#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ya7 s THR 2 N 0.00 0.20 0.08 12.58 2.01 -1.26 -0.10 115.64 129.15 1ya7 s THR 2 Ca 0.00 0.14 0.02 0.00 0.31 0.00 0.00 61.69 62.16 1ya7 s THR 2 Cb 0.00 -0.34 -0.04 0.00 0.01 0.00 0.00 72.50 72.13 1ya7 s THR 2 CO 0.00 0.19 -0.07 0.42 -0.69 0.00 0.00 174.62 174.47 1ya7 s THR 3 N 1.48 0.66 -0.08 -0.82 -4.23 -0.62 -2.55 115.64 109.48 1ya7 s THR 3 Ca -0.03 -1.70 -0.15 0.00 -1.18 0.00 0.00 61.69 58.63 1ya7 s THR 3 Cb -0.13 -1.39 0.03 0.00 1.34 0.00 0.00 72.50 72.35 1ya7 s THR 3 CO -0.03 -0.73 0.36 0.54 -0.54 0.00 0.00 174.62 174.22 1ya7 s VAL 4 N -2.99 0.03 -0.04 2.29 0.11 -0.49 -1.34 120.40 117.98 1ya7 s VAL 4 Ca 0.06 -0.21 0.01 0.00 -2.93 0.00 0.00 61.98 58.90 1ya7 s VAL 4 Cb 0.01 -0.58 0.03 0.00 -1.53 0.00 0.00 36.38 34.30 1ya7 s VAL 4 CO -0.03 -0.12 -0.01 -0.83 -3.33 0.00 0.00 175.10 170.78 1ya7 s GLY 5 N -0.53 0.31 0.09 6.54 0.00 -0.37 -1.50 107.32 111.86 1ya7 s GLY 5 Ca -0.06 0.09 0.07 0.00 0.00 0.00 0.00 44.72 44.81 1ya7 s GLY 5 CO 0.03 0.57 -0.19 -0.26 0.00 0.00 0.00 173.10 173.24 1ya7 s ILE 6 N 1.02 1.55 0.03 0.90 -4.36 -0.20 -1.38 121.20 118.76 1ya7 s ILE 6 Ca -0.10 -1.44 0.00 0.00 -0.26 0.00 0.00 60.65 58.85 1ya7 s ILE 6 Cb -0.14 -1.42 -0.04 0.00 1.25 0.00 0.00 42.46 42.11 1ya7 s ILE 6 CO -0.01 -0.07 0.12 0.42 0.24 0.00 0.00 174.94 175.64 1ya7 s THR 7 N -1.14 4.91 0.00 8.37 -4.23 -0.18 -1.45 115.64 121.92 1ya7 s THR 7 Ca 0.04 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.10 1ya7 s THR 7 Cb -0.10 -3.31 0.00 0.00 1.34 0.00 0.00 72.50 70.43 1ya7 s THR 7 CO 0.03 0.25 0.00 0.18 -0.54 0.00 0.00 174.62 174.55 1ya7 n LEU 8 N 0.81 0.00 0.07 4.79 4.77 0.59 -4.93 117.00 123.10 1ya7 n LEU 8 Ca -0.10 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.75 1ya7 n LEU 8 Cb 0.52 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.55 1ya7 n LEU 8 CO 0.43 0.00 0.63 0.11 -1.33 0.00 0.00 177.39 177.23 1ya7 h LYS 9 N 0.00 -0.50 -0.26 3.23 1.57 -1.84 -3.29 116.57 115.48 1ya7 h LYS 9 Ca 0.00 0.03 -0.23 0.00 -1.87 0.00 0.00 60.65 58.59 1ya7 h LYS 9 Cb 0.00 0.11 -0.32 0.00 0.08 0.00 0.00 32.23 32.11 1ya7 h LYS 9 CO 0.00 -0.33 -0.91 -0.25 -0.57 0.00 0.00 179.45 177.39 1ya7 n ASP 10 N -5.43 2.03 -3.80 0.86 9.92 -1.26 -4.70 116.55 114.17 1ya7 n ASP 10 Ca -0.05 -2.74 -0.12 0.00 -0.53 0.00 0.00 54.79 51.34 1ya7 n ASP 10 Cb 0.34 -0.41 -0.09 0.00 -0.64 0.00 0.00 41.12 40.32 1ya7 n ASP 10 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ya7 s ALA 11 N -2.41 -0.61 -0.04 2.24 0.00 -1.24 -4.50 121.76 115.19 1ya7 s ALA 11 Ca 0.36 0.25 0.07 0.00 0.00 0.00 0.00 51.96 52.64 1ya7 s ALA 11 Cb 0.37 -0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.47 1ya7 s ALA 11 CO -0.07 -0.22 -0.25 0.08 0.00 0.00 0.00 175.76 175.30 1ya7 s VAL 12 N -1.10 2.11 -0.09 0.00 1.01 -0.29 -0.30 120.40 121.74 1ya7 s VAL 12 Ca -0.12 -1.07 0.04 0.00 0.00 0.00 0.00 61.98 60.83 1ya7 s VAL 12 Cb -0.05 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.58 1ya7 s VAL 12 CO 0.03 0.58 -0.21 -0.63 0.00 0.00 0.00 175.10 174.86 1ya7 s ILE 13 N -0.43 1.83 -0.02 2.22 1.01 -0.53 0.56 121.20 125.84 1ya7 s ILE 13 Ca 0.04 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 59.85 1ya7 s ILE 13 Cb -0.12 -1.59 -0.01 0.00 0.01 0.00 0.00 42.46 40.75 1ya7 s ILE 13 CO 0.01 0.51 -0.14 -0.04 0.00 0.00 0.00 174.94 175.28 1ya7 s MET 14 N 0.42 1.23 0.04 2.79 -1.94 -0.34 -1.04 119.30 120.46 1ya7 s MET 14 Ca -0.18 -0.50 -0.10 0.00 -1.71 0.00 0.00 55.69 53.20 1ya7 s MET 14 Cb -0.17 -1.16 0.00 0.00 2.01 0.00 0.00 34.83 35.51 1ya7 s MET 14 CO 0.08 0.27 0.20 0.00 -0.01 0.00 0.00 175.02 175.56 1ya7 s ALA 15 N -0.21 -0.39 0.15 3.03 0.00 -0.56 -0.77 121.76 123.01 1ya7 s ALA 15 Ca 0.03 -0.24 -0.04 0.00 0.00 0.00 0.00 51.96 51.71 1ya7 s ALA 15 Cb -0.07 0.27 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 1ya7 s ALA 15 CO -0.00 -0.35 0.16 0.95 0.00 0.00 0.00 175.76 176.51 1ya7 s THR 16 N -2.45 0.08 0.00 0.00 -4.23 -0.74 -1.40 115.64 106.90 1ya7 s THR 16 Ca -0.06 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 1ya7 s THR 16 Cb -0.02 -1.97 0.00 0.00 1.34 0.00 0.00 72.50 71.85 1ya7 s THR 16 CO -0.03 -0.38 0.00 -1.84 -0.54 0.00 0.00 174.62 171.83 1ya7 n GLU 17 N -0.15 1.75 0.00 3.99 -0.00 -1.06 -0.69 120.64 124.48 1ya7 n GLU 17 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.10 1ya7 n GLU 17 Cb 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 32.07 1ya7 n GLU 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1ya7 n ARG 18 N -0.32 0.12 -2.48 3.44 1.74 -0.83 -4.64 116.66 113.69 1ya7 n ARG 18 Ca 0.00 -0.40 -0.42 0.00 -0.77 0.00 0.00 57.85 56.26 1ya7 n ARG 18 Cb 0.00 -0.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.88 1ya7 n ARG 18 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1ya7 s ARG 19 N -0.05 4.47 -0.21 5.56 3.52 -0.93 -0.44 118.95 130.87 1ya7 s ARG 19 Ca 0.00 1.71 0.00 0.00 -0.13 0.00 0.00 55.73 57.31 1ya7 s ARG 19 Cb 0.00 -3.36 0.02 0.00 -1.56 0.00 0.00 34.95 30.05 1ya7 s ARG 19 CO 0.00 -0.19 -0.14 0.08 -0.81 0.00 0.00 175.30 174.24 1ya7 s VAL 20 N 0.91 2.41 0.22 7.11 1.01 0.81 -4.71 120.40 128.15 1ya7 s VAL 20 Ca 0.57 -0.99 0.11 0.00 0.00 0.00 0.00 61.98 61.67 1ya7 s VAL 20 Cb -0.28 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1ya7 s VAL 20 CO 0.30 0.38 -0.18 0.42 0.00 0.00 0.00 175.10 176.02 1ya7 s THR 21 N 1.30 2.65 -0.34 3.92 -4.23 -1.26 -1.62 115.64 116.06 1ya7 s THR 21 Ca 0.02 -2.03 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 1ya7 s THR 21 Cb -0.15 -2.32 0.09 0.00 1.34 0.00 0.00 72.50 71.46 1ya7 s THR 21 CO -0.09 -0.20 0.06 -0.32 -0.54 0.00 0.00 174.62 173.53 1ya7 s MET 22 N -2.97 1.91 5.31 3.99 -2.45 -0.49 -4.92 119.30 119.67 1ya7 s MET 22 Ca 0.25 -1.67 0.00 0.00 -1.25 0.00 0.00 55.69 53.01 1ya7 s MET 22 Cb -0.07 -3.26 0.00 0.00 1.25 0.00 0.00 34.83 32.75 1ya7 s MET 22 CO 0.13 -0.86 0.00 0.39 1.05 0.00 0.00 175.02 175.73 1ya7 n GLU 23 N 4.44 0.00 0.10 4.11 4.71 -1.26 -1.83 120.64 130.91 1ya7 n GLU 23 Ca -0.03 0.00 0.12 0.00 -0.01 0.00 0.00 57.16 57.24 1ya7 n GLU 23 Cb 0.42 0.00 0.45 0.00 -1.01 0.00 0.00 31.44 31.30 1ya7 n GLU 23 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1ya7 n ASN 24 N 5.38 0.65 -4.56 1.62 3.02 -1.26 -4.80 115.26 115.30 1ya7 n ASN 24 Ca 0.00 0.60 -0.43 0.00 -0.03 0.00 0.00 54.58 54.72 1ya7 n ASN 24 Cb 0.00 -0.76 -0.04 0.00 -0.61 0.00 0.00 39.78 38.37 1ya7 n ASN 24 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1ya7 s PHE 25 N -3.18 2.90 -0.83 3.10 2.19 -0.76 -4.99 117.98 116.41 1ya7 s PHE 25 Ca 0.08 0.38 -0.25 0.00 0.33 0.00 0.00 56.93 57.46 1ya7 s PHE 25 Cb 0.11 -4.03 0.02 0.00 -1.31 0.00 0.00 43.02 37.81 1ya7 s PHE 25 CO 0.49 -1.14 1.50 0.42 1.83 0.00 0.00 175.22 178.32 1ya7 s ILE 26 N 3.85 3.69 -0.06 3.12 1.01 -1.26 -1.40 121.20 130.15 1ya7 s ILE 26 Ca 0.37 -0.08 -0.25 0.00 0.00 0.00 0.00 60.65 60.69 1ya7 s ILE 26 Cb -0.10 -4.70 -0.20 0.00 0.01 0.00 0.00 42.46 37.47 1ya7 s ILE 26 CO 0.26 -1.63 1.02 0.24 0.00 0.00 0.00 174.94 174.83 1ya7 h MET 27 N 10.88 -0.07 -4.51 