#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 1.64 -0.12 3.17 0.09 -1.26 -5.13 115.29 113.67 2jw2 s HIS 2 Ca 0.00 -0.48 -0.22 0.00 -0.00 0.00 0.00 55.06 54.36 2jw2 s HIS 2 Cb 0.00 -2.59 0.05 0.00 -0.00 0.00 0.00 32.58 30.04 2jw2 s HIS 2 CO 0.00 -1.34 0.54 -1.01 -0.00 0.00 0.00 174.74 172.93 2jw2 s HIS 3 N -2.86 -0.54 0.30 1.40 3.76 -1.26 -5.18 115.29 110.92 2jw2 s HIS 3 Ca 0.63 1.13 0.03 0.00 -0.15 0.00 0.00 55.06 56.70 2jw2 s HIS 3 Cb -0.06 0.24 0.06 0.00 1.11 0.00 0.00 32.58 33.93 2jw2 s HIS 3 CO 0.41 -0.41 0.42 0.72 -0.85 0.00 0.00 174.74 175.03 2jw2 n HIS 4 N 1.91 -2.86 -3.62 1.40 -0.00 -1.26 -4.75 115.22 106.04 2jw2 n HIS 4 Ca -0.17 -0.94 -0.28 0.00 -0.00 0.00 0.00 57.72 56.32 2jw2 n HIS 4 Cb 0.56 -0.30 0.01 0.00 -0.00 0.00 0.00 29.99 30.27 2jw2 n HIS 4 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2jw2 n HIS 5 N -1.79 -2.38 0.00 4.41 -0.00 -1.26 -4.94 115.22 109.26 2jw2 n HIS 5 Ca 0.08 0.98 0.00 0.00 -0.00 0.00 0.00 57.72 58.78 2jw2 n HIS 5 Cb 0.28 -2.51 0.00 0.00 -0.00 0.00 0.00 29.99 27.76 2jw2 n HIS 5 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2jw2 n HIS 6 N -1.61 0.00 -3.65 4.41 -0.00 -1.26 -5.03 115.22 108.08 2jw2 n HIS 6 Ca -0.21 0.00 -0.00 0.00 -0.00 0.00 0.00 57.72 57.51 2jw2 n HIS 6 Cb 0.68 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 30.60 2jw2 n HIS 6 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2jw2 s HIS 7 N 0.00 -0.22 0.29 4.41 0.00 -1.26 -5.15 115.29 113.35 2jw2 s HIS 7 Ca 0.00 0.46 -0.29 0.00 -3.00 0.00 0.00 55.06 52.23 2jw2 s HIS 7 Cb 0.00 0.21 -0.10 0.00 -4.00 0.00 0.00 32.58 28.69 2jw2 s HIS 7 CO 0.00 -0.11 1.25 -1.12 -1.00 0.00 0.00 174.74 173.76 2jw2 s SER 8 N 0.91 6.94 0.39 7.38 0.01 -1.26 -5.03 113.70 123.04 2jw2 s SER 8 Ca -0.05 2.50 0.08 0.00 1.31 0.00 0.00 55.95 59.79 2jw2 s SER 8 Cb -0.03 -2.63 -0.00 0.00 0.21 0.00 0.00 66.02 63.56 2jw2 s SER 8 CO -0.12 -0.42 0.50 -0.55 0.41 0.00 0.00 173.24 173.06 2jw2 s SER 9 N -0.40 5.65 0.00 2.44 0.15 -1.26 -5.02 113.70 115.26 2jw2 s SER 9 Ca 0.49 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.75 2jw2 s SER 9 Cb -0.37 -0.83 0.00 0.00 -1.71 0.00 0.00 66.02 63.11 2jw2 s SER 9 CO 0.46 -0.63 0.23 0.61 1.20 0.00 0.00 173.24 175.11 2jw2 n GLY 10 N -1.72 -0.05 3.91 9.45 0.00 -1.26 -5.15 105.19 110.37 2jw2 n GLY 10 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 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 4.06 0.54 0.99 1.43 -1.26 -5.09 118.68 119.36 2jw2 s LEU 11 Ca 0.00 0.63 -0.15 0.00 -1.03 0.00 0.00 54.13 53.58 2jw2 s LEU 11 Cb 0.00 -3.45 -0.07 0.00 