#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 2.75 -0.19 -0.67 0.04 -1.26 -4.82 135.00 130.85 2jxw s PRO 2 Ca 0.00 0.76 -0.16 0.00 0.04 0.00 0.00 61.00 61.64 2jxw s PRO 2 Cb 0.00 -4.35 -0.07 0.00 0.04 0.00 0.00 34.50 30.12 2jxw s PRO 2 CO 0.00 -2.57 -0.30 -1.13 0.04 0.00 0.00 177.00 173.04 2jxw n SER 3 N 12.31 1.92 -1.36 6.66 3.41 -1.26 -5.09 113.62 130.20 2jxw n SER 3 Ca 0.21 0.38 -0.03 0.00 -0.26 0.00 0.00 58.87 59.17 2jxw n SER 3 Cb 0.51 -0.78 -0.01 0.00 -0.26 0.00 0.00 64.21 63.67 2jxw n SER 3 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jxw n LYS 4 N -4.44 0.09 0.00 4.33 5.02 -1.26 -5.02 118.16 116.88 2jxw n LYS 4 Ca -0.21 -0.52 0.00 0.00 -2.02 0.00 0.00 58.31 55.55 2jxw n LYS 4 Cb 0.56 0.46 0.00 0.00 -0.02 0.00 0.00 35.03 36.03 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 -0.10 1.76 3.02 0.72 0.00 -1.26 -4.91 105.19 104.41 2jxw n GLY 5 Ca 0.01 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 2.72 -4.31 1.61 1.74 -1.26 -4.53 116.66 112.63 2jxw n ARG 6 Ca 0.00 -2.67 -0.28 0.00 -0.77 0.00 0.00 57.85 54.12 2jxw n ARG 6 Cb 0.00 -3.32 -0.11 0.00 -1.02 0.00 0.00 32.46 28.01 2jxw n ARG 6 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2jxw s TRP 7 N 4.02 2.54 -0.07 -1.55 0.52 -1.26 -3.57 118.94 119.56 2jxw s TRP 7 Ca 0.51 -0.26 0.04 0.00 0.02 0.00 0.00 56.10 56.40 2jxw s TRP 7 Cb 0.11 -1.31 0.00 0.00 -1.15 0.00 0.00 33.47 31.12 2jxw s TRP 7 CO -0.01 0.43 -0.18 0.08 0.02 0.00 0.00 176.95 177.29 2jxw s VAL 8 N -1.33 1.56 -0.11 4.03 1.01 -0.75 -4.93 120.40 119.88 2jxw s VAL 8 Ca 0.20 -0.75 -0.19 0.00 0.00 0.00 0.00 61.98 61.24 2jxw s VAL 8 Cb -0.10 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2jxw s VAL 8 CO 0.11 0.45 0.53 -0.70 0.00 0.00 0.00 175.10 175.49 2jxw s GLU 9 N 0.37 4.36 0.04 2.72 2.12 -1.26 -2.15 118.70 124.90 2jxw s GLU 9 Ca -0.13 0.54 0.03 0.00 0.36 0.00 0.00 54.97 55.77 2jxw s GLU 9 Cb -0.15 -3.44 -0.02 0.00 0.26 0.00 0.00 34.13 30.78 2jxw s GLU 9 CO 0.05 0.14 -0.09 0.20 -0.54 0.00 0.00 175.26 175.03 2jxw s GLY 10 N 0.65 0.53 -0.00 -1.50 0.00 -0.01 -5.01 107.32 101.98 2jxw s GLY 10 Ca 0.28 -0.73 -0.06 0.00 0.00 0.00 0.00 44.72 44.21 2jxw s GLY 10 CO 0.12 -0.76 0.25 -0.42 0.00 0.00 0.00 173.10 172.29 2jxw s ILE 11 N -1.18 5.33 0.20 0.90 -1.09 -1.26 -1.36 121.20 122.73 2jxw s ILE 11 Ca -0.07 0.16 0.05 0.00 -2.23 0.00 0.00 60.65 58.56 