#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 3.26 -0.20 -0.67 0.04 -1.26 -5.00 135.00 131.18 2jxw s PRO 2 Ca 0.00 1.51 0.08 0.00 0.04 0.00 0.00 61.00 62.63 2jxw s PRO 2 Cb 0.00 -2.00 -0.18 0.00 0.04 0.00 0.00 34.50 32.36 2jxw s PRO 2 CO 0.00 -0.90 -0.08 0.45 0.04 0.00 0.00 177.00 176.51 2jxw n SER 3 N -1.59 1.50 -3.06 6.66 2.88 -1.26 -5.07 113.62 113.68 2jxw n SER 3 Ca 0.11 -0.06 -0.12 0.00 -1.33 0.00 0.00 58.87 57.46 2jxw n SER 3 Cb 0.51 0.26 -0.01 0.00 -0.75 0.00 0.00 64.21 64.22 2jxw n SER 3 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2jxw s LYS 4 N -2.44 2.09 -0.02 -1.46 -2.85 -1.26 -5.18 119.74 108.62 2jxw s LYS 4 Ca -0.20 -1.63 0.07 0.00 -1.00 0.00 0.00 55.97 53.21 2jxw s LYS 4 Cb 0.07 0.53 -0.02 0.00 -2.06 0.00 0.00 37.83 36.35 2jxw s LYS 4 CO 0.61 -0.92 -0.22 0.20 0.10 0.00 0.00 175.35 175.12 2jxw s GLY 5 N -3.17 1.08 -0.93 0.59 0.00 -1.26 -5.08 107.32 98.56 2jxw s GLY 5 Ca 0.24 -0.94 -0.24 0.00 0.00 0.00 0.00 44.72 43.77 2jxw s GLY 5 CO 0.17 -0.77 1.45 0.50 0.00 0.00 0.00 173.10 174.45 2jxw s ARG 6 N -0.49 3.39 -0.03 2.90 1.81 -1.26 -4.91 118.95 120.36 2jxw s ARG 6 Ca 0.08 -0.79 0.04 0.00 -1.72 0.00 0.00 55.73 53.34 2jxw s ARG 6 Cb -0.09 -5.01 -0.01 0.00 -0.45 0.00 0.00 34.95 29.40 2jxw s ARG 6 CO -0.01 -2.29 -0.16 -1.58 -0.68 0.00 0.00 175.30 170.58 2jxw s TRP 7 N 5.65 1.55 0.09 -0.53 0.52 -1.26 -3.43 118.94 121.53 2jxw s TRP 7 Ca 0.45 -0.39 0.09 0.00 0.02 0.00 0.00 56.10 56.28 2jxw s TRP 7 Cb -0.03 -1.03 -0.04 0.00 -1.15 0.00 0.00 33.47 31.23 2jxw s TRP 7 CO -0.02 -0.11 -0.21 0.54 0.02 0.00 0.00 176.95 177.18 2jxw s VAL 8 N -0.10 2.64 -0.18 4.03 0.11 -0.99 -4.78 120.40 121.13 2jxw s VAL 8 Ca -0.00 -1.44 -0.09 0.00 -2.93 0.00 0.00 61.98 57.52 2jxw s VAL 8 Cb -0.09 -2.15 -0.05 0.00 -1.53 0.00 0.00 36.38 32.56 2jxw s VAL 8 CO 0.01 0.20 0.12 -0.70 -3.33 0.00 0.00 175.10 171.40 2jxw s GLU 9 N -1.81 4.03 0.04 1.54 -6.30 -1.26 -2.35 118.70 112.58 2jxw s GLU 9 Ca 0.15 -0.23 0.02 0.00 -2.50 0.00 0.00 54.97 52.42 2jxw s GLU 9 Cb -0.10 -3.34 -0.02 0.00 0.00 0.00 0.00 34.13 30.66 2jxw s GLU 9 CO 0.07 0.38 -0.08 0.20 0.02 0.00 0.00 175.26 175.85 2jxw s GLY 10 N 0.13 0.50 0.06 -1.50 0.00 0.47 -5.01 107.32 101.97 2jxw s GLY 10 Ca 0.08 -0.71 -0.10 0.00 0.00 0.00 0.00 44.72 43.99 2jxw s GLY 10 CO -0.01 -0.74 0.39 -0.42 0.00 0.00 0.00 173.10 172.32 2jxw s ILE 11 