#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yfy n LEU 2 N 0.00 6.50 0.00 3.17 4.77 -1.26 -4.84 117.00 125.34 1yfy n LEU 2 Ca 0.00 -4.00 0.00 0.00 -0.03 0.00 0.00 56.01 51.98 1yfy n LEU 2 Cb 0.00 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 39.88 1yfy n LEU 2 CO 0.00 1.67 0.00 0.41 -1.33 0.00 0.00 177.39 178.14 1yfy n THR 3 N 0.78 0.00 -0.15 -5.08 -1.04 -1.26 0.26 114.28 107.79 1yfy n THR 3 Ca 0.47 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 62.41 1yfy n THR 3 Cb 0.55 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.09 1yfy n THR 3 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1yfy n TYR 4 N -2.77 0.71 -4.35 -1.42 4.01 -1.26 -4.98 117.16 107.10 1yfy n TYR 4 Ca 0.00 -1.16 0.00 0.00 -0.16 0.00 0.00 57.90 56.58 1yfy n TYR 4 Cb 0.00 -0.58 0.00 0.00 -0.31 0.00 0.00 39.34 38.45 1yfy n TYR 4 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yfy n GLY 5 N 0.58 -0.04 2.92 2.72 0.00 0.74 -4.85 105.19 107.27 1yfy n GLY 5 Ca 0.14 -0.85 -0.16 0.00 0.00 0.00 0.00 46.02 45.15 1yfy n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yfy n ALA 6 N 0.85 0.85 -1.13 4.61 0.00 -1.26 -4.80 120.51 119.63 1yfy n ALA 6 Ca 0.00 -1.61 -0.32 0.00 0.00 0.00 0.00 53.44 51.52 1yfy n ALA 6 Cb 0.00 0.50 0.11 0.00 0.00 0.00 0.00 19.45 20.06 1yfy n ALA 6 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1yfy s PRO 7 N -3.90 1.91 0.02 0.00 0.02 -1.26 -5.07 135.00 126.72 1yfy s PRO 7 Ca 0.40 1.43 -0.23 0.00 0.02 0.00 0.00 61.00 62.62 1yfy s PRO 7 Cb -0.03 -1.84 0.05 0.00 0.02 0.00 0.00 34.50 32.70 1yfy s PRO 7 CO 0.25 -1.94 0.52 -0.59 -0.33 0.00 0.00 177.00 174.91 1yfy s PHE 8 N -2.58 -0.43 0.11 6.54 -0.12 -1.26 -5.13 117.98 115.11 1yfy s PHE 8 Ca 0.66 0.56 -0.31 0.00 -0.05 0.00 0.00 56.93 57.79 1yfy s PHE 8 Cb -0.22 0.31 -0.09 0.00 -0.63 0.00 0.00 43.02 42.40 1yfy s PHE 8 CO 0.53 -0.60 1.62 1.21 -0.05 0.00 0.00 175.22 177.93 1yfy s ASN 9 N -1.72 6.60 0.02 1.98 3.84 -1.26 -4.92 114.94 119.47 1yfy s ASN 9 Ca -0.08 2.54 -0.18 0.00 0.21 0.00 0.00 52.86 55.35 1yfy s ASN 9 Cb -0.01 -2.58 -0.28 0.00 -0.55 0.00 0.00 41.25 37.83 1yfy s ASN 9 CO 0.01 -0.86 1.05 0.15 -2.79 0.00 0.00 177.10 174.67 1yfy h PHE 10 N 7.71 0.82 0.36 0.43 3.57 -2.00 -3.15 116.94 124.67 1yfy h PHE 10 Ca -0.43 -0.52 -0.01 0.00 3.53 0.00 0.00 57.97 60.55 1yfy h PHE 10 Cb 1.20 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.87 1yfy h PHE 10 CO 0.73 1.37 -0.26 -1.35 -2.23 0.00 0.00 178.31 176.56 1yfy h PRO 11 N 0.04 -0.59 -0.54 6.41 0.11 -1.99 -1.33 132.00 134.11 1yfy h PRO 11 Ca -0.15 0.04 0.06 0.00 0.11 0.00 0.00 66.00 66.05 1yfy h PRO 11 Cb 1.72 0.13 -0.09 0.00 0.11 0.00 0.00 31.00 32.87 1yfy h PRO 11 CO 0.19 -0.39 -0.56 -0.09 -0.21 0.00 0.00 178.00 176.94 1yfy h ARG 12 N -0.61 -0.30 -0.79 1.05 2.43 -1.99 0.78 114.38 114.96 1yfy h ARG 12 Ca -0.03 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.28 1yfy h ARG 12 Cb 0.52 0.07 -0.13 0.00 -0.42 0.00 0.00 29.97 30.01 1yfy h ARG 12 CO 0.01 -0.20 -0.40 2.35 -1.51 0.00 0.00 179.97 180.22 1yfy h TRP 13 N -0.31 -1.16 -0.78 2.20 7.01 -1.46 0.71 115.95 122.16 1yfy h TRP 13 Ca 0.09 0.09 0.13 0.00 2.11 0.00 0.00 58.89 61.31 1yfy h TRP 13 Cb 0.55 0.62 -0.09 0.00 -2.10 0.00 0.00 29.16 28.15 1yfy h TRP 13 CO -0.80 -0.40 0.38 0.82 -2.79 0.00 0.00 178.44 175.65 1yfy h ILE 14 N -0.10 0.76 -0.64 2.65 2.04 0.12 -0.24 117.51 122.09 1yfy h ILE 14 Ca 0.26 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.87 1yfy h ILE 14 Cb 0.56 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1yfy h ILE 14 CO -0.83 0.11 0.21 0.44 0.00 0.00 0.00 178.15 178.08 1yfy h ASP 15 N 0.58 0.90 0.16 1.72 3.32 0.25 -2.50 116.42 120.85 1yfy h ASP 15 Ca 0.41 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 1yfy h ASP 15 Cb 0.54 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1yfy h ASP 15 CO -0.34 0.83 -0.08 -0.33 -1.72 0.00 0.00 179.24 177.61 1yfy h GLU 16 N 0.94 -0.21 -1.16 3.56 5.08 0.54 -3.23 114.58 120.09 1yfy h GLU 16 Ca 0.21 0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.46 1yfy h GLU 16 Cb 0.25 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.48 1yfy h GLU 16 CO -0.01 0.23 0.16 0.72 -1.00 0.00 0.00 179.01 179.11 1yfy n HIS 17 N -4.93 0.72 0.27 4.33 8.25 -0.23 -4.19 115.22 119.44 1yfy n HIS 17 Ca -0.08 -0.95 0.16 0.00 -0.26 0.00 0.00 57.72 56.59 1yfy n HIS 17 Cb 0.27 -0.48 0.70 0.00 1.12 0.00 0.00 29.99 31.60 1yfy n HIS 17 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yfy h ALA 18 N 1.66 1.03 -0.00 -1.41 0.00 -1.47 -2.92 119.26 116.15 1yfy h ALA 18 Ca 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1yfy h ALA 18 Cb 1.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1yfy h ALA 18 CO 0.28 0.07 -0.45 -2.39 0.00 0.00 0.00 179.25 176.75 1yfy n HIS 19 N -3.20 0.00 1.10 0.00 1.44 -1.26 -3.87 115.22 109.42 1yfy n HIS 19 Ca -0.00 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.83 1yfy n HIS 19 Cb 0.30 -0.25 0.32 0.00 0.12 0.00 0.00 29.99 30.48 1yfy n HIS 19 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1yfy n LEU 20 N -1.42 2.30 -4.51 2.39 4.77 -1.10 -4.74 117.00 114.68 1yfy n LEU 20 Ca 0.06 -0.85 -0.42 0.00 -0.03 0.00 0.00 56.01 54.77 1yfy n LEU 20 Cb 0.34 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.33 1yfy n LEU 20 CO 0.34 0.43 1.19 -0.76 -1.33 0.00 0.00 177.39 177.25 1yfy s LEU 21 N -1.82 4.08 0.07 2.23 1.43 -1.25 -4.86 118.68 118.57 1yfy s LEU 21 Ca 0.34 -1.47 0.05 0.00 -1.03 0.00 0.00 54.13 52.02 1yfy s LEU 21 Cb 0.20 -2.49 -0.03 0.00 0.03 0.00 0.00 46.19 43.90 1yfy s LEU 21 CO 0.31 -1.39 -0.13 -0.54 0.23 0.00 0.00 176.35 174.82 1yfy s LYS 22 N 4.20 0.79 1.06 1.70 1.02 -1.26 -4.81 119.74 122.45 1yfy s LYS 22 Ca 0.37 -0.97 -0.12 0.00 0.02 0.00 0.00 55.97 55.28 1yfy s LYS 22 Cb -0.05 -0.72 0.23 0.00 -0.52 0.00 0.00 37.83 36.77 1yfy s LYS 22 CO -0.04 0.15 1.07 -2.14 -0.92 0.00 0.00 175.35 173.47 1yfy s PRO 23 N -1.89 -0.14 0.00 -1.68 0.02 -1.26 -0.37 135.00 129.68 1yfy s PRO 23 Ca -0.02 1.12 0.30 0.00 0.02 0.00 0.00 61.00 62.42 1yfy s PRO 23 Cb -0.09 -1.62 1.48 0.00 0.02 0.00 0.00 34.50 34.28 1yfy s PRO 23 CO 0.02 -3.28 2.01 -0.35 -0.33 0.00 0.00 177.00 175.07 1yfy n PRO 24 N -4.64 0.68 -0.02 5.54 -0.04 -1.26 -4.57 135.00 130.69 1yfy n PRO 24 Ca 0.06 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1yfy n PRO 24 Cb 0.53 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.43 1yfy n PRO 24 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1yfy n VAL 25 N -1.06 0.28 -0.99 0.52 0.31 -1.26 -3.74 118.33 112.39 1yfy n VAL 25 Ca 0.16 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1yfy n VAL 25 Cb 0.23 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 1yfy n VAL 25 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1yfy n GLY 26 N 2.26 0.10 0.00 2.92 0.00 0.50 -4.83 105.19 106.15 1yfy n GLY 26 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1yfy n GLY 26 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1yfy n ASN 27 N -0.78 -0.39 0.00 1.61 3.02 -1.26 -2.40 115.26 115.06 1yfy n ASN 27 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1yfy n ASN 27 Cb 0.39 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.56 1yfy n ASN 27 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1yfy n ARG 28 N -0.39 0.00 -2.49 3.52 3.00 -1.18 -4.53 116.66 114.58 1yfy n ARG 28 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.85 57.43 1yfy n ARG 28 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.43 1yfy n ARG 28 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 1yfy s GLN 29 N 0.00 4.50 -0.05 -0.14 0.74 -1.26 -1.12 119.66 122.32 1yfy s GLN 29 Ca 0.00 1.71 -0.19 0.00 0.05 0.00 0.00 55.36 56.93 1yfy s GLN 29 Cb 0.00 -3.34 -0.14 0.00 1.10 0.00 0.00 33.01 30.63 1yfy s GLN 29 CO 0.00 -0.13 0.76 0.28 -0.55 0.00 0.00 175.29 175.65 1yfy h VAL 30 N 4.31 0.66 -3.83 1.34 2.07 -0.17 -3.45 116.25 117.18 1yfy h VAL 30 Ca -0.42 -1.06 -0.68 0.00 0.82 0.00 0.00 66.70 65.36 1yfy h VAL 30 Cb 1.21 1.11 -0.28 0.00 -1.52 0.00 0.00 31.29 31.82 1yfy h VAL 30 CO 0.78 0.17 -0.82 0.26 0.02 0.00 0.00 177.57 177.98 1yfy s TRP 31 N -3.24 2.61 0.42 1.57 0.51 -1.26 -5.10 118.94 114.45 1yfy s TRP 31 Ca -0.11 -0.54 -0.00 0.00 -2.12 0.00 0.00 56.10 53.32 1yfy s TRP 31 Cb 0.00 -1.67 -0.02 0.00 -0.81 0.00 0.00 33.47 30.97 1yfy s TRP 31 CO 0.40 -0.10 0.64 -0.65 -0.51 0.00 0.00 176.95 176.73 1yfy s GLN 32 N -0.19 3.29 -1.49 4.98 -1.52 -1.26 -4.55 119.66 118.92 1yfy s GLN 32 Ca -0.01 -0.33 -0.01 0.00 -1.95 0.00 0.00 55.36 53.05 1yfy s GLN 32 Cb -0.13 -2.57 0.00 0.00 -0.22 0.00 0.00 33.01 30.09 1yfy s GLN 32 CO 0.03 -0.11 0.15 -0.25 -0.25 0.00 0.00 175.29 174.87 1yfy n ASP 33 N -2.00 0.38 -0.01 5.90 8.00 -1.26 -4.97 116.55 122.60 1yfy n ASP 33 Ca -0.01 -1.20 0.00 0.00 0.71 0.00 0.00 54.79 54.29 1yfy n ASP 33 Cb 0.57 -2.04 0.00 0.00 -0.02 0.00 0.00 41.12 39.63 1yfy n ASP 33 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1yfy n SER 34 N -2.89 1.39 -0.04 -2.24 3.41 -1.26 -5.09 113.62 106.90 1yfy n SER 34 Ca -0.32 -0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.21 1yfy n SER 34 Cb 0.69 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.61 1yfy n SER 34 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1yfy n ASP 35 N -0.01 0.75 -4.72 4.04 4.64 -1.26 -4.86 116.55 115.13 1yfy n ASP 35 Ca 0.00 0.09 -0.42 0.00 -1.38 0.00 0.00 54.79 53.08 1yfy n ASP 35 Cb 0.00 -0.23 -0.03 0.00 -1.04 0.00 0.00 41.12 39.82 1yfy n ASP 35 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 1yfy s PHE 36 N -2.15 3.51 -0.52 -0.67 2.99 -1.26 -1.87 117.98 118.01 1yfy s PHE 36 Ca -0.11 1.45 -0.08 0.00 0.00 0.00 0.00 56.93 58.19 1yfy s PHE 36 Cb 0.04 -3.34 0.13 0.00 0.00 0.00 0.00 43.02 39.86 1yfy s PHE 36 CO 0.14 -0.92 0.38 0.42 -0.00 0.00 0.00 175.22 175.25 1yfy s ILE 37 N 0.55 4.14 -0.63 0.64 1.01 0.56 -4.96 121.20 122.51 1yfy s ILE 37 Ca 0.54 -2.09 -0.20 0.00 0.00 0.00 0.00 60.65 58.90 1yfy s ILE 37 Cb -0.29 -3.71 0.09 0.00 0.01 0.00 0.00 42.46 38.56 1yfy s ILE 37 CO 0.31 -0.81 0.81 -0.69 0.00 0.00 0.00 174.94 174.57 1yfy s VAL 38 N 0.98 4.64 0.30 2.92 1.01 -1.26 -1.70 120.40 127.28 1yfy s VAL 38 Ca 0.09 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.35 1yfy s VAL 38 Cb -0.23 -4.57 -0.03 0.00 0.00 0.00 0.00 36.38 31.54 1yfy s VAL 38 CO -0.02 -1.26 0.21 0.42 0.00 0.00 0.00 175.10 174.44 1yfy s THR 39 N 3.17 3.80 -0.15 3.92 -4.23 -0.05 0.61 115.64 122.72 1yfy s THR 39 Ca 0.16 -1.48 -0.03 0.00 -1.18 0.00 0.00 61.69 59.17 1yfy s THR 39 Cb -0.21 -3.21 0.05 0.00 1.34 0.00 0.00 72.50 70.47 1yfy s THR 39 CO 0.07 -0.26 0.03 -0.69 -0.54 0.00 0.00 174.62 173.23 1yfy s VAL 40 N -2.26 0.38 -0.15 2.29 1.01 -0.27 -1.54 120.40 119.86 1yfy s VAL 40 Ca 0.37 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 1yfy s VAL 40 Cb -0.06 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 1yfy s VAL 40 CO 0.25 -0.05 0.04 -0.69 0.00 0.00 0.00 175.10 174.65 1yfy s VAL 41 N 1.94 4.61 0.52 2.92 1.01 -0.89 -3.12 120.40 127.39 1yfy s VAL 41 Ca 0.02 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1yfy s VAL 41 Cb -0.15 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 1yfy s VAL 41 CO -0.07 0.51 0.01 -0.83 0.00 0.00 0.00 175.10 174.72 1yfy s GLY 42 N -0.03 3.05 0.41 4.51 0.00 -1.01 -1.68 107.32 112.57 1yfy s GLY 42 Ca 0.05 -0.29 0.08 0.00 0.00 0.00 0.00 44.72 44.55 1yfy s GLY 42 CO 0.01 -2.20 0.26 -0.32 0.00 0.00 0.00 173.10 170.85 1yfy s GLY 43 N -3.89 2.21 0.04 0.20 0.00 -1.23 -4.41 107.32 100.25 1yfy s GLY 43 Ca 0.05 -1.99 -0.22 0.00 0.00 0.00 0.00 44.72 