#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 4.37 -0.72 -0.24 0.04 -1.26 -4.97 135.00 132.22 2jxw s PRO 2 Ca 0.00 2.07 -0.22 0.00 0.04 0.00 0.00 61.00 62.89 2jxw s PRO 2 Cb 0.00 -3.20 0.08 0.00 0.04 0.00 0.00 34.50 31.42 2jxw s PRO 2 CO 0.00 -0.29 1.01 -1.54 0.04 0.00 0.00 177.00 176.23 2jxw s SER 3 N 0.46 6.26 0.65 6.66 1.04 -1.26 -5.02 113.70 122.49 2jxw s SER 3 Ca 0.58 -1.18 0.03 0.00 0.48 0.00 0.00 55.95 55.87 2jxw s SER 3 Cb -0.37 -2.42 0.11 0.00 0.10 0.00 0.00 66.02 63.44 2jxw s SER 3 CO 0.37 -1.39 0.90 -0.54 0.98 0.00 0.00 173.24 173.56 2jxw s LYS 4 N 3.89 1.97 0.04 4.02 3.01 -1.26 -4.89 119.74 126.52 2jxw s LYS 4 Ca 0.25 -1.30 0.03 0.00 -1.01 0.00 0.00 55.97 53.94 2jxw s LYS 4 Cb -0.14 -2.47 -0.02 0.00 -1.01 0.00 0.00 37.83 34.19 2jxw s LYS 4 CO 0.06 -1.17 -0.10 0.20 0.51 0.00 0.00 175.35 174.85 2jxw s GLY 5 N -4.69 0.60 -1.19 -3.33 0.00 -1.26 -5.06 107.32 92.39 2jxw s GLY 5 Ca 0.64 -0.74 -0.22 0.00 0.00 0.00 0.00 44.72 44.40 2jxw s GLY 5 CO 0.42 -0.76 1.90 0.50 0.00 0.00 0.00 173.10 175.16 2jxw s ARG 6 N -1.29 2.74 -0.04 2.90 0.52 -1.26 -4.91 118.95 117.61 2jxw s ARG 6 Ca -0.04 -1.25 0.04 0.00 -0.52 0.00 0.00 55.73 53.96 2jxw s ARG 6 Cb -0.08 -5.28 -0.03 0.00 0.52 0.00 0.00 34.95 30.08 2jxw s ARG 6 CO 0.01 -3.66 -0.15 -1.58 0.02 0.00 0.00 175.30 169.94 2jxw s TRP 7 N 9.84 2.68 -0.12 -0.53 0.52 -1.26 -3.64 118.94 126.42 2jxw s TRP 7 Ca 0.66 -0.18 -0.01 0.00 0.02 0.00 0.00 56.10 56.59 2jxw s TRP 7 Cb -0.00 -1.61 -0.03 0.00 -1.15 0.00 0.00 33.47 30.68 2jxw s TRP 7 CO 0.11 0.18 -0.07 0.54 0.02 0.00 0.00 176.95 177.74 2jxw s VAL 8 N -0.75 3.63 -0.10 4.03 0.11 -0.89 -4.91 120.40 121.52 2jxw s VAL 8 Ca 0.12 -0.47 -0.20 0.00 -2.93 0.00 0.00 61.98 58.50 2jxw s VAL 8 Cb -0.11 -2.54 -0.04 0.00 -1.53 0.00 0.00 36.38 32.16 2jxw s VAL 8 CO 0.01 0.53 0.54 -0.70 -3.33 0.00 0.00 175.10 172.15 2jxw s GLU 9 N -0.03 4.36 0.04 1.54 2.12 -1.26 -2.47 118.70 123.01 2jxw s GLU 9 Ca -0.00 0.56 0.03 0.00 0.36 0.00 0.00 54.97 55.92 2jxw s GLU 9 Cb -0.14 -3.44 -0.02 0.00 0.26 0.00 0.00 34.13 30.80 2jxw s GLU 9 CO 0.03 0.14 -0.10 0.20 -0.54 0.00 0.00 175.26 174.99 2jxw s GLY 10 N 0.64 0.59 -0.13 -1.50 0.00 0.49 -4.99 107.32 102.43 2jxw s GLY 10 Ca 0.29 -0.77 -0.07 0.00 0.00 0.00 0.00 44.72 44.17 2jxw s GLY 10 CO 0.12 -0.80 0.12 -0.42 0.00 0.00 0.00 173.10 172.12 2jxw s ILE 11 N -1.18 5.31 0.30 0.90 1.09 -1.26 -0.33 121.20 126.03 2jxw s ILE 11 Ca -0.06 0.14 0.11 0.00 -1.10 0.00 0.00 60.65 59.74 2jxw s ILE 11 Cb -0.09 -3.32 -0.05 0.00 -1.06 0.00 0.00 42.46 37.93 2jxw s ILE 11 CO 0.01 0.59 -0.15 0.42 -0.10 0.00 0.00 174.94 175.70 2jxw s THR 12 N -0.76 2.44 0.47 2.92 -4.23 0.36 -4.96 115.64 111.88 2jxw s THR 12 Ca 0.13 -2.32 -0.19 0.00 -1.18 0.00 0.00 61.69 58.13 2jxw s THR 12 Cb -0.12 -2.44 -0.14 0.00 1.34 0.00 0.00 72.50 71.14 2jxw s THR 12 CO 0.03 -0.33 0.09 -1.20 -0.54 0.00 0.00 174.62 172.67 2jxw n SER 13 N -0.69 -2.79 0.00 3.99 7.64 -1.26 -2.21 113.62 118.29 2jxw n SER 13 Ca -0.05 0.74 0.00 0.00 1.01 0.00 0.00 58.87 60.57 2jxw n SER 13 Cb 0.61 -0.93 0.00 0.00 -1.01 0.00 0.00 64.21 62.88 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 1.15 0.00 0.00 1.43 4.07 -1.26 -4.06 120.64 121.97 2jxw n GLU 14 Ca 0.10 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 2jxw n GLU 14 Cb 0.44 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.82 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 -0.37 3.19 8.31 0.00 -0.94 -5.12 105.19 110.26 2jxw n GLY 15 Ca 0.00 -0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 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 1.79 -0.31 1.61 2.02 -1.15 -4.97 117.35 116.35 2jxw s TYR 16 Ca 0.00 -0.39 -0.12 0.00 -0.37 0.00 0.00 57.07 56.19 2jxw s TYR 16 Cb 0.00 -1.17 -0.03 0.00 -0.40 0.00 0.00 41.96 40.36 2jxw s TYR 16 CO 0.00 -0.07 0.21 -1.01 -1.57 0.00 0.00 175.55 173.12 2jxw s HIS 17 N -0.34 3.22 0.12 2.71 3.76 -1.26 -0.49 115.29 123.01 2jxw s HIS 17 Ca 0.05 -0.10 0.06 0.00 -0.15 0.00 0.00 55.06 54.92 2jxw s HIS 17 Cb -0.09 -2.43 -0.04 0.00 1.11 0.00 0.00 32.58 31.13 2jxw s HIS 17 CO 0.00 -0.28 -0.04 1.52 -0.85 0.00 0.00 174.74 175.09 2jxw s TYR 18 N 1.73 2.85 0.10 1.40 1.13 0.55 -4.78 117.35 120.33 2jxw s TYR 18 Ca 0.06 -0.11 0.08 0.00 -1.41 0.00 0.00 57.07 55.70 2jxw s TYR 18 Cb -0.17 -1.45 -0.03 0.00 -1.10 0.00 0.00 41.96 39.21 2jxw s TYR 18 CO 0.10 0.48 -0.22 0.71 -2.51 0.00 0.00 175.55 174.11 2jxw s TYR 19 N -1.42 1.86 0.03 -3.49 2.02 -0.81 -0.38 117.35 115.17 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 -1.02 -0.02 0.00 -0.40 0.00 0.00 41.96 40.41 2jxw s TYR 19 CO 0.17 0.21 -0.12 -0.47 -1.57 0.00 0.00 175.55 173.77 2jxw s TYR 20 N -1.12 1.04 -0.20 2.71 6.14 -1.03 0.85 117.35 125.73 2jxw s TYR 20 Ca 0.07 -0.35 -0.04 0.00 0.64 0.00 