#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nww h PRO 11 N 0.00 0.06 -3.66 -0.72 0.11 -2.02 -3.48 132.00 122.28 2nww h PRO 11 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2nww h PRO 11 Cb 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.10 2nww h PRO 11 CO 0.00 0.04 -0.68 1.33 -0.21 0.00 0.00 178.00 178.49 2nww n VAL 12 N -5.37 -3.97 -0.04 3.15 0.24 -1.26 -4.53 118.33 106.54 2nww n VAL 12 Ca 0.11 1.83 0.00 0.00 -2.04 0.00 0.00 64.34 64.24 2nww n VAL 12 Cb 0.40 -2.44 0.00 0.00 -1.47 0.00 0.00 33.84 30.34 2nww n VAL 12 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2nww n LEU 13 N -0.11 0.03 -0.00 1.34 4.77 -1.26 -4.31 117.00 117.46 2nww n LEU 13 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 2nww n LEU 13 Cb 0.00 -0.32 -0.03 0.00 -2.33 0.00 0.00 43.42 40.74 2nww n LEU 13 CO 0.00 -0.02 -0.11 0.00 -1.33 0.00 0.00 177.39 175.94 2nww n GLN 14 N -2.00 4.37 0.14 3.23 6.02 -1.26 -4.40 117.38 123.49 2nww n GLN 14 Ca 0.00 -0.01 -0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2nww n GLN 14 Cb 0.00 -0.82 0.19 0.00 1.02 0.00 0.00 30.24 30.64 2nww n GLN 14 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.06 177.62 2nww h LYS 15 N 0.00 0.00 0.13 -1.09 -0.00 -1.86 -1.47 116.57 112.28 2nww h LYS 15 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 60.65 60.64 2nww h LYS 15 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.38 2nww h LYS 15 CO 0.00 0.58 -0.06 0.82 -0.00 0.00 0.00 179.45 180.79 2nww h ILE 16 N 0.00 1.04 -0.42 0.07 5.03 -1.90 -2.21 117.51 119.11 2nww h ILE 16 Ca -0.01 -0.81 0.03 0.00 -0.12 0.00 0.00 64.86 63.95 2nww h ILE 16 Cb 1.07 1.53 -0.02 0.00 -3.03 0.00 0.00 36.82 36.37 2nww h ILE 16 CO 0.08 0.19 0.28 -0.07 -0.68 0.00 0.00 178.15 177.95 2nww h LEU 17 N -0.57 0.40 -0.31 1.44 3.38 -1.74 0.65 115.31 118.56 2nww h LEU 17 Ca -0.02 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 2nww h LEU 17 Cb 0.44 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2nww h LEU 17 CO 0.03 0.28 -0.01 0.40 0.09 0.00 0.00 178.44 179.23 2nww h ILE 18 N 0.47 1.26 0.00 1.22 2.04 -1.26 -2.68 117.51 118.56 2nww h ILE 18 Ca 0.17 -0.97 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 2nww h ILE 18 Cb 0.09 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 2nww h ILE 18 CO -0.04 0.32 -0.22 1.23 0.00 0.00 0.00 178.15 179.43 2nww h GLY 19 N 0.36 0.00 0.40 5.37 0.00 -0.70 -2.58 103.07 105.92 2nww h GLY 19 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 2nww h GLY 19 CO 0.02 0.00 -0.14 -2.00 0.00 0.00 0.00 176.54 174.42 2nww h LEU 20 N 0.00 -0.33 -0.57 3.11 5.85 -0.82 -0.38 115.31 122.18 2nww h LEU 20 Ca -0.00 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.51 2nww h LEU 20 Cb 0.85 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 2nww h LEU 20 CO 0.03 0.16 0.19 0.40 -0.34 0.00 0.00 178.44 178.88 2nww h ILE 21 N -0.99 1.23 -0.40 4.05 1.08 -1.56 0.46 117.51 121.39 2nww h ILE 21 Ca -0.04 -0.78 -0.04 0.00 -0.39 0.00 0.00 64.86 63.61 2nww h ILE 21 Cb 0.47 0.67 -0.02 0.00 -3.07 0.00 0.00 36.82 34.88 2nww h ILE 21 CO 0.06 0.29 0.09 0.25 -0.69 0.00 0.00 178.15 178.16 2nww h LEU 22 N 0.79 0.62 -0.39 1.44 7.12 -1.58 -2.56 115.31 120.76 2nww h LEU 22 Ca 0.19 -0.24 -0.09 0.00 0.13 0.00 0.00 57.88 57.87 2nww h LEU 22 Cb 0.26 -0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 40.22 2nww h LEU 22 CO -0.01 0.70 -0.09 1.23 -0.13 0.00 0.00 178.44 180.14 2nww h GLY 23 N 0.51 0.81 1.53 3.75 0.00 -0.81 -1.39 103.07 107.46 2nww h GLY 23 Ca 0.12 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.74 2nww h GLY 23 CO 0.00 0.61 0.03 0.00 0.00 0.00 0.00 176.54 177.18 2nww h ALA 24 N 0.84 1.34 -0.01 3.60 0.00 -0.92 0.19 119.26 124.29 2nww h ALA 24 Ca 0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2nww h ALA 24 Cb 0.61 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2nww h ALA 24 CO 0.04 0.46 -0.03 0.82 0.00 0.00 0.00 179.25 180.54 2nww h ILE 25 N 0.57 1.47 0.00 0.00 2.04 -1.38 -1.36 117.51 118.85 2nww h ILE 25 Ca 0.12 -1.44 -0.02 0.00 1.00 0.00 0.00 64.86 64.53 2nww h ILE 25 Cb 0.32 2.42 -0.00 0.00 -0.74 0.00 0.00 36.82 38.82 2nww h ILE 25 CO 0.01 0.38 -0.09 1.62 0.00 0.00 0.00 178.15 180.06 2nww h VAL 26 N -0.55 0.32 0.03 1.67 3.04 -1.08 0.27 116.25 119.95 2nww h VAL 26 Ca -0.00 -0.60 -0.06 0.00 -1.01 0.00 0.00 66.70 65.03 2nww h VAL 26 Cb 0.63 1.45 0.01 0.00 -2.01 0.00 0.00 31.29 31.37 2nww h VAL 26 CO 0.01 0.09 -0.26 1.23 -1.01 0.00 0.00 177.57 177.62 2nww h GLY 27 N 1.40 0.14 1.52 3.17 0.00 -0.67 -2.98 103.07 105.65 2nww h GLY 27 Ca -0.00 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 46.97 2nww h GLY 27 CO 0.01 0.27 -0.00 -2.00 0.00 0.00 0.00 176.54 174.82 2nww h LEU 28 N -0.67 0.56 -0.52 3.11 5.85 -0.79 0.18 115.31 123.03 2nww h LEU 28 Ca -0.04 -0.11 -0.15 0.00 0.84 0.00 0.00 57.88 58.42 2nww h LEU 28 Cb 1.12 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 2nww h LEU 28 CO 0.05 0.63 -0.41 0.40 -0.34 0.00 0.00 178.44 178.77 2nww h ILE 29 N 0.57 1.29 0.00 4.05 5.03 -0.61 -2.69 117.51 125.14 2nww h ILE 29 Ca 0.12 -1.59 0.00 0.00 -0.12 0.00 0.00 64.86 63.27 2nww h ILE 29 Cb 0.36 1.49 0.00 0.00 -3.03 0.00 0.00 36.82 35.64 2nww h ILE 29 CO 0.01 0.52 0.00 -0.07 -0.68 0.00 0.00 178.15 177.93 2nww h LEU 30 N 0.61 0.00 0.62 1.44 3.38 -1.27 -3.23 115.31 116.86 2nww h LEU 30 Ca 0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2nww h LEU 30 Cb 0.96 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.72 2nww h LEU 30 CO 0.09 0.00 -0.30 1.23 0.09 0.00 0.00 178.44 179.55 2nww h GLY 31 N 3.59 -0.87 1.29 0.83 0.00 -0.35 -1.89 103.07 105.66 2nww h GLY 31 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.65 2nww h GLY 31 CO 0.00 -0.32 0.00 1.42 0.00 0.00 0.00 176.54 177.64 2nww n HIS 32 N -5.29 0.00 0.73 5.60 8.25 -1.05 -1.90 115.22 121.56 2nww n HIS 32 Ca -0.10 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.44 2nww n HIS 32 Cb 0.33 -0.14 0.02 0.00 1.12 0.00 0.00 29.99 31.32 2nww n HIS 32 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 2nww n TYR 33 N -1.14 0.00 -0.35 4.41 4.19 -1.20 -5.00 117.16 118.06 2nww n TYR 33 Ca 0.08 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.29 2nww n TYR 33 Cb 0.08 0.00 0.00 0.00 0.49 0.00 0.00 39.34 39.91 2nww n TYR 33 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2nww n GLY 34 N 1.10 0.71 2.38 2.98 0.00 -0.80 -4.97 105.19 106.59 2nww n GLY 34 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2nww n GLY 34 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2nww n TYR 35 N -2.07 2.45 -0.19 1.61 4.02 -0.73 -4.61 117.16 117.63 2nww n TYR 35 Ca 0.00 -2.41 -0.10 0.00 -0.01 0.00 0.00 57.90 55.38 2nww n TYR 35 Cb 0.00 -1.26 0.02 0.00 -0.02 0.00 0.00 39.34 38.07 2nww n TYR 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2nww h ALA 36 N 2.28 0.76 -0.00 -0.72 0.00 -1.83 -2.87 119.26 116.88 2nww h ALA 36 Ca 0.48 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2nww h ALA 36 Cb 0.64 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2nww h ALA 36 CO 1.22 0.68 -0.15 0.72 0.00 0.00 0.00 179.25 181.72 2nww n HIS 37 N -4.14 0.00 0.08 0.00 8.25 -1.26 -2.48 115.22 115.67 2nww n HIS 37 Ca 0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.39 2nww n HIS 37 Cb 0.40 -0.31 -0.09 0.00 1.12 0.00 0.00 29.99 31.12 2nww n HIS 37 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2nww h ALA 38 N 3.27 0.36 -0.07 -1.41 0.00 -1.86 -2.89 119.26 116.66 2nww h ALA 38 Ca 0.00 -0.86 -0.23 0.00 0.00 0.00 0.00 54.91 53.82 2nww h ALA 38 Cb 0.43 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2nww h ALA 38 CO 0.00 1.12 -0.89 0.28 0.00 0.00 0.00 179.25 179.76 2nww h VAL 39 N 0.03 1.31 -0.40 0.00 2.07 -1.39 -2.93 116.25 114.93 2nww h VAL 39 Ca -0.04 -2.17 0.04 0.00 0.82 0.00 0.00 66.70 65.36 2nww h VAL 39 Cb 1.73 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 33.67 2nww h VAL 39 CO 0.14 0.67 0.17 -0.74 0.02 0.00 0.00 177.57 177.83 2nww h HIS 40 N 0.41 0.30 -0.00 1.57 6.17 -1.55 -0.36 115.15 121.68 2nww h HIS 40 Ca -0.08 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.02 2nww h HIS 40 Cb 1.53 -0.08 0.00 0.00 2.52 0.00 0.00 27.41 31.38 2nww h HIS 40 CO 0.08 0.14 -0.00 -2.37 0.71 0.00 0.00 177.93 176.49 2nww n THR 41 N -4.97 0.00 0.14 6.26 5.66 -1.09 -4.13 114.28 116.14 2nww n THR 41 Ca 0.02 -0.05 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 2nww n THR 41 Cb 0.13 -0.30 0.00 0.00 -1.55 0.00 0.00 70.33 68.61 2nww n THR 41 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 2nww n TYR 42 N -0.78 -2.43 -0.06 1.09 4.02 -1.03 -4.92 117.16 113.05 2nww n TYR 42 Ca 0.23 0.45 -0.16 0.00 -0.01 0.00 0.00 57.90 58.41 2nww n TYR 42 Cb 0.16 0.68 -0.05 0.00 -0.02 0.00 0.00 39.34 40.11 2nww n TYR 42 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2nww h VAL 43 N 0.00 1.27 -0.40 -0.72 2.07 -1.32 -3.39 116.25 113.77 2nww h VAL 43 Ca 0.00 -1.83 0.06 0.00 0.82 0.00 0.00 66.70 65.75 2nww h VAL 43 Cb 0.00 1.77 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 2nww h VAL 43 CO 0.00 0.59 0.08 0.50 0.02 0.00 0.00 177.57 178.76 2nww h LYS 44 N 0.62 0.20 -0.73 1.57 3.64 -1.34 -2.94 116.57 117.59 2nww h LYS 44 Ca -0.01 -0.01 0.19 0.00 -1.27 0.00 0.00 60.65 59.54 2nww h LYS 44 Cb 1.27 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 33.00 2nww h LYS 44 CO 0.14 0.13 0.51 -1.35 -2.27 0.00 0.00 179.45 176.61 2nww h PRO 45 N 0.21 0.15 0.00 1.90 0.11 -1.80 0.28 132.00 132.85 2nww h PRO 45 Ca 0.19 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.21 2nww h PRO 45 Cb 0.23 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.29 2nww h PRO 45 CO -0.25 0.10 -0.40 0.74 -0.21 0.00 0.00 178.00 177.98 2nww h PHE 46 N 0.16 0.00 -0.01 0.65 0.05 -1.79 -0.25 116.94 115.75 2nww h PHE 46 Ca 0.36 0.00 -0.16 0.00 3.82 0.00 0.00 57.97 61.99 2nww h PHE 46 Cb 1.18 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 39.11 2nww h PHE 46 CO -0.00 0.40 -0.71 0.78 -0.18 0.00 0.00 178.31 178.60 2nww h GLY 47 N 1.22 0.09 0.80 -1.45 0.00 -0.59 -3.24 103.07 99.89 2nww h GLY 47 Ca -0.00 -0.13 -0.10 0.00 0.00 0.00 0.00 47.33 47.10 2nww h GLY 47 CO 0.05 0.11 -0.32 -0.55 0.00 0.00 0.00 176.54 175.84 2nww h ASP 48 N 0.05 0.51 -0.58 0.19 3.32 -0.61 -3.16 116.42 116.14 2nww h ASP 48 Ca -0.01 -0.57 0.11 0.00 0.02 0.00 0.00 57.03 56.58 2nww h ASP 48 Cb 1.26 -0.15 -0.11 0.00 0.22 0.00 0.00 39.33 40.55 2nww h ASP 48 CO 0.10 0.99 -0.22 0.25 -1.72 0.00 0.00 179.24 178.64 2nww h LEU 49 N 0.06 -0.79 -1.61 1.55 5.85 -1.13 0.31 115.31 119.54 2nww h LEU 49 Ca -0.00 0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.97 2nww h LEU 49 Cb 0.92 0.45 -0.03 0.00 0.37 0.00 0.00 40.66 42.37 2nww h LEU 49 CO 0.07 -0.25 0.33 0.15 -0.34 0.00 0.00 178.44 178.40 2nww h PHE 50 N -0.08 0.48 -0.05 1.25 3.57 -1.60 0.07 116.94 120.59 2nww h PHE 50 Ca 0.27 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.66 2nww h PHE 50 Cb 0.50 -0.16 0.01 0.00 2.79 0.00 0.00 35.95 39.08 2nww h PHE 50 CO -0.54 0.27 -0.44 0.28 -2.23 0.00 0.00 178.31 175.64 2nww h VAL 51 N 0.49 1.43 0.03 1.41 2.07 -1.02 -2.85 116.25 117.81 2nww h VAL 51 Ca 0.21 -1.88 0.02 0.00 0.82 0.00 0.00 66.70 65.87 2nww h VAL 51 Cb 0.22 2.44 -0.04 0.00 -1.52 0.00 0.00 31.29 32.39 2nww h VAL 51 CO -0.06 0.55 -0.21 0.03 0.02 0.00 0.00 177.57 177.90 2nww h ARG 52 N -0.12 -0.33 -0.76 1.57 2.47 0.17 0.41 114.38 117.79 2nww h ARG 52 Ca -0.04 0.02 0.03 0.00 -1.26 0.00 0.00 59.98 58.73 2nww h ARG 52 Cb 1.12 0.08 -0.04 0.00 -1.65 0.00 0.00 29.97 29.47 2nww h ARG 52 CO 0.09 -0.22 0.50 -0.07 0.56 0.00 0.00 179.97 180.83 2nww h LEU 53 N -0.35 0.81 -0.28 3.04 3.38 -1.12 -0.69 115.31 120.10 2nww h LEU 53 Ca 0.05 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 2nww h LEU 53 Cb 0.41 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 2nww h LEU 53 CO -0.17 0.56 -0.29 -0.07 0.09 0.00 0.00 178.44 178.56 2nww h LEU 54 N 0.94 0.74 -0.77 1.67 3.38 -1.18 -3.19 115.31 116.89 2nww h LEU 54 Ca 0.30 -0.47 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 2nww h LEU 54 Cb 0.04 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 2nww h LEU 54 CO -0.09 1.06 0.36 0.11 0.09 0.00 0.00 178.44 179.98 2nww h LYS 55 N 0.43 1.12 -1.13 1.13 1.57 -0.48 -2.97 116.57 116.24 2nww h LYS 55 Ca 0.04 -0.17 0.37 0.00 -1.87 0.00 0.00 60.65 59.02 2nww h LYS 55 Cb 0.86 -0.20 -0.14 0.00 0.08 0.00 0.00 32.23 32.83 2nww h LYS 55 CO 0.07 0.87 0.69 1.98 -0.57 0.00 0.00 179.45 182.50 2nww h MET 56 N 1.09 0.20 0.00 3.15 4.05 -1.12 0.27 114.93 122.57 2nww h MET 56 Ca 0.26 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.67 2nww h MET 56 Cb 0.13 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 30.89 2nww h MET 56 CO -0.03 0.13 -0.46 1.28 0.23 0.00 0.00 176.91 178.06 2nww n LEU 57 N -4.87 0.47 -0.13 3.39 4.77 -1.12 -4.38 117.00 115.14 2nww n LEU 57 Ca 0.34 0.11 -0.10 0.00 -0.03 0.00 0.00 56.01 56.33 2nww n LEU 57 Cb 1.17 -0.27 -0.01 0.00 -2.33 0.00 0.00 43.42 41.98 2nww n LEU 57 CO 0.15 0.07 0.87 0.58 -1.33 0.00 0.00 177.39 177.74 2nww h VAL 58 N 0.00 1.22 0.29 4.08 2.07 -1.02 -1.51 116.25 121.38 2nww h VAL 58 Ca 0.00 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 2nww h VAL 58 Cb 0.55 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 2nww h VAL 58 CO 0.00 0.25 -0.14 0.24 0.02 0.00 0.00 177.57 177.94 2nww h MET 59 N 0.46 -0.38 0.22 1.57 2.86 -1.76 -2.72 114.93 115.18 2nww h MET 59 Ca 0.12 0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 2nww h MET 59 Cb 0.28 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.02 2nww h MET 59 CO -0.00 -0.10 -0.12 -1.35 1.06 0.00 0.00 176.91 176.39 2nww h PRO 60 N -0.63 -0.31 -0.72 -0.22 0.11 -1.81 -2.68 132.00 125.74 2nww h PRO 60 Ca -0.04 0.02 0.10 0.00 0.11 0.00 0.00 66.00 66.19 2nww h PRO 60 Cb 0.45 0.07 -0.05 0.00 0.11 0.00 0.00 31.00 31.58 2nww h PRO 60 CO 0.07 -0.21 0.47 0.97 -0.21 0.00 0.00 178.00 179.09 2nww h ILE 61 N -0.32 0.93 0.09 4.15 2.10 -1.35 0.16 117.51 123.26 2nww h ILE 61 Ca -0.02 -0.21 -0.00 0.00 1.08 0.00 0.00 64.86 65.70 2nww h ILE 61 Cb 0.27 0.27 0.00 0.00 -1.09 0.00 0.00 36.82 36.27 2nww h ILE 61 CO 0.03 0.11 -0.04 0.58 -1.08 0.00 0.00 178.15 177.75 2nww h VAL 62 N 0.61 1.16 -0.31 2.19 2.07 -1.48 -2.33 116.25 118.16 2nww h VAL 62 Ca 0.33 -1.