#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jww n MET 2 N 0.00 -2.56 -0.05 -1.46 0.00 -1.26 -4.79 117.12 107.00 2jww n MET 2 Ca 0.00 0.62 -0.05 0.00 0.00 0.00 0.00 57.70 58.27 2jww n MET 2 Cb 0.00 -4.90 -0.15 0.00 0.00 0.00 0.00 33.22 28.17 2jww n MET 2 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2jww n THR 3 N -3.94 1.20 0.25 1.12 -2.24 -1.26 -2.69 114.28 106.71 2jww n THR 3 Ca -0.15 -0.77 0.09 0.00 -2.27 0.00 0.00 64.05 60.95 2jww n THR 3 Cb 0.62 -0.54 0.63 0.00 -2.10 0.00 0.00 70.33 68.95 2jww n THR 3 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2jww h ASP 4 N 0.00 0.00 0.00 3.42 5.19 -1.99 -3.25 116.42 119.79 2jww h ASP 4 Ca -0.37 0.00 -0.38 0.00 -0.62 0.00 0.00 57.03 55.66 2jww h ASP 4 Cb 1.93 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 41.38 2jww h ASP 4 CO 0.04 0.14 -2.32 0.18 -3.12 0.00 0.00 179.24 174.15 2jww n LEU 5 N -4.03 2.18 -4.81 1.55 4.77 -1.26 -4.97 117.00 110.43 2jww n LEU 5 Ca -0.02 0.14 -0.37 0.00 -0.03 0.00 0.00 56.01 55.72 2jww n LEU 5 Cb 0.22 -0.74 -0.06 0.00 -2.33 0.00 0.00 43.42 40.51 2jww n LEU 5 CO 0.33 0.65 0.38 -0.76 -1.33 0.00 0.00 177.39 176.66 2jww s LEU 6 N -6.93 4.42 -0.29 2.23 1.43 -1.10 -4.85 118.68 113.59 2jww s LEU 6 Ca -0.32 1.39 -0.33 0.00 -1.03 0.00 0.00 54.13 53.84 2jww s LEU 6 Cb 0.11 -3.38 -0.09 0.00 0.03 0.00 0.00 46.19 42.85 2jww s LEU 6 CO 0.46 0.11 2.17 -1.20 0.23 0.00 0.00 176.35 178.13 2jww n SER 7 N 1.05 2.57 -0.14 2.29 7.64 -1.25 -4.43 113.62 121.35 2jww n SER 7 Ca -0.05 0.39 0.00 0.00 1.01 0.00 0.00 58.87 60.23 2jww n SER 7 Cb 0.51 -1.36 0.27 0.00 -1.01 0.00 0.00 64.21 62.62 2jww n SER 7 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jww h ALA 8 N 12.93 1.44 -0.06 -0.43 0.00 -1.90 -2.22 119.26 129.02 2jww h ALA 8 Ca -0.33 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 2jww h ALA 8 Cb 1.29 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 2jww h ALA 8 CO 1.00 0.46 -0.08 1.05 0.00 0.00 0.00 179.25 181.68 2jww h GLU 9 N 0.84 0.16 -0.07 0.00 4.11 -1.92 -2.50 114.58 115.21 2jww h GLU 9 Ca 0.21 -0.09 0.04 0.00 0.07 0.00 0.00 59.36 59.59 2jww h GLU 9 Cb 0.03 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 2jww h GLU 9 CO -0.03 0.63 -0.19 -0.44 0.07 0.00 0.00 179.01 179.05 2jww h ASP 10 N -0.29 -0.56 0.13 3.06 5.19 -1.73 0.39 116.42 122.61 2jww h ASP 10 Ca 0.01 0.09 0.01 0.00 -0.62 0.00 0.00 57.03 56.52 2jww h ASP 10 Cb 0.61 0.25 -0.03 0.00 0.18 0.00 0.00 39.33 40.34 2jww h ASP 10 CO 0.02 -0.24 -0.22 0.40 -3.12 0.00 0.00 179.24 176.07 2jww h ILE 11 N -0.27 0.50 -0.24 0.35 2.04 -0.68 0.34 117.51 119.56 2jww h ILE 11 Ca 0.08 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.90 2jww h ILE 11 Cb 0.38 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2jww h ILE 11 CO -0.22 0.00 -0.01 0.07 0.00 0.00 0.00 178.15 177.98 2jww h LYS 12 N -0.43 0.36 0.25 2.37 2.10 -1.23 0.86 116.57 120.85 2jww h LYS 12 Ca 0.02 -0.06 -0.01 0.00 -2.00 0.00 0.00 60.65 58.60 2jww h LYS 12 Cb 0.44 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 2jww h LYS 12 CO -0.11 0.40 -0.12 0.87 -2.00 0.00 0.00 179.45 178.49 2jww h LYS 13 N 0.35 -0.32 -0.14 0.07 1.57 0.57 -2.06 116.57 116.61 2jww h LYS 13 Ca 0.08 0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.80 2jww h LYS 13 Cb 0.26 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 2jww h LYS 13 CO 0.01 0.01 -0.23 0.00 -0.57 0.00 0.00 179.45 178.67 2jww h ALA 14 N -0.07 0.22 -0.26 3.86 0.00 -0.18 -0.55 119.26 122.27 2jww h ALA 14 Ca -0.03 -0.38 0.03 0.00 0.00 0.00 0.00 54.91 54.53 2jww h ALA 14 Cb 0.48 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2jww h ALA 14 CO 0.06 0.18 0.08 0.82 0.00 0.00 0.00 179.25 180.39 2jww h ILE 15 N 