#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bye s GLU 2 N 0.00 1.04 3.73 1.61 1.03 -1.26 -5.12 118.70 119.72 2bye s GLU 2 Ca 0.00 0.20 0.00 0.00 0.03 0.00 0.00 54.97 55.20 2bye s GLU 2 Cb 0.00 0.49 0.00 0.00 -0.80 0.00 0.00 34.13 33.82 2bye s GLU 2 CO 0.00 -0.33 0.00 -1.91 -1.33 0.00 0.00 175.26 171.69 2bye n GLU 3 N 0.89 0.00 0.14 -4.83 0.00 -1.26 -3.65 120.64 111.92 2bye n GLU 3 Ca -0.19 0.00 -0.06 0.00 0.00 0.00 0.00 57.16 56.90 2bye n GLU 3 Cb 0.57 0.00 -0.03 0.00 0.00 0.00 0.00 31.44 31.98 2bye n GLU 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2bye h ARG 4 N 0.00 -0.40 -1.20 5.31 2.47 -2.01 -3.48 114.38 115.06 2bye h ARG 4 Ca 0.00 0.03 0.16 0.00 -1.26 0.00 0.00 59.98 58.91 2bye h ARG 4 Cb 0.00 0.09 -0.28 0.00 -1.65 0.00 0.00 29.97 28.14 2bye h ARG 4 CO 0.00 -0.27 0.43 -1.59 0.56 0.00 0.00 179.97 179.10 2bye s LYS 5 N -2.93 0.26 0.28 0.04 -2.85 -1.24 -5.02 119.74 108.28 2bye s LYS 5 Ca -0.06 0.52 0.09 0.00 -1.00 0.00 0.00 55.97 55.51 2bye s LYS 5 Cb 0.01 0.15 0.38 0.00 -2.06 0.00 0.00 37.83 36.31 2bye s LYS 5 CO 0.18 -0.07 1.63 0.00 0.10 0.00 0.00 175.35 177.20 2bye s LEU 7 N -7.82 3.63 -1.23 0.00 2.96 -1.26 -4.94 118.68 110.02 2bye s LEU 7 Ca -0.02 0.19 -0.19 0.00 -0.22 0.00 0.00 54.13 53.89 2bye s LEU 7 Cb 0.13 -3.27 -0.01 0.00 0.50 0.00 0.00 46.19 43.53 2bye s LEU 7 CO 0.77 -1.34 1.93 1.67 -1.32 0.00 0.00 176.35 178.06 2bye n GLN 8 N 8.03 2.47 -3.89 1.98 7.27 -1.26 -4.88 117.38 127.09 2bye n GLN 8 Ca 0.09 -2.70 -0.35 0.00 0.07 0.00 0.00 57.00 54.11 2bye n GLN 8 Cb 0.49 -3.40 -0.14 0.00 2.41 0.00 0.00 30.24 29.60 2bye n GLN 8 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2bye s THR 9 N 5.65 3.34 -0.03 1.69 -4.23 -1.26 -0.76 115.64 120.04 2bye s THR 9 Ca 0.56 -0.68 0.04 0.00 -1.18 0.00 0.00 61.69 60.43 2bye s THR 9 Cb 0.07 -2.61 -0.00 0.00 1.34 0.00 0.00 72.50 71.30 2bye s THR 9 CO 0.06 0.29 -0.15 -1.00 -0.54 0.00 0.00 174.62 173.29 2bye s HIS 10 N 1.44 1.42 0.09 3.99 3.76 -1.19 -4.84 115.29 119.96 2bye s HIS 10 Ca 0.04 -0.35 -0.14 0.00 -0.15 0.00 0.00 55.06 54.45 2bye s HIS 10 Cb -0.15 -0.95 -0.06 0.00 1.11 0.00 0.00 32.58 32.52 2bye s HIS 10 CO -0.03 -0.10 0.49 0.50 -0.85 0.00 0.00 174.74 174.75 2bye s ARG 11 N -0.07 3.95 -0.11 1.40 3.52 -1.26 -0.32 118.95 126.06 2bye s ARG 11 Ca -0.00 0.44 0.00 0.00 -0.13 0.00 0.00 55.73 56.04 2bye s ARG 11 Cb -0.09 -3.06 0.02 0.00 -1.56 0.00 0.00 34.95 30.27 2bye s ARG 11 CO 0.01 0.57 -0.09 0.54 -0.81 0.00 0.00 175.30 175.52 2bye s VAL 12 N -1.31 1.09 -0.02 7.11 0.11 -0.39 -4.92 120.40 122.07 2bye s VAL 12 Ca 0.32 -0.35 -0.30 0.00 -2.93 0.00 0.00 61.98 58.72 2bye s VAL 12 Cb -0.16 -1.08 -0.04 0.00 -1.53 0.00 0.00 36.38 33.57 2bye s VAL 12 CO 0.18 0.37 1.21 -0.89 -3.33 0.00 0.00 175.10 172.64 2bye s THR 13 N 1.51 4.17 -0.09 5.04 2.01 -1.26 -2.23 115.64 124.79 2bye s THR 13 Ca 0.02 1.52 0.03 0.00 0.31 0.00 0.00 61.69 63.57 2bye s THR 13 Cb -0.13 -3.98 -0.01 0.00 0.01 0.00 0.00 72.50 68.39 2bye s THR 13 CO -0.06 0.03 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.00 2bye s VAL 14 N 1.89 2.37 -0.25 3.82 1.01 0.68 -4.45 120.40 125.48 2bye s VAL 14 Ca 0.57 -0.92 0.22 0.00 0.00 0.00 0.00 61.98 61.85 2bye s VAL 14 Cb -0.26 -1.92 -0.19 0.00 0.00 0.00 0.00 36.38 34.00 2bye s VAL 14 CO 0.24 0.56 0.78 1.41 0.00 0.00 0.00 175.10 178.08 2bye n HIS 15 N 3.30 0.34 -1.17 5.22 8.25 0.49 -1.02 115.22 130.63 2bye n HIS 15 Ca -0.18 0.10 -0.11 0.00 -0.26 0.00 0.00 57.72 57.27 2bye n HIS 15 Cb 0.53 -0.60 0.25 0.00 1.12 0.00 0.00 29.99 31.28 2bye n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bye n GLY 16 N 1.27 4.16 3.73 -1.41 0.00 -1.25 -4.60 105.19 107.09 2bye n GLY 16 Ca -0.01 -1.07 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 2bye n GLY 16 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bye s VAL 17 N -3.13 2.50 -0.50 1.61 -7.23 -1.26 -4.09 120.40 108.30 2bye s VAL 17 Ca 0.54 0.23 0.24 0.00 -1.81 0.00 0.00 61.98 61.17 2bye s VAL 17 Cb 0.44 -2.72 0.33 0.00 0.56 0.00 0.00 36.38 34.99 2bye s VAL 17 CO 0.10 -0.15 1.65 1.55 -0.31 0.00 0.00 175.10 177.94 2bye h PRO 18 N -0.47 0.00 -6.91 4.82 0.13 -1.91 -3.47 132.00 124.20 2bye h PRO 18 Ca -0.47 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.19 2bye h PRO 18 Cb 1.28 0.00 0.22 0.00 0.13 0.00 0.00 31.00 32.63 2bye h PRO 18 CO 0.50 0.00 -0.49 0.41 -0.23 0.00 0.00 178.00 178.19 2bye n GLY 19 N 1.15 -1.98 0.21 1.56 0.00 -1.26 -4.92 105.19 99.94 2bye n GLY 19 Ca 0.04 -0.89 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 2bye n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bye h PRO 20 N -2.14 0.24 -7.19 1.61 0.13 -2.02 -3.44 132.00 119.18 2bye h PRO 20 Ca -0.53 -0.10 -0.52 0.00 -0.87 0.00 0.00 66.00 63.99 2bye h PRO 20 Cb 1.32 -0.01 0.12 0.00 0.13 0.00 0.00 31.00 32.57 2bye h PRO 20 CO 0.41 0.56 0.38 -1.21 -0.23 0.00 0.00 178.00 177.91 2bye s GLU 21 N -4.28 2.52 0.04 0.86 2.02 -1.26 -4.95 118.70 113.65 2bye s GLU 21 Ca -0.05 1.54 -0.01 0.00 0.02 0.00 0.00 54.97 56.48 2bye s GLU 21 Cb 0.14 -1.90 -0.26 0.00 0.10 0.00 0.00 34.13 32.20 2bye s GLU 21 CO 0.76 -1.50 1.00 -1.00 0.02 0.00 0.00 175.26 174.54 2bye h PRO 22 N -0.11 0.20 -2.90 0.39 0.14 -1.91 -3.45 132.00 124.35 2bye h PRO 22 Ca -0.47 -0.33 -0.17 0.00 0.14 0.00 0.00 66.00 65.16 2bye h PRO 22 Cb 1.27 0.12 -0.29 0.00 0.14 0.00 0.00 31.00 32.24 2bye h PRO 22 CO 0.52 1.08 -0.43 -0.59 0.14 0.00 0.00 178.00 178.72 2bye s PHE 23 N -2.64 -0.42 -0.00 1.56 -0.71 -1.26 -4.52 117.98 109.99 2bye s PHE 23 Ca -0.06 0.95 -0.13 0.00 -1.04 0.00 0.00 56.93 56.66 2bye s PHE 23 Cb 0.07 0.11 0.02 0.00 -1.21 0.00 0.00 43.02 42.02 2bye s PHE 23 CO 0.85 -0.27 0.26 -0.08 -1.34 0.00 0.00 175.22 174.64 2bye s THR 24 N 1.35 0.07 -0.17 -4.49 -1.32 -0.19 -4.94 115.64 105.95 2bye s THR 24 Ca -0.09 -0.57 -0.02 0.00 -1.21 0.00 0.00 61.69 59.79 2bye s THR 24 Cb -0.10 -0.62 -0.01 0.00 -1.51 0.00 0.00 72.50 70.25 2bye s THR 24 CO -0.10 -0.32 -0.08 -0.69 -2.21 0.00 0.00 174.62 171.22 2bye s VAL 25 N -1.54 3.30 0.02 5.08 1.01 -1.26 -0.23 120.40 126.77 2bye s VAL 25 Ca -0.13 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2bye s VAL 25 Cb -0.05 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 2bye s VAL 25 CO 0.02 0.49 -0.12 -0.36 0.00 0.00 0.00 175.10 175.13 2bye s PHE 26 N 0.74 2.74 0.15 5.22 0.40 -0.95 -4.82 117.98 121.47 2bye s PHE 26 Ca -0.04 -0.14 -0.18 0.00 -0.60 0.00 0.00 56.93 55.97 2bye s PHE 26 Cb -0.15 -1.55 -0.07 0.00 0.51 0.00 0.00 43.02 41.76 2bye s PHE 26 CO 0.02 0.31 0.63 0.99 0.70 0.00 0.00 175.22 177.86 2bye s THR 27 N -0.95 4.69 0.33 0.64 2.01 -1.26 -1.27 115.64 119.83 2bye s THR 27 Ca 0.16 1.16 0.03 0.00 0.31 0.00 0.00 61.69 63.36 2bye s THR 27 Cb -0.11 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.58 2bye s THR 27 CO 0.06 0.36 0.28 2.30 -0.69 0.00 0.00 174.62 176.93 2bye n ILE 28 N 1.15 0.00 -3.63 1.82 -5.35 0.56 -4.92 119.36 108.99 2bye n ILE 28 Ca -0.06 -1.27 -0.11 0.00 -0.27 0.00 0.00 62.75 61.04 2bye n ILE 28 Cb 0.51 -0.29 -0.07 0.00 -1.74 0.00 0.00 39.64 38.05 2bye n ILE 28 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2bye s ASN 29 N -2.94 -0.59 -1.38 7.28 2.47 -1.24 -3.16 114.94 115.39 2bye s ASN 29 Ca 0.21 1.14 0.00 0.00 0.42 0.00 0.00 52.86 54.63 2bye s ASN 29 Cb -0.02 1.16 0.00 0.00 -1.45 