#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bye n GLU 2 N 0.00 1.49 -1.84 1.61 4.71 -1.26 -4.99 120.64 120.35 2bye n GLU 2 Ca 0.00 -1.28 -0.42 0.00 -0.01 0.00 0.00 57.16 55.44 2bye n GLU 2 Cb 0.00 -1.09 -0.03 0.00 -1.01 0.00 0.00 31.44 29.31 2bye n GLU 2 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 2bye s GLU 3 N -0.71 4.16 -0.49 3.49 8.01 -1.26 -4.90 118.70 127.01 2bye s GLU 3 Ca 0.07 2.41 -0.28 0.00 0.01 0.00 0.00 54.97 57.18 2bye s GLU 3 Cb 0.04 -3.99 -0.01 0.00 -4.31 0.00 0.00 34.13 25.87 2bye s GLU 3 CO 0.05 -0.88 1.64 1.03 0.01 0.00 0.00 175.26 177.12 2bye s ARG 4 N 3.95 3.17 -1.09 1.61 0.52 -1.26 -4.92 118.95 120.94 2bye s ARG 4 Ca 0.80 0.85 -0.16 0.00 -0.52 0.00 0.00 55.73 56.70 2bye s ARG 4 Cb -0.39 -4.20 0.16 0.00 0.52 0.00 0.00 34.95 31.04 2bye s ARG 4 CO 0.35 -2.07 1.29 0.15 0.02 0.00 0.00 175.30 175.05 2bye s LYS 5 N 5.87 3.90 0.45 3.54 -0.14 -1.26 -4.99 119.74 127.10 2bye s LYS 5 Ca 0.65 -2.28 0.07 0.00 -1.36 0.00 0.00 55.97 53.05 2bye s LYS 5 Cb -0.15 -4.98 -0.01 0.00 -1.68 0.00 0.00 37.83 31.01 2bye s LYS 5 CO 0.27 -1.74 0.40 0.00 -0.76 0.00 0.00 175.35 173.52 2bye n LEU 7 N -1.61 1.98 -4.77 0.00 7.94 -1.26 -4.12 117.00 115.15 2bye n LEU 7 Ca 0.03 -1.52 -0.39 0.00 -1.11 0.00 0.00 56.01 53.02 2bye n LEU 7 Cb 0.62 -0.06 -0.01 0.00 0.53 0.00 0.00 43.42 44.51 2bye n LEU 7 CO 0.42 0.47 0.90 -1.10 -1.11 0.00 0.00 177.39 176.97 2bye s GLN 8 N -0.74 3.89 -0.54 1.96 -0.21 -1.26 -2.45 119.66 120.31 2bye s GLN 8 Ca 0.09 2.00 -0.25 0.00 0.02 0.00 0.00 55.36 57.22 2bye s GLN 8 Cb 0.05 -2.63 0.04 0.00 1.00 0.00 0.00 33.01 31.47 2bye s GLN 8 CO 0.07 -0.51 0.97 0.95 -2.12 0.00 0.00 175.29 174.65 2bye s THR 9 N -1.36 4.36 -0.14 -0.19 -4.23 -1.26 -3.03 115.64 109.80 2bye s THR 9 Ca 0.59 0.43 -0.04 0.00 -1.18 0.00 0.00 61.69 61.50 2bye s THR 9 Cb -0.34 -4.54 -0.03 0.00 1.34 0.00 0.00 72.50 68.92 2bye s THR 9 CO 0.43 -1.09 -0.01 -1.00 -0.54 0.00 0.00 174.62 172.41 2bye s HIS 10 N 4.03 3.10 0.16 3.99 0.09 -1.13 -4.77 115.29 120.75 2bye s HIS 10 Ca 0.33 -0.10 -0.18 0.00 -0.00 0.00 0.00 55.06 55.11 2bye s HIS 10 Cb -0.11 -1.93 -0.07 0.00 -0.00 0.00 0.00 32.58 30.46 2bye s HIS 10 CO 0.21 0.13 0.63 0.50 -0.00 0.00 0.00 174.74 176.21 2bye s ARG 11 N 0.04 4.15 -0.13 1.40 3.52 -1.26 -0.06 118.95 126.62 2bye s ARG 11 Ca 0.02 0.71 0.00 0.00 -0.13 0.00 0.00 55.73 56.33 2bye s ARG 11 Cb -0.13 -2.98 0.02 0.00 -1.56 0.00 0.00 34.95 30.30 2bye s ARG 11 CO 0.02 0.48 -0.11 0.54 -0.81 0.00 0.00 175.30 175.42 2bye s VAL 12 N -1.41 1.30 -0.19 7.11 0.11 -0.21 -4.92 120.40 122.19 2bye s VAL 12 Ca 0.38 -0.47 -0.29 0.00 -2.93 0.00 0.00 61.98 58.67 2bye s VAL 12 Cb -0.17 -1.26 -0.01 0.00 -1.53 0.00 0.00 36.38 33.42 2bye s VAL 12 CO 0.20 0.41 1.24 -0.89 -3.33 0.00 0.00 175.10 172.74 2bye s THR 13 N 1.50 4.31 -0.26 5.04 2.01 -1.26 -2.27 115.64 124.70 2bye s THR 13 Ca 0.03 1.57 -0.10 0.00 0.31 0.00 0.00 61.69 63.50 2bye s THR 13 Cb -0.13 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 2bye s THR 13 CO -0.08 -0.20 0.15 -0.69 -0.69 0.00 0.00 174.62 173.12 2bye s VAL 14 N 3.60 5.05 -1.30 3.82 1.01 0.68 -4.18 120.40 129.07 2bye s VAL 14 Ca 0.54 0.08 0.23 0.00 0.00 0.00 0.00 61.98 62.83 2bye s VAL 14 Cb -0.20 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 