#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ja7 n ASN 2 N 0.00 0.52 -4.65 6.12 3.02 -1.26 -4.90 115.26 114.12 2ja7 n ASN 2 Ca 0.00 0.03 -0.57 0.00 -0.03 0.00 0.00 54.58 54.01 2ja7 n ASN 2 Cb 0.00 0.07 -0.07 0.00 -0.61 0.00 0.00 39.78 39.17 2ja7 n ASN 2 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ja7 n ALA 3 N -1.63 -1.05 -0.66 5.41 0.00 -1.26 -4.92 120.51 116.40 2ja7 n ALA 3 Ca 0.05 0.47 -0.14 0.00 0.00 0.00 0.00 53.44 53.83 2ja7 n ALA 3 Cb 0.38 -2.08 0.21 0.00 0.00 0.00 0.00 19.45 17.96 2ja7 n ALA 3 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2ja7 n PRO 4 N 3.70 -3.58 -3.20 0.00 -0.04 -1.26 -4.94 135.00 125.68 2ja7 n PRO 4 Ca 0.23 -1.16 -0.43 0.00 -0.04 0.00 0.00 63.50 62.11 2ja7 n PRO 4 Cb 0.12 -1.33 -0.07 0.00 -0.04 0.00 0.00 33.50 32.18 2ja7 n PRO 4 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ja7 s ASP 5 N -3.13 6.25 0.02 3.54 1.01 -1.26 -4.96 116.67 118.13 2ja7 s ASP 5 Ca 0.51 -0.64 -0.03 0.00 0.71 0.00 0.00 52.55 53.10 2ja7 s ASP 5 Cb -0.07 -2.28 -0.01 0.00 1.01 0.00 0.00 42.92 41.57 2ja7 s ASP 5 CO 0.41 -0.74 0.15 0.54 0.21 0.00 0.00 175.17 175.73 2ja7 n ARG 6 N 5.99 -0.04 0.00 8.23 5.12 -1.26 -0.20 116.66 134.50 2ja7 n ARG 6 Ca -0.05 0.14 0.00 0.00 -1.93 0.00 0.00 57.85 56.01 2ja7 n ARG 6 Cb 0.47 -0.21 0.00 0.00 -1.16 0.00 0.00 32.46 31.56 2ja7 n ARG 6 CO 0.00 0.00 0.00 1.97 -1.93 0.00 0.00 177.63 177.67 2ja7 n PHE 7 N -4.12 0.00 0.53 -1.55 1.16 -1.26 -1.94 117.46 110.28 2ja7 n PHE 7 Ca 0.00 0.00 0.07 0.00 -1.87 0.00 0.00 57.45 55.65 2ja7 n PHE 7 Cb 0.02 0.00 0.20 0.00 -1.61 0.00 0.00 39.48 38.09 2ja7 n PHE 7 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 2ja7 n GLU 8 N -0.36 2.13 0.00 3.97 1.02 0.72 -2.77 120.64 125.34 2ja7 n GLU 8 Ca 0.00 -1.62 0.12 0.00 -0.02 0.00 0.00 57.16 55.64 2ja7 n GLU 8 Cb 0.00 -1.39 0.25 0.00 -0.02 0.00 0.00 31.44 30.28 2ja7 n GLU 8 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2ja7 n LEU 9 N 0.76 0.96 0.00 -4.62 4.77 -0.82 -4.57 117.00 113.49 2ja7 n LEU 9 Ca 0.15 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2ja7 n LEU 9 Cb 0.41 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2ja7 n LEU 9 CO 0.11 0.20 0.00 2.22 -1.33 0.00 0.00 177.39 178.58 2ja7 n PHE 10 N -0.93 0.00 -3.29 -1.77 1.16 -1.24 -4.35 117.46 107.04 2ja7 n PHE 10 Ca 0.09 0.00 -0.39 0.00 -1.87 0.00 0.00 57.45 55.28 2ja7 n PHE 10 Cb 0.36 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.15 2ja7 n PHE 10 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2ja7 s LEU 11 N 0.00 4.08 0.62 5.98 2.01 -1.11 -4.92 118.68 125.34 2ja7 s LEU 11 Ca 0.00 0.50 -0.17 0.00 0.01 0.00 0.00 54.13 54.48 2ja7 s LEU 11 Cb 0.00 -2.61 -0.02 0.00 0.01 0.00 0.00 46.19 43.57 2ja7 s LEU 11 CO 0.00 -0.22 1.13 -0.76 1.01 0.00 0.00 176.35 177.51 2ja7 s LEU 12 N 2.01 3.52 0.00 1.79 1.02 -1.26 -4.78 118.68 120.98 2ja7 s LEU 12 Ca 0.20 2.10 0.00 0.00 0.02 0.00 0.00 54.13 56.45 2ja7 s LEU 12 Cb -0.15 -4.57 0.00 0.00 0.02 0.00 0.00 46.19 41.49 2ja7 s LEU 12 CO 0.09 -1.53 0.00 0.61 0.02 0.00 0.00 176.35 175.54 2ja7 n GLY 13 N -0.19 2.57 3.61 -3.19 0.00 -1.26 -5.01 105.19 101.72 2ja7 n GLY 13 Ca 0.11 -2.14 -0.52 0.00 0.00 0.00 0.00 46.02 43.48 2ja7 n GLY 13 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ja7 n GLU 14 N -0.68 1.50 -2.86 1.61 1.02 -1.26 -3.71 120.64 116.25 2ja7 n GLU 14 Ca 0.00 0.51 -0.04 0.00 -0.02 0.00 0.00 57.16 57.61 2ja7 n GLU 14 Cb 0.00 -2.45 0.00 0.00 -0.02 0.00 0.00 31.44 28.98 2ja7 n GLU 14 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ja7 n GLY 15 N 5.13 -2.81 3.61 0.62 0.00 -1.26 -5.07 105.19 105.41 2ja7 n GLY 15 Ca 0.30 0.59 -0.11 0.00 0.00 0.00 0.00 46.02 46.80 2ja7 n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ja7 s GLU 16 N -1.77 0.63 0.10 1.61 2.02 -1.24 -5.18 118.70 114.88 2ja7 s GLU 16 Ca 0.07 0.52 0.09 0.00 0.02 0.00 0.00 