0.00 0.00 41.25 40.94 2bye s ASN 29 CO 0.13 -0.20 0.00 0.61 -3.72 0.00 0.00 177.10 173.93 2bye n GLY 30 N 2.46 1.10 0.00 1.21 0.00 0.06 -3.38 105.19 106.63 2bye n GLY 30 Ca -0.13 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2bye n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bye n GLY 31 N -1.26 2.73 1.98 -0.02 0.00 -1.25 -4.95 105.19 102.42 2bye n GLY 31 Ca -0.14 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.22 2bye n GLY 31 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bye n THR 32 N 0.00 -6.20 -1.38 2.61 -2.24 -1.22 -4.71 114.28 101.15 2bye n THR 32 Ca 0.00 1.52 -0.29 0.00 -2.27 0.00 0.00 64.05 63.01 2bye n THR 32 Cb 0.00 -3.21 0.18 0.00 -2.10 0.00 0.00 70.33 65.21 2bye n THR 32 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2bye s LYS 33 N -0.26 0.16 0.56 -0.78 -2.85 -1.26 -4.55 119.74 110.76 2bye s LYS 33 Ca 0.00 0.11 0.34 0.00 -1.00 0.00 0.00 55.97 55.42 2bye s LYS 33 Cb 0.00 -1.74 1.59 0.00 -2.06 0.00 0.00 37.83 35.62 2bye s LYS 33 CO 0.00 -2.83 2.08 0.00 0.10 0.00 0.00 175.35 174.70 2bye h ALA 34 N -1.95 1.07 0.00 0.59 0.00 -1.75 -1.50 119.26 115.73 2bye h ALA 34 Ca -0.49 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 2bye h ALA 34 Cb 1.31 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 2bye h ALA 34 CO 0.49 0.07 -0.16 1.57 0.00 0.00 0.00 179.25 181.21 2bye h LYS 35 N 0.00 0.00 0.00 0.00 2.10 -1.89 0.23 116.57 117.01 2bye h LYS 35 Ca -0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2bye h LYS 35 Cb 0.38 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.71 2bye h LYS 35 CO 0.01 0.93 -0.02 0.37 -2.00 0.00 0.00 179.45 178.73 2bye h GLN 36 N -1.00 0.00 0.05 0.07 4.15 -1.92 -1.82 115.11 114.64 2bye h GLN 36 Ca -0.04 0.00 -0.27 0.00 0.77 0.00 0.00 58.65 59.11 2bye h GLN 36 Cb 0.97 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.63 2bye h GLN 36 CO -0.03 0.02 -1.37 1.25 -1.93 0.00 0.00 178.83 176.77 2bye h LEU 37 N 0.00 0.15 -1.00 -2.39 7.12 -1.18 -2.71 115.31 115.30 2bye h LEU 37 Ca -0.00 -0.21 0.16 0.00 0.13 0.00 0.00 57.88 57.96 2bye h LEU 37 Cb 0.07 -0.05 -0.10 0.00 -0.53 0.00 0.00 40.66 40.05 2bye h LEU 37 CO 0.00 1.17 0.61 0.25 -0.13 0.00 0.00 178.44 180.35 2bye h LEU 38 N 0.03 0.84 0.00 2.25 7.12 0.34 0.18 115.31 126.08 2bye h LEU 38 Ca -0.16 0.07 0.03 0.00 0.13 0.00 0.00 57.88 57.95 2bye h LEU 38 Cb 1.92 -0.09 -0.05 0.00 -0.53 0.00 0.00 40.66 41.92 2bye h LEU 38 CO 0.13 0.38 -0.29 -0.61 -0.13 0.00 0.00 178.44 177.91 2bye h GLN 39 N 0.87 -0.43 -0.51 1.25 4.15 -1.45 0.19 115.11 119.19 2bye h GLN 39 Ca 0.54 0.03 0.13 0.00 0.77 0.00 0.00 58.65 60.12 2bye h GLN 39 Cb 0.69 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 2bye h GLN 39 CO -0.33 -0.28 0.36 1.96 -1.93 0.00 0.00 178.83 178.60 2bye h GLN 40 N -0.44 0.09 0.11 1.69 1.08 -0.42 0.50 115.11 117.71 2bye h GLN 40 Ca 0.06 -0.01 -0.27 0.00 -1.45 0.00 0.00 58.65 56.98 2bye h GLN 40 Cb 0.53 -0.02 0.01 0.00 -0.05 0.00 0.00 27.48 27.95 2bye h GLN 40 CO -0.25 0.06 -1.18 0.82 -0.95 0.00 0.00 178.83 177.33 2bye h ILE 41 N 0.09 1.41 0.00 2.54 5.03 -0.22 -2.93 117.51 123.44 2bye h ILE 41 Ca 0.24 -2.76 0.00 0.00 -0.12 0.00 0.00 64.86 62.22 2bye h ILE 41 Cb 0.83 2.77 0.00 0.00 -3.03 0.00 0.00 36.82 37.39 2bye h ILE 41 CO -0.02 0.82 0.00 -0.07 -0.68 0.00 0.00 178.15 178.19 2bye h LEU 42 N 0.16 0.00 -7.86 1.44 3.38 0.17 -3.41 115.31 109.18 2bye h LEU 42 Ca -0.14 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.39 2bye h LEU 42 Cb 1.87 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.58 2bye h LEU 42 CO 0.21 0.00 1.45 0.41 0.09 0.00 0.00 178.44 180.60 2bye n THR 43 N -2.64 2.47 