N -1.20 5.11 0.22 0.90 -1.09 -1.26 -0.93 121.20 122.95 2jxw s ILE 11 Ca -0.08 0.49 0.07 0.00 -2.23 0.00 0.00 60.65 58.90 2jxw s ILE 11 Cb -0.09 -3.65 -0.05 0.00 -1.58 0.00 0.00 42.46 37.10 2jxw s ILE 11 CO 0.00 0.35 -0.11 0.42 -1.23 0.00 0.00 174.94 174.37 2jxw s THR 12 N -1.33 1.61 0.64 2.92 -4.23 -0.40 -4.93 115.64 109.91 2jxw s THR 12 Ca 0.31 -2.16 -0.17 0.00 -1.18 0.00 0.00 61.69 58.48 2jxw s THR 12 Cb -0.14 -2.15 -0.10 0.00 1.34 0.00 0.00 72.50 71.44 2jxw s THR 12 CO 0.17 -0.51 0.17 -0.24 -0.54 0.00 0.00 174.62 173.67 2jxw n SER 13 N -0.42 -2.49 0.00 3.99 2.88 -1.26 -2.53 113.62 113.79 2jxw n SER 13 Ca -0.07 0.61 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 2jxw n SER 13 Cb 0.61 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 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 0.52 0.00 0.00 -1.46 4.07 -1.26 -3.93 120.64 118.59 2jxw n GLU 14 Ca 0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.18 2jxw n GLU 14 Cb 0.49 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.87 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 -0.06 3.45 8.31 0.00 -1.05 -5.17 105.19 110.66 2jxw n GLY 15 Ca 0.00 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 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 2.41 -0.27 1.61 2.02 -1.19 -4.98 117.35 116.95 2jxw s TYR 16 Ca 0.00 -0.32 -0.05 0.00 -0.37 0.00 0.00 57.07 56.32 2jxw s TYR 16 Cb 0.00 -1.25 0.00 0.00 -0.40 0.00 0.00 41.96 40.31 2jxw s TYR 16 CO 0.00 0.42 0.03 -1.01 -1.57 0.00 0.00 175.55 173.42 2jxw s HIS 17 N -1.32 3.09 0.12 2.71 3.76 -1.26 -1.28 115.29 121.11 2jxw s HIS 17 Ca 0.18 -0.99 0.07 0.00 -0.15 0.00 0.00 55.06 54.17 2jxw s HIS 17 Cb -0.09 -2.19 -0.04 0.00 1.11 0.00 0.00 32.58 31.37 2jxw s HIS 17 CO 0.09 -0.57 -0.04 1.52 -0.85 0.00 0.00 174.74 174.89 2jxw s TYR 18 N 1.48 2.84 0.10 1.40 1.13 -0.11 -4.78 117.35 119.41 2jxw s TYR 18 Ca 0.03 -0.11 0.08 0.00 -1.41 0.00 0.00 57.07 55.66 2jxw s TYR 18 Cb -0.16 -1.44 -0.03 0.00 -1.10 0.00 0.00 41.96 39.22 2jxw s TYR 18 CO 0.00 0.47 -0.22 0.71 -2.51 0.00 0.00 175.55 174.01 2jxw s TYR 19 N -1.40 1.86 0.09 -3.49 2.02 0.73 -0.39 117.35 116.77 2jxw s TYR 19 Ca 0.25 -0.41 0.08 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 0.21 -0.20 -0.47 -1.57 0.00 0.00 175.55 173.68 2jxw s TYR 20 N -1.10 1.71 -0.17 2.71 5.04 -0.99 0.66 117.35 125.20 2jxw s TYR 