#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 1.48 0.15 -1.46 0.02 -1.25 -4.96 135.00 128.99 1odk s PRO 3 Ca 0.00 1.61 -0.13 0.00 0.02 0.00 0.00 61.00 62.50 1odk s PRO 3 Cb 0.00 -1.77 0.04 0.00 0.02 0.00 0.00 34.50 32.78 1odk s PRO 3 CO 0.00 -2.30 1.66 0.82 -0.33 0.00 0.00 177.00 176.86 1odk h ILE 4 N -1.28 1.24 0.00 2.83 2.04 -1.99 -3.37 117.51 116.98 1odk h ILE 4 Ca -0.45 -0.85 -0.43 0.00 1.00 0.00 0.00 64.86 64.13 1odk h ILE 4 Cb 1.28 0.81 -0.07 0.00 -0.74 0.00 0.00 36.82 38.10 1odk h ILE 4 CO 0.45 0.31 -2.46 1.41 0.00 0.00 0.00 178.15 177.86 1odk n HIS 5 N -4.44 0.00 -3.11 1.37 8.25 -1.26 -4.71 115.22 111.32 1odk n HIS 5 Ca 0.02 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.03 1odk n HIS 5 Cb 0.22 -0.95 -0.03 0.00 1.12 0.00 0.00 29.99 30.35 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 -2.49 5.02 -1.40 1.59 1.01 -1.26 -4.73 120.40 118.15 1odk s VAL 6 Ca -0.36 -1.63 -0.15 0.00 0.00 0.00 0.00 61.98 59.83 1odk s VAL 6 Cb 0.13 -4.59 0.05 0.00 0.00 0.00 0.00 36.38 31.97 1odk s VAL 6 CO 0.49 -1.24 2.04 0.54 0.00 0.00 0.00 175.10 176.92 1odk n ARG 7 N 5.73 2.99 -4.25 2.72 1.74 -1.26 -3.97 116.66 120.37 1odk n ARG 7 Ca 0.09 -2.87 -0.21 0.00 -0.77 0.00 0.00 57.85 54.09 1odk n ARG 7 Cb 0.46 -3.36 -0.07 0.00 -1.02 0.00 0.00 32.46 28.47 1odk n ARG 7 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1odk n ALA 8 N 6.92 0.66 -2.52 7.54 0.00 -1.26 -4.82 120.51 127.03 1odk n ALA 8 Ca 0.51 -1.96 -0.25 0.00 0.00 0.00 0.00 53.44 51.74 1odk n ALA 8 Cb 0.42 1.49 -0.10 0.00 0.00 0.00 0.00 19.45 21.26 1odk n ALA 8 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1odk s HIS 9 N -3.24 2.47 0.24 0.00 3.76 -1.26 -4.21 115.29 113.05 1odk s HIS 9 Ca 0.33 -0.28 -0.10 0.00 -0.15 0.00 0.00 55.06 54.85 1odk s HIS 9 Cb 0.02 -1.15 0.36 0.00 1.11 0.00 0.00 32.58 32.92 1odk s HIS 9 CO 0.23 0.59 1.61 -1.35 -0.85 0.00 0.00 174.74 174.97 1odk h PRO 10 N 2.58 0.02 0.00 8.40 0.11 -1.90 0.19 132.00 141.40 1odk h PRO 10 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1odk h PRO 10 Cb 1.23 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1odk h PRO 10 CO 0.56 0.02 0.12 0.78 -0.21 0.00 0.00 178.00 179.26 1odk h GLY 11 N 0.03 0.00 1.58 -0.55 0.00 -1.97 -1.65 103.07 100.52 1odk h GLY 11 Ca 0.39 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.61 1odk h GLY 11 CO -0.76 0.00 -0.81 -0.55 0.00 0.00 0.00 176.54 174.43 1odk h ASP 12 N 0.00 0.00 -3.28 0.19 3.32 -0.96 -3.46 116.42 112.23 1odk h ASP 12 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 1odk h ASP 12 Cb 0.23 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.61 1odk h ASP 12 CO 0.00 0.45 -0.61 -0.69 -1.72 0.00 0.00 179.24 176.67 1odk s VAL 13 N -3.00 4.37 0.74 -1.35 1.01 -0.62 -4.72 120.40 116.84 1odk s VAL 13 Ca 0.02 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 61.69 1odk s VAL 13 Cb 0.08 -2.92 0.04 0.00 0.00 0.00 0.00 36.38 33.58 1odk s VAL 13 CO 0.77 0.51 1.10 0.00 0.00 0.00 0.00 175.10 177.48 1odk s ALA 14 N 0.03 2.63 0.32 5.51 0.00 -1.26 -4.82 121.76 124.18 1odk s ALA 14 Ca 0.03 -0.29 0.09 0.00 0.00 0.00 0.00 51.96 51.79 1odk s ALA 14 Cb -0.13 -3.06 0.56 0.00 0.00 0.00 0.00 23.12 20.49 1odk s ALA 14 CO 0.02 -1.38 1.76 0.93 0.00 0.00 0.00 175.76 177.08 1odk h GLU 15 N -0.83 0.17 -5.05 0.00 5.08 -1.83 -3.39 114.58 108.73 1odk h GLU 15 Ca -0.46 -0.07 -0.62 0.00 -1.00 0.00 0.00 59.36 57.21 1odk h GLU 15 Cb 1.26 -0.01 -0.15 0.00 0.50 0.00 0.00 28.75 30.35 1odk h GLU 15 CO 0.62 0.52 -0.51 1.03 -1.00 0.00 0.00 179.01 179.67 1odk s ARG 16 N -4.22 4.04 -0.02 2.33 0.52 -1.26 -0.27 118.95 120.07 1odk s ARG 16 Ca -0.04 -0.28 0.02 0.00 -0.52 0.00 0.00 55.73 54.91 1odk s ARG 16 Cb 0.14 -3.55 0.00 0.00 0.52 0.00 0.00 34.95 32.06 1odk s ARG 16 CO 0.75 0.02 -0.07 0.08 0.02 0.00 0.00 175.30 176.10 1odk s VAL 17 N 1.18 0.65 -0.07 3.52 1.01 0.67 -0.97 120.40 126.38 1odk s VAL 17 Ca 0.07 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.71 1odk s VAL 17 Cb -0.14 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 1odk s VAL 17 CO 0.06 0.21 0.16 -0.76 0.00 0.00 0.00 175.10 174.76 1odk s LEU 18 N 0.19 4.37 -0.63 3.92 1.43 0.90 -0.89 118.68 127.97 1odk s LEU 18 Ca -0.03 0.41 0.05 0.00 -1.03 0.00 0.00 54.13 53.53 1odk s LEU 18 Cb -0.07 -2.30 0.16 0.00 0.03 0.00 0.00 46.19 44.00 1odk s LEU 18 CO 0.00 0.35 0.41 -0.76 0.23 0.00 0.00 176.35 176.58 1odk s LEU 19 N -1.41 4.52 0.56 1.79 1.43 0.90 -1.09 118.68 125.37 1odk s LEU 19 Ca 0.20 -3.54 -0.14 0.00 -1.03 0.00 0.00 54.13 49.63 1odk s LEU 19 Cb -0.12 -1.59 -0.06 0.00 0.03 0.00 0.00 46.19 44.45 1odk s LEU 19 CO 0.10 -0.14 1.01 -2.16 0.23 0.00 0.00 176.35 175.39 1odk s PRO 20 N -1.00 3.79 -0.02 1.29 0.04 -1.22 -2.21 135.00 135.66 1odk s PRO 20 Ca 0.22 0.86 0.12 0.00 0.04 0.00 0.00 61.00 62.24 1odk s PRO 20 Cb -0.12 -2.11 -0.23 0.00 0.04 0.00 0.00 34.50 32.09 1odk s PRO 20 CO -0.11 -0.41 0.73 0.78 0.04 0.00 0.00 177.00 178.04 1odk h GLY 21 N 0.34 0.00 -6.74 0.56 0.00 -1.84 -1.21 103.07 94.19 1odk h GLY 21 Ca -0.45 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.26 1odk h GLY 21 CO 0.62 0.00 -0.28 -0.35 0.00 0.00 0.00 176.54 176.52 1odk s ASP 22 N -6.16 6.32 0.46 0.19 2.15 -1.26 -2.12 116.67 116.25 1odk s ASP 22 Ca -0.04 0.37 0.13 0.00 0.43 0.00 0.00 52.55 53.44 1odk s ASP 22 Cb 0.08 -2.20 1.05 0.00 -0.30 0.00 0.00 42.92 41.56 1odk s ASP 22 CO 0.82 -0.06 2.05 1.55 -0.17 0.00 0.00 175.17 179.36 1odk h PRO 23 N 7.57 0.10 -0.50 4.34 0.13 -1.89 -0.32 132.00 141.43 1odk h PRO 23 Ca -0.36 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.71 1odk h PRO 23 Cb 1.16 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 1odk h PRO 23 CO 0.69 0.16 0.09 0.78 -0.23 0.00 0.00 178.00 179.49 1odk h GLY 24 N 0.37 0.83 1.64 1.56 0.00 -1.94 -1.07 103.07 104.45 1odk h GLY 24 Ca 0.02 -0.49 -0.19 0.00 0.00 0.00 0.00 47.33 46.68 1odk h GLY 24 CO 0.01 0.46 -0.76 -0.09 0.00 0.00 0.00 176.54 176.15 1odk h ARG 25 N 0.74 0.35 -0.43 4.80 2.43 -1.54 -2.37 114.38 118.36 1odk h ARG 25 Ca 0.16 -0.30 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 1odk h ARG 25 Cb 0.32 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1odk h ARG 25 CO 0.00 0.96 0.23 0.00 -1.51 0.00 0.00 179.97 179.65 1odk h ALA 26 N 0.95 0.55 -0.53 2.80 0.00 -0.60 -0.61 119.26 121.82 1odk h ALA 26 Ca -0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1odk h ALA 26 Cb 1.35 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1odk h ALA 26 CO 0.13 0.08 0.30 1.49 0.00 0.00 0.00 179.25 181.24 1odk h GLU 27 N 0.56 0.73 -0.51 0.00 4.81 -1.15 -1.61 114.58 117.40 1odk h GLU 27 Ca 0.15 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1odk h GLU 27 Cb 0.06 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 1odk h GLU 27 CO -0.02 0.56 0.27 2.35 -0.73 0.00 0.00 179.01 181.43 1odk h TRP 28 N 0.71 0.72 -0.16 0.92 7.01 -1.14 -1.26 115.95 122.76 1odk h TRP 28 Ca 0.19 -0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.16 1odk h TRP 28 Cb 0.03 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.86 1odk h TRP 28 CO -0.02 0.55 0.09 0.82 -2.79 0.00 0.00 178.44 177.10 1odk h ILE 29 N 0.69 1.07 -0.19 2.65 2.04 -0.91 0.15 117.51 123.01 1odk h ILE 29 Ca 0.18 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1odk h ILE 29 Cb 0.08 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1odk h ILE 29 CO -0.03 0.07 0.12 0.00 0.00 0.00 0.00 178.15 178.32 1odk h ALA 30 N 1.01 0.24 -0.01 1.87 0.00 -1.12 0.69 119.26 121.95 1odk h ALA 30 Ca 0.06 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 1odk h ALA 30 Cb 0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1odk h ALA 30 CO -0.01 -0.28 -0.62 0.87 0.00 0.00 0.00 179.25 179.21 