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 2nww h VAL 62 Cb 0.48 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 2nww h VAL 62 CO -0.11 0.30 0.15 0.15 0.02 0.00 0.00 177.57 178.07 2nww h PHE 63 N -0.74 0.45 0.27 1.57 3.57 -1.10 -3.28 116.94 117.67 2nww h PHE 63 Ca -0.01 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 2nww h PHE 63 Cb 0.57 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.18 2nww h PHE 63 CO 0.11 0.40 -0.13 0.00 -2.23 0.00 0.00 178.31 176.46 2nww h ALA 64 N 1.01 -0.99 0.00 2.41 0.00 -0.81 -3.07 119.26 117.81 2nww h ALA 64 Ca 0.11 -0.08 -0.58 0.00 0.00 0.00 0.00 54.91 54.36 2nww h ALA 64 Cb 0.12 0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.07 2nww h ALA 64 CO -0.01 -0.96 2.67 0.43 0.00 0.00 0.00 179.25 181.38 2nww n SER 65 N -3.06 4.04 0.00 0.00 7.64 -0.88 -2.38 113.62 118.99 2nww n SER 65 Ca -0.04 -2.58 0.00 0.00 1.01 0.00 0.00 58.87 57.25 2nww n SER 65 Cb 0.14 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.11 2nww n SER 65 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2nww n LEU 66 N 5.88 0.00 0.01 -3.43 7.94 -1.23 -4.58 117.00 121.58 2nww n LEU 66 Ca 0.51 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 55.29 2nww n LEU 66 Cb 0.30 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.17 2nww n LEU 66 CO 0.90 0.00 0.77 0.58 -1.11 0.00 0.00 177.39 178.52 2nww h VAL 67 N 0.00 1.18 -0.58 1.96 2.07 -1.37 0.33 116.25 119.84 2nww h VAL 67 Ca 0.00 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 66.98 2nww h VAL 67 Cb 0.00 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2nww h VAL 67 CO 0.00 0.15 0.38 0.58 0.02 0.00 0.00 177.57 178.70 2nww h VAL 68 N -0.18 1.14 0.00 2.57 2.07 -1.77 -2.93 116.25 117.16 2nww h VAL 68 Ca 0.01 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 2nww h VAL 68 Cb 0.23 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 2nww h VAL 68 CO 0.00 0.14 -0.01 1.23 0.02 0.00 0.00 177.57 178.95 2nww h GLY 69 N 0.78 0.00 -2.74 2.17 0.00 -1.70 -2.01 103.07 99.58 2nww h GLY 69 Ca 0.22 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.37 2nww h GLY 69 CO -0.05 0.00 0.23 0.00 0.00 0.00 0.00 176.54 176.71 2nww n ALA 70 N -2.38 3.74 -3.14 3.60 0.00 0.12 -3.50 120.51 118.95 2nww n ALA 70 Ca -0.03 -1.23 -0.44 0.00 0.00 0.00 0.00 53.44 51.74 2nww n ALA 70 Cb 0.09 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2nww n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nww n ALA 71 N -0.12 4.15 -3.64 0.00 0.00 -0.76 -4.22 120.51 115.92 2nww n ALA 71 Ca 0.24 -4.48 -0.06 0.00 0.00 0.00 0.00 53.44 49.13 2nww n ALA 71 Cb 0.96 -2.72 -0.07 0.00 0.00 0.00 0.00 19.45 17.61 2nww n ALA 71 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2nww s SER 72 N 1.83 -0.29 -0.72 0.00 0.15 -1.26 -4.88 113.70 108.53 2nww s SER 72 Ca 0.36 0.56 -0.37 0.00 0.70 0.00 0.00 55.95 57.20 2nww s SER 72 Cb -0.06 0.59 -0.19 0.00 -1.71 0.00 0.00 66.02 64.65 2nww s SER 72 CO -0.04 -0.10 2.41 -0.38 1.20 0.00 0.00 173.24 176.34 2nww n ILE 73 N 2.03 0.01 -0.10 6.45 5.41 -1.26 -4.82 119.36 127.08 2nww n ILE 73 Ca -0.12 -0.05 -0.09 0.00 1.00 0.00 0.00 62.75 63.49 2nww n ILE 73 Cb 0.56 -0.67 -0.07 0.00 -0.71 0.00 0.00 39.64 38.76 2nww n ILE 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2nww h SER 74 N 11.02 -1.26 0.00 4.38 0.02 -1.98 -2.18 113.55 123.54 2nww h SER 74 Ca -0.09 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2nww h SER 74 Cb 1.36 0.52 0.00 0.00 0.14 0.00 0.00 62.40 64.42 2nww h SER 74 CO 1.23 -0.26 -0.00 1.55 -1.14 0.00 0.00 176.83 178.20 2nww h PRO 75 N -0.25 0.00 -0.94 3.45 0.14 -1.98 -3.19 132.00 129.23 2nww h PRO 75 Ca 0.05 0.00 0.23 0.00 0.14 0.00 0.00 66.00 66.42 2nww h PRO 75 Cb 0.39 0.00 -0.07 0.00 0.14 0.00 0.00 31.00 31.47 2nww h PRO 75 CO -0.41 0.00 0.63 0.00 0.14 0.00 0.00 178.00 178.36 2nww h ALA 76 N -1.20 2.37 -3.00 -0.56 0.00 -1.98 -0.23 119.26 114.66 2nww h ALA 76 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2nww h ALA 76 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2nww h ALA 76 CO 0.00 -0.67 0.00 0.54 0.00 0.00 0.00 179.25 179.12 2nww n ARG 77 N -4.47 0.00 -0.33 0.00 5.12 -0.82 -3.84 116.66 112.32 2nww n ARG 77 Ca 0.20 0.00 0.18 0.00 -1.93 0.00 0.00 57.85 56.31 2nww n ARG 77 Cb 0.80 0.00 0.35 0.00 -1.16 0.00 0.00 32.46 32.46 2nww n ARG 77 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2nww n LEU 78 N 0.00 0.00 0.41 0.55 4.77 -1.20 0.15 117.00 121.68 2nww n LEU 78 Ca 0.00 1.62 -0.19 0.00 -0.03 0.00 0.00 56.01 57.41 2nww n LEU 78 Cb 0.00 -0.64 -0.09 0.00 -2.33 0.00 0.00 43.42 40.36 2nww n LEU 78 CO 0.00 -1.68 0.61 1.23 -1.33 0.00 0.00 177.39 176.21 2nww h GLY 79 N 0.00 -1.12 1.39 -0.72 0.00 -1.12 0.30 103.07 101.81 2nww h GLY 79 Ca 0.64 0.43 -0.12 0.00 0.00 0.00 0.00 47.33 48.28 2nww h GLY 79 CO -0.86 -0.40 -0.26 0.07 0.00 0.00 0.00 176.54 175.09 2nww h ARG 80 N -1.06 0.69 -0.08 4.80 -0.00 -0.82 0.14 114.38 118.05 2nww h ARG 80 Ca -0.10 -0.29 0.03 0.00 -0.00 0.00 0.00 59.98 59.63 2nww h ARG 80 Cb 0.82 -0.03 -0.04 0.00 -0.00 0.00 0.00 29.97 30.73 2nww h ARG 80 CO 0.15 0.88 -0.15 0.28 -0.00 0.00 0.00 179.97 181.13 2nww h VAL 81 N 0.60 0.62 -0.59 0.08 2.07 -0.30 -0.67 116.25 118.06 2nww h VAL 81 Ca 0.08 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 2nww h VAL 81 Cb 0.75 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 2nww h VAL 81 CO 0.06 0.00 0.21 1.23 0.02 0.00 0.00 177.57 179.09 2nww h GLY 82 N -0.20 0.94 0.67 2.17 0.00 0.14 -0.04 103.07 106.74 2nww h GLY 82 Ca 0.08 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 46.87 2nww h GLY 82 CO -0.20 0.47 -0.10 -2.08 0.00 0.00 0.00 176.54 174.63 2nww h VAL 83 N 0.86 1.36 0.41 4.60 2.07 -0.57 -2.59 116.25 122.39 2nww h VAL 83 Ca 0.20 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.46 2nww h VAL 83 Cb 0.21 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 2nww h VAL 83 CO -0.01 0.35 -0.21 0.11 0.02 0.00 0.00 177.57 177.83 2nww h LYS 84 N -0.17 -0.56 -0.66 1.57 1.57 -0.94 -0.63 116.57 116.75 2nww h LYS 84 Ca 0.02 0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.90 2nww h LYS 84 Cb 0.61 0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.01 2nww h LYS 84 CO 0.02 -0.37 0.44 0.97 -0.57 0.00 0.00 179.45 179.94 2nww h ILE 85 N -0.58 1.01 -0.19 1.86 6.09 -1.09 0.62 117.51 125.23 2nww h ILE 85 Ca -0.05 -0.23 -0.14 0.00 -1.37 0.00 0.00 64.86 63.07 2nww h ILE 85 Cb 0.45 0.28 0.00 0.00 0.47 0.00 0.00 36.82 38.02 2nww h ILE 85 CO 0.08 0.12 -0.42 0.58 -3.07 0.00 0.00 178.15 175.45 2nww h VAL 86 N 0.67 1.33 -0.52 2.19 2.07 -1.29 0.79 116.25 121.50 2nww h VAL 86 Ca 0.29 -1.65 -0.07 0.00 0.82 0.00 0.00 66.70 66.08 2nww h VAL 86 Cb 0.27 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 2nww h VAL 86 CO -0.09 0.51 0.03 0.58 0.02 0.00 0.00 177.57 178.63 2nww h VAL 87 N 0.31 1.24 0.22 2.57 2.07 -0.08 -1.81 116.25 120.77 2nww h VAL 87 Ca 0.00 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 2nww h VAL 87 Cb 1.02 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 2nww h VAL 87 CO 0.09 0.35 -0.11 0.22 0.02 0.00 0.00 177.57 178.15 2nww h TYR 88 N 0.79 -0.28 -0.99 1.57 3.20 0.31 -2.92 116.97 118.65 2nww h TYR 88 Ca 0.16 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.07 2nww h TYR 88 Cb 0.43 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.73 2nww h TYR 88 CO 0.02 -0.16 0.64 1.88 -1.64 0.00 0.00 178.16 178.91 2nww h TYR 89 N -0.32 1.19 -0.18 -3.82 0.99 -0.53 -1.58 116.97 112.72 2nww h TYR 89 Ca -0.03 0.03 -0.16 0.00 2.00 0.00 0.00 58.73 60.57 2nww h TYR 89 Cb 0.24 -0.39 -0.01 0.00 1.00 0.00 0.00 36.73 37.57 2nww h TYR 89 CO -0.06 0.65 -0.55 -0.07 -0.00 0.00 0.00 178.16 178.13 2nww h LEU 90 N 1.20 0.61 0.00 3.88 4.07 -1.34 -2.41 115.31 121.32 2nww h LEU 90 Ca 0.41 -0.33 -0.17 0.00 0.08 0.00 0.00 57.88 57.87 2nww h LEU 90 Cb 0.09 -0.18 -0.03 0.00 1.08 0.00 0.00 40.66 41.62 2nww h LEU 90 CO -0.15 1.04 -0.87 -0.07 -1.08 0.00 0.00 178.44 177.31 2nww h LEU 91 N 0.42 0.00 -0.41 1.67 3.38 -1.27 -2.41 115.31 116.70 2nww h LEU 91 Ca 0.01 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.80 2nww h LEU 91 Cb 1.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 2nww h LEU 91 CO 0.10 0.78 -0.68 0.71 0.09 0.00 0.00 178.44 179.44 2nww h THR 92 N 0.00 1.35 0.00 0.22 1.35 -1.29 -2.35 112.91 112.19 2nww h THR 92 Ca -0.03 -2.02 -0.07 0.00 -0.55 0.00 0.00 66.41 63.73 2nww h THR 92 Cb 1.62 2.00 -0.01 0.00 -1.73 0.00 0.00 68.15 70.03 2nww h THR 92 CO 0.10 0.62 -0.35 0.28 -0.25 0.00 0.00 175.52 175.91 2nww h SER 93 N 0.35 0.00 -0.01 5.36 0.02 -1.44 -1.70 113.55 116.13 2nww h SER 93 Ca -0.02 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.70 2nww h SER 93 Cb 1.26 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.81 2nww h SER 93 CO 0.12 0.35 -0.83 0.00 -1.14 0.00 0.00 176.83 175.33 2nww h ALA 94 N 1.65 0.33 -0.31 3.77 0.00 -1.28 -3.09 119.26 120.32 2nww h ALA 94 Ca -0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 54.91 54.17 2nww h ALA 94 Cb 0.83 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2nww h ALA 94 CO 0.05 0.71 -0.21 0.74 0.00 0.00 0.00 179.25 180.53 2nww h PHE 95 N 0.45 0.82 -0.19 0.00 0.05 -1.28 -3.06 116.94 113.73 2nww h PHE 95 Ca -0.07 -0.22 0.02 0.00 3.82 0.00 0.00 57.97 61.53 2nww h PHE 95 Cb 1.46 -0.18 -0.02 0.00 2.00 0.00 0.00 35.95 39.20 2nww h PHE 95 CO 0.08 0.95 0.04 0.00 -0.18 0.00 0.00 178.31 179.20 2nww h ALA 96 N 0.74 0.20 -0.60 2.45 0.00 -1.37 0.28 119.26 120.96 2nww h ALA 96 Ca 0.06 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2nww h ALA 96 Cb 0.76 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2nww h ALA 96 CO 0.06 -0.39 0.09 -0.24 0.00 0.00 0.00 179.25 178.77 2nww h VAL 97 N 0.12 1.26 -0.07 0.00 3.04 -1.64 -1.13 116.25 117.82 2nww h VAL 97 Ca 0.09 -1.01 -0.11 0.00 -1.01 0.00 0.00 66.70 64.65 2nww h VAL 97 Cb 0.08 0.74 -0.01 0.00 -2.01 0.00 0.00 31.29 30.08 2nww h VAL 97 CO -0.11 0.37 -0.46 0.74 -1.01 0.00 0.00 177.57 177.10 2nww h THR 98 N 0.91 1.33 0.00 3.17 2.02 -1.35 -0.04 112.91 118.96 2nww h THR 98 Ca 0.18 -1.63 -0.12 0.00 0.77 0.00 0.00 66.41 65.61 2nww h THR 98 Cb 0.44 1.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.62 2nww h THR 98 CO 0.01 0.48 -0.59 0.25 0.37 0.00 0.00 175.52 176.04 2nww h LEU 99 N 0.15 0.00 -0.43 2.58 5.85 -0.30 -1.29 115.31 121.88 2nww h LEU 99 Ca 0.01 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.56 2nww h LEU 99 Cb 0.87 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.90 2nww h LEU 99 CO 0.07 0.59 -0.51 1.23 -0.34 0.00 0.00 178.44 179.48 2nww h GLY 100 N 1.94 0.81 0.83 3.75 0.00 -0.48 -0.52 103.07 109.40 2nww h GLY 100 Ca -0.01 -0.92 -0.00 0.00 0.00 0.00 0.00 47.33 46.41 2nww h GLY 100 CO 0.08 0.82 0.01 -2.22 0.00 0.00 0.00 176.54 175.23 2nww h ILE 101 N 0.58 1.14 -0.13 2.60 1.08 -0.94 -1.55 117.51 120.29 2nww h ILE 101 Ca 0.02 -0.41 -0.02 0.00 -0.39 0.00 0.00 64.86 64.06 2nww h ILE 101 Cb 1.09 1.39 -0.01 0.00 -3.07 0.00 0.00 36.82 36.22 2nww h ILE 101 CO 0.11 0.11 -0.00 0.40 -0.69 0.00 0.00 178.15 178.07 2nww h ILE 102 N -0.15 1.09 0.00 -0.67 5.03 -1.21 -0.91 117.51 120.70 2nww h ILE 102 Ca 0.00 -0.34 0.00 0.00 -0.12 0.00 0.00 64.86 64.40 2nww h ILE 102 Cb 0.17 1.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.96 2nww h ILE 102 CO -0.00 0.11 -0.16 -0.03 -0.68 0.00 0.00 178.15 177.40 2nww h MET 103 N 0.18 0.00 0.00 2.37 4.05 -0.99 -2.29 114.93 118.25 2nww h MET 103 Ca 0.04 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 2nww h MET 103 Cb 0.13 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.93 2nww h MET 103 CO 0.00 0.00 -0.72 0.00 0.23 0.00 0.00 176.91 176.43 2nww h ALA 104 N 2.07 0.54 0.00 0.39 0.00 -0.16 -2.62 119.26 119.48 2nww h ALA 104 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2nww h ALA 104 Cb 0.97 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2nww h ALA 104 CO 0.00 0.00 -1.74 0.54 0.00 0.00 0.00 179.25 178.05 2nww n ARG 105 N -2.16 0.65 -0.02 0.00 1.74 -0.52 -4.24 116.66 112.10 2nww n ARG 105 Ca 0.03 -0.02 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 2nww n ARG 105 Cb 0.45 -1.64 -0.10 0.00 -1.02 0.00 0.00 32.46 30.15 2nww n ARG 105 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2nww h LEU 106 N 0.00 0.32-10.72 0.55 7.12 -1.48 -3.45 115.31 107.66 2nww h LEU 106 Ca -0.12 -0.71 -0.46 0.00 0.13 0.00 0.00 57.88 56.72 2nww h LEU 106 Cb 1.31 -0.10 0.10 0.00 -0.53 0.00 0.00 40.66 41.44 2nww h LEU 106 CO 0.01 0.99 0.17 -0.36 -0.13 0.00 0.00 178.44 179.12 2nww s PHE 107 N -3.38 1.67 -0.53 1.25 0.40 -0.99 -5.09 117.98 111.31 2nww s PHE 107 Ca -0.15 -0.13 0.04 0.00 -0.60 0.00 0.00 56.93 56.09 2nww s PHE 107 Cb 0.02 -3.20 0.17 0.00 0.51 0.00 0.00 43.02 40.52 2nww s PHE 107 CO 0.76 -1.85 0.40 -0.80 0.70 0.00 0.00 175.22 174.43 2nww s ASN 108 N -4.75 2.88 -0.38 1.36 0.01 -1.26 -4.71 114.94 108.09 2nww s ASN 108 Ca 0.67 -3.38 -0.29 0.00 -0.71 0.00 0.00 52.86 49.15 2nww s ASN 108 Cb -0.05 -0.94 0.02 0.00 0.41 0.00 0.00 41.25 40.68 2nww s ASN 108 CO 0.46 -0.14 1.17 -2.84 -1.51 0.00 0.00 177.10 174.24 2nww s PRO 109 N -0.56 3.87 0.00 -0.60 0.02 -1.26 -3.80 135.00 132.67 2nww s PRO 109 Ca 0.29 0.90 0.00 0.00 0.02 0.00 0.00 61.00 62.22 2nww s PRO 109 Cb -0.00 -3.85 0.00 0.00 0.02 0.00 0.00 34.50 30.67 2nww s PRO 109 CO -0.18 -1.18 0.00 0.41 -0.33 0.00 0.00 177.00 175.72 2nww n GLY 110 N 4.42 0.76 0.22 0.52 0.00 -1.26 -4.18 105.19 105.67 2nww n GLY 110 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 2nww n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nww h ALA 111 N 0.00 0.55 -2.03 4.61 0.00 -1.84 -3.27 119.26 117.28 2nww h ALA 111 Ca 0.00 -0.54 -0.58 0.00 0.00 0.00 0.00 54.91 53.79 2nww h ALA 111 Cb 0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 2nww h ALA 111 CO 0.00 0.70 0.79 0.20 0.00 0.00 0.00 179.25 180.93 2nww s GLY 112 N -4.10 1.62 -1.44 0.00 0.00 -1.26 -4.95 107.32 97.20 2nww s GLY 112 Ca -0.09 -0.00 -0.09 0.00 0.00 0.00 0.00 44.72 44.54 2nww s GLY 112 CO 0.87 2.19 2.43 1.39 0.00 0.00 0.00 173.10 179.98 2nww n ILE 113 N 5.64 4.42 0.00 0.90 5.41 -1.26 -4.71 119.36 129.75 