#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 4.21 0.04 -0.67 0.04 -1.26 -5.06 135.00 132.29 2jxw s PRO 2 Ca 0.00 1.83 0.01 0.00 0.04 0.00 0.00 61.00 62.89 2jxw s PRO 2 Cb 0.00 -2.79 -0.02 0.00 0.04 0.00 0.00 34.50 31.72 2jxw s PRO 2 CO 0.00 -0.19 -0.06 0.45 0.04 0.00 0.00 177.00 177.24 2jxw s SER 3 N -1.07 0.63 0.15 6.66 0.15 -1.26 -5.17 113.70 113.79 2jxw s SER 3 Ca 0.54 -0.57 0.06 0.00 0.70 0.00 0.00 55.95 56.68 2jxw s SER 3 Cb -0.31 0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.03 2jxw s SER 3 CO 0.39 -0.26 -0.13 -0.54 1.20 0.00 0.00 173.24 173.90 2jxw s LYS 4 N -1.71 1.11 0.00 5.44 1.02 -1.26 -4.89 119.74 119.46 2jxw s LYS 4 Ca -0.11 -1.41 0.00 0.00 0.02 0.00 0.00 55.97 54.48 2jxw s LYS 4 Cb -0.09 -0.85 0.00 0.00 -0.52 0.00 0.00 37.83 36.37 2jxw s LYS 4 CO -0.01 0.14 0.00 0.41 -0.92 0.00 0.00 175.35 174.97 2jxw n GLY 5 N 0.03 0.63 3.58 -3.33 0.00 -1.26 -4.98 105.19 99.86 2jxw n GLY 5 Ca -0.12 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.04 3.32 -0.04 1.61 1.81 -1.26 -4.92 118.95 117.43 2jxw s ARG 6 Ca 0.00 -1.51 0.07 0.00 -1.72 0.00 0.00 55.73 52.57 2jxw s ARG 6 Cb 0.00 -5.39 -0.01 0.00 -0.45 0.00 0.00 34.95 29.10 2jxw s ARG 6 CO 0.00 -2.96 -0.25 -1.58 -0.68 0.00 0.00 175.30 169.84 2jxw s TRP 7 N 7.14 2.33 -0.13 -0.53 0.52 -1.26 -3.55 118.94 123.47 2jxw s TRP 7 Ca 0.59 -0.58 -0.01 0.00 0.02 0.00 0.00 56.10 56.13 2jxw s TRP 7 Cb 0.01 -1.52 -0.02 0.00 -1.15 0.00 0.00 33.47 30.80 2jxw s TRP 7 CO 0.08 -0.13 -0.11 0.54 0.02 0.00 0.00 176.95 177.34 2jxw s VAL 8 N -0.35 3.23 -0.11 4.03 0.11 -0.93 -4.92 120.40 121.45 2jxw s VAL 8 Ca 0.03 -0.60 -0.19 0.00 -2.93 0.00 0.00 61.98 58.28 2jxw s VAL 8 Cb -0.12 -2.36 -0.04 0.00 -1.53 0.00 0.00 36.38 32.33 2jxw s VAL 8 CO 0.01 0.53 0.53 -0.70 -3.33 0.00 0.00 175.10 172.14 2jxw s GLU 9 N 0.24 4.36 0.04 1.54 2.12 -1.26 -2.63 118.70 123.11 2jxw s GLU 9 Ca -0.08 0.55 0.03 0.00 0.36 0.00 0.00 54.97 55.83 2jxw s GLU 9 Cb -0.15 -3.45 -0.02 0.00 0.26 0.00 0.00 34.13 30.77 2jxw s GLU 9 CO 0.05 0.12 -0.08 0.20 -0.54 0.00 0.00 175.26 175.00 2jxw s GLY 10 N 0.70 0.53 -0.19 -1.50 0.00 0.42 -4.97 107.32 102.30 2jxw s GLY 10 Ca 0.29 -0.73 -0.12 0.00 0.00 0.00 0.00 44.72 44.16 2jxw s GLY 10 CO 0.12 -0.76 0.23 -0.42 0.00 0.00 0.00 173.10 172.26 2jxw s ILE 11 N -1.20 5.34 0.10 0.90 -1.09 -1.26 0.14 121.20 124.12 2jxw s ILE 11 Ca -0.07 0.39 0.05 0.00 -2.23 