#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 3.15 -0.23 2.03 0.09 -1.26 -4.91 115.29 114.16 2jw2 s HIS 2 Ca 0.00 -0.17 -0.14 0.00 -0.00 0.00 0.00 55.06 54.75 2jw2 s HIS 2 Cb 0.00 -2.99 -0.10 0.00 -0.00 0.00 0.00 32.58 29.50 2jw2 s HIS 2 CO 0.00 -0.69 -0.34 1.58 -0.00 0.00 0.00 174.74 175.29 2jw2 n HIS 3 N 5.76 0.00 -2.79 1.40 -0.00 -1.26 -5.09 115.22 113.24 2jw2 n HIS 3 Ca -0.06 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.64 2jw2 n HIS 3 Cb 0.48 -0.80 -0.02 0.00 -0.00 0.00 0.00 29.99 29.65 2jw2 n HIS 3 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2jw2 n HIS 4 N -4.26 -2.95 -4.29 1.57 -0.00 -1.26 -5.05 115.22 98.98 2jw2 n HIS 4 Ca -0.40 1.61 -0.17 0.00 0.46 0.00 0.00 57.72 59.21 2jw2 n HIS 4 Cb 0.75 -3.00 -0.09 0.00 -0.12 0.00 0.00 29.99 27.53 2jw2 n HIS 4 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2jw2 s HIS 5 N -0.75 1.52 -0.07 1.57 0.00 -1.26 -5.17 115.29 111.14 2jw2 s HIS 5 Ca -0.14 -1.42 -0.03 0.00 -3.00 0.00 0.00 55.06 50.47 2jw2 s HIS 5 Cb 0.01 -0.76 0.04 0.00 -4.00 0.00 0.00 32.58 27.87 2jw2 s HIS 5 CO 0.54 -0.61 0.15 -1.58 -1.00 0.00 0.00 174.74 172.24 2jw2 s HIS 6 N -3.72 -0.17 0.51 0.38 5.65 -1.26 -5.16 115.29 111.51 2jw2 s HIS 6 Ca 0.37 0.49 0.09 0.00 0.25 0.00 0.00 55.06 56.27 2jw2 s HIS 6 Cb 0.05 -0.07 0.05 0.00 -1.18 0.00 0.00 32.58 31.43 2jw2 s HIS 6 CO 0.18 -0.17 0.65 -1.01 -0.65 0.00 0.00 174.74 173.74 2jw2 s HIS 7 N 1.13 2.00 0.13 3.88 4.02 -1.26 -5.14 115.29 120.06 2jw2 s HIS 7 Ca -0.09 -0.61 -0.25 0.00 1.02 0.00 0.00 55.06 55.13 2jw2 s HIS 7 Cb -0.11 -2.24 0.07 0.00 -1.02 0.00 0.00 32.58 29.29 2jw2 s HIS 7 CO -0.06 -0.77 1.02 -1.54 1.02 0.00 0.00 174.74 174.42 2jw2 s SER 8 N -4.48 -0.13 0.30 1.40 1.04 -1.26 -5.19 113.70 105.37 2jw2 s SER 8 Ca 0.56 -0.40 -0.19 0.00 0.48 0.00 0.00 55.95 56.41 2jw2 s SER 8 Cb -0.07 0.44 0.02 0.00 0.10 0.00 0.00 66.02 66.51 2jw2 s SER 8 CO 0.35 -0.82 0.70 -0.94 0.98 0.00 0.00 173.24 173.50 2jw2 s SER 9 N -3.02 -0.16 0.00 7.02 1.04 -1.26 -5.16 113.70 112.17 2jw2 s SER 9 Ca 0.14 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.80 2jw2 s SER 9 Cb -0.01 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.85 2jw2 s SER 9 CO 0.02 -1.39 0.00 0.61 0.98 0.00 0.00 173.24 173.46 2jw2 n GLY 10 N -0.47 -0.67 3.12 7.32 0.00 -1.26 -5.17 105.19 108.06 2jw2 n GLY 10 Ca -0.04 0.88 -0.18 0.00 0.00 0.00 0.00 46.02 46.67 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 2.19 -0.45 0.99 1.02 -1.26 -5.09 118.68 116.08 2jw2 s LEU 11 Ca 0.00 -0.47 0.08 0.00 0.02 0.00 0.00 54.13 53.76 2jw2 s LEU 11 Cb 0.00 -0.50 0.28 0.00 0.02 0.00 0.00 46.19 45.99 2jw2 s LEU 11 CO 0.00 -0.02 0.65 0.52 0.02 0.00 0.00 176.35 177.53 2jw2 n VAL 12 N 1.80 0.40 -2.23 -1.59 0.31 -1.26 -5.12 118.33 110.65 2jw2 n VAL 12 Ca -0.19 -4.54 -0.32 0.00 -0.01 0.00 0.00 64.34 59.28 2jw2 n VAL 12 Cb 0.55 -1.55 -0.02 0.00 -0.91 0.00 0.00 33.84 31.91 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 -1.94 3.71 0.37 5.55 0.04 -1.26 -5.07 135.00 136.40 2jw2 s PRO 13 Ca 0.38 1.01 0.01 0.00 0.04 0.00 0.00 61.00 62.44 2jw2 s PRO 13 Cb 0.22 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 2jw2 s PRO 13 CO -0.09 -0.47 0.57 1.03 0.04 0.00 0.00 177.00 178.08 2jw2 s ARG 14 N -4.20 3.31 -0.43 4.56 1.81 -1.26 -4.23 118.95 118.50 2jw2 s ARG 14 Ca 0.60 -0.48 0.00 0.00 -1.72 0.00 0.00 55.73 54.12 2jw2 s ARG 14 Cb -0.12 -2.66 0.00 0.00 -0.45 0.00 0.00 34.95 31.72 2jw2 s ARG 14 CO 0.36 0.03 0.00 0.41 -0.68 0.00 0.00 175.30 175.41 2jw2 n GLY 15 N -1.84 -0.50 0.44 -3.53 0.00 -1.26 -4.73 105.19 93.77 2jw2 n GLY 15 Ca -0.03 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.63 1.17 -0.20 1.61 7.64 -1.26 -4.27 113.62 116.68 2jw2 n SER 16 Ca -0.06 -2.06 0.28 0.00 1.01 0.00 0.00 58.87 58.04 2jw2 n SER 16 Cb 0.55 -0.24 0.48 0.00 -1.01 0.00 0.00 64.21 63.99 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 0.86 0.00 0.03 1.43 5.75 -1.93 0.89 115.11 122.14 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 0.39 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.94 2jw2 h GLN 17 CO 0.03 0.00 -0.01 0.93 -2.65 0.00 0.00 178.83 177.13 2jw2 h GLU 18 N 0.00 -0.04 0.00 1.69 4.39 -1.98 -3.27 114.58 115.38 2jw2 h GLU 18 Ca 0.48 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.18 2jw2 h GLU 18 Cb 2.76 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 31.42 2jw2 h GLU 18 CO -0.01 -0.03 0.30 0.82 -1.16 0.00 0.00 179.01 178.94 2jw2 h ILE 19 N -0.20 0.00 0.00 3.13 2.04 -1.41 0.81 117.51 121.88 2jw2 h ILE 19 Ca -0.00 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.74 2jw2 h ILE 19 Cb 0.03 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 2jw2 h ILE 19 CO 0.01 0.00 -0.57 -0.33 0.00 0.00 0.00 178.15 177.25 2jw2 h GLU 20 N 0.00 0.00 0.30 2.37 5.08 -0.96 -2.73 114.58 118.65 2jw2 h GLU 20 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2jw2 h GLU 20 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2jw2 h GLU 20 CO 0.00 0.57 -0.14 0.00 -1.00 0.00 0.00 179.01 178.44 2jw2 h ALA 21 N 1.43 -0.74 -1.01 3.43 0.00 0.61 1.12 119.26 124.10 2jw2 h ALA 21 Ca -0.01 -0.09 0.22 0.00 0.00 0.00 0.00 54.91 55.04 2jw2 h ALA 21 Cb 