1odk h LYS 31 N 0.25 0.05 0.18 0.00 1.57 -1.13 -1.87 116.57 115.62 1odk h LYS 31 Ca 0.07 -0.03 -0.35 0.00 -1.87 0.00 0.00 60.65 58.47 1odk h LYS 31 Cb -0.03 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.29 1odk h LYS 31 CO -0.02 0.65 -1.74 1.15 -0.57 0.00 0.00 179.45 178.92 1odk h THR 32 N 0.03 0.95 0.00 -0.16 2.02 -0.56 -3.42 112.91 111.78 1odk h THR 32 Ca -0.01 -2.53 -0.13 0.00 0.77 0.00 0.00 66.41 64.51 1odk h THR 32 Cb 1.10 2.76 -0.02 0.00 -1.74 0.00 0.00 68.15 70.25 1odk h THR 32 CO 0.08 0.86 -1.76 0.49 0.37 0.00 0.00 175.52 175.56 1odk n PHE 33 N -3.58 0.00 -3.68 3.16 3.01 0.22 -5.04 117.46 111.56 1odk n PHE 33 Ca -0.24 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 57.90 1odk n PHE 33 Cb 1.07 -0.48 -0.05 0.00 -0.01 0.00 0.00 39.48 40.01 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 -4.48 4.29 -0.05 4.37 1.43 -0.70 -4.79 118.68 118.74 1odk s LEU 34 Ca -0.06 0.59 -0.13 0.00 -1.03 0.00 0.00 54.13 53.50 1odk s LEU 34 Cb 0.06 -3.21 -0.05 0.00 0.03 0.00 0.00 46.19 43.02 1odk s LEU 34 CO 0.54 0.09 0.34 -1.10 0.23 0.00 0.00 176.35 176.45 1odk s GLN 35 N -2.50 3.88 -1.36 1.70 -1.52 0.77 -4.40 119.66 116.22 1odk s GLN 35 Ca 0.39 0.25 -0.03 0.00 -1.95 0.00 0.00 55.36 54.02 1odk s GLN 35 Cb -0.12 -3.25 -0.00 0.00 -0.22 0.00 0.00 33.01 29.41 1odk s GLN 35 CO 0.23 0.62 0.49 -1.71 -0.25 0.00 0.00 175.29 174.68 1odk n ASN 36 N 2.19 -0.98 -4.74 5.90 5.15 -1.26 -1.23 115.26 120.28 1odk n ASN 36 Ca -0.15 -0.99 -0.41 0.00 -0.60 0.00 0.00 54.58 52.43 1odk n ASN 36 Cb 0.53 -3.20 -0.03 0.00 -0.53 0.00 0.00 39.78 36.55 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 -6.43 4.42 -0.08 1.20 0.04 -1.26 -4.53 135.00 128.36 1odk s PRO 37 Ca 0.06 2.01 0.02 0.00 0.04 0.00 0.00 61.00 63.13 1odk s PRO 37 Cb -0.02 -3.20 0.01 0.00 0.04 0.00 0.00 34.50 31.33 1odk s PRO 37 CO 0.88 -0.19 -0.13 1.03 0.04 0.00 0.00 177.00 178.62 1odk s ARG 38 N -0.28 1.91 -0.65 4.56 0.52 0.20 -4.94 118.95 120.28 1odk s ARG 38 Ca 0.55 -0.47 -0.25 0.00 -0.52 0.00 0.00 55.73 55.04 1odk s ARG 38 Cb -0.36 -1.61 0.04 0.00 0.52 0.00 0.00 34.95 33.55 1odk s ARG 38 CO 0.39 -0.01 1.09 0.50 0.02 0.00 0.00 175.30 177.29 1odk s ARG 39 N 0.82 3.25 0.15 3.54 3.52 -1.26 -1.05 118.95 127.93 1odk s ARG 39 Ca -0.11 -0.34 0.27 0.00 -0.13 0.00 0.00 55.73 55.41 1odk s ARG 39 Cb -0.15 -4.14 0.92 0.00 -1.56 0.00 0.00 34.95 30.02 1odk s ARG 39 CO 0.02 -1.82 1.81 2.48 -0.81 0.00 0.00 175.30 176.98 1odk n TYR 40 N 8.28 0.68 -3.73 5.12 0.18 -0.09 -4.84 117.16 122.77 1odk n TYR 40 Ca 0.02 0.20 -0.12 0.00 1.88 0.00 0.00 57.90 59.87 1odk n TYR 40 Cb 0.48 -0.82 -0.11 0.00 -0.38 0.00 0.00 39.34 38.51 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 -4.12 -0.44 0.00 9.48 2.47 -1.15 -4.67 114.94 116.51 1odk s ASN 41 Ca 0.12 0.81 0.00 0.00 0.42 0.00 0.00 52.86 54.20 1odk s ASN 41 Cb 0.14 0.77 0.00 0.00 -1.45 0.00 0.00 41.25 40.72 1odk s ASN 41 CO 0.58 -0.15 0.25 -0.90 -3.72 0.00 0.00 177.10 173.16 1odk n ASP 42 N 3.35 0.34 -4.75 -4.21 3.85 -1.26 -1.63 116.55 112.25 1odk n ASP 42 Ca -0.17 -1.06 -0.42 0.00 -0.71 0.00 0.00 54.79 52.43 1odk n ASP 42 Cb 0.56 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 40.32 1odk n ASP 42 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.20 177.76 1odk n HIS 43 N -0.03 2.86 -1.21 2.11 -0.00 -1.26 -1.41 115.22 116.28 1odk n HIS 43 Ca 0.00 0.29 -0.07 0.00 0.46 0.00 0.00 57.72 58.40 1odk n HIS 43 Cb 0.24 -2.58 -0.03 0.00 -0.12 0.00 0.00 29.99 27.49 1odk n HIS 43 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1odk n ARG 44 N 1.86 -1.81 -0.97 1.57 1.74 -1.26 -1.70 116.66 116.09 1odk n ARG 44 Ca 0.07 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 57.91 1odk n ARG 44 Cb 0.37 -5.21 0.00 0.00 -1.02 0.00 0.00 32.46 26.60 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 0.50 0.60 2.58 -0.13 0.00 -0.50 -4.91 105.19 103.33 1odk n GLY 45 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 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 7.59 -4.67 0.99 4.77 -0.69 -4.76 117.00 120.23 1odk n LEU 46 Ca 0.00 -4.32 -0.49 0.00 -0.03 0.00 0.00 56.01 51.18 1odk n LEU 46 Cb 0.05 -1.59 -0.05 0.00 -2.33 0.00 0.00 43.42 39.50 1odk n LEU 46 CO 0.00 1.53 1.34 0.79 -1.33 0.00 0.00 177.39 179.73 1odk n TRP 47 N 4.74 2.23 -4.56 -1.77 8.01 -1.26 -4.50 117.44 120.34 1odk n TRP 47 Ca 0.61 0.17 -0.23 0.00 -1.31 0.00 0.00 57.50 56.74 1odk n TRP 47 Cb 0.32 -2.59 -0.16 0.00 -2.01 0.00 0.00 31.31 26.87 1odk n TRP 47 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1odk s GLY 48 N 2.80 0.72 0.13 6.99 0.00 -0.65 -1.39 107.32 115.93 1odk s GLY 48 Ca 0.88 -0.42 0.08 0.00 0.00 0.00 0.00 44.72 45.26 1odk s GLY 48 CO 0.48 -0.02 -0.18 -0.19 0.00 0.00 0.00 173.10 173.19 1odk s TYR 49 N 0.41 1.69 -0.03 1.90 1.51 -0.05 -0.91 117.35 121.87 1odk s TYR 49 Ca -0.09 -0.47 0.03 0.00 -1.01 0.00 0.00 57.07 55.53 1odk s TYR 49 Cb -0.13 -0.89 0.00 0.00 -0.11 0.00 0.00 41.96 40.84 1odk s TYR 49 CO 0.02 0.24 -0.10 0.99 -1.11 0.00 0.00 175.55 175.59 1odk s THR 50 N -1.71 0.89 0.00 -0.71 2.01 -0.21 -0.06 115.64 115.84 1odk s THR 50 Ca 0.10 -0.41 0.00 0.00 0.31 0.00 0.00 61.69 61.70 1odk s THR 50 Cb -0.07 -0.80 0.00 0.00 0.01 0.00 0.00 72.50 71.64 1odk s THR 50 CO 0.05 0.28 0.00 0.61 -0.69 0.00 0.00 174.62 174.87 1odk n GLY 51 N 3.38 3.06 3.30 4.40 0.00 -0.32 -0.63 105.19 118.39 1odk n GLY 51 Ca -0.19 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 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 2.07 -0.19 0.99 2.01 -0.36 -0.85 118.68 122.34 1odk s LEU 52 Ca 0.00 -0.48 -0.00 0.00 0.01 0.00 0.00 54.13 53.66 1odk s LEU 52 Cb 0.00 -1.29 0.05 0.00 0.01 0.00 0.00 46.19 44.96 1odk s LEU 52 CO 0.00 0.30 -0.04 -0.47 1.01 0.00 0.00 176.35 177.15 1odk s TYR 53 N -0.62 1.86 -1.51 0.29 5.04 -0.08 -0.17 117.35 122.16 1odk s TYR 53 Ca 0.10 -1.29 -0.13 0.00 -2.44 0.00 0.00 57.07 53.31 1odk s TYR 53 Cb -0.10 -1.37 0.08 0.00 0.35 0.00 0.00 41.96 40.92 1odk s TYR 53 CO -0.01 -0.67 0.91 1.63 -1.34 0.00 0.00 175.55 176.08 1odk n LYS 54 N 4.83 -5.27 -0.21 4.97 5.02 -1.26 -1.26 118.16 124.98 1odk n LYS 54 Ca -0.12 0.60 0.00 0.00 -2.02 0.00 0.00 58.31 56.77 1odk n LYS 54 Cb 0.46 -5.48 0.00 0.00 -0.02 0.00 0.00 35.03 30.00 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 -1.63 2.01 3.69 0.72 0.00 -1.26 -5.03 105.19 103.69 1odk n GLY 55 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.01 5.19 0.25 1.61 1.01 -0.39 -5.02 120.40 120.04 1odk s VAL 56 Ca 0.00 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.79 1odk s VAL 56 Cb 0.00 -3.36 -0.10 0.00 0.00 0.00 0.00 36.38 32.92 1odk s VAL 56 CO 0.00 0.44 1.45 -2.16 0.00 0.00 0.00 175.10 174.83 1odk s PRO 57 N 0.44 4.26 -0.02 2.72 0.04 -1.26 -0.90 135.00 140.27 1odk s PRO 57 Ca 0.06 2.32 -0.01 0.00 0.04 0.00 0.00 61.00 63.41 1odk s PRO 57 Cb -0.12 -3.11 0.01 0.00 0.04 0.00 0.00 34.50 31.33 1odk s PRO 57 CO -0.01 -0.44 0.05 0.08 0.04 0.00 0.00 177.00 176.73 1odk s VAL 58 N 0.01 -0.02 0.16 -0.36 1.01 -0.03 -4.37 120.40 116.80 1odk s VAL 58 Ca 0.60 0.08 0.06 0.00 0.00 0.00 0.00 61.98 62.72 1odk s VAL 58 Cb -0.42 -0.