#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1odk n PRO 3 N 0.00 0.48 -0.08 -1.46 -0.02 -1.26 -4.93 135.00 127.74 1odk n PRO 3 Ca 0.00 0.21 -0.10 0.00 -2.02 0.00 0.00 63.50 61.60 1odk n PRO 3 Cb 0.00 -2.11 -0.03 0.00 -0.02 0.00 0.00 33.50 31.35 1odk n PRO 3 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1odk h ILE 4 N -0.22 1.13 0.00 4.25 2.04 -1.99 -3.36 117.51 119.36 1odk h ILE 4 Ca -0.47 -0.34 -0.28 0.00 1.00 0.00 0.00 64.86 64.77 1odk h ILE 4 Cb 1.34 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 38.24 1odk h ILE 4 CO 0.46 0.13 -1.81 1.41 0.00 0.00 0.00 178.15 178.34 1odk n HIS 5 N -4.83 0.25 -2.91 1.37 8.25 -1.26 -4.68 115.22 111.41 1odk n HIS 5 Ca -0.02 0.11 -0.44 0.00 -0.26 0.00 0.00 57.72 57.11 1odk n HIS 5 Cb 0.08 -0.88 -0.03 0.00 1.12 0.00 0.00 29.99 30.28 1odk n HIS 5 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1odk s VAL 6 N -2.56 4.62 -1.47 1.59 1.01 -1.26 -4.72 120.40 117.62 1odk s VAL 6 Ca -0.33 -1.27 -0.13 0.00 0.00 0.00 0.00 61.98 60.24 1odk s VAL 6 Cb 0.10 -4.76 0.03 0.00 0.00 0.00 0.00 36.38 31.75 1odk s VAL 6 CO 0.47 -1.50 2.29 0.54 0.00 0.00 0.00 175.10 176.91 1odk n ARG 7 N 6.86 2.97 -4.74 2.72 1.74 -1.26 -4.06 116.66 120.89 1odk n ARG 7 Ca 0.17 -2.60 -0.32 0.00 -0.77 0.00 0.00 57.85 54.33 1odk n ARG 7 Cb 0.48 -3.22 -0.08 0.00 -1.02 0.00 0.00 32.46 28.62 1odk n ARG 7 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1odk s ALA 8 N 2.97 4.01 -0.01 7.54 0.00 -1.26 -4.80 121.76 130.21 1odk s ALA 8 Ca 0.49 -0.46 0.06 0.00 0.00 0.00 0.00 51.96 52.05 1odk s ALA 8 Cb 0.14 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 1odk s ALA 8 CO -0.08 -0.05 -0.18 -1.58 0.00 0.00 0.00 175.76 173.87 1odk s HIS 9 N -2.91 2.57 0.25 0.00 2.46 -1.26 -4.39 115.29 112.01 1odk s HIS 9 Ca 0.07 -0.26 0.09 0.00 0.47 0.00 0.00 55.06 55.44 1odk s HIS 9 Cb 0.02 -1.54 0.78 0.00 -0.13 0.00 0.00 32.58 31.71 1odk s HIS 9 CO 0.04 0.17 1.12 -2.30 -2.47 0.00 0.00 174.74 171.30 1odk n PRO 10 N 2.03 -0.05 0.30 2.88 -0.02 -1.26 0.11 135.00 139.00 1odk n PRO 10 Ca -0.17 1.02 0.19 0.00 -2.02 0.00 0.00 63.50 62.52 1odk n PRO 10 Cb 0.52 -1.74 0.93 0.00 -0.02 0.00 0.00 33.50 33.19 1odk n PRO 10 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1odk h GLY 11 N 0.00 0.00 1.85 -1.23 0.00 -1.96 -3.02 103.07 98.70 1odk h GLY 11 Ca 0.53 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.71 1odk h GLY 11 CO -0.60 0.00 -0.64 -0.55 0.00 0.00 0.00 176.54 174.74 1odk h ASP 12 N 0.00 0.18 -3.11 0.19 3.32 0.47 -3.45 116.42 114.02 1odk h ASP 12 Ca -0.00 -0.11 -0.61 0.00 0.02 0.00 0.00 57.03 56.33 1odk h ASP 12 Cb 0.24 -0.05 -0.09 0.00 0.22 0.00 0.00 39.33 39.65 1odk h ASP 12 CO 0.00 0.77 -0.40 -0.69 -1.72 0.00 0.00 179.24 177.21 1odk s VAL 13 N -3.64 5.35 0.72 -1.35 1.01 -1.14 -4.72 120.40 116.63 1odk s VAL 13 Ca -0.03 0.39 -0.11 0.00 0.00 0.00 0.00 61.98 62.24 1odk s VAL 13 Cb 0.12 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.99 1odk s VAL 13 CO 0.79 0.47 1.09 0.00 0.00 0.00 0.00 175.10 177.46 1odk s ALA 14 N -0.05 2.90 0.31 5.51 0.00 -1.26 -4.80 121.76 124.36 1odk s ALA 14 Ca 0.14 -0.51 0.07 0.00 0.00 0.00 0.00 51.96 51.66 1odk s ALA 14 Cb -0.13 -2.93 0.49 0.00 0.00 0.00 0.00 23.12 20.56 1odk s ALA 14 CO 0.03 -1.26 1.73 0.93 0.00 0.00 0.00 175.76 177.19 1odk h GLU 15 N -0.70 0.26 -5.15 0.00 5.08 -1.84 -3.38 114.58 108.85 1odk h GLU 15 Ca -0.45 -0.11 -0.62 0.00 -1.00 0.00 0.00 59.36 57.18 1odk h GLU 15 Cb 1.28 -0.01 -0.15 0.00 0.50 0.00 0.00 28.75 30.37 1odk h GLU 15 CO 0.64 0.59 -0.52 1.03 -1.00 0.00 0.00 179.01 179.75 1odk s ARG 16 N -4.25 4.06 -0.01 2.33 0.52 -1.26 -0.30 118.95 120.05 1odk s ARG 16 Ca -0.05 -0.28 0.01 0.00 -0.52 0.00 0.00 55.73 54.89 1odk s ARG 16 Cb 0.14 -3.45 0.00 0.00 0.52 0.00 0.00 34.95 32.16 1odk s ARG 16 CO 0.77 0.14 -0.03 0.08 0.02 0.00 0.00 175.30 176.27 1odk s VAL 17 N 0.81 0.30 -0.10 3.52 1.01 0.11 -1.05 120.40 125.00 1odk s VAL 17 Ca 0.07 -0.13 -0.06 0.00 0.00 0.00 0.00 61.98 61.86 1odk s VAL 17 Cb -0.13 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 1odk s VAL 17 CO 0.02 0.10 0.15 -0.76 0.00 0.00 0.00 175.10 174.61 1odk s LEU 18 N 0.09 4.38 -0.72 3.92 1.43 0.56 -0.92 118.68 127.42 1odk s LEU 18 Ca -0.01 0.44 0.04 0.00 -1.03 0.00 0.00 54.13 53.57 1odk s LEU 18 Cb -0.04 -2.19 0.17 0.00 0.03 0.00 0.00 46.19 44.17 1odk s LEU 18 CO -0.00 0.38 0.52 -0.76 0.23 0.00 0.00 176.35 176.71 1odk s LEU 19 N -1.23 4.91 0.60 1.79 1.43 0.47 -0.87 118.68 125.78 1odk s LEU 19 Ca 0.18 -3.78 -0.11 0.00 -1.03 0.00 0.00 54.13 49.38 1odk s LEU 19 Cb -0.12 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 1odk s LEU 19 CO 0.07 -0.11 1.01 -2.16 0.23 0.00 0.00 176.35 175.39 1odk s PRO 20 N -1.37 3.63 -0.02 1.29 0.04 -1.22 -2.49 135.00 134.87 1odk s PRO 20 Ca 0.25 0.73 0.02 0.00 0.04 0.00 0.00 61.00 62.04 1odk s PRO 20 Cb -0.06 -2.11 -0.25 0.00 0.04 0.00 0.00 34.50 32.12 1odk s PRO 20 CO -0.15 -0.52 0.77 0.78 0.04 0.00 0.00 177.00 177.92 1odk h GLY 21 N -0.16 0.17 -6.12 0.56 0.00 -1.83 -1.44 103.07 94.25 1odk h GLY 21 Ca -0.44 -0.43 -0.60 0.00 0.00 0.00 0.00 47.33 45.86 1odk h GLY 21 CO 0.62 0.38 0.13 -0.35 0.00 0.00 0.00 176.54 177.32 1odk s ASP 22 N -6.68 6.65 0.49 0.19 2.15 -1.26 -2.15 116.67 116.06 1odk s ASP 22 Ca -0.09 0.80 0.16 0.00 0.43 0.00 0.00 52.55 53.85 1odk s ASP 22 Cb 0.07 -2.34 1.17 0.00 -0.30 0.00 0.00 42.92 41.52 1odk s ASP 22 CO 0.83 -0.30 2.09 1.55 -0.17 0.00 0.00 175.17 179.17 1odk h PRO 23 N 7.59 0.00 -0.05 4.34 0.13 -1.88 -0.67 132.00 141.46 1odk h PRO 23 Ca -0.30 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.73 1odk h PRO 23 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1odk h PRO 23 CO 0.77 0.07 -0.42 0.78 -0.23 0.00 0.00 178.00 178.97 1odk h GLY 24 N 0.21 0.12 1.37 1.56 0.00 -1.95 -1.87 103.07 102.52 1odk h GLY 24 Ca -0.00 -0.11 -0.25 0.00 0.00 0.00 0.00 47.33 46.97 1odk h GLY 24 CO 0.01 0.10 -0.99 -0.09 0.00 0.00 0.00 176.54 175.57 1odk h ARG 25 N 0.09 0.56 -0.38 4.80 2.43 -1.58 -2.43 114.38 117.87 1odk h ARG 25 Ca 0.01 -0.60 0.02 0.00 -0.81 0.00 0.00 59.98 58.59 1odk h ARG 25 Cb 0.78 0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.48 1odk h ARG 25 CO 0.06 1.22 0.22 0.00 -1.51 0.00 0.00 179.97 179.96 1odk h ALA 26 N 0.57 0.48 -0.41 2.80 0.00 -0.98 0.04 119.26 121.76 1odk h ALA 26 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1odk h ALA 26 Cb 1.63 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 1odk h ALA 26 CO 0.18 -0.12 0.27 1.49 0.00 0.00 0.00 179.25 181.07 1odk h GLU 27 N 0.45 0.54 -0.76 0.00 4.81 -1.35 -1.26 114.58 117.01 1odk h GLU 27 Ca 0.15 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1odk h GLU 27 Cb 0.00 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.23 1odk h GLU 27 CO -0.07 0.37 0.49 2.35 -0.73 0.00 0.00 179.01 181.42 1odk h TRP 28 N 0.55 0.97 -0.08 0.92 7.01 -1.01 -1.50 115.95 122.81 1odk h TRP 28 Ca 0.15 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.16 1odk h TRP 28 Cb -0.05 -0.33 -0.00 0.00 -2.10 0.00 0.00 29.16 26.68 1odk h TRP 28 CO -0.04 0.63 0.03 0.82 -2.79 0.00 0.00 178.44 177.09 1odk h ILE 29 N 1.03 1.15 -0.04 2.65 2.04 -0.67 -0.08 117.51 123.59 1odk h ILE 29 Ca 0.28 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.71 1odk h ILE 29 Cb -0.09 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1odk h ILE 29 CO -0.06 0.13 -0.03 0.00 0.00 0.00 0.00 178.15 178.19 1odk h ALA 30 N 0.87 -0.00 -0.16 1.87 0.00 -1.03 -0.16 119.26 120.65 1odk h ALA 30 Ca 0.03 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1odk h ALA 30 Cb 0.17 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1odk h ALA 30 CO -0.00 -0.52 -0.41 0.87 0.00 0.00 0.00 179.25 179.19 1odk h LYS 31 N -0.04 0.37 0.25 0.00 1.57 -1.27 -1.63 116.57 115.83 1odk h LYS 31 Ca 0.03 -0.18 -0.34 0.00 -1.87 0.00 0.00 60.65 58.29 1odk h LYS 31 Cb 0.08 -0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.43 1odk h LYS 31 CO -0.06 0.72 -1.49 1.15 -0.57 0.00 0.00 179.45 179.20 1odk h THR 32 N 0.31 1.27 0.00 -0.16 2.02 -0.86 -3.41 