1.10 0.16 -0.12 0.00 0.00 0.00 0.00 17.79 18.93 2jw2 h ALA 21 CO 0.07 -0.71 0.60 -0.22 0.00 0.00 0.00 179.25 179.00 2jw2 h LYS 22 N -0.58 0.64 0.09 0.00 3.11 -1.66 -1.23 116.57 116.95 2jw2 h LYS 22 Ca -0.04 -0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 57.76 2jw2 h LYS 22 Cb 0.31 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.40 2jw2 h LYS 22 CO 0.07 0.42 -0.04 0.93 -2.81 0.00 0.00 179.45 178.02 2jw2 h GLU 23 N 0.66 -0.12 -0.90 1.90 4.39 -1.49 -2.02 114.58 116.99 2jw2 h GLU 23 Ca 0.62 0.01 0.21 0.00 0.34 0.00 0.00 59.36 60.53 2jw2 h GLU 23 Cb 1.09 0.03 -0.17 0.00 -0.10 0.00 0.00 28.75 29.59 2jw2 h GLU 23 CO -0.43 0.40 -0.14 0.00 -1.16 0.00 0.00 179.01 177.68 2jw2 n ALA 24 N -2.51 0.31 0.07 3.43 0.00 0.39 0.24 120.51 122.44 2jw2 n ALA 24 Ca -0.08 0.98 -0.13 0.00 0.00 0.00 0.00 53.44 54.21 2jw2 n ALA 24 Cb 0.29 -0.64 -0.05 0.00 0.00 0.00 0.00 19.45 19.05 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 -3.72 0.77 -0.06 0.00 -0.08 0.35 -3.16 116.55 110.65 2jw2 n ASP 26 Ca -0.06 0.63 -0.22 0.00 -1.51 0.00 0.00 54.79 53.62 2jw2 n ASP 26 Cb 0.84 -0.81 -0.13 0.00 2.34 0.00 0.00 41.12 43.37 2jw2 n ASP 26 CO 0.00 0.00 0.00 1.87 0.12 0.00 0.00 177.20 179.19 2jw2 n TRP 27 N -2.28 0.83 -0.19 -0.67 -0.00 0.66 -3.44 117.44 112.35 2jw2 n TRP 27 Ca 0.04 0.23 0.19 0.00 -0.00 0.00 0.00 57.50 57.96 2jw2 n TRP 27 Cb 0.33 -1.10 0.55 0.00 -0.00 0.00 0.00 31.31 31.09 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 -0.34 0.33 -0.05 5.87 3.38 -1.24 1.13 115.31 124.39 2jw2 h LEU 28 Ca -0.47 0.03 -0.20 0.00 0.09 0.00 0.00 57.88 57.33 2jw2 h LEU 28 Cb 1.78 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 42.46 2jw2 h LEU 28 CO -0.08 0.15 -0.96 0.08 0.09 0.00 0.00 178.44 177.72 2jw2 h ARG 29 N 0.34 0.00 0.00 1.13 0.11 -1.54 1.06 114.38 115.47 2jw2 h ARG 29 Ca 0.42 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 60.38 2jw2 h ARG 29 Cb 1.11 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.17 2jw2 h ARG 29 CO -0.13 0.96 -0.68 0.00 0.10 0.00 0.00 179.97 180.22 2jw2 h ALA 30 N 1.04 0.66 0.00 0.08 0.00 -0.42 -3.18 119.26 117.44 2jw2 h ALA 30 Ca -0.01 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2jw2 h ALA 30 Cb 1.71 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.49 2jw2 h ALA 30 CO 0.12 0.68 0.00 0.00 0.00 0.00 0.00 179.25 180.06 2jw2 n ALA 31 N -2.26 2.25 0.00 0.00 0.00 0.35 -4.88 120.51 115.97 2jw2 n ALA 31 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2jw2 n ALA 31 Cb 0.76 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.74 