0.31 0.22 -1.04 0.15 -4.72 114.28 109.04 2bye n THR 43 Ca 0.01 -2.56 -0.16 0.00 -2.04 0.00 0.00 64.05 59.30 2bye n THR 43 Cb 0.24 -2.23 -0.08 0.00 -1.82 0.00 0.00 70.33 66.44 2bye n THR 43 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 2bye h ASN 44 N 9.01 -1.12 -3.82 8.00 4.21 -1.86 -3.48 115.58 126.52 2bye h ASN 44 Ca 0.29 0.08 -0.31 0.00 1.21 0.00 0.00 56.30 57.57 2bye h ASN 44 Cb 0.90 0.35 -0.08 0.00 -1.12 0.00 0.00 38.32 38.38 2bye h ASN 44 CO 1.32 -0.61 -0.28 -0.62 -1.29 0.00 0.00 177.43 175.95 2bye n GLU 45 N -5.05 0.46 0.00 0.81 1.02 -1.26 -5.08 120.64 111.54 2bye n GLU 45 Ca -0.12 -2.05 0.00 0.00 -0.02 0.00 0.00 57.16 54.98 2bye n GLU 45 Cb 0.41 1.42 0.00 0.00 -0.02 0.00 0.00 31.44 33.25 2bye n GLU 45 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2bye n GLN 46 N -0.46 0.00 -0.50 3.49 3.00 -1.26 -1.50 117.38 120.14 2bye n GLN 46 Ca 0.01 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.93 2bye n GLN 46 Cb 0.37 0.00 0.10 0.00 0.00 0.00 0.00 30.24 30.71 2bye n GLN 46 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2bye n ASP 47 N -1.13 3.27 -4.58 1.08 2.03 -1.26 -4.98 116.55 110.97 2bye n ASP 47 Ca 0.00 -2.63 -0.50 0.00 0.52 0.00 0.00 54.79 52.18 2bye n ASP 47 Cb 0.00 -0.63 -0.05 0.00 -0.72 0.00 0.00 41.12 39.72 2bye n ASP 47 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2bye n ILE 48 N -0.10 0.50 -3.78 5.18 5.41 -0.56 -4.96 119.36 121.05 2bye n ILE 48 Ca 0.23 -0.12 -0.29 0.00 1.00 0.00 0.00 62.75 63.56 2bye n ILE 48 Cb 0.93 -0.84 -0.13 0.00 -0.71 0.00 0.00 39.64 38.89 2bye n ILE 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2bye s LYS 49 N 0.01 1.69 0.89 0.38 1.02 -1.26 -4.74 119.74 117.74 2bye s LYS 49 Ca 0.78 -2.49 -0.14 0.00 0.02 0.00 0.00 55.97 54.14 2bye s LYS 49 Cb -0.89 -2.73 0.03 0.00 -0.52 0.00 0.00 37.83 33.72 2bye s LYS 49 CO 0.50 -1.20 -0.25 -2.30 -0.92 0.00 0.00 175.35 171.17 2bye n PRO 50 N 2.98 -1.07 -3.40 -1.68 -0.02 -1.26 -4.96 135.00 125.59 2bye n PRO 50 Ca 0.13 -0.31 -0.45 0.00 -2.02 0.00 0.00 63.50 60.85 2bye n PRO 50 Cb 0.35 -1.27 -0.05 0.00 -0.02 0.00 0.00 33.50 32.51 2bye n PRO 50 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bye s VAL 51 N -2.06 5.08 -0.66 -1.45 1.01 -1.26 -5.03 120.40 116.04 2bye s VAL 51 Ca 0.30 -2.11 -0.27 0.00 0.00 0.00 0.00 61.98 59.90 2bye s VAL 51 Cb -0.01 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.16 2bye s VAL 51 CO 0.37 -0.92 1.47 0.42 0.00 0.00 0.00 175.10 176.44 2bye s THR 52 N 0.78 3.64 0.00 3.92 -4.23 -1.26 -4.93 115.64 113.56 2bye s THR 52 Ca 0.11 0.43 0.00 0.00 -1.18 0.00 0.00 61.69 61.05 2bye s THR 52 Cb -0.20 -4.53 0.00 0.00 1.34 0.00 0.00 72.50 69.11 2bye s THR 52 CO -0.03 -1.42 0.00 1.07 -0.54 0.00 0.00 174.62 173.70 2bye n THR 53 N 6.73 0.00 0.00 3.99 5.66 -1.26 -4.87 114.28 124.53 2bye n THR 53 Ca 0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.10 2bye n THR 53 Cb 0.50 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 2bye n THR 53 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2bye n ASP 54 N 0.00 0.00 -4.77 1.09 9.92 -1.26 -4.74 116.55 116.79 2bye n ASP 54 Ca 0.00 0.15 -0.38 0.00 -0.53 0.00 0.00 54.79 54.02 2bye n ASP 54 Cb 0.00 -0.15 -0.02 0.00 -0.64 0.00 0.00 41.12 40.31 2bye n ASP 54 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2bye s TYR 55 N -2.24 3.13 0.25 1.24 2.02 -1.26 -0.15 117.35 120.34 2bye s TYR 55 Ca 0.00 1.57 -0.14 0.00 -0.37 0.00 0.00 57.07 58.13 2bye s TYR 55 Cb 0.00 -3.38 -0.00 0.00 -0.40 0.00 0.00 41.96 38.18 2bye s TYR 55 CO 0.00 -1.22 0.52 -0.59 -1.57 0.00 0.00 175.55 172.68 2bye s PHE 56 N -1.39 0.28 0.38 2.71 -0.71 -0.81 -4.91 