0.00 0.00 60.65 58.78 2jxw s ILE 11 Cb -0.09 -3.57 -0.03 0.00 -1.58 0.00 0.00 42.46 37.19 2jxw s ILE 11 CO 0.01 0.39 -0.12 0.42 -1.23 0.00 0.00 174.94 174.41 2jxw s THR 12 N 0.57 1.07 0.00 2.92 -4.23 -0.16 -4.94 115.64 110.87 2jxw s THR 12 Ca 0.13 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.05 2jxw s THR 12 Cb -0.12 -1.33 0.00 0.00 1.34 0.00 0.00 72.50 72.38 2jxw s THR 12 CO 0.02 -0.45 0.00 -0.24 -0.54 0.00 0.00 174.62 173.41 2jxw n SER 13 N 0.70 -0.04 -0.07 3.99 2.88 -1.26 -0.95 113.62 118.87 2jxw n SER 13 Ca -0.17 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.48 2jxw n SER 13 Cb 0.57 0.00 0.59 0.00 -0.75 0.00 0.00 64.21 64.62 2jxw n SER 13 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jxw n GLU 14 N 0.00 1.09 0.00 -1.46 4.71 -1.26 -4.69 120.64 119.04 2jxw n GLU 14 Ca 0.00 -0.14 0.00 0.00 -0.01 0.00 0.00 57.16 57.01 2jxw n GLU 14 Cb 0.00 -1.34 0.00 0.00 -1.01 0.00 0.00 31.44 29.09 2jxw n GLU 14 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2jxw n GLY 15 N 0.87 -0.89 2.64 0.62 0.00 -1.09 -5.15 105.19 102.19 2jxw n GLY 15 Ca 0.16 0.26 -0.26 0.00 0.00 0.00 0.00 46.02 46.17 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 0.42 -0.29 1.61 1.51 -0.13 -4.97 117.35 115.51 2jxw s TYR 16 Ca 0.00 -0.47 -0.29 0.00 -1.01 0.00 0.00 57.07 55.30 2jxw s TYR 16 Cb 0.00 -0.79 0.01 0.00 -0.11 0.00 0.00 41.96 41.07 2jxw s TYR 16 CO 0.00 -0.54 1.17 -1.01 -1.11 0.00 0.00 175.55 174.05 2jxw s HIS 17 N 2.06 2.98 0.13 2.71 3.76 -1.26 -0.98 115.29 124.69 2jxw s HIS 17 Ca 0.01 1.09 0.07 0.00 -0.15 0.00 0.00 55.06 56.08 2jxw s HIS 17 Cb -0.16 -3.70 -0.04 0.00 1.11 0.00 0.00 32.58 29.78 2jxw s HIS 17 CO -0.09 -1.16 -0.04 1.52 -0.85 0.00 0.00 174.74 174.12 2jxw s TYR 18 N 3.82 2.83 0.10 1.40 1.13 0.12 -4.86 117.35 121.89 2jxw s TYR 18 Ca 0.50 -0.12 0.09 0.00 -1.41 0.00 0.00 57.07 56.12 2jxw s TYR 18 Cb -0.15 -1.43 -0.03 0.00 -1.10 0.00 0.00 41.96 39.25 2jxw s TYR 18 CO 0.17 0.48 -0.22 0.71 -2.51 0.00 0.00 175.55 174.17 2jxw s TYR 19 N -1.45 1.91 0.02 -3.49 2.02 -0.44 -0.44 117.35 115.49 2jxw s TYR 19 Ca 0.25 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.56 2jxw s TYR 19 Cb -0.10 -1.06 -0.02 0.00 -0.40 0.00 0.00 41.96 40.38 2jxw s TYR 19 CO 0.17 0.22 -0.06 -0.47 -1.57 0.00 0.00 175.55 173.83 2jxw s TYR 20 N -1.09 0.56 -0.18 2.71 6.14 -1.08 0.91 117.35 125.33 2jxw s TYR 20 Ca 0.08 -0.34 -0.02 