2nww n ILE 113 Ca 0.11 -3.53 0.00 0.00 1.00 0.00 0.00 62.75 60.33 2nww n ILE 113 Cb 0.47 -2.41 0.00 0.00 -0.71 0.00 0.00 39.64 36.99 2nww n ILE 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2nww n HIS 114 N 3.61 0.00 -2.57 1.39 1.44 -1.26 -5.07 115.22 112.76 2nww n HIS 114 Ca 0.61 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 56.27 2nww n HIS 114 Cb 0.29 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.37 2nww n HIS 114 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2nww n LEU 115 N 0.00 -6.16 -4.77 2.39 4.32 -1.26 -4.96 117.00 106.56 2nww n LEU 115 Ca 0.00 2.40 -0.39 0.00 -0.02 0.00 0.00 56.01 57.99 2nww n LEU 115 Cb 0.00 -3.23 -0.01 0.00 -1.62 0.00 0.00 43.42 38.56 2nww n LEU 115 CO 0.00 -3.83 0.90 0.00 -1.22 0.00 0.00 177.39 173.24 2nww s ALA 116 N -0.63 3.24 -0.16 -1.18 0.00 -1.26 -4.95 121.76 116.83 2nww s ALA 116 Ca -0.23 1.10 -0.09 0.00 0.00 0.00 0.00 51.96 52.74 2nww s ALA 116 Cb 0.02 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.66 2nww s ALA 116 CO 0.62 -0.64 0.14 0.08 0.00 0.00 0.00 175.76 175.96 2nww s VAL 117 N -1.31 5.45 0.00 0.00 1.01 -1.26 -4.90 120.40 119.39 2nww s VAL 117 Ca 0.55 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.74 2nww s VAL 117 Cb -0.35 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.59 2nww s VAL 117 CO 0.44 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.68 2nww n GLY 118 N 2.77 3.08 0.00 4.51 0.00 -1.26 -5.13 105.19 109.15 2nww n GLY 118 Ca -0.18 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.03 2nww n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nww n GLY 119 N 0.00 0.43 0.00 -0.02 0.00 -1.26 -5.10 105.19 99.24 2nww n GLY 119 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2nww n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nww n GLN 120 N 0.00 0.00 -1.81 1.61 -0.00 -1.26 -4.89 117.38 111.03 2nww n GLN 120 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.00 56.68 2nww n GLN 120 Cb 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 30.24 30.28 2nww n GLN 120 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2nww s GLN 121 N 1.45 3.00 0.00 2.61 1.11 -1.26 -4.97 119.66 121.60 2nww s GLN 121 Ca 0.00 1.22 0.24 0.00 0.01 0.00 0.00 55.36 56.83 2nww s GLN 121 Cb 0.00 -1.99 0.34 0.00 -1.01 0.00 0.00 33.01 30.35 2nww s GLN 121 CO 0.00 -1.07 1.35 1.97 0.01 0.00 0.00 175.29 177.55 2nww n PHE 122 N -2.47 0.29 -1.98 0.91 -1.74 -1.26 -4.97 117.46 106.25 2nww n PHE 122 Ca 0.09 -0.14 0.00 0.00 -0.56 0.00 0.00 57.45 56.84 2nww n PHE 122 Cb 0.53 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.53 2nww n PHE 122 CO 0.00 0.00 0.00 0.94 -0.56 0.00 0.00 176.76 177.14 2nww n GLN 123 N 1.43 -3.93 -1.12 3.97 -0.06 -1.26 -4.99 117.38 111.42 2nww n GLN 123 Ca 0.17 2.97 -0.34 0.00 -2.00 0.00 0.00 57.00 57.80 2nww n GLN 123 Cb 0.60 -3.63 0.12 0.00 -4.06 0.00 0.00 30.24 23.28 2nww n GLN 123 CO 0.00 0.00 0.00 -2.30 -0.20 0.00 0.00 177.06 174.56 2nww n PRO 124 N 1.38 0.20 -1.90 3.69 -0.02 -1.26 -4.93 135.00 132.15 2nww n PRO 124 Ca 0.00 0.14 -0.42 0.00 -2.02 0.00 0.00 63.50 61.21 2nww n PRO 124 Cb 0.00 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.06 2nww n PRO 124 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2nww s HIS 125 N -2.10 2.92 0.41 6.00 -3.43 -1.26 -4.96 115.29 112.87 2nww s HIS 125 Ca 0.73 0.84 -0.26 0.00 -0.80 0.00 0.00 55.06 55.56 2nww s HIS 125 Cb -0.29 -3.95 -0.09 0.00 -1.43 0.00 0.00 32.58 26.82 2nww s HIS 125 CO 0.51 -3.21 1.38 -0.65 -2.00 0.00 0.00 174.74 170.76 2nww s GLN 126 N -0.11 3.95 0.24 -0.38 -1.52 -1.26 -4.89 119.66 115.69 2nww s GLN 126 Ca 0.63 2.32 -0.31 0.00 -1.95 0.00 0.00 55.36 56.05 2nww s GLN 126 Cb -0.45 -2.80 -0.13 0.00 -0.22 0.00 0.00 33.01 29.42 2nww s GLN 126 CO 0.43 -0.57 1.49 0.00 -0.25 0.00 0.00 175.29 176.38 2nww n ALA 127 N 0.16 1.56 -1.74 6.09 0.00 -1.26 -4.93 120.51 120.39 2nww n ALA 127 Ca 0.03 0.41 -0.38 0.00 0.00 0.00 0.00 53.44 53.50 2nww n ALA 127 Cb 0.42 -2.34 0.06 0.00 0.00 0.00 0.00 19.45 17.59 2nww n ALA 127 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2nww n PRO 128 N 2.32 1.39 -1.53 0.00 -0.02 -1.26 -4.87 135.00 131.02 2nww n PRO 128 Ca 0.12 0.53 -0.54 0.00 -2.02 0.00 0.00 63.50 61.58 2nww n PRO 128 Cb 0.32 -2.56 -0.06 0.00 -0.02 0.00 0.00 33.50 31.19 2nww n PRO 128 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2nww n PRO 129 N -1.50 0.52 -0.29 0.52 -0.01 -1.26 -4.74 135.00 128.24 2nww n PRO 129 Ca 0.13 0.19 0.17 0.00 -0.01 0.00 0.00 63.50 63.98 2nww n PRO 129 Cb 0.46 -1.68 0.43 0.00 -0.01 0.00 0.00 33.50 32.71 2nww n PRO 129 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 175.50 176.74 2nww h LEU 130 N 3.30 0.57 -1.53 2.45 5.85 -1.91 0.14 115.31 124.18 2nww h LEU 130 Ca -0.47 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.27 2nww h LEU 130 Cb 1.39 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.37 2nww h LEU 130 CO 0.69 0.21 -0.21 -0.37 -0.34 0.00 0.00 178.44 178.42 2nww h VAL 131 N 0.56 0.72 -0.54 1.05 -1.51 -1.99 0.29 116.25 114.83 2nww h VAL 131 Ca 0.52 -0.88 0.00 0.00 -1.23 0.00 0.00 66.70 65.11 2nww h VAL 131 Cb 1.07 1.55 0.00 0.00 -2.13 0.00 0.00 31.29 31.78 2nww h VAL 131 CO -0.26 0.21 0.00 1.41 -1.23 0.00 0.00 177.57 177.70 2nww n HIS 132 N -3.66 1.21 -0.08 5.19 8.25 0.47 -2.08 115.22 124.52 2nww n HIS 132 Ca -0.01 -0.48 -0.12 0.00 -0.26 0.00 0.00 57.72 56.84 2nww n HIS 132 Cb 0.33 -0.20 -0.07 0.00 1.12 0.00 0.00 29.99 31.17 2nww n HIS 132 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2nww n ILE 133 N 0.91 0.91 -0.01 1.59 5.41 -0.48 -4.32 119.36 123.38 2nww n ILE 133 Ca 0.21 -0.33 -0.11 0.00 1.00 0.00 0.00 62.75 63.53 2nww n ILE 133 Cb 0.74 -1.18 0.03 0.00 -0.71 0.00 0.00 39.64 38.52 2nww n ILE 133 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2nww h LEU 134 N -0.11 0.68 -1.42 1.39 3.38 -1.09 -2.66 115.31 115.49 2nww h LEU 134 Ca -0.37 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.20 2nww h LEU 134 Cb 1.52 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 2nww h LEU 134 CO -0.09 1.10 -0.17 -0.07 0.09 0.00 0.00 178.44 179.30 2nww h LEU 135 N 0.46 0.00 0.00 1.67 3.38 -1.66 -3.01 115.31 116.15 2nww h LEU 135 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2nww h LEU 135 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2nww h LEU 135 CO 0.11 0.17 0.00 0.47 0.09 0.00 0.00 178.44 179.28 2nww n ASP 136 N -3.41 0.00 0.17 -0.43 9.92 -1.01 -2.64 116.55 119.15 2nww n ASP 136 Ca -0.00 0.40 0.04 0.00 -0.53 0.00 0.00 54.79 54.70 2nww n ASP 136 Cb 0.36 -0.47 0.27 0.00 -0.64 0.00 0.00 41.12 40.64 2nww n ASP 136 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 2nww h ILE 137 N 0.00 0.93 -3.63 0.53 2.04 -1.46 -3.39 117.51 112.53 2nww h ILE 137 Ca 0.00 -1.71 -0.60 0.00 1.00 0.00 0.00 64.86 63.54 2nww h ILE 137 Cb 0.44 2.04 -0.11 0.00 -0.74 0.00 0.00 36.82 38.45 2nww h ILE 137 CO 0.00 0.42 0.54 -0.69 0.00 0.00 0.00 178.15 178.41 2nww s VAL 138 N -3.49 4.53 0.76 1.67 1.01 -1.08 -3.98 120.40 119.82 2nww s VAL 138 Ca 0.01 0.75 -0.11 0.00 0.00 0.00 0.00 61.98 62.63 2nww s VAL 138 Cb 0.11 -4.39 0.04 0.00 0.00 0.00 0.00 36.38 32.14 2nww s VAL 138 CO 0.70 -0.76 1.09 -2.16 0.00 0.00 0.00 175.10 173.97 2nww s PRO 139 N 3.61 2.44 -0.21 2.72 0.04 -1.26 -5.01 135.00 137.34 2nww s PRO 139 Ca 0.36 0.67 -0.08 0.00 0.04 0.00 0.00 61.00 61.98 2nww s PRO 139 Cb -0.11 -1.96 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 2nww s PRO 139 CO 0.24 -1.38 -0.25 2.41 0.04 0.00 0.00 177.00 178.07 2nww n THR 140 N -3.27 1.14 -3.77 1.26 -1.04 -1.26 -4.78 114.28 102.55 2nww n THR 140 Ca 0.07 -0.32 -0.36 0.00 -2.04 0.00 0.00 64.05 61.40 2nww n THR 140 Cb 0.56 -1.67 -0.11 0.00 -1.82 0.00 0.00 70.33 67.29 2nww n THR 140 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2nww s ASN 141 N -6.69 5.18 0.62 8.00 3.84 -1.26 -4.96 114.94 119.67 2nww s ASN 141 Ca -0.29 -2.39 0.39 0.00 0.21 0.00 0.00 52.86 50.78 2nww s ASN 141 Cb 0.10 -1.82 2.03 0.00 -0.55 0.00 0.00 41.25 41.02 2nww s ASN 141 CO 0.38 -0.46 2.24 1.55 -2.79 0.00 0.00 177.10 178.03 2nww h PRO 142 N 7.57 0.00 -0.32 0.43 0.13 -1.97 0.32 132.00 138.17 2nww h PRO 142 Ca -0.08 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.89 2nww h PRO 142 Cb 1.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 2nww h PRO 142 CO 0.70 0.01 -0.43 0.74 -0.23 0.00 0.00 178.00 178.79 2nww h PHE 143 N 0.00 1.04 -0.86 1.56 0.05 -2.00 -3.06 116.94 113.68 2nww h PHE 143 Ca -0.00 -0.34 -0.02 0.00 3.82 0.00 0.00 57.97 61.43 2nww h PHE 143 Cb 0.16 -0.21 -0.04 0.00 2.00 0.00 0.00 35.95 37.86 2nww h PHE 143 CO 0.00 1.15 0.46 0.78 -0.18 0.00 0.00 178.31 180.52 2nww h GLY 144 N 0.63 1.29 0.11 -1.45 0.00 -0.84 0.81 103.07 103.63 2nww h GLY 144 Ca 0.04 -0.59 0.08 0.00 0.00 0.00 0.00 47.33 46.85 2nww h GLY 144 CO 0.10 0.57 -0.15 0.00 0.00 0.00 0.00 176.54 177.06 2nww h ALA 145 N 1.25 0.17 -0.80 3.60 0.00 -1.19 -1.13 119.26 121.15 2nww h ALA 145 Ca 0.30 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.32 2nww h ALA 145 Cb 0.05 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2nww h ALA 145 CO -0.05 -0.51 0.35 -0.07 0.00 0.00 0.00 179.25 178.97 2nww h LEU 146 N -0.07 1.08 -1.07 0.00 3.38 -1.34 -3.21 115.31 114.08 2nww h LEU 146 Ca 0.19 -0.16 0.09 0.00 0.09 0.00 0.00 57.88 58.10 2nww h LEU 146 Cb 0.37 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.77 2nww h LEU 146 CO -0.44 0.94 0.62 0.00 0.09 0.00 0.00 178.44 179.65 2nww h ALA 147 N 1.18 1.52 -3.13 1.53 0.00 0.44 -3.37 119.26 117.43 2nww h ALA 147 Ca 0.27 -0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.68 2nww h ALA 147 Cb 0.17 -0.24 -0.40 0.00 0.00 0.00 0.00 17.79 17.32 2nww h ALA 147 CO -0.03 0.29 -0.76 0.54 0.00 0.00 0.00 179.25 179.29 2nww s ASN 148 N -5.84 2.82 0.14 0.00 2.20 -1.01 -5.09 114.94 108.16 2nww s ASN 148 Ca -0.12 -0.84 0.00 0.00 -0.94 0.00 0.00 52.86 50.97 2nww s ASN 148 Cb 0.21 -0.44 0.00 0.00 -2.00 0.00 0.00 41.25 39.02 2nww s ASN 148 CO 0.81 -0.34 0.00 0.61 -2.94 0.00 0.00 177.10 175.23 2nww n GLY 149 N 5.15 2.12 3.34 0.45 0.00 -1.26 -4.81 105.19 110.18 2nww n GLY 149 Ca -0.07 0.40 -0.12 0.00 0.00 0.00 0.00 46.02 46.23 2nww n GLY 149 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2nww n GLN 150 N 9.58 -1.46 -0.20 1.61 6.02 -1.26 -4.57 117.38 127.11 2nww n GLN 150 Ca 0.00 1.10 -0.09 0.00 -0.01 0.00 0.00 57.00 58.00 2nww n GLN 150 Cb 0.00 -4.76 0.02 0.00 1.02 0.00 0.00 30.24 26.52 2nww n GLN 150 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2nww h VAL 151 N -0.25 1.26 0.26 5.09 2.07 -1.90 -3.10 116.25 119.68 2nww h VAL 151 Ca -0.31 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.10 2nww h VAL 151 Cb 1.18 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 2nww h VAL 151 CO 0.36 0.39 -0.13 -0.07 0.02 0.00 0.00 177.57 178.15 2nww h LEU 152 N 0.86 -0.30 -1.47 2.57 4.07 -1.91 -1.38 115.31 117.75 2nww h LEU 152 Ca 0.16 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 58.06 2nww h LEU 152 Cb 0.52 0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.33 2nww h LEU 152 CO 0.03 -0.19 -0.25 -0.65 -1.08 0.00 0.00 178.44 176.29 2nww h PRO 153 N -0.38 0.00 -0.09 1.13 0.11 -1.69 -2.70 132.00 128.38 2nww h PRO 153 Ca -0.04 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 2nww h PRO 153 Cb 0.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.40 2nww h PRO 153 CO 0.06 0.25 0.03 1.15 -0.21 0.00 0.00 178.00 179.28 2nww h THR 154 N 0.00 1.17 -0.70 -1.15 2.02 -1.43 -2.23 112.91 110.59 2nww h THR 154 Ca -0.00 -0.50 0.11 0.00 0.77 0.00 0.00 66.41 66.79 2nww h THR 154 Cb 0.56 1.33 -0.08 0.00 -1.74 0.00 0.00 68.15 68.22 2nww h THR 154 CO 0.03 0.15 0.29 0.40 0.37 0.00 0.00 175.52 176.76 2nww h ILE 155 N -0.03 0.74 -0.73 3.11 2.04 -1.08 0.53 117.51 122.09 2nww h ILE 155 Ca 0.03 -0.16 -0.05 0.00 1.00 0.00 0.00 64.86 65.68 2nww h ILE 155 Cb 0.20 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.48 2nww h ILE 155 CO -0.00 0.09 0.25 0.15 0.00 0.00 0.00 178.15 178.64 2nww h PHE 156 N 0.47 1.14 -0.08 1.37 3.57 -1.41 -2.67 116.94 119.33 2nww h PHE 156 Ca 0.36 -0.10 -0.11 0.00 3.53 0.00 0.00 57.97 61.66 2nww h PHE 156 Cb 0.48 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 38.89 2nww h PHE 156 CO -0.15 0.89 -0.36 0.35 -2.23 0.00 0.00 178.31 176.80 2nww h PHE 157 N 1.08 0.52 -0.54 0.41 3.57 -0.69 -1.93 116.94 119.37 2nww h PHE 157 Ca 0.24 -0.23 0.07 0.00 3.53 0.00 0.00 57.97 61.58 2nww h PHE 157 Cb 0.26 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.86 2nww h PHE 157 CO 0.02 0.97 0.22 0.00 -2.23 0.00 0.00 178.31 177.29 2nww h ALA 158 N 0.45 0.68 -0.37 2.41 0.00 -0.96 0.39 119.26 121.85 2nww h ALA 158 Ca -0.02 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2nww h ALA 158 Cb 1.01 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2nww h ALA 158 CO 0.08 -0.16 -0.03 0.82 0.00 0.00 0.00 179.25 179.95 2nww h ILE 159 N 0.42 1.27 0.00 0.00 2.04 -1.51 0.40 117.51 120.13 2nww h ILE 159 Ca 0.25 -1.06 -0.07 0.00 1.00 0.00 0.00 64.86 64.98 2nww h ILE 159 Cb 0.25 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 2nww h ILE 159 CO -0.23 0.35 -0.34 0.40 0.00 0.00 0.00 178.15 178.33 2nww h ILE 160 N 0.49 1.18 0.03 -0.67 5.03 -0.98 -0.38 117.51 122.22 2nww h ILE 160 Ca 0.10 -1.19 -0.27 0.00 -0.12 0.00 0.00 64.86 63.37 2nww h ILE 160 Cb 0.52 1.65 0.02 0.00 -3.03 0.00 0.00 36.82 35.99 2nww h ILE 160 CO 0.03 0.33 -1.09 0.25 -0.68 0.00 0.00 178.15 176.99 2nww h LEU 161 N 0.00 0.88 -1.03 1.44 5.85 0.07 -2.95 115.31 119.57 2nww h LEU 161 Ca -0.00 -0.73 -0.10 0.00 0.84 0.00 0.00 57.88 57.89 2nww h LEU 161 Cb 0.63 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2nww h LEU 161 CO 0.04 1.53 -0.48 1.23 -0.34 0.00 0.00 178.44 180.43 2nww h GLY 162 N 0.46 0.00 1.37 3.75 0.00 0.08 0.31 103.07 109.04 2nww h GLY 162 Ca -0.14 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.98 2nww h GLY 162 CO 0.21 0.00 -0.77 -2.22 0.00 0.00 0.00 176.54 173.76 2nww h ILE 163 N 0.00 1.32 -0.26 2.60 5.03 -1.16 -3.06 117.51 121.98 2nww h ILE 163 Ca -0.00 -2.06 -0.11 0.00 -0.12 0.00 0.00 64.86 62.56 2nww h ILE 163 Cb 0.86 2.06 -0.01 0.00 -3.03 0.00 0.00 36.82 36.70 2nww h ILE 163 CO 0.06 0.64 -0.32 0.00 -0.68 0.00 0.00 178.15 177.85 2nww h ALA 164 N 0.73 0.97 0.00 1.87 0.00 -1.24 -2.49 119.26 119.10 2nww h ALA 164 Ca -0.05 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 2nww h ALA 164 Cb 1.37 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2nww h ALA 164 CO 0.15 0.61 -0.21 0.97 0.00 0.00 0.00 179.25 180.76 2nww h ILE 165 N 0.46 0.38 0.05 0.00 2.10 -1.00 -2.14 117.51 117.35 2nww h ILE 165 Ca 0.06 -1.46 -0.14 0.00 1.08 0.00 0.00 64.86 64.40 2nww h ILE 165 Cb 0.78 2.12 0.01 0.00 -1.09 0.00 0.00 36.82 38.65 2nww h ILE 165 CO 0.06 0.21 -0.58 0.74 -1.08 0.00 0.00 178.15 177.50 2nww h THR 166 N 0.00 1.50 0.00 2.19 2.02 -1.42 -3.01 112.91 114.19 2nww h THR 166 Ca -0.00 -2.23 -0.02 0.00 0.77 0.00 0.00 66.41 64.93 2nww h THR 166 Cb 1.11 2.88 -0.00 0.00 -1.74 0.00 0.00 68.15 70.39 2nww h THR 166 CO 0.03 0.63 -0.10 1.88 0.37 0.00 0.00 175.52 178.33 2nww h TYR 167 N -0.31 0.00 -0.03 3.16 -1.99 -1.43 -2.66 116.97 113.71 2nww h TYR 167 Ca -0.09 0.00 -0.22 0.00 2.00 0.00 0.00 58.73 60.42 2nww h TYR 167 Cb 1.36 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.09 2nww h TYR 167 CO 0.18 0.10 -0.90 1.25 -0.00 0.00 0.00 178.16 178.79 2nww h LEU 168 N 0.00 0.58 -1.27 3.88 5.85 -1.40 -3.27 115.31 119.67 2nww h LEU 168 Ca -0.00 -0.44 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 2nww h LEU 168 Cb 0.29 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 2nww h LEU 168 CO 0.01 1.23 -0.13 0.24 -0.34 0.00 0.00 178.44 179.46 2nww h MET 169 N 0.27 0.00 -0.64 1.25 2.86 -1.33 -3.01 114.93 114.34 2nww h MET 169 Ca -0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 2nww h MET 169 Cb 1.