112.91 112.09 1odk h THR 32 Ca 0.03 -2.70 -0.06 0.00 0.77 0.00 0.00 66.41 64.44 1odk h THR 32 Cb 0.86 3.04 -0.01 0.00 -1.74 0.00 0.00 68.15 70.29 1odk h THR 32 CO 0.07 0.81 -1.70 0.49 0.37 0.00 0.00 175.52 175.56 1odk n PHE 33 N -3.71 0.00 -3.86 3.16 3.01 -0.09 -5.04 117.46 110.94 1odk n PHE 33 Ca -0.17 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 57.98 1odk n PHE 33 Cb 1.11 -0.40 -0.04 0.00 -0.01 0.00 0.00 39.48 40.13 1odk n PHE 33 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1odk s LEU 34 N -4.22 4.34 -0.03 4.37 1.43 -0.61 -4.78 118.68 119.18 1odk s LEU 34 Ca -0.05 0.35 -0.09 0.00 -1.03 0.00 0.00 54.13 53.31 1odk s LEU 34 Cb 0.08 -3.04 -0.05 0.00 0.03 0.00 0.00 46.19 43.21 1odk s LEU 34 CO 0.57 0.14 0.27 -1.10 0.23 0.00 0.00 176.35 176.46 1odk s GLN 35 N -2.53 3.62 -1.40 1.70 -1.52 -0.17 -4.42 119.66 114.94 1odk s GLN 35 Ca 0.36 0.03 -0.05 0.00 -1.95 0.00 0.00 55.36 53.76 1odk s GLN 35 Cb -0.13 -3.14 0.03 0.00 -0.22 0.00 0.00 33.01 29.55 1odk s GLN 35 CO 0.27 0.69 0.73 0.09 -0.25 0.00 0.00 175.29 176.82 1odk n ASN 36 N 1.52 -2.06 -4.74 5.90 5.03 -1.26 -1.42 115.26 118.24 1odk n ASN 36 Ca -0.14 -0.85 -0.41 0.00 0.87 0.00 0.00 54.58 54.04 1odk n ASN 36 Cb 0.53 -3.77 -0.03 0.00 -1.02 0.00 0.00 39.78 35.50 1odk n ASN 36 CO 0.00 0.00 0.00 -2.84 -1.83 0.00 0.00 177.26 172.59 1odk s PRO 37 N -6.30 4.38 -0.03 3.52 0.02 -1.26 -4.55 135.00 130.78 1odk s PRO 37 Ca 0.21 2.06 0.02 0.00 0.02 0.00 0.00 61.00 63.32 1odk s PRO 37 Cb -0.11 -3.20 0.01 0.00 0.02 0.00 0.00 34.50 31.22 1odk s PRO 37 CO 0.84 -0.28 -0.08 1.03 -0.33 0.00 0.00 177.00 178.18 1odk s ARG 38 N 0.01 0.89 -0.34 5.54 1.81 -0.61 -4.97 118.95 121.28 1odk s ARG 38 Ca 0.58 -0.25 -0.24 0.00 -1.72 0.00 0.00 55.73 54.09 1odk s ARG 38 Cb -0.37 -0.84 0.01 0.00 -0.45 0.00 0.00 34.95 33.30 1odk s ARG 38 CO 0.38 0.07 0.84 0.50 -0.68 0.00 0.00 175.30 176.40 1odk s ARG 39 N 0.31 3.87 0.00 3.54 3.52 -1.26 -1.68 118.95 127.25 1odk s ARG 39 Ca -0.05 0.52 0.25 0.00 -0.13 0.00 0.00 55.73 56.32 1odk s ARG 39 Cb -0.09 -3.77 0.44 0.00 -1.56 0.00 0.00 34.95 29.97 1odk s ARG 39 CO 0.00 -0.81 1.37 2.48 -0.81 0.00 0.00 175.30 177.53 1odk n TYR 40 N 6.45 0.00 -3.66 5.12 0.18 0.30 -4.92 117.16 120.63 1odk n TYR 40 Ca 0.05 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.69 1odk n TYR 40 Cb 0.48 -0.20 -0.08 0.00 -0.38 0.00 0.00 39.34 39.16 1odk n TYR 40 CO 0.00 0.00 0.00 1.21 -2.08 0.00 0.00 176.86 175.99 1odk s ASN 41 N -2.94 -0.64 0.00 9.48 2.47 -1.18 -4.55 114.94 117.57 1odk s ASN 41 Ca 0.12 1.21 0.00 0.00 0.42 0.00 0.00 52.86 54.61 1odk s ASN 41 Cb 0.18 1.22 0.00 0.00 -1.45 0.00 0.00 41.25 41.19 1odk s ASN 41 CO 0.70 -0.24 0.11 -0.90 -3.72 0.00 0.00 177.10 173.05 1odk n ASP 42 N 2.62 0.10 -4.74 -4.21 3.85 -1.26 -1.72 116.55 111.18 1odk n ASP 42 Ca -0.14 -1.01 -0.42 0.00 -0.71 0.00 0.00 54.79 52.51 1odk n ASP 42 Cb 0.56 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 40.32 1odk n ASP 42 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.20 177.76 1odk n HIS 43 N -0.01 2.76 -1.52 2.11 -0.00 -1.26 -1.34 115.22 115.96 1odk n HIS 43 Ca 0.00 0.41 -0.18 0.00 0.46 0.00 0.00 57.72 58.41 1odk n HIS 43 Cb 0.26 -2.52 -0.08 0.00 -0.12 0.00 0.00 29.99 27.53 1odk n HIS 43 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1odk n ARG 44 N 1.07 -1.42 -0.97 1.57 1.74 -1.26 -1.61 116.66 115.77 1odk n ARG 44 Ca 0.05 1.08 0.00 0.00 -0.77 0.00 0.00 57.85 58.21 1odk n ARG 44 Cb 0.37 -5.42 0.00 0.00 -1.02 0.00 0.00 32.46 26.39 1odk n ARG 44 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1odk n GLY 45 N -0.31 0.29 2.58 -0.13 0.00 -0.45 -4.90 105.19 102.28 1odk n GLY 45 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1odk n GLY 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1odk n LEU 46 N 0.00 7.64 -4.67 0.99 4.77 -0.64 -4.77 117.00 120.33 1odk n LEU 46 Ca 0.00 -4.47 -0.48 0.00 -0.03 0.00 0.00 56.01 51.02 1odk n LEU 46 Cb 0.21 -1.53 -0.05 0.00 -2.33 0.00 0.00 43.42 39.73 1odk n LEU 46 CO 0.00 1.65 1.28 0.79 -1.33 0.00 0.00 177.39 179.79 1odk n TRP 47 N 3.96 2.20 -4.49 -1.77 8.01 -1.26 -4.47 117.44 119.62 1odk n TRP 47 Ca 0.59 0.22 -0.22 0.00 -1.31 0.00 0.00 57.50 56.78 1odk n TRP 47 Cb 0.31 -2.56 -0.16 0.00 -2.01 0.00 0.00 31.31 26.89 1odk n TRP 47 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1odk s GLY 48 N 2.21 0.65 0.16 6.99 0.00 -0.70 -1.28 107.32 115.34 1odk s GLY 48 Ca 0.86 -0.39 0.06 0.00 0.00 0.00 0.00 44.72 45.25 1odk s GLY 48 CO 0.46 -0.05 -0.13 -0.19 0.00 0.00 0.00 173.10 173.18 1odk s TYR 49 N 0.31 1.49 -0.01 1.90 1.51 0.38 -0.54 117.35 122.40 1odk s TYR 49 Ca -0.06 -0.62 0.00 0.00 -1.01 0.00 0.00 57.07 55.38 1odk s TYR 49 Cb -0.11 -0.74 0.01 0.00 -0.11 0.00 0.00 41.96 41.01 1odk s TYR 49 CO 0.01 0.21 -0.00 0.99 -1.11 0.00 0.00 175.55 175.65 1odk s THR 50 N -2.81 0.07 0.00 -0.71 2.01 -0.68 0.01 115.64 113.54 1odk s THR 50 Ca 0.17 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.18 1odk s THR 50 Cb -0.01 -0.10 0.00 0.00 0.01 0.00 0.00 72.50 72.40 1odk s THR 50 CO 0.04 0.05 0.00 0.61 -0.69 0.00 0.00 174.62 174.63 1odk n GLY 51 N 3.37 2.65 3.35 4.40 0.00 -0.23 -1.57 105.19 117.16 1odk n GLY 51 Ca -0.17 -1.03 -0.32 0.00 0.00 0.00 0.00 46.02 44.51 1odk n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1odk s LEU 52 N 0.00 2.37 -0.23 0.99 1.43 -0.50 -0.81 118.68 121.92 1odk s LEU 52 Ca 0.00 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 52.73 1odk s LEU 52 Cb 0.00 -1.46 0.05 0.00 0.03 0.00 0.00 46.19 44.81 1odk s LEU 52 CO 0.00 0.27 -0.10 -0.47 0.23 0.00 0.00 176.35 176.28 1odk s TYR 53 N -0.29 2.77 -1.51 0.29 5.04 0.76 -1.00 117.35 123.40 1odk s TYR 53 Ca 0.01 -1.91 -0.11 0.00 -2.44 0.00 0.00 57.07 52.62 1odk s TYR 53 Cb -0.13 -1.76 0.08 0.00 0.35 0.00 0.00 41.96 40.50 1odk s TYR 53 CO 0.03 -0.81 0.87 1.63 -1.34 0.00 0.00 175.55 175.93 1odk n LYS 54 N 4.58 -4.92 -0.85 4.97 5.02 -1.26 -1.14 118.16 124.56 1odk n LYS 54 Ca -0.14 0.55 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 1odk n LYS 54 Cb 0.45 -5.31 0.00 0.00 -0.02 0.00 0.00 35.03 30.15 1odk n LYS 54 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1odk n GLY 55 N -1.66 1.23 3.49 0.72 0.00 -1.26 -5.03 105.19 102.69 1odk n GLY 55 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 1odk n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1odk s VAL 56 N -3.82 3.66 0.25 1.61 1.01 -0.29 -5.05 120.40 117.76 1odk s VAL 56 Ca 0.00 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 1odk s VAL 56 Cb 0.00 -2.56 -0.11 0.00 0.00 0.00 0.00 36.38 33.71 1odk s VAL 56 CO 0.00 0.53 1.57 -2.84 0.00 0.00 0.00 175.10 174.35 1odk s PRO 57 N 0.07 4.17 -0.04 2.72 0.02 -1.26 -0.17 135.00 140.51 1odk s PRO 57 Ca -0.02 2.48 -0.02 0.00 0.02 0.00 0.00 61.00 63.46 1odk s PRO 57 Cb -0.14 -3.07 0.03 0.00 0.02 0.00 0.00 34.50 31.34 1odk s PRO 57 CO 0.03 -0.59 0.10 0.08 -0.33 0.00 0.00 177.00 176.29 1odk s VAL 58 N 0.31 -0.04 0.15 3.83 1.01 0.01 -4.40 120.40 121.27 1odk s VAL 58 Ca 0.65 0.13 0.06 0.00 0.00 0.00 0.00 61.98 62.81 1odk s VAL 58 Cb -0.46 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 1odk s VAL 58 CO 0.42 0.05 0.06 -0.44 0.00 0.00 0.00 175.10 175.19 1odk s SER 59 N 0.78 5.16 -0.20 3.32 0.01 -0.22 -1.07 113.70 121.48 1odk s SER 59 Ca -0.06 -0.22 -0.01 0.00 1.31 0.00 0.00 55.95 56.96 1odk s SER 59 Cb -0.08 -1.25 0.06 0.00 0.21 0.00 0.00 66.02 64.96 1odk s SER 59 CO -0.03 0.10 -0.00 -0.69 0.41 0.00 0.00 173.24 173.03 1odk s VAL 60 N -1.63 0.92 -0.15 3.43 1.01 0.10 -0.32 120.40 123.76 1odk s VAL 60 Ca 0.29 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.49 1odk s VAL 60 Cb -0.10 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 34.97 1odk s VAL 60 CO 0.21 -0.14 -0.20 -1.58 0.00 0.00 0.00 175.10 173.38 1odk s GLN 61 N 1.68 3.07 0.25 2.72 2.00 -0.05 -0.47 119.66 128.86 1odk s GLN 61 Ca -0.03 -0.83 -0.30 0.00 -2.00 0.00 0.00 55.36 52.21 1odk s GLN 61 Cb -0.18 -2.50 -0.10 0.00 0.80 0.00 0.00 33.01 31.04 1odk s GLN 61 CO -0.07 -0.03 1.42 0.99 -0.50 0.00 0.00 175.29 177.10 