0.00 0.64 0.00 0.00 57.07 57.43 2jxw s TYR 20 Cb -0.10 -0.35 -0.01 0.00 0.42 0.00 0.00 41.96 41.93 2jxw s TYR 20 CO 0.04 -0.06 -0.09 0.34 0.64 0.00 0.00 175.55 176.42 2jxw s ASP 21 N -1.00 4.11 0.14 4.32 2.15 -0.57 -2.19 116.67 123.62 2jxw s ASP 21 Ca -0.06 -0.38 0.10 0.00 0.43 0.00 0.00 52.55 52.64 2jxw s ASP 21 Cb -0.07 -1.67 -0.14 0.00 -0.30 0.00 0.00 42.92 40.74 2jxw s ASP 21 CO 0.00 0.06 1.24 0.17 -0.17 0.00 0.00 175.17 176.47 2jxw h LEU 22 N 7.51 0.00 0.26 -1.34 -0.00 -1.88 0.14 115.31 120.00 2jxw h LEU 22 Ca -0.36 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.51 2jxw h LEU 22 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.84 2jxw h LEU 22 CO 0.59 0.86 -0.12 0.40 -0.00 0.00 0.00 178.44 180.17 2jxw h ILE 23 N 0.00 0.76 0.01 0.15 2.04 -1.95 -3.29 117.51 115.24 2jxw h ILE 23 Ca -0.04 -0.05 -0.32 0.00 1.00 0.00 0.00 64.86 65.45 2jxw h ILE 23 Cb 1.69 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 38.50 2jxw h ILE 23 CO 0.11 0.01 -1.95 -1.20 0.00 0.00 0.00 178.15 175.12 2jxw n SER 24 N -5.23 0.85 -0.73 1.72 7.64 -1.26 -5.02 113.62 111.59 2jxw n SER 24 Ca -0.10 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.05 2jxw n SER 24 Cb 0.17 0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 2jxw n SER 24 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jxw n GLY 25 N 1.69 0.54 3.12 0.23 0.00 0.48 -5.09 105.19 106.15 2jxw n GLY 25 Ca -0.24 -0.41 -0.18 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.63 0.99 -0.13 4.61 0.00 -1.04 -4.98 121.76 118.58 2jxw s ALA 26 Ca 0.00 -0.83 -0.15 0.00 0.00 0.00 0.00 51.96 50.98 2jxw s ALA 26 Cb 0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 23.12 22.98 2jxw s ALA 26 CO 0.00 0.14 0.35 -1.54 0.00 0.00 0.00 175.76 174.71 2jxw s SER 27 N -1.36 6.54 0.38 0.00 1.04 -1.26 -1.51 113.70 117.52 2jxw s SER 27 Ca -0.02 0.63 0.07 0.00 0.48 0.00 0.00 55.95 57.11 2jxw s SER 27 Cb -0.09 -2.22 -0.07 0.00 0.10 0.00 0.00 66.02 63.74 2jxw s SER 27 CO 0.01 0.09 -0.00 -1.58 0.98 0.00 0.00 173.24 172.74 2jxw s GLN 28 N 0.36 1.87 0.00 4.02 2.00 0.26 -5.00 119.66 123.17 2jxw s GLN 28 Ca 0.20 -2.03 0.00 0.00 -2.00 0.00 0.00 55.36 51.52 2jxw s GLN 28 Cb -0.14 -1.51 0.00 0.00 0.80 0.00 0.00 33.01 32.16 2jxw s GLN 28 CO 0.06 -0.03 0.00 0.91 -0.50 0.00 0.00 175.29 175.73 2jxw n TRP 29 N -0.88 0.00 -2.93 1.67 7.02 -1.26 -1.32 117.44 119.74 2jxw n TRP 29 Ca -0.05 