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.18 2nww h MET 169 CO 0.16 0.13 0.00 0.09 1.06 0.00 0.00 176.91 178.35 2nww n ASN 170 N -3.28 3.06 -4.79 1.22 3.02 -1.22 -4.80 115.26 108.48 2nww n ASN 170 Ca 0.00 -2.32 -0.36 0.00 -0.03 0.00 0.00 54.58 51.87 2nww n ASN 170 Cb 0.37 -0.48 -0.05 0.00 -0.61 0.00 0.00 39.78 39.01 2nww n ASN 170 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2nww s SER 171 N -0.63 6.93 0.09 6.41 1.04 -1.14 -4.94 113.70 121.45 2nww s SER 171 Ca 0.29 1.92 0.20 0.00 0.48 0.00 0.00 55.95 58.84 2nww s SER 171 Cb 0.19 -2.58 0.82 0.00 0.10 0.00 0.00 66.02 64.56 2nww s SER 171 CO 0.12 -0.37 1.62 -1.84 0.98 0.00 0.00 173.24 173.75 2nww n GLU 172 N -0.02 0.07 -3.42 4.02 0.00 -1.26 -4.57 120.64 115.45 2nww n GLU 172 Ca 0.05 0.26 -0.38 0.00 0.00 0.00 0.00 57.16 57.09 2nww n GLU 172 Cb 0.51 -1.62 -0.08 0.00 0.00 0.00 0.00 31.44 30.24 2nww n GLU 172 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 2nww s ASN 173 N -3.45 6.39 -0.61 -1.84 2.47 -1.26 -4.98 114.94 111.65 2nww s ASN 173 Ca 0.07 0.46 -0.00 0.00 0.42 0.00 0.00 52.86 53.81 2nww s ASN 173 Cb 0.11 -2.21 0.51 0.00 -1.45 0.00 0.00 41.25 38.21 2nww s ASN 173 CO 0.36 -0.06 2.01 1.21 -3.72 0.00 0.00 177.10 176.89 2nww n GLU 174 N 4.47 2.56 -0.03 0.43 4.07 -1.26 -2.64 120.64 128.24 2nww n GLU 174 Ca -0.09 -3.20 -0.04 0.00 -0.06 0.00 0.00 57.16 53.77 2nww n GLU 174 Cb 0.51 -2.26 -0.05 0.00 -0.06 0.00 0.00 31.44 29.58 2nww n GLU 174 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2nww n LYS 175 N -0.98 2.67 0.06 5.31 5.02 -1.26 -4.28 118.16 124.70 2nww n LYS 175 Ca 0.62 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.74 2nww n LYS 175 Cb 0.95 -1.17 -0.08 0.00 -0.02 0.00 0.00 35.03 34.71 2nww n LYS 175 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 2nww h VAL 176 N 0.00 1.34 0.00 -0.18 -1.51 -1.91 -2.18 116.25 111.81 2nww h VAL 176 Ca -0.18 -2.35 -0.15 0.00 -1.23 0.00 0.00 66.70 62.79 2nww h VAL 176 Cb 1.40 2.41 -0.02 0.00 -2.13 0.00 0.00 31.29 32.95 2nww h VAL 176 CO 0.01 0.72 -0.71 0.08 -1.23 0.00 0.00 177.57 176.43 2nww h ARG 177 N 0.31 0.00 -0.35 5.19 -0.00 -1.67 -2.24 114.38 115.62 2nww h ARG 177 Ca -0.11 0.00 -0.14 0.00 -0.00 0.00 0.00 59.98 59.74 2nww h ARG 177 Cb 1.65 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.61 2nww h ARG 177 CO 0.19 0.71 -0.33 1.57 -0.00 0.00 0.00 179.97 182.10 2nww h LYS 178 N 0.00 0.79 0.00 0.08 5.09 -1.73 -1.71 116.57 119.08 2nww h LYS 178 Ca -0.01 -0.37 -0.19 0.00 0.09 0.00 0.00 60.65 60.17 2nww h LYS 178 Cb 1.35 -0.01 -0.03 0.00 0.10 0.00 0.00 32.23 33.65 2nww h LYS 178 CO 0.09 1.00 -0.93 0.66 -2.09 0.00 0.00 179.45 178.19 2nww h SER 179 N 0.66 0.00 0.06 7.07 4.64 -1.41 -3.09 113.55 121.48 2nww h SER 179 Ca 0.07 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2nww h SER 179 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2nww h SER 179 CO 0.08 0.86 -0.03 0.00 -0.87 0.00 0.00 176.83 176.87 2nww h ALA 180 N 1.14 -0.08 -0.59 5.18 0.00 -1.35 -2.95 119.26 120.62 2nww h ALA 180 Ca -0.03 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.77 2nww h ALA 180 Cb 1.68 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.44 2nww h ALA 180 CO 0.11 -0.36 0.27 1.05 0.00 0.00 0.00 179.25 180.31 2nww h GLU 181 N -0.44 0.48 -0.39 0.00 4.11 -1.42 -1.43 114.58 115.48 2nww h GLU 181 Ca -0.01 -0.03 0.03 0.00 0.07 0.00 0.00 59.36 59.43 2nww h GLU 181 Cb 0.39 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 2nww h GLU 181 CO 0.01 0.32 0.18 1.79 0.07 0.00 0.00 179.01 181.38 2nww h THR 182 N 0.49 0.95 -0.27 -1.06 1.35 -1.57 -1.20 112.91 111.60 2nww h THR 182 Ca 0.28 -0.13 -0.01 0.00 -0.55 0.00 0.00 66.41 66.00 2nww h THR 182 Cb 0.27 0.55 -0.01 0.00 -1.73 0.00 0.00 68.15 67.23 2nww h THR 182 CO -0.23 0.07 0.13 0.25 -0.25 0.00 0.00 175.52 175.48 2nww h LEU 183 N 0.37 0.36 -0.20 3.87 5.85 -1.29 -1.13 115.31 123.13 2nww h LEU 183 Ca 0.17 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.77 2nww h LEU 183 Cb 0.10 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2nww h LEU 183 CO -0.14 0.39 0.12 0.25 -0.34 0.00 0.00 178.44 178.72 2nww h LEU 184 N 0.30 0.20 -0.64 2.25 6.46 -0.95 -1.76 115.31 121.18 2nww h LEU 184 Ca 0.09 0.00 -0.09 0.00 -0.12 0.00 0.00 57.88 57.76 2nww h LEU 184 Cb 0.13 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 39.99 2nww h LEU 184 CO -0.01 0.14 0.03 0.44 -0.62 0.00 0.00 178.44 178.43 2nww h ASP 185 N 0.25 1.07 -0.01 1.25 3.32 -1.11 -0.17 116.42 121.01 2nww h ASP 185 Ca 0.08 -0.29 0.03 0.00 0.02 0.00 0.00 57.03 56.86 2nww h ASP 185 Cb -0.01 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 39.22 2nww h ASP 185 CO -0.03 1.10 -0.17 0.00 -1.72 0.00 0.00 179.24 178.41 2nww h ALA 186 N 1.01 -0.20 -0.91 3.45 0.00 -0.96 0.23 119.26 121.89 2nww h ALA 186 Ca 0.18 0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.21 2nww h ALA 186 Cb 0.53 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 2nww h ALA 186 CO 0.03 -0.66 0.58 0.82 0.00 0.00 0.00 179.25 180.02 2nww h ILE 187 N -0.28 0.94 0.00 0.00 2.04 -1.10 0.50 117.51 119.62 2nww h ILE 187 Ca 0.06 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 2nww h ILE 187 Cb 0.36 -0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.43 2nww h ILE 187 CO -0.18 0.16 -0.05 -1.13 0.00 0.00 0.00 178.15 176.95 2nww h ASN 188 N 0.87 0.00 0.17 1.72 -1.24 -0.15 -0.75 115.58 116.20 2nww h ASN 188 Ca 0.43 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.43 2nww h ASN 188 Cb 0.47 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.52 2nww h ASN 188 CO -0.19 0.05 -0.08 1.23 -1.29 0.00 0.00 177.43 177.14 2nww h GLY 189 N 2.63 -0.24 0.75 1.57 0.00 0.17 -2.04 103.07 105.90 2nww h GLY 189 Ca -0.00 0.09 0.05 0.00 0.00 0.00 0.00 47.33 47.47 2nww h GLY 189 CO 0.01 -0.09 0.47 -2.00 0.00 0.00 0.00 176.54 174.93 2nww h LEU 190 N -0.53 0.73 0.02 3.11 5.85 -1.17 0.10 115.31 123.43 2nww h LEU 190 Ca -0.02 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.72 2nww h LEU 190 Cb 0.41 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 2nww h LEU 190 CO 0.04 0.48 -0.28 0.00 -0.34 0.00 0.00 178.44 178.34 2nww h ALA 191 N 1.36 -0.75 -0.08 1.25 0.00 -1.11 -2.59 119.26 117.35 2nww h ALA 191 Ca 0.33 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.21 2nww h ALA 191 Cb 0.14 0.72 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2nww h ALA 191 CO -0.16 -0.83 0.06 0.93 0.00 0.00 0.00 179.25 179.25 2nww h GLU 192 N -0.36 0.00 0.56 0.00 3.07 -1.06 -3.01 114.58 113.79 2nww h GLU 192 Ca 0.00 -0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 2nww h GLU 192 Cb 0.38 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.28 2nww h GLU 192 CO -0.18 0.00 -0.37 0.00 -1.40 0.00 0.00 179.01 177.06 2nww h ALA 193 N 1.96 -1.16 -0.85 3.43 0.00 -0.43 -2.10 119.26 120.10 2nww h ALA 193 Ca 0.04 -0.18 0.13 0.00 0.00 0.00 0.00 54.91 54.90 2nww h ALA 193 Cb 0.14 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 2nww h ALA 193 CO -0.00 -1.14 0.55 0.52 0.00 0.00 0.00 179.25 179.19 2nww h MET 194 N -0.89 0.64 -0.38 0.00 2.86 -1.35 0.12 114.93 115.94 2nww h MET 194 Ca -0.07 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.48 2nww h MET 194 Cb 0.72 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 2nww h MET 194 CO 0.06 0.43 0.04 1.88 1.06 0.00 0.00 176.91 180.38 2nww h TYR 195 N 0.66 0.59 -0.04 -0.22 -1.99 -1.41 0.27 116.97 114.83 2nww h TYR 195 Ca 0.42 -0.05 -0.17 0.00 2.00 0.00 0.00 58.73 60.93 2nww h TYR 195 Cb 0.68 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 39.23 2nww h TYR 195 CO -0.00 0.54 -0.74 0.87 -0.00 0.00 0.00 178.16 178.83 2nww h LYS 196 N 0.55 0.24 -0.28 4.88 1.57 -0.10 -3.00 116.57 120.43 2nww h LYS 196 Ca 0.12 -0.21 -0.10 0.00 -1.87 0.00 0.00 60.65 58.60 2nww h LYS 196 Cb 0.29 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 2nww h LYS 196 CO 0.00 0.87 -0.24 0.82 -0.57 0.00 0.00 179.45 180.34 2nww h ILE 197 N 0.16 1.27 -0.02 1.86 2.04 -0.61 -3.00 117.51 119.20 2nww h ILE 197 Ca -0.03 -1.27 -0.04 0.00 1.00 0.00 0.00 64.86 64.52 2nww h ILE 197 Cb 1.31 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 38.69 2nww h ILE 197 CO 0.12 0.41 -0.18 1.62 0.00 0.00 0.00 178.15 180.11 2nww h VAL 198 N 0.48 1.14 -0.39 1.67 3.04 -0.34 0.32 116.25 122.17 2nww h VAL 198 Ca 0.07 -0.66 -0.11 0.00 -1.01 0.00 0.00 66.70 64.99 2nww h VAL 198 Cb 0.67 1.33 -0.01 0.00 -2.01 0.00 0.00 31.29 31.27 2nww h VAL 198 CO 0.05 0.19 -0.22 0.78 -1.01 0.00 0.00 177.57 177.36 2nww h ASN 199 N 0.03 0.79 0.50 3.17 2.35 -1.49 -1.38 115.58 119.55 2nww h ASN 199 Ca 0.00 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.45 2nww h ASN 199 Cb 0.34 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.49 2nww h ASN 199 CO 0.02 0.99 -0.24 1.23 -1.65 0.00 0.00 177.43 177.78 2nww h GLY 200 N 0.96 -0.70 0.49 2.83 0.00 -1.04 -2.94 103.07 102.67 2nww h GLY 200 Ca 0.09 0.26 0.19 0.00 0.00 0.00 0.00 47.33 47.87 2nww h GLY 200 CO 0.06 -0.25 0.55 -0.24 0.00 0.00 0.00 176.54 176.65 2nww h VAL 201 N -1.08 0.70 0.00 4.60 3.04 -1.04 0.93 116.25 123.40 2nww h VAL 201 Ca -0.07 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.52 2nww h VAL 201 Cb 0.58 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 30.24 2nww h VAL 201 CO 0.11 0.05 0.00 0.23 -1.01 0.00 0.00 177.57 176.96 2nww n MET 202 N -4.45 0.17 0.11 4.17 2.00 -0.52 -1.94 117.12 116.66 2nww n MET 202 Ca 0.16 0.37 -0.01 0.00 0.00 0.00 0.00 57.70 58.22 2nww n MET 202 Cb 0.67 -1.80 0.01 0.00 0.00 0.00 0.00 33.22 32.10 2nww n MET 202 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 175.97 176.34 2nww h GLN 203 N 0.00 0.00 0.00 0.03 5.75 0.11 -2.99 115.11 118.01 2nww h GLN 203 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2nww h GLN 203 Cb 0.38 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.93 2nww h GLN 203 CO 0.00 0.70 0.00 -0.92 -2.65 0.00 0.00 178.83 175.96 2nww h TYR 204 N 0.00 0.00 -0.73 3.99 3.20 -1.32 -3.38 116.97 118.72 2nww h TYR 204 Ca -0.01 0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.00 2nww h TYR 204 Cb 1.46 0.00 -0.13 0.00 1.54 0.00 0.00 36.73 39.60 2nww h TYR 204 CO 0.00 0.00 -0.30 0.00 -1.64 0.00 0.00 178.16 176.22 2nww h ALA 205 N 2.33 0.19 -0.09 1.82 0.00 -1.34 -1.83 119.26 120.34 2nww h ALA 205 Ca 0.00 0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.17 2nww h ALA 205 Cb 0.78 0.76 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 2nww h ALA 205 CO 0.00 -0.57 0.07 -1.00 0.00 0.00 0.00 179.25 177.75 2nww h PRO 206 N -0.08 0.00 -0.04 0.00 0.13 -1.79 0.94 132.00 131.17 2nww h PRO 206 Ca 0.30 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.33 2nww h PRO 206 Cb 0.57 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.70 2nww h PRO 206 CO -0.78 0.00 -0.38 0.82 -0.23 0.00 0.00 178.00 177.43 2nww h ILE 207 N 0.00 1.45 -0.07 -3.56 1.08 -1.65 -2.37 117.51 112.39 2nww h ILE 207 Ca 0.04 -1.87 0.00 0.00 -0.39 0.00 0.00 64.86 62.64 2nww h ILE 207 Cb 0.18 2.49 -0.00 0.00 -3.07 0.00 0.00 36.82 36.42 2nww h ILE 207 CO -0.00 0.53 0.04 1.23 -0.69 0.00 0.00 178.15 179.27 2nww h GLY 208 N -0.21 0.10 -0.07 5.37 0.00 -0.84 -1.16 103.07 106.25 2nww h GLY 208 Ca -0.04 -0.04 0.06 0.00 0.00 0.00 0.00 47.33 47.31 2nww h GLY 208 CO 0.08 0.04 -0.37 -2.08 0.00 0.00 0.00 176.54 174.21 2nww h VAL 209 N 0.07 0.20 -0.32 4.60 2.07 0.76 -1.06 116.25 122.58 2nww h VAL 209 Ca 0.03 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.61 2nww h VAL 209 Cb 0.02 0.20 -0.08 0.00 -1.52 0.00 0.00 31.29 29.90 2nww h VAL 209 CO -0.01 0.00 -0.34 0.15 0.02 0.00 0.00 177.57 177.40 2nww h PHE 210 N -0.36 -0.94 0.00 1.57 3.04 -1.24 -2.17 116.94 116.84 2nww h PHE 210 Ca 0.12 0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.13 2nww h PHE 210 Cb 0.57 0.46 0.00 0.00 2.56 0.00 0.00 35.95 39.54 2nww h PHE 210 CO -0.51 -0.40 0.00 0.00 -2.02 0.00 0.00 178.31 175.38 2nww h ALA 211 N 0.61 1.00 0.00 2.41 0.00 -0.76 -1.60 119.26 120.93 2nww h ALA 211 Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 2nww h ALA 211 Cb 0.55 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2nww h ALA 211 CO -0.49 0.00 -0.51 -0.07 0.00 0.00 0.00 179.25 178.18 2nww h LEU 212 N 0.00 0.00 0.00 0.00 3.38 -0.55 -3.29 115.31 114.85 2nww h LEU 212 Ca 0.00 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2nww h LEU 212 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2nww h LEU 212 CO 0.00 1.02 0.00 2.30 0.09 0.00 0.00 178.44 181.85 2nww n ILE 213 N -4.59 0.53 0.22 1.22 -6.64 -1.08 -1.51 119.36 107.51 2nww n ILE 