0.02 0.92 0.00 0.00 2.04 0.67 0.43 117.51 121.58 2jww h ILE 15 Ca 0.01 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2jww h ILE 15 Cb 0.81 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2jww h ILE 15 CO 0.05 0.04 -0.01 1.23 0.00 0.00 0.00 178.15 179.46 2jww h GLY 16 N 0.20 0.00 -0.41 5.37 0.00 -1.44 -3.21 103.07 103.58 2jww h GLY 16 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2jww h GLY 16 CO -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 176.54 176.04 2jww n ALA 17 N -2.08 3.33 -3.97 3.60 0.00 -0.22 -4.76 120.51 116.43 2jww n ALA 17 Ca 0.04 -0.53 -0.31 0.00 0.00 0.00 0.00 53.44 52.64 2jww n ALA 17 Cb 0.52 -0.96 -0.14 0.00 0.00 0.00 0.00 19.45 18.87 2jww n ALA 17 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2jww s PHE 18 N -2.49 3.54 -0.21 0.00 0.08 0.15 -4.91 117.98 114.14 2jww s PHE 18 Ca 0.21 -3.01 -0.18 0.00 0.12 0.00 0.00 56.93 54.07 2jww s PHE 18 Cb 0.19 -2.93 -0.19 0.00 -0.57 0.00 0.00 43.02 39.52 2jww s PHE 18 CO 0.55 -0.88 0.15 0.25 -0.10 0.00 0.00 175.22 175.19 2jww n THR 19 N 3.85 1.56 -0.13 0.64 -2.24 -1.26 -4.52 114.28 112.18 2jww n THR 19 Ca 0.04 -0.16 -0.23 0.00 -2.27 0.00 0.00 64.05 61.44 2jww n THR 19 Cb 0.38 -1.97 -0.11 0.00 -2.10 0.00 0.00 70.33 66.53 2jww n THR 19 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jww n ALA 20 N -3.48 1.33 -0.11 6.98 0.00 -1.26 -4.05 120.51 119.93 2jww n ALA 20 Ca -0.35 -1.10 -0.03 0.00 0.00 0.00 0.00 53.44 51.96 2jww n ALA 20 Cb 0.76 -0.02 -0.03 0.00 0.00 0.00 0.00 19.45 20.16 2jww n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jww n ALA 21 N -3.63 -0.16 0.24 0.00 0.00 -1.26 0.29 120.51 115.99 2jww n ALA 21 Ca -0.49 0.21 0.13 0.00 0.00 0.00 0.00 53.44 53.29 2jww n ALA 21 Cb 0.95 0.32 0.50 0.00 0.00 0.00 0.00 19.45 21.23 2jww n ALA 21 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2jww h ASP 22 N 0.00 0.00 -0.74 0.00 3.04 -1.80 -2.52 116.42 114.40 2jww h ASP 22 Ca 0.04 0.00 0.15 0.00 -3.24 0.00 0.00 57.03 53.98 2jww h ASP 22 Cb 0.10 0.00 -0.10 0.00 -1.04 0.00 0.00 39.33 38.29 2jww h ASP 22 CO -0.24 0.11 0.25 -1.28 -2.04 0.00 0.00 179.24 176.05 2jww h SER 23 N 0.00 0.17 0.17 4.15 0.87 -0.30 -2.77 113.55 115.84 2jww h SER 23 Ca -0.00 0.12 -0.35 0.00 -1.23 0.00 0.00 61.79 60.33 2jww h SER 23 Cb 0.70 0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 62.73 2jww h SER 23 CO 0.01 0.05 -2.15 2.22 -0.53 0.00 0.00 176.83 176.43 2jww n PHE 24 N -5.06 0.43 -3.37 2.24 1.16 -0.66 -4.22 117.46 107.97 2jww n PHE 24 Ca 0.14 0.14 -0.16 0.00 -1.87 0.00 0.00 57.45 55.70 2jww n PHE 24 Cb 0.43 -1.07 -0.08 0.00 -1.61 0.00 0.00 39.48 37.14 2jww n PHE 24 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2jww s ASP 25 N -5.93 1.35 0.50 5.98 1.01 -0.96 -3.54 116.67 115.08 2jww s ASP 25 Ca -0.12 -1.10 0.31 0.00 0.71 0.00 0.00 52.55 52.36 2jww s ASP 25 Cb 0.07 0.58 1.24 0.00 1.01 0.00 0.00 42.92 45.82 2jww s ASP 25 CO 0.80 -0.33 1.92 -0.74 0.21 0.00 0.00 175.17 177.03 2jww h HIS 26 N 7.72 0.00 -0.61 4.23 -0.00 -1.73 -3.26 115.15 121.50 2jww h HIS 26 Ca -0.05 0.00 0.11 0.00 -0.00 0.00 0.00 60.37 60.43 2jww h HIS 26 Cb 1.07 0.00 -0.12 0.00 -0.00 0.00 0.00 27.41 28.36 2jww h HIS 26 CO 0.30 0.00 -0.31 0.87 -0.00 0.00 0.00 177.93 178.79 2jww h LYS 27 N 0.00 -0.13 -0.68 5.26 1.79 -1.92 1.63 116.57 122.51 2jww h LYS 27 Ca 0.00 0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.49 2jww h LYS 27 Cb 0.52 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 31.17 2jww h LYS 27 CO 0.00 -0.09 0.45 -0.22 -1.08 0.00 0.00 179.45 178.51 2jww h LYS 28 N -0.14 0.90 -0.02 3.15 1.63 -1.93 0.10 116.57 120.27 2jww h LYS 28 Ca 0.25 -0.06 0.01 0.00 -0.85 0.00 0.00 60.65 60.00 2jww h LYS 28 Cb 0.55 -0.20 -0.00 0.00 -0.60 0.00 0.00 32.23 31.97 2jww h LYS 28 CO -0.69 0.60 0.02 0.35 -3.45 0.00 0.00 179.45 176.28 2jww h PHE 29 N 0.93 0.00 0.00 1.91 3.57 0.25 0.17 116.94 123.77 2jww h PHE 29 Ca 0.25 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.73 2jww h PHE 29 Cb -0.11 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.63 2jww h PHE 29 CO -0.03 0.00 -0.11 0.35 -2.23 0.00 0.00 178.31 176.30 2jww h PHE 30 N 0.00 0.00 0.08 0.41 3.04 0.46 0.94 116.94 121.87 2jww h PHE 30 Ca 0.01 0.00 -0.23 0.00 3.98 0.00 0.00 57.97 61.73 2jww h PHE 30 Cb 0.05 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.55 2jww h PHE 30 CO 0.00 0.11 -1.16 1.96 -2.02 0.00 0.00 178.31 177.20 2jww h GLN 31 N 0.00 0.17 0.00 1.11 4.20 -0.56 -3.10 115.11 116.93 2jww h GLN 31 Ca -0.00 -0.30 -0.08 0.00 0.06 0.00 0.00 58.65 58.33 2jww h GLN 31 Cb 0.24 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 2jww h GLN 31 CO 0.01 1.14 -0.40 0.52 -0.67 0.00 0.00 178.83 179.44 2jww h MET 32 N -0.52 0.00 0.00 1.46 2.86 -1.10 -3.01 114.93 114.62 2jww h MET 32 Ca -0.26 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.34 2jww h MET 32 Cb 1.58 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.23 2jww h MET 32 CO 0.01 0.40 -0.17 -0.24 1.06 0.00 0.00 176.91 177.96 2jww h VAL 33 N 0.00 0.58 0.00 -2.22 3.04 0.76 -3.39 116.25 115.02 2jww h VAL 33 Ca -0.00 -0.81 0.00 0.00 -1.01 0.00 0.00 66.70 64.88 2jww h VAL 33 Cb 0.92 1.53 0.00 0.00 -2.01 0.00 0.00 31.29 31.73 2jww h VAL 33 CO 0.05 0.17 0.00 0.61 -1.01 0.00 0.00 177.57 177.39 2jww n GLY 34 N -0.33 0.74 0.19 3.17 0.00 -1.14 -1.63 105.19 106.20 2jww n GLY 34 Ca -0.01 -0.56 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 2jww n GLY 34 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jww h LEU 35 N 0.00 0.66 -0.62 0.99 -0.00 -1.78 -2.89 115.31 111.67 2jww h LEU 35 Ca 0.00 -0.45 -0.05 0.00 -0.00 0.00 0.00 57.88 57.38 2jww h LEU 35 Cb 0.07 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 40.53 2jww h LEU 35 CO 0.00 1.22 -0.24 0.11 -0.00 0.00 0.00 178.44 179.53 2jww h LYS 36 N 0.36 0.00 -0.97 1.13 1.57 -1.86 -3.27 116.57 113.53 2jww h LYS 36 Ca -0.05 0.00 0.32 0.00 -1.87 0.00 0.00 60.65 59.05 2jww h LYS 36 Cb 1.40 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 33.55 2jww h LYS 36 CO 0.15 0.24 0.42 -0.22 -0.57 0.00 0.00 179.45 179.47 2jww h LYS 37 N 0.00 0.18 0.00 3.15 3.11 -1.84 -3.40 116.57 117.77 2jww h LYS 37 Ca -0.00 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 2jww h LYS 37 Cb 0.96 -0.04 0.00 0.00 -1.00 0.00 0.00 32.23 32.15 2jww h LYS 37 CO 0.03 0.12 0.00 1.17 -2.81 0.00 0.00 179.45 177.96 2jww n LYS 38 N -5.19 3.44 -4.45 1.90 4.81 -1.23 -5.12 118.16 112.32 2jww n LYS 38 Ca 0.30 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.50 2jww n LYS 38 Cb 0.96 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.92 2jww n LYS 38 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2jww s SER 39 N -0.87 3.78 0.57 3.14 0.01 -1.26 -5.00 113.70 114.07 2jww s SER 39 Ca 0.00 -1.00 0.30 0.00 1.31 0.00 0.00 55.95 56.57 2jww s SER 39 Cb 0.00 -0.40 1.45 0.00 0.21 0.00 0.00 66.02 67.28 2jww s SER 39 CO 0.00 -0.01 1.84 0.00 0.41 0.00 0.00 173.24 175.48 2jww h ALA 40 N 2.16 2.54 0.39 1.44 0.00 -1.91 -1.52 119.26 122.37 2jww h ALA 40 Ca -0.41 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 2jww h ALA 40 Cb 1.26 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2jww h ALA 40 CO 0.62 -0.99 -0.19 -0.44 0.00 0.00 0.00 179.25 178.25 2jww h ASP 41 N 0.00 -0.45 -0.15 0.00 3.32 -1.97 0.90 116.42 118.07 2jww h ASP 41 Ca 0.34 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2jww h ASP 41 Cb 1.58 0.12 -0.01 0.00 0.22 0.00 0.00 39.33 41.23 2jww