#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1woh s PRO 4 N 0.00 3.66 0.18 1.61 0.04 -1.26 -5.03 135.00 134.20 1woh s PRO 4 Ca 0.00 2.27 0.10 0.00 0.04 0.00 0.00 61.00 63.41 1woh s PRO 4 Cb 0.00 -2.59 -0.04 0.00 0.04 0.00 0.00 34.50 31.91 1woh s PRO 4 CO 0.00 -0.79 -0.16 0.00 0.04 0.00 0.00 177.00 176.09 1woh s ALA 5 N -1.26 2.75 0.72 8.56 0.00 -1.26 -5.13 121.76 126.15 1woh s ALA 5 Ca 0.62 -1.52 -0.14 0.00 0.00 0.00 0.00 51.96 50.92 1woh s ALA 5 Cb -0.41 -0.56 0.03 0.00 0.00 0.00 0.00 23.12 22.18 1woh s ALA 5 CO 0.51 0.47 1.13 -1.01 0.00 0.00 0.00 175.76 176.86 1woh s HIS 6 N -1.62 2.39 0.55 0.00 3.76 -1.26 -5.04 115.29 114.08 1woh s HIS 6 Ca 0.22 1.59 -0.04 0.00 -0.15 0.00 0.00 55.06 56.68 1woh s HIS 6 Cb -0.09 -3.23 0.01 0.00 1.11 0.00 0.00 32.58 30.38 1woh s HIS 6 CO 0.12 -2.01 0.84 -0.51 -0.85 0.00 0.00 174.74 172.33 1woh s LEU 7 N -5.29 3.34 0.40 0.89 2.01 -1.26 -4.90 118.68 113.87 1woh s LEU 7 Ca 0.67 0.58 0.18 0.00 0.01 0.00 0.00 54.13 55.57 1woh s LEU 7 Cb -0.22 -3.42 1.08 0.00 0.01 0.00 0.00 46.19 43.65 1woh s LEU 7 CO 0.47 -0.98 1.81 -0.65 1.01 0.00 0.00 176.35 178.01 1woh h PRO 8 N -0.02 0.40 -0.00 1.29 0.11 -1.97 0.34 132.00 132.15 1woh h PRO 8 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1woh h PRO 8 Cb 1.26 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1woh h PRO 8 CO 0.59 0.27 -0.00 2.48 -0.21 0.00 0.00 178.00 181.13 1woh n TYR 9 N -4.57 0.00 -4.08 0.65 4.11 -1.26 -4.86 117.16 107.16 1woh n TYR 9 Ca 0.22 0.00 -0.31 0.00 -0.00 0.00 0.00 57.90 57.82 1woh n TYR 9 Cb 0.79 -0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 40.05 1woh n TYR 9 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.86 177.06 1woh s GLY 10 N -2.01 2.00 0.00 -7.48 0.00 0.12 -5.04 107.32 94.91 1woh s GLY 10 Ca 0.45 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 44.15 1woh s GLY 10 CO 0.36 -0.99 0.00 0.61 0.00 0.00 0.00 173.10 173.09 1woh n GLY 11 N 0.57 -1.36 3.69 0.20 0.00 -1.26 -4.57 105.19 102.46 1woh n GLY 11 Ca -0.10 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 1woh n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1woh s ILE 12 N -2.12 4.12 -0.52 -0.61 -1.09 -1.26 -4.96 121.20 114.77 1woh s ILE 12 Ca 0.00 1.47 -0.28 0.00 -2.23 0.00 0.00 60.65 59.62 1woh s ILE 12 Cb 0.00 -3.95 -0.00 0.00 -1.58 0.00 0.00 42.46 36.93 1woh s ILE 12 CO 0.00 0.02 1.63 -2.16 -1.23 0.00 0.00 174.94 173.20 1woh s PRO 13 N 2.06 3.13 0.15 2.79 0.04 -1.26 -4.96 135.00 136.95 1woh s PRO 13 Ca 0.58 0.75 0.10 0.00 0.04 0.00 0.00 61.00 62.46 1woh s PRO 13 Cb -0.27 -4.21 -0.04 0.00 0.04 0.00 0.00 34.50 30.02 1woh s PRO 13 CO 0.24 -2.13 -0.22 0.95 0.04 0.00 0.00 177.00 175.88 1woh s THR 14 N 7.09 2.01 0.18 1.26 -4.23 -1.26 -4.78 115.64 115.92 1woh s THR 14 Ca 0.63 -1.83 -0.32 0.00 -1.18 0.00 0.00 61.69 58.99 1woh s THR 14 Cb -0.14 -1.87 -0.11 0.00 1.34 0.00 0.00 72.50 71.71 1woh s THR 14 CO 0.26 -0.13 1.74 0.12 -0.54 0.00 0.00 174.62 176.06 1woh s PHE 15 N -1.57 2.74 -2.11 3.99 5.36 -1.26 -0.57 117.98 124.55 1woh s PHE 15 Ca 0.15 0.28 0.00 0.00 -0.96 0.00 0.00 56.93 56.39 1woh s PHE 15 Cb -0.08 -4.13 0.00 0.00 -0.34 0.00 0.00 43.02 38.47 1woh s PHE 15 CO 0.07 -4.38 0.00 0.00 -1.46 0.00 0.00 175.22 169.45 1woh n ALA 16 N 4.39 -0.30 -3.01 11.12 0.00 -1.26 -0.87 120.51 130.58 1woh n ALA 16 Ca 0.16 0.32 -0.20 0.00 0.00 0.00 0.00 53.44 53.72 1woh n ALA 16 Cb 0.36 -1.98 0.01 0.00 0.00 0.00 0.00 19.45 17.84 1woh n ALA 16 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1woh n ARG 17 N -2.32 -3.46 -1.71 0.00 0.63 0.26 -4.63 116.66 105.42 1woh n ARG 17 Ca -0.20 0.65 -0.31 0.00 -0.92 0.00 0.00 57.85 57.07 1woh n ARG 17 Cb 0.65 -5.38 0.04 0.00 0.45 0.00 0.00 32.46 28.23 1woh n ARG 17 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1woh s ALA 18 N -2.93 2.80 0.49 5.13 0.00 -0.05 -4.95 121.76 122.25 1woh s ALA 18 Ca 0.26 -0.08 -0.23 0.00 0.00 0.00 0.00 51.96 51.92 1woh s ALA 18 Cb -0.13 -3.11 -0.06 0.00 0.00 0.00 0.00 23.12 19.81 1woh s ALA 18 CO 0.32 -1.10 1.26 -1.25 0.00 0.00 0.00 175.76 174.99 1woh s PRO 19 N -5.15 3.51 0.05 0.00 0.04 -1.26 -4.62 135.00 127.57 1woh s PRO 19 Ca 0.57 2.00 -0.26 0.00 0.04 0.00 0.00 61.00 63.35 1woh s PRO 19 Cb -0.13 -2.37 -0.05 0.00 0.04 0.00 0.00 34.50 31.99 1woh s PRO 19 CO 0.54 -0.82 0.79 -1.17 0.04 0.00 0.00 177.00 176.38 1woh s LEU 20 N -3.20 4.45 0.23 -3.56 2.96 -1.26 -1.73 118.68 116.57 1woh s LEU 20 Ca 0.66 1.49 -0.01 0.00 -0.22 0.00 0.00 54.13 56.05 1woh s LEU 20 Cb -0.34 -3.28 -0.03 0.00 0.50 0.00 0.00 46.19 43.04 1woh s LEU 20 CO 0.41 -0.01 0.20 0.68 -1.32 0.00 0.00 176.35 176.32 1woh s VAL 21 N 0.01 0.00 -0.12 1.68 -7.23 -0.16 -4.92 120.40 109.67 1woh s VAL 21 Ca 0.40 -1.92 -0.06 0.00 -1.81 0.00 0.00 61.98 58.59 1woh s VAL 21 Cb -0.21 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 1woh s VAL 21 CO 0.24 0.00 0.10 -1.10 -0.31 0.00 0.00 175.10 174.03 1woh s GLN 22 N -3.99 3.39 0.48 4.82 -1.52 -1.26 -4.04 119.66 117.54 1woh s GLN 22 Ca 0.37 -0.21 0.29 0.00 -1.95 0.00 0.00 55.36 53.87 1woh s GLN 22 Cb 0.05 -3.11 1.38 0.00 -0.22 0.00 0.00 33.01 31.11 1woh s GLN 22 CO 0.14 0.71 1.78 -1.35 -0.25 0.00 0.00 175.29 176.33 1woh h PRO 23 N 5.18 0.15 -0.31 2.91 0.11 -1.94 0.24 132.00 138.34 1woh h PRO 23 Ca -0.52 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.55 1woh h PRO 23 Cb 1.21 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1woh h PRO 23 CO 0.59 0.10 0.01 -0.40 -0.21 0.00 0.00 178.00 178.08 1woh n ASP 24 N -4.38 3.98 -4.57 -2.05 5.75 -1.26 -4.07 116.55 109.95 1woh n ASP 24 Ca 0.26 -3.07 -0.27 0.00 -0.01 0.00 0.00 54.79 51.70 1woh n ASP 24 Cb 1.12 -0.57 0.12 0.00 -1.03 0.00 0.00 41.12 40.76 1woh n ASP 24 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1woh s GLY 25 N -1.85 1.73 -1.09 6.12 0.00 0.85 -4.99 107.32 108.09 1woh s GLY 25 Ca 0.44 -1.22 -0.17 0.00 0.00 0.00 0.00 44.72 43.78 1woh s GLY 25 CO 0.09 -0.63 1.33 -0.35 0.00 0.00 0.00 173.10 173.54 1woh s ASP 26 N -4.71 6.83 0.25 1.64 2.15 -1.26 -4.94 116.67 116.63 1woh s ASP 26 Ca 0.67 -2.46 -0.11 0.00 0.43 0.00 0.00 52.55 51.08 1woh s ASP 26 Cb -0.07 -2.42 -0.01 0.00 -0.30 0.00 0.00 42.92 40.12 1woh s ASP 26 CO 0.48 -0.96 0.45 -1.66 -0.17 0.00 0.00 175.17 173.31 1woh s TRP 27 N 2.46 0.47 -0.24 -5.34 1.48 -1.26 -5.12 118.94 111.40 1woh s TRP 27 Ca 0.40 -0.82 -0.23 0.00 -1.06 0.00 0.00 56.10 54.38 1woh s TRP 27 Cb -0.03 0.12 0.06 0.00 -1.16 0.00 0.00 33.47 32.46 1woh s TRP 27 CO -0.04 -0.98 0.66 -0.65 -4.06 0.00 0.00 176.95 171.88 1woh s GLN 28 N -3.94 0.79 0.13 3.25 -0.21 -1.26 -4.83 119.66 113.59 1woh s GLN 28 Ca 0.24 0.87 -0.20 0.00 0.02 0.00 0.00 55.36 56.30 1woh s GLN 28 Cb -0.00 0.38 0.05 0.00 1.00 0.00 0.00 33.01 34.44 1woh s GLN 28 CO 0.10 -0.11 0.49 0.00 -2.12 0.00 0.00 175.29 173.66 1woh s ALA 29 N 0.25 -1.24 0.17 6.09 0.00 -0.85 -5.00 121.76 121.17 1woh s ALA 29 Ca -0.01 0.25 -0.09 0.00 0.00 0.00 0.00 51.96 52.10 1woh s ALA 29 Cb -0.04 0.73 0.03 0.00 0.00 0.00 0.00 23.12 23.83 1woh s ALA 29 CO 0.01 -0.67 1.56 -0.44 0.00 0.00 0.00 175.76 176.22 1woh h ASP 30 N 2.28 1.01 -3.77 0.00 3.32 -1.49 -3.07 116.42 114.70 1woh h ASP 30 Ca -0.34 -0.38 -0.55 0.00 0.02 0.00 0.00 57.03 55.78 1woh h ASP 30 Cb 1.27 -0.28 -0.32 0.00 0.22 0.00 0.00 39.33 40.23 1woh h ASP 30 CO 0.43 1.18 -0.83 -0.69 -1.72 0.00 0.00 179.24 177.60 1woh s VAL 31 N -4.67 1.37 -0.07 -1.35 1.01 0.19 -1.15 120.40 115.73 1woh s VAL 31 Ca -0.11 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.20 1woh s VAL 31 Cb 0.12 -1.19 0.02 0.00 0.00 0.00 0.00 36.38 35.34 1woh s VAL 31 CO 0.87 0.40 -0.06 0.00 0.00 0.00 0.00 175.10 176.31 1woh s ALA 32 N 0.18 0.96 0.05 5.51 0.00 -1.13 -0.75 121.76 126.58 1woh s ALA 32 Ca -0.07 -0.27 -0.12 0.00 0.00 0.00 0.00 51.96 51.51 1woh s ALA 32 Cb -0.12 -0.66 -0.06 0.00 0.00 0.00 0.00 23.12 22.28 1woh s ALA 32 CO 0.03 -0.21 0.40 0.00 0.00 0.00 0.00 175.76 175.98 1woh s ALA 33 N 1.34 3.71 -0.05 0.00 0.00 0.27 -0.57 121.76 126.47 1woh s ALA 33 Ca -0.03 -0.32 -0.02 0.00 0.00 0.00 0.00 51.96 51.58 1woh s ALA 33 Cb -0.14 -2.31 0.04 0.00 0.00 0.00 0.00 23.12 20.71 1woh s ALA 33 CO -0.03 0.53 0.11 -1.17 0.00 0.00 0.00 175.76 175.20 1woh s LEU 34 N -1.61 0.52 0.11 0.00 2.96 0.15 -0.49 118.68 120.32 1woh s LEU 34 Ca 0.30 0.21 -0.05 0.00 -0.22 0.00 0.00 54.13 54.36 1woh s LEU 34 Cb -0.15 0.15 -0.05 0.00 0.50 0.00 0.00 46.19 46.64 1woh s LEU 34 CO 0.16 -0.18 0.35 -0.83 -1.32 0.00 0.00 176.35 174.52 1woh s GLY 35 N 1.58 2.24 -0.48 7.98 0.00 -0.21 -0.43 107.32 118.00 1woh s GLY 35 Ca -0.04 -0.58 0.05 0.00 0.00 0.00 0.00 44.72 44.15 1woh s GLY 35 CO -0.05 -0.48 0.40 -0.62 0.00 0.00 0.00 173.10 172.36 1woh n VAL 36 N 0.32 -0.48 -0.81 1.40 0.31 0.14 -1.16 118.33 118.05 1woh n VAL 36 Ca -0.04 -3.83 -0.27 0.00 -0.01 0.00 0.00 64.34 60.19 1woh n VAL 36 Cb 0.52 -1.80 -0.03 0.00 -0.91 0.00 0.00 33.84 31.62 1woh n VAL 36 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1woh n PRO 37 N 2.47 1.85 -4.09 5.55 -0.04 -1.26 -3.13 135.00 136.35 1woh n PRO 37 Ca 0.27 -1.52 -0.32 0.00 -0.04 0.00 0.00 63.50 61.89 1woh n PRO 37 Cb 0.46 -2.55 -0.16 0.00 -0.04 0.00 0.00 33.50 31.20 1woh n PRO 37 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1woh s PHE 38 N 3.88 2.62 -0.00 0.54 5.36 -1.26 -4.73 117.98 124.38 1woh s PHE 38 Ca 0.42 -1.55 0.00 0.00 -0.96 0.00 0.00 56.93 54.85 1woh s PHE 38 Cb 0.11 -1.83 0.00 0.00 -0.34 0.00 0.00 43.02 40.96 1woh s PHE 38 CO 0.01 -0.77 0.89 -0.40 -1.46 0.00 0.00 175.22 173.48 1woh n ASP 39 N 4.66 0.05 -0.05 6.13 5.68 -1.26 0.03 116.55 131.79 1woh n ASP 39 Ca -0.20 -1.79 0.16 0.00 -0.50 0.00 0.00 54.79 52.46 1woh n ASP 39 Cb 0.50 -0.16 0.87 0.00 -1.14 0.00 0.00 41.12 41.19 1woh n ASP 39 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 1woh n ILE 40 N -0.03 0.00 0.63 2.12 -5.35 -1.26 -3.41 119.36 112.07 1woh n ILE 40 Ca 0.00 -0.02 0.11 0.00 -0.27 0.00 0.00 62.75 62.57 1woh n ILE 40 Cb 0.65 -0.40 0.01 0.00 -1.74 0.00 0.00 39.64 38.16 1woh n ILE 40 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1woh n ALA 41 N -0.94 3.58 -1.52 -1.28 0.00 -1.26 -4.95 120.51 114.15 1woh n ALA 41 Ca 0.22 -0.44 -0.32 0.00 0.00 0.00 0.00 53.44 52.90 1woh n ALA 41 Cb 0.16 -0.94 0.05 0.00 0.00 0.00 0.00 19.45 18.72 1woh n ALA 41 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1woh s LEU 42 N -3.75 3.28 0.00 0.00 0.05 -1.22 -3.07 118.68 113.97 1woh s LEU 42 Ca 0.04 1.81 0.21 