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.07 2jxw n TRP 29 Cb 0.66 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.49 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 -1.65 4.39 0.21 -0.99 8.01 -1.26 -4.66 118.70 122.75 2jxw s GLU 30 Ca 0.00 1.10 -0.30 0.00 0.01 0.00 0.00 54.97 55.78 2jxw s GLU 30 Cb 0.00 -2.76 -0.09 0.00 -4.31 0.00 0.00 34.13 26.97 2jxw s GLU 30 CO 0.00 0.29 1.28 0.21 0.01 0.00 0.00 175.26 177.05 2jxw s LYS 31 N -2.16 4.41 1.48 1.61 2.20 -1.26 -4.90 119.74 121.11 2jxw s LYS 31 Ca 0.49 2.03 -0.24 0.00 -0.36 0.00 0.00 55.97 57.88 2jxw s LYS 31 Cb -0.17 -3.19 0.38 0.00 -1.51 0.00 0.00 37.83 33.35 2jxw s LYS 31 CO 0.21 -0.20 0.89 -2.14 -0.36 0.00 0.00 175.35 173.76 2jxw s PRO 32 N -0.33 -3.35 0.31 4.03 0.02 -1.26 -4.91 135.00 129.51 2jxw s PRO 32 Ca 0.55 0.13 0.01 0.00 0.02 0.00 0.00 61.00 61.70 2jxw s PRO 32 Cb -0.36 -1.33 0.49 0.00 0.02 0.00 0.00 34.50 33.32 2jxw s PRO 32 CO 0.39 -5.15 1.88 0.93 -0.33 0.00 0.00 177.00 174.73 2jxw h GLU 33 N -3.61 0.79 -1.97 5.54 3.07 -1.98 -3.38 114.58 113.04 2jxw h GLU 33 Ca -0.42 -0.13 -0.45 0.00 -0.50 0.00 0.00 59.36 57.87 2jxw h GLU 33 Cb 1.35 -0.14 -0.31 0.00 -0.84 0.00 0.00 28.75 28.81 2jxw h GLU 33 CO 0.26 0.67 -0.81 0.20 -1.40 0.00 0.00 179.01 177.93 2jxw s GLY 34 N -3.62 0.39 -0.18 -3.84 0.00 -1.26 -4.90 107.32 93.91 2jxw s GLY 34 Ca -0.09 -1.71 -0.17 0.00 0.00 0.00 0.00 44.72 42.74 2jxw s GLY 34 CO 0.79 2.60 -0.34 0.33 0.00 0.00 0.00 173.10 176.48 2jxw n PHE 35 N 3.11 0.01 -0.02 1.90 7.35 -1.26 -4.92 117.46 123.63 2jxw n PHE 35 Ca 0.24 0.01 -0.03 0.00 -0.76 0.00 0.00 57.45 56.91 2jxw n PHE 35 Cb 0.49 -0.49 -0.01 0.00 0.35 0.00 0.00 39.48 39.81 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 -4.42 0.08 -3.39 -4.13 6.02 -1.26 -5.04 117.38 105.24 2jxw n GLN 36 Ca -0.14 0.02 -0.35 0.00 -0.01 0.00 0.00 57.00 56.53 2jxw n GLN 36 Cb 0.50 -0.96 -0.06 0.00 1.02 0.00 0.00 30.24 30.74 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 -4.50 2.44 -0.26 1.08 0.00 -1.26 -5.08 107.32 99.74 2jxw s GLY 37 Ca -0.05 -0.17 0.02 0.00 0.00 0.00 0.00 44.72 44.52 2jxw s GLY 37 CO 0.07 0.09 -0.05 0.99 0.00 0.00 0.00 173.10 174.21 2jxw s ASP 38 N -1.74 4.12 -0.88 1.64 1.01 -1.26 -4.66 116.67 114.90 2jxw s ASP 38 Ca 0.37 -1.38 -0.03 0.00 0.71 0.00 0.00 52.55 52.23 2jxw s ASP 38 Cb -0.15 -1.30 0.22 0.00 1.01 0.00 0.00 42.92 42.70 2jxw s ASP 38 