2.79 2.86 -1.66 -3.45 114.93 121.76 1ya7 h MET 27 Ca -0.08 0.00 -0.51 0.00 -2.06 0.00 0.00 59.70 57.05 1ya7 h MET 27 Cb 1.05 0.02 -0.34 0.00 0.06 0.00 0.00 31.60 32.39 1ya7 h MET 27 CO 1.31 0.51 -0.81 -1.01 1.06 0.00 0.00 176.91 177.97 1ya7 s HIS 28 N -3.51 1.42 -0.52 -0.22 3.76 -0.93 -5.00 115.29 110.29 1ya7 s HIS 28 Ca -0.15 -0.52 0.24 0.00 -0.15 0.00 0.00 55.06 54.47 1ya7 s HIS 28 Cb 0.00 -1.05 0.21 0.00 1.11 0.00 0.00 32.58 32.86 1ya7 s HIS 28 CO 0.61 -0.28 1.22 0.87 -0.85 0.00 0.00 174.74 176.31 1ya7 h LYS 29 N 7.00 0.00 -0.83 1.40 1.57 -1.86 0.23 116.57 124.08 1ya7 h LYS 29 Ca -0.31 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.08 1ya7 h LYS 29 Cb 1.18 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.09 1ya7 h LYS 29 CO 0.47 0.00 -1.03 -1.71 -0.57 0.00 0.00 179.45 176.62 1ya7 n ASN 30 N -2.28 2.64 -4.71 0.86 4.05 -1.23 -4.19 115.26 110.40 1ya7 n ASN 30 Ca 0.02 -2.81 -0.31 0.00 0.45 0.00 0.00 54.58 51.93 1ya7 n ASN 30 Cb 0.47 -0.47 0.14 0.00 1.23 0.00 0.00 39.78 41.15 1ya7 n ASN 30 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1ya7 s GLY 31 N -3.52 1.66 -0.11 8.20 0.00 0.41 -5.04 107.32 108.92 1ya7 s GLY 31 Ca 0.35 0.26 0.00 0.00 0.00 0.00 0.00 44.72 45.33 1ya7 s GLY 31 CO -0.02 0.69 -0.12 1.25 0.00 0.00 0.00 173.10 174.89 1ya7 s LYS 32 N -4.80 3.18 0.00 2.90 2.20 -1.26 -4.52 119.74 117.42 1ya7 s LYS 32 Ca 0.64 -0.67 0.00 0.00 -0.36 0.00 0.00 55.97 55.58 1ya7 s LYS 32 Cb -0.20 -2.60 0.00 0.00 -1.51 0.00 0.00 37.83 33.53 1ya7 s LYS 32 CO 0.57 0.34 0.20 1.63 -0.36 0.00 0.00 175.35 177.73 1ya7 n LYS 33 N 3.17 -0.25 -4.46 4.03 5.02 -1.26 -5.00 118.16 119.41 1ya7 n LYS 33 Ca -0.18 -0.21 -0.24 0.00 -2.02 0.00 0.00 58.31 55.66 1ya7 n LYS 33 Cb 0.53 -0.67 -0.17 0.00 -0.02 0.00 0.00 35.03 34.70 1ya7 n LYS 33 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1ya7 s LEU 34 N -0.02 1.55 0.01 -0.35 2.96 -1.26 -1.34 118.68 120.23 1ya7 s LEU 34 Ca 0.00 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 53.64 1ya7 s LEU 34 Cb 0.00 -0.76 -0.01 0.00 0.50 0.00 0.00 46.19 45.93 1ya7 s LEU 34 CO 0.00 0.01 -0.01 -0.36 -1.32 0.00 0.00 176.35 174.66 1ya7 s PHE 35 N 0.79 0.10 0.05 5.38 0.08 0.15 -4.97 117.98 119.56 1ya7 s PHE 35 Ca -0.13 -0.19 -0.30 0.00 0.12 0.00 0.00 56.93 56.43 1ya7 s PHE 35 Cb -0.15 -0.07 -0.04 0.00 -0.57 0.00 0.00 43.02 42.18 1ya7 s PHE 35 CO 0.02 -0.07 0.98 -1.14 -0.10 0.00 0.00 175.22 174.92 1ya7 s GLN 36 N -0.52 4.61 0.00 0.44 0.74 -1.26 -0.04 119.66 123.62 1ya7 s GLN 36 Ca -0.06 1.45 0.03 0.00 0.05 0.00 0.00 55.36 56.83 1ya7 s GLN 36 Cb -0.04 -3.42 -0.02 0.00 1.10 0.00 0.00 33.01 30.63 1ya7 s GLN 36 CO -0.00 0.05 0.24 0.44 -0.55 0.00 0.00 175.29 175.47 1ya7 n ILE 37 N 3.45 0.00 -3.80 -2.34 -5.35 0.05 -4.92 119.36 106.45 1ya7 n ILE 37 Ca 0.05 -0.45 -0.04 0.00 -0.27 0.00 0.00 62.75 62.04 1ya7 n ILE 37 Cb 0.50 1.02 -0.01 0.00 -1.74 0.00 0.00 39.64 39.41 1ya7 n ILE 37 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1ya7 s ASP 38 N -1.04 -0.15 0.25 7.28 2.15 -1.10 -4.42 116.67 119.63 1ya7 s ASP 38 Ca 0.02 -0.55 -0.04 0.00 0.43 0.00 0.00 52.55 52.41 1ya7 s ASP 38 Cb 0.02 0.57 0.49 0.00 -0.30 0.00 0.00 42.92 43.70 1ya7 s ASP 38 CO 0.10 -1.07 1.70 0.74 -0.17 0.00 0.00 175.17 176.47 1ya7 h THR 39 N 2.00 0.54 0.00 1.71 2.02 -1.97 -2.66 112.91 114.56 1ya7 h THR 39 Ca -0.24 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 1ya7 h THR 39 Cb 1.23 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 1ya7 h THR 39 CO 0.28 0.06 -0.44 -1.22 0.37 0.00 0.00 175.52 174.57 1ya7 n TYR 40 N -5.11 0.00 -4.08 3.16 4.01 -1.26 -3.00 117.16 110.88 1ya7 n TYR 40 Ca 0.15 -1.26 -0.20 0.00 -0.16 0.00 0.00 57.90 56.42 1ya7 n TYR 40 Cb 0.47 -0.21 -0.17 0.00 -0.31 0.00 0.00 39.34 39.12 1ya7 n TYR 40 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1ya7 s THR 41 N -2.79 0.49 0.36 -0.72 2.01 -1.00 -1.81 115.64 112.19 1ya7 s THR 41 Ca 0.35 -0.07 0.08 0.00 0.31 0.00 0.00 61.69 62.36 1ya7 s THR 41 Cb 0.34 -0.55 -0.07 0.00 0.01 0.00 0.00 72.50 72.24 1ya7 s THR 41 CO -0.05 0.23 -0.06 -0.83 -0.69 0.00 0.00 174.62 173.22 1ya7 s GLY 42 N 1.11 2.28 -0.06 4.40 0.00 0.07 -0.77 107.32 114.35 1ya7 s GLY 42 Ca -0.08 -2.15 -0.04 0.00 0.00 0.00 0.00 44.72 42.44 1ya7 s GLY 42 CO -0.01 -2.04 0.16 -0.29 0.00 0.00 0.00 173.10 170.91 1ya7 s MET 43 N -3.65 0.15 0.10 2.90 1.75 0.94 -1.95 119.30 119.54 1ya7 s MET 43 Ca 0.33 0.29 0.03 0.00 -1.25 0.00 0.00 55.69 55.09 1ya7 s MET 43 Cb 0.05 -0.02 -0.04 0.00 2.84 0.00 0.00 34.83 37.66 1ya7 s MET 43 CO 0.17 -0.08 0.13 0.95 -0.65 0.00 0.00 175.02 175.54 1ya7 s THR 44 N 0.53 4.74 0.10 10.11 -4.23 -0.71 -0.67 115.64 125.51 1ya7 s THR 44 Ca -0.04 -0.77 0.10 0.00 -1.18 0.00 0.00 61.69 59.80 1ya7 s THR 44 Cb -0.05 -3.34 -0.04 0.00 1.34 0.00 0.00 72.50 70.41 1ya7 s THR 44 CO -0.02 0.05 -0.24 0.27 -0.54 0.00 0.00 174.62 174.13 1ya7 s ILE 45 N -1.53 2.02 -0.01 2.99 -4.36 -0.45 -2.49 121.20 117.37 1ya7 s ILE 45 Ca 0.31 -1.60 -0.20 0.00 -0.26 0.00 0.00 60.65 58.90 1ya7 s ILE 45 Cb -0.12 -1.79 0.04 0.00 1.25 0.00 0.00 42.46 41.84 1ya7 s ILE 45 CO 0.24 0.08 0.44 0.00 0.24 0.00 0.00 174.94 175.95 1ya7 s ALA 46 N -1.04 -1.13 0.00 2.27 0.00 -1.01 -4.94 121.76 115.92 1ya7 s ALA 46 Ca 0.11 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1ya7 s ALA 46 Cb -0.10 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.14 1ya7 s ALA 46 CO 0.05 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.87 1ya7 n GLY 47 N 0.98 0.11 3.67 0.00 0.00 -1.26 -1.69 105.19 106.99 1ya7 n GLY 47 Ca -0.20 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 1ya7 n GLY 47 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ya7 s LEU 48 N 0.00 4.28 0.12 0.99 2.96 -0.06 -4.91 118.68 122.07 1ya7 s LEU 48 Ca 0.00 2.08 -0.20 0.00 -0.22 0.00 0.00 54.13 55.79 1ya7 s LEU 48 Cb 0.00 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.10 1ya7 s LEU 48 CO 0.00 -0.85 1.74 0.58 -1.32 0.00 0.00 176.35 176.50 1ya7 h VAL 49 N 5.42 0.93 -0.91 1.68 2.07 -1.92 -1.69 116.25 121.83 1ya7 h VAL 49 Ca -0.36 -0.04 0.07 0.00 0.82 0.00 0.00 66.70 67.19 1ya7 h VAL 49 Cb 1.16 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 31.66 1ya7 h VAL 49 CO 0.95 0.02 0.57 1.23 0.02 0.00 0.00 177.57 180.36 1ya7 h GLY 50 N 0.12 1.39 0.82 2.17 0.00 -1.99 0.13 103.07 105.71 1ya7 h GLY 50 Ca 0.08 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 1ya7 h GLY 50 CO -0.10 0.26 -0.22 -0.55 0.00 0.00 0.00 176.54 175.93 1ya7 h ASP 51 N 1.01 -0.53 -0.67 0.19 3.32 -1.79 -2.71 116.42 115.25 1ya7 h ASP 51 Ca 0.40 -0.07 0.14 0.00 0.02 0.00 0.00 57.03 57.53 1ya7 h ASP 51 Cb 0.22 0.14 -0.11 0.00 0.22 0.00 0.00 39.33 39.79 1ya7 h ASP 51 CO -0.19 -0.24 0.01 0.00 -1.72 0.00 0.00 179.24 177.11 1ya7 h ALA 52 N -0.38 0.68 -0.21 3.45 0.00 -1.18 -1.82 119.26 119.80 1ya7 h ALA 52 Ca -0.06 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1ya7 h ALA 52 Cb 0.56 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1ya7 h ALA 52 CO 0.10 -0.40 0.05 1.96 0.00 0.00 0.00 179.25 180.97 1ya7 h GLN 53 N 0.12 