20 Ca 0.07 -0.42 0.01 0.00 -2.44 0.00 0.00 57.07 54.30 2jxw s TYR 20 Cb -0.10 -0.94 0.01 0.00 0.35 0.00 0.00 41.96 41.28 2jxw s TYR 20 CO 0.04 0.17 -0.19 0.34 -1.34 0.00 0.00 175.55 174.57 2jxw s ASP 21 N -1.82 3.25 0.18 4.32 2.15 -0.79 -2.35 116.67 121.62 2jxw s ASP 21 Ca 0.05 -0.60 0.14 0.00 0.43 0.00 0.00 52.55 52.57 2jxw s ASP 21 Cb -0.10 -1.49 -0.05 0.00 -0.30 0.00 0.00 42.92 40.97 2jxw s ASP 21 CO 0.04 0.03 1.23 0.17 -0.17 0.00 0.00 175.17 176.47 2jxw h LEU 22 N 7.71 0.00 -0.44 -1.34 -0.00 -1.88 0.63 115.31 119.99 2jxw h LEU 22 Ca -0.40 0.00 0.05 0.00 -0.00 0.00 0.00 57.88 57.53 2jxw h LEU 22 Cb 1.16 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.78 2jxw h LEU 22 CO 0.61 0.65 0.18 0.40 -0.00 0.00 0.00 178.44 180.27 2jxw h ILE 23 N 0.00 0.90 0.00 0.15 2.04 -1.95 -3.33 117.51 115.32 2jxw h ILE 23 Ca -0.06 -0.12 -0.34 0.00 1.00 0.00 0.00 64.86 65.34 2jxw h ILE 23 Cb 1.54 0.50 -0.06 0.00 -0.74 0.00 0.00 36.82 38.07 2jxw h ILE 23 CO 0.07 0.07 -2.23 -1.20 0.00 0.00 0.00 178.15 174.87 2jxw n SER 24 N -4.98 2.02 0.00 1.72 7.64 -1.25 -5.05 113.62 113.72 2jxw n SER 24 Ca 0.03 0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.97 2jxw n SER 24 Cb 0.15 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 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 2.10 1.31 3.46 0.23 0.00 0.20 -5.11 105.19 107.38 2jxw n GLY 25 Ca -0.40 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.00 2.68 -0.19 4.61 0.00 -1.15 -4.96 121.76 120.75 2jxw s ALA 26 Ca 0.00 -1.73 -0.10 0.00 0.00 0.00 0.00 51.96 50.13 2jxw s ALA 26 Cb 0.00 -0.35 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 2jxw s ALA 26 CO 0.00 0.36 0.13 -1.54 0.00 0.00 0.00 175.76 174.71 2jxw s SER 27 N -3.07 6.22 0.37 0.00 1.04 -1.26 -1.88 113.70 115.11 2jxw s SER 27 Ca 0.25 0.25 0.07 0.00 0.48 0.00 0.00 55.95 57.01 2jxw s SER 27 Cb -0.07 -2.08 -0.07 0.00 0.10 0.00 0.00 66.02 63.90 2jxw s SER 27 CO 0.13 0.21 -0.01 -1.58 0.98 0.00 0.00 173.24 172.96 2jxw s GLN 28 N 0.20 1.83 0.00 4.02 0.74 0.21 -5.01 119.66 121.65 2jxw s GLN 28 Ca 0.09 -2.00 0.00 0.00 0.05 0.00 0.00 55.36 53.50 2jxw s GLN 28 Cb -0.11 -1.45 0.00 0.00 1.10 0.00 0.00 33.01 32.55 2jxw s GLN 28 CO -0.01 -0.03 0.00 0.91 -0.55 0.00 0.00 175.29 175.61 2jxw n TRP 29 N -0.84 0.00 -2.33 1.67 7.02 -1.26 -0.19 117.44 121.51 2jxw n TRP 29 Ca -0.05 