#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxw n PRO 2 N 0.00 1.89 -3.36 -0.24 -0.02 -1.26 -4.90 135.00 127.11 2jxw n PRO 2 Ca 0.00 0.69 -0.21 0.00 -2.02 0.00 0.00 63.50 61.95 2jxw n PRO 2 Cb 0.00 -2.45 0.02 0.00 -0.02 0.00 0.00 33.50 31.05 2jxw n PRO 2 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2jxw s SER 3 N 2.16 5.04 -0.42 2.55 0.15 -1.26 -5.10 113.70 116.81 2jxw s SER 3 Ca 0.86 -0.88 0.06 0.00 0.70 0.00 0.00 55.95 56.69 2jxw s SER 3 Cb -0.77 0.04 0.20 0.00 -1.71 0.00 0.00 66.02 63.78 2jxw s SER 3 CO 0.47 -1.07 0.49 0.29 1.20 0.00 0.00 173.24 174.61 2jxw n LYS 4 N -1.94 0.44 0.00 5.44 5.02 -1.26 -5.02 118.16 120.84 2jxw n LYS 4 Ca 0.08 -2.92 0.00 0.00 -2.02 0.00 0.00 58.31 53.44 2jxw n LYS 4 Cb 0.62 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 2jxw n LYS 4 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jxw n GLY 5 N 2.31 -1.61 3.56 0.72 0.00 -1.26 -5.02 105.19 103.89 2jxw n GLY 5 Ca 0.24 0.64 -0.27 0.00 0.00 0.00 0.00 46.02 46.63 2jxw n GLY 5 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jxw s ARG 6 N 0.00 2.39 0.07 1.61 3.00 -1.26 -4.93 118.95 119.83 2jxw s ARG 6 Ca 0.00 0.07 0.06 0.00 0.00 0.00 0.00 55.73 55.86 2jxw s ARG 6 Cb 0.00 -4.88 -0.03 0.00 0.00 0.00 0.00 34.95 30.04 2jxw s ARG 6 CO 0.00 -3.44 -0.17 -1.58 0.00 0.00 0.00 175.30 170.11 2jxw s TRP 7 N 10.78 1.48 -0.11 -0.53 0.52 -1.26 -3.65 118.94 126.16 2jxw s TRP 7 Ca 0.74 -0.41 0.03 0.00 0.02 0.00 0.00 56.10 56.48 2jxw s TRP 7 Cb -0.09 -0.84 0.00 0.00 -1.15 0.00 0.00 33.47 31.39 2jxw s TRP 7 CO 0.06 0.10 -0.22 0.08 0.02 0.00 0.00 176.95 176.99 2jxw s VAL 8 N -1.08 2.18 -0.08 4.03 1.01 -0.75 -4.91 120.40 120.79 2jxw s VAL 8 Ca 0.03 -0.97 -0.19 0.00 0.00 0.00 0.00 61.98 60.85 2jxw s VAL 8 Cb -0.09 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 2jxw s VAL 8 CO 0.03 0.55 0.52 -0.70 0.00 0.00 0.00 175.10 175.50 2jxw s GLU 9 N 0.43 4.31 0.03 2.72 -6.30 -1.26 -2.32 118.70 116.31 2jxw s GLU 9 Ca -0.16 0.55 0.02 0.00 -2.50 0.00 0.00 54.97 52.89 2jxw s GLU 9 Cb -0.17 -3.40 -0.02 0.00 0.00 0.00 0.00 34.13 30.54 2jxw s GLU 9 CO 0.07 0.24 -0.08 0.20 0.02 0.00 0.00 175.26 175.71 2jxw s GLY 10 N 0.31 0.49 -0.25 -1.50 0.00 0.04 -4.98 107.32 101.44 2jxw s GLY 10 Ca 0.28 -0.65 -0.10 0.00 0.00 0.00 0.00 44.72 44.24 2jxw s GLY 10 CO 0.13 -0.68 0.16 -0.42 0.00 0.00 0.00 173.10 172.29 2jxw s ILE 11 N -1.02 