0.03 0.00 0.00 46.19 42.70 2jw2 s LEU 11 CO 0.00 -0.20 1.00 0.68 0.23 0.00 0.00 176.35 178.05 2jw2 s VAL 12 N -2.11 4.58 -0.26 -1.59 -7.23 -1.26 -4.98 120.40 107.55 2jw2 s VAL 12 Ca 0.43 1.14 -0.29 0.00 -1.81 0.00 0.00 61.98 61.44 2jw2 s VAL 12 Cb -0.11 -3.76 -0.02 0.00 0.56 0.00 0.00 36.38 33.05 2jw2 s VAL 12 CO 0.31 -0.80 1.70 -2.16 -0.31 0.00 0.00 175.10 173.85 2jw2 s PRO 13 N -4.33 3.61 -0.49 4.82 0.04 -1.26 -4.89 135.00 132.50 2jw2 s PRO 13 Ca 0.58 1.59 0.06 0.00 0.04 0.00 0.00 61.00 63.27 2jw2 s PRO 13 Cb -0.10 -4.11 0.18 0.00 0.04 0.00 0.00 34.50 30.52 2jw2 s PRO 13 CO 0.37 -1.52 0.64 0.50 0.04 0.00 0.00 177.00 177.02 2jw2 s ARG 14 N 5.08 1.02 -1.43 4.56 3.52 -1.26 -4.92 118.95 125.52 2jw2 s ARG 14 Ca 0.75 -1.23 0.00 0.00 -0.13 0.00 0.00 55.73 55.12 2jw2 s ARG 14 Cb -0.24 -0.33 0.00 0.00 -1.56 0.00 0.00 34.95 32.82 2jw2 s ARG 14 CO 0.32 -1.33 0.00 0.41 -0.81 0.00 0.00 175.30 173.88 2jw2 n GLY 15 N 3.03 -0.47 1.43 8.12 0.00 -1.26 -4.83 105.19 111.20 2jw2 n GLY 15 Ca 0.20 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.90 4.44 0.06 1.61 7.64 -1.26 -4.56 113.62 119.65 2jw2 n SER 16 Ca -0.20 -2.37 0.16 0.00 1.01 0.00 0.00 58.87 57.47 2jw2 n SER 16 Cb 0.65 -0.53 0.33 0.00 -1.01 0.00 0.00 64.21 63.64 2jw2 n SER 16 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2jw2 h GLN 17 N 3.81 0.00 0.00 1.43 1.08 -1.99 -0.42 115.11 119.02 2jw2 h GLN 17 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2jw2 h GLN 17 Cb 1.32 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.75 2jw2 h GLN 17 CO 0.18 0.00 0.00 0.39 -0.95 0.00 0.00 178.83 178.45 2jw2 n GLU 18 N -2.98 0.00 0.27 1.46 -0.58 -1.26 -2.56 120.64 114.99 2jw2 n GLU 18 Ca 0.11 0.49 0.09 0.00 -0.42 0.00 0.00 57.16 57.43 2jw2 n GLU 18 Cb 1.17 -1.15 0.48 0.00 -0.57 0.00 0.00 31.44 31.37 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 0.01 -3.67 5.03 -1.49 1.05 117.51 118.44 2jw2 h ILE 19 Ca 0.00 0.00 -0.23 0.00 -0.12 0.00 0.00 64.86 64.51 2jw2 h ILE 19 Cb 0.00 0.39 0.00 0.00 -3.03 0.00 0.00 36.82 34.18 2jw2 h ILE 19 CO 0.00 0.00 -0.98 -0.33 -0.68 0.00 0.00 178.15 176.16 2jw2 h GLU 20 N 0.00 0.43 0.81 2.37 5.08 -1.24 -3.24 114.58 118.78 2jw2 h GLU 20 Ca 0.00 -0.48 -0.04 0.00 -1.00 0.00 0.00 59.36 57.85 2jw2 h GLU 20 Cb 0.92 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2jw2 h GLU 20 CO 0.00 1.14 -0.43 0.00 -1.00 0.00 0.00 179.01 178.71 2jw2 h ALA 21 N 0.69 -1.16 -0.52 3.43 0.00 0.14 0.39 119.26 122.24 2jw2 h ALA 21 Ca -0.09 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 54.68 2jw2 h ALA 21 Cb 1.62 0.50 -0.11 