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 1.24 1.61 2.46 0.00 0.00 -1.16 -4.98 105.19 104.36 2jw2 n GLY 32 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.32 -1.75 1.89 1.61 3.72 0.36 -4.96 117.46 118.02 2jw2 n PHE 33 Ca 0.00 -2.72 0.16 0.00 -0.05 0.00 0.00 57.45 54.83 2jw2 n PHE 33 Cb 0.00 0.58 0.91 0.00 -0.94 0.00 0.00 39.48 40.03 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 1.39 0.90 0.00 -1.08 -0.04 -1.22 -3.13 135.00 131.81 2jw2 n PRO 34 Ca 0.15 -0.01 0.13 0.00 -0.04 0.00 0.00 63.50 63.73 2jw2 n PRO 34 Cb 0.59 -1.50 0.34 0.00 -0.04 0.00 0.00 33.50 32.89 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 -1.05 0.00 -0.02 0.54 0.00 -1.26 -4.02 117.38 111.57 2jw2 n GLN 35 Ca 0.22 0.00 -0.01 0.00 0.00 0.00 0.00 57.00 57.22 2jw2 n GLN 35 Cb 0.14 -1.50 -0.00 0.00 0.00 0.00 0.00 30.24 28.87 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 -1.39 2.61 0.05 -1.91 -3.35 116.97 112.98 2jw2 h TYR 36 Ca 0.00 0.00 0.45 0.00 0.05 0.00 0.00 58.73 59.23 2jw2 h TYR 36 Cb 0.50 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 38.14 2jw2 h TYR 36 CO 0.00 0.00 0.94 0.00 -1.05 0.00 0.00 178.16 178.05 2jw2 n ALA 37 N -2.43 1.36 -0.31 3.88 0.00 -1.26 0.21 120.51 121.95 2jw2 n ALA 37 Ca -0.01 0.71 0.07 0.00 0.00 0.00 0.00 53.44 54.21 2jw2 n ALA 37 Cb 0.03 -0.96 0.23 0.00 0.00 0.00 0.00 19.45 18.75 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 0.71 -0.91 0.00 1.08 -1.70 0.28 115.11 114.58 2jw2 h GLN 38 Ca 0.80 -0.04 0.09 0.00 -1.45 0.00 0.00 58.65 58.04 2jw2 h GLN 38 Cb 2.78 -0.16 -0.06 0.00 -0.05 0.00 0.00 27.48 29.99 2jw2 h GLN 38 CO -0.28 0.47 0.59 -0.07 -0.95 0.00 0.00 178.83 178.59 2jw2 h LEU 39 N 0.74 0.86 -0.58 1.46 3.38 0.23 -2.57 115.31 118.83 2jw2 h LEU 39 Ca 0.48 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.56 2jw2 h LEU 39 Cb 0.61 -0.16 -0.11 0.00 0.09 0.00 0.00 40.66 41.09 2jw2 h LEU 39 CO -0.33 0.52 -0.36 0.22 0.09 0.00 0.00 178.44 178.59 2jw2 h TYR 40 N 0.96 -1.00 -1.55 1.13 3.20 -1.01 0.81 116.97 119.51 2jw2 h TYR 40 Ca 0.41 0.07 0.45 0.00 3.14 0.00 0.00 58.73 62.81 2jw2 h TYR 40 Cb 0.33 0.52 -0.07 0.00 1.54 0.00 0.00 36.73 39.05 2jw2 h TYR 40 CO -0.00 -0.39 1.11 0.93 -1.64 0.00 0.00 178.16 178.17 2jw2 h GLU 41 N -0.18 0.01 0.00 1.82 4.39 -1.53 2.19 114.58 121.28 2jw2 h GLU 41 Ca 0.22 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.92 2jw2 h GLU 41 Cb 0.55 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2jw2 h GLU 41 CO -0.68 0.01 -1.29 -3.47 -1.16 0.00 0.00 179.01 172.41 2jw2 n ASP 42 N -4.09 0.54 -0.02 1.42 -0.08 0.25 -4.96 116.55 