54.97 55.67 2ja7 s GLU 16 Cb -0.02 0.30 -0.04 0.00 0.10 0.00 0.00 34.13 34.48 2ja7 s GLU 16 CO 0.66 -0.12 -0.21 -1.12 0.02 0.00 0.00 175.26 174.49 2ja7 s SER 17 N -0.21 3.67 0.34 -0.19 0.01 -1.26 -4.86 113.70 111.21 2ja7 s SER 17 Ca 0.00 -0.59 0.08 0.00 1.31 0.00 0.00 55.95 56.75 2ja7 s SER 17 Cb -0.03 -0.45 0.79 0.00 0.21 0.00 0.00 66.02 66.54 2ja7 s SER 17 CO -0.02 0.20 1.86 0.11 0.41 0.00 0.00 173.24 175.80 2ja7 h LYS 18 N 3.98 0.70 -6.82 12.44 1.79 -1.90 -3.38 116.57 123.38 2ja7 h LYS 18 Ca -0.50 -0.04 -0.68 0.00 -2.18 0.00 0.00 60.65 57.25 2ja7 h LYS 18 Cb 1.16 -0.16 -0.21 0.00 -1.58 0.00 0.00 32.23 31.45 2ja7 h LYS 18 CO 0.44 0.46 -0.85 -0.51 -1.08 0.00 0.00 179.45 177.92 2ja7 s LEU 19 N -9.88 2.39 -0.17 2.94 1.43 -1.26 -0.82 118.68 113.30 2ja7 s LEU 19 Ca -0.10 -0.76 -0.05 0.00 -1.03 0.00 0.00 54.13 52.19 2ja7 s LEU 19 Cb 0.22 -1.24 0.08 0.00 0.03 0.00 0.00 46.19 45.28 2ja7 s LEU 19 CO 0.79 0.16 0.31 -0.75 0.23 0.00 0.00 176.35 177.10 2ja7 s LYS 20 N -2.22 0.22 -0.31 1.70 2.20 -1.07 -4.98 119.74 115.28 2ja7 s LYS 20 Ca 0.16 0.73 -0.05 0.00 -0.36 0.00 0.00 55.97 56.44 2ja7 s LYS 20 Cb -0.10 -0.14 0.03 0.00 -1.51 0.00 0.00 37.83 36.11 2ja7 s LYS 20 CO 0.07 -0.37 0.07 0.42 -0.36 0.00 0.00 175.35 175.18 2ja7 s ILE 21 N 2.48 3.64 -0.11 5.43 1.01 -1.26 -0.71 121.20 131.68 2ja7 s ILE 21 Ca 0.03 -1.03 -0.02 0.00 0.00 0.00 0.00 60.65 59.63 2ja7 s ILE 21 Cb -0.13 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 2ja7 s ILE 21 CO -0.11 -0.06 -0.03 -1.81 0.00 0.00 0.00 174.94 172.94 2ja7 s ASP 22 N 1.40 4.94 -0.49 3.58 1.01 -0.36 -4.98 116.67 121.78 2ja7 s ASP 22 Ca -0.01 0.00 -0.29 0.00 0.71 0.00 0.00 52.55 52.96 2ja7 s ASP 22 Cb -0.19 -1.53 0.03 0.00 1.01 0.00 0.00 42.92 42.24 2ja7 s ASP 22 CO 0.01 0.29 1.16 -2.16 0.21 0.00 0.00 175.17 174.69 2ja7 s PRO 23 N -0.36 3.68 0.32 8.23 0.04 -1.26 -0.97 135.00 144.68 2ja7 s PRO 23 Ca 0.06 0.54 -0.29 0.00 0.04 0.00 0.00 61.00 61.35 2ja7 s PRO 23 Cb -0.12 -3.93 -0.11 0.00 0.04 0.00 0.00 34.50 30.38 2ja7 s PRO 23 CO 0.02 -1.44 1.46 0.34 0.04 0.00 0.00 177.00 177.42 2ja7 s ASP 24 N 2.62 6.52 -0.06 6.66 -1.08 -1.18 -4.91 116.67 125.25 2ja7 s ASP 24 Ca 0.48 2.86 0.18 0.00 -0.52 0.00 0.00 52.55 55.54 2ja7 s ASP 24 Cb -0.07 -2.65 -0.27 0.00 -1.46 0.00 0.00 42.92 38.47 2ja7 s ASP 24 CO 0.31 -0.77 0.33 0.35 0.52 0.00 0.00 175.17 175.91 2ja7 n THR 25 N 1.39 0.26 -0.05 1.71 -2.24 -1.26 -4.52 114.28 109.57 2ja7 n THR 25 Ca 0.04 -0.49 0.25 0.00 -2.27 0.00 0.00 64.05 61.58 2ja7 n THR 25 Cb 0.40 -0.06 0.66 0.00 -2.10 0.00 0.00 70.33 69.23 2ja7 n THR 25 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2ja7 h LYS 26 N 0.00 0.00 -2.06 -0.78 1.79 -1.98 -3.41 116.57 110.13 2ja7 h LYS 26 Ca -0.10 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.32 2ja7 h LYS 26 Cb 1.11 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.54 2ja7 h LYS 26 CO 0.01 0.00 0.10 0.00 -1.08 0.00 0.00 179.45 178.48 2ja7 s ALA 27 N -4.60 -1.72 0.36 3.86 0.00 -1.26 -5.15 121.76 113.23 2ja7 s ALA 27 Ca -0.04 1.96 -0.27 0.00 0.00 0.00 0.00 51.96 53.61 2ja7 s ALA 27 Cb 0.16 -1.13 -0.12 0.00 0.00 0.00 0.00 23.12 22.03 2ja7 s ALA 27 CO 0.56 -0.33 1.10 -0.35 0.00 0.00 0.00 175.76 176.74 2ja7 n PRO 28 N 2.69 1.60 -3.09 0.00 -0.04 -1.26 -4.10 135.00 130.79 2ja7 n PRO 28 Ca -0.14 0.57 -0.07 0.00 -0.04 0.00 0.00 63.50 63.81 2ja7 n PRO 28 Cb 0.55 -2.08 0.01 0.00 -0.04 0.00 0.00 33.50 31.94 2ja7 n PRO 28 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2ja7 n ASN 29 N 0.80 -6.90 -3.58 3.54 2.85 -1.26 -4.91 115.26 105.81 2ja7 n ASN 29 Ca 0.08 0.59 -0.08 0.00 -0.11 0.00 0.00 54.58 55.06 2ja7 n ASN 29 Cb 0.36 -2.92 -0.04 0.00 1.24 0.00 0.00 39.78 38.42 2ja7 n ASN 29 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ja7 s ALA 30 N -1.39 -1.96 0.12 5.20 0.00 -1.26 -3.70 121.76 118.77 2ja7 s ALA 30 Ca 0.09 