CO 0.19 -0.25 0.76 -0.22 0.21 0.00 0.00 175.17 175.86 2jxw s LEU 39 N 1.28 5.60 -0.31 1.23 0.20 -1.26 -5.04 118.68 120.38 2jxw s LEU 39 Ca -0.04 -3.58 -0.15 0.00 0.69 0.00 0.00 54.13 51.05 2jxw s LEU 39 Cb -0.19 -1.93 -0.02 0.00 -0.43 0.00 0.00 46.19 43.61 2jxw s LEU 39 CO -0.07 -0.22 0.37 -0.54 -0.29 0.00 0.00 176.35 175.59 2jxw s LYS 40 N -1.15 3.79 0.09 1.98 1.02 -1.26 -5.06 119.74 119.16 2jxw s LYS 40 Ca 0.26 -0.18 -0.06 0.00 0.02 0.00 0.00 55.97 56.01 2jxw s LYS 40 Cb -0.09 -3.73 -0.02 0.00 -0.52 0.00 0.00 37.83 33.47 2jxw s LYS 40 CO -0.11 -0.40 0.13 0.21 -0.92 0.00 0.00 175.35 174.25 2jxw s LYS 41 N 2.06 0.84 0.04 1.68 2.47 -1.26 -5.06 119.74 120.50 2jxw s LYS 41 Ca 0.13 -1.12 -0.07 0.00 -1.56 0.00 0.00 55.97 53.35 2jxw s LYS 41 Cb -0.16 0.30 -0.30 0.00 -1.46 0.00 0.00 37.83 36.21 2jxw s LYS 41 CO 0.11 -0.25 0.99 1.79 0.16 0.00 0.00 175.35 178.16 2jxw h THR 42 N 2.84 1.31 -2.50 3.43 1.35 -2.08 -3.46 112.91 113.79 2jxw h THR 42 Ca -0.34 -2.87 -0.53 0.00 -0.55 0.00 0.00 66.41 62.12 2jxw h THR 42 Cb 1.19 2.90 -0.03 0.00 -1.73 0.00 0.00 68.15 70.48 2jxw h THR 42 CO 0.58 0.85 -0.47 0.00 -0.25 0.00 0.00 175.52 176.23 2jxw s ALA 43 N -2.63 3.91 -0.39 6.62 0.00 -1.26 -5.09 121.76 122.93 2jxw s ALA 43 Ca -0.07 -1.09 0.03 0.00 0.00 0.00 0.00 51.96 50.83 2jxw s ALA 43 Cb 0.06 -1.72 0.11 0.00 0.00 0.00 0.00 23.12 21.57 2jxw s ALA 43 CO 0.89 0.48 0.12 0.08 0.00 0.00 0.00 175.76 177.33 2jxw s VAL 44 N -1.79 2.15 -0.92 0.00 1.01 -1.26 -5.05 120.40 114.53 2jxw s VAL 44 Ca 0.34 -2.51 -0.24 0.00 0.00 0.00 0.00 61.98 59.57 2jxw s VAL 44 Cb -0.11 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 2jxw s VAL 44 CO 0.28 -0.68 1.91 -1.59 0.00 0.00 0.00 175.10 175.02 2jxw s LYS 45 N 0.64 2.62 -0.37 2.72 -2.85 -1.26 -4.84 119.74 116.40 2jxw s LYS 45 Ca 0.13 -0.39 0.01 0.00 -1.00 0.00 0.00 55.97 54.72 2jxw s LYS 45 Cb -0.21 -5.09 0.15 0.00 -2.06 0.00 0.00 37.83 30.62 2jxw s LYS 45 CO -0.07 -3.33 0.27 0.95 0.10 0.00 0.00 175.35 173.26 2jxw s THR 46 N 9.78 0.14 -0.16 3.79 -4.23 -1.26 -4.96 115.64 118.73 2jxw s THR 46 Ca 0.68 -1.90 0.16 0.00 -1.18 0.00 0.00 61.69 59.46 2jxw s THR 46 Cb -0.06 -1.10 0.01 0.00 1.34 0.00 0.00 72.50 72.69 2jxw s THR 46 CO -0.01 -1.02 1.23 1.62 -0.54 0.00 0.00 174.62 175.91 2jxw h VAL 47 N 4.91 0.65 -3.84 2.29 3.04 -1.96 -3.46 116.25 117.88 2jxw h VAL 47 Ca 0.12 -2.02 -0.48 0.00 -1.01 0.00 0.00 