16 -3.43 3.38 -1.10 -1.98 115.31 112.27 1yfl h LEU 200 Ca 0.50 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.41 1yfl h LEU 200 Cb 0.87 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1yfl h LEU 200 CO -0.96 0.17 -0.14 -1.13 0.09 0.00 0.00 178.44 176.48 1yfl h ASN 201 N 0.30 0.40 -0.30 -0.43 -0.00 0.22 0.19 115.58 115.95 1yfl h ASN 201 Ca 0.15 -0.46 0.02 0.00 -0.00 0.00 0.00 56.30 56.01 1yfl h ASN 201 Cb 0.23 -0.11 -0.02 0.00 -0.00 0.00 0.00 38.32 38.42 1yfl h ASN 201 CO -0.03 0.78 0.20 0.44 -0.00 0.00 0.00 177.43 178.82 1yfl h ASP 202 N 0.02 0.28 -0.01 1.15 5.19 -1.02 0.42 116.42 122.46 1yfl h ASP 202 Ca 0.03 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1yfl h ASP 202 Cb 0.66 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.10 1yfl h ASP 202 CO 0.04 0.20 0.00 0.54 -3.12 0.00 0.00 179.24 176.89 1yfl n ARG 203 N -4.49 1.01 -2.24 3.56 1.74 -0.78 -4.84 116.66 110.62 1yfl n ARG 203 Ca 0.02 -0.02 -0.19 0.00 -0.77 0.00 0.00 57.85 56.89 1yfl n ARG 203 Cb 0.13 -1.04 -0.02 0.00 -1.02 0.00 0.00 32.46 30.51 1yfl n ARG 203 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yfl n GLY 204 N 0.54 -0.08 3.51 -0.13 0.00 0.15 -4.96 105.19 104.22 1yfl n GLY 204 Ca 0.02 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 1yfl n GLY 204 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yfl s ILE 205 N -2.92 5.01 0.38 -0.61 1.01 0.66 -4.93 121.20 119.81 1yfl s ILE 205 Ca 0.00 -0.17 -0.27 0.00 0.00 0.00 0.00 60.65 60.21 1yfl s ILE 205 Cb 0.00 -3.50 -0.10 0.00 0.01 0.00 0.00 42.46 38.87 1yfl s ILE 205 CO 0.00 0.11 1.34 -0.54 0.00 0.00 0.00 174.94 175.85 1yfl s LYS 206 N 1.69 4.12 0.04 2.79 -0.14 -1.26 -3.93 119.74 123.05 1yfl s LYS 206 Ca 0.06 2.25 -0.01 0.00 -1.36 0.00 0.00 55.97 56.91 1yfl s LYS 206 Cb -0.17 -2.90 -0.03 0.00 -1.68 0.00 0.00 37.83 33.05 1yfl s LYS 206 CO 0.09 -0.40 -0.03 -0.59 -0.76 0.00 0.00 175.35 173.66 1yfl s PHE 207 N -1.19 0.44 -0.06 3.18 -0.12 -1.26 -2.63 117.98 116.34 1yfl s PHE 207 Ca 0.53 -0.90 -0.00 0.00 -0.05 0.00 0.00 56.93 56.51 1yfl s PHE 207 Cb -0.40 -0.33 0.03 0.00 -0.63 0.00 0.00 43.02 41.69 1yfl s PHE 207 CO 0.53 -0.32 -0.01 0.20 -0.05 0.00 0.00 175.22 175.57 1yfl s GLY 208 N -2.46 0.43 -0.18 1.99 0.00 0.37 -3.03 107.32 104.45 1yfl s GLY 208 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.66 1yfl s GLY 208 CO -0.07 0.88 -0.08 -2.27 0.00 0.00 0.00 173.10 171.56 1yfl s LEU 209 N 1.55 1.93 0.03 0.66 2.96 0.42 0.95 118.68 127.17 1yfl s LEU 209 Ca -0.01 -0.77 -0.13 0.00 -0.22 0.00 0.00 54.13 53.00 1yfl s LEU 209 Cb -0.13 -1.07 -0.06 0.00 0.50 0.00 0.00 46.19 45.44 1yfl s LEU 209 CO -0.03 -0.16 0.40 -0.55 -1.32 0.00 0.00 176.35 174.68 1yfl s SER 210 N 1.52 6.73 -0.00 3.68 0.15 -0.09 -0.94 113.70 124.75 1yfl s SER 210 Ca -0.00 0.88 -0.28 0.00 0.70 0.00 0.00 55.95 57.25 1yfl s SER 210 Cb -0.16 -2.22 0.10 0.00 -1.71 0.00 0.00 66.02 62.03 1yfl s SER 210 CO -0.08 0.26 1.27 0.21 1.20 0.00 0.00 173.24 176.10 1yfl s ASN 211 N -1.36 -0.00 -0.04 5.45 3.84 -1.08 -4.43 114.94 117.32 1yfl s ASN 211 Ca 0.27 -0.22 0.07 0.00 0.21 0.00 0.00 52.86 53.19 1yfl s ASN 211 Cb -0.15 0.17 -0.02 0.00 -0.55 0.00 0.00 41.25 40.70 1yfl s ASN 211 CO 0.15 -0.34 -0.25 0.68 -2.79 0.00 0.00 177.10 174.55 1yfl s VAL 212 N -2.08 2.09 0.00 -5.21 -7.23 -1.26 -1.51 120.40 105.19 1yfl s VAL 212 Ca 0.27 -1.07 0.02 0.00 -1.81 0.00 0.00 61.98 59.39 1yfl s VAL 212 Cb 0.00 -1.74 -0.25 0.00 0.56 0.00 0.00 36.38 34.95 1yfl s VAL 212 CO -0.01 0.57 0.85 -0.07 -0.31 0.00 0.00 175.10 176.13 1yfl h LEU 213 N 5.80 0.23 -7.43 1.32 3.38 -1.80 -3.43 115.31 113.39 1yfl h LEU 213 Ca -0.37 -0.35 -0.19 0.00 0.09 0.00 0.00 57.88 57.06 1yfl h LEU 213 Cb 1.15 -0.08 -0.29 0.00 0.09 0.00 0.00 40.66 41.54 1yfl h LEU 213 CO 0.47 1.30 -0.50 -1.61 0.09 0.00 0.00 178.44 178.19 1yfl s GLU 214 N -2.62 0.20 -0.20 1.13 2.02 -1.26 -0.24 118.70 117.73 1yfl s GLU 214 Ca -0.07 0.41 -0.10 0.00 0.02 0.00 0.00 54.97 55.23 1yfl s GLU 214 Cb 0.08 -0.04 0.07 0.00 0.10 0.00 0.00 34.13 34.34 1yfl s GLU 214 CO 0.83 -0.11 0.46 -1.58 0.02 0.00 0.00 175.26 174.89 1yfl s HIS 215 N 0.81 -0.73 -1.52 1.61 2.46 -0.98 -0.68 115.29 116.25 1yfl s HIS 215 Ca -0.06 1.50 -0.05 0.00 0.47 0.00 0.00 55.06 56.92 1yfl s HIS 215 Cb -0.07 0.35 0.02 0.00 -0.13 0.00 0.00 32.58 32.74 1yfl s HIS 215 CO -0.05 -0.41 0.58 0.72 -2.47 0.00 0.00 174.74 173.12 1yfl n HIS 216 N 4.50 -1.94 0.00 3.88 8.25 -1.22 -3.40 115.22 125.29 1yfl n HIS 216 Ca -0.20 0.51 0.00 0.00 -0.26 0.00 0.00 57.72 57.77 1yfl n HIS 216 Cb 0.55 -4.26 0.00 0.00 1.12 0.00 0.00 29.99 27.40 1yfl n HIS 216 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1yfl n GLY 217 N -1.47 2.30 3.95 -1.41 0.00 -1.26 -5.06 105.19 102.24 1yfl n GLY 217 Ca -0.10 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 44.92 1yfl n GLY 217 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yfl s LYS 218 N 0.00 3.01 0.06 1.61 0.00 -1.22 -5.12 119.74 118.09 1yfl s LYS 218 Ca 0.00 -0.49 0.07 0.00 0.00 0.00 0.00 55.97 55.55 1yfl s LYS 218 Cb 0.00 -2.53 -0.03 0.00 0.00 0.00 0.00 37.83 35.27 1yfl s LYS 218 CO 0.00 -0.34 -0.18 -1.83 0.00 0.00 0.00 175.35 