117.98 113.52 2bye s PHE 56 Ca 0.55 -0.65 0.07 0.00 -1.04 0.00 0.00 56.93 55.86 2bye s PHE 56 Cb -0.31 0.27 -0.00 0.00 -1.21 0.00 0.00 43.02 41.77 2bye s PHE 56 CO 0.39 -1.03 0.52 -0.51 -1.34 0.00 0.00 175.22 173.24 2bye s LEU 57 N -3.00 3.81 -0.04 -1.99 1.02 -1.25 0.24 118.68 117.46 2bye s LEU 57 Ca 0.21 -0.31 -0.21 0.00 0.02 0.00 0.00 54.13 53.84 2bye s LEU 57 Cb -0.02 -2.70 0.04 0.00 0.02 0.00 0.00 46.19 43.54 2bye s LEU 57 CO 0.09 -0.59 0.46 -0.04 0.02 0.00 0.00 176.35 176.29 2bye s MET 58 N -4.26 0.80 -0.16 1.70 -1.94 -0.76 0.50 119.30 115.18 2bye s MET 58 Ca 0.50 0.05 -0.01 0.00 -1.71 0.00 0.00 55.69 54.51 2bye s MET 58 Cb -0.10 0.37 0.05 0.00 2.01 0.00 0.00 34.83 37.16 2bye s MET 58 CO 0.32 -0.23 -0.01 -1.83 -0.01 0.00 0.00 175.02 173.27 2bye s GLU 59 N -1.13 1.00 -0.21 2.03 4.04 0.80 -0.10 118.70 125.12 2bye s GLU 59 Ca -0.11 -0.40 -0.15 0.00 0.04 0.00 0.00 54.97 54.34 2bye s GLU 59 Cb -0.03 -1.91 -0.04 0.00 0.02 0.00 0.00 34.13 32.17 2bye s GLU 59 CO 0.06 -0.50 0.38 -1.21 -1.84 0.00 0.00 175.26 172.14 2bye s GLU 60 N 1.76 4.15 -0.53 -4.83 0.41 -1.21 -3.61 118.70 114.84 2bye s GLU 60 Ca 0.00 0.15 -0.21 0.00 -0.41 0.00 0.00 54.97 54.50 2bye s GLU 60 Cb -0.16 -3.55 0.05 0.00 -1.78 0.00 0.00 34.13 28.70 2bye s GLU 60 CO -0.07 -0.06 0.77 0.15 -0.49 0.00 0.00 175.26 175.55 2bye s LYS 61 N 1.39 3.20 0.00 1.61 3.01 -0.86 -4.13 119.74 123.96 2bye s LYS 61 Ca 0.18 -0.66 0.00 0.00 -1.01 0.00 0.00 55.97 54.48 2bye s LYS 61 Cb -0.15 -4.09 0.00 0.00 -1.01 0.00 0.00 37.83 32.58 2bye s LYS 61 CO 0.08 -1.36 0.00 0.98 0.51 0.00 0.00 175.35 175.56 2bye n TYR 62 N 6.75 0.00 -0.25 3.18 9.36 -1.26 -2.91 117.16 132.03 2bye n TYR 62 Ca -0.03 0.00 0.20 0.00 3.32 0.00 0.00 57.90 61.38 2bye n TYR 62 Cb 0.46 0.00 0.52 0.00 -0.63 0.00 0.00 39.34 39.69 2bye n TYR 62 CO 0.00 0.00 0.00 0.35 0.22 0.00 0.00 176.86 177.43 2bye h PHE 63 N 0.00 0.53 -0.44 2.98 3.57 -1.76 -2.24 116.94 119.58 2bye h PHE 63 Ca 0.00 0.02 -0.62 0.00 3.53 0.00 0.00 57.97 60.89 2bye h PHE 63 Cb 0.00 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 38.53 2bye h PHE 63 CO 0.00 0.13 2.65 -0.89 -2.23 0.00 0.00 178.31 177.98 2bye n ILE 64 N -4.51 4.39 -2.09 1.41 2.08 -1.26 -4.93 119.36 114.45 2bye n ILE 64 Ca 0.20 -3.04 -0.42 0.00 0.56 0.00 0.00 62.75 60.04 2bye n ILE 64 Cb 0.72 -2.30 -0.03 0.00 -0.75 0.00 0.00 39.64 37.28 2bye n ILE 64 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 2bye s SER 65 N 1.45 6.74 0.26 4.38 0.01 -0.84 -5.00 113.70 120.70 2bye s SER 65 Ca 0.64 2.26 0.05 0.00 1.31 0.00 0.00 55.95 60.21 2bye s SER 65 Cb 0.21 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.83 2bye s SER 65 CO -0.08 -0.80 -0.01 -1.59 0.41 0.00 0.00 173.24 171.17 2bye s LYS 66 N 2.61 1.47 0.99 12.44 0.00 -1.26 -5.10 119.74 130.89 2bye s LYS 66 Ca 0.68 -1.76 0.00 0.00 0.00 0.00 0.00 55.97 54.90 2bye s LYS 66 Cb -0.35 -0.85 0.00 0.00 0.00 0.00 0.00 37.83 36.64 2bye s LYS 66 CO 0.29 -0.07 0.00 -0.85 0.00 0.00 0.00 175.35 174.72 2bye n GLU 67 N -0.52 0.00 -3.18 1.78 0.28 -1.26 -4.49 120.64 113.25 2bye n GLU 67 Ca -0.05 0.00 -0.45 0.00 -0.16 0.00 0.00 57.16 56.50 2bye n GLU 67 Cb 0.64 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.47 2bye n GLU 67 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2bye s LYS 68 N 0.00 3.06 0.13 3.44 -0.14 -1.26 -4.92 119.74 120.05 2bye s LYS 68 Ca 0.00 -1.50 0.00 0.00 -1.36 0.00 0.00 55.97 53.11 2bye s LYS 68 Cb 0.00 -4.30 0.00 0.00 -1.68 0.00 0.00 37.83 31.85 2bye s LYS 68 CO 0.00 -1.47 0.00 -1.71 -0.76 0.00 0.00 175.35 171.41 2bye n ASN 69 N 5.91 -4.65 -4.16 2.83 5.15 -1.26 -4.99 115.26 114.10 2bye n ASN 69 