0.00 57.07 57.40 2jxw s TYR 20 Cb -0.10 -0.62 -0.02 0.00 0.42 0.00 0.00 41.96 41.65 2jxw s TYR 20 CO 0.04 0.01 -0.03 0.34 0.64 0.00 0.00 175.55 176.55 2jxw s ASP 21 N -1.09 4.50 0.17 4.32 2.15 -1.03 -2.09 116.67 123.59 2jxw s ASP 21 Ca -0.00 -0.30 0.15 0.00 0.43 0.00 0.00 52.55 52.83 2jxw s ASP 21 Cb -0.08 -1.76 -0.05 0.00 -0.30 0.00 0.00 42.92 40.73 2jxw s ASP 21 CO 0.01 0.04 1.14 0.17 -0.17 0.00 0.00 175.17 176.36 2jxw h LEU 22 N 7.69 0.00 0.28 -1.34 -0.00 -1.90 -0.52 115.31 119.51 2jxw h LEU 22 Ca -0.37 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.51 2jxw h LEU 22 Cb 1.17 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.82 2jxw h LEU 22 CO 0.60 0.57 -0.26 0.40 -0.00 0.00 0.00 178.44 179.75 2jxw h ILE 23 N 0.00 0.46 0.03 0.15 5.03 -1.94 -3.33 117.51 117.90 2jxw h ILE 23 Ca -0.08 0.00 -0.38 0.00 -0.12 0.00 0.00 64.86 64.28 2jxw h ILE 23 Cb 1.50 0.46 -0.06 0.00 -3.03 0.00 0.00 36.82 35.69 2jxw h ILE 23 CO 0.06 0.00 -2.34 -1.20 -0.68 0.00 0.00 178.15 173.99 2jxw n SER 24 N -5.38 1.75 -0.23 1.72 7.64 -1.26 -5.05 113.62 112.82 2jxw n SER 24 Ca -0.09 -0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.76 2jxw n SER 24 Cb 0.29 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.15 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 2.12 0.63 2.86 0.23 0.00 -0.22 -5.11 105.19 105.69 2jxw n GLY 25 Ca -0.41 -0.30 -0.19 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.65 0.53 0.38 4.61 0.00 -1.10 -4.99 121.76 119.54 2jxw s ALA 26 Ca 0.00 0.03 -0.24 0.00 0.00 0.00 0.00 51.96 51.74 2jxw s ALA 26 Cb 0.00 -0.39 -0.09 0.00 0.00 0.00 0.00 23.12 22.63 2jxw s ALA 26 CO 0.00 -0.05 1.02 -1.12 0.00 0.00 0.00 175.76 175.61 2jxw s SER 27 N 0.99 6.92 0.25 0.00 0.01 -1.26 -2.47 113.70 118.14 2jxw s SER 27 Ca -0.10 1.98 0.02 0.00 1.31 0.00 0.00 55.95 59.16 2jxw s SER 27 Cb -0.14 -2.58 -0.05 0.00 0.21 0.00 0.00 66.02 63.46 2jxw s SER 27 CO -0.01 -0.38 0.06 -1.58 0.41 0.00 0.00 173.24 171.74 2jxw s GLN 28 N -2.40 1.39 0.00 12.44 0.74 0.25 -4.98 119.66 127.10 2jxw s GLN 28 Ca 0.56 -1.74 0.00 0.00 0.05 0.00 0.00 55.36 54.23 2jxw s GLN 28 Cb -0.21 -0.42 0.00 0.00 1.10 0.00 0.00 33.01 33.48 2jxw s GLN 28 CO 0.26 -0.22 0.00 0.91 -0.55 0.00 0.00 175.29 175.70 2jxw n TRP 29 N -0.46 0.00 -2.66 1.67 7.02 -1.26 -1.92 117.44 119.83 2jxw n TRP 29 Ca -0.02 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 