#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 -0.38 -0.06 -1.46 -0.02 -1.26 -4.94 135.00 126.87 1odk n PRO 3 Ca 0.00 -0.05 -0.14 0.00 -2.02 0.00 0.00 63.50 61.28 1odk n PRO 3 Cb 0.00 -2.17 -0.06 0.00 -0.02 0.00 0.00 33.50 31.24 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 -1.75 1.33 0.00 4.25 2.04 -1.99 -3.38 117.51 118.02 1odk h ILE 4 Ca -0.43 -1.58 -0.33 0.00 1.00 0.00 0.00 64.86 63.52 1odk h ILE 4 Cb 1.28 1.86 -0.05 0.00 -0.74 0.00 0.00 36.82 39.17 1odk h ILE 4 CO 0.38 0.49 -2.03 1.41 0.00 0.00 0.00 178.15 178.40 1odk n HIS 5 N -4.29 0.16 -2.94 1.37 8.25 -1.26 -4.67 115.22 111.83 1odk n HIS 5 Ca -0.06 0.07 -0.44 0.00 -0.26 0.00 0.00 57.72 57.03 1odk n HIS 5 Cb 0.50 -0.91 -0.03 0.00 1.12 0.00 0.00 29.99 30.68 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 4.74 -1.34 1.59 1.01 -1.26 -4.71 120.40 117.86 1odk s VAL 6 Ca -0.35 -1.52 -0.14 0.00 0.00 0.00 0.00 61.98 59.96 1odk s VAL 6 Cb 0.11 -4.75 -0.02 0.00 0.00 0.00 0.00 36.38 31.72 1odk s VAL 6 CO 0.48 -1.48 2.30 0.54 0.00 0.00 0.00 175.10 176.94 1odk n ARG 7 N 6.51 2.73 -4.36 2.72 1.74 -1.26 -4.12 116.66 120.62 1odk n ARG 7 Ca 0.21 -2.35 -0.29 0.00 -0.77 0.00 0.00 57.85 54.66 1odk n ARG 7 Cb 0.49 -3.10 -0.06 0.00 -1.02 0.00 0.00 32.46 28.76 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 3.34 3.94 0.24 7.54 0.00 -1.26 -4.81 121.76 130.75 1odk s ALA 8 Ca 0.52 -1.28 0.04 0.00 0.00 0.00 0.00 51.96 51.24 1odk s ALA 8 Cb 0.15 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.96 1odk s ALA 8 CO -0.05 -0.18 -0.01 -1.01 0.00 0.00 0.00 175.76 174.51 1odk s HIS 9 N -2.76 1.64 0.10 0.00 3.76 -1.26 -4.25 115.29 112.53 1odk s HIS 9 Ca 0.25 -0.88 -0.35 0.00 -0.15 0.00 0.00 55.06 53.93 1odk s HIS 9 Cb 0.02 -0.95 -0.15 0.00 1.11 0.00 0.00 32.58 32.62 1odk s HIS 9 CO 0.14 0.02 1.52 -2.30 -0.85 0.00 0.00 174.74 173.28 1odk n PRO 10 N -0.45 1.77 0.00 8.40 -0.02 -1.26 -1.37 135.00 142.07 1odk n PRO 10 Ca -0.05 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1odk n PRO 10 Cb 0.64 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1odk n PRO 10 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1odk n GLY 11 N 3.21 2.63 0.08 -1.23 0.00 -1.26 -4.93 105.19 103.69 1odk n GLY 11 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 1odk n GLY 11 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1odk h ASP 12 N 0.16 0.17 -3.19 1.61 3.32 -1.57 -3.46 116.42 113.46 1odk h ASP 12 Ca 0.00 -0.21 -0.62 0.00 0.02 0.00 0.00 57.03 56.22 1odk h ASP 12 Cb 0.00 -0.05 -0.13 0.00 0.22 0.00 0.00 39.33 39.36 1odk h ASP 12 CO 0.00 1.17 -0.53 -0.69 -1.72 0.00 0.00 179.24 177.47 1odk s VAL 13 N -2.66 5.07 0.60 -1.35 1.01 -1.26 -4.69 120.40 117.11 1odk s VAL 13 Ca -0.03 0.06 -0.09 0.00 0.00 0.00 0.00 61.98 61.92 1odk s VAL 13 Cb 0.08 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 1odk s VAL 13 CO 0.84 0.48 0.96 0.00 0.00 0.00 0.00 175.10 177.38 1odk s ALA 14 N 0.09 3.17 0.35 5.51 0.00 -1.26 -4.78 121.76 124.85 1odk s ALA 14 Ca 0.07 -0.37 0.06 0.00 0.00 0.00 0.00 51.96 51.72 1odk s ALA 14 Cb -0.12 -2.85 0.65 0.00 0.00 0.00 0.00 23.12 20.80 1odk s ALA 14 CO 0.00 -0.72 1.87 0.93 0.00 0.00 0.00 175.76 177.84 1odk h GLU 15 N -0.22 0.41 -5.30 0.00 5.08 -1.84 -3.38 114.58 109.33 1odk h GLU 15 Ca -0.45 -0.10 -0.60 0.00 -1.00 0.00 0.00 59.36 57.21 1odk h GLU 15 Cb 1.22 -0.06 -0.12 0.00 0.50 0.00 0.00 28.75 30.29 1odk h GLU 15 CO 0.62 0.50 -0.38 1.03 -1.00 0.00 0.00 179.01 179.79 1odk s ARG 16 N -4.83 4.16 -0.00 2.33 0.52 -1.26 -0.66 118.95 119.21 1odk s ARG 16 Ca -0.07 -0.05 0.01 0.00 -0.52 0.00 0.00 55.73 55.11 1odk s ARG 16 Cb 0.15 -3.50 -0.00 0.00 0.52 0.00 0.00 34.95 32.12 1odk s ARG 16 CO 0.76 0.11 -0.05 0.08 0.02 0.00 0.00 175.30 176.22 1odk s VAL 17 N 0.89 0.36 -0.06 3.52 1.01 0.62 -0.69 120.40 126.06 1odk s VAL 17 Ca 0.13 -0.20 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 1odk s VAL 17 Cb -0.13 -0.31 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 1odk s VAL 17 CO 0.04 0.10 0.09 -0.76 0.00 0.00 0.00 175.10 174.57 1odk s LEU 18 N -0.11 4.01 -0.70 3.92 1.43 0.74 -0.84 118.68 127.12 1odk s LEU 18 Ca 0.02 0.26 0.05 0.00 -1.03 0.00 0.00 54.13 53.43 1odk s LEU 18 Cb -0.02 -2.14 0.18 0.00 0.03 0.00 0.00 46.19 44.24 1odk s LEU 18 CO -0.00 0.34 0.52 0.18 0.23 0.00 0.00 176.35 177.61 1odk n LEU 19 N 1.63 3.05 -4.84 1.79 4.77 0.10 -1.36 117.00 122.14 1odk n LEU 19 Ca -0.16 -5.22 -0.32 0.00 -0.03 0.00 0.00 56.01 50.27 1odk n LEU 19 Cb 0.54 -0.73 -0.02 0.00 -2.33 0.00 0.00 43.42 40.87 1odk n LEU 19 CO 0.34 1.79 0.69 -2.16 -1.33 0.00 0.00 177.39 176.72 1odk s PRO 20 N -1.55 3.83 -0.02 3.23 0.04 -1.23 -2.61 135.00 136.70 1odk s PRO 20 Ca 0.26 0.96 0.06 0.00 0.04 0.00 0.00 61.00 62.33 1odk s PRO 20 Cb -0.02 -2.12 -0.24 0.00 0.04 0.00 0.00 34.50 32.16 1odk s PRO 20 CO -0.16 -0.37 0.75 0.78 0.04 0.00 0.00 177.00 178.05 1odk h GLY 21 N 0.72 0.09 -5.86 0.56 0.00 -1.83 -1.27 103.07 95.49 1odk h GLY 21 Ca -0.46 -0.24 -0.59 0.00 0.00 0.00 0.00 47.33 46.04 1odk h GLY 21 CO 0.61 0.21 0.16 -0.35 0.00 0.00 0.00 176.54 177.17 1odk s ASP 22 N -6.47 6.74 0.43 0.19 -1.08 -1.26 -2.24 116.67 112.98 1odk s ASP 22 Ca -0.07 0.90 0.14 0.00 -0.52 0.00 0.00 52.55 53.00 1odk s ASP 22 Cb 0.08 -2.37 0.95 0.00 -1.46 0.00 0.00 42.92 40.12 1odk s ASP 22 CO 0.82 -0.29 1.96 1.55 0.52 0.00 0.00 175.17 179.73 1odk h PRO 23 N 7.43 0.00 -0.16 4.34 0.13 -1.88 -1.55 132.00 140.31 1odk h PRO 23 Ca -0.31 0.00 -0.09 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 32.26 1odk h PRO 23 CO 0.78 0.22 -0.30 0.78 -0.23 0.00 0.00 178.00 179.26 1odk h GLY 24 N 0.68 0.35 1.71 1.56 0.00 -1.95 -1.72 103.07 103.71 1odk h GLY 24 Ca -0.00 -0.29 -0.20 0.00 0.00 0.00 0.00 47.33 46.84 1odk h GLY 24 CO 0.03 0.26 -0.88 -0.09 0.00 0.00 0.00 176.54 175.86 1odk h ARG 25 N 0.28 0.26 -0.50 4.80 2.43 -1.76 -2.09 114.38 117.79 1odk h ARG 25 Ca 0.04 -0.28 -0.01 0.00 -0.81 0.00 0.00 59.98 58.92 1odk h ARG 25 Cb 0.68 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.28 1odk h ARG 25 CO 0.05 0.99 0.28 0.00 -1.51 0.00 0.00 179.97 179.78 1odk h ALA 26 N 0.92 0.64 -0.20 2.80 0.00 -0.91 -0.18 119.26 122.32 1odk h ALA 26 Ca -0.05 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1odk h ALA 26 Cb 1.51 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1odk h ALA 26 CO 0.14 0.16 0.11 1.49 0.00 0.00 0.00 179.25 181.15 1odk h GLU 27 N 0.67 0.28 -0.44 0.00 4.81 -1.26 -1.71 114.58 116.94 1odk h GLU 27 Ca 0.18 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.40 1odk h GLU 27 Cb 0.04 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1odk h GLU 27 CO -0.03 0.28 0.23 2.35 -0.73 0.00 0.00 179.01 181.11 1odk h TRP 28 N 0.22 0.43 -0.12 0.92 7.01 -1.10 -1.85 115.95 121.46 1odk h TRP 28 Ca 0.07 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.10 1odk h TRP 28 Cb 0.08 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 26.99 1odk h TRP 28 CO -0.04 0.23 0.01 0.82 -2.79 0.00 0.00 178.44 176.68 1odk h ILE 29 N 0.47 0.93 0.00 2.65 2.04 -0.84 0.29 117.51 123.05 1odk h ILE 29 Ca 0.18 -0.02 0.01 0.00 1.00 0.00 0.00 64.86 66.03 1odk h ILE 29 Cb 0.06 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1odk h ILE 29 CO -0.11 0.01 -0.04 0.00 0.00 0.00 0.00 178.15 178.00 1odk h ALA 30 N 1.10 -0.05 -0.08 1.87 0.00 -1.06 0.15 119.26 121.19 1odk h ALA 30 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1odk h ALA 30 Cb 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1odk h ALA 30 CO -0.09 -0.54 -0.41 0.87 0.00 0.00 0.00 179.25 179.08 1odk h LYS 31 N -0.08 0.18 0.18 0.00 1.57 -1.27 -1.73 116.57 115.42 1odk h