42.56 1yfy s GLY 43 CO 0.02 -1.80 0.65 -4.14 0.00 0.00 0.00 173.10 167.83 1yfy s PRO 44 N -4.00 4.36 0.11 2.90 0.02 -1.26 -3.89 135.00 133.24 1yfy s PRO 44 Ca 0.44 0.86 0.04 0.00 0.02 0.00 0.00 61.00 62.36 1yfy s PRO 44 Cb 0.00 -3.31 -0.04 0.00 0.02 0.00 0.00 34.50 31.17 1yfy s PRO 44 CO 0.25 0.44 0.07 0.54 -0.33 0.00 0.00 177.00 177.97 1yfy s ASN 45 N -0.49 5.37 -0.57 2.53 4.22 0.18 -4.39 114.94 121.79 1yfy s ASN 45 Ca 0.33 -0.11 0.03 0.00 -2.14 0.00 0.00 52.86 50.98 1yfy s ASN 45 Cb -0.20 -1.38 0.14 0.00 1.28 0.00 0.00 41.25 41.10 1yfy s ASN 45 CO 0.20 0.14 0.33 -2.28 -2.04 0.00 0.00 177.10 173.45 1yfy s HIS 46 N -1.49 3.29 -0.09 1.54 2.46 -1.25 -4.51 115.29 115.24 1yfy s HIS 46 Ca 0.29 -3.17 0.04 0.00 0.47 0.00 0.00 55.06 52.69 1yfy s HIS 46 Cb -0.11 -2.84 0.00 0.00 -0.13 0.00 0.00 32.58 29.50 1yfy s HIS 46 CO 0.21 -0.71 -0.22 1.03 -2.47 0.00 0.00 174.74 172.59 1yfy s ARG 47 N -0.53 2.73 -0.01 2.88 1.81 -1.26 -4.78 118.95 119.79 1yfy s ARG 47 Ca 0.19 -0.79 0.01 0.00 -1.72 0.00 0.00 55.73 53.42 1yfy s ARG 47 Cb -0.21 -2.10 0.02 0.00 -0.45 0.00 0.00 34.95 32.21 1yfy s ARG 47 CO -0.04 0.16 0.75 0.25 -0.68 0.00 0.00 175.30 175.75 1yfy n THR 48 N 3.53 0.45 -3.96 0.02 -2.24 -1.26 -4.92 114.28 105.89 1yfy n THR 48 Ca -0.20 -0.47 -0.23 0.00 -2.27 0.00 0.00 64.05 60.89 1yfy n THR 48 Cb 0.53 0.71 -0.05 0.00 -2.10 0.00 0.00 70.33 69.41 1yfy n THR 48 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1yfy s ASP 49 N -0.61 4.81 -0.20 3.42 1.47 -1.26 -4.86 116.67 119.44 1yfy s ASP 49 Ca 0.02 -0.77 0.01 0.00 1.18 0.00 0.00 52.55 52.99 1yfy s ASP 49 Cb 0.02 -0.70 0.05 0.00 -0.34 0.00 0.00 42.92 41.94 1yfy s ASP 49 CO 0.00 -0.41 -0.08 -0.31 0.68 0.00 0.00 175.17 175.05 1yfy s TYR 50 N -2.44 2.28 0.16 2.11 2.02 -0.25 -4.27 117.35 116.96 1yfy s TYR 50 Ca 0.41 -1.54 -0.30 0.00 -0.37 0.00 0.00 57.07 55.27 1yfy s TYR 50 Cb -0.02 -1.57 -0.07 0.00 -0.40 0.00 0.00 41.96 39.90 1yfy s TYR 50 CO 0.24 -0.73 1.03 -1.58 -1.57 0.00 0.00 175.55 172.94 1yfy s HIS 51 N 1.44 3.72 -0.68 2.71 5.65 0.27 -0.81 115.29 127.59 1yfy s HIS 51 Ca -0.02 1.71 0.04 0.00 0.25 0.00 0.00 55.06 57.04 1yfy s HIS 51 Cb -0.17 -3.16 0.32 0.00 -1.18 0.00 0.00 32.58 28.40 1yfy s HIS 51 CO -0.08 -0.18 1.08 -3.47 -0.65 0.00 0.00 174.74 171.44 1yfy n ASP 52 N 2.44 4.91 -4.67 9.88 2.03 0.21 -2.02 116.55 129.33 1yfy n ASP 52 Ca 0.02 -3.65 -0.45 0.00 0.52 0.00 0.00 54.79 51.24 1yfy n ASP 52 Cb 0.47 -0.70 -0.03 0.00 -0.72 0.00 0.00 41.12 40.15 1yfy n ASP 52 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1yfy n ASP 53 N -0.01 2.90 -0.35 1.67 4.64 -1.26 -2.63 116.55 121.51 1yfy n ASP 53 Ca 0.33 1.13 0.11 0.00 -1.38 0.00 0.00 54.79 54.97 1yfy n ASP 53 Cb 0.37 -1.44 0.46 0.00 -1.04 0.00 0.00 41.12 39.48 1yfy n ASP 53 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1yfy n PRO 54 N 2.39 1.47 -4.43 -0.67 -0.04 -1.26 0.10 135.00 132.56 1yfy n PRO 54 Ca 0.13 -0.70 -0.22 0.00 -0.04 0.00 0.00 63.50 62.67 1yfy n PRO 54 Cb 0.31 -1.37 -0.09 0.00 -0.04 0.00 0.00 33.50 32.31 1yfy n PRO 54 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1yfy s LEU 55 N -1.62 1.91 0.72 1.53 1.43 -1.26 -4.64 118.68 116.75 1yfy s LEU 55 Ca 0.32 -1.55 -0.11 0.00 -1.03 0.00 0.00 54.13 51.76 1yfy s LEU 55 Cb 0.16 -0.06 0.02 0.00 0.03 0.00 0.00 46.19 46.35 1yfy s LEU 55 CO 0.26 -0.83 1.07 -1.61 0.23 0.00 0.00 176.35 175.46 1yfy s GLU 56 N -3.80 2.71 -0.03 1.70 2.02 -1.26 -4.32 118.70 115.71 1yfy s GLU 56 Ca 0.31 0.94 -0.02 0.00 0.02 0.00 0.00 54.97 56.22 1yfy s GLU 56 Cb 0.05 -1.97 0.02 0.00 0.10 0.00 0.00 34.13 32.34 1yfy s GLU 56 CO 0.16 -1.26 0.07 -1.21 0.02 0.00 0.00 175.26 173.04 1yfy s GLU 57 N -5.04 0.04 0.04 1.61 2.02 -1.06 -4.53 118.70 111.78 1yfy s GLU 57 Ca 0.59 0.18 0.08 0.00 0.02 0.00 0.00 54.97 55.84 1yfy s GLU 57 Cb -0.15 -0.10 -0.03 0.00 0.10 0.00 0.00 34.13 33.95 1yfy s GLU 57 CO 0.55 -0.09 -0.23 0.12 0.02 0.00 0.00 175.26 175.63 1yfy s PHE 58 N 0.61 2.43 0.01 1.61 5.36 -0.24 0.06 117.98 127.83 1yfy s PHE 58 Ca -0.05 -0.34 -0.01 0.00 -0.96 0.00 0.00 56.93 55.57 1yfy s PHE 58 Cb -0.07 -1.43 -0.01 0.00 -0.34 0.00 0.00 43.02 41.18 1yfy s PHE 58 CO -0.02 0.18 0.00 -0.06 -1.46 0.00 0.00 175.22 173.87 1yfy s PHE 59 N -0.86 0.17 -0.24 10.12 2.99 -0.79 -0.30 117.98 129.07 1yfy s PHE 59 Ca 0.13 -0.34 -0.03 0.00 0.00 0.00 0.00 56.93 56.69 1yfy s PHE 59 Cb -0.10 -0.13 0.10 0.00 0.00 0.00 0.00 43.02 42.89 1yfy s PHE 59 CO 0.03 -0.16 0.21 -0.47 -0.00 0.00 0.00 175.22 174.83 1yfy s TYR 60 N -1.11 -0.17 -1.10 0.36 5.04 -0.97 -1.55 117.35 117.86 1yfy s TYR 60 Ca -0.12 -0.12 -0.23 0.00 -2.44 0.00 0.00 57.07 54.15 1yfy s TYR 60 Cb -0.07 -0.51 -0.12 0.00 0.35 0.00 0.00 41.96 41.60 1yfy s TYR 60 CO -0.00 -0.71 1.95 0.94 -1.34 0.00 0.00 175.55 176.38 1yfy n GLN 61 N 5.30 1.35 -0.24 4.97 -0.06 -0.35 -1.54 117.38 126.80 1yfy n GLN 61 Ca -0.05 -2.27 -0.11 0.00 -2.00 0.00 0.00 57.00 52.57 1yfy n GLN 61 Cb 0.47 -3.64 -0.08 0.00 -4.06 0.00 0.00 30.24 22.93 1yfy n GLN 61 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 1yfy h LEU 62 N 17.99 -1.85 -7.31 1.69 3.38 -1.76 -0.67 115.31 126.78 1yfy h LEU 62 Ca 0.21 0.27 -0.29 0.00 0.09 0.00 0.00 57.88 58.17 1yfy h LEU 62 Cb 0.91 0.80 -0.35 0.00 0.09 0.00 0.00 40.66 42.11 1yfy h LEU 62 CO 1.30 -0.33 -0.64 0.00 0.09 0.00 0.00 178.44 178.85 1yfy s ARG 63 N -5.66 0.03 0.00 1.13 1.70 -0.67 -4.38 118.95 111.10 1yfy s ARG 63 Ca -0.14 0.49 0.00 0.00 -0.47 0.00 0.00 55.73 55.61 1yfy s ARG 63 Cb 0.11 -0.27 0.00 0.00 -0.57 0.00 0.00 34.95 34.21 1yfy s ARG 63 CO 0.63 -0.27 0.00 0.41 -1.08 0.00 0.00 175.30 174.99 1yfy n GLY 64 N 5.01 0.16 3.14 3.88 0.00 -1.26 -0.34 105.19 115.78 1yfy n GLY 64 Ca -0.11 -2.29 -0.16 0.00 0.00 0.00 0.00 46.02 43.46 1yfy n GLY 64 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1yfy