56.05 2jxw n TRP 29 Cb 0.65 0.13 -0.04 0.00 -2.42 0.00 0.00 31.31 29.64 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 -1.89 4.65 0.20 -0.99 -6.30 -1.26 -4.57 118.70 108.53 2jxw s GLU 30 Ca 0.00 1.52 -0.30 0.00 -2.50 0.00 0.00 54.97 53.69 2jxw s GLU 30 Cb 0.00 -3.36 -0.09 0.00 0.00 0.00 0.00 34.13 30.68 2jxw s GLU 30 CO 0.00 0.13 1.36 0.21 0.02 0.00 0.00 175.26 176.98 2jxw s LYS 31 N 0.09 4.34 0.77 4.30 2.20 -1.26 -4.93 119.74 125.25 2jxw s LYS 31 Ca 0.49 2.14 -0.13 0.00 -0.36 0.00 0.00 55.97 58.10 2jxw s LYS 31 Cb -0.25 -3.17 0.19 0.00 -1.51 0.00 0.00 37.83 33.09 2jxw s LYS 31 CO 0.31 -0.33 0.74 -0.35 -0.36 0.00 0.00 175.35 175.35 2jxw n PRO 32 N 2.74 -2.09 -1.31 4.03 -0.04 -1.26 -4.95 135.00 132.13 2jxw n PRO 32 Ca 0.07 -1.18 -0.32 0.00 -0.04 0.00 0.00 63.50 62.04 2jxw n PRO 32 Cb 0.42 -1.03 0.06 0.00 -0.04 0.00 0.00 33.50 32.92 2jxw n PRO 32 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2jxw n GLU 33 N -3.50 2.53 -1.95 0.54 2.13 -1.26 -4.31 120.64 114.82 2jxw n GLU 33 Ca 0.10 -2.97 -0.01 0.00 0.66 0.00 0.00 57.16 54.94 2jxw n GLU 33 Cb 0.38 -2.16 0.02 0.00 0.27 0.00 0.00 31.44 29.95 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 -0.60 -0.33 0.77 8.31 0.00 -1.26 -5.04 105.19 107.04 2jxw n GLY 34 Ca 0.56 -0.04 -0.03 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.40 0.00 -3.88 1.61 -0.00 -1.26 -4.27 117.46 109.26 2jxw n PHE 35 Ca -0.08 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.07 2jxw n PHE 35 Cb 0.61 -0.15 -0.14 0.00 -0.00 0.00 0.00 39.48 39.79 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 -2.26 1.56 -0.03 -4.13 -0.21 -1.26 -5.10 119.66 108.23 2jxw s GLN 36 Ca -0.09 -2.14 0.04 0.00 0.02 0.00 0.00 55.36 53.20 2jxw s GLN 36 Cb 0.01 -2.90 -0.03 0.00 1.00 0.00 0.00 33.01 31.09 2jxw s GLN 36 CO 0.12 -1.07 -0.16 0.20 -2.12 0.00 0.00 175.29 172.27 2jxw s GLY 37 N 0.33 1.52 -0.30 3.09 0.00 -1.26 -5.10 107.32 105.60 2jxw s GLY 37 Ca 0.15 -1.02 -0.02 0.00 0.00 0.00 0.00 44.72 43.83 2jxw s GLY 37 CO -0.04 -0.83 0.22 0.51 0.00 0.00 0.00 173.10 172.96 2jxw s ASP 38 N -0.83 2.57 -0.42 1.64 -4.77 -1.26 -5.06 116.67 108.54 2jxw s ASP 38 Ca 0.12 -1.19 0.05 0.00 -3.30 0.00 0.00 52.55 48.22 2jxw s ASP 38 Cb -0.11 0.05 0.18 0.00 -1.09 0.00 0.00 42.92 41.96 2jxw s ASP 38 CO 0.01 -0.39 0.38 0.18 0.70 0.00 0.00 175.17 176.05 2jxw n LEU 39 N 5.07 -0.23 -3.62 2.11 4.77 -1.26 -5.01 117.00 118.83 2jxw n LEU 39 Ca -0.01 -4.46 -0.03 0.00 -0.03 0.00 0.00 56.01 51.47 2jxw n LEU 39 Cb 0.43 0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 42.00 2jxw n LEU 39 CO 0.04 1.89 1.08 -0.75 -1.33 0.00 0.00 177.39 178.32 2jxw s LYS 40 N -0.21 0.18 2.65 3.23 2.20 -1.26 -5.16 119.74 121.36 2jxw s LYS 40 Ca 0.33 -0.