#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 3.53 -0.02 1.61 0.04 -1.26 -5.03 135.00 133.87 1woh s PRO 4 Ca 0.00 2.14 0.06 0.00 0.04 0.00 0.00 61.00 63.24 1woh s PRO 4 Cb 0.00 -2.45 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 1woh s PRO 4 CO 0.00 -0.85 -0.20 0.00 0.04 0.00 0.00 177.00 175.99 1woh s ALA 5 N -1.33 2.42 0.72 8.56 0.00 -1.26 -5.11 121.76 125.76 1woh s ALA 5 Ca 0.65 -1.08 -0.16 0.00 0.00 0.00 0.00 51.96 51.37 1woh s ALA 5 Cb -0.38 -0.74 0.02 0.00 0.00 0.00 0.00 23.12 22.02 1woh s ALA 5 CO 0.46 0.55 1.05 0.72 0.00 0.00 0.00 175.76 178.54 1woh n HIS 6 N 2.25 0.94 -2.32 0.00 8.25 -1.26 -5.02 115.22 118.06 1woh n HIS 6 Ca -0.17 0.40 -0.25 0.00 -0.26 0.00 0.00 57.72 57.44 1woh n HIS 6 Cb 0.52 -2.11 0.06 0.00 1.12 0.00 0.00 29.99 29.57 1woh n HIS 6 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1woh s LEU 7 N -3.67 2.98 0.43 2.41 2.01 -1.26 -4.92 118.68 116.65 1woh s LEU 7 Ca 0.75 0.42 0.18 0.00 0.01 0.00 0.00 54.13 55.49 1woh s LEU 7 Cb -0.34 -3.15 1.11 0.00 0.01 0.00 0.00 46.19 43.82 1woh s LEU 7 CO 0.49 -1.41 1.87 -0.65 1.01 0.00 0.00 176.35 177.66 1woh h PRO 8 N -0.40 0.36 -0.03 1.29 0.11 -1.96 -0.64 132.00 130.74 1woh h PRO 8 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1woh h PRO 8 Cb 1.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1woh h PRO 8 CO 0.59 0.24 0.00 2.48 -0.21 0.00 0.00 178.00 181.10 1woh n TYR 9 N -4.49 0.03 -4.18 0.65 4.11 -1.26 -4.88 117.16 107.15 1woh n TYR 9 Ca 0.18 -0.01 -0.29 0.00 -0.00 0.00 0.00 57.90 57.78 1woh n TYR 9 Cb 0.69 0.00 -0.08 0.00 -0.00 0.00 0.00 39.34 39.94 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 -1.89 1.82 0.00 -7.48 0.00 -0.25 -5.05 107.32 94.47 1woh s GLY 10 Ca 0.40 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.88 1woh s GLY 10 CO 0.32 -1.23 0.00 0.61 0.00 0.00 0.00 173.10 172.80 1woh n GLY 11 N 0.33 -0.41 3.70 0.20 0.00 -1.26 -4.64 105.19 103.11 1woh n GLY 11 Ca -0.11 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.77 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 -2.14 4.36 -0.56 -0.61 -1.09 -1.26 -4.96 121.20 114.94 1woh s ILE 12 Ca 0.00 1.68 -0.27 0.00 -2.23 0.00 0.00 60.65 59.82 1woh s ILE 12 Cb 0.00 -4.08 -0.00 0.00 -1.58 0.00 0.00 42.46 36.80 1woh s ILE 12 CO 0.00 0.04 1.61 -2.16 -1.23 0.00 0.00 174.94 173.20 1woh s PRO 13 N 1.80 3.07 0.19 2.79 0.04 -1.26 -4.93 135.00 136.69 1woh s PRO 13 Ca 0.55 0.59 0.11 0.00 0.04 0.00 0.00 61.00 62.29 1woh s PRO 13 Cb -0.24 -4.23 -0.04 0.00 0.04 0.00 0.00 34.50 30.02 1woh s PRO 13 CO 0.24 -2.22 -0.24 0.95 0.04 0.00 0.00 177.00 175.77 1woh s THR 14 N 7.18 2.34 0.09 1.26 -4.23 -1.26 -4.75 115.64 116.26 1woh s THR 14 Ca 0.60 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.80 1woh s THR 14 Cb -0.13 -2.11 -0.10 0.00 1.34 0.00 0.00 72.50 71.50 1woh s THR 14 CO 0.24 -0.09 1.91 0.33 -0.54 0.00 0.00 174.62 176.46 1woh n PHE 15 N 0.34 2.59 -1.85 3.99 7.35 -1.26 -0.92 117.46 127.70 1woh n PHE 15 Ca -0.13 -0.27 -0.21 0.00 -0.76 0.00 0.00 57.45 56.08 1woh n PHE 15 Cb 0.56 -2.77 -0.07 0.00 0.35 0.00 0.00 39.48 37.55 1woh n PHE 15 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1woh n ALA 16 N 6.55 -0.41 -2.54 3.13 0.00 -1.26 -1.48 120.51 124.49 1woh n ALA 16 Ca 0.19 0.29 -0.19 0.00 0.00 0.00 0.00 53.44 53.72 1woh n ALA 16 Cb 0.39 -2.10 -0.00 0.00 0.00 0.00 0.00 19.45 17.74 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 -2.58 -2.36 -2.00 0.00 0.63 -0.10 -4.67 116.66 105.58 1woh n ARG 17 Ca -0.22 0.88 -0.32 0.00 -0.92 0.00 0.00 57.85 57.27 1woh n ARG 17 Cb 0.69 -5.56 0.01 0.00 0.45 0.00 0.00 32.46 28.04 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 -2.96 2.93 0.53 5.13 0.00 -0.55 -4.96 121.76 121.87 1woh s ALA 18 Ca 0.06 0.13 -0.22 0.00 0.00 0.00 0.00 51.96 51.93 1woh s ALA 18 Cb -0.03 -3.14 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 1woh s ALA 18 CO 0.08 -0.69 1.29 -1.25 0.00 0.00 0.00 175.76 175.18 1woh s PRO 19 N -4.59 3.28 0.08 0.00 0.04 -1.26 -4.54 135.00 128.01 1woh s PRO 19 Ca 0.59 2.06 -0.25 0.00 0.04 0.00 0.00 61.00 63.44 1woh s PRO 19 Cb -0.12 -2.26 -0.06 0.00 0.04 0.00 0.00 34.50 32.10 1woh s PRO 19 CO 0.44 -1.03 0.76 -1.17 0.04 0.00 0.00 177.00 176.04 1woh s LEU 20 N -3.46 4.50 0.19 -3.56 2.96 -1.26 -1.36 118.68 116.68 1woh s LEU 20 Ca 0.70 1.50 -0.01 0.00 -0.22 0.00 0.00 54.13 56.10 1woh s LEU 20 Cb -0.36 -3.23 -0.04 0.00 0.50 0.00 0.00 46.19 43.06 1woh s LEU 20 CO 0.43 0.09 0.11 0.68 -1.32 0.00 0.00 176.35 176.33 1woh s VAL 21 N -0.43 0.08 -0.15 1.68 -7.23 -0.05 -4.91 120.40 109.38 1woh s VAL 21 Ca 0.37 -1.99 -0.08 0.00 -1.81 0.00 0.00 61.98 58.48 1woh s VAL 21 Cb -0.21 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 1woh s VAL 21 CO 0.24 -0.08 0.13 -1.10 -0.31 0.00 0.00 175.10 173.98 1woh s GLN 22 N -4.13 3.69 0.30 4.82 -1.52 -1.26 -4.11 119.66 117.44 1woh s GLN 22 Ca 0.36 -0.17 0.01 0.00 -1.95 0.00 0.00 55.36 53.61 1woh s GLN 22 Cb 0.07 -3.26 0.70 0.00 -0.22 0.00 0.00 33.01 30.31 1woh s GLN 22 CO 0.10 0.61 1.60 -1.35 -0.25 0.00 0.00 175.29 176.00 1woh h PRO 23 N 5.57 0.06 -0.47 2.91 0.11 -1.94 0.16 132.00 138.39 1woh h PRO 23 Ca -0.50 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1woh h PRO 23 Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1woh h PRO 23 CO 0.64 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 178.07 1woh n ASP 24 N -5.41 5.06 -3.51 -2.05 5.75 -1.26 -4.02 116.55 111.10 1woh n ASP 24 Ca 0.21 -2.93 -0.25 0.00 -0.01 0.00 0.00 54.79 51.81 1woh n ASP 24 Cb 0.71 -0.63 0.19 0.00 -1.03 0.00 0.00 41.12 40.36 1woh n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1woh n GLY 25 N 0.27 -2.03 3.39 6.12 0.00 0.55 -4.97 105.19 108.52 1woh n GLY 25 Ca 0.25 -1.61 -0.45 0.00 0.00 0.00 0.00 46.02 44.22 1woh n GLY 25 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1woh s ASP 26 N -4.62 7.09 0.16 1.61 2.15 -1.26 -4.97 116.67 116.84 1woh s ASP 26 Ca 0.62 -3.12 -0.10 0.00 0.43 0.00 0.00 52.55 50.38 1woh s ASP 26 Cb -0.04 -2.29 -0.00 0.00 -0.30 0.00 0.00 42.92 40.30 1woh s ASP 26 CO 0.45 -0.54 0.31 -1.66 -0.17 0.00 0.00 175.17 173.56 1woh s TRP 27 N 0.19 0.32 -0.13 -5.34 1.48 -1.26 -5.12 118.94 109.08 1woh s TRP 27 Ca 0.32 -0.68 -0.09 0.00 -1.06 0.00 0.00 56.10 54.59 1woh s TRP 27 Cb -0.07 -0.00 0.04 0.00 -1.16 0.00 0.00 33.47 32.28 1woh s TRP 27 CO -0.06 -0.73 0.32 -0.65 -4.06 0.00 0.00 176.95 171.77 1woh s GLN 28 N -3.95 0.34 0.08 3.25 -0.21 -1.26 -4.80 119.66 113.10 1woh s GLN 28 Ca 0.15 0.54 -0.17 0.00 0.02 0.00 0.00 55.36 55.91 1woh s GLN 28 Cb 0.03 0.06 0.03 0.00 1.00 0.00 0.00 33.01 34.13 1woh s GLN 28 CO -0.01 -0.10 0.40 0.00 -2.12 0.00 0.00 175.29 173.46 1woh s ALA 29 N 0.71 -0.95 0.15 6.09 0.00 -0.73 -5.02 121.76 122.01 1woh s ALA 29 Ca -0.04 0.14 -0.12 0.00 0.00 0.00 0.00 51.96 51.93 1woh s ALA 29 Cb -0.06 0.49 0.01 0.00 0.00 0.00 0.00 23.12 23.55 1woh s ALA 29 CO -0.05 -0.53 1.58 -0.44 0.00 0.00 0.00 175.76 176.32 1woh h ASP 30 N 2.75 0.86 -3.86 0.00 3.32 -1.71 -3.08 116.42 114.70 1woh h ASP 30 Ca -0.32 -0.33 -0.53 0.00 0.02 0.00 0.00 57.03 55.87 1woh h ASP 30 Cb 1.22 -0.23 -0.31 0.00 0.22 0.00 0.00 39.33 40.23 1woh h ASP 30 CO 0.45 0.99 -0.82 -0.69 -1.72 0.00 0.00 179.24 177.45 1woh s VAL 31 N -4.91 1.26 -0.04 -1.35 1.01 -0.24 -1.06 120.40 115.08 1woh s VAL 31 Ca -0.12 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.25 1woh s VAL 31 Cb 0.11 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.43 1woh s VAL 31 CO 0.83 0.37 -0.02 0.00 0.00 0.00 0.00 175.10 176.28 1woh s ALA 32 N 0.10 0.49 -0.02 5.51 0.00 -1.11 -1.12 121.76 125.59 1woh s ALA 32 Ca -0.04 0.06 -0.06 0.00 0.00 0.00 0.00 51.96 51.92 1woh s ALA 32 Cb -0.11 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 1woh s ALA 32 CO 0.02 -0.05 0.23 0.00 0.00 0.00 0.00 175.76 175.95 1woh s ALA 33 N 0.99 3.87 -0.03 0.00 0.00 -0.32 -0.59 121.76 125.69 1woh s ALA 33 Ca -0.10 -0.61 -0.01 0.00 0.00 0.00 0.00 51.96 51.24 1woh s ALA 33 Cb -0.14 -2.03 0.03 0.00 0.00 0.00 0.00 23.12 20.99 1woh s ALA 33 CO -0.01 0.65 0.06 -1.17 0.00 0.00 0.00 175.76 175.29 1woh s LEU 34 N -1.59 0.90 0.07 0.00 2.96 -0.08 -0.42 118.68 120.51 1woh s LEU 34 Ca 0.24 0.09 -0.01 0.00 -0.22 0.00 0.00 54.13 54.24 1woh s LEU 34 Cb -0.13 0.00 -0.04 0.00 0.50 0.00 0.00 46.19 46.52 1woh s LEU 34 CO 0.14 -0.15 0.25 -0.83 -1.32 0.00 0.00 176.35 174.44 1woh s GLY 35 N 1.22 2.20 -0.46 7.98 0.00 0.07 -1.34 107.32 116.98 1woh s GLY 35 Ca -0.07 -0.77 0.03 0.00 0.00 0.00 0.00 44.72 43.91 1woh s GLY 35 CO -0.04 -0.73 0.34 0.14 0.00 0.00 0.00 173.10 172.81 1woh s VAL 36 N -1.53 0.97 -1.16 1.40 1.01 0.26 -0.99 120.40 120.36 1woh s VAL 36 Ca 0.36 -2.83 -0.11 0.00 0.00 0.00 0.00 61.98 59.40 1woh s VAL 36 Cb -0.13 -1.66 -0.07 0.00 0.00 0.00 0.00 36.38 34.52 1woh s VAL 36 CO 0.26 -1.11 2.33 -0.81 0.00 0.00 0.00 175.10 175.77 1woh n PRO 37 N 2.94 2.53 -4.11 2.72 -0.04 -1.26 -3.13 135.00 134.64 1woh n PRO 37 Ca 0.22 -1.90 -0.32 0.00 -0.04 0.00 0.00 63.50 61.46 1woh n PRO 37 Cb 0.42 -2.75 -0.16 0.00 -0.04 0.00 0.00 33.50 30.96 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 3.33 2.59 -0.01 0.54 5.36 -1.26 -4.72 117.98 123.80 1woh s PHE 38 Ca 0.52 -1.51 0.02 0.00 -0.96 0.00 0.00 56.93 55.00 1woh s PHE 38 Cb 0.14 -1.82 0.02 0.00 -0.34 0.00 0.00 43.02 41.02 1woh s PHE 38 CO -0.02 -0.76 0.83 -0.40 -1.46 0.00 0.00 175.22 173.41 1woh n ASP 39 N 4.64 0.33 0.00 6.13 5.68 -1.26 0.00 116.55 132.07 1woh n ASP 39 Ca -0.20 -1.73 0.16 0.00 -0.50 0.00 0.00 54.79 52.52 1woh n ASP 39 Cb 0.50 -0.13 0.92 0.00 -1.14 0.00 0.00 41.12 41.27 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 -0.16 0.00 1.03 2.12 -5.35 -1.26 -3.34 119.36 112.40 1woh n ILE 40 Ca 0.01 0.00 0.11 0.00 -0.27 0.00 0.00 62.75 62.60 1woh n ILE 40 Cb 0.59 -0.51 0.03 0.00 -1.74 0.00 0.00 39.64 38.01 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 -1.02 3.87 -1.72 -1.28 0.00 -1.26 -4.96 120.51 114.14 1woh n ALA 41 Ca 0.23 -0.58 -0.32 0.00 0.00 0.00 0.00 53.44 52.77 1woh n ALA 41 Cb 0.12 -0.85 0.01 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 -2.67 3.44 0.00 0.00 0.05 -1.21 -2.69 118.68 115.59 1woh s