0.00 0.05 0.00 0.00 54.13 56.24 1woh s LEU 42 Cb 0.15 -4.52 0.42 0.00 -2.05 0.00 0.00 46.19 40.18 1woh s LEU 42 CO 0.81 -1.53 1.36 0.61 -0.55 0.00 0.00 176.35 177.05 1woh n GLY 43 N -1.18 1.83 0.00 -3.48 0.00 -1.26 -4.94 105.19 96.16 1woh n GLY 43 Ca 0.09 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1woh n GLY 43 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1woh n PHE 44 N 1.34 0.00 -3.52 1.61 -0.00 -1.26 -5.09 117.46 110.54 1woh n PHE 44 Ca 0.18 0.00 -0.41 0.00 -0.00 0.00 0.00 57.45 57.22 1woh n PHE 44 Cb 0.56 0.00 -0.10 0.00 -0.00 0.00 0.00 39.48 39.94 1woh n PHE 44 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1woh s ARG 45 N 0.82 3.36 0.97 -4.13 0.52 -1.26 -5.09 118.95 114.14 1woh s ARG 45 Ca 0.00 -0.74 -0.12 0.00 -0.52 0.00 0.00 55.73 54.35 1woh s ARG 45 Cb 0.00 -3.83 0.17 0.00 0.52 0.00 0.00 34.95 31.81 1woh s ARG 45 CO 0.00 -0.51 1.11 -1.25 0.02 0.00 0.00 175.30 174.67 1woh s PRO 46 N 1.71 0.68 0.00 3.54 0.04 -1.26 -4.45 135.00 135.26 1woh s PRO 46 Ca 0.06 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.51 1woh s PRO 46 Cb -0.18 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1woh s PRO 46 CO 0.10 -2.53 0.00 0.41 0.04 0.00 0.00 177.00 175.02 1woh n GLY 47 N -1.55 1.01 0.26 0.56 0.00 -1.26 -4.95 105.19 99.26 1woh n GLY 47 Ca 0.06 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.25 1woh n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1woh h ALA 48 N 0.00 1.00 0.00 4.61 0.00 -1.85 -0.85 119.26 122.17 1woh h ALA 48 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1woh h ALA 48 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1woh h ALA 48 CO 0.00 -0.00 0.00 0.07 0.00 0.00 0.00 179.25 179.32 1woh h ARG 49 N 0.00 0.00 -0.01 0.00 0.11 -1.84 -0.80 114.38 111.84 1woh h ARG 49 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1woh h ARG 49 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1woh h ARG 49 CO 0.00 0.00 -0.34 1.19 0.10 0.00 0.00 179.97 180.92 1woh n PHE 50 N -2.82 0.00 -0.15 4.08 3.72 -0.32 -4.47 117.46 117.50 1woh n PHE 50 Ca -0.00 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.32 1woh n PHE 50 Cb 0.21 -0.08 0.01 0.00 -0.94 0.00 0.00 39.48 38.67 1woh n PHE 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1woh h ALA 51 N 3.73 0.57 -0.46 4.37 0.00 -1.31 -1.81 119.26 124.35 1woh h ALA 51 Ca 0.00 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.93 1woh h ALA 51 Cb 0.58 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 1woh h ALA 51 CO 0.00 0.07 0.03 -1.35 0.00 0.00 0.00 179.25 177.99 1woh h PRO 52 N 0.59 0.14 -0.54 0.00 0.11 -1.76 0.30 132.00 130.84 1woh h PRO 52 Ca 0.16 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.22 1woh h PRO 52 Cb 0.01 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 1woh h PRO 52 CO -0.03 0.09 0.19 -0.09 -0.21 0.00 0.00 178.00 177.95 1woh h ARG 53 N 0.14 0.83 -0.81 1.05 2.43 -1.84 -1.54 114.38 114.64 1woh h ARG 53 Ca 0.23 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1woh h ARG 53 Cb 0.33 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.72 1woh h ARG 53 CO -0.36 0.74 0.36 0.00 -1.51 0.00 0.00 179.97 179.20 1woh h ALA 54 N 1.04 1.05 -0.52 2.80 0.00 -0.46 -1.82 119.26 121.35 1woh h ALA 54 Ca 0.18 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1woh h ALA 54 Cb 0.25 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1woh h ALA 54 CO -0.01 0.64 -0.12 -0.07 0.00 0.00 0.00 179.25 179.69 1woh h LEU 55 N 1.16 1.00 0.02 0.00 3.38 -0.18 -0.91 115.31 119.78 1woh h LEU 55 Ca 0.27 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1woh h LEU 55 Cb 0.17 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1woh h LEU 55 CO -0.03 1.12 -0.01 0.03 0.09 0.00 0.00 178.44 179.64 1woh h ARG 56 N 0.88 -0.03 -0.78 1.13 3.08 -1.04 0.34 114.38 117.96 1woh h ARG 56 Ca 0.13 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.23 1woh h ARG 56 Cb 0.68 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.69 1woh h ARG 56 CO 0.05 0.07 0.49 0.93 -1.07 0.00 0.00 179.97 180.44 1woh h GLU 57 N -0.11 0.91 0.00 0.04 5.08 -1.21 -2.06 114.58 117.23 1woh h GLU 57 Ca -0.00 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1woh h GLU 57 Cb 0.11 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1woh h GLU 57 CO 0.00 0.61 -0.38 0.00 -1.00 0.00 0.00 179.01 178.24 1woh h ALA 58 N 1.34 1.15 0.00 3.43 0.00 -0.91 -2.90 119.26 121.37 1woh h ALA 58 Ca 0.32 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1woh h ALA 58 Cb 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1woh h ALA 58 CO -0.13 0.47 0.00 -1.13 0.00 0.00 0.00 179.25 178.46 1woh n SER 59 N -3.75 0.49 0.03 0.00 3.41 0.09 -1.97 113.62 111.91 1woh n SER 59 Ca -0.01 0.62 0.09 0.00 -0.26 0.00 0.00 58.87 59.31 1woh n SER 59 Cb 0.46 -0.72 0.38 0.00 -0.26 0.00 0.00 64.21 64.06 1woh n SER 59 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1woh n LEU 60 N -2.04 0.17 -0.01 1.04 4.77 -1.09 -0.66 117.00 119.18 1woh n LEU 60 Ca 0.02 0.54 0.12 0.00 -0.03 0.00 0.00 56.01 56.66 1woh n LEU 60 Cb 0.21 -0.51 0.26 0.00 -2.33 0.00 0.00 43.42 41.04 1woh n LEU 60 CO 0.18 -0.30 0.46 0.54 -1.33 0.00 0.00 177.39 176.94 1woh n ARG 61 N -1.68 0.02 -3.15 3.23 5.12 -0.83 -4.33 116.66 115.02 1woh n ARG 61 Ca 0.04 -0.01 -0.20 0.00 -1.93 0.00 0.00 57.85 55.74 1woh n ARG 61 Cb 0.20 -1.50 -0.04 0.00 -1.16 0.00 0.00 32.46 29.97 1woh n ARG 61 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1woh n SER 62 N -1.48 1.45 -4.70 0.55 7.64 0.17 -5.09 113.62 112.16 1woh n SER 62 Ca 0.06 -3.10 -0.40 0.00 1.01 0.00 0.00 58.87 56.43 1woh n SER 62 Cb 0.34 -0.61 -0.04 0.00 -1.01 0.00 0.00 64.21 62.88 1woh n SER 62 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1woh s VAL 63 N -2.63 4.98 0.74 0.44 1.01 -1.19 -4.83 120.40 118.92 1woh s VAL 63 Ca 0.41 1.54 -0.11 0.00 0.00 0.00 0.00 61.98 63.82 1woh s VAL 63 Cb 0.31 -4.09 0.04 0.00 0.00 0.00 0.00 36.38 32.64 1woh s VAL 63 CO -0.09 0.18 1.08 -2.16 0.00 0.00 0.00 175.10 174.10 1woh s PRO 64 N 1.23 2.51 0.96 2.72 0.04 -1.26 -4.71 135.00 136.49 1woh s PRO 64 Ca 0.39 0.97 -0.15 0.00 0.04 0.00 0.00 61.00 62.25 1woh s PRO 64 Cb -0.18 -1.94 0.21 0.00 0.04 0.00 0.00 34.50 32.63 1woh s PRO 64 CO 0.17 -1.40 1.32 -1.25 0.04 0.00 0.00 177.00 175.87 1woh s PRO 65 N -5.01 0.58 -0.06 0.56 0.04 -1.26 -5.12 135.00 124.73 1woh s PRO 65 Ca 0.60 -0.52 0.03 0.00 0.04 0.00 0.00 61.00 61.15 1woh s PRO 65 Cb -0.15 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.53 1woh s PRO 65 CO 0.55 -2.43 -0.14 -0.06 0.04 0.00 0.00 177.00 174.97 1woh s PHE 66 N -3.87 1.55 -0.30 0.56 0.40 -0.89 -4.99 117.98 110.45 1woh s PHE 66 Ca 0.75 -0.56 -0.04 0.00 -0.60 0.00 0.00 56.93 56.47 1woh s PHE 66 Cb -0.03 -1.12 0.03 0.00 0.51 0.00 0.00 43.02 42.42 1woh s PHE 66 CO 0.53 -0.27 0.03 0.99 0.70 0.00 0.00 175.22 177.20 1woh s THR 67 N 0.56 3.37 0.68 0.64 2.01 -1.26 -0.63 115.64 121.02 1woh s THR 67 Ca -0.14 -1.12 -0.12 0.00 0.31 0.00 0.00 61.69 60.63 1woh s THR 67 Cb -0.15 -2.85 0.16 0.00 0.01 0.00 0.00 72.50 69.67 1woh s THR 67 CO 0.04 -0.03 0.74 0.61 -0.69 0.00 0.00 174.62 175.28 1woh n GLY 68 N 4.73 -2.06 0.31 4.40 0.00 -0.69 -4.86 105.19 107.02 1woh n GLY 68 Ca -0.14 -1.58 0.20 0.00 0.00 0.00 0.00 46.02 44.51 1woh n GLY 68 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1woh h LEU 69 N 0.00 0.00 -2.08 0.99 5.85 -1.99 -1.66 115.31 116.42 1woh h LEU 69 Ca -0.26 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1woh h LEU 69 Cb 0.75 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.78 1woh h LEU 69 CO 0.17 0.01 0.00 -0.90 -0.34 0.00 0.00 178.44 177.38 1woh n ASP 70 N -3.12 3.11 0.00 1.25 5.68 -1.26 -4.91 116.55 117.29 1woh n ASP 70 Ca -0.02 -2.27 0.00 0.00 -0.50 0.00 0.00 54.79 52.00 1woh n ASP 70 Cb 0.17 -0.45 0.00 0.00 -1.14 0.00 0.00 41.12 39.70 1woh n ASP 70 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1woh n GLY 71 N 0.80 1.47 3.76 6.12 0.00 -0.62 -4.96 105.19 111.76 1woh n GLY 71 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1woh n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1woh s LYS 72 N 0.00 4.52 -0.14 1.61 1.02 -1.26 -4.76 119.74 120.73 1woh s LYS 72 Ca 0.00 1.95 -0.02 0.00 0.02 0.00 0.00 55.97 57.92 1woh s LYS 72 Cb 0.00 -3.17 -0.02 0.00 -0.52 0.00 0.00 37.83 34.12 1woh s LYS 72 CO 0.00 0.01 -0.09 0.99 -0.92 0.00 0.00 175.35 175.34 1woh s THR 73 N -0.85 3.38 0.19 2.17 2.01 -1.26 -1.70 115.64 119.58 1woh s THR 73 Ca 0.48 -0.54 0.07 0.00 0.31 0.00 0.00 61.69 62.01 1woh s THR 73 Cb -0.34 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 1woh s THR 73 CO 0.43 0.51 0.01 -0.13 -0.69 0.00 0.00 174.62 174.75 1woh s ARG 74 N 0.39 2.44 -0.77 4.92 0.52 0.20 -4.48 118.95 122.16 1woh s ARG 74 Ca -0.08 -1.12 0.00 0.00 -0.52 0.00 0.00 55.73 54.01 1woh s ARG 74 Cb -0.15 -2.36 0.00 0.00 0.52 0.00 0.00 34.95 32.96 1woh s ARG 74 CO 0.04 0.45 0.00 1.28 0.02 0.00 0.00 175.30 177.09 1woh n LEU 75 N -0.25 -0.16 -4.63 2.53 4.77 -1.26 -2.08 117.00 115.91 1woh n LEU 75 Ca -0.09 0.18 -0.43 0.00 -0.03 0.00 0.00 56.01 55.64 1woh n LEU 75 Cb 0.56 -2.07 -0.03 0.00 -2.33 0.00 0.00 43.42 39.55 1woh n LEU 75 CO 0.39 -0.75 1.53 -1.58 -1.33 0.00 0.00 177.39 175.65 1woh s GLN 76 N -2.32 3.74 0.00 3.23 2.00 -1.26 -1.69 119.66 123.35 1woh s GLN 76 Ca 0.00 1.97 0.00 0.00 -2.00 0.00 0.00 55.36 55.33 1woh s GLN 76 Cb 0.00 -4.14 0.00 0.00 0.80 0.00 0.00 33.01 29.67 1woh s GLN 76 CO 0.00 -1.38 0.00 0.41 -0.50 0.00 0.00 175.29 173.82 1woh n GLY 77 N 4.86 1.15 3.70 2.59 0.00 -1.26 -5.03 105.19 111.19 1woh n GLY 77 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1woh n GLY 77 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1woh s VAL 78 N -2.49 4.53 0.02 1.61 1.01 -0.68 -5.02 120.40 119.37 1woh s VAL 78 Ca 0.00 1.82 -0.15 0.00 0.00 0.00 0.00 61.98 63.65 1woh s VAL 78 Cb 0.00 -4.17 -0.06 0.00 0.00 0.00 0.00 36.38 32.16 1woh s VAL 78 CO 0.00 0.05 0.42 0.42 0.00 0.00 0.00 175.10 175.99 1woh s THR 79 N 1.74 5.00 0.26 3.92 -4.23 -1.26 -4.96 115.64 116.11 1woh s THR 79 Ca 0.53 0.84 0.12 0.00 -1.18 0.00 0.00 61.69 62.00 1woh s THR 79 Cb -0.22 -3.72 -0.05 0.00 1.34 0.00 0.00 72.50 69.84 1woh s THR 79 CO 0.23 0.55 -0.20 -0.36 -0.54 0.00 0.00 174.62 174.30 1woh s PHE 80 N -1.12 2.31 -0.02 3.99 0.40 -1.26 -0.64 117.98 121.64 1woh s PHE 80 Ca 0.25 -0.33 -0.15 0.00 -0.60 0.00 0.00 56.93 56.10 1woh s PHE 80 Cb -0.17 -1.02 0.02 0.00 0.51 0.00 