2jxw s ILE 11 Cb -0.09 -3.55 -0.05 0.00 -1.58 0.00 0.00 42.46 37.19 2jxw s ILE 11 CO 0.01 0.39 -0.08 -0.89 -1.23 0.00 0.00 174.94 173.13 2jxw s THR 12 N -1.27 1.35 0.54 2.92 2.01 -0.51 -4.95 115.64 115.73 2jxw s THR 12 Ca 0.26 -2.10 -0.18 0.00 0.31 0.00 0.00 61.69 59.98 2jxw s THR 12 Cb -0.13 -2.12 -0.11 0.00 0.01 0.00 0.00 72.50 70.15 2jxw s THR 12 CO 0.15 -0.53 0.34 -1.20 -0.69 0.00 0.00 174.62 172.69 2jxw n SER 13 N -0.36 -1.79 0.00 3.53 7.64 -1.26 -2.47 113.62 118.91 2jxw n SER 13 Ca -0.08 0.73 0.00 0.00 1.01 0.00 0.00 58.87 60.53 2jxw n SER 13 Cb 0.62 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 2jxw n SER 13 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2jxw n GLU 14 N 0.45 0.00 0.00 1.43 2.13 -1.26 -3.87 120.64 119.52 2jxw n GLU 14 Ca 0.11 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.93 2jxw n GLU 14 Cb 0.47 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.18 2jxw n GLU 14 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jxw n GLY 15 N 0.00 -0.10 3.36 8.31 0.00 -1.03 -5.16 105.19 110.56 2jxw n GLY 15 Ca 0.00 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 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 2.64 -0.32 1.61 2.02 -1.20 -4.98 117.35 117.12 2jxw s TYR 16 Ca 0.00 -0.56 -0.14 0.00 -0.37 0.00 0.00 57.07 56.01 2jxw s TYR 16 Cb 0.00 -1.69 -0.02 0.00 -0.40 0.00 0.00 41.96 39.85 2jxw s TYR 16 CO 0.00 -0.11 0.30 -1.01 -1.57 0.00 0.00 175.55 173.15 2jxw s HIS 17 N -0.13 3.22 0.12 2.71 3.76 -1.26 -1.42 115.29 122.29 2jxw s HIS 17 Ca -0.03 0.01 0.06 0.00 -0.15 0.00 0.00 55.06 54.96 2jxw s HIS 17 Cb -0.14 -2.55 -0.04 0.00 1.11 0.00 0.00 32.58 30.96 2jxw s HIS 17 CO 0.04 -0.33 -0.03 1.52 -0.85 0.00 0.00 174.74 175.08 2jxw s TYR 18 N 1.89 2.86 0.10 1.40 1.13 -0.47 -4.75 117.35 119.53 2jxw s TYR 18 Ca 0.10 -0.10 0.09 0.00 -1.41 0.00 0.00 57.07 55.74 2jxw s TYR 18 Cb -0.17 -1.46 -0.03 0.00 -1.10 0.00 0.00 41.96 39.20 2jxw s TYR 18 CO 0.11 0.47 -0.22 0.71 -2.51 0.00 0.00 175.55 174.11 2jxw s TYR 19 N -1.40 1.88 0.07 -3.49 2.02 0.19 -0.83 117.35 115.78 2jxw s TYR 19 Ca 0.25 -0.41 0.07 0.00 -0.37 0.00 0.00 57.07 56.61 2jxw s TYR 19 Cb -0.11 -1.03 -0.03 0.00 -0.40 0.00 0.00 41.96 40.39 2jxw s TYR 19 CO 0.17 0.22 -0.19 -0.47 -1.57 0.00 0.00 175.55 173.70 2jxw s TYR 20 N -1.11 1.68 -0.17 2.71 6.14 -0.91 0.10 117.35 125.79 2jxw s TYR 20 Ca 0.08 -0.39 0.01 0.00 0.64 0.00 0.00 57.07 57.40 2jxw s TYR 20 Cb -0.10 -0.96 0.01 0.00 0.42 0.00 0.00 41.96 41.33 2jxw s TYR 20 CO 0.04 0.13 -0.19 0.34 0.64 0.00 0.00 175.55 176.51 2jxw s ASP 21 N -1.49 3.28 0.20 4.32 2.15 -0.80 -1.82 116.67 122.51 2jxw s ASP 21 Ca 0.06 -0.59 0.13 0.00 0.43 0.00 0.00 52.55 52.57 2jxw s ASP 21 Cb -0.09 -1.50 -0.05 0.00 -0.30 0.00 0.00 42.92 40.98 2jxw s ASP 21 CO 0.03 0.03 1.30 0.17 -0.17 0.00 0.00 175.17 176.53 2jxw h LEU 22 N 7.70 0.00 -0.19 -1.34 -0.00 -1.89 0.30 115.31 119.89 2jxw h LEU 22 Ca -0.40 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.49 2jxw h LEU 22 Cb 1.16 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.80 2jxw h LEU 22 CO 0.60 0.68 0.07 0.40 -0.00 0.00 0.00 178.44 180.19 2jxw h ILE 23 N 0.00 0.97 0.00 0.15 2.04 -1.95 -3.31 117.51 115.41 2jxw h ILE 23 Ca -0.03 -0.06 -0.37 0.00 1.00 0.00 0.00 64.86 65.41 2jxw h ILE 23 Cb 1.54 0.79 -0.07 0.00 -0.74 0.00 0.00 36.82 38.34 2jxw h ILE 23 CO 0.08 0.03 -2.38 -1.20 0.00 0.00 0.00 178.15 174.68 2jxw n SER 24 N -5.04 1.23 -0.62 1.72 7.64 -1.25 -5.05 113.62 112.25 2jxw n SER 24 Ca -0.03 -0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.78 2jxw n SER 24 Cb 0.06 0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 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 2.08 0.52 3.08 0.23 0.00 0.10 -5.09 105.19 106.11 2jxw n GLY 25 Ca -0.38 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.21 0.57 0.09 4.61 0.00 -1.10 -4.98 121.76 118.74 2jxw s ALA 26 Ca 0.00 -0.98 -0.13 0.00 0.00 0.00 0.00 51.96 50.85 2jxw s ALA 26 Cb 0.00 0.15 -0.06 0.00 0.00 0.00 0.00 23.12 23.20 2jxw s ALA 26 CO 0.00 -0.18 0.48 -1.54 0.00 0.00 0.00 175.76 174.52 2jxw s SER 27 N -2.23 6.79 0.24 0.00 1.04 -1.26 -1.90 113.70 116.37 2jxw s SER 27 Ca -0.02 0.99 0.02 0.00 0.48 0.00 0.00 55.95 57.41 2jxw s SER 27 Cb -0.02 -2.25 -0.05 0.00 0.10 0.00 0.00 66.02 63.80 2jxw s SER 27 CO -0.04 0.18 0.07 -1.58 0.98 0.00 0.00 173.24 172.86 2jxw s GLN 28 N -1.69 1.35 0.00 4.02 0.74 0.28 -4.99 119.66 119.37 2jxw s GLN 28 Ca 0.33 -1.72 0.00 0.00 0.05 0.00 0.00 55.36 54.02 2jxw s GLN 28 Cb -0.15 -0.30 0.00 0.00 1.10 0.00 0.00 33.01 33.66 2jxw s GLN 28 CO 0.18 -0.25 0.00 0.91 -0.55 0.00 0.00 175.29 175.58 2jxw n TRP 29 N -0.42 0.00 -2.36 1.67 7.02 -1.26 -0.64 117.44 121.44 2jxw n TRP 29 Ca -0.02 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.04 