#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxw s PRO 2 N 0.00 4.31 0.14 -0.24 0.04 -1.26 -4.94 135.00 133.05 2jxw s PRO 2 Ca 0.00 2.04 -0.05 0.00 0.04 0.00 0.00 61.00 63.02 2jxw s PRO 2 Cb 0.00 -3.39 -0.06 0.00 0.04 0.00 0.00 34.50 31.09 2jxw s PRO 2 CO 0.00 -0.49 1.34 0.77 0.04 0.00 0.00 177.00 178.66 2jxw h SER 3 N 7.25 0.61 -1.89 6.66 0.02 -2.08 -3.45 113.55 120.66 2jxw h SER 3 Ca -0.41 -0.44 -0.53 0.00 -0.84 0.00 0.00 61.79 59.57 2jxw h SER 3 Cb 1.20 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 63.49 2jxw h SER 3 CO 0.88 1.22 -0.51 -0.54 -1.14 0.00 0.00 176.83 176.74 2jxw s LYS 4 N -3.47 2.51 -0.12 3.45 3.01 -1.26 -5.07 119.74 118.79 2jxw s LYS 4 Ca -0.07 -1.44 -0.06 0.00 -1.01 0.00 0.00 55.97 53.39 2jxw s LYS 4 Cb 0.09 -2.29 0.05 0.00 -1.01 0.00 0.00 37.83 34.67 2jxw s LYS 4 CO 0.87 0.12 0.28 0.20 0.51 0.00 0.00 175.35 177.33 2jxw s GLY 5 N -3.89 -0.19 -1.02 -3.33 0.00 -1.26 -5.09 107.32 92.53 2jxw s GLY 5 Ca 0.38 1.11 -0.15 0.00 0.00 0.00 0.00 44.72 46.07 2jxw s GLY 5 CO 0.24 1.33 1.16 0.50 0.00 0.00 0.00 173.10 176.33 2jxw s ARG 6 N 1.24 3.83 -0.14 2.90 1.81 -1.26 -4.64 118.95 122.69 2jxw s ARG 6 Ca -0.09 -2.31 -0.03 0.00 -1.72 0.00 0.00 55.73 51.57 2jxw s ARG 6 Cb -0.10 -4.84 -0.03 0.00 -0.45 0.00 0.00 34.95 29.54 2jxw s ARG 6 CO -0.09 -1.63 -0.02 -1.58 -0.68 0.00 0.00 175.30 171.30 2jxw s TRP 7 N 1.45 3.06 -0.17 -0.53 0.52 -1.26 -3.55 118.94 118.46 2jxw s TRP 7 Ca 0.33 -0.16 -0.07 0.00 0.02 0.00 0.00 56.10 56.22 2jxw s TRP 7 Cb -0.06 -1.93 -0.04 0.00 -1.15 0.00 0.00 33.47 30.30 2jxw s TRP 7 CO -0.06 0.08 0.07 0.08 0.02 0.00 0.00 176.95 177.14 2jxw s VAL 8 N 0.10 4.85 -0.11 4.03 1.01 -0.58 -4.86 120.40 124.84 2jxw s VAL 8 Ca 0.00 -0.02 -0.19 0.00 0.00 0.00 0.00 61.98 61.77 2jxw s VAL 8 Cb -0.13 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 2jxw s VAL 8 CO 0.02 0.49 0.53 -0.70 0.00 0.00 0.00 175.10 175.45 2jxw s GLU 9 N 0.08 4.35 0.04 2.72 -6.30 -1.26 -2.34 118.70 115.99 2jxw s GLU 9 Ca 0.06 0.54 0.02 0.00 -2.50 0.00 0.00 54.97 53.09 2jxw s GLU 9 Cb -0.12 -3.45 -0.02 0.00 0.00 0.00 0.00 34.13 30.54 2jxw s GLU 9 CO 0.01 0.12 -0.08 0.20 0.02 0.00 0.00 175.26 175.52 2jxw s GLY 10 N 0.69 0.51 -0.20 -1.50 0.00 0.05 -4.98 107.32 101.89 2jxw s GLY 10 Ca 0.28 -0.72 -0.15 0.00 0.00 0.00 0.00 44.72 44.14 2jxw s GLY 10 CO 0.12 -0.76 0.35 -0.42 0.00 0.00 0.00 173.10 172.39 2jxw s ILE 11 N -1.21 5.24 0.04 0.90 -1.09 -1.26 -0.69 121.20 123.13 