#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jww s MET 2 N 0.00 2.56 -0.01 -1.46 0.00 -1.26 -4.49 119.30 114.64 2jww s MET 2 Ca 0.00 -0.58 -0.00 0.00 0.00 0.00 0.00 55.69 55.11 2jww s MET 2 Cb 0.00 -5.13 -0.01 0.00 0.00 0.00 0.00 34.83 29.70 2jww s MET 2 CO 0.00 -3.54 -0.01 0.25 0.00 0.00 0.00 175.02 171.72 2jww n THR 3 N 7.83 0.06 0.32 10.11 -2.24 -1.26 -3.98 114.28 125.13 2jww n THR 3 Ca 0.42 -0.02 0.20 0.00 -2.27 0.00 0.00 64.05 62.37 2jww n THR 3 Cb 0.47 -0.77 1.07 0.00 -2.10 0.00 0.00 70.33 69.00 2jww n THR 3 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2jww h ASP 4 N -0.01 0.00 0.00 3.42 1.82 -2.00 -3.21 116.42 116.44 2jww h ASP 4 Ca -0.02 0.00 -0.12 0.00 -0.39 0.00 0.00 57.03 56.49 2jww h ASP 4 Cb 1.03 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.02 2jww h ASP 4 CO -0.01 0.00 -1.19 0.18 -1.61 0.00 0.00 179.24 176.62 2jww n LEU 5 N -2.96 1.15 -4.86 2.28 7.99 -1.26 -5.03 117.00 114.31 2jww n LEU 5 Ca -0.03 0.19 -0.34 0.00 -0.01 0.00 0.00 56.01 55.82 2jww n LEU 5 Cb 0.15 -0.44 -0.05 0.00 -0.11 0.00 0.00 43.42 42.97 2jww n LEU 5 CO 0.17 -0.07 0.17 -0.76 -1.51 0.00 0.00 177.39 175.39 2jww s LEU 6 N -7.00 4.28 -0.32 2.23 1.43 -1.21 -4.88 118.68 113.21 2jww s LEU 6 Ca -0.16 0.91 -0.36 0.00 -1.03 0.00 0.00 54.13 53.49 2jww s LEU 6 Cb 0.05 -3.32 -0.12 0.00 0.03 0.00 0.00 46.19 42.83 2jww s LEU 6 CO 0.21 0.06 2.13 -1.54 0.23 0.00 0.00 176.35 177.45 2jww n SER 7 N 0.49 2.24 -0.17 2.29 3.41 -1.26 -4.21 113.62 116.41 2jww n SER 7 Ca -0.04 0.51 -0.09 0.00 -0.26 0.00 0.00 58.87 58.99 2jww n SER 7 Cb 0.52 -1.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.22 2jww n SER 7 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jww h ALA 8 N 11.73 0.64 -0.60 7.33 0.00 -1.85 -2.42 119.26 134.08 2jww h ALA 8 Ca -0.30 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2jww h ALA 8 Cb 1.32 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 2jww h ALA 8 CO 1.01 0.32 0.35 1.05 0.00 0.00 0.00 179.25 181.98 2jww h GLU 9 N 0.65 0.83 0.44 0.00 4.11 -1.94 -2.05 114.58 116.62 2jww h GLU 9 Ca 0.15 -0.08 -0.02 0.00 0.07 0.00 0.00 59.36 59.48 2jww h GLU 9 Cb 0.32 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2jww h GLU 9 CO 0.00 0.61 -0.21 -0.44 0.07 0.00 0.00 179.01 179.04 2jww h ASP 10 N 0.82 -0.50 0.12 3.06 5.19 -1.76 -2.30 116.42 121.05 2jww h ASP 10 Ca 0.22 0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.65 2jww h ASP 10 Cb 0.00 0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.62 2jww h ASP 10 CO -0.04 -0.35 -0.19 0.40 -3.12 0.00 0.00 179.24 175.94 2jww h ILE 11 N -0.59 0.57 -0.78 0.35 2.04 -1.26 0.80 117.51 118.63 2jww h ILE 11 Ca -0.06 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.94 2jww h ILE 11 Cb 0.45 0.57 -0.09 0.00 -0.74 0.00 0.00 36.82 37.01 2jww h ILE 11 CO 0.10 0.00 0.36 0.11 0.00 0.00 0.00 178.15 178.71 2jww h LYS 12 N -0.37 0.51 0.02 2.37 1.57 -1.37 1.03 116.57 120.33 2jww h LYS 12 Ca 0.02 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2jww h LYS 12 Cb 0.38 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2jww h LYS 12 CO -0.09 0.34 -0.01 0.87 -0.57 0.00 0.00 179.45 179.98 2jww h LYS 13 N 0.52 -0.03 -0.66 3.15 1.57 -0.92 -1.77 116.57 118.43 2jww h LYS 13 Ca 0.42 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.18 2jww h LYS 13 Cb 0.61 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 2jww h LYS 13 CO -0.37 0.62 0.28 0.00 -0.57 0.00 0.00 179.45 179.41 2jww h ALA 14 N 0.20 1.26 -0.10 3.86 0.00 0.10 1.38 119.26 125.96 2jww h ALA 14 Ca -0.00 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.56 2jww h ALA 14 Cb 0.66 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2jww h ALA 14 CO 0.01 0.55 -0.74 0.82 0.00 0.00 0.00 179.25 179.89 2jww h ILE 15 N 0.94 1.35 0.00 0.00 2.04 0.10 -3.29 117.51 118.65 2jww h ILE 15 Ca 0.23 -2.08 -0.10 0.00 1.00 0.00 0.00 64.86 63.90 2jww h ILE 15 Cb 0.15 2.