#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yj2 h GLU 5 N 0.00 0.00 0.00 1.61 4.11 -1.91 -1.33 114.58 117.06 1yj2 h GLU 5 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 1yj2 h GLU 5 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1yj2 h GLU 5 CO 0.00 0.09 -0.01 0.93 0.07 0.00 0.00 179.01 180.08 1yj2 h GLU 6 N 0.00 0.00 0.00 1.06 5.08 -1.99 -1.34 114.58 117.39 1yj2 h GLU 6 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1yj2 h GLU 6 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1yj2 h GLU 6 CO 0.01 0.01 0.00 1.28 -1.00 0.00 0.00 179.01 179.31 1yj2 n LEU 7 N -3.47 0.00 -0.38 1.33 4.77 -0.50 -3.77 117.00 114.98 1yj2 n LEU 7 Ca -0.03 0.45 0.05 0.00 -0.03 0.00 0.00 56.01 56.44 1yj2 n LEU 7 Cb 0.10 -0.45 0.11 0.00 -2.33 0.00 0.00 43.42 40.86 1yj2 n LEU 7 CO 0.24 -0.02 0.59 0.49 -1.33 0.00 0.00 177.39 177.37 1yj2 n PHE 8 N -1.45 0.31 0.59 -1.77 3.01 -0.51 -4.68 117.46 112.97 1yj2 n PHE 8 Ca 0.09 -0.62 0.12 0.00 1.01 0.00 0.00 57.45 58.05 1yj2 n PHE 8 Cb 0.30 -0.09 0.45 0.00 -0.01 0.00 0.00 39.48 40.13 1yj2 n PHE 8 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1yj2 n THR 9 N -0.25 0.63 -3.89 4.37 -2.24 -1.25 -4.22 114.28 107.43 1yj2 n THR 9 Ca 0.10 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1yj2 n THR 9 Cb 0.46 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 1yj2 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yj2 n GLY 10 N 0.83 4.56 3.72 3.38 0.00 -1.26 -4.82 105.19 111.60 1yj2 n GLY 10 Ca 0.04 -2.15 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 1yj2 n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yj2 s VAL 11 N -0.87 4.02 -0.11 1.61 1.01 -1.26 -4.51 120.40 120.28 1yj2 s VAL 11 Ca 0.00 1.50 0.03 0.00 0.00 0.00 0.00 61.98 63.51 1yj2 s VAL 11 Cb 0.00 -3.96 0.01 0.00 0.00 0.00 0.00 36.38 32.42 1yj2 s VAL 11 CO 0.00 0.15 -0.21 -0.69 0.00 0.00 0.00 175.10 174.34 1yj2 s VAL 12 N 0.80 1.92 0.45 2.92 1.01 -0.18 -4.96 120.40 122.36 1yj2 s VAL 12 Ca 0.57 -0.92 -0.23 0.00 0.00 0.00 0.00 61.98 61.40 1yj2 s VAL 12 Cb -0.29 -1.68 -0.07 0.00 0.00 0.00 0.00 36.38 34.33 1yj2 s VAL 12 CO 0.30 0.53 1.16 -2.16 0.00 0.00 0.00 175.10 174.94 1yj2 s PRO 13 N 0.59 3.78 -0.03 2.72 0.05 -1.26 -1.22 135.00 139.63 1yj2 s PRO 13 Ca -0.13 1.78 0.05 0.00 0.05 0.00 0.00 61.00 62.74 1yj2 s PRO 13 Cb -0.17 -2.43 -0.01 0.00 0.05 0.00 0.00 34.50 31.95 1yj2 s PRO 13 CO 0.04 -0.53 -0.17 0.42 0.05 0.00 0.00 177.00 176.81 1yj2 s ILE 14 N -1.54 1.36 -0.04 0.56 1.01 -0.08 -1.22 121.20 121.26 1yj2 s ILE 14 Ca 0.63 -0.70 0.06 0.00 0.00 0.00 0.00 60.65 60.64 1yj2 s ILE 14 Cb -0.29 -1.15 -0.01 0.00 0.01 0.00 0.00 42.46 41.02 1yj2 s ILE 14 CO 0.35 0.39 -0.22 -0.76 0.00 0.00 0.00 174.94 174.69 1yj2 s LEU 15 N -0.13 2.03 -0.08 2.97 1.43 -0.37 -2.04 118.68 122.49 1yj2 s LEU 15 Ca 0.00 -0.43 0.04 0.00 -1.03 0.00 0.00 54.13 52.71 1yj2 s LEU 15 Cb -0.09 -1.20 0.00 0.00 0.03 0.00 0.00 46.19 44.93 1yj2 s LEU 15 CO 0.01 0.25 -0.19 -0.69 0.23 0.00 0.00 176.35 175.95 1yj2 s VAL 16 N -0.31 1.67 -0.05 -1.59 1.01 -0.07 -1.01 120.40 120.05 1yj2 s VAL 16 Ca 0.02 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.20 1yj2 s VAL 16 Cb -0.11 -1.46 0.02 0.00 0.00 0.00 0.00 36.38 34.84 1yj2 s VAL 16 CO 0.01 0.47 -0.04 -1.61 0.00 0.00 0.00 175.10 173.94 1yj2 s GLU 17 N 0.34 0.82 -0.02 2.72 0.41 -0.11 -0.40 118.70 122.46 1yj2 s GLU 17 Ca -0.14 -0.07 0.03 0.00 -0.41 0.00 0.00 54.97 54.39 1yj2 s GLU 17 Cb -0.16 -0.90 -0.00 0.00 -1.78 0.00 0.00 34.13 31.28 1yj2 s GLU 17 CO 0.06 -0.13 -0.12 -1.17 -0.49 0.00 0.00 175.26 173.41 1yj2 s LEU 18 N 1.16 1.94 -0.13 1.80 0.20 -0.35 -0.61 118.68 122.69 1yj2 s LEU 18 Ca -0.07 -0.23 0.01 0.00 0.69 0.00 0.00 54.13 54.53 1yj2 s LEU 18 Cb -0.14 -0.65 -0.01 0.00 -0.43 0.00 0.00 46.19 44.96 1yj2 s LEU 18 CO -0.01 0.13 -0.16 -1.81 -0.29 0.00 0.00 176.35 174.20 1yj2 s ASP 19 N -0.10 3.67 0.09 3.68 -0.00 -0.55 -1.67 116.67 121.80 1yj2 s ASP 19 Ca 0.01 -0.43 0.06 0.00 -0.00 0.00 0.00 52.55 52.19 1yj2 s ASP 19 Cb -0.07 -1.55 -0.03 0.00 -0.00 0.00 0.00 42.92 41.27 1yj2 s ASP 19 CO 0.00 0.14 -0.15 -0.83 -0.00 0.00 0.00 175.17 174.33 1yj2 s GLY 20 N 0.49 0.99 -0.12 0.21 0.00 1.00 -1.13 107.32 108.75 1yj2 s GLY 20 Ca -0.11 -1.13 -0.04 0.00 0.00 0.00 0.00 44.72 43.44 1yj2 s GLY 20 CO 0.05 -1.16 0.08 -0.35 0.00 0.00 0.00 173.10 171.72 1yj2 s ASP 21 N -1.97 1.84 -0.24 1.64 -1.08 -0.43 -1.44 116.67 114.98 1yj2 s ASP 21 Ca 0.03 -0.33 0.02 0.00 -0.52 0.00 0.00 52.55 51.75 1yj2 s ASP 21 Cb -0.09 -0.18 0.05 0.00 -1.46 0.00 0.00 42.92 41.25 1yj2 s ASP 21 CO 0.03 -0.31 -0.12 -0.69 0.52 0.00 0.00 175.17 174.60 1yj2 s VAL 22 N 2.16 2.04 -1.44 1.11 1.01 -0.43 0.14 120.40 125.00 1yj2 s VAL 22 Ca 0.03 -1.43 -0.03 0.00 0.00 0.00 0.00 61.98 60.55 1yj2 s VAL 22 Cb -0.14 -2.12 0.01 0.00 0.00 0.00 0.00 36.38 34.13 1yj2 s VAL 22 CO -0.07 0.07 0.24 0.59 0.00 0.00 0.00 175.10 175.93 1yj2 n ASN 23 N 4.51 -5.06 0.00 3.32 4.13 -0.45 -1.07 115.26 120.64 1yj2 n ASN 23 Ca -0.15 -0.09 0.00 0.00 1.68 0.00 0.00 54.58 56.03 1yj2 n ASN 23 Cb 0.44 -4.19 0.00 0.00 -1.54 0.00 0.00 39.78 34.49 1yj2 n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1yj2 n GLY 24 N -1.12 1.29 3.61 7.41 0.00 -1.26 -5.00 105.19 110.12 1yj2 n GLY 24 Ca -0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 1yj2 n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yj2 s HIS 25 N -3.20 3.04 -0.12 1.61 3.76 -0.23 -5.02 115.29 115.13 1yj2 s HIS 25 Ca 0.00 0.86 -0.12 0.00 -0.15 0.00 0.00 55.06 55.65 1yj2 s HIS 25 Cb 0.00 -3.84 -0.05 0.00 1.11 0.00 0.00 32.58 29.80 1yj2 s HIS 25 CO 0.00 -0.92 0.27 0.15 -0.85 0.00 0.00 174.74 173.40 1yj2 s LYS 26 N 3.75 4.01 0.14 1.40 1.02 -1.26 -1.31 119.74 127.49 1yj2 s LYS 26 Ca 0.42 0.09 -0.18 0.00 0.02 0.00 0.00 55.97 56.33 1yj2 s LYS 26 Cb -0.11 -3.33 0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1yj2 s LYS 26 CO 0.21 0.45 0.45 -0.59 -0.92 0.00 0.00 175.35 174.95 1yj2 s PHE 27 N -0.17 -0.27 0.01 3.18 -0.71 -0.52 -5.00 117.98 114.50 1yj2 s PHE 27 Ca 0.17 -0.02 0.01 0.00 -1.04 0.00 0.00 56.93 56.05 1yj2 s PHE 27 Cb -0.13 0.33 -0.01 0.00 -1.21 0.00 0.00 43.02 42.00 1yj2 s PHE 27 CO 0.05 -0.75 -0.04 -1.12 -1.34 0.00 0.00 175.22 172.03 1yj2 s SER 28 N -2.80 0.43 -0.02 1.98 0.01 -1.26 -0.00 113.70 112.04 1yj2 s SER 28 Ca 0.03 -0.28 0.02 0.00 1.31 0.00 0.00 55.95 57.03 1yj2 s SER 28 Cb 0.01 0.01 0.01 0.00 0.21 0.00 0.00 66.02 66.26 1yj2 s SER 28 CO -0.12 -0.10 -0.06 -0.69 0.41 0.00 0.00 173.24 172.68 1yj2 s VAL 29 N -0.72 0.53 -0.06 3.43 1.01 -0.67 -1.06 120.40 122.87 1yj2 s VAL 29 Ca -0.06 -0.20 0.06 0.00 0.00 0.00 0.00 61.98 61.78 1yj2 s VAL 29 Cb -0.05 -0.50 -0.01 0.00 0.00 0.00 0.00 36.38 35.82 1yj2 s VAL 29 CO -0.00 0.19 -0.24 -0.44 0.00 0.00 0.00 175.10 174.61 1yj2 s SER 30 N 0.38 2.91 0.06 3.32 0.01 -0.44 -1.21 113.70 118.73 1yj2 s SER 30 Ca -0.05 -0.49 0.05 0.00 1.31 0.00 0.00 55.95 56.78 1yj2 s SER 30 Cb -0.09 -0.82 -0.03 0.00 0.21 0.00 0.00 66.02 65.30 1yj2 s SER 30 CO -0.00 0.23 -0.14 -0.83 0.41 0.00 0.00 173.24 172.90 1yj2 s GLY 31 N -0.11 0.86 0.03 3.44 0.00 0.46 -0.43 107.32 111.57 1yj2 s GLY 31 Ca -0.04 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 43.73 1yj2 s GLY 31 CO 0.04 -0.97 -0.06 -0.54 0.00 0.00 0.00 173.10 171.57 1yj2 s GLU 32 N -1.56 0.43 0.00 2.90 2.02 -0.75 -0.89 118.70 120.84 1yj2 s GLU 32 Ca -0.01 -0.59 0.00 0.00 0.02 0.00 0.00 54.97 54.39 1yj2 s GLU 32 Cb -0.09 -0.19 0.00 0.00 0.10 0.00 0.00 34.13 33.95 1yj2 s GLU 32 CO 0.02 0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.74 