#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 3.79 -1.27 -0.67 0.04 -1.26 -4.09 135.00 131.53 2jxw s PRO 2 Ca 0.00 0.95 -0.04 0.00 0.04 0.00 0.00 61.00 61.96 2jxw s PRO 2 Cb 0.00 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.44 2jxw s PRO 2 CO 0.00 -0.41 1.05 0.45 0.04 0.00 0.00 177.00 178.13 2jxw n SER 3 N -1.86 -3.62 -2.69 6.66 2.88 -1.26 -4.95 113.62 108.77 2jxw n SER 3 Ca 0.07 -0.61 -0.04 0.00 -1.33 0.00 0.00 58.87 56.96 2jxw n SER 3 Cb 0.54 -4.99 0.04 0.00 -0.75 0.00 0.00 64.21 59.05 2jxw n SER 3 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2jxw n LYS 4 N -4.47 0.24 -3.92 -1.46 2.85 -1.26 -5.11 118.16 105.03 2jxw n LYS 4 Ca -0.17 -1.06 -0.32 0.00 -1.05 0.00 0.00 58.31 55.71 2jxw n LYS 4 Cb 0.63 -0.37 -0.13 0.00 -0.65 0.00 0.00 35.03 34.51 2jxw n LYS 4 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2jxw s GLY 5 N 0.40 2.30 -1.33 2.58 0.00 -1.26 -4.96 107.32 105.06 2jxw s GLY 5 Ca 0.26 -3.04 -0.17 0.00 0.00 0.00 0.00 44.72 41.77 2jxw s GLY 5 CO -0.10 1.01 1.82 0.54 0.00 0.00 0.00 173.10 176.37 2jxw n ARG 6 N 3.55 3.14 -4.70 2.90 3.00 -1.26 -4.94 116.66 118.35 2jxw n ARG 6 Ca 0.05 -3.16 -0.33 0.00 -0.01 0.00 0.00 57.85 54.39 2jxw n ARG 6 Cb 0.36 -3.46 -0.13 0.00 0.00 0.00 0.00 32.46 29.23 2jxw n ARG 6 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 2jxw s TRP 7 N 4.01 2.86 -0.03 -1.55 0.52 -1.26 -3.50 118.94 119.98 2jxw s TRP 7 Ca 0.53 -0.33 0.03 0.00 0.02 0.00 0.00 56.10 56.35 2jxw s TRP 7 Cb 0.06 -1.79 -0.03 0.00 -1.15 0.00 0.00 33.47 30.56 2jxw s TRP 7 CO 0.05 0.02 -0.11 0.54 0.02 0.00 0.00 176.95 177.47 2jxw s VAL 8 N -0.13 3.33 -0.09 4.03 0.11 -0.93 -4.94 120.40 121.78 2jxw s VAL 8 Ca 0.00 -0.71 -0.18 0.00 -2.93 0.00 0.00 61.98 58.15 2jxw s VAL 8 Cb -0.13 -2.36 -0.04 0.00 -1.53 0.00 0.00 36.38 32.31 2jxw s VAL 8 CO 0.03 0.53 0.50 -0.70 -3.33 0.00 0.00 175.10 172.12 2jxw s GLU 9 N -0.97 4.30 0.05 1.54 -6.30 -1.26 -2.52 118.70 113.54 2jxw s GLU 9 Ca 0.13 0.50 0.04 0.00 -2.50 0.00 0.00 54.97 53.14 2jxw s GLU 9 Cb -0.11 -3.40 -0.02 0.00 0.00 0.00 0.00 34.13 30.59 2jxw s GLU 9 CO 0.03 0.23 -0.11 0.20 0.02 0.00 0.00 175.26 175.63 2jxw s GLY 10 N 0.36 0.65 -0.06 -1.50 0.00 0.77 -5.00 107.32 102.54 2jxw s GLY 10 Ca 0.27 -0.82 -0.05 0.00 0.00 0.00 0.00 44.72 44.12 2jxw s GLY 10 CO 0.12 -0.84 0.17 -0.42 0.00 0.00 0.00 173.10 172.12 2jxw s ILE 11 N -1.17 