2jxw n TRP 29 Cb 0.66 0.14 -0.03 0.00 -2.42 0.00 0.00 31.31 29.66 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 -1.92 4.32 0.34 -0.99 8.01 -1.26 -4.65 118.70 122.55 2jxw s GLU 30 Ca 0.00 1.79 -0.29 0.00 0.01 0.00 0.00 54.97 56.49 2jxw s GLU 30 Cb 0.00 -3.56 -0.11 0.00 -4.31 0.00 0.00 34.13 26.15 2jxw s GLU 30 CO 0.00 -0.50 1.52 0.21 0.01 0.00 0.00 175.26 176.50 2jxw s LYS 31 N 2.28 4.13 1.31 1.61 2.20 -1.26 -4.98 119.74 125.04 2jxw s LYS 31 Ca 0.59 2.55 -0.22 0.00 -0.36 0.00 0.00 55.97 58.53 2jxw s LYS 31 Cb -0.27 -3.00 0.34 0.00 -1.51 0.00 0.00 37.83 33.39 2jxw s LYS 31 CO 0.24 -0.55 0.78 -2.30 -0.36 0.00 0.00 175.35 173.15 2jxw n PRO 32 N 1.18 -4.59 -1.13 4.03 -0.02 -1.26 -4.89 135.00 128.32 2jxw n PRO 32 Ca 0.04 -1.30 -0.25 0.00 -2.02 0.00 0.00 63.50 59.97 2jxw n PRO 32 Cb 0.39 -1.69 0.05 0.00 -0.02 0.00 0.00 33.50 32.22 2jxw n PRO 32 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2jxw n GLU 33 N -5.41 2.20 0.00 -0.52 1.02 -1.26 -4.48 120.64 112.18 2jxw n GLU 33 Ca 0.12 -2.30 0.00 0.00 -0.02 0.00 0.00 57.16 54.96 2jxw n GLU 33 Cb 0.54 -1.92 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2jxw n GLU 33 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jxw n GLY 34 N -0.09 1.00 5.00 0.62 0.00 -1.26 -5.05 105.19 105.41 2jxw n GLY 34 Ca 0.44 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.39 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 -4.62 1.61 -0.00 -1.26 -4.69 117.46 108.49 2jxw n PHE 35 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.17 2jxw n PHE 35 Cb 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 39.48 39.31 2jxw n PHE 35 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 2jxw s GLN 36 N 0.00 2.28 -0.35 -4.13 -0.21 -1.26 -4.39 119.66 111.60 2jxw s GLN 36 Ca 0.00 -0.60 -0.04 0.00 0.02 0.00 0.00 55.36 54.75 2jxw s GLN 36 Cb 0.00 -1.88 0.24 0.00 1.00 0.00 0.00 33.01 32.37 2jxw s GLN 36 CO 0.00 -0.00 1.13 0.41 -2.12 0.00 0.00 175.29 174.71 2jxw n GLY 37 N 4.00 -1.57 3.63 3.09 0.00 -1.26 -5.13 105.19 107.95 2jxw n GLY 37 Ca -0.20 1.06 -0.38 0.00 0.00 0.00 0.00 46.02 46.51 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 0.28 6.17 -1.03 1.61 1.01 -1.26 -5.02 116.67 118.44 2jxw s ASP 38 Ca 0.25 0.19 -0.23 0.00 0.71 0.00 0.00 52.55 53.47 2jxw s ASP 38 Cb 0.16 -2.15 0.02 0.00 1.01 0.00 0.00 42.92 41.96 2jxw s ASP 