#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jw2 n HIS 2 N 0.00 -2.84 -2.47 1.12 -0.00 -1.26 -4.84 115.22 104.92 2jw2 n HIS 2 Ca 0.00 0.99 -0.23 0.00 -0.00 0.00 0.00 57.72 58.48 2jw2 n HIS 2 Cb 0.00 -1.79 0.06 0.00 -0.00 0.00 0.00 29.99 28.26 2jw2 n HIS 2 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2jw2 s HIS 3 N -1.49 2.68 -0.30 4.41 4.02 -1.26 -5.11 115.29 118.25 2jw2 s HIS 3 Ca 0.00 0.11 -0.12 0.00 1.02 0.00 0.00 55.06 56.06 2jw2 s HIS 3 Cb 0.00 -2.96 0.16 0.00 -1.02 0.00 0.00 32.58 28.76 2jw2 s HIS 3 CO 0.00 -1.20 0.85 -1.58 1.02 0.00 0.00 174.74 173.84 2jw2 s HIS 4 N -2.99 -0.95 0.29 1.40 5.65 -1.26 -5.18 115.29 112.25 2jw2 s HIS 4 Ca 0.60 1.54 -0.17 0.00 0.25 0.00 0.00 55.06 57.28 2jw2 s HIS 4 Cb -0.10 0.53 0.02 0.00 -1.18 0.00 0.00 32.58 31.85 2jw2 s HIS 4 CO 0.41 -0.48 0.66 -1.01 -0.65 0.00 0.00 174.74 173.68 2jw2 s HIS 5 N 2.66 0.05 0.48 3.88 4.02 -1.26 -5.18 115.29 119.94 2jw2 s HIS 5 Ca -0.02 -0.51 0.08 0.00 1.02 0.00 0.00 55.06 55.64 2jw2 s HIS 5 Cb -0.09 0.57 0.03 0.00 -1.02 0.00 0.00 32.58 32.08 2jw2 s HIS 5 CO -0.18 -1.23 0.60 -1.01 1.02 0.00 0.00 174.74 173.94 2jw2 s HIS 6 N -3.64 2.19 0.26 1.40 0.09 -1.26 -5.14 115.29 109.19 2jw2 s HIS 6 Ca 0.15 -0.57 -0.04 0.00 -0.00 0.00 0.00 55.06 54.60 2jw2 s HIS 6 Cb -0.04 -2.24 -0.02 0.00 -0.00 0.00 0.00 32.58 30.28 2jw2 s HIS 6 CO 0.09 -0.63 0.32 -1.01 -0.00 0.00 0.00 174.74 173.51 2jw2 s HIS 7 N -2.52 0.96 -0.12 1.40 4.02 -1.26 -5.18 115.29 112.59 2jw2 s HIS 7 Ca 0.54 -1.19 -0.27 0.00 1.02 0.00 0.00 55.06 55.16 2jw2 s HIS 7 Cb -0.07 -0.25 0.06 0.00 -1.02 0.00 0.00 32.58 31.31 2jw2 s HIS 7 CO 0.33 -0.88 0.64 0.45 1.02 0.00 0.00 174.74 176.31 2jw2 s SER 8 N -3.16 -0.63 0.00 1.40 0.15 -1.26 -5.18 113.70 105.03 2jw2 s SER 8 Ca 0.32 0.89 -0.29 0.00 0.70 0.00 0.00 55.95 57.57 2jw2 s SER 8 Cb 0.03 0.81 0.10 0.00 -1.71 0.00 0.00 66.02 65.25 2jw2 s SER 8 CO 0.14 -0.46 0.95 -0.44 1.20 0.00 0.00 173.24 174.64 2jw2 s SER 9 N -0.66 -0.29 0.00 5.45 0.01 -1.26 -5.17 113.70 111.78 2jw2 s SER 9 Ca -0.07 -0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.10 2jw2 s SER 9 Cb -0.02 0.37 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2jw2 s SER 9 CO 0.06 -0.62 0.00 0.61 0.41 0.00 0.00 173.24 173.70 2jw2 n GLY 10 N -0.28 4.37 3.02 3.44 0.00 -1.26 -5.13 105.19 109.35 2jw2 n GLY 10 Ca -0.07 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.87 2jw2 n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jw2 s LEU 11 N 0.00 2.01 -0.45 0.99 1.43 -1.26 -5.04 118.68 116.36 2jw2 s LEU 11 Ca 0.00 -0.68 0.08 0.00 -1.03 0.00 0.00 54.13 52.50 2jw2 s LEU 11 Cb 0.00 -1.25 0.28 0.00 0.03 0.00 0.00 46.19 45.25 2jw2 