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.01 2jxw n TRP 29 Cb 0.66 0.10 -0.02 0.00 -2.42 0.00 0.00 31.31 29.62 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 -1.83 4.19 0.03 -0.99 2.02 -1.26 -4.58 118.70 116.29 2jxw s GLU 30 Ca 0.00 1.75 -0.30 0.00 0.02 0.00 0.00 54.97 56.44 2jxw s GLU 30 Cb 0.00 -3.82 -0.07 0.00 0.10 0.00 0.00 34.13 30.34 2jxw s GLU 30 CO 0.00 -0.77 1.51 0.21 0.02 0.00 0.00 175.26 176.23 2jxw s LYS 31 N 3.68 4.25 0.89 1.61 2.20 -1.26 -5.00 119.74 126.11 2jxw s LYS 31 Ca 0.59 2.13 -0.12 0.00 -0.36 0.00 0.00 55.97 58.21 2jxw s LYS 31 Cb -0.24 -3.57 0.13 0.00 -1.51 0.00 0.00 37.83 32.64 2jxw s LYS 31 CO 0.18 -0.64 1.10 -1.25 -0.36 0.00 0.00 175.35 174.39 2jxw s PRO 32 N 2.46 1.28 -0.05 4.03 0.04 -1.26 -4.95 135.00 136.54 2jxw s PRO 32 Ca 0.68 0.58 -0.30 0.00 0.04 0.00 0.00 61.00 62.01 2jxw s PRO 32 Cb -0.35 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.30 2jxw s PRO 32 CO 0.29 -2.17 1.66 -2.00 0.04 0.00 0.00 177.00 174.82 2jxw s GLU 33 N -5.08 4.18 0.00 4.56 2.12 -1.26 -4.23 118.70 119.00 2jxw s GLU 33 Ca 0.63 2.20 0.00 0.00 0.36 0.00 0.00 54.97 58.16 2jxw s GLU 33 Cb -0.16 -3.99 0.00 0.00 0.26 0.00 0.00 34.13 30.24 2jxw s GLU 33 CO 0.55 -0.85 0.00 0.41 -0.54 0.00 0.00 175.26 174.84 2jxw n GLY 34 N 4.14 1.37 0.97 -1.50 0.00 -1.26 -5.09 105.19 103.82 2jxw n GLY 34 Ca 0.17 -0.79 0.12 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.61 -1.59 1.61 7.35 -1.26 -4.44 117.46 116.52 2jxw n PHE 35 Ca 0.00 1.44 -0.37 0.00 -0.76 0.00 0.00 57.45 57.76 2jxw n PHE 35 Cb 0.00 -2.38 -0.03 0.00 0.35 0.00 0.00 39.48 37.42 2jxw n PHE 35 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2jxw s GLN 36 N -3.88 2.24 0.00 -4.13 -0.21 -1.26 -4.40 119.66 108.02 2jxw s GLN 36 Ca 0.00 1.43 0.00 0.00 0.02 0.00 0.00 55.36 56.81 2jxw s GLN 36 Cb 0.00 -4.55 0.00 0.00 1.00 0.00 0.00 33.01 29.46 2jxw s GLN 36 CO 0.00 -3.12 0.00 0.41 -2.12 0.00 0.00 175.29 170.46 2jxw n GLY 37 N 5.96 0.38 2.51 3.09 0.00 -1.26 -5.08 105.19 110.79 2jxw n GLY 37 Ca 0.35 -1.31 -0.05 0.00 0.00 0.00 0.00 46.02 45.01 2jxw n GLY 37 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jxw n ASP 38 N 0.00 -0.54 -2.14 1.61 2.03 -1.26 -4.93 116.55 111.32 2jxw n ASP 38 Ca 0.00 1.28 -0.29 0.00 0.52 0.00 0.00 54.79 56.30 2jxw n ASP 38 Cb 0.00 -5.01 0.09 0.00 -0.72 0.00 0.00 41.12 35.48 2jxw n ASP 38 