Ca -0.09 0.48 -0.34 0.00 -0.60 0.00 0.00 54.58 54.03 2bye n ASN 69 Cb 0.42 -1.23 -0.14 0.00 -0.53 0.00 0.00 39.78 38.30 2bye n ASN 69 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2bye s GLU 70 N -3.27 2.56 0.00 1.20 2.56 -1.26 -4.95 118.70 115.53 2bye s GLU 70 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 54.97 53.81 2bye s GLU 70 Cb 0.00 -3.02 0.00 0.00 2.00 0.00 0.00 34.13 33.11 2bye s GLU 70 CO 0.00 -0.51 0.35 0.00 -0.56 0.00 0.00 175.26 174.53 2bye n ARG 72 N -0.16 0.00 -2.79 0.00 5.12 -1.26 -5.05 116.66 112.52 2bye n ARG 72 Ca 0.00 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.51 2bye n ARG 72 Cb 0.03 -0.45 -0.04 0.00 -1.16 0.00 0.00 32.46 30.84 2bye n ARG 72 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2bye s LYS 73 N -2.00 4.58 0.20 5.56 1.02 -1.26 -4.99 119.74 122.84 2bye s LYS 73 Ca 0.00 1.32 -0.30 0.00 0.02 0.00 0.00 55.97 57.00 2bye s LYS 73 Cb 0.00 -3.42 -0.09 0.00 -0.52 0.00 0.00 37.83 33.80 2bye s LYS 73 CO 0.00 0.09 1.40 -0.65 -0.92 0.00 0.00 175.35 175.26 2bye s GLN 74 N 0.54 4.32 0.57 1.68 -1.52 -1.26 -5.00 119.66 118.99 2bye s GLN 74 Ca 0.47 2.17 -0.19 0.00 -1.95 0.00 0.00 55.36 55.86 2bye s GLN 74 Cb -0.21 -3.17 -0.04 0.00 -0.22 0.00 0.00 33.01 29.36 2bye s GLN 74 CO 0.27 -0.38 1.19 -1.25 -0.25 0.00 0.00 175.29 174.86 2bye s PRO 75 N 0.17 3.13 -0.63 2.91 0.04 -1.26 -4.91 135.00 134.45 2bye s PRO 75 Ca 0.61 1.78 -0.27 0.00 0.04 0.00 0.00 61.00 63.16 2bye s PRO 75 Cb -0.39 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.15 2bye s PRO 75 CO 0.38 -1.07 1.76 -0.06 0.04 0.00 0.00 177.00 178.04 2bye s PHE 76 N -1.63 1.77 -0.31 0.56 0.08 -1.14 -4.94 117.98 112.37 2bye s PHE 76 Ca 0.75 0.65 -0.16 0.00 0.12 0.00 0.00 56.93 58.29 2bye s PHE 76 Cb -0.29 -4.18 -0.02 0.00 -0.57 0.00 0.00 43.02 37.96 2bye s PHE 76 CO 0.32 -2.28 0.43 -1.14 -0.10 0.00 0.00 175.22 172.45 2bye s GLN 77 N 6.78 3.77 -0.26 0.44 -0.44 -1.26 -2.03 119.66 126.66 2bye s GLN 77 Ca 0.62 -0.12 0.02 0.00 -2.50 0.00 0.00 55.36 53.37 2bye s GLN 77 Cb -0.12 -3.74 0.06 0.00 -1.64 0.00 0.00 33.01 27.57 2bye s GLN 77 CO 0.20 -0.47 -0.07 0.50 0.50 0.00 0.00 175.29 175.96 2bye s ARG 78 N 2.18 1.86 -0.02 1.67 6.06 -1.24 -5.02 118.95 124.44 2bye s ARG 78 Ca 0.16 -1.22 -0.09 0.00 -2.50 0.00 0.00 55.73 52.08 2bye s ARG 78 Cb -0.16 -2.76 -0.05 0.00 0.06 0.00 0.00 34.95 32.05 2bye s ARG 78 CO 0.11 -0.62 0.28 0.00 -2.50 0.00 0.00 175.30 172.57 2bye s ALA 79 N 1.23 3.81 -0.28 6.12 0.00 -1.26 -0.14 121.76 131.23 2bye s ALA 79 Ca -0.06 -0.48 -0.25 0.00 0.00 0.00 0.00 51.96 51.17 2bye s ALA 79 Cb -0.19 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2bye s ALA 79 CO -0.06 0.59 0.88 0.42 0.00 0.00 0.00 175.76 177.59 2bye s ILE 80 N -1.18 4.74 0.13 0.00 -1.09 0.18 -4.90 121.20 119.08 2bye s ILE 80 Ca 0.24 1.50 -0.02 0.00 -2.23 0.00 0.00 60.65 60.14 2bye s ILE 80 Cb -0.14 -4.20 -0.05 0.00 -1.58 0.00 0.00 42.46 36.49 2bye s ILE 80 CO 0.12 -0.23 0.32 -0.83 -1.23 0.00 0.00 174.94 173.10 2bye s GLY 81 N 1.49 2.08 0.40 6.18 0.00 -1.26 -3.89 107.32 112.31 2bye s GLY 81 Ca 0.37 -0.75 0.06 0.00 0.00 0.00 0.00 44.72 44.40 2bye s GLY 81 CO 0.11 -0.70 2.05 -2.55 0.00 0.00 0.00 173.10 172.00 2bye h PRO 82 N 2.66 0.60 -0.59 2.90 0.11 -1.97 -1.06 132.00 134.66 2bye h PRO 82 Ca -0.46 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 2bye h PRO 82 Cb 1.17 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 2bye h PRO 82 CO 0.72 0.40 0.21 0.93 -0.21 0.00 0.00 178.00 180.05 2bye h GLU 83 N 0.62 0.87 -6.63 1.05 4.39 -2.00 -3.33 114.58 109.55 2bye h GLU 83 Ca 0.17 -0.15 -0.56 0.00 0.34 0.00 0.00 59.36 59.16 2bye h GLU 