2jxw s ILE 11 Ca -0.08 0.61 0.04 0.00 -2.23 0.00 0.00 60.65 58.99 2jxw s ILE 11 Cb -0.09 -3.68 -0.02 0.00 -1.58 0.00 0.00 42.46 37.08 2jxw s ILE 11 CO 0.00 0.28 -0.11 0.42 -1.23 0.00 0.00 174.94 174.31 2jxw s THR 12 N 1.17 0.81 0.00 2.92 -4.23 -0.72 -4.94 115.64 110.65 2jxw s THR 12 Ca 0.17 -1.04 0.00 0.00 -1.18 0.00 0.00 61.69 59.64 2jxw s THR 12 Cb -0.14 -0.80 0.00 0.00 1.34 0.00 0.00 72.50 72.90 2jxw s THR 12 CO 0.07 -0.20 0.00 -0.24 -0.54 0.00 0.00 174.62 173.71 2jxw n SER 13 N 1.66 -0.15 0.18 3.99 2.88 -1.26 0.49 113.62 121.42 2jxw n SER 13 Ca -0.20 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.51 2jxw n SER 13 Cb 0.55 0.00 0.80 0.00 -0.75 0.00 0.00 64.21 64.81 2jxw n SER 13 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2jxw h GLU 14 N 0.00 0.00 0.00 -1.46 5.08 -2.06 -3.41 114.58 112.74 2jxw h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jxw h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2jxw h GLU 14 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 2jxw n GLY 15 N -1.44 0.00 3.53 -3.84 0.00 -1.05 -5.13 105.19 97.26 2jxw n GLY 15 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2jxw n GLY 15 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jxw s TYR 16 N 0.00 3.13 -0.22 1.61 1.51 0.18 -4.85 117.35 118.70 2jxw s TYR 16 Ca 0.00 -0.01 -0.29 0.00 -1.01 0.00 0.00 57.07 55.76 2jxw s TYR 16 Cb 0.00 -3.11 -0.01 0.00 -0.11 0.00 0.00 41.96 38.72 2jxw s TYR 16 CO 0.00 -0.72 1.40 -1.01 -1.11 0.00 0.00 175.55 174.12 2jxw s HIS 17 N 2.55 2.52 0.13 2.71 3.76 -1.26 -1.75 115.29 123.94 2jxw s HIS 17 Ca 0.20 0.76 0.06 0.00 -0.15 0.00 0.00 55.06 55.93 2jxw s HIS 17 Cb -0.15 -3.82 -0.04 0.00 1.11 0.00 0.00 32.58 29.68 2jxw s HIS 17 CO 0.16 -2.20 -0.03 1.52 -0.85 0.00 0.00 174.74 173.33 2jxw s TYR 18 N 4.34 2.86 0.10 1.40 1.13 0.14 -4.74 117.35 122.56 2jxw s TYR 18 Ca 0.61 -0.11 0.09 0.00 -1.41 0.00 0.00 57.07 56.25 2jxw s TYR 18 Cb -0.21 -1.44 -0.03 0.00 -1.10 0.00 0.00 41.96 39.17 2jxw s TYR 18 CO 0.23 0.48 -0.22 0.71 -2.51 0.00 0.00 175.55 174.24 2jxw s TYR 19 N -1.44 1.90 -0.01 -3.49 2.02 -0.53 -0.77 117.35 115.04 2jxw s TYR 19 Ca 0.25 -0.41 0.02 0.00 -0.37 0.00 0.00 57.07 56.57 2jxw s TYR 19 Cb -0.11 -1.05 -0.00 0.00 -0.40 0.00 0.00 41.96 40.40 2jxw s TYR 19 CO 0.17 0.21 -0.08 -0.47 -1.57 0.00 0.00 175.55 173.82 2jxw s TYR 20 N -1.09 0.71 -0.18 2.71 6.14 -0.99 0.10 117.35 124.76 2jxw s TYR 20 Ca 0.08 -0.14 -0.04 0.00 0.64 0.00 0.00 