#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 1.84 0.01 -0.24 -0.02 -1.26 -4.61 135.00 130.72 2jxw n PRO 2 Ca 0.00 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2jxw n PRO 2 Cb 0.00 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.06 2jxw n PRO 2 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2jxw n SER 3 N 4.24 -0.21 -0.51 2.55 2.88 -1.26 -5.17 113.62 116.15 2jxw n SER 3 Ca 0.20 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 2jxw n SER 3 Cb 0.25 0.44 0.00 0.00 -0.75 0.00 0.00 64.21 64.15 2jxw n SER 3 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2jxw n LYS 4 N -2.34 -1.37 -1.93 -1.46 4.76 -1.26 -5.05 118.16 109.51 2jxw n LYS 4 Ca 0.00 1.05 -0.01 0.00 -2.87 0.00 0.00 58.31 56.48 2jxw n LYS 4 Cb 0.00 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 31.91 2jxw n LYS 4 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jxw n GLY 5 N -1.63 -0.75 3.24 0.72 0.00 -1.26 -5.07 105.19 100.44 2jxw n GLY 5 Ca 0.00 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 2jxw n GLY 5 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jxw n ARG 6 N -0.26 3.65 -4.96 1.61 5.12 -1.26 -4.98 116.66 115.59 2jxw n ARG 6 Ca -0.10 -4.09 -0.32 0.00 -1.93 0.00 0.00 57.85 51.41 2jxw n ARG 6 Cb 0.57 -2.79 -0.14 0.00 -1.16 0.00 0.00 32.46 28.94 2jxw n ARG 6 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2jxw s TRP 7 N -0.23 2.65 -0.03 -1.55 0.52 -1.26 -3.48 118.94 115.56 2jxw s TRP 7 Ca 0.37 -0.35 0.04 0.00 0.02 0.00 0.00 56.10 56.18 2jxw s TRP 7 Cb -0.01 -1.65 -0.03 0.00 -1.15 0.00 0.00 33.47 30.63 2jxw s TRP 7 CO -0.00 0.04 -0.15 0.54 0.02 0.00 0.00 176.95 177.40 2jxw s VAL 8 N -0.45 3.03 -0.12 4.03 0.11 -0.92 -4.94 120.40 121.15 2jxw s VAL 8 Ca 0.05 -0.80 -0.16 0.00 -2.93 0.00 0.00 61.98 58.14 2jxw s VAL 8 Cb -0.12 -2.21 -0.05 0.00 -1.53 0.00 0.00 36.38 32.48 2jxw s VAL 8 CO 0.02 0.54 0.38 -0.70 -3.33 0.00 0.00 175.10 172.01 2jxw s GLU 9 N -0.87 4.23 0.04 1.54 2.12 -1.26 -2.51 118.70 121.98 2jxw s GLU 9 Ca 0.12 0.28 0.03 0.00 0.36 0.00 0.00 54.97 55.76 2jxw s GLU 9 Cb -0.11 -3.40 -0.02 0.00 0.26 0.00 0.00 34.13 30.87 2jxw s GLU 9 CO 0.02 0.28 -0.08 0.20 -0.54 0.00 0.00 175.26 175.13 2jxw s GLY 10 N 0.29 0.53 0.08 -1.50 0.00 0.19 -5.00 107.32 101.90 2jxw s GLY 10 Ca 0.21 -0.72 -0.15 0.00 0.00 0.00 0.00 44.72 44.06 2jxw s GLY 10 CO 0.08 -0.76 0.49 -0.42 0.00 0.00 0.00 173.10 172.49 2jxw s ILE 11 