LEU 42 Ca 0.16 1.67 0.24 0.00 0.05 0.00 0.00 54.13 56.24 1woh s LEU 42 Cb 0.18 -4.51 0.26 0.00 -2.05 0.00 0.00 46.19 40.06 1woh s LEU 42 CO 0.66 -1.03 1.26 0.61 -0.55 0.00 0.00 176.35 177.31 1woh n GLY 43 N -1.52 0.03 0.00 -3.48 0.00 -1.26 -4.92 105.19 94.03 1woh n GLY 43 Ca 0.08 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 0.04 0.00 -3.57 1.61 -0.00 -1.26 -5.09 117.46 109.19 1woh n PHE 44 Ca 0.11 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 57.16 1woh n PHE 44 Cb 0.45 0.00 -0.11 0.00 -0.00 0.00 0.00 39.48 39.82 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 0.62 3.45 0.96 -4.13 0.52 -1.26 -5.09 118.95 114.02 1woh s ARG 45 Ca 0.00 -0.67 -0.12 0.00 -0.52 0.00 0.00 55.73 54.42 1woh s ARG 45 Cb 0.00 -3.73 0.17 0.00 0.52 0.00 0.00 34.95 31.91 1woh s ARG 45 CO 0.00 -0.43 1.09 -2.14 0.02 0.00 0.00 175.30 173.84 1woh s PRO 46 N 1.69 0.72 0.00 3.54 0.02 -1.26 -4.46 135.00 135.25 1woh s PRO 46 Ca 0.06 0.61 0.00 0.00 0.02 0.00 0.00 61.00 61.68 1woh s PRO 46 Cb -0.17 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.58 1woh s PRO 46 CO 0.09 -2.55 0.00 0.41 -0.33 0.00 0.00 177.00 174.62 1woh n GLY 47 N -1.14 1.01 0.13 0.52 0.00 -1.26 -4.94 105.19 99.51 1woh n GLY 47 Ca 0.06 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.17 1woh n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1woh n ALA 48 N 0.00 1.16 0.30 4.61 0.00 -1.25 -1.10 120.51 124.23 1woh n ALA 48 Ca 0.00 0.14 0.17 0.00 0.00 0.00 0.00 53.44 53.76 1woh n ALA 48 Cb 0.00 -1.28 0.75 0.00 0.00 0.00 0.00 19.45 18.92 1woh n ALA 48 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1woh h ARG 49 N 0.00 0.00 -0.01 0.00 0.11 -1.84 -0.46 114.38 112.18 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 0.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.15 1woh h ARG 49 CO 0.00 0.00 -0.28 1.19 0.10 0.00 0.00 179.97 180.98 1woh n PHE 50 N -2.97 0.00 -0.16 4.08 3.72 -0.26 -4.45 117.46 117.42 1woh n PHE 50 Ca 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 1woh n PHE 50 Cb 0.26 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.74 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 3.92 0.60 -0.73 4.37 0.00 -1.41 -1.90 119.26 124.10 1woh h ALA 51 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.80 1woh h ALA 51 Cb 0.63 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 1woh h ALA 51 CO 0.00 0.27 0.39 -1.35 0.00 0.00 0.00 179.25 178.57 1woh h PRO 52 N 0.60 0.66 -0.27 0.00 0.11 -1.75 0.22 132.00 131.59 1woh h PRO 52 Ca 0.14 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.18 1woh h PRO 52 Cb 0.30 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 1woh h PRO 52 CO -0.00 0.44 0.01 -0.09 -0.21 0.00 0.00 178.00 178.15 1woh h ARG 53 N 0.68 0.46 -0.60 1.05 2.43 -1.83 -2.09 114.38 114.49 1woh h ARG 53 Ca 0.35 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 1woh h ARG 53 Cb 0.31 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.79 1woh h ARG 53 CO -0.24 0.61 0.24 0.00 -1.51 0.00 0.00 179.97 179.08 1woh h ALA 54 N 0.83 1.29 -0.41 2.80 0.00 -0.80 -1.62 119.26 121.36 1woh h ALA 54 Ca 0.08 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1woh h ALA 54 Cb 0.40 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1woh h ALA 54 CO 0.01 0.53 -0.14 -0.07 0.00 0.00 0.00 179.25 179.58 1woh h LEU 55 N 0.86 0.74 -0.02 0.00 3.38 -0.39 0.51 115.31 120.38 1woh h LEU 55 Ca 0.20 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1woh h LEU 55 Cb 0.17 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1woh h LEU 55 CO -0.02 0.89 0.00 0.03 0.09 0.00 0.00 178.44 179.44 1woh h ARG 56 N 0.67 0.04 -0.44 1.13 3.08 -0.96 0.08 114.38 117.97 1woh h ARG 56 Ca 0.11 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.20 1woh h ARG 56 Cb 0.62 -0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.61 1woh h ARG 56 CO 0.04 0.33 0.16 0.93 -1.07 0.00 0.00 179.97 180.36 1woh h GLU 57 N -0.26 0.33 0.00 0.04 5.08 -1.14 -1.78 114.58 116.86 1woh h GLU 57 Ca 0.01 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 1woh h GLU 57 Cb 0.31 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1woh h GLU 57 CO 0.00 0.22 -0.26 0.00 -1.00 0.00 0.00 179.01 177.96 1woh h ALA 58 N 1.29 1.32 0.00 3.43 0.00 -0.78 -2.66 119.26 121.86 1woh h ALA 58 Ca 0.21 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1woh h ALA 58 Cb 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1woh h ALA 58 CO -0.21 0.33 0.00 0.66 0.00 0.00 0.00 179.25 180.03 1woh h SER 59 N 0.00 0.00 0.58 0.00 4.64 -0.05 -2.01 113.55 116.70 1woh h SER 59 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1woh h SER 59 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1woh h SER 59 CO 0.03 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.17 1woh n LEU 60 N -2.35 0.29 -0.44 5.97 4.77 -1.00 -0.38 117.00 123.86 1woh n LEU 60 Ca 0.02 0.57 0.13 0.00 -0.03 0.00 0.00 56.01 56.70 1woh n LEU 60 Cb 0.22 -0.54 0.44 0.00 -2.33 0.00 0.00 43.42 41.21 1woh n LEU 60 CO 0.20 -0.40 0.77 0.54 -1.33 0.00 0.00 177.39 177.17 1woh n ARG 61 N -1.82 1.45 -2.87 3.23 5.12 -0.76 -4.28 116.66 116.74 1woh n ARG 61 Ca 0.03 -0.89 -0.12 0.00 -1.93 0.00 0.00 57.85 54.93 1woh n ARG 61 Cb 0.19 -1.48 0.01 0.00 -1.16 0.00 0.00 32.46 30.01 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 0.00 1.20 -4.69 0.55 7.64 0.49 -5.08 113.62 113.73 1woh n SER 62 Ca 0.16 -2.83 -0.42 0.00 1.01 0.00 0.00 58.87 56.80 1woh n SER 62 Cb 0.37 -0.56 -0.03 0.00 -1.01 0.00 0.00 64.21 62.98 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 -2.85 4.86 0.78 0.44 1.01 -1.18 -4.86 120.40 118.60 1woh s VAL 63 Ca 0.32 1.90 -0.11 0.00 0.00 0.00 0.00 61.98 64.09 1woh s VAL 63 Cb 0.42 -4.25 0.06 0.00 0.00 0.00 0.00 36.38 32.61 1woh s VAL 63 CO -0.01 0.08 1.09 -2.16 0.00 0.00 0.00 175.10 174.10 1woh s PRO 64 N 1.64 2.19 0.90 2.72 0.04 -1.26 -4.74 135.00 136.48 1woh s PRO 64 Ca 0.46 0.77 -0.14 0.00 0.04 0.00 0.00 61.00 62.13 1woh s PRO 64 Cb -0.19 -1.92 0.16 0.00 0.04 0.00 0.00 34.50 32.59 1woh s PRO 64 CO 0.19 -1.58 1.25 -1.25 0.04 0.00 0.00 177.00 175.66 1woh s PRO 65 N -5.09 1.11 -0.11 0.56 0.04 -1.26 -5.12 135.00 125.13 1woh s PRO 65 Ca 0.60 -0.31 0.02 0.00 0.04 0.00 0.00 61.00 61.36 1woh s PRO 65 Cb -0.15 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.49 1woh s PRO 65 CO 0.55 -2.10 -0.17 -0.06 0.04 0.00 0.00 177.00 175.26 1woh s PHE 66 N -3.74 2.11 -0.29 0.56 0.40 -0.68 -4.97 117.98 111.36 1woh s PHE 66 Ca 0.70 -0.96 -0.07 0.00 -0.60 0.00 0.00 56.93 56.00 1woh s PHE 66 Cb -0.06 -1.49 0.00 0.00 0.51 0.00 0.00 43.02 41.99 1woh s PHE 66 CO 0.51 -0.46 0.08 0.99 0.70 0.00 0.00 175.22 177.04 1woh s THR 67 N 0.81 4.00 0.84 0.64 2.01 -1.26 -0.07 115.64 122.61 1woh s THR 67 Ca -0.10 -0.63 -0.13 0.00 0.31 0.00 0.00 61.69 61.13 1woh s THR 67 Cb -0.16 -3.04 0.19 0.00 0.01 0.00 0.00 72.50 69.51 1woh s THR 67 CO 0.01 0.11 1.15 0.61 -0.69 0.00 0.00 174.62 175.81 1woh n GLY 68 N 4.87 -1.29 0.32 4.40 0.00 0.00 -4.87 105.19 108.62 1woh n GLY 68 Ca -0.15 -1.73 0.12 0.00 0.00 0.00 0.00 46.02 44.26 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 0.14 0.00 0.99 5.85 -1.99 0.13 115.31 120.43 1woh h LEU 69 Ca -0.37 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1woh h LEU 69 Cb 1.04 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1woh h LEU 69 CO 0.27 0.09 0.00 -0.90 -0.34 0.00 0.00 178.44 177.56 1woh n ASP 70 N -4.47 0.00 0.00 1.25 5.68 -1.26 -4.86 116.55 112.89 1woh n ASP 70 Ca 0.04 -0.44 0.00 0.00 -0.50 0.00 0.00 54.79 53.89 1woh n ASP 70 Cb 0.29 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 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 0.69 1.41 3.81 6.12 0.00 0.46 -5.02 105.19 112.67 1woh n GLY 71 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.20 4.29 -0.06 1.61 1.02 -1.26 -4.77 119.74 120.38 1woh s LYS 72 Ca 0.00 1.10 0.03 0.00 0.02 0.00 0.00 55.97 57.13 1woh s LYS 72 Cb 0.00 -2.38 -0.02 0.00 -0.52 0.00 0.00 37.83 34.90 1woh s LYS 72 CO 0.00 0.08 -0.14 0.99 -0.92 0.00 0.00 175.35 175.36 1woh s THR 73 N -2.00 3.09 0.12 2.17 2.01 -1.26 -0.82 115.64 118.95 1woh s THR 73 Ca 0.58 -0.71 0.11 0.00 0.31 0.00 0.00 61.69 61.97 1woh s THR 73 Cb -0.12 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 1woh s THR 73 CO 0.16 0.59 -0.26 -0.13 -0.69 0.00 0.00 174.62 174.29 1woh s ARG 74 N -0.63 1.47 -1.27 4.92 0.52 0.89 -4.64 118.95 120.22 1woh s ARG 74 Ca 0.09 -1.31 0.00 0.00 -0.52 0.00 0.00 55.73 53.99 1woh s ARG 74 Cb -0.11 -1.93 0.00 0.00 0.52 0.00 0.00 34.95 33.43 1woh s ARG 74 CO 0.01 0.46 0.00 1.28 0.02 0.00 0.00 175.30 177.07 1woh n LEU 75 N 0.99 -1.04 -4.69 2.53 4.77 -1.26 -1.69 117.00 116.61 1woh n LEU 75 Ca -0.18 0.24 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 1woh n LEU 75 Cb 0.53 -1.92 -0.03 0.00 -2.33 0.00 0.00 43.42 39.67 1woh n LEU 75 CO 0.23 -0.54 1.19 -1.58 -1.33 0.00 0.00 177.39 175.36 1woh s GLN 76 N -3.37 4.25 0.00 3.23 2.00 -1.26 -2.20 119.66 122.30 1woh s GLN 76 Ca 0.00 2.07 0.00 0.00 -2.00 0.00 0.00 55.36 55.43 1woh s GLN 76 Cb 0.00 -3.62 0.00 0.00 0.80 0.00 0.00 33.01 30.19 1woh s GLN 76 CO 0.00 -0.64 0.00 0.41 -0.50 0.00 0.00 175.29 174.56 1woh n GLY 77 N 3.77 0.91 3.66 2.59 0.00 -1.26 -4.99 105.19 109.87 1woh n GLY 77 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.69 4.74 0.21 1.61 1.01 -0.94 -5.02 120.40 118.32 1woh s VAL 78 Ca 0.00 1.87 -0.21 0.00 0.00 0.00 0.00 61.98 63.64 1woh s VAL 78 Cb 0.00 -4.24 -0.08 0.00 0.00 0.00 0.00 36.38 32.05 1woh s VAL 78 CO 0.00 -0.13 0.73 0.42 0.00 0.00 0.00 175.10 176.12 1woh s THR 79 N 3.00 4.53 0.21 3.92 -4.23 -1.26 -4.97 115.64 116.84 1woh s THR 79 Ca 0.41 1.37 0.10 0.00 -1.18 0.00 0.00 61.69 62.39 1woh s THR 79 Cb -0.15 -3.91 -0.04 0.00 1.34 0.00 0.00 72.50 69.73 1woh s THR 79 CO 0.07 0.27 -0.20 -0.36 -0.54 0.00 0.00 174.62 173.86 1woh s PHE 80 N -1.45 2.05 -0.00 3.99 0.40 -1.26 -1.07 117.98 120.64 1woh s PHE 80 Ca 0.41 -0.42 -0.17 0.00 -0.60 0.00 0.00 56.93 56.16 1woh s PHE 80 Cb -0.18 -0.98 0.03 0.00 0.51 0.00 0.00 43.02 42.40 1woh s PHE 80 CO 0.22 0.47 0.36 0.00 0.70 0.00 0.00 175.22 176.97 1woh s ALA 81 N -2.17 -0.91 -0.27 5.36 