#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1odk s PRO 3 N 0.00 0.90 0.14 -1.46 0.02 -1.26 -4.96 135.00 128.39 1odk s PRO 3 Ca 0.00 1.47 -0.13 0.00 0.02 0.00 0.00 61.00 62.36 1odk s PRO 3 Cb 0.00 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.80 1odk s PRO 3 CO 0.00 -2.69 1.58 0.82 -0.33 0.00 0.00 177.00 176.38 1odk h ILE 4 N -1.91 1.27 0.00 2.83 2.04 -1.99 -3.37 117.51 116.37 1odk h ILE 4 Ca -0.45 -1.10 -0.29 0.00 1.00 0.00 0.00 64.86 64.02 1odk h ILE 4 Cb 1.27 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 38.37 1odk h ILE 4 CO 0.43 0.38 -1.96 1.41 0.00 0.00 0.00 178.15 178.41 1odk n HIS 5 N -4.34 0.00 -2.90 1.37 8.25 -1.26 -4.72 115.22 111.62 1odk n HIS 5 Ca 0.00 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.03 1odk n HIS 5 Cb 0.33 -0.80 -0.03 0.00 1.12 0.00 0.00 29.99 30.61 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 -2.64 4.57 -1.41 1.59 1.01 -1.26 -4.71 120.40 117.55 1odk s VAL 6 Ca -0.35 -1.11 -0.15 0.00 0.00 0.00 0.00 61.98 60.38 1odk s VAL 6 Cb 0.11 -4.74 0.05 0.00 0.00 0.00 0.00 36.38 31.80 1odk s VAL 6 CO 0.46 -1.48 2.08 0.54 0.00 0.00 0.00 175.10 176.70 1odk n ARG 7 N 6.99 2.96 -4.63 2.72 1.74 -1.26 -3.99 116.66 121.19 1odk n ARG 7 Ca 0.13 -2.81 -0.29 0.00 -0.77 0.00 0.00 57.85 54.11 1odk n ARG 7 Cb 0.47 -3.34 -0.10 0.00 -1.02 0.00 0.00 32.46 28.48 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 3.43 3.33 0.11 7.54 0.00 -1.26 -4.78 121.76 130.12 1odk s ALA 8 Ca 0.49 -1.68 0.07 0.00 0.00 0.00 0.00 51.96 50.83 1odk s ALA 8 Cb 0.11 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 1odk s ALA 8 CO -0.04 -0.13 -0.07 -1.58 0.00 0.00 0.00 175.76 173.94 1odk s HIS 9 N -2.85 2.79 0.35 0.00 2.46 -1.26 -4.31 115.29 112.47 1odk s HIS 9 Ca 0.26 -0.13 0.12 0.00 0.47 0.00 0.00 55.06 55.78 1odk s HIS 9 Cb 0.07 -1.44 0.92 0.00 -0.13 0.00 0.00 32.58 32.00 1odk s HIS 9 CO 0.13 0.45 1.77 -1.35 -2.47 0.00 0.00 174.74 173.27 1odk h PRO 10 N 3.48 0.55 0.00 2.88 0.11 -1.95 0.22 132.00 137.30 1odk h PRO 10 Ca -0.48 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 1odk h PRO 10 Cb 1.17 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1odk h PRO 10 CO 0.54 0.37 -0.06 0.78 -0.21 0.00 0.00 178.00 179.42 1odk h GLY 11 N 0.57 0.00 1.93 -0.55 0.00 -1.95 -2.85 103.07 100.22 1odk h GLY 11 Ca 0.59 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.75 1odk h GLY 11 CO -0.36 0.00 -0.77 -0.55 0.00 0.00 0.00 176.54 174.86 1odk h ASP 12 N 0.00 0.08 -3.49 0.19 3.32 -0.94 -3.45 116.42 112.14 1odk h ASP 12 Ca -0.00 -0.06 -0.61 0.00 0.02 0.00 0.00 57.03 56.38 1odk h ASP 12 Cb 0.26 -0.02 -0.14 0.00 0.22 0.00 0.00 39.33 39.65 1odk h ASP 12 CO 0.01 0.82 -0.48 -0.69 -1.72 0.00 0.00 179.24 177.18 1odk s VAL 13 N -3.31 5.36 0.84 -1.35 1.01 -1.08 -4.73 120.40 117.15 1odk s VAL 13 Ca -0.01 0.22 -0.12 0.00 0.00 0.00 0.00 61.98 62.07 1odk s VAL 13 Cb 0.11 -3.51 0.09 0.00 0.00 0.00 0.00 36.38 33.08 1odk s VAL 13 CO 0.79 0.37 1.13 0.00 0.00 0.00 0.00 175.10 177.39 1odk s ALA 14 N 0.87 2.21 0.30 5.51 0.00 -1.26 -4.81 121.76 124.59 1odk s ALA 14 Ca 0.09 -0.45 0.07 0.00 0.00 0.00 0.00 51.96 51.67 1odk s ALA 14 Cb -0.13 -3.04 0.48 0.00 0.00 0.00 0.00 23.12 20.44 1odk s ALA 14 CO 0.03 -1.88 1.71 0.93 0.00 0.00 0.00 175.76 176.56 1odk h GLU 15 N -1.20 0.20 -5.17 0.00 5.08 -1.82 -3.40 114.58 108.27 1odk h GLU 15 Ca -0.48 -0.09 -0.62 0.00 -1.00 0.00 0.00 59.36 57.17 1odk h GLU 15 Cb 1.31 -0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.39 1odk h GLU 15 CO 0.62 0.58 -0.55 1.03 -1.00 0.00 0.00 179.01 179.70 1odk s ARG 16 N -4.13 3.97 -0.01 2.33 0.52 -1.26 -0.56 118.95 119.82 1odk s ARG 16 Ca -0.04 -0.33 0.02 0.00 -0.52 0.00 0.00 55.73 54.85 1odk s ARG 16 Cb 0.13 -3.35 0.00 0.00 0.52 0.00 0.00 34.95 32.26 1odk s ARG 16 CO 0.77 0.14 -0.05 0.08 0.02 0.00 0.00 175.30 176.25 1odk s VAL 17 N 0.77 0.45 -0.08 3.52 1.01 0.62 -0.98 120.40 125.71 1odk s VAL 17 Ca 0.05 -0.22 -0.04 0.00 0.00 0.00 0.00 61.98 61.78 1odk s VAL 17 Cb -0.13 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.81 1odk s VAL 17 CO 0.02 0.14 0.09 -0.76 0.00 0.00 0.00 175.10 174.59 1odk s LEU 18 N 0.04 4.03 -0.63 3.92 1.43 0.03 -1.11 118.68 126.40 1odk s LEU 18 Ca -0.00 0.30 0.04 0.00 -1.03 0.00 0.00 54.13 53.44 1odk s LEU 18 Cb -0.04 -2.05 0.15 0.00 0.03 0.00 0.00 46.19 44.28 1odk s LEU 18 CO -0.00 0.37 0.40 -0.76 0.23 0.00 0.00 176.35 176.59 1odk s LEU 19 N -1.16 4.66 0.52 1.79 1.43 0.10 -1.19 118.68 124.83 1odk s LEU 19 Ca 0.17 -3.44 -0.12 0.00 -1.03 0.00 0.00 54.13 49.71 1odk s LEU 19 Cb -0.12 -1.66 -0.06 0.00 0.03 0.00 0.00 46.19 44.38 1odk s LEU 19 CO 0.06 -0.17 0.92 -2.16 0.23 0.00 0.00 176.35 175.24 1odk s PRO 20 N -0.88 3.76 -0.04 1.29 0.04 -1.20 -2.23 135.00 135.74 1odk s PRO 20 Ca 0.21 0.69 0.05 0.00 0.04 0.00 0.00 61.00 61.99 1odk s PRO 20 Cb -0.15 -2.21 -0.24 0.00 0.04 0.00 0.00 34.50 31.94 1odk s PRO 20 CO -0.08 -0.30 0.69 0.78 0.04 0.00 0.00 177.00 178.13 1odk h GLY 21 N 0.55 0.12 -6.53 0.56 0.00 -1.83 -1.21 103.07 94.73 1odk h GLY 21 Ca -0.46 -0.31 -0.61 0.00 0.00 0.00 0.00 47.33 45.95 1odk h GLY 21 CO 0.62 0.27 -0.16 -0.35 0.00 0.00 0.00 176.54 176.92 1odk s ASP 22 N -6.52 6.43 0.46 0.19 2.15 -1.26 -2.07 116.67 116.05 1odk s ASP 22 Ca -0.09 0.51 0.13 0.00 0.43 0.00 0.00 52.55 53.53 1odk s ASP 22 Cb 0.08 -2.24 1.06 0.00 -0.30 0.00 0.00 42.92 41.51 1odk s ASP 22 CO 0.82 -0.13 2.06 1.55 -0.17 0.00 0.00 175.17 179.30 1odk h PRO 23 N 7.56 0.31 -0.20 4.34 0.13 -1.89 -0.44 132.00 141.81 1odk h PRO 23 Ca -0.34 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.68 1odk h PRO 23 Cb 1.16 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1odk h PRO 23 CO 0.71 0.21 -0.25 0.78 -0.23 0.00 0.00 178.00 179.22 1odk h GLY 24 N 0.32 0.41 1.72 1.56 0.00 -1.95 -1.47 103.07 103.67 1odk h GLY 24 Ca 0.15 -0.32 -0.19 0.00 0.00 0.00 0.00 47.33 46.97 1odk h GLY 24 CO -0.03 0.30 -0.82 -0.09 0.00 0.00 0.00 176.54 175.90 1odk h ARG 25 N 0.34 0.26 -0.45 4.80 2.43 -1.54 -2.05 114.38 118.17 1odk h ARG 25 Ca 0.05 -0.25 -0.03 0.00 -0.81 0.00 0.00 59.98 58.95 1odk h ARG 25 Cb 0.62 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 1odk h ARG 25 CO 0.04 0.94 0.18 0.00 -1.51 0.00 0.00 179.97 179.62 1odk h ALA 26 N 0.98 0.58 -0.13 2.80 0.00 -0.81 -0.29 119.26 122.39 1odk h ALA 26 Ca -0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1odk h ALA 26 Cb 1.42 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1odk h ALA 26 CO 0.13 0.18 0.07 1.49 0.00 0.00 0.00 179.25 181.12 1odk h GLU 27 N 0.58 0.19 -0.61 0.00 4.81 -1.22 -1.43 114.58 116.90 1odk h GLU 27 Ca 0.15 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.39 1odk h GLU 27 Cb 0.19 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 1odk h GLU 27 CO -0.01 0.23 0.35 2.35 -0.73 0.00 0.00 179.01 181.20 1odk h TRP 28 N 0.10 0.66 -0.20 0.92 7.01 -1.18 -0.83 115.95 122.43 1odk h TRP 28 Ca 0.05 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.07 1odk h TRP 28 Cb 0.09 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 26.94 1odk h TRP 28 CO -0.04 0.35 0.12 0.82 -2.79 0.00 0.00 178.44 176.91 1odk h ILE 29 N 0.68 1.08 0.19 2.65 2.04 -0.87 0.55 117.51 123.83 1odk h ILE 29 Ca 0.25 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.92 1odk h ILE 29 Cb 0.08 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1odk h ILE 29 CO -0.13 0.08 -0.19 0.00 0.00 0.00 0.00 178.15 177.91 1odk h ALA 30 N 1.03 -0.39 0.00 1.87 0.00 -0.81 -0.21 119.26 120.76 1odk h ALA 30 Ca 0.07 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1odk h ALA 30 Cb 0.02 