109.61 2jw2 n ASP 42 Ca 0.34 0.08 -0.00 0.00 -1.51 0.00 0.00 54.79 53.70 2jw2 n ASP 42 Cb 1.60 0.99 -0.00 0.00 2.34 0.00 0.00 41.12 46.05 2jw2 n ASP 42 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2jw2 n SER 43 N -2.35 -3.09 -1.45 1.67 2.88 0.74 -4.90 113.62 107.11 2jw2 n SER 43 Ca -0.01 0.01 -0.06 0.00 -1.33 0.00 0.00 58.87 57.48 2jw2 n SER 43 Cb 0.52 -0.61 0.14 0.00 -0.75 0.00 0.00 64.21 63.50 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 -2.92 2.17 -0.15 -1.46 1.13 -1.13 -4.32 117.38 110.70 2jw2 n GLN 44 Ca -0.00 -1.54 -0.10 0.00 -1.94 0.00 0.00 57.00 53.41 2jw2 n GLN 44 Cb 0.02 -1.71 0.03 0.00 0.11 0.00 0.00 30.24 28.68 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 1.11 1.10 -2.68 1.08 -1.00 -1.89 -3.42 116.94 111.23 2jw2 h PHE 45 Ca 0.19 -0.25 -0.56 0.00 2.81 0.00 0.00 57.97 60.16 2jw2 h PHE 45 Cb 1.67 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 40.94 2jw2 h PHE 45 CO 0.70 1.06 1.16 -2.14 -1.61 0.00 0.00 178.31 177.48 2jw2 s PRO 46 N -4.72 3.77 0.28 1.51 0.02 -1.26 -4.70 135.00 129.90 2jw2 s PRO 46 Ca -0.11 1.75 -0.19 0.00 0.02 0.00 0.00 61.00 62.47 2jw2 s PRO 46 Cb 0.13 -4.07 0.07 0.00 0.02 0.00 0.00 34.50 30.65 2jw2 s PRO 46 CO 0.86 -1.33 0.93 0.96 -0.33 0.00 0.00 177.00 178.09 2jw2 s ILE 47 N 5.38 0.00 -0.65 2.83 -4.36 -1.26 -5.08 121.20 118.06 2jw2 s ILE 47 Ca 0.75 -0.77 -0.26 0.00 -0.26 0.00 0.00 60.65 60.11 2jw2 s ILE 47 Cb -0.27 -2.91 -0.12 0.00 1.25 0.00 0.00 42.46 40.41 2jw2 s ILE 47 CO 0.30 0.00 2.43 -3.20 0.24 0.00 0.00 174.94 174.71 2jw2 n ASN 48 N -1.33 1.83 -0.07 4.36 4.05 -1.26 -4.75 115.26 118.08 2jw2 n ASN 48 Ca -0.05 -0.79 -0.07 0.00 0.45 0.00 0.00 54.58 54.12 2jw2 n ASN 48 Cb 0.60 -1.52 0.11 0.00 1.23 0.00 0.00 39.78 40.20 2jw2 n ASN 48 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 2jw2 h ILE 49 N 7.70 1.27 -0.22 -1.44 2.04 -1.98 -1.69 117.51 123.19 2jw2 h ILE 49 Ca -0.13 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.42 2jw2 h ILE 49 Cb 1.18 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 2jw2 h ILE 49 CO 1.15 0.43 0.11 0.58 0.00 0.00 0.00 178.15 180.42 2jw2 h VAL 50 N 0.64 1.13 -0.01 1.67 2.07 -1.99 -2.98 116.25 116.78 2jw2 h VAL 50 Ca 0.09 -0.38 -0.17 0.00 0.82 0.00 0.00 66.70 67.07 2jw2 h VAL 50 Cb 0.70 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 2jw2 h VAL 50 CO 0.05 0.13 -0.76 0.00 0.02 0.00 0.00 177.57 177.01 2jw2 h ALA 51 N 0.98 0.71 -0.07 1.67 0.00 -1.95 -3.31 119.26 117.28 2jw2 h ALA 51 Ca 0.08 -0.67 0.02 0.00 0.00 0.00 0.00 54.91 54.34 2jw2 h ALA 51 Cb 0.11 