1yj2 n GLY 33 N 1.80 -0.72 3.38 -1.39 0.00 -0.87 -1.06 105.19 106.35 1yj2 n GLY 33 Ca -0.21 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.32 1yj2 n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1yj2 s GLU 34 N -0.92 1.20 0.05 1.61 -1.05 -0.31 -0.90 118.70 118.38 1yj2 s GLU 34 Ca 0.00 -0.60 0.04 0.00 -0.15 0.00 0.00 54.97 54.26 1yj2 s GLU 34 Cb 0.00 0.54 -0.02 0.00 -0.44 0.00 0.00 34.13 34.20 1yj2 s GLU 34 CO 0.00 -0.50 -0.12 0.20 0.95 0.00 0.00 175.26 175.79 1yj2 s GLY 35 N -2.78 0.70 -0.37 -3.83 0.00 -0.36 -1.42 107.32 99.26 1yj2 s GLY 35 Ca 0.02 -0.84 0.01 0.00 0.00 0.00 0.00 44.72 43.91 1yj2 s GLY 35 CO -0.12 -0.86 0.23 -0.35 0.00 0.00 0.00 173.10 172.00 1yj2 s ASP 36 N -1.47 2.83 0.55 1.64 -1.08 0.11 -1.01 116.67 118.25 1yj2 s ASP 36 Ca -0.04 -2.34 0.28 0.00 -0.52 0.00 0.00 52.55 49.93 1yj2 s ASP 36 Cb -0.09 -0.46 1.58 0.00 -1.46 0.00 0.00 42.92 42.49 1yj2 s ASP 36 CO 0.01 -0.29 2.14 0.00 0.52 0.00 0.00 175.17 177.56 1yj2 h ALA 37 N 6.81 1.41 -0.49 3.66 0.00 -1.73 -1.15 119.26 127.77 1yj2 h ALA 37 Ca 0.08 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.07 1yj2 h ALA 37 Cb 0.96 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1yj2 h ALA 37 CO 0.30 0.09 0.39 1.15 0.00 0.00 0.00 179.25 181.17 1yj2 h THR 38 N 0.00 0.63 -0.09 0.00 2.02 -1.87 -1.52 112.91 112.07 1yj2 h THR 38 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1yj2 h THR 38 Cb 0.20 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1yj2 h THR 38 CO 0.01 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.68 1yj2 n TYR 39 N -4.19 0.16 -2.67 3.16 4.01 -0.51 -4.97 117.16 112.15 1yj2 n TYR 39 Ca 0.09 -0.60 -0.19 0.00 -0.16 0.00 0.00 57.90 57.03 1yj2 n TYR 39 Cb 0.59 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 1yj2 n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yj2 n GLY 40 N -0.44 -0.50 3.45 2.72 0.00 -0.57 -4.72 105.19 105.12 1yj2 n GLY 40 Ca 0.06 0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1yj2 n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yj2 s LYS 41 N -5.31 3.49 -0.05 1.61 2.20 -0.76 -1.18 119.74 119.75 1yj2 s LYS 41 Ca 0.12 -0.60 0.05 0.00 -0.36 0.00 0.00 55.97 55.18 1yj2 s LYS 41 Cb -0.06 -2.77 -0.01 0.00 -1.51 0.00 0.00 37.83 33.49 1yj2 s LYS 41 CO 0.15 0.26 -0.21 -0.51 -0.36 0.00 0.00 175.35 174.67 1yj2 s LEU 42 N 0.28 1.99 -0.12 5.43 1.43 -0.20 -0.71 118.68 126.78 1yj2 s LEU 42 Ca -0.06 -0.42 -0.00 0.00 -1.03 0.00 0.00 54.13 52.61 1yj2 s LEU 42 Cb -0.15 -1.15 0.02 0.00 0.03 0.00 0.00 46.19 44.95 1yj2 s LEU 42 CO 0.04 0.20 -0.09 0.42 0.23 0.00 0.00 176.35 177.15 1yj2 s THR 43 N -0.08 1.16 -0.01 5.49 -4.23 -0.51 -1.61 115.64 115.85 1yj2 s THR 43 Ca -0.03 -0.37 -0.02 0.00 -1.18 0.00 0.00 61.69 60.08 1yj2 s THR 43 Cb -0.12 -1.15 0.00 0.00 1.34 0.00 0.00 72.50 72.57 1yj2 s THR 43 CO 0.03 0.39 0.05 -0.76 -0.54 0.00 0.00 174.62 173.79 1yj2 s LEU 44 N 1.63 1.82 -0.14 4.79 1.43 -0.46 -1.16 118.68 126.59 1yj2 s LEU 44 Ca 0.04 0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 1yj2 s LEU 44 Cb -0.13 0.22 0.01 0.00 0.03 0.00 0.00 46.19 46.33 1yj2 s LEU 44 CO -0.08 -0.09 -0.20 -0.75 0.23 0.00 0.00 176.35 175.46 1yj2 s LYS 45 N -0.28 2.83 -0.08 1.70 2.20 -0.22 -0.64 119.74 125.25 1yj2 s LYS 45 Ca -0.03 -0.79 0.01 0.00 -0.36 0.00 0.00 55.97 54.80 1yj2 s LYS 45 Cb -0.02 -2.32 -0.03 0.00 -1.51 0.00 0.00 37.83 33.95 1yj2 s LYS 45 CO 0.00 -0.04 -0.09 -0.06 -0.36 0.00 0.00 175.35 174.80 1yj2 s PHE 46 N 0.90 2.88 -0.08 4.03 0.40 0.26 -1.82 117.98 124.56 1yj2 s PHE 46 Ca -0.06 -0.13 0.04 0.00 -0.60 0.00 0.00 56.93 56.18 1yj2 s PHE 46 Cb -0.15 -1.74 0.00 0.00 0.51 0.00 0.00 43.02 41.64 1yj2 s PHE 46 CO -0.03 0.19 -0.20 0.42 0.70 0.00 0.00 175.22 176.30 1yj2 s ILE 47 N -0.51 1.72 -0.31 0.64 1.01 0.43 -0.66 121.20 123.53 1yj2 s ILE 47 Ca 0.07 -0.83 -0.28 0.00 0.00 0.00 0.00 60.65 59.61 1yj2 s ILE 47 Cb -0.12 -1.50 0.01 0.00 0.01 0.00 0.00 42.46 40.86 1yj2 s ILE 47 CO 0.02 0.49 1.00 0.00 0.00 0.00 0.00 174.94 176.44 1yj2 n THR 49 N 5.73 0.00 0.87 0.00 -2.24 -0.22 -3.83 114.28 114.59 1yj2 n THR 49 Ca 0.10 -0.22 0.10 0.00 -2.27 0.00 0.00 64.05 61.76 1yj2 n THR 49 Cb 0.47 0.68 0.03 0.00 -2.10 0.00 0.00 70.33 69.41 1yj2 n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1yj2 n THR 50 N -0.12 0.00 0.00 4.28 -2.24 -1.25 -5.01 114.28 109.94 1yj2 n THR 50 Ca 0.14 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1yj2 n THR 50 Cb 0.40 1.30 0.00 0.00 -2.10 0.00 0.00 70.33 69.93 1yj2 n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yj2 n GLY 51 N 1.26 0.40 3.74 3.38 0.00 -1.25 -5.04 105.19 107.68 1yj2 n GLY 51 Ca 0.10 -1.24 -0.40 0.00 0.00 0.00 0.00 46.02 44.47 1yj2 n GLY 51 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yj2 s LYS 52 N -0.30 4.80 0.08 1.61 2.47 -1.26 -4.51 119.74 122.62 1yj2 s LYS 52 Ca 0.00 1.50 -0.31 0.00 -1.56 0.00 0.00 55.97 55.60 1yj2 s LYS 52 Cb 0.00 -3.30 -0.06 0.00 -1.46 0.00 0.00 37.83 33.00 1yj2 s LYS 52 CO 0.00 0.41 1.26 -1.17 0.16 0.00 0.00 175.35 176.02 1yj2 s LEU 53 N -0.84 4.37 0.00 5.43 2.96 -1.26 -4.93 118.68 124.41 1yj2 s LEU 53 Ca 0.43 2.12 0.28 0.00 -0.22 0.00 0.00 54.13 56.74 1yj2 s LEU 53 Cb -0.26 -3.58 1.34 0.00 0.50 0.00 0.00 46.19 44.19 1yj2 s LEU 53 CO 0.32 -0.53 1.90 -0.81 -1.32 0.00 0.00 176.35 175.90 1yj2 n PRO 54 N 3.96 1.39 -4.34 0.98 -0.04 -1.26 -4.80 135.00 130.90 1yj2 n PRO 54 Ca 0.10 -0.58 -0.19 0.00 -0.04 0.00 0.00 63.50 62.79 1yj2 n PRO 54 Cb 0.45 -1.47 -0.10 0.00 -0.04 0.00 0.00 33.50 32.34 1yj2 n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1yj2 s VAL 55 N -1.98 1.71 0.27 0.52 -7.23 -1.26 -4.71 120.40 107.72 1yj2 s VAL 55 Ca 0.41 -2.14 -0.30 0.00 -1.81 0.00 0.00 61.98 58.14 1yj2 s VAL 55 Cb 0.21 -1.98 -0.10 0.00 0.56 0.00 0.00 36.38 35.06 1yj2 s VAL 55 CO 0.33 -0.55 1.42 -2.84 -0.31 0.00 0.00 175.10 173.15 1yj2 s PRO 56 N -3.47 4.28 0.25 4.82 0.02 -1.26 -4.93 135.00 134.70 1yj2 s PRO 56 Ca 0.21 2.30 -0.05 0.00 0.02 0.00 0.00 61.00 63.48 1yj2 s PRO 56 Cb -0.02 -3.09 0.49 0.00 0.02 0.00 0.00 34.50 31.91 1yj2 s PRO 56 CO 0.06 -0.38 1.65 -1.49 -0.33 0.00 0.00 177.00 176.51 1yj2 h TRP 57 N 4.57 0.09 -0.05 6.54 4.06 -1.95 -0.83 115.95 128.39 1yj2 h TRP 57 Ca -0.47 0.05 0.01 0.00 2.06 0.00 0.00 58.89 60.55 1yj2 h TRP 57 Cb 1.22 0.08 -0.00 0.00 -1.00 0.00 0.00 29.16 29.46 1yj2 h TRP 57 CO 0.59 -0.20 0.05 -1.35 -3.56 0.00 0.00 178.44 173.97 1yj2 h PRO 58 N 0.15 0.00 0.00 0.49 0.11 -1.89 -0.80 132.00 130.06 1yj2 h PRO 58 Ca 0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.55 1yj2 h PRO 58 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1yj2 h PRO 58 CO -0.63 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.41 1yj2 n THR 59 N -3.91 0.87 0.83 -1.15 -2.24 -0.31 -2.76 114.28 105.59 1yj2 n THR 59 Ca -0.02 0.27 0.09 0.00 -2.27 0.00 0.00 64.05 62.13 1yj2 n THR 59 Cb 0.15 -1.20 0.02 0.00 -2.10 0.00 0.00 70.33 67.19 1yj2 n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1yj2 n LEU 60 N -2.19 1.98 -0.12 3.22 4.77 -0.31 -4.66 117.00 119.69 1yj2 n LEU 60 Ca 0.02 -0.82 -0.05 0.00 -0.03 0.00 0.00 56.01 55.13 1yj2 n LEU 60 Cb 0.21 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.33 1yj2 n LEU 60 CO 0.18 0.36 0.93 0.58 -1.33 0.00 0.00 177.39 178.11 1yj2 h VAL 61 N 2.47 0.83 -0.09 4.08 2.07 -1.55 -1.08 116.25 122.97 1yj2 h VAL 61 Ca 0.00 -0.09 -0.07 0.00 0.82 0.00 0.00 66.70 67.36 1yj2 h VAL 61 Cb 0.67 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1yj2 h VAL 61 CO 0.00 0.05 -0.28 0.71 0.02 