38 CO -0.10 -0.04 1.65 -0.76 0.21 0.00 0.00 175.17 176.13 2jxw s LEU 39 N 1.47 3.42 -0.49 1.23 1.43 -1.26 -4.79 118.68 119.68 2jxw s LEU 39 Ca 0.11 -1.36 0.01 0.00 -1.03 0.00 0.00 54.13 51.86 2jxw s LEU 39 Cb -0.15 -2.57 0.53 0.00 0.03 0.00 0.00 46.19 44.03 2jxw s LEU 39 CO 0.08 -1.91 1.92 0.29 0.23 0.00 0.00 176.35 176.96 2jxw n LYS 40 N 8.79 2.30 -1.12 1.70 4.76 -1.26 -4.30 118.16 129.04 2jxw n LYS 40 Ca 0.37 -2.85 0.01 0.00 -2.87 0.00 0.00 58.31 52.98 2jxw n LYS 40 Cb 0.49 -2.12 0.13 0.00 -1.84 0.00 0.00 35.03 31.70 2jxw n LYS 40 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2jxw n LYS 41 N -0.88 1.51 0.08 1.97 2.85 -1.26 -4.76 118.16 117.66 2jxw n LYS 41 Ca 0.56 -3.14 -0.22 0.00 -1.05 0.00 0.00 58.31 54.46 2jxw n LYS 41 Cb 1.20 -1.34 -0.15 0.00 -0.65 0.00 0.00 35.03 34.09 2jxw n LYS 41 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 2jxw h THR 42 N 2.77 1.03 -2.73 0.58 2.02 -2.01 -3.46 112.91 111.11 2jxw h THR 42 Ca -0.01 -2.61 -0.15 0.00 0.77 0.00 0.00 66.41 64.42 2jxw h THR 42 Cb 1.29 2.80 -0.28 0.00 -1.74 0.00 0.00 68.15 70.22 2jxw h THR 42 CO 0.14 0.84 -0.39 0.00 0.37 0.00 0.00 175.52 176.47 2jxw s ALA 43 N -2.59 -0.88 -1.37 6.16 0.00 -1.26 -5.06 121.76 116.75 2jxw s ALA 43 Ca -0.13 1.31 -0.08 0.00 0.00 0.00 0.00 51.96 53.05 2jxw s ALA 43 Cb 0.06 -0.97 0.10 0.00 0.00 0.00 0.00 23.12 22.30 2jxw s ALA 43 CO 0.87 -0.42 2.29 0.28 0.00 0.00 0.00 175.76 178.77 2jxw n VAL 44 N 4.70 4.64 -3.49 0.00 0.31 -1.26 -4.86 118.33 118.36 2jxw n VAL 44 Ca -0.17 -3.95 -0.10 0.00 -0.01 0.00 0.00 64.34 60.11 2jxw n VAL 44 Cb 0.52 -2.30 -0.02 0.00 -0.91 0.00 0.00 33.84 31.13 2jxw n VAL 44 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2jxw s LYS 45 N 0.28 0.93 -1.02 5.55 2.20 -1.26 -5.10 119.74 121.32 2jxw s LYS 45 Ca 0.51 -0.31 -0.18 0.00 -0.36 0.00 0.00 55.97 55.62 2jxw s LYS 45 Cb 0.15 0.43 0.13 0.00 -1.51 0.00 0.00 37.83 37.03 2jxw s LYS 45 CO -0.06 -0.40 1.26 0.99 -0.36 0.00 0.00 175.35 176.79 2jxw s THR 46 N -3.16 4.67 -0.36 3.43 2.01 -1.26 -4.81 115.64 116.16 2jxw s THR 46 Ca 0.03 -1.74 0.09 0.00 0.31 0.00 0.00 61.69 60.39 2jxw s THR 46 Cb -0.01 -4.86 0.68 0.00 0.01 0.00 0.00 72.50 68.32 2jxw s THR 46 CO -0.09 -1.61 1.68 0.55 -0.69 0.00 0.00 174.62 174.46 2jxw n VAL 47 N 5.50 2.64 -5.01 3.82 3.14 -1.26 -4.91 118.33 122.25 2jxw n VAL 47 Ca 0.29 -1.41 -0.32 0.00 -2.96 0.00 