N -1.18 4.92 0.25 0.90 -1.09 -1.26 -1.00 121.20 122.73 2jxw s ILE 11 Ca -0.07 0.85 0.08 0.00 -2.23 0.00 0.00 60.65 59.29 2jxw s ILE 11 Cb -0.09 -3.75 -0.05 0.00 -1.58 0.00 0.00 42.46 36.99 2jxw s ILE 11 CO 0.01 0.41 -0.13 0.42 -1.23 0.00 0.00 174.94 174.41 2jxw s THR 12 N -1.28 1.90 0.55 2.92 -4.23 -0.46 -4.92 115.64 110.11 2jxw s THR 12 Ca 0.31 -2.23 -0.18 0.00 -1.18 0.00 0.00 61.69 58.42 2jxw s THR 12 Cb -0.16 -2.26 -0.10 0.00 1.34 0.00 0.00 72.50 71.32 2jxw s THR 12 CO 0.17 -0.44 0.37 -0.24 -0.54 0.00 0.00 174.62 173.94 2jxw n SER 13 N -0.52 -1.67 0.00 3.99 2.88 -1.26 -2.47 113.62 114.57 2jxw n SER 13 Ca -0.06 0.72 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 2jxw n SER 13 Cb 0.61 -1.09 0.00 0.00 -0.75 0.00 0.00 64.21 62.98 2jxw n SER 13 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2jxw n GLU 14 N 0.35 0.00 0.00 -1.46 4.07 -1.26 -3.98 120.64 118.36 2jxw n GLU 14 Ca 0.11 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.21 2jxw n GLU 14 Cb 0.47 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.85 2jxw n GLU 14 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jxw n GLY 15 N 0.00 -0.27 3.46 8.31 0.00 -1.03 -4.79 105.19 110.87 2jxw n GLY 15 Ca 0.00 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 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 2.27 -0.23 1.61 2.02 -1.18 -4.87 117.35 116.97 2jxw s TYR 16 Ca 0.00 -0.34 -0.01 0.00 -0.37 0.00 0.00 57.07 56.35 2jxw s TYR 16 Cb 0.00 -0.99 0.02 0.00 -0.40 0.00 0.00 41.96 40.59 2jxw s TYR 16 CO 0.00 0.70 -0.09 -1.01 -1.57 0.00 0.00 175.55 173.58 2jxw s HIS 17 N -2.48 2.99 0.13 2.71 3.76 -1.26 -1.35 115.29 119.78 2jxw s HIS 17 Ca 0.29 -1.48 0.07 0.00 -0.15 0.00 0.00 55.06 53.78 2jxw s HIS 17 Cb -0.05 -2.03 -0.04 0.00 1.11 0.00 0.00 32.58 31.57 2jxw s HIS 17 CO 0.14 -0.72 -0.04 1.52 -0.85 0.00 0.00 174.74 174.80 2jxw s TYR 18 N 1.34 2.84 0.10 1.40 1.13 -0.17 -4.90 117.35 119.08 2jxw s TYR 18 Ca 0.02 -0.12 0.09 0.00 -1.41 0.00 0.00 57.07 55.65 2jxw s TYR 18 Cb -0.15 -1.43 -0.03 0.00 -1.10 0.00 0.00 41.96 39.24 2jxw s TYR 18 CO -0.06 0.48 -0.22 0.71 -2.51 0.00 0.00 175.55 173.95 2jxw s TYR 19 N -1.45 1.88 0.02 -3.49 2.02 -0.37 -0.64 117.35 115.32 2jxw s TYR 19 Ca 0.25 -0.41 0.02 0.00 -0.37 0.00 0.00 57.07 56.56 2jxw s TYR 19 Cb -0.10 -1.04 -0.02 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 0.00 175.55 173.81 2jxw s TYR 20 N -1.09 0.66 -0.21 2.71 5.04 -1.04 0.59 117.35 124.00 2jxw s TYR 20 Ca 0.08 -0.32 -0.05 0.00 -2.44 0.00 0.00 57.07 54.35 2jxw s TYR 20 Cb -0.10 -0.40 -0.02 0.00 0.35 0.00 0.00 41.96 41.79 2jxw s TYR 20 CO 0.04 -0.04 -0.01 0.34 -1.34 0.00 0.00 175.55 174.54 2jxw s ASP 21 N -0.93 4.63 0.22 4.32 -1.08 -0.78 -2.16 116.67 120.90 2jxw s ASP 21 Ca -0.04 -0.28 0.16 0.00 -0.52 0.00 0.00 52.55 51.88 2jxw s ASP 21 Cb -0.06 -1.80 0.02 0.00 -1.46 0.00 0.00 42.92 39.62 2jxw s ASP 21 CO 0.00 0.02 1.27 0.17 0.52 0.00 0.00 175.17 177.16 2jxw h LEU 22 N 7.78 0.00 0.97 -1.34 -0.00 -1.88 -0.92 115.31 119.92 2jxw h LEU 22 Ca -0.38 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.45 2jxw h LEU 22 Cb 1.17 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.84 2jxw h LEU 22 CO 0.60 0.48 -0.47 0.40 -0.00 0.00 0.00 178.44 179.45 2jxw h ILE 23 N 0.00 0.01 0.08 0.15 2.04 -1.94 -3.32 117.51 114.54 2jxw h ILE 23 Ca -0.04 -0.04 -0.31 0.00 1.00 0.00 0.00 64.86 65.47 2jxw h ILE 23 Cb 1.41 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 2jxw h ILE 23 CO 0.06 0.00 -1.62 0.28 0.00 0.00 0.00 178.15 176.87 2jxw h SER 24 N -1.34 0.27 -1.43 1.72 0.02 -1.97 -3.49 113.55 107.34 2jxw h SER 24 Ca -0.13 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.37 2jxw h SER 24 Cb 1.00 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.45 2jxw h SER 24 CO 0.22 1.38 0.00 0.61 -1.14 0.00 0.00 176.83 177.90 2jxw n GLY 25 N 1.67 0.76 2.99 -3.77 0.00 -0.38 -5.11 105.19 101.36 2jxw n GLY 25 Ca -0.18 -0.44 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.38 -0.24 -0.05 4.61 0.00 -1.03 -5.00 121.76 117.67 2jxw s ALA 26 Ca 0.00 0.20 -0.23 0.00 0.00 0.00 0.00 51.96 51.93 2jxw s ALA 26 Cb 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 2jxw s ALA 26 CO 0.00 -0.07 0.69 -1.12 0.00 0.00 0.00 175.76 175.25 2jxw s SER 27 N -0.18 7.00 0.34 0.00 0.01 -1.26 -1.86 113.70 117.75 2jxw s SER 27 Ca -0.02 1.20 0.06 0.00 1.31 0.00 0.00 55.95 58.50 2jxw s SER 27 Cb -0.02 -2.41 -0.07 0.00 0.21 0.00 0.00 66.02 63.73 2jxw s SER 27 CO 0.00 -0.07 0.01 -1.58 0.41 0.00 0.00 173.24 172.02 2jxw s GLN 28 N 0.55 1.73 0.00 12.44 2.00 0.20 -5.00 119.66 131.58 2jxw s GLN 28 Ca 0.36 -1.95 0.00 0.00 -2.00 0.00 0.00 55.36 51.78 2jxw s GLN 28 Cb -0.18 -1.20 0.00 0.00 0.80 0.00 0.00 33.01 32.43 2jxw s GLN 28 CO 0.18 -0.08 0.00 0.91 -0.50 0.00 0.00 175.29 175.80 2jxw n TRP 29 N -0.75 0.00 -2.21 1.67 7.02 -1.26 -1.24 117.44 120.67 2jxw n TRP 29 Ca -0.04 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.02 2jxw n TRP 29 Cb 0.66 0.12 -0.03 0.00 -2.42 0.00 0.00 31.31 29.64 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 -1.87 4.30 -0.02 -0.99 0.41 -1.26 -4.61 118.70 114.66 2jxw s GLU 30 Ca 0.00 2.00 -0.30 0.00 -0.41 0.00 0.00 54.97 56.26 2jxw s GLU 30 Cb 0.00 -3.49 -0.06 0.00 -1.78 0.00 0.00 34.13 28.80 2jxw s GLU 30 CO 0.00 -0.53 1.58 0.21 -0.49 0.00 0.00 175.26 176.03 2jxw s LYS 31 N 2.03 4.21 1.15 1.61 2.20 -1.26 -5.00 119.74 124.68 2jxw s LYS 31 Ca 0.64 2.15 -0.19 0.00 -0.36 0.00 0.00 55.97 58.21 2jxw s LYS 31 Cb -0.33 -3.80 0.27 0.00 -1.51 0.00 0.00 37.83 32.46 2jxw s LYS 31 CO 0.28 -0.76 1.19 -1.25 -0.36 0.00 0.00 175.35 174.45 2jxw s PRO 32 N 3.34 -0.81 -1.30 4.03 0.04 -1.26 -4.93 135.00 134.11 2jxw s PRO 32 Ca 0.71 -0.28 -0.14 0.00 0.04 0.00 0.00 61.00 61.33 2jxw s PRO 32 Cb -0.34 -1.66 0.12 0.00 0.04 0.00 0.00 34.50 32.66 2jxw s PRO 32 CO 0.29 -3.40 1.76 -1.91 0.04 0.00 0.00 177.00 173.78 2jxw n GLU 33 N -4.50 3.29 0.00 4.56 2.13 -1.26 -4.02 120.64 120.84 2jxw n GLU 33 Ca 0.15 -3.39 0.00 0.00 0.66 0.00 0.00 57.16 54.58 2jxw n GLU 33 Cb 0.60 -3.19 0.00 0.00 0.27 0.00 0.00 31.44 29.12 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 4.16 0.00 3.53 8.31 0.00 -1.26 -5.15 105.19 114.78 2jxw n GLY 34 Ca 0.44 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.21 2jxw n GLY 34 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jxw s PHE 35 N 0.00 2.15 -0.80 1.61 5.36 -1.26 -4.81 117.98 120.24 2jxw s PHE 35 Ca 0.00 -0.87 -0.02 0.00 -0.96 0.00 0.00 56.93 55.08 2jxw s PHE 35 Cb 0.00 -1.48 0.00 0.00 -0.34 0.00 0.00 43.02 41.21 2jxw s PHE 35 CO 0.00 0.16 0.28 1.04 -1.46 0.00 0.00 175.22 175.24 2jxw n GLN 36 N -0.84 -2.31 0.00 10.12 6.02 -1.26 -4.77 117.38 124.34 2jxw n GLN 36 Ca -0.04 0.47 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 2jxw n GLN 36 Cb 0.67 -4.41 0.00 0.00 1.02 0.00 0.00 30.24 27.52 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 -1.13 1.83 3.90 1.08 0.00 -1.26 -4.81 105.19 104.80 2jxw n GLY 37 Ca -0.06 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 2jxw n GLY 37 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jxw s ASP 38 N -4.00 2.82 -0.31 1.61 1.01 -1.26 -5.01 116.67 111.53 2jxw s ASP 38 Ca 0.00 0.29 0.00 0.00 0.71 0.00 0.00 52.55 53.55 2jxw s ASP 38 Cb 0.00 -0.34 