0.00 0.00 177.57 178.06 1yj2 h THR 62 N 0.26 1.24 -0.35 2.57 1.35 -1.83 -2.77 112.91 113.39 1yj2 h THR 62 Ca 0.19 -1.14 -0.09 0.00 -0.55 0.00 0.00 66.41 64.82 1yj2 h THR 62 Cb 0.21 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.11 1yj2 h THR 62 CO -0.23 0.34 -0.14 0.74 -0.25 0.00 0.00 175.52 175.98 1yj2 h THR 63 N 0.15 1.28 0.00 6.82 2.02 -1.66 -3.46 112.91 118.07 1yj2 h THR 63 Ca 0.02 -1.24 -0.38 0.00 0.77 0.00 0.00 66.41 65.58 1yj2 h THR 63 Cb 0.59 1.36 0.02 0.00 -1.74 0.00 0.00 68.15 68.37 1yj2 h THR 63 CO 0.04 0.41 2.43 0.49 0.37 0.00 0.00 175.52 179.26 1yj2 n PHE 64 N -4.35 1.31 0.00 3.16 0.99 -0.49 -5.04 117.46 113.04 1yj2 n PHE 64 Ca -0.02 -1.81 0.00 0.00 -0.00 0.00 0.00 57.45 55.62 1yj2 n PHE 64 Cb 0.38 -1.58 0.00 0.00 -1.00 0.00 0.00 39.48 37.28 1yj2 n PHE 64 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.76 178.09 1yj2 n VAL 68 N 4.53 0.00 1.16 -4.37 0.24 -1.26 -5.01 118.33 113.62 1yj2 n VAL 68 Ca 0.41 0.00 0.10 0.00 -2.04 0.00 0.00 64.34 62.82 1yj2 n VAL 68 Cb 0.16 0.00 0.58 0.00 -1.47 0.00 0.00 33.84 33.11 1yj2 n VAL 68 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yj2 n GLN 69 N 0.00 0.48 0.25 7.34 6.02 -1.26 -1.15 117.38 129.07 1yj2 n GLN 69 Ca 0.00 0.05 0.17 0.00 -0.01 0.00 0.00 57.00 57.21 1yj2 n GLN 69 Cb 0.00 -1.50 0.79 0.00 1.02 0.00 0.00 30.24 30.55 1yj2 n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yj2 n PHE 71 N -2.82 0.16 -1.84 0.00 3.72 -0.30 -4.71 117.46 111.66 1yj2 n PHE 71 Ca -0.00 -0.08 -0.38 0.00 -0.05 0.00 0.00 57.45 56.93 1yj2 n PHE 71 Cb 0.19 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.76 1yj2 n PHE 71 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1yj2 s SER 72 N -1.62 5.42 -0.36 4.37 0.01 -0.92 -4.00 113.70 116.60 1yj2 s SER 72 Ca 0.32 2.72 -0.23 0.00 1.31 0.00 0.00 55.95 60.07 1yj2 s SER 72 Cb 0.17 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.78 1yj2 s SER 72 CO 0.26 -1.47 0.78 -0.60 0.41 0.00 0.00 173.24 172.63 1yj2 s ARG 73 N -2.85 3.77 -0.35 12.44 3.52 0.38 -4.79 118.95 131.07 1yj2 s ARG 73 Ca 0.70 0.33 -0.17 0.00 -0.13 0.00 0.00 55.73 56.46 1yj2 s ARG 73 Cb -0.39 -3.80 -0.00 0.00 -1.56 0.00 0.00 34.95 29.19 1yj2 s ARG 73 CO 0.47 -0.83 0.45 0.71 -0.81 0.00 0.00 175.30 175.29 1yj2 s TYR 74 N 3.07 3.19 0.64 5.12 1.51 -1.26 -0.56 117.35 129.05 1yj2 s TYR 74 Ca 0.31 0.06 -0.18 0.00 -1.01 0.00 0.00 57.07 56.25 1yj2 s TYR 74 Cb -0.13 -2.83 -0.03 0.00 -0.11 0.00 0.00 41.96 38.85 1yj2 s TYR 74 CO 0.16 -0.52 0.95 -2.30 -1.11 0.00 0.00 175.55 172.74 1yj2 n PRO 75 N 5.60 0.78 -0.34 -1.71 -0.02 -1.26 -4.68 135.00 133.37 1yj2 n PRO 75 Ca -0.07 0.31 0.15 0.00 -2.02 0.00 0.00 63.50 61.88 1yj2 n PRO 75 Cb 0.49 -2.17 0.35 0.00 -0.02 0.00 0.00 33.50 32.15 1yj2 n PRO 75 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1yj2 h ASP 76 N 0.26 0.67 0.57 2.55 3.58 -2.00 0.16 116.42 122.21 1yj2 h ASP 76 Ca -0.48 0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.09 1yj2 h ASP 76 Cb 1.36 0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.43 1yj2 h ASP 76 CO 0.50 0.15 0.00 0.00 -2.88 0.00 0.00 179.24 177.01 1yj2 n HIS 77 N -4.87 0.04 -0.06 0.28 1.44 -1.26 -2.47 115.22 108.33 1yj2 n HIS 77 Ca 0.25 0.02 0.02 0.00 -2.01 0.00 0.00 57.72 56.00 1yj2 n HIS 77 Cb 0.67 -0.53 0.06 0.00 0.12 0.00 0.00 29.99 30.31 1yj2 n HIS 77 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1yj2 n MET 78 N -1.54 2.80 0.29 -1.40 2.81 0.51 -4.77 117.12 115.83 1yj2 n MET 78 Ca 0.04 -1.67 0.15 0.00 -1.81 0.00 0.00 57.70 54.41 1yj2 n MET 78 Cb 0.19 -1.10 0.89 0.00 -0.71 0.00 0.00 33.22 32.49 1yj2 n MET 78 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1yj2 h LYS 79 N 0.77 0.00 0.00 0.03 2.10 -1.12 0.14 116.57 118.49 1yj2 h LYS 79 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1yj2 h LYS 79 Cb 0.57 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.90 1yj2 h LYS 79 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.45 1yj2 n GLN 80 N -3.91 0.61 -0.18 0.07 0.00 -1.26 -2.62 117.38 110.09 1yj2 n GLN 80 Ca -0.03 0.00 0.07 0.00 0.00 0.00 0.00 57.00 57.04 1yj2 n GLN 80 Cb 0.09 -1.49 0.17 0.00 0.00 0.00 0.00 30.24 29.01 1yj2 n GLN 80 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1yj2 n HIS 81 N -0.99 0.48 -2.94 2.61 8.25 0.04 -4.66 115.22 117.99 1yj2 n HIS 81 Ca 0.14 -0.40 -0.44 0.00 -0.26 0.00 0.00 57.72 56.77 1yj2 n HIS 81 Cb 0.07 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.14 1yj2 n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1yj2 s ASP 82 N -1.04 6.68 0.14 0.41 -1.08 -1.08 -4.50 116.67 116.20 1yj2 s ASP 82 Ca 0.27 -2.16 -0.18 0.00 -0.52 0.00 0.00 52.55 49.96 1yj2 s ASP 82 Cb 0.15 -2.39 -0.02 0.00 -1.46 0.00 0.00 42.92 39.19 1yj2 s ASP 82 CO 0.20 -1.01 1.79 0.15 0.52 0.00 0.00 175.17 176.82 1yj2 h PHE 83 N 8.63 0.36 -0.31 -5.34 3.57 -1.91 -3.14 116.94 118.81 1yj2 h PHE 83 Ca 0.17 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.69 1yj2 h PHE 83 Cb 1.01 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1yj2 h PHE 83 CO 1.15 0.23 0.19 0.74 -2.23 0.00 0.00 178.31 178.39 1yj2 h PHE 84 N 0.39 0.37 0.00 0.41 0.04 -1.88 -1.36 116.94 114.91 1yj2 h PHE 84 Ca 0.11 0.01 -0.09 0.00 2.80 0.00 0.00 57.97 60.80 1yj2 h PHE 84 Cb -0.03 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 1yj2 h PHE 84 CO -0.06 0.22 -0.44 0.87 -0.60 0.00 0.00 178.31 178.30 1yj2 h LYS 85 N 0.40 0.00 0.00 1.51 1.57 -1.85 -3.20 116.57 115.00 1yj2 h LYS 85 Ca 0.12 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1yj2 h LYS 85 Cb -0.03 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1yj2 h LYS 85 CO -0.04 0.44 -0.09 0.66 -0.57 0.00 0.00 179.45 179.86 1yj2 h SER 86 N 0.00 0.00 0.95 0.86 4.64 -1.20 -1.66 113.55 117.13 1yj2 h SER 86 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yj2 h SER 86 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1yj2 h SER 86 CO 0.06 0.09 -0.02 0.00 -0.87 0.00 0.00 176.83 176.09 1yj2 n ALA 87 N -2.16 2.38 -2.34 5.18 0.00 -1.04 -4.74 120.51 117.79 1yj2 n ALA 87 Ca -0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 53.44 53.02 1yj2 n ALA 87 Cb 0.31 -1.46 -0.04 0.00 0.00 0.00 0.00 19.45 18.26 1yj2 n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1yj2 s MET 88 N -2.96 3.75 0.09 0.00 1.00 -0.62 -1.25 119.30 119.31 1yj2 s MET 88 Ca 0.15 0.28 0.26 0.00 0.00 0.00 0.00 55.69 56.39 1yj2 s MET 88 Cb 0.19 -2.53 0.77 0.00 0.00 0.00 0.00 34.83 33.26 1yj2 s MET 88 CO 0.53 0.14 1.65 -0.35 0.00 0.00 0.00 175.02 176.98 1yj2 n PRO 89 N -0.87 0.15 -0.05 2.03 -0.04 -1.26 -4.30 135.00 130.66 1yj2 n PRO 89 Ca 0.01 0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.63 1yj2 n PRO 89 Cb 0.54 -1.63 0.46 0.00 -0.04 0.00 0.00 33.50 32.82 1yj2 n PRO 89 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1yj2 h GLU 90 N 0.00 0.48 0.00 0.54 3.07 -1.90 -2.85 114.58 113.92 1yj2 h GLU 90 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1yj2 h GLU 90 Cb 0.63 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1yj2 h GLU 90 CO 0.00 0.32 0.00 0.41 -1.40 0.00 0.00 179.01 178.34 1yj2 n GLY 91 N -1.49 -3.33 3.06 -3.84 0.00 -0.38 -4.64 105.19 94.57 1yj2 n GLY 91 Ca 0.07 -2.05 -0.08 0.00 0.00 0.00 0.00 46.02 43.96 1yj2 n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yj2 s TYR 92 N -0.64 0.49 -0.09 1.61 -0.85 -0.18 -0.57 117.35 117.11 1yj2 s TYR 92 Ca 0.00 -0.87 -0.18 0.00 -0.52 0.00 0.00 57.07 55.50 1yj2 s TYR 92 Cb 0.00 -0.35 -0.05 0.00 0.38 0.00 0.00 41.96 41.95 1yj2 s TYR 92 CO 0.00 -0.29 0.47 0.08 -1.52 0.00 0.00 