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 2jww h ILE 15 CO -0.02 0.64 -1.11 0.61 0.00 0.00 0.00 178.15 178.26 2jww n GLY 16 N 0.58 -0.70 0.35 5.37 0.00 -0.67 -4.35 105.19 105.78 2jww n GLY 16 Ca -0.05 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 45.85 2jww n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jww n ALA 17 N -4.02 0.26 -3.75 4.61 0.00 0.47 -4.21 120.51 113.87 2jww n ALA 17 Ca -0.20 1.08 -0.22 0.00 0.00 0.00 0.00 53.44 54.10 2jww n ALA 17 Cb 0.51 -0.66 -0.18 0.00 0.00 0.00 0.00 19.45 19.12 2jww n ALA 17 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2jww s PHE 18 N -6.22 0.59 -0.12 0.00 -0.12 -1.24 -5.01 117.98 105.86 2jww s PHE 18 Ca -0.15 -0.11 -0.01 0.00 -0.05 0.00 0.00 56.93 56.62 2jww s PHE 18 Cb 0.27 -0.75 -0.25 0.00 -0.63 0.00 0.00 43.02 41.66 2jww s PHE 18 CO 0.77 -0.30 0.36 2.41 -0.05 0.00 0.00 175.22 178.41 2jww n THR 19 N 5.12 1.70 -0.32 -4.49 -1.04 -1.26 -4.28 114.28 109.71 2jww n THR 19 Ca -0.07 -0.69 0.16 0.00 -2.04 0.00 0.00 64.05 61.41 2jww n THR 19 Cb 0.50 -1.51 0.36 0.00 -1.82 0.00 0.00 70.33 67.86 2jww n THR 19 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jww h ALA 20 N 0.30 1.59 -0.02 2.41 0.00 -1.95 0.68 119.26 122.28 2jww h ALA 20 Ca -0.41 0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.68 2jww h ALA 20 Cb 2.03 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.95 2jww h ALA 20 CO 0.07 -0.40 -0.18 0.00 0.00 0.00 0.00 179.25 178.73 2jww h ALA 21 N 1.76 -0.62 0.00 0.00 0.00 -1.86 -0.56 119.26 117.99 2jww h ALA 21 Ca 0.61 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.50 2jww h ALA 21 Cb 1.24 0.69 0.00 0.00 0.00 0.00 0.00 17.79 19.71 2jww h ALA 21 CO -0.56 -0.68 0.00 0.38 0.00 0.00 0.00 179.25 178.39 2jww h ASP 22 N -0.21 0.00 0.26 0.00 2.03 -1.57 0.77 116.42 117.70 2jww h ASP 22 Ca 0.01 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.30 2jww h ASP 22 Cb 0.24 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.73 2jww h ASP 22 CO -0.13 0.00 -0.25 -1.28 -1.03 0.00 0.00 179.24 176.55 2jww h SER 23 N 0.00 -0.68 0.05 4.15 0.87 0.19 -3.36 113.55 114.78 2jww h SER 23 Ca 0.00 0.05 -0.38 0.00 -1.23 0.00 0.00 61.79 60.23 2jww h SER 23 Cb 0.47 0.22 -0.05 0.00 -0.44 0.00 0.00 62.40 62.60 2jww h SER 23 CO 0.00 -0.33 -2.31 2.22 -0.53 0.00 0.00 176.83 175.88 2jww n PHE 24 N -3.85 0.40 -3.45 2.24 1.16 -0.67 -4.72 117.46 108.57 2jww n PHE 24 Ca -0.06 0.09 -0.26 0.00 -1.87 0.00 0.00 57.45 55.35 2jww n PHE 24 Cb 0.23 -1.05 -0.12 0.00 -1.61 0.00 0.00 39.48 36.93 2jww n PHE 24 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2jww s ASP 25 N -6.59 2.68 0.00 5.98 2.15 0.23 -4.69 116.67 116.43 2jww s ASP 25 Ca -0.29 -1.87 0.13 0.00 0.43 0.00 0.00 52.55 50.95 2jww s ASP 25 Cb 0.08 -0.17 0.58 0.00 -0.30 0.00 0.00 42.92 43.11 2jww s ASP 25 CO 0.67 -0.33 1.37 0.00 -0.17 0.00 0.00 175.17 176.71 2jww n HIS 26 N 4.33 0.00 0.02 -5.34 1.44 -1.00 -3.31 115.22 111.37 2jww n HIS 26 Ca 0.08 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.69 2jww n HIS 26 Cb 0.40 -0.41 -0.04 0.00 0.12 0.00 0.00 29.99 30.06 2jww n HIS 26 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 2jww h LYS 27 N 0.00 -0.38 -0.30 -1.40 1.79 -1.93 1.35 116.57 115.69 2jww h LYS 27 Ca 0.00 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2jww h LYS 27 Cb 0.17 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 2jww h LYS 27 CO 0.00 -0.25 0.20 -0.22 -1.08 0.00 0.00 179.45 178.10 2jww h LYS 28 N -0.39 0.40 -0.71 