#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jw2 s HIS 2 N 0.00 3.23 0.87 2.03 4.02 -1.26 -5.03 115.29 119.15 2jw2 s HIS 2 Ca 0.00 1.19 -0.11 0.00 1.02 0.00 0.00 55.06 57.17 2jw2 s HIS 2 Cb 0.00 -3.42 0.11 0.00 -1.02 0.00 0.00 32.58 28.25 2jw2 s HIS 2 CO 0.00 -0.61 1.10 -1.01 1.02 0.00 0.00 174.74 175.24 2jw2 s HIS 3 N 3.31 2.23 0.02 1.40 0.09 -1.26 -5.03 115.29 116.06 2jw2 s HIS 3 Ca 0.41 1.47 -0.02 0.00 -0.00 0.00 0.00 55.06 56.92 2jw2 s HIS 3 Cb -0.14 -3.14 -0.04 0.00 -0.00 0.00 0.00 32.58 29.26 2jw2 s HIS 3 CO 0.11 -2.33 0.19 -1.01 -0.00 0.00 0.00 174.74 171.71 2jw2 s HIS 4 N -2.84 3.54 0.00 1.40 4.02 -1.26 -4.95 115.29 115.20 2jw2 s HIS 4 Ca 0.63 0.31 0.00 0.00 1.02 0.00 0.00 55.06 57.03 2jw2 s HIS 4 Cb -0.19 -1.80 0.00 0.00 -1.02 0.00 0.00 32.58 29.57 2jw2 s HIS 4 CO 0.57 0.62 0.17 0.72 1.02 0.00 0.00 174.74 177.85 2jw2 n HIS 5 N 0.67 0.00 0.79 1.40 -0.00 -1.26 -4.95 115.22 111.87 2jw2 n HIS 5 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.64 2jw2 n HIS 5 Cb 0.52 0.17 0.00 0.00 -0.00 0.00 0.00 29.99 30.68 2jw2 n HIS 5 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2jw2 n HIS 6 N 0.00 0.00 -3.13 4.41 -0.00 -1.26 -4.96 115.22 110.28 2jw2 n HIS 6 Ca 0.00 -0.29 0.00 0.00 -0.00 0.00 0.00 57.72 57.43 2jw2 n HIS 6 Cb 0.35 -0.18 0.00 0.00 -0.00 0.00 0.00 29.99 30.16 2jw2 n HIS 6 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2jw2 n HIS 7 N 0.47 -1.49 -0.42 1.57 -0.00 -1.26 -5.02 115.22 109.07 2jw2 n HIS 7 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2jw2 n HIS 7 Cb 0.34 0.18 0.00 0.00 -0.00 0.00 0.00 29.99 30.51 2jw2 n HIS 7 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2jw2 n SER 8 N -3.37 2.76 -3.58 0.41 2.88 -1.26 -5.18 113.62 106.28 2jw2 n SER 8 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 2jw2 n SER 8 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 2jw2 n SER 8 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2jw2 s SER 9 N 1.88 -0.61 0.00 -3.46 0.15 -1.26 -5.14 113.70 105.25 2jw2 s SER 9 Ca 0.00 0.92 0.00 0.00 0.70 0.00 0.00 55.95 57.57 2jw2 s SER 9 Cb 0.00 1.42 0.00 0.00 -1.71 0.00 0.00 66.02 65.73 2jw2 s SER 9 CO 0.00 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 174.91 2jw2 n GLY 10 N 4.21 -0.05 3.56 9.45 0.00 -1.26 -5.16 105.19 115.95 2jw2 n GLY 10 Ca -0.16 0.74 -0.00 0.00 0.00 0.00 0.00 46.02 46.60 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 -1.17 -0.48 0.99 1.43 -1.26 -5.09 118.68 113.10 2jw2 s LEU 11 Ca 0.00 1.45 0.06 0.00 -1.03 0.00 0.00 54.13 54.62 2jw2 s LEU 11 Cb 0.00 2.26 0.23 0.00 0.03 0.00 0.00 46.19 48.71 2jw2 s LEU 11 CO 0.00 -0.23 0.53 0.52 0.23 0.00 0.00 176.35 177.40 2jw2 n VAL 12 N 5.45 0.04 -2.01 -1.59 0.31 -1.26 -5.12 118.33 114.15 2jw2 n VAL 12 Ca -0.10 -4.22 -0.30 0.00 -0.01 0.00 0.00 64.34 59.71 2jw2 n VAL 12 Cb 0.49 -1.94 0.01 0.00 -0.91 0.00 0.00 33.84 31.49 2jw2 n VAL 12 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2jw2 s PRO 13 N -1.22 3.50 0.00 5.55 0.04 -1.26 -5.08 135.00 136.53 2jw2 s PRO 13 Ca 0.35 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.00 2jw2 s PRO 13 Cb 0.12 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2jw2 s PRO 13 CO -0.11 -0.56 0.00 0.54 0.04 0.00 0.00 177.00 176.91 2jw2 n ARG 14 N -2.69 2.26 0.00 4.56 5.12 -1.26 -5.01 116.66 119.64 2jw2 n ARG 14 Ca 0.05 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 2jw2 n ARG 14 Cb 0.55 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.85 2jw2 n ARG 14 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2jw2 n GLY 15 N 0.97 0.50 0.00 -0.13 0.00 -1.26 -4.76 105.19 100.51 2jw2 n GLY 15 Ca 0.00 -1.52 0.01 0.00 0.00 0.00 0.00 46.02 44.51 2jw2 n GLY 15 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jw2 n SER 16 N 0.00 0.00 -0.60 1.61 3.41 -1.26 -4.06 113.62 112.72 2jw2 n SER 16 Ca 0.00 -1.68 0.48 0.00 -0.26 0.00 0.00 58.87 57.41 2jw2 n SER 16 Cb 0.00 0.00 0.78 0.00 -0.26 0.00 0.00 64.21 64.73 2jw2 n SER 16 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2jw2 h GLN 17 N 0.00 0.01 0.00 4.33 5.75 -1.95 0.28 115.11 123.53 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 0.00 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 2jw2 h GLN 17 CO 0.00 0.01 0.00 0.39 -2.65 0.00 0.00 178.83 176.58 2jw2 n GLU 18 N -4.14 0.00 0.32 1.69 -0.58 -1.26 -3.04 120.64 113.63 2jw2 n GLU 18 Ca 0.41 0.49 0.12 0.00 -0.42 0.00 0.00 57.16 57.76 2jw2 n GLU 18 Cb 1.79 -1.21 0.66 0.00 -0.57 0.00 0.00 31.44 32.11 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 0.00 0.00 -3.67 2.04 -1.54 0.89 117.51 115.23 2jw2 h ILE 19 Ca 0.00 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.77 2jw2 h ILE 19 Cb 0.00 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 2jw2 h ILE 19 CO 0.00 0.00 -0.44 -0.33 0.00 0.00 0.00 178.15 177.38 2jw2 h GLU 20 N 0.00 0.00 0.23 2.37 4.39 -0.49 -2.16 114.58 118.91 2jw2 h GLU 20 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2jw2 h GLU 20 Cb 0.84 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2jw2 h GLU 20 CO 0.00 0.44 -0.11 0.00 -1.16 0.00 0.00 179.01 178.18 2jw2 h ALA 21 N 1.56 -0.63 -0.87 3.43 0.00 0.91 1.21 119.26 124.86 2jw2 h ALA 21 Ca -0.00 -0.07 0.18 0.00 0.00 0.00 0.00 54.91 55.02 2jw2 h ALA 21 Cb 0.92 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 2jw2 h ALA 21 CO 0.06 -0.61 0.57 0.87 0.00 0.00 0.00 179.25 180.15 2jw2 h LYS 22 N -0.49 0.44 0.14 0.00 1.79 -1.65 -1.35 116.57 115.44 2jw2 h LYS 22 Ca -0.03 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 2jw2 h LYS 22 Cb 0.24 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 2jw2 h LYS 22 CO 0.05 0.29 -0.07 0.93 -1.08 0.00 0.00 179.45 179.58 2jw2 h GLU 23 N 0.45 -0.18 -0.93 3.15 4.39 -1.40 -2.21 114.58 117.86 2jw2 h GLU 23 Ca 0.45 0.01 0.16 0.00 0.34 0.00 0.00 59.36 60.32 2jw2 h GLU 23 Cb 1.04 0.04 -0.16 0.00 -0.10 0.00 0.00 28.75 29.57 2jw2 h GLU 23 CO -0.17 0.27 -0.32 0.00 -1.16 0.00 0.00 179.01 177.63 