0.00 0.00 0.00 0.00 17.79 19.81 2jw2 h ALA 21 CO 0.17 -1.16 -0.25 0.87 0.00 0.00 0.00 179.25 178.88 2jw2 h LYS 22 N -1.14 -0.12 -0.03 0.00 1.79 -1.67 -1.74 116.57 113.66 2jw2 h LYS 22 Ca -0.11 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.36 2jw2 h LYS 22 Cb 0.90 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.57 2jw2 h LYS 22 CO 0.15 -0.08 -0.01 1.05 -1.08 0.00 0.00 179.45 179.48 2jw2 h GLU 23 N -0.12 0.06 -0.93 3.15 4.11 -1.57 -1.49 114.58 117.79 2jw2 h GLU 23 Ca 0.24 -0.02 0.17 0.00 0.07 0.00 0.00 59.36 59.82 2jw2 h GLU 23 Cb 0.50 -0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.58 2jw2 h GLU 23 CO -0.60 0.40 -0.28 0.00 0.07 0.00 0.00 179.01 178.60 2jw2 n ALA 24 N -2.29 0.10 0.04 1.06 0.00 0.14 0.29 120.51 119.85 2jw2 n ALA 24 Ca -0.08 0.99 -0.13 0.00 0.00 0.00 0.00 53.44 54.22 2jw2 n ALA 24 Cb 0.20 -0.54 -0.02 0.00 0.00 0.00 0.00 19.45 19.09 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 -3.83 0.61 -0.10 0.00 -0.08 0.23 -3.48 116.55 109.90 2jw2 n ASP 26 Ca -0.06 0.60 -0.16 0.00 -1.51 0.00 0.00 54.79 53.66 2jw2 n ASP 26 Cb 0.76 -0.75 -0.07 0.00 2.34 0.00 0.00 41.12 43.41 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 -2.12 0.64 -0.59 -0.67 -0.00 0.84 -3.50 117.44 112.05 2jw2 n TRP 27 Ca 0.04 0.28 0.48 0.00 -0.00 0.00 0.00 57.50 58.30 2jw2 n TRP 27 Cb 0.32 -0.89 0.80 0.00 -0.00 0.00 0.00 31.31 31.54 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 -1.00 0.00 0.09 5.87 3.38 -1.23 2.32 115.31 124.74 2jw2 h LEU 28 Ca -0.26 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.44 2jw2 h LEU 28 Cb 1.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2jw2 h LEU 28 CO -0.16 0.00 -1.36 -0.09 0.09 0.00 0.00 178.44 176.92 2jw2 h ARG 29 N 0.00 0.18 0.00 1.13 2.43 -1.69 0.85 114.38 117.28 2jw2 h ARG 29 Ca 0.82 -0.31 -0.09 0.00 -0.81 0.00 0.00 59.98 59.60 2jw2 h ARG 29 Cb 3.34 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 32.99 2jw2 h ARG 29 CO -0.01 1.06 -0.41 0.00 -1.51 0.00 0.00 179.97 179.10 2jw2 h ALA 30 N 0.67 0.82 0.00 2.80 0.00 0.36 -2.95 119.26 120.96 2jw2 h ALA 30 Ca -0.17 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2jw2 h ALA 30 Cb 1.95 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.68 2jw2 h ALA 30 CO 0.16 0.51 -0.01 0.00 0.00 0.00 0.00 179.25 179.90 2jw2 n ALA 31 N -2.24 2.31 0.00 0.00 0.00 0.14 -4.89 120.51 115.84 2jw2 n ALA 31 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2jw2 n ALA 31 Cb 0.62 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.60 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 1.36 