3.15 1.63 -1.89 -1.84 116.57 116.93 2jww h LYS 28 Ca 0.09 -0.03 0.15 0.00 -0.85 0.00 0.00 60.65 60.01 2jww h LYS 28 Cb 0.53 -0.09 -0.10 0.00 -0.60 0.00 0.00 32.23 31.96 2jww h LYS 28 CO -0.31 0.27 0.16 0.35 -3.45 0.00 0.00 179.45 176.47 2jww h PHE 29 N 0.41 0.25 -0.68 1.91 3.04 -1.45 0.38 116.94 120.80 2jww h PHE 29 Ca 0.11 0.04 0.20 0.00 3.98 0.00 0.00 57.97 62.30 2jww h PHE 29 Cb -0.04 -0.00 -0.03 0.00 2.56 0.00 0.00 35.95 38.44 2jww h PHE 29 CO -0.05 -0.07 0.65 0.35 -2.02 0.00 0.00 178.31 177.16 2jww h PHE 30 N 0.27 0.00 0.01 0.41 3.04 0.26 1.16 116.94 122.09 2jww h PHE 30 Ca 0.39 0.00 -0.09 0.00 3.98 0.00 0.00 57.97 62.26 2jww h PHE 30 Cb 0.65 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.15 2jww h PHE 30 CO -0.26 0.00 -0.46 1.96 -2.02 0.00 0.00 178.31 177.53 2jww h GLN 31 N 0.00 0.03 -0.10 1.11 4.20 -0.17 -2.67 115.11 117.51 2jww h GLN 31 Ca 0.32 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.83 2jww h GLN 31 Cb 1.63 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.41 2jww h GLN 31 CO -0.00 1.02 -0.62 0.52 -0.67 0.00 0.00 178.83 179.08 2jww h MET 32 N -0.93 0.35 0.00 1.46 2.86 -0.67 -3.02 114.93 114.98 2jww h MET 32 Ca -0.12 -0.25 -0.02 0.00 -2.06 0.00 0.00 59.70 57.25 2jww h MET 32 Cb 1.15 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.85 2jww h MET 32 CO -0.05 0.86 -0.11 -0.24 1.06 0.00 0.00 176.91 178.44 2jww h VAL 33 N 0.26 0.60 0.00 -2.22 3.04 0.11 -3.42 116.25 114.62 2jww h VAL 33 Ca -0.01 -0.46 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 2jww h VAL 33 Cb 1.15 1.29 0.00 0.00 -2.01 0.00 0.00 31.29 31.72 2jww h VAL 33 CO 0.10 0.10 0.00 0.61 -1.01 0.00 0.00 177.57 177.38 2jww n GLY 34 N -0.80 1.08 0.16 3.17 0.00 -1.14 -2.80 105.19 104.85 2jww n GLY 34 Ca -0.02 -0.43 -0.03 0.00 0.00 0.00 0.00 46.02 45.53 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 0.17 -1.11 0.99 3.38 -1.72 -2.38 115.31 114.63 2jww h LEU 35 Ca 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2jww h LEU 35 Cb 0.30 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2jww h LEU 35 CO 0.00 0.73 0.00 0.29 0.09 0.00 0.00 178.44 179.55 2jww n LYS 36 N -3.86 1.70 0.00 1.13 5.02 -1.24 -4.59 118.16 116.32 2jww n LYS 36 Ca -0.02 -1.08 0.00 0.00 -2.02 0.00 0.00 58.31 55.19 2jww n LYS 36 Cb 0.61 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 34.38 2jww n LYS 36 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2jww n LYS 37 N 0.38 0.00 0.00 1.97 4.81 -0.89 -4.59 118.16 119.83 2jww n LYS 37 Ca 0.10 0.17 0.00 0.00 -0.87 0.00 0.00 58.31 57.71 2jww n LYS 37 Cb 0.26 -0.75 0.00 0.00 0.02 0.00 0.00 35.03 34.56 2jww n LYS 37 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2jww n LYS 38 N -0.42 0.00 -4.14 1.64 5.02 -1.26 -5.08 118.16 113.92 2jww n LYS 38 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.14 2jww n LYS 38 Cb 0.00 -0.22 -0.06 0.00 -0.02 0.00 0.00 35.03 34.73 2jww n LYS 38 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2jww s SER 39 N -1.00 0.92 0.31 4.39 0.01 -1.26 -5.04 113.70 112.03 2jww s SER 39 Ca 0.00 -1.49 0.02 0.00 1.31 0.00 0.00 55.95 55.79 2jww s SER 39 Cb 0.00 0.60 0.51 0.00 0.21 0.00 0.00 66.02 67.35 2jww s SER 39 CO 0.00 -1.18 1.86 0.00 0.41 0.00 0.00 173.24 174.32 2jww h ALA 40 N 2.18 1.31 -0.97 1.44 0.00 -1.91 -2.32 119.26 118.99 2jww h ALA 40 Ca -0.28 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 54.65 2jww h ALA 40 Cb 1.24 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.76 2jww h ALA 40 CO 0.39 0.48 0.63 -0.44 0.00 0.00 0.00 179.25 180.31 2jww h ASP 41 N 0.65 0.50 0.08 0.00 3.32 -1.96 0.35 116.42 119.35 2jww h ASP 41 Ca 0.14 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 2jww h ASP 