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.91 2jxw s LYS 40 Cb 0.06 0.08 0.00 0.00 -1.51 0.00 0.00 37.83 36.46 2jxw s LYS 40 CO -0.18 -0.07 0.00 1.63 -0.36 0.00 0.00 175.35 176.37 2jxw n LYS 41 N 0.19 0.00 -1.73 4.03 4.76 -1.26 -4.71 118.16 119.44 2jxw n LYS 41 Ca 0.01 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.03 2jxw n LYS 41 Cb 0.58 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.76 2jxw n LYS 41 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2jxw n THR 42 N -0.61 1.95 -0.75 -0.18 -2.24 -1.26 -4.95 114.28 106.24 2jxw n THR 42 Ca 0.00 -0.49 -0.31 0.00 -2.27 0.00 0.00 64.05 60.99 2jxw n THR 42 Cb 0.00 -1.73 0.17 0.00 -2.10 0.00 0.00 70.33 66.67 2jxw n THR 42 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jxw s ALA 43 N -1.05 1.31 0.41 6.98 0.00 -1.26 -4.98 121.76 123.17 2jxw s ALA 43 Ca 0.55 0.45 -0.24 0.00 0.00 0.00 0.00 51.96 52.73 2jxw s ALA 43 Cb -0.53 -3.40 -0.09 0.00 0.00 0.00 0.00 23.12 19.10 2jxw s ALA 43 CO 0.62 -2.78 1.06 0.54 0.00 0.00 0.00 175.76 175.20 2jxw s VAL 44 N -2.66 3.66 0.13 0.00 0.11 -1.26 -5.06 120.40 115.31 2jxw s VAL 44 Ca 0.66 1.26 0.10 0.00 -2.93 0.00 0.00 61.98 61.07 2jxw s VAL 44 Cb -0.22 -3.65 -0.04 0.00 -1.53 0.00 0.00 36.38 30.94 2jxw s VAL 44 CO 0.59 -0.00 -0.20 -1.59 -3.33 0.00 0.00 175.10 170.56 2jxw s LYS 45 N -2.53 1.70 0.54 1.54 -2.85 -1.26 -5.07 119.74 111.80 2jxw s LYS 45 Ca 0.59 -1.25 0.00 0.00 -1.00 0.00 0.00 55.97 54.31 2jxw s LYS 45 Cb -0.23 -2.05 0.00 0.00 -2.06 0.00 0.00 37.83 33.49 2jxw s LYS 45 CO 0.28 0.47 0.00 -2.37 0.10 0.00 0.00 175.35 173.83 2jxw n THR 46 N 0.74 0.00 -2.45 3.79 5.66 -1.26 -4.79 114.28 115.97 2jxw n THR 46 Ca -0.16 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 60.85 2jxw n THR 46 Cb 0.53 -0.14 0.01 0.00 -1.55 0.00 0.00 70.33 69.18 2jxw n THR 46 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 2jxw n VAL 47 N -1.81 0.16 -4.91 1.08 0.31 -1.26 -5.10 118.33 106.81 2jxw n VAL 47 Ca 0.00 -1.04 -0.31 0.00 -0.01 0.00 0.00 64.34 62.99 2jxw n VAL 47 Cb 