0.00 -0.28 -4.26 121.76 119.24 1woh s ALA 81 Ca 0.21 0.39 0.03 0.00 0.00 0.00 0.00 51.96 52.59 1woh s ALA 81 Cb -0.06 0.13 0.06 0.00 0.00 0.00 0.00 23.12 23.26 1woh s ALA 81 CO 0.10 -0.31 -0.08 0.34 0.00 0.00 0.00 175.76 175.80 1woh s ASP 82 N -1.49 4.54 -0.00 0.00 -1.08 -0.47 -1.17 116.67 117.01 1woh s ASP 82 Ca -0.11 -1.48 0.02 0.00 -0.52 0.00 0.00 52.55 50.46 1woh s ASP 82 Cb -0.04 -1.58 0.06 0.00 -1.46 0.00 0.00 42.92 39.90 1woh s ASP 82 CO 0.03 -0.22 1.02 0.00 0.52 0.00 0.00 175.17 176.52 1woh n ALA 83 N 4.43 2.50 -0.22 3.66 0.00 0.44 -0.87 120.51 130.44 1woh n ALA 83 Ca -0.12 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1woh n ALA 83 Cb 0.42 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.88 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 0.56 -0.40 3.55 0.00 0.00 -1.26 -4.16 105.19 103.49 1woh n GLY 84 Ca 0.02 -1.07 -0.28 0.00 0.00 0.00 0.00 46.02 44.69 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 4.20 0.31 1.61 1.01 -1.26 -0.75 116.67 117.78 1woh s ASP 85 Ca 0.00 -0.54 -0.29 0.00 0.71 0.00 0.00 52.55 52.43 1woh s ASP 85 Cb 0.00 -0.70 -0.10 0.00 1.01 0.00 0.00 42.92 43.13 1woh s ASP 85 CO 0.00 0.13 1.33 -0.69 0.21 0.00 0.00 175.17 176.15 1woh s VAL 86 N -1.51 2.73 -0.57 -1.27 1.01 -0.16 -4.90 120.40 115.74 1woh s VAL 86 Ca 0.23 0.70 -0.27 0.00 0.00 0.00 0.00 61.98 62.65 1woh s VAL 86 Cb -0.10 -3.45 0.03 0.00 0.00 0.00 0.00 36.38 32.87 1woh s VAL 86 CO 0.14 0.15 1.09 -0.63 0.00 0.00 0.00 175.10 175.85 1woh s ILE 87 N -0.84 4.18 0.06 2.22 1.01 -1.26 -4.80 121.20 121.77 1woh s ILE 87 Ca 0.51 0.66 -0.07 0.00 0.00 0.00 0.00 60.65 61.75 1woh s ILE 87 Cb -0.40 -4.65 -0.05 0.00 0.01 0.00 0.00 42.46 37.37 1woh s ILE 87 CO 0.50 -1.24 0.33 -0.76 0.00 0.00 0.00 174.94 173.77 1woh s LEU 88 N 4.53 4.34 0.84 2.97 1.43 -1.26 -4.97 118.68 126.56 1woh s LEU 88 Ca 0.38 0.62 -0.07 0.00 -1.03 0.00 0.00 54.13 54.03 1woh s LEU 88 Cb -0.09 -2.91 0.18 0.00 0.03 0.00 0.00 46.19 43.39 1woh s LEU 88 CO 0.23 0.18 1.16 -2.16 0.23 0.00 0.00 176.35 175.99 1woh s PRO 89 N -2.03 1.08 0.11 1.29 0.04 -1.26 -5.06 135.00 129.17 1woh s PRO 89 Ca 0.32 -0.94 -0.13 0.00 0.04 0.00 0.00 61.00 60.30 1woh s PRO 89 Cb -0.13 -2.12 -0.06 0.00 0.04 0.00 0.00 34.50 32.22 1woh s PRO 89 CO 0.19 -1.97 0.49 -1.12 0.04 0.00 0.00 177.00 174.64 1woh s SER 90 N -4.86 6.77 0.77 6.66 0.01 -1.26 -4.88 113.70 116.91 1woh s SER 90 Ca 0.71 0.98 0.00 0.00 1.31 0.00 0.00 55.95 58.95 1woh s SER 90 Cb -0.04 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.94 1woh s SER 90 CO 0.49 0.15 0.00 0.18 0.41 0.00 0.00 173.24 174.46 1woh n LEU 91 N 0.94 0.00 -4.02 2.44 4.77 -1.26 -4.85 117.00 115.01 1woh n LEU 91 Ca -0.07 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 55.46 1woh n LEU 91 Cb 0.52 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.63 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 -0.40 -0.33 3.23 -0.58 -1.26 -4.72 120.64 130.57 1woh n GLU 92 Ca 0.00 0.13 0.07 0.00 -0.42 0.00 0.00 57.16 56.94 1woh n GLU 92 Cb 0.00 -2.77 0.24 0.00 -0.57 0.00 0.00 31.44 28.33 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 -2.53 0.81 -0.73 3.49 0.13 -1.97 -0.87 132.00 130.34 1woh h PRO 93 Ca -0.71 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 64.32 1woh h PRO 93 Cb 1.40 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 1woh h PRO 93 CO 0.52 0.54 0.26 0.37 -0.23 0.00 0.00 178.00 179.45 1woh h GLN 94 N 0.84 1.11 -0.52 0.86 4.15 -1.99 0.11 115.11 119.66 1woh h GLN 94 Ca 0.49 -0.22 -0.07 0.00 0.77 0.00 0.00 58.65 59.61 1woh h GLN 94 Cb 0.57 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 1woh h GLN 94 CO -0.30 0.93 0.03 1.25 -1.93 0.00 0.00 178.83 178.81 1woh h LEU 95 N 1.06 0.87 -0.44 -2.39 5.85 -1.75 -1.76 115.31 116.74 1woh h LEU 95 Ca 0.24 -0.29 0.02 0.00 0.84 0.00 0.00 57.88 58.69 1woh h LEU 95 Cb 0.26 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1woh h LEU 95 CO -0.01 0.94 0.25 0.00 -0.34 0.00 0.00 178.44 179.28 1woh h ALA 96 N 0.96 0.56 -0.48 1.25 0.00 -0.67 -1.39 119.26 119.49 1woh h ALA 96 Ca 0.15 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1woh h ALA 96 Cb 0.48 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1woh h ALA 96 CO 0.02 -0.08 0.22 0.45 0.00 0.00 0.00 179.25 179.86 1woh h HIS 97 N 0.51 0.39 -0.76 0.00 3.86 -0.50 -0.77 115.15 117.88 1woh h HIS 97 Ca 0.18 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.37 1woh h HIS 97 Cb 0.03 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.36 1woh h HIS 97 CO -0.08 0.17 0.32 -0.44 0.86 0.00 0.00 177.93 178.76 1woh h ASP 98 N 0.43 1.03 -0.20 2.45 3.32 -0.80 -1.34 116.42 121.31 1woh h ASP 98 Ca 0.22 -0.15 -0.12 0.00 0.02 0.00 0.00 57.03 57.01 1woh h ASP 98 Cb 0.17 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1woh h ASP 98 CO -0.18 0.90 -0.27 0.03 -1.72 0.00 0.00 179.24 178.00 1woh h ARG 99 N 1.10 0.68 -0.30 3.56 3.08 -0.70 -1.79 114.38 120.01 1woh h ARG 99 Ca 0.26 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1woh h ARG 99 Cb 0.19 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1woh h ARG 99 CO -0.02 0.88 0.03 0.82 -1.07 0.00 0.00 179.97 180.60 1woh h ILE 100 N 0.58 1.24 -0.57 2.04 2.04 -0.77 -1.37 117.51 120.70 1woh h ILE 100 Ca 0.08 -0.86 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 1woh h ILE 100 Cb 0.76 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 1woh h ILE 100 CO 0.06 0.28 0.24 0.74 0.00 0.00 0.00 178.15 179.47 1woh h THR 101 N 0.31 1.22 -0.25 -0.27 2.02 -1.17 -0.43 112.91 114.34 1woh h THR 101 Ca 0.09 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 66.58 1woh h THR 101 Cb 0.38 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1woh h THR 101 CO 0.01 0.26 0.08 -0.08 0.37 0.00 0.00 175.52 176.16 1woh h GLU 102 N 0.78 0.39 -0.69 6.66 4.57 -1.25 -0.22 114.58 124.83 1woh h GLU 102 Ca 0.19 -0.08 -0.05 0.00 -1.18 0.00 0.00 59.36 58.23 1woh h GLU 102 Cb 0.18 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.68 1woh h GLU 102 CO -0.02 0.46 0.22 0.00 -1.18 0.00 0.00 179.01 178.50 1woh h ALA 103 N 0.91 0.91 -0.60 2.92 0.00 -1.16 -1.83 119.26 120.40 1woh h ALA 103 Ca 0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1woh h ALA 103 Cb 0.24 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1woh h ALA 103 CO -0.00 0.58 0.21 0.00 0.00 0.00 0.00 179.25 180.04 1woh h ALA 104 N 1.10 0.78 -0.56 0.00 0.00 -0.89 -0.69 119.26 119.00 1woh h ALA 104 Ca 0.22 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1woh h ALA 104 Cb 0.29 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1woh h ALA 104 CO -0.01 0.43 0.35 0.00 0.00 0.00 0.00 179.25 180.02 1woh h ARG 105 N 0.85 0.75 -0.67 0.00 3.08 -0.77 0.14 114.38 117.76 1woh h ARG 105 Ca 0.20 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.13 1woh h ARG 105 Cb 0.25 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 1woh h ARG 105 CO -0.01 0.53 0.19 1.96 -1.07 0.00 0.00 179.97 181.57 1woh h GLN 106 N 0.76 1.05 -0.30 0.04 4.20 -1.02 -2.16 115.11 117.69 1woh h GLN 106 Ca 0.20 -0.24 -0.13 0.00 0.06 0.00 0.00 58.65 58.55 1woh h GLN 106 Cb -0.05 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.58 1woh h GLN 106 CO -0.04 0.92 -0.32 0.28 -0.67 0.00 0.00 178.83 179.00 1woh h VAL 107 N 0.98 1.30 -0.96 -0.54 2.07 -0.84 -3.13 116.25 115.13 1woh h VAL 107 Ca 0.21 -1.49 0.05 0.00 0.82 0.00 0.00 66.70 66.29 1woh h VAL 107 Cb 0.32 1.57 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 1woh h VAL 107 CO -0.00 0.48 0.62 0.03 0.02 0.00 0.00 177.57 178.71 1woh h ARG 108 N 0.49 1.12 0.00 1.57 2.47 -0.59 -1.81 114.38 117.63 1woh h ARG 108 Ca 0.04 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1woh h ARG 108 Cb 0.90 -0.25 0.00 0.00 -1.65 0.00 0.00 29.97 28.96 1woh h ARG 108 CO 0.08 0.74 0.00 0.41 0.56 0.00 0.00 179.97 181.76 1woh n GLY 109 N -1.35 -0.69 0.00 0.04 0.00 -0.82 -2.95 105.19 99.42 1woh n GLY 109 Ca 0.14 -0.11 0.00 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 -1.09 2.00 -4.08 1.61 1.74 -0.69 -5.06 116.66 111.09 1woh n ARG 110 Ca 0.13 -1.21 -0.11 0.00 -0.77 0.00 0.00 57.85 55.89 1woh n ARG 110 Cb 0.09 -0.94 -0.06 0.00 -1.02 0.00 0.00 32.46 30.53 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 2.32 0.00 -4.55 0.00 2.43 -1.03 -3.46 114.38 110.09 1woh h ARG 112 Ca -0.29 0.00 -0.63 0.00 -0.81 0.00 0.00 59.98 58.25 1woh h ARG 112 Cb 1.25 0.00 -0.37 0.00 -0.42 0.00 0.00 29.97 30.42 1woh h ARG 112 CO 0.41 0.87 -0.80 0.08 -1.51 0.00 0.00 179.97 179.02 1woh s VAL 113 N -2.31 1.72 0.16 0.20 1.01 -0.22 -4.83 120.40 116.13 1woh s VAL 113 Ca -0.25 -1.25 -0.20 0.00 0.00 0.00 0.00 61.98 60.28 1woh s VAL 113 Cb 0.04 -1.89 -0.08 0.00 0.00 0.00 0.00 36.38 34.46 1woh s VAL 113 CO 0.55 0.01 0.67 -2.16 0.00 0.00 0.00 175.10 174.17 1woh s PRO 114 N 1.32 4.27 -0.20 2.72 0.04 -1.26 -2.77 135.00 139.13 1woh s PRO 114 Ca -0.05 0.85 -0.00 0.00 0.04 0.00 0.00 61.00 61.84 1woh s PRO 114 Cb -0.18 -3.08 0.02 0.00 0.04 0.00 0.00 34.50 31.30 1woh s PRO 114 CO -0.07 0.52 -0.14 0.08 0.04 0.00 0.00 177.00 177.43 1woh s VAL 115 N -1.31 2.47 -0.23 -0.36 1.01 0.25 -2.03 120.40 120.20 1woh s VAL 115 Ca 0.37 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 61.37 1woh s VAL 115 Cb -0.19 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1woh s VAL 115 CO 0.21 0.43 0.08 -0.36 0.00 0.00 0.00 175.10 175.46 1woh s PHE 116 N 1.32 3.15 -0.35 5.22 0.40 0.57 -0.90 117.98 127.39 1woh s PHE 116 Ca 0.04 -0.18 -0.11 0.00 -0.60 0.00 0.00 56.93 56.08 1woh s PHE 116 Cb -0.14 -2.19 0.01 0.00 0.51 0.00 0.00 43.02 41.21 1woh s PHE 116 CO -0.09 -0.15 0.20 -0.51 0.70 0.00 0.00 175.22 175.36 1woh s LEU 117 N 1.18 4.53 0.90 -0.37 1.43 -0.45 -0.50 118.68 125.39 1woh s LEU 117 Ca 0.05 -0.80 -0.11 0.00 -1.03 0.00 0.00 54.13 52.24 1woh s LEU 117 Cb -0.14 -2.03 0.19 0.00 0.03 0.00 0.00 46.19 44.24 1woh s LEU 117 CO 0.04 -0.32 1.23 -0.83 0.23 0.00 0.00 176.35 176.70 1woh s GLY 118 N 1.59 1.79 0.00 -3.19 0.00 0.64 -0.58 107.32 107.57 1woh s GLY 118 Ca 0.03 -1.47 0.00 0.00 0.00 0.00 0.00 44.72 43.29 1woh s GLY 118 CO 0.07 -0.73 0.00 0.61 0.00 0.00 0.00 173.10 173.05 1woh n GLY 119 N -3.50 