s LEU 11 CO 0.00 -0.09 0.65 1.33 0.23 0.00 0.00 176.35 178.48 2jw2 n VAL 12 N 4.71 0.39 -2.53 -1.59 0.24 -1.26 -5.08 118.33 113.20 2jw2 n VAL 12 Ca -0.16 -4.53 -0.43 0.00 -2.04 0.00 0.00 64.34 57.18 2jw2 n VAL 12 Cb 0.48 -1.56 -0.02 0.00 -1.47 0.00 0.00 33.84 31.27 2jw2 n VAL 12 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2jw2 s PRO 13 N -1.93 3.68 0.69 7.34 0.04 -1.26 -4.77 135.00 138.78 2jw2 s PRO 13 Ca 0.38 0.65 0.00 0.00 0.04 0.00 0.00 61.00 62.08 2jw2 s PRO 13 Cb 0.22 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.81 2jw2 s PRO 13 CO -0.09 -1.44 0.00 0.54 0.04 0.00 0.00 177.00 176.05 2jw2 n ARG 14 N 7.93 0.00 0.00 4.56 3.00 -1.26 -4.13 116.66 126.76 2jw2 n ARG 14 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.97 2jw2 n ARG 14 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.95 2jw2 n ARG 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2jw2 n GLY 15 N 0.00 0.07 0.05 -0.13 0.00 -1.26 -5.04 105.19 98.89 2jw2 n GLY 15 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2jw2 n GLY 15 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jw2 n SER 16 N 0.00 0.53 -0.34 1.61 7.64 -1.26 -4.10 113.62 117.70 2jw2 n SER 16 Ca 0.00 -0.30 0.35 0.00 1.01 0.00 0.00 58.87 59.94 2jw2 n SER 16 Cb 0.00 0.10 0.61 0.00 -1.01 0.00 0.00 64.21 63.92 2jw2 n SER 16 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2jw2 h GLN 17 N 0.26 0.00 0.00 1.43 5.75 -1.96 -1.22 115.11 119.37 2jw2 h GLN 17 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2jw2 h GLN 17 Cb 0.49 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.04 2jw2 h GLN 17 CO 0.00 0.00 0.00 0.39 -2.65 0.00 0.00 178.83 176.57 2jw2 n GLU 18 N -3.58 0.00 -0.34 1.69 -0.58 -1.26 0.11 120.64 116.68 2jw2 n GLU 18 Ca 0.28 0.65 0.25 0.00 -0.42 0.00 0.00 57.16 57.92 2jw2 n GLU 18 Cb 1.55 -1.49 0.50 0.00 -0.57 0.00 0.00 31.44 31.42 2jw2 n GLU 18 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2jw2 h ILE 19 N 0.00 0.26 -0.55 -3.67 5.03 -1.56 1.22 117.51 118.25 2jw2 h ILE 19 Ca 0.00 -0.10 -0.09 0.00 -0.12 0.00 0.00 64.86 64.56 2jw2 h ILE 19 Cb 0.00 -0.04 -0.02 0.00 -3.03 0.00 0.00 36.82 33.73 2jw2 h ILE 19 CO 0.00 0.05 0.00 -0.33 -0.68 0.00 0.00 178.15 177.19 2jw2 h GLU 20 N 0.28 0.97 0.44 2.37 4.39 -1.31 -2.52 114.58 119.20 2jw2 h GLU 20 Ca 0.75 -0.31 -0.01 0.00 0.34 0.00 0.00 59.36 60.13 2jw2 h GLU 20 Cb 1.77 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 30.32 2jw2 h GLU 20 CO -0.61 0.98 -0.35 0.00 -1.16 0.00 0.00 179.01 177.87 2jw2 h ALA 21 N 0.96 -0.80 -0.65 3.43 0.00 0.88 0.74 119.26 123.82 2jw2 h ALA 21 Ca 0.16 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 55.04 2jw2 h ALA 