0.00 43.02 42.36 1woh s PHE 80 CO 0.14 0.68 0.32 0.00 0.70 0.00 0.00 175.22 177.06 1woh s ALA 81 N -2.36 -0.80 -0.27 5.36 0.00 0.07 -4.24 121.76 119.52 1woh s ALA 81 Ca 0.28 0.37 0.02 0.00 0.00 0.00 0.00 51.96 52.64 1woh s ALA 81 Cb -0.06 0.04 0.06 0.00 0.00 0.00 0.00 23.12 23.16 1woh s ALA 81 CO 0.14 -0.26 -0.08 0.34 0.00 0.00 0.00 175.76 175.91 1woh s ASP 82 N -1.24 4.58 -0.04 0.00 -1.08 -0.70 -0.56 116.67 117.62 1woh s ASP 82 Ca -0.13 -1.39 0.04 0.00 -0.52 0.00 0.00 52.55 50.56 1woh s ASP 82 Cb -0.05 -1.60 0.20 0.00 -1.46 0.00 0.00 42.92 40.01 1woh s ASP 82 CO 0.04 -0.22 0.93 0.00 0.52 0.00 0.00 175.17 176.44 1woh n ALA 83 N 4.48 2.74 -0.48 3.66 0.00 0.36 -0.98 120.51 130.28 1woh n ALA 83 Ca -0.13 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1woh n ALA 83 Cb 0.42 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1woh n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1woh n GLY 84 N 0.37 0.21 3.47 0.00 0.00 -1.26 -4.11 105.19 103.88 1woh n GLY 84 Ca 0.07 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 44.94 1woh n GLY 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1woh s ASP 85 N -4.00 3.67 0.29 1.61 1.01 -1.26 -1.05 116.67 116.94 1woh s ASP 85 Ca 0.00 -0.85 -0.29 0.00 0.71 0.00 0.00 52.55 52.11 1woh s ASP 85 Cb 0.00 -0.38 -0.10 0.00 1.01 0.00 0.00 42.92 43.45 1woh s ASP 85 CO 0.00 0.09 1.29 -0.69 0.21 0.00 0.00 175.17 176.07 1woh s VAL 86 N -1.95 2.92 -0.58 -1.27 1.01 -0.31 -4.91 120.40 115.32 1woh s VAL 86 Ca 0.25 0.87 -0.26 0.00 0.00 0.00 0.00 61.98 62.83 1woh s VAL 86 Cb -0.07 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.79 1woh s VAL 86 CO 0.13 0.18 1.09 -0.63 0.00 0.00 0.00 175.10 175.87 1woh s ILE 87 N -0.76 4.16 0.00 2.22 1.01 -1.26 -4.79 121.20 121.78 1woh s ILE 87 Ca 0.51 0.59 -0.07 0.00 0.00 0.00 0.00 60.65 61.68 1woh s ILE 87 Cb -0.38 -4.66 -0.05 0.00 0.01 0.00 0.00 42.46 37.38 1woh s ILE 87 CO 0.47 -1.28 0.26 -0.76 0.00 0.00 0.00 174.94 173.64 1woh s LEU 88 N 4.55 4.37 0.84 2.97 1.43 -1.26 -4.95 118.68 126.63 1woh s LEU 88 Ca 0.37 0.55 -0.09 0.00 -1.03 0.00 0.00 54.13 53.93 1woh s LEU 88 Cb -0.10 -2.64 0.16 0.00 0.03 0.00 0.00 46.19 43.64 1woh s LEU 88 CO 0.22 0.26 1.16 -2.16 0.23 0.00 0.00 176.35 176.07 1woh s PRO 89 N -1.72 1.23 0.11 1.29 0.04 -1.26 -5.05 135.00 129.63 1woh s PRO 89 Ca 0.27 -0.64 -0.17 0.00 0.04 0.00 0.00 61.00 60.49 1woh s PRO 89 Cb -0.13 -2.06 -0.07 0.00 0.04 0.00 0.00 34.50 32.28 1woh s PRO 89 CO 0.16 -1.91 0.57 -1.12 0.04 0.00 0.00 177.00 174.73 1woh s SER 90 N -4.79 6.97 0.74 6.66 0.01 -1.26 -4.87 113.70 117.15 1woh s SER 90 Ca 0.69 1.20 0.00 0.00 1.31 0.00 0.00 55.95 59.15 1woh s SER 90 Cb -0.05 -2.33 0.00 0.00 0.21 0.00 0.00 66.02 63.84 1woh s SER 90 CO 0.49 0.19 0.00 0.18 0.41 0.00 0.00 173.24 174.51 1woh n LEU 91 N 1.30 0.00 -3.94 2.44 4.77 -1.26 -4.86 117.00 115.46 1woh n LEU 91 Ca -0.08 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.52 1woh n LEU 91 Cb 0.51 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.62 1woh n LEU 91 CO 0.42 0.00 -0.16 -0.62 -1.33 0.00 0.00 177.39 175.70 1woh n GLU 92 N 14.00 -0.91 -0.28 3.23 -0.58 -1.26 -4.72 120.64 130.12 1woh n GLU 92 Ca 0.00 0.24 0.16 0.00 -0.42 0.00 0.00 57.16 57.15 1woh n GLU 92 Cb 0.00 -3.36 0.44 0.00 -0.57 0.00 0.00 31.44 27.95 1woh n GLU 92 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1woh h PRO 93 N -2.25 0.54 -0.35 3.49 0.13 -1.96 -1.12 132.00 130.48 1woh h PRO 93 Ca -0.69 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.37 1woh h PRO 93 Cb 1.39 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1woh h PRO 93 CO 0.53 0.35 0.07 0.37 -0.23 0.00 0.00 178.00 179.09 1woh h GLN 94 N 0.55 0.56 -0.65 0.86 4.15 -1.99 0.37 115.11 118.96 1woh h GLN 94 Ca 0.49 -0.14 -0.09 0.00 0.77 0.00 0.00 58.65 59.68 1woh h GLN 94 Cb 1.02 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.61 1woh h GLN 94 CO -0.23 0.63 0.07 1.25 -1.93 0.00 0.00 178.83 178.62 1woh h LEU 95 N 0.41 1.07 -0.60 -2.39 5.85 -1.73 -1.90 115.31 116.00 1woh h LEU 95 Ca 0.11 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1woh h LEU 95 Cb 0.33 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1woh h LEU 95 CO 0.00 1.08 0.39 0.00 -0.34 0.00 0.00 178.44 179.57 1woh h ALA 96 N 1.03 0.77 -0.72 1.25 0.00 -0.97 -0.57 119.26 120.05 1woh h ALA 96 Ca 0.19 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.08 1woh h ALA 96 Cb 0.49 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1woh h ALA 96 CO 0.02 0.21 0.45 0.45 0.00 0.00 0.00 179.25 180.39 1woh h HIS 97 N 0.82 0.85 -0.43 0.00 3.86 -0.55 -1.01 115.15 118.69 1woh h HIS 97 Ca 0.22 0.02 -0.09 0.00 -1.16 0.00 0.00 60.37 59.36 1woh h HIS 97 Cb -0.07 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.10 1woh h HIS 97 CO -0.03 0.49 -0.11 -0.44 0.86 0.00 0.00 177.93 178.71 1woh h ASP 98 N 0.89 0.76 -0.63 2.45 3.32 -0.77 -1.25 116.42 121.19 1woh h ASP 98 Ca 0.28 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 1woh h ASP 98 Cb 0.00 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 1woh h ASP 98 CO -0.10 0.90 0.12 0.03 -1.72 0.00 0.00 179.24 178.47 1woh h ARG 99 N 0.70 1.03 -0.20 3.56 2.47 -0.61 -1.77 114.38 119.56 1woh h ARG 99 Ca 0.12 -0.27 -0.02 0.00 -1.26 0.00 0.00 59.98 58.55 1woh h ARG 99 Cb 0.58 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.77 1woh h ARG 99 CO 0.04 0.95 0.05 0.82 0.56 0.00 0.00 179.97 182.39 1woh h ILE 100 N 0.95 1.21 -0.64 2.04 2.04 -0.90 -1.52 117.51 120.68 1woh h ILE 100 Ca 0.19 -0.66 -0.05 0.00 1.00 0.00 0.00 64.86 65.34 1woh h ILE 100 Cb 0.40 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 1woh h ILE 100 CO 0.01 0.21 0.19 0.74 0.00 0.00 0.00 178.15 179.29 1woh h THR 101 N 0.14 1.25 -0.34 -0.27 2.02 -1.16 -0.37 112.91 114.17 1woh h THR 101 Ca 0.06 -0.87 -0.03 0.00 0.77 0.00 0.00 66.41 66.34 1woh h THR 101 Cb 0.27 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 1woh h THR 101 CO 0.00 0.33 0.10 -0.08 0.37 0.00 0.00 175.52 176.24 1woh h GLU 102 N 0.92 0.53 -0.66 6.66 4.57 -1.24 -0.33 114.58 125.04 1woh h GLU 102 Ca 0.20 -0.12 -0.06 0.00 -1.18 0.00 0.00 59.36 58.21 1woh h GLU 102 Cb 0.31 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.80 1woh h GLU 102 CO -0.00 0.57 0.19 0.00 -1.18 0.00 0.00 179.01 178.59 1woh h ALA 103 N 0.94 0.86 -0.65 2.92 0.00 -1.17 -2.26 119.26 119.90 1woh h ALA 103 Ca 0.11 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1woh h ALA 103 Cb 0.27 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1woh h ALA 103 CO -0.00 0.55 0.43 0.00 0.00 0.00 0.00 179.25 180.23 1woh h ALA 104 N 1.08 0.82 -0.44 0.00 0.00 -0.80 -1.39 119.26 118.53 1woh h ALA 104 Ca 0.21 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1woh h ALA 104 Cb 0.32 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1woh h ALA 104 CO -0.00 0.25 0.27 0.00 0.00 0.00 0.00 179.25 179.77 1woh h ARG 105 N 0.88 0.53 -0.07 0.00 3.08 -0.71 -0.47 114.38 117.62 1woh h ARG 105 Ca 0.24 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.25 1woh h ARG 105 Cb -0.10 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 29.83 1woh h ARG 105 CO -0.05 0.35 0.03 1.96 -1.07 0.00 0.00 179.97 181.19 1woh h GLN 106 N 0.54 0.10 -0.81 0.04 4.20 -1.03 -2.55 115.11 115.60 1woh h GLN 106 Ca 0.17 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.83 1woh h GLN 106 Cb -0.01 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 1woh h GLN 106 CO -0.07 0.19 0.35 0.28 -0.67 0.00 0.00 178.83 178.91 1woh h VAL 107 N -0.01 1.26 -0.90 -0.54 2.07 -1.14 -2.89 116.25 114.09 1woh h VAL 107 Ca 0.02 -0.78 0.03 0.00 0.82 0.00 0.00 66.70 66.80 1woh h VAL 107 Cb 0.12 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.09 1woh h VAL 107 CO -0.00 0.32 0.59 0.03 0.02 0.00 0.00 177.57 178.53 1woh h ARG 108 N 1.17 1.12 0.00 1.57 2.47 -0.91 -2.20 114.38 117.60 1woh h ARG 108 Ca 0.27 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.93 1woh h ARG 108 Cb 0.17 -0.25 0.00 0.00 -1.65 0.00 0.00 29.97 28.24 1woh h ARG 108 CO -0.03 0.74 0.00 0.41 0.56 0.00 0.00 179.97 181.65 1woh n GLY 109 N -1.34 -1.04 0.35 0.04 0.00 -0.97 -3.29 105.19 98.93 1woh n GLY 109 Ca 0.11 -0.12 0.05 0.00 0.00 0.00 0.00 46.02 46.05 1woh n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1woh n ARG 110 N -1.24 0.58 -4.16 1.61 1.74 -0.84 -5.03 116.66 109.33 1woh n ARG 110 Ca 0.13 -0.98 -0.11 0.00 -0.77 0.00 0.00 57.85 56.11 1woh n ARG 110 Cb 0.18 -1.16 -0.09 0.00 -1.02 0.00 0.00 32.46 30.37 1woh n ARG 110 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1woh h ARG 112 N 2.53 0.00 -4.67 0.00 2.43 -1.32 -3.45 114.38 109.90 1woh h ARG 112 Ca -0.34 0.00 -0.65 0.00 -0.81 0.00 0.00 59.98 58.18 1woh h ARG 112 Cb 1.25 0.00 -0.38 0.00 -0.42 0.00 0.00 29.97 30.42 1woh h ARG 112 CO 0.49 0.77 -0.78 0.08 -1.51 0.00 0.00 179.97 179.03 1woh s VAL 113 N -2.26 2.01 0.12 0.20 1.01 -0.30 -4.82 120.40 116.36 1woh s VAL 113 Ca -0.23 -1.69 -0.24 0.00 0.00 0.00 0.00 61.98 59.82 1woh s VAL 113 Cb 0.03 -2.24 -0.07 0.00 0.00 0.00 0.00 36.38 34.10 1woh s VAL 113 CO 0.51 -0.19 0.74 -2.16 0.00 0.00 0.00 175.10 174.00 1woh s PRO 114 N 1.14 4.50 -0.24 2.72 0.04 -1.26 -2.84 135.00 139.06 1woh s PRO 114 Ca -0.03 1.07 -0.01 0.00 0.04 0.00 0.00 61.00 62.07 1woh s PRO 114 Cb -0.19 -3.28 0.03 0.00 0.04 0.00 0.00 34.50 31.09 1woh s PRO 114 CO -0.07 0.51 -0.09 0.08 0.04 0.00 0.00 177.00 177.47 1woh s VAL 115 N -0.88 2.64 -0.21 -0.36 1.01 0.27 -1.98 120.40 120.88 1woh s VAL 115 Ca 0.35 -1.07 -0.10 0.00 0.00 0.00 0.00 61.98 61.17 1woh s VAL 115 Cb -0.22 -2.32 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 1woh s VAL 115 CO 0.24 0.24 0.13 -0.36 0.00 0.00 0.00 175.10 175.36 1woh s PHE 116 N 1.29 3.35 -0.30 5.22 0.40 0.45 -0.68 117.98 127.72 1woh s PHE 116 Ca 0.00 0.25 -0.08 0.00 -0.60 0.00 0.00 56.93 56.50 1woh s PHE 116 Cb -0.16 -2.18 0.00 0.00 0.51 0.00 0.00 43.02 41.19 1woh s PHE 116 CO -0.06 0.19 0.10 -0.51 0.70 0.00 0.00 175.22 175.65 1woh s LEU 117 N 0.59 3.93 0.87 -0.37 1.43 0.43 -1.07 118.68 124.48 1woh s LEU 117 Ca 0.07 -0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 52.42 1woh s LEU 117 Cb -0.12 -1.92 0.18 0.00 0.03 0.00 0.00 46.19 44.36 1woh s LEU 117 CO 0.00 -0.19 1.19 -0.83 0.23 0.00 0.00 176.35 176.75 1woh s GLY 118 N 1.53 1.78 0.00 -3.19 0.00 0.35 0.26 107.32 108.05 1woh s GLY 118 Ca 0.03 -1.51 0.00 0.00 0.00 0.00 0.00 44.72 43.24 1woh s GLY 118 CO 0.04 -0.80 0.00 0.61 0.00 0.00 0.00 173.10 172.95 1woh n GLY 119 N -3.39 0.03 3.73 0.20 0.00 -0.44 -3.41 105.19 101.91 1woh n GLY 119 Ca 0.16 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.40 1woh n GLY 119 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1woh s ASP 120 N -1.10 2.49 0.42 1.61 1.47 0.10 -1.22 116.67 120.44 1woh s ASP 120 Ca 0.00 0.79 0.30 0.00 1.18 0.00 0.00 52.55 54.82 1woh s ASP 120 Cb 0.00 -1.20 1.40 0.00 -0.34 0.00 0.00 42.92 42.78 1woh s ASP 120 CO 0.00 -3.17 1.89 -0.74 0.68 0.00 0.00 175.17 173.83 1woh h HIS 121 N -1.93 0.00 0.00 2.11 -0.00 -1.90 -2.89 115.15 110.55 1woh h HIS 121 Ca -0.49 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 59.88 1woh h HIS 121 Cb 1.31 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.72 1woh h HIS 121 CO -0.66 0.00 -0.01 0.66 -0.00 0.00 0.00 177.93 177.92 1woh h SER 122 N 0.00 0.00 0.58 3.26 4.64 -1.80 -1.90 113.55 118.33 1woh h SER 122 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1woh h SER 122 Cb 0.