0.28 3.76 0.20 0.00 -0.27 -3.28 105.19 102.38 1woh n GLY 119 Ca 0.16 -1.51 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.96 3.37 0.61 1.61 1.47 0.10 -1.15 116.67 121.72 1woh s ASP 120 Ca 0.00 1.07 0.41 0.00 1.18 0.00 0.00 52.55 55.21 1woh s ASP 120 Cb 0.00 -1.69 2.15 0.00 -0.34 0.00 0.00 42.92 43.04 1woh s ASP 120 CO 0.00 -2.65 2.24 -0.74 0.68 0.00 0.00 175.17 174.70 1woh h HIS 121 N -1.56 0.00 -0.00 2.11 -0.00 -1.90 -2.55 115.15 111.25 1woh h HIS 121 Ca -0.51 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.86 1woh h HIS 121 Cb 1.32 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.73 1woh h HIS 121 CO 0.31 0.00 0.01 0.66 -0.00 0.00 0.00 177.93 178.91 1woh h SER 122 N 0.00 0.00 0.64 3.26 4.64 -1.80 -1.39 113.55 118.89 1woh h SER 122 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1woh h SER 122 Cb 0.07 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1woh h SER 122 CO 0.00 0.00 -0.00 -0.37 -0.87 0.00 0.00 176.83 175.59 1woh h VAL 123 N 0.00 0.01 0.00 0.95 -1.51 -1.80 -2.75 116.25 111.15 1woh h VAL 123 Ca 0.00 -0.33 -0.01 0.00 -1.23 0.00 0.00 66.70 65.13 1woh h VAL 123 Cb 0.01 1.32 -0.00 0.00 -2.13 0.00 0.00 31.29 30.50 1woh h VAL 123 CO -0.00 0.00 -0.07 0.28 -1.23 0.00 0.00 177.57 176.55 1woh h SER 124 N 0.00 0.00 0.73 4.19 0.02 -1.49 -2.21 113.55 114.79 1woh h SER 124 Ca -0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1woh h SER 124 Cb 0.32 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.87 1woh h SER 124 CO 0.00 0.07 -0.35 0.22 -1.14 0.00 0.00 176.83 175.63 1woh h TYR 125 N 0.00 -0.91 0.00 3.45 3.20 -1.68 -0.69 116.97 120.34 1woh h TYR 125 Ca -0.00 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 1woh h TYR 125 Cb 0.12 0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.69 1woh h TYR 125 CO 0.00 -0.57 -0.13 -1.00 -1.64 0.00 0.00 178.16 174.82 1woh h PRO 126 N -1.17 0.00 -0.01 1.82 0.13 -1.72 -2.21 132.00 128.84 1woh h PRO 126 Ca -0.10 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1woh h PRO 126 Cb 0.75 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.88 1woh h PRO 126 CO 0.17 0.13 0.00 -0.07 -0.23 0.00 0.00 178.00 178.00 1woh h LEU 127 N 0.00 0.02 -1.85 1.56 4.07 -1.37 -2.95 115.31 114.79 1woh h LEU 127 Ca -0.00 -0.20 -0.01 0.00 0.08 0.00 0.00 57.88 57.75 1woh h LEU 127 Cb 0.25 -0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.99 1woh h LEU 127 CO 0.02 0.21 -0.06 -0.07 -1.08 0.00 0.00 178.44 177.46 1woh h LEU 128 N -0.18 0.02 -2.79 1.67 3.38 -0.56 -1.69 115.31 115.16 1woh h LEU 128 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1woh h LEU 128 Cb 0.20 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1woh h LEU 128 CO -0.00 0.08 0.05 0.03 0.09 0.00 0.00 178.44 178.70 1woh h ARG 129 N 0.02 0.00 0.00 1.13 3.08 -1.23 0.82 114.38 118.20 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 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1woh h ARG 129 CO 0.01 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.91 1woh n ALA 130 N -2.08 2.53 -1.49 0.04 0.00 -0.63 -3.29 120.51 115.58 1woh n ALA 130 Ca -0.03 -0.17 -0.04 0.00 0.00 0.00 0.00 53.44 53.21 1woh n ALA 130 Cb 0.12 -1.48 0.20 0.00 0.00 0.00 0.00 19.45 18.29 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 -1.11 1.00 0.27 0.00 3.01 0.28 -4.73 117.46 116.19 1woh n PHE 131 Ca 0.19 -1.62 0.10 0.00 1.01 0.00 0.00 57.45 57.13 1woh n PHE 131 Cb 0.15 -0.48 0.73 0.00 -0.01 0.00 0.00 39.48 39.87 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 1.01 1.73 -0.24 4.37 0.00 -1.70 -2.33 119.26 122.10 1woh h ALA 132 Ca 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1woh h ALA 132 Cb 1.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1woh h ALA 132 CO 0.36 0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.26 1woh n ASP 133 N -4.19 1.58 -4.56 0.00 3.85 -1.26 -4.82 116.55 107.15 1woh n ASP 133 Ca -0.03 -1.85 -0.42 0.00 -0.71 0.00 0.00 54.79 51.79 1woh n ASP 133 Cb 0.12 -0.15 -0.06 0.00 -1.35 0.00 0.00 41.12 39.67 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 -1.69 4.86 0.26 2.12 1.01 -0.88 -5.03 120.40 121.05 1woh s VAL 134 Ca 0.26 0.53 -0.30 0.00 0.00 0.00 0.00 61.98 62.47 1woh s VAL 134 Cb 0.14 -4.11 -0.11 0.00 0.00 0.00 0.00 36.38 32.30 1woh s VAL 134 CO 0.20 -0.37 1.52 -2.16 0.00 0.00 0.00 175.10 174.28 1woh s PRO 135 N 2.77 4.20 -1.44 2.72 0.04 -1.26 -3.23 135.00 138.79 1woh s PRO 135 Ca 0.25 2.42 -0.01 0.00 0.04 0.00 0.00 61.00 63.70 1woh s PRO 135 Cb -0.14 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.32 1woh s PRO 135 CO 0.16 -0.52 0.30 -0.25 0.04 0.00 0.00 177.00 176.72 1woh n ASP 136 N 2.38 -0.02 -4.72 6.66 8.00 -1.23 -4.68 116.55 122.93 1woh n ASP 136 Ca 0.08 -1.09 -0.42 0.00 0.71 0.00 0.00 54.79 54.07 1woh n ASP 136 Cb 0.39 -2.60 -0.03 0.00 -0.02 0.00 0.00 41.12 38.86 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 -7.09 4.37 0.03 0.64 2.96 0.24 -4.44 118.68 115.38 1woh s LEU 137 Ca 0.01 2.88 0.06 0.00 -0.22 0.00 0.00 54.13 56.87 1woh s LEU 137 Cb -0.01 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 43.05 1woh s LEU 137 CO 0.92 -0.97 -0.17 -1.00 -1.32 0.00 0.00 176.35 173.82 1woh s HIS 138 N 1.01 2.60 -0.09 5.38 3.76 -0.22 -1.50 115.29 126.23 1woh s HIS 138 Ca 0.73 -0.23 0.04 0.00 -0.15 0.00 0.00 55.06 55.45 1woh s HIS 138 Cb -0.50 -1.49 -0.00 0.00 1.11 0.00 0.00 32.58 31.70 1woh s HIS 138 CO 0.34 0.25 -0.23 0.08 -0.85 0.00 0.00 174.74 174.33 1woh s VAL 139 N -0.91 2.12 -0.31 -0.90 1.01 -0.31 -1.01 120.40 120.09 1woh s VAL 139 Ca 0.14 -1.01 -0.07 0.00 0.00 0.00 0.00 61.98 61.05 1woh s VAL 139 Cb -0.11 -1.80 0.02 0.00 0.00 0.00 0.00 36.38 34.49 1woh s VAL 139 CO 0.05 0.56 0.10 -0.69 0.00 0.00 0.00 175.10 175.12 1woh s VAL 140 N 0.23 4.02 -0.21 2.92 1.01 -0.32 -0.71 120.40 127.35 1woh s VAL 140 Ca -0.15 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 1woh s VAL 140 Cb -0.17 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1woh s VAL 140 CO 0.08 -0.01 -0.06 -1.58 0.00 0.00 0.00 175.10 173.52 1woh s GLN 141 N 1.49 3.35 -0.21 2.72 0.74 0.35 -1.25 119.66 126.86 1woh s GLN 141 Ca 0.02 -0.64 -0.13 0.00 0.05 0.00 0.00 55.36 54.65 1woh s GLN 141 Cb -0.18 -2.94 -0.05 0.00 1.10 0.00 0.00 33.01 30.94 1woh s GLN 141 CO 0.03 -0.16 0.27 -0.51 -0.55 0.00 0.00 175.29 174.37 1woh s LEU 142 N 1.35 4.16 -0.23 3.68 1.43 -0.36 -0.52 118.68 128.19 1woh s LEU 142 Ca 0.04 0.34 -0.29 0.00 -1.03 0.00 0.00 54.13 53.19 1woh s LEU 142 Cb -0.14 -2.30 0.16 0.00 0.03 0.00 0.00 46.19 43.93 1woh s LEU 142 CO -0.03 0.03 1.18 -0.62 0.23 0.00 0.00 176.35 177.14 1woh s ASP 143 N 0.89 -0.22 0.29 2.29 -1.08 -0.72 -1.45 116.67 116.67 1woh s ASP 143 Ca 0.13 0.27 0.20 0.00 -0.52 0.00 0.00 52.55 52.63 1woh s ASP 143 Cb -0.14 0.22 0.12 0.00 -1.46 0.00 0.00 42.92 41.66 1woh s ASP 143 CO 0.05 -0.18 1.30 0.00 0.52 0.00 0.00 175.17 176.86 1woh h ALA 144 N 2.52 0.74 -3.61 3.66 0.00 -1.74 -2.61 119.26 118.21 1woh h ALA 144 Ca -0.16 -0.20 -0.67 0.00 0.00 0.00 0.00 54.91 53.88 1woh h ALA 144 Cb 1.18 0.02 -0.19 0.00 0.00 0.00 0.00 17.79 18.80 1woh h ALA 144 CO 0.25 0.24 -0.82 -1.01 0.00 0.00 0.00 179.25 177.92 1woh s HIS 145 N -3.17 2.44 0.14 0.00 3.76 -1.26 -2.15 115.29 115.05 1woh s HIS 145 Ca 0.03 -0.31 -0.11 0.00 -0.15 0.00 0.00 55.06 54.52 1woh s HIS 145 Cb 0.07 -1.28 -0.06 0.00 1.11 0.00 0.00 32.58 32.43 1woh s HIS 145 CO 0.74 0.40 1.45 1.25 -0.85 0.00 0.00 174.74 177.74 1woh h LEU 146 N 3.60 1.00 -1.46 0.89 5.85 -1.96 -3.48 115.31 119.76 1woh h LEU 146 Ca -0.49 -0.49 -0.44 0.00 0.84 0.00 0.00 57.88 57.30 1woh h LEU 146 Cb 1.18 -0.28 0.02 0.00 0.37 0.00 0.00 40.66 41.94 1woh h LEU 146 CO 0.45 1.29 -0.80 0.47 -0.34 0.00 0.00 178.44 179.51 1woh n ASP 147 N -4.04 -2.64 -0.68 1.25 8.00 -1.26 -4.89 116.55 112.28 1woh n ASP 147 Ca -0.03 -0.81 0.06 0.00 0.71 0.00 0.00 54.79 54.73 1woh n ASP 147 Cb 0.57 -3.97 0.15 0.00 -0.02 0.00 0.00 41.12 37.85 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 -4.45 0.00 -2.69 1.24 7.35 -1.05 -2.74 117.46 115.11 1woh n PHE 148 Ca -0.16 -1.13 -0.38 0.00 -0.76 0.00 0.00 57.45 55.02 1woh n PHE 148 Cb 0.62 -0.20 -0.06 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 -2.35 4.00 -0.02 -2.13 2.01 -0.25 -4.63 115.64 112.28 1woh s THR 149 Ca 0.34 1.76 -0.03 0.00 0.31 0.00 0.00 61.69 64.07 1woh s THR 149 Cb 0.34 -4.02 -0.02 0.00 0.01 0.00 0.00 72.50 68.81 1woh s THR 149 CO -0.07 0.23 0.31 -0.78 -0.69 0.00 0.00 174.62 173.63 1woh h ASP 150 N 3.38 -0.09 -4.31 3.53 3.58 -1.93 -3.37 116.42 117.22 1woh h ASP 150 Ca -0.47 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 56.44 1woh h ASP 150 Cb 1.20 0.02 -0.27 0.00 1.72 0.00 0.00 39.33 42.00 1woh h ASP 150 CO 0.65 0.04 -0.83 -0.89 -2.88 0.00 0.00 179.24 175.33 1woh s THR 151 N -1.88 1.43 -0.10 2.25 2.01 -1.26 -4.58 115.64 113.52 1woh s THR 151 Ca -0.02 -0.93 -0.07 0.00 0.31 0.00 0.00 61.69 60.98 1woh s THR 151 Cb 0.00 -1.22 0.03 0.00 0.01 0.00 0.00 72.50 71.32 1woh s THR 151 CO 0.05 0.27 0.24 -0.60 -0.69 0.00 0.00 174.62 173.89 1woh s ARG 152 N -0.77 0.25 -1.53 4.92 3.52 -0.85 -4.90 118.95 119.59 1woh s ARG 152 Ca 0.06 0.42 -0.06 0.00 -0.13 0.00 0.00 55.73 56.02 1woh s ARG 152 Cb -0.08 0.03 0.05 0.00 -1.56 0.00 0.00 34.95 33.39 1woh s ARG 152 CO 0.00 -0.09 0.43 0.09 -0.81 0.00 0.00 175.30 174.92 1woh n ASN 153 N 3.49 -0.84 -2.11 -2.12 4.13 -1.26 -1.57 115.26 114.98 1woh n ASN 153 Ca -0.18 -1.08 -0.21 0.00 1.68 0.00 0.00 54.58 54.80 1woh n ASN 153 Cb 0.56 -2.60 -0.04 0.00 -1.54 0.00 0.00 39.78 36.17 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 -2.86 -5.75 -3.98 6.41 8.00 -1.26 -4.99 116.55 112.12 1woh n ASP 154 Ca -0.20 0.15 -0.09 0.00 0.71 0.00 0.00 54.79 55.36 1woh n ASP 154 Cb 0.63 -4.86 -0.10 0.00 -0.02 0.00 0.00 41.12 36.77 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 -2.95 0.15 -0.83 -3.53 -1.32 -0.61 -5.03 115.64 101.52 1woh s THR 155 Ca 0.00 -1.23 0.21 0.00 -1.21 0.00 0.00 61.69 59.47 1woh s THR 155 Cb 0.00 -0.92 -0.23 0.00 -1.51 0.00 0.00 72.50 69.84 1woh s THR 155 CO 0.00 -0.68 0.86 0.29 -2.21 0.00 0.00 174.62 172.89 1woh n LYS 156 N 0.77 0.12 -0.66 7.08 4.76 -1.26 -2.01 