5.29 0.10 0.90 -1.09 -1.26 -0.80 121.20 123.32 2jxw s ILE 11 Ca -0.06 0.16 0.04 0.00 -2.23 0.00 0.00 60.65 58.56 2jxw s ILE 11 Cb -0.08 -3.47 -0.04 0.00 -1.58 0.00 0.00 42.46 37.29 2jxw s ILE 11 CO 0.00 0.33 -0.10 0.42 -1.23 0.00 0.00 174.94 174.36 2jxw s THR 12 N 1.21 0.95 0.00 2.92 -4.23 -0.89 -4.94 115.64 110.66 2jxw s THR 12 Ca 0.07 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 2jxw s THR 12 Cb -0.14 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.26 2jxw s THR 12 CO 0.06 -0.60 0.00 -0.24 -0.54 0.00 0.00 174.62 173.30 2jxw n SER 13 N 0.43 0.00 0.31 3.99 2.88 -1.26 0.84 113.62 120.81 2jxw n SER 13 Ca -0.15 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.58 2jxw n SER 13 Cb 0.58 0.00 0.98 0.00 -0.75 0.00 0.00 64.21 65.02 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 3.07 -2.06 -3.41 114.58 110.72 2jxw h GLU 14 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2jxw h GLU 14 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2jxw h GLU 14 CO 0.00 0.02 0.00 0.41 -1.40 0.00 0.00 179.01 178.04 2jxw n GLY 15 N -0.75 0.00 3.46 -3.84 0.00 -0.87 -5.12 105.19 98.07 2jxw n GLY 15 Ca -0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 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 3.00 -0.22 1.61 1.51 0.25 -4.86 117.35 118.63 2jxw s TYR 16 Ca 0.00 -0.45 -0.29 0.00 -1.01 0.00 0.00 57.07 55.32 2jxw s TYR 16 Cb 0.00 -3.64 -0.01 0.00 -0.11 0.00 0.00 41.96 38.20 2jxw s TYR 16 CO 0.00 -1.09 1.40 -1.01 -1.11 0.00 0.00 175.55 173.74 2jxw s HIS 17 N 2.86 2.52 0.12 2.71 3.76 -1.26 -2.09 115.29 123.92 2jxw s HIS 17 Ca 0.18 0.77 0.06 0.00 -0.15 0.00 0.00 55.06 55.92 2jxw s HIS 17 Cb -0.18 -3.82 -0.04 0.00 1.11 0.00 0.00 32.58 29.65 2jxw s HIS 17 CO 0.13 -2.20 -0.04 1.52 -0.85 0.00 0.00 174.74 173.30 2jxw s TYR 18 N 4.34 2.85 0.10 1.40 1.13 0.02 -4.82 117.35 122.37 2jxw s TYR 18 Ca 0.61 -0.11 0.08 0.00 -1.41 0.00 0.00 57.07 56.25 2jxw s TYR 18 Cb -0.21 -1.45 -0.03 0.00 -1.10 0.00 0.00 41.96 39.16 2jxw s TYR 18 CO 0.23 0.47 -0.22 0.71 -2.51 0.00 0.00 175.55 174.24 2jxw s TYR 19 N -1.42 1.86 0.01 -3.49 2.02 -0.93 -0.78 117.35 114.63 2jxw s TYR 19 Ca 0.25 -0.41 0.04 0.00 -0.37 0.00 0.00 57.07 56.57 2jxw s TYR 19 Cb -0.11 -1.03 -0.01 0.00 -0.40 0.00 0.00 41.96 40.41 2jxw s TYR 19 CO 0.17 0.21 -0.11 -0.47 -1.57 0.00 0.00 175.55 173.78 2jxw s TYR 20 N -1.11 0.99 -0.20 2.71 6.14 -0.98 