21 Cb 0.54 0.47 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 2jw2 h ALA 21 CO 0.03 -0.98 0.21 -0.22 0.00 0.00 0.00 179.25 178.29 2jw2 h LYS 22 N -0.78 0.35 0.14 0.00 1.63 -1.24 -1.63 116.57 115.03 2jw2 h LYS 22 Ca -0.04 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 2jw2 h LYS 22 Cb 0.67 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.23 2jw2 h LYS 22 CO -0.01 0.23 -0.07 0.93 -3.45 0.00 0.00 179.45 177.09 2jw2 h GLU 23 N 0.36 -0.18 -0.97 1.90 4.39 -1.16 -0.71 114.58 118.21 2jw2 h GLU 23 Ca 0.34 0.01 0.26 0.00 0.34 0.00 0.00 59.36 60.32 2jw2 h GLU 23 Cb 0.49 0.04 -0.18 0.00 -0.10 0.00 0.00 28.75 29.00 2jw2 h GLU 23 CO -0.38 0.17 0.01 0.00 -1.16 0.00 0.00 179.01 177.65 2jw2 n ALA 24 N -2.38 0.48 0.08 3.43 0.00 0.26 0.27 120.51 122.65 2jw2 n ALA 24 Ca -0.09 1.04 -0.17 0.00 0.00 0.00 0.00 53.44 54.23 2jw2 n ALA 24 Cb 0.23 -0.75 -0.09 0.00 0.00 0.00 0.00 19.45 18.84 2jw2 n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jw2 n ASP 26 N -3.73 0.17 -0.02 0.00 2.03 0.29 -3.12 116.55 112.16 2jw2 n ASP 26 Ca -0.09 0.52 -0.17 0.00 0.52 0.00 0.00 54.79 55.58 2jw2 n ASP 26 Cb 0.91 -0.57 -0.14 0.00 -0.72 0.00 0.00 41.12 40.60 2jw2 n ASP 26 CO 0.00 0.00 0.00 1.87 -1.92 0.00 0.00 177.20 177.15 2jw2 n TRP 27 N -1.66 1.04 0.06 -0.67 -0.00 0.78 -3.72 117.44 113.25 2jw2 n TRP 27 Ca 0.05 0.26 0.11 0.00 -0.00 0.00 0.00 57.50 57.93 2jw2 n TRP 27 Cb 0.30 -1.15 0.58 0.00 -0.00 0.00 0.00 31.31 31.03 2jw2 n TRP 27 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 2jw2 h LEU 28 N 0.04 0.18 -0.30 5.87 3.38 -1.40 0.87 115.31 123.95 2jw2 h LEU 28 Ca -0.40 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.37 2jw2 h LEU 28 Cb 2.03 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.74 2jw2 h LEU 28 CO 0.07 0.12 -0.81 0.03 0.09 0.00 0.00 178.44 177.94 2jw2 h ARG 29 N 0.21 0.45 0.00 1.13 3.08 -1.64 0.84 114.38 118.46 2jw2 h ARG 29 Ca 0.16 -0.40 -0.11 0.00 0.07 0.00 0.00 59.98 59.70 2jw2 h ARG 29 Cb 0.38 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 2jw2 h ARG 29 CO -0.03 1.05 -0.51 0.00 -1.07 0.00 0.00 179.97 179.41 2jw2 h ALA 30 N 0.83 1.00 0.00 0.04 0.00 -1.13 -2.66 119.26 117.33 2jw2 h ALA 30 Ca -0.05 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2jw2 h ALA 30 Cb 1.41 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2jw2 h ALA 30 CO 0.14 0.64 0.00 0.00 0.00 0.00 0.00 179.25 180.03 2jw2 h ALA 31 N 1.49 1.00 0.00 0.00 0.00 -0.83 -3.46 119.26 117.46 2jw2 h ALA 31 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jw2 h ALA 31 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2jw2 h ALA 31 CO 0.07 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.73 