0.35 -0.78 0.00 4.20 -1.00 0.45 115.11 118.44 1ya7 h GLN 53 Ca 0.35 -0.08 0.15 0.00 0.06 0.00 0.00 58.65 59.12 1ya7 h GLN 53 Cb 0.59 -0.04 -0.10 0.00 0.30 0.00 0.00 27.48 28.23 1ya7 h GLN 53 CO -0.57 0.47 0.34 0.28 -0.67 0.00 0.00 178.83 178.69 1ya7 h VAL 54 N 0.16 0.67 -0.35 -0.54 2.07 -1.39 -1.32 116.25 115.56 1ya7 h VAL 54 Ca 0.07 -0.17 -0.12 0.00 0.82 0.00 0.00 66.70 67.29 1ya7 h VAL 54 Cb 0.28 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1ya7 h VAL 54 CO 0.00 0.09 -0.28 -0.07 0.02 0.00 0.00 177.57 177.34 1ya7 h LEU 55 N 0.50 0.76 -0.66 2.57 3.38 -0.83 -1.25 115.31 119.77 1ya7 h LEU 55 Ca 0.43 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ya7 h LEU 55 Cb 0.65 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1ya7 h LEU 55 CO -0.39 0.99 0.41 0.58 0.09 0.00 0.00 178.44 180.12 1ya7 h VAL 56 N 0.63 1.19 -0.56 1.22 2.07 -0.60 -1.56 116.25 118.64 1ya7 h VAL 56 Ca 0.08 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 1ya7 h VAL 56 Cb 0.79 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1ya7 h VAL 56 CO 0.07 0.19 0.08 0.03 0.02 0.00 0.00 177.57 177.96 1ya7 h ARG 57 N 0.90 0.90 -0.28 1.57 3.08 -0.90 -2.13 114.38 117.52 1ya7 h ARG 57 Ca 0.24 -0.22 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 1ya7 h ARG 57 Cb -0.05 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1ya7 h ARG 57 CO -0.05 0.84 -0.26 1.88 -1.07 0.00 0.00 179.97 181.32 1ya7 h TYR 58 N 0.85 0.63 0.07 3.04 0.99 -0.98 -2.15 116.97 119.42 1ya7 h TYR 58 Ca 0.17 -0.14 -0.26 0.00 2.00 0.00 0.00 58.73 60.50 1ya7 h TYR 58 Cb 0.39 -0.15 0.02 0.00 1.00 0.00 0.00 36.73 37.99 1ya7 h TYR 58 CO 0.02 0.77 -1.07 0.52 -0.00 0.00 0.00 178.16 178.40 1ya7 h MET 59 N 0.49 0.61 -0.50 4.88 2.86 -1.19 -1.87 114.93 120.21 1ya7 h MET 59 Ca 0.07 -0.74 0.02 0.00 -2.06 0.00 0.00 59.70 56.98 1ya7 h MET 59 Cb 0.71 0.23 -0.03 0.00 0.06 0.00 0.00 31.60 32.57 1ya7 h MET 59 CO 0.05 1.32 0.31 0.87 1.06 0.00 0.00 176.91 180.52 1ya7 h LYS 60 N 0.23 0.60 0.23 1.72 1.57 -1.39 0.11 116.57 119.65 1ya7 h LYS 60 Ca -0.15 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 1ya7 h LYS 60 Cb 1.75 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.92 1ya7 h LYS 60 CO 0.21 0.40 -0.11 0.00 -0.57 0.00 0.00 179.45 179.38 1ya7 h ALA 61 N 1.21 -0.31 -0.17 3.86 0.00 -1.44 -2.92 119.26 119.49 1ya7 h ALA 61 Ca 0.19 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 1ya7 h ALA 61 Cb -0.02 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ya7 h ALA 61 CO -0.07 -0.65 -0.63 1.49 0.00 0.00 0.00 179.25 179.39 1ya7 h GLU 62 N -0.37 0.60 -0.14 0.00 4.57 -1.24 -1.27 114.58 116.74 1ya7 h GLU 62 Ca -0.03 -0.42 -0.11 0.00 -1.18 0.00 0.00 59.36 57.62 1ya7 h GLU 62 Cb 0.28 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1ya7 h GLU 62 CO 0.05 1.04 -0.39 -0.07 -1.18 0.00 0.00 179.01 178.47 1ya7 h LEU 63 N 0.44 0.31 0.15 1.64 3.38 -1.06 -0.50 115.31 119.67 1ya7 h LEU 63 Ca -0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1ya7 h LEU 63 Cb 1.20 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1ya7 h LEU 63 CO 0.12 0.68 -0.07 -0.08 0.09 0.00 0.00 178.44 179.18 1ya7 h GLU 64 N 0.26 -0.19 -0.44 1.13 4.81 -1.36 -2.66 114.58 116.12 1ya7 h GLU 64 Ca 0.03 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.36 1ya7 h GLU 64 Cb 0.80 0.04 -0.09 0.00 0.63 0.00 0.00 28.75 30.14 1ya7 h GLU 64 CO 0.06 0.19 -0.13 1.25 -0.73 0.00 0.00 179.01 179.66 1ya7 h LEU 65 N -0.63 -0.46 -0.35 1.64 5.85 -1.21 -1.46 115.31 118.70 1ya7 h LEU 65 Ca -0.02 0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.90 1ya7 h LEU 65 Cb 0.47 0.29 -0.06 0.00 0.37 0.00 0.00 40.66 41.74 1ya7 h LEU 65 CO 0.03 -0.16 0.00 0.22 -0.34 0.00 0.00 178.44 178.20 1ya7 h TYR 66 N -0.02 -0.01 -0.61 1.25 5.03 -1.11 -0.55 116.97 120.95 1ya7 h TYR 66 Ca 0.21 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.53 1ya7 h TYR 66 Cb 0.34 0.06 -0.03 0.00 1.55 0.00 0.00 36.73 38.65 1ya7 h TYR 66 CO -0.40 -0.06 0.31 -0.09 -1.32 0.00 0.00 178.16 176.60 1ya7 h ARG 67 N 0.10 0.87 -0.80 1.82 2.43 -1.27 0.85 114.38 118.39 1ya7 h ARG 67 Ca 0.17 -0.12 0.05 0.00 -0.81 0.00 0.00 59.98 59.27 1ya7 h ARG 67 Cb 0.23 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 29.57 1ya7 h ARG 67 CO -0.28 0.69 0.50 -0.07 -1.51 0.00 0.00 179.97 179.30 1ya7 h LEU 68 N 0.83 0.80 0.05 3.80 4.07 -0.80 0.20 115.31 124.26 1ya7 h LEU 68 Ca 0.21 0.01 -0.28 0.00 0.08 0.00 0.00 57.88 57.90 1ya7 h LEU 68 Cb 0.10 -0.16 0.02 0.00 1.08 0.00 0.00 40.66 41.70 1ya7 h LEU 68 CO -0.03 0.53 -1.15 1.56 -1.08 0.00 0.00 178.44 178.27 1ya7 h GLN 69 N 0.94 0.64 0.00 1.13 4.20 -0.21 -3.34 115.11 118.46 1ya7 h GLN 69 Ca 0.33 -0.77 0.00 0.00 0.06 0.00 0.00 58.65 58.27 1ya7 h GLN 69 Cb 0.09 0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1ya7 h GLN 69 CO -0.14 1.34 -1.21 0.54 -0.67 0.00 0.00 178.83 178.69 1ya7 n ARG 70 N -3.80 0.39 -1.24 1.46 3.00 0.29 -4.96 116.66 111.79 1ya7 n ARG 70 Ca -0.12 -0.02 -0.08 0.00 -0.01 0.00 0.00 57.85 57.61 1ya7 n ARG 70 Cb 0.94 -1.61 -0.03 0.00 0.00 0.00 0.00 32.46 31.76 1ya7 n ARG 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1ya7 n ARG 71 N -2.09 -1.61 -4.13 5.56 1.74 0.70 -4.97 116.66 111.86 1ya7 n ARG 71 Ca 0.01 0.76 -0.09 0.00 -0.77 0.00 0.00 57.85 57.75 1ya7 n ARG 71 Cb 0.47 -5.10 -0.10 0.00 -1.02 0.00 0.00 32.46 26.71 1ya7 n ARG 71 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1ya7 s VAL 72 N -1.78 0.49 0.28 1.55 -7.23 -1.24 -5.04 120.40 107.42 1ya7 s VAL 72 Ca 0.00 -1.79 -0.29 0.00 -1.81 0.00 0.00 61.98 58.09 1ya7 s VAL 72 Cb 0.00 -1.49 -0.10 0.00 0.56 0.00 0.00 36.38 35.35 1ya7 s VAL 72 CO 0.00 -0.87 1.24 0.20 -0.31 0.00 0.00 175.10 175.37 1ya7 s ASN 73 N -2.83 6.96 0.02 4.85 -0.87 -1.26 -3.99 114.94 117.82 1ya7 s ASN 73 Ca 0.07 2.48 -0.36 0.00 -1.57 0.00 0.00 52.86 53.49 1ya7 s ASN 73 Cb 0.04 -2.63 -0.15 0.00 -0.02 0.00 0.00 41.25 38.49 1ya7 s ASN 73 CO -0.06 -0.41 1.56 0.80 -2.57 0.00 0.00 177.10 176.42 1ya7 n MET 74 N 1.42 1.59 -1.69 -0.60 0.00 -1.26 -4.94 117.12 111.65 1ya7 n MET 74 Ca 0.01 0.58 -0.39 0.00 -0.00 0.00 0.00 57.70 57.90 1ya7 n MET 74 Cb 0.43 -2.30 0.03 0.00 0.00 0.00 0.00 33.22 31.39 1ya7 n MET 74 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1ya7 n PRO 75 N 3.90 1.56 -0.35 2.12 -0.02 -1.26 -4.79 135.00 136.16 1ya7 n PRO 75 Ca 0.20 0.57 -0.01 0.00 -2.02 0.00 0.00 63.50 62.24 1ya7 n PRO 75 Cb 0.22 -2.37 0.15 0.00 -0.02 0.00 0.00 33.50 31.48 1ya7 n PRO 75 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1ya7 h ILE 76 N 1.44 1.23 -0.32 4.25 1.08 -1.91 0.04 117.51 123.30 1ya7 h ILE 76 Ca -0.49 -0.44 -0.01 0.00 -0.39 0.00 0.00 64.86 63.53 1ya7 h ILE 76 Cb 1.32 -0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 34.89 1ya7 h ILE 76 CO 0.57 0.23 0.14 -0.08 -0.69 0.00 0.00 178.15 178.32 1ya7 h GLU 77 N 1.28 0.44 -0.29 2.37 4.81 -1.99 -1.48 114.58 119.72 1ya7 h GLU 77 Ca 0.36 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.39 1ya7 h GLU 77 Cb -0.11 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.17 1ya7 h GLU 77 