h ASP 41 CO -0.00 -0.04 0.09 0.44 -1.72 0.00 0.00 179.24 178.01 2jww h ASP 42 N -0.96 0.18 -0.59 6.45 5.19 -1.72 -2.21 116.42 122.76 2jww h ASP 42 Ca -0.05 -0.03 -0.02 0.00 -0.62 0.00 0.00 57.03 56.30 2jww h ASP 42 Cb 0.54 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.98 2jww h ASP 42 CO 0.09 0.15 0.30 -0.37 -3.12 0.00 0.00 179.24 176.29 2jww h VAL 43 N 0.18 1.20 -0.51 -1.35 -1.51 -1.41 -1.59 116.25 111.27 2jww h VAL 43 Ca 0.05 -0.56 0.15 0.00 -1.23 0.00 0.00 66.70 65.11 2jww h VAL 43 Cb 0.01 0.41 -0.02 0.00 -2.13 0.00 0.00 31.29 29.55 2jww h VAL 43 CO -0.01 0.23 0.38 0.11 -1.23 0.00 0.00 177.57 177.06 2jww h LYS 44 N 0.87 0.00 -0.88 5.19 1.57 -0.19 -1.98 116.57 121.15 2jww h LYS 44 Ca 0.22 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 59.08 2jww h LYS 44 Cb 0.08 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.32 2jww h LYS 44 CO -0.03 0.00 0.53 0.87 -0.57 0.00 0.00 179.45 180.25 2jww h LYS 45 N 0.00 0.87 -0.19 3.15 1.79 -0.97 0.39 116.57 121.62 2jww h LYS 45 Ca 0.24 -0.05 0.05 0.00 -2.18 0.00 0.00 60.65 58.71 2jww h LYS 45 Cb 1.00 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 31.45 2jww h LYS 45 CO -0.00 0.58 0.18 -0.24 -1.08 0.00 0.00 179.45 178.88 2jww h VAL 46 N 0.90 0.60 -0.77 0.50 3.04 -1.51 -1.58 116.25 117.44 2jww h VAL 46 Ca 0.41 0.00 0.17 0.00 -1.01 0.00 0.00 66.70 66.27 2jww h VAL 46 Cb 0.32 0.87 -0.11 0.00 -2.01 0.00 0.00 31.29 30.36 2jww h VAL 46 CO -0.23 0.00 0.23 0.15 -1.01 0.00 0.00 177.57 176.72 2jww h PHE 47 N 0.00 0.38 0.00 3.17 3.57 -0.33 0.67 116.94 124.39 2jww h PHE 47 Ca 0.09 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 2jww h PHE 47 Cb 0.44 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2jww h PHE 47 CO 0.00 -0.05 -0.43 1.25 -2.23 0.00 0.00 178.31 176.84 2jww h HIS 48 N 0.32 0.00 0.04 0.41 2.76 -1.39 1.66 115.15 118.95 2jww h HIS 48 Ca 0.44 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.61 2jww h HIS 48 Cb 0.75 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.71 2jww h HIS 48 CO -0.23 0.43 -0.02 0.82 -1.30 0.00 0.00 177.93 177.64 2jww h ILE 49 N 0.00 1.28 0.01 6.26 1.08 0.09 -3.21 117.51 123.02 2jww h ILE 49 Ca -0.00 -1.07 -0.27 0.00 -0.39 0.00 0.00 64.86 63.12 2jww h ILE 49 Cb 0.79 1.99 -0.04 0.00 -3.07 0.00 0.00 36.82 36.50 2jww h ILE 49 CO 0.06 0.27 -1.48 0.17 -0.69 0.00 0.00 178.15 176.47 2jww h LEU 50 N -0.53 0.04 -4.19 1.44 8.10 -0.13 -3.35 115.31 116.69 2jww h LEU 50 Ca -0.01 -0.06 -0.57 0.00 0.11 0.00 0.00 57.88 57.35 2jww h LEU 50 Cb 0.48 -0.01 -0.22 0.00 -0.44 0.00 0.00 40.66 40.47 2jww h LEU 50 CO 0.01 1.05 0.69 -0.67 -4.11 0.00 0.00 178.44 175.42 2jww n ASP 51 N -3.18 7.09 -0.02 0.17 -0.08 0.57 -4.59 116.55 116.50 2jww n ASP 51 Ca -0.12 -3.49 -0.13 0.00 -1.51 0.00 0.00 54.79 49.54 2jww n ASP 51 Cb 1.02 -1.07 -0.09 0.00 2.34 0.00 0.00 41.12 43.31 2jww n ASP 51 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 2jww h LYS 52 N 2.30 0.08 -0.01 -0.67 2.10 -1.70 -3.36 116.57 115.31 2jww h LYS 52 Ca 0.47 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 59.07 2jww h LYS 52 Cb 0.65 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 2jww h LYS 52 CO 1.19 0.57 -0.10 -0.40 -2.00 0.00 0.00 179.45 178.72 2jww n ASP 53 N -4.77 1.26 0.22 7.07 5.75 -1.26 -4.55 116.55 120.26 2jww n ASP 53 Ca -0.08 -1.13 0.14 0.00 -0.01 0.00 0.00 54.79 53.71 2jww n ASP 53 Cb 0.29 0.30 0.76 0.00 -1.03 0.00 0.00 41.12 41.44 2jww n ASP 53 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 2jww h LYS 54 N 1.08 0.00 -0.95 0.11 1.79 -1.83 -3.45 116.57 113.31 2jww h LYS 54 Ca 0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 2jww h LYS 54 Cb 0.28 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.93 