LYS 31 Ca 0.02 -0.08 -0.28 0.00 -1.87 0.00 0.00 60.65 58.43 1odk h LYS 31 Cb 0.10 -0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.43 1odk h LYS 31 CO -0.05 0.56 -1.32 1.15 -0.57 0.00 0.00 179.45 179.22 1odk h THR 32 N 0.15 1.23 0.00 -0.16 2.02 -0.73 -3.41 112.91 112.01 1odk h THR 32 Ca 0.01 -2.55 -0.04 0.00 0.77 0.00 0.00 66.41 64.60 1odk h THR 32 Cb 0.79 2.97 -0.01 0.00 -1.74 0.00 0.00 68.15 70.16 1odk h THR 32 CO 0.06 0.77 -1.77 0.49 0.37 0.00 0.00 175.52 175.44 1odk n PHE 33 N -3.86 0.00 -3.87 3.16 3.01 0.02 -5.03 117.46 110.90 1odk n PHE 33 Ca -0.19 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 57.97 1odk n PHE 33 Cb 0.98 -0.42 -0.04 0.00 -0.01 0.00 0.00 39.48 39.99 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 -4.26 4.33 -0.12 4.37 1.43 -0.65 -4.73 118.68 119.05 1odk s LEU 34 Ca -0.06 0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 53.27 1odk s LEU 34 Cb 0.09 -3.02 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 1odk s LEU 34 CO 0.65 0.10 0.14 -1.10 0.23 0.00 0.00 176.35 176.37 1odk s GLN 35 N -2.79 3.44 -1.43 1.70 -1.52 -0.26 -4.45 119.66 114.34 1odk s GLN 35 Ca 0.36 -0.14 -0.02 0.00 -1.95 0.00 0.00 55.36 53.61 1odk s GLN 35 Cb -0.12 -3.18 0.02 0.00 -0.22 0.00 0.00 33.01 29.50 1odk s GLN 35 CO 0.28 0.78 0.47 -1.71 -0.25 0.00 0.00 175.29 174.86 1odk n ASN 36 N 1.94 -0.71 -4.76 5.90 5.15 -1.26 -1.96 115.26 119.56 1odk n ASN 36 Ca -0.20 -1.00 -0.36 0.00 -0.60 0.00 0.00 54.58 52.43 1odk n ASN 36 Cb 0.55 -3.08 0.02 0.00 -0.53 0.00 0.00 39.78 36.74 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 -6.57 3.12 -0.02 1.20 0.04 -1.26 -4.65 135.00 126.86 1odk s PRO 37 Ca 0.08 1.74 -0.01 0.00 0.04 0.00 0.00 61.00 62.86 1odk s PRO 37 Cb -0.05 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1odk s PRO 37 CO 0.89 -1.06 0.05 0.50 0.04 0.00 0.00 177.00 177.42 1odk s ARG 38 N -3.31 0.02 -0.37 4.56 3.52 -0.04 -4.95 118.95 118.38 1odk s ARG 38 Ca 0.76 0.15 -0.20 0.00 -0.13 0.00 0.00 55.73 56.31 1odk s ARG 38 Cb -0.28 -0.11 0.00 0.00 -1.56 0.00 0.00 34.95 33.01 1odk s ARG 38 CO 0.31 -0.09 0.61 0.50 -0.81 0.00 0.00 175.30 175.82 1odk s ARG 39 N 0.59 3.61 0.01 5.12 3.52 -1.26 -0.65 118.95 129.89 1odk s ARG 39 Ca -0.05 -0.06 0.24 0.00 -0.13 0.00 0.00 55.73 55.74 1odk s ARG 39 Cb -0.07 -3.83 0.33 0.00 -1.56 0.00 0.00 34.95 29.82 1odk s ARG 39 CO -0.02 -0.76 1.28 2.48 -0.81 0.00 0.00 175.30 177.48 1odk n TYR 40 N 6.01 0.07 -3.69 5.12 0.18 0.39 -4.93 117.16 120.32 1odk n TYR 40 Ca -0.02 0.02 -0.14 0.00 1.88 0.00 0.00 57.90 59.64 1odk n TYR 40 Cb 0.49 -0.26 -0.09 0.00 -0.38 0.00 0.00 39.34 39.10 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 -3.20 -0.48 0.00 9.48 2.47 -1.18 -4.59 114.94 117.44 1odk s ASN 41 Ca 0.09 0.77 0.00 0.00 0.42 0.00 0.00 52.86 54.15 1odk s ASN 41 Cb 0.17 0.80 0.00 0.00 -1.45 0.00 0.00 41.25 40.77 1odk s ASN 41 CO 0.74 -0.30 0.00 -0.90 -3.72 0.00 0.00 177.10 172.92 1odk n ASP 42 N 2.19 0.00 -4.63 -4.21 5.75 -1.26 -1.57 116.55 112.82 1odk n ASP 42 Ca -0.16 -0.21 -0.48 0.00 -0.01 0.00 0.00 54.79 53.93 1odk n ASP 42 Cb 0.56 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.61 1odk n ASP 42 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 1odk n HIS 43 N 0.00 1.79 -1.58 2.11 -0.00 -1.26 -0.56 115.22 115.72 1odk n HIS 43 Ca 0.00 0.52 -0.20 0.00 0.46 0.00 0.00 57.72 58.50 1odk n HIS 43 Cb 0.05 -2.39 -0.09 0.00 -0.12 0.00 0.00 29.99 27.44 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 2.29 -1.42 -0.91 1.57 1.74 -1.26 -2.17 116.66 116.50 1odk n ARG 44 Ca 0.15 1.20 0.00 0.00 -0.77 0.00 0.00 57.85 58.43 1odk n ARG 44 Cb 0.26 -5.56 0.00 0.00 -1.02 0.00 0.00 32.46 26.14 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 -0.46 0.48 2.58 -0.13 0.00 0.28 -4.91 105.19 103.03 1odk n GLY 45 Ca -0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 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 7.61 -4.67 0.99 4.77 -0.92 -4.76 117.00 120.02 1odk n LEU 46 Ca 0.00 -4.42 -0.48 0.00 -0.03 0.00 0.00 56.01 51.08 1odk n LEU 46 Cb 0.09 -1.55 -0.05 0.00 -2.33 0.00 0.00 43.42 39.58 1odk n LEU 46 CO 0.00 1.61 1.34 0.79 -1.33 0.00 0.00 177.39 179.80 1odk n TRP 47 N 4.25 2.26 -4.57 -1.77 7.02 -1.26 -4.42 117.44 118.95 1odk n TRP 47 Ca 0.60 0.15 -0.25 0.00 -1.02 0.00 0.00 57.50 56.99 1odk n TRP 47 Cb 0.31 -2.59 -0.17 0.00 -2.42 0.00 0.00 31.31 26.44 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 2.66 0.79 0.22 6.99 0.00 -0.61 -1.32 107.32 116.05 1odk s GLY 48 Ca 0.87 -0.41 0.09 0.00 0.00 0.00 0.00 44.72 45.28 1odk s GLY 48 CO 0.47 0.13 -0.17 -0.19 0.00 0.00 0.00 173.10 173.34 1odk s TYR 49 N 0.68 1.94 -0.02 1.90 1.51 0.41 -0.46 117.35 123.30 1odk s TYR 49 Ca -0.14 -0.47 -0.01 0.00 -1.01 0.00 0.00 57.07 55.44 1odk s TYR 49 Cb -0.16 -0.88 0.02 0.00 -0.11 0.00 0.00 41.96 40.83 1odk s TYR 49 CO 0.04 0.48 0.04 0.99 -1.11 0.00 0.00 175.55 175.99 1odk s THR 50 N -2.67 -0.03 0.05 -0.71 2.01 0.17 0.06 115.64 114.52 1odk s THR 50 Ca 0.24 0.13 -0.02 0.00 0.31 0.00 0.00 61.69 62.35 1odk s THR 50 Cb -0.03 -0.09 0.01 0.00 0.01 0.00 0.00 72.50 72.40 1odk s THR 50 CO 0.10 0.05 0.10 0.61 -0.69 0.00 0.00 174.62 174.79 1odk n GLY 51 N 3.73 2.04 3.51 4.40 0.00 -0.79 -0.86 105.19 117.23 1odk n GLY 51 Ca -0.21 -1.11 -0.34 0.00 0.00 0.00 0.00 46.02 44.36 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 3.17 -0.25 0.99 1.43 -0.83 -0.62 118.68 122.57 1odk s LEU 52 Ca 0.03 -0.11 -0.01 0.00 -1.03 0.00 0.00 54.13 53.01 1odk s LEU 52 Cb -0.01 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.51 1odk s LEU 52 CO 0.02 0.24 -0.08 -0.47 0.23 0.00 0.00 176.35 176.28 1odk s TYR 53 N -0.05 3.08 -1.53 0.29 5.04 0.12 -1.11 117.35 123.20 1odk s TYR 53 Ca 0.01 -1.72 -0.09 0.00 -2.44 0.00 0.00 57.07 52.83 1odk s TYR 53 Cb -0.13 -2.02 0.07 0.00 0.35 0.00 0.00 41.96 40.22 1odk s TYR 53 CO 0.03 -0.77 0.69 1.63 -1.34 0.00 0.00 175.55 175.79 1odk n LYS 54 N 4.62 -3.89 -0.60 4.97 5.02 -1.26 -0.58 118.16 126.45 1odk n LYS 54 Ca -0.16 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 1odk n LYS 54 Cb 0.46 -4.99 0.00 0.00 -0.02 0.00 0.00 35.03 30.49 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 1.75 3.58 0.72 0.00 -1.26 -5.02 105.19 103.27 1odk n GLY 55 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.57 4.16 0.22 1.61 1.01 0.25 -5.03 120.40 119.06 1odk s VAL 56 Ca 0.00 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1odk s VAL 56 Cb 0.00 -2.80 -0.10 0.00 0.00 0.00 0.00 36.38 33.48 1odk s VAL 56 CO 0.00 0.53 1.49 -2.84 0.00 0.00 0.00 175.10 174.27 1odk s PRO 57 N -0.07 4.24 -0.08 2.72 0.02 -1.26 0.14 135.00 140.72 1odk s PRO 57 Ca 0.03 2.34 -0.04 0.00 0.02 0.00 0.00 61.00 63.34 1odk s PRO 57 Cb -0.13 -3.12 0.04 0.00 0.02 0.00 0.00 34.50 31.31 1odk s PRO 57 CO 0.02 -0.49 0.18 0.08 -0.33 0.00 0.00 177.00 176.46 1odk s VAL 58 N 0.36 -0.04 0.13 3.83 1.01 0.21 -4.45 120.40 121.45 1odk s VAL 58 Ca 0.63 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.77 1odk s VAL 58 Cb -0.43 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 1odk s VAL 58 CO 0.40 0.06 0.21 -0.44 0.00 0.00 0.00 175.10 175.32 1odk s SER 59 N 0.99 6.04 -0.25 3.32 0.01 0.13 -1.88 113.70 122.07 1odk s SER 59 Ca -0.07 0.09 -0.01 0.00 1.31 0.00 0.00 55.95 57.26 1odk s SER 59 Cb -0.09 -1.75 0.08 0.00 0.21 0.00 0.00 66.02 64.46 1odk s SER 59 CO -0.06 0.09 0.04 -0.69 0.41 0.00 0.00 173.24 173.04 1odk s VAL 60 N -1.67 0.88 -0.18 3.43 1.01 0.11 -0.19 120.40 123.80 1odk s VAL 60 Ca 0.33 -1.