213 Ca -0.15 0.13 0.09 0.00 -1.77 0.00 0.00 62.75 61.06 2nww n ILE 213 Cb 0.42 -0.77 0.47 0.00 -1.44 0.00 0.00 39.64 38.31 2nww n ILE 213 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2nww h ALA 214 N 2.77 1.06 0.00 -1.28 0.00 -1.39 -2.98 119.26 117.43 2nww h ALA 214 Ca 0.00 -0.22 -0.26 0.00 0.00 0.00 0.00 54.91 54.42 2nww h ALA 214 Cb 0.33 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2nww h ALA 214 CO 0.00 0.31 -1.59 0.98 0.00 0.00 0.00 179.25 178.95 2nww n TYR 215 N -3.47 0.56 -0.35 0.00 9.36 -0.57 -3.61 117.16 119.08 2nww n TYR 215 Ca -0.00 0.24 0.06 0.00 3.32 0.00 0.00 57.90 61.52 2nww n TYR 215 Cb 0.42 -0.97 0.23 0.00 -0.63 0.00 0.00 39.34 38.39 2nww n TYR 215 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2nww h VAL 216 N -1.00 0.99 0.00 2.97 2.07 -1.45 0.23 116.25 120.05 2nww h VAL 216 Ca -0.40 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 2nww h VAL 216 Cb 1.29 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2nww h VAL 216 CO -0.24 0.19 -0.23 0.24 0.02 0.00 0.00 177.57 177.54 2nww h MET 217 N 1.03 0.00 0.19 1.57 2.86 -1.75 -2.30 114.93 116.54 2nww h MET 217 Ca 0.46 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.81 2nww h MET 217 Cb 0.37 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.05 2nww h MET 217 CO -0.22 0.23 -1.32 0.00 1.06 0.00 0.00 176.91 176.67 2nww h ALA 218 N 1.77 -0.03 0.00 6.32 0.00 -1.09 -2.53 119.26 123.70 2nww h ALA 218 Ca -0.00 -0.90 -0.18 0.00 0.00 0.00 0.00 54.91 53.83 2nww h ALA 218 Cb 1.03 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 2nww h ALA 218 CO 0.03 0.67 -1.25 0.93 0.00 0.00 0.00 179.25 179.64 2nww h GLU 219 N -0.09 0.00 0.00 0.00 4.39 -0.74 -3.41 114.58 114.73 2nww h GLU 219 Ca -0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.45 2nww h GLU 219 Cb 1.93 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.58 2nww h GLU 219 CO 0.19 0.45 0.00 1.04 -1.16 0.00 0.00 179.01 179.52 2nww n GLN 220 N -3.03 0.80 0.04 2.33 6.02 -0.89 -4.87 117.38 117.78 2nww n GLN 220 Ca -0.08 -0.09 -0.10 0.00 -0.01 0.00 0.00 57.00 56.72 2nww n GLN 220 Cb 0.87 -0.44 -0.07 0.00 1.02 0.00 0.00 30.24 31.62 2nww n GLN 220 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2nww h GLY 221 N 0.00 -0.21 -1.35 1.08 0.00 -1.18 -3.18 103.07 98.22 2nww h GLY 221 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2nww h GLY 221 CO 0.00 -0.08 0.00 1.55 0.00 0.00 0.00 176.54 178.01 2nww n VAL 222 N -4.90 0.17 -0.13 4.60 3.14 -1.21 -1.30 118.33 118.70 2nww n VAL 222 Ca -0.07 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.31 2nww n VAL 222 Cb 0.26 -0.42 0.00 0.00 -1.06 0.00 0.00 33.84 32.61 2nww n VAL 222 CO 0.00 0.00 0.00 1.57 -6.46 0.00 0.00 176.83 171.94 2nww n HIS 223 N 0.43 0.00 1.73 1.45 -0.00 -1.20 -4.78 115.22 112.85 2nww n HIS 223 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 57.83 2nww n HIS 223 Cb 0.17 0.00 0.64 0.00 -0.00 0.00 0.00 29.99 30.80 2nww n HIS 223 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.34 177.89 2nww n VAL 224 N -0.41 0.00 -1.37 3.57 3.14 -0.42 -4.84 118.33 118.00 2nww n VAL 224 Ca 0.00 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.09 2nww n VAL 224 Cb 0.03 -0.46 0.13 0.00 -1.06 0.00 0.00 33.84 32.49 2nww n VAL 224 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 2nww s VAL 225 N -2.00 2.49 0.00 1.55 -7.23 -1.26 -2.60 120.40 111.35 2nww s VAL 225 Ca 0.32 0.16 0.00 0.00 -1.81 0.00 0.00 61.98 60.65 2nww s VAL 225 Cb 0.15 -2.78 0.00 0.00 0.56 0.00 0.00 36.38 34.31 2nww s VAL 225 CO 0.25 -0.21 0.00 0.61 -0.31 0.00 0.00 175.10 175.44 2nww n GLY 226 N -1.64 -0.81 0.33 2.32 0.00 -1.26 -3.82 105.19 100.30 2nww n GLY 226 Ca 0.06 -1.25 0.17 0.00 0.00 0.00 0.00 46.02 45.00 2nww n GLY 226 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2nww h GLU 227 N 0.00 0.00 0.00 1.61 4.39 -1.98 0.01 114.58 118.61 2nww h GLU 227 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2nww h GLU 227 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2nww h GLU 227 CO 0.00 0.00 0.00 -0.07 -1.16 0.00 0.00 179.01 177.78 2nww h LEU 228 N 0.00 0.00 -0.70 1.33 3.38 -1.84 -2.73 115.31 114.75 2nww h LEU 228 Ca 0.06 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2nww h LEU 228 Cb 0.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2nww h LEU 228 CO -0.00 0.00 -0.31 0.00 0.09 0.00 0.00 178.44 178.22 2nww h ALA 229 N 2.12 0.88 -0.40 1.53 0.00 -0.72 -2.40 119.26 120.27 2nww h ALA 229 Ca 0.00 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 2nww h ALA 229 Cb 0.65 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2nww h ALA 229 CO 0.00 0.63 0.05 0.87 0.00 0.00 0.00 179.25 180.79 2nww h LYS 230 N 0.56 0.61 0.22 0.00 1.57 -1.57 -1.29 116.57 116.67 2nww h LYS 230 Ca 0.07 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2nww h LYS 230 Cb 0.80 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.03 2nww h LYS 230 CO 0.07 0.60 -0.10 0.28 -0.57 0.00 0.00 179.45 179.72 2nww h VAL 231 N 0.59 0.86 -0.48 0.50 2.07 -1.50 -0.68 116.25 117.61 2nww h VAL 231 Ca 0.13 -0.66 0.05 0.00 0.82 0.00 0.00 66.70 67.03 2nww h VAL 231 Cb 0.31 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 2nww h VAL 231 CO 0.01 0.14 0.32 0.71 0.02 0.00 0.00 177.57 178.77 2nww h THR 232 N -0.64 1.00 -0.00 2.57 1.35 -1.37 0.11 112.91 115.93 2nww h THR 232 Ca -0.03 -0.16 -0.18 0.00 -0.55 0.00 0.00 66.41 65.49 2nww h THR 232 Cb 0.46 0.50 -0.02 0.00 -1.73 0.00 0.00 68.15 67.36 2nww h THR 232 CO 0.05 0.08 -0.82 0.00 -0.25 0.00 0.00 175.52 174.58 2nww h ALA 233 N 1.73 0.61 0.00 6.62 0.00 -1.21 -2.26 119.26 124.76 2nww h ALA 233 Ca 0.20 -0.71 -0.17 0.00 0.00 0.00 0.00 54.91 54.24 2nww h ALA 233 Cb 0.22 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2nww h ALA 233 CO -0.05 0.93 -0.80 0.00 0.00 0.00 0.00 179.25 179.33 2nww h ALA 234 N 1.08 0.65 0.06 0.00 0.00 0.52 -2.53 119.26 119.04 2nww h ALA 234 Ca -0.03 -0.73 -0.11 0.00 0.00 0.00 0.00 54.91 54.05 2nww h ALA 234 Cb 1.44 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.10 2nww h ALA 234 CO 0.12 1.00 -0.49 0.28 0.00 0.00 0.00 179.25 180.16 2nww h VAL 235 N 0.00 1.58 -0.29 0.00 2.07 -0.91 -3.15 116.25 115.55 2nww h VAL 235 Ca -0.01 -2.42 -0.10 0.00 0.82 0.00 0.00 66.70 65.00 2nww h VAL 235 Cb 1.44 3.20 -0.01 0.00 -1.52 0.00 0.00 31.29 34.41 2nww h VAL 235 CO 0.10 0.64 -0.24 1.88 0.02 0.00 0.00 177.57 179.97 2nww h TYR 236 N -0.71 0.62 -0.11 1.57 -1.99 -1.50 0.25 116.97 115.10 2nww h TYR 236 Ca -0.10 -0.13 -0.11 0.00 2.00 0.00 0.00 58.73 60.39 2nww h TYR 236 Cb 1.32 -0.15 -0.01 0.00 2.00 0.00 0.00 36.73 39.89 2nww h TYR 236 CO 0.23 0.75 -0.43 0.28 -0.00 0.00 0.00 178.16 178.99 2nww h VAL 237 N 0.49 1.32 -0.33 -2.88 2.07 -1.62 -0.63 116.25 114.66 2nww h VAL 237 Ca 0.07 -1.56 -0.14 0.00 0.82 0.00 0.00 66.70 65.89 2nww h VAL 237 Cb 0.68 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 2nww h VAL 237 CO 0.05 0.47 -0.36 1.23 0.02 0.00 0.00 177.57 178.97 2nww h GLY 238 N 1.24 0.83 1.57 2.17 0.00 -1.31 -1.40 103.07 106.16 2nww h GLY 238 Ca 0.02 -0.82 -0.15 0.00 0.00 0.00 0.00 47.33 46.38 2nww h GLY 238 CO 0.07 0.74 -0.53 1.41 0.00 0.00 0.00 176.54 178.22 2nww h LEU 239 N 0.63 0.50 -0.28 3.11 3.38 -0.35 -0.48 115.31 121.83 2nww h LEU 239 Ca 0.06 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 2nww h LEU 239 Cb 0.91 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2nww h LEU 239 CO 0.08 0.94 -0.00 0.74 0.09 0.00 0.00 178.44 180.29 2nww h THR 240 N 0.35 1.26 0.00 0.22 2.02 -1.08 -2.89 112.91 112.79 2nww h THR 240 Ca 0.01 -0.93 -0.03 0.00 0.77 0.00 0.00 66.41 66.23 2nww h THR 240 Cb 1.05 1.32 -0.00 0.00 -1.74 0.00 0.00 68.15 68.77 2nww h THR 240 CO 0.09 0.30 -0.14 -0.07 0.37 0.00 0.00 175.52 176.07 2nww h LEU 241 N 0.28 0.00 0.05 2.58 4.07 -1.16 -1.67 115.31 119.46 2nww h LEU 241 Ca 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.04 2nww h LEU 241 Cb 0.43 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.17 2nww h LEU 241 CO 0.01 0.14 -0.02 -0.61 -1.08 0.00 0.00 178.44 176.88 2nww h GLN 242 N 0.00 -0.06 -0.65 1.13 5.75 -0.98 0.31 115.11 120.61 2nww h GLN 242 Ca -0.00 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.51 2nww h GLN 242 Cb 0.69 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.22 2nww h GLN 242 CO 0.02 0.21 0.42 0.82 -2.65 0.00 0.00 178.83 177.65 2nww h ILE 243 N -0.34 1.15 0.00 2.39 2.04 -1.31 -0.53 117.51 120.92 2nww h ILE 243 Ca -0.01 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 2nww h ILE 243 Cb 0.30 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2nww h ILE 243 CO 0.01 0.16 -0.05 -0.07 0.00 0.00 0.00 178.15 178.20 2nww h LEU 244 N 0.86 0.04 0.00 1.44 -0.00 -1.29 -0.20 115.31 116.16 2nww h LEU 244 Ca 0.24 -0.88 -0.21 0.00 -0.00 0.00 0.00 57.88 57.04 2nww h LEU 244 Cb -0.08 -0.01 -0.03 0.00 -0.00 0.00 0.00 40.66 40.53 2nww h LEU 244 CO -0.06 0.91 -1.09 -0.07 -0.00 0.00 0.00 178.44 178.13 2nww h LEU 245 N -0.83 0.00 0.00 1.67 -0.00 -0.43 -3.32 115.31 112.39 2nww h LEU 245 Ca -0.01 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.71 2nww h LEU 245 Cb 0.92 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.55 2nww h LEU 245 CO 0.01 0.89 -1.63 0.55 -0.00 0.00 0.00 178.44 178.26 2nww n VAL 246 N -3.24 0.63 -0.08 1.22 3.14 -0.25 -4.41 118.33 115.34 2nww n VAL 246 Ca -0.04 -0.35 -0.14 0.00 -2.96 0.00 0.00 64.34 60.85 2nww n VAL 246 Cb 0.92 -0.80 -0.09 0.00 -1.06 0.00 0.00 33.84 32.81 2nww n VAL 246 CO 0.00 0.00 0.00 1.88 -6.46 0.00 0.00 176.83 172.25 2nww h TYR 247 N 0.00 0.00 0.00 1.45 0.99 -1.28 -3.02 116.97 115.11 2nww h TYR 247 Ca -0.25 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.46 2nww h TYR 247 Cb 1.51 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 39.24 2nww h TYR 247 CO 0.00 0.95 -0.10 0.74 -0.00 0.00 0.00 178.16 179.75 2nww h PHE 248 N -1.00 0.00 0.08 4.88 0.05 -1.14 0.28 116.94 120.09 2nww h PHE 248 Ca -0.16 0.00 -0.16 0.00 3.82 0.00 0.00 57.97 61.47 2nww h PHE 248 Cb 0.95 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.90 2nww h PHE 248 CO 0.08 0.10 -0.79 0.28 -0.18 0.00 0.00 178.31 177.80 2nww h VAL 249 N 0.00 1.39 -0.02 -0.55 2.07 -1.74 -2.95 116.25 114.46 2nww h VAL 249 Ca -0.00 -2.40 -0.09 0.00 0.82 0.00 0.00 66.70 65.03 2nww h VAL 249 Cb 0.35 3.01 -0.01 0.00 -1.52 0.00 0.00 31.29 33.11 2nww h VAL 249 CO 0.01 0.63 -0.40 -0.07 0.02 0.00 0.00 177.57 177.76 2nww h LEU 250 N -0.62 0.04 0.01 2.57 3.38 -1.36 -0.53 115.31 118.80 2nww h LEU 250 Ca -0.17 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 2nww h LEU 250 Cb 1.44 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.18 2nww h LEU 250 CO 0.04 0.43 -0.01 0.25 0.09 0.00 0.00 178.44 179.24 2nww h LEU 251 N 0.03 -0.01 -0.50 1.67 5.85 -0.59 -2.85 115.31 118.91 2nww h LEU 251 Ca 0.00 -0.44 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 2nww h LEU 251 Cb 0.72 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 2nww h LEU 251 CO 0.05 0.43 0.20 0.50 -0.34 0.00 0.00 178.44 179.29 2nww h LYS 252 N -0.46 0.74 0.00 1.25 1.63 -1.44 -2.50 116.57 115.79 2nww h LYS 252 Ca -0.00 -0.13 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 2nww h LYS 252 Cb 0.45 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.96 2nww h LYS 252 CO 0.00 0.65 0.00 1.51 -3.45 0.00 0.00 179.45 178.17 2nww n ILE 253 N -4.56 1.14 -0.16 2.00 0.00 -0.21 -1.57 119.36 116.00 2nww n ILE 253 Ca 0.02 0.30 0.07 0.00 0.00 0.00 0.00 62.75 63.14 2nww n ILE 253 Cb 0.15 -1.13 0.19 0.00 0.00 0.00 0.00 39.64 38.85 2nww n ILE 253 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2nww n TYR 254 N -1.63 0.55 -2.24 9.51 4.02 -0.96 -5.00 117.16 121.41 2nww n TYR 254 Ca 0.03 -0.46 -0.06 0.00 -0.01 0.00 0.00 57.90 57.40 2nww n TYR 254 Cb 0.15 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 2nww n TYR 254 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2nww n GLY 255 N 0.82 0.22 3.12 2.72 0.00 -0.61 -4.95 105.19 106.52 2nww n GLY 255 Ca 0.14 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 2nww n GLY 255 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2nww s ILE 256 N -2.43 1.63 -0.01 -0.61 2.07 -1.09 -5.07 121.20 115.69 2nww s ILE 256 Ca 0.03 -0.76 -0.30 0.00 -1.41 0.00 0.00 60.65 58.21 2nww s ILE 256 Cb -0.01 -1.44 -0.06 0.00 0.13 0.00 0.00 42.46 41.08 2nww s ILE 256 CO 0.04 0.46 1.63 -0.62 -1.91 0.00 0.00 174.94 174.54 2nww s ASP 257 N 0.56 6.67 0.20 4.50 2.15 -1.26 -3.96 116.67 125.52 2nww s ASP 257 Ca -0.15 2.31 -0.11 0.00 0.43 0.00 0.00 52.55 55.02 2nww s ASP 257 Cb -0.17 -2.55 0.21 0.00 -0.30 0.00 0.00 42.92 40.11 2nww s ASP 257 CO 0.05 -0.89 1.78 -0.65 -0.17 0.00 0.00 175.17 175.29 2nww h PRO 258 N 8.95 0.49 -0.20 4.34 0.11 -1.91 -0.83 132.00 142.94 2nww h PRO 258 Ca -0.40 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.48 2nww h PRO 258 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2nww h PRO 258 CO 0.94 0.32 -0.66 0.82 -0.21 0.00 0.00 178.00 179.21 2nww h ILE 259 N 0.50 1.29 -0.59 4.15 5.03 -1.98 0.13 117.51 126.03 2nww h ILE 259 Ca 0.27 -1.88 -0.00 0.00 -0.12 0.00 0.00 64.86 63.13 2nww h ILE 259 Cb 0.23 1.84 -0.03 0.00 -3.03 0.00 0.00 36.82 35.83 2nww h ILE 259 CO -0.21 0.60 0.36 -1.28 -0.68 0.00 0.00 178.15 176.94 2nww h SER 260 N 0.55 0.70 -0.20 1.72 0.87 -1.92 -0.03 113.55 115.25 2nww h SER 260 Ca -0.02 -0.03 -0.09 0.00 -1.23 0.00 0.00 61.79 60.42 2nww h SER 260 Cb 1.27 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 63.05 2nww h SER 260 CO 0.14 0.54 -0.23 0.15 -0.53 0.00 0.00 176.83 176.89 2nww h PHE 261 N 0.81 0.61 -0.40 2.24 3.57 -0.77 -2.99 116.94 120.01 2nww h PHE 261 Ca 0.21 -0.19 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 2nww h PHE 261 Cb -0.04 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 2nww h PHE 261 CO 0.00 0.88 0.20 0.82 -2.23 0.00 0.00 178.31 177.98 2nww h ILE 262 N 0.17 1.17 -0.81 1.41 1.08 -0.39 -0.28 117.51 119.86 2nww h ILE 262 Ca 0.03 -0.46 0.08 0.00 -0.39 0.00 0.00 64.86 64.12 2nww h ILE 262 Cb 0.79 0.73 -0.07 0.00 -3.07 0.00 0.00 36.82 35.21 2nww h ILE 262 CO 0.06 0.18 0.47 0.11 -0.69 0.00 0.00 178.15 178.27 2nww h LYS 263 N 0.51 0.78 -0.09 2.37 6.56 -1.07 -1.60 116.57 124.03 2nww h LYS 