175.55 174.30 1yj2 s VAL 93 N -3.05 5.14 -0.14 -3.49 1.01 0.14 -1.26 120.40 118.75 1yj2 s VAL 93 Ca -0.00 0.95 0.02 0.00 0.00 0.00 0.00 61.98 62.95 1yj2 s VAL 93 Cb 0.02 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.59 1yj2 s VAL 93 CO -0.06 0.37 -0.20 -1.58 0.00 0.00 0.00 175.10 173.63 1yj2 s GLN 94 N 0.31 3.07 0.03 2.72 0.74 0.46 -1.60 119.66 125.40 1yj2 s GLN 94 Ca 0.26 -0.83 0.08 0.00 0.05 0.00 0.00 55.36 54.92 1yj2 s GLN 94 Cb -0.16 -2.49 -0.02 0.00 1.10 0.00 0.00 33.01 31.45 1yj2 s GLN 94 CO 0.11 -0.00 -0.22 -1.21 -0.55 0.00 0.00 175.29 173.42 1yj2 s GLU 95 N 0.81 1.54 0.03 1.67 2.02 0.63 -1.04 118.70 124.37 1yj2 s GLU 95 Ca -0.07 -0.93 -0.02 0.00 0.02 0.00 0.00 54.97 53.97 1yj2 s GLU 95 Cb -0.15 -1.63 -0.02 0.00 0.10 0.00 0.00 34.13 32.42 1yj2 s GLU 95 CO -0.01 0.43 0.01 1.03 0.02 0.00 0.00 175.26 176.74 1yj2 s ARG 96 N -1.04 0.44 -0.21 1.61 0.52 -0.81 -0.99 118.95 118.47 1yj2 s ARG 96 Ca 0.08 -0.72 -0.02 0.00 -0.52 0.00 0.00 55.73 54.55 1yj2 s ARG 96 Cb -0.09 0.16 0.01 0.00 0.52 0.00 0.00 34.95 35.55 1yj2 s ARG 96 CO 0.01 -0.09 -0.10 0.99 0.02 0.00 0.00 175.30 176.13 1yj2 s THR 97 N -2.12 2.81 -0.33 0.02 2.01 -0.47 -1.25 115.64 116.30 1yj2 s THR 97 Ca -0.10 -0.75 -0.06 0.00 0.31 0.00 0.00 61.69 61.09 1yj2 s THR 97 Cb -0.05 -2.28 0.04 0.00 0.01 0.00 0.00 72.50 70.22 1yj2 s THR 97 CO -0.03 0.42 0.09 -0.63 -0.69 0.00 0.00 174.62 173.78 1yj2 s ILE 98 N 1.38 3.70 -0.41 1.82 1.01 0.40 -1.75 121.20 127.35 1yj2 s ILE 98 Ca 0.04 -1.10 -0.12 0.00 0.00 0.00 0.00 60.65 59.48 1yj2 s ILE 98 Cb -0.14 -3.07 0.05 0.00 0.01 0.00 0.00 42.46 39.31 1yj2 s ILE 98 CO -0.07 -0.13 0.26 -0.44 0.00 0.00 0.00 174.94 174.56 1yj2 s SER 99 N 1.40 5.83 -0.25 3.58 0.01 0.33 -1.00 113.70 123.60 1yj2 s SER 99 Ca -0.02 -1.17 -0.29 0.00 1.31 0.00 0.00 55.95 55.79 1yj2 s SER 99 Cb -0.19 -2.06 0.01 0.00 0.21 0.00 0.00 66.02 63.99 1yj2 s SER 99 CO 0.02 -0.48 1.07 -0.36 0.41 0.00 0.00 173.24 173.90 1yj2 s PHE 100 N 1.55 3.26 0.21 2.43 0.40 -0.49 -1.05 117.98 124.29 1yj2 s PHE 100 Ca 0.03 1.37 -0.32 0.00 -0.60 0.00 0.00 56.93 57.41 1yj2 s PHE 100 Cb -0.21 -3.39 -0.13 0.00 0.51 0.00 0.00 43.02 39.80 1yj2 s PHE 100 CO 0.06 -0.64 1.53 1.17 0.70 0.00 0.00 175.22 178.04 1yj2 n LYS 101 N 6.47 2.21 -2.13 0.44 4.81 -0.30 -1.08 118.16 128.58 1yj2 n LYS 101 Ca 0.12 0.79 -0.18 0.00 -0.87 0.00 0.00 58.31 58.17 1yj2 n LYS 101 Cb 0.46 -2.53 -0.03 0.00 0.02 0.00 0.00 35.03 32.95 1yj2 n LYS 101 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1yj2 n ASP 102 N 2.86 -5.09 0.00 3.14 2.03 -1.26 -4.83 116.55 113.39 1yj2 n ASP 102 Ca 0.14 0.18 0.00 0.00 0.52 0.00 0.00 54.79 55.63 1yj2 n ASP 102 Cb 0.31 -4.35 0.00 0.00 -0.72 0.00 0.00 41.12 36.36 1yj2 n ASP 102 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1yj2 n ASP 103 N -1.66 0.00 -2.32 1.67 -0.08 -0.24 -4.95 116.55 108.98 1yj2 n ASP 103 Ca -0.20 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.08 1yj2 n ASP 103 Cb 0.64 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.10 1yj2 n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yj2 n GLY 104 N 0.00 -0.88 3.03 0.27 0.00 -1.15 -4.60 105.19 101.86 1yj2 n GLY 104 Ca 0.00 -1.67 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 1yj2 n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yj2 s ASN 105 N -1.00 0.56 -0.14 1.61 2.20 -0.76 -1.40 114.94 116.01 1yj2 s ASN 105 Ca 0.00 -0.59 -0.07 0.00 -0.94 0.00 0.00 52.86 51.26 1yj2 s ASN 105 Cb 0.00 0.08 -0.04 0.00 -2.00 0.00 0.00 41.25 39.29 1yj2 s ASN 105 CO 0.00 -0.30 0.11 -0.31 -2.94 0.00 0.00 177.10 173.66 1yj2 s TYR 106 N -1.78 3.44 -0.12 1.54 2.02 -0.17 -1.65 117.35 120.64 1yj2 s TYR 106 Ca -0.10 0.37 -0.00 0.00 -0.37 0.00 0.00 57.07 56.97 1yj2 s TYR 106 Cb -0.07 -1.99 -0.02 0.00 -0.40 0.00 0.00 41.96 39.48 1yj2 s TYR 106 CO -0.01 0.52 -0.12 0.15 -1.57 0.00 0.00 175.55 174.51 1yj2 s LYS 107 N -0.50 3.33 0.05 -0.62 1.02 0.11 -0.46 119.74 122.68 1yj2 s LYS 107 Ca 0.11 -0.67 0.05 0.00 0.02 0.00 0.00 55.97 55.49 1yj2 s LYS 107 Cb -0.12 -2.63 -0.02 0.00 -0.52 0.00 0.00 37.83 34.54 1yj2 s LYS 107 CO 0.02 0.26 -0.15 0.95 -0.92 0.00 0.00 175.35 175.50 1yj2 s THR 108 N 0.24 1.20 -0.06 2.17 -4.23 -0.38 -0.52 115.64 114.07 1yj2 s THR 108 Ca -0.08 -1.12 -0.00 0.00 -1.18 0.00 0.00 61.69 59.31 1yj2 s THR 108 Cb -0.15 -1.10 0.02 0.00 1.34 0.00 0.00 72.50 72.62 1yj2 s THR 108 CO 0.05 -0.03 -0.03 -0.60 -0.54 0.00 0.00 174.62 173.48 1yj2 s ARG 109 N -1.32 0.77 0.09 3.99 3.52 -0.59 -1.92 118.95 123.49 1yj2 s ARG 109 Ca 0.02 -0.02 0.04 0.00 -0.13 0.00 0.00 55.73 55.63 1yj2 s ARG 109 Cb -0.09 -0.93 -0.03 0.00 -1.56 0.00 0.00 34.95 32.34 1yj2 s ARG 109 CO 0.02 -0.19 -0.11 0.00 -0.81 0.00 0.00 175.30 174.21 1yj2 s ALA 110 N 1.40 1.08 -0.15 6.12 0.00 -0.20 -0.91 121.76 129.09 1yj2 s ALA 110 Ca -0.03 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.84 1yj2 s ALA 110 Cb -0.13 0.00 0.01 0.00 0.00 0.00 0.00 23.12 23.00 1yj2 s ALA 110 CO -0.03 0.01 -0.20 -1.21 0.00 0.00 0.00 175.76 174.34 1yj2 s GLU 111 N -2.43 3.07 -0.22 0.00 2.02 -0.11 -0.40 118.70 120.63 1yj2 s GLU 111 Ca 0.02 -0.82 -0.01 0.00 0.02 0.00 0.00 54.97 54.18 1yj2 s GLU 111 Cb -0.05 -2.52 0.01 0.00 0.10 0.00 0.00 34.13 31.67 1yj2 s GLU 111 CO 0.01 -0.04 -0.11 0.08 0.02 0.00 0.00 175.26 175.22 1yj2 s VAL 112 N 0.90 2.71 0.08 2.63 1.01 -0.39 -1.69 120.40 125.66 1yj2 s VAL 112 Ca -0.04 -0.86 -0.26 0.00 0.00 0.00 0.00 61.98 60.82 1yj2 s VAL 112 Cb -0.15 -2.27 0.08 0.00 0.00 0.00 0.00 36.38 34.05 1yj2 s VAL 112 CO -0.03 0.38 0.82 -1.59 0.00 0.00 0.00 175.10 174.67 1yj2 s LYS 113 N 1.35 1.06 0.13 2.72 -2.85 -0.63 -1.01 119.74 120.52 1yj2 s LYS 113 Ca 0.03 -0.45 -0.30 0.00 -1.00 0.00 0.00 55.97 54.25 1yj2 s LYS 113 Cb -0.15 0.45 -0.06 0.00 -2.06 0.00 0.00 37.83 36.01 1yj2 s LYS 113 CO -0.07 -0.47 1.01 -0.06 0.10 0.00 0.00 175.35 175.85 1yj2 s PHE 114 N -3.36 3.75 -0.40 1.78 0.08 -1.08 -1.32 117.98 117.43 1yj2 s PHE 114 Ca 0.06 1.74 -0.03 0.00 0.12 0.00 0.00 56.93 58.82 1yj2 s PHE 114 Cb -0.01 -3.12 0.11 0.00 -0.57 0.00 0.00 43.02 39.42 1yj2 s PHE 114 CO -0.07 -0.05 0.19 -1.21 -0.10 0.00 0.00 175.22 173.99 1yj2 s GLU 115 N -0.13 2.01 7.60 0.44 0.41 0.07 -4.94 118.70 124.16 1yj2 s GLU 115 Ca 0.48 -1.80 0.00 0.00 -0.41 0.00 0.00 54.97 53.24 1yj2 s GLU 115 Cb -0.25 -3.56 0.00 0.00 -1.78 0.00 0.00 34.13 28.54 1yj2 s GLU 115 CO 0.31 -1.05 0.00 0.41 -0.49 0.00 0.00 175.26 174.44 1yj2 n GLY 116 N 4.59 2.98 1.24 -1.39 0.00 -1.26 -2.11 105.19 109.24 1yj2 n GLY 116 Ca -0.03 -0.22 0.10 0.00 0.00 0.00 0.00 46.02 45.88 1yj2 n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yj2 n ASP 117 N 5.34 3.60 -4.72 1.61 8.00 -1.26 -4.90 116.55 124.22 1yj2 n ASP 117 Ca 0.00 -2.03 -0.35 0.00 0.71 0.00 0.00 54.79 53.12 1yj2 n ASP 117 Cb 0.00 -0.45 -0.09 0.00 -0.02 0.00 0.00 41.12 40.56 1yj2 n ASP 117 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1yj2 s THR 118 N -1.17 4.83 -0.23 -3.53 2.01 -0.90 -4.41 115.64 112.25 1yj2 s THR 118 Ca 0.44 -0.04 -0.19 0.00 0.31 0.00 0.00 61.69 62.21 1yj2 s THR 118 Cb 0.24 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 1yj2 s THR 118 CO 0.30 0.56 0.58 -0.22 -0.69 0.00 0.00 174.62 175.14 1yj2 s LEU 119 N -0.46 4.10 -0.10 4.42 1.98 -0.35 -0.75 118.68 127.51 1yj2 s LEU 119 Ca 0.10 0.68 0.02 0.00 -2.89 0.00 0.00 54.13 52.04 1yj2 s LEU 119 Cb -0.12 -2.78 -0.02 0.00 0.66 0.00 0.00 46.19 43.93 1yj2 s LEU 119 CO 0.02 -0.29 -0.15 -0.69 -1.89 0.00 0.00 176.35 173.36 1yj2 s VAL 120 N 2.13 2.94 -0.30 1.68 1.01 -0.44 -1.23 120.40 