0.96 117.35 125.86 2jxw s TYR 20 Ca 0.08 -0.25 -0.04 0.00 0.64 0.00 0.00 57.07 57.50 2jxw s TYR 20 Cb -0.10 -0.62 -0.02 0.00 0.42 0.00 0.00 41.96 41.64 2jxw s TYR 20 CO 0.04 -0.01 -0.02 0.34 0.64 0.00 0.00 175.55 176.55 2jxw s ASP 21 N -0.58 4.68 0.15 4.32 -1.08 0.34 -1.81 116.67 122.68 2jxw s ASP 21 Ca 0.02 -0.24 0.14 0.00 -0.52 0.00 0.00 52.55 51.95 2jxw s ASP 21 Cb -0.05 -1.79 -0.08 0.00 -1.46 0.00 0.00 42.92 39.54 2jxw s ASP 21 CO 0.00 0.06 1.12 0.17 0.52 0.00 0.00 175.17 177.04 2jxw h LEU 22 N 7.52 0.00 -0.38 -1.34 -0.00 -1.87 0.20 115.31 119.44 2jxw h LEU 22 Ca -0.36 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.50 2jxw h LEU 22 Cb 1.18 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.82 2jxw h LEU 22 CO 0.61 0.64 0.18 0.40 -0.00 0.00 0.00 178.44 180.27 2jxw h ILE 23 N 0.00 1.18 0.00 0.15 2.04 -1.94 -3.31 117.51 115.63 2jxw h ILE 23 Ca -0.09 -0.52 -0.38 0.00 1.00 0.00 0.00 64.86 64.87 2jxw h ILE 23 Cb 1.57 0.81 -0.07 0.00 -0.74 0.00 0.00 36.82 38.39 2jxw h ILE 23 CO 0.07 0.19 -2.42 -0.24 0.00 0.00 0.00 178.15 175.75 2jxw n SER 24 N -4.69 1.17 -0.76 1.72 2.88 -1.25 -5.06 113.62 107.63 2jxw n SER 24 Ca -0.00 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 2jxw n SER 24 Cb 0.12 0.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.73 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 0.75 3.39 0.46 0.00 0.68 -5.08 105.19 107.42 2jxw n GLY 25 Ca -0.40 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.51 -1.36 0.10 4.61 0.00 -0.93 -4.98 121.76 116.69 2jxw s ALA 26 Ca 0.00 0.48 0.02 0.00 0.00 0.00 0.00 51.96 52.45 2jxw s ALA 26 Cb 0.00 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 2jxw s ALA 26 CO 0.00 -0.61 0.20 0.45 0.00 0.00 0.00 175.76 175.80 2jxw s SER 27 N -2.34 6.13 0.24 0.00 0.15 -1.26 -0.51 113.70 116.10 2jxw s SER 27 Ca -0.02 0.15 0.02 0.00 0.70 0.00 0.00 55.95 56.80 2jxw s SER 27 Cb -0.00 -1.81 -0.05 0.00 -1.71 0.00 0.00 66.02 62.45 2jxw s SER 27 CO -0.07 0.12 0.06 -1.58 1.20 0.00 0.00 173.24 172.98 2jxw s GLN 28 N -2.77 1.34 0.00 5.44 2.00 0.27 -4.97 119.66 120.97 2jxw s GLN 28 Ca 0.33 -1.70 0.00 0.00 -2.00 0.00 0.00 55.36 51.99 2jxw s GLN 28 Cb -0.12 -0.33 0.00 0.00 0.80 0.00 0.00 33.01 33.36 2jxw s GLN 28 CO 0.27 -0.23 0.69 0.91 -0.50 0.00 0.00 175.29 176.42 2jxw n TRP 29 N -0.41 0.00 -4.58 1.67 7.02 -1.26 -2.18 117.44 117.69 2jxw n TRP 29 Ca -0.02 -0.23 -0.24 0.00 -1.02 0.00 0.00 57.50 55.99 2jxw n TRP 29 Cb 0.65 -0.02 -0.16 0.00 -2.42 0.00 0.00 31.31 29.36 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 -0.47 1.54 -0.02 -0.99 8.01 -1.26 -4.97 118.70 120.55 2jxw s GLU 30 Ca 0.00 -0.41 -0.30 0.00 0.01 0.00 0.00 54.97 54.26 2jxw s GLU 30 Cb 0.00 -1.31 -0.04 0.00 -4.31 0.00 0.00 34.13 28.46 2jxw s GLU 30 CO 0.00 0.08 1.27 0.21 0.01 0.00 0.00 175.26 176.82 2jxw s LYS 31 N 0.48 4.34 0.70 1.61 2.20 -1.26 -4.95 119.74 122.86 2jxw s LYS 31 Ca -0.11 1.79 -0.12 0.00 -0.36 0.00 0.00 55.97 57.18 2jxw s LYS 31 Cb -0.14 -3.52 0.18 0.00 -1.51 0.00 0.00 37.83 32.84 2jxw s LYS 31 CO 0.03 -0.46 0.44 -2.30 -0.36 0.00 0.00 175.35 172.70 2jxw n PRO 32 N 5.03 -3.21 -0.69 4.03 -0.02 -1.26 -4.87 135.00 134.01 2jxw n PRO 32 Ca 0.11 -0.74 -0.12 0.00 -2.02 0.00 0.00 63.50 60.73 2jxw n PRO 32 Cb 0.45 -0.91 0.05 0.00 -0.02 0.00 0.00 33.50 33.07 2jxw n PRO 32 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2jxw n GLU 33 N -3.76 1.60 0.00 -0.52 2.13 -1.26 -4.43 120.64 114.40 2jxw n GLU 33 Ca 0.07 -1.25 0.00 0.00 0.66 0.00 0.00 57.16 56.64 2jxw n GLU 33 Cb 0.29 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.51 2jxw n GLU 33 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jxw n GLY 34 N 0.27 -1.73 0.00 8.31 0.00 -1.26 -5.11 105.19 105.66 2jxw n GLY 34 Ca 0.24 0.70 0.00 0.00 0.00 0.00 0.00 46.02 46.96 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 -2.72 1.61 7.35 -1.26 -4.80 117.46 117.64 2jxw n PHE 35 Ca 0.00 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.68 2jxw n PHE 35 Cb 0.00 -0.22 0.08 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 -1.95 1.43 -2.71 -4.13 6.02 -1.26 -5.02 117.38 109.77 2jxw n GLN 36 Ca 0.00 -2.38 -0.42 0.00 -0.01 0.00 0.00 57.00 54.19 2jxw n GLN 36 Cb 0.00 -0.60 -0.03 0.00 1.02 0.00 0.00 30.24 30.63 2jxw n GLN 36 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2jxw s GLY 37 N -2.50 1.43 -1.16 1.08 0.00 -1.26 -4.94 107.32 99.97 2jxw s GLY 37 Ca 0.19 -2.26 -0.18 0.00 0.00 0.00 0.00 44.72 42.46 2jxw s GLY 37 CO -0.08 2.40 1.52 0.51 0.00 0.00 0.00 173.10 177.45 2jxw s ASP 38 N 4.26 6.78 -0.44 1.64 -4.77 -1.26 -4.72 116.67 118.16 2jxw s ASP 38 Ca 0.38 -2.27 0.07 0.00 -3.30 0.00 0.00 52.55 47.44 2jxw s ASP 38 Cb -0.04 -2.52 0.29 0.00 -1.09 0.00 0.00 42.92 39.57 2jxw s ASP 38 CO -0.04 -1.15 0.90 0.18 0.70 0.00 