2jw2 n ALA 24 N -2.58 -0.01 0.01 3.43 0.00 0.42 0.31 120.51 122.08 2jw2 n ALA 24 Ca -0.07 0.96 -0.08 0.00 0.00 0.00 0.00 53.44 54.24 2jw2 n ALA 24 Cb 0.27 -0.48 0.08 0.00 0.00 0.00 0.00 19.45 19.32 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 -3.97 0.20 -0.10 0.00 2.03 0.23 -3.76 116.55 111.19 2jw2 n ASP 26 Ca -0.03 0.47 -0.24 0.00 0.52 0.00 0.00 54.79 55.51 2jw2 n ASP 26 Cb 0.58 -0.51 -0.12 0.00 -0.72 0.00 0.00 41.12 40.36 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 0.72 0.07 -0.67 -0.00 0.93 -3.82 117.44 113.01 2jw2 n TRP 27 Ca 0.07 0.27 0.18 0.00 -0.00 0.00 0.00 57.50 58.02 2jw2 n TRP 27 Cb 0.36 -1.08 0.52 0.00 -0.00 0.00 0.00 31.31 31.11 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 -0.75 0.00 0.00 5.87 3.38 -1.17 2.20 115.31 124.84 2jw2 h LEU 28 Ca -0.47 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.27 2jw2 h LEU 28 Cb 1.55 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.26 2jw2 h LEU 28 CO -0.21 0.00 -1.33 0.03 0.09 0.00 0.00 178.44 177.02 2jw2 h ARG 29 N 0.00 0.00 0.00 1.13 3.08 -1.71 0.19 114.38 117.07 2jw2 h ARG 29 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2jw2 h ARG 29 Cb 1.81 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.86 2jw2 h ARG 29 CO -0.00 0.61 0.00 0.00 -1.07 0.00 0.00 179.97 179.51 2jw2 n ALA 30 N -2.44 2.20 0.56 0.04 0.00 0.73 -2.78 120.51 118.83 2jw2 n ALA 30 Ca -0.09 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.39 2jw2 n ALA 30 Cb 0.95 -1.44 -0.10 0.00 0.00 0.00 0.00 19.45 18.87 2jw2 n ALA 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jw2 n ALA 31 N -1.57 3.78 -0.12 0.00 0.00 -0.55 -4.96 120.51 117.09 2jw2 n ALA 31 Ca 0.06 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2jw2 n ALA 31 Cb 0.33 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.97 2jw2 n ALA 31 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jw2 n GLY 32 N 1.39 0.93 2.57 0.00 0.00 -1.12 -5.01 105.19 103.95 2jw2 n GLY 32 Ca 0.01 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.12 2.18 0.38 1.61 3.72 0.61 -4.88 117.46 118.96 2jw2 n PHE 33 Ca 0.00 -3.62 0.09 0.00 -0.05 0.00 0.00 57.45 53.86 2jw2 n PHE 33 Cb 0.00 -0.39 0.39 0.00 -0.94 0.00 0.00 39.48 38.54 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 -0.07 0.10 0.07 -1.08 -0.04 -0.91 -2.68 135.00 130.39 2jw2 n PRO 34 Ca 0.27 0.38 0.05 0.00 -0.04 0.00 0.00 63.50 64.16 2jw2 n PRO 34 Cb 0.59 -1.70 0.28 0.00 -0.04 0.00 0.00 33.50 32.63 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 -1.89 0.07 -0.02 0.54 -0.00 -1.26 -2.92 117.38 111.90 2jw2 n GLN 35 Ca 0.02 0.54 -0.01 0.00 -0.00 0.00 0.00 57.00 57.56 2jw2 n GLN 35 Cb 0.17 -1.70 -0.00 0.00 -0.00 0.00 0.00 30.24 28.70 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 -0.85 2.61 0.05 -1.86 -3.38 116.97 113.54 2jw2 h TYR 36 Ca 0.00 0.00 0.31 0.00 0.05 0.00 0.00 58.73 59.09 2jw2 h TYR 36 Cb 0.03 0.00 -0.16 0.00 1.01 0.00 0.00 36.73 37.61 2jw2 h TYR 36 CO 0.00 0.00 