1.56 0.01 0.00 0.00 0.00 0.00 51.96 53.61 2ja7 s ALA 30 Cb -0.01 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.45 2ja7 s ALA 30 CO 0.42 -0.38 -0.02 0.08 0.00 0.00 0.00 175.76 175.86 2ja7 s VAL 31 N -1.50 0.52 -0.21 0.00 1.01 0.51 -3.07 120.40 117.66 2ja7 s VAL 31 Ca 0.02 -1.92 -0.00 0.00 0.00 0.00 0.00 61.98 60.07 2ja7 s VAL 31 Cb -0.01 -1.84 0.05 0.00 0.00 0.00 0.00 36.38 34.59 2ja7 s VAL 31 CO -0.02 -0.72 -0.04 -0.69 0.00 0.00 0.00 175.10 173.63 2ja7 s VAL 32 N -3.75 1.30 -0.22 2.92 1.01 -0.14 -1.01 120.40 120.51 2ja7 s VAL 32 Ca 0.16 -0.98 -0.05 0.00 0.00 0.00 0.00 61.98 61.11 2ja7 s VAL 32 Cb 0.06 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 2ja7 s VAL 32 CO -0.02 -0.05 0.01 -0.63 0.00 0.00 0.00 175.10 174.41 2ja7 s ILE 33 N 1.52 3.90 -0.42 2.22 1.01 0.21 -1.22 121.20 128.41 2ja7 s ILE 33 Ca -0.03 -0.32 -0.17 0.00 0.00 0.00 0.00 60.65 60.12 2ja7 s ILE 33 Cb -0.18 -2.78 0.02 0.00 0.01 0.00 0.00 42.46 39.53 2ja7 s ILE 33 CO -0.07 0.41 0.44 -0.89 0.00 0.00 0.00 174.94 174.83 2ja7 s THR 34 N 1.24 5.08 -0.20 2.92 2.01 0.11 0.83 115.64 127.64 2ja7 s THR 34 Ca 0.04 -0.29 -0.18 0.00 0.31 0.00 0.00 61.69 61.56 2ja7 s THR 34 Cb -0.15 -4.03 -0.03 0.00 0.01 0.00 0.00 72.50 68.30 2ja7 s THR 34 CO 0.01 -0.41 0.50 -0.36 -0.69 0.00 0.00 174.62 173.68 2ja7 s PHE 35 N 2.16 3.37 0.25 4.92 0.40 0.56 -2.61 117.98 127.03 2ja7 s PHE 35 Ca 0.13 0.75 -0.02 0.00 -0.60 0.00 0.00 56.93 57.19 2ja7 s PHE 35 Cb -0.17 -2.65 -0.04 0.00 0.51 0.00 0.00 43.02 40.67 2ja7 s PHE 35 CO 0.14 -0.09 0.46 -1.21 0.70 0.00 0.00 175.22 175.22 2ja7 s GLU 36 N 1.60 3.55 -1.37 0.44 0.41 -0.00 -1.61 118.70 121.72 2ja7 s GLU 36 Ca 0.23 -0.25 -0.15 0.00 -0.41 0.00 0.00 54.97 54.39 2ja7 s GLU 36 Cb -0.15 -2.76 0.02 0.00 -1.78 0.00 0.00 34.13 29.46 2ja7 s GLU 36 CO 0.09 0.31 0.39 1.63 -0.49 0.00 0.00 175.26 177.19 2ja7 n LYS 37 N -0.92 -1.01 -3.12 1.61 4.76 -0.91 -4.80 118.16 113.77 2ja7 n LYS 37 Ca -0.04 0.16 -0.09 0.00 -2.87 0.00 0.00 58.31 55.46 2ja7 n LYS 37 Cb 0.54 -3.34 -0.02 0.00 -1.84 0.00 0.00 35.03 30.37 2ja7 n LYS 37 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2ja7 n GLU 38 N -4.72 0.45 -0.96 1.97 -0.58 -1.25 -4.61 120.64 110.94 2ja7 n GLU 38 Ca -0.22 -1.81 0.00 0.00 -0.42 0.00 0.00 57.16 54.71 2ja7 n GLU 38 Cb 0.64 1.73 0.00 0.00 -0.57 0.00 0.00 31.44 33.24 2ja7 n GLU 38 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2ja7 n ASP 39 N -1.82 0.00 -0.35 1.62 5.75 -1.26 -1.61 116.55 118.88 2ja7 n ASP 39 Ca 0.01 -0.59 -0.09 0.00 -0.01 0.00 0.00 54.79 54.11 2ja7 n ASP 39 Cb 0.38 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.38 2ja7 n ASP 39 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2ja7 n HIS 40 N 0.00 -0.37 -0.12 2.11 8.25 -1.26 -0.40 115.22 123.44 2ja7 n HIS 40 Ca 0.00 1.05 -0.01 0.00 -0.26 0.00 0.00 57.72 58.50 2ja7 n HIS 40 Cb 0.00 -0.56 -0.00 0.00 1.12 0.00 0.00 29.99 30.54 2ja7 n HIS 40 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2ja7 n THR 41 N -4.95 -0.17 0.96 1.59 -1.04 -1.26 0.11 114.28 109.52 2ja7 n THR 41 Ca 0.02 0.69 0.10 0.00 -2.04 0.00 0.00 64.05 62.82 2ja7 n THR 41 Cb 0.22 -0.89 -0.08 0.00 -1.82 0.00 0.00 70.33 67.76 2ja7 n THR 41 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2ja7 n LEU 42 N -4.40 1.34 -0.09 -4.42 0.00 -0.50 -4.32 117.00 104.60 2ja7 n LEU 42 Ca 0.02 -0.60 -0.18 0.00 0.00 0.00 0.00 56.01 55.26 2ja7 n LEU 42 Cb 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 43.42 43.40 2ja7 n LEU 42 CO -0.04 0.29 -0.07 1.23 0.00 0.00 0.00 177.39 178.80 2ja7 h GLY 43 N 4.76 0.00 0.58 -3.96 0.00 0.37 -3.09 103.07 101.73 2ja7 h GLY 43 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.39 2ja7 h GLY 43 CO 0.00 0.00 0.23 -0.57 0.00 0.00 0.00 176.54 176.20 2ja7 h ASN 44 N -1.00 0.28 0.33 0.19 -1.24 -1.20 -2.02 115.58 110.92 2ja7 h ASN 44 Ca -0.17 0.05 -0.00 0.00 