1odk s THR 62 N 0.87 2.71 -0.04 -0.34 2.01 -0.41 -3.40 115.64 117.04 1odk s THR 62 Ca -0.05 0.61 0.15 0.00 0.31 0.00 0.00 61.69 62.70 1odk s THR 62 Cb -0.15 -3.39 -0.23 0.00 0.01 0.00 0.00 72.50 68.74 1odk s THR 62 CO -0.03 0.10 0.29 0.35 -0.69 0.00 0.00 174.62 174.64 1odk n THR 63 N 2.25 0.18 -1.41 -0.82 -2.24 -0.54 -4.77 114.28 106.92 1odk n THR 63 Ca 0.06 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1odk n THR 63 Cb 0.41 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 1odk n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1odk n GLY 64 N 1.72 -2.44 3.73 3.38 0.00 -0.92 -3.50 105.19 107.16 1odk n GLY 64 Ca -0.07 -1.66 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 1odk n GLY 64 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1odk s MET 65 N -0.50 3.25 0.00 1.61 -1.94 -1.26 -4.65 119.30 115.81 1odk s MET 65 Ca 0.00 -0.32 0.00 0.00 -1.71 0.00 0.00 55.69 53.66 1odk s MET 65 Cb 0.00 -2.96 0.00 0.00 2.01 0.00 0.00 34.83 33.88 1odk s MET 65 CO 0.00 0.67 0.00 0.41 -0.01 0.00 0.00 175.02 176.09 1odk n GLY 66 N 2.28 1.15 0.24 -0.03 0.00 -1.20 -4.47 105.19 103.17 1odk n GLY 66 Ca -0.19 -1.63 0.07 0.00 0.00 0.00 0.00 46.02 44.27 1odk n GLY 66 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1odk h THR 67 N 0.00 1.05 -0.61 2.61 1.35 -1.53 -1.14 112.91 114.64 1odk h THR 67 Ca 0.00 -0.36 -0.07 0.00 -0.55 0.00 0.00 66.41 65.42 1odk h THR 67 Cb 0.00 1.20 -0.02 0.00 -1.73 0.00 0.00 68.15 67.59 1odk h THR 67 CO 0.00 0.10 0.11 -0.65 -0.25 0.00 0.00 175.52 174.83 1odk h PRO 68 N 0.00 1.01 -0.17 4.72 0.11 -1.89 0.17 132.00 135.96 1odk h PRO 68 Ca -0.00 -0.27 -0.10 0.00 0.11 0.00 0.00 66.00 65.74 1odk h PRO 68 Cb 0.19 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.18 1odk h PRO 68 CO 0.01 0.94 -0.29 1.03 -0.21 0.00 0.00 178.00 179.49 1odk h SER 69 N 0.92 0.55 -0.40 -2.05 0.87 -1.70 -2.82 113.55 108.92 1odk h SER 69 Ca 0.19 -0.54 -0.06 0.00 -1.23 0.00 0.00 61.79 60.14 1odk h SER 69 Cb 0.42 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 1odk h SER 69 CO 0.01 0.98 0.03 0.00 -0.53 0.00 0.00 176.83 177.32 1odk h ALA 70 N 0.58 1.17 -0.55 6.23 0.00 -1.10 -2.37 119.26 123.21 1odk h ALA 70 Ca 0.01 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1odk h ALA 70 Cb 0.88 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1odk h ALA 70 CO 0.07 0.55 0.09 0.00 0.00 0.00 0.00 179.25 179.95 1odk h ALA 71 N 1.31 0.73 -0.57 0.00 0.00 -0.65 0.92 119.26 121.01 1odk h ALA 71 Ca 0.15 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1odk h ALA 71 Cb 0.40 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1odk h ALA 71 CO 0.01 0.48 0.33 0.82 0.00 0.00 0.00 179.25 180.89 1odk h ILE 72 N 0.81 1.17 -0.36 0.00 2.04 -1.27 0.10 117.51 120.00 1odk h ILE 72 Ca 0.17 -0.40 -0.09 0.00 1.00 0.00 0.00 64.86 65.54 1odk h ILE 72 Cb 0.41 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1odk h ILE 72 CO 0.01 0.18 -0.12 0.58 0.00 0.00 0.00 178.15 178.80 1odk h VAL 73 N 0.76 1.28 -0.16 1.67 2.07 -1.13 -2.38 116.25 118.36 1odk h VAL 73 Ca 0.20 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.50 1odk h VAL 73 Cb -0.00 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1odk h VAL 73 CO -0.04 0.40 0.05 0.58 0.02 0.00 0.00 177.57 178.58 1odk h VAL 74 N 0.51 1.18 -0.65 2.57 2.07 -0.65 0.94 116.25 122.22 1odk h VAL 74 Ca 0.09 -0.57 0.07 0.00 0.82 0.00 0.00 66.70 67.11 1odk h VAL 74 Cb 0.64 1.26 -0.06 0.00 -1.52 0.00 0.00 31.29 31.61 1odk h VAL 74 CO 0.04 0.17 0.33 -0.33 0.02 0.00 0.00 177.57 177.81 1odk h GLU 75 N 0.08 0.59 -0.15 1.57 4.39 -0.97 -1.00 114.58 119.09 1odk h GLU 75 Ca 0.05 -0.04 -0.18 0.00 0.34 0.00 0.00 59.36 59.54 1odk h GLU 75 Cb 0.23 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1odk h GLU 75 CO -0.00 0.39 -0.64 0.93 -1.16 0.00 0.00 179.01 178.53 1odk h GLU 76 N 0.60 0.55 -0.77 2.33 5.08 -1.28 -2.84 114.58 118.26 1odk h GLU 76 Ca 0.30 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1odk h GLU 76 Cb 0.25 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 1odk h GLU 76 CO -0.22 1.01 0.37 -0.07 -1.00 0.00 0.00 179.01 179.10 1odk h LEU 77 N 0.40 1.00 -0.72 1.33 3.38 -0.24 -1.13 115.31 119.34 1odk h LEU 77 Ca -0.01 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 1odk h LEU 77 Cb 1.21 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 1odk h LEU 77 CO 0.12 0.84 0.14 0.58 0.09 0.00 0.00 178.44 180.21 1odk h VAL 78 N 1.09 1.26 0.00 1.22 2.07 -1.15 -0.26 116.25 120.49 1odk h VAL 78 Ca 0.27 -1.01 -0.05 0.00 0.82 0.00 0.00 66.70 66.73 1odk h VAL 78 Cb 0.11 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1odk h VAL 78 CO -0.03 0.38 -0.24 0.03 0.02 0.00 0.00 177.57 177.73 1odk h ARG 79 N 1.05 0.00 -0.01 1.57 2.47 -1.17 -1.91 114.38 116.38 1odk h ARG 79 Ca 0.21 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.93 1odk h ARG 79 Cb 0.41 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 1odk h ARG 79 CO 0.01 0.24 0.00 1.28 0.56 0.00 0.00 179.97 182.06 1odk n LEU 80 N -4.09 0.64 0.00 3.04 4.77 -0.48 -4.90 117.00 115.98 1odk n LEU 80 Ca -0.02 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 1odk n LEU 80 Cb 0.31 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1odk n LEU 80 CO 0.36 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1odk n GLY 81 N 1.06 0.84 3.75 -0.72 0.00 -0.72 -4.51 105.19 104.90 1odk n GLY 81 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 1odk n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1odk s ALA 82 N -2.00 3.57 0.00 4.61 0.00 -0.20 -4.35 121.76 123.39 1odk s ALA 82 Ca 0.00 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1odk s ALA 82 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1odk s ALA 82 CO 0.00 -0.67 0.00 0.54 0.00 0.00 0.00 175.76 175.63 1odk n ARG 83 N 2.03 3.31 -3.92 0.00 5.12 0.59 -4.54 116.66 119.25 1odk n ARG 83 Ca 0.05 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.68 1odk n ARG 83 Cb 0.41 -0.92 -0.16 0.00 -1.16 0.00 0.00 32.46 30.63 1odk n ARG 83 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1odk s VAL 84 N -1.83 1.31 -0.15 1.55 1.01 0.42 -1.03 120.40 121.68 1odk s VAL 84 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1odk s VAL 84 Cb 0.00 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.91 1odk s VAL 84 CO 0.00 0.08 -0.15 -0.76 0.00 0.00 0.00 175.10 174.27 1odk s LEU 85 N 1.53 1.72 -0.24 3.92 1.02 0.23 0.04 118.68 126.91 1odk s LEU 85 Ca -0.01 -0.50 -0.00 0.00 0.02 0.00 0.00 54.13 53.64 1odk s LEU 85 Cb -0.16 -1.20 0.03 0.00 0.02 0.00 0.00 46.19 44.88 1odk s LEU 85 CO -0.08 -0.05 -0.10 -0.69 0.02 0.00 0.00 176.35 175.45 1odk s VAL 86 N 1.44 2.54 0.19 -1.59 1.01 -0.10 -1.73 120.40 122.18 1odk s VAL 86 Ca 0.04 -1.14 -0.30 0.00 0.00 0.00 0.00 61.98 60.59 1odk s VAL 86 Cb -0.13 -2.29 -0.08 0.00 0.00 0.00 0.00 36.38 33.88 1odk s VAL 86 CO -0.10 0.22 1.18 -0.60 0.00 0.00 0.00 175.10 175.80 1odk s ARG 87 N 1.27 4.52 -0.12 2.72 3.52 0.04 -0.40 118.95 130.50 1odk s ARG 87 Ca -0.01 1.85 -0.01 0.00 -0.13 0.00 0.00 55.73 57.44 1odk s ARG 87 Cb -0.17 -3.24 0.03 0.00 -1.56 0.00 0.00 34.95 30.01 1odk s ARG 87 CO -0.06 -0.04 -0.07 0.14 -0.81 0.00 0.00 175.30 174.46 1odk s VAL 88 N -0.20 1.00 0.00 7.11 -7.23 -1.04 -1.58 120.40 118.46 1odk s VAL 88 Ca 0.51 -0.34 0.00 0.00 -1.81 0.00 0.00 61.98 60.35 1odk s VAL 88 Cb -0.32 -1.06 0.00 0.00 0.56 0.00 0.00 36.38 35.56 1odk s VAL 88 CO 0.37 0.31 0.00 0.61 -0.31 0.00 0.00 175.10 176.08 1odk n GLY 89 N 4.94 2.61 3.75 2.32 0.00 -1.14 -3.93 105.19 113.75 1odk n GLY 89 Ca -0.12 -0.93 -0.22 0.00 0.00 0.00 0.00 46.02 44.74 1odk n GLY 89 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1odk s THR 90 N -2.91 3.82 0.00 2.61 -4.23 -1.26 -0.93 115.64 112.74 1odk s THR 90 Ca 0.00 -1.62 -0.16 0.00 -1.18 0.00 0.00 61.69 58.73 1odk s THR 90 Cb 0.00 -3.13 0.03 0.00 1.34 0.00 0.00 72.50 70.74 1odk s THR 90 CO 0.00 -0.32 0.33 0.00 -0.54 0.00 0.00 174.62 174.09 1odk s ALA 91 N -2.26 -0.82 -0.29 3.99 0.00 -0.78 -4.78 121.76 116.82 1odk s ALA 91 Ca 0.34 0.29 -0.13 