118.16 126.96 1woh n LYS 156 Ca -0.19 -0.03 0.06 0.00 -2.87 0.00 0.00 58.31 55.28 1woh n LYS 156 Cb 0.58 -1.51 0.31 0.00 -1.84 0.00 0.00 35.03 32.57 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 -1.64 1.45 -1.28 2.13 7.02 -1.26 -4.79 117.44 119.06 1woh n TRP 157 Ca 0.03 -0.91 -0.29 0.00 -1.02 0.00 0.00 57.50 55.30 1woh n TRP 157 Cb 0.37 -0.42 0.20 0.00 -2.42 0.00 0.00 31.31 29.04 1woh n TRP 157 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 1woh s SER 158 N -1.55 2.09 0.00 -0.99 1.04 -1.26 -4.85 113.70 108.18 1woh s SER 158 Ca 0.47 0.80 0.24 0.00 0.48 0.00 0.00 55.95 57.95 1woh s SER 158 Cb 0.38 -1.20 1.13 0.00 0.10 0.00 0.00 66.02 66.42 1woh s SER 158 CO 0.11 -3.42 1.79 -0.46 0.98 0.00 0.00 173.24 172.24 1woh n ASN 159 N -4.31 0.00 -0.24 7.02 6.94 -1.10 -2.37 115.26 121.20 1woh n ASN 159 Ca 0.10 0.24 0.14 0.00 -0.02 0.00 0.00 54.58 55.04 1woh n ASN 159 Cb 0.59 -0.40 0.60 0.00 -2.36 0.00 0.00 39.78 38.21 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 -1.40 0.83 0.00 0.53 7.64 -1.26 -4.33 113.62 115.63 1woh n SER 160 Ca 0.08 -1.01 0.00 0.00 1.01 0.00 0.00 58.87 58.95 1woh n SER 160 Cb 0.24 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 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 -0.53 1.41 -0.28 6.43 7.64 -1.00 -1.09 113.62 126.21 1woh n SER 161 Ca 0.17 -1.49 0.06 0.00 1.01 0.00 0.00 58.87 58.63 1woh n SER 161 Cb 0.29 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.69 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 0.54 0.00 1.43 0.13 -1.69 -1.29 132.00 131.12 1woh h PRO 162 Ca 0.00 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 65.07 1woh h PRO 162 Cb 0.30 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 31.31 1woh h PRO 162 CO 0.00 0.35 -0.13 0.74 -0.23 0.00 0.00 178.00 178.74 1woh h PHE 163 N 0.55 0.00 -0.03 1.56 -1.00 -1.85 0.06 116.94 116.23 1woh h PHE 163 Ca 0.44 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 61.07 1woh h PHE 163 Cb 0.63 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.20 1woh h PHE 163 CO -0.12 0.13 -0.54 -0.09 -1.61 0.00 0.00 178.31 176.08 1woh h ARG 164 N 0.00 0.42 -0.62 1.51 9.65 -1.51 -1.87 114.38 121.96 1woh h ARG 164 Ca -0.00 -0.41 -0.09 0.00 -1.10 0.00 0.00 59.98 58.38 1woh h ARG 164 Cb 0.90 0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.56 1woh h ARG 164 CO 0.02 1.06 0.05 0.00 2.80 0.00 0.00 179.97 183.91 1woh h ARG 165 N -0.06 1.06 -0.01 0.20 2.47 -1.17 -2.51 114.38 114.35 1woh h ARG 165 Ca -0.06 -0.31 0.00 0.00 -1.26 0.00 0.00 59.98 58.36 1woh h ARG 165 Cb 1.22 -0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 29.43 1woh h ARG 165 CO 0.11 1.01 -0.00 0.00 0.56 0.00 0.00 179.97 181.64 1woh h ALA 166 N 1.01 0.01 -0.82 0.04 0.00 -0.97 -2.03 119.26 116.49 1woh h ALA 166 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1woh h ALA 166 Cb 0.49 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1woh h ALA 166 CO 0.02 -0.50 0.44 0.00 0.00 0.00 0.00 179.25 179.22 1woh h GLU 168 N 1.15 0.00 0.00 0.00 4.11 -1.33 -2.98 114.58 115.53 1woh h GLU 168 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.72 1woh h GLU 168 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1woh h GLU 168 CO -0.04 0.04 -1.31 0.00 0.07 0.00 0.00 179.01 177.77 1woh n ALA 169 N -2.11 3.09 -3.76 1.06 0.00 -0.78 -4.76 120.51 113.24 1woh n ALA 169 Ca 0.01 -0.41 -0.30 0.00 0.00 0.00 0.00 53.44 52.75 1woh n ALA 169 Cb 0.36 -0.93 -0.14 0.00 0.00 0.00 0.00 19.45 18.74 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 -4.40 2.89 0.67 0.00 1.43 0.39 -4.96 118.68 114.70 1woh s LEU 170 Ca -0.01 -2.43 0.44 0.00 -1.03 0.00 0.00 54.13 51.10 1woh s LEU 170 Cb 0.13 -1.10 2.38 0.00 0.03 0.00 0.00 46.19 47.64 1woh s LEU 170 CO 0.83 -0.30 2.34 1.55 0.23 0.00 0.00 176.35 181.01 1woh h PRO 171 N 7.04 0.00 0.00 1.29 0.13 -1.86 -0.37 132.00 138.23 1woh h PRO 171 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1woh h PRO 171 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1woh h PRO 171 CO 0.50 0.00 0.00 -2.95 -0.23 0.00 0.00 178.00 175.32 1woh h ASN 172 N 0.00 0.00 -1.14 1.44 -1.07 -1.89 -3.39 115.58 109.52 1woh h ASN 172 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 56.30 55.79 1woh h ASN 172 Cb 0.05 0.00 -0.10 0.00 -2.07 0.00 0.00 38.32 36.20 1woh h ASN 172 CO 0.00 0.00 1.43 -0.22 0.07 0.00 0.00 177.43 178.71 1woh s LEU 173 N -4.92 3.46 0.11 6.14 0.20 -0.15 -0.59 118.68 122.93 1woh s LEU 173 Ca 0.08 -1.35 0.24 0.00 0.69 0.00 0.00 54.13 53.79 1woh s LEU 173 Cb 0.10 -2.57 0.24 0.00 -0.43 0.00 0.00 46.19 43.54 1woh s LEU 173 CO 0.57 -1.61 1.23 -0.37 -0.29 0.00 0.00 176.35 175.88 1woh h VAL 174 N 6.80 0.00 -2.00 1.68 -1.51 -1.48 -3.47 116.25 116.27 1woh h VAL 174 Ca 0.17 -0.54 -0.05 0.00 -1.23 0.00 0.00 66.70 65.05 1woh h VAL 174 Cb 1.01 1.05 -0.20 0.00 -2.13 0.00 0.00 31.29 31.02 1woh h VAL 174 CO 1.41 0.00 0.16 -2.28 -1.23 0.00 0.00 177.57 175.63 1woh s HIS 175 N -3.20 -0.73 -0.02 5.19 5.65 -1.21 -4.92 115.29 116.05 1woh s HIS 175 Ca 0.05 1.57 0.04 0.00 0.25 0.00 0.00 55.06 56.96 1woh s HIS 175 Cb 0.13 0.33 -0.00 0.00 -1.18 0.00 0.00 32.58 31.86 1woh s HIS 175 CO 0.75 -0.48 -0.13 0.42 -0.65 0.00 0.00 174.74 174.65 1woh s ILE 176 N -0.32 1.03 -0.23 0.89 1.01 -1.26 -1.16 121.20 121.15 1woh s ILE 176 Ca -0.05 -0.52 0.02 0.00 0.00 0.00 0.00 60.65 60.09 1woh s ILE 176 Cb -0.03 -0.88 0.04 0.00 0.01 0.00 0.00 42.46 41.60 1woh s ILE 176 CO 0.05 0.30 -0.13 -0.89 0.00 0.00 0.00 174.94 174.27 1woh s THR 177 N -0.05 2.26 -0.19 2.92 2.01 0.12 -0.67 115.64 122.03 1woh s THR 177 Ca 0.00 -1.32 -0.05 0.00 0.31 0.00 0.00 61.69 60.62 1woh s THR 177 Cb -0.08 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 1woh s THR 177 CO 0.00 0.18 0.01 -0.89 -0.69 0.00 0.00 174.62 173.23 1woh s THR 178 N 1.20 4.13 -0.05 -0.82 2.01 0.31 -0.49 115.64 121.93 1woh s THR 178 Ca -0.03 -0.26 0.04 0.00 0.31 0.00 0.00 61.69 61.75 1woh s THR 178 Cb -0.17 -2.86 -0.00 0.00 0.01 0.00 0.00 72.50 69.48 1woh s THR 178 CO -0.07 0.44 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.45 1woh s VAL 179 N 0.77 1.34 0.00 3.82 1.01 0.32 0.12 120.40 127.78 1woh s VAL 179 Ca 0.01 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1woh s VAL 179 Cb -0.14 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.07 1woh s VAL 179 CO 0.02 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.12 1woh n GLY 180 N 3.27 0.79 3.69 4.51 0.00 -0.47 -1.75 105.19 115.22 1woh n GLY 180 Ca -0.19 0.00 -0.44 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 3.35 -3.63 0.99 4.77 -0.98 -4.09 117.00 117.41 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 -1.46 -0.01 0.00 -2.33 0.00 0.00 43.42 39.62 1woh n LEU 181 CO 0.00 -0.46 0.81 0.00 -1.33 0.00 0.00 177.39 176.41 1woh s ARG 182 N -1.01 0.81 0.00 3.23 1.70 -0.91 -0.87 118.95 121.89 1woh s ARG 182 Ca 0.63 -0.39 0.00 0.00 -0.47 0.00 0.00 55.73 55.50 1woh s ARG 182 Cb -0.61 0.31 0.00 0.00 -0.57 0.00 0.00 34.95 34.09 1woh s ARG 182 CO 0.55 -0.36 0.00 0.41 -1.08 0.00 0.00 175.30 174.81 1woh n GLY 183 N -0.35 3.74 0.16 3.88 0.00 -1.26 -4.72 105.19 106.64 1woh n GLY 183 Ca -0.06 -1.78 0.03 0.00 0.00 0.00 0.00 46.02 44.21 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 -8.44 0.99 3.38 -2.02 -3.44 115.31 105.77 1woh h LEU 184 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 1woh h LEU 184 Cb 0.00 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.43 1woh h LEU 184 CO 0.00 0.47 -0.88 -0.60 0.09 0.00 0.00 178.44 177.52 1woh s ARG 185 N -3.32 2.64 0.02 1.13 3.52 -1.26 -5.11 118.95 116.57 1woh s ARG 185 Ca 0.01 -0.89 0.01 0.00 -0.13 0.00 0.00 55.73 54.74 1woh s ARG 185 Cb 0.10 -2.17 -0.02 0.00 -1.56 0.00 0.00 34.95 31.30 1woh s ARG 185 CO 0.72 0.33 -0.05 -0.06 -0.81 0.00 0.00 175.30 175.42 1woh s PHE 186 N -0.04 0.46 -0.57 5.12 0.40 -1.26 -5.06 117.98 117.03 1woh s PHE 186 Ca -0.07 -0.37 -0.28 0.00 -0.60 0.00 0.00 56.93 55.61 1woh s PHE 186 Cb -0.15 -0.29 0.03 0.00 0.51 0.00 0.00 43.02 43.12 1woh s PHE 186 CO 0.05 -0.08 1.23 0.34 0.70 0.00 0.00 175.22 177.46 1woh s ASP 187 N -1.08 6.40 0.40 1.36 -1.08 -1.26 -4.90 116.67 116.50 1woh s ASP 187 Ca -0.08 0.16 0.11 0.00 -0.52 0.00 0.00 52.55 52.22 1woh s ASP 187 Cb -0.07 -2.55 0.92 0.00 -1.46 0.00 0.00 42.92 39.76 1woh s ASP 187 CO -0.00 -1.51 1.93 1.55 0.52 0.00 0.00 175.17 177.66 1woh h PRO 188 N 9.80 0.54 -0.42 4.34 0.13 -1.99 -0.76 132.00 143.63 1woh h PRO 188 Ca -0.25 -0.03 -0.14 0.00 -0.87 0.00 0.00 66.00 64.70 1woh h PRO 188 Cb 1.06 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 1woh h PRO 188 CO 1.18 0.35 -0.29 1.49 -0.23 0.00 0.00 178.00 180.51 1woh h GLU 189 N 0.55 0.94 -0.26 0.86 4.22 -1.99 -1.39 114.58 117.52 1woh h GLU 189 Ca 0.35 -0.45 -0.05 0.00 0.08 0.00 0.00 59.36 59.29 1woh h GLU 189 Cb 0.60 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1woh h GLU 189 CO -0.12 1.11 -0.02 0.00 -2.18 0.00 0.00 179.01 177.80 1woh h ALA 190 N 0.81 0.35 -0.34 2.92 0.00 -1.55 0.15 119.26 121.60 1woh h ALA 190 Ca 0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1woh h ALA 190 Cb 0.87 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1woh h ALA 190 CO 0.08 0.12 0.14 0.28 0.00 0.00 0.00 179.25 179.86 1woh h VAL 191 N 0.24 1.18 -0.58 0.00 2.07 -1.16 -0.66 116.25 117.35 1woh h VAL 191 Ca 0.07 -0.56 -0.08 0.00 0.82 0.00 0.00 66.70 66.95 1woh h VAL 191 Cb 0.46 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1woh h VAL 191 CO 0.02 0.20 0.03 0.00 0.02 0.00 0.00 177.57 177.83 1woh h ALA 192 N 0.99 0.95 -0.46 1.67 0.00 -1.21 -0.91 119.26 120.29 1woh h ALA 192 Ca 0.11 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1woh h ALA 192 Cb 0.18 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1woh h ALA 192 CO -0.01 0.64 -0.04 0.00 0.00 0.00 0.00 179.25 179.84 1woh h ALA 193 N 1.11 0.62 -0.48 0.00 0.00 -0.80 0.43 119.26 120.13 1woh h ALA 193 Ca 0.17 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1woh h ALA 193 Cb 0.49 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1woh h ALA 193 CO 0.02 0.45 0.21 0.00 0.00 0.00 0.00 179.25 179.93 1woh h ALA 194 N 0.90 0.62 -0.60 0.00 