5.46 0.23 0.90 -1.09 -1.26 -0.57 121.20 123.70 2jxw s ILE 11 Ca -0.05 0.02 0.07 0.00 -2.23 0.00 0.00 60.65 58.47 2jxw s ILE 11 Cb -0.09 -3.48 -0.05 0.00 -1.58 0.00 0.00 42.46 37.26 2jxw s ILE 11 CO 0.01 0.46 -0.12 0.42 -1.23 0.00 0.00 174.94 174.49 2jxw s THR 12 N -1.19 1.71 0.63 2.92 -4.23 -0.04 -4.92 115.64 110.52 2jxw s THR 12 Ca 0.22 -2.19 -0.17 0.00 -1.18 0.00 0.00 61.69 58.36 2jxw s THR 12 Cb -0.12 -2.18 -0.09 0.00 1.34 0.00 0.00 72.50 71.44 2jxw s THR 12 CO 0.12 -0.50 0.24 -1.20 -0.54 0.00 0.00 174.62 172.74 2jxw n SER 13 N -0.45 -2.23 0.00 3.99 7.64 -1.26 -2.53 113.62 118.78 2jxw n SER 13 Ca -0.07 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.44 2jxw n SER 13 Cb 0.61 -1.06 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 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 0.38 0.00 0.00 1.43 0.00 -1.26 -3.94 120.64 117.25 2jxw n GLU 14 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.25 2jxw n GLU 14 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.93 2jxw n GLU 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2jxw n GLY 15 N 0.00 -0.05 3.44 8.31 0.00 -1.05 -5.17 105.19 110.66 2jxw n GLY 15 Ca 0.00 -0.03 -0.28 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 2.39 -0.25 1.61 2.02 -1.17 -4.98 117.35 116.98 2jxw s TYR 16 Ca 0.00 -0.33 -0.04 0.00 -0.37 0.00 0.00 57.07 56.33 2jxw s TYR 16 Cb 0.00 -1.24 0.01 0.00 -0.40 0.00 0.00 41.96 40.32 2jxw s TYR 16 CO 0.00 0.42 -0.01 -1.01 -1.57 0.00 0.00 175.55 173.38 2jxw s HIS 17 N -1.34 3.04 0.12 2.71 3.76 -1.26 -0.86 115.29 121.46 2jxw s HIS 17 Ca 0.18 -1.12 0.06 0.00 -0.15 0.00 0.00 55.06 54.03 2jxw s HIS 17 Cb -0.09 -2.13 -0.04 0.00 1.11 0.00 0.00 32.58 31.42 2jxw s HIS 17 CO 0.09 -0.61 -0.04 1.52 -0.85 0.00 0.00 174.74 174.86 2jxw s TYR 18 N 1.44 2.85 0.10 1.40 1.13 0.26 -4.79 117.35 119.75 2jxw s TYR 18 Ca 0.03 -0.11 0.09 0.00 -1.41 0.00 0.00 57.07 55.67 2jxw s TYR 18 Cb -0.16 -1.45 -0.04 0.00 -1.10 0.00 0.00 41.96 39.22 2jxw s TYR 18 CO -0.02 0.47 -0.22 0.71 -2.51 0.00 0.00 175.55 173.98 2jxw s TYR 19 N -1.40 1.89 0.05 -3.49 2.02 -0.50 -0.16 117.35 115.75 2jxw s TYR 19 Ca 0.25 -0.41 0.04 0.00 -0.37 0.00 0.00 57.07 56.58 2jxw s TYR 19 Cb -0.11 -1.04 -0.02 0.00 -0.40 0.00 0.00 41.96 40.39 2jxw s TYR 19 CO 0.17 0.22 -0.13 -0.47 -1.57 0.00 0.00 175.55 173.77 2jxw s TYR 20 N -1.12 1.12 -0.19 2.71 5.04 -1.05 0.11 