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1odk h ALA 30 CO -0.01 -0.74 -0.23 0.87 0.00 0.00 0.00 179.25 179.13 1odk h LYS 31 N -0.41 0.00 0.13 0.00 1.57 -1.10 -1.01 116.57 115.74 1odk h LYS 31 Ca 0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 1odk h LYS 31 Cb 0.39 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1odk h LYS 31 CO -0.05 0.23 -1.87 1.15 -0.57 0.00 0.00 179.45 178.34 1odk h THR 32 N 0.00 0.77 0.00 -0.16 2.02 -0.65 -3.42 112.91 111.47 1odk h THR 32 Ca -0.00 -2.46 -0.02 0.00 0.77 0.00 0.00 66.41 64.69 1odk h THR 32 Cb 0.69 2.58 -0.00 0.00 -1.74 0.00 0.00 68.15 69.68 1odk h THR 32 CO 0.03 0.84 -1.55 0.49 0.37 0.00 0.00 175.52 175.70 1odk n PHE 33 N -3.46 0.00 -3.78 3.16 3.01 -0.11 -5.03 117.46 111.24 1odk n PHE 33 Ca -0.27 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 57.84 1odk n PHE 33 Cb 1.06 -0.30 -0.05 0.00 -0.01 0.00 0.00 39.48 40.18 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 -3.93 4.37 -0.10 4.37 1.43 -0.38 -4.76 118.68 119.68 1odk s LEU 34 Ca -0.04 0.53 -0.19 0.00 -1.03 0.00 0.00 54.13 53.40 1odk s LEU 34 Cb 0.07 -2.64 -0.04 0.00 0.03 0.00 0.00 46.19 43.61 1odk s LEU 34 CO 0.47 0.26 0.50 -1.58 0.23 0.00 0.00 176.35 176.24 1odk s GLN 35 N -1.74 4.33 -1.36 1.70 0.74 -0.24 -4.21 119.66 118.89 1odk s GLN 35 Ca 0.27 0.50 -0.06 0.00 0.05 0.00 0.00 55.36 56.12 1odk s GLN 35 Cb -0.13 -3.42 0.03 0.00 1.10 0.00 0.00 33.01 30.58 1odk s GLN 35 CO 0.16 0.18 0.97 -1.71 -0.55 0.00 0.00 175.29 174.34 1odk n ASN 36 N 3.56 -3.70 -4.77 6.67 5.15 -1.26 -1.63 115.26 119.27 1odk n ASN 36 Ca -0.07 -0.69 -0.41 0.00 -0.60 0.00 0.00 54.58 52.82 1odk n ASN 36 Cb 0.52 -4.51 -0.02 0.00 -0.53 0.00 0.00 39.78 35.24 1odk n ASN 36 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1odk s PRO 37 N -6.10 4.31 -0.01 1.20 0.04 -1.26 -4.61 135.00 128.57 1odk s PRO 37 Ca 0.33 2.24 0.02 0.00 0.04 0.00 0.00 61.00 63.63 1odk s PRO 37 Cb -0.16 -3.04 -0.00 0.00 0.04 0.00 0.00 34.50 31.34 1odk s PRO 37 CO 0.78 -0.23 -0.07 1.03 0.04 0.00 0.00 177.00 178.55 1odk s ARG 38 N -1.85 0.58 -0.30 4.56 1.81 -0.28 -4.95 118.95 118.52 1odk s ARG 38 Ca 0.50 -0.25 -0.20 0.00 -1.72 0.00 0.00 55.73 54.06 1odk s ARG 38 Cb -0.40 -0.57 -0.01 0.00 -0.45 0.00 0.00 34.95 33.52 1odk s ARG 38 CO 0.53 0.14 0.62 0.50 -0.68 0.00 0.00 175.30 176.42 1odk s ARG 39 N -0.13 3.90 0.01 3.54 3.52 -1.26 -1.14 118.95 127.38 1odk s ARG 39 Ca 0.02 0.28 0.23 0.00 -0.13 0.00 0.00 55.73 56.13 1odk s ARG 39 Cb -0.03 -3.73 0.14 0.00 -1.56 0.00 0.00 34.95 29.78 1odk s ARG 39 CO -0.00 -0.56 1.15 2.48 -0.81 0.00 0.00 175.30 177.56 1odk n TYR 40 N 5.85 0.04 -3.69 5.12 0.18 -0.08 -4.94 117.16 119.65 1odk n TYR 40 Ca -0.01 0.01 -0.13 0.00 1.88 0.00 0.00 57.90 59.65 1odk n TYR 40 Cb 0.49 -0.18 -0.09 0.00 -0.38 0.00 0.00 39.34 39.18 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 -3.15 -0.55 0.00 9.48 2.47 -1.21 -4.68 114.94 117.30 1odk s ASN 41 Ca 0.09 1.06 0.00 0.00 0.42 0.00 0.00 52.86 54.43 1odk s ASN 41 Cb 0.16 1.07 0.00 0.00 -1.45 0.00 0.00 41.25 41.04 1odk s ASN 41 CO 0.78 -0.18 0.25 -0.90 -3.72 0.00 0.00 177.10 173.33 1odk n ASP 42 N 2.84 0.10 -4.76 -4.21 3.85 -1.26 -1.86 116.55 111.25 1odk n ASP 42 Ca -0.14 -1.03 -0.41 0.00 -0.71 0.00 0.00 54.79 52.50 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 -2.28 -1.01 0.00 0.00 177.20 173.91 1odk s HIS 43 N -0.03 2.80 -1.98 2.11 2.46 -1.26 -1.81 115.29 117.58 1odk s HIS 43 Ca 0.00 1.06 0.00 0.00 0.47 0.00 0.00 55.06 56.59 1odk s HIS 43 Cb 0.00 -3.94 0.00 0.00 -0.13 0.00 0.00 32.58 28.51 1odk s HIS 43 CO 0.00 -2.93 0.00 0.54 -2.47 0.00 0.00 174.74 169.88 1odk n ARG 44 N 1.42 -1.43 -0.90 2.88 1.74 -1.26 -1.75 116.66 117.37 1odk n ARG 44 Ca 0.04 1.10 0.00 0.00 -0.77 0.00 0.00 57.85 58.22 1odk n ARG 44 Cb 0.39 -5.46 0.00 0.00 -1.02 0.00 0.00 32.46 26.37 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 -0.37 0.42 2.62 -0.13 0.00 -0.75 -4.90 105.19 102.08 1odk n GLY 45 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 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 7.44 -4.67 0.99 4.77 -0.71 -4.75 117.00 120.06 1odk n LEU 46 Ca 0.00 -4.37 -0.46 0.00 -0.03 0.00 0.00 56.01 51.14 1odk n LEU 46 Cb 0.11 -1.57 -0.04 0.00 -2.33 0.00 0.00 43.42 39.59 1odk n LEU 46 CO 0.00 1.51 1.30 0.79 -1.33 0.00 0.00 177.39 179.66 1odk n TRP 47 N 4.58 2.33 -4.59 -1.77 7.02 -1.25 -4.47 117.44 119.29 1odk n TRP 47 Ca 0.57 0.15 -0.23 0.00 -1.02 0.00 0.00 57.50 56.98 1odk n TRP 47 Cb 0.33 -2.60 -0.16 0.00 -2.42 0.00 0.00 31.31 26.47 1odk n TRP 47 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1odk s GLY 48 N 1.93 0.72 0.15 6.99 0.00 -0.78 -1.42 107.32 114.92 1odk s GLY 48 Ca 0.83 -0.48 0.07 0.00 0.00 0.00 0.00 44.72 45.13 1odk s GLY 48 CO 0.41 -0.17 -0.15 -0.19 0.00 0.00 0.00 173.10 173.01 1odk s TYR 49 N 0.19 1.55 -0.01 1.90 1.51 0.57 -0.90 117.35 122.16 1odk s TYR 49 Ca -0.05 -0.57 0.00 0.00 -1.01 0.00 0.00 57.07 55.45 1odk s TYR 49 Cb -0.11 -0.77 0.01 0.00 -0.11 0.00 0.00 41.96 40.98 1odk s TYR 49 CO 0.01 0.23 0.00 0.99 -1.11 0.00 0.00 175.55 175.67 1odk s THR 50 N -2.46 0.08 0.00 -0.71 2.01 -0.29 0.42 115.64 114.68 1odk s THR 50 Ca 0.15 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.19 1odk s THR 50 Cb -0.03 -0.13 0.00 0.00 0.01 0.00 0.00 72.50 72.35 1odk s THR 50 CO 0.04 0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.65 1odk n GLY 51 N 3.55 2.35 3.48 4.40 0.00 -0.48 -1.13 105.19 117.36 1odk n GLY 51 Ca -0.19 -0.98 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 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 2.91 -0.25 0.99 1.43 -0.65 -0.67 118.68 122.44 1odk s LEU 52 Ca 0.00 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.93 1odk s LEU 52 Cb 0.00 -1.64 0.05 0.00 0.03 0.00 0.00 46.19 44.63 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 3.16 -1.47 0.29 5.04 0.13 -1.08 117.35 123.13 1odk s TYR 53 Ca 0.03 -2.05 -0.07 0.00 -2.44 0.00 0.00 57.07 52.54 1odk s TYR 53 Cb -0.13 -1.97 0.05 0.00 0.35 0.00 0.00 41.96 40.27 1odk s TYR 53 CO 0.03 -0.84 0.72 1.63 -1.34 0.00 0.00 175.55 175.75 1odk n LYS 54 N 4.52 -4.35 -0.66 4.97 5.02 -1.26 -1.06 118.16 125.34 1odk n LYS 54 Ca -0.15 0.51 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1odk n LYS 54 Cb 0.44 -5.08 0.00 0.00 -0.02 0.00 0.00 35.03 30.37 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 -1.69 1.63 3.59 0.72 0.00 -1.26 -5.02 105.19 103.16 1odk n GLY 55 Ca -0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 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 -3.61 4.13 0.20 1.61 1.01 -0.22 -5.04 120.40 118.48 1odk s VAL 56 Ca 0.00 -0.30 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1odk s VAL 56 Cb 0.00 -2.77 -0.09 0.00 0.00 0.00 0.00 36.38 33.52 1odk s VAL 56 CO 0.00 0.55 1.41 -2.84 0.00 0.00 0.00 175.10 174.21 1odk s PRO 57 N -0.27 4.31 -0.03 2.72 0.02 -1.26 0.22 135.00 140.71 1odk s PRO 57 Ca 0.05 2.19 -0.01 0.00 0.02 0.00 0.00 61.00 63.25 1odk s PRO 57 Cb -0.12 -3.16 0.02 0.00 0.02 0.00 0.00 34.50 31.25 1odk s PRO 57 CO 0.02 -0.39 0.06 0.08 -0.33 0.00 0.00 177.00 176.44 1odk s VAL 58 N 0.37 -0.03 0.15 3.83 1.01 0.16 -4.39 120.40 121.49 1odk s VAL 58 Ca 0.61 0.12 0.05 0.00 0.00 0.00 0.00 61.98 62.75 1odk s VAL 58 Cb -0.40 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 1odk s VAL 58 CO 0.38 0.05 0.13 -0.44 0.00 0.00 0.00 175.10 175.22 1odk s SER 59 N 0.64 5.54 -0.23 3.32 0.01 -0.15 -1.39 113.70 121.45 1odk s SER 59 Ca -0.05 -0.10 -0.01 0.00 1.31 0.00 0.00 55.95 57.09 1odk s SER 59 Cb -0.07 -1.46 0.07 0.00 0.21 0.00 0.00 66.02 64.76 1odk s SER 59 CO -0.02 0.08 0.02 -0.69 