0.19 0.94 -0.14 0.00 -0.91 0.00 0.00 33.84 33.92 2jxw n VAL 47 CO 0.00 0.00 0.00 0.26 -1.32 0.00 0.00 176.83 175.77 2jxw s TRP 48 N -0.47 2.41 -0.10 3.52 0.52 -1.26 -3.81 118.94 119.74 2jxw s TRP 48 Ca 0.25 -0.36 -0.04 0.00 0.02 0.00 0.00 56.10 55.97 2jxw s TRP 48 Cb 0.31 -1.44 -0.04 0.00 -1.15 0.00 0.00 33.47 31.15 2jxw s TRP 48 CO -0.12 0.14 0.06 0.54 0.02 0.00 0.00 176.95 177.59 2jxw s VAL 49 N -0.80 4.81 -0.22 4.03 0.11 -0.56 -4.90 120.40 122.87 2jxw s VAL 49 Ca 0.12 -0.05 -0.19 0.00 -2.93 0.00 0.00 61.98 58.92 2jxw s VAL 49 Cb -0.10 -3.06 -0.03 0.00 -1.53 0.00 0.00 36.38 31.66 2jxw s VAL 49 CO 0.02 0.60 0.57 -0.70 -3.33 0.00 0.00 175.10 172.27 2jxw s GLU 50 N -0.88 4.15 0.22 1.54 -6.30 -1.26 -2.34 118.70 113.83 2jxw s GLU 50 Ca 0.13 0.47 0.11 0.00 -2.50 0.00 0.00 54.97 53.19 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 0.03 -0.27 -0.19 0.20 0.02 0.00 0.00 175.26 175.04 2jxw s GLY 51 N 1.32 1.76 -0.09 -1.50 0.00 0.18 -4.98 107.32 104.02 2jxw s GLY 51 Ca 0.25 -1.69 -0.01 0.00 0.00 0.00 0.00 44.72 43.27 2jxw s GLY 51 CO 0.09 -1.74 -0.04 -2.27 0.00 0.00 0.00 173.10 169.15 2jxw s LEU 52 N -3.01 3.32 0.11 0.66 2.96 -1.26 -0.92 118.68 120.53 2jxw s LEU 52 Ca 0.25 0.01 0.07 0.00 -0.22 0.00 0.00 54.13 54.24 2jxw s LEU 52 Cb -0.07 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 2jxw s LEU 52 CO 0.13 0.33 -0.17 -0.55 -1.32 0.00 0.00 176.35 174.77 2jxw s SER 53 N -0.58 2.14 0.73 3.68 0.15 -0.12 -4.93 113.70 114.78 2jxw s SER 53 Ca 0.09 -0.73 -0.17 0.00 0.70 0.00 0.00 55.95 55.85 2jxw s SER 53 Cb -0.12 -0.09 -0.07 0.00 -1.71 0.00 0.00 66.02 64.02 2jxw s SER 53 CO 0.02 -0.05 0.19 -0.62 1.20 0.00 0.00 173.24 173.98 2jxw n GLU 54 N 0.87 0.16 -1.04 5.44 1.02 -1.26 -1.61 120.64 124.23 2jxw n GLU 54 Ca -0.18 0.08 -0.01 0.00 -0.02 0.00 0.00 57.16 57.03 2jxw n GLU 54 Cb 0.55 -1.54 -0.01 0.00 -0.02 0.00 0.00 31.44 30.43 2jxw n GLU 54 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2jxw n ASP 55 N 0.80 -4.88 -1.97 1.62 8.00 -1.26 -3.71 116.55 115.14 2jxw n ASP 55 Ca 0.08 0.03 -0.02 0.00 0.71 0.00 0.00 54.79 55.59 2jxw n ASP 55 Cb 0.50 -2.50 0.01 0.00 -0.02 0.00 0.00 41.12 39.11 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 -0.54 -0.27 2.81 0.44 0.00 -0.88 -5.07 105.19 101.69 2jxw n GLY 56 Ca -0.01 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.04 1.69 -0.22 1.61 0.08 -0.63 -4.98 