117.35 123.98 2jxw s TYR 20 Ca 0.08 -0.39 -0.02 0.00 -2.44 0.00 0.00 57.07 54.30 2jxw s TYR 20 Cb -0.10 -0.66 -0.00 0.00 0.35 0.00 0.00 41.96 41.55 2jxw s TYR 20 CO 0.04 0.03 -0.11 0.34 -1.34 0.00 0.00 175.55 174.51 2jxw s ASP 21 N -1.34 3.89 0.16 4.32 2.15 -0.70 -2.18 116.67 122.97 2jxw s ASP 21 Ca -0.01 -0.45 0.08 0.00 0.43 0.00 0.00 52.55 52.60 2jxw s ASP 21 Cb -0.09 -1.63 -0.06 0.00 -0.30 0.00 0.00 42.92 40.84 2jxw s ASP 21 CO 0.01 0.03 1.37 0.17 -0.17 0.00 0.00 175.17 176.58 2jxw h LEU 22 N 7.73 0.00 0.98 -1.34 -0.00 -1.89 0.15 115.31 120.94 2jxw h LEU 22 Ca -0.39 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.44 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 0.89 -0.47 0.40 -0.00 0.00 0.00 178.44 179.86 2jxw h ILE 23 N 0.00 0.00 0.02 0.15 2.04 -1.95 -3.29 117.51 114.48 2jxw h ILE 23 Ca -0.01 -0.03 -0.25 0.00 1.00 0.00 0.00 64.86 65.57 2jxw h ILE 23 Cb 1.59 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 2jxw h ILE 23 CO 0.12 0.00 -1.32 -1.28 0.00 0.00 0.00 178.15 175.67 2jxw h SER 24 N -1.34 0.06 -1.49 1.72 0.87 -1.97 -3.49 113.55 107.92 2jxw h SER 24 Ca -0.13 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2jxw h SER 24 Cb 1.01 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 2jxw h SER 24 CO 0.22 1.06 0.00 0.61 -0.53 0.00 0.00 176.83 178.19 2jxw n GLY 25 N 1.46 0.66 3.14 5.77 0.00 0.49 -5.09 105.19 111.64 2jxw n GLY 25 Ca -0.08 -0.53 -0.16 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.90 1.01 0.13 4.61 0.00 -1.10 -4.98 121.76 118.53 2jxw s ALA 26 Ca 0.00 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 50.85 2jxw s ALA 26 Cb 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 23.12 23.03 2jxw s ALA 26 CO 0.00 0.07 0.48 -1.54 0.00 0.00 0.00 175.76 174.77 2jxw s SER 27 N -1.89 6.71 0.25 0.00 1.04 -1.26 -1.73 113.70 116.82 2jxw s SER 27 Ca -0.02 0.92 0.02 0.00 0.48 0.00 0.00 55.95 57.35 2jxw s SER 27 Cb -0.08 -2.23 -0.05 0.00 0.10 0.00 0.00 66.02 63.76 2jxw s SER 27 CO 0.01 0.10 0.07 -1.58 0.98 0.00 0.00 173.24 172.82 2jxw s GLN 28 N -2.10 1.37 0.00 4.02 0.74 0.30 -4.99 119.66 119.00 2jxw s GLN 28 Ca 0.38 -1.73 0.00 0.00 0.05 0.00 0.00 55.36 54.06 2jxw s GLN 28 Cb -0.14 -0.34 0.00 0.00 1.10 0.00 0.00 33.01 33.63 2jxw s GLN 28 CO 0.19 -0.24 0.00 0.91 -0.55 0.00 0.00 175.29 175.60 2jxw n TRP 29 N -0.44 0.00 -2.95 1.67 7.02 -1.26 -1.41 117.44 