s ASN 65 N -2.20 1.41 0.07 1.61 0.01 -1.26 -2.39 114.94 112.19 1yfy s ASN 65 Ca 0.00 -0.64 -0.28 0.00 -0.71 0.00 0.00 52.86 51.23 1yfy s ASN 65 Cb 0.00 -0.02 0.09 0.00 0.41 0.00 0.00 41.25 41.73 1yfy s ASN 65 CO 0.00 -0.15 1.08 0.00 -1.51 0.00 0.00 177.10 176.52 1yfy s ALA 66 N -1.55 -1.88 0.33 0.60 0.00 -0.11 -4.53 121.76 114.61 1yfy s ALA 66 Ca -0.03 0.46 0.05 0.00 0.00 0.00 0.00 51.96 52.44 1yfy s ALA 66 Cb -0.08 0.49 -0.03 0.00 0.00 0.00 0.00 23.12 23.50 1yfy s ALA 66 CO 0.01 -1.00 0.21 1.52 0.00 0.00 0.00 175.76 176.50 1yfy s TYR 67 N -2.94 1.68 -0.17 0.00 1.13 -0.86 0.27 117.35 116.47 1yfy s TYR 67 Ca 0.12 -1.50 -0.03 0.00 -1.41 0.00 0.00 57.07 54.25 1yfy s TYR 67 Cb 0.01 -0.83 0.06 0.00 -1.10 0.00 0.00 41.96 40.10 1yfy s TYR 67 CO -0.01 -0.65 0.05 -0.51 -2.51 0.00 0.00 175.55 171.92 1yfy s LEU 68 N -3.41 0.78 0.33 -3.49 1.43 0.23 -0.79 118.68 113.77 1yfy s LEU 68 Ca 0.36 -0.63 -0.26 0.00 -1.03 0.00 0.00 54.13 52.56 1yfy s LEU 68 Cb 0.03 -0.44 -0.10 0.00 0.03 0.00 0.00 46.19 45.72 1yfy s LEU 68 CO 0.21 -0.31 0.98 0.20 0.23 0.00 0.00 176.35 177.66 1yfy s ASN 69 N 1.98 7.24 0.25 2.29 0.01 -1.06 0.15 114.94 125.80 1yfy s ASN 69 Ca 0.01 1.93 -0.14 0.00 -0.71 0.00 0.00 52.86 53.94 1yfy s ASN 69 Cb -0.16 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 38.91 1yfy s ASN 69 CO -0.08 -0.14 0.52 -0.76 -1.51 0.00 0.00 177.10 175.14 1yfy s LEU 70 N -2.04 0.21 -0.32 0.60 1.43 -1.21 -1.73 118.68 115.61 1yfy s LEU 70 Ca 0.50 -0.86 -0.05 0.00 -1.03 0.00 0.00 54.13 52.70 1yfy s LEU 70 Cb -0.21 1.96 0.04 0.00 0.03 0.00 0.00 46.19 48.00 1yfy s LEU 70 CO 0.27 -1.18 0.07 0.26 0.23 0.00 0.00 176.35 176.00 1yfy s TRP 71 N -4.00 3.24 0.01 0.29 0.52 -1.24 0.13 118.94 117.89 1yfy s TRP 71 Ca 0.20 -1.49 -0.25 0.00 0.02 0.00 0.00 56.10 54.58 1yfy s TRP 71 Cb -0.02 -2.23 -0.15 0.00 -1.15 0.00 0.00 33.47 29.93 1yfy s TRP 71 CO 0.08 -0.73 1.09 -0.24 0.02 0.00 0.00 176.95 177.17 1yfy h VAL 72 N 6.21 0.15 0.00 4.03 3.04 -1.69 -3.41 116.25 124.58 1yfy h VAL 72 Ca -0.24 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.07 1yfy h VAL 72 Cb 1.08 0.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 1yfy h VAL 72 CO 0.59 0.02 -0.15 0.47 -1.01 0.00 0.00 177.57 177.49 1yfy n ASP 73 N -5.33 0.75 0.00 3.17 8.00 -1.26 -4.87 116.55 117.01 1yfy n ASP 73 Ca -0.11 -0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.22 1yfy n ASP 73 Cb 0.34 0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.93 1yfy n ASP 73 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yfy n GLY 74 N 0.71 -0.09 3.30 0.44 0.00 -1.26 -5.14 105.19 103.15 1yfy n GLY 74 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1yfy n GLY 74 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1yfy s ARG 75 N 0.00 3.26 0.46 1.61 3.03 -1.26 -5.07 118.95 120.98 1yfy s ARG 75 Ca 0.00 -0.74 -0.23 0.00 2.03 0.00 0.00 55.73 56.79 1yfy s ARG 75 Cb 0.00 -2.58 -0.10 0.00 -1.03 0.00 0.00 34.95 31.25 1yfy s ARG 75 CO 0.00 0.12 0.97 0.54 -1.13 0.00 0.00 175.30 175.80 1yfy n ARG 76 N 3.76 1.22 0.00 3.89 1.74 -1.26 -1.88 116.66 124.13 1yfy n ARG 76 Ca -0.19 0.44 0.00 0.00 -0.77 0.00 0.00 57.85 57.34 1yfy n ARG 76 Cb 0.52 -2.03 0.00 0.00 -1.02 0.00 0.00 32.46 29.93 1yfy n ARG 76 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1yfy n GLU 77 N -0.04 0.00 -3.35 5.56 -0.58 0.12 -4.83 120.64 117.53 1yfy n GLU 77 Ca 0.10 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 56.86 1yfy n GLU 77 Cb 0.41 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 31.24 1yfy n GLU 77 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 1yfy s ARG 78 N 1.01 0.18 -0.13 3.49 3.52 -1.25 -3.35 118.95 122.41 1yfy s ARG 78 Ca 0.00 0.44 -0.07 0.00 -0.13 0.00 0.00 55.73 55.97 1yfy s ARG 78 Cb 0.00 0.24 -0.04 0.00 -1.56 0.00 0.00 34.95 33.59 1yfy s ARG 78 CO 0.00 -0.06 0.10 0.00 -0.81 0.00 0.00 175.30 174.53 1yfy s ALA 79 N 2.13 3.67 -0.25 6.12 0.00 0.12 -4.90 121.76 128.65 1yfy s ALA 79 Ca -0.02 -0.69 -0.08 0.00 0.00 0.00 0.00 51.96 51.16 1yfy s ALA 79 Cb -0.04 -1.90 -0.03 0.00 0.00 0.00 0.00 23.12 21.15 1yfy s ALA 79 CO -0.16 0.48 0.10 -0.51 0.00 0.00 0.00 175.76 175.66 1yfy s ASP 80 N -0.59 5.36 -1.18 0.00 1.01 -1.26 0.74 116.67 120.75 1yfy s ASP 80 Ca 0.12 -0.15 -0.13 0.00 0.71 0.00 0.00 52.55 53.10 1yfy s ASP 80 Cb -0.12 -1.97 0.19 0.00 1.01 0.00 0.00 42.92 42.03 1yfy s ASP 80 CO 0.02 -0.03 1.36 -0.76 0.21 0.00 0.00 175.17 175.97 1yfy s LEU 81 N 1.61 5.31 0.28 1.23 1.43 0.77 -4.96 118.68 124.34 1yfy s LEU 81 Ca 0.06 -3.09 -0.29 0.00 -1.03 0.00 0.00 54.13 49.78 1yfy s LEU 81 Cb -0.15 -2.36 -0.09 0.00 0.03 0.00 0.00 46.19 43.61 1yfy s LEU 81 CO 0.05 -0.66 1.02 -0.75 0.23 0.00 0.00 176.35 176.24 1yfy s LYS 82 N 1.05 4.68 0.16 1.70 2.20 -1.26 -0.93 119.74 127.34 1yfy s LYS 82 Ca 0.40 1.63 -0.32 0.00 -0.36 0.00 0.00 55.97 57.33 1yfy s LYS 82 Cb -0.04 -3.15 -0.17 0.00 -1.51 0.00 0.00 37.83 32.96 1yfy s LYS 82 CO -0.02 0.31 0.78 -1.91 -0.36 0.00 0.00 175.35 174.15 1yfy n GLU 83 N 1.16 0.27 -0.14 4.03 2.13 -1.00 -1.59 120.64 125.50 1yfy n GLU 83 Ca -0.01 0.10 0.00 0.00 0.66 0.00 0.00 57.16 57.91 1yfy n GLU 83 Cb 0.46 -1.31 0.00 0.00 0.27 0.00 0.00 31.44 30.86 1yfy n GLU 83 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1yfy n GLY 84 N 1.81 1.64 3.89 8.31 0.00 -0.26 -5.01 105.19 115.57 1yfy n GLY 84 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1yfy n GLY 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yfy s ASP 85 N -3.20 6.42 0.33 1.61 -0.00 -0.62 -4.81 116.67 116.39 1yfy s ASP 85 Ca 0.00 1.03 0.04 0.00 -0.00 0.00 0.00 52.55 53.62 1yfy s ASP 85 Cb 0.00 -2.28 -0.06 0.00 -0.00 0.00 0.00 42.92 40.57 1yfy s ASP 85 CO 0.00 -0.46 0.06 0.27 -0.00 0.00 0.00 175.17 175.04 1yfy s ILE 86 N -2.50 1.20 -0.29 0.77 -0.00 -1.26 -1.21 121.20 117.91 1yfy s ILE 86 Ca 0.49 -2.00 -0.25 0.00 -0.00 0.00 0.00 60.65 58.89 1yfy s ILE 86 Cb -0.10 -2.80 0.18 0.00 -0.00 0.00 0.00 42.46 39.74 1yfy s ILE 86 CO 0.36 -0.00 1.39 0.12 -0.00 0.00 0.00 174.94 176.81 1yfy s PHE 87 N -3.29 -0.10 -0.19 1.37 5.36 -0.59 -4.96 117.98 115.58 1yfy s PHE 87 Ca 0.37 0.24 -0.02 0.00 -0.96 0.00 0.00 56.93 56.55 1yfy s PHE 87 Cb 0.09 0.47 -0.01 0.00 -0.34 0.00 0.00 43.02 43.23 1yfy s PHE 87 CO 0.16 -0.05 -0.08 -1.17 -1.46 0.00 0.00 175.22 172.61 1yfy s LEU 88 N -0.07 2.79 -0.14 6.12 2.96 -1.26 -1.89 118.68 127.18 1yfy s LEU 88 Ca 0.07 -0.38 -0.23 0.00 -0.22 0.00 0.00 54.13 53.37 1yfy s LEU 88 Cb -0.05 -1.68 -0.03 0.00 0.50 0.00 0.00 46.19 44.94 1yfy s LEU 88 CO -0.14 0.05 0.72 -0.22 -1.32 0.00 0.00 176.35 175.43 1yfy s LEU 89 N 1.08 4.22 1.01 -0.68 2.96 0.11 -4.95 118.68 122.43 1yfy s LEU 89 Ca 0.00 1.07 -0.12 0.00 -0.22 0.00 0.00 54.13 54.86 1yfy s LEU 89 Cb -0.15 -3.06 0.20 0.00 0.50 0.00 0.00 46.19 43.68 1yfy s LEU 89 CO -0.01 -0.25 1.08 -2.84 -1.32 0.00 0.00 176.35 173.00 1yfy s PRO 90 N 1.57 0.31 0.52 0.98 0.02 -1.26 -2.56 135.00 134.58 1yfy s PRO 90 Ca 0.35 0.78 -0.22 0.00 0.02 0.00 0.00 61.00 61.93 1yfy s PRO 90 Cb -0.17 -1.70 -0.06 0.00 0.02 0.00 0.00 34.50 32.59 1yfy s PRO 90 CO 0.14 -2.88 1.25 -2.14 -0.33 0.00 0.00 177.00 173.04 1yfy s PRO 91 N -4.78 3.36 0.00 5.54 0.02 -1.26 -3.36 135.00 134.52 1yfy s PRO 91 Ca 0.66 1.97 0.00 0.00 0.02 0.00 0.00 61.00 63.64 1yfy s PRO 91 Cb -0.21 -2.26 0.00 0.00 0.02 0.00 0.00 34.50 32.06 1yfy s PRO 91 CO 0.59 -0.93 0.00 0.72 -0.33 0.00 0.00 177.00 177.06 1yfy n HIS 92 N -0.91 0.00 -1.68 6.54 8.25 0.29 -4.91 115.22 122.79 1yfy n HIS 92 Ca 0.10 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.11 1yfy n HIS 92 Cb 0.47 -0.60 -0.04 0.00 1.12 0.00 0.00 29.99 30.94 1yfy n HIS 92 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1yfy n VAL 93 N -1.57 0.21 -2.28 1.59 0.31 -1.21 -4.68 118.33 110.70 1yfy n VAL 93 Ca 0.00 -0.04 -0.42 0.00 -0.01 0.00 0.00 64.34 63.87 1yfy n VAL 93 Cb 0.00 -1.80 -0.03 0.00 -0.91 0.00 0.00 33.84 31.10 1yfy n VAL 93 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1yfy s ARG 94 N 2.02 4.27 0.04 5.55 1.81 -1.26 -4.60 118.95 126.78 1yfy s ARG 94 Ca 0.82 1.88 0.07 0.00 -1.72 0.00 0.00 55.73 56.78 1yfy s ARG 94 Cb -0.61 -3.67 -0.02 0.00 -0.45 0.00 0.00 34.95 30.20 1yfy s ARG 94 CO 0.40 -0.62 -0.19 -3.38 -0.68 0.00 0.00 175.30 170.83 1yfy s HIS 95 N 2.82 1.68 -0.46 -0.53 -3.43 -0.86 -3.73 115.29 110.77 1yfy s HIS 95 Ca 0.62 -0.37 0.03 0.00 -0.80 0.00 0.00 55.06 54.54 1yfy s HIS 95 Cb -0.28 -1.00 0.14 0.00 -1.43 0.00 0.00 32.58 30.01 1yfy s HIS 95 CO 0.24 0.08 0.28 0.45 -2.00 0.00 0.00 174.74 173.78 1yfy s SER 96 N -1.15 3.50 -0.13 7.38 0.15 -0.71 -0.57 113.70 122.18 1yfy s SER 96 Ca 0.06 -2.80 -0.29 0.00 0.70 0.00 0.00 55.95 53.62 1yfy s SER 96 Cb -0.09 -1.01 -0.05 0.00 -1.71 0.00 0.00 66.02 63.16 1yfy s SER 96 CO 0.02 -0.24 1.81 -2.84 1.20 0.00 0.00 173.24 173.19 1yfy s PRO 97 N 0.14 3.83 -0.40 5.44 0.02 -1.26 -2.57 135.00 140.19 1yfy s PRO 97 Ca 0.20 2.05 -0.10 0.00 0.02 0.00 0.00 61.00 63.17 1yfy s PRO 97 Cb -0.19 -4.12 0.06 0.00 0.02 0.00 0.00 34.50 30.28 1yfy s PRO 97 CO -0.04 -1.28 0.23 -0.65 -0.33 0.00 0.00 177.00 174.93 1yfy s GLN 98 N 4.81 2.68 -0.54 5.54 -1.52 0.03 -4.55 119.66 126.11 1yfy s GLN 98 Ca 0.81 -1.32 0.02 0.00 -1.95 0.00 0.00 55.36 52.92 1yfy s GLN 98 Cb -0.32 -3.74 0.14 0.00 -0.22 0.00 0.00 33.01 28.87 1yfy s GLN 98 CO 0.33 -0.85 0.30 1.03 -0.25 0.00 0.00 175.29 175.85 1yfy s ARG 99 N 1.46 2.12 -0.10 2.91 0.52 -1.26 -2.02 118.95 122.59 1yfy s ARG 99 Ca 0.02 -2.57 -0.27 0.00 -0.52 0.00 0.00 55.73 52.40 1yfy s ARG 99 Cb -0.22 -3.43 -0.26 0.00 0.52 0.00 0.00 34.95 31.56 1yfy s ARG 99 CO 0.04 -1.12 0.86 -1.00 0.02 0.00 0.00 175.30 174.10 1yfy h PRO 100 N 6.70 0.09 -6.24 3.54 0.13 -1.85 0.52 132.00 134.88 1yfy h PRO 100 Ca -0.06 -0.13 -0.57 0.00 -0.87 0.00 0.00 66.00 64.37 1yfy h PRO 100 Cb 0.91 0.05 -0.04 0.00 0.13 0.00 0.00 31.00 32.05 1yfy h PRO 100 CO 0.69 1.01 0.96 -1.83 -0.23 0.00 0.00 178.00 178.59 1yfy s GLU 101 N -2.52 4.06 0.75 0.86 -1.05 -1.26 -4.26 118.70 115.28 1yfy s GLU 101 Ca -0.17 1.52 -0.15 0.00 -0.15 0.00 0.00 54.97 56.01 1yfy s GLU 101 Cb -0.01 -3.84 0.02 0.00 -0.44 0.00 0.00 34.13 29.85 1yfy s GLU 101 CO 0.73 -0.93 0.94 0.00 0.95 0.00 0.00 175.26 176.94 1yfy n ALA 102 N 7.20 -0.44 -1.02 -0.84 0.00 -1.26 -2.63 120.51 121.53 1yfy n ALA 102 Ca 0.15 -0.24 -0.01 0.00 0.00 0.00 0.00 53.44 53.34 1yfy n ALA 102 Cb 0.45 -2.10 -0.00 0.00 0.00 0.00 0.00 19.45 17.80 1yfy n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yfy n GLY 103 N 1.07 0.48 3.88 0.00 0.00 -1.25 -4.91 105.19 104.46 1yfy n GLY 103 Ca 0.12 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 1yfy n GLY 103 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1yfy s SER 104 N -2.42 6.57 -0.18 1.61 0.15 -1.08 -4.80 113.70 113.56 1yfy s SER 104 Ca 0.00 0.98 -0.07 0.00 0.70 0.00 0.00 55.95 57.56 1yfy s SER 104 Cb 0.00 -2.25 0.07 0.00 -1.71 0.00 0.00 66.02 62.13 1yfy s SER 104 CO 0.00 -0.22 0.39 0.00 1.20 0.00 0.00 173.24 174.61 1yfy s ALA 105 N -2.08 -1.03 0.01 5.45 0.00 0.54 -3.50 121.76 121.16 1yfy s ALA 105 Ca 0.49 1.43 0.06 0.00 0.00 0.00 0.00 51.96 53.94 1yfy s ALA 105 Cb -0.11 -1.12 -0.02 0.00 0.00 0.00 0.00 23.12 21.87 1yfy s ALA 105 CO 0.26 -0.54 -0.19 0.00 0.00 0.00 0.00 175.76 175.29 1yfy s LEU 107 N -0.80 4.83 -0.20 0.00 2.96 -0.59 -2.09 118.68 122.79 1yfy s LEU 107 Ca 0.07 -0.96 -0.07 0.00 -0.22 0.00 0.00 54.13 52.95 1yfy s LEU 107 Cb -0.08 -2.47 -0.04 0.00 0.50 0.00 0.00 46.19 44.10 1yfy s LEU 107 CO 0.00 -1.09 0.05 -0.69 -1.32 0.00 0.00 176.35 173.30 1yfy s VAL 108 N 3.10 4.52 -0.08 1.68 1.01 -0.59 -2.28 120.40 127.75 1yfy s VAL 108 Ca 0.18 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.06 1yfy s VAL 108 Cb -0.19 -3.05 0.01 0.00 0.00 0.00 0.00 36.38 33.16 1yfy s VAL 108 CO 0.11 0.43 -0.15 -0.63 0.00 0.00 0.00 175.10 174.87 1yfy s ILE 109 N 0.71 1.37 0.14 2.22 1.01 0.59 -0.87 121.20 126.37 1yfy s ILE 109 Ca 0.02 -0.60 0.03 0.00 0.00 0.00 0.00 60.65 60.10 1yfy s ILE 109 Cb -0.13 -1.24 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 1yfy s ILE 109 CO 0.02 0.41 0.10 -0.62 0.00 0.00 0.00 174.94 174.85 1yfy n GLU 110 N 3.88 0.37 -4.28 2.79 1.02 -0.69 -1.08 120.64 122.65 1yfy n GLU 110 Ca -0.21 -1.36 -0.28 0.00 -0.02 0.00 0.00 57.16 55.29 1yfy n GLU 110 Cb 0.52 0.99 -0.05 0.00 -0.02 0.00 0.00 31.44 32.87 1yfy n GLU 110 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1yfy s ARG 111 N -2.57 2.21 -0.29 3.49 0.52 -1.26 0.21 118.95 121.26 1yfy s ARG 111 Ca 0.14 -2.11 -0.20 0.00 -0.52 0.00 0.00 55.73 53.03 1yfy s ARG 111 Cb 0.01 -1.85 -0.01 0.00 0.52 0.00 0.00 34.95 33.61 1yfy s ARG 111 CO 0.10 -0.37 0.64 -0.65 0.02 0.00 0.00 175.30 175.03 1yfy s GLN 112 N -4.02 3.98 0.11 3.54 -1.52 -0.78 -4.75 119.66 116.22 1yfy s GLN 112 Ca 0.26 0.40 -0.31 0.00 -1.95 0.00 0.00 55.36 53.76 1yfy s GLN 112 Cb 0.01 -3.70 -0.09 0.00 -0.22 0.00 0.00 33.01 29.01 1yfy s GLN 112 CO 0.15 -0.52 1.56 1.03 -0.25 0.00 0.00 175.29 177.26 1yfy s ARG 113 N 2.59 4.23 1.31 2.91 3.00 -1.26 -4.98 118.95 126.75 1yfy s ARG 113 Ca 0.26 2.28 -0.20 0.00 0.00 0.00 0.00 55.73 58.07 1yfy s ARG 113 Cb -0.15 -3.35 0.31 0.00 0.00 0.00 0.00 34.95 31.75 1yfy s ARG 113 CO 0.11 -0.62 0.71 -2.30 0.00 0.00 0.00 175.30 173.19 1yfy n PRO 114 N 4.64 -3.82 -2.89 3.54 -0.02 -1.26 -4.86 135.00 130.32 1yfy n PRO 114 Ca 0.14 -1.13 -0.41 0.00 -2.02 0.00 0.00 63.50 60.08 1yfy n PRO 114 Cb 0.40 -1.81 -0.04 0.00 -0.02 0.00 0.00 33.50 32.04 1yfy n PRO 114 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yfy s ALA 115 N -2.13 3.47 0.00 3.55 0.00 -1.26 -3.20 121.76 122.19 1yfy s ALA 115 Ca 0.58 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.63 1yfy s ALA 115 Cb -0.12 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1yfy s ALA 115 CO 0.51 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 176.13 1yfy n GLY 116 N 3.37 1.22 3.42 0.00 0.00 -1.26 -5.07 105.19 106.86 1yfy n GLY 116 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1yfy n GLY 116 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1yfy s MET 117 N -0.29 3.60 0.08 1.61 0.00 -1.19 -5.10 119.30 118.01 1yfy s MET 117 Ca 0.00 -0.51 0.08 0.00 0.00 0.00 0.00 55.69 55.26 1yfy s MET 117 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 34.83 31.55 1yfy s MET 117 CO 0.00 -0.18 -0.16 -0.51 0.00 0.00 0.00 175.02 174.17 1yfy s LEU 118 N 1.55 2.75 0.23 4.11 1.43 -1.26 -4.58 118.68 122.92 1yfy s LEU 118 Ca 0.06 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 1yfy s LEU 118 Cb -0.15 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 1yfy s LEU 118 CO 0.02 0.21 0.40 -1.81 0.23 0.00 0.00 176.35 175.41 1yfy s ASP 119 N -1.86 6.35 0.30 2.29 -0.00 0.14 -4.41 116.67 119.47 1yfy s ASP 119 Ca 0.17 0.33 0.11 0.00 -0.00 0.00 0.00 52.55 53.17 1yfy s ASP 119 Cb -0.11 -1.98 -0.05 0.00 -0.00 0.00 0.00 42.92 40.78 1yfy s ASP 119 CO 0.09 -0.08 -0.16 -0.83 -0.00 0.00 0.00 175.17 174.19 1yfy s GLY 120 N -3.47 1.98 -0.34 0.21 0.00 -1.08 -0.60 107.32 104.02 1yfy s GLY 120 Ca 0.38 -1.94 -0.01 0.00 0.00 0.00 0.00 44.72 43.15 1yfy s GLY 120 CO 0.30 -1.98 0.21 -1.36 0.00 0.00 0.00 173.10 170.27 1yfy s PHE 121 N -2.53 0.55 0.50 1.90 0.08 -0.10 0.66 117.98 119.03 1yfy s PHE 121 Ca 0.31 -1.41 -0.00 0.00 0.12 0.00 0.00 56.93 55.95 1yfy s PHE 121 Cb -0.03 -0.86 0.01 0.00 -0.57 0.00 0.00 43.02 41.57 1yfy s PHE 121 CO 0.16 -0.84 0.73 -1.21 -0.10 0.00 0.00 175.22 173.95 1yfy s GLU 122 N 1.31 2.88 -0.07 0.44 2.02 0.01 -2.89 118.70 122.40 1yfy s GLU 122 Ca 0.16 -0.53 -0.03 0.00 0.02 0.00 0.00 54.97 54.59 1yfy s GLU 122 Cb -0.21 -2.51 0.04 0.00 0.10 0.00 0.00 34.13 31.55 1yfy s GLU 122 CO -0.07 -0.45 0.16 -1.58 0.02 0.00 0.00 175.26 173.34 1yfy s TRP 123 N -2.66 -0.18 0.19 1.61 0.51 0.10 -1.09 118.94 117.42 1yfy s TRP 123 Ca 0.52 0.50 0.10 0.00 -2.12 0.00 0.00 56.10 55.09 1yfy s TRP 123 Cb -0.10 -0.05 -0.04 0.00 -0.81 0.00 0.00 33.47 32.47 1yfy s TRP 123 CO 0.39 -0.16 -0.15 0.71 -0.51 0.00 0.00 176.95 177.23 1yfy s TYR 124 N 1.01 2.50 0.39 -1.98 2.02 -1.26 0.23 117.35 120.25 1yfy s TYR 124 Ca -0.08 -0.28 -0.22 0.00 -0.37 0.00 0.00 57.07 56.13 1yfy s TYR 124 Cb -0.10 -1.22 -0.10 0.00 -0.40 0.00 0.00 41.96 40.14 1yfy s TYR 124 CO -0.05 0.52 0.93 0.00 -1.57 0.00 0.00 175.55 175.37 1yfy h ASP 126 N 2.32 0.96 0.00 0.00 1.82 -1.92 -2.17 116.42 117.44 1yfy h ASP 126 Ca -0.48 -0.61 -0.03 0.00 -0.39 0.00 0.00 57.03 55.52 1yfy h ASP 126 Cb 1.18 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 40.90 1yfy h ASP 126 CO 0.62 1.41 -0.24 0.00 -1.61 0.00 0.00 179.24 179.42 1yfy h ALA 127 N 0.58 0.04 0.00 -0.78 0.00 -1.96 -3.40 119.26 113.74 1yfy h ALA 127 Ca -0.04 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1yfy h ALA 127 Cb 1.36 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1yfy h ALA 127 CO 0.15 0.16 -0.65 0.00 0.00 0.00 0.00 179.25 178.92 1yfy n GLY 129 N 1.48 0.74 3.88 0.00 0.00 -0.81 -4.96 105.19 105.52 1yfy n GLY 129 Ca 0.05 -0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1yfy n GLY 129 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1yfy s HIS 130 N -1.82 3.49 0.07 1.61 5.65 -1.26 -4.63 115.29 118.39 1yfy s HIS 130 Ca 0.00 1.03 -0.31 0.00 0.25 0.00 0.00 55.06 56.03 1yfy s HIS 130 Cb 0.00 -2.44 -0.09 0.00 -1.18 0.00 0.00 32.58 28.87 1yfy s HIS 130 CO 0.00 -0.17 1.75 -1.17 -0.65 0.00 0.00 174.74 174.50 1yfy s LEU 131 N -4.07 4.38 -0.13 8.88 2.96 -1.26 -1.05 118.68 128.39 1yfy s LEU 131 Ca 0.51 2.56 -0.12 0.00 -0.22 0.00 0.00 54.13 56.86 1yfy s LEU 131 Cb -0.10 -3.56 -0.25 0.00 0.50 0.00 0.00 46.19 42.78 1yfy s LEU 131 CO 0.35 -0.95 0.38 0.58 -1.32 0.00 0.00 176.35 175.39 1yfy h VAL 132 N 4.97 0.79 -1.82 1.68 2.07 0.25 -3.42 116.25 120.77 1yfy h VAL 132 Ca -0.44 -2.32 0.02 0.00 0.82 0.00 0.00 66.70 64.78 1yfy h VAL 132 Cb 1.21 2.49 -0.23 0.00 -1.52 0.00 0.00 31.29 33.24 1yfy h VAL 132 CO 0.94 0.72 0.23 -2.28 0.02 0.00 0.00 177.57 177.20 1yfy s HIS 133 N -2.50 -0.73 0.02 1.57 5.65 -0.87 -4.70 115.29 113.72 1yfy s HIS 133 Ca -0.23 1.65 0.01 0.00 0.25 0.00 0.00 55.06 56.74 1yfy s HIS 133 Cb 0.06 0.39 -0.01 0.00 -1.18 0.00 0.00 32.58 31.84 1yfy s HIS 133 CO 0.73 -0.36 -0.04 0.50 -0.65 0.00 0.00 174.74 174.92 1yfy s ARG 134 N 0.77 0.32 -0.00 2.88 3.52 -1.26 -0.72 118.95 124.46 1yfy s ARG 134 Ca -0.03 -0.47 0.02 0.00 -0.13 0.00 0.00 55.73 55.13 1yfy s ARG 134 Cb -0.05 -0.09 -0.01 0.00 -1.56 0.00 0.00 34.95 33.25 1yfy s ARG 134 CO -0.08 0.01 -0.07 0.08 -0.81 0.00 0.00 175.30 174.43 1yfy s VAL 135 N -0.96 0.55 -0.01 7.11 1.01 -1.14 -4.95 120.40 122.01 1yfy s VAL 135 Ca -0.09 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.57 1yfy s VAL 135 Cb -0.07 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 1yfy s VAL 135 CO -0.00 0.10 -0.14 -1.61 0.00 0.00 0.00 175.10 173.45 1yfy s GLU 136 N -0.30 2.36 0.08 2.72 2.02 -1.26 -0.93 118.70 123.40 1yfy s GLU 136 Ca 0.02 -0.80 -0.10 0.00 0.02 0.00 0.00 54.97 54.10 1yfy s GLU 136 Cb -0.03 -2.34 0.01 0.00 0.10 0.00 0.00 34.13 31.86 1yfy s GLU 136 CO -0.00 0.59 0.23 0.14 0.02 0.00 0.00 175.26 176.24 1yfy s VAL 137 N -0.86 0.12 -0.94 2.63 -7.23 0.23 -4.95 120.40 109.40 1yfy s VAL 137 Ca 0.14 -1.02 -0.14 0.00 -1.81 0.00 0.00 61.98 59.15 1yfy s VAL 137 Cb -0.11 -1.23 0.21 0.00 0.56 0.00 0.00 36.38 35.81 1yfy s VAL 137 CO 0.04 -0.56 0.97 -1.58 -0.31 0.00 0.00 175.10 173.65 1yfy s GLN 138 N -3.60 3.78 0.42 4.82 2.00 -1.26 -0.69 119.66 125.12 1yfy s GLN 138 Ca 0.03 -2.50 -0.26 0.00 -2.00 0.00 0.00 55.36 50.63 1yfy s GLN 138 Cb 0.03 -4.60 -0.10 0.00 0.80 0.00 0.00 33.01 29.14 1yfy s GLN 138 CO -0.10 -1.41 1.29 -0.11 -0.50 0.00 0.00 175.29 174.46 1yfy n LEU 139 N 4.33 4.16 0.00 3.68 7.94 -1.26 -4.92 117.00 130.93 1yfy n LEU 139 Ca 0.20 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 56.21 1yfy n LEU 139 Cb 0.45 -1.51 0.00 0.00 0.53 0.00 0.00 43.42 42.89 1yfy n LEU 139 CO 0.42 -0.57 0.17 1.17 -1.11 0.00 0.00 177.39 177.46 1yfy n LYS 140 N 0.03 0.00 -2.74 1.96 4.81 -1.26 -4.76 118.16 116.21 1yfy n LYS 140 Ca 0.06 -0.34 0.02 0.00 -0.87 0.00 0.00 58.31 57.18 1yfy n LYS 140 Cb 0.40 -0.35 0.01 0.00 0.02 0.00 0.00 35.03 35.10 1yfy n LYS 140 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1yfy s SER 141 N 0.00 -0.22 0.00 3.14 0.15 -1.26 -5.00 113.70 110.51 1yfy s SER 141 Ca 0.00 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.54 1yfy s SER 141 Cb 0.00 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 1yfy s SER 141 CO 0.00 -0.02 0.42 2.30 1.20 0.00 0.00 173.24 177.13 1yfy n ILE 142 N 3.66 0.00 0.03 6.45 -5.35 -1.26 -2.71 119.36 120.17 1yfy n ILE 142 Ca 0.05 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.52 1yfy n ILE 142 Cb 0.64 -0.25 -0.00 0.00 -1.74 0.00 0.00 39.64 38.29 1yfy n ILE 142 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 1yfy n VAL 143 N -0.22 0.89 -2.19 7.28 0.31 -1.26 -4.84 118.33 118.30 1yfy n VAL 143 Ca 0.00 0.27 -0.31 0.00 -0.01 0.00 0.00 64.34 64.29 1yfy n VAL 143 Cb 0.05 -1.59 0.02 0.00 -0.91 0.00 0.00 33.84 31.41 1yfy n VAL 143 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1yfy n THR 144 N -3.39 2.83 -1.69 2.52 -2.24 -1.19 -4.61 114.28 106.51 1yfy n THR 144 Ca -0.01 -4.54 0.00 0.00 -2.27 0.00 0.00 64.05 57.23 1yfy n THR 144 Cb 0.18 -1.24 0.00 0.00 -2.10 0.00 0.00 70.33 67.17 1yfy n THR 144 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1yfy n ASP 145 N -0.55 0.00 -0.03 3.42 2.03 -1.10 -4.93 116.55 115.38 1yfy n ASP 145 Ca 0.46 -0.84 -0.03 0.00 0.52 0.00 0.00 54.79 54.89 1yfy n ASP 145 Cb 0.57 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.96 1yfy n ASP 145 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1yfy n LEU 146 N 0.00 0.80 -0.28 -2.67 4.32 -1.26 -4.58 117.00 113.33 1yfy n LEU 146 Ca 0.00 0.25 0.26 0.00 -0.02 0.00 0.00 56.01 56.50 1yfy n LEU 146 Cb 0.39 -0.62 0.47 0.00 -1.62 0.00 0.00 43.42 42.04 1yfy n LEU 146 CO 0.00 -0.44 0.84 -2.65 -1.22 0.00 0.00 177.39 173.92 1yfy n PRO 147 N -3.30 -0.04 -0.05 3.23 -0.02 -1.26 -1.30 135.00 132.26 1yfy n PRO 147 Ca -0.05 1.01 0.25 0.00 -2.02 0.00 0.00 63.50 62.69 1yfy n PRO 147 Cb 0.18 -1.87 0.67 0.00 -0.02 0.00 0.00 33.50 32.46 1yfy n PRO 147 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1yfy h PRO 148 N 0.00 0.00 0.00 0.52 0.11 -1.97 0.69 132.00 131.35 1yfy h PRO 148 Ca 0.65 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.71 1yfy h PRO 148 Cb 1.84 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.95 1yfy h PRO 148 CO -0.51 0.00 -0.53 -0.07 -0.21 0.00 0.00 178.00 176.69 1yfy h LEU 149 N 0.00 0.00 -0.76 2.35 3.38 -1.50 -3.26 115.31 115.52 1yfy h LEU 149 Ca 0.33 -0.17 0.14 0.00 0.09 0.00 0.00 57.88 58.27 1yfy h LEU 149 Cb 1.74 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 42.36 1yfy h LEU 149 CO -0.00 0.87 -0.22 0.49 0.09 0.00 0.00 178.44 179.66 1yfy n PHE 150 N -4.61 0.19 0.24 1.13 3.01 -0.79 0.32 117.46 116.95 1yfy n PHE 150 Ca -0.11 0.93 0.16 0.00 1.01 0.00 0.00 57.45 59.44 1yfy n PHE 150 Cb 0.31 -0.89 0.85 0.00 -0.01 0.00 0.00 39.48 39.74 1yfy n PHE 150 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1yfy h GLU 151 N 0.00 0.00 -0.36 -1.08 4.57 -1.01 0.53 114.58 117.24 1yfy h