0.00 64.34 59.94 2jxw n VAL 47 Cb 0.48 -0.39 -0.14 0.00 -1.06 0.00 0.00 33.84 32.73 2jxw n VAL 47 CO 0.00 0.00 0.00 0.26 -6.46 0.00 0.00 176.83 170.63 2jxw s TRP 48 N -2.69 2.59 0.04 1.45 0.52 -1.26 -3.77 118.94 115.82 2jxw s TRP 48 Ca 0.49 -0.24 -0.07 0.00 0.02 0.00 0.00 56.10 56.30 2jxw s TRP 48 Cb 0.39 -1.59 -0.05 0.00 -1.15 0.00 0.00 33.47 31.07 2jxw s TRP 48 CO 0.12 0.12 0.32 0.54 0.02 0.00 0.00 176.95 178.07 2jxw s VAL 49 N -0.70 5.23 -0.24 4.03 0.11 -0.66 -4.88 120.40 123.28 2jxw s VAL 49 Ca 0.11 0.22 -0.16 0.00 -2.93 0.00 0.00 61.98 59.22 2jxw s VAL 49 Cb -0.10 -3.60 -0.03 0.00 -1.53 0.00 0.00 36.38 31.11 2jxw s VAL 49 CO 0.00 0.30 0.43 -0.70 -3.33 0.00 0.00 175.10 171.80 2jxw s GLU 50 N -1.91 4.10 0.17 1.54 2.12 -1.26 -2.36 118.70 121.10 2jxw s GLU 50 Ca 0.31 0.19 0.11 0.00 0.36 0.00 0.00 54.97 55.94 2jxw s GLU 50 Cb -0.13 -3.61 -0.04 0.00 0.26 0.00 0.00 34.13 30.61 2jxw s GLU 50 CO 0.18 -0.20 -0.22 0.20 -0.54 0.00 0.00 175.26 174.67 2jxw s GLY 51 N 1.37 1.68 -0.08 -1.50 0.00 0.19 -4.99 107.32 104.00 2jxw s GLY 51 Ca 0.18 -1.56 -0.00 0.00 0.00 0.00 0.00 44.72 43.34 2jxw s GLY 51 CO 0.09 -1.57 -0.06 -2.27 0.00 0.00 0.00 173.10 169.29 2jxw s LEU 52 N -2.52 3.24 0.16 0.66 2.96 -1.26 -0.75 118.68 121.16 2jxw s LEU 52 Ca 0.20 -0.01 0.11 0.00 -0.22 0.00 0.00 54.13 54.21 2jxw s LEU 52 Cb -0.09 -1.72 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 2jxw s LEU 52 CO 0.10 0.35 -0.24 -0.44 -1.32 0.00 0.00 176.35 174.79 2jxw s SER 53 N -0.70 3.23 0.64 3.68 0.01 0.18 -4.93 113.70 115.80 2jxw s SER 53 Ca 0.11 -0.81 -0.17 0.00 1.31 0.00 0.00 55.95 56.39 2jxw s SER 53 Cb -0.11 -0.22 -0.10 0.00 0.21 0.00 0.00 66.02 65.79 2jxw s SER 53 CO 0.02 0.12 0.12 1.21 0.41 0.00 0.00 173.24 175.12 2jxw n GLU 54 N 0.58 0.20 0.00 12.44 4.07 -1.26 -2.01 120.64 134.66 2jxw n GLU 54 Ca -0.15 0.08 0.00 0.00 -0.06 0.00 0.00 57.16 57.03 2jxw n GLU 54 Cb 0.55 -1.39 0.00 0.00 -0.06 0.00 0.00 31.44 30.54 2jxw n GLU 54 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2jxw n ASP 55 N 1.40 0.00 0.00 4.31 8.00 -1.26 -3.80 116.55 125.20 2jxw n ASP 55 Ca 0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.58 2jxw n ASP 55 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 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 0.00 0.39 3.37 0.44 0.00 -0.85 -5.15 105.19 103.38 2jxw n GLY 56 