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2jxw n LEU 39 N 1.61 6.63 -3.83 -2.67 4.32 -1.26 -4.94 117.00 116.86 2jxw n LEU 39 Ca -0.40 -4.29 -0.13 0.00 -0.02 0.00 0.00 56.01 51.18 2jxw n LEU 39 Cb 0.61 -0.78 -0.14 0.00 -1.62 0.00 0.00 43.42 41.49 2jxw n LEU 39 CO 0.37 1.56 -0.32 -0.54 -1.22 0.00 0.00 177.39 177.24 2jxw s LYS 40 N -3.67 0.02 -1.08 3.23 1.02 -1.26 -5.05 119.74 112.95 2jxw s LYS 40 Ca 0.59 0.11 -0.08 0.00 0.02 0.00 0.00 55.97 56.61 2jxw s LYS 40 Cb 0.47 -0.07 -0.11 0.00 -0.52 0.00 0.00 37.83 37.61 2jxw s LYS 40 CO 0.01 -0.06 3.07 1.63 -0.92 0.00 0.00 175.35 179.09 2jxw n LYS 41 N 3.47 3.27 -1.10 1.68 5.02 -1.26 -4.92 118.16 124.31 2jxw n LYS 41 Ca -0.18 -2.02 0.14 0.00 -2.02 0.00 0.00 58.31 54.23 2jxw n LYS 41 Cb 0.56 -2.52 -0.06 0.00 -0.02 0.00 0.00 35.03 32.99 2jxw n LYS 41 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2jxw n THR 42 N 2.92 -0.24 -2.42 -0.18 -1.04 -1.26 -4.84 114.28 107.21 2jxw n THR 42 Ca 0.65 0.49 -0.38 0.00 -2.04 0.00 0.00 64.05 62.78 2jxw n THR 42 Cb 0.44 -0.86 -0.03 0.00 -1.82 0.00 0.00 70.33 68.05 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 -3.31 3.19 -0.21 2.41 0.00 -1.26 -4.98 121.76 117.61 2jxw s ALA 43 Ca 0.00 0.86 0.22 0.00 0.00 0.00 0.00 51.96 53.03 2jxw s ALA 43 Cb 0.00 -3.33 0.49 0.00 0.00 0.00 0.00 23.12 20.28 2jxw s ALA 43 CO 0.00 -0.33 1.13 0.28 0.00 0.00 0.00 175.76 176.84 2jxw n VAL 44 N 0.28 1.15 -3.27 0.00 0.31 -1.26 -4.96 118.33 110.57 2jxw n VAL 44 Ca 0.03 -2.65 -0.22 0.00 -0.01 0.00 0.00 64.34 61.49 2jxw n VAL 44 Cb 0.47 0.98 -0.08 0.00 -0.91 0.00 0.00 33.84 34.30 2jxw n VAL 44 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2jxw s LYS 45 N -2.99 0.91 -0.27 5.55 1.02 -1.26 -5.09 119.74 117.61 2jxw s LYS 45 Ca 0.31 -1.82 0.00 0.00 0.02 0.00 0.00 55.97 54.48 2jxw s LYS 45 Cb 0.34 -1.11 0.08 0.00 -0.52 0.00 0.00 37.83 36.62 2jxw s LYS 45 CO -0.06 -1.36 0.02 0.95 -0.92 0.00 0.00 175.35 173.98 2jxw s THR 46 N 0.32 1.29 -0.17 2.17 -4.23 -1.26 -4.96 115.64 108.81 2jxw s THR 46 Ca 0.31 -1.35 0.17 0.00 -1.18 0.00 0.00 61.69 59.65 2jxw s THR 46 Cb 0.01 -1.78 -0.25 0.00 1.34 0.00 0.00 72.50 71.82 2jxw s THR 46 CO -0.15 -0.37 0.45 0.55 -0.54 0.00 0.00 174.62 174.55 2jxw n VAL 47 N 4.72 0.00 -4.54 2.29 3.14 -1.26 -4.97 118.33 117.70 2jxw n VAL 47 Ca -0.06 -0.34 -0.31 0.00 -2.96 0.00 0.00 64.34 60.66 2jxw