1.31 2.39 0.00 0.00 -1.11 -5.03 105.19 104.10 2jw2 n GLY 32 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.53 1.10 0.39 1.61 3.72 0.29 -4.90 117.46 118.14 2jw2 n PHE 33 Ca 0.00 -3.73 0.10 0.00 -0.05 0.00 0.00 57.45 53.77 2jw2 n PHE 33 Cb 0.00 -0.42 0.43 0.00 -0.94 0.00 0.00 39.48 38.55 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 0.12 0.13 -0.02 -1.08 -0.04 -0.97 -2.80 135.00 130.34 2jw2 n PRO 34 Ca 0.25 0.40 0.11 0.00 -0.04 0.00 0.00 63.50 64.22 2jw2 n PRO 34 Cb 0.62 -1.77 0.52 0.00 -0.04 0.00 0.00 33.50 32.84 2jw2 n PRO 34 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2jw2 h GLN 35 N 0.00 0.34 0.19 0.54 -0.00 -1.90 -2.95 115.11 111.33 2jw2 h GLN 35 Ca 0.00 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.62 2jw2 h GLN 35 Cb 0.29 -0.08 0.00 0.00 0.00 0.00 0.00 27.48 27.69 2jw2 h GLN 35 CO 0.00 0.23 -0.09 1.88 0.00 0.00 0.00 178.83 180.85 2jw2 h TYR 36 N 0.36 -0.24 -0.77 3.99 0.05 -1.87 -3.19 116.97 115.30 2jw2 h TYR 36 Ca 0.22 -0.01 0.29 0.00 0.05 0.00 0.00 58.73 59.28 2jw2 h TYR 36 Cb 0.40 0.08 -0.14 0.00 1.01 0.00 0.00 36.73 38.08 2jw2 h TYR 36 CO -0.00 -0.15 0.29 0.00 -1.05 0.00 0.00 178.16 177.25 2jw2 n ALA 37 N -2.19 0.67 -0.30 3.88 0.00 -1.15 0.20 120.51 121.61 2jw2 n ALA 37 Ca -0.03 0.79 0.14 0.00 0.00 0.00 0.00 53.44 54.34 2jw2 n ALA 37 Cb 0.10 -0.73 0.30 0.00 0.00 0.00 0.00 19.45 19.13 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 0.20 -0.23 0.00 1.08 -1.50 1.29 115.11 115.96 2jw2 h GLN 38 Ca 0.59 -0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.85 2jw2 h GLN 38 Cb 1.49 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.87 2jw2 h GLN 38 CO -0.63 0.13 0.17 -0.07 -0.95 0.00 0.00 178.83 177.49 2jw2 h LEU 39 N 0.21 0.00 0.42 1.46 3.38 0.22 -2.83 115.31 118.17 2jw2 h LEU 39 Ca 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.51 2jw2 h LEU 39 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2jw2 h LEU 39 CO -0.66 0.00 -0.24 0.22 0.09 0.00 0.00 178.44 177.86 2jw2 h TYR 40 N 0.00 -0.62 -1.21 1.13 3.20 0.16 0.55 116.97 120.19 2jw2 h TYR 40 Ca 0.11 -0.01 0.39 0.00 3.14 0.00 0.00 58.73 62.35 2jw2 h TYR 40 Cb 0.46 0.22 -0.13 0.00 1.54 0.00 0.00 36.73 38.82 2jw2 h TYR 40 CO 0.00 -0.36 0.76 0.93 -1.64 0.00 0.00 178.16 177.85 2jw2 h GLU 41 N -0.60 0.17 0.00 1.82 3.07 -1.49 2.19 114.58 119.73 2jw2 h GLU 41 Ca -0.06 -0.01 -0.15 0.00 -0.50 0.00 0.00 59.36 58.64 2jw2 h GLU 41 Cb 0.48 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.33 2jw2 h GLU 41 CO 0.07 0.11 -0.72 -0.44 -1.40 0.00 0.00 179.01 176.63 2jw2 h ASP 42 N 0.17 0.00 -0.98 1.42 5.19 -1.29 -3.48 116.42 117.45 2jw2 h ASP 42 Ca 0.76 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.17 2jw2 h ASP 42 Cb 2.