126.19 1yj2 s VAL 120 Ca 0.25 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1yj2 s VAL 120 Cb -0.16 -2.19 0.07 0.00 0.00 0.00 0.00 36.38 34.10 1yj2 s VAL 120 CO 0.09 0.55 -0.02 0.21 0.00 0.00 0.00 175.10 175.93 1yj2 s ASN 121 N -0.01 4.67 -0.23 3.32 2.47 -0.18 -1.61 114.94 123.37 1yj2 s ASN 121 Ca -0.04 -1.64 -0.08 0.00 0.42 0.00 0.00 52.86 51.52 1yj2 s ASN 121 Cb -0.14 -1.62 -0.04 0.00 -1.45 0.00 0.00 41.25 38.00 1yj2 s ASN 121 CO 0.04 -0.28 0.08 -0.13 -3.72 0.00 0.00 177.10 173.09 1yj2 s ARG 122 N 1.07 3.79 -0.02 0.43 0.52 -0.68 -0.93 118.95 123.12 1yj2 s ARG 122 Ca -0.02 -0.42 0.03 0.00 -0.52 0.00 0.00 55.73 54.81 1yj2 s ARG 122 Cb -0.20 -3.33 -0.00 0.00 0.52 0.00 0.00 34.95 31.94 1yj2 s ARG 122 CO -0.05 -0.04 -0.11 0.42 0.02 0.00 0.00 175.30 175.53 1yj2 s ILE 123 N 1.25 0.93 -0.14 1.52 1.01 0.22 -0.93 121.20 125.05 1yj2 s ILE 123 Ca 0.05 -0.46 -0.01 0.00 0.00 0.00 0.00 60.65 60.23 1yj2 s ILE 123 Cb -0.14 -0.81 -0.02 0.00 0.01 0.00 0.00 42.46 41.50 1yj2 s ILE 123 CO 0.04 0.28 -0.11 -1.61 0.00 0.00 0.00 174.94 173.54 1yj2 s GLU 124 N 0.03 3.44 -0.06 2.79 2.02 -0.09 -1.48 118.70 125.36 1yj2 s GLU 124 Ca -0.01 -0.65 0.05 0.00 0.02 0.00 0.00 54.97 54.38 1yj2 s GLU 124 Cb -0.08 -2.71 -0.00 0.00 0.10 0.00 0.00 34.13 31.44 1yj2 s GLU 124 CO 0.00 0.20 -0.20 -1.17 0.02 0.00 0.00 175.26 174.11 1yj2 s LEU 125 N 0.41 1.96 -0.11 1.80 0.20 -0.28 -1.55 118.68 121.11 1yj2 s LEU 125 Ca -0.09 -0.43 0.01 0.00 0.69 0.00 0.00 54.13 54.32 1yj2 s LEU 125 Cb -0.15 -1.14 0.02 0.00 -0.43 0.00 0.00 46.19 44.48 1yj2 s LEU 125 CO 0.05 0.17 -0.13 -0.75 -0.29 0.00 0.00 176.35 175.40 1yj2 s LYS 126 N 0.07 2.04 -0.09 1.98 2.47 0.33 -1.32 119.74 125.22 1yj2 s LYS 126 Ca -0.07 -0.48 0.03 0.00 -1.56 0.00 0.00 55.97 53.89 1yj2 s LYS 126 Cb -0.13 -1.82 -0.01 0.00 -1.46 0.00 0.00 37.83 34.40 1yj2 s LYS 126 CO 0.04 -0.13 -0.19 0.20 0.16 0.00 0.00 175.35 175.42 1yj2 s GLY 127 N 1.20 1.42 0.09 5.54 0.00 0.12 0.07 107.32 115.77 1yj2 s GLY 127 Ca -0.03 -0.97 0.02 0.00 0.00 0.00 0.00 44.72 43.74 1yj2 s GLY 127 CO -0.04 -0.45 -0.07 -0.26 0.00 0.00 0.00 173.10 172.29 1yj2 s ILE 128 N 0.03 0.66 -1.45 0.90 -4.36 -0.66 -1.34 121.20 114.98 1yj2 s ILE 128 Ca -0.07 -1.86 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 1yj2 s ILE 128 Cb -0.15 -1.59 0.00 0.00 1.25 0.00 0.00 42.46 41.97 1yj2 s ILE 128 CO 0.05 -0.84 0.00 0.47 0.24 0.00 0.00 174.94 174.86 1yj2 n ASP 129 N 0.09 -4.90 -4.78 4.36 10.43 -1.26 -1.83 116.55 118.65 1yj2 n ASP 129 Ca -0.13 0.03 -0.37 0.00 2.57 0.00 0.00 54.79 56.90 1yj2 n ASP 129 Cb 0.60 -3.99 -0.05 0.00 1.84 0.00 0.00 41.12 39.52 1yj2 n ASP 129 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1yj2 s PHE 130 N -2.80 3.45 0.03 1.24 0.40 -1.26 -2.96 117.98 116.08 1yj2 s PHE 130 Ca 0.00 1.70 -0.29 0.00 -0.60 0.00 0.00 56.93 57.74 1yj2 s PHE 130 Cb 0.00 -3.03 -0.04 0.00 0.51 0.00 0.00 43.02 40.46 1yj2 s PHE 130 CO 0.00 -0.25 0.92 0.15 0.70 0.00 0.00 175.22 176.73 1yj2 s LYS 131 N -2.33 4.58 0.40 0.44 1.02 -1.26 -4.91 119.74 117.67 1yj2 s LYS 131 Ca 0.55 1.32 0.13 0.00 0.02 0.00 0.00 55.97 57.98 1yj2 s LYS 131 Cb -0.20 -3.42 0.95 0.00 -0.52 0.00 0.00 37.83 34.63 1yj2 s LYS 131 CO 0.25 0.08 1.91 0.93 -0.92 0.00 0.00 175.35 177.60 1yj2 h GLU 132 N 6.29 0.52 -0.72 1.68 4.39 -1.96 -1.37 114.58 123.42 1yj2 h GLU 132 Ca -0.42 -0.03 -0.39 0.00 0.34 0.00 0.00 59.36 58.86 1yj2 h GLU 132 Cb 1.21 -0.12 -0.41 0.00 -0.10 0.00 0.00 28.75 29.33 1yj2 h GLU 132 CO 0.74 0.34 -0.99 -3.47 -1.16 0.00 0.00 179.01 174.47 1yj2 n ASP 133 N -4.51 2.99 -2.10 1.42 2.03 -1.26 -3.96 116.55 111.17 1yj2 n ASP 133 Ca 0.15 -2.86 0.00 0.00 0.52 0.00 0.00 54.79 52.60 1yj2 n ASP 133 Cb 0.48 -0.44 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 1yj2 n ASP 133 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1yj2 n GLY 134 N -0.56 -1.20 0.24 0.27 0.00 -0.52 -4.64 105.19 98.79 1yj2 n GLY 134 Ca 0.23 -1.65 0.12 0.00 0.00 0.00 0.00 46.02 44.71 1yj2 n GLY 134 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1yj2 h ASN 135 N -0.07 0.00 0.00 1.61 2.35 -1.93 -0.47 115.58 117.07 1yj2 h ASN 135 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1yj2 h ASN 135 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1yj2 h ASN 135 CO 0.00 0.17 -0.21 0.40 -1.65 0.00 0.00 177.43 176.14 1yj2 h ILE 136 N 0.00 0.00 0.00 2.81 5.03 -1.92 -1.68 117.51 121.75 1yj2 h ILE 136 Ca -0.00 -0.63 0.00 0.00 -0.12 0.00 0.00 64.86 64.11 1yj2 h ILE 136 Cb 0.61 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.40 1yj2 h ILE 136 CO 0.02 0.00 0.00 -0.07 -0.68 0.00 0.00 178.15 177.42 1yj2 h LEU 137 N -0.63 0.00 -1.21 1.44 3.38 -1.74 -1.84 115.31 114.71 1yj2 h LEU 137 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1yj2 h LEU 137 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1yj2 h LEU 137 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1yj2 n GLY 138 N -0.01 0.38 3.65 0.83 0.00 -0.18 -4.82 105.19 105.04 1yj2 n GLY 138 Ca 0.01 -0.46 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 1yj2 n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1yj2 n HIS 139 N 0.43 -1.95 -0.14 1.61 8.25 -0.69 -4.90 115.22 117.83 1yj2 n HIS 139 Ca 0.17 0.49 0.06 0.00 -0.26 0.00 0.00 57.72 58.18 1yj2 n HIS 139 Cb 0.37 -3.51 0.16 0.00 1.12 0.00 0.00 29.99 28.13 1yj2 n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1yj2 n LYS 140 N -4.12 2.70 -3.56 -0.41 5.02 -0.64 -4.97 118.16 112.18 1yj2 n LYS 140 Ca -0.10 -2.04 -0.37 0.00 -2.02 0.00 0.00 58.31 53.78 1yj2 n LYS 140 Cb 0.60 -1.29 -0.06 0.00 -0.02 0.00 0.00 35.03 34.25 1yj2 n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1yj2 s LEU 141 N -1.00 4.35 0.60 -0.35 1.43 -1.25 -1.12 118.68 121.34 1yj2 s LEU 141 Ca 0.25 0.69 -0.18 0.00 -1.03 0.00 0.00 54.13 53.86 1yj2 s LEU 141 Cb 0.13 -2.43 -0.03 0.00 0.03 0.00 0.00 46.19 43.89 1yj2 s LEU 141 CO 0.17 0.22 1.14 -1.61 0.23 0.00 0.00 176.35 176.50 1yj2 s GLU 142 N -0.30 3.04 -1.26 1.70 2.02 -0.04 -4.87 118.70 119.00 1yj2 s GLU 142 Ca 0.20 1.57 -0.13 0.00 0.02 0.00 0.00 54.97 56.63 1yj2 s GLU 142 Cb -0.14 -1.97 0.15 0.00 0.10 0.00 0.00 34.13 32.27 1yj2 s GLU 142 CO 0.08 -1.09 1.66 0.98 0.02 0.00 0.00 175.26 176.91 1yj2 n TYR 143 N -1.81 4.19 -3.63 1.61 9.36 -1.26 -4.82 117.16 120.80 1yj2 n TYR 143 Ca 0.12 -3.09 -0.07 0.00 3.32 0.00 0.00 57.90 58.17 1yj2 n TYR 143 Cb 0.51 -2.19 0.02 0.00 -0.63 0.00 0.00 39.34 37.05 1yj2 n TYR 143 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1yj2 n ASN 144 N 5.41 -1.67 -3.66 2.98 0.23 -1.26 -4.87 115.26 112.42 1yj2 n ASN 144 Ca 0.40 -2.23 -0.10 0.00 -0.53 0.00 0.00 54.58 52.12 1yj2 n ASN 144 Cb 0.41 2.80 -0.08 0.00 -2.08 0.00 0.00 39.78 40.83 1yj2 n ASN 144 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1yj2 s TYR 145 N -3.80 -0.85 0.34 -2.53 5.04 -1.26 -4.86 117.35 109.43 1yj2 s TYR 145 Ca 0.13 1.83 -0.06 0.00 -2.44 0.00 0.00 57.07 56.54 1yj2 s TYR 145 Cb -0.03 0.42 -0.05 0.00 0.35 0.00 0.00 41.96 42.65 1yj2 s TYR 145 CO 0.10 -0.42 0.63 -0.80 -1.34 0.00 0.00 175.55 173.71 1yj2 s ASN 146 N 1.09 6.43 0.51 4.32 0.01 -1.26 -4.68 114.94 121.36 1yj2 s ASN 146 Ca -0.06 0.82 -0.18 0.00 -0.71 0.00 0.00 52.86 52.73 1yj2 s ASN 146 Cb -0.05 -2.19 -0.08 0.00 0.41 0.00 0.00 41.25 39.34 1yj2 s ASN 146 CO -0.11 -0.29 1.01 -0.44 -1.51 0.00 0.00 177.10 175.76 1yj2 s SER 147 N -3.33 6.42 0.13 -1.22 0.01 -1.26 -4.67 113.70 109.77 1yj2 s SER 147 Ca 0.46 1.74 -0.24 0.00 1.31 0.00 0.00 55.95 59.21 1yj2 s SER 147 Cb -0.10 -2.53 0.08 0.00 0.21 0.00 0.00 