0.00 -0.89 -1.83 119.26 117.46 1woh h ALA 194 Ca 0.12 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1woh h ALA 194 Cb 0.55 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1woh h ALA 194 CO 0.03 0.21 0.07 0.00 0.00 0.00 0.00 179.25 179.57 1woh h ARG 195 N 0.63 1.02 0.00 0.00 3.08 -1.01 -0.74 114.38 117.36 1woh h ARG 195 Ca 0.16 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1woh h ARG 195 Cb 0.16 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 1woh h ARG 195 CO -0.02 0.97 -0.04 0.00 -1.07 0.00 0.00 179.97 179.82 1woh h ALA 196 N 1.01 1.06 -0.02 0.04 0.00 -0.66 -0.93 119.26 119.76 1woh h ALA 196 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1woh h ALA 196 Cb 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1woh h ALA 196 CO 0.02 0.05 -0.02 0.54 0.00 0.00 0.00 179.25 179.83 1woh n ARG 197 N -3.22 1.63 -0.60 0.00 1.74 -0.71 -4.93 116.66 110.57 1woh n ARG 197 Ca -0.01 -0.98 0.00 0.00 -0.77 0.00 0.00 57.85 56.09 1woh n ARG 197 Cb 0.22 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 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 1.20 0.77 3.72 -0.13 0.00 -0.35 -4.96 105.19 105.43 1woh n GLY 198 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.83 2.02 -0.23 1.61 3.76 -0.32 -4.87 115.29 114.42 1woh s HIS 199 Ca 0.00 1.59 -0.08 0.00 -0.15 0.00 0.00 55.06 56.42 1woh s HIS 199 Cb 0.00 -3.51 -0.04 0.00 1.11 0.00 0.00 32.58 30.14 1woh s HIS 199 CO 0.00 -2.70 0.09 0.99 -0.85 0.00 0.00 174.74 172.27 1woh s THR 200 N -1.90 4.60 -0.27 1.30 2.01 0.15 -4.56 115.64 116.97 1woh s THR 200 Ca 0.76 -0.08 -0.05 0.00 0.31 0.00 0.00 61.69 62.62 1woh s THR 200 Cb -0.31 -3.13 0.01 0.00 0.01 0.00 0.00 72.50 69.08 1woh s THR 200 CO 0.45 0.36 0.03 -0.63 -0.69 0.00 0.00 174.62 174.13 1woh s ILE 201 N 1.29 3.66 -0.40 1.82 1.01 -1.26 -0.53 121.20 126.79 1woh s ILE 201 Ca 0.05 -0.68 0.02 0.00 0.00 0.00 0.00 60.65 60.04 1woh s ILE 201 Cb -0.15 -2.83 0.11 0.00 0.01 0.00 0.00 42.46 39.61 1woh s ILE 201 CO 0.04 0.19 0.15 -0.63 0.00 0.00 0.00 174.94 174.69 1woh s ILE 202 N 1.47 2.71 0.74 2.92 1.01 0.12 -4.98 121.20 125.18 1woh s ILE 202 Ca 0.03 -2.42 -0.15 0.00 0.00 0.00 0.00 60.65 58.10 1woh s ILE 202 Cb -0.16 -2.92 0.04 0.00 0.01 0.00 0.00 42.46 39.43 1woh s ILE 202 CO 0.00 -0.67 1.25 -2.65 0.00 0.00 0.00 174.94 172.87 1woh n PRO 203 N 4.16 0.59 -0.02 2.79 -0.02 -1.26 -1.36 135.00 139.87 1woh n PRO 203 Ca 0.03 0.27 0.07 0.00 -2.02 0.00 0.00 63.50 61.84 1woh n PRO 203 Cb 0.40 -2.48 0.46 0.00 -0.02 0.00 0.00 33.50 31.85 1woh n PRO 203 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1woh h MET 204 N -0.28 0.48 -0.50 -0.52 1.85 -1.15 -1.57 114.93 113.24 1woh h MET 204 Ca -0.48 -0.03 0.09 0.00 -0.61 0.00 0.00 59.70 58.67 1woh h MET 204 Cb 1.32 -0.11 -0.03 0.00 0.43 0.00 0.00 31.60 33.21 1woh h MET 204 CO 0.49 0.32 0.34 -0.44 -0.40 0.00 0.00 176.91 177.22 1woh h ASP 205 N 0.49 0.26 -0.01 1.39 3.32 -1.90 -0.70 116.42 119.27 1woh h ASP 205 Ca 0.19 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.06 1woh h ASP 205 Cb 0.15 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1woh h ASP 205 CO -0.05 0.16 -0.65 0.44 -1.72 0.00 0.00 179.24 177.43 1woh h ASP 206 N 0.30 0.72 -0.55 6.45 3.32 -1.63 -0.43 116.42 124.60 1woh h ASP 206 Ca 0.23 -0.43 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 1woh h ASP 206 Cb 0.52 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1woh h ASP 206 CO -0.05 1.18 0.30 0.58 -1.72 0.00 0.00 179.24 179.53 1woh h VAL 207 N 0.46 1.18 -0.28 -1.35 2.07 -1.14 0.83 116.25 118.03 1woh h VAL 207 Ca -0.02 -0.47 -0.05 0.00 0.82 0.00 0.00 66.70 66.98 1woh h VAL 207 Cb 1.23 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1woh h VAL 207 CO 0.13 0.20 -0.04 0.74 0.02 0.00 0.00 177.57 178.61 1woh h THR 208 N 0.74 1.27 -0.62 2.57 2.02 -1.16 -2.87 112.91 114.86 1woh h THR 208 Ca 0.19 -1.02 -0.09 0.00 0.77 0.00 0.00 66.41 66.26 1woh h THR 208 Cb 0.05 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 1woh h THR 208 CO -0.03 0.32 0.03 0.00 0.37 0.00 0.00 175.52 176.22 1woh h ALA 209 N 0.79 0.88 -0.88 6.16 0.00 -0.84 -3.42 119.26 121.95 1woh h ALA 209 Ca 0.07 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1woh h ALA 209 Cb 0.50 -0.23 -0.18 0.00 0.00 0.00 0.00 17.79 17.87 1woh h ALA 209 CO 0.02 0.67 -0.41 0.34 0.00 0.00 0.00 179.25 179.87 1woh s ASP 210 N -6.56 -1.34 0.28 0.00 2.15 0.27 -5.02 116.67 106.45 1woh s ASP 210 Ca -0.12 -0.92 -0.02 0.00 0.43 0.00 0.00 52.55 51.93 1woh s ASP 210 Cb 0.14 1.72 0.43 0.00 -0.30 0.00 0.00 42.92 44.91 1woh s ASP 210 CO 0.85 -0.12 1.92 0.25 -0.17 0.00 0.00 175.17 177.91 1woh h LEU 211 N 6.26 1.00 -0.31 -1.34 7.12 -1.66 -2.20 115.31 124.17 1woh h LEU 211 Ca 0.04 -0.01 0.04 0.00 0.13 0.00 0.00 57.88 58.08 1woh h LEU 211 Cb 1.17 -0.23 -0.04 0.00 -0.53 0.00 0.00 40.66 41.03 1woh h LEU 211 CO 0.05 0.68 0.08 0.00 -0.13 0.00 0.00 178.44 179.12 1woh h ALA 212 N 1.46 0.34 -0.09 1.25 0.00 -1.93 -0.32 119.26 119.97 1woh h ALA 212 Ca 0.37 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 1woh h ALA 212 Cb 0.03 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1woh h ALA 212 CO -0.12 -0.32 0.04 0.78 0.00 0.00 0.00 179.25 179.62 1woh h GLY 213 N 0.20 0.13 0.56 0.00 0.00 -1.79 -1.68 103.07 100.49 1woh h GLY 213 Ca 0.14 -0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.38 1woh h GLY 213 CO -0.17 0.05 -0.14 -2.08 0.00 0.00 0.00 176.54 174.19 1woh h VAL 214 N 0.12 1.44 -0.05 4.60 2.07 -0.75 -3.09 116.25 120.59 1woh h VAL 214 Ca 0.03 -1.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.04 1woh h VAL 214 Cb 0.02 2.30 -0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1woh h VAL 214 CO -0.00 0.42 0.03 -0.07 0.02 0.00 0.00 177.57 177.96 1woh h LEU 215 N -0.33 0.06 -0.86 2.57 3.38 -0.70 0.47 115.31 119.89 1woh h LEU 215 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1woh h LEU 215 Cb 0.75 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1woh h LEU 215 CO 0.03 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.61 1woh h ALA 216 N 1.96 1.00 0.00 1.53 0.00 -1.24 -2.60 119.26 119.91 1woh h ALA 216 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1woh h ALA 216 Cb -0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1woh h ALA 216 CO -0.00 0.00 -0.64 1.04 0.00 0.00 0.00 179.25 179.65 1woh n GLN 217 N -2.46 0.07 -1.66 0.00 6.02 0.15 -4.94 117.38 114.55 1woh n GLN 217 Ca 0.02 0.01 -0.33 0.00 -0.01 0.00 0.00 57.00 56.68 1woh n GLN 217 Cb 0.26 -1.53 0.06 0.00 1.02 0.00 0.00 30.24 30.05 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 -3.26 3.36 0.79 1.08 1.43 -0.98 -5.00 118.68 116.11 1woh s LEU 218 Ca 0.09 2.08 -0.13 0.00 -1.03 0.00 0.00 54.13 55.15 1woh s LEU 218 Cb 0.16 -4.56 0.08 0.00 0.03 0.00 0.00 46.19 41.90 1woh s LEU 218 CO 0.73 -1.80 1.16 -2.16 0.23 0.00 0.00 176.35 174.51 1woh s PRO 219 N -4.06 1.82 -0.02 1.29 0.04 -1.26 -5.06 135.00 127.74 1woh s PRO 219 Ca 0.69 1.57 0.00 0.00 0.04 0.00 0.00 61.00 63.30 1woh s PRO 219 Cb -0.22 -1.82 0.03 0.00 0.04 0.00 0.00 34.50 32.53 1woh s PRO 219 CO 0.43 -2.04 0.01 1.03 0.04 0.00 0.00 177.00 176.47 1woh s ARG 220 N -4.33 0.13 -1.41 4.56 0.52 -1.26 -4.78 118.95 112.38 1woh s ARG 220 Ca 0.69 0.11 0.00 0.00 -0.52 0.00 0.00 55.73 56.01 1woh s ARG 220 Cb -0.24 -0.34 0.00 0.00 0.52 0.00 0.00 34.95 34.88 1woh s ARG 220 CO 0.51 -0.13 0.00 0.41 0.02 0.00 0.00 175.30 176.11 1woh n GLY 221 N 4.05 1.15 3.90 -3.53 0.00 0.14 -5.00 105.19 105.91 1woh n GLY 221 Ca -0.26 -0.37 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 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 -3.43 2.66 -0.34 1.61 -1.52 -1.26 -4.85 119.66 112.53 1woh s GLN 222 Ca 0.00 -1.40 -0.20 0.00 -1.95 0.00 0.00 55.36 51.81 1woh s GLN 222 Cb 0.00 -2.50 -0.00 0.00 -0.22 0.00 0.00 33.01 30.29 1woh s GLN 222 CO 0.00 -0.14 0.60 -0.80 -0.25 0.00 0.00 175.29 174.70 1woh s ASN 223 N -4.15 6.41 -0.06 5.90 0.01 -1.26 -0.57 114.94 121.22 1woh s ASN 223 Ca 0.48 0.18 0.04 0.00 -0.71 0.00 0.00 52.86 52.85 1woh s ASN 223 Cb -0.05 -2.31 -0.02 0.00 0.41 0.00 0.00 41.25 39.28 1woh s ASN 223 CO 0.29 -0.52 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.48 1woh s VAL 224 N 2.58 2.62 -0.15 1.60 1.01 0.57 -1.06 120.40 127.58 1woh s VAL 224 Ca 0.23 -0.87 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 1woh s VAL 224 Cb -0.15 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 1woh s VAL 224 CO 0.13 0.57 -0.08 -0.47 0.00 0.00 0.00 175.10 175.26 1woh s TYR 225 N -0.35 2.92 -0.20 5.22 5.04 -0.18 -0.53 117.35 129.27 1woh s TYR 225 Ca 0.03 -0.52 -0.13 0.00 -2.44 0.00 0.00 57.07 54.00 1woh s TYR 225 Cb -0.12 -1.93 -0.04 0.00 0.35 0.00 0.00 41.96 40.22 1woh s TYR 225 CO 0.02 -0.17 0.28 -0.06 -1.34 0.00 0.00 175.55 174.29 1woh s PHE 226 N 0.48 3.39 -0.23 4.97 2.99 -0.35 -1.18 117.98 128.06 1woh s PHE 226 Ca -0.06 0.49 0.02 0.00 0.00 0.00 0.00 56.93 57.38 1woh s PHE 226 Cb -0.15 -2.37 0.04 0.00 0.00 0.00 0.00 43.02 40.54 1woh s PHE 226 CO 0.03 0.11 -0.14 0.45 -0.00 0.00 0.00 175.22 175.67 1woh s SER 227 N 0.81 3.93 -0.34 1.36 0.15 -0.38 -0.73 113.70 118.49 1woh s SER 227 Ca 0.15 -1.10 -0.06 0.00 0.70 0.00 0.00 55.95 55.64 1woh s SER 227 Cb -0.14 -1.52 0.05 0.00 -1.71 0.00 0.00 66.02 62.70 1woh s SER 227 CO 0.05 -0.11 0.11 -0.69 1.20 0.00 0.00 173.24 173.79 1woh s VAL 228 N 1.18 3.64 -0.25 4.45 1.01 -0.03 -1.22 120.40 129.17 1woh s VAL 228 Ca -0.03 -1.27 -0.17 0.00 0.00 0.00 0.00 61.98 60.50 1woh s VAL 228 Cb -0.17 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 1woh s VAL 228 CO -0.08 -0.23 0.49 -0.62 0.00 0.00 0.00 175.10 174.65 1woh s ASP 229 N 1.48 6.42 0.66 3.32 -1.08 -0.53 -0.93 116.67 126.01 1woh s ASP 229 Ca -0.01 0.50 0.42 0.00 -0.52 0.00 0.00 52.55 52.93 1woh s ASP 229 Cb -0.20 -2.27 2.29 0.00 -1.46 0.00 0.00 42.92 41.28 1woh s ASP 229 CO 0.01 -0.25 2.31 -0.37 0.52 0.00 0.00 175.17 177.39 1woh h VAL 230 N 5.35 0.05 0.00 1.11 -1.51 -1.67 -0.71 116.25 118.87 1woh h VAL 230 Ca -0.30 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 1woh h VAL 230 Cb 1.15 0.