0.71 0.00 0.00 56.30 56.89 2ja7 h ASN 44 Cb 1.14 0.01 -0.02 0.00 0.73 0.00 0.00 38.32 40.18 2ja7 h ASN 44 CO -0.10 0.19 -0.31 0.25 -1.29 0.00 0.00 177.43 176.17 2ja7 h LEU 45 N 0.44 -0.82 0.00 0.34 5.85 -1.75 0.13 115.31 119.49 2ja7 h LEU 45 Ca 0.25 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.04 2ja7 h LEU 45 Cb 0.23 0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.54 2ja7 h LEU 45 CO -0.22 -0.44 0.00 -0.38 -0.34 0.00 0.00 178.44 177.05 2ja7 n ILE 46 N -5.43 0.00 -0.12 4.05 5.41 -1.11 -2.00 119.36 120.16 2ja7 n ILE 46 Ca -0.09 0.00 -0.25 0.00 1.00 0.00 0.00 62.75 63.41 2ja7 n ILE 46 Cb 0.33 -0.71 -0.08 0.00 -0.71 0.00 0.00 39.64 38.46 2ja7 n ILE 46 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 2ja7 n ARG 47 N -0.93 0.53 0.14 0.38 0.00 -0.23 -3.94 116.66 112.62 2ja7 n ARG 47 Ca 0.09 0.23 -0.14 0.00 -0.00 0.00 0.00 57.85 58.03 2ja7 n ARG 47 Cb 0.04 -1.40 -0.08 0.00 0.00 0.00 0.00 32.46 31.02 2ja7 n ARG 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ja7 h ALA 48 N -0.92 -0.31 -0.27 5.13 0.00 -0.61 -2.25 119.26 120.03 2ja7 h ALA 48 Ca -0.57 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 54.30 2ja7 h ALA 48 Cb 1.48 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 2ja7 h ALA 48 CO -0.34 -0.60 0.20 0.93 0.00 0.00 0.00 179.25 179.44 2ja7 h GLU 49 N -0.47 0.00 0.00 0.00 4.39 -1.66 0.77 114.58 117.61 2ja7 h GLU 49 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2ja7 h GLU 49 Cb 0.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 2ja7 h GLU 49 CO 0.05 0.00 0.00 1.25 -1.16 0.00 0.00 179.01 179.15 2ja7 h LEU 50 N 0.00 0.00 -0.37 1.33 6.46 -1.58 -2.90 115.31 118.25 2ja7 h LEU 50 Ca 0.13 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.89 2ja7 h LEU 50 Cb 0.52 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.45 2ja7 h LEU 50 CO -0.00 0.00 -0.05 -0.11 -0.62 0.00 0.00 178.44 177.66 2ja7 n LEU 51 N -2.63 0.63 -0.07 2.25 7.94 0.27 -3.81 117.00 121.58 2ja7 n LEU 51 Ca 0.03 -0.14 -0.19 0.00 -1.11 0.00 0.00 56.01 54.59 2ja7 n LEU 51 Cb 0.35 -0.08 -0.13 0.00 0.53 0.00 0.00 43.42 44.10 2ja7 n LEU 51 CO 0.27 0.11 -0.23 0.78 -1.11 0.00 0.00 177.39 177.21 2ja7 h ASN 52 N 0.91 0.10 -0.03 1.96 2.35 -1.51 -3.44 115.58 115.91 2ja7 h ASN 52 Ca 0.00 -0.74 -0.47 0.00 -0.55 0.00 0.00 56.30 54.54 2ja7 h ASN 52 Cb 0.30 -0.03 -0.09 0.00 0.05 0.00 0.00 38.32 38.54 2ja7 h ASN 52 CO 0.00 1.38 1.80 -0.67 -1.65 0.00 0.00 177.43 178.29 2ja7 n ASP 53 N -4.36 0.00 0.16 5.81 -0.08 -1.25 -4.63 116.55 112.21 2ja7 n ASP 53 Ca -0.24 0.02 0.08 0.00 -1.51 0.00 0.00 54.79 53.15 2ja7 n ASP 53 Cb 0.68 -0.86 0.44 0.00 2.34 0.00 0.00 41.12 43.71 2ja7 n ASP 53 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2ja7 n ARG 54 N 7.95 0.11 0.05 -0.67 5.12 -1.26 0.76 116.66 128.71 2ja7 n ARG 54 Ca 0.66 0.59 0.13 0.00 -1.93 0.00 0.00 57.85 57.30 2ja7 n ARG 54 Cb 0.06 -2.05 0.48 0.00 -1.16 0.00 0.00 32.46 29.79 2ja7 n ARG 54 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2ja7 n LYS 55 N -2.13 0.13 -3.07 5.56 4.76 -1.26 -4.72 118.16 117.43 2ja7 n LYS 55 Ca -0.01 0.09 -0.43 0.00 -2.87 0.00 0.00 58.31 55.09 2ja7 n LYS 55 Cb 0.22 -1.63 -0.06 0.00 -1.84 0.00 0.00 35.03 31.71 2ja7 n LYS 55 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2ja7 s VAL 56 N -3.05 4.78 0.25 -0.18 1.01 0.23 -1.33 120.40 122.11 2ja7 s VAL 56 Ca 0.12 0.17 0.18 0.00 0.00 0.00 0.00 61.98 62.45 2ja7 s VAL 56 Cb 0.16 -4.24 0.14 0.00 0.00 0.00 0.00 36.38 32.44 2ja7 s VAL 56 CO 0.58 -0.64 1.79 -0.07 0.00 0.00 0.00 175.10 176.76 2ja7 h LEU 57 N 9.81 0.00 -7.00 3.92 3.38 0.61 -3.46 115.31 122.56 2ja7 h LEU 57 Ca -0.25 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.73 2ja7 h LEU 57 Cb 1.09 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.63 2ja7 h LEU 57 CO 0.91 0.36 0.34 0.12 0.09 0.00 0.00 178.44 180.26 2ja7 s PHE 58 