0.41 0.00 0.00 173.24 173.04 1odk s VAL 60 N -1.70 0.94 -0.14 3.43 1.01 0.17 -0.79 120.40 123.32 1odk s VAL 60 Ca 0.31 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1odk s VAL 60 Cb -0.10 -1.42 -0.00 0.00 0.00 0.00 0.00 36.38 34.86 1odk s VAL 60 CO 0.23 -0.26 -0.17 -1.58 0.00 0.00 0.00 175.10 173.33 1odk s GLN 61 N 1.65 3.22 0.19 2.72 2.00 -0.33 -0.31 119.66 128.79 1odk s GLN 61 Ca -0.01 -0.76 -0.30 0.00 -2.00 0.00 0.00 55.36 52.29 1odk s GLN 61 Cb -0.18 -2.56 -0.09 0.00 0.80 0.00 0.00 33.01 30.98 1odk s GLN 61 CO -0.10 0.09 1.36 0.99 -0.50 0.00 0.00 175.29 177.13 1odk s THR 62 N 0.63 3.09 -0.12 -0.34 2.01 -0.51 -3.24 115.64 117.16 1odk s THR 62 Ca -0.09 0.87 0.17 0.00 0.31 0.00 0.00 61.69 62.96 1odk s THR 62 Cb -0.16 -3.56 -0.25 0.00 0.01 0.00 0.00 72.50 68.54 1odk s THR 62 CO 0.03 0.12 0.21 0.35 -0.69 0.00 0.00 174.62 174.63 1odk n THR 63 N 2.86 0.74 -2.00 -0.82 -2.24 -0.46 -4.77 114.28 107.59 1odk n THR 63 Ca 0.08 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 1odk n THR 63 Cb 0.42 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 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 1.70 -2.10 3.62 3.38 0.00 -0.88 -3.47 105.19 107.44 1odk n GLY 64 Ca -0.19 -1.71 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.14 3.50 0.00 1.61 -1.94 -1.26 -4.65 119.30 116.42 1odk s MET 65 Ca 0.00 -0.41 0.00 0.00 -1.71 0.00 0.00 55.69 53.57 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 0.44 0.00 0.41 -0.01 0.00 0.00 175.02 175.86 1odk n GLY 66 N 2.96 2.22 0.23 -0.03 0.00 -1.23 -4.51 105.19 104.83 1odk n GLY 66 Ca -0.18 -1.74 0.06 0.00 0.00 0.00 0.00 46.02 44.17 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 1.06 -0.48 2.61 1.35 -1.57 -1.63 112.91 114.26 1odk h THR 67 Ca 0.00 -0.64 -0.04 0.00 -0.55 0.00 0.00 66.41 65.18 1odk h THR 67 Cb 0.00 1.35 -0.02 0.00 -1.73 0.00 0.00 68.15 67.75 1odk h THR 67 CO 0.00 0.18 0.15 -0.65 -0.25 0.00 0.00 175.52 174.95 1odk h PRO 68 N 0.00 0.74 -0.16 4.72 0.11 -1.89 0.20 132.00 135.72 1odk h PRO 68 Ca -0.00 -0.16 -0.05 0.00 0.11 0.00 0.00 66.00 65.90 1odk h PRO 68 Cb 0.34 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.34 1odk h PRO 68 CO 0.02 0.70 -0.08 1.03 -0.21 0.00 0.00 178.00 179.46 1odk h SER 69 N 0.63 0.35 -0.64 -2.05 0.87 -1.74 -2.67 113.55 108.31 1odk h SER 69 Ca 0.15 -0.41 -0.04 0.00 -1.23 0.00 0.00 61.79 60.26 1odk h SER 69 Cb 0.27 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 1odk h SER 69 CO -0.01 0.69 0.27 0.00 -0.53 0.00 0.00 176.83 177.25 1odk h ALA 70 N 0.68 1.22 -0.56 6.23 0.00 -1.22 -1.95 119.26 123.66 1odk h ALA 70 Ca 0.04 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1odk h ALA 70 Cb 0.55 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1odk h ALA 70 CO 0.02 0.57 0.13 0.00 0.00 0.00 0.00 179.25 179.97 1odk h ALA 71 N 1.33 0.74 -0.21 0.00 0.00 -0.56 0.16 119.26 120.73 1odk h ALA 71 Ca 0.23 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1odk h ALA 71 Cb 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1odk h ALA 71 CO -0.02 0.45 0.13 0.82 0.00 0.00 0.00 179.25 180.63 1odk h ILE 72 N 0.80 1.07 -0.35 0.00 2.04 -1.19 0.27 117.51 120.15 1odk h ILE 72 Ca 0.18 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1odk h ILE 72 Cb 0.36 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1odk h ILE 72 CO 0.00 0.07 0.16 0.58 0.00 0.00 0.00 178.15 178.96 1odk h VAL 73 N 0.26 1.17 -0.52 1.67 2.07 -1.07 -1.91 116.25 117.92 1odk h VAL 73 Ca 0.07 -0.50 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 1odk h VAL 73 Cb -0.00 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1odk h VAL 73 CO -0.01 0.18 0.06 0.58 0.02 0.00 0.00 177.57 178.40 1odk h VAL 74 N 0.43 1.26 -0.39 2.57 2.07 -0.54 -0.21 116.25 121.44 1odk h VAL 74 Ca 0.12 -0.99 0.02 0.00 0.82 0.00 0.00 66.70 66.67 1odk h VAL 74 Cb 0.14 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1odk h VAL 74 CO -0.01 0.35 0.22 -0.33 0.02 0.00 0.00 177.57 177.82 1odk h GLU 75 N 0.75 0.44 -0.46 1.57 4.39 -0.84 -0.73 114.58 119.69 1odk h GLU 75 Ca 0.15 -0.03 -0.12 0.00 0.34 0.00 0.00 59.36 59.71 1odk h GLU 75 Cb 0.44 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 1odk h GLU 75 CO 0.01 0.29 -0.18 0.93 -1.16 0.00 0.00 179.01 178.90 1odk h GLU 76 N 0.45 0.89 -0.79 2.33 5.08 -1.18 -2.04 114.58 119.32 1odk h GLU 76 Ca 0.15 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 1odk h GLU 76 Cb 0.02 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 1odk h GLU 76 CO -0.08 0.99 0.29 -0.07 -1.00 0.00 0.00 179.01 179.14 1odk h LEU 77 N 0.78 1.11 -0.64 1.33 3.38 -0.74 -1.27 115.31 119.25 1odk h LEU 77 Ca 0.11 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1odk h LEU 77 Cb 0.72 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1odk h LEU 77 CO 0.05 0.99 0.23 0.58 0.09 0.00 0.00 178.44 180.39 1odk h VAL 78 N 1.15 1.24 0.00 1.22 2.07 -0.93 -0.88 116.25 120.12 1odk h VAL 78 Ca 0.26 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 1odk h VAL 78 Cb 0.25 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1odk h VAL 78 CO -0.02 0.31 -0.09 -0.09 0.02 0.00 0.00 177.57 177.70 1odk h ARG 79 N 0.91 0.00 -0.15 1.57 9.65 -0.94 -1.42 114.38 124.00 1odk h ARG 79 Ca 0.21 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.09 1odk h ARG 79 Cb 0.25 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.83 1odk h ARG 79 CO -0.01 0.09 0.00 1.28 2.80 0.00 0.00 179.97 184.13 1odk n LEU 80 N -3.43 1.73 0.00 3.80 4.77 -0.52 -4.93 117.00 118.42 1odk n LEU 80 Ca -0.01 -0.70 0.00 0.00 -0.03 0.00 0.00 56.01 55.27 1odk n LEU 80 Cb 0.24 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1odk n LEU 80 CO 0.28 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1odk n GLY 81 N 1.16 0.69 3.74 -0.72 0.00 -0.54 -4.56 105.19 104.96 1odk n GLY 81 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 3.72 -0.06 4.61 0.00 -0.45 -4.60 121.76 122.98 1odk s ALA 82 Ca 0.00 1.42 0.04 0.00 0.00 0.00 0.00 51.96 53.42 1odk s ALA 82 Cb 0.00 -3.61 -0.07 0.00 0.00 0.00 0.00 23.12 19.45 1odk s ALA 82 CO 0.00 -0.83 0.00 -2.13 0.00 0.00 0.00 175.76 172.80 1odk n ARG 83 N 2.81 2.43 -3.93 0.00 0.63 0.19 -4.60 116.66 114.19 1odk n ARG 83 Ca 0.09 0.01 -0.28 0.00 -0.92 0.00 0.00 57.85 56.75 1odk n ARG 83 Cb 0.39 -1.15 -0.17 0.00 0.45 0.00 0.00 32.46 31.98 1odk n ARG 83 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1odk s VAL 84 N -2.15 1.22 -0.14 5.15 1.01 0.28 -1.07 120.40 124.71 1odk s VAL 84 Ca -0.04 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.35 1odk s VAL 84 Cb 0.02 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 35.12 1odk s VAL 84 CO 0.23 0.25 -0.11 -0.76 0.00 0.00 0.00 175.10 174.70 1odk s LEU 85 N 1.60 1.56 -0.21 3.92 1.02 0.37 -0.27 118.68 126.67 1odk s LEU 85 Ca 0.02 -0.46 0.00 0.00 0.02 0.00 0.00 54.13 53.71 1odk s LEU 85 Cb -0.14 -1.06 0.02 0.00 0.02 0.00 0.00 46.19 45.03 1odk s LEU 85 CO -0.08 -0.09 -0.15 -0.69 0.02 0.00 0.00 176.35 175.36 1odk s VAL 86 N 1.56 2.35 0.22 -1.59 1.01 -0.26 -1.86 120.40 121.83 1odk s VAL 86 Ca 0.04 -1.00 -0.30 0.00 0.00 0.00 0.00 61.98 60.72 1odk s VAL 86 Cb -0.13 -2.09 -0.09 0.00 0.00 0.00 0.00 36.38 34.07 1odk s VAL 86 CO -0.10 0.39 1.09 -0.60 0.00 0.00 0.00 175.10 175.89 1odk s ARG 87 N 1.29 4.63 -0.07 2.72 3.52 -0.17 0.00 118.95 130.87 1odk s ARG 87 Ca 0.02 1.74 0.01 0.00 -0.13 0.00 0.00 55.73 57.38 1odk s ARG 87 Cb -0.15 -3.24 0.02 0.00 -1.56 0.00 0.00 34.95 30.02 1odk s ARG 87 CO -0.09 0.16 -0.10 0.14 -0.81 0.00 0.00 175.30 174.60 1odk s VAL 88 N -0.68 0.99 0.00 7.11 -7.23 -0.95 -1.89 120.40 117.75 1odk