2jww h LYS 54 CO 0.00 0.00 -0.07 0.45 -1.08 0.00 0.00 179.45 178.75 2jww n SER 55 N -2.49 -2.05 0.00 0.86 2.88 -1.26 -3.36 113.62 108.20 2jww n SER 55 Ca -0.02 -0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 2jww n SER 55 Cb 0.06 -1.03 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 2jww n SER 55 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jww n GLY 56 N -0.84 2.58 2.94 0.46 0.00 -1.26 -4.98 105.19 104.08 2jww n GLY 56 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 2jww n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jww s PHE 57 N -2.98 0.63 -0.26 1.61 0.40 -1.21 -4.36 117.98 111.82 2jww s PHE 57 Ca 0.00 -0.14 -0.08 0.00 -0.60 0.00 0.00 56.93 56.11 2jww s PHE 57 Cb 0.00 -0.49 -0.03 0.00 0.51 0.00 0.00 43.02 43.01 2jww s PHE 57 CO 0.00 -0.08 0.10 0.42 0.70 0.00 0.00 175.22 176.36 2jww s ILE 58 N 0.31 4.57 -0.16 0.64 1.01 -1.24 -4.67 121.20 121.67 2jww s ILE 58 Ca -0.04 -0.08 -0.07 0.00 0.00 0.00 0.00 60.65 60.46 2jww s ILE 58 Cb -0.08 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.20 2jww s ILE 58 CO -0.00 0.32 0.07 -1.61 0.00 0.00 0.00 174.94 173.72 2jww s GLU 59 N 1.62 3.75 0.37 2.79 2.02 -1.26 -2.58 118.70 125.40 2jww s GLU 59 Ca 0.06 -0.31 0.32 0.00 0.02 0.00 0.00 54.97 55.06 2jww s GLU 59 Cb -0.15 -3.15 1.19 0.00 0.10 0.00 0.00 34.13 32.12 2jww s GLU 59 CO 0.05 0.42 1.14 -0.85 0.02 0.00 0.00 175.26 176.04 2jww n GLU 60 N 3.06 -0.01 0.06 1.61 0.28 -1.24 0.17 120.64 124.58 2jww n GLU 60 Ca -0.17 0.84 -0.13 0.00 -0.16 0.00 0.00 57.16 57.54 2jww n GLU 60 Cb 0.53 -1.82 -0.08 0.00 1.43 0.00 0.00 31.44 31.50 2jww n GLU 60 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 2jww h ASP 61 N 0.00 -0.11 1.11 -1.84 5.19 -1.93 -3.10 116.42 115.74 2jww h ASP 61 Ca 0.67 -0.23 -0.04 0.00 -0.62 0.00 0.00 57.03 56.81 2jww h ASP 61 Cb 2.48 0.03 -0.01 0.00 0.18 0.00 0.00 39.33 42.01 2jww h ASP 61 CO -0.14 0.17 -0.91 -0.33 -3.12 0.00 0.00 179.24 174.90 2jww h GLU 62 N -0.40 0.00 -0.54 3.56 5.08 0.70 -3.36 114.58 119.61 2jww h GLU 62 Ca -0.01 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.45 2jww h GLU 62 Cb 0.34 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.50 2jww h GLU 62 CO 0.02 0.08 -0.00 1.25 -1.00 0.00 0.00 179.01 179.36 2jww h LEU 63 N 0.00 -0.24 -1.65 1.33 7.12 0.18 0.90 115.31 122.95 2jww h LEU 63 Ca -0.03 0.13 -0.04 0.00 0.13 0.00 0.00 57.88 58.07 2jww h LEU 63 Cb 1.13 0.23 -0.01 0.00 -0.53 0.00 0.00 40.66 41.49 2jww h LEU 63 CO 0.01 -0.09 -0.19 1.23 -0.13 0.00 0.00 178.44 179.27 2jww h GLY 64 N 0.11 0.00 0.00 3.75 0.00 -1.69 -1.22 103.07 104.02 2jww h GLY 64 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2jww h GLY 64 CO -0.46 0.00 -0.04 0.23 0.00 0.00 0.00 176.54 176.27 2jww h SER 65 N 0.00 0.00 -0.23 0.19 0.87 -0.86 -3.31 113.55 110.21 2jww h SER 65 Ca -0.00 0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.63 2jww h SER 65 Cb 0.45 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 2jww h SER 65 CO 0.03 0.50 0.48 -0.29 -0.53 0.00 0.00 176.83 177.01 2jww h ILE 66 N -0.96 0.16 -0.70 2.23 6.09 0.67 -2.31 117.51 122.68 2jww h ILE 66 Ca 0.00 0.00 0.14 0.00 -1.37 0.00 0.00 64.86 63.63 2jww h ILE 66 Cb 0.04 0.58 -0.13 0.00 0.47 0.00 0.00 36.82 37.78 2jww h ILE 66 CO 0.00 0.00 -0.15 -0.07 -3.07 0.00 0.00 178.15 174.86 2jww h LEU 67 N 0.00 -0.60 -0.48 2.19 -0.00 -1.31 0.15 115.31 115.26 2jww h LEU 67 Ca 0.11 0.21 0.00 0.00 -0.00 0.00 0.00 57.88 58.20 2jww h LEU 67 Cb 1.06 0.42 0.00 0.00 -0.00 0.00 0.00 40.66 42.14 2jww h LEU 67 CO -0.00 -0.22 0.31 2.29 -0.00 0.00 0.00 178.44 180.81 2jww n LYS 68 N -5.45 0.05 -0.20 1.13 -0.00 -0.87 -1.97 118.16 110.85 2jww n LYS 68 Ca 0.10 0.45 -0.01 0.00 -0.00 0.00 0.00 