N -3.80 -0.55 -0.30 1.13 5.36 -0.75 -4.95 117.98 114.12 2ja7 s PHE 58 Ca -0.01 1.07 -0.15 0.00 -0.96 0.00 0.00 56.93 56.88 2ja7 s PHE 58 Cb 0.12 0.40 0.16 0.00 -0.34 0.00 0.00 43.02 43.36 2ja7 s PHE 58 CO 0.68 -0.43 0.99 0.00 -1.46 0.00 0.00 175.22 175.01 2ja7 s ALA 59 N -0.74 -2.67 0.21 11.12 0.00 -1.25 -0.01 121.76 128.41 2ja7 s ALA 59 Ca -0.04 2.06 -0.06 0.00 0.00 0.00 0.00 51.96 53.92 2ja7 s ALA 59 Cb -0.02 -2.02 -0.02 0.00 0.00 0.00 0.00 23.12 21.06 2ja7 s ALA 59 CO 0.04 -0.89 0.27 0.00 0.00 0.00 0.00 175.76 175.18 2ja7 s ALA 60 N 2.33 0.51 0.23 0.00 0.00 -1.01 -4.95 121.76 118.87 2ja7 s ALA 60 Ca -0.03 -1.30 -0.08 0.00 0.00 0.00 0.00 51.96 50.55 2ja7 s ALA 60 Cb -0.06 1.20 -0.02 0.00 0.00 0.00 0.00 23.12 24.24 2ja7 s ALA 60 CO -0.17 -0.69 0.35 1.52 0.00 0.00 0.00 175.76 176.76 2ja7 s TYR 61 N -4.08 0.67 -0.18 0.00 -0.00 -1.26 -0.87 117.35 111.62 2ja7 s TYR 61 Ca 0.30 -0.97 -0.28 0.00 -0.00 0.00 0.00 57.07 56.11 2ja7 s TYR 61 Cb 0.04 -0.09 0.10 0.00 -0.00 0.00 0.00 41.96 42.01 2ja7 s TYR 61 CO 0.09 -0.86 0.88 -1.59 -0.00 0.00 0.00 175.55 174.07 2ja7 s LYS 62 N -4.06 0.73 -0.19 -3.49 -2.85 -0.22 -4.98 119.74 104.68 2ja7 s LYS 62 Ca 0.29 0.41 -0.18 0.00 -1.00 0.00 0.00 55.97 55.49 2ja7 s LYS 62 Cb 0.02 0.35 -0.04 0.00 -2.06 0.00 0.00 37.83 36.10 2ja7 s LYS 62 CO 0.10 -0.18 0.48 0.14 0.10 0.00 0.00 175.35 175.99 2ja7 s VAL 63 N -0.59 5.15 0.13 1.79 -7.23 -1.26 -1.51 120.40 116.87 2ja7 s VAL 63 Ca -0.03 0.88 -0.17 0.00 -1.81 0.00 0.00 61.98 60.86 2ja7 s VAL 63 Cb -0.02 -3.81 -0.02 0.00 0.56 0.00 0.00 36.38 33.09 2ja7 s VAL 63 CO 0.02 0.22 1.69 -0.33 -0.31 0.00 0.00 175.10 176.39 2ja7 h GLU 64 N 7.30 0.53 -1.72 4.82 4.39 -1.90 -3.45 114.58 124.55 2ja7 h GLU 64 Ca -0.36 -0.08 0.09 0.00 0.34 0.00 0.00 59.36 59.35 2ja7 h GLU 64 Cb 1.16 -0.09 -0.22 0.00 -0.10 0.00 0.00 28.75 29.50 2ja7 h GLU 64 CO 0.74 0.49 0.07 -1.58 -1.16 0.00 0.00 179.01 177.57 2ja7 s HIS 65 N -5.65 -1.00 0.48 4.33 5.04 -1.26 -5.06 115.29 112.17 2ja7 s HIS 65 Ca -0.13 1.84 0.39 0.00 -1.54 0.00 0.00 55.06 55.62 2ja7 s HIS 65 Cb 0.10 0.60 1.34 0.00 0.04 0.00 0.00 32.58 34.65 2ja7 s HIS 65 CO 0.74 -0.50 1.27 -0.35 -2.34 0.00 0.00 174.74 173.57 2ja7 n PRO 66 N 4.74 0.00 0.23 2.88 -0.04 -1.26 -0.59 135.00 140.95 2ja7 n PRO 66 Ca -0.15 0.90 0.07 0.00 -0.04 0.00 0.00 63.50 64.29 2ja7 n PRO 66 Cb 0.54 -2.11 0.55 0.00 -0.04 0.00 0.00 33.50 32.43 2ja7 n PRO 66 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2ja7 h PHE 67 N 0.00 0.00 -3.91 0.54 0.05 -2.01 -3.43 116.94 108.18 2ja7 h PHE 67 Ca 0.73 0.00 -0.69 0.00 3.82 0.00 0.00 57.97 61.83 2ja7 h PHE 67 Cb 3.07 0.00 -0.22 0.00 2.00 0.00 0.00 35.95 40.79 2ja7 h PHE 67 CO 0.00 0.20 -0.75 -0.06 -0.18 0.00 0.00 178.31 177.53 2ja7 s PHE 68 N -4.35 2.77 -0.50 -0.55 2.99 0.24 -5.07 117.98 113.50 2ja7 s PHE 68 Ca -0.03 -0.13 -0.25 0.00 0.00 0.00 0.00 56.93 56.52 2ja7 s PHE 68 Cb 0.14 -1.66 0.03 0.00 0.00 0.00 0.00 43.02 41.54 2ja7 s PHE 68 CO 0.66 0.21 0.94 0.00 -0.00 0.00 0.00 175.22 177.03 2ja7 s ALA 69 N -0.71 3.19 0.00 5.36 0.00 -1.26 -4.76 121.76 123.58 2ja7 s ALA 69 Ca 0.11 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2ja7 s ALA 69 Cb -0.11 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2ja7 s ALA 69 CO 0.01 -2.22 0.00 2.89 0.00 0.00 0.00 175.76 176.44 2ja7 n ARG 70 N 7.34 0.00 -3.74 0.00 1.85 -0.63 -2.13 116.66 119.35 2ja7 n ARG 70 Ca 0.04 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 56.80 2ja7 n ARG 70 Cb 0.48 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.83 2ja7 n ARG 70 CO 0.00 0.00 0.00 -0.59 -0.01 0.00 0.00 177.63 177.03 2ja7 s PHE 71 N -2.00 -0.03 -0.09 2.89 -0.12 -0.63 -4.14 117.98 113.85 2ja7 s PHE 71 Ca 0.00 -0.34 -0.01 0.00 -0.05 0.00 0.00 56.93 56.53 2ja7 s PHE 71 Cb 0.00 0.10 -0.03 0.00 -0.63 0.00 0.00 43.02 42.46 2ja7 s PHE 71 CO 0.00 -0.62 -0.04 