0.00 0.00 0.00 0.00 51.96 52.46 1odk s ALA 91 Cb -0.06 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.17 1odk s ALA 91 CO 0.23 -0.32 0.28 0.20 0.00 0.00 0.00 175.76 176.15 1odk s GLY 92 N -1.55 1.91 0.29 0.00 0.00 -0.51 -1.17 107.32 106.29 1odk s GLY 92 Ca -0.11 -1.02 -0.30 0.00 0.00 0.00 0.00 44.72 43.30 1odk s GLY 92 CO 0.02 0.82 1.59 0.00 0.00 0.00 0.00 173.10 175.53 1odk n ALA 93 N 5.20 2.48 -0.00 3.20 0.00 0.14 -0.77 120.51 130.75 1odk n ALA 93 Ca -0.11 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1odk n ALA 93 Cb 0.51 -2.46 -0.11 0.00 0.00 0.00 0.00 19.45 17.39 1odk n ALA 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1odk n ALA 94 N 2.19 2.04 -2.81 0.00 0.00 -0.23 -1.71 120.51 119.99 1odk n ALA 94 Ca 0.09 -0.71 -0.21 0.00 0.00 0.00 0.00 53.44 52.61 1odk n ALA 94 Cb 0.36 -0.74 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 1odk n ALA 94 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1odk s SER 95 N -5.43 5.72 0.13 0.00 0.01 -1.23 -4.07 113.70 108.83 1odk s SER 95 Ca -0.06 -0.19 0.25 0.00 1.31 0.00 0.00 55.95 57.27 1odk s SER 95 Cb 0.09 -1.46 0.60 0.00 0.21 0.00 0.00 66.02 65.46 1odk s SER 95 CO 0.83 -0.10 1.55 -1.54 0.41 0.00 0.00 173.24 174.39 1odk n SER 96 N -1.28 0.67 0.15 2.44 3.41 -1.26 -3.65 113.62 114.09 1odk n SER 96 Ca -0.07 0.29 -0.00 0.00 -0.26 0.00 0.00 58.87 58.83 1odk n SER 96 Cb 0.58 -0.24 0.26 0.00 -0.26 0.00 0.00 64.21 64.55 1odk n SER 96 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1odk h ASP 97 N 0.00 0.07 -3.41 4.04 -0.00 -1.98 -3.43 116.42 111.71 1odk h ASP 97 Ca 0.00 -0.03 -0.55 0.00 -0.00 0.00 0.00 57.03 56.45 1odk h ASP 97 Cb 0.70 -0.02 -0.04 0.00 -0.00 0.00 0.00 39.33 39.97 1odk h ASP 97 CO 0.00 0.53 0.16 -0.76 -0.00 0.00 0.00 179.24 179.17 1odk s LEU 98 N -8.01 4.40 0.12 2.28 1.43 -1.24 -5.07 118.68 112.59 1odk s LEU 98 Ca -0.03 1.40 0.06 0.00 -1.03 0.00 0.00 54.13 54.53 1odk s LEU 98 Cb 0.14 -3.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.09 1odk s LEU 98 CO 0.75 -0.06 -0.04 0.00 0.23 0.00 0.00 176.35 177.24 1odk s ALA 99 N 0.32 3.15 0.32 4.21 0.00 -1.26 -4.94 121.76 123.56 1odk s ALA 99 Ca 0.40 -1.23 -0.29 0.00 0.00 0.00 0.00 51.96 50.84 1odk s ALA 99 Cb -0.20 -1.03 -0.12 0.00 0.00 0.00 0.00 23.12 21.76 1odk s ALA 99 CO 0.22 0.62 1.34 -2.30 0.00 0.00 0.00 175.76 175.64 1odk n PRO 100 N 0.43 2.17 0.00 0.00 -0.02 -1.26 -1.75 135.00 134.57 1odk n PRO 100 Ca -0.11 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1odk n PRO 100 Cb 0.53 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1odk n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1odk n GLY 101 N 1.07 2.47 3.80 -1.23 0.00 0.10 -4.96 105.19 106.45 1odk n GLY 101 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1odk n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1odk s GLU 102 N -0.74 3.64 0.12 1.61 2.12 -0.72 -4.54 118.70 120.20 1odk s GLU 102 Ca 0.00 1.36 0.02 0.00 0.36 0.00 0.00 54.97 56.71 1odk s GLU 102 Cb 0.00 -2.07 -0.04 0.00 0.26 0.00 0.00 34.13 32.28 1odk s GLU 102 CO 0.00 -0.56 0.22 -0.51 -0.54 0.00 0.00 175.26 173.87 1odk s LEU 103 N -3.73 4.21 -0.09 2.70 1.43 -0.69 -0.88 118.68 121.63 1odk s LEU 103 Ca 0.67 0.14 -0.01 0.00 -1.03 0.00 0.00 54.13 53.90 1odk s LEU 103 Cb -0.17 -2.81 0.03 0.00 0.03 0.00 0.00 46.19 43.26 1odk s LEU 103 CO 0.24 0.10 -0.05 -0.63 0.23 0.00 0.00 176.35 176.24 1odk s ILE 104 N -1.65 0.76 -0.39 -0.59 1.01 0.76 -0.38 121.20 120.72 1odk s ILE 104 Ca 0.34 -0.13 -0.19 0.00 0.00 0.00 0.00 60.65 60.67 1odk s ILE 104 Cb -0.12 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.54 1odk s ILE 104 CO 0.27 0.32 0.54 -0.69 0.00 0.00 0.00 174.94 175.38 1odk s VAL 105 N 1.72 4.97 -0.36 2.92 1.01 -0.05 -0.60 120.40 130.02 1odk s VAL 105 Ca 0.03 0.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.90 1odk s VAL 105 Cb -0.13 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.19 1odk s VAL 105 CO -0.06 -0.36 1.76 0.00 0.00 0.00 0.00 175.10 176.44 1odk s ALA 106 N 2.48 2.83 -0.07 5.51 0.00 -0.49 -2.37 121.76 129.65 1odk s ALA 106 Ca 0.19 0.15 0.15 0.00 0.00 0.00 0.00 51.96 52.45 1odk s ALA 106 Cb -0.15 -4.03 0.16 0.00 0.00 0.00 0.00 23.12 19.10 1odk s ALA 106 CO 0.15 -2.70 1.49 0.37 0.00 0.00 0.00 175.76 175.06 1odk h GLN 107 N 12.81 0.00 -1.99 0.00 4.15 -0.81 -3.43 115.11 125.84 1odk h GLN 107 Ca -0.32 0.00 0.24 0.00 0.77 0.00 0.00 58.65 59.34 1odk h GLN 107 Cb 1.16 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.76 1odk h GLN 107 CO 1.05 0.52 0.64 0.20 -1.93 0.00 0.00 178.83 179.31 1odk s GLY 108 N -4.46 -0.27 -0.07 2.39 0.00 -1.24 -4.28 107.32 99.39 1odk s GLY 108 Ca 0.03 0.30 -0.02 0.00 0.00 0.00 0.00 44.72 45.04 1odk s GLY 108 CO 0.74 0.42 0.02 0.00 0.00 0.00 0.00 173.10 174.28 1odk s ALA 109 N -2.82 0.58 0.03 3.20 0.00 -0.39 -2.25 121.76 120.11 1odk s ALA 109 Ca 0.14 -0.08 -0.30 0.00 0.00 0.00 0.00 51.96 51.72 1odk s ALA 109 Cb 0.01 -0.75 -0.07 0.00 0.00 0.00 0.00 23.12 22.31 1odk s ALA 109 CO 0.00 -0.54 1.67 0.08 0.00 0.00 0.00 175.76 176.98 1odk s VAL 110 N 2.03 3.22 -1.10 0.00 1.01 0.03 -4.06 120.40 121.53 1odk s VAL 110 Ca 0.05 0.53 -0.20 0.00 0.00 0.00 0.00 61.98 62.35 1odk s VAL 110 Cb -0.13 -3.34 0.08 0.00 0.00 0.00 0.00 36.38 32.99 1odk s VAL 110 CO -0.05 -0.02 1.48 -2.16 0.00 0.00 0.00 175.10 174.35 1odk s PRO 111 N 3.21 3.75 -0.13 2.72 0.04 -1.26 -1.27 135.00 142.05 1odk s PRO 111 Ca 0.75 -1.58 0.15 0.00 0.04 0.00 0.00 61.00 60.35 1odk s PRO 111 Cb -0.38 -5.32 0.66 0.00 0.04 0.00 0.00 34.50 29.50 1odk s PRO 111 CO 0.32 -2.12 1.54 1.28 0.04 0.00 0.00 177.00 178.06 1odk n LEU 112 N 8.14 4.52 -4.76 -3.56 4.77 -0.31 -4.95 117.00 120.85 1odk n LEU 112 Ca 0.36 -2.28 -0.26 0.00 -0.03 0.00 0.00 56.01 53.80 1odk n LEU 112 Cb 0.49 -0.58 -0.06 0.00 -2.33 0.00 0.00 43.42 40.94 1odk n LEU 112 CO 0.66 0.68 -0.25 1.51 -1.33 0.00 0.00 177.39 178.66 1odk s ASP 113 N -0.79 5.28 0.15 -1.43 1.47 -1.12 -4.04 116.67 116.19 1odk s ASP 113 Ca 0.46 -0.24 0.26 0.00 1.18 0.00 0.00 52.55 54.21 1odk s ASP 113 Cb 0.31 -1.30 0.65 0.00 -0.34 0.00 0.00 42.92 42.25 1odk s ASP 113 CO 0.19 0.06 1.60 0.61 0.68 0.00 0.00 175.17 178.31 1odk n GLY 114 N -0.41 -1.56 0.09 2.12 0.00 -1.26 -3.41 105.19 100.76 1odk n GLY 114 Ca -0.09 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 1odk n GLY 114 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1odk h THR 115 N 0.00 1.39 -0.67 2.61 2.02 -1.96 -0.18 112.91 116.12 1odk h THR 115 Ca 0.00 -1.30 -0.06 0.00 0.77 0.00 0.00 66.41 65.82 1odk h THR 115 Cb 0.71 2.12 -0.03 0.00 -1.74 0.00 0.00 68.15 69.21 1odk h THR 115 CO 0.00 0.36 0.17 0.71 0.37 0.00 0.00 175.52 177.13 1odk h THR 116 N -0.30 1.25 -0.70 3.16 1.35 -1.94 -2.12 112.91 113.60 1odk h THR 116 Ca 0.01 -0.91 0.05 0.00 -0.55 0.00 0.00 66.41 65.01 1odk h THR 116 Cb 0.62 0.55 -0.05 0.00 -1.73 0.00 0.00 68.15 67.54 1odk h THR 116 CO 0.02 0.35 0.41 -0.09 -0.25 0.00 0.00 175.52 175.96 1odk h ARG 117 N 1.00 0.75 -0.18 4.72 2.43 -1.55 0.11 114.38 121.65 1odk h ARG 117 Ca 0.21 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 1odk h ARG 117 Cb 0.33 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1odk h ARG 117 CO -0.00 0.49 0.02 0.37 -1.51 0.00 0.00 179.97 179.34 1odk h GLN 118 N 0.77 0.31 -0.91 0.20 4.15 -0.64 0.26 115.11 119.25 1odk h GLN 118 Ca 0.30 -0.09 0.01 0.00 0.77 0.00 0.00 58.65 59.64 1odk h GLN 118 Cb 0.14 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.75 1odk h GLN 118 CO -0.16 0.49 0.59 1.88 -1.93 0.00 0.00 178.83 179.71 1odk h TYR 119 N 0.09 1.15 -0.01 3.99 -1.99 -1.00 -2.27 116.97 116.93 1odk h TYR 119 Ca 0.05 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.81 1odk h TYR 119 Cb 0.34 -0.39 0.00 0.00 2.00 0.00 0.00 36.73 38.69 1odk h TYR 119 CO 0.03 0.73 -0.12 1.28 -0.00 0.00 0.00 178.16 180.08 1odk n LEU 120 N -4.39 0.76 -3.61 3.88 4.77 0.36 -4.93 117.00 113.83 1odk n LEU 120 Ca 0.10 -0.15 -0.25 0.00 -0.03 0.00 0.00 56.01 55.68 1odk n LEU 120 Cb 0.02 -0.12 0.06 0.00 -2.33 0.00 0.00 43.42 41.05 1odk n LEU 120 CO 0.37 0.14 