n VAL 47 Cb 0.44 0.27 -0.11 0.00 -1.06 0.00 0.00 33.84 33.37 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 -3.10 2.71 -0.13 1.45 0.52 -1.26 -3.74 118.94 115.40 2jxw s TRP 48 Ca -0.04 -0.16 -0.01 0.00 0.02 0.00 0.00 56.10 55.91 2jxw s TRP 48 Cb 0.11 -1.52 -0.02 0.00 -1.15 0.00 0.00 33.47 30.89 2jxw s TRP 48 CO 0.72 0.32 -0.08 0.08 0.02 0.00 0.00 176.95 178.00 2jxw s VAL 49 N -0.98 3.50 -0.24 4.03 1.01 -0.84 -4.90 120.40 121.98 2jxw s VAL 49 Ca 0.16 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.47 2jxw s VAL 49 Cb -0.11 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 2jxw s VAL 49 CO 0.07 0.52 0.41 -1.61 0.00 0.00 0.00 175.10 174.49 2jxw s GLU 50 N 0.16 4.09 0.25 2.72 8.01 -1.26 -2.43 118.70 130.24 2jxw s GLU 50 Ca -0.04 0.15 0.11 0.00 0.01 0.00 0.00 54.97 55.21 2jxw s GLU 50 Cb -0.14 -3.60 -0.05 0.00 -4.31 0.00 0.00 34.13 26.03 2jxw s GLU 50 CO 0.04 -0.19 -0.18 0.20 0.01 0.00 0.00 175.26 175.14 2jxw s GLY 51 N 1.37 1.80 -0.23 -1.39 0.00 0.43 -4.92 107.32 104.38 2jxw s GLY 51 Ca 0.18 -1.76 -0.06 0.00 0.00 0.00 0.00 44.72 43.08 2jxw s GLY 51 CO 0.09 -1.83 0.02 -2.27 0.00 0.00 0.00 173.10 169.11 2jxw s LEU 52 N -3.25 3.24 -0.03 0.66 2.96 -1.26 -1.02 118.68 119.98 2jxw s LEU 52 Ca 0.27 -0.25 -0.04 0.00 -0.22 0.00 0.00 54.13 53.89 2jxw s LEU 52 Cb -0.06 -1.84 0.01 0.00 0.50 0.00 0.00 46.19 44.79 2jxw s LEU 52 CO 0.14 0.00 0.11 -0.44 -1.32 0.00 0.00 176.35 174.84 2jxw s SER 53 N 1.37 -0.07 -0.20 3.68 0.01 -0.69 -4.92 113.70 112.89 2jxw s SER 53 Ca 0.05 0.12 -0.05 0.00 1.31 0.00 0.00 55.95 57.37 2jxw s SER 53 Cb -0.15 0.22 0.02 0.00 0.21 0.00 0.00 66.02 66.32 2jxw s SER 53 CO 0.01 -0.11 0.10 1.21 0.41 0.00 0.00 173.24 174.87 2jxw n GLU 54 N 2.69 -3.41 0.00 12.44 4.07 -1.26 -1.11 120.64 134.06 2jxw n GLU 54 Ca -0.15 2.71 0.00 0.00 -0.06 0.00 0.00 57.16 59.66 2jxw n GLU 54 Cb 0.58 -4.34 0.00 0.00 -0.06 0.00 0.00 31.44 27.62 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 1.37 0.00 0.00 4.31 8.00 -1.26 -2.63 116.55 126.35 2jxw n ASP 55 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 2jxw n ASP 55 Cb 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 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 0.00 3.65 0.44 0.00 -1.25 -5.13 105.19 102.90 2jxw n GLY 56 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 3.34 -0.23 1.61 0.08 -0.27 -4.82 