2jw2 n GLY 32 N 0.32 0.99 2.83 0.00 0.00 -1.00 -5.04 105.19 103.29 2jw2 n GLY 32 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 2jw2 n GLY 32 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jw2 n PHE 33 N -1.08 2.80 0.97 1.61 3.72 0.28 -4.90 117.46 120.85 2jw2 n PHE 33 Ca 0.00 -4.20 0.13 0.00 -0.05 0.00 0.00 57.45 53.33 2jw2 n PHE 33 Cb 0.00 -0.53 0.48 0.00 -0.94 0.00 0.00 39.48 38.50 2jw2 n PHE 33 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2jw2 n PRO 34 N 2.02 0.02 0.11 -1.08 -0.04 -1.23 -3.59 135.00 131.21 2jw2 n PRO 34 Ca 0.21 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.80 2jw2 n PRO 34 Cb 0.37 -1.52 0.46 0.00 -0.04 0.00 0.00 33.50 32.77 2jw2 n PRO 34 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jw2 n GLN 35 N -1.55 0.17 -0.01 0.54 0.00 -1.26 -3.09 117.38 112.18 2jw2 n GLN 35 Ca 0.06 0.38 -0.00 0.00 0.00 0.00 0.00 57.00 57.44 2jw2 n GLN 35 Cb 0.35 -1.82 -0.00 0.00 0.00 0.00 0.00 30.24 28.77 2jw2 n GLN 35 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.06 178.94 2jw2 h TYR 36 N 0.00 0.00 -1.57 2.61 0.05 -1.93 -3.34 116.97 112.79 2jw2 h TYR 36 Ca 0.00 0.00 0.50 0.00 0.05 0.00 0.00 58.73 59.28 2jw2 h TYR 36 Cb 0.38 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 38.01 2jw2 h TYR 36 CO 0.00 0.00 1.06 0.00 -1.05 0.00 0.00 178.16 178.17 2jw2 n ALA 37 N -2.23 1.53 -0.27 3.88 0.00 -1.24 0.20 120.51 122.37 2jw2 n ALA 37 Ca -0.00 0.76 0.04 0.00 0.00 0.00 0.00 53.44 54.24 2jw2 n ALA 37 Cb 0.01 -1.06 0.18 0.00 0.00 0.00 0.00 19.45 18.59 2jw2 n ALA 37 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2jw2 h GLN 38 N 0.00 0.58 -0.77 0.00 1.08 -1.66 0.12 115.11 114.45 2jw2 h GLN 38 Ca 0.87 -0.03 0.17 0.00 -1.45 0.00 0.00 58.65 58.21 2jw2 h GLN 38 Cb 3.11 -0.13 -0.05 0.00 -0.05 0.00 0.00 27.48 30.36 2jw2 h GLN 38 CO -0.27 0.38 0.52 -0.07 -0.95 0.00 0.00 178.83 178.44 2jw2 h LEU 39 N 0.60 0.30 -0.22 1.46 3.38 0.21 -1.70 115.31 119.34 2jw2 h LEU 39 Ca 0.41 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.46 2jw2 h LEU 39 Cb 0.52 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.17 2jw2 h LEU 39 CO -0.33 0.14 -0.30 0.22 0.09 0.00 0.00 178.44 178.26 2jw2 h TYR 40 N 0.31 -0.82 -1.19 1.13 3.20 -0.84 0.39 116.97 119.16 2jw2 h TYR 40 Ca 0.38 0.04 0.40 0.00 3.14 0.00 0.00 58.73 62.70 2jw2 h TYR 40 Cb 1.04 0.39 -0.14 0.00 1.54 0.00 0.00 36.73 39.56 2jw2 h TYR 40 CO -0.00 -0.37 0.73 0.93 -1.64 0.00 0.00 178.16 177.80 2jw2 h GLU 41 N -0.33 0.12 0.00 1.82 5.08 -1.39 2.21 114.58 122.10 2jw2 h GLU 41 Ca 0.12 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2jw2 h GLU 41 Cb 0.52 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 