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 1odk s VAL 58 CO 0.43 0.03 0.03 -0.44 0.00 0.00 0.00 175.10 175.16 1odk s SER 59 N 0.42 5.01 -0.24 3.32 0.01 -0.14 -1.17 113.70 120.91 1odk s SER 59 Ca -0.03 -0.29 -0.01 0.00 1.31 0.00 0.00 55.95 56.93 1odk s SER 59 Cb -0.05 -1.16 0.07 0.00 0.21 0.00 0.00 66.02 65.09 1odk s SER 59 CO -0.01 0.10 0.02 -0.69 0.41 0.00 0.00 173.24 173.06 1odk s VAL 60 N -1.66 0.99 -0.17 3.43 1.01 0.91 -0.07 120.40 124.83 1odk s VAL 60 Ca 0.28 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1odk s VAL 60 Cb -0.10 -1.47 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 1odk s VAL 60 CO 0.20 -0.28 -0.12 -1.58 0.00 0.00 0.00 175.10 173.32 1odk s GLN 61 N 1.62 3.27 0.24 2.72 2.00 -0.25 -0.87 119.66 128.40 1odk s GLN 61 Ca -0.00 -0.71 -0.30 0.00 -2.00 0.00 0.00 55.36 52.35 1odk s GLN 61 Cb -0.18 -2.73 -0.10 0.00 0.80 0.00 0.00 33.01 30.80 1odk s GLN 61 CO -0.11 -0.03 1.45 0.99 -0.50 0.00 0.00 175.29 177.10 1odk s THR 62 N 0.96 2.64 -0.05 -0.34 2.01 -0.49 -3.38 115.64 116.99 1odk s THR 62 Ca -0.02 0.53 0.16 0.00 0.31 0.00 0.00 61.69 62.67 1odk s THR 62 Cb -0.15 -3.34 -0.24 0.00 0.01 0.00 0.00 72.50 68.78 1odk s THR 62 CO -0.01 0.08 0.29 0.35 -0.69 0.00 0.00 174.62 174.64 1odk n THR 63 N 2.45 0.23 -1.34 -0.82 -2.24 -0.46 -4.76 114.28 107.34 1odk n THR 63 Ca 0.07 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 1odk n THR 63 Cb 0.40 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 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 1.68 -2.45 3.79 3.38 0.00 -0.90 -3.48 105.19 107.21 1odk n GLY 64 Ca -0.08 -1.64 -0.36 0.00 0.00 0.00 0.00 46.02 43.94 1odk n GLY 64 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1odk s MET 65 N -0.56 3.70 0.00 1.61 -1.94 -1.26 -4.68 119.30 116.17 1odk s MET 65 Ca 0.00 -0.21 0.00 0.00 -1.71 0.00 0.00 55.69 53.77 1odk s MET 65 Cb 0.00 -3.23 0.00 0.00 2.01 0.00 0.00 34.83 33.61 1odk s MET 65 CO 0.00 0.56 0.00 0.41 -0.01 0.00 0.00 175.02 175.98 1odk n GLY 66 N 2.66 1.48 0.23 -0.03 0.00 -1.19 -4.48 105.19 103.86 1odk n GLY 66 Ca -0.18 -1.70 0.08 0.00 0.00 0.00 0.00 46.02 44.22 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 0.90 -0.48 2.61 1.35 -1.50 -1.47 112.91 114.33 1odk h THR 67 Ca 0.00 -0.70 -0.08 0.00 -0.55 0.00 0.00 66.41 65.08 1odk h THR 67 Cb 0.00 1.40 -0.02 0.00 -1.73 0.00 0.00 68.15 67.80 1odk h THR 67 CO 0.00 0.18 -0.01 -0.65 -0.25 0.00 0.00 175.52 174.79 1odk h PRO 68 N 0.00 0.85 -0.17 4.72 0.11 -1.88 0.13 132.00 135.75 1odk h PRO 68 Ca -0.00 -0.28 -0.07 0.00 0.11 0.00 0.00 66.00 65.76 1odk h PRO 68 Cb 0.39 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.42 1odk h PRO 68 CO 0.02 0.90 -0.16 1.03 -0.21 0.00 0.00 178.00 179.59 1odk h SER 69 N 0.70 0.44 -0.68 -2.05 0.87 -1.73 -2.74 113.55 108.37 1odk h SER 69 Ca 0.13 -0.47 -0.01 0.00 -1.23 0.00 0.00 61.79 60.21 1odk h SER 69 Cb 0.53 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 1odk h SER 69 CO 0.03 0.82 0.39 0.00 -0.53 0.00 0.00 176.83 177.54 1odk h ALA 70 N 0.63 0.87 -0.68 6.23 0.00 -1.22 -1.90 119.26 123.20 1odk h ALA 70 Ca 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1odk h ALA 70 Cb 0.69 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1odk h ALA 70 CO 0.04 0.36 0.38 0.00 0.00 0.00 0.00 179.25 180.03 1odk h ALA 71 N 1.20 0.87 -0.21 0.00 0.00 -0.74 0.18 119.26 120.55 1odk h ALA 71 Ca 0.24 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1odk h ALA 71 Cb 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1odk h ALA 71 CO -0.04 0.37 0.13 0.82 0.00 0.00 0.00 179.25 180.52 1odk h ILE 72 N 0.92 1.03 -0.33 0.00 2.04 -1.18 0.10 117.51 120.09 1odk h ILE 72 Ca 0.24 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.99 1odk h ILE 72 Cb 0.02 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1odk h ILE 72 CO -0.04 0.05 0.13 0.58 0.00 0.00 0.00 178.15 178.87 1odk h VAL 73 N 0.26 1.19 -0.33 1.67 2.07 -0.88 -2.13 116.25 118.10 1odk h VAL 73 Ca 0.08 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1odk h VAL 73 Cb -0.01 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1odk h VAL 73 CO -0.03 0.20 0.16 0.58 0.02 0.00 0.00 177.57 178.50 1odk h VAL 74 N 0.39 1.16 -0.61 2.57 2.07 -0.49 0.59 116.25 121.94 1odk h VAL 74 Ca 0.11 -0.48 0.06 0.00 0.82 0.00 0.00 66.70 67.21 1odk h VAL 74 Cb 0.19 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 1odk h VAL 74 CO -0.01 0.17 0.32 -0.33 0.02 0.00 0.00 177.57 177.74 1odk h GLU 75 N 0.40 0.58 -0.24 1.57 4.39 -0.89 -0.53 114.58 119.85 1odk h GLU 75 Ca 0.11 -0.03 -0.17 0.00 0.34 0.00 0.00 59.36 59.61 1odk h GLU 75 Cb 0.13 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1odk h GLU 75 CO -0.01 0.38 -0.52 0.93 -1.16 0.00 0.00 179.01 178.62 1odk h GLU 76 N 0.59 0.70 -0.71 2.33 5.08 -1.15 -2.61 114.58 118.82 1odk h GLU 76 Ca 0.27 -0.43 -0.04 0.00 -1.00 0.00 0.00 59.36 58.16 1odk h GLU 76 Cb 0.19 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1odk h GLU 76 CO -0.18 1.05 0.26 -0.07 -1.00 0.00 0.00 179.01 179.07 1odk h LEU 77 N 0.54 0.97 -0.78 1.33 3.38 -0.46 -1.03 115.31 119.26 1odk h LEU 77 Ca 0.02 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1odk h LEU 77 Cb 1.09 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 1odk h LEU 77 CO 0.11 0.88 0.31 0.58 0.09 0.00 0.00 178.44 180.41 1odk h VAL 78 N 1.03 1.26 0.00 1.22 2.07 -1.00 -0.63 116.25 120.20 1odk h VAL 78 Ca 0.24 -0.82 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 1odk h VAL 78 Cb 0.22 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1odk h VAL 78 CO -0.02 0.33 -0.19 0.03 0.02 0.00 0.00 177.57 177.75 1odk h ARG 79 N 1.13 0.00 -0.08 1.57 2.47 -1.01 -1.67 114.38 116.80 1odk h ARG 79 Ca 0.26 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.98 1odk h ARG 79 Cb 0.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.54 1odk h ARG 79 CO -0.02 0.19 0.00 1.28 0.56 0.00 0.00 179.97 181.98 1odk n LEU 80 N -4.11 0.92 0.00 3.04 4.77 -0.37 -4.88 117.00 116.38 1odk n LEU 80 Ca -0.02 -0.37 0.00 0.00 -0.03 0.00 0.00 56.01 55.59 1odk n LEU 80 Cb 0.26 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1odk n LEU 80 CO 0.35 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1odk n GLY 81 N 1.01 0.78 3.74 -0.72 0.00 -0.63 -4.40 105.19 104.96 1odk n GLY 81 Ca 0.16 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 3.70 -0.02 4.61 0.00 -0.45 -4.40 121.76 123.20 1odk s ALA 82 Ca 0.00 1.38 0.01 0.00 0.00 0.00 0.00 51.96 53.35 1odk s ALA 82 Cb 0.00 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.51 1odk s ALA 82 CO 0.00 -0.79 0.00 -2.13 0.00 0.00 0.00 175.76 172.84 1odk n ARG 83 N 2.87 3.27 -3.91 0.00 0.63 0.63 -4.59 116.66 115.56 1odk n ARG 83 Ca 0.09 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.74 1odk n ARG 83 Cb 0.39 -1.04 -0.17 0.00 0.45 0.00 0.00 32.46 32.09 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 -2.04 1.15 -0.13 5.15 1.01 -0.08 -0.80 120.40 124.66 1odk s VAL 84 Ca -0.01 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1odk s VAL 84 Cb 0.01 -1.26 0.02 0.00 0.00 0.00 0.00 36.38 35.14 1odk s VAL 84 CO 0.06 0.22 -0.12 -0.76 0.00 0.00 0.00 175.10 174.50 1odk s LEU 85 N 1.63 1.53 -0.21 3.92 1.02 0.58 -0.24 118.68 126.91 1odk s LEU 85 Ca 0.02 -0.41 0.02 0.00 0.02 0.00 0.00 54.13 53.78 1odk s LEU 85 Cb -0.14 -1.04 0.03 0.00 0.02 0.00 0.00 46.19 45.06 1odk s LEU 85 CO -0.08 -0.06 -0.17 -0.69 0.02 0.00 0.00 176.35 175.37 1odk s VAL 86 N 1.43 2.09 0.21 -1.59 1.01 -0.07 -1.47 120.40 122.02 1odk s VAL 86 Ca 0.02 -1.17 -0.30 0.00 0.00 0.00 0.00 61.98 60.53 1odk s VAL 86 Cb -0.13 -2.00 -0.08 0.00 0.00 0.00 0.00 36.38 34.17 1odk s VAL 86 CO -0.08 0.34 1.16 -0.60 0.00 0.00 0.00 175.10 175.93 1odk s ARG 87 N 1.23 4.54 -0.05 2.72 3.52 0.00 -0.07 118.95 130.83 1odk s ARG 87 Ca 0.00 1.85 0.02 0.00 -0.13 0.00 0.00 55.73 57.47 1odk s ARG 87 Cb -0.15 -3.23 0.02 0.00 -1.56 0.00 0.00 34.95 30.03 1odk s ARG 87 CO -0.10 0.01 -0.09 0.14 -0.81 0.00 0.00 175.30 174.44 1odk s VAL 88 N -0.41 0.89 0.00 7.11 -7.23 -0.94 -1.66 120.40 118.16 1odk s VAL 88 Ca 0.50 -0.34 0.00 0.00 -1.81 0.00 0.00 61.98 60.33 1odk s VAL 88 Cb -0.32 -0.84 0.00 0.00 0.56 0.00 0.00 36.38 35.78 1odk s VAL 88 CO 0.38 0.30 0.00 0.61 -0.31 0.00 0.00 175.10 176.08 1odk n GLY 89 N 3.85 1.01 