66.70 63.31 2jxw h VAL 47 Cb 0.96 2.22 -0.01 0.00 -2.01 0.00 0.00 31.29 32.45 2jxw h VAL 47 CO 0.28 0.37 0.38 0.26 -1.01 0.00 0.00 177.57 177.85 2jxw s TRP 48 N -2.99 3.70 0.17 3.17 0.52 -1.26 -4.40 118.94 117.86 2jxw s TRP 48 Ca 0.02 1.79 0.05 0.00 0.02 0.00 0.00 56.10 57.97 2jxw s TRP 48 Cb 0.08 -3.03 -0.04 0.00 -1.15 0.00 0.00 33.47 29.33 2jxw s TRP 48 CO 0.77 0.03 0.19 0.08 0.02 0.00 0.00 176.95 178.04 2jxw s VAL 49 N -1.42 4.71 -0.20 4.03 1.01 -0.84 -4.92 120.40 122.78 2jxw s VAL 49 Ca 0.48 -1.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 2jxw s VAL 49 Cb -0.23 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 2jxw s VAL 49 CO 0.30 -0.14 -0.07 -0.70 0.00 0.00 0.00 175.10 174.48 2jxw s GLU 50 N -3.25 3.35 0.25 2.72 -6.30 -1.26 -2.78 118.70 111.43 2jxw s GLU 50 Ca 0.32 -0.65 0.12 0.00 -2.50 0.00 0.00 54.97 52.26 2jxw s GLU 50 Cb -0.10 -2.90 -0.05 0.00 0.00 0.00 0.00 34.13 31.08 2jxw s GLU 50 CO 0.25 -0.12 -0.19 0.20 0.02 0.00 0.00 175.26 175.42 2jxw s GLY 51 N 1.24 1.82 -0.16 -1.50 0.00 0.50 -4.97 107.32 104.26 2jxw s GLY 51 Ca 0.03 -1.79 -0.02 0.00 0.00 0.00 0.00 44.72 42.94 2jxw s GLY 51 CO -0.03 -1.86 -0.08 -2.27 0.00 0.00 0.00 173.10 168.87 2jxw s LEU 52 N -3.28 2.95 0.02 0.66 2.96 -1.26 -1.37 118.68 119.36 2jxw s LEU 52 Ca 0.27 -0.27 -0.02 0.00 -0.22 0.00 0.00 54.13 53.90 2jxw s LEU 52 Cb -0.06 -1.70 -0.02 0.00 0.50 0.00 0.00 46.19 44.91 2jxw s LEU 52 CO 0.14 0.13 0.01 -0.55 -1.32 0.00 0.00 176.35 174.76 2jxw s SER 53 N 0.58 0.23 0.80 3.68 0.15 0.19 -4.96 113.70 114.36 2jxw s SER 53 Ca -0.05 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.08 2jxw s SER 53 Cb -0.15 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.30 2jxw s SER 53 CO 0.03 -0.37 0.00 1.21 1.20 0.00 0.00 173.24 175.31 2jxw n GLU 54 N 1.30 0.00 0.21 5.44 0.00 -1.26 0.97 120.64 127.29 2jxw n GLU 54 Ca -0.22 0.00 0.16 0.00 0.00 0.00 0.00 57.16 57.10 2jxw n GLU 54 Cb 0.56 0.00 0.82 0.00 0.00 0.00 0.00 31.44 32.82 2jxw n GLU 54 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 2jxw h ASP 55 N 1.17 0.00 0.00 4.31 1.82 -2.06 -3.39 116.42 118.26 2jxw h ASP 55 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2jxw h ASP 55 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 2jxw h ASP 55 CO 0.00 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.24 2jxw n GLY 56 N -1.42 0.00 3.65 -0.78 0.00 -1.18 -5.15 105.19 