0.28 0.00 -1.05 0.00 0.00 178.16 177.39 2jw2 n ALA 37 N -2.42 0.70 -0.32 3.88 0.00 -1.15 0.19 120.51 121.38 2jw2 n ALA 37 Ca -0.01 0.89 0.18 0.00 0.00 0.00 0.00 53.44 54.50 2jw2 n ALA 37 Cb 0.04 -0.79 0.37 0.00 0.00 0.00 0.00 19.45 19.07 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 0.16 -0.71 0.00 1.08 -1.69 1.38 115.11 115.33 2jw2 h GLN 38 Ca 0.64 -0.01 0.12 0.00 -1.45 0.00 0.00 58.65 57.95 2jw2 h GLN 38 Cb 1.57 -0.04 -0.05 0.00 -0.05 0.00 0.00 27.48 28.92 2jw2 h GLN 38 CO -0.71 0.11 0.47 -0.07 -0.95 0.00 0.00 178.83 177.67 2jw2 h LEU 39 N 0.17 0.44 -0.01 1.46 3.38 0.19 -2.54 115.31 118.39 2jw2 h LEU 39 Ca 0.64 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.65 2jw2 h LEU 39 Cb 1.42 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 42.04 2jw2 h LEU 39 CO -0.71 0.25 -0.50 0.22 0.09 0.00 0.00 178.44 177.79 2jw2 h TYR 40 N 0.48 -1.47 -1.30 1.13 3.20 0.18 0.74 116.97 119.93 2jw2 h TYR 40 Ca 0.34 0.05 0.41 0.00 3.14 0.00 0.00 58.73 62.67 2jw2 h TYR 40 Cb 0.64 0.64 -0.12 0.00 1.54 0.00 0.00 36.73 39.44 2jw2 h TYR 40 CO -0.00 -0.53 0.85 0.93 -1.64 0.00 0.00 178.16 177.76 2jw2 h GLU 41 N -0.62 0.12 0.00 1.82 5.08 -1.51 2.14 114.58 121.61 2jw2 h GLU 41 Ca 0.01 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 2jw2 h GLU 41 Cb 0.67 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 2jw2 h GLU 41 CO -0.34 0.08 -0.85 -0.44 -1.00 0.00 0.00 179.01 176.46 2jw2 h ASP 42 N 0.12 0.00 0.00 1.42 5.19 -0.76 -3.48 116.42 118.91 2jw2 h ASP 42 Ca 0.79 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.20 2jw2 h ASP 42 Cb 2.46 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.97 2jw2 h ASP 42 CO -0.37 0.49 0.00 -0.24 -3.12 0.00 0.00 179.24 176.00 2jw2 n SER 43 N -3.07 -2.86 -2.12 6.45 2.88 0.72 -4.93 113.62 110.68 2jw2 n SER 43 Ca -0.02 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.26 2jw2 n SER 43 Cb 0.76 -0.50 0.14 0.00 -0.75 0.00 0.00 64.21 63.86 2jw2 n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jw2 n GLN 44 N -2.88 2.42 -0.07 -1.46 1.13 -0.98 -4.58 117.38 110.96 2jw2 n GLN 44 Ca 0.00 -3.19 -0.14 0.00 -1.94 0.00 0.00 57.00 51.73 2jw2 n GLN 44 Cb 0.03 -2.18 -0.06 0.00 0.11 0.00 0.00 30.24 28.14 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 1.41 0.77 -2.41 1.08 -1.00 -1.90 -3.43 116.94 111.46 2jw2 h PHE 45 Ca 0.56 -0.26 -0.56 0.00 2.81 0.00 0.00 57.97 60.53 2jw2 h PHE 45 Cb 1.95 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 41.35 2jw2 h PHE 45 CO 1.44 1.00 1.28 -2.14 -1.61 0.00 0.00 178.31 178.27 2jw2 s PRO 46 N -4.19 3.67 0.16 1.51 0.02 -1.26 -4.70 135.00 130.21 2jw2 s PRO 46 Ca -0.13 2.04 -0.23 0.00 0.02 0.00 0.00 61.00 62.71 2jw2 s PRO 46 Cb 0.08 -4.18 0.08 0.00 0.02 0.00 0.00 34.50 30.49 2jw2 s PRO 46 CO 0.82 -1.47 1.07 0.96 -0.33 0.00 0.00 177.00 178.05 2jw2 s ILE 47 N 6.02 0.00 -0.66 2.83 -4.36 -1.26 -5.08 121.20 118.69 2jw2 s ILE 47 Ca 0.86 -0.53 -0.26 0.00 -0.26 0.00 0.00 60.65 60.46 2jw2 s ILE 47 