2jw2 h GLU 41 CO -0.40 0.08 -0.83 0.22 -1.00 0.00 0.00 179.01 177.08 2jw2 h ASP 42 N 0.13 0.00 0.00 1.42 3.58 -0.87 -3.47 116.42 117.20 2jw2 h ASP 42 Ca 0.80 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.25 2jw2 h ASP 42 Cb 2.30 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.35 2jw2 h ASP 42 CO -0.52 0.02 0.00 -1.54 -2.88 0.00 0.00 179.24 174.32 2jw2 n SER 43 N -2.77 -2.95 -1.01 2.28 3.41 0.75 -4.89 113.62 108.44 2jw2 n SER 43 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.60 2jw2 n SER 43 Cb 0.56 -0.49 0.08 0.00 -0.26 0.00 0.00 64.21 64.09 2jw2 n SER 43 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jw2 n GLN 44 N -2.98 1.69 0.10 4.33 1.13 -1.02 -4.33 117.38 116.30 2jw2 n GLN 44 Ca 0.00 -0.74 -0.13 0.00 -1.94 0.00 0.00 57.00 54.19 2jw2 n GLN 44 Cb 0.00 -1.53 -0.08 0.00 0.11 0.00 0.00 30.24 28.74 2jw2 n GLN 44 CO 0.00 0.00 0.00 0.74 -1.44 0.00 0.00 177.06 176.36 2jw2 h PHE 45 N 0.68 -0.16 -2.56 1.08 -1.00 -1.89 -3.41 116.94 109.68 2jw2 h PHE 45 Ca 0.06 -0.00 -0.56 0.00 2.81 0.00 0.00 57.97 60.27 2jw2 h PHE 45 Cb 1.08 0.05 -0.01 0.00 3.61 0.00 0.00 35.95 40.68 2jw2 h PHE 45 CO 0.31 -0.05 1.21 -1.25 -1.61 0.00 0.00 178.31 176.91 2jw2 s PRO 46 N -5.94 3.74 0.24 1.51 0.04 -1.26 -4.81 135.00 128.52 2jw2 s PRO 46 Ca -0.14 1.89 -0.20 0.00 0.04 0.00 0.00 61.00 62.58 2jw2 s PRO 46 Cb 0.05 -4.12 0.07 0.00 0.04 0.00 0.00 34.50 30.54 2jw2 s PRO 46 CO 0.65 -1.38 0.97 0.96 0.04 0.00 0.00 177.00 178.24 2jw2 s ILE 47 N 5.62 0.00 -0.88 0.56 -4.36 -1.26 -5.05 121.20 115.82 2jw2 s ILE 47 Ca 0.79 -0.70 -0.23 0.00 -0.26 0.00 0.00 60.65 60.25 2jw2 s ILE 47 Cb -0.29 -2.90 -0.19 0.00 1.25 0.00 0.00 42.46 40.33 2jw2 s ILE 47 CO 0.32 0.00 2.10 -0.46 0.24 0.00 0.00 174.94 177.14 2jw2 n ASN 48 N -1.29 0.98 0.09 4.36 6.94 -1.26 -4.74 115.26 120.34 2jw2 n ASN 48 Ca -0.04 -1.97 -0.11 0.00 -0.02 0.00 0.00 54.58 52.44 2jw2 n ASN 48 Cb 0.60 -1.53 -0.06 0.00 -2.36 0.00 0.00 39.78 36.42 2jw2 n ASN 48 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 2jw2 h ILE 49 N 7.05 0.00 -0.81 1.53 2.04 -1.97 -1.73 117.51 123.62 2jw2 h ILE 49 Ca 0.00 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.16 2jw2 h ILE 49 Cb 1.01 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.94 2jw2 h ILE 49 CO 1.04 0.00 0.28 0.55 0.00 0.00 0.00 178.15 180.02 2jw2 n VAL 50 N -4.39 -0.34 0.12 1.67 3.14 -1.26 0.23 118.33 117.49 2jw2 n VAL 50 Ca -0.06 1.70 0.03 0.00 -2.96 0.00 0.00 64.34 63.05 2jw2 n VAL 50 Cb 0.27 -2.66 0.40 0.00 -1.06 0.00 0.00 33.84 30.79 2jw2 n VAL 50 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2jw2 h ALA 51 N 1.63 1.54 0.13 1.55 0.00 -1.70 -2.91 119.26 