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.13 2.80 -0.27 1.61 0.08 -0.93 -4.96 117.98 116.18 2jxw s PHE 57 Ca 0.00 -0.65 -0.12 0.00 0.12 0.00 0.00 56.93 56.28 2jxw s PHE 57 Cb 0.00 -1.84 -0.05 0.00 -0.57 0.00 0.00 43.02 40.56 2jxw s PHE 57 CO 0.00 -0.22 0.21 0.99 -0.10 0.00 0.00 175.22 176.11 2jxw s THR 58 N 0.34 5.29 0.03 0.64 2.01 -1.26 0.50 115.64 123.20 2jxw s THR 58 Ca -0.11 0.23 0.05 0.00 0.31 0.00 0.00 61.69 62.17 2jxw s THR 58 Cb -0.16 -3.55 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 2jxw s THR 58 CO 0.06 0.24 -0.10 -0.72 -0.69 0.00 0.00 174.62 173.41 2jxw s TYR 59 N 1.74 2.78 0.01 4.92 1.13 0.07 -4.57 117.35 123.43 2jxw s TYR 59 Ca 0.08 -0.12 0.08 0.00 -1.41 0.00 0.00 57.07 55.71 2jxw s TYR 59 Cb -0.16 -1.54 -0.02 0.00 -1.10 0.00 0.00 41.96 39.14 2jxw s TYR 59 CO 0.10 0.35 -0.26 0.71 -2.51 0.00 0.00 175.55 173.95 2jxw s TYR 60 N -1.02 2.28 0.13 -3.49 2.02 -0.55 0.53 117.35 117.25 2jxw s TYR 60 Ca 0.17 -0.42 0.11 0.00 -0.37 0.00 0.00 57.07 56.56 2jxw s TYR 60 Cb -0.11 -1.42 -0.04 0.00 -0.40 0.00 0.00 41.96 39.99 2jxw s TYR 60 CO 0.08 0.04 -0.25 -0.47 -1.57 0.00 0.00 175.55 173.38 2jxw s TYR 61 N -0.69 2.21 -0.13 2.71 5.04 -0.99 0.34 117.35 125.84 2jxw s TYR 61 Ca 0.11 -0.39 0.00 0.00 -2.44 0.00 0.00 57.07 54.35 2jxw s TYR 61 Cb -0.10 -1.19 -0.01 0.00 0.35 0.00 0.00 41.96 41.01 2jxw s TYR 61 CO 0.00 0.34 -0.13 1.21 -1.34 0.00 0.00 175.55 175.63 2jxw s ASN 62 N -2.12 3.98 0.19 4.32 2.47 -1.20 -1.66 114.94 120.93 2jxw s ASN 62 Ca 0.14 -0.33 0.14 0.00 0.42 0.00 0.00 52.86 53.22 2jxw s ASN 62 Cb -0.10 -1.59 -0.03 0.00 -1.45 0.00 0.00 41.25 38.08 2jxw s ASN 62 CO 0.06 0.17 1.25 0.71 -3.72 0.00 0.00 177.10 175.57 2jxw h THR 63 N 5.40 0.91 0.57 -5.21 1.35 -1.94 -1.80 112.91 112.19 2jxw h THR 63 Ca -0.26 -2.37 -0.02 0.00 -0.55 0.00 0.00 66.41 63.21 2jxw h THR 63 Cb 1.21 2.40 -0.01 0.00 -1.73 0.00 0.00 68.15 70.02 2jxw h THR 63 CO 0.55 0.52 -0.41 -0.08 -0.25 0.00 0.00 175.52 175.85 2jxw h GLU 64 N 0.00 -0.91 0.02 4.72 4.81 -1.95 -3.37 114.58 117.91 2jxw h GLU 64 Ca -0.05 0.06 -0.34 0.00 -0.13 0.00 0.00 59.36 58.90 2jxw h GLU 64 Cb 1.51 0.21 -0.04 0.00 0.63 0.00 0.00 28.75 31.05 2jxw h GLU 64 CO 0.07 -0.60 -1.89 0.25 -0.73 0.00 0.00 179.01 176.11 2jxw n THR 65 N -4.99 1.58 0.00 0.32 -2.24 -1.26 -5.06 114.28 102.63 2jxw n THR 65 Ca -0.11 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2jxw