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.74 2jw2 h ASP 42 CO -0.43 0.72 0.00 -1.54 -3.12 0.00 0.00 179.24 174.87 2jw2 n SER 43 N -3.50 -1.90 -2.61 6.45 3.41 0.74 -5.00 113.62 111.21 2jw2 n SER 43 Ca -0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 2jw2 n SER 43 Cb 0.75 -0.47 0.03 0.00 -0.26 0.00 0.00 64.21 64.26 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 -0.49 2.04 -0.02 4.33 6.02 -0.52 -4.88 117.38 123.86 2jw2 n GLN 44 Ca 0.00 -3.65 -0.18 0.00 -0.01 0.00 0.00 57.00 53.16 2jw2 n GLN 44 Cb 0.47 -1.67 -0.08 0.00 1.02 0.00 0.00 30.24 29.98 2jw2 n GLN 44 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2jw2 h PHE 45 N 2.67 0.99 -2.56 1.08 -1.00 -1.90 -3.43 116.94 112.78 2jw2 h PHE 45 Ca 0.01 -0.45 -0.56 0.00 2.81 0.00 0.00 57.97 59.77 2jw2 h PHE 45 Cb 1.24 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 40.64 2jw2 h PHE 45 CO 0.59 1.28 1.22 -2.14 -1.61 0.00 0.00 178.31 177.65 2jw2 s PRO 46 N -3.66 3.71 0.20 1.51 0.02 -1.26 -4.73 135.00 130.79 2jw2 s PRO 46 Ca -0.11 1.87 -0.21 0.00 0.02 0.00 0.00 61.00 62.56 2jw2 s PRO 46 Cb 0.08 -4.12 0.07 0.00 0.02 0.00 0.00 34.50 30.55 2jw2 s PRO 46 CO 0.89 -1.41 1.02 0.96 -0.33 0.00 0.00 177.00 178.13 2jw2 s ILE 47 N 5.72 0.00 -0.86 2.83 -4.36 -1.26 -5.06 121.20 118.21 2jw2 s ILE 47 Ca 0.80 -0.62 -0.24 0.00 -0.26 0.00 0.00 60.65 60.33 2jw2 s ILE 47 Cb -0.29 -2.92 -0.18 0.00 1.25 0.00 0.00 42.46 40.32 2jw2 s ILE 47 CO 0.32 0.00 2.27 -0.46 0.24 0.00 0.00 174.94 177.31 2jw2 n ASN 48 N -1.26 1.26 0.12 4.36 0.23 -1.26 -4.77 115.26 113.93 2jw2 n ASN 48 Ca -0.03 -1.67 -0.11 0.00 -0.53 0.00 0.00 54.58 52.24 2jw2 n ASN 48 Cb 0.59 -1.55 -0.06 0.00 -2.08 0.00 0.00 39.78 36.68 2jw2 n ASN 48 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 2jw2 h ILE 49 N 7.36 0.00 -0.86 1.53 2.04 -1.97 -2.17 117.51 123.44 2jw2 h ILE 49 Ca 0.00 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.13 2jw2 h ILE 49 Cb 1.01 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.93 2jw2 h ILE 49 CO 1.06 0.00 0.12 0.52 0.00 0.00 0.00 178.15 179.85 2jw2 n VAL 50 N -4.34 -0.36 0.21 1.67 0.31 -1.26 0.20 118.33 114.76 2jw2 n VAL 50 Ca -0.06 1.85 0.07 0.00 -0.01 0.00 0.00 64.34 66.18 2jw2 n VAL 50 Cb 0.27 -2.77 0.57 0.00 -0.91 0.00 0.00 33.84 31.00 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 1.71 1.87 0.15 3.52 0.00 -1.78 -2.96 119.26 121.78 2jw2 h ALA 51 Ca 0.57 -0.05 -0.32 0.00 0.00 0.00 0.00 54.91 55.10 2jw2 h ALA 51 Cb 1.