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 1odk s VAL 60 Cb -0.11 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.81 1odk s VAL 60 CO 0.26 -0.39 -0.13 -1.58 0.00 0.00 0.00 175.10 173.26 1odk s GLN 61 N 1.66 3.22 0.26 2.72 2.00 -0.46 -0.45 119.66 128.61 1odk s GLN 61 Ca 0.03 -0.73 -0.30 0.00 -2.00 0.00 0.00 55.36 52.36 1odk s GLN 61 Cb -0.18 -2.72 -0.11 0.00 0.80 0.00 0.00 33.01 30.81 1odk s GLN 61 CO -0.15 -0.09 1.50 0.99 -0.50 0.00 0.00 175.29 177.05 1odk s THR 62 N 1.09 2.44 -0.10 -0.34 2.01 -0.43 -3.54 115.64 116.76 1odk s THR 62 Ca -0.00 0.36 0.17 0.00 0.31 0.00 0.00 61.69 62.54 1odk s THR 62 Cb -0.14 -3.23 -0.26 0.00 0.01 0.00 0.00 72.50 68.88 1odk s THR 62 CO -0.04 0.06 0.24 0.35 -0.69 0.00 0.00 174.62 174.54 1odk n THR 63 N 2.37 0.61 -1.70 -0.82 -2.24 -0.48 -4.75 114.28 107.26 1odk n THR 63 Ca 0.08 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1odk n THR 63 Cb 0.39 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.39 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 1.67 -2.16 3.66 3.38 0.00 -0.95 -3.56 105.19 107.24 1odk n GLY 64 Ca -0.16 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.76 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 -0.18 3.35 0.00 1.61 -1.94 -1.26 -4.65 119.30 116.23 1odk s MET 65 Ca 0.00 -0.39 0.00 0.00 -1.71 0.00 0.00 55.69 53.59 1odk s MET 65 Cb 0.00 -2.94 0.00 0.00 2.01 0.00 0.00 34.83 33.90 1odk s MET 65 CO 0.00 0.55 0.00 0.41 -0.01 0.00 0.00 175.02 175.97 1odk n GLY 66 N 2.64 1.05 0.24 -0.03 0.00 -1.21 -4.48 105.19 103.40 1odk n GLY 66 Ca -0.18 -1.64 0.08 0.00 0.00 0.00 0.00 46.02 44.28 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 0.95 -0.48 2.61 1.35 -1.53 -1.48 112.91 114.33 1odk h THR 67 Ca 0.00 -0.60 -0.03 0.00 -0.55 0.00 0.00 66.41 65.23 1odk h THR 67 Cb 0.00 1.34 -0.02 0.00 -1.73 0.00 0.00 68.15 67.74 1odk h THR 67 CO 0.00 0.16 0.18 -0.65 -0.25 0.00 0.00 175.52 174.96 1odk h PRO 68 N 0.00 0.73 -0.33 4.72 0.11 -1.89 0.28 132.00 135.62 1odk h PRO 68 Ca -0.00 -0.14 -0.11 0.00 0.11 0.00 0.00 66.00 65.85 1odk h PRO 68 Cb 0.32 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 1odk h PRO 68 CO 0.02 0.67 -0.24 1.03 -0.21 0.00 0.00 178.00 179.27 1odk h SER 69 N 0.64 0.78 -0.69 -2.05 0.87 -1.73 -2.66 113.55 108.71 1odk h SER 69 Ca 0.16 -0.44 -0.08 0.00 -1.23 0.00 0.00 61.79 60.20 1odk h SER 69 Cb 0.22 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 61.94 1odk h SER 69 CO -0.01 1.06 0.14 0.00 -0.53 0.00 0.00 176.83 177.48 1odk h ALA 70 N 0.75 0.92 -0.63 6.23 0.00 -1.09 -2.20 119.26 123.23 1odk h ALA 70 Ca 0.06 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1odk h ALA 70 Cb 0.80 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1odk h ALA 70 CO 0.06 0.67 0.25 0.00 0.00 0.00 0.00 179.25 180.23 1odk h ALA 71 N 1.07 0.82 0.04 0.00 0.00 -0.42 -0.05 119.26 120.73 1odk h ALA 71 Ca 0.21 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1odk h ALA 71 Cb 0.41 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1odk h ALA 71 CO 0.01 0.44 -0.10 0.82 0.00 0.00 0.00 179.25 180.42 1odk h ILE 72 N 0.89 0.75 -0.53 0.00 2.04 -1.23 -0.10 117.51 119.32 1odk h ILE 72 Ca 0.21 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.06 1odk h ILE 72 Cb 0.21 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 1odk h ILE 72 CO -0.02 0.00 0.30 0.58 0.00 0.00 0.00 178.15 179.02 1odk h VAL 73 N -0.20 1.17 -0.18 1.67 2.07 -1.17 -2.27 116.25 117.34 1odk h VAL 73 Ca 0.02 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 1odk h VAL 73 Cb 0.23 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1odk h VAL 73 CO -0.07 0.18 0.07 0.58 0.02 0.00 0.00 177.57 178.35 1odk h VAL 74 N 0.72 1.17 -0.59 2.57 2.07 -0.81 0.26 116.25 121.64 1odk h VAL 74 Ca 0.19 -0.51 0.05 0.00 0.82 0.00 0.00 66.70 67.25 1odk h VAL 74 Cb 0.03 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 1odk h VAL 74 CO -0.03 0.16 0.31 -0.33 0.02 0.00 0.00 177.57 177.70 1odk h GLU 75 N 0.13 0.56 -0.30 1.57 4.39 -0.94 0.06 114.58 120.06 1odk h GLU 75 Ca 0.06 -0.03 -0.17 0.00 0.34 0.00 0.00 59.36 59.55 1odk h GLU 75 Cb 0.19 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1odk h GLU 75 CO -0.00 0.37 -0.49 0.93 -1.16 0.00 0.00 179.01 178.66 1odk h GLU 76 N 0.58 0.84 -0.40 2.33 5.08 -1.30 -2.62 114.58 119.09 1odk h GLU 76 Ca 0.26 -0.50 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 1odk h GLU 76 Cb 0.17 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1odk h GLU 76 CO -0.18 1.13 0.21 -0.07 -1.00 0.00 0.00 179.01 179.11 1odk h LEU 77 N 0.66 0.51 -1.00 1.33 3.38 -0.54 -1.34 115.31 118.30 1odk h LEU 77 Ca 0.03 -0.10 0.06 0.00 0.09 0.00 0.00 57.88 57.96 1odk h LEU 77 Cb 1.08 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.64 1odk h LEU 77 CO 0.11 0.46 0.65 0.58 0.09 0.00 0.00 178.44 180.33 1odk h VAL 78 N 0.51 1.11 -0.28 1.22 2.07 -0.96 0.11 116.25 120.04 1odk h VAL 78 Ca 0.14 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 1odk h VAL 78 Cb 0.07 -0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 29.63 1odk h VAL 78 CO -0.02 0.22 -0.06 0.03 0.02 0.00 0.00 177.57 177.76 1odk h ARG 79 N 1.20 0.44 0.00 1.57 2.47 -1.02 -2.41 114.38 116.63 1odk h ARG 79 Ca 0.42 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 59.04 1odk h ARG 79 Cb 0.12 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.38 1odk h ARG 79 CO -0.16 0.52 0.00 1.28 0.56 0.00 0.00 179.97 182.17 1odk n LEU 80 N -4.27 0.00 0.00 3.04 4.77 -0.06 -4.90 117.00 115.58 1odk n LEU 80 Ca 0.01 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1odk n LEU 80 Cb 0.26 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1odk n LEU 80 CO 0.39 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1odk n GLY 81 N 1.38 1.03 3.75 -0.72 0.00 -0.66 -4.61 105.19 105.36 1odk n GLY 81 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.68 3.68 0.00 4.61 0.00 -0.73 -4.38 121.76 123.27 1odk s ALA 82 Ca 0.00 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.45 1odk s ALA 82 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1odk s ALA 82 CO 0.00 -0.91 0.00 0.54 0.00 0.00 0.00 175.76 175.39 1odk n ARG 83 N 1.93 2.86 -3.76 0.00 5.12 0.17 -4.50 116.66 118.48 1odk n ARG 83 Ca 0.06 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.70 1odk n ARG 83 Cb 0.39 -0.75 -0.16 0.00 -1.16 0.00 0.00 32.46 30.78 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 -1.07 0.73 -0.15 1.55 1.01 -0.29 -1.10 120.40 121.08 1odk s VAL 84 Ca 0.00 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1odk s VAL 84 Cb 0.00 -1.26 0.01 0.00 0.00 0.00 0.00 36.38 35.14 1odk s VAL 84 CO 0.00 -0.28 -0.21 -0.76 0.00 0.00 0.00 175.10 173.85 1odk s LEU 85 N 1.75 2.09 -0.20 3.92 1.02 0.16 -0.27 118.68 127.14 1odk s LEU 85 Ca 0.00 -0.60 0.01 0.00 0.02 0.00 0.00 54.13 53.56 1odk s LEU 85 Cb -0.17 -1.43 0.03 0.00 0.02 0.00 0.00 46.19 44.64 1odk s LEU 85 CO -0.11 0.06 -0.18 -0.69 0.02 0.00 0.00 176.35 175.45 1odk s VAL 86 N 0.91 2.10 0.24 -1.59 1.01 -0.02 -1.18 120.40 121.87 1odk s VAL 86 Ca -0.05 -1.08 -0.30 0.00 0.00 0.00 0.00 61.98 60.55 1odk s VAL 86 Cb -0.15 -1.96 -0.09 0.00 0.00 0.00 0.00 36.38 34.18 1odk s VAL 86 CO -0.04 0.42 1.06 -0.60 0.00 0.00 0.00 175.10 175.94 1odk s ARG 87 N 1.25 4.68 -0.04 2.72 3.52 0.33 0.03 118.95 131.43 1odk s ARG 87 Ca 0.02 1.70 0.02 0.00 -0.13 0.00 0.00 55.73 57.34 1odk s ARG 87 Cb -0.15 -3.24 0.01 0.00 -1.56 0.00 0.00 34.95 30.02 1odk s ARG 87 CO -0.11 0.25 -0.09 0.14 -0.81 0.00 0.00 175.30 174.68 1odk s VAL 88 N -0.91 0.85 0.00 7.11 -7.23 -1.07 -1.35 120.40 117.80 1odk s VAL 88 Ca 0.45 -0.35 0.00 0.00 -1.81 0.00 0.00 61.98 60.27 1odk s VAL 88 Cb -0.30 -0.78 0.00 0.00 0.56 0.00 0.00 36.38 35.86 1odk s VAL 88 CO 