0.00 175.17 175.75 2jxw n LEU 39 N 7.69 -1.52 -2.73 2.11 4.77 -1.26 -5.05 117.00 121.00 2jxw n LEU 39 Ca 0.39 -4.00 -0.00 0.00 -0.03 0.00 0.00 56.01 52.37 2jxw n LEU 39 Cb 0.47 0.83 0.00 0.00 -2.33 0.00 0.00 43.42 42.39 2jxw n LEU 39 CO 0.68 2.10 -0.48 1.17 -1.33 0.00 0.00 177.39 179.53 2jxw n LYS 40 N 0.84 -3.45 -3.51 3.23 4.81 -1.26 -5.04 118.16 113.78 2jxw n LYS 40 Ca 0.13 2.76 -0.28 0.00 -0.87 0.00 0.00 58.31 60.05 2jxw n LYS 40 Cb 0.65 -5.37 -0.14 0.00 0.02 0.00 0.00 35.03 30.20 2jxw n LYS 40 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2jxw s LYS 41 N -1.67 0.30 -0.29 1.64 2.20 -1.26 -4.98 119.74 115.68 2jxw s LYS 41 Ca 0.01 -0.71 0.11 0.00 -0.36 0.00 0.00 55.97 55.02 2jxw s LYS 41 Cb -0.00 -1.15 0.69 0.00 -1.51 0.00 0.00 37.83 35.85 2jxw s LYS 41 CO 0.78 -1.07 1.69 2.41 -0.36 0.00 0.00 175.35 178.80 2jxw n THR 42 N 4.92 2.76 -3.52 3.43 -1.04 -1.26 -4.97 114.28 114.60 2jxw n THR 42 Ca -0.01 -1.80 -0.38 0.00 -2.04 0.00 0.00 64.05 59.83 2jxw n THR 42 Cb 0.41 -0.33 -0.06 0.00 -1.82 0.00 0.00 70.33 68.53 2jxw n THR 42 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jxw s ALA 43 N -2.98 3.71 0.05 2.41 0.00 -1.26 -5.09 121.76 118.61 2jxw s ALA 43 Ca 0.52 -0.25 -0.07 0.00 0.00 0.00 0.00 51.96 52.16 2jxw s ALA 43 Cb 0.42 -2.36 -0.05 0.00 0.00 0.00 0.00 23.12 21.13 2jxw s ALA 43 CO 0.11 0.48 0.32 0.54 0.00 0.00 0.00 175.76 177.21 2jxw s VAL 44 N -1.05 5.23 -0.50 0.00 0.11 -1.26 -5.01 120.40 117.92 2jxw s VAL 44 Ca 0.23 0.17 0.00 0.00 -2.93 0.00 0.00 61.98 59.45 2jxw s VAL 44 Cb -0.16 -3.60 0.44 0.00 -1.53 0.00 0.00 36.38 31.53 2jxw s VAL 44 CO 0.13 0.27 1.95 1.17 -3.33 0.00 0.00 175.10 175.28 2jxw n LYS 45 N 0.82 2.30 -3.49 1.54 3.00 -1.26 -4.71 118.16 116.36 2jxw n LYS 45 Ca -0.08 -2.69 -0.28 0.00 -0.00 0.00 0.00 58.31 55.25 2jxw n LYS 45 Cb 0.52 -2.06 -0.11 0.00 0.00 0.00 0.00 35.03 33.38 2jxw n LYS 45 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2jxw s THR 46 N -3.64 0.51 0.10 3.15 -4.23 -1.26 -4.96 115.64 105.32 2jxw s THR 46 Ca 0.53 -2.32 0.04 0.00 -1.18 0.00 0.00 61.69 58.75 2jxw s THR 46 Cb 0.42 -1.37 -0.23 0.00 1.34 0.00 0.00 72.50 72.66 2jxw s THR 46 CO 0.03 -1.08 1.23 1.62 -0.54 0.00 0.00 174.62 175.88 2jxw h VAL 47 N 4.86 1.65 -3.62 2.29 3.04 -1.95 -3.45 116.25 119.06 2jxw h VAL 47 Ca 0.14 -3.32 -0.51 0.00 -1.01 0.00 0.00 66.70 62.00 2jxw h VAL 47 Cb 0.93 2.87 -0.03 0.00 -2.01 0.00 0.00 31.29 33.06 2jxw h VAL 47 CO 0.36 0.95 0.27 0.26 -1.01 0.00 0.00 177.57 178.39 2jxw s TRP 48 N -2.69 3.92 -0.08 3.17 0.52 -1.26 -3.53 118.94 118.99 2jxw s TRP 48 Ca -0.01 1.76 0.03 0.00 0.02 0.00 0.00 56.10 57.90 2jxw s TRP 48 Cb 0.09 -2.89 -0.02 0.00 -1.15 0.00 0.00 33.47 29.51 2jxw s TRP 48 CO 0.84 0.45 -0.16 0.54 0.02 0.00 0.00 176.95 178.64 2jxw s VAL 49 N -0.99 2.83 -0.23 4.03 0.11 -0.63 -4.94 120.40 120.58 2jxw s VAL 49 Ca 0.39 -0.78 -0.17 0.00 -2.93 0.00 0.00 61.98 58.49 2jxw s VAL 49 Cb -0.24 -2.13 -0.03 0.00 -1.53 0.00 0.00 36.38 32.45 2jxw s VAL 49 CO 0.29 0.56 0.46 -0.70 -3.33 0.00 0.00 175.10 172.38 2jxw s GLU 50 N -0.20 4.12 0.26 1.54 2.12 -1.26 -2.20 118.70 123.07 2jxw s GLU 50 Ca -0.00 0.27 0.11 0.00 0.36 0.00 0.00 54.97 55.71 2jxw s GLU 50 Cb -0.13 -3.60 -0.05 0.00 0.26 0.00 0.00 34.13 30.61 2jxw s GLU 50 CO 0.03 -0.21 -0.17 0.20 -0.54 0.00 0.00 175.26 174.57 2jxw s GLY 51 N 1.34 1.82 -0.11 -1.50 0.00 0.13 -4.98 107.32 104.02 2jxw s GLY 51 Ca 0.20 -1.79 -0.02 0.00 0.00 0.00 0.00 44.72 43.11 2jxw s GLY 51 CO 0.09 -1.86 -0.01 -2.27 0.00 0.00 0.00 173.10 169.05 2jxw s LEU 52 N -3.38 3.46 0.12 0.66 2.96 -1.26 -1.18 118.68 120.05 2jxw s LEU 52 Ca 0.29 0.05 0.08 0.00 -0.22 0.00 0.00 54.13 54.32 2jxw s LEU 52 Cb -0.06 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 2jxw s LEU 52 CO 0.15 0.31 -0.18 -0.55 -1.32 0.00 0.00 176.35 174.76 2jxw s SER 53 N -0.48 2.41 0.64 3.68 0.15 -0.39 -4.94 113.70 114.77 2jxw s SER 53 Ca 0.08 -0.75 -0.17 0.00 0.70 0.00 0.00 55.95 55.81 2jxw s SER 53 Cb -0.12 -0.12 -0.10 0.00 -1.71 0.00 0.00 66.02 63.97 2jxw s SER 53 CO 0.02 -0.01 0.17 1.21 1.20 0.00 0.00 173.24 175.83 2jxw n GLU 54 N 0.78 0.22 -1.05 5.44 0.00 -1.26 -1.59 120.64 123.18 2jxw n GLU 54 Ca -0.17 0.09 -0.02 0.00 0.00 0.00 0.00 57.16 57.06 2jxw n GLU 54 Cb 0.55 -1.44 -0.01 0.00 0.00 0.00 0.00 31.44 30.54 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 1.21 -4.72 -2.09 4.31 8.00 -1.26 -3.73 116.55 118.26 2jxw n ASP 55 Ca 0.08 0.05 -0.03 0.00 0.71 0.00 0.00 54.79 55.60 2jxw n ASP 55 Cb 0.49 -2.38 0.01 0.00 -0.02 0.00 0.00 41.12 39.22 2jxw n ASP 55 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jxw n GLY 56 N -0.77 -0.21 2.87 0.44 0.00 -0.82 -5.06 105.19 101.64 2jxw n GLY 56 Ca -0.02 0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 2.16 -0.21 1.61 0.08 -0.62 -4.97 