57.07 57.62 2jxw s TYR 20 Cb -0.10 -0.46 -0.02 0.00 0.42 0.00 0.00 41.96 41.80 2jxw s TYR 20 CO 0.04 -0.02 -0.04 0.34 0.64 0.00 0.00 175.55 176.51 2jxw s ASP 21 N -0.13 4.60 0.06 4.32 2.15 -0.46 -1.52 116.67 125.69 2jxw s ASP 21 Ca 0.02 -0.23 0.06 0.00 0.43 0.00 0.00 52.55 52.83 2jxw s ASP 21 Cb -0.04 -1.76 -0.23 0.00 -0.30 0.00 0.00 42.92 40.59 2jxw s ASP 21 CO -0.00 0.10 1.04 0.17 -0.17 0.00 0.00 175.17 176.31 2jxw h LEU 22 N 7.22 0.08 -0.55 -1.34 -0.00 -1.88 0.19 115.31 119.05 2jxw h LEU 22 Ca -0.34 -0.11 0.06 0.00 -0.00 0.00 0.00 57.88 57.49 2jxw h LEU 22 Cb 1.18 -0.03 -0.05 0.00 -0.00 0.00 0.00 40.66 41.77 2jxw h LEU 22 CO 0.61 1.09 0.27 0.40 -0.00 0.00 0.00 178.44 180.80 2jxw h ILE 23 N 0.01 0.92 0.00 0.15 2.04 -1.95 -3.24 117.51 115.46 2jxw h ILE 23 Ca -0.13 -0.17 -0.37 0.00 1.00 0.00 0.00 64.86 65.18 2jxw h ILE 23 Cb 1.89 0.37 -0.07 0.00 -0.74 0.00 0.00 36.82 38.27 2jxw h ILE 23 CO 0.13 0.09 -2.41 -0.24 0.00 0.00 0.00 178.15 175.72 2jxw n SER 24 N -4.89 1.09 -0.35 1.72 2.88 -1.26 -5.04 113.62 107.78 2jxw n SER 24 Ca 0.06 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 2jxw n SER 24 Cb 0.16 0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2jxw n SER 24 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jxw n GLY 25 N 2.04 0.90 3.24 0.46 0.00 0.65 -5.09 105.19 107.39 2jxw n GLY 25 Ca -0.39 -0.39 -0.19 0.00 0.00 0.00 0.00 46.02 45.05 2jxw n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jxw s ALA 26 N -2.54 1.51 0.14 4.61 0.00 -1.04 -4.97 121.76 119.47 2jxw s ALA 26 Ca 0.00 -1.26 -0.05 0.00 0.00 0.00 0.00 51.96 50.65 2jxw s ALA 26 Cb 0.00 -0.10 -0.06 0.00 0.00 0.00 0.00 23.12 22.96 2jxw s ALA 26 CO 0.00 0.14 0.38 -1.54 0.00 0.00 0.00 175.76 174.74 2jxw s SER 27 N -2.32 6.50 0.21 0.00 1.04 -1.26 -1.35 113.70 116.52 2jxw s SER 27 Ca 0.08 0.60 0.01 0.00 0.48 0.00 0.00 55.95 57.12 2jxw s SER 27 Cb -0.06 -2.10 -0.05 0.00 0.10 0.00 0.00 66.02 63.91 2jxw s SER 27 CO 0.03 0.06 0.05 -1.58 0.98 0.00 0.00 173.24 172.78 2jxw s GLN 28 N -2.62 1.25 0.00 4.02 0.74 0.29 -4.98 119.66 118.36 2jxw s GLN 28 Ca 0.41 -1.64 0.00 0.00 0.05 0.00 0.00 55.36 54.17 2jxw s GLN 28 Cb -0.12 -0.24 0.00 0.00 1.10 0.00 0.00 33.01 33.74 2jxw s GLN 28 CO 0.24 -0.22 0.63 0.91 -0.55 0.00 0.00 175.29 176.31 2jxw n TRP 29 N -0.34 0.00 -4.11 1.67 7.02 -1.26 -1.45 117.44 118.97 2jxw n TRP 29 Ca -0.03 -0.20 -0.16 0.00 -1.02 0.00 0.00 57.50 56.09 2jxw n TRP 29 Cb 0.65 -0.02 -0.15 