s VAL 88 Ca 0.47 -0.36 0.00 0.00 -1.81 0.00 0.00 61.98 60.28 1odk s VAL 88 Cb -0.30 -0.95 0.00 0.00 0.56 0.00 0.00 36.38 35.69 1odk s VAL 88 CO 0.37 0.33 0.00 0.61 -0.31 0.00 0.00 175.10 176.11 1odk n GLY 89 N 4.15 1.38 3.75 2.32 0.00 -1.17 -3.93 105.19 111.68 1odk n GLY 89 Ca -0.20 -0.77 -0.22 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.42 3.99 0.04 2.61 -4.23 -1.26 -0.48 115.64 113.89 1odk s THR 90 Ca 0.00 -1.63 -0.06 0.00 -1.18 0.00 0.00 61.69 58.82 1odk s THR 90 Cb 0.00 -3.15 -0.01 0.00 1.34 0.00 0.00 72.50 70.68 1odk s THR 90 CO 0.00 -0.36 0.12 0.00 -0.54 0.00 0.00 174.62 173.84 1odk s ALA 91 N -2.22 -0.15 -0.32 3.99 0.00 -0.77 -4.80 121.76 117.49 1odk s ALA 91 Ca 0.32 -0.47 -0.12 0.00 0.00 0.00 0.00 51.96 51.69 1odk s ALA 91 Cb -0.07 0.25 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 1odk s ALA 91 CO 0.23 -0.32 0.23 0.20 0.00 0.00 0.00 175.76 176.10 1odk s GLY 92 N -2.08 1.95 0.34 0.00 0.00 0.13 -1.82 107.32 105.83 1odk s GLY 92 Ca -0.05 -1.24 -0.29 0.00 0.00 0.00 0.00 44.72 43.13 1odk s GLY 92 CO -0.04 0.75 1.51 0.00 0.00 0.00 0.00 173.10 175.32 1odk s ALA 93 N 1.77 3.64 -0.15 3.20 0.00 0.25 -0.11 121.76 130.36 1odk s ALA 93 Ca 0.07 1.55 0.19 0.00 0.00 0.00 0.00 51.96 53.77 1odk s ALA 93 Cb -0.17 -3.61 -0.28 0.00 0.00 0.00 0.00 23.12 19.06 1odk s ALA 93 CO 0.11 -0.99 0.20 0.00 0.00 0.00 0.00 175.76 175.07 1odk n ALA 94 N 1.21 1.91 -2.95 0.00 0.00 -0.57 -1.69 120.51 118.42 1odk n ALA 94 Ca 0.04 -1.08 -0.21 0.00 0.00 0.00 0.00 53.44 52.19 1odk n ALA 94 Cb 0.39 -0.36 -0.02 0.00 0.00 0.00 0.00 19.45 19.46 1odk n ALA 94 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1odk s SER 95 N -5.18 6.26 0.33 0.00 1.04 -1.24 -4.14 113.70 110.77 1odk s SER 95 Ca -0.09 0.04 0.23 0.00 0.48 0.00 0.00 55.95 56.61 1odk s SER 95 Cb 0.08 -1.82 0.22 0.00 0.10 0.00 0.00 66.02 64.61 1odk s SER 95 CO 0.85 -0.07 1.38 0.77 0.98 0.00 0.00 173.24 177.15 1odk h SER 96 N 1.19 0.00 0.00 7.02 4.64 -1.95 -3.30 113.55 121.15 1odk h SER 96 Ca -0.52 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 1odk h SER 96 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1odk h SER 96 CO 0.61 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.67 1odk n ASP 97 N -2.87 0.00 -4.49 4.97 3.85 -1.26 -4.69 116.55 112.06 1odk n ASP 97 Ca 0.02 -1.16 -0.36 0.00 -0.71 0.00 0.00 54.79 52.59 1odk n ASP 97 Cb 0.53 0.00 -0.12 0.00 -1.35 0.00 0.00 41.12 40.18 1odk n ASP 97 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1odk s LEU 98 N -1.61 3.50 0.21 -2.12 1.43 -1.25 -5.10 118.68 113.75 1odk s LEU 98 Ca 0.25 -0.14 -0.01 0.00 -1.03 0.00 0.00 54.13 53.20 1odk s LEU 98 Cb 0.11 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1odk s LEU 98 CO 0.19 0.02 0.40 0.00 0.23 0.00 0.00 176.35 177.19 1odk s ALA 99 N 1.27 3.82 0.39 4.21 0.00 -1.26 -4.98 121.76 125.21 1odk s ALA 99 Ca 0.05 -0.84 -0.28 0.00 0.00 0.00 0.00 51.96 50.89 1odk s ALA 99 Cb -0.15 -2.00 -0.10 0.00 0.00 0.00 0.00 23.12 20.87 1odk s ALA 99 CO 0.03 0.40 1.46 -1.25 0.00 0.00 0.00 175.76 176.40 1odk s PRO 100 N -3.41 4.04 0.00 0.00 0.04 -1.26 -1.87 135.00 132.53 1odk s PRO 100 Ca 0.38 2.52 0.00 0.00 0.04 0.00 0.00 61.00 63.94 1odk s PRO 100 Cb -0.11 -2.91 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1odk s PRO 100 CO 0.29 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.17 1odk n GLY 101 N 0.50 2.42 3.76 0.56 0.00 0.16 -4.89 105.19 107.70 1odk n GLY 101 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.49 3.27 0.00 1.61 2.12 -0.78 -4.47 118.70 119.95 1odk s GLU 102 Ca 0.00 1.76 -0.02 0.00 0.36 0.00 0.00 54.97 57.07 1odk s GLU 102 Cb 0.00 -2.06 -0.04 0.00 0.26 0.00 0.00 34.13 32.29 1odk s GLU 102 CO 0.00 -0.95 0.16 -0.51 -0.54 0.00 0.00 175.26 173.42 1odk s LEU 103 N -3.75 4.25 -0.12 2.70 1.43 -1.07 -1.04 118.68 121.08 1odk s LEU 103 Ca 0.73 0.28 0.00 0.00 -1.03 0.00 0.00 54.13 54.11 1odk s LEU 103 Cb -0.28 -2.59 0.02 0.00 0.03 0.00 0.00 46.19 43.37 1odk s LEU 103 CO 0.32 0.25 -0.11 -0.63 0.23 0.00 0.00 176.35 176.40 1odk s ILE 104 N -1.33 1.28 -0.42 -0.59 1.01 -0.04 -0.22 121.20 120.89 1odk s ILE 104 Ca 0.27 -0.47 -0.19 0.00 0.00 0.00 0.00 60.65 60.27 1odk s ILE 104 Cb -0.13 -1.22 0.02 0.00 0.01 0.00 0.00 42.46 41.14 1odk s ILE 104 CO 0.19 0.41 0.53 -0.69 0.00 0.00 0.00 174.94 175.37 1odk s VAL 105 N 1.40 4.97 -0.27 2.92 1.01 0.04 -0.92 120.40 129.56 1odk s VAL 105 Ca 0.01 -0.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 1odk s VAL 105 Cb -0.13 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.13 1odk s VAL 105 CO -0.06 -0.46 1.74 0.00 0.00 0.00 0.00 175.10 176.32 1odk s ALA 106 N 2.44 3.05 -0.14 5.51 0.00 -0.52 -2.46 121.76 129.65 1odk s ALA 106 Ca 0.17 0.39 0.15 0.00 0.00 0.00 0.00 51.96 52.67 1odk s ALA 106 Cb -0.16 -3.95 0.02 0.00 0.00 0.00 0.00 23.12 19.03 1odk s ALA 106 CO 0.16 -2.33 1.34 0.37 0.00 0.00 0.00 175.76 175.30 1odk h GLN 107 N 12.02 0.00 -2.09 0.00 4.15 -0.97 -3.43 115.11 124.79 1odk h GLN 107 Ca -0.34 0.00 0.22 0.00 0.77 0.00 0.00 58.65 59.30 1odk h GLN 107 Cb 1.17 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.77 1odk h GLN 107 CO 1.01 0.50 0.58 0.20 -1.93 0.00 0.00 178.83 179.19 1odk s GLY 108 N -4.52 -0.28 -0.11 2.39 0.00 -1.25 -4.29 107.32 99.26 1odk s GLY 108 Ca 0.03 0.27 -0.03 0.00 0.00 0.00 0.00 44.72 45.00 1odk s GLY 108 CO 0.76 0.04 0.04 0.00 0.00 0.00 0.00 173.10 173.94 1odk s ALA 109 N -3.05 0.61 0.02 3.20 0.00 -0.32 -2.39 121.76 119.83 1odk s ALA 109 Ca 0.13 -0.22 -0.30 0.00 0.00 0.00 0.00 51.96 51.57 1odk s ALA 109 Cb 0.00 -0.87 -0.07 0.00 0.00 0.00 0.00 23.12 22.18 1odk s ALA 109 CO 0.01 -0.76 1.74 0.08 0.00 0.00 0.00 175.76 176.83 1odk s VAL 110 N 2.02 3.21 -1.04 0.00 1.01 -0.16 -4.12 120.40 121.33 1odk s VAL 110 Ca 0.03 0.43 -0.21 0.00 0.00 0.00 0.00 61.98 62.23 1odk s VAL 110 Cb -0.14 -3.28 0.07 0.00 0.00 0.00 0.00 36.38 33.03 1odk s VAL 110 CO -0.06 -0.02 1.41 -2.16 0.00 0.00 0.00 175.10 174.27 1odk s PRO 111 N 3.62 3.65 -0.19 2.72 0.04 -1.26 -0.91 135.00 142.67 1odk s PRO 111 Ca 0.78 -1.39 0.16 0.00 0.04 0.00 0.00 61.00 60.58 1odk s PRO 111 Cb -0.38 -5.28 0.78 0.00 0.04 0.00 0.00 34.50 29.66 1odk s PRO 111 CO 0.34 -2.11 1.70 1.28 0.04 0.00 0.00 177.00 178.25 1odk n LEU 112 N 8.25 5.36 -4.78 -3.56 4.77 -0.15 -4.96 117.00 121.93 1odk n LEU 112 Ca 0.33 -2.77 -0.25 0.00 -0.03 0.00 0.00 56.01 53.30 1odk n LEU 112 Cb 0.50 -0.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.89 1odk n LEU 112 CO 0.64 0.70 -0.22 1.51 -1.33 0.00 0.00 177.39 178.69 1odk s ASP 113 N -0.87 5.39 0.16 -1.43 1.47 -1.12 -4.10 116.67 116.17 1odk s ASP 113 Ca 0.53 -0.22 0.25 0.00 1.18 0.00 0.00 52.55 54.29 1odk s ASP 113 Cb 0.38 -1.35 0.60 0.00 -0.34 0.00 0.00 42.92 42.21 1odk s ASP 113 CO 0.19 0.04 1.56 0.61 0.68 0.00 0.00 175.17 178.25 1odk n GLY 114 N -0.59 -1.56 0.09 2.12 0.00 -1.26 -3.37 105.19 100.62 1odk n GLY 114 Ca -0.08 -0.14 -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 1.42 -0.38 2.61 2.02 -1.96 -0.72 112.91 115.90 1odk h THR 115 Ca 0.00 -1.39 -0.07 0.00 0.77 0.00 0.00 66.41 65.71 1odk h THR 115 Cb 0.73 2.22 -0.02 0.00 -1.74 0.00 0.00 68.15 69.34 1odk h THR 115 CO 0.00 0.38 -0.07 0.71 0.37 0.00 0.00 175.52 176.91 1odk h THR 116 N -0.34 1.24 -0.70 3.16 1.35 -1.95 -1.94 112.91 113.73 1odk h THR 116 Ca 0.00 -1.02 -0.03 0.00 -0.55 0.00 0.00 66.41 64.81 1odk h THR 116 Cb 0.67 1.02 -0.03 0.00 -1.73 0.00 0.00 68.15 68.08 1odk h THR 116 CO 0.02 0.34 0.30 -0.09 -0.25 0.00 0.00 175.52 175.85 1odk h ARG 117 N 0.59 1.01 -0.14 4.72 2.43 -1.54 -0.67 114.38 120.78 1odk h ARG 117 Ca 0.11 -0.16 -0.17 