58.31 58.84 2jww n LYS 68 Cb 0.37 -1.97 0.06 0.00 -0.00 0.00 0.00 35.03 33.49 2jww n LYS 68 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2jww h GLY 69 N 0.00 0.43 0.05 2.58 0.00 -1.19 1.28 103.07 106.22 2jww h GLY 69 Ca 0.00 0.20 -0.41 0.00 0.00 0.00 0.00 47.33 47.12 2jww h GLY 69 CO 0.00 -0.23 -2.35 1.97 0.00 0.00 0.00 176.54 175.93 2jww n PHE 70 N -5.42 0.21 1.10 5.60 -1.74 -0.83 -3.48 117.46 112.90 2jww n PHE 70 Ca 0.07 0.07 0.07 0.00 -0.56 0.00 0.00 57.45 57.10 2jww n PHE 70 Cb 0.32 -1.02 0.41 0.00 1.52 0.00 0.00 39.48 40.71 2jww n PHE 70 CO 0.00 0.00 0.00 0.43 -0.56 0.00 0.00 176.76 176.63 2jww n SER 71 N -3.89 0.00 -0.12 5.98 7.64 -0.88 -4.05 113.62 118.30 2jww n SER 71 Ca -0.48 -0.67 0.26 0.00 1.01 0.00 0.00 58.87 58.99 2jww n SER 71 Cb 0.91 0.00 0.57 0.00 -1.01 0.00 0.00 64.21 64.68 2jww n SER 71 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2jww h SER 72 N 0.00 0.00 -0.88 6.43 4.64 0.15 1.48 113.55 125.37 2jww h SER 72 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2jww h SER 72 Cb 0.00 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.81 2jww h SER 72 CO 0.00 0.00 0.51 0.47 -0.87 0.00 0.00 176.83 176.94 2jww n ASP 73 N -3.44 5.15 0.00 4.97 8.00 -1.26 -4.97 116.55 125.01 2jww n ASP 73 Ca 0.18 -3.72 0.00 0.00 0.71 0.00 0.00 54.79 51.96 2jww n ASP 73 Cb 1.21 -0.82 0.00 0.00 -0.02 0.00 0.00 41.12 41.48 2jww n ASP 73 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jww n ALA 74 N -1.02 0.00 -1.62 2.24 0.00 0.51 -3.99 120.51 116.63 2jww n ALA 74 Ca 0.56 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.94 2jww n ALA 74 Cb 1.14 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.63 2jww n ALA 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jww n ARG 75 N 0.00 -0.06 -0.67 0.00 5.12 -1.26 -4.96 116.66 114.83 2jww n ARG 75 Ca 0.00 -0.57 0.00 0.00 -1.93 0.00 0.00 57.85 55.35 2jww n ARG 75 Cb 0.00 -0.28 0.00 0.00 -1.16 0.00 0.00 32.46 31.02 2jww n ARG 75 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 2jww n ASP 76 N -3.13 1.95 -4.69 0.55 5.68 -1.26 -4.76 116.55 110.90 2jww n ASP 76 Ca 0.04 -0.34 -0.37 0.00 -0.50 0.00 0.00 54.79 53.62 2jww n ASP 76 Cb 0.15 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.05 2jww n ASP 76 CO 0.00 0.00 0.00 -1.48 -1.33 0.00 0.00 177.20 174.39 2jww s LEU 77 N 0.00 4.18 0.00 -2.12 2.34 -1.26 -4.66 118.68 117.16 2jww s LEU 77 Ca 0.00 0.42 0.00 0.00 0.06 0.00 0.00 54.13 54.61 2jww s LEU 77 Cb 0.00 -2.36 0.00 0.00 -0.56 0.00 0.00 46.19 43.27 2jww s LEU 77 CO 0.00 0.03 0.00 -0.24 -1.06 0.00 0.00 176.35 175.08 2jww n SER 78 N 4.07 0.59 -0.16 1.48 2.88 -1.26 -4.53 113.62 116.68 2jww n SER 78 Ca -0.11 -0.99 -0.03 0.00 -1.33 0.00 0.00 58.87 56.40 2jww n SER 78 Cb 0.52 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.01 2jww n SER 78 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jww h ALA 79 N 0.64 0.23 -0.67 -1.46 0.00 -1.96 1.37 119.26 117.40 2jww h ALA 79 Ca 0.00 0.19 0.07 0.00 0.00 0.00 0.00 54.91 55.17 2jww h ALA 79 Cb 0.00 0.49 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 2jww h ALA 79 CO 0.00 -0.51 0.35 0.87 0.00 0.00 0.00 179.25 179.96 2jww h LYS 80 N -0.07 0.60 0.00 0.00 1.57 -1.92 -0.71 116.57 116.05 2jww h LYS 80 Ca 0.24 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.87 2jww h LYS 80 Cb 0.44 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2jww h LYS 80 CO -0.56 0.40 -0.55 0.93 -0.57 0.00 0.00 179.45 179.09 2jww h GLU 81 N 0.62 0.00 -0.08 3.15 5.08 -1.02 1.50 114.58 123.83 2jww h GLU 81 Ca 0.32 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 2jww h GLU 81 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2jww h GLU 81 CO -0.22 0.55 0.03 1.15 -1.00 0.00 