2bye s VAL 14 CO 0.15 0.29 1.21 1.57 0.00 0.00 0.00 175.10 178.32 2bye n HIS 15 N 4.89 0.00 0.01 5.22 -0.00 0.53 -1.28 115.22 124.59 2bye n HIS 15 Ca -0.15 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 57.90 2bye n HIS 15 Cb 0.52 -0.10 -0.14 0.00 -0.12 0.00 0.00 29.99 30.15 2bye n HIS 15 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 2bye h GLY 16 N 4.96 0.13 -5.08 1.57 0.00 -1.77 -3.45 103.07 99.44 2bye h GLY 16 Ca 0.00 -0.34 -0.53 0.00 0.00 0.00 0.00 47.33 46.45 2bye h GLY 16 CO 0.00 0.30 1.07 0.54 0.00 0.00 0.00 176.54 178.44 2bye s VAL 17 N -2.61 3.09 0.00 4.60 0.11 -1.26 -4.44 120.40 119.89 2bye s VAL 17 Ca -0.09 0.41 0.00 0.00 -2.93 0.00 0.00 61.98 59.37 2bye s VAL 17 Cb 0.08 -3.26 0.00 0.00 -1.53 0.00 0.00 36.38 31.66 2bye s VAL 17 CO 0.82 -0.01 0.00 -0.81 -3.33 0.00 0.00 175.10 171.77 2bye n PRO 18 N 6.21 0.00 0.00 1.54 -0.04 -1.26 -4.68 135.00 136.78 2bye n PRO 18 Ca 0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 2bye n PRO 18 Cb 0.41 -0.33 0.00 0.00 -0.04 0.00 0.00 33.50 33.54 2bye n PRO 18 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bye n GLY 19 N 0.71 -1.20 0.14 0.55 0.00 -1.26 -3.95 105.19 100.18 2bye n GLY 19 Ca 0.00 -1.10 0.02 0.00 0.00 0.00 0.00 46.02 44.95 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 0.00 0.00 -7.36 1.61 0.13 -2.00 -3.46 132.00 120.92 2bye h PRO 20 Ca 0.00 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.62 2bye h PRO 20 Cb 0.00 0.00 0.06 0.00 0.13 0.00 0.00 31.00 31.19 2bye h PRO 20 CO 0.00 0.52 0.41 -1.21 -0.23 0.00 0.00 178.00 177.50 2bye s GLU 21 N -3.11 3.51 0.04 0.86 2.02 -1.25 -4.99 118.70 115.78 2bye s GLU 21 Ca 0.03 0.76 -0.03 0.00 0.02 0.00 0.00 54.97 55.75 2bye s GLU 21 Cb 0.09 -2.07 -0.28 0.00 0.10 0.00 0.00 34.13 31.97 2bye s GLU 21 CO 0.74 -0.64 0.99 -1.35 0.02 0.00 0.00 175.26 175.02 2bye h PRO 22 N -0.37 0.25 -3.22 0.39 0.11 -1.89 -3.45 132.00 123.81 2bye h PRO 22 Ca -0.44 -0.43 -0.15 0.00 0.11 0.00 0.00 66.00 65.08 2bye h PRO 22 Cb 1.19 0.16 -0.23 0.00 0.11 0.00 0.00 31.00 32.23 2bye h PRO 22 CO 0.62 1.15 -0.42 -0.59 -0.21 0.00 0.00 178.00 178.54 2bye s PHE 23 N -2.63 -0.17 0.01 0.65 -0.71 -1.26 -4.70 117.98 109.15 2bye s PHE 23 Ca -0.06 0.38 0.01 0.00 -1.04 0.00 0.00 56.93 56.22 2bye s PHE 23 Cb 0.07 0.06 -0.01 0.00 -1.21 0.00 0.00 43.02 41.93 2bye s PHE 23 CO 0.87 -0.21 -0.04 -0.08 -1.34 0.00 0.00 175.22 174.41 2bye s THR 24 N -0.49 0.32 -0.15 -4.49 -1.32 -0.41 -4.93 115.64 104.16 2bye s THR 24 Ca -0.06 -0.34 -0.02 0.00 -1.21 0.00 0.00 61.69 60.06 2bye s THR 24 Cb -0.04 -0.30 -0.02 0.00 -1.51 0.00 0.00 72.50 70.63 2bye s THR 24 CO 0.01 -0.02 -0.10 -0.69 -2.21 0.00 0.00 174.62 171.61 2bye s VAL 25 N -0.37 3.27 0.03 5.08 1.01 -1.26 -0.23 120.40 127.94 2bye s VAL 25 Ca -0.01 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.46 2bye s VAL 25 Cb -0.03 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 2bye s VAL 25 CO -0.00 0.50 -0.15 -0.36 0.00 0.00 0.00 175.10 175.09 2bye s PHE 26 N 0.56 2.65 0.10 5.22 0.08 -0.96 -4.82 117.98 120.81 2bye s PHE 26 Ca -0.06 -0.19 -0.20 0.00 0.12 0.00 0.00 56.93 56.59 2bye s PHE 26 Cb -0.15 -1.50 -0.07 0.00 -0.57 0.00 0.00 43.02 40.73 2bye s PHE 26 CO 0.03 0.29 0.62 0.99 -0.10 0.00 0.00 175.22 177.05 2bye s THR 27 N -0.96 4.66 0.49 0.64 2.01 -1.26 -1.05 115.64 120.17 2bye s THR 27 Ca 0.16 1.30 0.05 0.00 0.31 0.00 0.00 61.69 63.50 2bye s THR 27 Cb -0.11 -3.94 0.05 0.00 0.01 0.00 0.00 72.50 68.51 2bye s THR 27 CO 0.06 0.52 0.41 2.30 -0.69 0.00 0.00 174.62 177.22 2bye n ILE 28 N 1.61 0.00 -3.70 1.82 -6.64 0.92 -4.92 119.36 108.45 2bye n ILE 28 Ca -0.09 -1.89 -0.13 0.00 -1.77 0.00 0.00 62.75 58.87 2bye n ILE 28 Cb 0.50 -0.15 -0.09 0.00 -1.44 0.00 0.00 39.64 38.47 2bye n ILE 28 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 2bye s ASN 29 N -3.88 -0.53 1.73 7.28 2.20 -1.26 -2.85 114.94 117.62 2bye s ASN 29 Ca 0.31 1.02 0.00 0.00 -0.94 0.00 0.00 52.86 53.25 2bye s ASN 29 Cb -0.02 1.04 0.00 0.00 -2.00 0.00 0.00 41.25 40.26 2bye s ASN 29 CO 0.20 -0.19 0.00 0.61 -2.94 0.00 0.00 177.10 174.78 2bye n GLY 30 N 2.76 1.63 2.26 0.45 0.00 -1.03 -3.42 105.19 107.85 2bye n GLY 30 Ca -0.14 0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 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 0.00 3.47 3.73 -0.02 0.00 -1.26 -4.36 105.19 106.74 2bye n GLY 31 Ca 0.00 -1.80 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 2bye n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bye s THR 32 N -1.93 3.16 0.27 2.61 -4.23 -1.22 -5.04 115.64 109.26 2bye s THR 32 Ca 0.38 0.88 -0.02 0.00 -1.18 0.00 0.00 61.69 61.75 2bye s THR 32 Cb 0.24 -3.56 0.06 0.00 1.34 0.00 0.00 72.50 70.57 2bye s THR 32 CO -0.09 0.09 0.37 2.29 -0.54 0.00 0.00 174.62 176.74 2bye n LYS 33 N 3.39 0.08 0.27 3.99 2.85 -1.26 -4.58 118.16 122.91 2bye n LYS 33 Ca 0.10 -0.82 0.15 0.00 -1.05 0.00 0.00 58.31 56.68 2bye n LYS 33 Cb 0.42 -0.31 0.75 0.00 -0.65 0.00 0.00 35.03 35.24 2bye n LYS 33 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2bye h ALA 34 N -1.03 1.14 0.00 0.58 0.00 -1.78 0.55 119.26 118.72 2bye h ALA 34 Ca -0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2bye h ALA 34 Cb 0.40 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2bye h ALA 34 CO 0.11 0.11 -0.13 -0.22 0.00 0.00 0.00 179.25 179.12 2bye h LYS 35 N 0.00 0.00 0.00 0.00 1.63 -1.86 0.26 116.57 116.59 2bye h LYS 35 Ca -0.00 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 2bye h LYS 35 Cb 0.39 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.02 2bye h LYS 35 CO 0.01 0.73 -0.05 1.96 -3.45 0.00 0.00 179.45 178.65 2bye h GLN 36 N -1.00 0.00 0.17 1.90 1.08 -1.92 -2.63 115.11 112.71 2bye h GLN 36 Ca -0.03 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.84 2bye h GLN 36 Cb 0.77 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.21 2bye h GLN 36 CO -0.02 0.05 -1.61 1.25 -0.95 0.00 0.00 178.83 177.54 2bye h LEU 37 N 0.00 0.57 -1.36 1.46 7.12 -0.85 -2.64 115.31 119.61 2bye h LEU 37 Ca -0.00 -0.78 0.14 0.00 0.13 0.00 0.00 57.88 57.37 2bye h LEU 37 Cb 0.18 -0.19 -0.06 0.00 -0.53 0.00 0.00 40.66 40.05 2bye h LEU 37 CO 0.01 1.64 0.55 0.25 -0.13 0.00 0.00 178.44 180.76 2bye h LEU 38 N 0.10 0.59 0.14 2.25 7.12 -0.13 0.23 115.31 125.61 2bye h LEU 38 Ca -0.29 0.03 0.02 0.00 0.13 0.00 0.00 57.88 57.77 2bye h LEU 38 Cb 2.08 -0.09 -0.04 0.00 -0.53 0.00 0.00 40.66 42.09 2bye h LEU 38 CO 0.19 0.31 -0.30 -0.61 -0.13 0.00 0.00 178.44 177.90 2bye h GLN 39 N 0.63 -0.52 -0.52 1.25 4.15 -1.51 0.31 115.11 118.90 2bye h GLN 39 Ca 0.42 0.04 0.13 0.00 0.77 0.00 0.00 58.65 60.01 2bye h GLN 39 Cb 0.72 0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.50 2bye h GLN 39 CO -0.18 -0.34 0.37 1.96 -1.93 0.00 0.00 178.83 178.71 2bye h GLN 40 N -0.53 0.11 0.15 1.69 1.08 -0.28 0.29 115.11 117.61 2bye h GLN 40 Ca 0.03 -0.01 -0.30 0.00 -1.45 0.00 0.00 58.65 56.92 2bye h GLN 40 Cb 0.55 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 27.96 2bye h GLN 40 CO -0.16 0.07 -1.38 0.82 -0.95 0.00 0.00 178.83 177.23 2bye h ILE 41 N 0.12 1.35 0.00 2.54 5.03 -0.40 -3.17 117.51 122.98 2bye h ILE 41 Ca 0.25 -2.91 -0.03 0.00 -0.12 0.00 0.00 64.86 62.04 2bye h ILE 41 Cb 0.83 2.90 -0.00 0.00 -3.03 0.00 0.00 36.82 37.52 2bye h ILE 41 CO -0.03 0.86 -0.15 -0.07 -0.68 0.00 0.00 178.15 178.08 2bye h LEU 42 N 0.08 0.00 -8.25 1.44 3.38 0.15 -3.43 115.31 108.68 2bye h LEU 42 Ca -0.19 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.63 2bye h LEU 42 Cb 2.02 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.73 2bye h LEU 42 CO 0.20 0.15 0.75 0.41 0.09 0.00 0.00 178.44 180.04 2bye n THR 43 N -3.68 -0.01 0.32 0.22 -1.04 0.84 -4.67 114.28 106.27 2bye n THR 43 Ca -0.02 -0.51 0.15 0.00 -2.04 0.00 0.00 64.05 61.64 2bye n THR 43 Cb 0.27 -1.44 0.63 0.00 -1.82 0.00 0.00 70.33 67.98 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 12.67 0.00 0.00 8.00 2.35 -1.85 -3.46 115.58 133.29 2bye h ASN 44 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2bye h ASN 44 Cb 1.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.44 2bye h ASN 44 CO 1.20 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 176.36 2bye n GLU 45 N -2.77 0.00 -2.42 0.81 -0.58 -1.26 -4.79 120.64 109.64 2bye n GLU 45 Ca 0.01 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.37 2bye n GLU 45 Cb 0.27 -1.05 -0.03 0.00 -0.57 0.00 0.00 31.44 30.05 2bye n GLU 45 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2bye s GLN 46 N 0.00 3.21 0.00 3.49 -0.21 -1.26 -3.14 119.66 121.75 2bye s GLN 46 Ca 0.00 -0.58 0.00 0.00 0.02 0.00 0.00 55.36 54.80 2bye s GLN 46 Cb 0.00 -4.91 0.00 0.00 1.00 0.00 0.00 33.01 29.10 2bye s GLN 46 CO 0.00 -2.45 0.00 -3.47 -2.12 0.00 0.00 175.29 167.25 2bye n ASP 47 N 10.29 0.00 0.00 5.90 2.03 -1.26 -4.63 116.55 128.87 2bye n ASP 47 Ca 0.25 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.56 2bye n ASP 47 Cb 0.50 -2.30 0.00 0.00 -0.72 0.00 0.00 41.12 38.60 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 -1.97 0.00 0.00 5.18 5.41 -1.19 -4.85 119.36 121.95 2bye n ILE 48 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2bye n ILE 48 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2bye n ILE 48 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2bye n LYS 49 N 0.00 0.00 -0.48 0.38 5.02 -1.26 -4.11 118.16 117.70 2bye n LYS 49 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.07 2bye n LYS 49 Cb 0.00 0.00 0.18 0.00 -0.02 0.00 0.00 35.03 35.19 2bye n LYS 49 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2bye n PRO 50 N 0.00 -2.72 -3.86 1.97 -0.02 -1.26 -5.03 135.00 124.07 2bye n PRO 50 Ca 0.00 -0.80 -0.30 0.00 -2.02 0.00 0.00 63.50 60.38 2bye n PRO 50 Cb 0.00 -1.61 -0.14 0.00 -0.02 0.00 0.00 33.50 31.73 