0.14 0.00 1.01 0.00 0.00 42.92 43.73 2jxw s ASP 38 CO 0.00 -2.92 0.30 -0.22 0.21 0.00 0.00 175.17 172.54 2jxw s LEU 39 N -6.02 -0.09 0.38 1.23 0.20 -1.26 -5.04 118.68 108.08 2jxw s LEU 39 Ca 0.74 -1.08 0.00 0.00 0.69 0.00 0.00 54.13 54.48 2jxw s LEU 39 Cb -0.04 0.42 0.00 0.00 -0.43 0.00 0.00 46.19 46.14 2jxw s LEU 39 CO 0.53 -0.35 0.00 1.17 -0.29 0.00 0.00 176.35 177.41 2jxw n LYS 40 N 4.96 -2.53 -2.45 1.98 4.81 -1.26 -5.01 118.16 118.65 2jxw n LYS 40 Ca 0.02 1.86 -0.05 0.00 -0.87 0.00 0.00 58.31 59.27 2jxw n LYS 40 Cb 0.45 -3.03 -0.04 0.00 0.02 0.00 0.00 35.03 32.43 2jxw n LYS 40 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2jxw n LYS 41 N -3.93 -4.11 -1.86 1.64 3.00 -1.26 -4.25 118.16 107.39 2jxw n LYS 41 Ca -0.02 3.14 -0.17 0.00 -0.00 0.00 0.00 58.31 61.25 2jxw n LYS 41 Cb 0.55 -4.60 -0.05 0.00 0.00 0.00 0.00 35.03 30.94 2jxw n LYS 41 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2jxw n THR 42 N 1.51 -0.36 -4.43 3.15 -1.04 -1.26 -4.97 114.28 106.89 2jxw n THR 42 Ca -0.37 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.41 2jxw n THR 42 Cb 0.58 -2.11 -0.08 0.00 -1.82 0.00 0.00 70.33 66.90 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 -2.75 2.49 -0.47 2.41 0.00 -1.26 -5.11 121.76 117.07 2jxw s ALA 43 Ca 0.00 -1.53 0.03 0.00 0.00 0.00 0.00 51.96 50.46 2jxw s ALA 43 Cb 0.00 0.98 0.13 0.00 0.00 0.00 0.00 23.12 24.23 2jxw s ALA 43 CO 0.00 -0.44 0.24 0.08 0.00 0.00 0.00 175.76 175.64 2jxw s VAL 44 N -3.35 2.00 -0.07 0.00 1.01 -1.26 -4.85 120.40 113.88 2jxw s VAL 44 Ca 0.30 -2.88 -0.03 0.00 0.00 0.00 0.00 61.98 59.37 2jxw s VAL 44 Cb 0.03 -2.40 0.04 0.00 0.00 0.00 0.00 36.38 34.05 2jxw s VAL 44 CO 0.18 -0.83 0.09 -0.75 0.00 0.00 0.00 175.10 173.78 2jxw s LYS 45 N 0.10 -0.04 1.10 2.72 2.47 -1.26 -5.03 119.74 119.81 2jxw s LYS 45 Ca 0.17 0.36 -0.17 0.00 -1.56 0.00 0.00 55.97 54.77 2jxw s LYS 45 Cb -0.25 -0.62 0.25 0.00 -1.46 0.00 0.00 37.83 35.75 2jxw s LYS 45 CO -0.01 -0.37 1.18 0.95 0.16 0.00 0.00 175.35 177.26 2jxw s THR 46 N 2.19 1.77 0.16 3.43 -4.23 -1.26 -4.88 115.64 112.82 2jxw s THR 46 Ca 0.04 0.00 0.08 0.00 -1.18 0.00 0.00 61.69 60.63 2jxw s THR 46 Cb -0.13 -2.66 -0.16 0.00 1.34 0.00 0.00 72.50 70.89 2jxw s THR 46 CO -0.04 0.00 1.37 1.62 -0.54 0.00 0.00 174.62 177.03 2jxw h VAL 47 N -2.19 1.64 -3.25 2.29 3.04 -2.01 -3.45 116.25 112.32 2jxw h VAL 47 Ca -0.46 -3.06 -0.57 0.00 -1.01 0.00 0.00 66.70 