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2jw2 h ALA 51 CO -0.01 0.89 -0.49 0.28 0.00 0.00 0.00 179.25 179.92 2jw2 h VAL 52 N 0.06 0.00 -0.52 0.00 2.07 -1.16 0.71 116.25 117.42 2jw2 h VAL 52 Ca -0.02 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.65 2jw2 h VAL 52 Cb 1.34 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 2jw2 h VAL 52 CO 0.11 0.00 0.63 0.07 0.02 0.00 0.00 177.57 178.40 2jw2 h LYS 53 N -0.56 0.00 0.00 1.57 2.10 -1.62 1.95 116.57 120.00 2jw2 h LYS 53 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 2jw2 h LYS 53 Cb 0.63 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 2jw2 h LYS 53 CO -0.37 0.00 -1.06 0.09 -2.00 0.00 0.00 179.45 176.11 2jw2 n ASN 54 N -3.50 0.61 -0.03 7.07 3.02 0.91 -3.30 115.26 120.04 2jw2 n ASN 54 Ca 0.10 -0.10 -0.03 0.00 -0.03 0.00 0.00 54.58 54.53 2jw2 n ASN 54 Cb 0.83 0.79 -0.01 0.00 -0.61 0.00 0.00 39.78 40.77 2jw2 n ASN 54 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2jw2 n ASP 55 N -2.09 0.67 0.00 6.41 8.00 0.61 -4.30 116.55 125.84 2jw2 n ASP 55 Ca 0.01 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.70 2jw2 n ASP 55 Cb 0.46 -0.60 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 2jw2 n ASP 55 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2jw2 n HIS 56 N -3.16 0.00 -2.93 1.24 8.25 0.19 -4.82 115.22 113.99 2jw2 n HIS 56 Ca -0.04 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.34 2jw2 n HIS 56 Cb 0.16 -0.27 0.01 0.00 1.12 0.00 0.00 29.99 31.00 2jw2 n HIS 56 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2jw2 n ASP 57 N -1.27 -7.51 -4.59 0.41 -0.08 -1.25 -4.89 116.55 97.38 2jw2 n ASP 57 Ca 0.00 0.77 -0.36 0.00 -1.51 0.00 0.00 54.79 53.69 2jw2 n ASP 57 Cb 0.21 -4.42 0.08 0.00 2.34 0.00 0.00 41.12 39.32 2jw2 n ASP 57 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 2jw2 n PHE 58 N 0.29 0.44 0.00 -0.67 1.16 -1.21 -4.97 117.46 112.50 2jw2 n PHE 58 Ca 0.03 0.40 -0.01 0.00 -1.87 0.00 0.00 57.45 56.00 2jw2 n PHE 58 Cb 0.32 -2.06 -0.00 0.00 -1.61 0.00 0.00 39.48 36.13 2jw2 n PHE 58 CO 0.00 0.00 0.00 1.25 -1.87 0.00 0.00 176.76 176.14 2jw2 h LEU 59 N -0.11 -0.03 -9.23 5.98 5.85 -1.90 -3.47 115.31 112.40 2jw2 h LEU 59 Ca -0.47 0.00 -0.67 0.00 0.84 0.00 0.00 57.88 57.58 2jw2 h LEU 59 Cb 1.34 0.01 -0.16 0.00 0.37 0.00 0.00 40.66 42.22 2jw2 h LEU 59 CO 0.47 0.08 -0.72 -1.61 -0.34 0.00 0.00 178.44 176.31 2jw2 s GLU 60 N -1.40 2.35 0.19 1.25 2.02 -1.26 -5.01 118.70 116.84 2jw2 s GLU 60 Ca -0.00 -0.87 -0.14 0.00 0.02 0.00 0.00 54.97 53.97 2jw2 s GLU 60 Cb 0.00 -2.40 0.19 0.00 0.10 0.00 0.00 34.13 32.02 