CO -0.09 0.36 -0.43 0.00 -0.73 0.00 0.00 179.01 178.12 1ya7 h ALA 78 N 1.71 0.68 -0.54 2.92 0.00 -1.39 -1.76 119.26 120.87 1ya7 h ALA 78 Ca 0.11 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ya7 h ALA 78 Cb 0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1ya7 h ALA 78 CO -0.01 0.67 0.34 0.28 0.00 0.00 0.00 179.25 180.53 1ya7 h VAL 79 N 0.60 1.15 -0.23 0.00 2.07 -0.75 0.12 116.25 119.21 1ya7 h VAL 79 Ca 0.04 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.14 1ya7 h VAL 79 Cb 0.99 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1ya7 h VAL 79 CO 0.09 0.15 -0.31 0.00 0.02 0.00 0.00 177.57 177.52 1ya7 h ALA 80 N 1.18 1.02 -0.16 1.67 0.00 -1.14 -2.03 119.26 119.80 1ya7 h ALA 80 Ca 0.20 -0.38 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1ya7 h ALA 80 Cb -0.05 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1ya7 h ALA 80 CO -0.04 0.59 -0.52 1.15 0.00 0.00 0.00 179.25 180.43 1ya7 h THR 81 N 0.42 1.33 -0.12 0.00 2.02 -1.10 -1.21 112.91 114.24 1ya7 h THR 81 Ca 0.05 -1.77 0.04 0.00 0.77 0.00 0.00 66.41 65.50 1ya7 h THR 81 Cb 0.76 1.99 -0.04 0.00 -1.74 0.00 0.00 68.15 69.11 1ya7 h THR 81 CO 0.06 0.55 -0.14 0.25 0.37 0.00 0.00 175.52 176.61 1ya7 h LEU 82 N 0.31 -0.42 -0.59 2.58 5.85 -0.88 0.35 115.31 122.51 1ya7 h LEU 82 Ca -0.02 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1ya7 h LEU 82 Cb 1.15 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.35 1ya7 h LEU 82 CO 0.11 -0.18 0.34 -0.07 -0.34 0.00 0.00 178.44 178.30 1ya7 h LEU 83 N -0.17 0.72 -0.41 2.25 3.38 -1.27 -1.46 115.31 118.35 1ya7 h LEU 83 Ca 0.09 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ya7 h LEU 83 Cb 0.30 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1ya7 h LEU 83 CO -0.22 0.58 0.25 -1.28 0.09 0.00 0.00 178.44 177.86 1ya7 h SER 84 N 0.79 0.50 -0.30 -0.43 0.87 -0.95 -0.73 113.55 113.30 1ya7 h SER 84 Ca 0.21 -0.06 0.03 0.00 -1.23 0.00 0.00 61.79 60.74 1ya7 h SER 84 Cb 0.01 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.82 1ya7 h SER 84 CO -0.04 0.41 0.12 0.78 -0.53 0.00 0.00 176.83 177.57 1ya7 h ASN 85 N 0.54 0.16 -0.52 6.23 2.35 -0.47 -1.84 115.58 122.02 1ya7 h ASN 85 Ca 0.15 0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1ya7 h ASN 85 Cb 0.00 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 1ya7 h ASN 85 CO -0.03 0.13 0.22 0.24 -1.65 0.00 0.00 177.43 176.34 1ya7 h MET 86 N 0.27 0.77 -0.21 0.81 2.86 -0.86 -1.95 114.93 116.63 1ya7 h MET 86 Ca 0.13 -0.13 -0.20 0.00 -2.06 0.00 0.00 59.70 57.44 1ya7 h MET 86 Cb 0.08 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1ya7 h MET 86 CO -0.12 0.67 -0.65 -0.07 1.06 0.00 0.00 176.91 177.80 1ya7 h LEU 87 N 0.70 0.88 -1.09 1.22 3.38 -1.13 -3.14 115.31 116.13 1ya7 h LEU 87 Ca 0.18 -0.52 -0.07 0.00 0.09 0.00 0.00 57.88 57.56 1ya7 h LEU 87 Cb 0.17 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1ya7 h LEU 87 CO -0.02 1.31 -0.09 -1.13 0.09 0.00 0.00 178.44 178.60 1ya7 h ASN 88 N 0.56 0.51 0.51 -0.43 -0.73 -1.28 -2.61 115.58 112.11 1ya7 h ASN 88 Ca -0.02 -0.13 -0.01 0.00 1.87 0.00 0.00 56.30 58.02 1ya7 h ASN 88 Cb 1.26 -0.14 -0.00 0.00 0.27 0.00 0.00 38.32 39.71 1ya7 h ASN 88 CO 0.14 0.65 -0.06 1.56 -0.37 0.00 0.00 177.43 179.34 1ya7 h GLN 89 N 0.49 0.00 -0.04 6.67 4.20 -1.30 -2.53 115.11 122.59 1ya7 h GLN 89 Ca 0.09 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 1ya7 h GLN 89 Cb 0.47 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1ya7 h GLN 89 CO 0.03 0.06 -0.31 1.33 -0.67 0.00 0.00 178.83 179.26 1ya7 n VAL 90 N -3.33 2.16 0.26 -0.54 0.24 -1.13 -4.87 118.33 111.13 1ya7 n VAL 90 Ca -0.01 -2.90 0.17 0.00 -2.04 0.00 0.00 64.34 59.56 1ya7 n VAL 90 Cb 0.23 -0.25 0.92 0.00 -1.47 0.00 0.00 33.84 33.27 1ya7 n VAL 90 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1ya7 h LYS 91 N 0.76 0.00 0.00 7.34 2.10 -1.07 -0.49 116.57 125.22 1ya7 h LYS 91 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 1ya7 h LYS 91 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 1ya7 h LYS 91 CO 0.05 0.00 -1.12 0.66 -2.00 0.00 0.00 179.45 177.03 1ya7 n TYR 92 N -2.71 0.19 -3.20 0.07 4.02 -1.26 -4.16 117.16 110.11 1ya7 n TYR 92 Ca -0.02 0.06 -0.26 0.00 -0.01 0.00 0.00 57.90 57.67 1ya7 n TYR 92 Cb 0.07 -0.38 -0.06 0.00 -0.02 0.00 0.00 39.34 38.95 1ya7 n TYR 92 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 1ya7 n MET 93 N -1.92 2.43 -2.14 -0.72 2.81 -0.25 -5.14 117.12 112.19 1ya7 n MET 93 Ca 0.02 -4.45 -0.32 0.00 -1.81 0.00 0.00 57.70 51.14 1ya7 n MET 93 Cb 0.43 -2.08 -0.01 0.00 -0.71 0.00 0.00 33.22 30.86 1ya7 n MET 93 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1ya7 s PRO 94 N -2.69 3.70 -0.21 0.03 0.04 -0.82 -4.86 135.00 130.18 1ya7 s PRO 94 Ca 0.43 0.93 -0.29 0.00 0.04 0.00 0.00 61.00 62.10 1ya7 s PRO 94 Cb 0.22 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.65 1ya7 s PRO 94 CO -0.08 -0.49 1.43 0.71 0.04 0.00 0.00 177.00 178.62 1ya7 s TYR 95 N -2.80 2.46 -1.38 0.56 1.51 -1.26 -4.95 117.35 111.49 1ya7 s TYR 95 Ca 0.58 0.72 -0.12 0.00 -1.01 0.00 0.00 57.07 57.25 1ya7 s TYR 95 Cb -0.11 -3.83 0.10 0.00 -0.11 0.00 0.00 41.96 38.01 1ya7 s TYR 95 CO 0.40 -2.35 2.07 -1.33 -1.11 0.00 0.00 175.55 173.24 1ya7 n MET 96 N 7.22 3.23 -4.13 -0.62 2.81 -1.26 -4.60 117.12 119.78 1ya7 n MET 96 Ca 0.16 -3.04 -0.10 0.00 -1.81 0.00 0.00 57.70 52.91 1ya7 n MET 96 Cb 0.45 -3.11 -0.10 0.00 -0.71 0.00 0.00 33.22 29.75 1ya7 n MET 96 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1ya7 s VAL 97 N 1.83 0.56 -0.10 2.03 -7.23 -1.26 -0.88 120.40 115.35 1ya7 s VAL 97 Ca 0.44 -1.72 0.04 0.00 -1.81 0.00 0.00 61.98 58.92 1ya7 s VAL 97 Cb 0.12 -1.40 -0.01 0.00 0.56 0.00 0.00 36.38 35.65 1ya7 s VAL 97 CO -0.05 -0.79 -0.21 -1.10 -0.31 0.00 0.00 175.10 172.64 1ya7 s GLN 98 N -3.35 3.00 0.00 4.82 -0.21 -0.68 -3.02 119.66 120.23 1ya7 s GLN 98 Ca 0.06 -0.84 0.07 0.00 0.02 0.00 0.00 55.36 54.68 1ya7 s GLN 98 Cb 0.02 -2.35 -0.02 0.00 1.00 0.00 0.00 33.01 31.67 1ya7 s GLN 98 CO -0.05 0.24 -0.23 -0.51 -2.12 0.00 0.00 175.29 172.63 1ya7 s LEU 99 N 0.20 2.09 -0.16 2.90 1.43 0.09 -2.39 118.68 122.83 1ya7 s LEU 99 Ca -0.13 -0.46 -0.04 0.00 -1.03 0.00 0.00 54.13 52.47 1ya7 s LEU 99 Cb -0.16 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.87 1ya7 s LEU 99 CO 0.07 0.25 -0.02 -0.76 0.23 0.00 0.00 176.35 176.12 1ya7 s LEU 100 N -0.78 3.33 -0.18 1.79 1.43 -1.04 -0.97 118.68 122.27 1ya7 s LEU 100 Ca 0.09 -0.09 -0.00 0.00 -1.03 0.00 0.00 54.13 53.09 1ya7 s LEU 100 Cb -0.09 -1.81 0.01 0.00 0.03 0.00 0.00 46.19 44.33 1ya7 s LEU 100 CO 0.00 0.18 -0.15 -0.69 0.23 0.00 0.00 176.35 175.92 1ya7 s VAL 101 N 0.32 2.55 0.06 -1.59 1.01 0.34 -1.75 120.40 121.34 1ya7 s VAL 101 Ca -0.03 -0.79 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1ya7 s VAL 101 Cb -0.14 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 1ya7 s VAL 101 CO 0.03 0.51 -0.13 -0.83 0.00 0.00 0.00 175.10 174.67 1ya7 s GLY 102 N 1.14 0.78 0.00 4.51 0.00 -0.82 -0.13 107.32 112.80 1ya7 s GLY 102 Ca 0.01 -0.89 0.00 0.00 0.00 0.00 0.00 