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 -2.11 1.81 -0.53 -1.45 1.01 -1.26 -5.08 120.40 112.79 2bye s VAL 51 Ca 0.45 -2.39 -0.27 0.00 0.00 0.00 0.00 61.98 59.78 2bye s VAL 51 Cb -0.08 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 2bye s VAL 51 CO 0.43 -0.73 1.87 0.42 0.00 0.00 0.00 175.10 177.09 2bye s THR 52 N 0.68 3.37 0.00 3.92 -4.23 -1.26 -4.93 115.64 113.19 2bye s THR 52 Ca 0.14 0.28 0.00 0.00 -1.18 0.00 0.00 61.69 60.92 2bye s THR 52 Cb -0.21 -3.81 0.00 0.00 1.34 0.00 0.00 72.50 69.82 2bye s THR 52 CO -0.08 -0.72 0.00 0.41 -0.54 0.00 0.00 174.62 173.69 2bye n THR 53 N 7.32 0.00 1.74 3.99 -1.04 -1.26 -4.89 114.28 120.14 2bye n THR 53 Ca 0.22 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.24 2bye n THR 53 Cb 0.51 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.05 2bye n THR 53 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2bye n ASP 54 N 0.00 0.40 -4.77 8.00 8.00 -1.26 -4.89 116.55 122.04 2bye n ASP 54 Ca 0.00 -2.01 -0.37 0.00 0.71 0.00 0.00 54.79 53.13 2bye n ASP 54 Cb 0.00 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 2bye n ASP 54 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2bye s TYR 55 N -1.86 2.73 0.35 1.24 2.02 -1.26 -0.44 117.35 120.12 2bye s TYR 55 Ca 0.04 1.52 -0.10 0.00 -0.37 0.00 0.00 57.07 58.16 2bye s TYR 55 Cb 0.02 -3.43 0.02 0.00 -0.40 0.00 0.00 41.96 38.18 2bye s TYR 55 CO 0.03 -1.75 0.61 -0.59 -1.57 0.00 0.00 175.55 172.28 2bye s PHE 56 N -1.55 0.55 0.40 2.71 -0.12 -0.44 -4.91 117.98 114.62 2bye s PHE 56 Ca 0.67 -0.98 0.08 0.00 -0.05 0.00 0.00 56.93 56.65 2bye s PHE 56 Cb -0.29 0.35 -0.01 0.00 -0.63 0.00 0.00 43.02 42.43 2bye s PHE 56 CO 0.35 -1.30 0.42 -0.51 -0.05 0.00 0.00 175.22 174.13 2bye s LEU 57 N -3.13 3.53 0.00 -1.99 1.02 -1.22 0.15 118.68 117.05 2bye s LEU 57 Ca 0.23 -0.58 -0.20 0.00 0.02 0.00 0.00 54.13 53.59 2bye s LEU 57 Cb -0.03 -2.29 0.04 0.00 0.02 0.00 0.00 46.19 43.94 2bye s LEU 57 CO 0.15 -0.62 0.45 -0.04 0.02 0.00 0.00 176.35 176.31 2bye s MET 58 N -4.17 0.88 -0.46 1.70 -1.94 -0.38 0.66 119.30 115.58 2bye s MET 58 Ca 0.49 -0.16 -0.18 0.00 -1.71 0.00 0.00 55.69 54.13 2bye s MET 58 Cb -0.06 0.40 0.04 0.00 2.01 0.00 0.00 34.83 37.22 2bye s MET 58 CO 0.29 -0.28 0.51 -2.00 -0.01 0.00 0.00 175.02 173.54 2bye s GLU 59 N -1.80 3.10 0.08 2.03 -6.30 -0.66 -0.99 118.70 114.16 2bye s GLU 59 Ca -0.09 -0.85 0.05 0.00 -2.50 0.00 0.00 54.97 51.58 2bye s GLU 59 Cb -0.02 -4.03 -0.04 0.00 0.00 0.00 0.00 34.13 30.04 2bye s GLU 59 CO 0.03 -1.02 -0.05 -1.21 0.02 0.00 0.00 175.26 173.03 2bye s GLU 60 N 2.30 2.38 -0.35 4.30 2.02 -1.08 -3.94 118.70 124.33 2bye s GLU 60 Ca 0.13 -0.89 -0.11 0.00 0.02 0.00 0.00 54.97 54.12 2bye s GLU 60 Cb -0.19 -2.44 0.01 0.00 0.10 0.00 0.00 34.13 31.62 2bye s GLU 60 CO 0.13 0.54 0.19 0.15 0.02 0.00 0.00 175.26 176.29 2bye s LYS 61 N -2.10 3.05 0.53 1.61 -0.14 -1.26 -4.10 119.74 117.34 2bye s LYS 61 Ca 0.22 -0.92 -0.05 0.00 -1.36 0.00 0.00 55.97 53.86 2bye s LYS 61 Cb -0.11 -3.69 -0.02 0.00 -1.68 0.00 0.00 37.83 32.33 2bye s LYS 61 CO 0.14 -0.59 0.83 0.71 -0.76 0.00 0.00 175.35 175.69 2bye s TYR 62 N 1.59 3.42 0.31 3.18 2.02 -1.26 -5.06 117.35 121.55 2bye s TYR 62 Ca 0.03 0.72 -0.27 0.00 -0.37 0.00 0.00 57.07 57.18 2bye s TYR 