0.37 0.28 0.00 0.61 -0.31 0.00 0.00 175.10 176.05 1odk n GLY 89 N 3.58 0.72 3.81 2.32 0.00 -1.16 -3.91 105.19 110.55 1odk n GLY 89 Ca -0.21 -0.73 -0.22 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.10 2.86 0.06 2.61 -4.23 -1.26 -0.53 115.64 113.06 1odk s THR 90 Ca 0.00 -1.49 -0.19 0.00 -1.18 0.00 0.00 61.69 58.83 1odk s THR 90 Cb 0.00 -3.03 0.04 0.00 1.34 0.00 0.00 72.50 70.85 1odk s THR 90 CO 0.00 -0.08 0.44 0.00 -0.54 0.00 0.00 174.62 174.44 1odk s ALA 91 N -2.45 -1.09 -0.27 3.99 0.00 -0.98 -4.81 121.76 116.15 1odk s ALA 91 Ca 0.43 0.31 -0.13 0.00 0.00 0.00 0.00 51.96 52.57 1odk s ALA 91 Cb -0.02 0.44 -0.04 0.00 0.00 0.00 0.00 23.12 23.49 1odk s ALA 91 CO 0.25 -0.51 0.29 0.20 0.00 0.00 0.00 175.76 175.99 1odk s GLY 92 N -2.17 1.92 0.28 0.00 0.00 -0.13 -1.63 107.32 105.58 1odk s GLY 92 Ca -0.03 -0.91 -0.30 0.00 0.00 0.00 0.00 44.72 43.47 1odk s GLY 92 CO -0.04 0.80 1.58 0.00 0.00 0.00 0.00 173.10 175.44 1odk n ALA 93 N 5.11 2.35 -0.06 3.20 0.00 0.15 -0.49 120.51 130.76 1odk n ALA 93 Ca -0.11 0.38 -0.10 0.00 0.00 0.00 0.00 53.44 53.61 1odk n ALA 93 Cb 0.51 -2.44 -0.15 0.00 0.00 0.00 0.00 19.45 17.37 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 2.28 1.48 -2.01 0.00 0.00 -0.09 -1.89 120.51 120.28 1odk n ALA 94 Ca 0.10 -1.04 -0.18 0.00 0.00 0.00 0.00 53.44 52.32 1odk n ALA 94 Cb 0.36 -0.52 0.03 0.00 0.00 0.00 0.00 19.45 19.31 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 -5.84 5.44 0.00 0.00 1.04 -1.24 -4.15 113.70 108.96 1odk s SER 95 Ca -0.08 -0.48 0.24 0.00 0.48 0.00 0.00 55.95 56.11 1odk s SER 95 Cb 0.07 -0.43 0.16 0.00 0.10 0.00 0.00 66.02 65.92 1odk s SER 95 CO 0.82 -0.98 1.20 -1.54 0.98 0.00 0.00 173.24 173.73 1odk n SER 96 N -2.03 2.03 -0.09 7.02 3.41 -1.26 -4.15 113.62 118.56 1odk n SER 96 Ca 0.10 -1.51 0.13 0.00 -0.26 0.00 0.00 58.87 57.33 1odk n SER 96 Cb 0.60 0.34 0.41 0.00 -0.26 0.00 0.00 64.21 65.30 1odk n SER 96 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1odk n ASP 97 N 0.12 0.56 -4.72 4.04 3.85 -1.26 -4.83 116.55 114.31 1odk n ASP 97 Ca 0.11 -0.38 -0.36 0.00 -0.71 0.00 0.00 54.79 53.44 1odk n ASP 97 Cb 0.47 0.05 -0.07 0.00 -1.35 0.00 0.00 41.12 40.22 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 -2.76 4.24 -0.03 -2.12 1.43 -1.26 -5.08 118.68 113.09 1odk s LEU 98 Ca 0.19 0.51 -0.02 0.00 -1.03 0.00 0.00 54.13 53.78 1odk s LEU 98 Cb 0.19 -2.39 -0.04 0.00 0.03 0.00 0.00 46.19 43.98 1odk s LEU 98 CO 0.58 0.09 0.10 0.00 0.23 0.00 0.00 176.35 177.35 1odk s ALA 99 N 0.53 3.66 0.30 4.21 0.00 -1.26 -4.99 121.76 124.21 1odk s ALA 99 Ca 0.17 -0.81 -0.28 0.00 0.00 0.00 0.00 51.96 51.04 1odk s ALA 99 Cb -0.13 -1.69 -0.13 0.00 0.00 0.00 0.00 23.12 21.17 1odk s ALA 99 CO 0.04 0.68 1.15 -2.30 0.00 0.00 0.00 175.76 175.33 1odk n PRO 100 N 1.39 1.69 0.00 0.00 -0.02 -1.26 -1.42 135.00 135.38 1odk n PRO 100 Ca -0.14 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1odk n PRO 100 Cb 0.53 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 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 1.13 3.25 3.76 -1.23 0.00 0.41 -4.82 105.19 107.68 1odk n GLY 101 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.53 3.27 0.15 1.61 2.12 -0.51 -4.35 118.70 120.47 1odk s GLU 102 Ca 0.00 1.96 -0.09 0.00 0.36 0.00 0.00 54.97 57.20 1odk s GLU 102 Cb 0.00 -2.19 -0.06 0.00 0.26 0.00 0.00 34.13 32.13 1odk s GLU 102 CO 0.00 -1.01 0.47 -0.51 -0.54 0.00 0.00 175.26 173.67 1odk s LEU 103 N -3.55 4.27 -0.10 2.70 1.43 -1.23 -0.95 118.68 121.25 1odk s LEU 103 Ca 0.71 0.83 -0.01 0.00 -1.03 0.00 0.00 54.13 54.64 1odk s LEU 103 Cb -0.34 -3.33 0.03 0.00 0.03 0.00 0.00 46.19 42.58 1odk s LEU 103 CO 0.39 0.05 -0.05 -0.63 0.23 0.00 0.00 176.35 176.35 1odk s ILE 104 N -1.60 0.79 -0.41 -0.59 1.01 0.11 -0.85 121.20 119.65 1odk s ILE 104 Ca 0.40 -0.14 -0.18 0.00 0.00 0.00 0.00 60.65 60.74 1odk s ILE 104 Cb -0.13 -0.85 0.02 0.00 0.01 0.00 0.00 42.46 41.50 1odk s ILE 104 CO 0.21 0.33 0.48 -0.69 0.00 0.00 0.00 174.94 175.27 1odk s VAL 105 N 1.79 5.03 -0.27 2.92 1.01 0.04 -1.01 120.40 129.92 1odk s VAL 105 Ca 0.05 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.58 1odk s VAL 105 Cb -0.12 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 1odk s VAL 105 CO -0.07 -0.42 1.72 0.00 0.00 0.00 0.00 175.10 176.33 1odk s ALA 106 N 2.29 3.08 -0.21 5.51 0.00 -0.80 -2.26 121.76 129.37 1odk s ALA 106 Ca 0.15 0.40 0.17 0.00 0.00 0.00 0.00 51.96 52.68 1odk s ALA 106 Cb -0.16 -3.93 0.07 0.00 0.00 0.00 0.00 23.12 19.09 1odk s ALA 106 CO 0.15 -2.27 1.31 0.37 0.00 0.00 0.00 175.76 175.32 1odk h GLN 107 N 11.80 0.00 -1.77 0.00 4.15 -1.11 -3.43 115.11 124.74 1odk h GLN 107 Ca -0.34 0.00 0.25 0.00 0.77 0.00 0.00 58.65 59.33 1odk h GLN 107 Cb 1.16 0.00 -0.12 0.00 0.21 0.00 0.00 27.48 28.73 1odk h GLN 107 CO 1.01 0.32 0.70 0.20 -1.93 0.00 0.00 178.83 179.14 1odk s GLY 108 N -4.47 -0.35 -0.10 2.39 0.00 -1.25 -4.29 107.32 99.25 1odk s GLY 108 Ca 0.03 0.73 -0.02 0.00 0.00 0.00 0.00 44.72 45.46 1odk s GLY 108 CO 0.75 0.18 -0.00 0.00 0.00 0.00 0.00 173.10 174.03 1odk s ALA 109 N -2.72 0.85 0.05 3.20 0.00 -0.18 -2.23 121.76 120.73 1odk s ALA 109 Ca 0.12 -0.31 -0.30 0.00 0.00 0.00 0.00 51.96 51.46 1odk s ALA 109 Cb 0.02 -0.86 -0.08 0.00 0.00 0.00 0.00 23.12 22.19 1odk s ALA 109 CO -0.03 -0.61 1.73 0.08 0.00 0.00 0.00 175.76 176.93 1odk s VAL 110 N 1.91 3.06 -1.08 0.00 1.01 -0.12 -4.06 120.40 121.13 1odk s VAL 110 Ca 0.04 0.39 -0.20 0.00 0.00 0.00 0.00 61.98 62.20 1odk s VAL 110 Cb -0.13 -3.25 0.08 0.00 0.00 0.00 0.00 36.38 33.07 1odk s VAL 110 CO -0.06 -0.01 1.45 -2.16 0.00 0.00 0.00 175.10 174.32 1odk s PRO 111 N 3.20 3.71 -0.13 2.72 0.04 -1.26 -1.02 135.00 142.26 1odk s PRO 111 Ca 0.77 -1.53 0.16 0.00 0.04 0.00 0.00 61.00 60.44 1odk s PRO 111 Cb -0.40 -5.29 0.70 0.00 0.04 0.00 0.00 34.50 29.55 1odk s PRO 111 CO 0.34 -2.11 1.60 1.28 0.04 0.00 0.00 177.00 178.15 1odk n LEU 112 N 8.12 4.70 -4.85 -3.56 4.77 -0.15 -4.95 117.00 121.08 1odk n LEU 112 Ca 0.35 -2.37 -0.23 0.00 -0.03 0.00 0.00 56.01 53.72 1odk n LEU 112 Cb 0.49 -0.59 -0.04 0.00 -2.33 0.00 0.00 43.42 40.95 1odk n LEU 112 CO 0.65 0.74 -0.15 1.51 -1.33 0.00 0.00 177.39 178.80 1odk s ASP 113 N -0.84 5.71 0.21 -1.43 3.84 -1.10 -4.12 116.67 118.94 1odk s ASP 113 Ca 0.49 -0.14 0.24 0.00 -0.00 0.00 0.00 52.55 53.14 1odk s ASP 113 Cb 0.33 -1.52 0.44 0.00 -1.38 0.00 0.00 42.92 40.78 1odk s ASP 113 CO 0.22 -0.01 1.47 1.23 -0.00 0.00 0.00 175.17 178.07 1odk h GLY 114 N 1.70 0.00 0.58 2.12 0.00 -1.93 -3.25 103.07 102.29 1odk h GLY 114 Ca -0.49 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 1odk h GLY 114 CO 0.62 0.00 -0.03 -0.84 0.00 0.00 0.00 176.54 176.29 1odk h THR 115 N 0.00 1.19 -0.83 4.70 2.02 -1.96 0.02 112.91 118.05 1odk h THR 115 Ca 0.00 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.23 1odk h THR 115 Cb 0.82 1.79 -0.04 0.00 -1.74 0.00 0.00 68.15 68.98 1odk h THR 115 CO 0.00 0.23 0.42 0.71 0.37 0.00 0.00 175.52 177.25 1odk h THR 116 N -0.51 1.25 -0.94 3.16 1.35 -1.95 -2.08 112.91 113.19 1odk h THR 116 Ca -0.01 -0.67 0.04 0.00 -0.55 0.00 0.00 66.41 65.22 1odk h THR 116 Cb 0.44 0.16 -0.06 0.00 -1.73 0.00 0.00 68.15 66.97 1odk h THR 116 CO 0.01 0.29 0.61 -0.09 -0.25 0.00 0.00 175.52 176.10 1odk h ARG 117 N 1.18 1.14 -0.19 4.72 2.43 -1.55 0.12 114.38 122.22 1odk h ARG 117 Ca 0.29 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.34 1odk h ARG 117 Cb 0.08 -0.26 -0.00 0.00 -0.42 0.00 0.00 29.97 29.37 1odk h ARG 117 CO -0.04 0.75 -0.09 0.37 -1.51 0.00 0.00 179.97 179.45 1odk h GLN 118 N 1.17 0.40 -0.96 0.20 4.15 -0.41 0.14 115.11 119.81 1odk h GLN 