44.72 43.84 1ya7 s GLY 102 CO -0.06 -0.91 0.00 0.61 0.00 0.00 0.00 173.10 172.75 1ya7 n GLY 103 N 1.55 -1.27 3.13 0.20 0.00 -0.28 -0.75 105.19 107.78 1ya7 n GLY 103 Ca -0.20 -0.91 -0.31 0.00 0.00 0.00 0.00 46.02 44.60 1ya7 n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ya7 s ILE 104 N -2.70 1.85 0.00 -0.61 -1.09 -0.75 -0.48 121.20 117.42 1ya7 s ILE 104 Ca 0.00 -0.86 0.00 0.00 -2.23 0.00 0.00 60.65 57.56 1ya7 s ILE 104 Cb 0.00 -1.64 0.00 0.00 -1.58 0.00 0.00 42.46 39.24 1ya7 s ILE 104 CO 0.00 0.51 0.00 -0.90 -1.23 0.00 0.00 174.94 173.32 1ya7 n ASP 105 N 4.03 0.00 0.02 3.58 5.68 -1.26 -4.82 116.55 123.78 1ya7 n ASP 105 Ca -0.20 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.20 1ya7 n ASP 105 Cb 0.52 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.50 1ya7 n ASP 105 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1ya7 n THR 106 N 0.00 0.11 -3.82 2.12 -2.24 -1.26 -4.96 114.28 104.22 1ya7 n THR 106 Ca 0.00 -0.19 -0.09 0.00 -2.27 0.00 0.00 64.05 61.50 1ya7 n THR 106 Cb 0.00 0.35 -0.06 0.00 -2.10 0.00 0.00 70.33 68.52 1ya7 n THR 106 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ya7 s ALA 107 N -3.16 -0.41 0.38 6.98 0.00 -1.26 -5.16 121.76 119.14 1ya7 s ALA 107 Ca 0.05 -0.52 -0.25 0.00 0.00 0.00 0.00 51.96 51.23 1ya7 s ALA 107 Cb 0.15 0.70 -0.09 0.00 0.00 0.00 0.00 23.12 23.88 1ya7 s ALA 107 CO 0.81 -0.62 1.09 -2.14 0.00 0.00 0.00 175.76 174.90 1ya7 s PRO 108 N -3.88 4.19 -0.03 0.00 0.02 -1.26 -4.31 135.00 129.73 1ya7 s PRO 108 Ca 0.09 1.66 -0.05 0.00 0.02 0.00 0.00 61.00 62.72 1ya7 s PRO 108 Cb 0.03 -2.68 0.01 0.00 0.02 0.00 0.00 34.50 31.88 1ya7 s PRO 108 CO -0.07 -0.15 0.12 -1.01 -0.33 0.00 0.00 177.00 175.57 1ya7 s HIS 109 N -1.50 -0.06 -0.08 6.54 3.76 0.37 -4.98 115.29 119.34 1ya7 s HIS 109 Ca 0.56 0.13 0.02 0.00 -0.15 0.00 0.00 55.06 55.62 1ya7 s HIS 109 Cb -0.26 0.00 0.02 0.00 1.11 0.00 0.00 32.58 33.44 1ya7 s HIS 109 CO 0.33 -0.15 -0.12 0.08 -0.85 0.00 0.00 174.74 174.03 1ya7 s VAL 110 N -0.53 1.17 0.00 -0.90 1.01 -1.26 -1.12 120.40 118.78 1ya7 s VAL 110 Ca -0.06 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 61.53 1ya7 s VAL 110 Cb -0.04 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 1ya7 s VAL 110 CO 0.01 0.37 -0.26 -0.36 0.00 0.00 0.00 175.10 174.86 1ya7 s PHE 111 N 0.91 2.29 -0.21 5.22 0.40 0.81 -1.67 117.98 125.74 1ya7 s PHE 111 Ca -0.10 -0.43 -0.04 0.00 -0.60 0.00 0.00 56.93 55.77 1ya7 s PHE 111 Cb -0.15 -1.44 -0.01 0.00 0.51 0.00 0.00 43.02 41.93 1ya7 s PHE 111 CO 0.01 0.02 -0.04 0.45 0.70 0.00 0.00 175.22 176.35 1ya7 s SER 112 N -0.83 4.38 -0.12 1.36 0.15 -0.28 -0.50 113.70 117.86 1ya7 s SER 112 Ca 0.10 -0.34 0.03 0.00 0.70 0.00 0.00 55.95 56.44 1ya7 s SER 112 Cb -0.10 -1.74 0.01 0.00 -1.71 0.00 0.00 66.02 62.47 1ya7 s SER 112 CO 0.00 0.02 -0.23 -0.63 1.20 0.00 0.00 173.24 173.60 1ya7 s ILE 113 N 1.25 2.04 0.67 6.45 1.09 -0.15 -1.45 121.20 131.11 1ya7 s ILE 113 Ca 0.03 -0.99 0.04 0.00 -1.10 0.00 0.00 60.65 58.63 1ya7 s ILE 113 Cb -0.14 -1.79 0.12 0.00 -1.06 0.00 0.00 42.46 39.58 1ya7 s ILE 113 CO -0.01 0.55 0.92 1.51 -0.10 0.00 0.00 174.94 177.81 1ya7 s ASP 114 N 0.58 4.60 0.36 3.58 1.47 -0.19 -0.74 116.67 126.34 1ya7 s ASP 114 Ca -0.13 -0.60 0.27 0.00 1.18 0.00 0.00 52.55 53.27 1ya7 s ASP 114 Cb -0.17 0.19 1.14 0.00 -0.34 0.00 0.00 42.92 43.73 1ya7 s ASP 114 CO 0.03 -1.69 1.81 0.00 0.68 0.00 0.00 175.17 176.00 1ya7 h ALA 115 N -0.27 1.00 -0.60 2.11 0.00 -1.79 -1.60 119.26 118.12 1ya7 h ALA 115 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1ya7 h ALA 115 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1ya7 h ALA 115 CO 0.39 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.64 1ya7 n ALA 116 N -1.88 3.21 -1.06 0.00 0.00 -1.26 -4.53 120.51 115.00 1ya7 n ALA 116 Ca 0.01 -1.70 -0.02 0.00 0.00 0.00 0.00 53.44 51.73 1ya7 n ALA 116 Cb 0.24 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.69 1ya7 n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ya7 n GLY 117 N 0.90 0.53 3.71 0.00 0.00 -0.60 -3.81 105.19 105.92 1ya7 n GLY 117 Ca 0.26 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1ya7 n GLY 117 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ya7 s GLY 118 N -2.34 2.13 -0.05 -0.02 0.00 -1.26 -4.49 107.32 101.29 1ya7 s GLY 118 Ca 0.00 1.02 -0.00 0.00 0.00 0.00 0.00 44.72 45.74 1ya7 s GLY 118 CO 0.00 2.23 0.00 -0.45 0.00 0.00 0.00 173.10 174.89 1ya7 s SER 119 N 1.08 0.96 -0.03 1.64 0.15 -1.26 -1.02 113.70 115.22 1ya7 s SER 119 Ca 0.62 -0.04 0.01 0.00 0.70 0.00 0.00 55.95 57.24 1ya7 s SER 119 Cb -0.34 -0.31 0.02 0.00 -1.71 0.00 0.00 66.02 63.68 1ya7 s SER 119 CO 0.30 -0.14 -0.02 -0.69 1.20 0.00 0.00 173.24 173.89 1ya7 s VAL 120 N 1.46 0.29 0.29 4.45 1.01 -0.53 -4.97 120.40 122.40 1ya7 s VAL 120 Ca -0.03 0.01 -0.28 0.00 0.00 0.00 0.00 61.98 61.67 1ya7 s VAL 120 Cb -0.13 -0.36 -0.09 0.00 0.00 0.00 0.00 36.38 35.80 1ya7 s VAL 120 CO -0.03 0.17 1.00 -0.70 0.00 0.00 0.00 175.10 175.54 1ya7 s GLU 121 N 0.92 4.66 0.20 2.72 2.12 -1.26 -1.13 118.70 126.94 1ya7 s GLU 121 Ca -0.10 1.55 -0.08 0.00 0.36 0.00 0.00 54.97 56.69 1ya7 s GLU 121 Cb -0.13 -3.07 -0.02 0.00 0.26 0.00 0.00 34.13 31.17 1ya7 s GLU 121 CO -0.01 0.30 0.31 0.34 -0.54 0.00 0.00 175.26 175.67 1ya7 s ASP 122 N -1.23 0.02 0.22 -1.70 -1.08 -0.67 -4.97 116.67 107.26 1ya7 s ASP 122 Ca 0.46 -1.03 0.07 0.00 -0.52 0.00 0.00 52.55 51.53 1ya7 s ASP 122 Cb -0.26 0.48 0.19 0.00 -1.46 0.00 0.00 42.92 41.87 1ya7 s ASP 122 CO 0.32 -0.97 1.51 0.40 0.52 0.00 0.00 175.17 176.95 1ya7 h ILE 123 N 2.46 1.48 -3.53 4.11 2.04 -1.95 -3.36 117.51 118.76 1ya7 h ILE 123 Ca -0.31 -2.36 -0.05 0.00 1.00 0.00 0.00 64.86 63.14 1ya7 h ILE 123 Cb 1.24 2.27 -0.11 0.00 -0.74 0.00 0.00 36.82 39.49 1ya7 h ILE 123 CO 0.45 0.68 -0.10 -0.72 0.00 0.00 0.00 178.15 178.46 1ya7 s TYR 124 N -3.44 0.11 0.12 1.37 -0.85 -1.26 -1.01 117.35 112.39 1ya7 s TYR 124 Ca -0.02 -0.47 -0.25 0.00 -0.52 0.00 0.00 57.07 55.81 1ya7 s TYR 124 Cb 0.12 0.23 0.08 0.00 0.38 0.00 0.00 41.96 42.76 1ya7 s TYR 124 CO 0.79 -0.88 0.73 0.00 -1.52 0.00 0.00 175.55 174.67 1ya7 s ALA 125 N -3.93 -1.64 -0.02 9.51 0.00 -0.48 -5.00 121.76 120.20 1ya7 s ALA 125 Ca 0.14 0.57 -0.08 0.00 0.00 0.00 0.00 51.96 52.59 1ya7 s ALA 125 Cb 0.00 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.85 1ya7 s ALA 125 CO 0.00 -0.78 0.18 0.45 0.00 0.00 0.00 175.76 175.61 1ya7 s SER 126 N -2.69 -0.07 0.27 0.00 0.15 -1.26 -1.24 113.70 108.86 1ya7 s SER 126 Ca 0.04 0.01 0.03 0.00 0.70 0.00 0.00 55.95 56.73 1ya7 s SER 126 Cb -0.01 0.28 -0.06 0.00 -1.71 0.00 0.00 66.02 64.52 1ya7 s SER 126 CO -0.09 -0.29 0.06 0.42 1.20 0.00 0.00 173.24 174.53 1ya7 s THR 127 N -0.94 0.90 0.00 6.45 -4.23 -0.45 -4.88 115.64 112.50 1ya7 s THR 127 Ca -0.10 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.40 1ya7 s THR 127 Cb -0.05 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 71.18 1ya7 s THR 127 CO 0.02 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 1ya7 n GLY 128 N -0.52 -0.01 0.27 3.99 0.00 -1.26 -1.59 105.19 