119.50 2jw2 h ALA 51 Ca 0.62 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 55.11 2jw2 h ALA 51 Cb 1.53 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 19.25 2jw2 h ALA 51 CO -0.68 0.33 -1.07 -0.39 0.00 0.00 0.00 179.25 177.44 2jw2 h VAL 52 N 0.22 1.31 -0.41 0.00 -1.51 0.30 -2.25 116.25 113.91 2jw2 h VAL 52 Ca 0.05 -2.49 0.12 0.00 -1.23 0.00 0.00 66.70 63.15 2jw2 h VAL 52 Cb 0.34 3.00 -0.02 0.00 -2.13 0.00 0.00 31.29 32.48 2jw2 h VAL 52 CO 0.02 0.71 0.47 0.11 -1.23 0.00 0.00 177.57 177.65 2jw2 h LYS 53 N -0.34 0.00 0.07 5.19 1.57 -1.27 0.90 116.57 122.68 2jw2 h LYS 53 Ca -0.21 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.31 2jw2 h LYS 53 Cb 1.70 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.99 2jw2 h LYS 53 CO 0.11 0.00 -1.38 -0.91 -0.57 0.00 0.00 179.45 176.70 2jw2 h ASN 54 N 0.00 0.22 0.38 0.86 -0.26 -1.56 0.52 115.58 115.73 2jw2 h ASN 54 Ca 0.20 -0.75 -0.02 0.00 -0.56 0.00 0.00 56.30 55.16 2jw2 h ASN 54 Cb 1.13 -0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 38.32 2jw2 h ASN 54 CO -0.00 1.58 -0.11 -2.24 -1.06 0.00 0.00 177.43 175.60 2jw2 h ASP 55 N -0.54 0.00 0.00 5.81 3.04 -0.36 -3.36 116.42 121.00 2jw2 h ASP 55 Ca -0.33 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.46 2jw2 h ASP 55 Cb 1.59 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.88 2jw2 h ASP 55 CO -0.04 0.11 0.00 1.57 -2.04 0.00 0.00 179.24 178.84 2jw2 n HIS 56 N -3.62 0.00 0.00 4.15 -0.00 0.29 -4.94 115.22 111.10 2jw2 n HIS 56 Ca -0.02 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.16 2jw2 n HIS 56 Cb 0.24 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.11 2jw2 n HIS 56 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 2jw2 n ASP 57 N -2.14 0.00 -1.28 0.26 -0.08 0.17 -4.87 116.55 108.60 2jw2 n ASP 57 Ca 0.00 0.00 0.15 0.00 -1.51 0.00 0.00 54.79 53.43 2jw2 n ASP 57 Cb 0.00 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.41 2jw2 n ASP 57 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2jw2 n PHE 58 N 0.00 -3.11 0.00 -0.67 3.72 -1.26 -4.57 117.46 111.57 2jw2 n PHE 58 Ca 0.00 1.62 0.00 0.00 -0.05 0.00 0.00 57.45 59.02 2jw2 n PHE 58 Cb 0.00 -2.82 0.00 0.00 -0.94 0.00 0.00 39.48 35.72 2jw2 n PHE 58 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 2jw2 n LEU 59 N -3.88 0.00 0.00 4.37 7.94 -1.26 -4.76 117.00 119.41 2jw2 n LEU 59 Ca -0.03 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.87 2jw2 n LEU 59 Cb 0.65 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.60 2jw2 n LEU 59 CO 0.02 0.00 0.00 -0.62 -1.11 0.00 0.00 177.39 175.68 2jw2 n GLU 60 N 13.26 3.84 0.00 1.96 -0.58 -1.26 -4.99 120.64 132.86 2jw2 n GLU 60 Ca 