118 Ca 0.38 -0.18 0.01 0.00 0.77 0.00 0.00 58.65 59.63 1odk h GLN 118 Cb 0.04 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.67 1odk h GLN 118 CO -0.13 0.70 0.62 1.88 -1.93 0.00 0.00 178.83 179.97 1odk h TYR 119 N 0.10 1.22 -0.00 3.99 -1.99 -1.03 -2.43 116.97 116.83 1odk h TYR 119 Ca 0.04 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.79 1odk h TYR 119 Cb 0.58 -0.41 0.00 0.00 2.00 0.00 0.00 36.73 38.90 1odk h TYR 119 CO 0.06 0.78 -0.14 1.28 -0.00 0.00 0.00 178.16 180.15 1odk n LEU 120 N -4.40 0.48 -3.42 3.88 4.77 -0.00 -4.93 117.00 113.37 1odk n LEU 120 Ca 0.11 0.03 -0.24 0.00 -0.03 0.00 0.00 56.01 55.88 1odk n LEU 120 Cb 0.02 -0.21 0.06 0.00 -2.33 0.00 0.00 43.42 40.97 1odk n LEU 120 CO 0.37 0.09 0.16 -0.62 -1.33 0.00 0.00 177.39 176.06 1odk n GLU 121 N -1.01 -6.91 -0.98 3.23 1.02 0.20 -2.39 120.64 113.81 1odk n GLU 121 Ca 0.13 0.85 0.00 0.00 -0.02 0.00 0.00 57.16 58.12 1odk n GLU 121 Cb 0.29 -5.84 0.00 0.00 -0.02 0.00 0.00 31.44 25.87 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 0.84 3.83 0.62 0.00 0.24 -5.03 105.19 103.84 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 -0.07 3.81 0.76 1.61 0.52 -1.00 -5.03 118.95 119.54 1odk s ARG 123 Ca 0.00 1.06 -0.13 0.00 -0.52 0.00 0.00 55.73 56.15 1odk s ARG 123 Cb 0.00 -2.11 0.05 0.00 0.52 0.00 0.00 34.95 33.41 1odk s ARG 123 CO 0.00 -0.39 1.14 -2.14 0.02 0.00 0.00 175.30 173.93 1odk s PRO 124 N -3.91 2.14 0.10 3.54 0.02 -1.26 -4.93 135.00 130.70 1odk s PRO 124 Ca 0.61 1.46 -0.26 0.00 0.02 0.00 0.00 61.00 62.84 1odk s PRO 124 Cb -0.12 -1.86 0.08 0.00 0.02 0.00 0.00 34.50 32.62 1odk s PRO 124 CO 0.30 -1.77 0.82 -0.47 -0.33 0.00 0.00 177.00 175.54 1odk s TYR 125 N -2.45 -0.33 -0.47 6.54 5.04 -1.26 -5.11 117.35 119.32 1odk s TYR 125 Ca 0.67 0.10 0.03 0.00 -2.44 0.00 0.00 57.07 55.43 1odk s TYR 125 Cb -0.22 0.58 0.14 0.00 0.35 0.00 0.00 41.96 42.81 1odk s TYR 125 CO 0.49 -0.76 0.26 0.00 -1.34 0.00 0.00 175.55 174.21 1odk s ALA 126 N -3.39 2.37 -0.00 3.97 0.00 -1.26 -4.86 121.76 118.58 1odk s ALA 126 Ca 0.06 -2.76 -0.30 0.00 0.00 0.00 0.00 51.96 48.97 1odk s ALA 126 Cb -0.02 -1.93 -0.08 0.00 0.00 0.00 0.00 23.12 21.10 1odk s ALA 126 CO -0.06 -2.06 1.89 -2.14 0.00 0.00 0.00 175.76 173.40 1odk s PRO 127 N 0.14 4.10 0.04 0.00 0.02 -1.26 -4.95 135.00 133.09 1odk s PRO 127 Ca 0.19 2.46 0.02 0.00 0.02 0.00 0.00 61.00 63.69 1odk s PRO 127 Cb -0.22 -4.13 -0.02 0.00 0.02 0.00 0.00 34.50 30.15 1odk s PRO 127 CO -0.02 -0.99 -0.07 0.14 -0.33 0.00 0.00 177.00 175.73 1odk s VAL 128 N 4.55 0.52 1.12 3.83 -7.23 -1.26 -1.01 120.40 120.92 1odk s VAL 128 Ca 0.85 -1.12 -0.18 0.00 -1.81 0.00 0.00 61.98 59.72 1odk s VAL 128 Cb -0.39 -0.65 0.25 0.00 0.56 0.00 0.00 36.38 36.15 1odk s VAL 128 CO 0.38 -0.42 1.17 -2.16 -0.31 0.00 0.00 175.10 173.76 1odk s PRO 129 N -1.70 -0.55 0.22 4.82 0.04 -1.26 -4.74 135.00 131.82 1odk s PRO 129 Ca -0.09 -0.12 -0.30 0.00 0.04 0.00 0.00 61.00 60.53 1odk s PRO 129 Cb -0.09 -1.68 -0.09 0.00 0.04 0.00 0.00 34.50 32.68 1odk s PRO 129 CO 0.00 -3.26 1.25 0.34 0.04 0.00 0.00 177.00 175.38 1odk s ASP 130 N -4.15 6.97 0.26 6.66 2.15 0.44 -4.90 116.67 124.10 1odk s ASP 130 Ca 0.71 2.37 -0.02 0.00 0.43 0.00 0.00 52.55 56.04 1odk s ASP 130 Cb -0.09 -2.62 0.41 0.00 -0.30 0.00 0.00 42.92 40.32 1odk s ASP 130 CO 0.55 -0.44 1.88 1.55 -0.17 0.00 0.00 175.17 178.54 1odk h PRO 131 N 4.92 1.13 -0.47 4.34 0.13 -1.93 -0.27 132.00 139.85 1odk h PRO 131 Ca -0.45 -0.07 -0.09 0.00 -0.87 0.00 0.00 66.00 64.52 1odk h PRO 131 Cb 1.22 -0.25 -0.02 0.00 0.13 0.00 0.00 31.00 32.08 1odk h PRO 131 CO 0.74 0.74 -0.04 0.93 -0.23 0.00 0.00 178.00 180.14 1odk h GLU 132 N 1.16 0.86 -0.32 0.86 4.39 -1.95 -0.53 114.58 119.05 1odk h GLU 132 Ca 0.43 -0.30 -0.06 0.00 0.34 0.00 0.00 59.36 59.77 1odk h GLU 132 Cb 0.18 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1odk h GLU 132 CO -0.18 0.93 -0.04 0.28 -1.16 0.00 0.00 179.01 178.84 1odk h VAL 133 N 0.71 1.27 -0.27 3.13 2.07 -1.77 -0.42 116.25 120.96 1odk h VAL 133 Ca 0.13 -1.05 0.05 0.00 0.82 0.00 0.00 66.70 66.65 1odk h VAL 133 Cb 0.57 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.59 1odk h VAL 133 CO 0.03 0.34 -0.06 0.15 0.02 0.00 0.00 177.57 178.06 1odk h PHE 134 N 0.39 -0.12 -0.64 1.57 3.57 -0.95 -0.69 116.94 120.06 1odk h PHE 134 Ca 0.09 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1odk h PHE 134 Cb 0.51 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 1odk h PHE 134 CO 0.04 -0.11 0.41 -0.09 -2.23 0.00 0.00 178.31 176.34 1odk h ARG 135 N 0.01 0.81 -0.53 1.11 2.43 -0.93 -2.16 114.38 115.12 1odk h ARG 135 Ca 0.13 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1odk h ARG 135 Cb 0.19 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1odk h ARG 135 CO -0.27 0.54 0.23 0.00 -1.51 0.00 0.00 179.97 178.96 1odk h ALA 136 N 1.25 0.69 -0.59 2.80 0.00 -0.50 -0.73 119.26 122.17 1odk h ALA 136 Ca 0.24 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1odk h ALA 136 Cb -0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1odk h ALA 136 CO -0.07 0.28 0.29 -0.07 0.00 0.00 0.00 179.25 179.68 1odk h LEU 137 N 0.72 0.77 -0.05 0.00 3.38 -0.93 0.12 115.31 119.32 1odk h LEU 137 Ca 0.18 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1odk h LEU 137 Cb 0.16 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1odk h LEU 137 CO -0.02 0.68 0.02 -0.25 0.09 0.00 0.00 178.44 178.96 1odk h TRP 138 N 0.80 0.08 -0.76 1.13 2.91 -1.22 -1.81 115.95 117.09 1odk h TRP 138 Ca 0.20 -0.01 -0.00 0.00 1.13 0.00 0.00 58.89 60.21 1odk h TRP 138 Cb 0.11 -0.02 -0.04 0.00 -0.51 0.00 0.00 29.16 28.70 1odk h TRP 138 CO -0.00 0.21 0.46 0.00 -1.03 0.00 0.00 178.44 178.08 1odk h ARG 139 N -0.07 1.04 -0.44 2.65 3.08 -0.95 -2.10 114.38 117.59 1odk h ARG 139 Ca 0.02 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 59.86 1odk h ARG 139 Cb 0.16 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1odk h ARG 139 CO -0.00 0.74 -0.17 0.00 -1.07 0.00 0.00 179.97 179.47 1odk h ARG 140 N 1.05 0.84 -0.82 0.04 2.47 -0.89 0.13 114.38 117.19 1odk h ARG 140 Ca 0.27 -0.31 -0.02 0.00 -1.26 0.00 0.00 59.98 58.66 1odk h ARG 140 Cb -0.03 -0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.20 1odk h ARG 140 CO -0.05 0.94 0.44 0.00 0.56 0.00 0.00 179.97 181.86 1odk h ALA 141 N 1.07 1.23 0.13 0.04 0.00 -1.03 -0.71 119.26 120.00 1odk h ALA 141 Ca 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1odk h ALA 141 Cb 0.68 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1odk h ALA 141 CO 0.05 0.62 -0.06 0.93 0.00 0.00 0.00 179.25 180.78 1odk h GLU 142 N 1.15 -0.17 -0.99 0.00 5.08 -0.96 -1.71 114.58 116.98 1odk h GLU 142 Ca 0.29 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.79 1odk h GLU 142 Cb 0.04 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.24 1odk h GLU 142 CO -0.05 0.20 0.61 0.00 -1.00 0.00 0.00 179.01 178.78 1odk h ALA 143 N 0.18 1.50 -0.00 3.43 0.00 -0.52 0.40 119.26 124.25 1odk h ALA 143 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1odk h ALA 143 Cb 0.46 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1odk h ALA 143 CO 0.03 0.18 -0.04 1.28 0.00 0.00 0.00 179.25 180.70 1odk n LEU 144 N -4.65 0.12 -1.59 0.00 4.77 -0.29 -4.93 117.00 110.43 1odk n LEU 144 Ca 0.19 0.23 -0.14 0.00 -0.03 0.00 0.00 56.01 56.27 1odk n LEU 144 Cb 0.37 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1odk n LEU 144 CO 0.26 0.02 -0.17 0.61 -1.33 0.00 0.00 177.39 176.79 1odk n GLY 145 N 1.31 -0.20 3.69 -0.72 0.00 0.13 -5.00 105.19 104.40 1odk n GLY 145 Ca 0.13 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.70 3.40 0.11 