117.98 117.70 2jxw s PHE 57 Ca 0.00 1.14 -0.29 0.00 0.12 0.00 0.00 56.93 57.90 2jxw s PHE 57 Cb 0.00 -3.01 0.01 0.00 -0.57 0.00 0.00 43.02 39.45 2jxw s PHE 57 CO 0.00 -0.34 1.04 0.99 -0.10 0.00 0.00 175.22 176.81 2jxw s THR 58 N 2.56 4.68 0.04 0.64 2.01 -1.26 -1.70 115.64 122.63 2jxw s THR 58 Ca 0.35 2.02 0.05 0.00 0.31 0.00 0.00 61.69 64.42 2jxw s THR 58 Cb -0.16 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 68.01 2jxw s THR 58 CO 0.09 -0.18 -0.11 -0.72 -0.69 0.00 0.00 174.62 173.01 2jxw s TYR 59 N 3.18 2.75 0.00 4.92 -0.85 -0.19 -4.86 117.35 122.31 2jxw s TYR 59 Ca 0.44 -0.14 0.08 0.00 -0.52 0.00 0.00 57.07 56.93 2jxw s TYR 59 Cb -0.15 -1.51 -0.02 0.00 0.38 0.00 0.00 41.96 40.65 2jxw s TYR 59 CO 0.06 0.35 -0.25 0.71 -1.52 0.00 0.00 175.55 174.90 2jxw s TYR 60 N -1.04 2.35 0.12 -3.49 2.02 -0.83 -0.43 117.35 116.06 2jxw s TYR 60 Ca 0.18 -0.41 0.06 0.00 -0.37 0.00 0.00 57.07 56.52 2jxw s TYR 60 Cb -0.11 -1.47 -0.04 0.00 -0.40 0.00 0.00 41.96 39.95 2jxw s TYR 60 CO 0.09 0.04 -0.14 -0.47 -1.57 0.00 0.00 175.55 173.50 2jxw s TYR 61 N -0.70 1.38 -0.14 2.71 5.04 -1.02 0.13 117.35 124.75 2jxw s TYR 61 Ca 0.11 -0.57 -0.01 0.00 -2.44 0.00 0.00 57.07 54.16 2jxw s TYR 61 Cb -0.10 -0.72 -0.02 0.00 0.35 0.00 0.00 41.96 41.47 2jxw s TYR 61 CO 0.00 0.14 -0.12 1.21 -1.34 0.00 0.00 175.55 175.45 2jxw s ASN 62 N -2.50 4.10 -0.19 4.32 3.84 -1.07 -1.99 114.94 121.45 2jxw s ASN 62 Ca 0.09 -0.31 0.08 0.00 0.21 0.00 0.00 52.86 52.93 2jxw s ASN 62 Cb -0.04 -1.64 0.53 0.00 -0.55 0.00 0.00 41.25 39.55 2jxw s ASN 62 CO 0.03 0.15 1.41 0.35 -2.79 0.00 0.00 177.10 176.25 2jxw n THR 63 N 3.62 2.01 -0.08 -5.21 -2.24 -1.24 -3.24 114.28 107.88 2jxw n THR 63 Ca -0.18 -1.02 -0.07 0.00 -2.27 0.00 0.00 64.05 60.51 2jxw n THR 63 Cb 0.53 -0.42 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 2jxw n THR 63 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2jxw n GLU 64 N 0.19 0.49 -0.06 -0.78 2.13 -1.26 -4.84 120.64 116.51 2jxw n GLU 64 Ca 0.24 0.35 -0.07 0.00 0.66 0.00 0.00 57.16 58.33 2jxw n GLU 64 Cb 0.98 -1.54 -0.06 0.00 0.27 0.00 0.00 31.44 31.09 2jxw n GLU 64 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 2jxw n THR 65 N -4.52 0.70 0.00 6.31 5.66 -1.26 -5.08 114.28 116.08 2jxw n THR 65 Ca -0.11 -0.33 0.00 0.00 -3.05 0.00 0.00 64.05 60.56 2jxw n THR 65 Cb 0.41 -0.87 0.00 0.00 -1.55 0.00 