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.26 1woh h VAL 230 CO 0.71 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 176.15 1woh n ASP 231 N -3.13 0.00 0.20 4.19 5.68 -1.26 -1.47 116.55 120.76 1woh n ASP 231 Ca -0.03 -0.32 0.05 0.00 -0.50 0.00 0.00 54.79 54.00 1woh n ASP 231 Cb 0.11 -0.16 0.42 0.00 -1.14 0.00 0.00 41.12 40.35 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 3.46 0.00 -2.12 6.12 0.00 -1.39 -3.36 103.07 105.78 1woh h GLY 232 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.87 1woh h GLY 232 CO 0.00 0.00 0.30 -1.36 0.00 0.00 0.00 176.54 175.48 1woh s PHE 233 N -3.97 3.36 0.31 5.60 0.40 -0.54 -1.88 117.98 121.25 1woh s PHE 233 Ca -0.02 1.49 -0.29 0.00 -0.60 0.00 0.00 56.93 57.51 1woh s PHE 233 Cb 0.13 -2.77 -0.12 0.00 0.51 0.00 0.00 43.02 40.77 1woh s PHE 233 CO 0.69 -0.14 1.45 -3.47 0.70 0.00 0.00 175.22 174.44 1woh n ASP 234 N -0.85 3.31 0.31 1.36 -0.08 0.16 -4.57 116.55 116.19 1woh n ASP 234 Ca 0.06 1.18 0.19 0.00 -1.51 0.00 0.00 54.79 54.71 1woh n ASP 234 Cb 0.54 -1.53 1.03 0.00 2.34 0.00 0.00 41.12 43.49 1woh n ASP 234 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1woh h PRO 235 N 3.69 0.00 -0.08 -0.67 0.11 -1.77 -0.59 132.00 132.68 1woh h PRO 235 Ca -0.47 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 1woh h PRO 235 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1woh h PRO 235 CO 0.71 0.02 -0.50 0.00 -0.21 0.00 0.00 178.00 178.02 1woh h ALA 236 N 1.98 1.01 0.00 -0.75 0.00 -1.95 -2.11 119.26 117.44 1woh h ALA 236 Ca -0.00 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 1woh h ALA 236 Cb 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1woh h ALA 236 CO 0.00 0.65 -0.38 0.28 0.00 0.00 0.00 179.25 179.81 1woh h VAL 237 N 0.17 1.11 -3.09 0.00 2.07 -1.54 -3.42 116.25 111.56 1woh h VAL 237 Ca 0.01 -1.96 -0.62 0.00 0.82 0.00 0.00 66.70 64.95 1woh h VAL 237 Cb 0.94 2.22 -0.42 0.00 -1.52 0.00 0.00 31.29 32.52 1woh h VAL 237 CO 0.08 0.38 -0.60 -0.63 0.02 0.00 0.00 177.57 176.81 1woh s ILE 238 N -2.15 2.70 -0.37 4.57 -1.09 -0.37 -4.62 121.20 119.87 1woh s ILE 238 Ca -0.18 -4.04 0.27 0.00 -2.23 0.00 0.00 60.65 54.47 1woh s ILE 238 Cb 0.00 -2.79 0.32 0.00 -1.58 0.00 0.00 42.46 38.42 1woh s ILE 238 CO 0.51 -0.99 1.77 1.55 -1.23 0.00 0.00 174.94 176.55 1woh h PRO 239 N 5.58 0.00 -4.92 2.79 0.13 -1.63 -3.40 132.00 130.55 1woh h PRO 239 Ca 0.12 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.62 1woh h PRO 239 Cb 0.78 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.88 1woh h PRO 239 CO 0.69 0.00 2.33 0.41 -0.23 0.00 0.00 178.00 181.20 1woh n GLY 240 N 0.66 2.89 3.44 1.56 0.00 -1.26 -4.79 105.19 107.69 1woh n GLY 240 Ca 0.03 -1.33 -0.17 0.00 0.00 0.00 0.00 46.02 44.55 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 5.25 0.02 0.11 2.61 -1.32 -1.26 0.01 115.64 121.05 1woh s THR 241 Ca 0.55 -0.13 -0.26 0.00 -1.21 0.00 0.00 61.69 60.64 1woh s THR 241 Cb 0.08 -0.90 -0.08 0.00 -1.51 0.00 0.00 72.50 70.10 1woh s THR 241 CO 0.04 -0.07 1.65 -1.28 -2.21 0.00 0.00 174.62 172.75 1woh h SER 242 N 3.22 -0.63 -2.84 8.08 0.87 -1.78 -3.38 113.55 117.10 1woh h SER 242 Ca -0.28 0.08 -0.61 0.00 -1.23 0.00 0.00 61.79 59.75 1woh h SER 242 Cb 1.15 0.24 -0.41 0.00 -0.44 0.00 0.00 62.40 62.94 1woh h SER 242 CO 0.39 -0.30 -0.64 -1.20 -0.53 0.00 0.00 176.83 174.55 1woh n SER 243 N -5.34 2.57 -4.77 6.23 7.64 -1.26 -4.49 113.62 114.20 1woh n SER 243 Ca -0.06 -3.12 -0.36 0.00 1.01 0.00 0.00 58.87 56.35 1woh n SER 243 Cb 0.26 -0.72 0.01 0.00 -1.01 0.00 0.00 64.21 62.75 1woh n SER 243 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1woh s PRO 244 N -1.39 3.27 -0.05 1.43 0.04 -1.26 -4.99 135.00 132.05 1woh s PRO 244 Ca 0.28 1.74 0.01 0.00 0.04 0.00 0.00 61.00 63.07 1woh s PRO 244 Cb 0.00 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.51 1woh s PRO 244 CO -0.15 -0.94 -0.06 -2.00 0.04 0.00 0.00 177.00 173.88 1woh s GLU 245 N -3.19 1.07 0.94 4.56 2.56 -1.26 -5.09 118.70 118.29 1woh s GLU 245 Ca 0.73 -0.18 -0.11 0.00 0.00 0.00 0.00 54.97 55.41 1woh s GLU 245 Cb -0.28 -1.02 0.16 0.00 2.00 0.00 0.00 34.13 34.99 1woh s GLU 245 CO 0.31 -0.07 1.11 -1.25 -0.56 0.00 0.00 175.26 174.80 1woh s PRO 246 N 0.92 0.84 -0.87 4.30 0.04 -1.26 -4.34 135.00 134.64 1woh s PRO 246 Ca -0.11 1.28 -0.04 0.00 0.04 0.00 0.00 61.00 62.18 1woh s PRO 246 Cb -0.15 -1.73 -0.02 0.00 0.04 0.00 0.00 34.50 32.65 1woh s PRO 246 CO 0.01 -2.66 0.75 -0.25 0.04 0.00 0.00 177.00 174.88 1woh n ASP 247 N -4.23 -6.85 -0.86 6.66 8.00 -1.26 -4.93 116.55 113.08 1woh n ASP 247 Ca 0.09 -0.45 0.00 0.00 0.71 0.00 0.00 54.79 55.14 1woh n ASP 247 Cb 0.53 -4.57 0.00 0.00 -0.02 0.00 0.00 41.12 37.06 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 -1.63 4.36 3.76 0.44 0.00 -1.26 -4.94 105.19 105.93 1woh n GLY 248 Ca -0.07 -2.09 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 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 4.48 0.73 0.99 1.43 -0.79 -4.16 118.68 121.37 1woh s LEU 249 Ca 0.00 2.50 -0.10 0.00 -1.03 0.00 0.00 54.13 55.50 1woh s LEU 249 Cb 0.00 -3.64 0.05 0.00 0.03 0.00 0.00 46.19 42.63 1woh s LEU 249 CO 0.00 -0.37 1.09 0.42 0.23 0.00 0.00 176.35 177.72 1woh s THR 250 N -1.10 2.62 0.19 5.49 -4.23 -1.26 -0.66 115.64 116.69 1woh s THR 250 Ca 0.47 0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 60.92 1woh s THR 250 Cb -0.36 -3.17 0.11 0.00 1.34 0.00 0.00 72.50 70.42 1woh s THR 250 CO 0.47 -0.21 1.84 0.22 -0.54 0.00 0.00 174.62 176.40 1woh h TYR 251 N -0.75 0.74 -0.81 3.99 3.20 -1.97 -2.15 116.97 119.22 1woh h TYR 251 Ca -0.45 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.46 1woh h TYR 251 Cb 1.30 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 39.28 1woh h TYR 251 CO 0.38 0.44 0.52 0.00 -1.64 0.00 0.00 178.16 177.86 1woh h ALA 252 N 1.26 1.05 -0.23 1.82 0.00 -1.98 -0.72 119.26 120.45 1woh h ALA 252 Ca 0.25 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1woh h ALA 252 Cb -0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1woh h ALA 252 CO -0.09 0.37 -0.02 1.96 0.00 0.00 0.00 179.25 181.47 1woh h GLN 253 N 1.03 0.43 -0.70 0.00 4.20 -1.84 -0.07 115.11 118.16 1woh h GLN 253 Ca 0.31 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.88 1woh h GLN 253 Cb -0.03 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 1woh h GLN 253 CO -0.10 0.63 0.46 0.78 -0.67 0.00 0.00 178.83 179.93 1woh h GLY 254 N 0.18 0.98 1.38 3.46 0.00 -1.19 -1.84 103.07 106.05 1woh h GLY 254 Ca 0.06 -0.37 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 1woh h GLY 254 CO 0.02 0.36 -0.07 1.98 0.00 0.00 0.00 176.54 178.83 1woh h MET 255 N 0.95 0.74 -0.56 4.80 1.85 -0.99 -1.79 114.93 119.93 1woh h MET 255 Ca 0.26 -0.22 -0.08 0.00 -0.61 0.00 0.00 59.70 59.04 1woh h MET 255 Cb -0.11 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 31.83 1woh h MET 255 CO -0.05 0.80 0.02 0.87 -0.40 0.00 0.00 176.91 178.15 1woh h LYS 256 N 0.68 0.94 -0.03 0.39 1.57 -0.57 0.11 116.57 119.65 1woh h LYS 256 Ca 0.12 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1woh h LYS 256 Cb 0.53 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 1woh h LYS 256 CO 0.03 0.91 0.01 0.82 -0.57 0.00 0.00 179.45 180.65 1woh h ILE 257 N 0.87 1.17 -0.58 1.86 2.04 -1.03 -0.98 117.51 120.86 1woh h ILE 257 Ca 0.17 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.49 1woh h ILE 257 Cb 0.48 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 1woh h ILE 257 CO 0.02 0.14 0.19 -0.07 0.00 0.00 0.00 178.15 178.43 1woh h LEU 258 N -0.14 0.83 -0.65 1.44 3.38 -1.20 -2.16 115.31 116.81 1woh h LEU 258 Ca 0.01 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1woh h LEU 258 Cb 0.21 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1woh h LEU 258 CO -0.00 0.80 0.41 0.00 0.09 0.00 0.00 178.44 179.74 1woh h ALA 259 N 1.06 0.82 -0.41 1.53 0.00 -0.69 0.30 119.26 121.86 1woh h ALA 259 Ca 0.19 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1woh h ALA 259 Cb 0.26 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1woh h ALA 259 CO -0.01 0.28 0.23 0.00 0.00 0.00 0.00 179.25 179.75 1woh h ALA 260 N 1.22 0.53 -0.52 0.00 0.00 -0.99 -1.81 119.26 117.69 1woh h ALA 260 Ca 0.23 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1woh h ALA 260 Cb -0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1woh h ALA 260 CO -0.05 0.05 -0.06 0.00 0.00 0.00 0.00 179.25 179.19 1woh h ALA 261 N 1.09 0.90 0.00 0.00 0.00 -1.06 -2.90 119.26 117.28 1woh h ALA 261 Ca 0.15 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1woh h ALA 261 Cb 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1woh h ALA 261 CO -0.02 0.64 -0.26 0.00 0.00 0.00 0.00 179.25 179.61 1woh h ALA 262 N 1.07 1.36 0.00 0.00 0.00 -0.62 -2.60 119.26 118.47 1woh h ALA 262 Ca 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1woh h ALA 262 Cb 0.59 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1woh h ALA 262 CO 0.04 0.32 -0.08 0.00 0.00 0.00 0.00 179.25 179.52 1woh h ALA 263 N 1.74 0.95 0.00 0.00 0.00 -1.13 -3.35 119.26 117.47 1woh h ALA 263 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1woh h ALA 263 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1woh h ALA 263 CO 0.03 0.10 -0.00 0.09 0.00 0.00 0.00 179.25 179.47 1woh n ASN 264 N -3.12 2.05 -4.10 0.00 3.02 -1.11 -4.96 115.26 107.05 1woh n ASN 264 Ca 0.04 -2.28 -0.11 0.00 -0.03 0.00 0.00 54.58 52.19 1woh n ASN 264 Cb 0.56 -0.12 -0.08 0.00 -0.61 0.00 0.00 39.78 39.53 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 -1.50 0.13 -0.47 6.41 0.01 -1.00 0.29 114.94 118.82 1woh s ASN 265 Ca 0.09 -1.27 -0.17 0.00 -0.71 0.00 0.00 52.86 50.80 1woh s ASN 265 Cb 0.08 0.45 0.06 0.00 0.41 0.00 0.00 41.25 42.24 1woh s ASN 265 CO 0.01 -0.94 0.46 -0.89 -1.51 0.00 0.00 177.10 174.23 1woh s THR 266 N -4.08 5.11 -0.25 1.60 2.01 0.27 -4.85 115.64 115.45 1woh s THR 266 Ca 0.34 -0.76 -0.29 0.00 0.31 0.00 0.00 61.69 61.29 1woh s THR 266 Cb 0.04 -4.15 0.01 0.00 0.01 0.00 0.00 72.50 68.41 1woh s THR 266 CO 0.12 -0.61 1.03 -0.69 -0.69 0.00 0.00 174.62 173.78 1woh s VAL 267 N 2.01 4.66 -0.90 3.82 1.01 -1.26 -0.32 120.40 129.43 1woh s VAL 267 Ca 0.09 1.93 0.21 0.00 0.00 0.00 0.00 61.98 64.21 1woh s