0.00 0.00 0.15 0.00 -0.42 0.00 0.00 57.16 56.89 2jw2 n GLU 60 Cb 0.00 0.00 0.77 0.00 -0.57 0.00 0.00 31.44 31.64 2jw2 n GLU 60 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2jw2 n LYS 61 N 0.00 0.76 0.00 3.49 4.76 -1.26 -3.13 118.16 122.77 2jw2 n LYS 61 Ca 0.00 -0.11 0.14 0.00 -2.87 0.00 0.00 58.31 55.47 2jw2 n LYS 61 Cb 0.00 -1.50 0.67 0.00 -1.84 0.00 0.00 35.03 32.36 2jw2 n LYS 61 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2jw2 n ASP 62 N -1.02 0.17 0.00 4.39 -0.08 -1.26 -3.46 116.55 115.28 2jw2 n ASP 62 Ca 0.18 -0.17 0.00 0.00 -1.51 0.00 0.00 54.79 53.29 2jw2 n ASP 62 Cb 0.21 -0.23 0.00 0.00 2.34 0.00 0.00 41.12 43.44 2jw2 n ASP 62 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2jw2 n LEU 63 N -1.24 0.47 -0.08 -2.67 4.32 -1.19 -4.71 117.00 111.91 2jw2 n LEU 63 Ca 0.13 -0.53 -0.11 0.00 -0.02 0.00 0.00 56.01 55.48 2jw2 n LEU 63 Cb 0.27 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.02 2jw2 n LEU 63 CO 0.25 0.12 -0.39 0.58 -1.22 0.00 0.00 177.39 176.73 2jw2 h VAL 64 N 0.32 0.34 -0.34 4.08 2.07 -1.58 -3.28 116.25 117.86 2jw2 h VAL 64 Ca 0.00 -1.43 0.05 0.00 0.82 0.00 0.00 66.70 66.14 2jw2 h VAL 64 Cb 0.16 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 2jw2 h VAL 64 CO 0.00 0.12 0.09 -0.33 0.02 0.00 0.00 177.57 177.47 2jw2 h GLU 65 N -1.00 0.21 -0.56 1.57 3.07 -1.88 -1.34 114.58 114.66 2jw2 h GLU 65 Ca -0.12 -0.01 0.07 0.00 -0.50 0.00 0.00 59.36 58.79 2jw2 h GLU 65 Cb 0.78 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.60 2jw2 h GLU 65 CO -0.07 0.14 0.37 -1.35 -1.40 0.00 0.00 179.01 176.70 2jw2 h PRO 66 N 0.22 0.46 -0.69 2.33 0.11 -1.84 -1.61 132.00 130.98 2jw2 h PRO 66 Ca 0.16 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 66.28 2jw2 h PRO 66 Cb 0.16 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 31.12 2jw2 h PRO 66 CO -0.19 0.31 0.42 1.25 -0.21 0.00 0.00 178.00 179.58 2jw2 h LEU 67 N 0.48 0.67 -1.71 2.35 5.85 -1.30 0.23 115.31 121.87 2jw2 h LEU 67 Ca 0.25 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 2jw2 h LEU 67 Cb 0.36 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 2jw2 h LEU 67 CO -0.07 0.45 -0.09 0.00 -0.34 0.00 0.00 178.44 178.39 2jw2 h ARG 69 N 0.00 -0.18 -0.63 0.00 -0.00 -0.82 -1.19 114.38 111.57 2jw2 h ARG 69 Ca -0.00 0.01 -0.04 0.00 -0.50 0.00 0.00 59.98 59.45 2jw2 h ARG 69 Cb 0.45 0.04 -0.03 0.00 0.00 0.00 0.00 29.97 30.43 2jw2 h ARG 69 CO 0.01 0.19 0.24 0.00 0.00 0.00 0.00 179.97 180.41 2jw2 h ARG 70 N -0.96 0.95 0.30 0.04 2.47 -1.17 -0.77 114.38 115.25 2jw2 h ARG 70 Ca -0.02 -0.18 -0.01 0.00 -1.26 0.00 0.00 59.98 58.51 2jw2 h ARG 70 Cb 0.45 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.63 