173.00 1yfl s GLU 219 N -4.60 1.09 -0.88 1.78 -1.05 -1.26 -2.31 118.70 111.47 1yfl s GLU 219 Ca 0.50 -0.96 -0.17 0.00 -0.15 0.00 0.00 54.97 54.18 1yfl s GLU 219 Cb -0.10 -1.21 0.16 0.00 -0.44 0.00 0.00 34.13 32.54 1yfl s GLU 219 CO 0.38 0.29 1.00 1.21 0.95 0.00 0.00 175.26 179.10 1yfl s ASN 220 N -1.47 6.65 -0.01 0.83 3.84 0.66 -4.87 114.94 120.57 1yfl s ASN 220 Ca 0.04 -2.20 -0.24 0.00 0.21 0.00 0.00 52.86 50.66 1yfl s ASN 220 Cb -0.09 -2.34 -0.19 0.00 -0.55 0.00 0.00 41.25 38.08 1yfl s ASN 220 CO 0.02 -0.92 1.23 0.74 -2.79 0.00 0.00 177.10 175.38 1yfl h THR 221 N 5.52 1.42 -0.96 -5.21 2.02 -1.97 0.39 112.91 114.12 1yfl h THR 221 Ca 0.12 -1.36 0.24 0.00 0.77 0.00 0.00 66.41 66.19 1yfl h THR 221 Cb 1.03 2.23 -0.18 0.00 -1.74 0.00 0.00 68.15 69.49 1yfl h THR 221 CO 1.00 0.37 -0.04 -0.07 0.37 0.00 0.00 175.52 177.15 1yfl h LEU 222 N -0.38 -0.56 0.00 2.58 4.07 -1.99 0.46 115.31 119.48 1yfl h LEU 222 Ca 0.00 0.27 -0.24 0.00 0.08 0.00 0.00 57.88 58.00 1yfl h LEU 222 Cb 0.63 0.50 -0.04 0.00 1.08 0.00 0.00 40.66 42.83 1yfl h LEU 222 CO 0.02 -0.33 -1.32 0.17 -1.08 0.00 0.00 178.44 175.89 1yfl h LEU 223 N 0.02 0.00 -1.52 1.67 -0.00 -1.97 -2.65 115.31 110.85 1yfl h LEU 223 Ca 0.55 0.00 0.16 0.00 -0.00 0.00 0.00 57.88 58.59 1yfl h LEU 223 Cb 1.06 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.66 1yfl h LEU 223 CO -0.92 0.94 0.54 0.50 -0.00 0.00 0.00 178.44 179.51 1yfl h LYS 224 N 0.00 0.44 0.00 0.17 3.64 0.21 0.93 116.57 121.96 1yfl h LYS 224 Ca -0.15 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.06 1yfl h LYS 224 Cb 1.85 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 33.55 1yfl h LYS 224 CO 0.10 0.29 -0.85 0.93 -2.27 0.00 0.00 179.45 177.64 1yfl h GLU 225 N 0.45 0.00 -0.95 1.90 5.08 -1.18 -3.37 114.58 116.52 1yfl h GLU 225 Ca 0.41 0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.96 1yfl h GLU 225 Cb 0.92 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.09 1yfl h GLU 225 CO -0.15 0.86 0.61 2.35 -1.00 0.00 0.00 179.01 181.69 1yfl h TRP 226 N -1.00 0.78 0.00 4.33 7.01 -1.08 -0.84 115.95 125.15 1yfl h TRP 226 Ca -0.22 0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.80 1yfl h TRP 226 Cb 1.11 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 27.93 1yfl h TRP 226 CO 0.10 0.20 0.16 0.66 -2.79 0.00 0.00 178.44 176.78 1yfl h SER 227 N 0.59 0.00 -0.07 2.65 4.64 0.74 -2.57 113.55 119.53 1yfl h SER 227 Ca 0.51 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.79 1yfl h SER 227 Cb 1.02 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1yfl h