66.02 63.67 1yj2 s SER 147 CO 0.32 -0.73 1.09 -0.83 0.41 0.00 0.00 173.24 173.50 1yj2 s GLY 148 N -2.56 -0.02 -0.03 3.44 0.00 -0.96 -4.99 107.32 102.20 1yj2 s GLY 148 Ca 0.63 -0.12 0.05 0.00 0.00 0.00 0.00 44.72 45.28 1yj2 s GLY 148 CO 0.26 2.32 -0.17 -1.31 0.00 0.00 0.00 173.10 174.20 1yj2 s ASN 149 N -3.36 3.84 -0.29 1.64 0.01 -1.26 -0.54 114.94 114.98 1yj2 s ASN 149 Ca 0.21 -0.28 -0.05 0.00 -0.71 0.00 0.00 52.86 52.03 1yj2 s ASN 149 Cb -0.01 -0.73 0.02 0.00 0.41 0.00 0.00 41.25 40.94 1yj2 s ASN 149 CO 0.03 0.32 0.04 -0.69 -1.51 0.00 0.00 177.10 175.30 1yj2 s VAL 150 N -0.75 3.61 -0.30 1.60 1.01 0.51 -4.59 120.40 121.50 1yj2 s VAL 150 Ca 0.12 -0.86 -0.16 0.00 0.00 0.00 0.00 61.98 61.08 1yj2 s VAL 150 Cb -0.10 -2.88 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 1yj2 s VAL 150 CO 0.01 0.08 0.41 -0.31 0.00 0.00 0.00 175.10 175.29 1yj2 s TYR 151 N 1.43 3.23 -0.10 5.22 2.02 -1.06 -0.86 117.35 127.23 1yj2 s TYR 151 Ca 0.01 0.31 -0.04 0.00 -0.37 0.00 0.00 57.07 56.98 1yj2 s TYR 151 Cb -0.17 -2.67 -0.04 0.00 -0.40 0.00 0.00 41.96 38.68 1yj2 s TYR 151 CO 0.00 -0.33 0.06 0.42 -1.57 0.00 0.00 175.55 174.14 1yj2 s ILE 152 N 2.15 4.83 0.04 2.71 1.01 0.22 -1.64 121.20 130.52 1yj2 s ILE 152 Ca 0.16 -0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.77 1yj2 s ILE 152 Cb -0.16 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 1yj2 s ILE 152 CO 0.11 0.61 -0.05 0.42 0.00 0.00 0.00 174.94 176.02 1yj2 s THR 153 N -0.89 0.33 0.49 2.92 -4.23 -0.45 -2.30 115.64 111.51 1yj2 s THR 153 Ca 0.14 -1.20 -0.20 0.00 -1.18 0.00 0.00 61.69 59.24 1yj2 s THR 153 Cb -0.12 -0.70 -0.08 0.00 1.34 0.00 0.00 72.50 72.94 1yj2 s THR 153 CO 0.03 -0.57 1.03 0.00 -0.54 0.00 0.00 174.62 174.57 1yj2 s ALA 154 N -2.00 2.88 -0.63 3.99 0.00 -1.24 -0.87 121.76 123.88 1yj2 s ALA 154 Ca -0.08 0.58 0.05 0.00 0.00 0.00 0.00 51.96 52.51 1yj2 s ALA 154 Cb -0.06 -3.24 0.16 0.00 0.00 0.00 0.00 23.12 19.98 1yj2 s ALA 154 CO -0.02 -0.31 0.43 0.34 0.00 0.00 0.00 175.76 176.20 1yj2 s ASP 155 N -2.05 4.37 0.33 0.00 3.68 0.33 -4.67 116.67 118.66 1yj2 s ASP 155 Ca 0.67 -3.58 0.05 0.00 2.13 0.00 0.00 52.55 51.81 1yj2 s ASP 155 Cb -0.16 -1.49 0.67 0.00 -1.45 0.00 0.00 42.92 40.49 1yj2 s ASP 155 CO 0.20 -0.12 1.89 0.11 0.13 0.00 0.00 175.17 177.38 1yj2 h LYS 156 N 5.67 0.83 -0.08 4.34 1.79 -1.95 -1.14 116.57 126.03 1yj2 h LYS 156 Ca 0.11 -0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.46 1yj2 h LYS 156 Cb 0.80 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 31.25 1yj2 h LYS 156 CO 0.67 0.55 -0.28 1.96 -1.08 0.00 0.00 179.45 181.27 1yj2 h GLN 157 N 0.86 0.14 -0.47 3.15 4.20 -1.93 -1.08 115.11 119.96 1yj2 h GLN 157 Ca 0.41 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.08 1yj2 h GLN 157 Cb 0.43 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1yj2 h GLN 157 CO -0.17 0.41 0.00 1.63 -0.67 0.00 0.00 178.83 180.02 1yj2 n LYS 158 N -4.17 2.50 -3.57 1.46 5.02 -0.86 -4.95 118.16 113.60 1yj2 n LYS 158 Ca -0.01 -2.29 -0.26 0.00 -2.02 0.00 0.00 58.31 53.73 1yj2 n LYS 158 Cb 0.36 -1.52 0.04 0.00 -0.02 0.00 0.00 35.03 33.89 1yj2 n LYS 158 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1yj2 n ASN 159 N 1.44 -5.53 0.00 4.39 5.15 -0.41 -4.67 115.26 115.63 1yj2 n ASN 159 Ca 0.20 -0.56 0.00 0.00 -0.60 0.00 0.00 54.58 53.63 1yj2 n ASN 159 Cb 0.59 -4.41 0.00 0.00 -0.53 0.00 0.00 39.78 35.43 1yj2 n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1yj2 n GLY 160 N -1.72 4.14 3.24 8.20 0.00 -0.51 -4.33 105.19 114.22 1yj2 n GLY 160 Ca -0.00 -0.89 -0.14 0.00 0.00 0.00 0.00 46.02 44.99 1yj2 n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1yj2 s ILE 161 N -1.04 0.95 0.22 -0.61 -4.36 -0.81 -0.51 121.20 115.05 1yj2 s ILE 161 Ca 0.00 -2.01 0.11 0.00 -0.26 0.00 0.00 60.65 58.49 1yj2 s ILE 161 Cb 0.00 -1.92 -0.05 0.00 1.25 0.00 0.00 42.46 41.74 1yj2 s ILE 161 CO 0.00 -0.67 -0.22 -0.54 0.24 0.00 0.00 174.94 173.74 1yj2 s LYS 162 N -3.81 1.56 0.02 0.37 1.02 -0.05 -1.16 119.74 117.69 1yj2 s LYS 162 Ca 0.18 -1.61 0.00 0.00 0.02 0.00 0.00 55.97 54.56 1yj2 s LYS 162 Cb 0.04 -1.78 -0.02 0.00 -0.52 0.00 0.00 37.83 35.55 1yj2 s LYS 162 CO 0.01 0.36 -0.03 0.00 -0.92 0.00 0.00 175.35 174.77 1yj2 s ALA 163 N -2.02 0.14 -0.03 5.17 0.00 0.03 -1.34 121.76 123.71 1yj2 s ALA 163 Ca 0.24 -0.56 0.01 0.00 0.00 0.00 0.00 51.96 51.65 1yj2 s ALA 163 Cb -0.07 0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.21 1yj2 s ALA 163 CO 0.12 -0.14 -0.00 -0.80 0.00 0.00 0.00 175.76 174.93 1yj2 s ASN 164 N -1.35 0.42 0.17 0.00 0.01 -0.65 -1.19 114.94 112.35 1yj2 s ASN 164 Ca -0.14 -0.03 -0.24 0.00 -0.71 0.00 0.00 52.86 51.73 1yj2 s ASN 164 Cb -0.09 -0.21 0.06 0.00 0.41 0.00 0.00 41.25 41.41 1yj2 s ASN 164 CO -0.01 -0.08 0.89 0.72 -1.51 0.00 0.00 177.10 177.11 1yj2 s PHE 165 N 0.89 -0.17 -0.11 2.20 -0.12 -0.68 -2.57 117.98 117.41 1yj2 s PHE 165 Ca -0.09 -0.16 0.03 0.00 -0.05 0.00 0.00 56.93 56.67 1yj2 s PHE 165 Cb -0.12 0.65 0.00 0.00 -0.63 0.00 0.00 43.02 42.92 1yj2 s PHE 165 CO -0.01 -0.91 -0.23 0.15 -0.05 0.00 0.00 175.22 174.17 1yj2 s LYS 166 N -3.44 3.06 -0.16 1.99 1.02 -1.26 -0.58 119.74 120.37 1yj2 s LYS 166 Ca 0.11 -0.86 -0.05 0.00 0.02 0.00 0.00 55.97 55.19 1yj2 s LYS 166 Cb -0.02 -2.36 -0.03 0.00 -0.52 0.00 0.00 37.83 34.90 1yj2 s LYS 166 CO 0.02 0.13 -0.00 0.42 -0.92 0.00 0.00 175.35 175.00 1yj2 s ILE 167 N 0.46 4.19 -0.32 2.17 -1.09 -0.49 -4.85 121.20 121.27 1yj2 s ILE 167 Ca -0.15 -0.25 -0.09 0.00 -2.23 0.00 0.00 60.65 57.93 1yj2 s ILE 167 Cb -0.17 -2.86 0.01 0.00 -1.58 0.00 0.00 42.46 37.86 1yj2 s ILE 167 CO 0.06 0.48 0.15 -0.13 -1.23 0.00 0.00 174.94 174.27 1yj2 s ARG 168 N 0.37 3.13 -0.22 2.79 0.52 -1.26 -0.67 118.95 123.62 1yj2 s ARG 168 Ca -0.02 -0.85 -0.17 0.00 -0.52 0.00 0.00 55.73 54.17 1yj2 s ARG 168 Cb -0.14 -3.55 -0.03 0.00 0.52 0.00 0.00 34.95 31.75 1yj2 s ARG 168 CO 0.02 -0.50 0.46 -1.01 0.02 0.00 0.00 175.30 174.29 1yj2 s HIS 169 N 1.56 3.34 0.12 -0.53 3.76 0.19 -4.49 115.29 119.24 1yj2 s HIS 169 Ca 0.03 0.65 -0.31 0.00 -0.15 0.00 0.00 55.06 55.28 1yj2 s HIS 169 Cb -0.18 -2.62 -0.09 0.00 1.11 0.00 0.00 32.58 30.81 1yj2 s HIS 169 CO 0.05 -0.11 1.57 -0.80 -0.85 0.00 0.00 174.74 174.60 1yj2 s ASN 170 N 1.23 6.63 0.12 1.40 0.01 -1.26 -0.07 114.94 123.00 1yj2 s ASN 170 Ca 0.21 2.51 -0.12 0.00 -0.71 0.00 0.00 52.86 54.75 1yj2 s ASN 170 Cb -0.15 -2.58 -0.06 0.00 0.41 0.00 0.00 41.25 38.86 1yj2 s ASN 170 CO 0.09 -0.82 0.47 -0.63 -1.51 0.00 0.00 177.10 174.70 1yj2 s ILE 171 N 1.76 4.99 -0.64 0.60 1.01 -0.39 -0.86 121.20 127.67 1yj2 s ILE 171 Ca 0.71 0.60 0.08 0.00 0.00 0.00 0.00 60.65 62.04 1yj2 s ILE 171 Cb -0.41 -3.68 0.08 0.00 0.01 0.00 0.00 42.46 38.46 1yj2 s ILE 171 CO 0.31 0.25 1.23 -1.84 0.00 0.00 0.00 174.94 174.89 1yj2 n GLU 172 N 0.79 0.05 -0.31 2.79 0.28 -0.28 -1.73 120.64 122.25 1yj2 n GLU 172 Ca -0.06 0.54 0.12 0.00 -0.16 0.00 0.00 57.16 57.59 1yj2 n GLU 172 Cb 0.52 -1.71 0.29 0.00 1.43 0.00 0.00 31.44 31.97 1yj2 n GLU 172 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1yj2 n ASP 173 N -1.78 3.73 0.00 -1.84 5.75 -1.26 -4.93 116.55 116.22 1yj2 n ASP 173 Ca -0.01 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.78 1yj2 n ASP 173 Cb 0.04 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 39.73 1yj2 n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1yj2 n GLY 174 N 1.60 0.65 0.89 6.12 0.00 -0.70 -5.07 105.19 108.68 1yj2 n GLY 174 Ca 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.19 1yj2 n GLY 174 