106.07 1ya7 n GLY 128 Ca -0.02 -1.89 0.10 0.00 0.00 0.00 0.00 46.02 44.21 1ya7 n GLY 128 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ya7 h SER 129 N 0.00 0.00 0.88 1.61 4.64 -1.66 -2.10 113.55 116.91 1ya7 h SER 129 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ya7 h SER 129 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ya7 h SER 129 CO 0.00 0.00 -0.18 0.61 -0.87 0.00 0.00 176.83 176.39 1ya7 n GLY 130 N -1.49 -1.44 0.38 -0.77 0.00 0.86 -4.42 105.19 98.31 1ya7 n GLY 130 Ca -0.03 -0.18 0.14 0.00 0.00 0.00 0.00 46.02 45.96 1ya7 n GLY 130 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ya7 h SER 131 N 0.00 0.51 -0.58 1.61 4.64 -1.52 -1.94 113.55 116.26 1ya7 h SER 131 Ca 0.00 0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.33 1ya7 h SER 131 Cb 0.53 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.52 1ya7 h SER 131 CO 0.00 0.25 0.29 -0.65 -0.87 0.00 0.00 176.83 175.85 1ya7 h PRO 132 N 0.53 0.86 -0.33 4.77 0.11 -1.81 -0.94 132.00 135.18 1ya7 h PRO 132 Ca 0.42 -0.11 -0.04 0.00 0.11 0.00 0.00 66.00 66.38 1ya7 h PRO 132 Cb 0.84 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 1ya7 h PRO 132 CO -0.17 0.67 0.05 0.74 -0.21 0.00 0.00 178.00 179.08 1ya7 h PHE 133 N 0.86 0.59 -0.07 0.65 0.04 -1.68 -2.46 116.94 114.86 1ya7 h PHE 133 Ca 0.21 -0.08 0.04 0.00 2.80 0.00 0.00 57.97 60.94 1ya7 h PHE 133 Cb 0.09 -0.16 -0.05 0.00 2.20 0.00 0.00 35.95 38.03 1ya7 h PHE 133 CO 0.01 0.62 -0.22 0.28 -0.60 0.00 0.00 178.31 178.39 1ya7 h VAL 134 N 0.38 0.47 -0.61 -0.55 2.07 -1.34 -2.42 116.25 114.24 1ya7 h VAL 134 Ca 0.10 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.73 1ya7 h VAL 134 Cb 0.35 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 1ya7 h VAL 134 CO 0.01 0.00 0.41 1.88 0.02 0.00 0.00 177.57 179.89 1ya7 h TYR 135 N -0.31 0.38 0.33 1.57 0.05 -1.10 -1.03 116.97 116.86 1ya7 h TYR 135 Ca 0.08 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.87 1ya7 h TYR 135 Cb 0.43 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 38.02 1ya7 h TYR 135 CO -0.30 0.17 -0.41 0.78 -1.05 0.00 0.00 178.16 177.35 1ya7 h GLY 136 N 0.35 -0.94 0.87 3.88 0.00 -0.96 -1.34 103.07 104.94 1ya7 h GLY 136 Ca 0.29 0.48 0.02 0.00 0.00 0.00 0.00 47.33 48.12 1ya7 h GLY 136 CO -0.07 -0.31 0.31 -2.08 0.00 0.00 0.00 176.54 174.39 1ya7 h VAL 137 N -0.79 1.05 -0.36 4.60 2.07 -1.07 -2.73 116.25 119.02 1ya7 h VAL 137 Ca -0.02 -0.21 -0.16 0.00 0.82 0.00 0.00 66.70 67.12 1ya7 h VAL 137 Cb 0.73 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1ya7 h VAL 137 CO -0.11 0.11 -0.42 -0.07 0.02 0.00 0.00 177.57 177.10 1ya7 h LEU 138 N 0.62 0.98 -0.67 2.57 3.38 -1.22 0.94 115.31 121.90 1ya7 h LEU 138 Ca 0.21 -0.46 0.04 0.00 0.09 0.00 0.00 57.88 57.76 1ya7 h LEU 138 Cb 0.03 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 1ya7 h LEU 138 CO -0.10 1.26 0.40 -0.33 0.09 0.00 0.00 178.44 179.76 1ya7 h GLU 139 N 0.73 0.73 -0.07 1.13 4.39 -1.24 0.53 114.58 120.79 1ya7 h GLU 139 Ca 0.05 -0.04 -0.22 0.00 0.34 0.00 0.00 59.36 59.49 1ya7 h GLU 139 Cb 1.01 -0.17 0.01 0.00 -0.10 0.00 0.00 28.75 29.51 1ya7 h GLU 139 CO 0.10 0.49 -0.80 1.03 -1.16 0.00 0.00 179.01 178.67 1ya7 h SER 140 N 0.76 0.83 -0.00 1.42 0.87 -1.27 -3.41 113.55 112.75 1ya7 h SER 140 Ca 0.29 -0.69 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1ya7 h SER 140 Cb 0.11 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 61.82 1ya7 h SER 140 CO -0.15 1.39 -0.07 0.00 -0.53 0.00 0.00 176.83 177.47 1ya7 n GLN 141 N -4.00 6.21 -2.28 2.24 6.02 0.30 -5.02 117.38 120.86 1ya7 n GLN 141 Ca -0.09 -0.02 -0.41 0.00 -0.01 0.00 0.00 57.00 56.47 1ya7 n GLN 141 Cb 0.76 -0.59 -0.03 0.00 1.02 0.00 0.00 30.24 31.40 1ya7 n GLN 141 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1ya7 s TYR 142 N -1.11 3.31 -0.01 1.08 5.04 0.17 -5.00 117.35 120.82 1ya7 s TYR 142 Ca 0.01 1.40 0.02 0.00 -2.44 0.00 0.00 57.07 56.06 1ya7 s TYR 142 Cb 0.01 -3.52 -0.00 0.00 0.35 0.00 0.00 41.96 38.80 1ya7 s TYR 142 CO 0.06 -1.47 -0.08 0.45 -1.34 0.00 0.00 175.55 173.17 1ya7 s SER 143 N -0.15 1.02 0.39 4.32 0.15 -1.26 -4.97 113.70 113.20 1ya7 s SER 143 Ca 0.52 -0.16 0.28 0.00 0.70 0.00 0.00 55.95 57.29 1ya7 s SER 143 Cb -0.36 -0.17 1.34 0.00 -1.71 0.00 0.00 66.02 65.12 1ya7 s SER 143 CO 0.42 0.09 1.85 -0.33 1.20 0.00 0.00 173.24 176.46 1ya7 h GLU 144 N 6.11 0.00 -0.00 5.44 5.08 -1.96 -2.81 114.58 126.44 1ya7 h GLU 144 Ca -0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1ya7 h GLU 144 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1ya7 h GLU 144 CO 0.49 0.00 -0.32 1.63 -1.00 0.00 0.00 179.01 179.82 1ya7 n LYS 145 N -2.53 0.31 -1.62 2.33 5.02 -1.26 -4.36 118.16 116.05 1ya7 n LYS 145 Ca -0.00 -0.15 -0.38 0.00 -2.02 0.00 0.00 58.31 55.76 1ya7 n LYS 145 Cb 0.16 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.72 1ya7 n LYS 145 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1ya7 n MET 146 N -1.21 0.94 -2.26 1.97 2.81 -1.06 -5.01 117.12 113.30 1ya7 n MET 146 Ca 0.09 0.36 -0.26 0.00 -1.81 0.00 0.00 57.70 56.08 1ya7 n MET 146 Cb 0.33 -2.17 0.05 0.00 -0.71 0.00 0.00 33.22 30.72 1ya7 n MET 146 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1ya7 s THR 147 N -1.50 2.79 0.35 2.03 -4.23 -1.26 -4.71 115.64 109.12 1ya7 s THR 147 Ca 0.75 -0.16 0.05 0.00 -1.18 0.00 0.00 61.69 61.15 1ya7 s THR 147 Cb -0.42 -3.17 0.28 0.00 1.34 0.00 0.00 72.50 70.53 1ya7 s THR 147 CO 0.48 -0.18 1.97 0.58 -0.54 0.00 0.00 174.62 176.93 1ya7 h VAL 148 N -0.45 1.06 -0.64 2.29 2.07 -1.99 -0.83 116.25 117.77 1ya7 h VAL 148 Ca -0.45 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 66.73 1ya7 h VAL 148 Cb 1.29 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1ya7 h VAL 148 CO 0.60 0.15 0.14 0.44 0.02 0.00 0.00 177.57 178.92 1ya7 h ASP 149 N 0.80 0.98 -0.44 0.57 3.32 -2.00 -1.90 116.42 117.76 1ya7 h ASP 149 Ca 0.30 -0.24 -0.09 0.00 0.02 0.00 0.00 57.03 57.02 1ya7 h ASP 149 Cb 0.17 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1ya7 h ASP 149 CO -0.09 0.96 -0.08 -0.33 -1.72 0.00 0.00 179.24 177.98 1ya7 h GLU 150 N 0.94 0.83 -0.50 3.56 5.08 -1.74 -2.50 114.58 120.25 1ya7 h GLU 150 Ca 0.20 -0.30 -0.10 0.00 -1.00 0.00 0.00 59.36 58.16 1ya7 h GLU 150 Cb 0.38 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1ya7 h GLU 150 CO 0.00 0.93 -0.07 0.78 -1.00 0.00 0.00 179.01 179.65 1ya7 h GLY 151 N 0.66 0.97 0.99 -3.84 0.00 -1.15 -0.25 103.07 100.46 1ya7 h GLY 151 Ca 0.12 -0.73 -0.02 0.00 0.00 0.00 0.00 47.33 46.70 1ya7 h GLY 151 CO 0.04 0.67 0.29 -2.08 0.00 0.00 0.00 176.54 175.45 1ya7 h VAL 152 N 0.82 1.20 -0.74 4.60 2.07 -1.29 -1.18 116.25 121.72 1ya7 h VAL 152 Ca 0.14 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 67.05 1ya7 h VAL 152 Cb 0.59 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1ya7 h VAL 152 CO 0.04 0.23 0.28 0.44 0.02 0.00 0.00 177.57 178.58 1ya7 h ASP 153 N 0.78 1.03 -0.12 0.57 5.19 -1.05 -2.16 116.42 120.65 1ya7 h ASP 153 Ca 0.20 -0.16 -0.01 0.00 -0.62 0.00 0.00 57.03 56.44 1ya7 h ASP 153 Cb 0.10 