1.61 4.12 -0.69 -5.03 117.35 118.17 1odk s TYR 146 Ca 0.01 0.60 -0.34 0.00 0.02 0.00 0.00 57.07 57.36 1odk s TYR 146 Cb -0.00 -2.46 -0.13 0.00 -1.52 0.00 0.00 41.96 37.84 1odk s TYR 146 CO 0.01 0.07 1.64 -0.35 0.02 0.00 0.00 175.55 176.94 1odk n PRO 147 N 4.18 2.17 -3.84 -1.71 -0.04 -1.26 -4.67 135.00 129.82 1odk n PRO 147 Ca -0.10 0.79 -0.09 0.00 -0.04 0.00 0.00 63.50 64.06 1odk n PRO 147 Cb 0.51 -2.57 -0.07 0.00 -0.04 0.00 0.00 33.50 31.33 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 1.59 0.14 0.04 0.54 -3.43 -1.26 -3.48 115.29 109.42 1odk s HIS 148 Ca 0.82 -0.55 0.07 0.00 -0.80 0.00 0.00 55.06 54.60 1odk s HIS 148 Cb -0.68 -0.02 -0.02 0.00 -1.43 0.00 0.00 32.58 30.43 1odk s HIS 148 CO 0.41 -0.58 -0.21 1.03 -2.00 0.00 0.00 174.74 173.38 1odk s ARG 149 N -3.87 1.48 -0.14 -0.38 1.81 -0.03 -4.98 118.95 112.85 1odk s ARG 149 Ca 0.06 -0.94 0.02 0.00 -1.72 0.00 0.00 55.73 53.16 1odk s ARG 149 Cb 0.04 -1.58 0.01 0.00 -0.45 0.00 0.00 34.95 32.97 1odk s ARG 149 CO -0.10 0.41 -0.21 0.08 -0.68 0.00 0.00 175.30 174.80 1odk s VAL 150 N -0.76 2.13 -2.30 3.52 1.01 -1.26 -0.78 120.40 121.96 1odk s VAL 150 Ca 0.08 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.10 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 0.01 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1odk n GLY 151 N 4.03 -0.80 3.82 4.51 0.00 -0.96 -4.94 105.19 110.84 1odk n GLY 151 Ca -0.20 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 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 4.06 0.30 0.99 1.43 -1.26 -0.47 118.68 123.74 1odk s LEU 152 Ca 0.00 1.60 0.04 0.00 -1.03 0.00 0.00 54.13 54.74 1odk s LEU 152 Cb 0.00 -4.28 -0.06 0.00 0.03 0.00 0.00 46.19 41.88 1odk s LEU 152 CO 0.00 -0.25 0.03 0.68 0.23 0.00 0.00 176.35 177.04 1odk s VAL 153 N -2.00 1.23 -0.10 -1.59 -7.23 -0.95 -0.84 120.40 108.94 1odk s VAL 153 Ca 0.57 -2.02 0.03 0.00 -1.81 0.00 0.00 61.98 58.75 1odk s VAL 153 Cb -0.11 -2.68 0.00 0.00 0.56 0.00 0.00 36.38 34.15 1odk s VAL 153 CO 0.16 -0.09 -0.21 0.00 -0.31 0.00 0.00 175.10 174.65 1odk s ALA 154 N -3.27 1.96 -0.36 1.32 0.00 -0.20 -0.95 121.76 120.26 1odk s ALA 154 Ca 0.34 -0.85 -0.15 0.00 0.00 0.00 0.00 51.96 51.30 1odk s ALA 154 Cb 0.08 -0.77 -0.00 0.00 0.00 0.00 0.00 23.12 22.42 1odk s ALA 154 CO 0.14 0.21 0.33 -1.12 0.00 0.00 0.00 175.76 175.33 1odk s SER 155 N 0.47 6.14 0.36 0.00 0.01 -0.19 -1.24 113.70 119.25 1odk s SER 155 Ca -0.17 -0.43 0.08 0.00 1.31 0.00 0.00 55.95 56.75 1odk s SER 155 Cb -0.17 -2.18 -0.05 0.00 0.21 0.00 0.00 66.02 63.82 1odk s SER 155 CO 0.07 -0.36 0.06 -1.83 0.41 0.00 0.00 173.24 171.58 1odk s GLU 156 N 1.91 2.13 -0.26 12.44 -1.05 -0.38 -0.97 118.70 132.52 1odk s GLU 156 Ca 0.09 -1.76 -0.05 0.00 -0.15 0.00 0.00 54.97 53.10 1odk s GLU 156 Cb -0.17 -1.95 -0.14 0.00 -0.44 0.00 0.00 34.13 31.42 1odk s GLU 156 CO 0.11 0.08 -0.28 -0.25 0.95 0.00 0.00 175.26 175.87 1odk n ASP 157 N -1.03 1.97 -4.38 0.83 10.43 -1.26 -4.48 116.55 118.64 1odk n ASP 157 Ca -0.04 0.09 -0.45 0.00 2.57 0.00 0.00 54.79 56.96 1odk n ASP 157 Cb 0.63 -0.59 -0.01 0.00 1.84 0.00 0.00 41.12 42.99 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 -2.50 4.08 0.25 2.24 0.00 -1.26 -4.91 121.76 119.66 1odk s ALA 158 Ca -0.36 -3.33 -0.07 0.00 0.00 0.00 0.00 51.96 48.20 1odk s ALA 158 Cb 0.11 -3.73 0.45 0.00 0.00 0.00 0.00 23.12 19.96 1odk s ALA 158 CO 0.53 -2.48 1.63 0.35 0.00 0.00 0.00 175.76 175.79 1odk h PHE 159 N 7.66 -0.06 -0.16 0.00 3.57 -1.99 -1.11 116.94 124.85 1odk h PHE 159 Ca 0.16 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.72 1odk h PHE 159 Cb 0.97 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.87 1odk h PHE 159 CO 1.01 -0.26 0.00 0.66 -2.23 0.00 0.00 178.31 177.49 1odk n TYR 160 N -5.36 0.21 -0.03 0.41 4.02 -1.26 -4.03 117.16 111.12 1odk n TYR 160 Ca 0.14 -0.11 -0.12 0.00 -0.01 0.00 0.00 57.90 57.81 1odk n TYR 160 Cb 0.49 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.67 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 1.36 -2.27 -0.72 0.00 -0.42 -4.91 120.51 113.69 1odk n ALA 161 Ca 0.14 -0.80 -0.42 0.00 0.00 0.00 0.00 53.44 52.36 1odk n ALA 161 Cb 0.26 -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 3.74 0.25 0.00 2.01 -1.23 -5.03 115.64 112.80 1odk s THR 162 Ca -0.10 1.17 0.03 0.00 0.31 0.00 0.00 61.69 63.10 1odk s THR 162 Cb 0.07 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 1odk s THR 162 CO 0.81 0.03 0.40 0.42 -0.69 0.00 0.00 174.62 175.58 1odk s THR 163 N 1.95 5.23 0.40 -0.82 -4.23 -1.26 -4.96 115.64 111.94 1odk s THR 163 Ca 0.62 -0.75 0.11 0.00 -1.18 0.00 0.00 61.69 60.49 1odk s THR 163 Cb -0.31 -3.83 0.32 0.00 1.34 0.00 0.00 72.50 70.02 1odk s THR 163 CO 0.27 -0.33 1.93 -0.65 -0.54 0.00 0.00 174.62 175.31 1odk h PRO 164 N 1.31 0.55 -0.47 3.99 0.11 -1.96 0.64 132.00 136.17 1odk h PRO 164 Ca -0.51 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.54 1odk h PRO 164 Cb 1.22 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1odk h PRO 164 CO 0.63 0.36 0.15 1.49 -0.21 0.00 0.00 178.00 180.43 1odk h GLU 165 N 0.57 0.73 -0.49 1.05 4.81 -1.95 -0.20 114.58 119.09 1odk h GLU 165 Ca 0.35 -0.15 -0.12 0.00 -0.13 0.00 0.00 59.36 59.31 1odk h GLU 165 Cb 0.58 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1odk h GLU 165 CO -0.12 0.69 -0.15 0.93 -0.73 0.00 0.00 179.01 179.63 1odk h GLU 166 N 0.63 0.94 -0.37 1.92 5.08 -1.51 -2.04 114.58 119.24 1odk h GLU 166 Ca 0.15 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1odk h GLU 166 Cb 0.26 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1odk h GLU 166 CO -0.01 1.02 0.23 0.00 -1.00 0.00 0.00 179.01 179.26 1odk h ALA 167 N 0.98 0.47 -0.63 3.43 0.00 -0.63 -1.22 119.26 121.67 1odk h ALA 167 Ca 0.12 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1odk h ALA 167 Cb 0.70 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1odk h ALA 167 CO 0.05 -0.06 0.35 0.00 0.00 0.00 0.00 179.25 179.60 1odk h ARG 168 N 0.49 0.86 -0.37 0.00 3.08 -0.89 -0.70 114.38 116.85 1odk h ARG 168 Ca 0.13 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 1odk h ARG 168 Cb -0.03 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 1odk h ARG 168 CO -0.03 0.63 0.16 0.00 -1.07 0.00 0.00 179.97 179.66 1odk h ALA 169 N 1.52 0.48 -0.33 0.04 0.00 -0.72 -2.54 119.26 117.71 1odk h ALA 169 Ca 0.22 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1odk h ALA 169 Cb 0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1odk h ALA 169 CO -0.04 0.06 -0.03 -1.49 0.00 0.00 0.00 179.25 177.76 1odk h TRP 170 N 0.46 0.54 -0.22 0.00 4.06 -0.61 -2.34 115.95 117.84 1odk h TRP 170 Ca 0.13 -0.06 -0.01 0.00 2.06 0.00 0.00 58.89 61.01 1odk h TRP 170 Cb 0.16 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 1odk h TRP 170 CO -0.01 0.55 0.11 0.00 -3.56 0.00 0.00 178.44 175.53 1odk h ALA 171 N 1.48 1.78 0.00 1.49 0.00 -0.73 0.42 119.26 123.70 1odk h ALA 171 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1odk h ALA 171 Cb 0.