0.00 70.33 68.32 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 2.71 0.74 3.19 1.09 0.00 -1.20 -5.14 105.19 106.58 2jxw n GLY 66 Ca -0.20 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.73 0.30 0.38 1.61 2.12 -1.25 -5.02 118.70 116.12 2jxw s GLU 67 Ca 0.00 0.77 -0.17 0.00 0.36 0.00 0.00 54.97 55.93 2jxw s GLU 67 Cb 0.00 0.02 -0.09 0.00 0.26 0.00 0.00 34.13 34.31 2jxw s GLU 67 CO 0.00 -0.19 0.83 -1.54 -0.54 0.00 0.00 175.26 173.81 2jxw s SER 68 N 1.72 6.80 0.12 -1.70 1.04 -1.26 -2.59 113.70 117.82 2jxw s SER 68 Ca -0.07 1.42 0.05 0.00 0.48 0.00 0.00 55.95 57.84 2jxw s SER 68 Cb -0.10 -2.43 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 2jxw s SER 68 CO -0.11 -0.30 -0.12 -0.60 0.98 0.00 0.00 173.24 173.08 2jxw s ARG 69 N -3.19 0.97 -0.13 4.02 3.52 0.35 -4.98 118.95 119.51 2jxw s ARG 69 Ca 0.57 -1.23 0.15 0.00 -0.13 0.00 0.00 55.73 55.09 2jxw s ARG 69 Cb -0.10 -0.76 0.36 0.00 -1.56 0.00 0.00 34.95 32.89 2jxw s ARG 69 CO 0.18 0.13 1.17 0.91 -0.81 0.00 0.00 175.30 176.89 2jxw n TRP 70 N 0.47 0.00 -3.84 5.12 7.02 -1.26 -1.96 117.44 122.99 2jxw n TRP 70 Ca -0.15 -1.03 -0.09 0.00 -1.02 0.00 0.00 57.50 55.21 2jxw n TRP 70 Cb 0.58 -0.19 -0.06 0.00 -2.42 0.00 0.00 31.31 29.21 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 -2.10 1.04 -0.51 -0.99 2.02 -1.26 -5.02 118.70 111.87 2jxw s GLU 71 Ca 0.32 -0.98 -0.24 0.00 0.02 0.00 0.00 54.97 54.09 2jxw s GLU 71 Cb 0.32 0.39 0.03 0.00 0.10 0.00 0.00 34.13 34.98 2jxw s GLU 71 CO -0.07 -0.38 0.91 0.21 0.02 0.00 0.00 175.26 175.96 2jxw s LYS 72 N -3.89 3.40 0.39 1.61 2.20 -1.26 -4.87 119.74 117.31 2jxw s LYS 72 Ca 0.09 -0.12 -0.26 0.00 -0.36 0.00 0.00 55.97 55.33 2jxw s LYS 72 Cb 0.03 -4.00 -0.09 0.00 -1.51 0.00 0.00 37.83 32.27 2jxw s LYS 72 CO -0.07 -1.35 1.19 -1.25 -0.36 0.00 0.00 175.35 173.51 2jxw s PRO 73 N 3.79 4.10 -0.30 4.03 0.04 -1.26 -5.04 135.00 140.36 2jxw s PRO 73 Ca 0.32 1.90 -0.09 0.00 0.04 0.00 0.00 61.00 63.17 2jxw s PRO 73 Cb -0.12 -2.74 0.18 0.00 0.04 0.00 0.00 34.50 31.86 2jxw s PRO 73 CO 0.22 -0.30 0.88 0.34 0.04 0.00 0.00 177.00 178.18 2jxw s ASP 74 N -1.03 -0.81 0.00 6.66 -1.08 -1.26 -5.24 116.67 113.90 2jxw s ASP 74 Ca 0.56 0.57 0.29 0.00 -0.52 0.00 0.00 52.55 53.45 2jxw s ASP 74 Cb -0.32 1.71 1.72 0.00 -1.46 0.00 0.00 42.92 44.57 2jxw s ASP 74 CO 0.41 -0.15 2.06 -0.67 0.52 0.00 0.00 175.17 177.33