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1woh h SER 122 CO 0.00 0.01 -0.09 -0.37 -0.87 0.00 0.00 176.83 175.51 1woh h VAL 123 N 0.00 0.33 -0.14 0.95 -1.51 -1.86 -2.85 116.25 111.17 1woh h VAL 123 Ca -0.00 -0.55 0.04 0.00 -1.23 0.00 0.00 66.70 64.96 1woh h VAL 123 Cb 0.09 1.41 -0.01 0.00 -2.13 0.00 0.00 31.29 30.66 1woh h VAL 123 CO 0.00 0.09 0.11 0.28 -1.23 0.00 0.00 177.57 176.82 1woh h SER 124 N 0.00 0.00 0.51 4.19 0.02 -1.59 -1.81 113.55 114.87 1woh h SER 124 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1woh h SER 124 Cb 0.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1woh h SER 124 CO 0.01 0.00 -0.24 0.22 -1.14 0.00 0.00 176.83 175.68 1woh h TYR 125 N 0.00 -0.63 0.00 3.45 3.20 -1.70 -0.53 116.97 120.75 1woh h TYR 125 Ca 0.07 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 1woh h TYR 125 Cb 0.29 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.77 1woh h TYR 125 CO 0.00 -0.39 -0.02 -1.00 -1.64 0.00 0.00 178.16 175.10 1woh h PRO 126 N -0.99 0.00 -0.05 1.82 0.13 -1.72 -1.75 132.00 129.45 1woh h PRO 126 Ca -0.07 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1woh h PRO 126 Cb 0.52 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.65 1woh h PRO 126 CO 0.11 0.02 -0.03 -0.07 -0.23 0.00 0.00 178.00 177.81 1woh h LEU 127 N 0.00 0.11 -1.68 1.56 4.07 -1.28 -3.13 115.31 114.95 1woh h LEU 127 Ca -0.00 -0.42 -0.04 0.00 0.08 0.00 0.00 57.88 57.50 1woh h LEU 127 Cb 0.07 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.77 1woh h LEU 127 CO 0.00 0.51 -0.17 -0.07 -1.08 0.00 0.00 178.44 177.63 1woh h LEU 128 N -0.29 0.00 -2.24 1.67 3.38 -0.26 -2.26 115.31 115.31 1woh h LEU 128 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1woh h LEU 128 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1woh h LEU 128 CO 0.01 0.17 0.10 0.03 0.09 0.00 0.00 178.44 178.83 1woh h ARG 129 N 0.00 0.00 -0.08 1.13 3.08 -1.31 0.26 114.38 117.46 1woh h ARG 129 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1woh h ARG 129 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1woh h ARG 129 CO 0.02 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.92 1woh n ALA 130 N -1.92 2.57 -1.65 0.04 0.00 -0.85 -3.73 120.51 114.96 1woh n ALA 130 Ca -0.02 -0.31 0.05 0.00 0.00 0.00 0.00 53.44 53.15 1woh n ALA 130 Cb 0.15 -1.20 0.19 0.00 0.00 0.00 0.00 19.45 18.60 1woh n ALA 130 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1woh n PHE 131 N -0.25 0.13 0.26 0.00 3.01 0.91 -4.78 117.46 116.73 1woh n PHE 131 Ca 0.15 -1.50 0.13 0.00 1.01 0.00 0.00 57.45 57.24 1woh n PHE 131 Cb 0.19 -0.25 0.71 0.00 -0.01 0.00 0.00 39.48 40.12 1woh n PHE 131 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1woh h ALA 132 N 1.06 1.20 -0.01 4.37 0.00 -1.71 -2.72 119.26 121.45 1woh h ALA 132 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1woh h ALA 132 Cb 1.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1woh h ALA 132 CO 0.04 0.15 0.00 -0.40 0.00 0.00 0.00 179.25 179.04 1woh n ASP 133 N -3.52 1.22 -4.57 0.00 3.85 -1.26 -4.77 116.55 107.50 1woh n ASP 133 Ca -0.01 -1.41 -0.43 0.00 -0.71 0.00 0.00 54.79 52.23 1woh n ASP 133 Cb 0.26 -0.00 -0.03 0.00 -1.35 0.00 0.00 41.12 40.00 1woh n ASP 133 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1woh s VAL 134 N -2.00 4.29 0.31 2.12 1.01 -1.03 -5.00 120.40 120.11 1woh s VAL 134 Ca 0.40 0.83 -0.29 0.00 0.00 0.00 0.00 61.98 62.92 1woh s VAL 134 Cb 0.21 -4.56 -0.12 0.00 0.00 0.00 0.00 36.38 31.91 1woh s VAL 134 CO 0.34 -1.03 1.49 -0.81 0.00 0.00 0.00 175.10 175.09 1woh n PRO 135 N 7.66 2.50 -4.07 2.72 -0.04 -1.26 -3.05 135.00 139.45 1woh n PRO 135 Ca 0.08 0.88 -0.42 0.00 -0.04 0.00 0.00 63.50 64.00 1woh n PRO 135 Cb 0.49 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 1woh n PRO 135 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1woh n ASP 136 N 1.56 -3.28 -4.72 3.54 8.00 -1.24 -4.69 116.55 115.72 1woh n ASP 136 Ca 0.07 -1.26 -0.42 0.00 0.71 0.00 0.00 54.79 53.89 1woh n ASP 136 Cb 0.36 -1.91 -0.03 0.00 -0.02 0.00 0.00 41.12 39.52 1woh n ASP 136 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1woh s LEU 137 N -7.33 4.37 0.11 0.64 2.96 0.14 -4.34 118.68 115.24 1woh s LEU 137 Ca 0.39 2.45 0.08 0.00 -0.22 0.00 0.00 54.13 56.83 1woh s LEU 137 Cb -0.21 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.86 1woh s LEU 137 CO 0.96 -0.73 -0.16 -1.00 -1.32 0.00 0.00 176.35 174.10 1woh s HIS 138 N 1.13 2.58 -0.10 5.38 3.76 -0.20 -1.83 115.29 126.01 1woh s HIS 138 Ca 0.67 -0.24 0.02 0.00 -0.15 0.00 0.00 55.06 55.36 1woh s HIS 138 Cb -0.40 -1.37 0.01 0.00 1.11 0.00 0.00 32.58 31.94 1woh s HIS 138 CO 0.31 0.39 -0.16 0.08 -0.85 0.00 0.00 174.74 174.51 1woh s VAL 139 N -1.15 1.49 -0.36 -0.90 1.01 -0.27 -1.08 120.40 119.15 1woh s VAL 139 Ca 0.18 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.40 1woh s VAL 139 Cb -0.11 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 34.95 1woh s VAL 139 CO 0.11 0.44 0.19 -0.69 0.00 0.00 0.00 175.10 175.14 1woh s VAL 140 N 0.81 4.52 -0.24 2.92 1.01 -0.68 -0.98 120.40 127.75 1woh s VAL 140 Ca -0.11 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.02 1woh s VAL 140 Cb -0.16 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 1woh s VAL 140 CO 0.01 -0.18 -0.00 -1.58 0.00 0.00 0.00 175.10 173.35 1woh s GLN 141 N 1.55 3.32 -0.22 2.72 0.74 0.04 -1.66 119.66 126.15 1woh s GLN 141 Ca 0.02 -0.68 -0.17 0.00 0.05 0.00 0.00 55.36 54.59 1woh s GLN 141 Cb -0.19 -3.13 -0.03 0.00 1.10 0.00 0.00 33.01 30.76 1woh s GLN 141 CO 0.06 -0.26 0.45 -0.51 -0.55 0.00 0.00 175.29 174.48 1woh s LEU 142 N 1.49 4.12 -0.18 3.68 1.43 -0.42 -0.49 118.68 128.31 1woh s LEU 142 Ca 0.05 0.54 -0.29 0.00 -1.03 0.00 0.00 54.13 53.39 1woh s LEU 142 Cb -0.15 -2.59 0.13 0.00 0.03 0.00 0.00 46.19 43.61 1woh s LEU 142 CO -0.01 -0.16 1.00 -0.62 0.23 0.00 0.00 176.35 176.79 1woh s ASP 143 N 1.23 -0.39 0.32 2.29 -1.08 -0.84 -1.50 116.67 116.70 1woh s ASP 143 Ca 0.20 0.49 0.20 0.00 -0.52 0.00 0.00 52.55 52.92 1woh s ASP 143 Cb -0.15 0.41 0.16 0.00 -1.46 0.00 0.00 42.92 41.87 1woh s ASP 143 CO 0.09 -0.31 1.39 0.00 0.52 0.00 0.00 175.17 176.85 1woh h ALA 144 N 2.86 0.78 -3.01 3.66 0.00 -1.74 -2.77 119.26 119.04 1woh h ALA 144 Ca -0.20 -0.21 -0.59 0.00 0.00 0.00 0.00 54.91 53.91 1woh h ALA 144 Cb 1.16 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.78 1woh h ALA 144 CO 0.28 0.26 -0.80 -1.01 0.00 0.00 0.00 179.25 177.98 1woh s HIS 145 N -3.14 2.06 0.18 0.00 3.76 -1.26 -1.51 115.29 115.37 1woh s HIS 145 Ca 0.04 -0.41 -0.09 0.00 -0.15 0.00 0.00 55.06 54.44 1woh s HIS 145 Cb 0.07 -1.02 0.06 0.00 1.11 0.00 0.00 32.58 32.80 1woh s HIS 145 CO 0.73 0.42 1.63 1.25 -0.85 0.00 0.00 174.74 177.92 1woh h LEU 146 N 3.19 1.06 -1.30 0.89 5.85 -1.95 -3.48 115.31 119.58 1woh h LEU 146 Ca -0.44 -0.31 -0.45 0.00 0.84 0.00 0.00 57.88 57.52 1woh h LEU 146 Cb 1.21 -0.29 0.01 0.00 0.37 0.00 0.00 40.66 41.96 1woh h LEU 146 CO 0.50 1.12 -0.78 0.47 -0.34 0.00 0.00 178.44 179.40 1woh n ASP 147 N -4.17 -3.42 -0.48 1.25 8.00 -1.26 -4.88 116.55 111.59 1woh n ASP 147 Ca 0.03 -0.78 0.07 0.00 0.71 0.00 0.00 54.79 54.81 1woh n ASP 147 Cb 0.36 -4.01 0.16 0.00 -0.02 0.00 0.00 41.12 37.60 1woh n ASP 147 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1woh n PHE 148 N -4.54 0.00 -2.50 1.24 7.35 -1.11 -3.06 117.46 114.83 1woh n PHE 148 Ca -0.10 -1.15 -0.37 0.00 -0.76 0.00 0.00 57.45 55.08 1woh n PHE 148 Cb 0.59 -0.19 -0.04 0.00 0.35 0.00 0.00 39.48 40.19 1woh n PHE 148 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1woh s THR 149 N -2.64 3.63 -0.05 -2.13 2.01 -0.50 -4.60 115.64 111.36 1woh s THR 149 Ca 0.33 1.25 -0.00 0.00 0.31 0.00 0.00 61.69 63.58 1woh s THR 149 Cb 0.32 -3.65 -0.00 0.00 0.01 0.00 0.00 72.50 69.18 1woh s THR 149 CO -0.04 0.01 -0.00 -0.78 -0.69 0.00 0.00 174.62 173.12 1woh h ASP 150 N 2.46 0.00 -4.15 3.53 3.58 -1.93 -3.37 116.42 116.54 1woh h ASP 150 Ca -0.48 0.00 -0.49 0.00 0.42 0.00 0.00 57.03 56.48 1woh h ASP 150 Cb 1.22 0.00 -0.29 0.00 1.72 0.00 0.00 39.33 41.97 1woh h ASP 150 CO 0.62 0.27 -0.81 -0.89 -2.88 0.00 0.00 179.24 175.55 1woh s THR 151 N -1.30 1.13 -0.06 2.25 2.01 -1.26 -4.57 115.64 113.83 1woh s THR 151 Ca -0.00 -0.60 -0.04 0.00 0.31 0.00 0.00 61.69 61.36 1woh s THR 151 Cb 0.00 -0.95 0.03 0.00 0.01 0.00 0.00 72.50 71.59 1woh s THR 151 CO 0.00 0.32 0.15 -0.60 -0.69 0.00 0.00 174.62 173.80 1woh s ARG 152 N -0.25 0.13 -1.48 4.92 3.52 -0.86 -4.90 118.95 120.03 1woh s ARG 152 Ca 0.04 0.30 -0.01 0.00 -0.13 0.00 0.00 55.73 55.92 1woh s ARG 152 Cb -0.06 -0.05 0.01 0.00 -1.56 0.00 0.00 34.95 33.28 1woh s ARG 152 CO -0.00 -0.10 0.30 0.09 -0.81 0.00 0.00 175.30 174.79 1woh n ASN 153 N 3.65 -0.08 -2.29 -2.12 4.13 -1.26 -1.63 115.26 115.66 1woh n ASN 153 Ca -0.20 -1.10 -0.20 0.00 1.68 0.00 0.00 54.58 54.76 1woh n ASN 153 Cb 0.55 -2.54 -0.02 0.00 -1.54 0.00 0.00 39.78 36.23 1woh n ASN 153 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1woh n ASP 154 N -2.93 -5.68 -3.91 6.41 8.00 -1.26 -4.99 116.55 112.19 1woh n ASP 154 Ca -0.29 0.07 -0.10 0.00 0.71 0.00 0.00 54.79 55.18 1woh n ASP 154 Cb 0.68 -4.77 -0.09 0.00 -0.02 0.00 0.00 41.12 36.91 1woh n ASP 154 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1woh s THR 155 N -2.96 0.12 -1.00 -3.53 -1.32 -0.64 -5.03 115.64 101.27 1woh s THR 155 Ca 0.00 -0.95 0.22 0.00 -1.21 0.00 0.00 61.69 59.75 1woh s THR 155 