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1odk h ALA 171 CO 0.01 0.18 0.00 0.54 0.00 0.00 0.00 179.25 179.99 1odk n ARG 172 N -4.47 0.07 -0.27 0.00 1.74 -0.88 -1.56 116.66 111.29 1odk n ARG 172 Ca 0.00 0.22 0.07 0.00 -0.77 0.00 0.00 57.85 57.37 1odk n ARG 172 Cb 0.10 -1.50 0.19 0.00 -1.02 0.00 0.00 32.46 30.24 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 -1.43 0.64 -0.03 -1.55 4.01 0.11 -4.96 117.16 113.94 1odk n TYR 173 Ca 0.04 -0.59 0.00 0.00 -0.16 0.00 0.00 57.90 57.19 1odk n TYR 173 Cb 0.15 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 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 0.33 0.41 3.66 2.72 0.00 -0.60 -5.05 105.19 106.66 1odk n GLY 174 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.07 4.17 -0.03 1.61 1.01 -1.02 -4.01 120.40 120.05 1odk s VAL 175 Ca 0.00 1.42 -0.09 0.00 0.00 0.00 0.00 61.98 63.31 1odk s VAL 175 Cb 0.00 -3.92 -0.30 0.00 0.00 0.00 0.00 36.38 32.16 1odk s VAL 175 CO 0.00 -0.12 0.72 -0.07 0.00 0.00 0.00 175.10 175.64 1odk h LEU 176 N 9.68 0.58 -7.49 3.92 3.38 -1.33 -3.35 115.31 120.71 1odk h LEU 176 Ca -0.29 -0.85 0.04 0.00 0.09 0.00 0.00 57.88 56.87 1odk h LEU 176 Cb 1.12 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 41.59 1odk h LEU 176 CO 0.96 1.71 0.24 0.00 0.09 0.00 0.00 178.44 181.45 1odk s ALA 177 N -2.59 -1.44 0.01 1.53 0.00 -1.25 -0.91 121.76 117.11 1odk s ALA 177 Ca -0.14 0.13 0.03 0.00 0.00 0.00 0.00 51.96 51.98 1odk s ALA 177 Cb 0.06 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.98 1odk s ALA 177 CO 0.86 -0.90 -0.03 -0.06 0.00 0.00 0.00 175.76 175.62 1odk s PHE 178 N -3.78 2.97 0.00 0.00 0.40 0.35 -1.03 117.98 116.89 1odk s PHE 178 Ca 0.06 0.01 0.00 0.00 -0.60 0.00 0.00 56.93 56.40 1odk s PHE 178 Cb -0.03 -1.63 0.00 0.00 0.51 0.00 0.00 43.02 41.87 1odk s PHE 178 CO -0.03 0.42 0.00 -0.85 0.70 0.00 0.00 175.22 175.46 1odk n GLU 179 N 1.40 0.00 -1.41 0.44 -0.00 -0.37 -0.95 120.64 119.74 1odk n GLU 179 Ca -0.15 0.00 0.04 0.00 -0.00 0.00 0.00 57.16 57.05 1odk n GLU 179 Cb 0.53 0.00 0.02 0.00 -0.00 0.00 0.00 31.44 31.99 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 0.05 0.00 3.44 2.81 -1.26 -1.25 117.12 120.91 1odk n MET 180 Ca 0.00 -1.99 0.00 0.00 -1.81 0.00 0.00 57.70 53.90 1odk n MET 180 Cb 0.00 -0.08 0.00 0.00 -0.71 0.00 0.00 33.22 32.43 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 0.42 0.00 -0.18 0.03 4.71 -1.26 -1.37 120.64 122.98 1odk n GLU 181 Ca 0.06 0.00 -0.01 0.00 -0.01 0.00 0.00 57.16 57.20 1odk n GLU 181 Cb 1.11 -0.41 0.07 0.00 -1.01 0.00 0.00 31.44 31.19 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 0.47 -0.47 0.62 0.00 -1.96 -2.93 119.26 115.00 1odk h ALA 182 Ca 0.00 0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.19 1odk h ALA 182 Cb 0.00 0.34 -0.08 0.00 0.00 0.00 0.00 17.79 18.04 1odk h ALA 182 CO 0.00 -0.41 -0.03 0.66 0.00 0.00 0.00 179.25 179.47 1odk h SER 183 N 0.07 -0.27 -0.13 0.00 4.64 -1.89 -0.20 113.55 115.77 1odk h SER 183 Ca 0.28 0.12 -0.09 0.00 -0.47 0.00 0.00 61.79 61.63 1odk h SER 183 Cb 0.43 0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 1odk h SER 183 CO -0.50 -0.09 -0.21 0.00 -0.87 0.00 0.00 176.83 175.15 1odk h ALA 184 N 1.43 1.09 -0.22 5.18 0.00 -1.91 -1.11 119.26 123.73 1odk h ALA 184 Ca 0.23 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1odk h ALA 184 Cb 0.35 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1odk h ALA 184 CO -0.42 0.56 0.05 1.25 0.00 0.00 0.00 179.25 180.69 1odk h LEU 185 N 0.49 0.33 -0.46 0.00 5.85 -1.14 -1.31 115.31 119.08 1odk h LEU 185 Ca 0.08 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1odk h LEU 185 Cb 0.64 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1odk h LEU 185 CO 0.05 0.48 0.22 -0.26 -0.34 0.00 0.00 178.44 178.58 1odk h PHE 186 N 0.17 0.65 -0.06 1.25 0.05 -0.90 -0.22 116.94 117.88 1odk h PHE 186 Ca 0.07 -0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.83 1odk h PHE 186 Cb 0.28 -0.20 -0.00 0.00 2.00 0.00 0.00 35.95 38.02 1odk h PHE 186 CO 0.01 0.53 0.04 1.25 -0.18 0.00 0.00 178.31 179.95 1odk h LEU 187 N 0.59 0.07 -1.36 1.54 5.85 -1.13 -2.50 115.31 118.37 1odk h LEU 187 Ca 0.16 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 1odk h LEU 187 Cb 0.11 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1odk h LEU 187 CO -0.02 0.10 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.09 1odk h LEU 188 N 0.04 0.37 -0.53 2.25 3.38 -1.11 -0.35 115.31 119.36 1odk h LEU 188 Ca 0.02 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1odk h LEU 188 Cb 0.04 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1odk h LEU 188 CO -0.00 0.45 0.26 1.23 0.09 0.00 0.00 178.44 180.47 1odk h GLY 189 N 0.73 0.74 0.96 0.83 0.00 -0.60 0.26 103.07 105.99 1odk h GLY 189 Ca 0.09 -0.18 -0.14 0.00 0.00 0.00 0.00 47.33 47.10 1odk h GLY 189 CO 0.01 0.11 -0.43 3.21 0.00 0.00 0.00 176.54 179.43 1odk h ARG 190 N 0.51 0.64 -0.57 4.80 2.47 -1.11 0.10 114.38 121.22 1odk h ARG 190 Ca 0.24 -0.43 -0.02 0.00 -1.26 0.00 0.00 59.98 58.51 1odk h ARG 190 Cb 0.15 0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.50 1odk h ARG 190 CO -0.17 1.04 0.29 0.52 0.56 0.00 0.00 179.97 182.22 1odk h MET 191 N 0.32 0.81 -0.56 0.04 2.86 -0.62 -3.06 114.93 114.72 1odk h MET 191 Ca 0.00 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 1odk h MET 191 Cb 1.04 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1odk h MET 191 CO 0.10 0.64 0.00 0.54 1.06 0.00 0.00 176.91 179.24 1odk n ARG 192 N -4.57 2.41 -3.11 1.72 5.12 0.88 -4.97 116.66 114.14 1odk n ARG 192 Ca 0.03 -2.18 -0.20 0.00 -1.93 0.00 0.00 57.85 53.57 1odk n ARG 192 Cb 0.10 -1.48 0.05 0.00 -1.16 0.00 0.00 32.46 29.96 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 1.47 -0.33 3.54 -0.13 0.00 -0.82 -5.02 105.19 103.90 1odk n GLY 193 Ca 0.20 0.04 -0.26 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.16 2.30 -0.22 1.61 -7.23 -0.04 -5.04 120.40 108.62 1odk s VAL 194 Ca 0.35 -2.21 -0.13 0.00 -1.81 0.00 0.00 61.98 58.18 1odk s VAL 194 Cb -0.16 -2.62 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 1odk s VAL 194 CO 0.44 -0.23 0.26 -0.13 -0.31 0.00 0.00 175.10 175.13 1odk s ARG 195 N -3.60 4.12 0.27 4.82 0.52 -0.25 -4.35 118.95 120.47 1odk s ARG 195 Ca 0.32 -0.07 0.05 0.00 -0.52 0.00 0.00 55.73 55.52 1odk s ARG 195 Cb 0.01 -3.53 -0.06 0.00 0.52 0.00 0.00 34.95 31.89 1odk s ARG 195 CO 0.17 0.03 -0.03 0.95 0.02 0.00 0.00 175.30 176.44 1odk s THR 196 N 1.13 1.41 0.21 0.02 -4.23 -1.26 -0.67 115.64 112.25 1odk s THR 196 Ca 0.12 -2.08 -0.23 0.00 -1.18 0.00 0.00 61.69 58.33 1odk s THR 196 Cb -0.14 -2.46 0.05 0.00 1.34 0.00 0.00 72.50 71.29 1odk s THR 196 CO 0.06 -0.27 0.90 -0.83 -0.54 0.00 0.00 174.62 173.94 1odk s GLY 197 N -3.41 -0.09 -0.19 3.99 0.00 -0.33 -0.42 107.32 106.87 1odk s GLY 197 Ca 0.30 -0.12 -0.15 0.00 0.00 0.00 0.00 44.72 44.75 1odk s GLY 197 CO 0.11 0.27 0.48 0.00 0.00 0.00 0.00 173.10 173.96 1odk s ALA 198 N -3.19 -1.21 -0.02 3.20 0.00 -1.26 -0.52 121.76 118.77 1odk s ALA 198 Ca 0.14 1.48 0.01 0.00 0.00 0.00 0.00 51.96 53.59 1odk s ALA 198 Cb -0.03 -0.87 0.01 0.00 0.00 0.00 0.00 23.12 22.23 1odk s ALA 198 CO 0.05 -0.25 -0.04 -1.50 0.00 0.00 0.00 175.76 174.02 1odk s ILE 199 N 0.64 0.40 0.16 0.00 2.07 -0.46 -1.91 121.20 122.11 1odk s ILE 199 Ca -0.03 -0.14 0.05 0.00 -1.41 0.00 0.00 60.65 59.12 1odk s ILE 199 Cb -0.05 -0.38 -0.05 0.00 0.13 0.00 0.00 42.46 42.11 1odk s ILE 199 CO -0.04 0.15 -0.11 -0.76 -1.91 0.00 0.00 174.94 172.27 1odk s LEU 200 N 0.34 2.52 -0.12 8.50 1.43 -0.18 -2.99 118.68 128.19 1odk s LEU 200 Ca -0.04 -1.03 0.02 0.00 -1.03 0.00 0.00 54.13 52.05 1odk s LEU 200 Cb -0.07 -0.42 -0.01 0.00 0.03 0.00 0.00 46.19 45.72 1odk s LEU 200 CO -0.00 -0.30 -0.18 0.00 0.23 0.00 0.00 176.35 176.09 1odk s ALA 201 N -3.25 2.41 0.01 4.21 0.00 0.31 -0.71 121.76 124.74 1odk s ALA 201 Ca 0.19 -0.95 -0.30 0.00 0.00 0.00 0.00 51.96 50.89 1odk s ALA 201 Cb 0.02 -1.05 -0.06 0.00 0.00 0.00 0.00 23.12 22.02 1odk s ALA 201 CO 0.02 0.21 1.57 0.08 0.00 0.00 0.00 175.76 177.64 1odk s VAL 202 N 0.44 3.43 -0.13 0.00 1.01 -0.12 -2.32 120.40 122.72 1odk s VAL 202 Ca -0.13 0.76 0.18 0.00 0.00 0.00 0.00 61.98 62.79 1odk s VAL 202 Cb -0.17 -3.49 -0.27 0.00 0.00 