263 Ca 0.14 -0.05 -0.16 0.00 -1.06 0.00 0.00 60.65 59.52 2nww h LYS 263 Cb 0.10 -0.18 -0.01 0.00 -0.57 0.00 0.00 32.23 31.57 2nww h LYS 263 CO -0.02 0.52 -0.63 0.45 -2.06 0.00 0.00 179.45 177.70 2nww h HIS 264 N 0.80 0.43 0.00 -1.35 3.86 -1.33 -3.20 115.15 114.36 2nww h HIS 264 Ca 0.38 -0.17 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 2nww h HIS 264 Cb 0.31 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.71 2nww h HIS 264 CO -0.06 0.87 0.00 0.00 0.86 0.00 0.00 177.93 179.60 2nww n ALA 265 N -2.49 2.25 -0.33 2.45 0.00 -0.14 -4.34 120.51 117.91 2nww n ALA 265 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2nww n ALA 265 Cb 0.64 -1.45 0.07 0.00 0.00 0.00 0.00 19.45 18.71 2nww n ALA 265 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2nww h LYS 266 N 0.00 -0.03 -0.33 0.00 -0.00 -1.31 0.70 116.57 115.60 2nww h LYS 266 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 60.65 60.62 2nww h LYS 266 Cb 0.50 0.01 -0.01 0.00 -0.00 0.00 0.00 32.23 32.72 2nww h LYS 266 CO 0.00 -0.02 0.08 -0.44 -0.00 0.00 0.00 179.45 179.07 2nww h ASP 267 N -0.03 0.50 -0.58 7.07 5.19 -1.85 -2.55 116.42 124.16 2nww h ASP 267 Ca 0.36 -0.23 -0.09 0.00 -0.62 0.00 0.00 57.03 56.46 2nww h ASP 267 Cb 0.62 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.97 2nww h ASP 267 CO -0.91 0.60 0.03 0.00 -3.12 0.00 0.00 179.24 175.83 2nww h ALA 268 N 0.92 0.78 -0.10 3.45 0.00 -1.55 -2.70 119.26 120.05 2nww h ALA 268 Ca 0.10 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2nww h ALA 268 Cb 0.29 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2nww h ALA 268 CO 0.00 0.59 0.07 1.98 0.00 0.00 0.00 179.25 181.89 2nww h MET 269 N 0.90 0.13 0.00 0.00 -1.53 -0.83 -2.79 114.93 110.81 2nww h MET 269 Ca 0.17 -0.01 -0.19 0.00 -3.44 0.00 0.00 59.70 56.23 2nww h MET 269 Cb 0.51 -0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 31.51 2nww h MET 269 CO 0.02 0.09 -0.88 -0.07 0.14 0.00 0.00 176.91 176.21 2nww h LEU 270 N 0.13 0.05 -0.29 3.39 3.38 -1.41 -1.90 115.31 118.66 2nww h LEU 270 Ca 0.04 -0.04 -0.20 0.00 0.09 0.00 0.00 57.88 57.76 2nww h LEU 270 Cb -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2nww h LEU 270 CO -0.01 0.91 -0.74 0.71 0.09 0.00 0.00 178.44 179.39 2nww h THR 271 N 0.02 1.33 -0.66 0.22 1.35 -1.54 -2.44 112.91 111.19 2nww h THR 271 Ca -0.02 -2.04 -0.04 0.00 -0.55 0.00 0.00 66.41 63.77 2nww h THR 271 Cb 1.55 2.02 -0.03 0.00 -1.73 0.00 0.00 68.15 69.96 2nww h THR 271 CO 0.12 0.63 0.26 0.00 -0.25 0.00 0.00 175.52 176.27 2nww h ALA 272 N 0.75 1.21 -0.18 6.62 0.00 -1.44 0.55 119.26 126.77 2nww h ALA 272 Ca -0.04 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 2nww h ALA 272 Cb 1.34 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2nww h ALA 272 CO 0.14 0.57 -0.21 0.35 0.00 0.00 0.00 179.25 180.11 2nww h PHE 273 N 0.95 0.35 0.00 0.00 3.57 -1.26 -1.69 116.94 118.85 2nww h PHE 273 Ca 0.22 -0.06 -0.27 0.00 3.53 0.00 0.00 57.97 61.40 2nww h PHE 273 Cb 0.19 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.79 2nww h PHE 273 CO 0.02 0.51 -2.14 1.33 -2.23 0.00 0.00 178.31 175.80 2nww n VAL 274 N -4.18 1.11 -0.01 1.41 0.24 -0.93 -4.40 118.33 111.56 2nww n VAL 274 Ca -0.01 -0.76 -0.16 0.00 -2.04 0.00 0.00 64.34 61.37 2nww n VAL 274 Cb 0.34 -0.45 -0.10 0.00 -1.47 0.00 0.00 33.84 32.16 2nww n VAL 274 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 2nww h THR 275 N 0.00 1.44 -1.60 3.34 2.02 0.02 -3.46 112.91 114.66 2nww h THR 275 Ca -0.37 -1.95 -0.25 0.00 0.77 0.00 0.00 66.41 64.61 2nww h THR 275 Cb 1.90 2.52 -0.02 0.00 -1.74 0.00 0.00 68.15 70.81 2nww h THR 275 CO 0.03 0.56 -0.30 0.54 0.37 0.00 0.00 175.52 176.72 2nww n ARG 276 N -4.31 -0.97 -3.84 6.66 1.74 -0.64 -5.02 116.66 110.29 2nww n ARG 276 Ca -0.10 0.64 -0.28 0.00 -0.77 0.00 0.00 57.85 57.35 2nww n ARG 276 Cb 0.60 -4.80 -0.16 0.00 -1.02 0.00 0.00 32.46 27.07 2nww n ARG 276 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2nww s SER 277 N -2.50 2.98 0.11 0.55 0.15 -1.26 -4.97 113.70 108.75 2nww s SER 277 Ca 0.00 -0.78 -0.16 0.00 0.70 0.00 0.00 55.95 55.71 2nww s SER 277 Cb 0.00 -0.83 -0.05 0.00 -1.71 0.00 0.00 66.02 63.43 2nww s SER 277 CO 0.00 -0.24 1.53 -1.28 1.20 0.00 0.00 173.24 174.46 2nww h SER 278 N 8.14 0.61 0.89 5.45 0.87 -1.91 -1.54 113.55 126.06 2nww h SER 278 Ca -0.20 -0.33 -0.16 0.00 -1.23 0.00 0.00 61.79 59.87 2nww h SER 278 Cb 1.11 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.88 2nww h SER 278 CO 0.37 0.79 -0.77 0.77 -0.53 0.00 0.00 176.83 177.46 2nww h SER 279 N 0.41 0.00 -0.82 6.23 4.64 -1.96 -3.22 113.55 118.83 2nww h SER 279 Ca 0.09 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.44 2nww h SER 279 Cb 0.50 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.54 2nww h SER 279 CO 0.02 0.77 0.53 1.23 -0.87 0.00 0.00 176.83 178.52 2nww h GLY 280 N 2.56 1.19 -3.68 -0.77 0.00 -1.89 -2.31 103.07 98.16 2nww h GLY 280 Ca -0.01 -0.40 -0.46 0.00 0.00 0.00 0.00 47.33 46.46 2nww h GLY 280 CO 0.10 0.35 0.59 -1.30 0.00 0.00 0.00 176.54 176.28 2nww n THR 281 N -4.57 2.95 -0.18 4.70 -2.24 -0.60 -4.20 114.28 110.15 2nww n THR 281 Ca 0.10 -1.82 -0.08 0.00 -2.27 0.00 0.00 64.05 59.97 2nww n THR 281 Cb 0.08 -0.75 0.01 0.00 -2.10 0.00 0.00 70.33 67.57 2nww n THR 281 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2nww h LEU 282 N 1.33 0.73 -1.06 3.22 3.38 -1.45 -2.22 115.31 119.25 2nww h LEU 282 Ca 0.51 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 58.23 2nww h LEU 282 Cb 2.05 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.59 2nww h LEU 282 CO 1.01 0.73 0.02 -0.65 0.09 0.00 0.00 178.44 179.64 2nww h PRO 283 N 0.69 0.69 -0.17 1.13 0.11 -1.83 0.43 132.00 133.03 2nww h PRO 283 Ca 0.17 -0.16 -0.20 0.00 0.11 0.00 0.00 66.00 65.91 2nww h PRO 283 Cb 0.25 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.27 2nww h PRO 283 CO -0.01 0.69 -0.69 0.28 -0.21 0.00 0.00 178.00 178.06 2nww h VAL 284 N 0.65 1.30 0.00 3.15 2.07 -1.89 -0.43 116.25 121.11 2nww h VAL 284 Ca 0.13 -1.93 -0.10 0.00 0.82 0.00 0.00 66.70 65.63 2nww h VAL 284 Cb 0.38 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 2nww h VAL 284 CO 0.01 0.61 -0.46 0.71 0.02 0.00 0.00 177.57 178.46 2nww h THR 285 N 0.51 1.30 0.15 2.57 1.35 -1.22 -1.77 112.91 115.79 2nww h THR 285 Ca -0.03 -1.58 -0.23 0.00 -0.55 0.00 0.00 66.41 64.02 2nww h THR 285 Cb 1.30 1.86 0.03 0.00 -1.73 0.00 0.00 68.15 69.60 2nww h THR 285 CO 0.14 0.45 -0.98 0.24 -0.25 0.00 0.00 175.52 175.11 2nww h MET 286 N 0.00 0.40 -0.44 4.72 2.86 -0.84 -2.60 114.93 119.04 2nww h MET 286 Ca -0.00 -0.63 0.01 0.00 -2.06 0.00 0.00 59.70 57.01 2nww h MET 286 Cb 0.82 0.23 -0.03 0.00 0.06 0.00 0.00 31.60 32.69 2nww h MET 286 CO 0.06 1.29 0.27 -0.09 1.06 0.00 0.00 176.91 179.50 2nww h ARG 287 N -0.16 0.54 0.00 1.72 2.43 -1.10 -1.28 114.38 116.52 2nww h ARG 287 Ca -0.17 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.96 2nww h ARG 287 Cb 1.75 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 31.18 2nww h ARG 287 CO 0.19 0.36 -0.04 0.28 -1.51 0.00 0.00 179.97 179.24 2nww h VAL 288 N 0.55 0.21 0.11 0.20 2.07 -1.40 0.36 116.25 118.35 2nww h VAL 288 Ca 0.17 -0.31 -0.28 0.00 0.82 0.00 0.00 66.70 67.10 2nww h VAL 288 Cb -0.03 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2nww h VAL 288 CO -0.06 0.04 -1.34 0.00 0.02 0.00 0.00 177.57 176.23 2nww h ALA 289 N 1.96 0.19 -0.07 1.67 0.00 -0.93 -2.42 119.26 119.66 2nww h ALA 289 Ca -0.00 -0.98 -0.21 0.00 0.00 0.00 0.00 54.91 53.72 2nww h ALA 289 Cb 0.25 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.15 2nww h ALA 289 CO 0.01 1.07 -0.78 -0.22 0.00 0.00 0.00 179.25 179.33 2nww h LYS 290 N 0.06 0.65 0.00 0.00 3.64 -0.70 -2.24 116.57 117.99 2nww h LYS 290 Ca -0.17 -0.61 0.00 0.00 -1.27 0.00 0.00 60.65 58.61 2nww h LYS 290 Cb 1.97 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.94 2nww h LYS 290 CO 0.18 1.21 0.00 1.49 -2.27 0.00 0.00 179.45 180.07 2nww h GLU 291 N 0.31 0.00 0.00 1.90 4.81 -1.06 -0.65 114.58 119.89 2nww h GLU 291 Ca -0.08 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.12 2nww h GLU 291 Cb 1.43 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.80 2nww h GLU 291 CO 0.16 0.00 -0.15 1.98 -0.73 0.00 0.00 179.01 180.26 2nww h MET 292 N 0.00 0.00 0.00 1.92 4.05 -1.28 -3.48 114.93 116.14 2nww h MET 292 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2nww h MET 292 Cb 0.36 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.16 2nww h MET 292 CO 0.00 0.15 0.00 0.41 0.23 0.00 0.00 176.91 177.70 2nww n GLY 293 N 1.11 0.95 3.78 1.39 0.00 -0.25 -5.07 105.19 107.10 2nww n GLY 293 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 2nww n GLY 293 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nww s ILE 294 N -2.00 4.05 0.48 -0.61 1.01 -0.86 -5.02 121.20 118.25 2nww s ILE 294 Ca 0.00 1.64 -0.18 0.00 0.00 0.00 0.00 60.65 62.12 2nww s ILE 294 Cb 0.00 -3.88 -0.09 0.00 0.01 0.00 0.00 42.46 38.50 2nww s ILE 294 CO 0.00 0.08 0.96 -0.94 0.00 0.00 0.00 174.94 175.04 2nww s SER 295 N -1.61 6.72 0.50 3.58 1.04 -1.26 -4.52 113.70 118.16 2nww s SER 295 Ca 0.53 1.59 0.34 0.00 0.48 0.00 0.00 55.95 58.88 2nww s SER 295 Cb -0.19 -2.51 1.71 0.00 0.10 0.00 0.00 66.02 65.12 2nww s SER 295 CO 0.25 -0.50 2.03 -0.33 0.98 0.00 0.00 173.24 175.66 2nww h GLU 296 N 1.27 0.00 0.00 4.02 5.08 -1.96 -2.41 114.58 120.59 2nww h GLU 296 Ca -0.48 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.87 2nww h GLU 296 Cb 1.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 2nww h GLU 296 CO 0.61 0.00 -0.09 0.78 -1.00 0.00 0.00 179.01 179.32 2nww h GLY 297 N 0.72 0.00 0.00 -3.84 0.00 -1.90 -3.09 103.07 94.96 2nww h GLY 297 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2nww h GLY 297 CO 0.00 0.00 -0.27 1.39 0.00 0.00 0.00 176.54 177.66 2nww n ILE 298 N -3.36 0.60 0.26 2.60 5.41 -0.93 -4.72 119.36 119.23 2nww n ILE 298 Ca -0.01 0.28 0.08 0.00 1.00 0.00 0.00 62.75 64.11 2nww n ILE 298 Cb 0.27 -1.64 0.65 0.00 -0.71 0.00 0.00 39.64 38.20 2nww n ILE 298 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 176.55 176.65 2nww h TYR 299 N -0.27 0.00 0.00 1.39 -0.00 -1.66 -0.41 116.97 116.02 2nww h TYR 299 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 2nww h TYR 299 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.00 2nww h TYR 299 CO -0.12 0.00 0.00 0.45 -0.00 0.00 0.00 178.16 178.49 2nww n SER 300 N -4.52 0.00 -0.06 0.10 2.88 -1.17 -2.55 113.62 108.31 2nww n SER 300 Ca -0.03 0.45 -0.09 0.00 -1.33 0.00 0.00 58.87 57.87 2nww n SER 300 Cb 0.09 -0.48 -0.05 0.00 -0.75 0.00 0.00 64.21 63.03 2nww n SER 300 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 2nww n PHE 301 N -1.48 0.00 0.16 0.66 7.35 -0.29 -4.68 117.46 119.18 2nww n PHE 301 Ca 0.05 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 56.78 2nww n PHE 301 Cb 0.23 -0.42 0.21 0.00 0.35 0.00 0.00 39.48 39.86 2nww n PHE 301 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 2nww h THR 302 N -0.16 0.97 0.15 -2.13 1.35 -1.26 -3.01 112.91 108.81 2nww h THR 302 Ca -0.26 -1.87 -0.24 0.00 -0.55 0.00 0.00 66.41 63.49 2nww h THR 302 Cb 1.33 2.14 0.03 0.00 -1.73 0.00 0.00 68.15 69.91 2nww h THR 302 CO -0.09 0.46 -1.02 -0.07 -0.25 0.00 0.00 175.52 174.55 2nww h LEU 303 N 0.00 0.64 -0.41 3.87 3.38 -1.74 -1.76 115.31 119.28 2nww h LEU 303 Ca -0.00 -0.90 -0.06 0.00 0.09 0.00 0.00 57.88 57.00 2nww h LEU 303 Cb 1.10 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 2nww h LEU 303 CO 0.06 1.48 -0.31 -0.65 0.09 0.00 0.00 178.44 179.12 2nww h PRO 304 N -0.10 0.00 -0.40 1.13 0.11 -1.80 -2.33 132.00 128.60 2nww h PRO 304 Ca -0.17 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.90 2nww h PRO 304 Cb 1.77 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.86 2nww h PRO 304 CO 0.19 0.31 0.08 1.25 -0.21 0.00 0.00 178.00 179.62 2nww h LEU 305 N 0.00 0.63 -1.66 2.35 5.85 -1.62 -3.19 115.31 117.67 2nww h LEU 305 Ca -0.00 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 2nww h LEU 305 Cb 1.08 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.94 2nww h LEU 305 CO 0.04 0.72 -0.02 1.23 -0.34 0.00 0.00 178.44 180.06 2nww h GLY 306 N 0.52 0.00 -1.82 3.75 0.00 -1.18 -0.69 103.07 103.65 2nww h GLY 306 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2nww h GLY 306 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.55 2nww n ALA 307 N -2.11 2.92 0.00 3.60 0.00 -0.89 -2.98 120.51 121.06 2nww n ALA 307 Ca -0.00 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.72 2nww n ALA 307 Cb 0.28 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.70 2nww n ALA 307 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2nww n THR 308 N 0.28 0.00 -0.04 0.00 -1.04 -0.60 -4.38 114.28 108.50 2nww n THR 308 Ca 0.11 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 62.04 2nww n THR 308 Cb 0.55 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.02 2nww n THR 308 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2nww n ILE 309 N -0.32 0.47 -2.78 12.58 5.41 -0.37 -4.66 119.36 129.70 2nww n ILE 309 Ca 0.00 -0.14 -0.43 0.00 1.00 0.00 0.00 62.75 63.18 2nww n ILE 309 Cb 0.00 -1.34 -0.03 0.00 -0.71 0.00 0.00 39.64 37.56 2nww n ILE 309 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 2nww s ASN 310 N -5.45 6.53 -0.80 4.38 2.47 -1.16 -4.86 114.94 116.05 2nww s ASN 310 Ca -0.12 -1.70 0.02 0.00 0.42 0.00 0.00 52.86 51.48 2nww s ASN 310 Cb 0.04 -2.47 0.20 0.00 -1.45 0.00 0.00 41.25 37.57 2nww s ASN 310 CO 0.16 -1.28 0.65 0.23 -3.72 0.00 0.00 177.10 173.14 2nww n MET 311 N 7.57 2.26 -0.03 0.43 2.81 -1.26 -4.74 117.12 124.15 2nww n MET 311 Ca 0.24 -4.49 -0.13 0.00 -1.81 0.00 0.00 57.70 51.51 2nww n MET 311 Cb 0.49 -2.35 -0.08 0.00 -0.71 0.00 0.00 33.22 30.58 2nww n MET 311 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2nww h ASP 312 N 5.65 0.17 -0.80 7.83 3.32 -1.85 -0.60 116.42 130.15 2nww h ASP 312 Ca 0.16 -0.40 0.06 0.00 0.02 0.00 0.00 57.03 56.87 2nww h ASP 312 Cb 0.78 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.23 2nww h ASP 312 CO 0.79 0.53 0.52 1.23 -1.72 0.00 0.00 179.24 180.60 2nww h GLY 313 N -0.19 1.11 0.54 2.75 0.00 -1.76 -0.30 103.07 105.22 2nww h GLY 313 Ca 0.02 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 2nww h GLY 313 CO 0.01 0.27 -0.03 -0.84 0.00 0.00 0.00 176.54 175.94 2nww h THR 314 N 0.88 1.40 -0.39 4.70 2.02 -1.72 -1.96 112.91 117.84 2nww h THR 314 Ca 0.34 -1.23 0.04 0.00 0.77 0.00 0.00 66.41 66.33 2nww h THR 314 Cb 0.21 2.