2jw2 h ARG 70 CO 0.03 0.81 -0.15 -0.07 0.56 0.00 0.00 179.97 181.16 2jw2 h LEU 71 N 0.89 -0.34 -2.72 3.04 3.38 -1.01 0.01 115.31 118.56 2jw2 h LEU 71 Ca 0.21 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2jw2 h LEU 71 Cb 0.23 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2jw2 h LEU 71 CO -0.01 -0.16 0.02 -1.13 0.09 0.00 0.00 178.44 177.24 2jw2 h ASN 72 N -0.51 0.00 0.04 -0.43 -0.00 -1.10 -0.40 115.58 113.18 2jw2 h ASN 72 Ca -0.04 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.26 2jw2 h ASN 72 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.70 2jw2 h ASN 72 CO 0.07 0.00 -0.02 0.74 -0.00 0.00 0.00 177.43 178.22 2jw2 h THR 73 N 0.00 0.00 -0.99 -3.57 2.02 -0.37 -3.27 112.91 106.72 2jw2 h THR 73 Ca 0.00 -0.35 0.20 0.00 0.77 0.00 0.00 66.41 67.04 2jw2 h THR 73 Cb 0.04 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.35 2jw2 h THR 73 CO -0.00 0.00 0.62 -0.07 0.37 0.00 0.00 175.52 176.44 2jw2 h LEU 74 N -0.40 0.68 -2.00 2.58 3.38 -0.91 0.52 115.31 119.16 2jw2 h LEU 74 Ca -0.01 0.09 0.20 0.00 0.09 0.00 0.00 57.88 58.25 2jw2 h LEU 74 Cb 0.04 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2jw2 h LEU 74 CO 0.01 0.23 0.51 0.78 0.09 0.00 0.00 178.44 180.05 2jw2 h ASN 75 N 0.65 0.00 0.95 -0.43 2.35 -1.20 2.05 115.58 119.95 2jw2 h ASN 75 Ca 0.57 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 56.27 2jw2 h ASN 75 Cb 1.04 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.40 2jw2 h ASN 75 CO -0.34 0.00 -1.09 0.50 -1.65 0.00 0.00 177.43 174.85 2jw2 h LYS 76 N 0.00 0.00 0.00 0.81 3.64 -0.02 -3.33 116.57 117.67 2jw2 h LYS 76 Ca 0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 2jw2 h LYS 76 Cb 1.33 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 2jw2 h LYS 76 CO -0.00 0.09 -1.14 0.00 -2.27 0.00 0.00 179.45 176.13 2jw2 n ALA 78 N -1.87 2.42 0.83 0.00 0.00 0.64 -2.32 120.51 120.22 2jw2 n ALA 78 Ca 0.01 -0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.44 2jw2 n ALA 78 Cb 0.45 -1.28 -0.00 0.00 0.00 0.00 0.00 19.45 18.62 2jw2 n ALA 78 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jw2 n SER 79 N -0.83 1.80 -2.82 0.00 7.64 -1.25 -4.93 113.62 113.23 2jw2 n SER 79 Ca 0.13 -1.40 -0.01 0.00 1.01 0.00 0.00 58.87 58.60 2jw2 n SER 79 Cb 0.06 0.47 -0.01 0.00 -1.01 0.00 0.00 64.21 63.72 2jw2 n SER 79 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2jw2 n MET 80 N -0.07 -2.92 -0.24 1.43 2.81 -0.98 -5.18 117.12 111.97 2jw2 n MET 80 Ca 0.08 2.42 0.00 0.00 -1.81 0.00 0.00 57.70 58.38 2jw2 n MET 80 Cb 0.39 -4.09 0.00 0.00 -0.71 0.00 0.00 33.22 28.81 2jw2 n MET 80 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65