Cb -0.32 -2.93 -0.07 0.00 1.25 0.00 0.00 42.46 40.39 2jw2 s ILE 47 CO 0.35 0.00 2.20 0.21 0.24 0.00 0.00 174.94 177.94 2jw2 s ASN 48 N -3.48 4.61 0.05 4.36 3.04 -1.26 -4.83 114.94 117.43 2jw2 s ASN 48 Ca 0.23 0.36 -0.21 0.00 0.04 0.00 0.00 52.86 53.29 2jw2 s ASN 48 Cb -0.02 -2.53 -0.10 0.00 -1.54 0.00 0.00 41.25 37.06 2jw2 s ASN 48 CO 0.05 -2.99 1.32 0.40 -3.04 0.00 0.00 177.10 172.84 2jw2 h ILE 49 N 7.43 0.00 -0.89 -5.21 2.04 -1.98 -2.47 117.51 116.42 2jw2 h ILE 49 Ca -0.13 0.00 0.26 0.00 1.00 0.00 0.00 64.86 65.99 2jw2 h ILE 49 Cb 1.14 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 37.05 2jw2 h ILE 49 CO 1.15 0.00 0.06 0.52 0.00 0.00 0.00 178.15 179.87 2jw2 n VAL 50 N -4.18 -0.38 0.01 1.67 0.31 -1.26 0.18 118.33 114.68 2jw2 n VAL 50 Ca -0.07 1.96 0.14 0.00 -0.01 0.00 0.00 64.34 66.36 2jw2 n VAL 50 Cb 0.26 -2.88 0.60 0.00 -0.91 0.00 0.00 33.84 30.91 2jw2 n VAL 50 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jw2 h ALA 51 N 1.79 2.20 0.15 3.52 0.00 -1.84 -0.43 119.26 124.65 2jw2 h ALA 51 Ca 0.56 -0.01 -0.33 0.00 0.00 0.00 0.00 54.91 55.13 2jw2 h ALA 51 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2jw2 h ALA 51 CO -0.83 -0.32 -1.63 -0.39 0.00 0.00 0.00 179.25 176.08 2jw2 h VAL 52 N 0.18 1.05 -0.45 0.00 -1.51 0.20 -0.27 116.25 115.46 2jw2 h VAL 52 Ca 0.22 -2.67 -0.01 0.00 -1.23 0.00 0.00 66.70 63.01 2jw2 h VAL 52 Cb 0.63 2.76 -0.02 0.00 -2.13 0.00 0.00 31.29 32.53 2jw2 h VAL 52 CO -0.04 0.83 0.23 0.11 -1.23 0.00 0.00 177.57 177.47 2jw2 h LYS 53 N 0.09 0.61 0.00 5.19 1.57 -0.61 -0.36 116.57 123.06 2jw2 h LYS 53 Ca -0.29 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.37 2jw2 h LYS 53 Cb 2.06 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 34.23 2jw2 h LYS 53 CO 0.17 0.47 -0.50 -0.91 -0.57 0.00 0.00 179.45 178.11 2jw2 h ASN 54 N 0.62 0.00 0.00 0.86 2.35 -1.19 -2.82 115.58 115.40 2jw2 h ASN 54 Ca 0.16 -0.30 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 2jw2 h ASN 54 Cb 0.05 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 2jw2 h ASN 54 CO -0.02 0.93 -0.10 -0.78 -1.65 0.00 0.00 177.43 175.81 2jw2 h ASP 55 N -1.00 -0.31 0.17 5.81 1.82 -1.02 -3.27 116.42 118.61 2jw2 h ASP 55 Ca -0.09 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.57 2jw2 h ASP 55 Cb 0.68 0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.81 2jw2 h ASP 55 CO -0.06 -0.10 -0.08 0.45 -1.61 0.00 0.00 179.24 177.85 2jw2 h HIS 56 N -0.12 -0.21 -3.52 0.28 -0.00 -1.26 -3.49 115.15 106.83 2jw2 h HIS 56 Ca 0.00 -0.00 0.10 0.00 -0.00 0.00 0.00 60.37 60.46 2jw2 h HIS 56 Cb 0.13 0.07 -0.05 0.00 -0.00 0.00 0.00 27.41 27.56 2jw2 h HIS 56 CO -0.39 -0.13 -0.96 -3.47 -0.00 0.00 0.00 177.93 172.98 2jw2 n ASP 57 N -2.63 -7.45 -1.46 2.45 -0.08 -1.06 -4.94 116.55 101.38 2jw2 n ASP 57 Ca -0.03 1.58 -0.01 0.00 -1.51 0.00 0.00 54.79 54.82 2jw2 n ASP 57 Cb 0.09 -4.76 -0.01 0.00 2.34 0.00 0.00 41.12 38.78 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 -3.09 -0.05 0.00 -0.67 3.72 -1.26 -5.04 117.46 111.07 2jw2 n PHE 58 Ca -0.03 -0.69 0.00 0.00 -0.05 0.00 0.00 57.45 56.68 2jw2 n PHE 58 Cb 0.49 0.22 0.00 0.00 -0.94 0.00 0.00 39.48 39.26 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 0.09 0.00 -4.43 4.37 0.00 -1.26 -4.79 117.00 110.97 2jw2 n LEU 59 Ca -0.10 0.00 -0.46 0.00 0.00 0.00 0.00 56.01 55.45 2jw2 n LEU 59 Cb 0.92 0.00 -0.14 0.00 0.00 0.00 0.00 43.42 44.20 2jw2 n LEU 59 CO -0.08 0.00 2.09 -0.62 0.00 0.00 0.00 177.39 178.78 2jw2 n GLU 60 N 0.00 0.02 0.17 1.96 -0.58 -1.26 -4.73 120.64 116.22 2jw2 n GLU 60 Ca 0.00 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.79 2jw2 n GLU 60 Cb 0.00 -1.53 0.24 0.00 -0.57 0.00 0.00 31.44 29.58 2jw2 n GLU 60 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2jw2 h LYS 61 N 11.29 0.00 0.00 3.49 1.63 -2.00 -2.76 116.57 128.21 2jw2 h LYS 61 Ca -0.07 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.70 2jw2 h LYS 61 Cb 1.34 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.96 2jw2 h LYS 61 CO 1.30 0.43 -0.15 0.38 -3.45 0.00 0.00 179.45 177.96 2jw2 h ASP 62 N 0.00 0.00 0.90 4.20 2.03 -1.99 -2.34 116.42 119.22 2jw2 h ASP 62 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2jw2 h ASP 62 Cb 1.06 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.56 2jw2 h ASP 62 CO 0.06 0.15 -1.07 0.18 -1.03 0.00 0.00 179.24 177.53 2jw2 n LEU 63 N -3.38 0.77 -0.05 0.15 4.77 -1.07 -4.00 117.00 114.20 2jw2 n LEU 63 Ca -0.00 0.29 -0.11 0.00 -0.03 0.00 0.00 56.01 56.15 2jw2 n LEU 63 Cb 0.35 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.40 2jw2 n LEU 63 CO 0.31 -0.16 0.51 0.58 -1.33 0.00 0.00 177.39 177.29 2jw2 h VAL 64 N 0.00 1.29 0.55 4.08 2.07 -1.16 -1.97 116.25 121.11 2jw2 h VAL 64 Ca 0.00 -1.68 -0.02 0.00 0.82 0.00 0.00 66.70 65.82 2jw2 h VAL 64 Cb 0.98 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 2jw2 h VAL 64 CO 0.00 0.54 -0.39 -0.33 0.02 0.00 0.00 177.57 177.41 2jw2 h GLU 65 N 0.58 -0.87 -0.38 1.57 4.39 -1.66 -1.89 114.58 116.33 2jw2 h GLU 65 Ca 0.03 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.79 2jw2 h GLU 65 Cb 1.04 0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.87 2jw2 h GLU 65 CO 0.10 -0.58 0.24 -1.00 -1.16 0.00 0.00 179.01 176.61 2jw2 h PRO 66 N -0.90 0.51 -0.74 2.33 0.13 -1.73 -2.09 132.00 129.50 2jw2 h PRO 66 Ca -0.07 -0.03 0.07 0.00 -0.87 0.00 0.00 66.00 65.10 2jw2 h PRO 66 Cb 0.74 -0.11 -0.06 0.00 0.13 0.00 0.00 31.00 31.69 2jw2 h PRO 66 CO 0.04 0.34 0.42 1.25 -0.23 0.00 0.00 178.00 179.82 2jw2 h LEU 67 N 0.52 0.61 -1.30 1.56 5.85 -1.06 0.24 115.31 121.73 2jw2 h LEU 67 Ca 0.14 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.90 2jw2 h LEU 67 Cb -0.04 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 40.91 2jw2 h LEU 67 CO -0.03 0.37 0.00 0.00 -0.34 0.00 0.00 178.44 178.44 2jw2 h ARG 69 N 0.00 0.00 0.29 0.00 2.43 -0.43 -2.97 114.38 113.70 2jw2 h ARG 69 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2jw2 