3.76 2.32 0.00 -1.20 -3.80 105.19 111.13 1odk n GLY 89 Ca -0.24 -0.73 -0.23 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.22 2.99 -0.04 2.61 -4.23 -1.26 -0.95 115.64 112.54 1odk s THR 90 Ca 0.00 -1.63 -0.22 0.00 -1.18 0.00 0.00 61.69 58.66 1odk s THR 90 Cb 0.00 -3.01 0.05 0.00 1.34 0.00 0.00 72.50 70.88 1odk s THR 90 CO 0.00 -0.15 0.49 0.00 -0.54 0.00 0.00 174.62 174.42 1odk s ALA 91 N -2.43 -1.26 -0.10 3.99 0.00 -1.00 -4.82 121.76 116.15 1odk s ALA 91 Ca 0.39 0.83 -0.19 0.00 0.00 0.00 0.00 51.96 52.99 1odk s ALA 91 Cb -0.02 -0.00 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 1odk s ALA 91 CO 0.23 -0.31 0.52 0.20 0.00 0.00 0.00 175.76 176.41 1odk s GLY 92 N -1.19 2.45 0.28 0.00 0.00 -0.58 -2.07 107.32 106.21 1odk s GLY 92 Ca -0.12 -0.12 -0.30 0.00 0.00 0.00 0.00 44.72 44.19 1odk s GLY 92 CO 0.07 0.83 1.44 0.00 0.00 0.00 0.00 173.10 175.44 1odk s ALA 93 N 0.56 3.62 -0.69 3.20 0.00 0.77 -0.52 121.76 128.70 1odk s ALA 93 Ca 0.28 1.36 0.25 0.00 0.00 0.00 0.00 51.96 53.86 1odk s ALA 93 Cb -0.16 -3.56 0.66 0.00 0.00 0.00 0.00 23.12 20.06 1odk s ALA 93 CO 0.12 -0.78 1.65 0.00 0.00 0.00 0.00 175.76 176.75 1odk h ALA 94 N 4.62 0.89 -2.27 0.00 0.00 -1.35 -1.62 119.26 119.54 1odk h ALA 94 Ca -0.47 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.26 1odk h ALA 94 Cb 1.22 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.86 1odk h ALA 94 CO 0.75 0.00 -0.68 -1.54 0.00 0.00 0.00 179.25 177.78 1odk s SER 95 N -4.57 0.78 0.23 0.00 1.04 -1.26 -2.90 113.70 107.01 1odk s SER 95 Ca 0.09 -1.05 0.22 0.00 0.48 0.00 0.00 55.95 55.69 1odk s SER 95 Cb 0.12 0.17 0.93 0.00 0.10 0.00 0.00 66.02 67.34 1odk s SER 95 CO 0.63 -0.56 1.67 -1.20 0.98 0.00 0.00 173.24 174.75 1odk n SER 96 N -0.01 0.57 0.23 7.02 7.64 -1.26 -3.24 113.62 124.57 1odk n SER 96 Ca -0.11 0.65 0.14 0.00 1.01 0.00 0.00 58.87 60.55 1odk n SER 96 Cb 0.61 -0.77 0.34 0.00 -1.01 0.00 0.00 64.21 63.39 1odk n SER 96 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 1odk h ASP 97 N 0.00 0.00 -3.42 6.43 2.03 -1.99 -3.43 116.42 116.05 1odk h ASP 97 Ca 0.00 0.00 -0.60 0.00 -0.73 0.00 0.00 57.03 55.70 1odk h ASP 97 Cb 0.32 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 38.72 1odk h ASP 97 CO 0.00 0.00 0.38 -0.76 -1.03 0.00 0.00 179.24 177.83 1odk s LEU 98 N -6.13 4.08 0.16 0.15 1.43 -1.20 -5.05 118.68 112.12 1odk s LEU 98 Ca 0.05 0.72 -0.14 0.00 -1.03 0.00 0.00 54.13 53.73 1odk s LEU 98 Cb 0.06 -3.07 -0.07 0.00 0.03 0.00 0.00 46.19 43.15 1odk s LEU 98 CO 0.62 -0.57 0.56 0.00 0.23 0.00 0.00 176.35 177.19 1odk s ALA 99 N 2.89 3.57 0.35 4.21 0.00 -1.26 -4.81 121.76 126.71 1odk s ALA 99 Ca 0.32 -0.13 -0.28 0.00 0.00 0.00 0.00 51.96 51.87 1odk s ALA 99 Cb -0.14 -2.53 -0.12 0.00 0.00 0.00 0.00 23.12 20.33 1odk s ALA 99 CO 0.11 0.45 1.27 -0.35 0.00 0.00 0.00 175.76 177.25 1odk n PRO 100 N 0.69 2.06 0.00 0.00 -0.04 -1.26 -2.22 135.00 134.24 1odk n PRO 100 Ca -0.05 0.72 0.00 0.00 -0.04 0.00 0.00 63.50 64.14 1odk n PRO 100 Cb 0.52 -2.32 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 1odk n PRO 100 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1odk n GLY 101 N 0.80 3.28 3.75 0.55 0.00 0.26 -4.83 105.19 108.99 1odk n GLY 101 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 1odk n GLY 101 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1odk s GLU 102 N -0.56 2.92 0.07 1.61 2.02 -0.94 -4.41 118.70 119.41 1odk s GLU 102 Ca 0.00 1.88 -0.05 0.00 0.02 0.00 0.00 54.97 56.82 1odk s GLU 102 Cb 0.00 -1.93 -0.05 0.00 0.10 0.00 0.00 34.13 32.25 1odk s GLU 102 CO 0.00 -1.26 0.31 -0.51 0.02 0.00 0.00 175.26 173.81 1odk s LEU 103 N -4.09 4.33 -0.13 1.80 1.43 -1.25 -1.19 118.68 119.58 1odk s LEU 103 Ca 0.78 0.54 -0.01 0.00 -1.03 0.00 0.00 54.13 54.40 1odk s LEU 103 Cb -0.32 -2.98 0.04 0.00 0.03 0.00 0.00 46.19 42.96 1odk s LEU 103 CO 0.35 0.16 -0.03 -0.63 0.23 0.00 0.00 176.35 176.42 1odk s ILE 104 N -1.47 0.80 -0.36 -0.59 1.01 0.30 -0.53 121.20 120.35 1odk s ILE 104 Ca 0.34 -0.33 -0.20 0.00 0.00 0.00 0.00 60.65 60.46 1odk s ILE 104 Cb -0.13 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.37 1odk s ILE 104 CO 0.21 0.17 0.62 -0.69 0.00 0.00 0.00 174.94 175.26 1odk s VAL 105 N 1.78 4.90 -0.36 2.92 1.01 0.02 -0.82 120.40 129.85 1odk s VAL 105 Ca 0.03 0.50 -0.29 0.00 0.00 0.00 0.00 61.98 62.22 1odk s VAL 105 Cb -0.14 -4.08 -0.00 0.00 0.00 0.00 0.00 36.38 32.16 1odk s VAL 105 CO -0.07 -0.33 1.57 0.00 0.00 0.00 0.00 175.10 176.27 1odk s ALA 106 N 2.68 3.01 -0.30 5.51 0.00 -0.57 -2.21 121.76 129.88 1odk s ALA 106 Ca 0.23 0.07 0.19 0.00 0.00 0.00 0.00 51.96 52.46 1odk s ALA 106 Cb -0.15 -3.96 0.19 0.00 0.00 0.00 0.00 23.12 19.21 1odk s ALA 106 CO 0.15 -2.42 1.47 0.37 0.00 0.00 0.00 175.76 175.33 1odk h GLN 107 N 11.47 0.00 -1.64 0.00 4.15 -1.06 -3.43 115.11 124.61 1odk h GLN 107 Ca -0.30 0.00 0.31 0.00 0.77 0.00 0.00 58.65 59.43 1odk h GLN 107 Cb 1.13 0.00 -0.11 0.00 0.21 0.00 0.00 27.48 28.72 1odk h GLN 107 CO 1.06 0.21 0.80 0.20 -1.93 0.00 0.00 178.83 179.17 1odk s GLY 108 N -4.35 -0.35 -0.08 2.39 0.00 -1.25 -4.33 107.32 99.36 1odk s GLY 108 Ca 0.05 0.53 -0.02 0.00 0.00 0.00 0.00 44.72 45.28 1odk s GLY 108 CO 0.71 0.85 0.04 0.00 0.00 0.00 0.00 173.10 174.71 1odk s ALA 109 N -2.44 0.46 0.09 3.20 0.00 -0.31 -2.28 121.76 120.48 1odk s ALA 109 Ca 0.16 -0.03 -0.31 0.00 0.00 0.00 0.00 51.96 51.78 1odk s ALA 109 Cb 0.03 -0.75 -0.09 0.00 0.00 0.00 0.00 23.12 22.32 1odk s ALA 109 CO -0.03 -0.61 1.66 0.08 0.00 0.00 0.00 175.76 176.87 1odk s VAL 110 N 2.08 2.91 -1.06 0.00 1.01 -0.01 -4.11 120.40 121.21 1odk s VAL 110 Ca 0.04 0.42 -0.19 0.00 0.00 0.00 0.00 61.98 62.26 1odk s VAL 110 Cb -0.13 -3.27 0.10 0.00 0.00 0.00 0.00 36.38 33.08 1odk s VAL 110 CO -0.05 0.00 1.37 -2.16 0.00 0.00 0.00 175.10 174.27 1odk s PRO 111 N 2.42 3.74 -0.13 2.72 0.04 -1.26 -1.14 135.00 141.39 1odk s PRO 111 Ca 0.74 -1.74 0.16 0.00 0.04 0.00 0.00 61.00 60.20 1odk s PRO 111 Cb -0.41 -5.18 0.70 0.00 0.04 0.00 0.00 34.50 29.65 1odk s PRO 111 CO 0.33 -1.98 1.59 1.28 0.04 0.00 0.00 177.00 178.26 1odk n LEU 112 N 7.40 4.70 -4.80 -3.56 4.77 -0.53 -4.95 117.00 120.04 1odk n LEU 112 Ca 0.33 -2.38 -0.25 0.00 -0.03 0.00 0.00 56.01 53.68 1odk n LEU 112 Cb 0.48 -0.59 -0.05 0.00 -2.33 0.00 0.00 43.42 40.93 1odk n LEU 112 CO 0.61 0.72 -0.21 1.51 -1.33 0.00 0.00 177.39 178.69 1odk s ASP 113 N -0.82 5.48 0.16 -1.43 1.47 -1.14 -4.21 116.67 116.20 1odk s ASP 113 Ca 0.48 -0.17 0.25 0.00 1.18 0.00 0.00 52.55 54.30 1odk s ASP 113 Cb 0.33 -1.41 0.64 0.00 -0.34 0.00 0.00 42.92 42.14 1odk s ASP 113 CO 0.21 0.04 1.60 0.61 0.68 0.00 0.00 175.17 178.32 1odk n GLY 114 N -0.54 -1.58 0.07 2.12 0.00 -1.26 -3.29 105.19 100.71 1odk n GLY 114 Ca -0.08 -0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 1odk n GLY 114 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1odk h THR 115 N 0.00 1.39 -0.74 2.61 2.02 -1.96 0.02 112.91 116.25 1odk h THR 115 Ca 0.00 -1.18 -0.05 0.00 0.77 0.00 0.00 66.41 65.95 1odk h THR 115 Cb 0.73 2.15 -0.03 0.00 -1.74 0.00 0.00 68.15 69.25 1odk h THR 115 CO 0.00 0.31 0.27 0.71 0.37 0.00 0.00 175.52 177.18 1odk h THR 116 N -0.43 1.25 -0.65 3.16 1.35 -1.95 -2.10 112.91 113.54 1odk h THR 116 Ca 0.00 -0.83 0.05 0.00 -0.55 0.00 0.00 66.41 65.08 1odk h THR 116 Cb 0.52 0.39 -0.05 0.00 -1.73 0.00 0.00 68.15 67.28 1odk h THR 116 CO 0.01 0.33 0.38 -0.09 -0.25 0.00 0.00 175.52 175.89 1odk h ARG 117 N 1.09 0.69 -0.24 4.72 2.43 -1.51 0.99 114.38 122.54 1odk h ARG 117 Ca 0.25 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 1odk h ARG 117 Cb 0.24 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1odk h ARG 117 CO -0.02 0.46 0.03 0.37 -1.51 0.00 0.00 179.97 179.30 1odk