0.00 -0.81 0.00 0.00 59.98 58.96 1odk h ARG 117 Cb 0.48 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1odk h ARG 117 CO 0.03 0.81 -0.57 0.37 -1.51 0.00 0.00 179.97 179.10 1odk h GLN 118 N 1.00 0.64 -0.47 0.20 4.15 -0.68 0.18 115.11 120.14 1odk h GLN 118 Ca 0.24 -0.49 -0.03 0.00 0.77 0.00 0.00 58.65 59.13 1odk h GLN 118 Cb 0.15 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.91 1odk h GLN 118 CO -0.03 1.12 0.15 1.88 -1.93 0.00 0.00 178.83 180.02 1odk h TYR 119 N 0.30 0.69 -0.01 3.99 -1.99 -1.18 -2.80 116.97 115.97 1odk h TYR 119 Ca -0.03 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.66 1odk h TYR 119 Cb 1.20 -0.21 0.00 0.00 2.00 0.00 0.00 36.73 39.72 1odk h TYR 119 CO 0.10 0.57 -0.29 1.28 -0.00 0.00 0.00 178.16 179.82 1odk n LEU 120 N -4.33 1.15 -3.65 3.88 4.77 -0.27 -4.95 117.00 113.59 1odk n LEU 120 Ca 0.03 -0.32 -0.24 0.00 -0.03 0.00 0.00 56.01 55.45 1odk n LEU 120 Cb 0.18 -0.11 0.07 0.00 -2.33 0.00 0.00 43.42 41.23 1odk n LEU 120 CO 0.38 0.22 0.20 -0.62 -1.33 0.00 0.00 177.39 176.23 1odk n GLU 121 N -0.58 -7.26 -0.94 3.23 1.02 -0.07 -2.28 120.64 113.76 1odk n GLU 121 Ca 0.12 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 58.04 1odk n GLU 121 Cb 0.36 -5.78 0.00 0.00 -0.02 0.00 0.00 31.44 26.00 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 -1.84 0.50 3.84 0.62 0.00 0.43 -5.02 105.19 103.72 1odk n GLY 122 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.45 3.93 0.73 1.61 0.52 -0.96 -5.03 118.95 119.29 1odk s ARG 123 Ca 0.00 0.98 -0.14 0.00 -0.52 0.00 0.00 55.73 56.05 1odk s ARG 123 Cb 0.00 -2.13 0.04 0.00 0.52 0.00 0.00 34.95 33.38 1odk s ARG 123 CO 0.00 -0.29 1.16 -2.14 0.02 0.00 0.00 175.30 174.05 1odk s PRO 124 N -4.02 2.24 0.05 3.54 0.02 -1.26 -4.93 135.00 130.63 1odk s PRO 124 Ca 0.59 1.56 -0.27 0.00 0.02 0.00 0.00 61.00 62.90 1odk s PRO 124 Cb -0.10 -1.87 0.09 0.00 0.02 0.00 0.00 34.50 32.64 1odk s PRO 124 CO 0.31 -1.72 0.83 -0.47 -0.33 0.00 0.00 177.00 175.61 1odk s TYR 125 N -2.26 -0.37 -0.54 6.54 5.04 -1.26 -5.11 117.35 119.39 1odk s TYR 125 Ca 0.70 0.20 0.04 0.00 -2.44 0.00 0.00 57.07 55.56 1odk s TYR 125 Cb -0.24 0.55 0.15 0.00 0.35 0.00 0.00 41.96 42.77 1odk s TYR 125 CO 0.46 -0.65 0.34 0.00 -1.34 0.00 0.00 175.55 174.37 1odk s ALA 126 N -3.29 2.81 -0.04 3.97 0.00 -1.26 -4.87 121.76 119.08 1odk s ALA 126 Ca 0.05 -3.12 -0.31 0.00 0.00 0.00 0.00 51.96 48.58 1odk s ALA 126 Cb -0.01 -1.99 -0.09 0.00 0.00 0.00 0.00 23.12 21.03 1odk s ALA 126 CO -0.09 -2.05 1.99 -2.30 0.00 0.00 0.00 175.76 173.31 1odk n PRO 127 N 2.83 2.55 -4.11 0.00 -0.02 -1.26 -4.94 135.00 130.04 1odk n PRO 127 Ca 0.15 0.91 -0.14 0.00 -2.02 0.00 0.00 63.50 62.40 1odk n PRO 127 Cb 0.36 -2.94 -0.11 0.00 -0.02 0.00 0.00 33.50 30.79 1odk n PRO 127 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1odk s VAL 128 N 4.96 0.73 1.06 -1.45 -7.23 -1.26 -1.18 120.40 116.03 1odk s VAL 128 Ca 0.92 -1.29 -0.17 0.00 -1.81 0.00 0.00 61.98 59.63 1odk s VAL 128 Cb -0.49 -0.92 0.23 0.00 0.56 0.00 0.00 36.38 35.76 1odk s VAL 128 CO 0.44 -0.43 1.20 -2.16 -0.31 0.00 0.00 175.10 173.85 1odk s PRO 129 N -2.02 -0.11 0.22 4.82 0.04 -1.26 -4.72 135.00 131.98 1odk s PRO 129 Ca -0.04 -0.16 -0.30 0.00 0.04 0.00 0.00 61.00 60.54 1odk s PRO 129 Cb -0.07 -1.74 -0.09 0.00 0.04 0.00 0.00 34.50 32.64 1odk s PRO 129 CO 0.00 -2.95 1.29 0.34 0.04 0.00 0.00 177.00 175.72 1odk s ASP 130 N -4.33 6.91 0.18 6.66 2.15 0.57 -4.91 116.67 123.90 1odk s ASP 130 Ca 0.71 2.42 -0.16 0.00 0.43 0.00 0.00 52.55 55.95 1odk s ASP 130 Cb -0.08 -2.62 0.14 0.00 -0.30 0.00 0.00 42.92 40.06 1odk s ASP 130 CO 0.54 -0.50 1.65 -0.65 -0.17 0.00 0.00 175.17 176.05 1odk h PRO 131 N 5.01 -0.01 -0.62 4.34 0.11 -1.93 -1.05 132.00 137.85 1odk h PRO 131 Ca -0.45 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 1odk h PRO 131 Cb 1.22 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 1odk h PRO 131 CO 0.75 -0.01 0.19 0.93 -0.21 0.00 0.00 178.00 179.66 1odk h GLU 132 N -0.01 0.96 -0.56 1.05 4.39 -1.95 -1.26 114.58 117.20 1odk h GLU 132 Ca 0.22 -0.21 -0.06 0.00 0.34 0.00 0.00 59.36 59.66 1odk h GLU 132 Cb 0.35 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 1odk h GLU 132 CO -0.49 0.85 0.13 0.28 -1.16 0.00 0.00 179.01 178.63 1odk h VAL 133 N 0.88 1.25 -0.10 3.13 2.07 -1.76 -1.12 116.25 120.60 1odk h VAL 133 Ca 0.20 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.84 1odk h VAL 133 Cb 0.29 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1odk h VAL 133 CO -0.01 0.33 0.03 0.15 0.02 0.00 0.00 177.57 178.09 1odk h PHE 134 N 0.80 0.05 -0.71 1.57 3.57 -1.01 -0.94 116.94 120.26 1odk h PHE 134 Ca 0.18 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.71 1odk h PHE 134 Cb 0.35 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 1odk h PHE 134 CO 0.02 0.02 0.45 -0.09 -2.23 0.00 0.00 178.31 176.49 1odk h ARG 135 N 0.07 0.85 -0.56 1.11 2.43 -1.06 -2.02 114.38 115.20 1odk h ARG 135 Ca 0.04 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 1odk h ARG 135 Cb 0.03 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.37 1odk h ARG 135 CO -0.05 0.56 -0.02 0.00 -1.51 0.00 0.00 179.97 178.96 1odk h ALA 136 N 1.30 0.76 -0.37 2.80 0.00 -0.88 -0.89 119.26 121.98 1odk h ALA 136 Ca 0.29 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1odk h ALA 136 Cb 0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1odk h ALA 136 CO -0.11 0.61 0.14 -0.07 0.00 0.00 0.00 179.25 179.82 1odk h LEU 137 N 0.89 0.52 0.19 0.00 3.38 -0.92 -0.46 115.31 118.91 1odk h LEU 137 Ca 0.16 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1odk h LEU 137 Cb 0.57 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1odk h LEU 137 CO 0.03 0.56 -0.09 -0.25 0.09 0.00 0.00 178.44 178.78 1odk h TRP 138 N 0.46 -0.24 -0.89 1.13 2.91 -1.28 -1.50 115.95 116.55 1odk h TRP 138 Ca 0.12 -0.01 0.05 0.00 1.13 0.00 0.00 58.89 60.19 1odk h TRP 138 Cb 0.20 0.08 -0.06 0.00 -0.51 0.00 0.00 29.16 28.87 1odk h TRP 138 CO 0.00 -0.10 0.56 0.00 -1.03 0.00 0.00 178.44 177.87 1odk h ARG 139 N -0.31 1.03 -0.45 2.65 3.08 -1.07 -2.16 114.38 117.16 1odk h ARG 139 Ca -0.03 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.82 1odk h ARG 139 Cb 0.24 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1odk h ARG 139 CO 0.04 0.68 -0.26 0.00 -1.07 0.00 0.00 179.97 179.37 1odk h ARG 140 N 1.07 0.95 -0.26 0.04 2.47 -0.96 -1.11 114.38 116.58 1odk h ARG 140 Ca 0.37 -0.43 -0.02 0.00 -1.26 0.00 0.00 59.98 58.64 1odk h ARG 140 Cb 0.08 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.37 1odk h ARG 140 CO -0.14 1.09 0.06 0.00 0.56 0.00 0.00 179.97 181.54 1odk h ALA 141 N 0.88 1.63 -0.05 0.04 0.00 -0.90 -0.46 119.26 120.41 1odk h ALA 141 Ca 0.10 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 1odk h ALA 141 Cb 0.83 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.52 1odk h ALA 141 CO 0.07 0.28 -0.68 0.93 0.00 0.00 0.00 179.25 179.85 1odk h GLU 142 N 0.36 0.55 0.29 0.00 5.08 -1.13 -2.50 114.58 117.23 1odk h GLU 142 Ca 0.09 -0.53 -0.01 0.00 -1.00 0.00 0.00 59.36 57.92 1odk h GLU 142 Cb 0.15 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1odk h GLU 142 CO -0.00 1.15 -0.19 0.00 -1.00 0.00 0.00 179.01 178.97 1odk h ALA 143 N 0.41 -0.45 0.00 3.43 0.00 -0.64 -1.47 119.26 120.54 1odk h ALA 143 Ca -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1odk h ALA 143 Cb 1.35 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1odk h ALA 143 CO 0.14 -0.77 0.00 1.28 0.00 0.00 0.00 179.25 179.90 1odk n LEU 144 N -5.31 0.09 -1.90 0.00 4.77 -0.23 -4.87 117.00 109.55 1odk n LEU 144 Ca -0.09 