0.18 -0.62 -1.33 0.00 0.00 177.39 176.12 1odk n GLU 121 N -0.68 -6.87 -0.94 3.23 1.02 0.53 -1.98 120.64 114.94 1odk n GLU 121 Ca 0.15 0.77 0.00 0.00 -0.02 0.00 0.00 57.16 58.06 1odk n GLU 121 Cb 0.30 -5.75 0.00 0.00 -0.02 0.00 0.00 31.44 25.96 1odk n GLU 121 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1odk n GLY 122 N -1.85 0.73 3.82 0.62 0.00 0.61 -5.02 105.19 104.09 1odk n GLY 122 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1odk n GLY 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1odk s ARG 123 N -0.21 3.73 0.81 1.61 0.52 -0.84 -5.03 118.95 119.54 1odk s ARG 123 Ca 0.00 1.09 -0.12 0.00 -0.52 0.00 0.00 55.73 56.19 1odk s ARG 123 Cb 0.00 -2.10 0.08 0.00 0.52 0.00 0.00 34.95 33.45 1odk s ARG 123 CO 0.00 -0.46 1.14 -2.14 0.02 0.00 0.00 175.30 173.86 1odk s PRO 124 N -3.93 1.81 -0.03 3.54 0.02 -1.26 -4.92 135.00 130.23 1odk s PRO 124 Ca 0.62 1.45 -0.29 0.00 0.02 0.00 0.00 61.00 62.79 1odk s PRO 124 Cb -0.13 -1.82 0.11 0.00 0.02 0.00 0.00 34.50 32.68 1odk s PRO 124 CO 0.31 -2.02 0.92 -0.47 -0.33 0.00 0.00 177.00 175.41 1odk s TYR 125 N -2.57 -0.32 -0.51 6.54 5.04 -1.26 -5.11 117.35 119.15 1odk s TYR 125 Ca 0.66 0.20 0.03 0.00 -2.44 0.00 0.00 57.07 55.53 1odk s TYR 125 Cb -0.22 0.53 0.14 0.00 0.35 0.00 0.00 41.96 42.77 1odk s TYR 125 CO 0.53 -0.50 0.30 0.00 -1.34 0.00 0.00 175.55 174.53 1odk s ALA 126 N -3.02 2.77 0.03 3.97 0.00 -1.26 -4.85 121.76 119.40 1odk s ALA 126 Ca 0.05 -3.03 -0.30 0.00 0.00 0.00 0.00 51.96 48.69 1odk s ALA 126 Cb -0.01 -2.01 -0.09 0.00 0.00 0.00 0.00 23.12 21.02 1odk s ALA 126 CO -0.08 -2.05 1.93 -2.14 0.00 0.00 0.00 175.76 173.42 1odk s PRO 127 N -0.19 4.15 0.04 0.00 0.02 -1.26 -4.95 135.00 132.81 1odk s PRO 127 Ca 0.20 2.57 0.02 0.00 0.02 0.00 0.00 61.00 63.80 1odk s PRO 127 Cb -0.20 -4.14 -0.02 0.00 0.02 0.00 0.00 34.50 30.16 1odk s PRO 127 CO -0.04 -0.94 -0.07 0.14 -0.33 0.00 0.00 177.00 175.76 1odk s VAL 128 N 4.39 0.46 1.04 3.83 -7.23 -1.26 -1.26 120.40 120.38 1odk s VAL 128 Ca 0.87 -1.13 -0.15 0.00 -1.81 0.00 0.00 61.98 59.76 1odk s VAL 128 Cb -0.42 -0.64 0.21 0.00 0.56 0.00 0.00 36.38 36.09 1odk s VAL 128 CO 0.40 -0.45 1.15 -2.16 -0.31 0.00 0.00 175.10 173.73 1odk s PRO 129 N -1.77 0.04 0.28 4.82 0.04 -1.26 -4.73 135.00 132.42 1odk s PRO 129 Ca -0.09 0.09 -0.29 0.00 0.04 0.00 0.00 61.00 60.74 1odk s PRO 129 Cb -0.08 -1.73 -0.10 0.00 0.04 0.00 0.00 34.50 32.63 1odk s PRO 129 CO -0.00 -2.90 1.33 0.34 0.04 0.00 0.00 177.00 175.81 1odk s ASP 130 N -4.00 6.79 0.23 6.66 2.15 0.17 -4.90 116.67 123.76 1odk s ASP 130 Ca 0.68 2.61 -0.08 0.00 0.43 0.00 0.00 52.55 56.19 1odk s ASP 130 Cb -0.12 -2.63 0.24 0.00 -0.30 0.00 0.00 42.92 40.11 1odk s ASP 130 CO 0.55 -0.56 1.87 1.55 -0.17 0.00 0.00 175.17 178.41 1odk h PRO 131 N 4.20 0.96 -0.36 4.34 0.13 -1.93 -1.25 132.00 138.09 1odk h PRO 131 Ca -0.47 -0.06 -0.03 0.00 -0.87 0.00 0.00 66.00 64.57 1odk h PRO 131 Cb 1.22 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1odk h PRO 131 CO 0.71 0.64 0.13 0.93 -0.23 0.00 0.00 178.00 180.17 1odk h GLU 132 N 0.99 0.55 -0.44 0.86 4.39 -1.94 -0.35 114.58 118.65 1odk h GLU 132 Ca 0.32 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.91 1odk h GLU 132 Cb 0.02 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 1odk h GLU 132 CO -0.12 0.56 0.27 0.28 -1.16 0.00 0.00 179.01 178.84 1odk h VAL 133 N 0.43 1.14 -0.28 3.13 2.07 -1.80 -0.31 116.25 120.64 1odk h VAL 133 Ca 0.12 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.38 1odk h VAL 133 Cb 0.23 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 1odk h VAL 133 CO -0.01 0.14 0.05 0.15 0.02 0.00 0.00 177.57 177.92 1odk h PHE 134 N 0.58 0.09 -0.60 1.57 3.57 -1.01 -0.39 116.94 120.74 1odk h PHE 134 Ca 0.16 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.69 1odk h PHE 134 Cb -0.01 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 1odk h PHE 134 CO -0.03 0.02 0.38 -0.09 -2.23 0.00 0.00 178.31 176.35 1odk h ARG 135 N 0.15 0.74 -0.62 1.11 2.43 -0.68 -1.66 114.38 115.86 1odk h ARG 135 Ca 0.13 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 1odk h ARG 135 Cb 0.14 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1odk h ARG 135 CO -0.17 0.49 0.11 0.00 -1.51 0.00 0.00 179.97 178.88 1odk h ALA 136 N 1.25 0.82 -0.56 2.80 0.00 -0.58 -0.36 119.26 122.63 1odk h ALA 136 Ca 0.23 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1odk h ALA 136 Cb -0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1odk h ALA 136 CO -0.08 0.57 0.16 -0.07 0.00 0.00 0.00 179.25 179.83 1odk h LEU 137 N 0.93 0.83 -0.10 0.00 3.38 -0.81 -0.58 115.31 118.96 1odk h LEU 137 Ca 0.19 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1odk h LEU 137 Cb 0.42 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1odk h LEU 137 CO 0.01 0.84 0.04 -0.25 0.09 0.00 0.00 178.44 179.16 1odk h TRP 138 N 0.79 0.17 -0.80 1.13 2.91 -1.13 -1.14 115.95 117.87 1odk h TRP 138 Ca 0.18 -0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.20 1odk h TRP 138 Cb 0.31 -0.05 -0.04 0.00 -0.51 0.00 0.00 29.16 28.87 1odk h TRP 138 CO 0.02 0.29 0.52 0.00 -1.03 0.00 0.00 178.44 178.25 1odk h ARG 139 N -0.01 1.02 -0.32 2.65 3.08 -0.93 -1.23 114.38 118.64 1odk h ARG 139 Ca 0.03 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.88 1odk h ARG 139 Cb 0.20 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1odk h ARG 139 CO -0.00 0.68 -0.38 0.00 -1.07 0.00 0.00 179.97 179.20 1odk h ARG 140 N 1.05 0.76 -0.67 0.04 2.47 -1.01 -1.59 114.38 115.42 1odk h ARG 140 Ca 0.30 -0.38 -0.02 0.00 -1.26 0.00 0.00 59.98 58.62 1odk h ARG 140 Cb -0.08 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.22 1odk h ARG 140 CO -0.08 1.01 0.34 0.00 0.56 0.00 0.00 179.97 181.80 1odk h ALA 141 N 0.95 0.87 -0.22 0.04 0.00 -0.83 -1.04 119.26 119.03 1odk h ALA 141 Ca 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1odk h ALA 141 Cb 0.92 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1odk h ALA 141 CO 0.08 0.41 0.08 0.93 0.00 0.00 0.00 179.25 180.76 1odk h GLU 142 N 0.93 0.33 -0.42 0.00 5.08 -1.09 -2.47 114.58 116.94 1odk h GLU 142 Ca 0.23 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1odk h GLU 142 Cb 0.09 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1odk h GLU 142 CO -0.03 0.39 0.27 0.00 -1.00 0.00 0.00 179.01 178.63 1odk h ALA 143 N 0.92 0.53 0.00 3.43 0.00 -1.04 -2.56 119.26 120.55 1odk h ALA 143 Ca 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1odk h ALA 143 Cb 0.19 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1odk h ALA 143 CO -0.01 0.01 -0.06 -0.07 0.00 0.00 0.00 179.25 179.12 1odk h LEU 144 N 0.56 0.00 0.00 0.00 3.38 -1.17 -3.47 115.31 114.61 1odk h LEU 144 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1odk h LEU 144 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1odk h LEU 144 CO -0.03 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.17 1odk n GLY 145 N -0.04 0.53 3.76 0.83 0.00 -0.93 -5.03 105.19 104.31 1odk n GLY 145 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1odk n GLY 145 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1odk s TYR 146 N -2.21 3.68 0.09 1.61 2.02 -1.25 -4.94 117.35 116.35 1odk s TYR 146 Ca 0.00 1.75 -0.35 0.00 -0.37 0.00 0.00 57.07 58.10 1odk s TYR 146 Cb 0.00 -3.21 -0.15 0.00 -0.40 0.00 0.00 41.96 38.20 1odk s TYR 146 CO 0.00 -0.31 1.55 -2.30 -1.57 0.00 0.00 175.55 172.92 1odk n PRO 147 N 1.29 1.82 -3.79 -1.71 -0.02 -1.26 -4.89 135.00 126.43 1odk n PRO 147 Ca -0.01 0.66 -0.09 0.00 -2.02 0.00 0.00 63.50 62.03 1odk n PRO 147 Cb 0.45 -2.39 -0.04 0.00 -0.02 0.00 0.00 33.50 31.50 1odk n PRO 147 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1odk s HIS 148 N 1.24 -0.06 0.12 6.00 -3.43 -1.26 -1.70 115.29 116.20 1odk s HIS 148 Ca 0.83 -0.30 0.04 0.00 -0.80 0.00 0.00 55.06 54.83 1odk s HIS 148 Cb -0.78 0.41 -0.04 0.00 -1.43 0.00 0.00 32.58 30.74 1odk s HIS 148 CO 0.43 -0.98 -0.10 1.03 -2.00 0.00 0.00 174.74 173.13 1odk s ARG 149 N -3.90 0.93 -0.12 -0.38 1.81 0.48 -4.92 118.95 112.86 1odk s ARG 149 Ca 0.11 -1.30 0.00 0.00 -1.72 0.00 0.00 55.73 52.83 1odk s ARG 149 Cb -0.02 -0.54 0.02 0.00 -0.45 0.00 0.00 34.95 33.96 1odk s ARG 149 CO 0.00 0.07 -0.12 0.08 -0.68 0.00 0.00 175.30 174.65 1odk s VAL 150 N -2.91 1.35 -2.41 3.52 1.01 -1.26 -0.87 120.40 118.83 1odk s VAL 150 Ca 0.11 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1odk s VAL 150 Cb 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 35.10 1odk s VAL 150 CO -0.00 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1odk n GLY 151 N 4.67 -0.57 3.81 4.51 0.00 -1.00 -4.92 105.19 111.68 1odk n GLY 151 Ca -0.16 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 1odk n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1odk s LEU 152 N 0.00 4.21 0.32 0.99 1.43 -1.25 -0.07 118.68 124.31 1odk s LEU 152 Ca 0.00 1.60 0.05 0.00 -1.03 0.00 0.00 54.13 54.75 1odk s LEU 152 Cb 0.00 -4.02 -0.06 0.00 0.03 0.00 0.00 46.19 42.14 1odk s LEU 152 CO 0.00 -0.12 0.01 0.68 0.23 0.00 0.00 176.35 177.15 1odk s VAL 153 N -1.77 1.43 -0.10 -1.59 -7.23 -0.95 -0.57 120.40 109.62 1odk s VAL 153 Ca 0.51 -2.04 0.02 0.00 -1.81 0.00 0.00 61.98 58.67 1odk s VAL 153 Cb -0.15 -2.69 0.01 0.00 0.56 0.00 0.00 36.38 34.11 1odk s VAL 153 CO 0.20 -0.11 -0.17 0.00 -0.31 0.00 0.00 175.10 174.71 1odk s ALA 154 N -3.14 1.76 -0.34 1.32 0.00 -0.49 -0.78 121.76 120.09 1odk s ALA 154 Ca 0.34 -0.75 -0.16 0.00 0.00 0.00 0.00 51.96 51.38 1odk s ALA 154 Cb 0.07 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 1odk s ALA 154 CO 0.14 0.06 0.42 -1.12 0.00 0.00 0.00 175.76 175.26 1odk s SER 155 N 0.75 6.23 0.38 0.00 0.01 -0.40 -1.23 113.70 119.44 1odk s SER 155 Ca -0.11 -0.15 0.08 0.00 1.31 0.00 0.00 55.95 57.08 1odk s SER 155 Cb -0.16 -2.22 -0.06 0.00 0.21 0.00 0.00 66.02 63.79 1odk s SER 155 CO 0.02 -0.39 0.08 -1.83 0.41 0.00 0.00 173.24 171.53 1odk s GLU 156 N 2.16 2.13 -0.24 12.44 -1.05 -0.56 -1.16 118.70 132.42 1odk s GLU 156 Ca 0.14 -1.83 0.01 0.00 -0.15 0.00 0.00 54.97 53.14 1odk s GLU 156 Cb -0.16 -1.92 -0.15 0.00 -0.44 0.00 0.00 34.13 31.46 1odk s GLU 156 CO 0.12 0.01 -0.22 -0.25 0.95 0.00 0.00 175.26 175.87 1odk n ASP 157 N -1.08 2.13 -4.31 0.83 10.43 -1.26 -4.52 116.55 118.78 1odk n ASP 157 Ca -0.03 -0.09 -0.45 0.00 2.57 0.00 0.00 54.79 56.79 1odk n ASP 157 Cb 0.64 -0.41 -0.02 0.00 1.84 0.00 0.00 41.12 43.17 1odk n ASP 157 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1odk s ALA 158 N -2.47 4.34 0.27 2.24 0.00 -1.26 -4.92 121.76 119.94 1odk s ALA 158 Ca -0.32 -3.56 -0.03 0.00 0.00 0.00 0.00 51.96 48.04 1odk s ALA 158 Cb 0.09 -3.45 0.56 0.00 0.00 0.00 0.00 23.12 20.31 1odk s ALA 158 CO 0.54 -2.23 1.62 0.35 0.00 0.00 0.00 175.76 176.04 1odk h PHE 159 N 7.18 0.02 -0.18 0.00 3.57 -1.99 -0.32 116.94 125.23 1odk h PHE 159 Ca 0.13 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.69 1odk h PHE 159 Cb 0.96 0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.82 1odk h PHE 159 CO 0.89 -0.27 0.00 0.66 -2.23 0.00 0.00 178.31 177.36 1odk n TYR 160 N -5.35 0.24 -0.02 0.41 4.02 -1.26 -3.97 117.16 111.23 1odk n TYR 160 Ca 0.17 -0.12 -0.15 0.00 -0.01 0.00 0.00 57.90 57.79 1odk n TYR 160 Cb 0.57 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.75 1odk n TYR 160 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1odk n ALA 161 N 0.14 1.20 -2.15 -0.72 0.00 -0.13 -4.90 120.51 113.95 1odk n ALA 161 Ca 0.13 -0.72 -0.43 0.00 0.00 0.00 0.00 53.44 52.43 1odk n ALA 161 Cb 0.25 -0.71 -0.03 0.00 0.00 0.00 0.00 19.45 18.97 1odk n ALA 161 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1odk s THR 162 N -2.57 3.81 0.49 0.00 2.01 -1.24 -5.02 115.64 113.12 1odk s THR 162 Ca -0.15 0.97 -0.02 0.00 0.31 0.00 0.00 61.69 62.80 1odk s THR 162 Cb 0.07 -3.66 -0.01 0.00 0.01 0.00 0.00 72.50 68.92 1odk s THR 162 CO 0.79 -0.12 0.74 0.42 -0.69 0.00 0.00 174.62 175.76 1odk s THR 163 N 4.03 4.11 0.40 -0.82 -4.23 -1.26 -4.77 115.64 113.11 1odk s THR 163 Ca 0.67 -0.26 0.08 0.00 -1.18 0.00 0.00 61.69 61.01 1odk s THR 163 Cb -0.29 -3.55 0.22 0.00 1.34 0.00 0.00 72.50 70.22 1odk s THR 163 CO 0.25 -0.46 2.00 -0.65 -0.54 0.00 0.00 174.62 175.22 1odk h PRO 164 N 0.24 0.40 -0.56 3.99 0.11 -1.96 -0.84 132.00 133.38 1odk h PRO 164 Ca -0.46 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 1odk h PRO 164 Cb 1.24 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1odk h PRO 164 CO 0.59 0.36 0.14 0.93 -0.21 0.00 0.00 178.00 179.82 1odk h GLU 165 N 0.40 0.90 -0.24 1.05 3.07 -1.94 -1.16 114.58 116.66 1odk h GLU 165 Ca 0.10 -0.21 -0.16 0.00 -0.50 0.00 0.00 59.36 58.59 1odk h GLU 165 Cb 0.13 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 27.92 1odk h GLU 165 CO -0.01 0.84 -0.49 0.93 -1.40 0.00 0.00 179.01 178.88 1odk h GLU 166 N 0.80 0.66 -0.47 2.33 5.08 -1.79 -2.30 114.58 118.89 1odk h GLU 166 Ca 0.18 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1odk h GLU 166 Cb 0.34 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 1odk h GLU 166 CO 0.00 1.00 0.29 0.00 -1.00 0.00 0.00 179.01 179.30 1odk h ALA 167 N 0.93 0.60 -0.60 3.43 0.00 -0.90 -1.36 119.26 121.36 1odk h ALA 167 Ca 0.02 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1odk h ALA 167 Cb 1.04 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1odk h ALA 167 CO 0.10 0.09 0.21 0.00 0.00 0.00 0.00 179.25 179.65 1odk h ARG 168 N 0.63 0.90 -0.42 0.00 3.08 -1.11 -1.22 114.38 116.23 1odk h ARG 168 Ca 0.17 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1odk h ARG 168 Cb -0.02 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1odk h ARG 168 CO -0.03 0.76 0.20 0.00 -1.07 0.00 0.00 179.97 179.82 1odk h ALA 169 N 1.36 0.55 -0.24 0.04 0.00 -0.88 -2.61 119.26 117.47 1odk h ALA 169 Ca 0.20 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1odk h ALA 169 Cb 0.22 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1odk h ALA 169 CO -0.01 0.11 -0.12 -1.49 0.00 0.00 0.00 179.25 177.74 1odk h TRP 170 N 0.54 0.43 0.00 0.00 4.06 -0.81 -2.36 115.95 117.80 1odk h TRP 170 Ca 0.14 -0.06 -0.02 0.00 2.06 0.00 0.00 58.89 61.01 1odk h TRP 170 Cb 0.13 -0.12 -0.00 0.00 -1.00 0.00 0.00 29.16 28.17 1odk h TRP 170 CO -0.01 0.52 -0.12 0.00 -3.56 0.00 0.00 178.44 175.27 1odk h ALA 171 N 1.50 1.81 0.00 1.49 0.00 -0.86 0.72 119.26 123.92 1odk h ALA 171 Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1odk h ALA 171 Cb 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1odk h ALA 171 CO 0.03 0.14 0.00 0.54 0.00 0.00 0.00 179.25 179.96 1odk n ARG 172 N -4.40 0.09 -0.38 0.00 1.74 -0.89 -1.33 116.66 111.48 1odk n ARG 172 Ca -0.03 0.37 0.08 0.00 -0.77 0.00 0.00 57.85 57.50 1odk n ARG 172 Cb 0.19 -1.69 0.25 0.00 -1.02 0.00 0.00 32.46 30.19 1odk n ARG 172 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1odk n TYR 173 N -1.86 0.91 -0.04 -1.55 4.01 0.22 -4.96 117.16 113.89 1odk n TYR 173 Ca 0.02 -0.64 0.00 0.00 -0.16 0.00 0.00 57.90 57.12 1odk n TYR 173 Cb 0.17 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1odk n TYR 173 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1odk n GLY 174 N 0.42 0.38 3.67 2.72 0.00 -0.44 -5.05 105.19 106.88 1odk n GLY 174 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1odk n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1odk s VAL 175 N -2.11 3.95 -0.03 1.61 1.01 -1.05 -3.97 120.40 119.80 1odk s VAL 175 Ca 0.00 1.23 -0.04 0.00 0.00 0.00 0.00 61.98 63.17 1odk s VAL 175 Cb 0.00 -3.79 -0.28 0.00 0.00 0.00 0.00 36.38 32.31 1odk s VAL 175 CO 0.00 -0.06 0.71 -0.07 0.00 0.00 0.00 175.10 175.68 1odk h LEU 176 N 9.17 0.41 -7.86 3.92 3.38 -1.18 -3.35 115.31 119.79 1odk h LEU 176 Ca -0.34 -0.65 0.09 0.00 0.09 0.00 0.00 57.88 57.07 1odk h LEU 176 Cb 1.15 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.71 1odk h LEU 176 CO 0.93 1.56 0.29 0.00 0.09 0.00 0.00 178.44 181.31 1odk s ALA 177 N -2.60 -1.35 -0.06 1.53 0.00 -1.25 -1.06 121.76 116.97 1odk s ALA 177 Ca -0.13 -0.15 0.03 0.00 0.00 0.00 0.00 51.96 51.71 1odk s ALA 177 Cb 0.07 0.80 -0.03 0.00 0.00 0.00 0.00 23.12 23.96 1odk s ALA 177 CO 0.84 -1.03 -0.13 -0.06 0.00 0.00 0.00 175.76 