SER 227 CO -0.26 0.00 -0.12 0.11 -0.87 0.00 0.00 176.83 175.69 1yfl h LYS 228 N 0.00 0.21 -0.33 4.77 6.56 -1.34 -3.18 116.57 123.25 1yfl h LYS 228 Ca 0.00 -0.13 0.10 0.00 -1.06 0.00 0.00 60.65 59.56 1yfl h LYS 228 Cb 0.32 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 31.98 1yfl h LYS 228 CO 0.00 0.70 0.73 0.87 -2.06 0.00 0.00 179.45 179.69 1yfl h LYS 229 N -0.26 0.00 0.00 3.15 1.57 -1.63 -3.41 116.57 115.99 1yfl h LYS 229 Ca 0.01 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.64 1yfl h LYS 229 Cb 0.69 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 1yfl h LYS 229 CO 0.03 0.00 -0.12 0.66 -0.57 0.00 0.00 179.45 179.45 1yfl n TYR 230 N -3.07 0.10 -0.17 -1.35 4.01 -1.20 -5.12 117.16 110.35 1yfl n TYR 230 Ca 0.06 -0.67 0.00 0.00 -0.16 0.00 0.00 57.90 57.14 1yfl n TYR 230 Cb 0.85 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.86 1yfl n TYR 230 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1yfl n ASN 231 N -1.73 -0.22 -3.65 7.72 4.13 -0.02 -4.90 115.26 116.60 1yfl n ASN 231 Ca -0.02 -0.17 -0.02 0.00 1.68 0.00 0.00 54.58 56.05 1yfl n ASN 231 Cb 0.16 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.34 1yfl n ASN 231 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1yfl s VAL 232 N -0.28 0.00 -0.42 2.41 1.01 -1.25 -4.08 120.40 117.80 1yfl s VAL 232 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.06 1yfl s VAL 232 Cb 0.00 -1.00 0.27 0.00 0.00 0.00 0.00 36.38 35.65 1yfl s VAL 232 CO 0.00 0.00 0.69 0.29 0.00 0.00 0.00 175.10 176.08 1yfl n LYS 233 N 0.99 0.78 -1.18 2.72 5.02 -0.93 -4.94 118.16 120.63 1yfl n LYS 233 Ca -0.04 -2.75 -0.45 0.00 -2.02 0.00 0.00 58.31 53.05 1yfl n LYS 233 Cb 0.58 -1.33 -0.05 0.00 -0.02 0.00 0.00 35.03 34.20 1yfl n LYS 233 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1yfl n HIS 234 N 1.26 0.31 -0.01 2.13 8.25 -1.26 -4.08 115.22 121.82 1yfl n HIS 234 Ca 0.17 0.83 -0.01 0.00 -0.26 0.00 0.00 57.72 58.45 1yfl n HIS 234 Cb 0.59 -1.64 -0.02 0.00 1.12 0.00 0.00 29.99 30.03 1yfl n HIS 234 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1yfl n LEU 235 N 1.29 0.00 0.00 2.41 4.77 0.60 -4.97 117.00 121.10 1yfl n LEU 235 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1yfl n LEU 235 Cb 0.09 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1yfl n LEU 235 CO 0.48 0.05 0.00 -0.46 -1.33 0.00 0.00 177.39 176.12 1yfl n ASN 236 N -2.01 0.00 0.00 -1.43 0.23 -1.18 -4.90 115.26 105.97 1yfl n ASN 236 Ca -0.03 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.02 1yfl n ASN 236 Cb 0.50 