61.61 2jxw h VAL 47 Cb 1.28 2.65 -0.04 0.00 -2.01 0.00 0.00 31.29 33.17 2jxw h VAL 47 CO 0.38 0.87 -0.09 0.26 -1.01 0.00 0.00 177.57 177.98 2jxw s TRP 48 N -2.96 3.67 -0.11 3.17 0.52 -1.26 -4.25 118.94 117.72 2jxw s TRP 48 Ca 0.00 1.09 -0.03 0.00 0.02 0.00 0.00 56.10 57.19 2jxw s TRP 48 Cb 0.11 -2.38 -0.03 0.00 -1.15 0.00 0.00 33.47 30.01 2jxw s TRP 48 CO 0.80 0.50 0.01 0.54 0.02 0.00 0.00 176.95 178.82 2jxw s VAL 49 N -1.33 4.35 -0.23 4.03 0.11 -0.80 -4.92 120.40 121.61 2jxw s VAL 49 Ca 0.34 -0.22 -0.19 0.00 -2.93 0.00 0.00 61.98 58.97 2jxw s VAL 49 Cb -0.16 -2.86 -0.03 0.00 -1.53 0.00 0.00 36.38 31.80 2jxw s VAL 49 CO 0.18 0.57 0.57 -0.70 -3.33 0.00 0.00 175.10 172.39 2jxw s GLU 50 N -0.55 4.14 0.28 1.54 -6.30 -1.26 -2.50 118.70 114.05 2jxw s GLU 50 Ca 0.09 0.46 0.12 0.00 -2.50 0.00 0.00 54.97 53.14 2jxw s GLU 50 Cb -0.12 -3.61 -0.05 0.00 0.00 0.00 0.00 34.13 30.35 2jxw s GLU 50 CO 0.02 -0.29 -0.18 0.20 0.02 0.00 0.00 175.26 175.04 2jxw s GLY 51 N 1.35 1.89 -0.12 -1.50 0.00 0.15 -4.97 107.32 104.12 2jxw s GLY 51 Ca 0.25 -1.88 -0.00 0.00 0.00 0.00 0.00 44.72 43.09 2jxw s GLY 51 CO 0.09 -1.95 -0.11 -2.27 0.00 0.00 0.00 173.10 168.86 2jxw s LEU 52 N -3.53 2.84 0.02 0.66 2.96 -1.26 -0.66 118.68 119.71 2jxw s LEU 52 Ca 0.30 -0.26 -0.04 0.00 -0.22 0.00 0.00 54.13 53.91 2jxw s LEU 52 Cb -0.05 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.99 2jxw s LEU 52 CO 0.16 0.20 0.06 -0.44 -1.32 0.00 0.00 176.35 175.00 2jxw s SER 53 N 0.17 0.17 0.67 3.68 0.01 0.72 -4.95 113.70 114.17 2jxw s SER 53 Ca -0.06 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 56.76 2jxw s SER 53 Cb -0.15 0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.25 2jxw s SER 53 CO 0.04 -0.39 0.00 1.21 0.41 0.00 0.00 173.24 174.51 2jxw n GLU 54 N 1.26 0.00 0.20 12.44 2.13 -1.26 0.73 120.64 136.14 2jxw n GLU 54 Ca -0.22 0.00 0.16 0.00 0.66 0.00 0.00 57.16 57.77 2jxw n GLU 54 Cb 0.56 0.00 0.81 0.00 0.27 0.00 0.00 31.44 33.08 2jxw n GLU 54 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2jxw h ASP 55 N 2.40 0.00 0.00 4.31 5.19 -2.00 -3.40 116.42 122.92 2jxw h ASP 55 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2jxw h ASP 55 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2jxw h ASP 55 CO 0.00 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.73 2jxw n GLY 56 N -1.43 0.00 3.83 2.75 0.00 -1.19 -5.08 105.19 104.07 