0.15 -0.05 0.00 0.00 175.22 174.66 2ja7 s LYS 72 N -3.82 3.01 -0.13 1.99 1.02 -0.57 -0.33 119.74 120.91 2ja7 s LYS 72 Ca 0.04 -0.49 0.03 0.00 0.02 0.00 0.00 55.97 55.57 2ja7 s LYS 72 Cb 0.03 -2.73 0.01 0.00 -0.52 0.00 0.00 37.83 34.62 2ja7 s LYS 72 CO -0.11 0.60 -0.22 -1.17 -0.92 0.00 0.00 175.35 173.52 2ja7 s LEU 73 N -0.62 2.13 -0.16 3.17 2.96 0.24 -1.05 118.68 125.35 2ja7 s LEU 73 Ca 0.10 -0.58 -0.04 0.00 -0.22 0.00 0.00 54.13 53.38 2ja7 s LEU 73 Cb -0.12 -1.44 -0.03 0.00 0.50 0.00 0.00 46.19 45.10 2ja7 s LEU 73 CO 0.02 0.11 -0.03 -0.60 -1.32 0.00 0.00 176.35 174.53 2ja7 s ARG 74 N 0.66 3.69 -0.08 1.98 3.52 -0.05 0.63 118.95 129.31 2ja7 s ARG 74 Ca -0.11 -0.50 0.01 0.00 -0.13 0.00 0.00 55.73 55.00 2ja7 s ARG 74 Cb -0.16 -2.95 0.02 0.00 -1.56 0.00 0.00 34.95 30.30 2ja7 s ARG 74 CO 0.02 0.23 -0.09 0.42 -0.81 0.00 0.00 175.30 175.07 2ja7 s ILE 75 N 0.39 0.96 -0.04 4.11 1.01 -0.18 -2.40 121.20 125.05 2ja7 s ILE 75 Ca -0.03 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 60.35 2ja7 s ILE 75 Cb -0.14 -0.93 -0.01 0.00 0.01 0.00 0.00 42.46 41.39 2ja7 s ILE 75 CO 0.03 0.33 -0.21 -1.58 0.00 0.00 0.00 174.94 173.51 2ja7 s GLN 76 N 1.14 1.99 0.32 2.79 0.74 0.98 -0.36 119.66 127.26 2ja7 s GLN 76 Ca -0.06 -0.74 0.04 0.00 0.05 0.00 0.00 55.36 54.65 2ja7 s GLN 76 Cb -0.14 -1.77 -0.03 0.00 1.10 0.00 0.00 33.01 32.17 2ja7 s GLN 76 CO -0.02 0.35 0.19 0.95 -0.55 0.00 0.00 175.29 176.22 2ja7 s THR 77 N -0.20 0.23 0.11 -0.34 -4.23 -1.24 0.12 115.64 110.08 2ja7 s THR 77 Ca 0.00 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.20 2ja7 s THR 77 Cb -0.11 -2.48 -0.07 0.00 1.34 0.00 0.00 72.50 71.18 2ja7 s THR 77 CO 0.02 0.00 1.28 -0.89 -0.54 0.00 0.00 174.62 174.49 2ja7 s THR 78 N -3.52 3.63 0.37 3.99 2.01 -0.44 -4.74 115.64 116.94 2ja7 s THR 78 Ca 0.36 1.20 -0.23 0.00 0.31 0.00 0.00 61.69 63.33 2ja7 s THR 78 Cb 0.04 -3.77 -0.15 0.00 0.01 0.00 0.00 72.50 68.63 2ja7 s THR 78 CO 0.20 0.11 0.36 1.21 -0.69 0.00 0.00 174.62 175.81 2ja7 n GLU 79 N 3.69 0.26 -0.99 4.92 2.13 -1.26 -1.99 120.64 127.40 2ja7 n GLU 79 Ca 0.09 0.09 0.00 0.00 0.66 0.00 0.00 57.16 58.01 2ja7 n GLU 79 Cb 0.44 -1.22 0.00 0.00 0.27 0.00 0.00 31.44 30.93 2ja7 n GLU 79 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ja7 n GLY 80 N 2.04 0.64 2.79 8.31 0.00 -1.26 -4.98 105.19 112.73 2ja7 n GLY 80 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2ja7 n GLY 80 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2ja7 s TYR 81 N -2.59 1.78 0.05 1.61 6.04 -0.84 -5.11 117.35 118.29 2ja7 s TYR 81 Ca 0.00 -1.57 -0.31 0.00 0.04 0.00 0.00 57.07 55.24 2ja7 s TYR 81 Cb 0.00 -1.56 -0.07 0.00 -1.04 0.00 0.00 41.96 39.29 2ja7 s TYR 81 CO 0.00 -0.79 1.44 0.34 -1.54 0.00 0.00 175.55 175.00 2ja7 s ASP 82 N 1.60 6.80 0.46 4.32 -1.08 -1.26 -4.59 116.67 122.92 2ja7 s ASP 82 Ca 0.04 2.25 0.13 0.00 -0.52 0.00 0.00 52.55 54.45 2ja7 s ASP 82 Cb -0.18 -2.57 1.06 0.00 -1.46 0.00 0.00 42.92 39.77 2ja7 s ASP 82 CO -0.16 -0.72 2.05 1.55 0.52 0.00 0.00 175.17 178.41 2ja7 h PRO 83 N 7.54 0.10 -0.96 4.34 0.13 -1.95 -1.24 132.00 139.98 2ja7 h PRO 83 Ca -0.40 -0.01 0.15 0.00 -0.87 0.00 0.00 66.00 64.87 2ja7 h PRO 83 Cb 1.19 -0.02 -0.10 0.00 0.13 0.00 0.00 31.00 32.21 2ja7 h PRO 83 CO 0.89 0.16 0.57 0.87 -0.23 0.00 0.00 178.00 180.26 2ja7 h LYS 84 N 0.10 0.78 -0.08 0.86 1.57 -1.96 0.30 116.57 118.14 2ja7 h LYS 84 Ca 0.03 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2ja7 h LYS 84 Cb 0.15 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 2ja7 h LYS 84 CO 0.01 0.51 0.03 -0.44 -0.57 0.00 0.00 179.45 178.99 2ja7 h ASP 85 N 0.80 0.12 -0.76 0.86 3.32 -1.61 -2.38 116.42 116.76 2ja7 h ASP 85 Ca 0.52 -0.18 0.15 0.00 0.02 0.00 0.00 57.03 57.54 2ja7 h ASP 85 Cb 0.68 -0.03 -0.10 0.00 0.22 0.00 0.00 39.33 40.10 2ja7 h ASP 85 CO -0.34 0.27 0.27 0.00 -1.72 0.00 0.00 179.24 177.73 