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.20 1yfl n ASN 236 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1yfl n ASN 250 N 0.00 0.00 -1.89 0.53 5.15 -1.26 -5.00 115.26 112.79 1yfl n ASN 250 Ca 0.00 0.00 -0.27 0.00 -0.60 0.00 0.00 54.58 53.71 1yfl n ASN 250 Cb 0.00 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.21 1yfl n ASN 250 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1yfl n GLY 251 N 0.00 0.06 3.81 8.20 0.00 -1.26 -3.46 105.19 112.54 1yfl n GLY 251 Ca 0.00 0.40 -0.36 0.00 0.00 0.00 0.00 46.02 46.05 1yfl n GLY 251 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yfl s THR 252 N 1.09 5.08 -0.55 2.61 2.01 -1.26 -4.43 115.64 120.20 1yfl s THR 252 Ca 0.42 0.04 -0.20 0.00 0.31 0.00 0.00 61.69 62.25 1yfl s THR 252 Cb -0.59 -3.20 0.07 0.00 0.01 0.00 0.00 72.50 68.79 1yfl s THR 252 CO 0.32 0.61 0.70 -0.62 -0.69 0.00 0.00 174.62 174.94 1yfl s ASP 253 N -1.01 6.22 -0.19 3.53 2.15 0.14 -4.57 116.67 122.94 1yfl s ASP 253 Ca 0.15 -1.04 -0.23 0.00 0.43 0.00 0.00 52.55 51.86 1yfl s ASP 253 Cb -0.12 -2.32 -0.02 0.00 -0.30 0.00 0.00 42.92 40.17 1yfl s ASP 253 CO 0.04 -1.04 0.74 -1.83 -0.17 0.00 0.00 175.17 172.91 1yfl s GLU 254 N 2.87 4.25 0.29 4.34 -1.05 -1.26 -2.26 118.70 125.88 1yfl s GLU 254 Ca 0.16 0.83 0.04 0.00 -0.15 0.00 0.00 54.97 55.84 1yfl s GLU 254 Cb -0.20 -3.58 -0.06 0.00 -0.44 0.00 0.00 34.13 29.85 1yfl s GLU 254 CO 0.11 -0.31 0.04 0.14 0.95 0.00 0.00 175.26 176.19 1yfl s VAL 255 N 2.11 1.10 -0.30 1.83 -7.23 -0.57 0.22 120.40 117.57 1yfl s VAL 255 Ca 0.34 -2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.47 1yfl s VAL 255 Cb -0.16 -2.64 0.10 0.00 0.56 0.00 0.00 36.38 34.23 1yfl s VAL 255 CO 0.11 -0.10 0.10 -0.47 -0.31 0.00 0.00 175.10 174.43 1yfl s TYR 256 N -3.37 1.40 -0.11 2.82 5.04 -1.26 -2.62 117.35 119.26 1yfl s TYR 256 Ca 0.34 -1.51 -0.20 0.00 -2.44 0.00 0.00 57.07 53.27 1yfl s TYR 256 Cb 0.08 -1.51 -0.04 0.00 0.35 0.00 0.00 41.96 40.84 1yfl s TYR 256 CO 0.13 -0.85 0.56 0.42 -1.34 0.00 0.00 175.55 174.47 1yfl s ILE 257 N 1.72 5.13 0.38 3.14 1.01 -0.11 -2.18 121.20 130.29 1yfl s ILE 257 Ca 0.09 1.12 -0.16 0.00 0.00 0.00 0.00 60.65 61.70 1yfl s ILE 257 Cb -0.17 -3.89 0.05 0.00 0.01 0.00 0.00 42.46 38.46 1yfl s ILE 257 CO -0.26 0.28 0.78 0.72 0.00 0.00 0.00 174.94 176.46 1yfl s PHE 258 N 0.84 0.13 0.00 3.97 -0.71 -1.26 -0.44 117.98 120.51 1yfl s PHE 258 Ca 0.29 -0.78 0.00 0.00 -1.04 0.00 0.00 56.93 55.40 1yfl s PHE 258 Cb -0.16 0.81 0.00 0.00 -1.21 0.00 0.00 43.02 42.46 1yfl s PHE 258 CO 0.13 -1.55 0.31 0.27 -1.34 0.00 0.00 175.22 173.04