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2jw2 h ALA 51 CO -0.77 0.10 -1.63 -0.39 0.00 0.00 0.00 179.25 176.56 2jw2 h VAL 52 N 0.08 0.95 0.00 0.00 -1.51 0.24 -3.20 116.25 112.80 2jw2 h VAL 52 Ca 0.02 -2.45 0.00 0.00 -1.23 0.00 0.00 66.70 63.04 2jw2 h VAL 52 Cb 0.09 2.73 0.00 0.00 -2.13 0.00 0.00 31.29 31.98 2jw2 h VAL 52 CO 0.00 0.80 0.52 0.11 -1.23 0.00 0.00 177.57 177.78 2jw2 h LYS 53 N -0.07 0.00 0.09 5.19 1.57 -1.06 2.32 116.57 124.61 2jw2 h LYS 53 Ca -0.33 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.13 2jw2 h LYS 53 Cb 1.96 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.25 2jw2 h LYS 53 CO 0.12 0.00 -1.69 -0.91 -0.57 0.00 0.00 179.45 176.40 2jw2 h ASN 54 N 0.00 0.29 0.58 0.86 -0.26 -1.61 -3.36 115.58 112.09 2jw2 h ASN 54 Ca 0.00 -0.81 0.00 0.00 -0.56 0.00 0.00 56.30 54.93 2jw2 h ASN 54 Cb 1.05 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 38.21 2jw2 h ASN 54 CO 0.00 1.72 -0.19 -0.90 -1.06 0.00 0.00 177.43 177.00 2jw2 n ASP 55 N -3.83 0.36 -0.36 5.81 5.75 0.19 -3.96 116.55 120.51 2jw2 n ASP 55 Ca -0.31 -0.18 0.26 0.00 -0.01 0.00 0.00 54.79 54.55 2jw2 n ASP 55 Cb 0.92 -0.10 0.51 0.00 -1.03 0.00 0.00 41.12 41.42 2jw2 n ASP 55 CO 0.00 0.00 0.00 1.12 -0.11 0.00 0.00 177.20 178.21 2jw2 h HIS 56 N 0.26 0.76 0.00 2.11 2.07 0.34 -3.44 115.15 117.25 2jw2 h HIS 56 Ca 0.00 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 2jw2 h HIS 56 Cb 0.44 -0.21 0.00 0.00 2.57 0.00 0.00 27.41 30.22 2jw2 h HIS 56 CO 0.00 -0.07 0.00 -0.25 -3.07 0.00 0.00 177.93 174.54 2jw2 n ASP 57 N -4.81 0.00 -0.99 3.10 9.92 -1.26 -4.99 116.55 117.53 2jw2 n ASP 57 Ca 0.30 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.56 2jw2 n ASP 57 Cb 1.02 0.01 -0.01 0.00 -0.64 0.00 0.00 41.12 41.51 2jw2 n ASP 57 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 2jw2 n PHE 58 N -0.75 0.00 -2.56 1.24 3.72 -1.26 -5.09 117.46 112.76 2jw2 n PHE 58 Ca 0.00 -0.29 -0.03 0.00 -0.05 0.00 0.00 57.45 57.08 2jw2 n PHE 58 Cb 0.00 0.06 -0.02 0.00 -0.94 0.00 0.00 39.48 38.57 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 0.20 -5.37 -3.89 4.37 7.94 -1.25 -4.96 117.00 114.04 2jw2 n LEU 59 Ca -0.03 2.10 -0.29 0.00 -1.11 0.00 0.00 56.01 56.68 2jw2 n LEU 59 Cb 0.85 -2.79 -0.13 0.00 0.53 0.00 0.00 43.42 41.88 2jw2 n LEU 59 CO -0.04 -3.29 -0.13 -1.61 -1.11 0.00 0.00 177.39 171.21 2jw2 s GLU 60 N -0.46 2.08 0.41 1.96 2.02 -1.26 -4.95 118.70 118.49 2jw2 s GLU 60 Ca -0.13 -2.85 0.34 0.00 0.02 0.00 0.00 54.97 52.35 2jw2 s GLU 60 Cb 0.01 -3.21 1.15 0.00 0.10 0.00 0.00 34.13 32.18 