100.32 2jxw n GLY 56 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 3.31 -0.25 1.61 0.40 0.27 -4.91 117.98 118.41 2jxw s PHE 57 Ca 0.00 0.31 -0.19 0.00 -0.60 0.00 0.00 56.93 56.45 2jxw s PHE 57 Cb 0.00 -2.37 -0.02 0.00 0.51 0.00 0.00 43.02 41.14 2jxw s PHE 57 CO 0.00 -0.01 0.57 0.99 0.70 0.00 0.00 175.22 177.47 2jxw s THR 58 N 1.31 5.03 0.04 0.64 2.01 -1.26 -0.64 115.64 122.77 2jxw s THR 58 Ca 0.11 1.01 0.05 0.00 0.31 0.00 0.00 61.69 63.17 2jxw s THR 58 Cb -0.14 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 2jxw s THR 58 CO 0.07 0.07 -0.10 -0.72 -0.69 0.00 0.00 174.62 173.24 2jxw s TYR 59 N 2.32 2.77 0.01 4.92 -0.85 -0.47 -4.80 117.35 121.24 2jxw s TYR 59 Ca 0.24 -0.12 0.08 0.00 -0.52 0.00 0.00 57.07 56.75 2jxw s TYR 59 Cb -0.16 -1.53 -0.02 0.00 0.38 0.00 0.00 41.96 40.63 2jxw s TYR 59 CO 0.09 0.35 -0.26 0.71 -1.52 0.00 0.00 175.55 174.92 2jxw s TYR 60 N -1.02 2.28 0.06 -3.49 2.02 0.46 -0.37 117.35 117.30 2jxw s TYR 60 Ca 0.17 -0.42 0.08 0.00 -0.37 0.00 0.00 57.07 56.53 2jxw s TYR 60 Cb -0.11 -1.43 -0.03 0.00 -0.40 0.00 0.00 41.96 40.00 2jxw s TYR 60 CO 0.08 0.03 -0.21 -0.47 -1.57 0.00 0.00 175.55 173.41 2jxw s TYR 61 N -0.68 1.80 -0.19 2.71 6.14 -1.12 0.11 117.35 126.11 2jxw s TYR 61 Ca 0.10 -0.39 -0.02 0.00 0.64 0.00 0.00 57.07 57.41 2jxw s TYR 61 Cb -0.10 -1.05 -0.01 0.00 0.42 0.00 0.00 41.96 41.23 2jxw s TYR 61 CO 0.00 0.13 -0.09 1.21 0.64 0.00 0.00 175.55 177.44 2jxw s ASN 62 N -1.41 4.06 0.36 4.32 2.47 -0.94 -1.98 114.94 121.82 2jxw s ASN 62 Ca 0.07 -0.41 0.19 0.00 0.42 0.00 0.00 52.86 53.13 2jxw s ASN 62 Cb -0.09 -1.67 0.51 0.00 -1.45 0.00 0.00 41.25 38.55 2jxw s ASN 62 CO 0.03 0.03 1.65 0.71 -3.72 0.00 0.00 177.10 175.80 2jxw h THR 63 N 5.65 0.78 0.43 -5.21 1.35 -1.91 0.12 112.91 114.13 2jxw h THR 63 Ca -0.38 -1.67 -0.01 0.00 -0.55 0.00 0.00 66.41 63.79 2jxw h THR 63 Cb 1.17 2.07 -0.02 0.00 -1.73 0.00 0.00 68.15 69.65 2jxw h THR 63 CO 0.60 0.37 -0.42 -0.08 -0.25 0.00 0.00 175.52 175.74 2jxw h GLU 64 N 0.00 -0.82 0.01 4.72 4.81 -1.94 -3.34 114.58 118.02 2jxw h GLU 64 Ca -0.00 0.06 -0.36 0.00 -0.13 0.00 0.00 59.36 58.92 2jxw h GLU 64 Cb 1.04 0.19 -0.06 0.00 0.63 0.00 0.00 28.75 30.55 2jxw h GLU 64 CO 0.05 -0.55 -2.24 -2.37 -0.73 0.00 0.00 179.01 173.17 2jxw n THR 65 N -4.98 1.49 -0.64 0.32 5.66 -1.25 -5.05 114.28 109.82 2jxw n THR 65 Ca -0.10 -0.77 0.00 0.00 -3.05 0.00 0.00 64.05 60.13 