2ja7 h ALA 86 N 0.85 1.06 -0.11 3.45 0.00 -0.49 0.12 119.26 124.15 2ja7 h ALA 86 Ca 0.03 0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2ja7 h ALA 86 Cb 0.19 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2ja7 h ALA 86 CO -0.00 -0.26 -0.05 1.25 0.00 0.00 0.00 179.25 180.19 2ja7 h LEU 87 N 0.39 -0.17 0.00 0.00 5.85 -0.29 -1.20 115.31 119.89 2ja7 h LEU 87 Ca 0.43 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.19 2ja7 h LEU 87 Cb 0.69 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.82 2ja7 h LEU 87 CO -0.45 -0.07 0.00 0.29 -0.34 0.00 0.00 178.44 177.88 2ja7 n LYS 88 N -5.18 0.00 -0.04 1.25 5.02 0.37 -1.73 118.16 117.85 2ja7 n LYS 88 Ca -0.04 0.57 -0.01 0.00 -2.02 0.00 0.00 58.31 56.81 2ja7 n LYS 88 Cb 0.11 -1.20 -0.01 0.00 -0.02 0.00 0.00 35.03 33.90 2ja7 n LYS 88 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ja7 n ASN 89 N -1.62 -0.11 -0.57 4.39 3.02 -0.85 0.74 115.26 120.26 2ja7 n ASN 89 Ca 0.00 0.98 0.44 0.00 -0.03 0.00 0.00 54.58 55.97 2ja7 n ASN 89 Cb 0.00 -0.42 0.67 0.00 -0.61 0.00 0.00 39.78 39.42 2ja7 n ASN 89 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ja7 n ALA 90 N -2.95 1.55 -0.07 5.41 0.00 -0.46 0.15 120.51 124.13 2ja7 n ALA 90 Ca 0.00 0.53 -0.13 0.00 0.00 0.00 0.00 53.44 53.85 2ja7 n ALA 90 Cb 0.03 -0.93 -0.10 0.00 0.00 0.00 0.00 19.45 18.45 2ja7 n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ja7 h ASN 92 N -1.00 -0.90 -0.72 0.00 2.35 0.25 0.28 115.58 115.84 2ja7 h ASN 92 Ca -0.07 0.19 0.12 0.00 -0.55 0.00 0.00 56.30 55.99 2ja7 h ASN 92 Cb 0.86 0.47 -0.13 0.00 0.05 0.00 0.00 38.32 39.57 2ja7 h ASN 92 CO -0.04 -0.28 -0.37 -1.28 -1.65 0.00 0.00 177.43 173.82 2ja7 h SER 93 N -0.15 -1.29 -0.28 5.81 0.87 -0.39 0.46 113.55 118.57 2ja7 h SER 93 Ca 0.22 0.26 0.05 0.00 -1.23 0.00 0.00 61.79 61.09 2ja7 h SER 93 Cb 0.50 0.65 -0.05 0.00 -0.44 0.00 0.00 62.40 63.06 2ja7 h SER 93 CO -0.58 -0.30 -0.05 0.40 -0.53 0.00 0.00 176.83 175.77 2ja7 h ILE 94 N -0.12 0.74 0.81 2.23 2.04 -0.43 0.11 117.51 122.89 2ja7 h ILE 94 Ca 0.26 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 66.08 2ja7 h ILE 94 Cb 0.56 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 2ja7 h ILE 94 CO -0.78 0.00 -0.44 0.40 0.00 0.00 0.00 178.15 177.34 2ja7 h ILE 95 N 0.03 0.12 -0.93 -0.67 2.04 0.74 -1.08 117.51 117.75 2ja7 h ILE 95 Ca 0.14 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.25 2ja7 h ILE 95 Cb 0.20 0.12 -0.17 0.00 -0.74 0.00 0.00 36.82 36.23 2ja7 h ILE 95 CO -0.27 0.00 0.09 0.78 0.00 0.00 0.00 178.15 178.74 2ja7 h ASN 96 N -1.15 -0.33 -0.72 1.72 2.35 0.25 1.10 115.58 118.79 2ja7 h ASN 96 Ca -0.11 0.25 -0.06 0.00 -0.55 0.00 0.00 56.30 55.83 2ja7 h ASN 96 Cb 0.90 0.41 -0.03 0.00 0.05 0.00 0.00 38.32 39.65 2ja7 h ASN 96 CO 0.15 -0.29 0.22 0.11 -1.65 0.00 0.00 177.43 175.97 2ja7 h LYS 97 N 0.06 1.12 -0.24 0.81 1.57 -0.40 -2.39 116.57 117.11 2ja7 h LYS 97 Ca 0.57 -0.24 -0.09 0.00 -1.87 0.00 0.00 60.65 59.02 2ja7 h LYS 97 Cb 1.17 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 2ja7 h LYS 97 CO -0.82 0.96 -0.21 -0.07 -0.57 0.00 0.00 179.45 178.74 2ja7 h LEU 98 N 1.07 0.59 -1.20 2.94 3.38 0.17 -1.63 115.31 120.63 2ja7 h LEU 98 Ca 0.23 -0.46 0.22 0.00 0.09 0.00 0.00 57.88 57.96 2ja7 h LEU 98 Cb 0.31 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 40.79 2ja7 h LEU 98 CO -0.01 0.93 0.62 1.23 0.09 0.00 0.00 178.44 181.31 2ja7 h GLY 99 N 0.26 1.47 0.38 0.83 0.00 0.11 0.88 103.07 106.99 2ja7 h GLY 99 Ca 0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 2ja7 h GLY 99 CO 0.05 -0.09 -0.06 0.00 0.00 0.00 0.00 176.54 176.45 2ja7 h ALA 100 N 1.64 -0.16 -0.89 3.60 0.00 -1.27 -3.13 119.26 119.05 2ja7 h ALA 100 Ca 0.57 -0.25 0.12 0.00 0.00 0.00 0.00 54.91 55.35 2ja7 h ALA 100 Cb 1.15 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 2ja7 h ALA 100 CO -0.33 -0.28 0.57 