117.98 112.95 2jxw s PHE 57 Ca 0.09 -1.74 -0.29 0.00 0.12 0.00 0.00 56.93 55.11 2jxw s PHE 57 Cb -0.01 -1.67 0.00 0.00 -0.57 0.00 0.00 43.02 40.77 2jxw s PHE 57 CO 0.27 -0.79 1.09 0.99 -0.10 0.00 0.00 175.22 176.68 2jxw s THR 58 N 1.47 4.58 0.04 0.64 2.01 -1.26 -1.27 115.64 121.86 2jxw s THR 58 Ca 0.01 1.91 0.05 0.00 0.31 0.00 0.00 61.69 63.97 2jxw s THR 58 Cb -0.18 -4.23 -0.03 0.00 0.01 0.00 0.00 72.50 68.06 2jxw s THR 58 CO -0.11 -0.16 -0.11 -0.72 -0.69 0.00 0.00 174.62 172.83 2jxw s TYR 59 N 3.21 2.75 0.01 4.92 1.13 -0.33 -4.87 117.35 124.18 2jxw s TYR 59 Ca 0.47 -0.13 0.08 0.00 -1.41 0.00 0.00 57.07 56.08 2jxw s TYR 59 Cb -0.17 -1.52 -0.02 0.00 -1.10 0.00 0.00 41.96 39.15 2jxw s TYR 59 CO 0.09 0.35 -0.26 0.71 -2.51 0.00 0.00 175.55 173.93 2jxw s TYR 60 N -1.03 2.28 0.11 -3.49 2.02 0.24 0.18 117.35 117.66 2jxw s TYR 60 Ca 0.17 -0.42 0.06 0.00 -0.37 0.00 0.00 57.07 56.52 2jxw s TYR 60 Cb -0.11 -1.43 -0.04 0.00 -0.40 0.00 0.00 41.96 39.99 2jxw s TYR 60 CO 0.08 0.03 -0.16 -0.47 -1.57 0.00 0.00 175.55 173.47 2jxw s TYR 61 N -0.68 1.47 -0.10 2.71 5.04 -0.94 0.11 117.35 124.96 2jxw s TYR 61 Ca 0.10 -0.50 0.01 0.00 -2.44 0.00 0.00 57.07 54.24 2jxw s TYR 61 Cb -0.10 -0.78 -0.02 0.00 0.35 0.00 0.00 41.96 41.41 2jxw s TYR 61 CO 0.00 0.16 -0.13 1.21 -1.34 0.00 0.00 175.55 175.45 2jxw s ASN 62 N -2.24 4.07 -0.02 4.32 3.84 -0.76 -1.61 114.94 122.55 2jxw s ASN 62 Ca 0.07 -0.25 0.12 0.00 0.21 0.00 0.00 52.86 53.01 2jxw s ASN 62 Cb -0.07 -1.29 -0.22 0.00 -0.55 0.00 0.00 41.25 39.12 2jxw s ASN 62 CO 0.03 0.25 0.73 0.71 -2.79 0.00 0.00 177.10 176.03 2jxw h THR 63 N 4.92 0.91 0.88 -5.21 1.35 -1.90 -1.89 112.91 111.97 2jxw h THR 63 Ca -0.35 -2.74 -0.04 0.00 -0.55 0.00 0.00 66.41 62.73 2jxw h THR 63 Cb 1.19 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 70.05 2jxw h THR 63 CO 0.54 0.52 -0.47 -0.08 -0.25 0.00 0.00 175.52 175.78 2jxw h GLU 64 N 0.00 -1.20 0.07 4.72 4.81 -1.95 -3.34 114.58 117.69 2jxw h GLU 64 Ca -0.25 0.08 -0.34 0.00 -0.13 0.00 0.00 59.36 58.72 2jxw h GLU 64 Cb 1.97 0.27 -0.03 0.00 0.63 0.00 0.00 28.75 31.59 2jxw h GLU 64 CO 0.08 -0.80 -1.94 -2.37 -0.73 0.00 0.00 179.01 173.26 2jxw n THR 65 N -5.49 1.70 -0.85 0.32 5.66 -1.26 -5.03 114.28 109.33 2jxw n THR 65 Ca -0.15 -0.71 0.00 0.00 -3.05 0.00 0.00 64.05 60.14 2jxw n THR 65 Cb 0.50 -1.43 0.00 0.00 -1.55 0.00 0.00 70.33 67.85 2jxw n THR 65 