2jw2 s GLU 60 CO 0.36 -1.19 1.09 1.63 0.02 0.00 0.00 175.26 177.17 2jw2 n LYS 61 N 2.68 0.00 -0.07 1.61 4.76 -1.26 0.28 118.16 126.16 2jw2 n LYS 61 Ca 0.12 0.78 -0.18 0.00 -2.87 0.00 0.00 58.31 56.16 2jw2 n LYS 61 Cb 0.34 -1.82 -0.13 0.00 -1.84 0.00 0.00 35.03 31.59 2jw2 n LYS 61 CO 0.00 0.00 0.00 0.22 -1.37 0.00 0.00 177.40 176.25 2jw2 h ASP 62 N 0.00 0.05 -0.01 4.39 3.58 -2.02 -3.29 116.42 119.12 2jw2 h ASP 62 Ca 0.63 -0.79 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2jw2 h ASP 62 Cb 2.64 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 43.67 2jw2 h ASP 62 CO -0.01 1.27 0.00 0.18 -2.88 0.00 0.00 179.24 177.80 2jw2 n LEU 63 N -4.46 0.89 0.02 2.28 4.77 0.47 -3.49 117.00 117.48 2jw2 n LEU 63 Ca -0.20 -0.30 -0.04 0.00 -0.03 0.00 0.00 56.01 55.44 2jw2 n LEU 63 Cb 0.61 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.60 2jw2 n LEU 63 CO 0.29 0.15 -0.34 0.58 -1.33 0.00 0.00 177.39 176.74 2jw2 h VAL 64 N 1.38 0.70 0.53 4.08 2.07 0.40 -3.29 116.25 122.13 2jw2 h VAL 64 Ca 0.00 -2.34 -0.02 0.00 0.82 0.00 0.00 66.70 65.15 2jw2 h VAL 64 Cb 0.29 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 2jw2 h VAL 64 CO 0.00 0.40 -0.30 -0.33 0.02 0.00 0.00 177.57 177.36 2jw2 h GLU 65 N 0.00 -0.74 -0.94 1.57 3.07 -1.62 -1.73 114.58 114.19 2jw2 h GLU 65 Ca -0.20 0.05 0.10 0.00 -0.50 0.00 0.00 59.36 58.81 2jw2 h GLU 65 Cb 1.76 0.17 -0.08 0.00 -0.84 0.00 0.00 28.75 29.76 2jw2 h GLU 65 CO 0.06 -0.49 0.58 -1.00 -1.40 0.00 0.00 179.01 176.76 2jw2 h PRO 66 N -0.77 0.94 -0.62 2.33 0.13 -1.77 -1.74 132.00 130.51 2jw2 h PRO 66 Ca -0.07 -0.06 0.11 0.00 -0.87 0.00 0.00 66.00 65.11 2jw2 h PRO 66 Cb 0.60 -0.21 -0.08 0.00 0.13 0.00 0.00 31.00 31.44 2jw2 h PRO 66 CO 0.09 0.62 0.19 1.25 -0.23 0.00 0.00 178.00 179.93 2jw2 h LEU 67 N 0.97 0.14 -1.34 1.56 5.85 -1.59 0.51 115.31 121.41 2jw2 h LEU 67 Ca 0.45 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.26 2jw2 h LEU 67 Cb 0.36 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2jw2 h LEU 67 CO -0.23 0.08 0.00 0.00 -0.34 0.00 0.00 178.44 177.94 2jw2 h ARG 69 N 0.00 0.18 0.65 0.00 2.43 0.35 -2.71 114.38 115.27 2jw2 h ARG 69 Ca 0.00 -0.24 -0.03 0.00 -0.81 0.00 0.00 59.98 58.89 2jw2 h ARG 69 Cb 0.43 0.08 0.01 0.00 -0.42 0.00 0.00 29.97 30.07 2jw2 h ARG 69 CO 0.00 1.04 -0.31 0.00 -1.51 0.00 0.00 179.97 179.19 2jw2 h ARG 70 N -0.57 -0.84 -0.68 0.20 2.47 -0.91 -2.36 114.38 111.70 2jw2 h ARG 70 Ca -0.06 0.06 0.15 0.00 -1.26 0.00 0.00 59.98 58.87 2jw2 h ARG 70 Cb 1.20 0.19 -0.11 0.00 -1.65 0.00 0.00 29.97 29.60 2jw2 h ARG 70 CO 0.07 -0.56 0.04 -0.07 