h ARG 69 Cb 0.53 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 2jw2 h ARG 69 CO 0.00 0.47 -0.46 0.00 -1.51 0.00 0.00 179.97 178.47 2jw2 h ARG 70 N -1.00 -0.76 -0.80 0.20 2.47 -0.92 -1.43 114.38 112.15 2jw2 h ARG 70 Ca -0.01 0.05 0.19 0.00 -1.26 0.00 0.00 59.98 58.96 2jw2 h ARG 70 Cb 0.48 0.17 -0.14 0.00 -1.65 0.00 0.00 29.97 28.84 2jw2 h ARG 70 CO -0.00 -0.51 0.07 -0.07 0.56 0.00 0.00 179.97 180.02 2jw2 h LEU 71 N -0.79 -0.25 -1.94 3.04 3.38 -1.66 1.33 115.31 118.42 2jw2 h LEU 71 Ca -0.03 0.20 0.14 0.00 0.09 0.00 0.00 57.88 58.27 2jw2 h LEU 71 Cb 0.73 0.32 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 2jw2 h LEU 71 CO -0.15 -0.17 0.37 0.78 0.09 0.00 0.00 178.44 179.36 2jw2 h ASN 72 N 0.14 0.06 0.05 -0.43 -0.26 -1.17 0.42 115.58 114.38 2jw2 h ASN 72 Ca 0.46 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 56.20 2jw2 h ASN 72 Cb 0.85 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 38.10 2jw2 h ASN 72 CO -0.67 0.03 -0.02 0.74 -1.06 0.00 0.00 177.43 176.45 2jw2 h THR 73 N 0.06 0.00 -1.00 2.81 2.02 0.27 -3.22 112.91 113.85 2jw2 h THR 73 Ca 0.25 -0.33 0.23 0.00 0.77 0.00 0.00 66.41 67.32 2jw2 h THR 73 Cb 0.89 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.20 2jw2 h THR 73 CO -0.02 0.00 0.62 -0.07 0.37 0.00 0.00 175.52 176.43 2jw2 h LEU 74 N -0.39 0.62 -2.24 2.58 3.38 -1.05 1.14 115.31 119.34 2jw2 h LEU 74 Ca -0.01 0.10 0.05 0.00 0.09 0.00 0.00 57.88 58.11 2jw2 h LEU 74 Cb 0.05 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2jw2 h LEU 74 CO 0.01 0.17 0.20 0.78 0.09 0.00 0.00 178.44 179.70 2jw2 h ASN 75 N 0.58 0.00 0.01 -0.43 2.35 -0.28 2.28 115.58 120.09 2jw2 h ASN 75 Ca 0.59 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 56.02 2jw2 h ASN 75 Cb 1.17 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.50 2jw2 h ASN 75 CO -0.36 0.00 -1.76 1.17 -1.65 0.00 0.00 177.43 174.83 2jw2 n LYS 76 N -3.72 0.59 0.09 0.81 4.81 0.37 -4.24 118.16 116.87 2jw2 n LYS 76 Ca 0.01 0.44 0.12 0.00 -0.87 0.00 0.00 58.31 58.01 2jw2 n LYS 76 Cb 0.32 -1.66 0.45 0.00 0.02 0.00 0.00 35.03 34.17 2jw2 n LYS 76 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2jw2 h ALA 78 N 2.50 2.07 0.00 0.00 0.00 0.37 0.50 119.26 124.70 2jw2 h ALA 78 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jw2 h ALA 78 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2jw2 h ALA 78 CO 0.00 -0.23 0.00 0.43 0.00 0.00 0.00 179.25 179.45 2jw2 n SER 79 N -4.47 2.85 0.00 0.00 7.64 -1.20 -4.90 113.62 113.54 2jw2 n SER 79 Ca 0.11 -1.98 0.00 0.00 1.01 0.00 0.00 58.87 58.01 2jw2 n SER 79 Cb 0.44 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 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 0.47 0.00 -0.76 1.43 2.81 0.17 -5.17 117.12 116.07 2jw2 n MET 80 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2jw2 n MET 80 Cb 0.48 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.99 2jw2 n MET 80 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65