2jw2 s GLU 60 CO 0.01 0.55 1.65 -0.22 0.02 0.00 0.00 175.26 177.28 2jw2 h LYS 61 N 4.06 0.03 0.00 1.61 3.11 -2.02 1.30 116.57 124.66 2jw2 h LYS 61 Ca -0.48 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.35 2jw2 h LYS 61 Cb 1.17 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.39 2jw2 h LYS 61 CO 0.53 0.02 0.00 -0.40 -2.81 0.00 0.00 179.45 176.79 2jw2 n ASP 62 N -5.34 0.00 -1.04 4.20 5.75 -1.26 -0.47 116.55 118.39 2jw2 n ASP 62 Ca 0.06 0.07 0.12 0.00 -0.01 0.00 0.00 54.79 55.03 2jw2 n ASP 62 Cb 0.29 -0.19 0.15 0.00 -1.03 0.00 0.00 41.12 40.34 2jw2 n ASP 62 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2jw2 n LEU 63 N -1.19 3.20 -0.04 -2.12 7.94 0.44 -4.33 117.00 120.90 2jw2 n LEU 63 Ca 0.03 -1.22 -0.21 0.00 -1.11 0.00 0.00 56.01 53.50 2jw2 n LEU 63 Cb 0.04 -0.11 -0.13 0.00 0.53 0.00 0.00 43.42 43.75 2jw2 n LEU 63 CO 0.04 0.61 -0.55 0.58 -1.11 0.00 0.00 177.39 176.96 2jw2 h VAL 64 N 4.58 0.88 0.42 1.96 2.07 -0.62 -3.21 116.25 122.32 2jw2 h VAL 64 Ca 0.00 -2.29 -0.02 0.00 0.82 0.00 0.00 66.70 65.21 2jw2 h VAL 64 Cb 0.99 2.47 -0.01 0.00 -1.52 0.00 0.00 31.29 33.22 2jw2 h VAL 64 CO 0.00 0.59 -0.29 -0.33 0.02 0.00 0.00 177.57 177.56 2jw2 h GLU 65 N -0.51 -0.65 -0.90 1.57 5.08 -1.76 -1.25 114.58 116.17 2jw2 h GLU 65 Ca -0.35 0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.16 2jw2 h GLU 65 Cb 1.63 0.15 -0.07 0.00 0.50 0.00 0.00 28.75 30.96 2jw2 h GLU 65 CO -0.05 -0.43 0.58 -1.00 -1.00 0.00 0.00 179.01 177.11 2jw2 h PRO 66 N -0.67 0.85 -0.26 2.33 0.13 -1.78 -0.42 132.00 132.17 2jw2 h PRO 66 Ca -0.06 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 65.03 2jw2 h PRO 66 Cb 0.55 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 31.47 2jw2 h PRO 66 CO 0.03 0.56 0.15 1.25 -0.23 0.00 0.00 178.00 179.77 2jw2 h LEU 67 N 0.87 0.25 -0.79 1.56 6.46 -1.53 0.22 115.31 122.37 2jw2 h LEU 67 Ca 0.42 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.18 2jw2 h LEU 67 Cb 0.45 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.33 2jw2 h LEU 67 CO -0.19 0.19 0.00 0.00 -0.62 0.00 0.00 178.44 177.82 2jw2 h ARG 69 N 0.00 0.02 0.13 0.00 2.43 0.18 -3.10 114.38 114.03 2jw2 h ARG 69 Ca 0.00 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2jw2 h ARG 69 Cb 0.57 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2jw2 h ARG 69 CO 0.00 1.02 -0.06 0.00 -1.51 0.00 0.00 179.97 179.42 2jw2 h ARG 70 N -0.96 -0.16 -0.89 0.20 2.47 -0.61 -2.87 114.38 111.56 2jw2 h ARG 70 Ca -0.04 0.01 0.20 0.00 -1.26 0.00 0.00 59.98 58.89 2jw2 h ARG 70 Cb 1.07 0.04 -0.11 0.00 -1.65 0.00 0.00 29.97 