Cb 0.00 -0.74 -0.17 0.00 -1.51 0.00 0.00 72.50 70.08 1woh s THR 155 CO 0.00 -0.53 1.03 0.29 -2.21 0.00 0.00 174.62 173.21 1woh n LYS 156 N 0.98 0.00 -0.64 7.08 4.76 -1.26 -2.03 118.16 127.04 1woh n LYS 156 Ca -0.20 -0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.31 1woh n LYS 156 Cb 0.58 -1.50 0.31 0.00 -1.84 0.00 0.00 35.03 32.58 1woh n LYS 156 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 1woh n TRP 157 N -1.50 1.43 -1.45 2.13 5.03 -1.26 -4.79 117.44 117.02 1woh n TRP 157 Ca 0.04 -0.86 -0.29 0.00 3.03 0.00 0.00 57.50 59.43 1woh n TRP 157 Cb 0.33 -0.41 0.17 0.00 -1.03 0.00 0.00 31.31 30.37 1woh n TRP 157 CO 0.00 0.00 0.00 -1.54 -0.03 0.00 0.00 177.69 176.12 1woh s SER 158 N -1.50 2.88 0.00 -0.99 1.04 -1.26 -4.85 113.70 109.01 1woh s SER 158 Ca 0.47 0.85 0.22 0.00 0.48 0.00 0.00 55.95 57.97 1woh s SER 158 Cb 0.38 -1.32 1.23 0.00 0.10 0.00 0.00 66.02 66.41 1woh s SER 158 CO 0.11 -2.93 1.70 -0.46 0.98 0.00 0.00 173.24 172.64 1woh n ASN 159 N -4.00 0.00 -0.30 7.02 6.94 -1.17 -2.11 115.26 121.64 1woh n ASN 159 Ca 0.08 -0.40 0.13 0.00 -0.02 0.00 0.00 54.58 54.37 1woh n ASN 159 Cb 0.59 -0.13 0.30 0.00 -2.36 0.00 0.00 39.78 38.18 1woh n ASN 159 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1woh n SER 160 N -1.13 1.23 0.00 0.53 7.64 -1.26 -4.38 113.62 116.25 1woh n SER 160 Ca 0.14 -1.02 0.00 0.00 1.01 0.00 0.00 58.87 59.00 1woh n SER 160 Cb 0.12 0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1woh n SER 160 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1woh n SER 161 N -0.52 1.36 -0.21 6.43 7.64 -0.90 -1.41 113.62 126.01 1woh n SER 161 Ca 0.12 -1.38 0.00 0.00 1.01 0.00 0.00 58.87 58.62 1woh n SER 161 Cb 0.37 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.66 1woh n SER 161 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1woh h PRO 162 N 0.00 0.04 0.00 1.43 0.13 -1.69 -1.16 132.00 130.75 1woh h PRO 162 Ca 0.00 -0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.06 1woh h PRO 162 Cb 0.21 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.32 1woh h PRO 162 CO 0.00 0.02 -0.32 0.74 -0.23 0.00 0.00 178.00 178.21 1woh h PHE 163 N 0.04 0.00 -0.19 1.56 -1.00 -1.88 -0.68 116.94 114.79 1woh h PHE 163 Ca 0.32 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.95 1woh h PHE 163 Cb 0.51 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.07 1woh h PHE 163 CO -0.47 0.32 -0.46 -0.09 -1.61 0.00 0.00 178.31 176.00 1woh h ARG 164 N 0.00 0.65 -0.54 1.51 9.65 -1.49 -2.04 114.38 122.12 1woh h ARG 164 Ca -0.00 -0.44 -0.11 0.00 -1.10 0.00 0.00 59.98 58.32 1woh h ARG 164 Cb 0.89 0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.51 1woh h ARG 164 CO 0.04 1.06 -0.10 0.00 2.80 0.00 0.00 179.97 183.77 1woh h ARG 165 N 0.33 1.01 -0.21 0.20 2.47 -1.05 -2.88 114.38 114.26 1woh h ARG 165 Ca -0.00 -0.37 -0.01 0.00 -1.26 0.00 0.00 59.98 58.33 1woh h ARG 165 Cb 1.07 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 29.31 1woh h ARG 165 CO 0.10 1.05 0.07 0.00 0.56 0.00 0.00 179.97 181.75 1woh h ALA 166 N 0.97 0.27 -0.88 0.04 0.00 -1.08 -2.89 119.26 115.70 1woh h ALA 166 Ca 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1woh h ALA 166 Cb 0.66 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1woh h ALA 166 CO 0.05 -0.12 0.52 0.00 0.00 0.00 0.00 179.25 179.70 1woh n GLU 168 N -4.40 0.01 -0.00 0.00 0.28 -1.09 -2.99 120.64 112.45 1woh n GLU 168 Ca 0.09 0.15 0.05 0.00 -0.16 0.00 0.00 57.16 57.29 1woh n GLU 168 Cb 0.06 -1.52 -0.06 0.00 1.43 0.00 0.00 31.44 31.35 1woh n GLU 168 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1woh n ALA 169 N -1.52 3.07 -3.71 -1.84 0.00 -0.74 -4.86 120.51 110.92 1woh n ALA 169 Ca 0.05 -0.28 -0.30 0.00 0.00 0.00 0.00 53.44 52.92 1woh n ALA 169 Cb 0.25 -0.36 -0.14 0.00 0.00 0.00 0.00 19.45 19.20 1woh n ALA 169 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1woh s LEU 170 N -2.81 2.51 0.59 0.00 1.43 0.56 -4.96 118.68 116.01 1woh s LEU 170 Ca 0.02 -2.26 0.39 0.00 -1.03 0.00 0.00 54.13 51.25 1woh s LEU 170 Cb 0.07 -0.96 1.94 0.00 0.03 0.00 0.00 46.19 47.28 1woh s LEU 170 CO 0.42 -0.32 2.17 1.55 0.23 0.00 0.00 176.35 180.40 1woh h PRO 171 N 7.22 0.00 0.00 1.29 0.13 -1.87 -0.88 132.00 137.90 1woh h PRO 171 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1woh h PRO 171 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1woh h PRO 171 CO 0.47 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.51 1woh n ASN 172 N -2.99 0.17 -4.48 1.44 6.94 -1.26 -4.33 115.26 110.75 1woh n ASN 172 Ca -0.02 0.52 -0.43 0.00 -0.02 0.00 0.00 54.58 54.64 1woh n ASN 172 Cb 0.15 -0.56 -0.03 0.00 -2.36 0.00 0.00 39.78 36.98 1woh n ASN 172 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1woh s LEU 173 N -3.32 4.63 0.08 -4.53 0.20 -0.34 0.28 118.68 115.68 1woh s LEU 173 Ca 0.12 -1.84 0.24 0.00 0.69 0.00 0.00 54.13 53.34 1woh s LEU 173 Cb 0.16 -2.44 0.36 0.00 -0.43 0.00 0.00 46.19 43.83 1woh s LEU 173 CO 0.48 -1.20 1.31 1.33 -0.29 0.00 0.00 176.35 177.99 1woh n VAL 174 N 5.86 0.23 -3.61 1.68 0.24 -0.76 -4.92 118.33 117.06 1woh n VAL 174 Ca 0.25 -0.20 -0.13 0.00 -2.04 0.00 0.00 64.34 62.22 1woh n VAL 174 Cb 0.49 0.01 -0.07 0.00 -1.47 0.00 0.00 33.84 32.81 1woh n VAL 174 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1woh s HIS 175 N -3.13 -0.67 -0.04 6.34 5.65 -1.20 -4.93 115.29 117.31 1woh s HIS 175 Ca 0.07 1.54 0.03 0.00 0.25 0.00 0.00 55.06 56.95 1woh s HIS 175 Cb 0.15 0.33 0.00 0.00 -1.18 0.00 0.00 32.58 31.88 1woh s HIS 175 CO 0.72 -0.38 -0.13 0.42 -0.65 0.00 0.00 174.74 174.72 1woh s ILE 176 N -0.01 1.14 -0.25 0.89 1.01 -1.26 -1.11 121.20 121.61 1woh s ILE 176 Ca -0.01 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1woh s ILE 176 Cb -0.04 -1.01 0.04 0.00 0.01 0.00 0.00 42.46 41.47 1woh s ILE 176 CO 0.01 0.34 -0.09 -0.89 0.00 0.00 0.00 174.94 174.31 1woh s THR 177 N 0.27 2.50 -0.18 2.92 2.01 -0.15 -0.47 115.64 122.54 1woh s THR 177 Ca -0.07 -1.34 -0.06 0.00 0.31 0.00 0.00 61.69 60.53 1woh s THR 177 Cb -0.12 -2.36 -0.03 0.00 0.01 0.00 0.00 72.50 70.00 1woh s THR 177 CO 0.02 0.09 0.03 -0.89 -0.69 0.00 0.00 174.62 173.18 1woh s THR 178 N 1.21 4.42 -0.05 -0.82 2.01 0.36 -0.78 115.64 121.99 1woh s THR 178 Ca -0.04 -0.16 0.04 0.00 0.31 0.00 0.00 61.69 61.84 1woh s THR 178 Cb -0.18 -2.99 -0.00 0.00 0.01 0.00 0.00 72.50 69.34 1woh s THR 178 CO -0.05 0.45 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.46 1woh s VAL 179 N 0.56 1.54 0.00 3.82 1.01 0.36 0.14 120.40 127.83 1woh s VAL 179 Ca 0.01 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.23 1woh s VAL 179 Cb -0.13 -1.33 0.00 0.00 0.00 0.00 0.00 36.38 34.92 1woh s VAL 179 CO 0.02 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.17 1woh n GLY 180 N 3.23 0.86 3.70 4.51 0.00 -0.30 -1.98 105.19 115.21 1woh n GLY 180 Ca -0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 1woh n GLY 180 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1woh n LEU 181 N 0.00 3.64 -3.83 0.99 4.77 -1.05 -4.10 117.00 117.43 1woh n LEU 181 Ca 0.00 1.17 -0.04 0.00 -0.03 0.00 0.00 56.01 57.11 1woh n LEU 181 Cb 0.00 -1.50 0.01 0.00 -2.33 0.00 0.00 43.42 39.60 1woh n LEU 181 CO 0.00 -0.30 0.74 0.00 -1.33 0.00 0.00 177.39 176.51 1woh s ARG 182 N -0.99 1.41 0.00 3.23 1.70 -0.57 -0.55 118.95 123.18 1woh s ARG 182 Ca 0.62 -0.88 0.00 0.00 -0.47 0.00 0.00 55.73 55.01 1woh s ARG 182 Cb -0.58 0.42 0.00 0.00 -0.57 0.00 0.00 34.95 34.22 1woh s ARG 182 CO 0.54 -0.66 0.00 0.41 -1.08 0.00 0.00 175.30 174.51 1woh n GLY 183 N -0.61 2.61 0.14 3.88 0.00 -1.26 -4.70 105.19 105.25 1woh n GLY 183 Ca -0.05 -2.11 0.06 0.00 0.00 0.00 0.00 46.02 43.93 1woh n GLY 183 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1woh h LEU 184 N 0.00 0.00 -8.46 0.99 3.38 -2.02 -3.46 115.31 105.75 1woh h LEU 184 Ca 0.00 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.30 1woh h LEU 184 Cb 0.00 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 40.45 1woh h LEU 184 CO 0.00 0.29 -0.83 -0.60 0.09 0.00 0.00 178.44 177.39 1woh s ARG 185 N -3.11 3.20 0.02 1.13 3.52 -1.26 -5.11 118.95 117.34 1woh s ARG 185 Ca 0.01 -0.79 0.04 0.00 -0.13 0.00 0.00 55.73 54.86 1woh s ARG 185 Cb 0.08 -2.45 -0.01 0.00 -1.56 0.00 0.00 34.95 31.00 1woh s ARG 185 CO 0.76 0.19 -0.11 -0.06 -0.81 0.00 0.00 175.30 175.27 1woh s PHE 186 N 0.36 0.99 -0.57 5.12 0.40 -1.26 -5.05 117.98 117.96 1woh s PHE 186 Ca -0.15 -0.28 -0.26 0.00 -0.60 0.00 0.00 56.93 55.65 1woh s PHE 186 Cb -0.17 -0.61 0.04 0.00 0.51 0.00 0.00 43.02 42.79 1woh s PHE 186 CO 0.07 -0.00 1.04 0.34 0.70 0.00 0.00 175.22 177.37 1woh s ASP 187 N -0.75 6.36 0.33 1.36 -1.08 -1.26 -4.91 116.67 116.72 1woh s ASP 187 Ca 0.01 -0.23 0.04 0.00 -0.52 0.00 0.00 52.55 51.86 1woh s ASP 187 Cb -0.06 -2.48 0.67 0.00 -1.46 0.00 0.00 42.92 39.59 1woh s ASP 187 CO 0.00 -1.35 1.91 1.55 0.52 0.00 0.00 175.17 177.80 1woh h PRO 188 N 9.43 0.83 -0.41 4.34 0.13 -1.99 0.18 132.00 144.52 1woh h PRO 188 Ca -0.26 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.78 1woh h PRO 188 Cb 1.07 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 31.99 1woh h PRO 188 CO 1.13 0.55 0.09 1.49 -0.23 0.00 0.00 178.00 181.04 1woh h GLU 189 N 0.86 0.66 -0.41 0.86 4.22 -1.99 -0.53 114.58 118.24 1woh h GLU 189 Ca 0.39 -0.16 -0.05 0.00 0.08 0.00 0.00 59.36 59.62 1woh h GLU 189 Cb 0.39 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1woh h GLU 189 CO -0.16 0.69 0.05 0.00 -2.18 0.00 0.00 179.01 177.40 1woh h ALA 190 N 0.95 0.55 -0.12 2.92 0.00 -1.51 -1.35 119.26 120.70 1woh h ALA 190 Ca 0.13 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1woh h ALA 190 Cb 0.33 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1woh h ALA 190 CO 0.00 0.29 0.07 0.28 0.00 0.00 0.00 179.25 179.89 1woh h VAL 191 N 0.54 1.05 -0.90 0.00 2.07 -0.52 -0.82 116.25 117.66 1woh h VAL 191 Ca 0.12 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 1woh h VAL 191 Cb 0.41 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1woh h VAL 191 CO 0.01 0.04 0.56 0.00 0.02 0.00 0.00 177.57 178.20 1woh h ALA 192 N 1.02 1.28 -0.46 1.67 0.00 -1.02 -0.82 119.26 120.93 1woh h ALA 192 Ca 0.04 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1woh h ALA 192 Cb 0.01 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1woh h ALA 192 CO -0.01 0.63 -0.09 0.00 0.00 0.00 0.00 179.25 179.77 1woh h ALA 193 N 1.38 0.96 -0.24 0.00 0.00 -0.87 -0.33 119.26 120.16 