120.06 2jxw n TRP 29 Ca -0.02 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.07 2jxw n TRP 29 Cb 0.66 0.02 -0.06 0.00 -2.42 0.00 0.00 31.31 29.51 2jxw n TRP 29 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2jxw s GLU 30 N -1.69 4.56 0.35 -0.99 -6.30 -1.26 -4.66 118.70 108.71 2jxw s GLU 30 Ca 0.00 1.16 -0.29 0.00 -2.50 0.00 0.00 54.97 53.34 2jxw s GLU 30 Cb 0.00 -3.31 -0.11 0.00 0.00 0.00 0.00 34.13 30.71 2jxw s GLU 30 CO 0.00 0.44 1.43 0.21 0.02 0.00 0.00 175.26 177.36 2jxw s LYS 31 N -0.65 4.20 0.97 4.30 2.20 -1.26 -4.92 119.74 124.57 2jxw s LYS 31 Ca 0.38 2.44 -0.16 0.00 -0.36 0.00 0.00 55.97 58.27 2jxw s LYS 31 Cb -0.22 -3.01 0.24 0.00 -1.51 0.00 0.00 37.83 33.33 2jxw s LYS 31 CO 0.26 -0.42 0.77 -0.35 -0.36 0.00 0.00 175.35 175.24 2jxw n PRO 32 N 0.83 -3.05 -2.30 4.03 -0.04 -1.26 -4.86 135.00 128.35 2jxw n PRO 32 Ca 0.02 -1.24 -0.34 0.00 -0.04 0.00 0.00 63.50 61.90 2jxw n PRO 32 Cb 0.40 -1.27 -0.04 0.00 -0.04 0.00 0.00 33.50 32.55 2jxw n PRO 32 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2jxw s GLU 33 N -4.76 3.09 0.00 0.54 0.41 -1.26 -4.37 118.70 112.35 2jxw s GLU 33 Ca 0.52 -0.93 0.00 0.00 -0.41 0.00 0.00 54.97 54.15 2jxw s GLU 33 Cb -0.06 -5.25 0.00 0.00 -1.78 0.00 0.00 34.13 27.03 2jxw s GLU 33 CO 0.41 -2.92 0.00 0.41 -0.49 0.00 0.00 175.26 172.66 2jxw n GLY 34 N 6.52 2.24 0.87 -1.39 0.00 -1.26 -5.06 105.19 107.11 2jxw n GLY 34 Ca 0.40 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.39 -2.35 1.61 7.35 -1.26 -5.02 117.46 115.40 2jxw n PHE 35 Ca 0.00 1.29 -0.02 0.00 -0.76 0.00 0.00 57.45 57.96 2jxw n PHE 35 Cb 0.00 -2.25 -0.02 0.00 0.35 0.00 0.00 39.48 37.56 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 -1.88 -2.99 0.00 -4.13 6.02 -1.26 -5.00 117.38 108.15 2jxw n GLN 36 Ca 0.00 2.44 0.00 0.00 -0.01 0.00 0.00 57.00 59.43 2jxw n GLN 36 Cb 0.21 -4.12 0.00 0.00 1.02 0.00 0.00 30.24 27.35 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 0.88 -2.79 3.57 1.08 0.00 -1.26 -4.97 105.19 101.69 2jxw n GLY 37 Ca -0.15 0.09 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 2jxw n GLY 37 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2jxw s ASP 38 N -2.17 -0.70 -0.14 1.61 -4.77 -1.26 -5.16 116.67 104.08 2jxw s ASP 38 Ca 0.00 1.04 -0.01 0.00 -3.30 0.00 0.00 52.55 50.27 2jxw s ASP 38 Cb 0.00 0.94 0.04 0.00 -1.09 0.00 0.00 42.92 42.81 2jxw s ASP 38 