h GLN 118 N 0.71 0.40 -0.62 0.20 4.15 -0.61 0.21 115.11 119.56 1odk h GLN 118 Ca 0.28 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 1odk h GLN 118 Cb 0.13 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 1odk h GLN 118 CO -0.16 0.55 0.34 1.88 -1.93 0.00 0.00 178.83 179.52 1odk h TYR 119 N 0.20 0.82 -0.01 3.99 -1.99 -0.99 -2.56 116.97 116.44 1odk h TYR 119 Ca 0.07 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.79 1odk h TYR 119 Cb 0.35 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 38.81 1odk h TYR 119 CO 0.03 0.57 -0.24 1.28 -0.00 0.00 0.00 178.16 179.80 1odk n LEU 120 N -4.39 0.74 -3.52 3.88 4.77 0.31 -4.94 117.00 113.85 1odk n LEU 120 Ca 0.06 -0.11 -0.24 0.00 -0.03 0.00 0.00 56.01 55.68 1odk n LEU 120 Cb 0.09 -0.17 0.07 0.00 -2.33 0.00 0.00 43.42 41.08 1odk n LEU 120 CO 0.37 0.14 0.19 -0.62 -1.33 0.00 0.00 177.39 176.14 1odk n GLU 121 N -0.90 -7.17 -0.97 3.23 1.02 0.51 -2.13 120.64 114.24 1odk n GLU 121 Ca 0.12 0.82 0.00 0.00 -0.02 0.00 0.00 57.16 58.08 1odk n GLU 121 Cb 0.32 -5.83 0.00 0.00 -0.02 0.00 0.00 31.44 25.92 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 -1.89 0.54 3.83 0.62 0.00 0.05 -5.03 105.19 103.32 1odk n GLY 122 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.31 4.06 0.81 1.61 0.52 -0.91 -5.03 118.95 119.71 1odk s ARG 123 Ca 0.00 0.99 -0.12 0.00 -0.52 0.00 0.00 55.73 56.08 1odk s ARG 123 Cb 0.00 -2.17 0.09 0.00 0.52 0.00 0.00 34.95 33.38 1odk s ARG 123 CO 0.00 -0.15 1.15 -2.14 0.02 0.00 0.00 175.30 174.18 1odk s PRO 124 N -3.66 1.73 0.03 3.54 0.02 -1.26 -4.93 135.00 130.47 1odk s PRO 124 Ca 0.60 1.51 -0.28 0.00 0.02 0.00 0.00 61.00 62.85 1odk s PRO 124 Cb -0.10 -1.81 0.09 0.00 0.02 0.00 0.00 34.50 32.71 1odk s PRO 124 CO 0.23 -2.09 0.92 -0.47 -0.33 0.00 0.00 177.00 175.26 1odk s TYR 125 N -2.51 -0.27 -0.46 6.54 5.04 -1.26 -5.11 117.35 119.31 1odk s TYR 125 Ca 0.68 0.10 0.03 0.00 -2.44 0.00 0.00 57.07 55.43 1odk s TYR 125 Cb -0.23 0.57 0.14 0.00 0.35 0.00 0.00 41.96 42.79 1odk s TYR 125 CO 0.53 -0.61 0.27 0.00 -1.34 0.00 0.00 175.55 174.40 1odk s ALA 126 N -3.13 2.28 -0.02 3.97 0.00 -1.26 -4.88 121.76 118.72 1odk s ALA 126 Ca 0.07 -2.72 -0.30 0.00 0.00 0.00 0.00 51.96 49.01 1odk s ALA 126 Cb -0.01 -1.90 -0.07 0.00 0.00 0.00 0.00 23.12 21.14 1odk s ALA 126 CO -0.06 -2.06 1.91 -2.14 0.00 0.00 0.00 175.76 173.42 1odk s PRO 127 N 0.14 4.03 0.05 0.00 0.02 -1.26 -4.96 135.00 133.02 1odk s PRO 127 Ca 0.20 2.42 0.02 0.00 0.02 0.00 0.00 61.00 63.65 1odk s PRO 127 Cb -0.20 -4.14 -0.03 0.00 0.02 0.00 0.00 34.50 30.15 1odk s PRO 127 CO -0.03 -1.07 -0.08 0.14 -0.33 0.00 0.00 177.00 175.64 1odk s VAL 128 N 4.80 0.55 1.05 3.83 -7.23 -1.26 -1.16 120.40 120.98 1odk s VAL 128 Ca 0.86 -1.17 -0.16 0.00 -1.81 0.00 0.00 61.98 59.70 1odk s VAL 128 Cb -0.39 -0.72 0.22 0.00 0.56 0.00 0.00 36.38 36.06 1odk s VAL 128 CO 0.38 -0.44 1.17 -2.16 -0.31 0.00 0.00 175.10 173.74 1odk s PRO 129 N -1.82 -0.05 0.26 4.82 0.04 -1.26 -4.73 135.00 132.26 1odk s PRO 129 Ca -0.08 -0.03 -0.30 0.00 0.04 0.00 0.00 61.00 60.64 1odk s PRO 129 Cb -0.08 -1.73 -0.10 0.00 0.04 0.00 0.00 34.50 32.63 1odk s PRO 129 CO -0.00 -2.94 1.33 0.34 0.04 0.00 0.00 177.00 175.77 1odk s ASP 130 N -4.15 6.82 0.24 6.66 2.15 0.45 -4.92 116.67 123.93 1odk s ASP 130 Ca 0.70 2.55 -0.06 0.00 0.43 0.00 0.00 52.55 56.16 1odk s ASP 130 Cb -0.10 -2.63 0.31 0.00 -0.30 0.00 0.00 42.92 40.20 1odk s ASP 130 CO 0.55 -0.55 1.87 1.55 -0.17 0.00 0.00 175.17 178.41 1odk h PRO 131 N 4.59 1.01 -0.49 4.34 0.13 -1.93 -1.71 132.00 137.94 1odk h PRO 131 Ca -0.46 -0.06 -0.12 0.00 -0.87 0.00 0.00 66.00 64.49 1odk h PRO 131 Cb 1.22 -0.23 -0.02 0.00 0.13 0.00 0.00 31.00 32.11 1odk h PRO 131 CO 0.73 0.67 -0.15 0.93 -0.23 0.00 0.00 178.00 179.95 1odk h GLU 132 N 1.04 0.94 -0.35 0.86 4.39 -1.95 -0.01 114.58 119.50 1odk h GLU 132 Ca 0.37 -0.36 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 1odk h GLU 132 Cb 0.10 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1odk h GLU 132 CO -0.15 1.02 0.06 0.28 -1.16 0.00 0.00 179.01 179.06 1odk h VAL 133 N 0.83 1.24 -0.22 3.13 2.07 -1.81 0.63 116.25 122.13 1odk h VAL 133 Ca 0.12 -0.84 0.04 0.00 0.82 0.00 0.00 66.70 66.84 1odk h VAL 133 Cb 0.70 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 1odk h VAL 133 CO 0.05 0.28 0.00 0.15 0.02 0.00 0.00 177.57 178.08 1odk h PHE 134 N 0.42 -0.01 -0.77 1.57 3.57 -1.15 0.28 116.94 120.86 1odk h PHE 134 Ca 0.11 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 1odk h PHE 134 Cb 0.36 0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.09 1odk h PHE 134 CO 0.02 -0.03 0.50 -0.09 -2.23 0.00 0.00 178.31 176.48 1odk h ARG 135 N 0.07 1.03 -0.49 1.11 2.43 -0.76 -1.90 114.38 115.87 1odk h ARG 135 Ca 0.10 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 1odk h ARG 135 Cb 0.13 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 1odk h ARG 135 CO -0.17 0.70 0.19 0.00 -1.51 0.00 0.00 179.97 179.18 1odk h ALA 136 N 1.27 0.64 -0.38 2.80 0.00 -0.27 -0.09 119.26 123.23 1odk h ALA 136 Ca 0.28 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1odk h ALA 136 Cb -0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1odk h ALA 136 CO -0.06 0.25 0.24 -0.07 0.00 0.00 0.00 179.25 179.62 1odk h LEU 137 N 0.66 0.44 -0.17 0.00 3.38 -0.68 0.01 115.31 118.95 1odk h LEU 137 Ca 0.16 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1odk h LEU 137 Cb 0.20 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1odk h LEU 137 CO -0.01 0.34 0.10 -0.25 0.09 0.00 0.00 178.44 178.70 1odk h TRP 138 N 0.50 0.22 -0.28 1.13 2.91 -1.17 -1.67 115.95 117.60 1odk h TRP 138 Ca 0.14 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.15 1odk h TRP 138 Cb -0.04 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.53 1odk h TRP 138 CO -0.04 0.20 0.14 0.00 -1.03 0.00 0.00 178.44 177.71 1odk h ARG 139 N 0.18 0.40 -0.72 2.65 3.08 -0.78 -2.42 114.38 116.77 1odk h ARG 139 Ca 0.06 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1odk h ARG 139 Cb 0.05 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 1odk h ARG 139 CO -0.01 0.38 0.39 0.00 -1.07 0.00 0.00 179.97 179.66 1odk h ARG 140 N 0.33 1.00 -0.94 0.04 2.47 -0.94 0.10 114.38 116.45 1odk h ARG 140 Ca 0.10 -0.12 0.07 0.00 -1.26 0.00 0.00 59.98 58.77 1odk h ARG 140 Cb 0.10 -0.20 -0.07 0.00 -1.65 0.00 0.00 29.97 28.16 1odk h ARG 140 CO -0.01 0.75 0.59 0.00 0.56 0.00 0.00 179.97 181.86 1odk h ALA 141 N 1.20 1.31 -0.21 0.04 0.00 -1.14 0.17 119.26 120.62 1odk h ALA 141 Ca 0.25 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1odk h ALA 141 Cb 0.04 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1odk h ALA 141 CO -0.04 0.35 -0.29 0.93 0.00 0.00 0.00 179.25 180.20 1odk h GLU 142 N 1.07 0.57 -0.49 0.00 5.08 -0.88 -1.92 114.58 118.01 1odk h GLU 142 Ca 0.41 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1odk h GLU 142 Cb 0.19 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1odk h GLU 142 CO -0.18 0.93 0.21 0.00 -1.00 0.00 0.00 179.01 178.97 1odk h ALA 143 N 0.63 1.45 -0.00 3.43 0.00 -0.25 -1.48 119.26 123.03 1odk h ALA 143 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1odk h ALA 143 Cb 0.87 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1odk h ALA 143 CO 0.07 0.43 -0.12 1.28 0.00 0.00 0.00 179.25 180.91 1odk n LEU 144 N -4.36 0.36 -1.83 0.00 4.77 -0.00 -4.94 117.00 110.99 1odk n LEU 144 Ca 0.04 0.10 -0.15 0.00 -0.03 0.00 0.00 56.01 55.97 1odk n LEU 144 Cb 0.14 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1odk n LEU 144 CO 0.38 0.07 -0.12 0.61 -1.33 0.00 0.00 177.39 177.00 1odk n GLY 145 N 1.33 -0.20 3.66 -0.72 0.00 -0.56 -5.00 105.19 103.69 1odk n GLY 145 Ca 0.13 