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 1ya7 h ASP 153 CO -0.03 0.92 0.05 0.25 -3.12 0.00 0.00 179.24 177.32 1ya7 h LEU 154 N 1.08 0.17 -1.04 1.55 5.85 -0.42 0.23 115.31 122.73 1ya7 h LEU 154 Ca 0.25 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.72 1ya7 h LEU 154 Cb 0.23 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1ya7 h LEU 154 CO -0.02 0.28 -0.34 -0.37 -0.34 0.00 0.00 178.44 177.65 1ya7 h VAL 155 N 0.05 1.28 -0.32 1.05 -1.51 -1.21 0.75 116.25 116.34 1ya7 h VAL 155 Ca 0.04 -1.34 -0.02 0.00 -1.23 0.00 0.00 66.70 64.15 1ya7 h VAL 155 Cb 0.16 1.56 -0.01 0.00 -2.13 0.00 0.00 31.29 30.86 1ya7 h VAL 155 CO -0.00 0.40 0.13 0.40 -1.23 0.00 0.00 177.57 177.27 1ya7 h ILE 156 N 0.22 1.18 -0.26 7.19 2.04 -1.09 -1.66 117.51 125.13 1ya7 h ILE 156 Ca 0.03 -0.55 0.03 0.00 1.00 0.00 0.00 64.86 65.37 1ya7 h ILE 156 Cb 0.71 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 1ya7 h ILE 156 CO 0.05 0.19 0.06 0.03 0.00 0.00 0.00 178.15 178.49 1ya7 h ARG 157 N 0.38 0.16 0.21 2.37 3.08 -0.57 0.46 114.38 120.47 1ya7 h ARG 157 Ca 0.11 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1ya7 h ARG 157 Cb 0.18 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 1ya7 h ARG 157 CO -0.01 0.11 -0.21 0.00 -1.07 0.00 0.00 179.97 178.79 1ya7 h ALA 158 N 1.18 -0.43 -0.48 0.04 0.00 -0.78 -1.24 119.26 117.56 1ya7 h ALA 158 Ca 0.12 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1ya7 h ALA 158 Cb 0.11 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ya7 h ALA 158 CO -0.15 -0.77 -0.08 0.82 0.00 0.00 0.00 179.25 179.07 1ya7 h ILE 159 N -0.45 1.26 -0.78 0.00 2.04 -1.29 -1.41 117.51 116.87 1ya7 h ILE 159 Ca -0.00 -1.17 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1ya7 h ILE 159 Cb 0.43 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 1ya7 h ILE 159 CO -0.05 0.41 0.43 0.28 0.00 0.00 0.00 178.15 179.22 1ya7 h SER 160 N 0.78 0.97 -0.49 1.72 0.02 -0.69 0.26 113.55 116.12 1ya7 h SER 160 Ca 0.13 -0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 1ya7 h SER 160 Cb 0.59 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 1ya7 h SER 160 CO 0.04 0.78 0.17 0.00 -1.14 0.00 0.00 176.83 176.68 1ya7 h ALA 161 N 1.23 0.64 -0.43 3.77 0.00 -0.93 -2.70 119.26 120.83 1ya7 h ALA 161 Ca 0.28 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1ya7 h ALA 161 Cb 0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1ya7 h ALA 161 CO -0.05 0.27 0.26 0.00 0.00 0.00 0.00 179.25 179.74 1ya7 h ALA 162 N 1.02 0.55 0.00 0.00 0.00 -0.86 -2.57 119.26 117.40 1ya7 h ALA 162 Ca 0.16 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ya7 h ALA 162 Cb 0.24 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ya7 h ALA 162 CO -0.01 -0.06 -0.01 0.87 0.00 0.00 0.00 179.25 180.05 1ya7 h LYS 163 N 0.53 0.00 0.00 0.00 1.57 -0.74 0.11 116.57 118.04 1ya7 h LYS 163 Ca 0.17 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.88 1ya7 h LYS 163 Cb -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1ya7 h LYS 163 CO -0.07 0.01 -0.32 1.96 -0.57 0.00 0.00 179.45 180.46 1ya7 h GLN 164 N 0.00 0.00 0.00 3.15 1.08 -1.14 -3.37 115.11 114.82 1ya7 h GLN 164 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ya7 h GLN 164 Cb 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1ya7 h GLN 164 CO 0.00 0.32 -0.02 0.54 -0.95 0.00 0.00 178.83 178.73 1ya7 n ARG 165 N -3.35 6.57 -3.98 1.46 5.12 -0.69 -4.95 116.66 116.84 1ya7 n ARG 165 Ca 0.01 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.60 1ya7 n ARG 165 Cb 0.54 -0.49 -0.14 0.00 -1.16 0.00 0.00 32.46 31.21 1ya7 n ARG 165 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1ya7 s ASP 166 N -0.97 4.72 0.25 0.55 2.15 0.31 -4.98 116.67 118.70 1ya7 s ASP 166 Ca 0.00 -1.53 0.24 0.00 0.43 0.00 0.00 52.55 51.69 1ya7 s ASP 166 Cb 0.00 -1.64 0.95 0.00 -0.30 0.00 0.00 42.92 41.93 1ya7 s ASP 166 CO 0.00 -0.28 1.72 -1.54 -0.17 0.00 0.00 175.17 174.91 1ya7 n SER 167 N 4.48 0.69 -0.31 -0.34 3.41 -1.26 -1.36 113.62 118.93 1ya7 n SER 167 Ca -0.10 0.65 0.12 0.00 -0.26 0.00 0.00 58.87 59.28 1ya7 n SER 167 Cb 0.42 -0.80 0.55 0.00 -0.26 0.00 0.00 64.21 64.12 1ya7 n SER 167 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ya7 n ALA 168 N -1.77 2.58 -2.55 7.33 0.00 -1.26 -4.80 120.51 120.04 1ya7 n ALA 168 Ca 0.03 -0.35 -0.31 0.00 0.00 0.00 0.00 53.44 52.81 1ya7 n ALA 168 Cb 0.27 -1.23 -0.11 0.00 0.00 0.00 0.00 19.45 18.38 1ya7 n ALA 168 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1ya7 s SER 169 N -1.76 4.32 0.00 0.00 0.01 -0.46 -1.34 113.70 114.47 1ya7 s SER 169 Ca 0.35 -0.32 0.00 0.00 1.31 0.00 0.00 55.95 57.29 1ya7 s SER 169 Cb 0.18 -0.85 0.00 0.00 0.21 0.00 0.00 66.02 65.56 1ya7 s SER 169 CO 0.29 0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.78 1ya7 n GLY 170 N 1.17 0.85 3.11 3.44 0.00 -1.26 -4.79 105.19 107.70 1ya7 n GLY 170 Ca -0.15 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 44.95 1ya7 n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ya7 n GLY 171 N -0.33 -2.19 3.77 -0.02 0.00 -1.26 -1.97 105.19 103.19 1ya7 n GLY 171 Ca 0.00 -1.72 -0.40 0.00 0.00 0.00 0.00 46.02 43.89 1ya7 n GLY 171 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ya7 s MET 172 N -0.21 4.32 -0.06 1.61 -2.45 -1.26 -4.69 119.30 116.56 1ya7 s MET 172 Ca 0.00 2.11 -0.27 0.00 -1.25 0.00 0.00 55.69 56.28 1ya7 s MET 172 Cb 0.00 -3.01 -0.03 0.00 1.25 0.00 0.00 34.83 33.04 1ya7 s MET 172 CO 0.00 -0.18 0.88 0.42 1.05 0.00 0.00 175.02 177.20 1ya7 s ILE 173 N -1.18 4.91 -0.06 10.11 1.01 -1.26 -3.91 121.20 130.82 1ya7 s ILE 173 Ca 0.50 1.82 -0.07 0.00 0.00 0.00 0.00 60.65 62.90 1ya7 s ILE 173 Cb -0.38 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 37.84 1ya7 s ILE 173 CO 0.49 0.14 0.21 -1.81 0.00 0.00 0.00 174.94 173.97 1ya7 s ASP 174 N 0.99 6.45 -0.05 3.58 -0.00 0.13 -4.97 116.67 122.80 1ya7 s ASP 174 Ca 0.45 0.51 -0.03 0.00 -0.00 0.00 0.00 52.55 53.49 1ya7 s ASP 174 Cb -0.19 -2.08 0.03 0.00 -0.00 0.00 0.00 42.92 40.68 1ya7 s ASP 174 CO 0.21 0.33 0.13 -0.69 -0.00 0.00 0.00 175.17 175.16 1ya7 s VAL 175 N -1.16 -0.03 0.05 -1.27 1.01 -1.26 -1.78 120.40 115.95 1ya7 s VAL 175 Ca 0.21 0.11 0.08 0.00 0.00 0.00 0.00 61.98 62.37 1ya7 s VAL 175 Cb -0.13 -0.20 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 1ya7 s VAL 175 CO 0.11 0.04 -0.21 0.00 0.00 0.00 0.00 175.10 175.04 1ya7 s ALA 176 N 0.70 1.81 -0.07 5.51 0.00 0.05 -0.78 121.76 128.98 1ya7 s ALA 176 Ca -0.05 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 50.86 1ya7 s ALA 176 Cb -0.07 -0.35 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 1ya7 s ALA 176 CO -0.03 0.41 -0.19 0.08 0.00 0.00 0.00 175.76 176.03 1ya7 s VAL 177 N -0.82 2.63 -0.14 0.00 1.01 -0.24 -1.19 120.40 121.65 1ya7 s VAL 177 Ca 0.08 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.23 1ya7 s VAL 177 Cb -0.09 -2.02 0.01 0.00 0.00 0.00 0.00 36.38 34.28 1ya7 s VAL 177 CO 0.02 0.57 -0.22 -0.63 0.00 0.00 0.00 175.10 174.84 1ya7 s ILE 178 N -0.25 2.08 0.07 2.22 1.01 0.19 -0.96 121.20 125.56 1ya7 s ILE 178 Ca 0.00 -0.98 -0.00 