CO 0.00 -0.45 -0.02 -0.76 0.70 0.00 0.00 175.17 174.64 2jxw s LEU 39 N -0.51 1.23 -1.24 2.11 1.43 -1.26 -5.07 118.68 115.38 2jxw s LEU 39 Ca -0.06 -0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 52.40 2jxw s LEU 39 Cb -0.02 -0.72 0.18 0.00 0.03 0.00 0.00 46.19 45.65 2jxw s LEU 39 CO 0.06 -0.21 1.65 1.17 0.23 0.00 0.00 176.35 179.25 2jxw n LYS 40 N 4.99 3.55 -3.57 1.70 4.81 -1.26 -4.91 118.16 123.48 2jxw n LYS 40 Ca -0.10 -3.74 -0.11 0.00 -0.87 0.00 0.00 58.31 53.49 2jxw n LYS 40 Cb 0.48 -2.94 -0.05 0.00 0.02 0.00 0.00 35.03 32.54 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 0.69 0.66 0.10 1.64 2.20 -1.26 -5.19 119.74 118.57 2jxw s LYS 41 Ca 0.40 0.13 -0.07 0.00 -0.36 0.00 0.00 55.97 56.07 2jxw s LYS 41 Cb 0.04 0.31 -0.01 0.00 -1.51 0.00 0.00 37.83 36.65 2jxw s LYS 41 CO 0.01 -0.21 0.16 0.95 -0.36 0.00 0.00 175.35 175.89 2jxw s THR 42 N -1.25 0.14 -0.24 3.43 -4.23 -1.26 -5.15 115.64 107.08 2jxw s THR 42 Ca -0.02 -1.39 -0.01 0.00 -1.18 0.00 0.00 61.69 59.09 2jxw s THR 42 Cb -0.00 -1.52 0.07 0.00 1.34 0.00 0.00 72.50 72.38 2jxw s THR 42 CO 0.02 -0.63 0.01 0.00 -0.54 0.00 0.00 174.62 173.47 2jxw s ALA 43 N -3.91 1.60 -1.44 3.99 0.00 -1.26 -5.04 121.76 115.70 2jxw s ALA 43 Ca 0.09 -1.23 -0.14 0.00 0.00 0.00 0.00 51.96 50.68 2jxw s ALA 43 Cb 0.05 -1.40 0.02 0.00 0.00 0.00 0.00 23.12 21.79 2jxw s ALA 43 CO -0.08 -1.29 2.29 1.55 0.00 0.00 0.00 175.76 178.23 2jxw n VAL 44 N 4.81 3.45 -4.32 0.00 3.14 -1.26 -4.70 118.33 119.45 2jxw n VAL 44 Ca -0.09 -2.88 -0.17 0.00 -2.96 0.00 0.00 64.34 58.24 2jxw n VAL 44 Cb 0.45 -2.59 -0.10 0.00 -1.06 0.00 0.00 33.84 30.53 2jxw n VAL 44 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2jxw s LYS 45 N 3.19 1.29 -0.33 1.45 1.02 -1.26 -5.06 119.74 120.03 2jxw s LYS 45 Ca 0.50 -1.62 0.06 0.00 0.02 0.00 0.00 55.97 54.94 2jxw s LYS 45 Cb 0.14 -0.77 0.46 0.00 -0.52 0.00 0.00 37.83 37.14 2jxw s LYS 45 CO -0.08 0.01 1.34 2.41 -0.92 0.00 0.00 175.35 178.11 2jxw n THR 46 N -0.37 2.65 -1.19 2.17 -1.04 -1.26 -4.68 114.28 110.55 2jxw n THR 46 Ca -0.07 -3.81 -0.08 0.00 -2.04 0.00 0.00 64.05 58.05 2jxw n THR 46 Cb 0.62 -0.97 0.24 0.00 -1.82 0.00 0.00 70.33 68.40 2jxw n THR 46 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 2jxw n VAL 47 N -0.82 2.83 -4.49 12.58 3.14 -1.26 -4.96 118.33 125.35 2jxw n VAL 47 Ca 0.43 -2.03 -0.33 0.00 -2.96 0.00 0.00 64.34 