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.81 3.32 0.38 1.61 4.12 -0.76 -5.04 117.35 118.16 1odk s TYR 146 Ca 0.07 0.34 -0.27 0.00 0.02 0.00 0.00 57.07 57.23 1odk s TYR 146 Cb -0.03 -2.36 -0.11 0.00 -1.52 0.00 0.00 41.96 37.94 1odk s TYR 146 CO 0.09 0.02 1.25 -0.35 0.02 0.00 0.00 175.55 176.59 1odk n PRO 147 N 4.42 1.98 -3.44 -1.71 -0.04 -1.26 -4.67 135.00 130.27 1odk n PRO 147 Ca -0.13 0.70 -0.11 0.00 -0.04 0.00 0.00 63.50 63.92 1odk n PRO 147 Cb 0.52 -2.31 -0.02 0.00 -0.04 0.00 0.00 33.50 31.64 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 -1.15 -0.50 0.15 0.54 -3.43 -1.26 -3.88 115.29 105.77 1odk s HIS 148 Ca 0.58 0.30 0.09 0.00 -0.80 0.00 0.00 55.06 55.23 1odk s HIS 148 Cb -0.55 0.56 -0.04 0.00 -1.43 0.00 0.00 32.58 31.12 1odk s HIS 148 CO 0.60 -0.80 -0.15 1.03 -2.00 0.00 0.00 174.74 173.42 1odk s ARG 149 N -3.64 1.88 -0.11 -0.38 1.81 0.31 -4.97 118.95 113.85 1odk s ARG 149 Ca 0.02 -1.25 0.01 0.00 -1.72 0.00 0.00 55.73 52.79 1odk s ARG 149 Cb -0.01 -2.11 0.02 0.00 -0.45 0.00 0.00 34.95 32.40 1odk s ARG 149 CO -0.12 0.45 -0.12 0.08 -0.68 0.00 0.00 175.30 174.91 1odk s VAL 150 N -1.44 1.31 -2.47 3.52 1.01 -1.26 -0.80 120.40 120.27 1odk s VAL 150 Ca 0.21 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.68 1odk s VAL 150 Cb -0.10 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.05 1odk s VAL 150 CO 0.12 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.24 1odk n GLY 151 N 4.46 -0.54 3.82 4.51 0.00 -0.94 -4.93 105.19 111.57 1odk n GLY 151 Ca -0.17 -0.85 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 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 4.09 0.34 0.99 1.43 -1.25 -0.40 118.68 123.88 1odk s LEU 152 Ca 0.00 1.61 0.04 0.00 -1.03 0.00 0.00 54.13 54.75 1odk s LEU 152 Cb 0.00 -4.24 -0.07 0.00 0.03 0.00 0.00 46.19 41.92 1odk s LEU 152 CO 0.00 -0.23 0.05 0.68 0.23 0.00 0.00 176.35 177.08 1odk s VAL 153 N -1.96 1.35 -0.08 -1.59 -7.23 -0.97 -0.86 120.40 109.07 1odk s VAL 153 Ca 0.56 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.75 1odk s VAL 153 Cb -0.12 -2.82 0.01 0.00 0.56 0.00 0.00 36.38 34.01 1odk s VAL 153 CO 0.17 -0.01 -0.16 0.00 -0.31 0.00 0.00 175.10 174.79 1odk s ALA 154 N -3.18 1.55 -0.32 1.32 0.00 -0.19 -0.83 121.76 120.09 1odk s ALA 154 Ca 0.36 -0.59 -0.14 0.00 0.00 0.00 0.00 51.96 51.60 1odk s ALA 154 Cb 0.09 -0.65 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 1odk s ALA 154 CO 0.16 0.17 0.29 -1.12 0.00 0.00 0.00 175.76 175.25 1odk s SER 155 N 0.57 6.11 0.39 0.00 0.01 -0.29 -0.91 113.70 119.58 1odk s SER 155 Ca -0.16 -0.22 0.08 0.00 1.31 0.00 0.00 55.95 56.96 1odk s SER 155 Cb -0.16 -2.16 -0.06 0.00 0.21 0.00 0.00 66.02 63.84 1odk s SER 155 CO 0.05 -0.24 0.09 -1.83 0.41 0.00 0.00 173.24 171.72 1odk s GLU 156 N 1.87 2.12 -0.20 12.44 -1.05 -0.10 -1.46 118.70 132.32 1odk s GLU 156 Ca 0.09 -1.86 -0.01 0.00 -0.15 0.00 0.00 54.97 53.04 1odk s GLU 156 Cb -0.17 -1.90 -0.12 0.00 -0.44 0.00 0.00 34.13 31.50 1odk s GLU 156 CO 0.11 -0.01 -0.20 -0.25 0.95 0.00 0.00 175.26 175.86 1odk n ASP 157 N -1.09 2.24 -4.34 0.83 10.43 -1.26 -4.46 116.55 118.90 1odk n ASP 157 Ca -0.03 -0.02 -0.46 0.00 2.57 0.00 0.00 54.79 56.84 1odk n ASP 157 Cb 0.64 -0.39 -0.02 0.00 1.84 0.00 0.00 41.12 43.20 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 -2.40 4.14 0.22 2.24 0.00 -1.26 -4.91 121.76 119.79 1odk s ALA 158 Ca -0.28 -3.37 -0.11 0.00 0.00 0.00 0.00 51.96 48.20 1odk s ALA 158 Cb 0.08 -3.57 0.30 0.00 0.00 0.00 0.00 23.12 19.93 1odk s ALA 158 CO 0.44 -2.32 1.64 0.35 0.00 0.00 0.00 175.76 175.87 1odk h PHE 159 N 7.67 -0.18 -0.26 0.00 3.57 -1.98 -1.04 116.94 124.72 1odk h PHE 159 Ca 0.13 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.68 1odk h PHE 159 Cb 1.01 0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.93 1odk h PHE 159 CO 1.01 -0.23 0.00 0.66 -2.23 0.00 0.00 178.31 177.52 1odk n TYR 160 N -5.36 0.61 -0.12 0.41 4.02 -1.26 -3.98 117.16 111.47 1odk n TYR 160 Ca 0.09 -0.24 -0.17 0.00 -0.01 0.00 0.00 57.90 57.57 1odk n TYR 160 Cb 0.37 -0.13 -0.11 0.00 -0.02 0.00 0.00 39.34 39.45 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 0.30 1.48 -1.87 -0.72 0.00 -0.40 -4.95 120.51 114.35 1odk n ALA 161 Ca 0.10 -1.02 -0.42 0.00 0.00 0.00 0.00 53.44 52.10 1odk n ALA 161 Cb 0.44 -0.05 -0.03 0.00 0.00 0.00 0.00 19.45 19.81 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 -2.48 3.27 0.36 0.00 2.01 -1.21 -5.00 115.64 112.59 1odk s THR 162 Ca -0.32 0.42 -0.02 0.00 0.31 0.00 0.00 61.69 62.08 1odk s THR 162 Cb 0.08 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.28 1odk s THR 162 CO 0.55 -0.03 0.61 0.42 -0.69 0.00 0.00 174.62 175.48 1odk s THR 163 N 3.88 5.04 0.38 -0.82 -4.23 -1.26 -4.95 115.64 113.68 1odk s THR 163 Ca 0.79 -0.17 0.07 0.00 -1.18 0.00 0.00 61.69 61.19 1odk s THR 163 Cb -0.38 -3.83 0.29 0.00 1.34 0.00 0.00 72.50 69.92 1odk s THR 163 CO 0.34 -0.57 1.99 -0.65 -0.54 0.00 0.00 174.62 175.19 1odk h PRO 164 N 0.86 0.67 -0.42 3.99 0.11 -1.95 -0.91 132.00 134.36 1odk h PRO 164 Ca -0.49 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 1odk h PRO 164 Cb 1.21 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1odk h PRO 164 CO 0.63 0.44 0.12 1.49 -0.21 0.00 0.00 178.00 180.47 1odk h GLU 165 N 0.69 0.65 -0.80 1.05 4.81 -1.93 -1.42 114.58 117.63 1odk h GLU 165 Ca 0.27 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1odk h GLU 165 Cb 0.19 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 1odk h GLU 165 CO -0.08 0.66 0.32 0.93 -0.73 0.00 0.00 179.01 180.10 1odk h GLU 166 N 0.53 1.19 -0.38 1.92 5.08 -1.71 -1.21 114.58 120.00 1odk h GLU 166 Ca 0.13 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1odk h GLU 166 Cb 0.28 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1odk h GLU 166 CO -0.00 0.97 0.23 0.00 -1.00 0.00 0.00 179.01 179.21 1odk h ALA 167 N 1.17 0.48 0.00 3.43 0.00 -0.87 -1.73 119.26 121.74 1odk h ALA 167 Ca 0.27 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1odk h ALA 167 Cb 0.22 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1odk h ALA 167 CO -0.02 -0.09 -0.26 0.00 0.00 0.00 0.00 179.25 178.87 1odk h ARG 168 N 0.48 0.00 -0.35 0.00 3.08 -0.97 -1.81 114.38 114.81 1odk h ARG 168 Ca 0.15 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 1odk h ARG 168 Cb -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1odk h ARG 168 CO -0.05 0.26 0.01 0.00 -1.07 0.00 0.00 179.97 179.12 1odk h ALA 169 N 1.74 0.47 0.00 0.04 0.00 -0.44 -2.60 119.26 118.47 1odk h ALA 169 Ca -0.00 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 1odk h ALA 169 Cb 0.60 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1odk h ALA 169 CO 0.03 0.22 -0.24 -1.49 0.00 0.00 0.00 179.25 177.77 1odk h TRP 170 N 0.42 0.00 -0.01 0.00 4.06 -0.77 -2.37 115.95 117.28 1odk h TRP 170 Ca 0.10 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.02 1odk h TRP 170 Cb 0.43 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.59 1odk h TRP 170 CO 0.03 0.24 -0.15 0.00 -3.56 0.00 0.00 178.44 175.00 1odk h ALA 171 N 1.76 1.73 0.00 1.49 0.00 -0.95 -0.49 119.26 122.81 1odk h ALA 171 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1odk h ALA 171 Cb 0.46 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1odk h ALA 171 CO 0.03 0.20 0.00 0.54 0.00 0.00 0.00 179.25 180.02 1odk n ARG 172 N -4.35 0.04 -0.29 0.00 1.74 -0.89 -1.76 116.66 111.15 1odk n ARG 172 Ca -0.02 0.28 0.08 0.00 -0.77 0.00 0.00 57.85 57.41 1odk n ARG 172 Cb 0.22 -1.57 0.22 0.00 -1.02 0.00 0.00 32.46 30.31 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 -1.65 0.72 0.00 -1.55 4.01 -0.23 -4.96 117.16 113.51 1odk n TYR 173 Ca 0.03 -0.55 0.00 0.00 -0.16 0.00 