62 Cb -0.18 -2.49 -0.09 0.00 -0.40 0.00 0.00 41.96 38.79 2bye s TYR 62 CO 0.07 -0.52 1.00 -0.59 -1.57 0.00 0.00 175.55 173.94 2bye s PHE 63 N -2.85 3.66 0.40 2.71 -0.71 -1.26 -5.07 117.98 114.87 2bye s PHE 63 Ca 0.50 1.77 0.08 0.00 -1.04 0.00 0.00 56.93 58.24 2bye s PHE 63 Cb -0.10 -3.06 -0.03 0.00 -1.21 0.00 0.00 43.02 38.62 2bye s PHE 63 CO 0.45 -0.06 0.32 0.96 -1.34 0.00 0.00 175.22 175.55 2bye s ILE 64 N -1.42 2.73 -0.87 -4.49 -4.36 -1.26 -5.03 121.20 106.50 2bye s ILE 64 Ca 0.48 -1.43 -0.25 0.00 -0.26 0.00 0.00 60.65 59.19 2bye s ILE 64 Cb -0.24 -3.02 -0.01 0.00 1.25 0.00 0.00 42.46 40.45 2bye s ILE 64 CO 0.30 -0.04 1.71 -0.55 0.24 0.00 0.00 174.94 176.61 2bye s SER 65 N -4.05 5.68 0.08 4.36 0.15 -1.26 -4.84 113.70 113.81 2bye s SER 65 Ca 0.45 -0.71 -0.02 0.00 0.70 0.00 0.00 55.95 56.37 2bye s SER 65 Cb -0.02 -2.56 0.01 0.00 -1.71 0.00 0.00 66.02 61.74 2bye s SER 65 CO 0.26 -2.21 0.13 2.29 1.20 0.00 0.00 173.24 174.91 2bye n LYS 66 N 8.98 0.19 -0.64 5.44 2.85 -1.26 -5.16 118.16 128.56 2bye n LYS 66 Ca 0.30 -0.50 -0.31 0.00 -1.05 0.00 0.00 58.31 56.76 2bye n LYS 66 Cb 0.49 0.55 0.19 0.00 -0.65 0.00 0.00 35.03 35.61 2bye n LYS 66 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2bye s GLU 67 N -2.08 0.62 -0.09 -1.58 8.01 -1.26 -4.94 118.70 117.38 2bye s GLU 67 Ca 0.04 1.46 -0.28 0.00 0.01 0.00 0.00 54.97 56.20 2bye s GLU 67 Cb -0.01 -1.69 -0.02 0.00 -4.31 0.00 0.00 34.13 28.11 2bye s GLU 67 CO 0.03 -2.88 0.95 0.21 0.01 0.00 0.00 175.26 173.58 2bye s LYS 68 N -4.60 4.44 0.40 1.61 2.47 -1.26 -5.04 119.74 117.76 2bye s LYS 68 Ca 0.67 1.29 0.06 0.00 -1.56 0.00 0.00 55.97 56.43 2bye s LYS 68 Cb -0.23 -3.52 -0.07 0.00 -1.46 0.00 0.00 37.83 32.55 2bye s LYS 68 CO 0.59 -0.22 0.02 -0.80 0.16 0.00 0.00 175.35 175.10 2bye s ASN 69 N 1.06 3.57 -1.00 1.43 0.01 -1.26 -5.03 114.94 113.72 2bye s ASN 69 Ca 0.47 -1.41 -0.08 0.00 -0.71 0.00 0.00 52.86 51.13 2bye s ASN 69 Cb -0.19 -0.21 -0.12 0.00 0.41 0.00 0.00 41.25 41.15 2bye s ASN 69 CO 0.19 -0.54 3.11 -0.62 -1.51 0.00 0.00 177.10 177.74 2bye n GLU 70 N -0.94 3.17 -3.28 -0.60 1.02 -1.26 -4.76 120.64 113.98 2bye n GLU 70 Ca -0.06 -1.95 -0.45 0.00 -0.02 0.00 0.00 57.16 54.68 2bye n GLU 70 Cb 0.67 -2.48 -0.01 0.00 -0.02 0.00 0.00 31.44 29.60 2bye n GLU 70 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bye n ARG 72 N 3.48 0.64 -4.99 0.00 3.00 -1.26 -4.92 116.66 112.61 2bye n ARG 72 Ca 0.23 0.17 -0.31 0.00 -0.00 0.00 0.00 57.85 57.94 2bye n ARG 72 Cb 0.42 -1.52 -0.17 0.00 0.00 0.00 0.00 32.46 31.19 2bye n ARG 72 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2bye s LYS 73 N -2.52 2.85 -0.45 -0.14 1.02 -1.26 -5.09 119.74 114.14 2bye s LYS 73 Ca -0.35 -0.80 -0.29 0.00 0.02 0.00 0.00 55.97 54.55 2bye s LYS 73 Cb 0.10 -2.21 0.02 0.00 -0.52 0.00 0.00 37.83 35.22 2bye s LYS 73 CO 0.59 0.11 1.23 -1.14 -0.92 0.00 0.00 175.35 175.21 2bye s GLN 74 N 0.52 3.69 0.28 1.68 0.74 -1.26 -4.89 119.66 120.40 2bye s GLN 74 Ca -0.15 0.71 0.15 0.00 0.05 0.00 0.00 55.36 56.11 2bye s GLN 74 Cb -0.17 -3.94 0.10 0.00 1.10 0.00 0.00 33.01 30.10 2bye s GLN 74 CO 0.05 -1.43 1.46 -1.00 -0.55 0.00 0.00 175.29 173.83 2bye h PRO 75 N 9.67 0.00 -4.31 1.67 0.13 -2.01 -3.41 132.00 133.74 2bye h PRO 75 Ca -0.24 