59.45 2jxw n VAL 47 Cb 0.91 -0.37 -0.10 0.00 -1.06 0.00 0.00 33.84 33.22 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 -3.12 2.95 0.07 1.45 0.52 -1.26 -3.82 118.94 115.73 2jxw s TRP 48 Ca 0.51 0.01 0.02 0.00 0.02 0.00 0.00 56.10 56.67 2jxw s TRP 48 Cb 0.43 -1.66 -0.04 0.00 -1.15 0.00 0.00 33.47 31.05 2jxw s TRP 48 CO 0.09 0.38 0.09 0.54 0.02 0.00 0.00 176.95 178.06 2jxw s VAL 49 N -0.93 4.62 -0.25 4.03 0.11 -0.49 -4.90 120.40 122.59 2jxw s VAL 49 Ca 0.15 -0.69 -0.14 0.00 -2.93 0.00 0.00 61.98 58.38 2jxw s VAL 49 Cb -0.11 -3.21 -0.04 0.00 -1.53 0.00 0.00 36.38 31.49 2jxw s VAL 49 CO 0.05 0.16 0.31 -0.70 -3.33 0.00 0.00 175.10 171.59 2jxw s GLU 50 N -2.30 4.06 0.24 1.54 -6.30 -1.26 -2.38 118.70 112.29 2jxw s GLU 50 Ca 0.29 -0.04 0.11 0.00 -2.50 0.00 0.00 54.97 52.83 2jxw s GLU 50 Cb -0.12 -3.60 -0.05 0.00 0.00 0.00 0.00 34.13 30.36 2jxw s GLU 50 CO 0.21 -0.13 -0.19 0.20 0.02 0.00 0.00 175.26 175.37 2jxw s GLY 51 N 1.38 1.79 -0.17 -1.50 0.00 0.13 -4.98 107.32 103.97 2jxw s GLY 51 Ca 0.13 -1.74 -0.05 0.00 0.00 0.00 0.00 44.72 43.06 2jxw s GLY 51 CO 0.08 -1.80 0.01 -2.27 0.00 0.00 0.00 173.10 169.13 2jxw s LEU 52 N -3.16 3.55 0.16 0.66 2.96 -1.26 -1.35 118.68 120.24 2jxw s LEU 52 Ca 0.26 -0.01 0.11 0.00 -0.22 0.00 0.00 54.13 54.28 2jxw s LEU 52 Cb -0.06 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 2jxw s LEU 52 CO 0.14 0.18 -0.25 -0.55 -1.32 0.00 0.00 176.35 174.54 2jxw s SER 53 N 0.30 3.39 0.70 3.68 0.15 -0.64 -4.95 113.70 116.32 2jxw s SER 53 Ca 0.00 -0.81 -0.17 0.00 0.70 0.00 0.00 55.95 55.68 2jxw s SER 53 Cb -0.13 -0.24 -0.07 0.00 -1.71 0.00 0.00 66.02 63.86 2jxw s SER 53 CO 0.01 0.15 0.28 1.21 1.20 0.00 0.00 173.24 176.10 2jxw n GLU 54 N 0.59 0.23 -1.03 5.44 2.13 -1.26 -1.87 120.64 124.86 2jxw n GLU 54 Ca -0.15 0.11 -0.01 0.00 0.66 0.00 0.00 57.16 57.76 2jxw n GLU 54 Cb 0.54 -1.59 -0.00 0.00 0.27 0.00 0.00 31.44 30.66 2jxw n GLU 54 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2jxw n ASP 55 N 0.63 -4.89 -2.00 4.31 8.00 -1.26 -3.72 116.55 117.62 2jxw n ASP 55 Ca 0.09 0.03 -0.02 0.00 0.71 0.00 0.00 54.79 55.60 2jxw n ASP 55 Cb 0.50 -2.49 0.01 0.00 -0.02 0.00 0.00 41.12 39.12 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 -0.53 -0.22 2.79 0.44 0.00 -0.88 -5.06 105.19 101.73 2jxw n GLY 56 Ca -0.01 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.05 1.66 -0.14 