0.00 0.00 36.38 32.45 1odk s VAL 202 CO 0.06 -0.02 0.45 -1.54 0.00 0.00 0.00 175.10 174.04 1odk n SER 203 N 6.02 0.83 -3.58 3.32 3.41 -0.65 0.15 113.62 123.12 1odk n SER 203 Ca 0.15 -0.12 -0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1odk n SER 203 Cb 0.42 1.73 0.02 0.00 -0.26 0.00 0.00 64.21 66.12 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 0.01 -0.10 4.04 4.22 -1.24 -4.88 114.94 113.06 1odk s ASN 204 Ca -0.05 -0.44 0.03 0.00 -2.14 0.00 0.00 52.86 50.26 1odk s ASN 204 Cb 0.12 0.32 0.00 0.00 1.28 0.00 0.00 41.25 42.98 1odk s ASN 204 CO 0.76 -0.65 -0.21 -0.60 -2.04 0.00 0.00 177.10 174.36 1odk s ARG 205 N -2.09 2.72 0.00 3.55 3.52 -1.26 0.31 118.95 125.70 1odk s ARG 205 Ca 0.26 -0.76 0.00 0.00 -0.13 0.00 0.00 55.73 55.09 1odk s ARG 205 Cb -0.02 -2.10 0.00 0.00 -1.56 0.00 0.00 34.95 31.27 1odk s ARG 205 CO 0.02 0.11 0.38 -0.89 -0.81 0.00 0.00 175.30 174.11 1odk n ILE 206 N 3.68 0.00 0.00 4.11 5.41 -0.79 -4.88 119.36 126.88 1odk n ILE 206 Ca -0.20 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.55 1odk n ILE 206 Cb 0.52 -1.34 0.00 0.00 -0.71 0.00 0.00 39.64 38.11 1odk n ILE 206 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1odk n PRO 212 N 2.73 0.00 -0.00 0.38 -0.02 -1.26 -4.80 135.00 132.03 1odk n PRO 212 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1odk n PRO 212 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1odk n PRO 212 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1odk h PRO 213 N 0.00 -0.00 0.00 0.52 0.11 -2.01 -0.34 132.00 130.29 1odk h PRO 213 Ca 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1odk h PRO 213 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 1odk h PRO 213 CO 0.00 -0.00 -0.16 1.49 -0.21 0.00 0.00 178.00 179.12 1odk h GLU 215 N -0.00 0.00 -0.46 1.05 4.57 -2.05 0.44 114.58 118.14 1odk h GLU 215 Ca 0.00 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.04 1odk h GLU 215 Cb 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 1odk h GLU 215 CO -0.00 0.16 -0.25 0.28 -1.18 0.00 0.00 179.01 178.02 1odk h VAL 216 N 0.00 1.27 0.08 0.32 2.07 -1.90 -1.04 116.25 117.04 1odk h VAL 216 Ca -0.00 -1.41 -0.26 0.00 0.82 0.00 0.00 66.70 65.85 1odk h VAL 216 Cb 0.40 1.19 0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1odk h VAL 216 CO 0.02 0.48 -1.12 0.25 0.02 0.00 0.00 177.57 177.22 1odk h LEU 217 N 0.82 0.53 -0.84 2.57 5.85 -0.37 -3.03 115.31 120.83 1odk h LEU 217 Ca 0.10 -0.49 -0.08 0.00 0.84 0.00 0.00 57.88 58.25 1odk h LEU 217 Cb 0.83 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 1odk h LEU 217 CO 0.07 1.33 0.03 -0.61 -0.34 0.00 0.00 178.44 178.93 1odk h GLN 218 N 0.16 0.90 -0.50 1.25 5.75 -0.03 0.10 115.11 122.73 1odk h GLN 218 Ca -0.12 -0.24 -0.11 0.00 -0.15 0.00 0.00 58.65 58.03 1odk h GLN 218 Cb 1.80 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 30.23 1odk h GLN 218 CO 0.19 0.87 -0.12 1.49 -2.65 0.00 0.00 178.83 178.61 1odk h GLU 219 N 0.84 0.95 -0.53 1.69 4.57 -1.26 0.12 114.58 120.95 1odk h GLU 219 Ca 0.16 -0.35 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 1odk h GLU 219 Cb 0.46 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 1odk h GLU 219 CO 0.02 1.01 0.34 0.78 -1.18 0.00 0.00 179.01 179.98 1odk h GLY 220 N 0.95 0.76 1.02 1.92 0.00 -1.27 0.64 103.07 107.09 1odk h GLY 220 Ca 0.13 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 1odk h GLY 220 CO 0.05 0.28 0.46 -2.08 0.00 0.00 0.00 176.54 175.25 1odk h VAL 221 N 0.72 1.25 -0.06 4.60 2.07 -0.30 0.14 116.25 124.67 1odk h VAL 221 Ca 0.19 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 1odk h VAL 221 Cb -0.06 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 29.82 1odk h VAL 221 CO -0.04 0.28 0.01 -0.09 0.02 0.00 0.00 177.57 177.76 1odk h ARG 222 N 1.19 0.10 -0.79 1.57 2.43 -0.09 -1.43 114.38 117.35 1odk h ARG 222 Ca 0.30 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.45 1odk h ARG 222 Cb 0.04 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.54 1odk h ARG 222 CO -0.05 0.30 0.52 0.00 -1.51 0.00 0.00 179.97 179.23 1odk h ARG 223 N -0.12 1.04 -0.22 0.20 3.08 -0.69 -1.12 114.38 116.55 1odk h ARG 223 Ca 0.02 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.03 1odk h ARG 223 Cb 0.24 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1odk h ARG 223 CO 0.00 0.69 0.06 1.98 -1.07 0.00 0.00 179.97 181.63 1odk h MET 224 N 1.07 0.15 -0.56 0.04 4.05 -0.82 -0.90 114.93 117.96 1odk h MET 224 Ca 0.29 -0.01 -0.09 0.00 -0.28 0.00 0.00 59.70 59.61 1odk h MET 224 Cb -0.12 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.62 1odk h MET 224 CO -0.06 0.10 0.00 0.28 0.23 0.00 0.00 176.91 177.46 1odk h VAL 225 N 0.16 1.26 -0.69 -5.77 2.07 -0.94 -1.85 116.25 110.48 1odk h VAL 225 Ca 0.10 -1.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 1odk h VAL 225 Cb 0.08 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1odk h VAL 225 CO -0.11 0.40 0.37 -0.08 0.02 0.00 0.00 177.57 178.17 1odk h GLU 226 N 0.87 0.97 -0.41 1.57 4.81 -0.97 -0.45 114.58 120.97 1odk h GLU 226 Ca 0.16 -0.12 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1odk h GLU 226 Cb 0.54 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1odk h GLU 226 CO 0.03 0.74 0.12 0.28 -0.73 0.00 0.00 179.01 179.44 1odk h VAL 227 N 0.96 1.22 -0.77 0.32 2.07 -1.01 -1.81 116.25 117.23 1odk h VAL 227 Ca 0.24 -0.75 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 1odk h VAL 227 Cb 0.05 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1odk h VAL 227 CO -0.04 0.26 0.35 0.00 0.02 0.00 0.00 177.57 178.17 1odk h ALA 228 N 0.97 0.99 -0.05 1.67 0.00 -1.02 -0.12 119.26 121.70 1odk h ALA 228 Ca 0.13 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1odk h ALA 228 Cb 0.28 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1odk h ALA 228 CO -0.00 0.58 0.01 -0.07 0.00 0.00 0.00 179.25 179.77 1odk h LEU 229 N 1.09 0.08 -1.01 0.00 3.38 -0.94 -1.27 115.31 116.64 1odk h LEU 229 Ca 0.26 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1odk h LEU 229 Cb 0.15 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1odk h LEU 229 CO -0.03 0.28 0.52 -0.33 0.09 0.00 0.00 178.44 178.97 1odk h GLU 230 N -0.13 1.20 -0.56 1.13 4.39 -1.18 -2.81 114.58 116.63 1odk h GLU 230 Ca 0.02 -0.12 -0.08 0.00 0.34 0.00 0.00 59.36 59.52 1odk h GLU 230 Cb 0.23 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1odk h GLU 230 CO 0.00 0.85 0.04 0.00 -1.16 0.00 0.00 179.01 178.74 1odk h ALA 231 N 1.35 0.74 0.00 3.43 0.00 -0.84 -2.27 119.26 121.67 1odk h ALA 231 Ca 0.32 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1odk h ALA 231 Cb -0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1odk h ALA 231 CO -0.06 0.53 -0.17 -0.39 0.00 0.00 0.00 179.25 179.16 1odk h VAL 232 N 0.84 0.50 0.00 0.00 -1.51 -1.01 -1.99 116.25 113.08 1odk h VAL 232 Ca 0.16 -0.88 -0.15 0.00 -1.23 0.00 0.00 66.70 64.60 1odk h VAL 232 Cb 0.48 1.61 -0.02 0.00 -2.13 0.00 0.00 31.29 31.23 1odk h VAL 232 CO 0.02 0.17 -0.72 -0.07 -1.23 0.00 0.00 177.57 175.74 1odk h LEU 233 N 0.00 0.00 -1.07 4.19 4.07 -1.28 -3.24 115.31 117.97 1odk h LEU 233 Ca -0.00 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.86 1odk h LEU 233 Cb 0.59 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 1odk h LEU 233 CO 0.02 0.72 -0.46 -0.33 -1.08 0.00 0.00 178.44 177.32 1odk h GLU 234 N 0.00 0.00 -0.03 1.13 4.39 -0.77 -3.52 114.58 115.78 1odk h GLU 234 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1odk h GLU 234 Cb 1.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.17 1odk h GLU 234 CO 0.09 0.46 0.00 1.33 -1.16 0.00 0.00 179.01 179.73