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 64.16 2bye h PRO 75 Cb 1.08 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.94 2bye h PRO 75 CO 1.11 0.53 -0.38 0.12 -0.23 0.00 0.00 178.00 179.15 2bye s PHE 76 N -2.99 3.34 -0.13 1.56 5.36 -1.26 -5.02 117.98 118.84 2bye s PHE 76 Ca 0.03 -1.52 -0.01 0.00 -0.96 0.00 0.00 56.93 54.47 2bye s PHE 76 Cb 0.08 -3.32 0.04 0.00 -0.34 0.00 0.00 43.02 39.47 2bye s PHE 76 CO 0.75 -0.92 -0.03 -0.65 -1.46 0.00 0.00 175.22 172.91 2bye s GLN 77 N 1.46 1.08 -0.16 10.12 -0.21 -1.26 -4.73 119.66 125.97 2bye s GLN 77 Ca 0.04 -0.24 -0.00 0.00 0.02 0.00 0.00 55.36 55.18 2bye s GLN 77 Cb -0.26 -1.60 -0.00 0.00 1.00 0.00 0.00 33.01 32.15 2bye s GLN 77 CO 0.02 -0.38 -0.14 0.50 -2.12 0.00 0.00 175.29 173.16 2bye s ARG 78 N 1.79 3.25 0.05 2.91 3.52 -1.25 -5.06 118.95 124.16 2bye s ARG 78 Ca 0.03 -0.73 -0.23 0.00 -0.13 0.00 0.00 55.73 54.67 2bye s ARG 78 Cb -0.14 -2.65 -0.06 0.00 -1.56 0.00 0.00 34.95 30.54 2bye s ARG 78 CO -0.07 0.03 0.69 0.00 -0.81 0.00 0.00 175.30 175.14 2bye s ALA 79 N 0.79 3.44 -0.17 6.12 0.00 -1.26 -1.65 121.76 129.03 2bye s ALA 79 Ca -0.05 0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.80 2bye s ALA 79 Cb -0.15 -2.87 -0.00 0.00 0.00 0.00 0.00 23.12 20.09 2bye s ALA 79 CO 0.00 0.17 1.06 0.42 0.00 0.00 0.00 175.76 177.41 2bye s ILE 80 N -0.39 4.66 0.44 0.00 1.01 0.21 -4.92 121.20 122.21 2bye s ILE 80 Ca 0.35 1.97 0.07 0.00 0.00 0.00 0.00 60.65 63.04 2bye s ILE 80 Cb -0.20 -4.27 -0.01 0.00 0.01 0.00 0.00 42.46 37.99 2bye s ILE 80 CO 0.21 -0.10 0.38 -0.83 0.00 0.00 0.00 174.94 174.61 2bye s GLY 81 N 1.24 2.17 0.54 6.18 0.00 -1.26 -3.45 107.32 112.73 2bye s GLY 81 Ca 0.47 -1.84 0.22 0.00 0.00 0.00 0.00 44.72 43.58 2bye s GLY 81 CO 0.12 -1.74 2.08 -2.55 0.00 0.00 0.00 173.10 171.01 2bye h PRO 82 N 0.99 0.00 0.27 2.90 0.11 -1.97 -2.06 132.00 132.24 2bye h PRO 82 Ca -0.40 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 2bye h PRO 82 Cb 1.27 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2bye h PRO 82 CO 0.57 0.00 -0.16 0.93 -0.21 0.00 0.00 178.00 179.13 2bye h GLU 83 N 0.00 -0.40 -6.25 1.05 5.08 -2.00 -3.40 114.58 108.66 2bye h GLU 83 Ca 0.12 0.03 -0.58 0.00 -1.00 0.00 0.00 59.36 57.92 2bye h GLU 83 Cb 0.51 0.09 -0.10 0.00 0.50 0.00 0.00 28.75 29.75 2bye h GLU 83 CO -0.00 -0.27 0.74 -1.21 -1.00 0.00 0.00 179.01 177.27 2bye s GLU 84 N -6.12 3.48 0.08 2.33 2.02 -0.78 -4.98 118.70 114.73 2bye s GLU 84 Ca -0.15 0.09 -0.28 0.00 0.02 0.00 0.00 54.97 54.65 2bye s GLU 84 Cb 0.05 -4.00 -0.06 0.00 0.10 0.00 0.00 34.13 30.23 2bye s GLU 84 CO 0.64 -1.48 0.87 -1.21 0.02 0.00 0.00 175.26 174.11 2bye s GLU 85 N 4.28 4.60 0.54 1.61 2.02 -1.26 -4.25 118.70 126.24 2bye s GLU 85 Ca 0.38 1.27 0.26 0.00 0.02 0.00 0.00 54.97 56.90 2bye s GLU 85 Cb -0.10 -3.37 1.52 0.00 0.10 0.00 0.00 34.13 32.28 2bye s GLU 85 CO 0.24 0.25 2.14 -0.84 0.02 0.00 0.00 175.26 177.07 2bye h ILE 86 N 4.07 0.66 0.00 -1.63 -2.65 -1.88 0.16 117.51 116.25 2bye h ILE 86 Ca -0.43 -0.31 -0.06 0.00 1.03 0.00 0.00 64.86 65.09 2bye h ILE 86 Cb 1.21 1.19 -0.01 0.00 -2.05 0.00 0.00 36.82 37.16 2bye h ILE 86 CO 0.71 0.07 -0.27 0.24 0.03 0.00 0.00 178.15 178.93 2bye h MET 87 N 0.00 0.00 0.00 0.16 2.86 -1.92 0.19 114.93 116.21 