0.00 -2.42 0.00 0.00 31.31 29.37 2jxw n TRP 29 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2jxw s GLU 30 N -0.40 0.40 -0.37 -0.99 2.02 -1.26 -4.90 118.70 113.20 2jxw s GLU 30 Ca 0.00 -0.13 -0.28 0.00 0.02 0.00 0.00 54.97 54.57 2jxw s GLU 30 Cb 0.00 -0.41 0.02 0.00 0.10 0.00 0.00 34.13 33.84 2jxw s GLU 30 CO 0.00 0.06 1.05 0.21 0.02 0.00 0.00 175.26 176.60 2jxw s LYS 31 N 0.09 3.92 1.39 1.61 2.20 -1.26 -4.91 119.74 122.78 2jxw s LYS 31 Ca -0.01 0.82 -0.23 0.00 -0.36 0.00 0.00 55.97 56.19 2jxw s LYS 31 Cb -0.04 -3.80 0.36 0.00 -1.51 0.00 0.00 37.83 32.84 2jxw s LYS 31 CO -0.00 -1.03 0.98 -2.30 -0.36 0.00 0.00 175.35 172.63 2jxw n PRO 32 N 7.08 -4.21 -2.24 4.03 -0.02 -1.26 -4.89 135.00 133.48 2jxw n PRO 32 Ca 0.11 -1.60 -0.42 0.00 -2.02 0.00 0.00 63.50 59.56 2jxw n PRO 32 Cb 0.48 -1.82 -0.03 0.00 -0.02 0.00 0.00 33.50 32.12 2jxw n PRO 32 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 2jxw s GLU 33 N -5.28 3.29 0.00 -0.52 -1.05 -1.26 -3.64 118.70 110.24 2jxw s GLU 33 Ca 0.70 0.83 0.00 0.00 -0.15 0.00 0.00 54.97 56.35 2jxw s GLU 33 Cb -0.10 -4.15 0.00 0.00 -0.44 0.00 0.00 34.13 29.44 2jxw s GLU 33 CO 0.56 -1.93 0.00 0.41 0.95 0.00 0.00 175.26 175.26 2jxw n GLY 34 N 5.31 2.92 5.18 -3.83 0.00 -1.26 -4.97 105.19 108.53 2jxw n GLY 34 Ca 0.17 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2jxw n GLY 34 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2jxw n PHE 35 N 0.00 0.00 -0.04 1.61 7.35 -1.24 -2.59 117.46 122.56 2jxw n PHE 35 Ca 0.00 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.56 2jxw n PHE 35 Cb 0.00 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 39.69 2jxw n PHE 35 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 2jxw n GLN 36 N 0.00 0.67 0.00 -4.13 6.02 -1.26 -4.18 117.38 114.51 2jxw n GLN 36 Ca 0.00 0.22 0.00 0.00 -0.01 0.00 0.00 57.00 57.21 2jxw n GLN 36 Cb 0.00 -1.70 0.00 0.00 1.02 0.00 0.00 30.24 29.56 2jxw n GLN 36 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jxw n GLY 37 N 1.76 1.00 2.55 1.08 0.00 -1.07 -4.63 105.19 105.88 2jxw n GLY 37 Ca -0.26 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.43 2jxw n GLY 37 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jxw n ASP 38 N 0.00 7.18 -3.51 1.61 2.03 -1.26 -4.82 116.55 117.78 2jxw n ASP 38 Ca 0.00 -3.30 -0.20 0.00 0.52 0.00 0.00 54.79 51.81 2jxw n ASP 38 Cb 0.00 -1.25 -0.14 0.00 -0.72 0.00 0.00 41.12 39.01 2jxw n ASP 38 