0.00 0.00 0.00 0.00 60.65 59.67 1ya7 s ILE 178 Cb -0.13 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.47 1ya7 s ILE 178 CO 0.03 0.55 -0.03 0.42 0.00 0.00 0.00 174.94 175.91 1ya7 s THR 179 N 0.81 0.32 0.21 2.92 -4.23 -0.53 -1.14 115.64 114.01 1ya7 s THR 179 Ca -0.07 -1.85 -0.09 0.00 -1.18 0.00 0.00 61.69 58.50 1ya7 s THR 179 Cb -0.16 -1.60 0.16 0.00 1.34 0.00 0.00 72.50 72.25 1ya7 s THR 179 CO -0.02 -0.93 1.85 -0.09 -0.54 0.00 0.00 174.62 174.90 1ya7 h ARG 180 N 3.08 1.06 -0.16 3.99 9.65 -1.86 0.32 114.38 130.46 1ya7 h ARG 180 Ca -0.34 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.42 1ya7 h ARG 180 Cb 1.15 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 29.50 1ya7 h ARG 180 CO 0.65 0.75 0.04 -0.22 2.80 0.00 0.00 179.97 183.99 1ya7 h LYS 181 N 1.07 0.25 -0.01 0.20 3.64 -1.97 -3.33 116.57 116.43 1ya7 h LYS 181 Ca 0.28 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1ya7 h LYS 181 Cb -0.04 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1ya7 h LYS 181 CO -0.05 0.39 -0.24 -0.25 -2.27 0.00 0.00 179.45 177.03 1ya7 n ASP 182 N -4.82 1.31 0.00 4.20 8.00 -1.24 -5.10 116.55 118.91 1ya7 n ASP 182 Ca -0.05 -1.16 0.00 0.00 0.71 0.00 0.00 54.79 54.30 1ya7 n ASP 182 Cb 0.16 0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 1ya7 n ASP 182 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ya7 n GLY 183 N 0.95 0.73 3.64 0.44 0.00 0.11 -4.65 105.19 106.41 1ya7 n GLY 183 Ca 0.05 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.86 1ya7 n GLY 183 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ya7 s TYR 184 N 0.00 3.31 -0.11 1.61 6.14 -1.16 -1.45 117.35 125.70 1ya7 s TYR 184 Ca 0.00 0.97 0.00 0.00 0.64 0.00 0.00 57.07 58.68 1ya7 s TYR 184 Cb 0.00 -2.92 0.02 0.00 0.42 0.00 0.00 41.96 39.49 1ya7 s TYR 184 CO 0.00 -0.32 -0.10 0.08 0.64 0.00 0.00 175.55 175.85 1ya7 s VAL 185 N 2.50 1.18 -0.14 3.14 1.01 -0.14 -5.00 120.40 122.96 1ya7 s VAL 185 Ca 0.30 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.58 1ya7 s VAL 185 Cb -0.16 -1.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.07 1ya7 s VAL 185 CO 0.09 0.39 1.09 -1.10 0.00 0.00 0.00 175.10 175.56 1ya7 s GLN 186 N 1.41 4.34 0.31 2.72 -0.21 -1.26 -1.08 119.66 125.88 1ya7 s GLN 186 Ca 0.00 1.48 -0.29 0.00 0.02 0.00 0.00 55.36 56.57 1ya7 s GLN 186 Cb -0.13 -3.60 -0.10 0.00 1.00 0.00 0.00 33.01 30.17 1ya7 s GLN 186 CO -0.06 -0.49 1.24 -0.51 -2.12 0.00 0.00 175.29 173.36 1ya7 s LEU 187 N 2.60 4.47 0.49 2.90 1.43 0.04 -4.98 118.68 125.63 1ya7 s LEU 187 Ca 0.49 2.56 -0.22 0.00 -1.03 0.00 0.00 54.13 55.94 1ya7 s LEU 187 Cb -0.19 -3.64 -0.07 0.00 0.03 0.00 0.00 46.19 42.32 1ya7 s LEU 187 CO 0.15 -0.42 1.19 -2.84 0.23 0.00 0.00 176.35 174.66 1ya7 s PRO 188 N -1.68 3.57 0.20 1.29 0.02 -1.26 -4.73 135.00 132.41 1ya7 s PRO 188 Ca 0.48 1.81 -0.11 0.00 0.02 0.00 0.00 61.00 63.20 1ya7 s PRO 188 Cb -0.37 -2.30 0.16 0.00 0.02 0.00 0.00 34.50 32.01 1ya7 s PRO 188 CO 0.49 -0.71 1.83 1.15 -0.33 0.00 0.00 177.00 179.43 1ya7 h THR 189 N 1.66 1.06 -0.91 0.99 2.02 -1.95 -1.95 112.91 113.84 1ya7 h THR 189 Ca -0.50 -0.26 0.15 0.00 0.77 0.00 0.00 66.41 66.57 1ya7 h THR 189 Cb 1.26 0.25 -0.07 0.00 -1.74 0.00 0.00 68.15 67.84 1ya7 h THR 189 CO 0.59 0.14 0.59 0.44 0.37 0.00 0.00 175.52 177.64 1ya7 h ASP 190 N 0.75 0.69 -0.41 4.18 3.32 -1.99 0.07 116.42 123.03 1ya7 h ASP 190 Ca 0.26 0.05 -0.13 0.00 0.02 0.00 0.00 57.03 57.22 1ya7 h ASP 190 Cb 0.04 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1ya7 h ASP 190 CO -0.11 0.34 -0.26 -0.61 -1.72 0.00 0.00 179.24 176.88 1ya7 h GLN 191 N 0.72 0.91 -0.35 3.56 4.15 -1.74 -2.08 115.11 120.29 1ya7 h GLN 191 Ca 0.46 -0.42 -0.03 0.00 0.77 0.00 0.00 58.65 59.43 1ya7 h GLN 191 Cb 0.72 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.39 1ya7 h GLN 191 CO -0.22 1.08 0.10 0.82 -1.93 0.00 0.00 178.83 178.67 1ya7 h ILE 192 N 0.73 1.22 -0.83 2.39 2.04 -0.95 -1.89 117.51 120.23 1ya7 h ILE 192 Ca 0.08 -0.73 0.08 0.00 1.00 0.00 0.00 64.86 65.30 1ya7 h ILE 192 Cb 0.84 1.03 -0.07 0.00 -0.74 0.00 0.00 36.82 37.88 1ya7 h ILE 192 CO 0.07 0.25 0.48 -0.33 0.00 0.00 0.00 178.15 178.62 1ya7 h GLU 193 N 0.42 0.81 -0.69 2.37 5.08 -1.05 0.10 114.58 121.61 1ya7 h GLU 193 Ca 0.11 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1ya7 h GLU 193 Cb 0.28 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1ya7 h GLU 193 CO -0.00 0.53 0.31 1.03 -1.00 0.00 0.00 179.01 179.89 1ya7 h SER 194 N 0.83 0.92 0.06 1.42 0.87 -1.29 -0.75 113.55 115.62 1ya7 h SER 194 Ca 0.39 -0.15 -0.15 0.00 -1.23 0.00 0.00 61.79 60.65 1ya7 h SER 194 Cb 0.31 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 1ya7 h SER 194 CO -0.22 0.81 -0.51 0.03 -0.53 0.00 0.00 176.83 176.41 1ya7 h ARG 195 N 0.97 0.51 -0.65 2.24 3.08 -0.53 0.24 114.38 120.22 1ya7 h ARG 195 Ca 0.23 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 1ya7 h ARG 195 Cb 0.15 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 1ya7 h ARG 195 CO -0.03 0.90 0.27 0.82 -1.07 0.00 0.00 179.97 180.86 1ya7 h ILE 196 N 0.40 1.22 0.08 2.04 2.04 -0.57 0.18 117.51 122.90 1ya7 h ILE 196 Ca 0.01 -0.69 -0.00 0.00 1.00 0.00 0.00 64.86 65.18 1ya7 h ILE 196 Cb 1.03 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1ya7 h ILE 196 CO 0.09 0.28 -0.04 -0.09 0.00 0.00 0.00 178.15 178.40 1ya7 h ARG 197 N 0.94 -0.10 -0.87 2.37 2.43 -0.97 -1.42 114.38 116.76 1ya7 h ARG 197 Ca 0.22 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.45 1ya7 h ARG 197 Cb 0.16 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.68 1ya7 h ARG 197 CO -0.02 0.37 0.57 -0.22 -1.51 0.00 0.00 179.97 179.15 1ya7 h LYS 198 N -0.62 0.99 0.00 0.20 3.64 -0.86 -2.64 116.57 117.28 1ya7 h LYS 198 Ca -0.01 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1ya7 h LYS 198 Cb 0.51 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1ya7 h LYS 198 CO 0.02 0.65 0.00 1.28 -2.27 0.00 0.00 179.45 179.13 1ya7 n LEU 199 N -4.47 0.25 -0.42 5.20 4.77 0.04 -4.95 117.00 117.42 1ya7 n LEU 199 Ca 0.12 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.63 1ya7 n LEU 199 Cb 0.16 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 1ya7 n LEU 199 CO 0.34 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1ya7 n GLY 200 N 1.36 0.92 1.80 -0.72 0.00 -0.99 -5.08 105.19 102.48 1ya7 n GLY 200 Ca 0.06 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.43 1ya7 n GLY 200 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ya7 n LEU 201 N -0.42 0.00 0.00 0.99 4.77 -0.56 -5.06 117.00 116.72 1ya7 n LEU 201 Ca 0.00 -1.48 0.00 0.00 -0.03 0.00 0.00 56.01 54.50 1ya7 n LEU 201 Cb 0.39 0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1ya7 n LEU 201 CO 0.00 -0.31 0.00 2.30 -1.33 0.00 0.00 177.39 178.05 1ya7 n ILE 202 N -0.85 0.00 -0.43 -0.08 -5.35 -1.26 -4.80 119.36 106.60 1ya7 n ILE 202 Ca -0.06 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 1ya7 n ILE 202 Cb 0.31 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.21 1ya7 n ILE 202 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68