83 Cb -0.07 -0.15 -0.07 0.00 -0.10 0.00 0.00 28.75 28.36 2bye h GLU 83 CO -0.04 0.73 0.93 -1.21 -1.16 0.00 0.00 179.01 178.26 2bye s GLU 84 N -5.35 3.62 -0.01 2.33 2.02 -0.40 -4.98 118.70 115.94 2bye s GLU 84 Ca -0.10 0.41 -0.20 0.00 0.02 0.00 0.00 54.97 55.10 2bye s GLU 84 Cb 0.16 -3.95 -0.05 0.00 0.10 0.00 0.00 34.13 30.38 2bye s GLU 84 CO 0.80 -1.50 0.56 -1.21 0.02 0.00 0.00 175.26 173.93 2bye s GLU 85 N 4.63 4.27 0.38 1.61 2.02 -1.26 -4.29 118.70 126.07 2bye s GLU 85 Ca 0.45 0.67 0.18 0.00 0.02 0.00 0.00 54.97 56.29 2bye s GLU 85 Cb -0.07 -3.33 0.76 0.00 0.10 0.00 0.00 34.13 31.58 2bye s GLU 85 CO 0.29 0.40 1.78 -0.84 0.02 0.00 0.00 175.26 176.91 2bye h ILE 86 N 4.11 0.96 -0.09 -1.63 3.07 -1.90 -1.61 117.51 120.41 2bye h ILE 86 Ca -0.46 -1.40 -0.01 0.00 1.55 0.00 0.00 64.86 64.54 2bye h ILE 86 Cb 1.20 1.83 -0.01 0.00 -0.27 0.00 0.00 36.82 39.57 2bye h ILE 86 CO 0.69 0.35 -0.00 0.24 -1.05 0.00 0.00 178.15 178.38 2bye h MET 87 N 0.00 0.13 0.08 0.16 2.86 -1.84 0.14 114.93 116.46 2bye h MET 87 Ca -0.00 -0.01 -0.27 0.00 -2.06 0.00 0.00 59.70 57.36 2bye h MET 87 Cb 0.80 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 32.44 2bye h MET 87 CO 0.05 0.15 -1.14 1.96 1.06 0.00 0.00 176.91 178.98 2bye h GLN 88 N 0.13 0.44 0.13 1.72 4.20 -1.71 -2.19 115.11 117.83 2bye h GLN 88 Ca 0.03 -0.59 -0.01 0.00 0.06 0.00 0.00 58.65 58.15 2bye h GLN 88 Cb 0.10 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2bye h GLN 88 CO 0.00 1.24 -0.06 0.82 -0.67 0.00 0.00 178.83 180.16 2bye h ILE 89 N 0.20 0.88 0.00 2.54 1.08 -1.13 -2.92 117.51 118.16 2bye h ILE 89 Ca -0.14 -0.04 -0.01 0.00 -0.39 0.00 0.00 64.86 64.29 2bye h ILE 89 Cb 1.82 0.90 -0.00 0.00 -3.07 0.00 0.00 36.82 36.47 2bye h ILE 89 CO 0.20 0.01 -0.05 -0.07 -0.69 0.00 0.00 178.15 177.55 2bye h LEU 90 N -0.19 0.00 0.00 1.44 3.38 -1.04 -1.52 115.31 117.38 2bye h LEU 90 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2bye h LEU 90 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2bye h LEU 90 CO 0.03 0.05 0.00 -1.20 0.09 0.00 0.00 178.44 177.41 2bye n SER 91 N -3.14 0.00 -4.34 -0.43 7.64 -0.83 -4.75 113.62 107.78 2bye n SER 91 Ca 0.02 -0.77 -0.33 0.00 1.01 0.00 0.00 58.87 58.80 2bye n SER 91 Cb 0.40 -0.06 -0.15 0.00 -1.01 0.00 0.00 64.21 63.40 2bye n SER 91 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2bye s SER 92 N -2.11 3.71 0.00 6.43 0.01 -0.57 -5.01 113.70 116.16 2bye s SER 92 Ca 0.41 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.29 2bye s SER 92 Cb 0.20 -1.42 0.00 0.00 0.21 0.00 0.00 66.02 65.01 2bye s SER 92 CO 0.36 0.19 0.00 0.79 0.41 0.00 0.00 173.24 174.99 2bye n TRP 93 N 3.35 0.00 -3.39 2.43 8.01 -1.26 -4.96 117.44 121.62 2bye n TRP 93 Ca -0.18 0.00 -0.14 0.00 -1.31 0.00 0.00 57.50 55.87 2bye n TRP 93 Cb 0.53 -1.06 -0.09 0.00 -2.01 0.00 0.00 31.31 28.67 2bye n TRP 93 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.69 176.09 2bye s PHE 94 N -1.44 -0.61 0.80 -5.99 -0.71 -1.26 -5.05 117.98 103.72 2bye s PHE 94 Ca 0.00 0.25 -0.14 0.00 -1.04 0.00 0.00 56.93 56.00 2bye s PHE 94 Cb 0.00 -0.27 0.18 0.00 -1.21 0.00 0.00 43.02 41.73 2bye s PHE 94 CO 0.00 -0.82 1.06 -2.30 -1.34 0.00 0.00 175.22 171.82 2bye n PRO 95 N 5.33 -1.14 0.00 1.99 -0.02 -1.26 -4.97 135.00 134.93 2bye n PRO 95 Ca -0.03 -1.63 0.13 0.00 -2.02 0.00 0.00 63.50 59.95 2bye n PRO 95 Cb 0.48 -1.11 0.45 0.00 -0.02 0.00 0.00 33.50 33.30 2bye n PRO 95 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2bye n GLU 96 N -3.31 0.48 0.00 -0.52 1.02 -1.26 -4.86 120.64 112.19 2bye n GLU 96 Ca 0.13 -0.23 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 2bye n GLU 96 