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2jxw s LEU 39 N -2.57 0.02 -0.24 -2.67 1.43 -1.26 -5.02 118.68 108.37 2jxw s LEU 39 Ca 0.55 -0.41 -0.04 0.00 -1.03 0.00 0.00 54.13 53.20 2jxw s LEU 39 Cb 0.31 0.21 0.02 0.00 0.03 0.00 0.00 46.19 46.76 2jxw s LEU 39 CO -0.20 -0.34 0.08 1.17 0.23 0.00 0.00 176.35 177.29 2jxw n LYS 40 N 5.31 -3.55 -3.58 1.70 4.81 -1.26 -4.85 118.16 116.73 2jxw n LYS 40 Ca -0.06 2.81 -0.40 0.00 -0.87 0.00 0.00 58.31 59.79 2jxw n LYS 40 Cb 0.49 -4.89 -0.08 0.00 0.02 0.00 0.00 35.03 30.57 2jxw n LYS 40 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2jxw s LYS 41 N -1.21 2.73 0.69 1.64 1.02 -1.26 -5.02 119.74 118.33 2jxw s LYS 41 Ca -0.09 -2.23 -0.08 0.00 0.02 0.00 0.00 55.97 53.59 2jxw s LYS 41 Cb 0.01 -3.94 0.05 0.00 -0.52 0.00 0.00 37.83 33.42 2jxw s LYS 41 CO 0.72 -1.20 1.02 0.95 -0.92 0.00 0.00 175.35 175.92 2jxw s THR 42 N 0.52 2.72 0.28 2.17 -4.23 -1.26 -5.11 115.64 110.73 2jxw s THR 42 Ca 0.13 -0.07 -0.10 0.00 -1.18 0.00 0.00 61.69 60.47 2jxw s THR 42 Cb -0.20 -3.17 0.00 0.00 1.34 0.00 0.00 72.50 70.47 2jxw s THR 42 CO -0.04 -0.19 0.50 0.00 -0.54 0.00 0.00 174.62 174.35 2jxw s ALA 43 N -3.25 0.00 -0.50 3.99 0.00 -1.26 -5.05 121.76 115.69 2jxw s ALA 43 Ca 0.59 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 51.48 2jxw s ALA 43 Cb -0.11 1.06 0.27 0.00 0.00 0.00 0.00 23.12 24.34 2jxw s ALA 43 CO 0.46 -0.84 2.17 1.55 0.00 0.00 0.00 175.76 179.10 2jxw n VAL 44 N -0.44 3.22 -1.88 0.00 3.14 -1.26 -4.23 118.33 116.89 2jxw n VAL 44 Ca -0.01 -2.57 0.05 0.00 -2.96 0.00 0.00 64.34 58.85 2jxw n VAL 44 Cb 0.62 -1.33 0.12 0.00 -1.06 0.00 0.00 33.84 32.19 2jxw n VAL 44 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2jxw n LYS 45 N -0.01 0.90 -3.64 1.45 4.81 -1.26 -5.03 118.16 115.38 2jxw n LYS 45 Ca 0.46 -2.61 -0.06 0.00 -0.87 0.00 0.00 58.31 55.22 2jxw n LYS 45 Cb 0.56 -0.97 -0.07 0.00 0.02 0.00 0.00 35.03 34.57 2jxw n LYS 45 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2jxw s THR 46 N -1.86 0.00 -0.55 3.15 -4.23 -1.26 -5.04 115.64 105.84 2jxw s THR 46 Ca 0.33 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.84 2jxw s THR 46 Cb 0.34 -1.00 0.44 0.00 1.34 0.00 0.00 72.50 73.62 2jxw s THR 46 CO -0.09 0.00 1.99 0.52 -0.54 0.00 0.00 174.62 176.50 2jxw n VAL 47 N 4.21 3.35 -4.08 2.29 0.31 -1.26 -4.91 118.33 118.24 2jxw n VAL 47 Ca -0.20 -2.45 -0.15 0.00 -0.01 0.00 0.00 64.34 61.54 2jxw n VAL 47 Cb 0.59 -1.05 -0.14 0.00 -0.91 0.00 0.00 33.84 