41 Cb 0.30 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2jww h ASP 41 CO 0.00 0.17 -0.04 0.44 -1.72 0.00 0.00 179.24 178.09 2jww h ASP 42 N 0.48 -0.09 -0.42 6.45 3.32 -1.79 -2.80 116.42 121.57 2jww h ASP 42 Ca 0.53 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 57.28 2jww h ASP 42 Cb 1.22 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 2jww h ASP 42 CO -0.25 0.23 0.18 -0.37 -1.72 0.00 0.00 179.24 177.30 2jww h VAL 43 N -0.41 1.18 -0.12 -1.35 -1.51 -1.09 -1.94 116.25 111.01 2jww h VAL 43 Ca -0.01 -0.58 0.03 0.00 -1.23 0.00 0.00 66.70 64.91 2jww h VAL 43 Cb 0.35 0.63 -0.00 0.00 -2.13 0.00 0.00 31.29 30.14 2jww h VAL 43 CO 0.02 0.23 0.08 0.50 -1.23 0.00 0.00 177.57 177.17 2jww h LYS 44 N 0.68 0.00 -0.93 5.19 3.64 -0.25 -1.78 116.57 123.11 2jww h LYS 44 Ca 0.16 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.62 2jww h LYS 44 Cb 0.16 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.91 2jww h LYS 44 CO -0.01 0.00 0.60 0.87 -2.27 0.00 0.00 179.45 178.64 2jww h LYS 45 N 0.00 0.99 -0.17 1.90 6.56 -1.08 0.52 116.57 125.29 2jww h LYS 45 Ca 0.05 -0.06 0.05 0.00 -1.06 0.00 0.00 60.65 59.63 2jww h LYS 45 Cb 0.22 -0.22 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 2jww h LYS 45 CO -0.00 0.66 0.16 -0.24 -2.06 0.00 0.00 179.45 177.96 2jww h VAL 46 N 1.02 0.60 -1.02 0.50 3.04 -1.45 -0.77 116.25 118.17 2jww h VAL 46 Ca 0.42 0.00 0.25 0.00 -1.01 0.00 0.00 66.70 66.36 2jww h VAL 46 Cb 0.27 0.88 -0.09 0.00 -2.01 0.00 0.00 31.29 30.34 2jww h VAL 46 CO -0.17 0.00 0.66 0.15 -1.01 0.00 0.00 177.57 177.19 2jww h PHE 47 N 0.00 0.69 -0.00 3.17 3.57 -0.06 1.35 116.94 125.66 2jww h PHE 47 Ca 0.08 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.42 2jww h PHE 47 Cb 0.39 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 2jww h PHE 47 CO 0.00 0.08 -0.82 1.25 -2.23 0.00 0.00 178.31 176.60 2jww h HIS 48 N 0.43 0.14 0.14 0.41 2.76 -1.24 1.52 115.15 119.30 2jww h HIS 48 Ca 0.58 -0.08 -0.01 0.00 -2.20 0.00 0.00 60.37 58.67 2jww h HIS 48 Cb 1.42 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 30.36 2jww h HIS 48 CO -0.00 0.87 -0.07 0.82 -1.30 0.00 0.00 177.93 178.24 2jww h ILE 49 N 0.06 1.00 0.18 6.26 1.08 0.13 -3.23 117.51 122.99 2jww h ILE 49 Ca -0.02 -1.03 -0.32 0.00 -0.39 0.00 0.00 64.86 63.10 2jww h ILE 49 Cb 1.43 1.60 0.02 0.00 -3.07 0.00 0.00 36.82 36.79 2jww h ILE 49 CO 0.12 0.23 -1.50 0.17 -0.69 0.00 0.00 178.15 176.47 2jww h LEU 50 N -0.72 0.61 -7.47 1.44 8.10 0.74 -3.40 115.31 114.61 2jww h LEU 50 Ca -0.02 -0.74 -0.70 0.00 0.11 0.00 0.00 57.88 56.54 2jww h LEU 50 Cb 0.52 -0.20 -0.35 0.00 -0.44 0.00 0.00 40.66 40.19 2jww h LEU 50 CO 0.03 1.59 -0.27 -0.62 -4.11 0.00 0.00 178.44 175.06 2jww s ASP 51 N -7.30 5.49 0.21 0.17 2.15 0.52 -4.89 116.67 113.02 2jww s ASP 51 Ca -0.09 -3.18 -0.01 0.00 0.43 0.00 0.00 52.55 49.69 2jww s ASP 51 Cb 0.06 -1.87 0.18 0.00 -0.30 0.00 0.00 42.92 40.99 2jww s ASP 51 CO 0.89 -0.30 1.56 0.07 -0.17 0.00 0.00 175.17 177.22 2jww h LYS 52 N 6.64 0.52 0.00 4.34 -0.00 -1.69 -2.70 116.57 123.68 2jww h LYS 52 Ca 0.05 -0.30 -0.01 0.00 -0.00 0.00 0.00 60.65 60.40 2jww h LYS 52 Cb 0.90 0.02 -0.00 0.00 -0.00 0.00 0.00 32.23 33.15 2jww h LYS 52 CO 0.76 0.89 -0.04 0.22 -0.00 0.00 0.00 179.45 181.28 2jww h ASP 53 N 0.41 0.00 -7.05 7.07 1.82 -1.90 -3.47 116.42 113.31 2jww h ASP 53 Ca 0.02 0.00 -0.60 0.00 -0.39 0.00 0.00 57.03 56.06 2jww h ASP 53 Cb 1.00 0.00 -0.30 0.00 0.68 0.00 0.00 39.33 40.71 2jww h ASP 53 CO 0.09 0.04 -0.90 0.29 -1.61 0.00 0.00 179.24 177.15 2jww n LYS 54 N -3.14 -1.42 0.29 0.28 5.02 -1.02 -4.72 118.16 113.46 2jww n LYS 54 Ca 0.01 0.19 0.12 0.00 -2.02 0.00 0.00 58.31 56.62 2jww n LYS 54 Cb 0.37 -4.59 