29.31 2jw2 h ARG 70 CO -0.01 0.14 0.43 -0.07 0.56 0.00 0.00 179.97 181.03 2jw2 h LEU 71 N -0.47 0.45 -0.77 3.04 3.38 -1.57 0.32 115.31 119.68 2jw2 h LEU 71 Ca -0.02 0.13 0.08 0.00 0.09 0.00 0.00 57.88 58.16 2jw2 h LEU 71 Cb 0.38 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.14 2jw2 h LEU 71 CO 0.03 0.10 0.44 -1.13 0.09 0.00 0.00 178.44 177.96 2jw2 h ASN 72 N 0.51 0.64 0.62 -0.43 -1.24 -1.44 0.54 115.58 114.77 2jw2 h ASN 72 Ca 0.53 0.04 -0.03 0.00 0.71 0.00 0.00 56.30 57.55 2jw2 h ASN 72 Cb 0.93 -0.08 0.01 0.00 0.73 0.00 0.00 38.32 39.90 2jw2 h ASN 72 CO -0.46 0.38 -0.30 0.74 -1.29 0.00 0.00 177.43 176.51 2jw2 h THR 73 N 0.76 0.00 -0.80 -3.57 2.02 -0.19 -2.78 112.91 108.34 2jw2 h THR 73 Ca 0.36 -0.07 0.13 0.00 0.77 0.00 0.00 66.41 67.60 2jw2 h THR 73 Cb 0.28 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.61 2jw2 h THR 73 CO -0.22 0.00 0.40 -0.07 0.37 0.00 0.00 175.52 176.00 2jw2 h LEU 74 N -0.89 0.49 -1.86 2.58 3.38 -1.17 0.40 115.31 118.24 2jw2 h LEU 74 Ca -0.08 0.08 0.16 0.00 0.09 0.00 0.00 57.88 58.13 2jw2 h LEU 74 Cb 0.63 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 2jw2 h LEU 74 CO 0.14 0.23 0.57 0.78 0.09 0.00 0.00 178.44 180.25 2jw2 h ASN 75 N 0.61 0.00 0.25 -0.43 4.21 0.17 2.28 115.58 122.67 2jw2 h ASN 75 Ca 0.43 0.00 -0.34 0.00 1.21 0.00 0.00 56.30 57.60 2jw2 h ASN 75 Cb 0.56 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 37.71 2jw2 h ASN 75 CO -0.34 0.00 -2.00 1.17 -1.29 0.00 0.00 177.43 174.97 2jw2 n LYS 76 N -3.69 0.68 0.00 0.81 4.81 0.13 -4.07 118.16 116.83 2jw2 n LYS 76 Ca 0.11 0.21 0.13 0.00 -0.87 0.00 0.00 58.31 57.89 2jw2 n LYS 76 Cb 0.78 -1.69 0.40 0.00 0.02 0.00 0.00 35.03 34.54 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 3.16 1.00 0.00 0.00 0.00 0.35 -0.96 119.26 122.81 2jw2 h ALA 78 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jw2 h ALA 78 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2jw2 h ALA 78 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.91 2jw2 h SER 79 N 0.00 0.00 0.00 0.00 4.64 -1.80 -3.46 113.55 112.93 2jw2 h SER 79 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jw2 h SER 79 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2jw2 h SER 79 CO 0.00 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.19 2jw2 n MET 80 N -2.43 0.00 0.00 4.77 2.81 -0.37 -5.21 117.12 116.69 2jw2 n MET 80 Ca 0.03 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 2jw2 n MET 80 Cb 0.35 0.00 0.02 0.00 -0.71 0.00 0.00 33.22 32.87 2jw2 n MET 80 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11