175.38 1odk s PHE 178 N -3.75 2.74 0.00 0.00 0.40 0.05 -1.40 117.98 116.03 1odk s PHE 178 Ca 0.11 -0.17 0.00 0.00 -0.60 0.00 0.00 56.93 56.27 1odk s PHE 178 Cb -0.05 -1.65 0.00 0.00 0.51 0.00 0.00 43.02 41.83 1odk s PHE 178 CO 0.05 0.17 0.00 -0.85 0.70 0.00 0.00 175.22 175.29 1odk n GLU 179 N 2.39 0.00 -1.38 0.44 -0.00 -0.37 -1.42 120.64 120.30 1odk n GLU 179 Ca -0.17 0.00 0.04 0.00 -0.00 0.00 0.00 57.16 57.03 1odk n GLU 179 Cb 0.52 0.00 0.04 0.00 -0.00 0.00 0.00 31.44 32.00 1odk n GLU 179 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1odk n MET 180 N 0.00 0.16 0.00 3.44 2.81 -1.26 -1.50 117.12 120.77 1odk n MET 180 Ca 0.00 -2.11 0.00 0.00 -1.81 0.00 0.00 57.70 53.78 1odk n MET 180 Cb 0.00 -0.18 0.00 0.00 -0.71 0.00 0.00 33.22 32.33 1odk n MET 180 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1odk n GLU 181 N 0.32 0.00 -0.19 0.03 4.71 -1.26 -1.35 120.64 122.89 1odk n GLU 181 Ca 0.07 0.00 -0.02 0.00 -0.01 0.00 0.00 57.16 57.20 1odk n GLU 181 Cb 1.09 -0.38 0.05 0.00 -1.01 0.00 0.00 31.44 31.18 1odk n GLU 181 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1odk h ALA 182 N 0.00 0.31 -0.53 0.62 0.00 -1.96 -2.84 119.26 114.86 1odk h ALA 182 Ca 0.00 0.22 0.10 0.00 0.00 0.00 0.00 54.91 55.23 1odk h ALA 182 Cb 0.00 0.51 -0.09 0.00 0.00 0.00 0.00 17.79 18.21 1odk h ALA 182 CO 0.00 -0.48 0.00 0.66 0.00 0.00 0.00 179.25 179.44 1odk h SER 183 N -0.04 -0.22 -0.59 0.00 4.64 -1.89 -0.67 113.55 114.77 1odk h SER 183 Ca 0.27 0.13 -0.09 0.00 -0.47 0.00 0.00 61.79 61.63 1odk h SER 183 Cb 0.46 0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.75 1odk h SER 183 CO -0.62 -0.08 0.03 0.00 -0.87 0.00 0.00 176.83 175.30 1odk h ALA 184 N 1.47 0.80 -0.19 5.18 0.00 -1.88 -1.16 119.26 123.48 1odk h ALA 184 Ca 0.27 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1odk h ALA 184 Cb 0.41 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1odk h ALA 184 CO -0.44 0.61 0.11 1.25 0.00 0.00 0.00 179.25 180.78 1odk h LEU 185 N 0.92 0.23 -0.28 0.00 5.85 -1.26 0.16 115.31 120.94 1odk h LEU 185 Ca 0.17 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1odk h LEU 185 Cb 0.51 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1odk h LEU 185 CO 0.02 0.21 0.19 -0.26 -0.34 0.00 0.00 178.44 178.26 1odk h PHE 186 N 0.22 0.36 -0.01 1.25 0.05 -0.98 0.66 116.94 118.49 1odk h PHE 186 Ca 0.07 0.01 0.01 0.00 3.82 0.00 0.00 57.97 61.87 1odk h PHE 186 Cb 0.02 -0.12 -0.01 0.00 2.00 0.00 0.00 35.95 37.85 1odk h PHE 186 CO -0.05 0.23 -0.02 1.25 -0.18 0.00 0.00 178.31 179.54 1odk h LEU 187 N 0.38 -0.06 -1.65 1.54 5.85 -1.04 -2.39 115.31 117.95 1odk h LEU 187 Ca 0.10 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1odk h LEU 187 Cb -0.04 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1odk h LEU 187 CO -0.02 -0.03 -0.17 -0.07 -0.34 0.00 0.00 178.44 177.81 1odk h LEU 188 N -0.03 0.01 -0.47 2.25 3.38 -0.73 -0.68 115.31 119.05 1odk h LEU 188 Ca 0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1odk h LEU 188 Cb 0.05 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1odk h LEU 188 CO -0.03 0.18 0.31 1.23 0.09 0.00 0.00 178.44 180.22 1odk h GLY 189 N 0.52 0.66 0.82 0.83 0.00 -0.36 0.12 103.07 105.66 1odk h GLY 189 Ca 0.00 -0.25 -0.11 0.00 0.00 0.00 0.00 47.33 46.97 1odk h GLY 189 CO 0.02 0.25 -0.34 3.21 0.00 0.00 0.00 176.54 179.68 1odk h ARG 190 N 0.64 0.48 -0.86 4.80 2.47 -1.13 0.50 114.38 121.28 1odk h ARG 190 Ca 0.17 -0.33 -0.02 0.00 -1.26 0.00 0.00 59.98 58.55 1odk h ARG 190 Cb -0.07 0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.26 1odk h ARG 190 CO -0.04 0.94 0.46 0.52 0.56 0.00 0.00 179.97 182.41 1odk h MET 191 N 0.09 1.21 -0.02 0.04 2.86 -0.98 -2.95 114.93 115.18 1odk h MET 191 Ca -0.00 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 1odk h MET 191 Cb 0.94 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.37 1odk h MET 191 CO 0.07 0.90 -0.04 0.54 1.06 0.00 0.00 176.91 179.44 1odk n ARG 192 N -4.35 1.94 -3.18 1.72 5.12 0.39 -4.98 116.66 113.31 1odk n ARG 192 Ca 0.09 -1.43 -0.15 0.00 -1.93 0.00 0.00 57.85 54.42 1odk n ARG 192 Cb 0.10 -1.47 0.05 0.00 -1.16 0.00 0.00 32.46 29.98 1odk n ARG 192 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1odk n GLY 193 N 1.28 0.01 3.46 -0.13 0.00 -0.55 -5.04 105.19 104.23 1odk n GLY 193 Ca 0.16 -0.09 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1odk n GLY 193 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1odk s VAL 194 N -3.20 1.91 -0.24 1.61 -7.23 0.06 -5.03 120.40 108.27 1odk s VAL 194 Ca 0.36 -2.18 -0.14 0.00 -1.81 0.00 0.00 61.98 58.21 1odk s VAL 194 Cb -0.16 -2.47 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 1odk s VAL 194 CO 0.46 -0.30 0.34 -0.13 -0.31 0.00 0.00 175.10 175.16 1odk s ARG 195 N -3.67 4.09 0.35 4.82 0.52 -0.20 -4.39 118.95 120.47 1odk s ARG 195 Ca 0.30 0.05 0.07 0.00 -0.52 0.00 0.00 55.73 55.63 1odk s ARG 195 Cb 0.02 -3.59 -0.07 0.00 0.52 0.00 0.00 34.95 31.84 1odk s ARG 195 CO 0.13 -0.12 -0.03 0.95 0.02 0.00 0.00 175.30 176.25 1odk s THR 196 N 1.59 1.83 0.08 0.02 -4.23 -1.26 -0.60 115.64 113.08 1odk s THR 196 Ca 0.15 -2.09 -0.27 0.00 -1.18 0.00 0.00 61.69 58.31 1odk s THR 196 Cb -0.15 -2.73 0.08 0.00 1.34 0.00 0.00 72.50 71.04 1odk s THR 196 CO 0.08 -0.13 1.04 -0.83 -0.54 0.00 0.00 174.62 174.24 1odk s GLY 197 N -3.58 -0.31 -0.17 3.99 0.00 -0.70 -0.65 107.32 105.90 1odk s GLY 197 Ca 0.33 0.43 -0.12 0.00 0.00 0.00 0.00 44.72 45.36 1odk s GLY 197 CO 0.16 0.09 0.43 0.00 0.00 0.00 0.00 173.10 173.78 1odk s ALA 198 N -3.03 -1.09 -0.02 3.20 0.00 -1.26 -0.78 121.76 118.78 1odk s ALA 198 Ca 0.12 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.54 1odk s ALA 198 Cb 0.00 -0.85 -0.00 0.00 0.00 0.00 0.00 23.12 22.26 1odk s ALA 198 CO -0.01 -0.24 -0.12 -1.50 0.00 0.00 0.00 175.76 173.89 1odk s ILE 199 N 0.90 0.96 0.15 0.00 2.07 -0.61 -1.39 121.20 123.28 1odk s ILE 199 Ca -0.05 -0.48 0.06 0.00 -1.41 0.00 0.00 60.65 58.77 1odk s ILE 199 Cb -0.06 -0.82 -0.04 0.00 0.13 0.00 0.00 42.46 41.67 1odk s ILE 199 CO -0.07 0.28 -0.14 -0.76 -1.91 0.00 0.00 174.94 172.34 1odk s LEU 200 N -0.04 2.47 -0.15 8.50 1.43 0.23 -2.87 118.68 128.25 1odk s LEU 200 Ca 0.00 -0.91 -0.00 0.00 -1.03 0.00 0.00 54.13 52.20 1odk s LEU 200 Cb -0.07 -0.58 -0.01 0.00 0.03 0.00 0.00 46.19 45.56 1odk s LEU 200 CO 0.00 -0.17 -0.14 0.00 0.23 0.00 0.00 176.35 176.28 1odk s ALA 201 N -2.54 2.56 -0.02 4.21 0.00 -0.11 -0.17 121.76 125.68 1odk s ALA 201 Ca 0.15 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 50.81 1odk s ALA 201 Cb -0.03 -1.24 -0.06 0.00 0.00 0.00 0.00 23.12 21.79 1odk s ALA 201 CO 0.04 0.05 1.59 0.08 0.00 0.00 0.00 175.76 177.52 1odk s VAL 202 N 0.68 3.50 -0.99 0.00 1.01 -0.06 -1.87 120.40 122.68 1odk s VAL 202 Ca -0.07 0.76 0.15 0.00 0.00 0.00 0.00 61.98 62.82 1odk s VAL 202 Cb -0.16 -3.49 -0.11 0.00 0.00 0.00 0.00 36.38 32.63 1odk s VAL 202 CO 0.02 -0.04 0.72 -1.54 0.00 0.00 0.00 175.10 174.26 1odk n SER 203 N 6.40 1.04 0.00 3.32 3.41 -0.32 0.02 113.62 127.50 1odk n SER 203 Ca 0.16 -1.02 0.00 0.00 -0.26 0.00 0.00 58.87 57.75 1odk n SER 203 Cb 0.42 0.81 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 1odk n SER 203 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1odk n ASN 204 N -0.92 0.00 -4.48 4.04 6.94 -1.24 -1.01 115.26 118.59 1odk n ASN 204 Ca 0.04 0.00 -0.33 0.00 -0.02 0.00 0.00 54.58 54.28 1odk n ASN 204 Cb 0.27 0.00 -0.13 0.00 -2.36 0.00 0.00 39.78 37.56 1odk n ASN 204 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1odk s ARG 205 N -1.88 2.49 0.07 -3.83 0.52 -1.26 0.24 118.95 115.31 1odk s ARG 205 Ca 0.00 -0.70 -0.36 0.00 -0.52 0.00 0.00 55.73 54.15 1odk s ARG 205 Cb 0.00 -2.38 -0.16 0.00 0.52 0.00 0.00 34.95 32.94 1odk s ARG 205 CO 0.00 0.62 1.46 -0.89 0.02 0.00 0.00 175.30 176.52 1odk n ILE 206 N 2.26 0.05 0.00 1.52 2.08 -0.70 -1.27 119.36 123.30 1odk n ILE 206 Ca -0.17 -0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.13 1odk n ILE 206 Cb 0.52 -1.11 0.00 0.00 -0.75 0.00 0.00 39.64 38.31 1odk n ILE 206 