0.00 179.01 179.52 2jww h THR 82 N 0.00 1.16 -0.00 1.13 2.02 0.29 1.90 112.91 119.40 2jww h THR 82 Ca -0.01 -0.47 -0.19 0.00 0.77 0.00 0.00 66.41 66.51 2jww h THR 82 Cb 1.19 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 2jww h THR 82 CO 0.07 0.13 -0.86 0.11 0.37 0.00 0.00 175.52 175.35 2jww h LYS 83 N -0.04 0.18 0.00 6.66 1.79 -1.10 -1.71 116.57 122.36 2jww h LYS 83 Ca 0.03 -0.20 -0.04 0.00 -2.18 0.00 0.00 60.65 58.26 2jww h LYS 83 Cb 0.19 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.89 2jww h LYS 83 CO -0.00 0.93 -0.55 1.15 -1.08 0.00 0.00 179.45 179.90 2jww h THR 84 N 0.10 0.26 0.01 -0.16 2.02 0.23 -3.31 112.91 112.06 2jww h THR 84 Ca -0.04 -1.29 -0.00 0.00 0.77 0.00 0.00 66.41 65.85 2jww h THR 84 Cb 1.48 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 2jww h THR 84 CO 0.13 0.09 -0.00 0.25 0.37 0.00 0.00 175.52 176.35 2jww h LEU 85 N -1.00 -0.01 -0.13 2.58 5.85 0.26 -1.72 115.31 121.15 2jww h LEU 85 Ca -0.07 -0.85 -0.02 0.00 0.84 0.00 0.00 57.88 57.79 2jww h LEU 85 Cb 0.60 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 2jww h LEU 85 CO -0.04 0.87 0.01 -0.03 -0.34 0.00 0.00 178.44 178.91 2jww h MET 86 N -0.92 0.22 -0.38 1.25 4.05 -0.32 -2.58 114.93 116.25 2jww h MET 86 Ca -0.00 -0.07 -0.10 0.00 -0.28 0.00 0.00 59.70 59.25 2jww h MET 86 Cb 0.85 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.62 2jww h MET 86 CO 0.00 0.44 -0.19 0.00 0.23 0.00 0.00 176.91 177.40 2jww h ALA 87 N 0.77 0.95 0.85 0.39 0.00 -1.40 -1.67 119.26 119.15 2jww h ALA 87 Ca 0.04 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2jww h ALA 87 Cb 0.34 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.98 2jww h ALA 87 CO 0.00 0.61 -0.44 0.00 0.00 0.00 0.00 179.25 179.43 2jww h ALA 88 N 1.14 -1.30 -0.81 0.00 0.00 -1.24 0.35 119.26 117.39 2jww h ALA 88 Ca 0.10 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 54.84 2jww h ALA 88 Cb 0.67 0.50 -0.07 0.00 0.00 0.00 0.00 17.79 18.89 2jww h ALA 88 CO 0.05 -1.23 0.47 0.78 0.00 0.00 0.00 179.25 179.32 2jww h GLY 89 N -1.18 1.25 -3.79 0.00 0.00 -1.50 -1.27 103.07 96.57 2jww h GLY 89 Ca -0.12 -0.32 -0.54 0.00 0.00 0.00 0.00 47.33 46.35 2jww h GLY 89 CO 0.17 0.16 0.69 1.34 0.00 0.00 0.00 176.54 178.91 2jww n ASP 90 N -4.72 6.78 -0.41 0.19 2.03 -0.63 -3.62 116.55 116.17 2jww n ASP 90 Ca 0.13 -3.51 0.31 0.00 0.52 0.00 0.00 54.79 52.24 2jww n ASP 90 Cb 0.24 -0.98 0.47 0.00 -0.72 0.00 0.00 41.12 40.14 2jww n ASP 90 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 2jww n LYS 91 N -0.53 0.00 0.30 -0.67 -0.00 0.12 0.11 118.16 117.49 2jww n LYS 91 Ca 0.51 0.63 0.18 0.00 -0.00 0.00 0.00 58.31 59.63 2jww n LYS 91 Cb 0.74 -1.46 0.97 0.00 -0.00 0.00 0.00 35.03 35.28 2jww n LYS 91 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 2jww h ASP 92 N 0.00 0.00 -3.54 -5.58 3.32 -1.86 -3.46 116.42 105.29 2jww h ASP 92 Ca 0.54 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.56 2jww h ASP 92 Cb 2.20 0.00 0.03 0.00 0.22 0.00 0.00 39.33 41.77 2jww h ASP 92 CO -0.01 0.00 -0.11 0.61 -1.72 0.00 0.00 179.24 178.01 2jww n GLY 93 N -1.16 0.05 0.08 2.75 0.00 0.29 -5.01 105.19 102.19 2jww n GLY 93 Ca -0.02 -0.07 0.03 0.00 0.00 0.00 0.00 46.02 45.96 2jww n GLY 93 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jww n ASP 94 N -1.59 0.66 0.00 1.61 9.92 -1.26 -4.99 116.55 120.90 2jww n ASP 94 Ca -0.01 -0.83 0.00 0.00 -0.53 0.00 0.00 54.79 53.42 2jww n ASP 94 Cb 0.52 0.76 0.00 0.00 -0.64 0.00 0.00 41.12 41.75 2jww n ASP 94 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jww n GLY 95 N 0.99 1.65 3.18 0.44 0.00 -1.26 -4.99 105.19 105.20 2jww n GLY 95 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 2jww