1woh h ALA 193 Ca 0.32 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1woh h ALA 193 Cb -0.08 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1woh h ALA 193 CO -0.06 0.61 -0.25 0.00 0.00 0.00 0.00 179.25 179.55 1woh h ALA 194 N 1.14 0.35 -0.15 0.00 0.00 -0.67 -2.86 119.26 117.07 1woh h ALA 194 Ca 0.13 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 1woh h ALA 194 Cb 0.59 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1woh h ALA 194 CO 0.04 0.33 -0.30 0.00 0.00 0.00 0.00 179.25 179.31 1woh h ARG 195 N 0.29 0.28 0.00 0.00 3.08 -1.04 -1.26 114.38 115.73 1woh h ARG 195 Ca 0.04 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 1woh h ARG 195 Cb 0.81 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1woh h ARG 195 CO 0.06 0.56 -0.24 0.00 -1.07 0.00 0.00 179.97 179.28 1woh h ALA 196 N 1.44 1.51 -0.03 0.04 0.00 -0.98 -1.03 119.26 120.21 1woh h ALA 196 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1woh h ALA 196 Cb 0.66 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1woh h ALA 196 CO 0.05 0.30 0.00 0.54 0.00 0.00 0.00 179.25 180.14 1woh n ARG 197 N -4.12 1.67 -1.02 0.00 1.74 -0.97 -4.93 116.66 109.04 1woh n ARG 197 Ca -0.02 -0.98 -0.01 0.00 -0.77 0.00 0.00 57.85 56.07 1woh n ARG 197 Cb 0.30 -1.47 -0.00 0.00 -1.02 0.00 0.00 32.46 30.27 1woh n ARG 197 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1woh n GLY 198 N 1.17 0.44 3.77 -0.13 0.00 -0.39 -4.93 105.19 105.11 1woh n GLY 198 Ca 0.19 -1.00 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 1woh n GLY 198 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1woh s HIS 199 N -2.02 2.60 -0.26 1.61 3.76 -0.51 -4.86 115.29 115.60 1woh s HIS 199 Ca 0.00 1.55 -0.10 0.00 -0.15 0.00 0.00 55.06 56.36 1woh s HIS 199 Cb 0.00 -3.19 -0.05 0.00 1.11 0.00 0.00 32.58 30.45 1woh s HIS 199 CO 0.00 -1.72 0.16 0.99 -0.85 0.00 0.00 174.74 173.31 1woh s THR 200 N -2.27 5.17 -0.30 1.30 2.01 0.38 -4.66 115.64 117.28 1woh s THR 200 Ca 0.68 0.12 -0.05 0.00 0.31 0.00 0.00 61.69 62.75 1woh s THR 200 Cb -0.21 -3.43 0.03 0.00 0.01 0.00 0.00 72.50 68.89 1woh s THR 200 CO 0.40 0.31 0.05 -0.63 -0.69 0.00 0.00 174.62 174.06 1woh s ILE 201 N 1.42 3.57 -0.39 1.82 1.01 -1.26 -0.49 121.20 126.88 1woh s ILE 201 Ca 0.07 -0.98 -0.02 0.00 0.00 0.00 0.00 60.65 59.73 1woh s ILE 201 Cb -0.15 -2.92 0.11 0.00 0.01 0.00 0.00 42.46 39.51 1woh s ILE 201 CO 0.07 0.00 0.17 -0.63 0.00 0.00 0.00 174.94 174.56 1woh s ILE 202 N 1.41 3.10 0.64 2.92 1.01 0.12 -4.98 121.20 125.42 1woh s ILE 202 Ca -0.00 -2.09 -0.18 0.00 0.00 0.00 0.00 60.65 58.38 1woh s ILE 202 Cb -0.18 -3.14 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 1woh s ILE 202 CO 0.01 -0.66 1.23 -2.84 0.00 0.00 0.00 174.94 172.68 1woh s PRO 203 N 1.10 2.67 0.50 2.79 0.02 -1.26 -1.15 135.00 139.67 1woh s PRO 203 Ca 0.08 1.87 0.20 0.00 0.02 0.00 0.00 61.00 63.17 1woh s PRO 203 Cb -0.22 -1.89 1.26 0.00 0.02 0.00 0.00 34.50 33.67 1woh s PRO 203 CO -0.05 -1.45 2.02 1.98 -0.33 0.00 0.00 177.00 179.17 1woh h MET 204 N 0.52 0.13 -0.98 5.54 1.85 -0.98 -0.62 114.93 120.40 1woh h MET 204 Ca -0.50 -0.01 0.16 0.00 -0.61 0.00 0.00 59.70 58.74 1woh h MET 204 Cb 1.31 -0.03 -0.09 0.00 0.43 0.00 0.00 31.60 33.22 1woh h MET 204 CO 0.53 0.09 0.61 -0.44 -0.40 0.00 0.00 176.91 177.30 1woh h ASP 205 N 0.13 0.79 0.20 1.39 3.32 -1.90 -0.77 116.42 119.58 1woh h ASP 205 Ca 0.22 0.07 -0.16 0.00 0.02 0.00 0.00 57.03 57.18 1woh h ASP 205 Cb 0.69 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 1woh h ASP 205 CO -0.03 0.36 -0.60 0.44 -1.72 0.00 0.00 179.24 177.69 1woh h ASP 206 N 0.81 0.45 -0.49 6.45 3.32 -1.46 -1.42 116.42 124.08 1woh h ASP 206 Ca 0.52 -0.25 -0.04 0.00 0.02 0.00 0.00 57.03 57.27 1woh h ASP 206 Cb 0.74 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 1woh h ASP 206 CO -0.29 0.94 0.13 0.58 -1.72 0.00 0.00 179.24 178.88 1woh h VAL 207 N 0.30 1.24 -0.33 -1.35 2.07 -1.15 0.10 116.25 117.13 1woh h VAL 207 Ca -0.00 -0.81 -0.06 0.00 0.82 0.00 0.00 66.70 66.65 1woh h VAL 207 Cb 1.13 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1woh h VAL 207 CO 0.10 0.29 -0.02 0.74 0.02 0.00 0.00 177.57 178.71 1woh h THR 208 N 0.67 1.26 -0.35 2.57 2.02 -1.25 -2.89 112.91 114.94 1woh h THR 208 Ca 0.16 -1.00 -0.15 0.00 0.77 0.00 0.00 66.41 66.19 1woh h THR 208 Cb 0.31 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1woh h THR 208 CO -0.00 0.33 -0.36 0.00 0.37 0.00 0.00 175.52 175.86 1woh h ALA 209 N 0.84 0.51 -1.18 6.16 0.00 -1.12 -3.42 119.26 121.04 1woh h ALA 209 Ca 0.09 -0.44 -0.17 0.00 0.00 0.00 0.00 54.91 54.39 1woh h ALA 209 Cb 0.48 -0.11 -0.20 0.00 0.00 0.00 0.00 17.79 17.96 1woh h ALA 209 CO 0.02 0.59 -0.53 0.34 0.00 0.00 0.00 179.25 179.67 1woh s ASP 210 N -6.74 -1.05 0.26 0.00 2.15 0.34 -5.01 116.67 106.62 1woh s ASP 210 Ca -0.11 -1.51 -0.05 0.00 0.43 0.00 0.00 52.55 51.31 1woh s ASP 210 Cb 0.10 1.64 0.32 0.00 -0.30 0.00 0.00 42.92 44.68 1woh s ASP 210 CO 0.86 -0.12 1.92 0.25 -0.17 0.00 0.00 175.17 177.92 1woh h LEU 211 N 5.88 1.10 -0.43 -1.34 7.12 -1.64 -2.22 115.31 123.78 1woh h LEU 211 Ca 0.07 -0.02 0.06 0.00 0.13 0.00 0.00 57.88 58.12 1woh h LEU 211 Cb 1.11 -0.27 -0.05 0.00 -0.53 0.00 0.00 40.66 40.93 1woh h LEU 211 CO 0.08 0.78 0.13 0.00 -0.13 0.00 0.00 178.44 179.30 1woh h ALA 212 N 1.40 0.51 -0.37 1.25 0.00 -1.93 -1.12 119.26 119.00 1woh h ALA 212 Ca 0.38 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 1woh h ALA 212 Cb -0.08 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1woh h ALA 212 CO -0.10 -0.26 0.15 0.78 0.00 0.00 0.00 179.25 179.82 1woh h GLY 213 N 0.29 0.56 0.85 0.00 0.00 -1.79 -1.78 103.07 101.19 1woh h GLY 213 Ca 0.21 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 47.22 1woh h GLY 213 CO -0.23 0.24 -0.08 -2.08 0.00 0.00 0.00 176.54 174.39 1woh h VAL 214 N 0.52 1.29 -0.15 4.60 2.07 -0.88 -2.81 116.25 120.89 1woh h VAL 214 Ca 0.13 -1.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 1woh h VAL 214 Cb 0.10 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1woh h VAL 214 CO -0.01 0.35 0.04 -0.07 0.02 0.00 0.00 177.57 177.89 1woh h LEU 215 N 0.23 0.18 -0.10 2.57 3.38 -0.82 0.23 115.31 120.99 1woh h LEU 215 Ca 0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1woh h LEU 215 Cb 0.56 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1woh h LEU 215 CO 0.03 0.20 0.00 0.00 0.09 0.00 0.00 178.44 178.76 1woh n ALA 216 N -2.51 1.84 0.48 1.53 0.00 -0.71 -2.36 120.51 118.78 1woh n ALA 216 Ca -0.01 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.50 1woh n ALA 216 Cb 0.13 -1.32 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 1woh n ALA 216 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1woh n GLN 217 N -1.64 0.35 -1.48 0.00 6.02 0.06 -4.95 117.38 115.73 1woh n GLN 217 Ca 0.04 -0.03 -0.34 0.00 -0.01 0.00 0.00 57.00 56.67 1woh n GLN 217 Cb 0.23 -1.59 0.09 0.00 1.02 0.00 0.00 30.24 29.98 1woh n GLN 217 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1woh s LEU 218 N -4.05 3.32 0.92 1.08 1.43 -1.00 -4.98 118.68 115.41 1woh s LEU 218 Ca 0.02 2.29 -0.11 0.00 -1.03 0.00 0.00 54.13 55.30 1woh s LEU 218 Cb 0.14 -4.58 0.15 0.00 0.03 0.00 0.00 46.19 41.93 1woh s LEU 218 CO 0.82 -2.16 1.11 -2.16 0.23 0.00 0.00 176.35 174.19 1woh s PRO 219 N -3.95 0.99 -0.05 1.29 0.04 -1.26 -5.07 135.00 127.00 1woh s PRO 219 Ca 0.73 1.23 -0.04 0.00 0.04 0.00 0.00 61.00 62.96 1woh s PRO 219 Cb -0.28 -1.75 0.02 0.00 0.04 0.00 0.00 34.50 32.53 1woh s PRO 219 CO 0.45 -2.54 0.12 1.03 0.04 0.00 0.00 177.00 176.09 1woh s ARG 220 N -4.72 0.12 -1.48 4.56 0.52 -1.26 -4.79 118.95 111.89 1woh s ARG 220 Ca 0.65 0.20 0.00 0.00 -0.52 0.00 0.00 55.73 56.06 1woh s ARG 220 Cb -0.21 0.01 0.00 0.00 0.52 0.00 0.00 34.95 35.27 1woh s ARG 220 CO 0.58 -0.05 0.00 0.41 0.02 0.00 0.00 175.30 176.27 1woh n GLY 221 N 3.25 -0.34 3.72 -3.53 0.00 0.22 -4.96 105.19 103.54 1woh n GLY 221 Ca -0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 1woh n GLY 221 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1woh s GLN 222 N -4.92 2.28 -0.26 1.61 -1.52 -1.26 -4.90 119.66 110.68 1woh s GLN 222 Ca 0.00 -1.67 -0.22 0.00 -1.95 0.00 0.00 55.36 51.52 1woh s GLN 222 Cb 0.00 -2.08 -0.01 0.00 -0.22 0.00 0.00 33.01 30.70 1woh s GLN 222 CO 0.00 0.04 0.72 -0.80 -0.25 0.00 0.00 175.29 175.00 1woh s ASN 223 N -3.84 6.67 -0.05 5.90 0.01 -1.26 -0.83 114.94 121.54 1woh s ASN 223 Ca 0.38 0.81 0.05 0.00 -0.71 0.00 0.00 52.86 53.39 1woh s ASN 223 Cb -0.00 -2.38 -0.01 0.00 0.41 0.00 0.00 41.25 39.27 1woh s ASN 223 CO 0.22 -0.45 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.45 1woh s VAL 224 N 2.68 1.77 -0.19 1.60 1.01 -0.21 -1.03 120.40 126.03 1woh s VAL 224 Ca 0.30 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.34 1woh s VAL 224 Cb -0.15 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 1woh s VAL 224 CO 0.09 0.50 -0.06 -0.47 0.00 0.00 0.00 175.10 175.16 1woh s TYR 225 N -0.04 2.95 -0.08 5.22 5.04 -0.24 -0.62 117.35 129.58 1woh s TYR 225 Ca -0.05 -0.70 -0.18 0.00 -2.44 0.00 0.00 57.07 53.71 1woh s TYR 225 Cb -0.13 -2.02 -0.05 0.00 0.35 0.00 0.00 41.96 40.12 1woh s TYR 225 CO 0.03 -0.34 0.50 -0.06 -1.34 0.00 0.00 175.55 174.34 1woh s PHE 226 N 0.97 3.57 -0.21 4.97 2.99 -0.08 -1.69 117.98 128.50 1woh s PHE 226 Ca -0.00 0.97 0.00 0.00 0.00 0.00 0.00 56.93 57.90 1woh s PHE 226 Cb -0.15 -2.54 0.05 0.00 0.00 0.00 0.00 43.02 40.39 1woh s PHE 226 CO 0.00 0.26 -0.06 0.45 -0.00 0.00 0.00 175.22 175.88 1woh s SER 227 N 0.26 3.53 -0.30 1.36 0.15 -0.66 -0.76 113.70 117.27 1woh s SER 227 Ca 0.27 -1.01 -0.05 0.00 0.70 0.00 0.00 55.95 55.86 1woh s SER 227 Cb -0.16 -1.10 0.03 0.00 -1.71 0.00 0.00 66.02 63.08 1woh s SER 227 CO 0.12 -0.22 0.04 -0.69 1.20 0.00 0.00 173.24 173.70 1woh s VAL 228 N 1.47 3.51 -0.29 4.45 1.01 0.20 -1.30 120.40 129.46 1woh s VAL 228 Ca -0.04 -0.99 -0.15 0.00 0.00 0.00 0.00 61.98 60.80 1woh s VAL 228 Cb -0.18 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 1woh s VAL 228 CO -0.07 0.01 0.35 -0.62 0.00 0.00 0.00 175.10 174.77 1woh s ASP 229 N 1.39 6.21 0.67 3.32 -1.08 -0.56 -0.78 116.67 125.83 1woh s ASP 229 Ca -0.00 0.13 0.39 0.00 -0.52 0.00 0.00 52.55 52.55 1woh s ASP 229 Cb -0.18 -2.20 2.13 0.00 -1.46 0.00 0.00 42.92 41.21 1woh s ASP 229 CO 0.00 -0.21 2.20 -0.37 0.52 0.00 0.00 175.17 177.32 1woh h VAL 230 N 5.42 0.02 0.00 1.11 -1.51 -1.66 -0.37 116.25 119.26 1woh h VAL 230 