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jxw n GLY 66 N 1.85 0.48 3.04 1.09 0.00 -0.72 -5.10 105.19 105.83 2jxw n GLY 66 Ca -0.27 -0.21 -0.22 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.13 1.20 0.21 1.61 2.12 -1.17 -4.94 118.70 116.60 2jxw s GLU 67 Ca 0.00 -0.39 -0.18 0.00 0.36 0.00 0.00 54.97 54.76 2jxw s GLU 67 Cb 0.00 -1.09 -0.08 0.00 0.26 0.00 0.00 34.13 33.22 2jxw s GLU 67 CO 0.00 0.15 0.68 -1.12 -0.54 0.00 0.00 175.26 174.43 2jxw s SER 68 N 0.15 6.97 0.02 -1.70 0.01 -1.26 -1.82 113.70 116.07 2jxw s SER 68 Ca -0.03 1.31 0.02 0.00 1.31 0.00 0.00 55.95 58.56 2jxw s SER 68 Cb -0.09 -2.38 -0.01 0.00 0.21 0.00 0.00 66.02 63.74 2jxw s SER 68 CO 0.01 0.03 -0.07 -0.60 0.41 0.00 0.00 173.24 173.02 2jxw s ARG 69 N -2.06 0.53 -0.09 12.44 3.52 0.29 -4.98 118.95 128.60 2jxw s ARG 69 Ca 0.43 -0.45 0.13 0.00 -0.13 0.00 0.00 55.73 55.71 2jxw s ARG 69 Cb -0.16 -0.44 0.20 0.00 -1.56 0.00 0.00 34.95 32.99 2jxw s ARG 69 CO 0.20 0.11 1.10 0.91 -0.81 0.00 0.00 175.30 176.81 2jxw n TRP 70 N 2.34 0.00 -1.54 5.12 7.02 -1.26 -0.60 117.44 128.52 2jxw n TRP 70 Ca -0.17 -0.68 0.01 0.00 -1.02 0.00 0.00 57.50 55.64 2jxw n TRP 70 Cb 0.57 -0.12 0.01 0.00 -2.42 0.00 0.00 31.31 29.35 2jxw n TRP 70 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2jxw n GLU 71 N -0.98 0.20 -0.80 -0.99 1.02 -1.26 -5.00 120.64 112.83 2jxw n GLU 71 Ca 0.11 -0.96 0.00 0.00 -0.02 0.00 0.00 57.16 56.28 2jxw n GLU 71 Cb 0.65 -0.59 0.00 0.00 -0.02 0.00 0.00 31.44 31.49 2jxw n GLU 71 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2jxw n LYS 72 N -0.12 -2.28 -2.18 3.49 4.81 -1.26 -4.96 118.16 115.66 2jxw n LYS 72 Ca 0.01 1.69 -0.35 0.00 -0.87 0.00 0.00 58.31 58.79 2jxw n LYS 72 Cb 0.61 -1.88 0.01 0.00 0.02 0.00 0.00 35.03 33.79 2jxw n LYS 72 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2jxw s PRO 73 N -4.40 3.28 0.30 1.64 0.04 -1.26 -5.07 135.00 129.53 2jxw s PRO 73 Ca 0.00 1.55 0.05 0.00 0.04 0.00 0.00 61.00 62.64 2jxw s PRO 73 Cb 0.00 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 2jxw s PRO 73 CO 0.00 -0.90 0.00 -0.51 0.04 0.00 0.00 177.00 175.63 2jxw s ASP 74 N -1.96 2.54 0.00 6.66 1.01 -1.26 -5.20 116.67 118.47 2jxw s ASP 74 Ca 0.71 -1.28 0.00 0.00 0.71 0.00 0.00 52.55 52.69 2jxw s ASP 74 Cb -0.23 -0.12 0.00 0.00 1.01 0.00 0.00 42.92 43.58 2jxw s ASP 74 CO 0.29 -0.48 0.33 -0.67 0.21 0.00 0.00 175.17 174.85