GLU 151 Ca 0.33 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.51 1yfy h GLU 151 Cb 0.52 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 1yfy h GLU 151 CO -0.77 0.00 0.00 -1.13 -1.18 0.00 0.00 179.01 175.93 1yfy n SER 152 N -3.86 3.41 -0.07 1.04 3.41 0.96 -3.70 113.62 114.81 1yfy n SER 152 Ca -0.00 -1.98 -0.14 0.00 -0.26 0.00 0.00 58.87 56.49 1yfy n SER 152 Cb 0.23 -0.23 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 1yfy n SER 152 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1yfy n PHE 153 N 1.46 0.00 0.20 7.33 -0.00 -0.50 -3.95 117.46 121.99 1yfy n PHE 153 Ca 0.19 0.00 0.11 0.00 -0.00 0.00 0.00 57.45 57.74 1yfy n PHE 153 Cb 0.60 -0.52 0.54 0.00 -0.00 0.00 0.00 39.48 40.10 1yfy n PHE 153 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1yfy n TYR 154 N -3.42 0.70 0.33 -5.13 4.01 0.06 -0.95 117.16 112.77 1yfy n TYR 154 Ca -0.27 0.35 0.08 0.00 -0.16 0.00 0.00 57.90 57.90 1yfy n TYR 154 Cb 0.72 -1.06 0.12 0.00 -0.31 0.00 0.00 39.34 38.81 1yfy n TYR 154 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1yfy n ALA 155 N -1.76 2.39 -3.86 -0.72 0.00 -1.24 -4.61 120.51 110.71 1yfy n ALA 155 Ca -0.01 -0.84 -0.30 0.00 0.00 0.00 0.00 53.44 52.30 1yfy n ALA 155 Cb 0.07 -0.57 -0.16 0.00 0.00 0.00 0.00 19.45 18.79 1yfy n ALA 155 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1yfy s SER 156 N -1.21 3.66 0.21 0.00 0.15 -0.13 -4.98 113.70 111.40 1yfy s SER 156 Ca 0.24 -1.19 -0.09 0.00 0.70 0.00 0.00 55.95 55.61 1yfy s SER 156 Cb 0.15 -0.99 0.17 0.00 -1.71 0.00 0.00 66.02 63.64 1yfy s SER 156 CO 0.21 -0.29 1.84 -0.33 1.20 0.00 0.00 173.24 175.87 1yfy h GLU 157 N 8.04 1.12 -0.93 5.44 5.08 -1.90 -2.59 114.58 128.83 1yfy h GLU 157 Ca -0.16 -0.13 0.26 0.00 -1.00 0.00 0.00 59.36 58.33 1yfy h GLU 157 Cb 1.07 -0.22 -0.14 0.00 0.50 0.00 0.00 28.75 29.96 1yfy h GLU 157 CO 0.40 0.82 0.41 -0.44 -1.00 0.00 0.00 179.01 179.21 1yfy h ASP 158 N 1.12 0.31 0.09 1.42 5.19 -1.94 -1.73 116.42 120.88 1yfy h ASP 158 Ca 0.29 0.18 -0.12 0.00 -0.62 0.00 0.00 57.03 56.75 1yfy h ASP 158 Cb 0.02 0.17 0.01 0.00 0.18 0.00 0.00 39.33 39.71 1yfy h ASP 158 CO -0.05 -0.08 -0.52 0.11 -3.12 0.00 0.00 179.24 175.58 1yfy h LYS 159 N 0.33 0.20 -0.11 3.56 1.57 -1.82 -3.27 116.57 117.03 1yfy h LYS 159 Ca 0.62 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1yfy h LYS 159 Cb 1.28 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1yfy h LYS 159 CO -0.59 1.15 0.00 0.54 -0.57 0.00 0.00 179.45 179.98 1yfy n ARG 160 N -4.30 0.42 -3.14 3.15 1.74 -0.70 -4.53 116.66 109.30 1yfy n ARG 160 Ca -0.12 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.54 1yfy n ARG 160 Cb 0.70 -1.06 -0.07 0.00 -1.02 0.00 0.00 32.46 31.01 1yfy n ARG 160 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1yfy s ARG 161 N -1.73 3.55 -0.19 5.56 6.06 -0.89 0.19 118.95 131.50 1yfy s ARG 161 Ca 0.00 -0.11 -0.28 0.00 -2.50 0.00 0.00 55.73 52.83 1yfy s ARG 161 Cb 0.00 -3.85 -0.05 0.00 0.06 0.00 0.00 34.95 31.11 1yfy s ARG 161 CO 0.00 -0.80 2.11 0.00 -2.50 0.00 0.00 175.30 174.11 1yfy n PRO 163 N 8.49 0.42 0.00 0.00 -0.04 -1.26 0.12 135.00 142.72 1yfy n PRO 163 Ca 0.27 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 1yfy n PRO 163 Cb 0.45 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.80 1yfy n PRO 163 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1yfy n HIS 164 N -0.61 0.00 -0.13 0.54 -0.00 -1.26 -4.88 115.22 108.88 1yfy n HIS 164 Ca 0.02 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.20 1yfy n HIS 164 Cb 0.01 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.88 1yfy n HIS 164 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1yfy n GLY 166 N 0.41 2.74 3.71 0.00 0.00 0.12 -4.97 105.19 107.19 1yfy n GLY 166 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1yfy n GLY 166 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1yfy s GLN 167 N 0.00 4.14 0.17 1.61 2.00 -1.26 -4.26 119.66 122.06 1yfy s GLN 167 Ca 0.00 2.58 -0.30 0.00 -2.00 0.00 0.00 55.36 55.64 1yfy s GLN 167 Cb 0.00 -3.29 -0.07 0.00 0.80 0.00 0.00 33.01 30.45 1yfy s GLN 167 CO 0.00 -0.78 1.04 0.08 -0.50 0.00 0.00 175.29 175.13 1yfy s VAL 168 N 1.80 4.05 0.08 1.34 1.01 -1.26 -2.84 120.40 124.58 1yfy s VAL 168 Ca 0.77 1.80 -0.30 0.00 0.00 0.00 0.00 61.98 64.25 1yfy s VAL 168 Cb -0.48 -4.15 -0.06 0.00 0.00 0.00 0.00 36.38 31.70 1yfy s VAL 168 CO 0.34 0.32 1.11 -2.28 0.00 0.00 0.00 175.10 174.59 1yfy s HIS 169 N -0.36 3.56 0.31 5.22 2.46 0.13 -4.94 115.29 121.67 1yfy s HIS 169 Ca 0.47 1.51 0.07 0.00 0.47 0.00 0.00 55.06 57.58 1yfy s HIS 169 Cb -0.27 -3.29 0.88 0.00 -0.13 0.00 0.00 32.58 29.77 1yfy s HIS 169 CO 0.33 -0.70 1.62 -1.35 -2.47 0.00 0.00 174.74 172.17 1yfy h PRO 170 N 6.24 0.14 0.00 2.88 0.11 -1.90 -3.47 132.00 136.00 1yfy h PRO 170 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1yfy h PRO 170 Cb 1.21 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1yfy h PRO 170 CO 0.77 0.09 0.00 0.41 -0.21 0.00 0.00 178.00 179.06 1yfy n GLY 171 N -1.37 0.99 0.00 -0.55 0.00 -1.26 -4.23 105.19 98.76 1yfy n GLY 171 Ca 0.26 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1yfy n GLY 171 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1yfy n ARG 172 N 6.02 0.00 -3.15 1.61 0.63 -1.26 -3.14 116.66 117.37 1yfy n ARG 172 Ca 0.00 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.97 1yfy n ARG 172 Cb 0.00 -1.21 -0.00 0.00 0.45 0.00 0.00 32.46 31.70 1yfy n ARG 172 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yfy s ALA 173 N -1.89 -2.60 -2.00 5.13 0.00 -1.26 -5.16 121.76 113.98 1yfy s ALA 173 Ca 0.00 1.32 0.10 0.00 0.00 0.00 0.00 51.96 53.38 1yfy s ALA 173 Cb 0.00 -2.47 0.62 0.00 0.00 0.00 0.00 23.12 21.27 1yfy s ALA 173 CO 0.00 -1.71 1.07 0.00 0.00 0.00 0.00 175.76 175.12