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1yj2 n SER 175 N 0.00 0.26 -4.04 1.61 2.88 -1.25 -4.87 113.62 108.21 1yj2 n SER 175 Ca 0.00 -1.24 -0.20 0.00 -1.33 0.00 0.00 58.87 56.10 1yj2 n SER 175 Cb 0.00 -0.16 -0.15 0.00 -0.75 0.00 0.00 64.21 63.15 1yj2 n SER 175 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1yj2 s VAL 176 N -0.71 0.83 -0.38 2.46 1.01 -1.26 -1.26 120.40 121.09 1yj2 s VAL 176 Ca 0.16 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 1yj2 s VAL 176 Cb -0.01 -0.70 0.03 0.00 0.00 0.00 0.00 36.38 35.70 1yj2 s VAL 176 CO 0.10 0.24 0.21 -1.58 0.00 0.00 0.00 175.10 174.08 1yj2 s GLN 177 N -0.15 2.79 0.22 2.72 2.00 0.90 -4.91 119.66 123.24 1yj2 s GLN 177 Ca 0.02 -1.13 -0.30 0.00 -2.00 0.00 0.00 55.36 51.96 1yj2 s GLN 177 Cb -0.05 -3.74 -0.09 0.00 0.80 0.00 0.00 33.01 29.94 1yj2 s GLN 177 CO -0.00 -0.73 1.15 -1.17 -0.50 0.00 0.00 175.29 174.03 1yj2 s LEU 178 N 1.54 4.49 -0.34 3.68 2.96 -1.26 -0.64 118.68 129.12 1yj2 s LEU 178 Ca 0.02 2.24 0.00 0.00 -0.22 0.00 0.00 54.13 56.17 1yj2 s LEU 178 Cb -0.20 -3.62 0.11 0.00 0.50 0.00 0.00 46.19 42.99 1yj2 s LEU 178 CO 0.06 -0.27 0.12 0.00 -1.32 0.00 0.00 176.35 174.95 1yj2 s ALA 179 N -0.54 1.72 0.06 5.97 0.00 0.16 -1.15 121.76 127.97 1yj2 s ALA 179 Ca 0.49 -1.90 -0.31 0.00 0.00 0.00 0.00 51.96 50.25 1yj2 s ALA 179 Cb -0.32 -1.69 -0.05 0.00 0.00 0.00 0.00 23.12 21.05 1yj2 s ALA 179 CO 0.39 -1.75 1.17 -0.51 0.00 0.00 0.00 175.76 175.06 1yj2 s ASP 180 N 1.33 7.12 -0.17 0.00 1.01 -0.21 -1.40 116.67 124.34 1yj2 s ASP 180 Ca 0.11 1.97 -0.03 0.00 0.71 0.00 0.00 52.55 55.32 1yj2 s ASP 180 Cb -0.19 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.15 1yj2 s ASP 180 CO -0.19 -0.44 -0.07 -1.00 0.21 0.00 0.00 175.17 173.68 1yj2 s HIS 181 N 1.03 2.92 -0.15 4.23 3.76 0.26 -0.52 115.29 126.83 1yj2 s HIS 181 Ca 0.58 -0.68 0.01 0.00 -0.15 0.00 0.00 55.06 54.81 1yj2 s HIS 181 Cb -0.28 -1.98 0.00 0.00 1.11 0.00 0.00 32.58 31.43 1yj2 s HIS 181 CO 0.29 -0.31 -0.18 -0.47 -0.85 0.00 0.00 174.74 173.23 1yj2 s TYR 182 N 0.82 2.74 0.01 1.40 5.04 -0.72 -1.69 117.35 124.95 1yj2 s TYR 182 Ca -0.02 -1.12 0.03 0.00 -2.44 0.00 0.00 57.07 53.51 1yj2 s TYR 182 Cb -0.15 -1.86 -0.01 0.00 0.35 0.00 0.00 41.96 40.29 1yj2 s TYR 182 CO 0.01 -0.50 -0.08 -1.14 -1.34 0.00 0.00 175.55 172.49 1yj2 s GLN 183 N 0.78 0.63 -0.01 4.97 0.74 -0.33 -1.37 119.66 125.07 1yj2 s GLN 183 Ca -0.07 -0.40 0.02 0.00 0.05 0.00 0.00 55.36 54.97 1yj2 s GLN 183 Cb -0.16 -0.58 -0.00 0.00 1.10 0.00 0.00 33.01 33.37 1yj2 s GLN 183 CO -0.00 0.15 -0.07 -0.65 -0.55 0.00 0.00 175.29 174.18 1yj2 s GLN 184 N -0.50 0.62 -0.02 1.67 -0.21 -0.16 -0.79 119.66 120.28 1yj2 s GLN 184 Ca 0.01 -0.23 0.04 0.00 0.02 0.00 0.00 55.36 55.20 1yj2 s GLN 184 Cb -0.05 -0.61 -0.01 0.00 1.00 0.00 0.00 33.01 33.35 1yj2 s GLN 184 CO 0.00 0.11 -0.14 -0.80 -2.12 0.00 0.00 175.29 172.34 1yj2 s ASN 185 N 0.03 1.71 -0.01 5.90 -0.87 -0.31 -0.27 114.94 121.11 1yj2 s ASN 185 Ca 0.00 -0.27 -0.01 0.00 -1.57 0.00 0.00 52.86 51.01 1yj2 s ASN 185 Cb -0.05 -0.25 0.00 0.00 -0.02 0.00 0.00 41.25 40.93 1yj2 s ASN 185 CO -0.00 0.16 0.03 0.28 -2.57 0.00 0.00 177.10 175.00 1yj2 s THR 186 N -0.24 -0.00 0.53 1.60 -1.32 -0.62 -1.93 115.64 113.66 1yj2 s THR 186 Ca 0.04 0.00 -0.21 0.00 -1.21 0.00 0.00 61.69 60.31 1yj2 s THR 186 Cb -0.07 -0.05 -0.06 0.00 -1.51 0.00 0.00 72.50 70.81 1yj2 s THR 186 CO -0.00 0.00 1.21 -2.16 -2.21 0.00 0.00 174.62 171.46 1yj2 s PRO 187 N 0.03 3.35 -0.06 7.08 0.04 -1.26 -0.68 135.00 143.50 1yj2 s PRO 187 Ca -0.00 1.86 -0.07 0.00 0.04 0.00 0.00 61.00 62.82 1yj2 s PRO 187 Cb -0.00 -2.18 -0.29 0.00 0.04 0.00 0.00 34.50 32.07 1yj2 s PRO 187 CO -0.00 -0.91 0.63 0.82 0.04 0.00 0.00 177.00 177.58 1yj2 h ILE 188 N 1.40 0.89 -4.34 0.56 2.04 -1.12 -3.44 117.51 113.50 1yj2 h ILE 188 Ca -0.50 -2.53 -0.46 0.00 1.00 0.00 0.00 64.86 62.37 1yj2 h ILE 188 Cb 1.27 2.68 0.13 0.00 -0.74 0.00 0.00 36.82 40.17 1yj2 h ILE 188 CO 0.58 0.85 0.40 -0.83 0.00 0.00 0.00 178.15 179.14 1yj2 s GLY 189 N -5.20 1.66 0.00 5.37 0.00 -1.26 -5.02 107.32 102.87 1yj2 s GLY 189 Ca -0.16 -0.84 0.22 0.00 0.00 0.00 0.00 44.72 43.94 1yj2 s GLY 189 CO 0.83 -0.24 1.08 1.22 0.00 0.00 0.00 173.10 176.00 1yj2 n ASP 190 N -3.56 2.15 -4.75 1.64 9.92 -1.26 -4.99 116.55 115.70 1yj2 n ASP 190 Ca 0.11 -1.57 -0.30 0.00 -0.53 0.00 0.00 54.79 52.49 1yj2 n ASP 190 Cb 0.60 0.39 0.11 0.00 -0.64 0.00 0.00 41.12 41.59 1yj2 n ASP 190 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1yj2 s GLY 191 N -2.31 1.64 0.46 0.44 0.00 -1.26 -4.97 107.32 101.33 1yj2 s GLY 191 Ca 0.19 0.08 -0.23 0.00 0.00 0.00 0.00 44.72 44.76 1yj2 s GLY 191 CO 0.50 0.49 1.15 2.56 0.00 0.00 0.00 173.10 177.80 1yj2 s PRO 192 N -4.94 3.75 0.37 2.90 0.04 -1.26 -5.03 135.00 130.83 1yj2 s PRO 192 Ca 0.62 1.72 0.08 0.00 0.04 0.00 0.00 61.00 63.47 1yj2 s PRO 192 Cb -0.17 -2.37 -0.07 0.00 0.04 0.00 0.00 34.50 31.93 1yj2 s PRO 192 CO 0.56 -0.54 -0.05 0.14 0.04 0.00 0.00 177.00 177.15 1yj2 s VAL 193 N -1.59 2.08 -0.23 -0.36 -7.23 -1.26 -4.85 120.40 106.97 1yj2 s VAL 193 Ca 0.64 -2.11 -0.20 0.00 -1.81 0.00 0.00 61.98 58.50 1yj2 s VAL 193 Cb -0.27 -2.79 -0.02 0.00 0.56 0.00 0.00 36.38 33.86 1yj2 s VAL 193 CO 0.33 -0.12 0.62 -0.76 -0.31 0.00 0.00 175.10 174.86 1yj2 s LEU 194 N -3.64 4.10 -0.39 1.32 1.43 -1.26 -5.04 118.68 115.20 1yj2 s LEU 194 Ca 0.33 0.76 -0.14 0.00 -1.03 0.00 0.00 54.13 54.05 1yj2 s LEU 194 Cb 0.06 -2.86 0.02 0.00 0.03 0.00 0.00 46.19 43.44 1yj2 s LEU 194 CO 0.17 -0.32 0.27 -0.76 0.23 0.00 0.00 176.35 175.94 1yj2 s LEU 195 N 2.21 4.94 0.51 1.79 1.43 -1.26 -3.93 118.68 124.36 1yj2 s LEU 195 Ca 0.27 -0.85 -0.14 0.00 -1.03 0.00 0.00 54.13 52.38 1yj2 s LEU 195 Cb -0.16 -2.13 -0.07 0.00 0.03 0.00 0.00 46.19 43.87 1yj2 s LEU 195 CO 0.09 -0.40 0.94 -2.16 0.23 0.00 0.00 176.35 175.05 1yj2 s PRO 196 N 1.66 3.85 0.84 1.29 0.04 -1.26 -4.95 135.00 136.47 1yj2 s PRO 196 Ca 0.05 0.80 -0.11 0.00 0.04 0.00 0.00 61.00 61.78 1yj2 s PRO 196 Cb -0.19 -2.19 0.10 0.00 0.04 0.00 0.00 34.50 32.26 1yj2 s PRO 196 CO 0.09 -0.26 1.09 -0.51 0.04 0.00 0.00 177.00 177.45 1yj2 s ASP 197 N -3.28 3.94 0.18 6.66 -0.00 -1.26 -3.72 116.67 119.18 1yj2 s ASP 197 Ca 0.56 1.67 -0.33 0.00 -0.00 0.00 0.00 52.55 54.45 1yj2 s ASP 197 Cb -0.10 -2.35 -0.14 0.00 -0.00 0.00 0.00 42.92 40.32 1yj2 s ASP 197 CO 0.35 -2.37 1.47 0.59 -0.00 0.00 0.00 175.17 175.21 1yj2 n ASN 198 N -3.73 2.74 -2.15 0.27 4.13 -1.26 -4.81 115.26 110.45 1yj2 n ASN 198 Ca 0.08 1.11 -0.04 0.00 1.68 0.00 0.00 54.58 57.41 1yj2 n ASN 198 Cb 0.54 -1.39 0.02 0.00 -1.54 0.00 0.00 39.78 37.40 1yj2 n ASN 198 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1yj2 n HIS 199 N 2.68 -1.51 -4.02 3.10 1.44 -0.97 -4.74 115.22 111.20 1yj2 n HIS 199 Ca 0.15 -0.95 -0.08 0.00 -2.01 0.00 0.00 57.72 54.82 1yj2 n HIS 199 Cb 0.29 0.47 -0.09 0.00 0.12 0.00 0.00 29.99 30.78 1yj2 n HIS 199 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 1yj2 s TYR 200 N -4.53 0.47 -0.20 -1.40 -0.85 -0.65 -0.61 117.35 109.59 1yj2 s TYR 200 Ca 0.11 -0.94 -0.07 0.00 -0.52 0.00 0.00 57.07 55.66 1yj2 s TYR 200 Cb -0.02 -0.28 -0.03 0.00 0.38 0.00 0.00 41.96 42.00 1yj2 s TYR 200 CO 0.06 -0.49 0.04 -0.51 -1.52 0.00 0.00 175.55 173.13 1yj2 s LEU 201 N -2.94 3.58 -0.28 -3.49 1.43 -0.04 -0.48 118.68 116.47 1yj2 s LEU 201 Ca 0.11 -0.06 -0.16 0.00 -1.03 0.00 0.00 54.13 52.99 1yj2 s LEU 201 Cb 0.07 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 1yj2 s LEU 201 CO -0.07 0.11 0.43 -0.55 0.23 0.00 0.00 176.35 176.50 1yj2 s SER 202 N 0.77 6.32 0.14 