117.98 112.49 2jxw s PHE 57 Ca 0.05 -1.37 -0.28 0.00 0.12 0.00 0.00 56.93 55.44 2jxw s PHE 57 Cb -0.01 -1.38 0.01 0.00 -0.57 0.00 0.00 43.02 41.07 2jxw s PHE 57 CO 0.22 -0.72 1.01 0.99 -0.10 0.00 0.00 175.22 176.62 2jxw s THR 58 N 1.63 4.71 0.04 0.64 2.01 -1.26 -0.94 115.64 122.47 2jxw s THR 58 Ca -0.01 1.97 0.05 0.00 0.31 0.00 0.00 61.69 64.02 2jxw s THR 58 Cb -0.18 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.01 2jxw s THR 58 CO -0.10 -0.15 -0.10 -0.72 -0.69 0.00 0.00 174.62 172.85 2jxw s TYR 59 N 3.06 2.77 0.01 4.92 1.13 -0.10 -4.82 117.35 124.32 2jxw s TYR 59 Ca 0.43 -0.12 0.09 0.00 -1.41 0.00 0.00 57.07 56.05 2jxw s TYR 59 Cb -0.15 -1.52 -0.02 0.00 -1.10 0.00 0.00 41.96 39.16 2jxw s TYR 59 CO 0.07 0.36 -0.26 0.71 -2.51 0.00 0.00 175.55 173.92 2jxw s TYR 60 N -1.05 2.33 0.05 -3.49 2.02 0.49 0.51 117.35 118.21 2jxw s TYR 60 Ca 0.18 -0.43 0.06 0.00 -0.37 0.00 0.00 57.07 56.51 2jxw s TYR 60 Cb -0.11 -1.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.97 2jxw s TYR 60 CO 0.09 0.03 -0.18 -0.47 -1.57 0.00 0.00 175.55 173.46 2jxw s TYR 61 N -0.70 1.55 -0.16 2.71 6.14 -0.99 0.84 117.35 126.74 2jxw s TYR 61 Ca 0.11 -0.37 -0.01 0.00 0.64 0.00 0.00 57.07 57.44 2jxw s TYR 61 Cb -0.10 -0.92 -0.01 0.00 0.42 0.00 0.00 41.96 41.35 2jxw s TYR 61 CO 0.00 0.08 -0.11 1.21 0.64 0.00 0.00 175.55 177.37 2jxw s ASN 62 N -1.22 4.01 0.36 4.32 2.47 -1.17 -1.49 114.94 122.22 2jxw s ASN 62 Ca 0.05 -0.37 0.19 0.00 0.42 0.00 0.00 52.86 53.14 2jxw s ASN 62 Cb -0.08 -1.64 0.46 0.00 -1.45 0.00 0.00 41.25 38.54 2jxw s ASN 62 CO 0.02 0.10 1.62 0.71 -3.72 0.00 0.00 177.10 175.83 2jxw h THR 63 N 5.54 0.72 0.48 -5.21 1.35 -1.92 0.08 112.91 113.96 2jxw h THR 63 Ca -0.32 -1.69 -0.02 0.00 -0.55 0.00 0.00 66.41 63.83 2jxw h THR 63 Cb 1.19 2.11 -0.01 0.00 -1.73 0.00 0.00 68.15 69.71 2jxw h THR 63 CO 0.58 0.36 -0.39 -0.08 -0.25 0.00 0.00 175.52 175.74 2jxw h GLU 64 N 0.00 -0.81 0.09 4.72 4.81 -1.95 -3.33 114.58 118.10 2jxw h GLU 64 Ca -0.00 0.06 -0.35 0.00 -0.13 0.00 0.00 59.36 58.93 2jxw h GLU 64 Cb 1.08 0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.61 2jxw h GLU 64 CO 0.05 -0.54 -1.99 0.25 -0.73 0.00 0.00 179.01 176.05 2jxw n THR 65 N -4.77 1.71 -0.83 0.32 -2.24 -1.25 -5.03 114.28 102.18 2jxw n THR 65 Ca -0.10 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 2jxw n THR 65 Cb 0.37 -1.53 0.00 0.00 -2.10 