32.32 2jxw n VAL 47 CO 0.00 0.00 0.00 0.26 -1.32 0.00 0.00 176.83 175.77 2jxw s TRP 48 N -3.30 0.37 0.00 3.52 0.52 -1.26 -3.66 118.94 115.14 2jxw s TRP 48 Ca 0.56 -0.11 -0.00 0.00 0.02 0.00 0.00 56.10 56.58 2jxw s TRP 48 Cb 0.45 -0.24 -0.04 0.00 -1.15 0.00 0.00 33.47 32.49 2jxw s TRP 48 CO 0.01 -0.02 0.08 0.54 0.02 0.00 0.00 176.95 177.59 2jxw s VAL 49 N -0.21 4.71 -0.25 4.03 0.11 -0.82 -4.91 120.40 123.07 2jxw s VAL 49 Ca 0.00 -0.44 -0.14 0.00 -2.93 0.00 0.00 61.98 58.48 2jxw s VAL 49 Cb -0.02 -3.17 -0.04 0.00 -1.53 0.00 0.00 36.38 31.62 2jxw s VAL 49 CO -0.00 0.33 0.30 -0.70 -3.33 0.00 0.00 175.10 171.70 2jxw s GLU 50 N -1.80 4.06 0.25 1.54 2.12 -1.26 -2.48 118.70 121.12 2jxw s GLU 50 Ca 0.24 -0.04 0.11 0.00 0.36 0.00 0.00 54.97 55.64 2jxw s GLU 50 Cb -0.12 -3.60 -0.05 0.00 0.26 0.00 0.00 34.13 30.62 2jxw s GLU 50 CO 0.15 -0.12 -0.17 0.20 -0.54 0.00 0.00 175.26 174.77 2jxw s GLY 51 N 1.36 1.81 -0.06 -1.50 0.00 0.83 -4.99 107.32 104.78 2jxw s GLY 51 Ca 0.13 -1.77 -0.01 0.00 0.00 0.00 0.00 44.72 43.07 2jxw s GLY 51 CO 0.08 -1.83 0.02 -2.27 0.00 0.00 0.00 173.10 169.09 2jxw s LEU 52 N -3.30 3.63 0.07 0.66 2.96 -1.26 -1.51 118.68 119.93 2jxw s LEU 52 Ca 0.28 0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.34 2jxw s LEU 52 Cb -0.06 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.67 2jxw s LEU 52 CO 0.15 0.35 -0.10 -0.55 -1.32 0.00 0.00 176.35 174.87 2jxw s SER 53 N -1.14 1.29 0.70 3.68 0.15 -0.81 -4.93 113.70 112.63 2jxw s SER 53 Ca 0.16 -0.68 -0.17 0.00 0.70 0.00 0.00 55.95 55.97 2jxw s SER 53 Cb -0.11 0.01 -0.08 0.00 -1.71 0.00 0.00 66.02 64.12 2jxw s SER 53 CO 0.05 -0.20 0.18 1.21 1.20 0.00 0.00 173.24 175.69 2jxw n GLU 54 N 1.05 0.19 -1.06 5.44 0.00 -1.26 -1.76 120.64 123.24 2jxw n GLU 54 Ca -0.20 0.09 -0.02 0.00 0.00 0.00 0.00 57.16 57.03 2jxw n GLU 54 Cb 0.56 -1.50 -0.01 0.00 0.00 0.00 0.00 31.44 30.49 2jxw n GLU 54 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2jxw n ASP 55 N 0.95 -4.97 -2.17 4.31 9.92 -1.26 -3.65 116.55 119.68 2jxw n ASP 55 Ca 0.08 0.05 -0.03 0.00 -0.53 0.00 0.00 54.79 54.36 2jxw n ASP 55 Cb 0.50 -2.64 0.01 0.00 -0.64 0.00 0.00 41.12 38.35 2jxw n ASP 55 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jxw n GLY 56 N -0.45 -0.37 2.85 0.44 0.00 -0.81 -5.05 105.19 101.79 2jxw n GLY 56 Ca -0.02 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 2jxw n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jxw s PHE 57 N -3.07 2.22 -0.18 1.61 0.08 -0.72 -4.98 117.98 112.95 2jxw s PHE 57 Ca 0.08 -1.89 -0.29 0.00 0.12 0.00 0.00 56.93 54.94 2jxw s PHE 57 Cb -0.01 -1.84 -0.01 0.00 -0.57 0.00 0.00 43.02 40.59 2jxw s PHE 57 CO 0.31 -0.83 1.22 0.99 -0.10 0.00 0.00 175.22 176.80 2jxw s THR 58 N 1.44 4.36 0.04 0.64 2.01 -1.26 -1.93 115.64 120.94 2jxw s THR 58 Ca 0.04 1.64 0.05 0.00 0.31 0.00 0.00 61.69 63.74 2jxw s THR 58 Cb -0.18 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 2jxw s THR 58 CO -0.15 -0.14 -0.11 -0.72 -0.69 0.00 0.00 174.62 172.81 2jxw s TYR 59 N 3.43 2.76 0.01 4.92 1.13 -0.57 -4.83 117.35 124.20 2jxw s TYR 59 Ca 0.53 -0.13 0.08 0.00 -1.41 0.00 0.00 57.07 56.14 2jxw s TYR 59 Cb -0.20 -1.52 -0.02 0.00 -1.10 0.00 0.00 41.96 39.11 2jxw s TYR 59 CO 0.13 0.35 -0.26 0.71 -2.51 0.00 0.00 175.55 173.97 2jxw s TYR 60 N -1.03 2.29 0.13 -3.49 2.02 -0.40 -0.12 117.35 116.75 2jxw s TYR 60 Ca 0.18 -0.42 0.09 0.00 -0.37 0.00 0.00 57.07 56.54 2jxw s TYR 60 Cb -0.11 -1.43 -0.04 0.00 -0.40 0.00 0.00 41.96 39.98 2jxw s TYR 60 CO 0.09 0.03 -0.20 -0.47 -1.57 0.00 0.00 175.55 173.42 2jxw s TYR 61 N -0.69 1.85 -0.08 2.71 5.04 -1.04 0.11 117.35 125.26 2jxw s TYR 61 Ca 0.11 -0.43 0.02 0.00 -2.44 0.00 0.00 57.07 54.32 2jxw s TYR 61 Cb -0.10 -0.97 -0.02 0.00 0.35 0.00 0.00 41.96 41.22 2jxw s TYR 61 CO 0.00 0.28 -0.13 1.21 -1.34 0.00 0.00 175.55 175.57 2jxw s ASN 62 N -2.27 4.09 -0.00 4.32 3.84 -1.05 -1.95 114.94 121.92 2jxw s ASN 62 Ca 0.11 -0.22 0.09 0.00 0.21 0.00 0.00 52.86 53.05 2jxw s ASN 62 Cb -0.08 -1.15 -0.23 0.00 -0.55 0.00 0.00 41.25 39.23 2jxw s ASN 62 CO 0.06 0.28 0.82 0.71 -2.79 0.00 0.00 177.10 176.17 2jxw h THR 63 N 4.71 1.07 0.70 -5.21 1.35 -1.92 -2.21 112.91 111.40 2jxw h THR 63 Ca -0.39 -2.87 -0.03 0.00 -0.55 0.00 0.00 66.41 62.56 2jxw h THR 63 Cb 1.18 2.55 0.01 0.00 -1.73 0.00 0.00 68.15 70.15 2jxw h THR 63 CO 0.53 0.65 -0.34 -0.33 -0.25 0.00 0.00 175.52 175.78 2jxw h GLU 64 N 0.01 -0.90 0.11 4.72 5.08 -1.96 -3.35 114.58 118.29 2jxw h GLU 64 Ca -0.22 0.06 -0.23 0.00 -1.00 0.00 0.00 59.36 57.97 2jxw h GLU 64 Cb 1.96 0.21 0.00 0.00 0.50 0.00 0.00 28.75 31.41 2jxw h GLU 64 CO 0.10 -0.60 -1.15 1.79 -1.00 0.00 0.00 179.01 178.14 2jxw h THR 65 N -0.96 1.21 -0.46 1.13 1.35 -1.97 -3.49 112.91 109.72 2jxw h THR 65 Ca -0.10 -2.43 0.00 0.00 -0.55 0.00 0.00 66.41 63.33 2jxw h THR 65 Cb 0.72 2.87 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 2jxw h THR 65 CO 0.16 0.68 0.00 0.61 -0.25 0.00 0.00 175.52 176.72 2jxw n GLY 66 N 1.70 0.55 3.00 5.82 0.00 -0.83 -5.10 105.19 110.33 2jxw n GLY 66 Ca -0.21 -0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 2jxw n GLY 66 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jxw s GLU 67 N -0.36 0.61 0.40 1.61 2.12 -1.23 -4.95 118.70 116.90 2jxw s GLU 67 Ca 0.00 -0.31 -0.21 0.00 0.36 0.00 0.00 54.97 54.81 2jxw s GLU 67 Cb 0.00 -0.58 -0.11 0.00 0.26 0.00 0.00 34.13 33.70 2jxw s GLU 67 CO 0.00 0.16 0.92 -1.54 -0.54 0.00 0.00 175.26 174.26 2jxw s SER 68 N -0.28 6.99 0.09 -1.70 1.04 -1.26 -2.53 113.70 116.04 2jxw s SER 68 Ca 0.02 1.67 0.03 0.00 0.48 0.00 0.00 55.95 58.15 2jxw s SER 68 Cb -0.03 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.52 2jxw s SER 68 CO -0.00 -0.29 -0.09 -0.60 0.98 0.00 0.00 173.24 173.24 2jxw s ARG 69 N -2.96 0.80 -0.12 4.02 6.06 0.30 -4.98 118.95 122.08 2jxw s ARG 69 Ca 0.59 -1.14 0.14 0.00 -2.50 0.00 0.00 55.73 52.82 2jxw s ARG 69 Cb -0.11 -0.43 0.31 0.00 0.06 0.00 0.00 34.95 34.79 2jxw s ARG 69 CO 0.15 0.06 1.15 0.91 -2.50 0.00 0.00 175.30 175.07 2jxw n TRP 70 N 0.54 0.00 -3.75 5.12 7.02 -1.26 -1.27 117.44 123.84 2jxw n TRP 70 Ca -0.16 -0.93 -0.13 0.00 -1.02 0.00 0.00 57.50 55.26 2jxw n TRP 70 Cb 0.58 -0.17 -0.13 0.00 -2.42 0.00 0.00 31.31 29.17 2jxw n TRP 70 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2jxw s GLU 71 N -2.07 0.22 -0.17 -0.99 8.01 -1.26 -5.00 118.70 117.44 2jxw s GLU 71 Ca 0.29 0.45 -0.28 0.00 0.01 0.00 0.00 54.97 55.44 2jxw s GLU 71 Cb 0.29 -0.04 -0.06 0.00 -4.31 0.00 0.00 34.13 30.01 2jxw s GLU 71 CO -0.04 -0.12 2.18 1.63 0.01 0.00 0.00 175.26 178.92 2jxw n LYS 72 N 3.79 2.12 -1.54 1.61 5.02 -1.26 -4.85 118.16 123.04 2jxw n LYS 72 Ca -0.21 0.62 -0.38 0.00 -2.02 0.00 0.00 58.31 56.32 2jxw n LYS 72 Cb 0.55 -3.20 -0.05 0.00 -0.02 0.00 0.00 35.03 32.32 2jxw n LYS 72 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2jxw n PRO 73 N 8.54 1.03 -3.19 1.97 -0.02 -1.26 -4.93 135.00 137.14 2jxw n PRO 73 Ca 0.28 0.08 -0.39 0.00 -2.02 0.00 0.00 63.50 61.45 2jxw n PRO 73 Cb 0.44 -3.13 -0.06 0.00 -0.02 0.00 0.00 33.50 30.73 2jxw n PRO 73 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 2jxw s ASP 74 N 11.08 6.72 0.00 2.55 -4.77 -1.26 -5.22 116.67 125.77 2jxw s ASP 74 Ca 1.04 0.86 0.00 0.00 -3.30 0.00 0.00 52.55 51.15 2jxw s ASP 74 Cb -0.37 -2.33 0.00 0.00 -1.09 0.00 0.00 42.92 39.13 2jxw s ASP 74 CO 0.31 -0.14 0.00 -0.67 0.70 0.00 0.00 175.17 175.37