0.53 -0.16 0.00 -0.03 0.00 0.00 56.01 56.26 1odk n LEU 144 Cb 0.22 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 1odk n LEU 144 CO 0.33 -0.39 -0.16 0.61 -1.33 0.00 0.00 177.39 176.45 1odk n GLY 145 N -0.53 -0.26 3.76 -0.72 0.00 -0.56 -5.00 105.19 101.87 1odk n GLY 145 Ca 0.02 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.83 3.61 0.04 1.61 4.12 -0.97 -5.01 117.35 117.92 1odk s TYR 146 Ca 0.05 1.02 -0.31 0.00 0.02 0.00 0.00 57.07 57.85 1odk s TYR 146 Cb -0.02 -2.53 -0.09 0.00 -1.52 0.00 0.00 41.96 37.79 1odk s TYR 146 CO 0.06 0.31 1.95 -0.35 0.02 0.00 0.00 175.55 177.55 1odk n PRO 147 N 3.03 2.82 -4.09 -1.71 -0.04 -1.26 -4.77 135.00 128.99 1odk n PRO 147 Ca -0.08 1.03 -0.10 0.00 -0.04 0.00 0.00 63.50 64.31 1odk n PRO 147 Cb 0.51 -2.98 -0.08 0.00 -0.04 0.00 0.00 33.50 30.92 1odk n PRO 147 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1odk s HIS 148 N 4.21 0.74 0.06 0.54 -3.43 -1.26 -2.60 115.29 113.55 1odk s HIS 148 Ca 0.88 -1.06 0.05 0.00 -0.80 0.00 0.00 55.06 54.14 1odk s HIS 148 Cb -0.46 -0.26 -0.03 0.00 -1.43 0.00 0.00 32.58 30.40 1odk s HIS 148 CO 0.42 -0.70 -0.15 1.03 -2.00 0.00 0.00 174.74 173.34 1odk s ARG 149 N -4.06 0.88 -0.17 -0.38 1.81 0.70 -4.94 118.95 112.79 1odk s ARG 149 Ca 0.27 -0.90 0.01 0.00 -1.72 0.00 0.00 55.73 53.39 1odk s ARG 149 Cb 0.05 -0.91 0.02 0.00 -0.45 0.00 0.00 34.95 33.66 1odk s ARG 149 CO 0.06 0.21 -0.20 0.08 -0.68 0.00 0.00 175.30 174.77 1odk s VAL 150 N -1.12 2.06 -1.50 3.52 1.01 -1.26 -0.78 120.40 122.33 1odk s VAL 150 Ca -0.00 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1odk s VAL 150 Cb -0.09 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.44 1odk s VAL 150 CO 0.02 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1odk n GLY 151 N 4.50 -0.54 3.82 4.51 0.00 -1.03 -4.93 105.19 111.52 1odk n GLY 151 Ca -0.21 -0.74 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 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 4.14 0.32 0.99 1.43 -1.25 -0.27 118.68 124.04 1odk s LEU 152 Ca 0.00 1.50 0.04 0.00 -1.03 0.00 0.00 54.13 54.65 1odk s LEU 152 Cb 0.00 -4.06 -0.06 0.00 0.03 0.00 0.00 46.19 42.09 1odk s LEU 152 CO 0.00 -0.16 0.04 0.68 0.23 0.00 0.00 176.35 177.13 1odk s VAL 153 N -1.86 1.32 -0.09 -1.59 -7.23 -1.01 -0.50 120.40 109.45 1odk s VAL 153 Ca 0.53 -2.02 0.02 0.00 -1.81 0.00 0.00 61.98 58.71 1odk s VAL 153 Cb -0.13 -2.76 0.01 0.00 0.56 0.00 0.00 36.38 34.07 1odk s VAL 153 CO 0.18 -0.05 -0.15 0.00 -0.31 0.00 0.00 175.10 174.77 1odk s ALA 154 N -3.21 1.58 -0.29 1.32 0.00 -0.34 -0.99 121.76 119.83 1odk s ALA 154 Ca 0.35 -0.63 -0.15 0.00 0.00 0.00 0.00 51.96 51.54 1odk s ALA 154 Cb 0.08 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 1odk s ALA 154 CO 0.15 0.08 0.35 -1.12 0.00 0.00 0.00 175.76 175.22 1odk s SER 155 N 0.72 6.21 0.37 0.00 0.01 -0.09 -1.28 113.70 119.65 1odk s SER 155 Ca -0.13 0.13 0.08 0.00 1.31 0.00 0.00 55.95 57.35 1odk s SER 155 Cb -0.16 -2.20 -0.07 0.00 0.21 0.00 0.00 66.02 63.80 1odk s SER 155 CO 0.03 -0.21 -0.03 -1.83 0.41 0.00 0.00 173.24 171.62 1odk s GLU 156 N 2.03 1.93 -0.22 12.44 -1.05 -0.36 -0.98 118.70 132.48 1odk s GLU 156 Ca 0.13 -1.98 0.03 0.00 -0.15 0.00 0.00 54.97 53.01 1odk s GLU 156 Cb -0.16 -1.72 -0.16 0.00 -0.44 0.00 0.00 34.13 31.65 1odk s GLU 156 CO 0.11 0.05 -0.17 -0.25 0.95 0.00 0.00 175.26 175.94 1odk n ASP 157 N -0.91 2.05 -4.33 0.83 10.43 -1.26 -4.46 116.55 118.91 1odk n ASP 157 Ca -0.05 -0.11 -0.47 0.00 2.57 0.00 0.00 54.79 56.74 1odk n ASP 157 Cb 0.65 -0.22 -0.02 0.00 1.84 0.00 0.00 41.12 43.37 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 -2.45 4.07 0.24 2.24 0.00 -1.26 -4.92 121.76 119.67 1odk s ALA 158 Ca -0.28 -3.30 -0.06 0.00 0.00 0.00 0.00 51.96 48.31 1odk s ALA 158 Cb 0.08 -3.50 0.43 0.00 0.00 0.00 0.00 23.12 20.13 1odk s ALA 158 CO 0.55 -2.27 1.67 0.35 0.00 0.00 0.00 175.76 176.06 1odk h PHE 159 N 7.80 0.17 -0.37 0.00 3.57 -1.99 -1.91 116.94 124.20 1odk h PHE 159 Ca 0.09 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1odk h PHE 159 Cb 1.04 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.82 1odk h PHE 159 CO 1.02 -0.13 0.00 0.66 -2.23 0.00 0.00 178.31 177.64 1odk n TYR 160 N -5.21 0.54 -0.08 0.41 4.02 -1.26 -4.16 117.16 111.42 1odk n TYR 160 Ca 0.13 -0.26 -0.12 0.00 -0.01 0.00 0.00 57.90 57.64 1odk n TYR 160 Cb 0.45 -0.02 -0.15 0.00 -0.02 0.00 0.00 39.34 39.60 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 0.59 1.43 -2.16 -0.72 0.00 -0.72 -4.94 120.51 113.99 1odk n ALA 161 Ca 0.13 -1.09 -0.42 0.00 0.00 0.00 0.00 53.44 52.05 1odk n ALA 161 Cb 0.34 -0.37 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 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 -2.53 3.45 0.29 0.00 2.01 -1.24 -5.03 115.64 112.60 1odk s THR 162 Ca -0.14 0.94 0.06 0.00 0.31 0.00 0.00 61.69 62.86 1odk s THR 162 Cb 0.07 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.96 1odk s THR 162 CO 0.78 0.03 0.42 0.42 -0.69 0.00 0.00 174.62 175.58 1odk s THR 163 N 1.93 4.65 0.39 -0.82 -4.23 -1.26 -4.98 115.64 111.33 1odk s THR 163 Ca 0.66 -0.98 0.05 0.00 -1.18 0.00 0.00 61.69 60.24 1odk s THR 163 Cb -0.35 -3.63 0.27 0.00 1.34 0.00 0.00 72.50 70.13 1odk s THR 163 CO 0.29 -0.25 2.04 -0.65 -0.54 0.00 0.00 174.62 175.51 1odk h PRO 164 N 1.02 0.65 -0.33 3.99 0.11 -1.96 -0.53 132.00 134.96 1odk h PRO 164 Ca -0.49 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 1odk h PRO 164 Cb 1.24 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1odk h PRO 164 CO 0.57 0.43 0.09 0.93 -0.21 0.00 0.00 178.00 179.81 1odk h GLU 165 N 0.67 0.52 -0.55 1.05 3.07 -1.97 -0.40 114.58 116.99 1odk h GLU 165 Ca 0.19 -0.12 -0.10 0.00 -0.50 0.00 0.00 59.36 58.83 1odk h GLU 165 Cb -0.06 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 27.75 1odk h GLU 165 CO -0.04 0.57 -0.04 0.93 -1.40 0.00 0.00 179.01 179.03 1odk h GLU 166 N 0.38 0.97 -0.44 2.33 5.08 -1.81 -1.77 114.58 119.31 1odk h GLU 166 Ca 0.10 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1odk h GLU 166 Cb 0.27 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1odk h GLU 166 CO -0.00 0.97 0.28 0.00 -1.00 0.00 0.00 179.01 179.26 1odk h ALA 167 N 1.07 0.56 -0.39 3.43 0.00 -0.86 -1.18 119.26 121.89 1odk h ALA 167 Ca 0.15 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1odk h ALA 167 Cb 0.57 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1odk h ALA 167 CO 0.03 0.03 0.05 0.00 0.00 0.00 0.00 179.25 179.37 1odk h ARG 168 N 0.59 0.59 -0.44 0.00 3.08 -0.83 -1.58 114.38 115.79 1odk h ARG 168 Ca 0.16 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 1odk h ARG 168 Cb -0.03 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 1odk h ARG 168 CO -0.03 0.57 0.08 0.00 -1.07 0.00 0.00 179.97 179.52 1odk h ALA 169 N 1.49 0.58 -0.17 0.04 0.00 -0.65 -2.74 119.26 117.81 1odk h ALA 169 Ca 0.13 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1odk h ALA 169 Cb 0.28 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1odk h ALA 169 CO 0.00 0.28 -0.20 -1.49 0.00 0.00 0.00 179.25 177.85 1odk h TRP 170 N 0.58 0.32 -0.07 0.00 4.06 -0.82 -2.48 115.95 117.54 1odk h TRP 170 Ca 0.13 -0.05 -0.02 0.00 2.06 0.00 0.00 58.89 61.02 1odk h TRP 170 Cb 0.36 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.43 1odk h TRP 170 CO 0.02 0.48 -0.04 0.00 -3.56 0.00 0.00 178.44 175.35 1odk h ALA 171 N 1.53 1.82 0.00 1.49 0.00 -1.00 0.17 119.26 123.27 1odk h ALA 171 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1odk h ALA 171 Cb 0.51 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1odk h ALA 171 CO 0.03 