n THR 65 Cb 0.41 -1.87 0.00 0.00 -2.10 0.00 0.00 70.33 66.77 2jxw n THR 65 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jxw n GLY 66 N 1.59 0.71 2.91 3.38 0.00 -0.68 -5.10 105.19 108.00 2jxw n GLY 66 Ca -0.40 -0.44 -0.19 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.52 0.75 0.49 1.61 2.12 -1.23 -4.98 118.70 116.94 2jxw s GLU 67 Ca 0.00 -0.13 -0.21 0.00 0.36 0.00 0.00 54.97 54.99 2jxw s GLU 67 Cb 0.00 -0.75 -0.07 0.00 0.26 0.00 0.00 34.13 33.56 2jxw s GLU 67 CO 0.00 -0.03 1.10 -1.54 -0.54 0.00 0.00 175.26 174.25 2jxw s SER 68 N 0.66 6.12 0.10 -1.70 1.04 -1.26 -3.24 113.70 115.43 2jxw s SER 68 Ca -0.09 2.11 0.03 0.00 0.48 0.00 0.00 55.95 58.48 2jxw s SER 68 Cb -0.12 -2.58 -0.04 0.00 0.10 0.00 0.00 66.02 63.38 2jxw s SER 68 CO 0.00 -0.94 -0.08 -0.60 0.98 0.00 0.00 173.24 172.60 2jxw s ARG 69 N -3.05 0.83 -0.14 4.02 6.06 0.15 -4.99 118.95 121.84 2jxw s ARG 69 Ca 0.67 -1.24 0.16 0.00 -2.50 0.00 0.00 55.73 52.82 2jxw s ARG 69 Cb -0.22 -0.35 0.41 0.00 0.06 0.00 0.00 34.95 34.85 2jxw s ARG 69 CO 0.26 0.03 1.20 0.91 -2.50 0.00 0.00 175.30 175.20 2jxw n TRP 70 N 0.26 0.00 -3.94 5.12 7.02 -1.26 -1.47 117.44 123.16 2jxw n TRP 70 Ca -0.14 -1.17 -0.09 0.00 -1.02 0.00 0.00 57.50 55.08 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 -2.22 0.95 -0.57 -0.99 2.02 -1.26 -4.95 118.70 111.69 2jxw s GLU 71 Ca 0.36 -1.10 -0.16 0.00 0.02 0.00 0.00 54.97 54.09 2jxw s GLU 71 Cb 0.37 0.34 0.13 0.00 0.10 0.00 0.00 34.13 35.07 2jxw s GLU 71 CO -0.10 -0.31 0.56 0.21 0.02 0.00 0.00 175.26 175.64 2jxw s LYS 72 N -3.92 3.05 -0.05 1.61 2.20 -1.26 -4.59 119.74 116.77 2jxw s LYS 72 Ca 0.11 -1.69 -0.30 0.00 -0.36 0.00 0.00 55.97 53.73 2jxw s LYS 72 Cb 0.05 -4.31 -0.03 0.00 -1.51 0.00 0.00 37.83 32.03 2jxw s LYS 72 CO -0.06 -1.37 1.17 -1.25 -0.36 0.00 0.00 175.35 173.49 2jxw s PRO 73 N 1.70 4.37 -0.30 4.03 0.04 -1.26 -5.00 135.00 138.57 2jxw s PRO 73 Ca 0.06 1.64 -0.15 0.00 0.04 0.00 0.00 61.00 62.58 2jxw s PRO 73 Cb -0.27 -3.54 0.17 0.00 0.04 0.00 0.00 34.50 30.89 2jxw s PRO 73 CO 0.03 -0.41 1.03 0.34 0.04 0.00 0.00 177.00 178.03 2jxw s ASP 74 N 1.40 -0.50 0.00 6.66 2.15 -1.26 -5.09 116.67 120.03 2jxw s ASP 74 Ca 0.55 0.61 0.26 0.00 0.43 0.00 0.00 52.55 54.40 2jxw s ASP 74 Cb -0.24 1.54 0.62 0.00 -0.30 0.00 0.00 42.92 44.54 2jxw s ASP 74 CO 0.22 -0.10 1.50 -0.67 -0.17 0.00 0.00 175.17 175.96