0.00 0.00 70.33 67.07 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 1.92 0.49 2.95 3.38 0.00 0.01 -5.10 105.19 108.84 2jxw n GLY 66 Ca -0.30 -0.20 -0.17 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.10 0.51 0.26 1.61 2.12 -1.20 -4.99 118.70 115.91 2jxw s GLU 67 Ca 0.00 -0.18 -0.29 0.00 0.36 0.00 0.00 54.97 54.85 2jxw s GLU 67 Cb 0.00 -0.51 -0.09 0.00 0.26 0.00 0.00 34.13 33.79 2jxw s GLU 67 CO 0.00 0.09 0.99 -1.54 -0.54 0.00 0.00 175.26 174.25 2jxw s SER 68 N 0.05 7.50 0.11 -1.70 1.04 -1.26 -3.02 113.70 116.42 2jxw s SER 68 Ca -0.00 2.03 0.03 0.00 0.48 0.00 0.00 55.95 58.49 2jxw s SER 68 Cb -0.04 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.42 2jxw s SER 68 CO -0.00 0.05 -0.09 -0.60 0.98 0.00 0.00 173.24 173.58 2jxw s ARG 69 N -1.34 0.89 -0.19 4.02 6.06 0.25 -5.00 118.95 123.63 2jxw s ARG 69 Ca 0.43 -1.28 0.14 0.00 -2.50 0.00 0.00 55.73 52.52 2jxw s ARG 69 Cb -0.27 -0.45 0.44 0.00 0.06 0.00 0.00 34.95 34.73 2jxw s ARG 69 CO 0.34 0.05 1.19 0.91 -2.50 0.00 0.00 175.30 175.29 2jxw n TRP 70 N 0.20 0.84 -3.69 5.12 7.02 -1.26 -0.38 117.44 125.29 2jxw n TRP 70 Ca -0.13 -1.56 -0.14 0.00 -1.02 0.00 0.00 57.50 54.65 2jxw n TRP 70 Cb 0.59 -0.25 -0.14 0.00 -2.42 0.00 0.00 31.31 29.09 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 -2.76 0.14 -0.12 -0.99 0.41 -1.26 -4.98 118.70 109.14 2jxw s GLU 71 Ca 0.39 0.61 -0.29 0.00 -0.41 0.00 0.00 54.97 55.28 2jxw s GLU 71 Cb 0.38 -0.12 -0.07 0.00 -1.78 0.00 0.00 34.13 32.54 2jxw s GLU 71 CO -0.06 -0.24 2.14 0.36 -0.49 0.00 0.00 175.26 176.96 2jxw n LYS 72 N 4.90 2.31 -0.29 1.61 2.85 -1.26 -4.95 118.16 123.34 2jxw n LYS 72 Ca -0.14 0.73 -0.23 0.00 -1.05 0.00 0.00 58.31 57.62 2jxw n LYS 72 Cb 0.51 -3.16 0.22 0.00 -0.65 0.00 0.00 35.03 31.95 2jxw n LYS 72 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 2jxw n PRO 73 N 8.32 -3.93 -4.41 -1.58 -0.02 -1.26 -5.08 135.00 127.04 2jxw n PRO 73 Ca 0.26 -1.15 -0.21 0.00 -2.02 0.00 0.00 63.50 60.38 2jxw n PRO 73 Cb 0.43 -1.41 -0.10 0.00 -0.02 0.00 0.00 33.50 32.40 2jxw n PRO 73 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2jxw s ASP 74 N -3.01 2.72 0.00 2.55 -1.08 -1.26 -5.23 116.67 111.37 2jxw s ASP 74 Ca 0.52 -1.16 0.00 0.00 -0.52 0.00 0.00 52.55 51.38 2jxw s ASP 74 Cb -0.08 -0.16 0.00 0.00 -1.46 0.00 0.00 42.92 41.22 2jxw s ASP 74 CO 0.42 -0.31 0.25 -0.67 0.52 0.00 0.00 175.17 175.38