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.42 1odk h ARG 172 N 0.09 0.00 -0.52 0.00 3.08 -1.30 -1.74 114.38 113.99 1odk h ARG 172 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1odk h ARG 172 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1odk h ARG 172 CO 0.01 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.57 1odk n TYR 173 N -2.57 1.16 -0.08 3.04 4.01 0.01 -4.95 117.16 117.79 1odk n TYR 173 Ca 0.01 -0.64 0.00 0.00 -0.16 0.00 0.00 57.90 57.11 1odk n TYR 173 Cb 0.21 -0.21 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 0.71 0.49 3.65 2.72 0.00 -0.66 -5.05 105.19 107.05 1odk n GLY 174 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.19 4.11 -0.02 1.61 1.01 -0.98 -3.94 120.40 120.00 1odk s VAL 175 Ca 0.00 1.32 -0.11 0.00 0.00 0.00 0.00 61.98 63.19 1odk s VAL 175 Cb 0.00 -3.90 -0.32 0.00 0.00 0.00 0.00 36.38 32.16 1odk s VAL 175 CO 0.00 -0.17 0.79 -0.07 0.00 0.00 0.00 175.10 175.65 1odk h LEU 176 N 10.07 0.66 -7.76 3.92 3.38 -1.13 -3.35 115.31 121.11 1odk h LEU 176 Ca -0.29 -0.88 0.03 0.00 0.09 0.00 0.00 57.88 56.83 1odk h LEU 176 Cb 1.12 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.58 1odk h LEU 176 CO 0.98 1.73 0.18 0.00 0.09 0.00 0.00 178.44 181.41 1odk s ALA 177 N -2.59 -1.21 -0.02 1.53 0.00 -1.25 -1.51 121.76 116.71 1odk s ALA 177 Ca -0.13 -0.16 0.03 0.00 0.00 0.00 0.00 51.96 51.70 1odk s ALA 177 Cb 0.05 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 24.01 1odk s ALA 177 CO 0.88 -0.94 -0.08 -0.06 0.00 0.00 0.00 175.76 175.56 1odk s PHE 178 N -3.88 2.86 0.00 0.00 0.40 0.84 -1.20 117.98 116.99 1odk s PHE 178 Ca 0.09 -0.05 0.00 0.00 -0.60 0.00 0.00 56.93 56.37 1odk s PHE 178 Cb -0.04 -1.62 0.00 0.00 0.51 0.00 0.00 43.02 41.87 1odk s PHE 178 CO 0.02 0.34 0.00 -0.85 0.70 0.00 0.00 175.22 175.43 1odk n GLU 179 N 1.78 0.00 -1.22 0.44 -0.00 -0.40 -0.69 120.64 120.55 1odk n GLU 179 Ca -0.16 0.00 0.04 0.00 -0.00 0.00 0.00 57.16 57.04 1odk n GLU 179 Cb 0.53 0.00 0.05 0.00 -0.00 0.00 0.00 31.44 32.02 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 0.31 0.00 3.44 2.81 -1.26 -1.23 117.12 121.19 1odk n MET 180 Ca 0.00 -2.15 0.00 0.00 -1.81 0.00 0.00 57.70 53.74 1odk n MET 180 Cb 0.00 -0.36 0.00 0.00 -0.71 0.00 0.00 33.22 32.15 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 0.13 0.00 -0.21 0.03 4.71 -1.26 -1.50 120.64 122.53 1odk n GLU 181 Ca 0.08 0.00 0.02 0.00 -0.01 0.00 0.00 57.16 57.25 1odk n GLU 181 Cb 1.02 -0.36 0.13 0.00 -1.01 0.00 0.00 31.44 31.21 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 0.75 -0.39 0.62 0.00 -1.96 -2.89 119.26 115.39 1odk h ALA 182 Ca 0.00 0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1odk h ALA 182 Cb 0.00 0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 1odk h ALA 182 CO 0.00 -0.34 -0.07 0.66 0.00 0.00 0.00 179.25 179.50 1odk h SER 183 N 0.22 -0.31 -0.54 0.00 4.64 -1.90 -0.10 113.55 115.56 1odk h SER 183 Ca 0.35 0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.69 1odk h SER 183 Cb 0.55 0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.84 1odk h SER 183 CO -0.47 -0.11 0.01 0.00 -0.87 0.00 0.00 176.83 175.39 1odk h ALA 184 N 1.38 0.93 -0.15 5.18 0.00 -1.89 -1.47 119.26 123.24 1odk h ALA 184 Ca 0.19 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1odk h ALA 184 Cb 0.29 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1odk h ALA 184 CO -0.38 0.64 0.09 1.25 0.00 0.00 0.00 179.25 180.85 1odk h LEU 185 N 0.91 0.18 -0.74 0.00 5.85 -1.19 -0.32 115.31 119.99 1odk h LEU 185 Ca 0.17 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1odk h LEU 185 Cb 0.52 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1odk h LEU 185 CO 0.03 0.18 0.37 -0.26 -0.34 0.00 0.00 178.44 178.42 1odk h PHE 186 N 0.17 1.05 -0.18 1.25 0.05 -0.89 -0.00 116.94 118.39 1odk h PHE 186 Ca 0.05 -0.04 -0.01 0.00 3.82 0.00 0.00 57.97 61.79 1odk h PHE 186 Cb 0.03 -0.33 -0.01 0.00 2.00 0.00 0.00 35.95 37.64 1odk h PHE 186 CO -0.05 0.76 0.07 1.25 -0.18 0.00 0.00 178.31 180.16 1odk h LEU 187 N 1.04 0.24 -1.45 1.54 5.85 -1.07 -2.70 115.31 118.76 1odk h LEU 187 Ca 0.26 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 1odk h LEU 187 Cb 0.09 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1odk h LEU 187 CO -0.04 0.34 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.13 1odk h LEU 188 N 0.13 0.11 -0.12 2.25 3.38 -0.83 -0.61 115.31 119.62 1odk h LEU 188 Ca 0.06 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1odk h LEU 188 Cb 0.17 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1odk h LEU 188 CO -0.01 0.32 0.03 1.23 0.09 0.00 0.00 178.44 180.10 1odk h GLY 189 N 0.74 0.13 0.78 0.83 0.00 -0.69 0.29 103.07 105.16 1odk h GLY 189 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1odk h GLY 189 CO 0.03 0.01 -0.02 3.21 0.00 0.00 0.00 176.54 179.77 1odk h ARG 190 N 0.08 0.30 -0.67 4.80 2.47 -1.18 -0.67 114.38 119.51 1odk h ARG 190 Ca 0.05 -0.11 0.02 0.00 -1.26 0.00 0.00 59.98 58.68 1odk h ARG 190 Cb 0.04 -0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 28.30 1odk h ARG 190 CO -0.06 0.55 0.44 0.52 0.56 0.00 0.00 179.97 181.97 1odk h MET 191 N 0.02 0.85 -0.18 0.04 2.86 -0.94 -3.04 114.93 114.54 1odk h MET 191 Ca 0.04 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1odk h MET 191 Cb 0.43 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1odk h MET 191 CO 0.01 0.56 0.00 0.54 1.06 0.00 0.00 176.91 179.08 1odk n ARG 192 N -4.65 2.13 -2.21 1.72 5.12 0.10 -4.98 116.66 113.91 1odk n ARG 192 Ca 0.06 -1.69 -0.11 0.00 -1.93 0.00 0.00 57.85 54.19 1odk n ARG 192 Cb 0.05 -1.46 -0.01 0.00 -1.16 0.00 0.00 32.46 29.88 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 1.32 -0.08 3.68 -0.13 0.00 -0.39 -5.03 105.19 104.56 1odk n GLY 193 Ca 0.17 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.56 2.58 -0.26 1.61 -7.23 -0.44 -5.04 120.40 109.07 1odk s VAL 194 Ca 0.00 -1.85 -0.13 0.00 -1.81 0.00 0.00 61.98 58.19 1odk s VAL 194 Cb 0.00 -2.90 -0.04 0.00 0.56 0.00 0.00 36.38 34.00 1odk s VAL 194 CO 0.00 -0.13 0.28 -0.13 -0.31 0.00 0.00 175.10 174.81 1odk s ARG 195 N -3.79 4.02 0.27 4.82 0.52 -0.23 -4.42 118.95 120.14 1odk s ARG 195 Ca 0.37 -0.10 0.08 0.00 -0.52 0.00 0.00 55.73 55.55 1odk s ARG 195 Cb 0.01 -3.62 -0.05 0.00 0.52 0.00 0.00 34.95 31.80 1odk s ARG 195 CO 0.21 -0.16 -0.09 0.95 0.02 0.00 0.00 175.30 176.22 1odk s THR 196 N 1.72 1.78 0.20 0.02 -4.23 -1.26 -0.48 115.64 113.39 1odk s THR 196 Ca 0.12 -2.18 -0.24 0.00 -1.18 0.00 0.00 61.69 58.22 1odk s THR 196 Cb -0.15 -2.36 0.05 0.00 1.34 0.00 0.00 72.50 71.38 1odk s THR 196 CO 0.09 -0.37 0.88 -0.83 -0.54 0.00 0.00 174.62 173.85 1odk s GLY 197 N -3.43 -0.18 -0.15 3.99 0.00 -0.78 -0.31 107.32 106.45 1odk s GLY 197 Ca 0.28 -0.03 -0.13 0.00 0.00 0.00 0.00 44.72 44.84 1odk s GLY 197 CO 0.11 -0.03 0.40 0.00 0.00 0.00 0.00 173.10 173.59 1odk s ALA 198 N -3.50 -1.00 -0.01 3.20 0.00 -1.26 -1.00 121.76 118.18 1odk s ALA 198 Ca 0.12 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.27 1odk s ALA 198 Cb -0.03 -0.69 0.01 0.00 0.00 0.00 0.00 23.12 22.41 1odk s ALA 198 CO 0.04 -0.20 -0.02 -1.50 0.00 0.00 0.00 175.76 174.08 1odk s ILE 199 N 0.35 0.23 0.22 0.00 2.07 -0.79 -1.43 121.20 121.84 1odk s ILE 199 Ca -0.01 -0.05 0.05 0.00 -1.41 0.00 0.00 60.65 59.22 1odk s ILE 199 Cb -0.03 -0.25 -0.05 0.00 0.13 0.00 0.00 42.46 42.26 1odk s ILE 199 CO -0.01 0.10 -0.05 -0.76 -1.91 0.00 0.00 174.94 172.31 1odk s LEU 200 N 0.35 2.37 -0.14 8.50 1.43 -0.10 -3.07 118.68 128.03 1odk s LEU 200 Ca -0.03 -1.15 0.02 0.00 -1.03 0.00 0.00 54.13 51.95 1odk s LEU 200 Cb -0.06 -0.42 0.01 0.00 