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1odk n GLY 207 N 2.99 3.03 3.73 7.39 0.00 -1.26 -4.61 105.19 116.46 1odk n GLY 207 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1odk n GLY 207 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1odk s ASP 208 N -1.24 6.85 0.43 1.61 -0.00 -0.40 -4.92 116.67 119.00 1odk s ASP 208 Ca 0.00 2.41 0.23 0.00 -0.00 0.00 0.00 52.55 55.19 1odk s ASP 208 Cb 0.00 -2.61 0.86 0.00 -0.00 0.00 0.00 42.92 41.18 1odk s ASP 208 CO 0.00 -0.58 1.80 1.55 -0.00 0.00 0.00 175.17 177.94 1odk h PRO 209 N 5.70 0.00 -4.80 8.23 0.13 -1.98 -3.46 132.00 135.83 1odk h PRO 209 Ca -0.44 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.41 1odk h PRO 209 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.20 1odk h PRO 209 CO 0.80 0.25 -0.68 -1.21 -0.23 0.00 0.00 178.00 176.92 1odk s GLU 210 N -3.63 1.02 0.73 0.86 2.02 -1.26 -5.16 118.70 113.28 1odk s GLU 210 Ca 0.01 -1.46 -0.10 0.00 0.02 0.00 0.00 54.97 53.43 1odk s GLU 210 Cb 0.10 -0.32 0.04 0.00 0.10 0.00 0.00 34.13 34.06 1odk s GLU 210 CO 0.65 -0.06 1.09 -0.51 0.02 0.00 0.00 175.26 176.45 1odk s LEU 211 N -3.13 2.79 1.09 1.80 1.43 -1.26 -4.89 118.68 116.49 1odk s LEU 211 Ca 0.19 0.88 -0.12 0.00 -1.03 0.00 0.00 54.13 54.05 1odk s LEU 211 Cb 0.05 -3.55 0.24 0.00 0.03 0.00 0.00 46.19 42.96 1odk s LEU 211 CO 0.01 -1.54 1.06 0.00 0.23 0.00 0.00 176.35 176.10 1odk s ALA 212 N -3.38 0.11 0.23 4.21 0.00 -0.18 -4.88 121.76 117.87 1odk s ALA 212 Ca 0.59 -0.00 -0.31 0.00 0.00 0.00 0.00 51.96 52.24 1odk s ALA 212 Cb -0.11 -3.27 -0.15 0.00 0.00 0.00 0.00 23.12 19.59 1odk s ALA 212 CO 0.49 -3.48 1.15 -2.30 0.00 0.00 0.00 175.76 171.62 1odk n PRO 213 N -4.68 1.40 -0.33 0.00 -0.02 -1.26 -4.67 135.00 125.44 1odk n PRO 213 Ca 0.05 0.50 0.19 0.00 -2.02 0.00 0.00 63.50 62.22 1odk n PRO 213 Cb 0.54 -1.97 0.44 0.00 -0.02 0.00 0.00 33.50 32.49 1odk n PRO 213 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1odk h PRO 214 N 2.97 0.50 0.43 0.52 0.13 -1.99 -0.76 132.00 133.81 1odk h PRO 214 Ca -0.42 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.66 1odk h PRO 214 Cb 1.33 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1odk h PRO 214 CO 0.67 0.33 -0.23 0.93 -0.23 0.00 0.00 178.00 179.47 1odk h GLU 215 N 0.52 -0.60 -0.21 0.86 3.07 -1.99 0.95 114.58 117.17 1odk h GLU 215 Ca 0.59 0.04 0.04 0.00 -0.50 0.00 0.00 59.36 59.53 1odk h GLU 215 Cb 1.29 0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 29.30 1odk h GLU 215 CO -0.35 -0.40 -0.01 0.28 -1.40 0.00 0.00 179.01 177.14 1odk h VAL 216 N -0.62 0.84 -0.49 3.13 2.07 -1.59 -1.84 116.25 117.74 1odk h VAL 216 Ca -0.05 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 1odk h VAL 216 Cb 0.49 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1odk h VAL 216 CO 0.08 0.01 0.22 0.25 0.02 0.00 0.00 177.57 178.15 1odk h LEU 217 N 0.06 0.66 -1.17 2.57 6.46 -1.08 -2.15 115.31 120.66 1odk h LEU 217 Ca 0.10 -0.15 -0.05 0.00 -0.12 0.00 0.00 57.88 57.66 1odk h LEU 217 Cb 0.13 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 39.87 1odk h LEU 217 CO -0.18 0.62 -0.01 -0.61 -0.62 0.00 0.00 178.44 177.64 1odk h GLN 218 N 0.66 0.56 -0.29 1.25 5.75 -0.59 -0.89 115.11 121.56 1odk h GLN 218 Ca 0.17 -0.13 -0.16 0.00 -0.15 0.00 0.00 58.65 58.39 1odk h GLN 218 Cb 0.15 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1odk h GLN 218 CO -0.02 0.59 -0.45 1.49 -2.65 0.00 0.00 178.83 177.79 1odk h GLU 219 N 0.53 0.74 -0.68 1.69 4.57 -1.13 -0.95 114.58 119.35 1odk h GLU 219 Ca 0.11 -0.41 -0.05 0.00 -1.18 0.00 0.00 59.36 57.83 1odk h GLU 219 Cb 0.36 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.95 1odk h GLU 219 CO 0.01 1.04 0.23 0.78 -1.18 0.00 0.00 179.01 179.89 1odk h GLY 220 N 0.91 1.13 1.00 1.92 0.00 -0.96 -1.36 103.07 105.71 1odk h GLY 220 Ca 0.04 -0.65 -0.03 0.00 0.00 0.00 0.00 47.33 46.68 1odk h GLY 220 CO 0.10 0.61 0.26 -2.08 0.00 0.00 0.00 176.54 175.42 1odk h VAL 221 N 0.99 1.23 -0.50 4.60 2.07 -0.98 -1.35 116.25 122.31 1odk h VAL 221 Ca 0.22 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1odk h VAL 221 Cb 0.27 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1odk h VAL 221 CO -0.01 0.28 0.24 -0.09 0.02 0.00 0.00 177.57 178.01 1odk h ARG 222 N 0.86 0.72 -0.45 1.57 2.43 -0.79 -1.71 114.38 117.01 1odk h ARG 222 Ca 0.21 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 1odk h ARG 222 Cb 0.19 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1odk h ARG 222 CO -0.02 0.60 0.22 0.00 -1.51 0.00 0.00 179.97 179.25 1odk h ARG 223 N 0.66 0.66 -0.67 0.20 3.08 -1.06 -1.89 114.38 115.35 1odk h ARG 223 Ca 0.17 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1odk h ARG 223 Cb 0.11 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 1odk h ARG 223 CO -0.02 0.56 0.39 1.98 -1.07 0.00 0.00 179.97 181.82 1odk h MET 224 N 0.59 0.92 -0.47 0.04 1.85 -1.07 -1.68 114.93 115.12 1odk h MET 224 Ca 0.16 -0.09 -0.09 0.00 -0.61 0.00 0.00 59.70 59.07 1odk h MET 224 Cb 0.13 -0.19 -0.02 0.00 0.43 0.00 0.00 31.60 31.95 1odk h MET 224 CO -0.02 0.67 -0.06 0.28 -0.40 0.00 0.00 176.91 177.38 1odk h VAL 225 N 0.92 1.27 -0.65 -5.77 2.07 -1.15 -1.20 116.25 111.73 1odk h VAL 225 Ca 0.24 -1.15 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 1odk h VAL 225 Cb -0.01 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1odk h VAL 225 CO -0.04 0.40 0.40 -0.08 0.02 0.00 0.00 177.57 178.27 1odk h GLU 226 N 0.71 0.88 -0.30 1.57 4.81 -1.18 0.63 114.58 121.70 1odk h GLU 226 Ca 0.12 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1odk h GLU 226 Cb 0.58 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 1odk h GLU 226 CO 0.03 0.62 0.14 0.28 -0.73 0.00 0.00 179.01 179.35 1odk h VAL 227 N 0.88 1.16 -0.47 0.32 2.07 -1.13 -1.88 116.25 117.20 1odk h VAL 227 Ca 0.23 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1odk h VAL 227 Cb -0.04 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1odk h VAL 227 CO -0.05 0.16 0.23 0.00 0.02 0.00 0.00 177.57 177.94 1odk h ALA 228 N 0.99 0.60 -0.29 1.67 0.00 -0.81 -0.11 119.26 121.31 1odk h ALA 228 Ca 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1odk h ALA 228 Cb 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1odk h ALA 228 CO -0.01 0.15 0.16 -0.07 0.00 0.00 0.00 179.25 179.48 1odk h LEU 229 N 0.61 0.37 -0.96 0.00 3.38 -0.80 -0.90 115.31 117.01 1odk h LEU 229 Ca 0.16 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1odk h LEU 229 Cb 0.10 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1odk h LEU 229 CO -0.02 0.35 0.55 -0.33 0.09 0.00 0.00 178.44 179.07 1odk h GLU 230 N 0.35 1.26 -0.31 1.13 4.39 -1.19 -3.04 114.58 117.18 1odk h GLU 230 Ca 0.10 -0.12 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 1odk h GLU 230 Cb 0.07 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 1odk h GLU 230 CO -0.02 0.89 0.03 0.00 -1.16 0.00 0.00 179.01 178.76 1odk h ALA 231 N 1.32 0.41 0.00 3.43 0.00 -0.55 -3.03 119.26 120.84 1odk h ALA 231 Ca 0.33 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1odk h ALA 231 Cb -0.04 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1odk h ALA 231 CO -0.06 0.12 -0.06 -0.39 0.00 0.00 0.00 179.25 178.86 1odk h VAL 232 N 0.33 0.32 0.00 0.00 -1.51 -1.07 -0.17 116.25 114.15 1odk h VAL 232 Ca 0.09 -0.39 -0.01 0.00 -1.23 0.00 0.00 66.70 65.17 1odk h VAL 232 Cb 0.37 1.28 -0.00 0.00 -2.13 0.00 0.00 31.29 30.82 1odk h VAL 232 CO 0.01 0.06 -0.04 -0.07 -1.23 0.00 0.00 177.57 176.30 1odk h LEU 233 N 0.00 0.00 -0.06 4.19 4.07 -1.44 -3.09 115.31 118.98 1odk h LEU 233 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1odk h LEU 233 Cb 0.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.02 1odk h LEU 233 CO 0.01 0.04 0.00 -0.62 -1.08 0.00 0.00 178.44 176.79 1odk n GLU 234 N -3.11 0.19 0.00 1.13 -0.58 -0.08 -5.14 120.64 113.05 1odk n GLU 234 Ca 0.03 0.19 0.00 0.00 -0.42 0.00 0.00 57.16 56.96 1odk n GLU 234 Cb 0.50 -1.74 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 1odk n GLU 234 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98