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 3.64 -0.27 1.61 0.40 0.23 -4.90 117.98 118.68 2jxw s PHE 57 Ca 0.00 0.79 -0.14 0.00 -0.60 0.00 0.00 56.93 56.98 2jxw s PHE 57 Cb 0.00 -2.21 -0.04 0.00 0.51 0.00 0.00 43.02 41.28 2jxw s PHE 57 CO 0.00 0.59 0.33 0.99 0.70 0.00 0.00 175.22 177.83 2jxw s THR 58 N -0.75 5.21 0.05 0.64 2.01 -1.26 -0.20 115.64 121.34 2jxw s THR 58 Ca 0.20 0.48 0.06 0.00 0.31 0.00 0.00 61.69 62.74 2jxw s THR 58 Cb -0.15 -3.66 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 2jxw s THR 58 CO 0.09 0.18 -0.11 -0.72 -0.69 0.00 0.00 174.62 173.37 2jxw s TYR 59 N 1.99 2.74 0.01 4.92 -0.85 0.17 -4.76 117.35 121.57 2jxw s TYR 59 Ca 0.13 -0.14 0.09 0.00 -0.52 0.00 0.00 57.07 56.62 2jxw s TYR 59 Cb -0.16 -1.51 -0.02 0.00 0.38 0.00 0.00 41.96 40.65 2jxw s TYR 59 CO 0.10 0.35 -0.26 0.71 -1.52 0.00 0.00 175.55 174.93 2jxw s TYR 60 N -1.04 2.33 0.07 -3.49 2.02 -0.79 0.31 117.35 116.76 2jxw s TYR 60 Ca 0.18 -0.42 0.05 0.00 -0.37 0.00 0.00 57.07 56.50 2jxw s TYR 60 Cb -0.11 -1.45 -0.03 0.00 -0.40 0.00 0.00 41.96 39.97 2jxw s TYR 60 CO 0.09 0.04 -0.14 -0.47 -1.57 0.00 0.00 175.55 173.49 2jxw s TYR 61 N -0.70 1.21 -0.15 2.71 5.04 -1.04 0.95 117.35 125.38 2jxw s TYR 61 Ca 0.11 -0.45 -0.01 0.00 -2.44 0.00 0.00 57.07 54.28 2jxw s TYR 61 Cb -0.10 -0.69 -0.01 0.00 0.35 0.00 0.00 41.96 41.51 2jxw s TYR 61 CO 0.00 0.06 -0.11 1.21 -1.34 0.00 0.00 175.55 175.37 2jxw s ASN 62 N -1.68 4.11 0.40 4.32 3.84 -1.17 -1.91 114.94 122.85 2jxw s ASN 62 Ca -0.02 -0.32 0.22 0.00 0.21 0.00 0.00 52.86 52.95 2jxw s ASN 62 Cb -0.10 -1.64 0.28 0.00 -0.55 0.00 0.00 41.25 39.24 2jxw s ASN 62 CO 0.02 0.14 1.53 0.71 -2.79 0.00 0.00 177.10 176.70 2jxw h THR 63 N 5.43 0.05 0.62 -5.21 1.35 -1.93 -1.70 112.91 111.51 2jxw h THR 63 Ca -0.29 -1.07 -0.03 0.00 -0.55 0.00 0.00 66.41 64.47 2jxw h THR 63 Cb 1.20 1.96 0.00 0.00 -1.73 0.00 0.00 68.15 69.58 2jxw h THR 63 CO 0.57 0.03 -0.35 -0.08 -0.25 0.00 0.00 175.52 175.44 2jxw h GLU 64 N 0.00 -0.87 0.00 4.72 4.81 -1.94 -3.38 114.58 117.92 2jxw h GLU 64 Ca -0.00 0.06 -0.40 0.00 -0.13 0.00 0.00 59.36 58.89 2jxw h GLU 64 Cb 1.02 0.20 -0.07 0.00 0.63 0.00 0.00 28.75 30.53 2jxw h GLU 64 CO 0.00 -0.58 -2.48 -2.37 -0.73 0.00 0.00 179.01 172.85 2jxw n THR 65 N -4.62 1.50 0.00 0.32 5.66 -1.26 -5.07 114.28 110.81 2jxw n THR 65 Ca -0.11 -0.54 0.00 0.00 -3.05 0.00 0.00 64.05 60.35 2jxw n THR 65 Cb 0.37 -1.50 0.00 0.00 -1.55 0.00 