0.00 57.90 57.22 1odk n TYR 173 Cb 0.18 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 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 0.72 0.29 3.65 2.72 0.00 -0.72 -5.06 105.19 106.79 1odk n GLY 174 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.00 4.13 -0.01 1.61 1.01 -1.00 -3.89 120.40 120.25 1odk s VAL 175 Ca 0.00 1.34 -0.06 0.00 0.00 0.00 0.00 61.98 63.26 1odk s VAL 175 Cb 0.00 -3.94 -0.29 0.00 0.00 0.00 0.00 36.38 32.15 1odk s VAL 175 CO 0.00 -0.20 0.79 -0.07 0.00 0.00 0.00 175.10 175.62 1odk h LEU 176 N 10.14 0.48 -7.36 3.92 3.38 -1.34 -3.34 115.31 121.20 1odk h LEU 176 Ca -0.28 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.00 1odk h LEU 176 Cb 1.11 -0.16 -0.10 0.00 0.09 0.00 0.00 40.66 41.61 1odk h LEU 176 CO 0.98 1.57 0.19 0.00 0.09 0.00 0.00 178.44 181.28 1odk s ALA 177 N -2.60 -1.41 -0.08 1.53 0.00 -1.25 -1.02 121.76 116.92 1odk s ALA 177 Ca -0.11 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1odk s ALA 177 Cb 0.06 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 24.02 1odk s ALA 177 CO 0.86 -0.85 -0.06 -0.06 0.00 0.00 0.00 175.76 175.65 1odk s PHE 178 N -3.81 2.96 0.05 0.00 0.40 0.32 -1.02 117.98 116.87 1odk s PHE 178 Ca 0.05 -0.01 0.00 0.00 -0.60 0.00 0.00 56.93 56.37 1odk s PHE 178 Cb -0.02 -1.74 -0.00 0.00 0.51 0.00 0.00 43.02 41.76 1odk s PHE 178 CO -0.06 0.29 0.06 -0.85 0.70 0.00 0.00 175.22 175.36 1odk n GLU 179 N 2.37 0.08 -1.24 0.44 -0.00 -0.08 -1.52 120.64 120.68 1odk n GLU 179 Ca -0.18 -0.44 0.05 0.00 -0.00 0.00 0.00 57.16 56.58 1odk n GLU 179 Cb 0.53 0.39 0.07 0.00 -0.00 0.00 0.00 31.44 32.43 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 -0.09 0.44 0.00 3.44 2.81 -1.26 -0.92 117.12 121.54 1odk n MET 180 Ca 0.01 -2.36 0.00 0.00 -1.81 0.00 0.00 57.70 53.54 1odk n MET 180 Cb 0.09 -0.45 0.00 0.00 -0.71 0.00 0.00 33.22 32.14 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 0.05 0.00 -0.16 0.03 4.71 -1.26 -1.30 120.64 122.71 1odk n GLU 181 Ca 0.10 0.00 -0.02 0.00 -0.01 0.00 0.00 57.16 57.22 1odk n GLU 181 Cb 1.02 -0.35 0.06 0.00 -1.01 0.00 0.00 31.44 31.16 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 0.54 -0.49 0.62 0.00 -1.95 -2.99 119.26 114.98 1odk h ALA 182 Ca 0.00 0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.12 1odk h ALA 182 Cb 0.00 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 1odk h ALA 182 CO 0.00 -0.33 -0.05 0.66 0.00 0.00 0.00 179.25 179.53 1odk h SER 183 N 0.20 -0.31 -0.53 0.00 4.64 -1.89 -0.28 113.55 115.39 1odk h SER 183 Ca 0.25 0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.67 1odk h SER 183 Cb 0.35 0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.66 1odk h SER 183 CO -0.35 -0.11 0.20 0.00 -0.87 0.00 0.00 176.83 175.71 1odk h ALA 184 N 1.46 0.69 -0.32 5.18 0.00 -1.91 -1.13 119.26 123.24 1odk h ALA 184 Ca 0.25 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1odk h ALA 184 Cb 0.38 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1odk h ALA 184 CO -0.45 0.31 0.16 1.25 0.00 0.00 0.00 179.25 180.52 1odk h LEU 185 N 0.72 0.25 -0.41 0.00 5.85 -1.23 -0.24 115.31 120.24 1odk h LEU 185 Ca 0.18 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1odk h LEU 185 Cb 0.21 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1odk h LEU 185 CO -0.01 0.18 0.20 -0.26 -0.34 0.00 0.00 178.44 178.21 1odk h PHE 186 N 0.34 0.60 -0.20 1.25 0.05 -0.86 -0.54 116.94 117.58 1odk h PHE 186 Ca 0.13 -0.03 0.01 0.00 3.82 0.00 0.00 57.97 61.90 1odk h PHE 186 Cb 0.04 -0.18 -0.01 0.00 2.00 0.00 0.00 35.95 37.79 1odk h PHE 186 CO -0.09 0.49 0.12 1.25 -0.18 0.00 0.00 178.31 179.90 1odk h LEU 187 N 0.53 0.20 -1.60 1.54 5.85 -0.95 -2.30 115.31 118.58 1odk h LEU 187 Ca 0.14 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 1odk h LEU 187 Cb 0.12 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1odk h LEU 187 CO -0.02 0.15 -0.22 -0.07 -0.34 0.00 0.00 178.44 177.94 1odk h LEU 188 N 0.25 0.00 -0.32 2.25 3.38 -0.84 -0.39 115.31 119.63 1odk h LEU 188 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1odk h LEU 188 Cb -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1odk h LEU 188 CO -0.03 0.22 0.21 1.23 0.09 0.00 0.00 178.44 180.16 1odk h GLY 189 N 0.88 0.45 1.05 0.83 0.00 -0.53 0.20 103.07 105.96 1odk h GLY 189 Ca -0.00 -0.17 -0.18 0.00 0.00 0.00 0.00 47.33 46.97 1odk h GLY 189 CO 0.03 0.17 -0.62 3.21 0.00 0.00 0.00 176.54 179.33 1odk h ARG 190 N 0.43 0.71 -0.63 4.80 2.47 -1.18 -0.09 114.38 120.90 1odk h ARG 190 Ca 0.12 -0.54 -0.03 0.00 -1.26 0.00 0.00 59.98 58.26 1odk h ARG 190 Cb -0.04 0.10 -0.03 0.00 -1.65 0.00 0.00 29.97 28.35 1odk h ARG 190 CO -0.02 1.16 0.27 0.52 0.56 0.00 0.00 179.97 182.45 1odk h MET 191 N 0.41 0.93 -0.06 0.04 2.86 -0.87 -3.07 114.93 115.16 1odk h MET 191 Ca -0.03 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1odk h MET 191 Cb 1.25 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.75 1odk h MET 191 CO 0.13 0.77 0.00 0.54 1.06 0.00 0.00 176.91 179.41 1odk n ARG 192 N -4.46 2.05 -2.99 1.72 5.12 0.67 -4.97 116.66 113.79 1odk n ARG 192 Ca 0.04 -1.53 -0.14 0.00 -1.93 0.00 0.00 57.85 54.29 1odk n ARG 192 Cb 0.16 -1.47 0.04 0.00 -1.16 0.00 0.00 32.46 30.03 1odk n ARG 192 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1odk n GLY 193 N 1.28 0.01 3.50 -0.13 0.00 -0.52 -5.04 105.19 104.29 1odk n GLY 193 Ca 0.17 -0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.09 2.09 -0.15 1.61 -7.23 -0.16 -5.04 120.40 108.43 1odk s VAL 194 Ca 0.29 -2.20 -0.15 0.00 -1.81 0.00 0.00 61.98 58.11 1odk s VAL 194 Cb -0.13 -2.56 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 1odk s VAL 194 CO 0.36 -0.25 0.35 -0.13 -0.31 0.00 0.00 175.10 175.12 1odk s ARG 195 N -3.63 4.28 0.16 4.82 0.52 0.02 -4.41 118.95 120.71 1odk s ARG 195 Ca 0.31 0.20 0.04 0.00 -0.52 0.00 0.00 55.73 55.76 1odk s ARG 195 Cb 0.02 -3.44 -0.05 0.00 0.52 0.00 0.00 34.95 32.01 1odk s ARG 195 CO 0.15 0.20 -0.06 0.95 0.02 0.00 0.00 175.30 176.55 1odk s THR 196 N 0.57 1.04 0.23 0.02 -4.23 -1.26 -0.31 115.64 111.70 1odk s THR 196 Ca 0.19 -2.03 -0.22 0.00 -1.18 0.00 0.00 61.69 58.44 1odk s THR 196 Cb -0.14 -1.98 0.04 0.00 1.34 0.00 0.00 72.50 71.76 1odk s THR 196 CO 0.06 -0.63 0.77 -0.83 -0.54 0.00 0.00 174.62 173.45 1odk s GLY 197 N -3.19 -0.18 -0.14 3.99 0.00 -0.54 -0.41 107.32 106.85 1odk s GLY 197 Ca 0.20 -0.09 -0.12 0.00 0.00 0.00 0.00 44.72 44.71 1odk s GLY 197 CO 0.02 -0.03 0.36 0.00 0.00 0.00 0.00 173.10 173.45 1odk s ALA 198 N -3.73 -0.90 -0.02 3.20 0.00 -1.26 -0.82 121.76 118.23 1odk s ALA 198 Ca 0.10 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1odk s ALA 198 Cb -0.04 -0.65 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1odk s ALA 198 CO 0.04 -0.19 -0.00 -1.50 0.00 0.00 0.00 175.76 174.11 1odk s ILE 199 N 0.43 0.14 0.21 0.00 2.07 -0.67 -1.51 121.20 121.87 1odk s ILE 199 Ca -0.02 0.05 0.07 0.00 -1.41 0.00 0.00 60.65 59.34 1odk s ILE 199 Cb -0.04 -0.20 -0.05 0.00 0.13 0.00 0.00 42.46 42.30 1odk s ILE 199 CO -0.02 0.10 -0.11 -0.76 -1.91 0.00 0.00 174.94 172.24 1odk s LEU 200 N 0.67 2.52 -0.13 8.50 1.43 0.00 -3.21 118.68 128.46 1odk s LEU 200 Ca -0.06 -1.06 0.03 0.00 -1.03 0.00 0.00 54.13 52.00 1odk s LEU 200 Cb -0.09 -0.60 0.01 0.00 0.03 0.00 0.00 46.19 45.54 1odk s LEU 200 CO -0.01 -0.24 -0.22 0.00 0.23 0.00 0.00 176.35 176.10 1odk s ALA 201 N -3.06 2.25 -0.07 4.21 0.00 -0.12 -0.54 121.76 124.43 1odk s ALA 201 Ca 0.23 -1.06 -0.30 0.00 0.00 0.00 0.00 51.96 50.84 1odk s ALA 201 Cb 0.01 -0.97 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 1odk s ALA 201 CO 0.07 0.05 1.68 0.08 0.00 0.00 0.00 175.76 177.64 1odk s VAL 202 N 0.69 3.55 -0.39 0.00 1.01 -0.33 -2.37 120.40 