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.77 2nww h THR 314 CO -0.12 0.33 0.26 0.00 0.37 0.00 0.00 175.52 176.36 2nww h ALA 315 N 0.51 1.90 -0.27 6.16 0.00 -0.77 -0.35 119.26 126.43 2nww h ALA 315 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 2nww h ALA 315 Cb 0.55 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2nww h ALA 315 CO 0.01 0.05 -0.35 1.25 0.00 0.00 0.00 179.25 180.21 2nww h LEU 316 N 0.37 0.77 -1.10 0.00 6.46 -1.04 -3.05 115.31 117.72 2nww h LEU 316 Ca 0.16 -0.50 -0.03 0.00 -0.12 0.00 0.00 57.88 57.39 2nww h LEU 316 Cb 0.18 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 39.86 2nww h LEU 316 CO -0.04 1.11 0.25 0.22 -0.62 0.00 0.00 178.44 179.37 2nww h TYR 317 N 0.44 0.89 0.00 1.25 3.20 -0.52 -2.53 116.97 119.71 2nww h TYR 317 Ca 0.03 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.81 2nww h TYR 317 Cb 0.93 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 2nww h TYR 317 CO 0.08 0.68 -0.21 1.96 -1.64 0.00 0.00 178.16 179.03 2nww h GLN 318 N 0.88 0.00 0.18 1.82 4.20 -1.08 -0.34 115.11 120.77 2nww h GLN 318 Ca 0.21 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.91 2nww h GLN 318 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 2nww h GLN 318 CO -0.02 0.21 -0.09 0.78 -0.67 0.00 0.00 178.83 179.04 2nww h GLY 319 N 1.31 -0.26 2.00 3.46 0.00 -1.34 -2.71 103.07 105.54 2nww h GLY 319 Ca -0.00 0.10 -0.13 0.00 0.00 0.00 0.00 47.33 47.30 2nww h GLY 319 CO 0.03 -0.09 -0.61 -0.24 0.00 0.00 0.00 176.54 175.62 2nww h VAL 320 N -0.61 1.41 -0.30 4.60 3.04 -1.46 -2.83 116.25 120.10 2nww h VAL 320 Ca -0.03 -2.11 -0.12 0.00 -1.01 0.00 0.00 66.70 63.44 2nww h VAL 320 Cb 0.45 2.15 -0.01 0.00 -2.01 0.00 0.00 31.29 31.87 2nww h VAL 320 CO 0.04 0.60 -0.27 0.00 -1.01 0.00 0.00 177.57 176.93 2nww h THR 322 N 0.47 1.20 -0.65 0.00 2.02 -1.52 -2.31 112.91 112.12 2nww h THR 322 Ca 0.05 -0.60 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 2nww h THR 322 Cb 0.83 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 2nww h THR 322 CO 0.07 0.23 0.27 -0.26 0.37 0.00 0.00 175.52 176.20 2nww h PHE 323 N 0.66 0.96 -0.28 3.16 -1.00 -1.37 -1.46 116.94 117.61 2nww h PHE 323 Ca 0.17 -0.06 -0.01 0.00 2.81 0.00 0.00 57.97 60.89 2nww h PHE 323 Cb 0.16 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.41 2nww h PHE 323 CO -0.00 0.73 0.16 0.35 -1.61 0.00 0.00 178.31 177.94 2nww h PHE 324 N 0.94 0.39 -0.50 -0.55 3.57 -0.53 -0.53 116.94 119.74 2nww h PHE 324 Ca 0.22 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.60 2nww h PHE 324 Cb 0.17 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 2nww h PHE 324 CO 0.01 0.32 -0.14 0.82 -2.23 0.00 0.00 178.31 177.10 2nww h ILE 325 N 0.34 1.27 0.00 1.41 2.04 -1.25 -1.05 117.51 120.28 2nww h ILE 325 Ca 0.10 -1.29 -0.03 0.00 1.00 0.00 0.00 64.86 64.64 2nww h ILE 325 Cb 0.06 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2nww h ILE 325 CO -0.02 0.45 -0.15 0.00 0.00 0.00 0.00 178.15 178.43 2nww h ALA 326 N 0.89 1.02 0.02 1.87 0.00 -1.16 -1.56 119.26 120.34 2nww h ALA 326 Ca 0.12 -0.13 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 2nww h ALA 326 Cb 0.70 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2nww h ALA 326 CO 0.05 0.18 -1.35 -0.91 0.00 0.00 0.00 179.25 177.23 2nww h ASN 327 N 0.00 0.08 -0.48 0.00 2.35 -0.91 0.73 115.58 117.34 2nww h ASN 327 Ca -0.00 -0.11 -0.10 0.00 -0.55 0.00 0.00 56.30 55.54 2nww h ASN 327 Cb 0.67 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 2nww h ASN 327 CO 0.02 1.09 -0.07 0.00 -1.65 0.00 0.00 177.43 176.82 2nww h ALA 328 N 0.90 0.89 0.16 -0.83 0.00 -0.92 -3.01 119.26 116.46 2nww h ALA 328 Ca -0.15 -0.32 -0.30 0.00 0.00 0.00 0.00 54.91 54.14 2nww h ALA 328 Cb 1.90 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 19.52 2nww h ALA 328 CO 0.12 0.64 -1.30 -0.07 0.00 0.00 0.00 179.25 178.64 2nww h LEU 329 N 0.85 0.67 0.00 0.00 4.07 -1.41 -3.41 115.31 116.09 2nww h LEU 329 Ca 0.14 -0.68 0.00 0.00 0.08 0.00 0.00 57.88 57.42 2nww h LEU 329 Cb 0.60 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.12 2nww h LEU 329 CO 0.04 1.52 0.00 0.61 -1.08 0.00 0.00 178.44 179.53 2nww n GLY 330 N 1.52 1.73 3.80 0.83 0.00 -0.12 -5.06 105.19 107.90 2nww n GLY 330 Ca -0.12 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 2nww n GLY 330 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nww s SER 331 N -2.10 6.68 0.36 1.61 0.01 0.24 -4.97 113.70 115.52 2nww s SER 331 Ca 0.00 1.83 0.27 0.00 1.31 0.00 0.00 55.95 59.36 2nww s SER 331 Cb 0.00 -2.55 0.98 0.00 0.21 0.00 0.00 66.02 64.65 2nww s SER 331 CO 0.00 -0.55 1.79 1.12 0.41 0.00 0.00 173.24 176.02 2nww h HIS 332 N 1.86 0.00 -1.55 2.43 2.07 -1.99 -3.43 115.15 114.54 2nww h HIS 332 Ca -0.49 0.00 -0.33 0.00 -2.85 0.00 0.00 60.37 56.70 2nww h HIS 332 Cb 1.20 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 31.11 2nww h HIS 332 CO 0.59 0.00 -0.36 1.28 -3.07 0.00 0.00 177.93 176.37 2nww n LEU 333 N -2.62 -1.47 -2.77 6.12 4.77 -1.26 -4.31 117.00 115.46 2nww n LEU 333 Ca 0.03 0.20 -0.02 0.00 -0.03 0.00 0.00 56.01 56.18 2nww n LEU 333 Cb 0.33 -2.39 -0.02 0.00 -2.33 0.00 0.00 43.42 39.02 2nww n LEU 333 CO 0.26 -0.52 -0.27 0.41 -1.33 0.00 0.00 177.39 175.94 2nww n THR 334 N -3.27 -5.92 -0.47 -5.08 -1.04 -1.26 -4.21 114.28 93.03 2nww n THR 334 Ca -0.18 1.20 -0.35 0.00 -2.04 0.00 0.00 64.05 62.68 2nww n THR 334 Cb 0.59 -4.07 -0.09 0.00 -1.82 0.00 0.00 70.33 64.94 2nww n THR 334 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 2nww n VAL 335 N 2.16 0.00 0.00 12.58 3.14 -1.26 -1.00 118.33 133.95 2nww n VAL 335 Ca -0.15 -0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.19 2nww n VAL 335 Cb 0.23 -1.74 0.00 0.00 -1.06 0.00 0.00 33.84 31.27 2nww n VAL 335 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2nww n GLY 336 N 4.71 3.78 2.48 7.55 0.00 -1.26 -5.04 105.19 117.40 2nww n GLY 336 Ca 0.36 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 2nww n GLY 336 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nww n GLN 337 N 0.00 2.50 0.00 1.61 -0.00 -0.17 -4.03 117.38 117.29 2nww n GLN 337 Ca 0.00 -2.88 0.15 0.00 -0.00 0.00 0.00 57.00 54.27 2nww n GLN 337 Cb 0.00 -2.14 0.76 0.00 -0.00 0.00 0.00 30.24 28.86 2nww n GLN 337 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2nww n GLN 338 N -0.22 1.15 0.23 2.61 3.00 -1.26 -3.33 117.38 119.57 2nww n GLN 338 Ca 0.52 -0.34 0.10 0.00 -0.01 0.00 0.00 57.00 57.27 2nww n GLN 338 Cb 0.49 -1.49 0.57 0.00 0.00 0.00 0.00 30.24 29.81 2nww n GLN 338 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2nww h LEU 339 N 0.83 0.00 -0.57 1.08 3.38 -1.94 -2.45 115.31 115.63 2nww h LEU 339 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 2nww h LEU 339 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2nww h LEU 339 CO 0.00 0.21 -0.68 0.74 0.09 0.00 0.00 178.44 178.80 2nww h THR 340 N 0.00 1.43 -0.38 0.22 2.02 -1.90 -0.07 112.91 114.22 2nww h THR 340 Ca -0.00 -2.17 -0.12 0.00 0.77 0.00 0.00 66.41 64.88 2nww h THR 340 Cb 0.53 2.14 -0.01 0.00 -1.74 0.00 0.00 68.15 69.08 2nww h THR 340 CO 0.03 0.64 -0.23 0.40 0.37 0.00 0.00 175.52 176.72 2nww h ILE 341 N 0.13 1.28 -0.25 3.11 2.04 -1.69 -2.59 117.51 119.54 2nww h ILE 341 Ca -0.01 -1.38 -0.04 0.00 1.00 0.00 0.00 64.86 64.42 2nww h ILE 341 Cb 1.21 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 2nww h ILE 341 CO 0.10 0.46 0.01 0.58 0.00 0.00 0.00 178.15 179.30 2nww h VAL 342 N 0.64 1.25 0.55 1.67 2.07 -1.33 -2.68 116.25 118.42 2nww h VAL 342 Ca 0.08 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 2nww h VAL 342 Cb 0.80 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 2nww h VAL 342 CO 0.07 0.27 -0.29 0.25 0.02 0.00 0.00 177.57 177.89 2nww h LEU 343 N 0.22 -0.71 0.00 2.57 5.85 -1.04 -2.90 115.31 119.30 2nww h LEU 343 Ca 0.07 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2nww h LEU 343 Cb 0.39 0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.62 2nww h LEU 343 CO 0.01 -0.48 0.00 0.35 -0.34 0.00 0.00 178.44 177.98 2nww n THR 344 N -5.44 0.55 0.02 1.05 -2.24 -0.98 -2.20 114.28 105.04 2nww n THR 344 Ca -0.12 0.14 -0.19 0.00 -2.27 0.00 0.00 64.05 61.61 2nww n THR 344 Cb 0.33 -0.80 -0.11 0.00 -2.10 0.00 0.00 70.33 67.65 2nww n THR 344 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nww h ALA 345 N 2.78 0.11 0.01 6.98 0.00 -1.26 -1.80 119.26 126.08 2nww h ALA 345 Ca 0.00 -0.63 -0.19 0.00 0.00 0.00 0.00 54.91 54.09 2nww h ALA 345 Cb 0.27 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2nww h ALA 345 CO 0.00 0.53 -0.89 -0.39 0.00 0.00 0.00 179.25 178.50 2nww h VAL 346 N 0.17 1.59 0.00 0.00 -1.51 -1.42 -3.01 116.25 112.07 2nww h VAL 346 Ca -0.10 -2.89 0.00 0.00 -1.23 0.00 0.00 66.70 62.48 2nww h VAL 346 Cb 1.50 2.59 0.00 0.00 -2.13 0.00 0.00 31.29 33.25 2nww h VAL 346 CO 0.16 0.83 0.00 0.18 -1.23 0.00 0.00 177.57 177.51 2nww n LEU 347 N -3.54 0.16 0.05 4.19 4.77 -0.94 -2.66 117.00 119.04 2nww n LEU 347 Ca -0.02 0.52 -0.14 0.00 -0.03 0.00 0.00 56.01 56.34 2nww n LEU 347 Cb 0.83 -0.46 -0.05 0.00 -2.33 0.00 0.00 43.42 41.41 2nww n LEU 347 CO 0.46 -0.04 0.19 0.00 -1.33 0.00 0.00 177.39 176.68 2nww h ALA 348 N 2.90 0.35 -0.49 -1.18 0.00 -1.18 -2.55 119.26 117.11 2nww h ALA 348 Ca 0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 54.91 54.15 2nww h ALA 348 Cb 0.55 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2nww h ALA 348 CO 0.00 0.78 0.00 0.77 0.00 0.00 0.00 179.25 180.80 2nww h SER 349 N 0.29 0.84 -0.04 0.00 0.02 -1.49 -1.70 113.55 111.47 2nww h SER 349 Ca -0.08 -0.31 -0.10 0.00 -0.84 0.00 0.00 61.79 60.46 2nww h SER 349 Cb 1.55 -0.23 0.01 0.00 0.14 0.00 0.00 62.40 63.87 2nww h SER 349 CO 0.17 0.94 -0.37 0.40 -1.14 0.00 0.00 176.83 176.83 2nww h ILE 350 N 0.72 1.46 0.00 3.27 2.04 -1.69 -2.85 117.51 120.46 2nww h ILE 350 Ca 0.14 -1.87 0.00 0.00 1.00 0.00 0.00 64.86 64.13 2nww h ILE 350 Cb 0.51 2.50 0.00 0.00 -0.74 0.00 0.00 36.82 39.09 2nww h ILE 350 CO 0.02 0.53 0.00 0.61 0.00 0.00 0.00 178.15 179.32 2nww n GLY 351 N 0.87 -0.73 0.04 5.37 0.00 -0.96 -2.90 105.19 106.88 2nww n GLY 351 Ca -0.09 -0.10 -0.05 0.00 0.00 0.00 0.00 46.02 45.78 2nww n GLY 351 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2nww n THR 352 N -0.85 0.46 0.00 2.61 5.66 -0.65 -4.74 114.28 116.78 2nww n THR 352 Ca 0.12 -0.21 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 2nww n THR 352 Cb 0.06 -0.80 0.00 0.00 -1.55 0.00 0.00 70.33 68.03 2nww n THR 352 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2nww n ALA 353 N -2.56 0.00 0.03 1.79 0.00 -1.08 -2.15 120.51 116.55 2nww n ALA 353 Ca -0.13 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.21 2nww n ALA 353 Cb 0.67 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.05 2nww n ALA 353 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2nww h GLY 354 N 0.00 -0.19 -2.10 0.00 0.00 -1.90 -3.47 103.07 95.41 2nww h GLY 354 Ca 0.00 0.07 -0.25 0.00 0.00 0.00 0.00 47.33 47.15 2nww h GLY 354 CO 0.00 -0.07 0.28 1.55 0.00 0.00 0.00 176.54 178.30 2nww n VAL 355 N -4.88 0.00 -2.16 4.60 3.14 -0.91 -4.83 118.33 113.28 2nww n VAL 355 Ca -0.07 0.00 -0.36 0.00 -2.96 0.00 0.00 64.34 60.95 2nww n VAL 355 Cb 0.25 -0.15 0.01 0.00 -1.06 0.00 0.00 33.84 32.90 2nww n VAL 355 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2nww s PRO 356 N 1.23 3.28 -0.95 1.45 0.04 -1.26 -3.54 135.00 135.24 2nww s PRO 356 Ca 0.33 1.73 -0.03 0.00 0.04 0.00 0.00 61.00 63.06 2nww s PRO 356 Cb -0.45 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.05 2nww s PRO 356 CO 0.23 -0.94 0.44 0.41 0.04 0.00 0.00 177.00 177.19 2nww n GLY 357 N 0.33 -0.05 0.27 0.56 0.00 -1.26 -4.93 105.19 100.11 2nww n GLY 357 Ca 0.12 -0.19 0.16 0.00 0.00 0.00 0.00 46.02 46.10 2nww n GLY 357 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nww h ALA 358 N 0.63 1.01 -0.58 4.61 0.00 -1.92 -3.22 119.26 119.78 2nww h ALA 358 Ca -0.34 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 2nww h ALA 358 Cb 1.23 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2nww h ALA 358 CO 0.35 0.04 0.36 0.78 0.00 0.00 0.00 179.25 180.78 2nww h GLY 359 N 2.09 0.84 1.62 0.00 0.00 -1.91 0.23 103.07 105.94 2nww h GLY 359 Ca -0.00 -0.33 -0.27 0.00 0.00 0.00 0.00 47.33 46.73 2nww h GLY 359 CO 0.00 0.33 -1.26 0.00 0.00 0.00 0.00 176.54 175.61 2nww h ALA 360 N 1.59 0.21 0.00 3.60 0.00 -1.98 -3.23 119.26 119.46 2nww h ALA 360 Ca 0.21 -0.96 -0.05 0.00 0.00 0.00 0.00 54.91 54.11 2nww h ALA 360 Cb -0.04 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2nww h ALA 360 CO -0.04 1.09 -0.43 -0.84 0.00 0.00 0.00 179.25 179.03 2nww h ILE 361 N 0.05 0.37 -0.18 0.00 3.07 -1.45 -0.09 117.51 119.28 2nww h ILE 361 Ca -0.13 -1.54 -0.20 0.00 1.55 0.00 0.00 64.86 64.54 2nww h ILE 361 Cb 1.94 2.10 0.01 0.00 -0.27 0.00 0.00 36.82 40.59 2nww h ILE 361 CO 0.17 0.21 -0.67 0.24 -1.05 0.00 0.00 178.15 177.05 2nww h MET 362 N 0.00 0.77 0.00 0.16 2.86 -0.71 -2.90 114.93 115.11 2nww h MET 362 Ca -0.02 -0.59 -0.09 0.00 -2.06 0.00 0.00 59.70 56.94 2nww h MET 362 Cb 1.20 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.95 2nww h MET 362 CO 0.03 1.20 -0.43 1.25 1.06 0.00 0.00 176.91 180.02 2nww h LEU 363 N 0.49 0.00 -0.81 1.22 5.85 -1.56 -1.61 115.31 118.89 2nww h LEU 363 Ca -0.03 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.56 2nww h LEU 363 Cb 1.30 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 2nww h LEU 363 CO 0.14 0.43 -0.46 0.00 -0.34 0.00 0.00 178.44 178.21 2nww h ALA 364 N 1.57 0.98 0.00 1.25 0.00 -0.99 -2.28 119.26 119.79 2nww h ALA 364 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2nww h ALA 364 Cb 1.