0.66 0.00 -0.02 0.00 0.00 35.03 31.46 2jww n LYS 54 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2jww h SER 55 N -1.22 0.00 0.00 4.39 0.87 -1.90 -3.44 113.55 112.25 2jww h SER 55 Ca -0.61 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 59.95 2jww h SER 55 Cb 1.39 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 2jww h SER 55 CO 0.83 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 177.74 2jww n GLY 56 N -1.25 1.27 3.63 5.77 0.00 -1.26 -5.02 105.19 108.33 2jww n GLY 56 Ca -0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.27 -1.04 -0.03 1.61 0.08 -1.26 -3.60 117.98 111.46 2jww s PHE 57 Ca 0.00 2.01 -0.02 0.00 0.12 0.00 0.00 56.93 59.04 2jww s PHE 57 Cb 0.00 0.62 -0.04 0.00 -0.57 0.00 0.00 43.02 43.03 2jww s PHE 57 CO 0.00 -0.51 0.10 0.42 -0.10 0.00 0.00 175.22 175.13 2jww s ILE 58 N 1.85 4.93 -0.26 0.64 1.01 -0.56 -4.92 121.20 123.90 2jww s ILE 58 Ca -0.09 -0.26 -0.12 0.00 0.00 0.00 0.00 60.65 60.18 2jww s ILE 58 Cb -0.06 -3.24 -0.05 0.00 0.01 0.00 0.00 42.46 39.13 2jww s ILE 58 CO -0.19 0.40 0.23 -1.61 0.00 0.00 0.00 174.94 173.77 2jww s GLU 59 N -1.61 4.03 0.47 2.79 2.02 -1.26 -1.86 118.70 123.28 2jww s GLU 59 Ca 0.22 -0.19 0.39 0.00 0.02 0.00 0.00 54.97 55.41 2jww s GLU 59 Cb -0.12 -3.60 1.51 0.00 0.10 0.00 0.00 34.13 32.02 2jww s GLU 59 CO 0.12 -0.09 1.45 -0.85 0.02 0.00 0.00 175.26 175.91 2jww n GLU 60 N 4.76 -0.02 0.07 1.61 -0.00 -1.22 0.16 120.64 126.01 2jww n GLU 60 Ca -0.13 1.08 -0.13 0.00 -0.00 0.00 0.00 57.16 57.98 2jww n GLU 60 Cb 0.52 -2.31 -0.08 0.00 -0.00 0.00 0.00 31.44 29.57 2jww n GLU 60 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 2jww h ASP 61 N 0.00 -0.12 0.99 -1.84 1.82 -1.92 -3.04 116.42 112.31 2jww h ASP 61 Ca 0.85 -0.14 -0.10 0.00 -0.39 0.00 0.00 57.03 57.25 2jww h ASP 61 Cb 3.12 0.03 -0.02 0.00 0.68 0.00 0.00 39.33 43.14 2jww h ASP 61 CO -0.20 0.07 -1.07 -0.33 -1.61 0.00 0.00 179.24 176.10 2jww h GLU 62 N -0.30 0.00 -0.53 0.28 5.08 -0.30 -3.37 114.58 115.44 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 0.25 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.39 2jww h GLU 62 CO 0.02 0.21 -0.16 1.25 -1.00 0.00 0.00 179.01 179.34 2jww h LEU 63 N 0.00 -0.57 -2.07 1.33 5.85 0.16 0.35 115.31 120.37 2jww h LEU 63 Ca -0.08 0.17 0.10 0.00 0.84 0.00 0.00 57.88 58.91 2jww h LEU 63 Cb 1.34 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 42.71 2jww h LEU 63 CO 0.03 -0.20 0.32 1.23 -0.34 0.00 0.00 178.44 179.48 2jww h GLY 64 N -0.03 0.00 0.10 3.75 0.00 -1.69 0.23 103.07 105.43 2jww h GLY 64 Ca 0.25 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.58 2jww h GLY 64 CO -0.56 0.00 -0.04 1.76 0.00 0.00 0.00 176.54 177.70 2jww h SER 65 N 0.00 -0.09 0.00 0.19 0.02 -0.58 -3.19 113.55 109.90 2jww h SER 65 Ca 0.17 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2jww h SER 65 Cb 0.80 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.37 2jww h SER 65 CO -0.00 0.47 0.03 -0.29 -1.14 0.00 0.00 176.83 175.89 2jww h ILE 66 N -1.01 0.00 -0.64 3.27 6.09 -0.73 -2.37 117.51 122.12 2jww h ILE 66 Ca -0.01 0.00 0.18 0.00 -1.37 0.00 0.00 64.86 63.66 2jww h ILE 66 Cb 0.24 0.84 -0.03 0.00 0.47 0.00 0.00 36.82 38.35 2jww h ILE 66 CO 0.02 0.00 0.68 -0.07 -3.07 0.00 0.00 178.15 175.71 2jww h LEU 67 N 0.00 0.00 -1.47 2.19 -0.00 -0.62 0.24 115.31 115.65 2jww h LEU 67 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.90 2jww h LEU 67 Cb 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.71 2jww h LEU 67 CO 0.00 0.00 0.53 0.11 -0.00 0.00 0.00 178.44 179.08 2jww h LYS 68 N 0.00 0.00 -0.80 1.13 1.57 -1.64 -1.86 116.57 114.97 2jww h LYS 68 Ca 0.30 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 59.21 