0.00 70.33 67.65 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 2.10 0.82 2.79 1.09 0.00 -0.64 -5.11 105.19 106.24 2jxw n GLY 66 Ca -0.47 -0.81 -0.18 0.00 0.00 0.00 0.00 46.02 44.55 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 -1.69 0.31 0.46 1.61 2.12 -1.22 -4.97 118.70 115.31 2jxw s GLU 67 Ca 0.00 0.12 -0.21 0.00 0.36 0.00 0.00 54.97 55.24 2jxw s GLU 67 Cb 0.00 -0.57 -0.10 0.00 0.26 0.00 0.00 34.13 33.72 2jxw s GLU 67 CO 0.00 -0.19 0.99 -1.54 -0.54 0.00 0.00 175.26 173.98 2jxw s SER 68 N 1.33 6.67 0.12 -1.70 1.04 -1.26 -3.01 113.70 116.88 2jxw s SER 68 Ca -0.05 1.79 0.04 0.00 0.48 0.00 0.00 55.95 58.20 2jxw s SER 68 Cb -0.13 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.40 2jxw s SER 68 CO -0.02 -0.55 -0.09 -0.60 0.98 0.00 0.00 173.24 172.95 2jxw s ARG 69 N -3.23 0.92 -0.14 4.02 3.52 0.27 -4.98 118.95 119.34 2jxw s ARG 69 Ca 0.64 -1.30 0.16 0.00 -0.13 0.00 0.00 55.73 55.10 2jxw s ARG 69 Cb -0.12 -0.50 0.40 0.00 -1.56 0.00 0.00 34.95 33.16 2jxw s ARG 69 CO 0.16 0.06 1.19 0.91 -0.81 0.00 0.00 175.30 176.82 2jxw n TRP 70 N 0.17 0.00 -3.73 5.12 7.02 -1.26 -1.88 117.44 122.88 2jxw n TRP 70 Ca -0.13 -1.12 -0.14 0.00 -1.02 0.00 0.00 57.50 55.09 2jxw n TRP 70 Cb 0.59 -0.21 -0.08 0.00 -2.42 0.00 0.00 31.31 29.19 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 -2.16 0.69 -0.29 -0.99 8.01 -1.26 -5.03 118.70 117.68 2jxw s GLU 71 Ca 0.35 -0.04 -0.29 0.00 0.01 0.00 0.00 54.97 55.00 2jxw s GLU 71 Cb 0.36 0.31 -0.00 0.00 -4.31 0.00 0.00 34.13 30.48 2jxw s GLU 71 CO -0.09 -0.19 1.38 0.21 0.01 0.00 0.00 175.26 176.59 2jxw s LYS 72 N -1.12 3.87 0.50 1.61 2.20 -1.26 -4.88 119.74 120.66 2jxw s LYS 72 Ca -0.12 1.33 -0.22 0.00 -0.36 0.00 0.00 55.97 56.61 2jxw s LYS 72 Cb -0.04 -3.92 -0.07 0.00 -1.51 0.00 0.00 37.83 32.29 2jxw s LYS 72 CO 0.04 -1.19 1.18 -1.25 -0.36 0.00 0.00 175.35 173.78 2jxw s PRO 73 N 4.33 3.56 0.28 4.03 0.04 -1.26 -5.05 135.00 140.93 2jxw s PRO 73 Ca 0.60 1.78 0.04 0.00 0.04 0.00 0.00 61.00 63.47 2jxw s PRO 73 Cb -0.18 -2.27 -0.03 0.00 0.04 0.00 0.00 34.50 32.06 2jxw s PRO 73 CO 0.25 -0.72 0.42 0.16 0.04 0.00 0.00 177.00 177.15 2jxw s ASP 74 N -1.43 6.26 0.00 6.66 -4.77 -1.26 -5.24 116.67 116.88 2jxw s ASP 74 Ca 0.67 0.11 0.00 0.00 -3.30 0.00 0.00 52.55 50.04 2jxw s ASP 74 Cb -0.29 -1.80 0.00 0.00 -1.09 0.00 0.00 42.92 39.74 2jxw s ASP 74 CO 0.34 -0.18 0.00 -0.90 0.70 0.00 0.00 175.17 175.13