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2nww h ALA 364 CO 0.06 0.64 -1.43 0.00 0.00 0.00 0.00 179.25 178.51 2nww n MET 365 N -3.98 0.58 0.08 0.00 0.00 -1.10 -2.43 117.12 110.27 2nww n MET 365 Ca -0.02 -0.03 -0.05 0.00 0.00 0.00 0.00 57.70 57.60 2nww n MET 365 Cb 0.52 -1.66 -0.06 0.00 0.00 0.00 0.00 33.22 32.02 2nww n MET 365 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 175.97 175.73 2nww h VAL 366 N 0.00 1.55 0.01 3.17 3.04 -1.33 -1.79 116.25 120.90 2nww h VAL 366 Ca 0.00 -3.08 -0.21 0.00 -1.01 0.00 0.00 66.70 62.40 2nww h VAL 366 Cb 0.96 2.70 -0.01 0.00 -2.01 0.00 0.00 31.29 32.93 2nww h VAL 366 CO 0.00 0.86 -0.93 -0.07 -1.01 0.00 0.00 177.57 176.42 2nww h LEU 367 N 0.00 0.33 -0.75 3.16 3.38 -1.52 -3.15 115.31 116.76 2nww h LEU 367 Ca -0.01 -0.28 -0.09 0.00 0.09 0.00 0.00 57.88 57.60 2nww h LEU 367 Cb 1.63 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.26 2nww h LEU 367 CO 0.11 1.09 -0.41 -0.74 0.09 0.00 0.00 178.44 178.59 2nww h HIS 368 N 0.13 0.00 -0.37 1.13 2.76 -1.49 0.24 115.15 117.55 2nww h HIS 368 Ca -0.06 0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.02 2nww h HIS 368 Cb 1.57 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.52 2nww h HIS 368 CO 0.04 0.41 -0.11 0.77 -1.30 0.00 0.00 177.93 177.73 2nww h SER 369 N 0.00 0.74 -0.34 3.26 0.02 -1.30 -3.10 113.55 112.84 2nww h SER 369 Ca -0.00 -0.38 -0.14 0.00 -0.84 0.00 0.00 61.79 60.43 2nww h SER 369 Cb 1.01 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 2nww h SER 369 CO 0.05 0.94 -0.30 1.62 -1.14 0.00 0.00 176.83 178.01 2nww h VAL 370 N 0.52 1.27 0.00 2.27 3.04 -1.56 -3.47 116.25 118.32 2nww h VAL 370 Ca 0.09 -1.45 0.00 0.00 -1.01 0.00 0.00 66.70 64.33 2nww h VAL 370 Cb 0.63 1.28 0.00 0.00 -2.01 0.00 0.00 31.29 31.20 2nww h VAL 370 CO 0.04 0.49 0.00 0.61 -1.01 0.00 0.00 177.57 177.70 2nww n GLY 371 N -0.06 1.79 2.84 3.17 0.00 -1.05 -5.07 105.19 106.82 2nww n GLY 371 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 2nww n GLY 371 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nww s LEU 372 N 0.00 4.04 0.25 0.99 1.43 0.80 -5.00 118.68 121.19 2nww s LEU 372 Ca 0.00 -3.32 -0.30 0.00 -1.03 0.00 0.00 54.13 49.48 2nww s LEU 372 Cb 0.00 -1.44 -0.09 0.00 0.03 0.00 0.00 46.19 44.69 2nww s LEU 372 CO 0.00 -0.17 1.02 -2.84 0.23 0.00 0.00 176.35 174.60 2nww s PRO 373 N -0.67 4.74 0.00 1.29 0.02 -1.26 -3.86 135.00 135.27 2nww s PRO 373 Ca 0.22 1.65 0.07 0.00 0.02 0.00 0.00 61.00 62.96 2nww s PRO 373 Cb -0.14 -3.24 0.32 0.00 0.02 0.00 0.00 34.50 31.46 2nww s PRO 373 CO -0.09 0.35 1.20 1.28 -0.33 0.00 0.00 177.00 179.41 2nww n LEU 374 N 1.41 0.00 0.12 -5.54 4.77 -1.26 -1.88 117.00 114.62 2nww n LEU 374 Ca -0.01 0.46 -0.02 0.00 -0.03 0.00 0.00 56.01 56.40 2nww n LEU 374 Cb 0.46 -0.46 0.13 0.00 -2.33 0.00 0.00 43.42 41.22 2nww n LEU 374 CO 0.52 -0.35 0.45 0.71 -1.33 0.00 0.00 177.39 177.39 2nww h THR 375 N 0.00 1.47 -2.85 -5.08 1.35 -1.93 -3.39 112.91 102.47 2nww h THR 375 Ca 0.00 -2.25 -0.56 0.00 -0.55 0.00 0.00 66.41 63.06 2nww h THR 375 Cb 0.11 2.21 -0.02 0.00 -1.73 0.00 0.00 68.15 68.72 2nww h THR 375 CO 0.00 0.64 0.91 -1.81 -0.25 0.00 0.00 175.52 175.02 2nww s ASP 376 N -6.84 6.87 0.62 5.36 1.11 -0.79 -4.91 116.67 118.08 2nww s ASP 376 Ca -0.01 1.93 0.35 0.00 0.18 0.00 0.00 52.55 54.99 2nww s ASP 376 Cb 0.12 -2.54 2.02 0.00 1.07 0.00 0.00 42.92 43.58 2nww s ASP 376 CO 0.77 -0.77 2.29 -0.65 1.18 0.00 0.00 175.17 177.98 2nww h PRO 377 N 8.37 0.00 0.03 8.23 0.11 -1.88 -1.76 132.00 145.10 2nww h PRO 377 Ca -0.33 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.78 2nww h PRO 377 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2nww h PRO 377 CO 0.94 0.00 -0.01 -0.91 -0.21 0.00 0.00 178.00 177.81 2nww h ASN 378 N 0.00 -0.04 -0.72 -2.05 -0.26 -1.94 -2.45 115.58 108.12 2nww h ASN 378 Ca 0.00 -0.58 0.05 0.00 -0.56 0.00 0.00 56.30 55.22 2nww h ASN 378 Cb 0.03 0.01 -0.05 0.00 -1.06 0.00 0.00 38.32 37.25 2nww h ASN 378 CO -0.00 0.58 0.42 0.58 -1.06 0.00 0.00 177.43 177.95 2nww h VAL 379 N -0.67 1.01 0.00 2.81 2.07 -1.62 -2.62 116.25 117.23 2nww h VAL 379 Ca -0.00 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.19 2nww h VAL 379 Cb 0.61 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2nww h VAL 379 CO 0.01 0.14 -0.29 0.00 0.02 0.00 0.00 177.57 177.45 2nww h ALA 380 N 1.35 0.85 -0.22 1.67 0.00 -1.52 -1.92 119.26 119.47 2nww h ALA 380 Ca 0.31 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 2nww h ALA 380 Cb 0.15 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2nww h ALA 380 CO -0.16 0.36 -0.52 0.00 0.00 0.00 0.00 179.25 178.93 2nww h ALA 381 N 1.71 0.68 -0.04 0.00 0.00 -1.08 -2.05 119.26 118.48 2nww h ALA 381 Ca -0.00 -0.50 -0.19 0.00 0.00 0.00 0.00 54.91 54.21 2nww h ALA 381 Cb 1.12 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2nww h ALA 381 CO 0.04 0.68 -0.80 0.00 0.00 0.00 0.00 179.25 179.16 2nww h ALA 382 N 0.93 0.54 -0.05 0.00 0.00 -1.36 -3.17 119.26 116.15 2nww h ALA 382 Ca 0.02 -0.65 -0.10 0.00 0.00 0.00 0.00 54.91 54.17 2nww h ALA 382 Cb 1.07 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2nww h ALA 382 CO 0.10 0.80 -0.44 -0.92 0.00 0.00 0.00 179.25 178.80 2nww h TYR 383 N 0.22 0.14 -0.23 0.00 3.20 -1.34 -2.80 116.97 116.16 2nww h TYR 383 Ca -0.04 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.75 2nww h TYR 383 Cb 1.40 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 2nww h TYR 383 CO 0.04 0.54 -0.00 0.00 -1.64 0.00 0.00 178.16 177.10 2nww h ALA 384 N 1.46 1.56 -0.13 1.82 0.00 -1.34 -2.85 119.26 119.78 2nww h ALA 384 Ca 0.01 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 2nww h ALA 384 Cb 0.82 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2nww h ALA 384 CO 0.06 0.32 -0.58 1.98 0.00 0.00 0.00 179.25 181.03 2nww h MET 385 N 0.34 0.42 -0.72 0.00 1.85 -1.52 -3.03 114.93 112.27 2nww h MET 385 Ca 0.08 -0.28 -0.03 0.00 -0.61 0.00 0.00 59.70 58.86 2nww h MET 385 Cb 0.24 0.04 -0.03 0.00 0.43 0.00 0.00 31.60 32.27 2nww h MET 385 CO 0.01 0.88 0.35 0.82 -0.40 0.00 0.00 176.91 178.57 2nww h ILE 386 N 0.32 1.23 0.00 1.77 1.08 -1.49 -2.94 117.51 117.48 2nww h ILE 386 Ca -0.00 -0.65 -0.01 0.00 -0.39 0.00 0.00 64.86 63.81 2nww h ILE 386 Cb 1.11 0.34 -0.00 0.00 -3.07 0.00 0.00 36.82 35.20 2nww h ILE 386 CO 0.10 0.27 -0.03 -0.07 -0.69 0.00 0.00 178.15 177.73 2nww h LEU 387 N 1.00 0.00 -1.61 1.44 3.38 -1.40 -1.80 115.31 116.32 2nww h LEU 387 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2nww h LEU 387 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2nww h LEU 387 CO -0.03 0.03 0.00 1.23 0.09 0.00 0.00 178.44 179.76 2nww h GLY 388 N 0.88 0.00 -1.57 0.83 0.00 -1.52 -2.53 103.07 99.16 2nww h GLY 388 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2nww h GLY 388 CO 0.00 0.00 -0.65 0.29 0.00 0.00 0.00 176.54 176.18 2nww n ILE 389 N -3.00 1.54 0.05 2.60 -5.35 -0.71 -4.72 119.36 109.77 2nww n ILE 389 Ca 0.00 -2.55 -0.10 0.00 -0.27 0.00 0.00 62.75 59.83 2nww n ILE 389 Cb 0.26 0.13 0.03 0.00 -1.74 0.00 0.00 39.64 38.32 2nww n ILE 389 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 2nww h ASP 390 N 0.98 0.51 1.13 7.28 1.82 -1.03 -2.76 116.42 124.34 2nww h ASP 390 Ca -0.07 -0.33 -0.07 0.00 -0.39 0.00 0.00 57.03 56.17 2nww h ASP 390 Cb 1.27 -0.15 -0.01 0.00 0.68 0.00 0.00 39.33 41.12 2nww h ASP 390 CO 0.03 1.07 -0.35 0.00 -1.61 0.00 0.00 179.24 178.38 2nww h ALA 391 N 0.93 0.90 -0.32 -0.78 0.00 -1.89 0.13 119.26 118.22 2nww h ALA 391 Ca -0.03 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 2nww h ALA 391 Cb 1.29 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2nww h ALA 391 CO 0.12 0.43 0.03 0.82 0.00 0.00 0.00 179.25 180.66 2nww h ILE 392 N 0.00 1.25 0.00 0.00 1.08 -1.86 -3.08 117.51 114.90 2nww h ILE 392 Ca -0.00 -0.88 -0.12 0.00 -0.39 0.00 0.00 64.86 63.47 2nww h ILE 392 Cb 1.00 1.19 -0.02 0.00 -3.07 0.00 0.00 36.82 35.93 2nww h ILE 392 CO 0.05 0.29 -0.58 -0.07 -0.69 0.00 0.00 178.15 177.14 2nww h LEU 393 N 0.37 0.00 -0.65 1.44 3.38 -1.23 -3.28 115.31 115.33 2nww h LEU 393 Ca 0.10 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 2nww h LEU 393 Cb 0.39 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 2nww h LEU 393 CO 0.01 0.58 0.14 -0.78 0.09 0.00 0.00 178.44 178.48 2nww h ASP 394 N 0.00 1.00 0.03 -0.43 3.58 -0.69 -2.28 116.42 117.63 2nww h ASP 394 Ca -0.01 -0.24 0.02 0.00 0.42 0.00 0.00 57.03 57.22 2nww h ASP 394 Cb 1.04 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 41.79 2nww h ASP 394 CO 0.08 0.99 -0.20 0.24 -2.88 0.00 0.00 179.24 177.46 2nww h MET 395 N 0.97 -0.33 -0.78 0.28 2.86 -1.59 -0.08 114.93 116.26 2nww h MET 395 Ca 0.20 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.83 2nww h MET 395 Cb 0.39 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.09 2nww h MET 395 CO 0.01 -0.22 0.34 0.78 1.06 0.00 0.00 176.91 178.88 2nww h GLY 396 N -0.34 1.23 1.66 8.32 0.00 -1.67 -2.55 103.07 109.72 2nww h GLY 396 Ca 0.05 -0.63 -0.25 0.00 0.00 0.00 0.00 47.33 46.49 2nww h GLY 396 CO -0.16 0.60 -1.12 0.07 0.00 0.00 0.00 176.54 175.93 2nww h ARG 397 N 1.13 0.27 -0.26 4.80 0.11 -1.12 -2.98 114.38 116.32 2nww h ARG 397 Ca 0.27 -0.40 -0.10 0.00 0.10 0.00 0.00 59.98 59.85 2nww h ARG 397 Cb 0.16 0.14 -0.01 0.00 1.11 0.00 0.00 29.97 31.37 2nww h ARG 397 CO -0.03 1.15 -0.25 1.15 0.10 0.00 0.00 179.97 182.09 2nww h THR 398 N 0.10 1.26 -0.11 0.08 2.02 -1.00 -0.77 112.91 114.50 2nww h THR 398 Ca -0.10 -1.27 -0.07 0.00 0.77 0.00 0.00 66.41 65.74 2nww h THR 398 Cb 1.82 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 69.55 2nww h THR 398 CO 0.18 0.40 -0.25 -0.03 0.37 0.00 0.00 175.52 176.20 2nww h MET 399 N 0.44 0.19 0.00 6.66 1.85 -1.45 -2.43 114.93 120.19 2nww h MET 399 Ca 0.06 -0.06 -0.06 0.00 -0.61 0.00 0.00 59.70 59.04 2nww h MET 399 Cb 0.67 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.67 2nww h MET 399 CO 0.05 0.43 -0.79 0.28 -0.40 0.00 0.00 176.91 176.48 2nww h VAL 400 N 0.17 0.29 -0.75 -5.77 2.07 -1.33 -3.09 116.25 107.84 2nww h VAL 400 Ca 0.03 -1.48 -0.06 0.00 0.82 0.00 0.00 66.70 66.01 2nww h VAL 400 Cb 0.53 1.92 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 2nww h VAL 400 CO 0.04 0.17 0.24 0.78 0.02 0.00 0.00 177.57 178.81 2nww h ASN 401 N 0.00 1.08 0.96 0.57 2.35 -0.67 -3.13 115.58 116.74 2nww h ASN 401 Ca -0.04 -0.21 -0.20 0.00 -0.55 0.00 0.00 56.30 55.31 2nww h ASN 401 Cb 1.22 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 39.28 2nww h ASN 401 CO 0.02 1.00 -1.10 -0.37 -1.65 0.00 0.00 177.43 175.34 2nww h VAL 402 N 1.11 1.14 -0.05 2.81 -1.51 -1.57 -3.31 116.25 114.87 2nww h VAL 402 Ca 0.24 -2.77 0.00 0.00 -1.23 0.00 0.00 66.70 62.95 2nww h VAL 402 Cb 0.30 2.53 -0.00 0.00 -2.13 0.00 0.00 31.29 31.99 2nww h VAL 402 CO -0.01 0.65 0.02 0.74 -1.23 0.00 0.00 177.57 177.74 2nww h THR 403 N 0.00 1.00 -0.02 7.19 2.02 -1.53 -2.20 112.91 119.36 2nww h THR 403 Ca -0.09 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 2nww h THR 403 Cb 1.70 0.94 -0.00 0.00 -1.74 0.00 0.00 68.15 69.05 2nww h THR 403 CO 0.09 0.01 -0.09 1.23 0.37 0.00 0.00 175.52 177.13 2nww h GLY 404 N 0.05 0.03 0.90 2.16 0.00 -1.67 0.49 103.07 105.03 2nww h GLY 404 Ca 0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2nww h GLY 404 CO -0.02 0.01 0.03 -0.55 0.00 0.00 0.00 176.54 176.02 2nww h ASP 405 N 0.03 0.55 -0.32 0.19 3.32 -1.55 0.15 116.42 118.78 2nww h ASP 405 Ca 0.01 -0.28 -0.16 0.00 0.02 0.00 0.00 57.03 56.62 2nww h ASP 405 Cb 0.18 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2nww h ASP 405 CO 0.01 0.69 -0.40 -0.07 -1.72 0.00 0.00 179.24 177.76 2nww h LEU 406 N 0.38 0.93 -0.35 1.55 3.38 -0.65 -1.17 115.31 119.39 2nww h LEU 406 Ca 0.10 -0.43 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 2nww h LEU 406 Cb 0.39 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2nww h LEU 406 CO 0.01 1.21 0.14 0.74 0.09 0.00 0.00 178.44 180.63 2nww h THR 407 N 0.71 1.19 -0.46 0.22 2.02 0.03 -0.49 112.91 116.13 2nww h THR 407 Ca 0.06 -0.58 -0.06 0.00 0.77 0.00 0.00 66.41 66.60 2nww h THR 407 Cb 0.98 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 2nww h THR 407 CO 0.09 0.20 0.06 1.23 0.37 0.00 0.00 175.52 177.48 2nww h GLY 408 N 0.42 0.83 0.75 2.16 0.00 -0.68 -1.59 103.07 104.95 2nww h GLY 408 Ca 0.12 -0.56 0.05 0.00 0.00 0.00 0.00 47.33 46.93 2nww h GLY 408 CO -0.01 0.52 0.34 -0.84 0.00 0.00 0.00 176.54 176.55 2nww h THR 409 N 0.63 1.00 -0.07 4.70 2.02 -1.03 -0.95 112.91 119.21 2nww h THR 409 Ca 0.14 -0.22 -0.11 0.00 0.77 0.00 0.00 66.41 66.98 2nww h THR 409 Cb 0.40 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 2nww h THR 409 CO 0.01 0.12 -0.47 0.00 0.37 0.00 0.00 175.52 175.55 2nww h ALA 410 N 1.30 1.09 -0.24 6.16 0.00 -0.96 -0.68 119.26 125.93 2nww h ALA 410 Ca 0.26 -0.44 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 2nww h ALA 410 Cb 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2nww h ALA 410 CO -0.15 0.62 -0.59 0.82 0.00 0.00 0.00 179.25 179.95 2nww h ILE 411 N 0.14 1.29 -0.25 0.00 5.03 -0.84 -2.60 117.51 120.27 2nww h ILE 411 Ca 0.01 -1.80 -0.15 0.00 -0.12 0.00 0.00 64.86 62.80 2nww h ILE 411 Cb 0.88 1.73 -0.01 0.00 -3.03 0.00 0.00 36.82 36.39 2nww h ILE 411 CO 0.07 0.58 -0.45 0.58 -0.68 0.00 0.00 178.15 178.24 2nww h VAL 412 N 0.58 1.30 -0.79 1.67 2.07 -1.06 -1.93 116.25 118.10 2nww h VAL 412 Ca 0.00 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 65.88 2nww h VAL 412 Cb 1.18 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 32.51 2nww h VAL 412 CO 0.12 0.52 0.50 0.00 0.02 0.00 0.00 177.57 178.74 2nww h ALA 413 N 0.98 1.00 -0.38 1.67 0.00 -1.09 0.44 119.26 121.88 2nww h ALA 413 Ca 0.03 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2nww h ALA 413 Cb 0.99 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2nww h ALA 413 CO 0.09 0.44 -0.27 0.87 0.00 0.00 0.00 179.25 180.38 2nww h LYS 414 N 1.07 0.86 0.39 0.00 1.79 -1.39 -3.34 116.57 115.95 2nww h LYS 414 Ca 0.29 -0.41 -0.02 0.00 -2.18 0.00 0.00 60.65 58.32 2nww h LYS 414 Cb -0.08 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.57 2nww h LYS 414 CO -0.06 1.06 -0.19 1.15 -1.08 0.00 0.00 179.45 180.33 2nww h THR 415 N 0.66 0.30 -0.01 -0.16 2.02 -0.93 -3.52 112.91 111.27 2nww h THR 415 Ca 0.07 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.60 2nww h THR 415 Cb 0.85 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2nww h THR 415 CO 0.07 0.07 0.00 1.21 0.37 0.00 0.00 175.52 177.24