1.25 0.00 0.00 0.00 179.25 180.46 2ja7 h LEU 101 N -0.78 0.71 -0.11 0.00 6.46 0.06 0.27 115.31 121.93 2ja7 h LEU 101 Ca -0.02 0.03 0.03 0.00 -0.12 0.00 0.00 57.88 57.81 2ja7 h LEU 101 Cb 0.55 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.34 2ja7 h LEU 101 CO 0.03 0.39 -0.09 0.50 -0.62 0.00 0.00 178.44 178.65 2ja7 h LYS 102 N 0.77 -0.10 0.41 1.25 3.64 0.63 -2.08 116.57 121.08 2ja7 h LYS 102 Ca 0.43 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.80 2ja7 h LYS 102 Cb 0.59 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2ja7 h LYS 102 CO -0.19 -0.06 -0.20 1.15 -2.27 0.00 0.00 179.45 177.88 2ja7 h THR 103 N -0.10 0.00 0.00 1.00 2.02 -0.99 -2.66 112.91 112.19 2ja7 h THR 103 Ca 0.07 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.13 2ja7 h THR 103 Cb 0.20 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 2ja7 h THR 103 CO -0.17 0.00 0.03 0.59 0.37 0.00 0.00 175.52 176.34 2ja7 n ASN 104 N -3.82 0.00 -0.10 4.18 3.02 0.78 -0.98 115.26 118.34 2ja7 n ASN 104 Ca -0.07 0.08 -0.14 0.00 -0.03 0.00 0.00 54.58 54.42 2ja7 n ASN 104 Cb 0.22 -0.08 -0.05 0.00 -0.61 0.00 0.00 39.78 39.26 2ja7 n ASN 104 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2ja7 n PHE 105 N -0.97 0.21 0.05 3.10 7.35 -0.78 -4.19 117.46 122.23 2ja7 n PHE 105 Ca 0.00 0.09 0.20 0.00 -0.76 0.00 0.00 57.45 56.98 2ja7 n PHE 105 Cb 0.03 -0.69 0.72 0.00 0.35 0.00 0.00 39.48 39.89 2ja7 n PHE 105 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2ja7 h GLU 106 N -1.00 0.00 0.92 -4.13 5.08 -0.69 -0.50 114.58 114.25 2ja7 h GLU 106 Ca -0.18 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.13 2ja7 h GLU 106 Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 2ja7 h GLU 106 CO -0.11 0.00 -0.48 1.15 -1.00 0.00 0.00 179.01 178.57 2ja7 h THR 107 N 0.00 0.02 -0.68 1.13 2.02 -1.38 -2.01 112.91 112.02 2ja7 h THR 107 Ca 0.22 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.44 2ja7 h THR 107 Cb 0.95 0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 2ja7 h THR 107 CO -0.00 0.00 0.45 -0.33 0.37 0.00 0.00 175.52 176.01 2ja7 h GLU 108 N -1.29 0.75 0.14 6.66 4.39 -1.42 -3.14 114.58 120.68 2ja7 h GLU 108 Ca -0.13 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 2ja7 h GLU 108 Cb 1.00 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 29.48 2ja7 h GLU 108 CO 0.18 0.50 -0.09 2.35 -1.16 0.00 0.00 179.01 180.79 2ja7 h TRP 109 N 0.78 -0.23 0.00 4.33 2.91 -0.75 -3.31 115.95 119.67 2ja7 h TRP 109 Ca 0.28 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.30 2ja7 h TRP 109 Cb 0.13 0.08 0.00 0.00 -0.51 0.00 0.00 29.16 28.87 2ja7 h TRP 109 CO -0.00 -0.14 0.00 0.09 -1.03 0.00 0.00 178.44 177.36 2ja7 n ASN 110 N -5.20 0.00 -3.04 2.65 3.02 -0.79 -4.57 115.26 107.33 2ja7 n ASN 110 Ca -0.08 -0.05 -0.18 0.00 -0.03 0.00 0.00 54.58 54.24 2ja7 n ASN 110 Cb 0.13 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.28 2ja7 n ASN 110 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2ja7 n LEU 111 N 0.82 -0.76 0.00 3.41 4.77 -1.25 -5.12 117.00 118.86 2ja7 n LEU 111 Ca 0.00 -4.29 0.00 0.00 -0.03 0.00 0.00 56.01 51.69 2ja7 n LEU 111 Cb 0.00 0.73 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 2ja7 n LEU 111 CO 0.00 2.08 0.00 0.00 -1.33 0.00 0.00 177.39 178.14 2ja7 n GLN 112 N 1.24 0.00 -0.47 3.23 10.64 -1.26 -5.19 117.38 125.57 2ja7 n GLN 112 Ca 0.17 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.34 2ja7 n GLN 112 Cb 0.59 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.97 2ja7 n GLN 112 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 2ja7 n THR 113 N 0.00 0.00 -0.70 -0.39 -2.24 -1.26 -5.28 114.28 104.42 2ja7 n THR 113 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2ja7 n THR 113 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2ja7 n THR 113 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39