122.56 1odk s VAL 202 Ca -0.10 0.66 0.22 0.00 0.00 0.00 0.00 61.98 62.76 1odk s VAL 202 Cb -0.16 -3.45 -0.26 0.00 0.00 0.00 0.00 36.38 32.51 1odk s VAL 202 CO 0.01 -0.08 0.71 -1.54 0.00 0.00 0.00 175.10 174.19 1odk n SER 203 N 7.41 0.41 -3.61 3.32 3.41 -0.88 0.93 113.62 124.60 1odk n SER 203 Ca 0.18 -0.29 -0.02 0.00 -0.26 0.00 0.00 58.87 58.48 1odk n SER 203 Cb 0.43 1.46 -0.01 0.00 -0.26 0.00 0.00 64.21 65.83 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 -4.06 -0.12 -0.30 4.04 4.22 -1.26 -4.92 114.94 112.54 1odk s ASN 204 Ca -0.01 -0.10 -0.10 0.00 -2.14 0.00 0.00 52.86 50.51 1odk s ASN 204 Cb 0.14 0.20 -0.02 0.00 1.28 0.00 0.00 41.25 42.85 1odk s ASN 204 CO 0.88 -0.35 0.17 -0.13 -2.04 0.00 0.00 177.10 175.63 1odk s ARG 205 N -2.55 3.54 0.00 3.55 0.52 -1.26 -0.16 118.95 122.59 1odk s ARG 205 Ca 0.11 -0.59 0.00 0.00 -0.52 0.00 0.00 55.73 54.74 1odk s ARG 205 Cb 0.01 -3.62 0.00 0.00 0.52 0.00 0.00 34.95 31.87 1odk s ARG 205 CO -0.04 -0.35 0.39 -0.89 0.02 0.00 0.00 175.30 174.44 1odk n ILE 206 N 5.02 0.00 0.00 1.52 5.41 -0.61 -4.86 119.36 125.84 1odk n ILE 206 Ca -0.14 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.61 1odk n ILE 206 Cb 0.50 -0.90 0.00 0.00 -0.71 0.00 0.00 39.64 38.54 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 213 N 2.91 0.00 -0.09 0.38 -0.02 -1.26 -4.80 135.00 132.12 1odk n PRO 213 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.46 1odk n PRO 213 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.46 1odk n PRO 213 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1odk n PRO 214 N 0.00 -0.10 0.16 0.52 -0.04 -1.26 -1.39 135.00 132.90 1odk n PRO 214 Ca 0.00 0.96 0.04 0.00 -0.04 0.00 0.00 63.50 64.45 1odk n PRO 214 Cb 0.00 -1.42 0.45 0.00 -0.04 0.00 0.00 33.50 32.48 1odk n PRO 214 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1odk h GLU 215 N 0.00 0.15 0.14 0.54 4.57 -2.05 -1.77 114.58 116.16 1odk h GLU 215 Ca 0.03 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 1odk h GLU 215 Cb 0.09 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.66 1odk h GLU 215 CO -0.20 0.28 -0.07 0.28 -1.18 0.00 0.00 179.01 178.12 1odk h VAL 216 N 0.14 0.95 -0.26 0.32 2.07 -1.64 -1.13 116.25 116.70 1odk h VAL 216 Ca 0.03 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.12 1odk h VAL 216 Cb 0.31 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1odk h VAL 216 CO 0.02 0.09 0.01 0.25 0.02 0.00 0.00 177.57 177.96 1odk h LEU 217 N -0.38 0.45 -0.85 2.57 5.85 -1.14 -2.67 115.31 119.13 1odk h LEU 217 Ca -0.02 -0.30 0.05 0.00 0.84 0.00 0.00 57.88 58.45 1odk h LEU 217 Cb 0.30 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 1odk h LEU 217 CO 0.03 0.64 0.54 -0.61 -0.34 0.00 0.00 178.44 178.70 1odk h GLN 218 N 0.24 0.98 -0.45 1.25 5.75 -1.31 0.58 115.11 122.15 1odk h GLN 218 Ca 0.08 -0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.46 1odk h GLN 218 Cb 0.41 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 1odk h GLN 218 CO 0.01 0.65 0.06 1.49 -2.65 0.00 0.00 178.83 178.39 1odk h GLU 219 N 1.01 0.69 -0.43 1.69 4.57 -1.15 0.78 114.58 121.75 1odk h GLU 219 Ca 0.36 -0.15 -0.06 0.00 -1.18 0.00 0.00 59.36 58.33 1odk h GLU 219 Cb 0.09 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 1odk h GLU 219 CO -0.15 0.67 0.05 0.78 -1.18 0.00 0.00 179.01 179.18 1odk h GLY 220 N 0.91 0.79 1.03 1.92 0.00 -0.78 -1.34 103.07 105.61 1odk h GLY 220 Ca 0.14 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 1odk h GLY 220 CO 0.01 0.50 0.24 -2.08 0.00 0.00 0.00 176.54 175.21 1odk h VAL 221 N 0.59 1.25 -0.50 4.60 2.07 -0.36 -0.33 116.25 123.57 1odk h VAL 221 Ca 0.13 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 1odk h VAL 221 Cb 0.41 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 1odk h VAL 221 CO 0.01 0.33 0.27 -0.09 0.02 0.00 0.00 177.57 178.11 1odk h ARG 222 N 1.00 0.70 -0.33 1.57 2.43 -0.66 -1.09 114.38 118.00 1odk h ARG 222 Ca 0.23 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 1odk h ARG 222 Cb 0.26 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1odk h ARG 222 CO -0.01 0.55 0.12 0.00 -1.51 0.00 0.00 179.97 179.11 1odk h ARG 223 N 0.66 0.50 -0.61 0.20 3.08 -0.97 -1.12 114.38 116.13 1odk h ARG 223 Ca 0.17 -0.10 0.06 0.00 0.07 0.00 0.00 59.98 60.18 1odk h ARG 223 Cb 0.06 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 29.98 1odk h ARG 223 CO -0.03 0.52 0.32 1.98 -1.07 0.00 0.00 179.97 181.70 1odk h MET 224 N 0.38 0.59 -0.31 0.04 4.05 -0.83 -0.04 114.93 118.81 1odk h MET 224 Ca 0.11 -0.04 -0.06 0.00 -0.28 0.00 0.00 59.70 59.43 1odk h MET 224 Cb 0.22 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 1odk h MET 224 CO -0.01 0.39 -0.03 0.28 0.23 0.00 0.00 176.91 177.77 1odk h VAL 225 N 0.60 1.27 -0.61 -5.77 2.07 -1.03 -1.27 116.25 111.51 1odk h VAL 225 Ca 0.27 -1.03 0.02 0.00 0.82 0.00 0.00 66.70 66.79 1odk h VAL 225 Cb 0.18 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 1odk h VAL 225 CO -0.18 0.33 0.38 -0.08 0.02 0.00 0.00 177.57 178.04 1odk h GLU 226 N 0.35 0.74 -0.45 1.57 4.81 -0.80 -0.34 114.58 120.46 1odk h GLU 226 Ca 0.08 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1odk h GLU 226 Cb 0.50 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 1odk h GLU 226 CO 0.02 0.49 0.25 0.28 -0.73 0.00 0.00 179.01 179.32 1odk h VAL 227 N 0.76 1.16 -0.61 0.32 2.07 -0.87 -1.64 116.25 117.44 1odk h VAL 227 Ca 0.24 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1odk h VAL 227 Cb -0.02 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1odk h VAL 227 CO -0.08 0.16 0.32 0.00 0.02 0.00 0.00 177.57 177.99 1odk h ALA 228 N 1.10 0.78 -0.43 1.67 0.00 -0.72 -0.30 119.26 121.36 1odk h ALA 228 Ca 0.16 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1odk h ALA 228 Cb 0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1odk h ALA 228 CO -0.03 0.32 0.10 -0.07 0.00 0.00 0.00 179.25 179.58 1odk h LEU 229 N 0.83 0.66 -1.02 0.00 3.38 -0.92 -1.38 115.31 116.85 1odk h LEU 229 Ca 0.21 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1odk h LEU 229 Cb 0.08 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1odk h LEU 229 CO -0.03 0.72 -0.06 -0.33 0.09 0.00 0.00 178.44 178.83 1odk h GLU 230 N 0.56 0.63 -0.33 1.13 4.39 -1.09 -3.08 114.58 116.80 1odk h GLU 230 Ca 0.14 -0.17 -0.14 0.00 0.34 0.00 0.00 59.36 59.52 1odk h GLU 230 Cb 0.32 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1odk h GLU 230 CO 0.00 0.70 -0.35 0.00 -1.16 0.00 0.00 179.01 178.20 1odk h ALA 231 N 1.34 0.48 0.00 3.43 0.00 -0.76 -3.04 119.26 120.72 1odk h ALA 231 Ca 0.11 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1odk h ALA 231 Cb 0.47 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1odk h ALA 231 CO 0.02 0.56 -0.07 -0.39 0.00 0.00 0.00 179.25 179.37 1odk h VAL 232 N 0.60 0.32 0.00 0.00 -1.51 -1.18 -0.23 116.25 114.24 1odk h VAL 232 Ca 0.05 -0.43 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 1odk h VAL 232 Cb 0.94 1.32 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 1odk h VAL 232 CO 0.09 0.07 0.00 -0.07 -1.23 0.00 0.00 177.57 176.43 1odk h LEU 233 N 0.00 0.00 0.00 4.19 4.07 -1.46 -3.10 115.31 119.02 1odk h LEU 233 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1odk h LEU 233 Cb 0.32 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.06 1odk h LEU 233 CO 0.01 0.00 -0.23 -0.62 -1.08 0.00 0.00 178.44 176.52 1odk n GLU 234 N -2.35 0.01 0.00 1.13 -0.58 -0.10 -5.13 120.64 113.62 1odk n GLU 234 Ca 0.05 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 1odk n GLU 234 Cb 0.44 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.80 1odk n GLU 234 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98