2jww h LYS 68 Cb 1.66 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.84 2jww h LYS 68 CO -0.00 0.00 -0.40 0.78 -0.57 0.00 0.00 179.45 179.26 2jww h GLY 69 N 0.00 -0.15 0.09 3.86 0.00 -1.22 1.42 103.07 107.07 2jww h GLY 69 Ca 0.03 0.53 -0.39 0.00 0.00 0.00 0.00 47.33 47.49 2jww h GLY 69 CO -0.00 -0.18 -2.36 1.97 0.00 0.00 0.00 176.54 175.97 2jww n PHE 70 N -5.43 0.24 0.99 5.60 -1.74 -0.83 -4.36 117.46 111.93 2jww n PHE 70 Ca 0.06 0.06 0.08 0.00 -0.56 0.00 0.00 57.45 57.09 2jww n PHE 70 Cb 0.37 -1.03 0.46 0.00 1.52 0.00 0.00 39.48 40.80 2jww n PHE 70 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 2jww n SER 71 N -3.55 0.00 -0.14 5.98 3.41 -0.76 -3.75 113.62 114.82 2jww n SER 71 Ca -0.45 -0.50 0.28 0.00 -0.26 0.00 0.00 58.87 57.93 2jww n SER 71 Cb 0.96 0.00 0.66 0.00 -0.26 0.00 0.00 64.21 65.57 2jww n SER 71 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2jww h SER 72 N 0.00 0.00 -0.12 4.04 4.64 0.17 1.38 113.55 123.66 2jww h SER 72 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2jww h SER 72 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2jww h SER 72 CO 0.00 0.00 -0.18 -0.90 -0.87 0.00 0.00 176.83 174.88 2jww n ASP 73 N -3.69 2.41 0.00 4.97 5.75 -1.25 -4.85 116.55 119.89 2jww n ASP 73 Ca 0.18 -3.50 0.00 0.00 -0.01 0.00 0.00 54.79 51.46 2jww n ASP 73 Cb 1.11 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 40.67 2jww n ASP 73 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jww n ALA 74 N -1.13 1.16 -1.00 2.12 0.00 0.47 -4.21 120.51 117.92 2jww n ALA 74 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2jww n ALA 74 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.24 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 -0.16 0.00 -3.14 0.00 1.74 -1.10 -5.01 116.66 108.99 2jww n ARG 75 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2jww n ARG 75 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2jww n ARG 75 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2jww n ASP 76 N -0.14 0.00 -3.71 0.55 5.68 -1.26 -4.91 116.55 112.76 2jww n ASP 76 Ca 0.00 0.00 -0.28 0.00 -0.50 0.00 0.00 54.79 54.01 2jww n ASP 76 Cb 0.00 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 39.87 2jww n ASP 76 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2jww s LEU 77 N 0.00 3.43 0.00 -2.12 0.20 -1.20 -4.81 118.68 114.17 2jww s LEU 77 Ca 0.00 -3.46 -0.04 0.00 0.69 0.00 0.00 54.13 51.32 2jww s LEU 77 Cb 0.00 -1.16 0.06 0.00 -0.43 0.00 0.00 46.19 44.66 2jww s LEU 77 CO 0.00 -0.13 0.25 -1.20 -0.29 0.00 0.00 176.35 174.97 2jww n SER 78 N 2.44 -1.00 -0.23 3.68 7.64 -1.26 -4.20 113.62 120.68 2jww n SER 78 Ca 0.22 -0.73 0.03 0.00 1.01 0.00 0.00 58.87 59.40 2jww n SER 78 Cb 0.39 -0.22 0.12 0.00 -1.01 0.00 0.00 64.21 63.50 2jww n SER 78 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jww h ALA 79 N -2.12 0.67 -0.35 -0.43 0.00 -1.97 1.30 119.26 116.37 2jww h ALA 79 Ca -0.09 0.22 0.07 0.00 0.00 0.00 0.00 54.91 55.12 2jww h ALA 79 Cb 0.27 0.40 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 2jww h ALA 79 CO 0.06 -0.41 -0.28 -0.22 0.00 0.00 0.00 179.25 178.39 2jww h LYS 80 N 0.09 -0.23 0.00 0.00 3.11 -1.97 0.29 116.57 117.86 2jww h LYS 80 Ca 0.37 0.02 -0.15 0.00 -2.81 0.00 0.00 60.65 58.08 2jww h LYS 80 Cb 0.61 0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.88 2jww h LYS 80 CO -0.62 -0.16 -0.70 0.93 -2.81 0.00 0.00 179.45 176.10 2jww h GLU 81 N -0.24 0.00 -0.06 1.90 5.08 -1.43 0.28 114.58 120.10 2jww h GLU 81 Ca 0.17 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2jww h GLU 81 Cb 0.51 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2jww h GLU 81 CO -0.48 0.70 -0.03 1.15 -1.00 0.00 0.00 179.01 179.34 2jww