Cb 0.46 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.39 2bye n GLU 96 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2bye n GLU 97 N -1.06 1.51 -1.97 3.49 0.00 -1.26 -5.15 120.64 116.20 2bye n GLU 97 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 57.16 56.98 2bye n GLU 97 Cb 0.32 0.00 0.08 0.00 0.00 0.00 0.00 31.44 31.84 2bye n GLU 97 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 2bye s GLY 98 N 0.00 1.61 0.15 8.31 0.00 -1.26 -4.97 107.32 111.16 2bye s GLY 98 Ca 0.00 -0.69 -0.32 0.00 0.00 0.00 0.00 44.72 43.71 2bye s GLY 98 CO 0.00 -0.23 1.75 2.98 0.00 0.00 0.00 173.10 177.60 2bye n TYR 99 N -3.20 2.58 0.87 1.90 9.36 -1.26 -4.73 117.16 122.68 2bye n TYR 99 Ca 0.08 0.01 0.00 0.00 3.32 0.00 0.00 57.90 61.31 2bye n TYR 99 Cb 0.61 -2.67 0.00 0.00 -0.63 0.00 0.00 39.34 36.65 2bye n TYR 99 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2bye n MET 100 N 4.66 0.87 -3.67 2.98 0.00 -1.26 -4.74 117.12 115.97 2bye n MET 100 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.77 2bye n MET 100 Cb 0.34 -1.20 -0.05 0.00 0.00 0.00 0.00 33.22 32.32 2bye n MET 100 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2bye s GLY 101 N 0.59 -0.20 -0.11 3.17 0.00 -1.26 -4.10 107.32 105.41 2bye s GLY 101 Ca 0.00 -0.14 -0.13 0.00 0.00 0.00 0.00 44.72 44.45 2bye s GLY 101 CO 0.00 -0.36 0.36 1.09 0.00 0.00 0.00 173.10 174.20 2bye s ARG 102 N -3.82 0.48 0.04 2.90 1.70 -1.26 -4.96 118.95 114.03 2bye s ARG 102 Ca 0.04 0.37 -0.25 0.00 -0.47 0.00 0.00 55.73 55.43 2bye s ARG 102 Cb 0.02 0.23 -0.05 0.00 -0.57 0.00 0.00 34.95 34.57 2bye s ARG 102 CO -0.10 -0.08 0.76 0.42 -1.08 0.00 0.00 175.30 175.22 2bye s ILE 103 N -0.12 4.74 -0.25 4.99 1.01 -1.25 -3.29 121.20 127.03 2bye s ILE 103 Ca -0.03 1.62 0.02 0.00 0.00 0.00 0.00 60.65 62.27 2bye s ILE 103 Cb -0.03 -4.11 0.06 0.00 0.01 0.00 0.00 42.46 38.39 2bye s ILE 103 CO 0.01 0.36 -0.10 0.68 0.00 0.00 0.00 174.94 175.90 2bye s VAL 104 N -0.05 2.00 -0.28 2.92 -7.23 0.86 -0.38 120.40 118.24 2bye s VAL 104 Ca 0.38 -1.52 -0.28 0.00 -1.81 0.00 0.00 61.98 58.75 2bye s VAL 104 Cb -0.20 -2.15 -0.03 0.00 0.56 0.00 0.00 36.38 34.56 2bye s VAL 104 CO 0.23 -0.03 1.92 -0.22 -0.31 0.00 0.00 175.10 176.68 2bye s LEU 105 N 1.18 3.52 0.00 1.32 2.96 -1.26 -1.82 118.68 124.58 2bye s LEU 105 Ca -0.08 1.53 0.07 0.00 -0.22 0.00 0.00 54.13 55.43 2bye s LEU 105 Cb -0.20 -3.52 0.07 0.00 0.50 0.00 0.00 46.19 43.05 2bye s LEU 105 CO -0.05 -1.75 0.60 0.29 -1.32 0.00 0.00 176.35 174.12 2bye n LYS 106 N 8.48 0.69 -4.56 1.98 4.76 0.14 -4.43 118.16 125.21 2bye n LYS 106 Ca 0.25 -2.74 -0.28 0.00 -2.87 0.00 0.00 58.31 52.67 2bye n LYS 106 Cb 0.46 -0.08 -0.11 0.00 -1.84 0.00 0.00 35.03 33.47 2bye n LYS 106 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2bye s THR 107 N -2.14 2.03 0.00 -0.18 -4.23 -1.26 -1.92 115.64 107.94 2bye s THR 107 Ca 0.46 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 2bye s THR 107 Cb -0.04 -3.00 0.00 0.00 1.34 0.00 0.00 72.50 70.81 2bye s THR 107 CO 0.29 0.00 1.89 1.67 -0.54 0.00 0.00 174.62 177.93 2bye n GLN 108 N -1.00 0.96 -0.57 3.99 7.27 0.79 -4.80 117.38 124.01 2bye n GLN 108 Ca -0.05 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.73 2bye n GLN 108 Cb 0.67 -1.02 0.22 0.00 2.41 0.00 0.00 30.24 32.51 2bye n GLN 108 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2bye n GLN 109 N 1.49 -1.69 0.00 3.69 10.64 -1.26 -5.08 117.38 125.17 2bye n GLN 109 Ca 0.00 -0.45 0.06 0.00 -1.83 0.00 0.00 57.00 54.77 2bye n GLN 109 Cb 0.48 -2.18 0.34 0.00 -0.86 0.00 0.00 30.24 28.02 2bye n GLN 109 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32