n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jww s LYS 96 N -0.37 0.70 -0.35 1.61 0.00 -1.26 -3.62 119.74 116.45 2jww s LYS 96 Ca 0.00 -0.62 -0.11 0.00 0.00 0.00 0.00 55.97 55.24 2jww s LYS 96 Cb 0.00 0.29 0.01 0.00 0.00 0.00 0.00 37.83 38.13 2jww s LYS 96 CO 0.00 -0.20 0.19 0.42 0.00 0.00 0.00 175.35 175.76 2jww s ILE 97 N -2.57 4.63 0.53 3.79 1.01 -1.07 -4.73 121.20 122.79 2jww s ILE 97 Ca -0.05 -0.68 -0.03 0.00 0.00 0.00 0.00 60.65 59.89 2jww s ILE 97 Cb -0.01 -3.50 0.11 0.00 0.01 0.00 0.00 42.46 39.07 2jww s ILE 97 CO -0.04 -0.12 0.72 0.61 0.00 0.00 0.00 174.94 176.11 2jww n GLY 98 N 5.00 0.06 0.22 6.18 0.00 -1.26 -3.61 105.19 111.79 2jww n GLY 98 Ca -0.12 -1.91 0.02 0.00 0.00 0.00 0.00 46.02 44.00 2jww n GLY 98 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2jww h VAL 99 N -0.83 1.21 0.16 1.61 3.04 -1.99 0.13 116.25 119.59 2jww h VAL 99 Ca -0.24 -1.00 -0.01 0.00 -1.01 0.00 0.00 66.70 64.45 2jww h VAL 99 Cb 0.80 1.39 0.00 0.00 -2.01 0.00 0.00 31.29 31.46 2jww h VAL 99 CO 0.22 0.30 -0.08 -0.33 -1.01 0.00 0.00 177.57 176.68 2jww h GLU 100 N 0.17 -0.20 0.00 4.17 4.39 -1.96 -3.27 114.58 117.88 2jww h GLU 100 Ca 0.03 0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.69 2jww h GLU 100 Cb 0.50 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 2jww h GLU 100 CO 0.03 0.23 -0.27 0.93 -1.16 0.00 0.00 179.01 178.77 2jww h GLU 101 N -0.83 0.00 -0.64 2.33 3.07 -1.81 -2.80 114.58 113.90 2jww h GLU 101 Ca -0.02 0.00 0.19 0.00 -0.50 0.00 0.00 59.36 59.03 2jww h GLU 101 Cb 0.53 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.42 2jww h GLU 101 CO 0.04 0.27 0.51 0.35 -1.40 0.00 0.00 179.01 178.78 2jww h PHE 102 N 0.00 0.00 0.05 4.33 3.57 -0.79 0.56 116.94 124.66 2jww h PHE 102 Ca -0.00 0.00 -0.25 0.00 3.53 0.00 0.00 57.97 61.25 2jww h PHE 102 Cb 0.62 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.37 2jww h PHE 102 CO 0.00 0.00 -1.06 1.03 -2.23 0.00 0.00 178.31 176.05 2jww h SER 103 N 0.00 0.58 -0.25 0.41 0.87 -1.63 -3.21 113.55 110.33 2jww h SER 103 Ca 0.31 -0.51 -0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2jww h SER 103 Cb 1.33 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 63.09 2jww h SER 103 CO -0.00 1.33 0.15 0.74 -0.53 0.00 0.00 176.83 178.52 2jww h THR 104 N 0.21 1.08 -0.60 2.23 2.02 0.00 -1.37 112.91 116.48 2jww h THR 104 Ca -0.11 -0.20 0.05 0.00 0.77 0.00 0.00 66.41 66.92 2jww h THR 104 Cb 1.72 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.81 2jww h THR 104 CO 0.19 0.09 0.40 0.25 0.37 0.00 0.00 175.52 176.81 2jww h LEU 105 N 0.37 0.55 -1.19 2.58 6.46 -1.39 0.19 115.31 122.88 2jww h LEU 105 Ca 0.10 -0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.81 2jww h LEU 105 Cb -0.00 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 39.79 2jww h LEU 105 CO -0.02 0.37 0.07 0.58 -0.62 0.00 0.00 178.44 178.82 2jww h VAL 106 N 0.63 1.20 0.00 1.05 2.07 -1.37 -1.57 116.25 118.26 2jww h VAL 106 Ca 0.25 -0.74 -0.15 0.00 0.82 0.00 0.00 66.70 66.88 2jww h VAL 106 Cb 0.20 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 2jww h VAL 106 CO -0.07 0.27 -0.73 0.00 0.02 0.00 0.00 177.57 177.05 2jww h ALA 107 N 1.47 0.57 0.05 1.67 0.00 -1.05 -3.37 119.26 118.60 2jww h ALA 107 Ca 0.14 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2jww h ALA 107 Cb 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2jww h ALA 107 CO 0.00 0.86 -0.02 0.93 0.00 0.00 0.00 179.25 181.02 2jww h GLU 108 N 0.00 -0.06 0.00 0.00 4.39 0.03 -3.52 114.58 115.42 2jww h GLU 108 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2jww h GLU 108 Cb 1.53 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.20 2jww h GLU 108 CO 0.09 -0.04 0.00 -1.13 -1.16 0.00 0.00 179.01 176.76