h THR 82 N 0.00 0.89 0.00 1.13 2.02 0.31 1.72 112.91 118.98 2jww h THR 82 Ca -0.01 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 66.99 2jww h THR 82 Cb 1.32 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.61 2jww h THR 82 CO 0.09 0.00 -0.83 0.11 0.37 0.00 0.00 175.52 175.26 2jww h LYS 83 N -0.04 0.07 0.00 6.66 1.79 -0.47 -2.48 116.57 122.10 2jww h LYS 83 Ca 0.04 -0.08 -0.02 0.00 -2.18 0.00 0.00 60.65 58.40 2jww h LYS 83 Cb 0.09 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.75 2jww h LYS 83 CO -0.08 0.86 -0.47 1.15 -1.08 0.00 0.00 179.45 179.83 2jww h THR 84 N 0.04 0.15 0.00 -0.16 2.02 0.05 -3.36 112.91 111.65 2jww h THR 84 Ca -0.02 -1.17 -0.07 0.00 0.77 0.00 0.00 66.41 65.92 2jww h THR 84 Cb 1.45 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 2jww h THR 84 CO 0.11 0.05 -0.39 -0.07 0.37 0.00 0.00 175.52 175.60 2jww h LEU 85 N -1.00 0.00 -0.02 2.58 -0.00 0.23 -3.08 115.31 114.02 2jww h LEU 85 Ca -0.04 -0.78 0.01 0.00 -0.00 0.00 0.00 57.88 57.08 2jww h LEU 85 Cb 0.50 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.14 2jww h LEU 85 CO -0.02 1.12 -0.06 0.24 -0.00 0.00 0.00 178.44 179.71 2jww h MET 86 N -1.00 -0.10 -0.31 1.13 2.86 -0.98 0.12 114.93 116.65 2jww h MET 86 Ca -0.10 0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.63 2jww h MET 86 Cb 1.03 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 2jww h MET 86 CO -0.06 -0.06 0.35 0.00 1.06 0.00 0.00 176.91 178.19 2jww h ALA 87 N 0.91 1.97 0.14 6.32 0.00 -1.59 -1.59 119.26 125.42 2jww h ALA 87 Ca 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2jww h ALA 87 Cb 0.14 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2jww h ALA 87 CO -0.08 -0.51 -0.07 0.00 0.00 0.00 0.00 179.25 178.59 2jww h ALA 88 N 1.59 -0.24 -1.07 0.00 0.00 -0.74 -3.14 119.26 115.65 2jww h ALA 88 Ca 0.15 -0.04 0.31 0.00 0.00 0.00 0.00 54.91 55.33 2jww h ALA 88 Cb 0.85 0.07 -0.12 0.00 0.00 0.00 0.00 17.79 18.58 2jww h ALA 88 CO -0.00 -0.23 0.66 0.78 0.00 0.00 0.00 179.25 180.46 2jww h GLY 89 N -0.74 1.60 -3.52 0.00 0.00 -0.78 1.23 103.07 100.87 2jww h GLY 89 Ca -0.02 -0.22 -0.38 0.00 0.00 0.00 0.00 47.33 46.71 2jww h GLY 89 CO 0.03 -0.30 0.49 2.09 0.00 0.00 0.00 176.54 178.85 2jww n ASP 90 N -4.81 6.18 -0.23 0.19 5.68 -0.63 -3.02 116.55 119.91 2jww n ASP 90 Ca 0.30 -3.17 0.19 0.00 -0.50 0.00 0.00 54.79 51.61 2jww n ASP 90 Cb 0.98 -0.98 0.32 0.00 -1.14 0.00 0.00 41.12 40.30 2jww n ASP 90 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 2jww n LYS 91 N -0.01 -0.02 0.29 0.11 0.00 0.42 0.19 118.16 119.14 2jww n LYS 91 Ca 0.37 0.58 0.15 0.00 0.00 0.00 0.00 58.31 59.41 2jww n LYS 91 Cb 0.70 -1.16 0.83 0.00 0.00 0.00 0.00 35.03 35.39 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 -0.70 3.14 5.19 -1.84 -3.45 116.42 118.76 2jww h ASP 92 Ca 0.42 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.83 2jww h ASP 92 Cb 1.37 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.88 2jww h ASP 92 CO -0.20 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.53 2jww n GLY 93 N -1.20 0.85 0.43 2.75 0.00 0.49 -5.00 105.19 103.51 2jww n GLY 93 Ca -0.02 -0.35 0.09 0.00 0.00 0.00 0.00 46.02 45.74 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 0.48 1.82 -2.04 1.61 8.00 -1.19 -4.97 116.55 120.26 2jww n ASP 94 Ca 0.00 -1.41 -0.17 0.00 0.71 0.00 0.00 54.79 53.92 2jww n ASP 94 Cb 0.28 0.46 -0.03 0.00 -0.02 0.00 0.00 41.12 41.80 2jww n ASP 94 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jww n GLY 95 N 1.25 0.37 3.38 0.44 0.00 -1.26 -4.93 105.19 104.44 2jww n GLY 95 Ca 0.08 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.96 2jww n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jww