Ca -0.32 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 1woh h VAL 230 Cb 1.16 0.87 0.00 0.00 -2.13 0.00 0.00 31.29 31.19 1woh h VAL 230 CO 0.65 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 176.09 1woh n ASP 231 N -3.03 0.00 0.14 4.19 5.68 -1.26 -1.71 116.55 120.55 1woh n ASP 231 Ca -0.03 -0.85 0.01 0.00 -0.50 0.00 0.00 54.79 53.43 1woh n ASP 231 Cb 0.19 0.00 0.16 0.00 -1.14 0.00 0.00 41.12 40.33 1woh n ASP 231 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1woh h GLY 232 N 3.86 0.00 -1.73 6.12 0.00 -1.33 -3.36 103.07 106.62 1woh h GLY 232 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.86 1woh h GLY 232 CO 0.00 0.00 0.38 -1.36 0.00 0.00 0.00 176.54 175.56 1woh s PHE 233 N -3.37 3.43 0.34 5.60 0.40 -0.70 -1.72 117.98 121.96 1woh s PHE 233 Ca 0.00 1.46 -0.29 0.00 -0.60 0.00 0.00 56.93 57.51 1woh s PHE 233 Cb 0.11 -2.81 -0.11 0.00 0.51 0.00 0.00 43.02 40.72 1woh s PHE 233 CO 0.74 -0.43 1.51 0.34 0.70 0.00 0.00 175.22 178.08 1woh s ASP 234 N -3.09 6.39 0.55 1.36 -1.08 0.52 -4.55 116.67 116.78 1woh s ASP 234 Ca 0.59 2.97 0.22 0.00 -0.52 0.00 0.00 52.55 55.82 1woh s ASP 234 Cb -0.10 -2.65 1.45 0.00 -1.46 0.00 0.00 42.92 40.16 1woh s ASP 234 CO 0.32 -0.86 2.14 -0.65 0.52 0.00 0.00 175.17 176.64 1woh h PRO 235 N 3.80 0.00 -0.58 4.34 0.11 -1.77 0.50 132.00 138.39 1woh h PRO 235 Ca -0.49 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 1woh h PRO 235 Cb 1.23 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 1woh h PRO 235 CO 0.70 0.00 0.10 0.00 -0.21 0.00 0.00 178.00 178.60 1woh h ALA 236 N 1.92 1.08 0.00 -0.75 0.00 -1.95 -1.41 119.26 118.16 1woh h ALA 236 Ca 0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1woh h ALA 236 Cb 0.24 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1woh h ALA 236 CO -0.00 0.60 -0.00 0.28 0.00 0.00 0.00 179.25 180.13 1woh h VAL 237 N 0.88 1.66 -2.96 0.00 2.07 -1.50 -3.41 116.25 112.99 1woh h VAL 237 Ca 0.18 -2.18 -0.61 0.00 0.82 0.00 0.00 66.70 64.91 1woh h VAL 237 Cb 0.37 3.10 -0.41 0.00 -1.52 0.00 0.00 31.29 32.83 1woh h VAL 237 CO 0.01 0.55 -0.68 -0.63 0.02 0.00 0.00 177.57 176.83 1woh s ILE 238 N -2.33 2.14 0.08 4.57 -1.09 0.01 -4.61 121.20 119.97 1woh s ILE 238 Ca -0.18 -3.61 0.24 0.00 -2.23 0.00 0.00 60.65 54.87 1woh s ILE 238 Cb -0.02 -2.43 0.24 0.00 -1.58 0.00 0.00 42.46 38.66 1woh s ILE 238 CO 0.65 -1.02 1.80 1.55 -1.23 0.00 0.00 174.94 176.69 1woh h PRO 239 N 5.74 0.00 -5.32 2.79 0.13 -1.50 -3.40 132.00 130.44 1woh h PRO 239 Ca 0.13 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.86 1woh h PRO 239 Cb 0.82 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.93 1woh h PRO 239 CO 0.61 0.22 1.32 0.41 -0.23 0.00 0.00 178.00 180.33 1woh n GLY 240 N 0.27 1.32 3.57 1.56 0.00 -1.26 -4.81 105.19 105.85 1woh n GLY 240 Ca 0.00 -0.80 -0.15 0.00 0.00 0.00 0.00 46.02 45.07 1woh n GLY 240 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1woh s THR 241 N 9.82 0.00 0.13 2.61 -1.32 -1.26 -0.89 115.64 124.73 1woh s THR 241 Ca 0.66 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.90 1woh s THR 241 Cb 0.02 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.98 1woh s THR 241 CO 0.13 0.00 1.64 -1.28 -2.21 0.00 0.00 174.62 172.90 1woh h SER 242 N 3.44 -0.72 -2.88 8.08 0.87 -1.78 -3.37 113.55 117.20 1woh h SER 242 Ca -0.26 0.11 -0.61 0.00 -1.23 0.00 0.00 61.79 59.80 1woh h SER 242 Cb 1.15 0.31 -0.41 0.00 -0.44 0.00 0.00 62.40 63.02 1woh h SER 242 CO 0.27 -0.29 -0.70 -0.44 -0.53 0.00 0.00 176.83 175.14 1woh s SER 243 N -4.95 3.78 0.54 6.23 0.01 -1.26 -4.47 113.70 113.58 1woh s SER 243 Ca -0.15 -3.61 -0.19 0.00 1.31 0.00 0.00 55.95 53.30 1woh s SER 243 Cb 0.10 -1.27 -0.06 0.00 0.21 0.00 0.00 66.02 65.00 1woh s SER 243 CO 0.67 -0.11 1.12 -2.16 0.41 0.00 0.00 173.24 173.16 1woh s PRO 244 N -0.99 3.39 -0.04 12.44 0.04 -1.26 -5.01 135.00 143.57 1woh s PRO 244 Ca 0.27 1.58 0.03 0.00 0.04 0.00 0.00 61.00 62.92 1woh s PRO 244 Cb -0.02 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.51 1woh s PRO 244 CO -0.18 -0.81 -0.11 -2.00 0.04 0.00 0.00 177.00 173.94 1woh s GLU 245 N -3.30 1.38 0.93 4.56 2.56 -1.26 -5.08 118.70 118.49 1woh s GLU 245 Ca 0.72 -0.39 -0.11 0.00 0.00 0.00 0.00 54.97 55.19 1woh s GLU 245 Cb -0.23 -1.21 0.15 0.00 2.00 0.00 0.00 34.13 34.84 1woh s GLU 245 CO 0.26 0.10 1.10 -1.25 -0.56 0.00 0.00 175.26 174.91 1woh s PRO 246 N 0.38 0.93 -0.94 4.30 0.04 -1.26 -4.33 135.00 134.12 1woh s PRO 246 Ca -0.08 1.14 -0.08 0.00 0.04 0.00 0.00 61.00 62.02 1woh s PRO 246 Cb -0.12 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.65 1woh s PRO 246 CO 0.02 -2.56 0.76 -0.25 0.04 0.00 0.00 177.00 175.01 1woh n ASP 247 N -4.14 -6.39 -0.30 6.66 8.00 -1.26 -4.91 116.55 114.21 1woh n ASP 247 Ca 0.08 -0.63 0.00 0.00 0.71 0.00 0.00 54.79 54.96 1woh n ASP 247 Cb 0.54 -4.18 0.00 0.00 -0.02 0.00 0.00 41.12 37.46 1woh n ASP 247 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1woh n GLY 248 N -1.61 4.16 3.77 0.44 0.00 -1.26 -4.95 105.19 105.73 1woh n GLY 248 Ca -0.09 -2.05 -0.39 0.00 0.00 0.00 0.00 46.02 43.49 1woh n GLY 248 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1woh s LEU 249 N 0.00 4.39 0.74 0.99 1.43 -0.70 -4.24 118.68 121.30 1woh s LEU 249 Ca 0.00 2.22 -0.09 0.00 -1.03 0.00 0.00 54.13 55.23 1woh s LEU 249 Cb 0.00 -3.83 0.06 0.00 0.03 0.00 0.00 46.19 42.45 1woh s LEU 249 CO 0.00 -0.31 1.09 0.42 0.23 0.00 0.00 176.35 177.77 1woh s THR 250 N -1.33 2.36 0.17 5.49 -4.23 -1.26 -0.35 115.64 116.48 1woh s THR 250 Ca 0.50 -0.06 -0.15 0.00 -1.18 0.00 0.00 61.69 60.80 1woh s THR 250 Cb -0.29 -3.08 0.05 0.00 1.34 0.00 0.00 72.50 70.52 1woh s THR 250 CO 0.37 -0.09 1.82 0.22 -0.54 0.00 0.00 174.62 176.40 1woh h TYR 251 N -0.78 0.63 -0.53 3.99 3.20 -1.97 -2.27 116.97 119.24 1woh h TYR 251 Ca -0.45 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.49 1woh h TYR 251 Cb 1.31 -0.21 -0.05 0.00 1.54 0.00 0.00 36.73 39.32 1woh h TYR 251 CO 0.35 0.40 0.23 0.00 -1.64 0.00 0.00 178.16 177.50 1woh h ALA 252 N 1.17 0.67 -0.19 1.82 0.00 -1.99 -0.49 119.26 120.24 1woh h ALA 252 Ca 0.18 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1woh h ALA 252 Cb -0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1woh h ALA 252 CO -0.04 -0.15 0.05 1.96 0.00 0.00 0.00 179.25 181.07 1woh h GLN 253 N 0.43 0.31 -0.77 0.00 4.20 -1.88 -0.62 115.11 116.79 1woh h GLN 253 Ca 0.25 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1woh h GLN 253 Cb 0.23 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 1woh h GLN 253 CO -0.22 0.43 0.50 0.78 -0.67 0.00 0.00 178.83 179.65 1woh h GLY 254 N 0.13 1.09 1.24 3.46 0.00 -1.15 -2.25 103.07 105.58 1woh h GLY 254 Ca 0.06 -0.42 -0.07 0.00 0.00 0.00 0.00 47.33 46.90 1woh h GLY 254 CO -0.00 0.41 0.05 1.98 0.00 0.00 0.00 176.54 178.98 1woh h MET 255 N 1.04 0.93 -0.61 4.80 1.85 -0.95 -1.94 114.93 120.06 1woh h MET 255 Ca 0.28 -0.25 -0.04 0.00 -0.61 0.00 0.00 59.70 59.08 1woh h MET 255 Cb -0.10 -0.11 -0.03 0.00 0.43 0.00 0.00 31.60 31.79 1woh h MET 255 CO -0.06 0.89 0.22 0.87 -0.40 0.00 0.00 176.91 178.43 1woh h LYS 256 N 0.87 0.90 -0.19 0.39 1.57 -0.63 0.32 116.57 119.80 1woh h LYS 256 Ca 0.17 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 1woh h LYS 256 Cb 0.44 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 1woh h LYS 256 CO 0.02 0.75 -0.10 0.82 -0.57 0.00 0.00 179.45 180.37 1woh h ILE 257 N 0.88 1.31 -0.68 1.86 2.04 -1.19 -1.73 117.51 120.01 1woh h ILE 257 Ca 0.20 -1.16 -0.06 0.00 1.00 0.00 0.00 64.86 64.84 1woh h ILE 257 Cb 0.21 1.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 1woh h ILE 257 CO -0.01 0.35 0.18 -0.07 0.00 0.00 0.00 178.15 178.60 1woh h LEU 258 N 0.08 1.01 -0.18 1.44 3.38 -1.02 -1.95 115.31 118.08 1woh h LEU 258 Ca 0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1woh h LEU 258 Cb 0.59 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1woh h LEU 258 CO 0.03 0.97 0.08 0.00 0.09 0.00 0.00 178.44 179.61 1woh h ALA 259 N 1.08 0.23 -0.26 1.53 0.00 -0.33 -0.33 119.26 121.19 1woh h ALA 259 Ca 0.21 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1woh h ALA 259 Cb 0.34 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1woh h ALA 259 CO -0.00 -0.19 0.12 0.00 0.00 0.00 0.00 179.25 179.18 1woh h ALA 260 N 0.93 0.30 -0.14 0.00 0.00 -1.21 -1.50 119.26 117.65 1woh h ALA 260 Ca 0.06 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1woh h ALA 260 Cb 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1woh h ALA 260 CO -0.01 -0.28 -0.28 0.00 0.00 0.00 0.00 179.25 178.68 1woh h ALA 261 N 1.13 1.26 0.00 0.00 0.00 -1.27 -2.82 119.26 117.56 1woh h ALA 261 Ca 0.11 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1woh h ALA 261 Cb 0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1woh h ALA 261 CO -0.08 0.50 -0.19 0.00 0.00 0.00 0.00 179.25 179.48 1woh h ALA 262 N 1.47 0.96 0.00 0.00 0.00 -0.54 -2.88 119.26 118.27 1woh h ALA 262 Ca 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1woh h ALA 262 Cb 0.63 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1woh h ALA 262 CO 0.05 0.24 -0.69 0.00 0.00 0.00 0.00 179.25 178.85 1woh n ALA 263 N -2.18 2.99 -0.10 0.00 0.00 -0.61 -4.17 120.51 116.44 1woh n ALA 263 Ca 0.01 -0.27 0.01 0.00 0.00 0.00 0.00 53.44 53.19 1woh n ALA 263 Cb 0.47 -1.14 0.01 0.00 0.00 0.00 0.00 19.45 18.79 1woh n ALA 263 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1woh n ASN 264 N -2.10 2.04 -4.11 0.00 3.02 -1.16 -4.98 115.26 107.97 1woh n ASN 264 Ca 0.03 -2.10 -0.12 0.00 -0.03 0.00 0.00 54.58 52.36 1woh n ASN 264 Cb 0.44 -0.04 -0.09 0.00 -0.61 0.00 0.00 39.78 39.48 1woh n ASN 264 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1woh s ASN 265 N -1.16 0.23 -0.56 6.41 0.01 -1.09 0.69 114.94 119.46 1woh s ASN 265 Ca 0.03 -1.36 -0.17 0.00 -0.71 0.00 0.00 52.86 50.65 1woh s ASN 265 Cb 0.03 0.42 0.13 0.00 0.41 0.00 0.00 41.25 42.23 1woh s ASN 265 CO 0.00 -0.90 0.56 -0.89 -1.51 0.00 0.00 177.10 174.37 1woh s THR 266 N -4.08 5.13 -0.15 1.60 2.01 -0.01 -4.86 115.64 115.28 1woh s THR 266 Ca 0.37 -1.42 -0.29 0.00 0.31 0.00 0.00 61.69 60.66 1woh s THR 266 Cb 0.06 -4.38 -0.02 0.00 0.01 0.00 0.00 72.50 68.17 1woh s THR 266 CO 0.13 -0.94 1.31 -0.69 -0.69 0.00 0.00 174.62 173.74 1woh s VAL 267 N 1.81 4.20 -1.92 3.82 1.01 -1.26 -1.05 120.40 127.01 1woh s VAL 267 Ca 0.06 1.45 0.21 0.00 0.00 0.00 0.00 61.98 63.69 1woh s VAL 267 Cb -0.28 -3.94 -0.00 0.00 0.00 0.00 0.00 36.38 32.17 1woh s VAL 267 CO 0.03 -0.13 1.03 1.33 0.00 0.00 0.00 175.10 177.36 1woh n VAL 268 N 5.39 0.00 0.00 2.92 0.24 0.21 -4.85 118.33 122.24 1woh n VAL 268 Ca 0.14 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 1woh n VAL 268 Cb 0.45 1.25 0.00 0.00 -1.47 0.00 0.00 33.84 34.07 1woh n VAL 268 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1woh n GLY 269 N 1.34 1.61 3.50 7.63 0.00 -1.25 -4.37 105.19 113.64 1woh n GLY 269 Ca 0.09 -1.08 -0.15 0.00 0.00 0.00 0.00 46.02 44.88 1woh n GLY 269 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1woh s LEU 270 N 0.00 -0.36 0.11 0.99 0.20 -0.84 -0.90 118.68 117.88 1woh s LEU 270 Ca 0.00 0.99 0.09 0.00 0.69 0.00 0.00 54.13 55.90 1woh s LEU 270 Cb 0.00 2.19 -0.04 0.00 -0.43 0.00 0.00 46.19 47.91 1woh s LEU 270 CO 0.00 -0.36 -0.22 1.51 -0.29 0.00 0.00 176.35 176.99 1woh s ASP 271 N -0.28 2.73 -0.24 3.68 1.47 0.06 -0.41 116.67 123.68 1woh s ASP 271 Ca -0.05 -0.71 0.00 0.00 1.18 0.00 0.00 52.55 52.98 1woh s ASP 271 Cb -0.03 -0.16 0.07 0.00 -0.34 0.00 0.00 42.92 42.46 1woh s ASP 271 CO 0.04 0.08 -0.02 -0.22 0.68 0.00 0.00 175.17 175.73 1woh s LEU 272 N -1.97 2.52 0.32 2.11 1.98 -0.24 -0.63 118.68 122.77 1woh s LEU 272 Ca 0.09 -1.23 0.07 0.00 -2.89 0.00 0.00 54.13 50.16 1woh s LEU 272 Cb -0.10 -1.11 -0.06 0.00 0.66 0.00 0.00 46.19 45.57 1woh s LEU 272 CO 0.05 -0.27 -0.03 0.68 -1.89 0.00 0.00 176.35 174.89 1woh s VAL 273 N 1.44 1.70 -0.34 1.68 -7.23 0.04 -0.50 120.40 117.20 1woh s VAL 273 Ca -0.03 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.05 1woh s VAL 273 Cb -0.19 -2.63 0.00 0.00 0.56 0.00 0.00 36.38 34.13 1woh s VAL 273 CO -0.08 -0.18 0.00 -0.62 -0.31 0.00 0.00 175.10 173.91 1woh n GLU 274 N -0.69 -0.62 -2.48 4.82 -0.58 -0.36 -1.81 120.64 118.91 1woh n GLU 274 Ca -0.05 0.43 -0.42 0.00 -0.42 0.00 0.00 57.16 56.70 1woh n GLU 274 Cb 0.65 -4.07 -0.03 0.00 -0.57 0.00 0.00 31.44 27.41 1woh n GLU 274 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1woh s LEU 275 N -0.72 4.42 -0.49 -4.62 0.20 -1.26 -4.24 118.68 111.97 1woh s LEU 275 Ca 0.00 2.02 0.03 0.00 0.69 0.00 0.00 54.13 56.87 1woh s LEU 275 Cb 0.00 -3.59 0.14 0.00 -0.43 0.00 0.00 46.19 42.31 1woh s LEU 275 CO 0.00 -0.35 0.27 0.00 -0.29 0.00 0.00 176.35 175.98 1woh s ALA 276 N 0.50 2.65 0.33 5.97 0.00 -0.07 -3.68 121.76 127.45 1woh s ALA 276 Ca 0.54 -2.92 0.07 0.00 0.00 0.00 0.00 51.96 49.65 1woh s ALA 276 Cb -0.29 -1.99 0.74 0.00 0.00 0.00 0.00 23.12 21.58 1woh s ALA 276 CO 0.32 -2.05 1.84 -1.35 0.00 0.00 0.00 175.76 174.52 1woh h PRO 277 N 6.51 0.75 0.00 0.00 0.11 -1.82 -0.21 132.00 137.35 1woh h PRO 277 Ca -0.01 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1woh h PRO 277 Cb 0.90 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1woh h PRO 277 CO 0.57 0.50 0.00 -2.95 -0.21 0.00 0.00 178.00 175.91 1woh h ASN 278 N 0.78 0.00 -0.26 -2.05 -1.07 -1.93 -2.04 115.58 109.00 1woh h ASN 278 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.85 1woh h ASN 278 Cb 0.71 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.96 1woh h ASN 278 CO -0.25 0.00 0.00 0.18 0.07 0.00 0.00 177.43 177.43 1woh n LEU 279 N -2.69 2.82 -3.48 6.14 4.77 -0.09 -4.63 117.00 119.84 1woh n LEU 279 Ca -0.01 -1.16 -0.29 0.00 -0.03 0.00 0.00 56.01 54.52 1woh n LEU 279 Cb 0.13 -0.17 -0.12 0.00 -2.33 0.00 0.00 43.42 40.94 1woh n LEU 279 CO 0.18 0.58 -0.30 -0.62 -1.33 0.00 0.00 177.39 175.90 1woh s ASP 280 N -1.60 2.69 0.00 -1.43 3.68 -0.76 -4.33 116.67 114.91 1woh s ASP 280 Ca 0.35 -2.50 0.11 0.00 2.13 0.00 0.00 52.55 52.64 1woh s ASP 280 Cb 0.21 -0.51 0.55 0.00 -1.45 0.00 0.00 42.92 41.72 1woh s ASP 280 CO 0.30 -0.26 1.25 -0.81 0.13 0.00 0.00 175.17 175.77 1woh n PRO 281 N 3.63 0.15 0.08 4.34 -0.04 -1.26 -1.45 135.00 140.44 1woh n PRO 281 Ca 0.16 0.19 0.12 0.00 -0.04 0.00 0.00 63.50 63.93 1woh n PRO 281 Cb 0.39 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.58 1woh n PRO 281 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1woh h THR 282 N 0.00 0.00 0.00 0.52 1.35 -1.93 -3.47 112.91 109.37 1woh h THR 282 Ca 0.00 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 1woh h THR 282 Cb 0.11 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 1woh h THR 282 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1woh n GLY 283 N 1.32 0.50 0.19 5.82 0.00 -0.53 -4.88 105.19 107.60 1woh n GLY 283 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1woh n GLY 283 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1woh h ARG 284 N 1.43 0.10 -0.09 1.61 0.11 -1.92 -2.92 114.38 112.69 1woh h ARG 284 Ca 0.00 -0.04 0.03 0.00 0.10 0.00 0.00 59.98 60.07 1woh h ARG 284 Cb 0.10 -0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.14 1woh h ARG 284 CO 0.00 0.48 -0.14 0.77 0.10 0.00 0.00 179.97 181.19 1woh h SER 285 N 0.08 -0.42 0.25 0.08 0.02 -1.89 0.12 113.55 111.80 1woh h SER 285 Ca 0.01 0.08 -0.15 0.00 -0.84 0.00 0.00 61.79 60.88 1woh h SER 285 Cb 0.75 0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 1woh h SER 285 CO 0.06 -0.18 -0.58 1.05 -1.14 0.00 0.00 176.83 176.03 1woh h GLU 286 N -0.18 0.33 -0.47 3.45 9.09 -1.93 -1.43 114.58 123.44 1woh h GLU 286 Ca 0.08 -0.22 -0.05 0.00 0.05 0.00 0.00 59.36 59.22 1woh h GLU 286 Cb 0.30 0.03 -0.02 0.00 -1.65 0.00 0.00 28.75 27.41 1woh h GLU 286 CO -0.20 0.82 0.11 -0.07 0.05 0.00 0.00 179.01 179.72 1woh h LEU 287 N 0.25 0.72 -0.38 3.06 3.38 -1.26 -0.81 115.31 120.27 1woh h LEU 287 Ca -0.00 -0.23 -0.19 0.00 0.09 0.00 0.00 57.88 57.55 1woh h LEU 287 Cb 1.09 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1woh h LEU 287 CO 0.10 0.77 -0.72 -0.07 0.09 0.00 0.00 178.44 178.60 1woh h LEU 288 N 0.64 0.55 -0.50 1.67 4.07 -0.72 -2.66 115.31 118.36 1woh h LEU 288 Ca 0.15 -0.35 -0.12 0.00 0.08 0.00 0.00 57.88 57.64 1woh h LEU 288 Cb 0.33 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 41.89 1woh h LEU 288 CO 0.00 1.10 -0.56 0.24 -1.08 0.00 0.00 178.44 178.14 1woh h MET 289 N 0.32 0.00 -0.34 1.13 2.86 -1.19 -0.90 114.93 116.80 1woh h MET 289 Ca -0.03 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.50 1woh h MET 289 Cb 1.30 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.95 1woh h MET 289 CO 0.13 0.56 -0.21 0.00 1.06 0.00 0.00 176.91 178.45 1woh h ALA 290 N 1.44 0.48 -0.64 6.32 0.00 -1.13 -2.54 119.26 123.19 1woh h ALA 290 Ca -0.01 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 1woh h ALA 290 Cb 1.21 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1woh h ALA 290 CO 0.07 0.44 0.08 -0.09 0.00 0.00 0.00 179.25 179.76 1woh h ARG 291 N 0.52 1.07 -0.37 0.00 2.43 -1.31 -2.57 114.38 114.16 1woh h ARG 291 Ca 0.07 -0.29 0.07 0.00 -0.81 0.00 0.00 59.98 59.02 1woh h ARG 291 Cb 0.77 -0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 30.13 1woh h ARG 291 CO 0.06 1.00 -0.04 1.25 -1.51 0.00 0.00 179.97 180.73 1woh h LEU 292 N 1.00 -0.23 -0.01 3.80 5.85 -0.96 0.39 115.31 125.15 1woh h LEU 292 Ca 0.19 0.10 0.01 0.00 0.84 0.00 0.00 57.88 59.02 1woh h LEU 292 Cb 0.46 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1woh h LEU 292 CO 0.02 -0.07 -0.03 0.58 -0.34 0.00 0.00 178.44 178.59 1woh h VAL 293 N 0.06 0.91 -0.66 1.05 2.07 -1.30 0.89 116.25 119.27 1woh h VAL 293 Ca 0.18 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.71 1woh h VAL 293 Cb 0.26 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 1woh h VAL 293 CO -0.33 0.00 0.43 0.24 0.02 0.00 0.00 177.57 177.93 1woh h MET 294 N -0.05 0.86 -0.28 1.57 2.86 -1.01 -0.66 114.93 118.21 1woh h MET 294 Ca 0.02 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 1woh h MET 294 Cb 0.08 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.53 1woh h MET 294 CO -0.04 0.57 -0.18 1.49 1.06 0.00 0.00 176.91 179.80 1woh h GLU 295 N 0.88 0.50 -0.43 1.72 4.81 0.01 -0.82 114.58 121.25 1woh h GLU 295 Ca 0.24 -0.16 -0.08 0.00 -0.13 0.00 0.00 59.36 59.23 1woh h GLU 295 Cb -0.09 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 1woh h GLU 295 CO -0.06 0.66 -0.03 1.15 -0.73 0.00 0.00 179.01 180.01 1woh h THR 296 N 0.45 1.27 -0.75 0.32 2.02 -0.25 -1.99 112.91 113.98 1woh h THR 296 Ca 0.08 -1.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.16 1woh h THR 296 Cb 0.58 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 68.05 1woh h THR 296 CO 0.04 0.37 0.42 -0.07 0.37 0.00 0.00 175.52 176.64 1woh h LEU 297 N 0.61 0.92 -0.28 2.58 3.38 -0.70 0.23 115.31 122.04 1woh h LEU 297 Ca 0.12 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1woh h LEU 297 Cb 0.53 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1woh h LEU 297 CO 0.03 0.73 0.05 0.00 0.09 0.00 0.00 178.44 179.34 1woh h GLU 299 N 0.16 0.22 -0.12 0.00 4.39 -0.52 -2.40 114.58 116.31 1woh h GLU 299 Ca 0.13 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.85 1woh h GLU 299 Cb 0.14 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.70 1woh h GLU 299 CO -0.18 0.20 -0.14 0.28 -1.16 0.00 0.00 179.01 178.02 1woh h VAL 300 N 0.17 0.62 0.00 3.13 2.07 -0.17 -2.32 116.25 119.76 1woh h VAL 300 Ca 0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1woh h VAL 300 Cb 0.04 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1woh h VAL 300 CO -0.01 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.07 1woh n PHE 301 N -5.28 0.00 1.50 1.57 3.01 -0.47 -2.46 117.46 115.32 1woh n PHE 301 Ca -0.03 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.57 1woh n PHE 301 Cb 0.20 -0.12 0.53 0.00 -0.01 0.00 0.00 39.48 40.08 1woh n PHE 301 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1woh n ASP 302 N -1.12 1.47 -2.72 4.37 10.43 -0.88 -4.12 116.55 123.99 1woh n ASP 302 Ca 0.18 -1.48 -0.09 0.00 2.57 0.00 0.00 54.79 55.97 1woh n ASP 302 Cb 0.15 0.00 0.05 0.00 1.84 0.00 0.00 41.12 43.16 1woh n ASP 302 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 1woh n HIS 303 N 0.14 0.09 -3.65 1.24 8.25 -1.03 -5.08 115.22 115.17 1woh n HIS 303 Ca 0.19 -2.66 -0.36 0.00 -0.26 0.00 0.00 57.72 54.63 1woh n HIS 303 Cb 0.35 0.14 -0.08 0.00 1.12 0.00 0.00 29.99 31.52 1woh n HIS 303 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1woh s VAL 304 N -2.18 5.36 -0.04 1.59 1.01 -1.24 -4.92 120.40 119.98 1woh s VAL 304 Ca 0.27 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1woh s VAL 304 Cb 0.43 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 33.29 1woh s VAL 304 CO -0.00 0.39 0.51 0.18 0.00 0.00 0.00 175.10 176.17