1.61 0.08 -0.78 -4.98 117.98 112.37 2jxw s PHE 57 Ca 0.06 -1.42 -0.29 0.00 0.12 0.00 0.00 56.93 55.40 2jxw s PHE 57 Cb -0.01 -1.43 -0.02 0.00 -0.57 0.00 0.00 43.02 40.99 2jxw s PHE 57 CO 0.23 -0.74 1.32 0.99 -0.10 0.00 0.00 175.22 176.91 2jxw s THR 58 N 1.64 4.17 0.04 0.64 2.01 -1.26 -1.63 115.64 121.25 2jxw s THR 58 Ca 0.01 1.41 0.05 0.00 0.31 0.00 0.00 61.69 63.48 2jxw s THR 58 Cb -0.18 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 2jxw s THR 58 CO -0.13 -0.12 -0.11 -0.72 -0.69 0.00 0.00 174.62 172.85 2jxw s TYR 59 N 3.53 2.76 0.01 4.92 -0.85 -0.46 -4.76 117.35 122.50 2jxw s TYR 59 Ca 0.58 -0.13 0.09 0.00 -0.52 0.00 0.00 57.07 57.08 2jxw s TYR 59 Cb -0.24 -1.52 -0.02 0.00 0.38 0.00 0.00 41.96 40.56 2jxw s TYR 59 CO 0.17 0.35 -0.26 0.71 -1.52 0.00 0.00 175.55 175.01 2jxw s TYR 60 N -1.04 2.32 0.05 -3.49 2.02 -0.18 0.21 117.35 117.23 2jxw s TYR 60 Ca 0.18 -0.43 0.05 0.00 -0.37 0.00 0.00 57.07 56.50 2jxw s TYR 60 Cb -0.11 -1.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.98 2jxw s TYR 60 CO 0.09 0.03 -0.15 -0.47 -1.57 0.00 0.00 175.55 173.48 2jxw s TYR 61 N -0.70 1.30 -0.15 2.71 5.04 -1.00 0.96 117.35 125.51 2jxw s TYR 61 Ca 0.11 -0.39 -0.01 0.00 -2.44 0.00 0.00 57.07 54.34 2jxw s TYR 61 Cb -0.10 -0.76 -0.02 0.00 0.35 0.00 0.00 41.96 41.44 2jxw s TYR 61 CO 0.00 0.06 -0.10 1.21 -1.34 0.00 0.00 175.55 175.38 2jxw s ASN 62 N -1.36 4.16 0.32 4.32 3.84 -1.04 -1.39 114.94 123.78 2jxw s ASN 62 Ca 0.01 -0.31 0.17 0.00 0.21 0.00 0.00 52.86 52.94 2jxw s ASN 62 Cb -0.09 -1.65 0.20 0.00 -0.55 0.00 0.00 41.25 39.16 2jxw s ASN 62 CO 0.02 0.14 1.51 0.71 -2.79 0.00 0.00 177.10 176.69 2jxw h THR 63 N 5.42 0.68 0.54 -5.21 1.35 -1.92 -0.48 112.91 113.29 2jxw h THR 63 Ca -0.29 -1.89 -0.03 0.00 -0.55 0.00 0.00 66.41 63.65 2jxw h THR 63 Cb 1.20 2.28 0.01 0.00 -1.73 0.00 0.00 68.15 69.91 2jxw h THR 63 CO 0.58 0.38 -0.26 -0.08 -0.25 0.00 0.00 175.52 175.88 2jxw h GLU 64 N 0.00 -0.70 0.06 4.72 4.81 -1.95 -3.35 114.58 118.17 2jxw h GLU 64 Ca -0.00 0.05 -0.32 0.00 -0.13 0.00 0.00 59.36 58.95 2jxw h GLU 64 Cb 1.25 0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.76 2jxw h GLU 64 CO 0.05 -0.46 -1.83 -2.37 -0.73 0.00 0.00 179.01 173.67 2jxw n THR 65 N -3.95 1.69 -0.99 0.32 5.66 -1.26 -5.03 114.28 110.73 2jxw n THR 65 Ca -0.09 -0.74 0.00 0.00 -3.05 0.00 0.00 64.05 60.17 2jxw n THR 65 Cb 0.29 -1.35 