s LYS 96 N -4.39 0.60 -0.33 1.61 1.02 -1.26 -3.39 119.74 113.59 2jww s LYS 96 Ca 0.00 0.60 -0.08 0.00 0.02 0.00 0.00 55.97 56.51 2jww s LYS 96 Cb 0.00 0.29 0.02 0.00 -0.52 0.00 0.00 37.83 37.62 2jww s LYS 96 CO 0.00 -0.09 0.13 0.42 -0.92 0.00 0.00 175.35 174.89 2jww s ILE 97 N 0.08 4.15 0.42 2.17 1.01 -0.78 -4.53 121.20 123.71 2jww s ILE 97 Ca -0.01 -0.85 0.07 0.00 0.00 0.00 0.00 60.65 59.86 2jww s ILE 97 Cb -0.03 -3.25 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 2jww s ILE 97 CO 0.01 -0.09 0.29 -0.83 0.00 0.00 0.00 174.94 174.32 2jww s GLY 98 N 1.50 2.23 0.57 6.18 0.00 -1.26 -1.49 107.32 115.04 2jww s GLY 98 Ca 0.01 -1.98 0.34 0.00 0.00 0.00 0.00 44.72 43.08 2jww s GLY 98 CO 0.04 -1.80 1.74 -0.24 0.00 0.00 0.00 173.10 172.84 2jww h VAL 99 N 1.20 0.30 0.15 1.40 3.04 -1.97 0.32 116.25 120.69 2jww h VAL 99 Ca -0.42 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.26 2jww h VAL 99 Cb 1.26 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 30.92 2jww h VAL 99 CO 0.63 0.00 -0.07 -0.33 -1.01 0.00 0.00 177.57 176.79 2jww h GLU 100 N 0.00 -0.20 0.00 4.17 4.39 -1.94 -3.29 114.58 117.71 2jww h GLU 100 Ca 0.47 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 60.15 2jww h GLU 100 Cb 2.14 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 30.83 2jww h GLU 100 CO -0.00 0.22 -0.17 0.93 -1.16 0.00 0.00 179.01 178.83 2jww h GLU 101 N -0.90 0.00 -0.33 2.33 3.07 -1.30 -2.50 114.58 114.95 2jww h GLU 101 Ca -0.02 0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.93 2jww h GLU 101 Cb 0.51 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 2jww h GLU 101 CO 0.03 0.17 0.44 0.35 -1.40 0.00 0.00 179.01 178.61 2jww h PHE 102 N 0.00 0.00 0.13 4.33 3.04 -0.54 0.71 116.94 124.60 2jww h PHE 102 Ca -0.00 0.00 -0.29 0.00 3.98 0.00 0.00 57.97 61.65 2jww h PHE 102 Cb 0.39 0.00 0.03 0.00 2.56 0.00 0.00 35.95 38.93 2jww h PHE 102 CO 0.00 0.00 -1.25 0.77 -2.02 0.00 0.00 178.31 175.81 2jww h SER 103 N 0.00 0.80 -0.50 0.41 0.02 -1.60 -3.32 113.55 109.36 2jww h SER 103 Ca 0.16 -0.75 -0.03 0.00 -0.84 0.00 0.00 61.79 60.33 2jww h SER 103 Cb 1.04 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.31 2jww h SER 103 CO -0.00 1.56 0.20 0.74 -1.14 0.00 0.00 176.83 178.19 2jww h THR 104 N 0.24 1.21 -0.37 -2.27 2.02 0.24 -1.88 112.91 112.10 2jww h THR 104 Ca -0.18 -0.65 0.11 0.00 0.77 0.00 0.00 66.41 66.45 2jww h THR 104 Cb 1.92 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 69.02 2jww h THR 104 CO 0.23 0.25 0.49 0.17 0.37 0.00 0.00 175.52 177.03 2jww h LEU 105 N 0.67 0.00 -0.30 2.58 -0.00 -1.09 0.77 115.31 117.94 2jww h LEU 105 Ca 0.17 0.00 -0.20 0.00 -0.00 0.00 0.00 57.88 57.85 2jww h LEU 105 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.85 2jww h LEU 105 CO -0.01 0.00 -0.76 0.58 -0.00 0.00 0.00 178.44 178.24 2jww h VAL 106 N 0.00 1.34 0.00 0.15 2.07 -1.45 -3.02 116.25 115.34 2jww h VAL 106 Ca 0.17 -2.09 -0.21 0.00 0.82 0.00 0.00 66.70 65.39 2jww h VAL 106 Cb 1.15 2.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.98 2jww h VAL 106 CO -0.00 0.64 -1.00 0.00 0.02 0.00 0.00 177.57 177.23 2jww h ALA 107 N 0.78 0.36 0.11 1.67 0.00 0.33 -3.36 119.26 119.15 2jww h ALA 107 Ca -0.04 -0.90 -0.00 0.00 0.00 0.00 0.00 54.91 53.96 2jww h ALA 107 Cb 1.36 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 2jww h ALA 107 CO 0.14 1.23 -0.09 0.93 0.00 0.00 0.00 179.25 181.46 2jww h GLU 108 N 0.00 -0.19 0.00 0.00 4.39 -0.35 -3.52 114.58 114.91 2jww h GLU 108 Ca -0.01 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2jww h GLU 108 Cb 1.76 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.45 2jww h GLU 108 CO 0.13 -0.13 0.00 0.45 -1.16 0.00 0.00 179.01 178.31