2jxw n THR 65 Cb 0.39 -0.88 0.00 0.00 -1.55 0.00 0.00 70.33 68.29 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 1.84 0.73 3.10 1.09 0.00 0.40 -5.10 105.19 107.24 2jxw n GLY 66 Ca -0.32 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.43 0.31 0.14 1.61 2.12 -1.16 -4.98 118.70 114.32 2jxw s GLU 67 Ca 0.00 0.11 -0.21 0.00 0.36 0.00 0.00 54.97 55.23 2jxw s GLU 67 Cb 0.00 0.14 -0.07 0.00 0.26 0.00 0.00 34.13 34.46 2jxw s GLU 67 CO 0.00 -0.06 0.67 -1.54 -0.54 0.00 0.00 175.26 173.79 2jxw s SER 68 N -0.30 7.16 0.09 -1.70 1.04 -1.26 -2.22 113.70 116.51 2jxw s SER 68 Ca -0.04 1.41 0.03 0.00 0.48 0.00 0.00 55.95 57.83 2jxw s SER 68 Cb -0.03 -2.41 -0.04 0.00 0.10 0.00 0.00 66.02 63.64 2jxw s SER 68 CO 0.01 0.19 -0.09 -0.60 0.98 0.00 0.00 173.24 173.74 2jxw s ARG 69 N -1.35 0.82 -0.17 4.02 6.06 0.29 -4.99 118.95 123.63 2jxw s ARG 69 Ca 0.35 -1.19 0.15 0.00 -2.50 0.00 0.00 55.73 52.53 2jxw s ARG 69 Cb -0.20 -0.39 0.43 0.00 0.06 0.00 0.00 34.95 34.85 2jxw s ARG 69 CO 0.22 0.04 1.20 0.91 -2.50 0.00 0.00 175.30 175.17 2jxw n TRP 70 N 0.40 0.41 -3.78 5.12 7.02 -1.26 -0.40 117.44 124.94 2jxw n TRP 70 Ca -0.15 -1.36 -0.13 0.00 -1.02 0.00 0.00 57.50 54.84 2jxw n TRP 70 Cb 0.59 -0.23 -0.13 0.00 -2.42 0.00 0.00 31.31 29.11 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 -2.46 0.17 0.22 -0.99 2.02 -1.26 -5.00 118.70 111.39 2jxw s GLU 71 Ca 0.38 0.31 -0.30 0.00 0.02 0.00 0.00 54.97 55.38 2jxw s GLU 71 Cb 0.38 -0.01 -0.09 0.00 0.10 0.00 0.00 34.13 34.51 2jxw s GLU 71 CO -0.08 -0.08 1.29 0.21 0.02 0.00 0.00 175.26 176.61 2jxw s LYS 72 N 0.54 4.41 -0.11 1.61 2.20 -1.26 -4.93 119.74 122.20 2jxw s LYS 72 Ca -0.04 2.04 -0.32 0.00 -0.36 0.00 0.00 55.97 57.30 2jxw s LYS 72 Cb -0.05 -3.18 -0.09 0.00 -1.51 0.00 0.00 37.83 32.99 2jxw s LYS 72 CO -0.03 -0.20 2.02 -2.30 -0.36 0.00 0.00 175.35 174.49 2jxw n PRO 73 N 2.31 2.20 -3.74 4.03 -0.02 -1.26 -4.97 135.00 133.55 2jxw n PRO 73 Ca 0.05 0.75 -0.23 0.00 -2.02 0.00 0.00 63.50 62.05 2jxw n PRO 73 Cb 0.43 -2.87 -0.17 0.00 -0.02 0.00 0.00 33.50 30.87 2jxw n PRO 73 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2jxw s ASP 74 N 5.54 1.71 0.00 2.55 1.11 -1.26 -5.29 116.67 121.03 2jxw s ASP 74 Ca 0.96 -0.18 0.00 0.00 0.18 0.00 0.00 52.55 53.51 2jxw s ASP 74 Cb -0.56 -0.39 0.00 0.00 1.07 0.00 0.00 42.92 43.05 2jxw s ASP 74 CO 0.45 -0.23 0.07 0.47 1.18 0.00 0.00 175.17 177.11