0.03 0.00 0.00 46.19 45.75 1odk s LEU 200 CO -0.01 -0.39 -0.21 0.00 0.23 0.00 0.00 176.35 175.96 1odk s ALA 201 N -3.25 2.20 -0.10 4.21 0.00 0.37 -0.86 121.76 124.33 1odk s ALA 201 Ca 0.26 -1.06 -0.29 0.00 0.00 0.00 0.00 51.96 50.86 1odk s ALA 201 Cb 0.04 -0.98 -0.05 0.00 0.00 0.00 0.00 23.12 22.13 1odk s ALA 201 CO 0.08 -0.03 1.64 0.08 0.00 0.00 0.00 175.76 177.53 1odk s VAL 202 N 0.82 3.63 -0.31 0.00 1.01 -0.20 -1.85 120.40 123.50 1odk s VAL 202 Ca -0.07 0.75 0.20 0.00 0.00 0.00 0.00 61.98 62.86 1odk s VAL 202 Cb -0.15 -3.53 -0.29 0.00 0.00 0.00 0.00 36.38 32.41 1odk s VAL 202 CO -0.02 -0.12 0.57 -1.54 0.00 0.00 0.00 175.10 174.00 1odk n SER 203 N 7.53 0.48 -3.47 3.32 3.41 -0.76 0.37 113.62 124.50 1odk n SER 203 Ca 0.18 -0.29 -0.02 0.00 -0.26 0.00 0.00 58.87 58.47 1odk n SER 203 Cb 0.43 1.66 0.01 0.00 -0.26 0.00 0.00 64.21 66.05 1odk n SER 203 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1odk s ASN 204 N -3.92 -0.02 -0.02 4.04 4.22 -1.25 -4.93 114.94 113.05 1odk s ASN 204 Ca -0.03 -0.57 0.02 0.00 -2.14 0.00 0.00 52.86 50.14 1odk s ASN 204 Cb 0.14 0.45 -0.03 0.00 1.28 0.00 0.00 41.25 43.09 1odk s ASN 204 CO 0.85 -0.89 -0.03 -0.13 -2.04 0.00 0.00 177.10 174.86 1odk s ARG 205 N -2.33 2.72 -0.03 3.55 0.52 -1.26 -0.58 118.95 121.53 1odk s ARG 205 Ca 0.21 -0.62 -0.06 0.00 -0.52 0.00 0.00 55.73 54.74 1odk s ARG 205 Cb -0.02 -2.61 -0.25 0.00 0.52 0.00 0.00 34.95 32.59 1odk s ARG 205 CO 0.04 0.63 3.45 -0.89 0.02 0.00 0.00 175.30 178.55 1odk n ILE 206 N 1.65 2.86 0.00 1.52 5.41 -0.68 -4.85 119.36 125.27 1odk n ILE 206 Ca -0.16 -1.44 0.00 0.00 1.00 0.00 0.00 62.75 62.15 1odk n ILE 206 Cb 0.53 -1.98 0.00 0.00 -0.71 0.00 0.00 39.64 37.47 1odk n ILE 206 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1odk n GLU 215 N 2.55 0.00 -0.03 0.38 4.07 -1.26 -4.61 120.64 121.74 1odk n GLU 215 Ca 0.41 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 57.37 1odk n GLU 215 Cb 0.86 -0.92 -0.10 0.00 -0.06 0.00 0.00 31.44 31.22 1odk n GLU 215 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1odk h VAL 216 N 0.00 1.44 -0.10 6.31 2.07 -2.00 -2.53 116.25 121.44 1odk h VAL 216 Ca 0.00 -1.69 -0.20 0.00 0.82 0.00 0.00 66.70 65.62 1odk h VAL 216 Cb 0.00 2.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1odk h VAL 216 CO 0.00 0.48 -0.77 0.25 0.02 0.00 0.00 177.57 177.55 1odk h LEU 217 N -0.24 0.67 -1.04 2.57 5.85 -1.90 -3.04 115.31 118.18 1odk h LEU 217 Ca -0.02 -0.45 -0.02 0.00 0.84 0.00 0.00 57.88 58.24 1odk h LEU 217 Cb 0.91 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 1odk h LEU 217 CO 0.06 1.22 0.43 -0.61 -0.34 0.00 0.00 178.44 179.20 1odk h GLN 218 N 0.38 1.11 -0.35 1.25 5.75 -1.99 0.93 115.11 122.18 1odk h GLN 218 Ca -0.05 -0.13 -0.12 0.00 -0.15 0.00 0.00 58.65 58.21 1odk h GLN 218 Cb 1.38 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 29.69 1odk h GLN 218 CO 0.14 0.81 -0.26 1.49 -2.65 0.00 0.00 178.83 178.36 1odk h GLU 219 N 1.11 0.72 -0.47 1.69 4.57 -1.48 -1.06 114.58 119.66 1odk h GLU 219 Ca 0.28 -0.30 -0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1odk h GLU 219 Cb 0.03 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 1odk h GLU 219 CO -0.05 0.90 0.25 0.78 -1.18 0.00 0.00 179.01 179.72 1odk h GLY 220 N 0.98 0.71 0.88 1.92 0.00 -1.18 -0.44 103.07 105.93 1odk h GLY 220 Ca 0.08 -0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.10 1odk h GLY 220 CO 0.06 0.32 0.32 -2.08 0.00 0.00 0.00 176.54 175.16 1odk h VAL 221 N 0.62 1.06 -0.19 4.60 2.07 -0.54 0.85 116.25 124.72 1odk h VAL 221 Ca 0.17 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1odk h VAL 221 Cb 0.07 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 1odk h VAL 221 CO -0.02 0.12 0.10 -0.09 0.02 0.00 0.00 177.57 177.70 1odk h ARG 222 N 0.64 0.26 -0.76 1.57 2.43 -0.75 -0.75 114.38 117.03 1odk h ARG 222 Ca 0.22 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.32 1odk h ARG 222 Cb 0.02 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 1odk h ARG 222 CO -0.09 0.25 0.34 0.00 -1.51 0.00 0.00 179.97 178.95 1odk h ARG 223 N 0.20 1.11 -0.34 0.20 3.08 -0.82 -1.26 114.38 116.55 1odk h ARG 223 Ca 0.07 -0.18 0.02 0.00 0.07 0.00 0.00 59.98 59.96 1odk h ARG 223 Cb 0.06 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 1odk h ARG 223 CO -0.01 0.88 0.18 1.98 -1.07 0.00 0.00 179.97 181.93 1odk h MET 224 N 1.08 0.36 -0.39 0.04 4.05 -0.53 -1.59 114.93 117.95 1odk h MET 224 Ca 0.26 -0.02 -0.08 0.00 -0.28 0.00 0.00 59.70 59.58 1odk h MET 224 Cb 0.16 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.86 1odk h MET 224 CO -0.03 0.24 -0.05 0.28 0.23 0.00 0.00 176.91 177.58 1odk h VAL 225 N 0.37 1.27 -0.65 -5.77 2.07 -0.89 -2.11 116.25 110.55 1odk h VAL 225 Ca 0.14 -1.10 0.03 0.00 0.82 0.00 0.00 66.70 66.59 1odk h VAL 225 Cb 0.03 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 1odk h VAL 225 CO -0.08 0.37 0.39 -0.08 0.02 0.00 0.00 177.57 178.18 1odk h GLU 226 N 0.54 0.73 -0.45 1.57 4.81 -1.05 -0.88 114.58 119.85 1odk h GLU 226 Ca 0.10 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1odk h GLU 226 Cb 0.55 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1odk h GLU 226 CO 0.03 0.49 0.24 0.28 -0.73 0.00 0.00 179.01 179.31 1odk h VAL 227 N 0.76 1.17 -0.37 0.32 2.07 -1.15 -2.08 116.25 116.96 1odk h VAL 227 Ca 0.27 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1odk h VAL 227 Cb 0.06 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1odk h VAL 227 CO -0.12 0.18 0.20 0.00 0.02 0.00 0.00 177.57 177.85 1odk h ALA 228 N 1.08 0.48 -0.34 1.67 0.00 -0.89 -1.10 119.26 120.15 1odk h ALA 228 Ca 0.16 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1odk h ALA 228 Cb 0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1odk h ALA 228 CO -0.02 0.01 0.20 -0.07 0.00 0.00 0.00 179.25 179.37 1odk h LEU 229 N 0.47 0.41 -1.01 0.00 3.38 -1.06 -0.58 115.31 116.91 1odk h LEU 229 Ca 0.13 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1odk h LEU 229 Cb 0.07 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1odk h LEU 229 CO -0.02 0.35 0.11 -0.33 0.09 0.00 0.00 178.44 178.64 1odk h GLU 230 N 0.44 0.82 -0.12 1.13 4.39 -1.27 -3.04 114.58 116.93 1odk h GLU 230 Ca 0.12 -0.17 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 1odk h GLU 230 Cb 0.02 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.54 1odk h GLU 230 CO -0.02 0.75 -0.08 0.00 -1.16 0.00 0.00 179.01 178.50 1odk h ALA 231 N 1.33 0.17 -0.03 3.43 0.00 -0.79 -3.15 119.26 120.23 1odk h ALA 231 Ca 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1odk h ALA 231 Cb 0.32 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1odk h ALA 231 CO 0.00 -0.01 -0.02 -0.39 0.00 0.00 0.00 179.25 178.84 1odk h VAL 232 N -0.10 1.03 0.00 0.00 -1.51 -1.10 -0.50 116.25 114.07 1odk h VAL 232 Ca 0.02 -0.13 -0.04 0.00 -1.23 0.00 0.00 66.70 65.33 1odk h VAL 232 Cb 0.57 1.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.76 1odk h VAL 232 CO 0.02 0.04 -0.18 -0.07 -1.23 0.00 0.00 177.57 176.15 1odk h LEU 233 N 0.04 0.00 -0.10 4.19 4.07 -1.49 -2.63 115.31 119.38 1odk h LEU 233 Ca 0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1odk h LEU 233 Cb 0.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.80 1odk h LEU 233 CO 0.00 0.18 0.00 -0.33 -1.08 0.00 0.00 178.44 177.21 1odk h GLU 234 N 0.00 0.00 -0.01 1.13 4.39 -1.09 -3.52 114.58 115.48 1odk h GLU 234 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1odk h GLU 234 Cb 0.49 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1odk h GLU 234 CO 0.02 0.00 0.00 1.33 -1.16 0.00 0.00 179.01 179.20