0.00 0.00 -1.55 0.00 0.00 70.33 67.71 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 1.74 0.61 2.99 1.09 0.00 -0.19 -5.10 105.19 106.34 2jxw n GLY 66 Ca -0.23 -0.35 -0.16 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.96 0.50 0.23 1.61 2.12 -1.20 -4.97 118.70 115.03 2jxw s GLU 67 Ca 0.00 -0.34 -0.20 0.00 0.36 0.00 0.00 54.97 54.79 2jxw s GLU 67 Cb 0.00 -0.44 -0.08 0.00 0.26 0.00 0.00 34.13 33.87 2jxw s GLU 67 CO 0.00 0.11 0.73 -1.54 -0.54 0.00 0.00 175.26 174.02 2jxw s SER 68 N -0.48 7.06 0.11 -1.70 1.04 -1.26 -2.51 113.70 115.96 2jxw s SER 68 Ca -0.00 1.43 0.03 0.00 0.48 0.00 0.00 55.95 57.89 2jxw s SER 68 Cb -0.04 -2.42 -0.04 0.00 0.10 0.00 0.00 66.02 63.62 2jxw s SER 68 CO -0.00 0.02 -0.09 -0.60 0.98 0.00 0.00 173.24 173.55 2jxw s ARG 69 N -2.01 0.89 -0.24 4.02 3.52 0.27 -4.99 118.95 120.41 2jxw s ARG 69 Ca 0.44 -1.28 0.13 0.00 -0.13 0.00 0.00 55.73 54.89 2jxw s ARG 69 Cb -0.16 -0.46 0.46 0.00 -1.56 0.00 0.00 34.95 33.23 2jxw s ARG 69 CO 0.21 0.05 1.18 0.91 -0.81 0.00 0.00 175.30 176.84 2jxw n TRP 70 N 0.20 1.61 -3.69 5.12 7.02 -1.26 -1.01 117.44 125.42 2jxw n TRP 70 Ca -0.13 -1.90 -0.11 0.00 -1.02 0.00 0.00 57.50 54.34 2jxw n TRP 70 Cb 0.59 -0.28 -0.10 0.00 -2.42 0.00 0.00 31.31 29.10 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 -3.24 0.48 -0.17 -0.99 2.02 -1.26 -5.01 118.70 110.53 2jxw s GLU 71 Ca 0.42 0.79 -0.29 0.00 0.02 0.00 0.00 54.97 55.91 2jxw s GLU 71 Cb 0.38 0.09 -0.05 0.00 0.10 0.00 0.00 34.13 34.65 2jxw s GLU 71 CO -0.02 -0.13 2.07 -1.59 0.02 0.00 0.00 175.26 175.61 2jxw s LYS 72 N 1.04 3.45 -0.85 1.61 0.00 -1.26 -4.89 119.74 118.84 2jxw s LYS 72 Ca -0.06 2.08 -0.25 0.00 0.00 0.00 0.00 55.97 57.74 2jxw s LYS 72 Cb -0.06 -4.28 -0.01 0.00 0.00 0.00 0.00 37.83 33.48 2jxw s LYS 72 CO -0.09 -1.73 1.73 -1.25 0.00 0.00 0.00 175.35 174.01 2jxw s PRO 73 N 5.68 2.89 -0.40 1.78 0.04 -1.26 -4.82 135.00 138.90 2jxw s PRO 73 Ca 0.93 -0.28 0.06 0.00 0.04 0.00 0.00 61.00 61.75 2jxw s PRO 73 Cb -0.34 -4.88 0.18 0.00 0.04 0.00 0.00 34.50 29.51 2jxw s PRO 73 CO 0.36 -2.82 0.67 0.34 0.04 0.00 0.00 177.00 175.59 2jxw s ASP 74 N 6.83 -1.42 0.00 6.66 -1.08 -1.26 -4.65 116.67 121.74 2jxw s ASP 74 Ca 0.60 -0.69 0.14 0.00 -0.52 0.00 0.00 52.55 52.07 2jxw s ASP 74 Cb -0.07 1.82 0.11 0.00 -1.46 0.00 0.00 42.92 43.32 2jxw s ASP 74 CO 0.04 -0.16 0.93 0.47 0.52 0.00 0.00 175.17 176.96