0.56 0.00 0.00 179.97 180.01 2jw2 h LEU 71 N -1.18 -0.23 -1.18 3.04 3.38 -1.58 0.45 115.31 118.01 2jw2 h LEU 71 Ca -0.09 0.16 0.16 0.00 0.09 0.00 0.00 57.88 58.20 2jw2 h LEU 71 Cb 0.67 0.27 -0.08 0.00 0.09 0.00 0.00 40.66 41.61 2jw2 h LEU 71 CO 0.15 -0.11 0.60 -1.13 0.09 0.00 0.00 178.44 178.03 2jw2 h ASN 72 N 0.14 0.73 0.21 -0.43 -1.24 -1.48 0.42 115.58 113.94 2jw2 h ASN 72 Ca 0.36 0.06 -0.01 0.00 0.71 0.00 0.00 56.30 57.42 2jw2 h ASN 72 Cb 0.61 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.58 2jw2 h ASN 72 CO -0.56 0.34 -0.10 0.74 -1.29 0.00 0.00 177.43 176.56 2jw2 h THR 73 N 0.76 0.00 -1.04 -3.57 2.02 0.35 -3.08 112.91 108.35 2jw2 h THR 73 Ca 0.49 -0.40 0.27 0.00 0.77 0.00 0.00 66.41 67.55 2jw2 h THR 73 Cb 0.75 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.05 2jw2 h THR 73 CO -0.26 0.00 0.64 -0.07 0.37 0.00 0.00 175.52 176.20 2jw2 h LEU 74 N -0.68 0.55 -2.24 2.58 3.38 -0.74 1.37 115.31 119.53 2jw2 h LEU 74 Ca -0.03 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jw2 h LEU 74 Cb 0.21 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2jw2 h LEU 74 CO 0.05 0.06 -0.01 0.78 0.09 0.00 0.00 178.44 179.41 2jw2 h ASN 75 N 0.46 0.00 0.13 -0.43 4.21 -0.22 1.52 115.58 121.25 2jw2 h ASN 75 Ca 0.65 0.00 -0.35 0.00 1.21 0.00 0.00 56.30 57.81 2jw2 h ASN 75 Cb 1.46 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.65 2jw2 h ASN 75 CO -0.42 0.01 -1.85 0.11 -1.29 0.00 0.00 177.43 173.99 2jw2 h LYS 76 N 0.00 0.28 0.00 0.81 1.79 0.18 -3.36 116.57 116.27 2jw2 h LYS 76 Ca -0.00 -0.48 -0.04 0.00 -2.18 0.00 0.00 60.65 57.95 2jw2 h LYS 76 Cb 0.01 0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 2jw2 h LYS 76 CO 0.00 1.23 -0.17 0.00 -1.08 0.00 0.00 179.45 179.43 2jw2 h ALA 78 N 1.83 1.00 0.15 0.00 0.00 0.20 -1.46 119.26 120.97 2jw2 h ALA 78 Ca -0.00 -0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 2jw2 h ALA 78 Cb 1.02 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2jw2 h ALA 78 CO 0.02 0.00 -1.66 0.77 0.00 0.00 0.00 179.25 178.38 2jw2 h SER 79 N 0.00 0.48 -3.43 0.00 0.02 -1.73 -3.47 113.55 105.43 2jw2 h SER 79 Ca -0.00 -0.72 -0.21 0.00 -0.84 0.00 0.00 61.79 60.02 2jw2 h SER 79 Cb 0.03 -0.16 -0.30 0.00 0.14 0.00 0.00 62.40 62.11 2jw2 h SER 79 CO 0.00 1.61 -0.52 -0.04 -1.14 0.00 0.00 176.83 176.73 2jw2 s MET 80 N -2.60 0.17 0.00 3.45 -1.94 -0.55 -5.18 119.30 112.65 2jw2 s MET 80 Ca -0.13 0.45 0.32 0.00 -1.71 0.00 0.00 55.69 54.62 2jw2 s MET 80 Cb 0.06 -0.12 1.87 0.00 2.01 0.00 0.00 34.83 38.65 2jw2 s MET 80 CO 0.85 -0.15 2.21 1.17 -0.01 0.00 0.00 175.02 179.09