VAL 267 Cb -0.21 -4.31 -0.23 0.00 0.00 0.00 0.00 36.38 31.63 1woh s VAL 267 CO 0.09 -0.22 0.89 1.33 0.00 0.00 0.00 175.10 177.19 1woh n VAL 268 N 5.41 0.00 0.00 2.92 0.24 0.31 -4.85 118.33 122.36 1woh n VAL 268 Ca 0.11 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 1woh n VAL 268 Cb 0.46 0.85 0.00 0.00 -1.47 0.00 0.00 33.84 33.68 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 1.47 0.85 3.38 7.63 0.00 -1.25 -4.23 105.19 113.05 1woh n GLY 269 Ca 0.03 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 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 0.12 0.09 0.99 0.20 -0.86 -1.21 118.68 118.01 1woh s LEU 270 Ca 0.00 0.98 0.09 0.00 0.69 0.00 0.00 54.13 55.89 1woh s LEU 270 Cb 0.00 1.67 -0.03 0.00 -0.43 0.00 0.00 46.19 47.40 1woh s LEU 270 CO 0.00 -0.17 -0.23 1.51 -0.29 0.00 0.00 176.35 177.17 1woh s ASP 271 N 0.29 2.79 -0.24 3.68 1.47 0.09 -0.31 116.67 124.43 1woh s ASP 271 Ca -0.00 -0.66 0.01 0.00 1.18 0.00 0.00 52.55 53.08 1woh s ASP 271 Cb -0.04 -0.19 0.06 0.00 -0.34 0.00 0.00 42.92 42.42 1woh s ASP 271 CO 0.00 0.13 -0.05 -0.22 0.68 0.00 0.00 175.17 175.71 1woh s LEU 272 N -1.74 2.74 0.31 2.11 1.98 0.35 -0.85 118.68 123.58 1woh s LEU 272 Ca 0.09 -1.26 0.06 0.00 -2.89 0.00 0.00 54.13 50.13 1woh s LEU 272 Cb -0.10 -1.22 -0.06 0.00 0.66 0.00 0.00 46.19 45.47 1woh s LEU 272 CO 0.04 -0.24 -0.03 0.68 -1.89 0.00 0.00 176.35 174.91 1woh s VAL 273 N 1.35 1.64 -0.40 1.68 -7.23 -0.10 -0.26 120.40 117.08 1woh s VAL 273 Ca -0.05 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 1woh s VAL 273 Cb -0.19 -2.62 0.00 0.00 0.56 0.00 0.00 36.38 34.13 1woh s VAL 273 CO -0.07 -0.18 0.00 -0.62 -0.31 0.00 0.00 175.10 173.92 1woh n GLU 274 N -0.68 -0.98 -2.44 4.82 -0.58 -0.30 -1.88 120.64 118.61 1woh n GLU 274 Ca -0.05 0.48 -0.42 0.00 -0.42 0.00 0.00 57.16 56.76 1woh n GLU 274 Cb 0.65 -4.34 -0.03 0.00 -0.57 0.00 0.00 31.44 27.14 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 -0.86 4.42 -0.47 -4.62 0.20 -1.26 -4.21 118.68 111.87 1woh s LEU 275 Ca 0.00 2.07 0.03 0.00 0.69 0.00 0.00 54.13 56.92 1woh s LEU 275 Cb 0.00 -3.59 0.13 0.00 -0.43 0.00 0.00 46.19 42.30 1woh s LEU 275 CO 0.00 -0.38 0.23 0.00 -0.29 0.00 0.00 176.35 175.91 1woh s ALA 276 N 0.50 2.76 0.44 5.97 0.00 0.10 -3.80 121.76 127.73 1woh s ALA 276 Ca 0.55 -2.90 0.15 0.00 0.00 0.00 0.00 51.96 49.75 1woh s ALA 276 Cb -0.30 -2.02 1.06 0.00 0.00 0.00 0.00 23.12 21.86 1woh s ALA 276 CO 0.32 -2.01 1.99 -1.35 0.00 0.00 0.00 175.76 174.71 1woh h PRO 277 N 6.72 0.36 0.00 0.00 0.11 -1.80 -1.24 132.00 136.14 1woh h PRO 277 Ca -0.05 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1woh h PRO 277 Cb 0.92 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1woh h PRO 277 CO 0.59 0.24 0.00 -2.95 -0.21 0.00 0.00 178.00 175.67 1woh h ASN 278 N 0.37 0.00 -0.40 -2.05 -1.07 -1.93 -2.50 115.58 108.00 1woh h ASN 278 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.64 1woh h ASN 278 Cb 0.56 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.81 1woh h ASN 278 CO -0.07 0.00 0.00 0.18 0.07 0.00 0.00 177.43 177.61 1woh n LEU 279 N -2.37 3.33 -3.49 6.14 4.77 -0.47 -4.67 117.00 120.25 1woh n LEU 279 Ca 0.01 -1.46 -0.29 0.00 -0.03 0.00 0.00 56.01 54.24 1woh n LEU 279 Cb 0.19 -0.26 -0.12 0.00 -2.33 0.00 0.00 43.42 40.90 1woh n LEU 279 CO 0.19 0.73 -0.31 -0.62 -1.33 0.00 0.00 177.39 176.04 1woh s ASP 280 N -1.45 3.00 0.00 -1.43 3.68 -0.94 -4.35 116.67 115.19 1woh s ASP 280 Ca 0.39 -2.26 0.11 0.00 2.13 0.00 0.00 52.55 52.92 1woh s ASP 280 Cb 0.22 -0.47 0.48 0.00 -1.45 0.00 0.00 42.92 41.70 1woh s ASP 280 CO 0.31 -0.30 1.34 -0.81 0.13 0.00 0.00 175.17 175.84 1woh n PRO 281 N 3.95 0.02 0.18 4.34 -0.04 -1.26 -1.74 135.00 140.45 1woh n PRO 281 Ca 0.12 0.29 0.12 0.00 -0.04 0.00 0.00 63.50 64.00 1woh n PRO 281 Cb 0.37 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.54 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 -1.94 -3.47 112.91 109.37 1woh h THR 282 Ca 0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 1woh h THR 282 Cb 0.18 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 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 1.17 0.64 0.20 5.82 0.00 -0.71 -4.88 105.19 107.43 1woh n GLY 283 Ca 0.04 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.12 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 1.88 0.00 0.10 1.61 0.11 -1.92 -2.84 114.38 113.33 1woh h ARG 284 Ca 0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 1woh h ARG 284 Cb 0.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.12 1woh h ARG 284 CO 0.00 0.32 -0.05 0.77 0.10 0.00 0.00 179.97 181.11 1woh h SER 285 N 0.00 -0.11 0.36 0.08 0.02 -1.89 0.04 113.55 112.05 1woh h SER 285 Ca -0.00 -0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 60.80 1woh h SER 285 Cb 0.68 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 1woh h SER 285 CO 0.04 -0.07 -0.59 1.05 -1.14 0.00 0.00 176.83 176.12 1woh h GLU 286 N -0.15 0.24 -0.05 3.45 9.09 -1.93 -1.45 114.58 123.78 1woh h GLU 286 Ca -0.01 -0.16 -0.00 0.00 0.05 0.00 0.00 59.36 59.23 1woh h GLU 286 Cb 0.12 0.02 -0.00 0.00 -1.65 0.00 0.00 28.75 27.24 1woh h GLU 286 CO 0.02 0.76 0.01 -0.07 0.05 0.00 0.00 179.01 179.79 1woh h LEU 287 N 0.18 0.07 -0.65 3.06 3.38 -1.35 -1.11 115.31 118.89 1woh h LEU 287 Ca -0.00 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.66 1woh h LEU 287 Cb 1.09 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1woh h LEU 287 CO 0.09 0.25 -0.04 -0.07 0.09 0.00 0.00 178.44 178.76 1woh h LEU 288 N -0.12 1.00 -0.81 1.67 4.07 -0.97 -2.55 115.31 117.59 1woh h LEU 288 Ca 0.02 -0.30 -0.11 0.00 0.08 0.00 0.00 57.88 57.57 1woh h LEU 288 Cb 0.21 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 1woh h LEU 288 CO -0.00 1.07 -0.54 0.24 -1.08 0.00 0.00 178.44 178.13 1woh h MET 289 N 0.92 0.00 -0.34 1.13 2.86 -1.21 -0.88 114.93 117.40 1woh h MET 289 Ca 0.16 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.64 1woh h MET 289 Cb 0.59 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 1woh h MET 289 CO 0.04 0.54 -0.41 0.00 1.06 0.00 0.00 176.91 178.13 1woh h ALA 290 N 1.46 0.63 -0.60 6.32 0.00 -1.11 -2.51 119.26 123.45 1woh h ALA 290 Ca -0.01 -0.46 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 1woh h ALA 290 Cb 1.04 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1woh h ALA 290 CO 0.07 0.67 0.02 -0.09 0.00 0.00 0.00 179.25 179.93 1woh h ARG 291 N 0.68 1.03 -0.77 0.00 2.43 -1.19 -2.01 114.38 114.56 1woh h ARG 291 Ca 0.05 -0.31 0.04 0.00 -0.81 0.00 0.00 59.98 58.96 1woh h ARG 291 Cb 0.99 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 30.38 1woh h ARG 291 CO 0.10 1.00 0.47 1.25 -1.51 0.00 0.00 179.97 181.27 1woh h LEU 292 N 0.95 0.76 -0.26 3.80 5.85 -0.99 0.48 115.31 125.90 1woh h LEU 292 Ca 0.17 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1woh h LEU 292 Cb 0.52 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1woh h LEU 292 CO 0.03 0.51 0.09 0.58 -0.34 0.00 0.00 178.44 179.31 1woh h VAL 293 N 0.90 1.19 -0.67 1.05 2.07 -1.12 0.93 116.25 120.61 1woh h VAL 293 Ca 0.32 -0.58 -0.08 0.00 0.82 0.00 0.00 66.70 67.18 1woh h VAL 293 Cb 0.09 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 1woh h VAL 293 CO -0.14 0.19 0.09 0.24 0.02 0.00 0.00 177.57 177.97 1woh h MET 294 N 0.27 1.12 -0.33 1.57 2.86 -0.70 -1.39 114.93 118.32 1woh h MET 294 Ca 0.09 -0.31 -0.13 0.00 -2.06 0.00 0.00 59.70 57.29 1woh h MET 294 Cb 0.21 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1woh h MET 294 CO -0.00 1.03 -0.31 1.49 1.06 0.00 0.00 176.91 180.17 1woh h GLU 295 N 1.04 0.72 -0.62 1.72 4.81 0.08 -1.90 114.58 120.43 1woh h GLU 295 Ca 0.20 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1woh h GLU 295 Cb 0.47 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 1woh h GLU 295 CO 0.02 0.94 0.30 1.15 -0.73 0.00 0.00 179.01 180.69 1woh h THR 296 N 0.61 1.22 -0.32 0.32 2.02 -0.50 -1.81 112.91 114.45 1woh h THR 296 Ca 0.07 -0.61 -0.04 0.00 0.77 0.00 0.00 66.41 66.60 1woh h THR 296 Cb 0.83 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1woh h THR 296 CO 0.07 0.25 0.05 -0.07 0.37 0.00 0.00 175.52 176.19 1woh h LEU 297 N 0.86 0.44 -0.32 2.58 3.38 -1.04 0.15 115.31 121.36 1woh h LEU 297 Ca 0.21 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1woh h LEU 297 Cb 0.12 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1woh h LEU 297 CO -0.03 0.47 0.20 0.00 0.09 0.00 0.00 178.44 179.17 1woh h GLU 299 N 0.42 0.55 0.21 0.00 4.39 -0.58 -2.35 114.58 117.23 1woh h GLU 299 Ca 0.12 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.72 1woh h GLU 299 Cb -0.02 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 1woh h GLU 299 CO -0.02 0.55 -0.26 0.28 -1.16 0.00 0.00 179.01 178.39 1woh h VAL 300 N 0.44 0.43 0.00 3.13 2.07 -0.33 -2.29 116.25 119.70 1woh h VAL 300 Ca 0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1woh h VAL 300 Cb 0.21 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 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 -5.38 0.00 0.11 1.57 3.01 -0.27 -2.23 117.46 114.26 1woh n PHE 301 Ca -0.08 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.47 1woh n PHE 301 Cb 0.29 -0.22 0.01 0.00 -0.01 0.00 0.00 39.48 39.55 1woh n PHE 301 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1woh h ASP 302 N 0.00 0.00 0.00 4.37 3.45 -0.85 -3.37 116.42 120.02 1woh h ASP 302 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1woh h ASP 302 Cb 0.14 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.91 1woh h ASP 302 CO 0.00 0.14 -0.09 1.41 -1.57 0.00 0.00 179.24 179.13 1woh n HIS 303 N -2.81 0.00 -2.35 4.55 8.25 -0.96 -5.06 115.22 116.83 1woh n HIS 303 Ca -0.01 -0.68 -0.39 0.00 -0.26 0.00 0.00 57.72 56.39 1woh n HIS 303 Cb 0.61 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.59 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 -1.87 3.27 -2.59 1.59 1.01 -0.95 -4.89 120.40 115.97 1woh s VAL 304 Ca 0.19 1.11 0.21 0.00 0.00 0.00 0.00 61.98 63.48 1woh s VAL 304 Cb 0.16 -3.64 0.16 0.00 0.00 0.00 0.00 36.38 33.07 1woh s VAL 304 CO 0.02 0.13 1.16 0.18 0.00 0.00 0.00 175.10 176.59