2.29 0.15 0.08 -0.36 113.70 123.09 1yj2 s SER 202 Ca 0.02 0.33 0.10 0.00 0.70 0.00 0.00 55.95 57.10 1yj2 s SER 202 Cb -0.14 -2.24 -0.04 0.00 -1.71 0.00 0.00 66.02 61.89 1yj2 s SER 202 CO 0.02 -0.25 -0.18 0.42 1.20 0.00 0.00 173.24 174.45 1yj2 s THR 203 N 2.18 2.76 -0.06 6.45 -4.23 0.29 -1.62 115.64 121.41 1yj2 s THR 203 Ca 0.17 -1.65 -0.02 0.00 -1.18 0.00 0.00 61.69 59.01 1yj2 s THR 203 Cb -0.16 -2.29 0.04 0.00 1.34 0.00 0.00 72.50 71.43 1yj2 s THR 203 CO 0.10 0.02 0.12 -1.10 -0.54 0.00 0.00 174.62 173.22 1yj2 s GLN 204 N -2.36 0.06 -0.01 3.99 -0.21 -0.38 -2.27 119.66 118.48 1yj2 s GLN 204 Ca 0.19 0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.92 1yj2 s GLN 204 Cb -0.10 -0.20 0.02 0.00 1.00 0.00 0.00 33.01 33.73 1yj2 s GLN 204 CO 0.11 -0.18 0.01 -1.12 -2.12 0.00 0.00 175.29 171.99 1yj2 s SER 205 N 1.23 0.09 -0.09 5.90 0.01 -1.26 -0.73 113.70 118.85 1yj2 s SER 205 Ca -0.08 0.01 0.02 0.00 1.31 0.00 0.00 55.95 57.21 1yj2 s SER 205 Cb -0.12 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.07 1yj2 s SER 205 CO -0.05 -0.06 -0.15 0.00 0.41 0.00 0.00 173.24 173.38 1yj2 s ALA 206 N 0.56 1.58 -0.05 1.44 0.00 0.59 -4.48 121.76 121.39 1yj2 s ALA 206 Ca -0.05 -0.64 -0.01 0.00 0.00 0.00 0.00 51.96 51.26 1yj2 s ALA 206 Cb -0.07 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 1yj2 s ALA 206 CO -0.01 0.03 0.03 -0.51 0.00 0.00 0.00 175.76 175.29 1yj2 s LEU 207 N 0.81 3.69 0.38 0.00 1.43 -1.26 -1.30 118.68 122.43 1yj2 s LEU 207 Ca -0.11 0.14 -0.09 0.00 -1.03 0.00 0.00 54.13 53.04 1yj2 s LEU 207 Cb -0.16 -1.97 0.03 0.00 0.03 0.00 0.00 46.19 44.13 1yj2 s LEU 207 CO 0.01 0.34 0.66 -0.94 0.23 0.00 0.00 176.35 176.65 1yj2 s SER 208 N -1.20 0.49 0.11 2.29 1.04 -0.09 -4.93 113.70 111.39 1yj2 s SER 208 Ca 0.17 -1.35 0.08 0.00 0.48 0.00 0.00 55.95 55.32 1yj2 s SER 208 Cb -0.12 0.78 -0.04 0.00 0.10 0.00 0.00 66.02 66.75 1yj2 s SER 208 CO 0.06 -1.55 -0.20 -0.54 0.98 0.00 0.00 173.24 171.99 1yj2 s LYS 209 N -2.50 1.13 -0.32 4.02 -0.14 -1.26 -1.33 119.74 119.35 1yj2 s LYS 209 Ca 0.23 -1.18 -0.21 0.00 -1.36 0.00 0.00 55.97 53.44 1yj2 s LYS 209 Cb -0.03 -1.35 -0.00 0.00 -1.68 0.00 0.00 37.83 34.76 1yj2 s LYS 209 CO 0.16 0.31 0.68 0.34 -0.76 0.00 0.00 175.35 176.08 1yj2 s ASP 210 N -2.00 6.54 0.32 2.83 -1.08 -1.26 -4.93 116.67 117.08 1yj2 s ASP 210 Ca 0.07 0.45 0.24 0.00 -0.52 0.00 0.00 52.55 52.79 1yj2 s ASP 210 Cb -0.09 -2.35 1.17 0.00 -1.46 0.00 0.00 42.92 40.18 1yj2 s ASP 210 CO 0.04 -0.55 1.73 1.55 0.52 0.00 0.00 175.17 178.46 1yj2 h PRO 211 N 8.22 0.00 -0.43 4.34 0.13 -2.04 -1.98 132.00 140.24 1yj2 h PRO 211 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1yj2 h PRO 211 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1yj2 h PRO 211 CO 0.84 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.70 1yj2 n ASN 212 N -2.32 3.38 -4.56 1.44 3.02 -1.26 -4.91 115.26 110.05 1yj2 n ASN 212 Ca -0.00 -1.95 -0.38 0.00 -0.03 0.00 0.00 54.58 52.22 1yj2 n ASN 212 Cb 0.12 -0.28 -0.11 0.00 -0.61 0.00 0.00 39.78 38.89 1yj2 n ASN 212 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1yj2 s GLU 213 N -1.25 3.89 0.02 3.52 2.56 -0.75 -4.97 118.70 121.72 1yj2 s GLU 213 Ca 0.37 -0.36 0.22 0.00 0.00 0.00 0.00 54.97 55.20 1yj2 s GLU 213 Cb 0.21 -3.57 -0.16 0.00 2.00 0.00 0.00 34.13 32.61 1yj2 s GLU 213 CO 0.28 -0.17 0.81 1.63 -0.56 0.00 0.00 175.26 177.25 1yj2 n LYS 214 N 4.98 0.35 -1.48 4.30 5.02 -1.26 -4.89 118.16 125.18 1yj2 n LYS 214 Ca -0.15 -0.06 -0.32 0.00 -2.02 0.00 0.00 58.31 55.76 1yj2 n LYS 214 Cb 0.52 -1.55 0.07 0.00 -0.02 0.00 0.00 35.03 34.05 1yj2 n LYS 214 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1yj2 s ARG 215 N -3.26 2.51 0.06 1.97 0.52 -1.26 -4.98 118.95 114.51 1yj2 s ARG 215 Ca 0.01 1.26 -0.31 0.00 -0.52 0.00 0.00 55.73 56.17 1yj2 s ARG 215 Cb 0.14 -1.92 -0.07 0.00 0.52 0.00 0.00 34.95 33.62 1yj2 s ARG 215 CO 0.86 -1.46 1.42 0.34 0.02 0.00 0.00 175.30 176.47 1yj2 s ASP 216 N -3.05 6.82 0.30 0.23 2.15 -1.26 -4.95 116.67 116.91 1yj2 s ASP 216 Ca 0.64 2.25 -0.19 0.00 0.43 0.00 0.00 52.55 55.67 1yj2 s ASP 216 Cb -0.19 -2.57 0.03 0.00 -0.30 0.00 0.00 42.92 39.89 1yj2 s ASP 216 CO 0.50 -0.70 0.72 -1.38 -0.17 0.00 0.00 175.17 174.13 1yj2 s HIS 217 N 1.81 -0.06 -0.10 -5.34 -3.43 -1.26 -1.04 115.29 105.87 1yj2 s HIS 217 Ca 0.65 -0.44 -0.05 0.00 -0.80 0.00 0.00 55.06 54.42 1yj2 s HIS 217 Cb -0.35 0.69 0.04 0.00 -1.43 0.00 0.00 32.58 31.54 1yj2 s HIS 217 CO 0.29 -1.30 0.24 1.41 -2.00 0.00 0.00 174.74 173.38 1yj2 s MET 218 N -3.55 0.20 -0.21 -0.38 1.75 0.16 -4.98 119.30 112.29 1yj2 s MET 218 Ca 0.13 0.50 -0.11 0.00 -1.25 0.00 0.00 55.69 54.97 1yj2 s MET 218 Cb -0.05 -0.11 -0.05 0.00 2.84 0.00 0.00 34.83 37.46 1yj2 s MET 218 CO 0.08 -0.15 0.17 0.08 -0.65 0.00 0.00 175.02 174.55 1yj2 s VAL 219 N 1.18 5.37 -0.11 10.11 1.01 -0.44 -0.57 120.40 136.94 1yj2 s VAL 219 Ca -0.09 0.25 0.03 0.00 0.00 0.00 0.00 61.98 62.17 1yj2 s VAL 219 Cb -0.10 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.78 1yj2 s VAL 219 CO -0.08 0.39 -0.22 -0.22 0.00 0.00 0.00 175.10 174.98 1yj2 s LEU 220 N 0.69 2.03 -0.18 3.92 2.96 0.19 -0.92 118.68 127.37 1yj2 s LEU 220 Ca 0.09 -0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 53.45 1yj2 s LEU 220 Cb -0.12 -1.35 0.00 0.00 0.50 0.00 0.00 46.19 45.22 1yj2 s LEU 220 CO 0.02 0.10 -0.13 -0.22 -1.32 0.00 0.00 176.35 174.80 1yj2 s LEU 221 N 0.62 2.50 0.01 -0.68 2.96 -0.42 -1.35 118.68 122.32 1yj2 s LEU 221 Ca -0.13 -0.50 0.02 0.00 -0.22 0.00 0.00 54.13 53.31 1yj2 s LEU 221 Cb -0.17 -1.59 -0.01 0.00 0.50 0.00 0.00 46.19 44.92 1yj2 s LEU 221 CO 0.03 0.03 -0.07 -0.70 -1.32 0.00 0.00 176.35 174.32 1yj2 s GLU 222 N 1.13 0.53 -0.07 1.98 2.12 -0.63 -0.30 118.70 123.46 1yj2 s GLU 222 Ca 0.01 -0.43 0.04 0.00 0.36 0.00 0.00 54.97 54.95 1yj2 s GLU 222 Cb -0.14 -0.45 0.00 0.00 0.26 0.00 0.00 34.13 33.80 1yj2 s GLU 222 CO -0.05 0.11 -0.18 -0.06 -0.54 0.00 0.00 175.26 174.54 1yj2 s PHE 223 N -0.59 1.92 -0.04 5.30 0.40 0.09 -1.03 117.98 124.03 1yj2 s PHE 223 Ca -0.02 -0.69 -0.00 0.00 -0.60 0.00 0.00 56.93 55.62 1yj2 s PHE 223 Cb -0.05 -1.32 0.03 0.00 0.51 0.00 0.00 43.02 42.19 1yj2 s PHE 223 CO 0.00 -0.28 0.01 0.08 0.70 0.00 0.00 175.22 175.73 1yj2 s VAL 224 N 0.33 0.17 -0.06 -0.44 1.01 -0.32 -1.25 120.40 119.84 1yj2 s VAL 224 Ca -0.12 0.16 0.03 0.00 0.00 0.00 0.00 61.98 62.05 1yj2 s VAL 224 Cb -0.15 -0.31 0.01 0.00 0.00 0.00 0.00 36.38 35.92 1yj2 s VAL 224 CO 0.05 0.18 -0.13 -0.89 0.00 0.00 0.00 175.10 174.30 1yj2 s THR 225 N 1.48 1.20 0.38 3.92 2.01 -0.64 -0.47 115.64 123.52 1yj2 s THR 225 Ca -0.03 -0.54 -0.24 0.00 0.31 0.00 0.00 61.69 61.18 1yj2 s THR 225 Cb -0.13 -1.07 -0.09 0.00 0.01 0.00 0.00 72.50 71.22 1yj2 s THR 225 CO -0.03 0.36 1.03 0.00 -0.69 0.00 0.00 174.62 175.30 1yj2 s ALA 226 N 0.46 3.12 0.36 7.40 0.00 0.27 -0.74 121.76 132.63 1yj2 s ALA 226 Ca -0.11 0.68 -0.09 0.00 0.00 0.00 0.00 51.96 52.43 1yj2 s ALA 226 Cb -0.14 -3.26 0.04 0.00 0.00 0.00 0.00 23.12 19.76 1yj2 s ALA 226 CO 0.03 -0.14 0.64 0.00 0.00 0.00 0.00 175.76 176.29 1yj2 n ALA 227 N 0.07 -1.17 -0.25 0.00 0.00 0.37 -4.58 120.51 114.94 1yj2 n ALA 227 Ca 0.04 -1.33 0.00 0.00 0.00 0.00 0.00 53.44 52.15 1yj2 n ALA 227 Cb 0.50 1.07 0.00 0.00 0.00 0.00 0.00 19.45 21.01 1yj2 n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yj2 n GLY 228 N -0.52 0.82 0.00 0.00 0.00 -1.26 -1.63 105.19 102.59 1yj2 n GLY 228 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1yj2 n GLY 228 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71