2bye h MET 87 Ca -0.00 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.50 2bye h MET 87 Cb 0.18 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 2bye h MET 87 CO 0.01 0.27 -0.65 -0.56 1.06 0.00 0.00 176.91 177.05 2bye h GLN 88 N 0.00 0.00 -0.08 1.72 3.07 -1.07 -1.36 115.11 117.38 2bye h GLN 88 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.65 2bye h GLN 88 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.35 2bye h GLN 88 CO 0.04 0.65 -0.28 0.82 0.09 0.00 0.00 178.83 180.14 2bye h ILE 89 N 0.00 1.41 0.00 1.86 1.08 -1.02 -3.24 117.51 117.60 2bye h ILE 89 Ca -0.01 -1.65 -0.00 0.00 -0.39 0.00 0.00 64.86 62.81 2bye h ILE 89 Cb 1.40 2.26 -0.00 0.00 -3.07 0.00 0.00 36.82 37.40 2bye h ILE 89 CO 0.08 0.47 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.94 2bye h LEU 90 N -0.14 0.00 -1.87 1.44 3.38 -0.92 -3.28 115.31 113.91 2bye h LEU 90 Ca -0.01 0.00 0.31 0.00 0.09 0.00 0.00 57.88 58.27 2bye h LEU 90 Cb 0.91 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 2bye h LEU 90 CO 0.06 0.01 0.77 0.28 0.09 0.00 0.00 178.44 179.64 2bye h SER 91 N 0.00 0.09 -0.21 -0.43 0.02 -1.27 -1.26 113.55 110.49 2bye h SER 91 Ca -0.00 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 60.86 2bye h SER 91 Cb 0.64 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.11 2bye h SER 91 CO 0.00 0.02 0.14 -1.54 -1.14 0.00 0.00 176.83 174.31 2bye n SER 92 N -4.29 3.51 -1.28 3.07 3.41 -1.24 -4.42 113.62 112.38 2bye n SER 92 Ca 0.24 -2.38 -0.02 0.00 -0.26 0.00 0.00 58.87 56.45 2bye n SER 92 Cb 1.10 -0.64 0.01 0.00 -0.26 0.00 0.00 64.21 64.42 2bye n SER 92 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 2bye n TRP 93 N 0.27 0.20 0.22 7.33 2.14 -0.48 -4.42 117.44 122.71 2bye n TRP 93 Ca 0.12 -0.82 -0.15 0.00 2.07 0.00 0.00 57.50 58.73 2bye n TRP 93 Cb 0.71 -0.41 -0.08 0.00 -0.81 0.00 0.00 31.31 30.73 2bye n TRP 93 CO 0.00 0.00 0.00 0.74 2.07 0.00 0.00 177.69 180.50 2bye h PHE 94 N 0.49 -0.47 -0.23 -2.67 0.04 -1.88 -2.97 116.94 109.25 2bye h PHE 94 Ca 0.04 -0.01 -0.69 0.00 2.80 0.00 0.00 57.97 60.11 2bye h PHE 94 Cb 1.06 0.16 -0.01 0.00 2.20 0.00 0.00 35.95 39.36 2bye h PHE 94 CO 0.19 -0.26 3.48 -0.35 -0.60 0.00 0.00 178.31 180.77 2bye n PRO 95 N -5.29 3.73 -0.31 1.51 -0.04 -1.26 -4.81 135.00 128.53 2bye n PRO 95 Ca -0.11 -2.50 0.15 0.00 -0.04 0.00 0.00 63.50 61.00 2bye n PRO 95 Cb 0.23 -2.84 0.33 0.00 -0.04 0.00 0.00 33.50 31.18 2bye n PRO 95 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2bye h GLU 96 N 5.10 0.41 -4.15 0.54 4.11 -1.88 0.15 114.58 118.85 2bye h GLU 96 Ca 0.79 -0.02 -0.76 0.00 0.07 0.00 0.00 59.36 59.44 2bye h GLU 96 Cb 0.34 -0.09 -0.24 0.00 0.50 0.00 0.00 28.75 29.26 2bye h GLU 96 CO 1.75 0.27 0.26 -2.00 0.07 0.00 0.00 179.01 179.36 2bye s GLU 97 N -5.85 3.56 0.00 1.06 2.56 -1.26 -3.97 118.70 114.79 2bye s GLU 97 Ca -0.11 -2.23 0.00 0.00 0.00 0.00 0.00 54.97 52.63 2bye s GLU 97 Cb 0.26 -4.53 0.00 0.00 2.00 0.00 0.00 34.13 31.86 2bye s GLU 97 CO 0.78 -1.41 0.00 0.41 -0.56 0.00 0.00 175.26 174.48 2bye n GLY 98 N 4.42 1.69 3.77 -1.50 0.00 -1.14 -5.12 105.19 107.30 2bye n GLY 98 Ca 0.14 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 2bye n GLY 98 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2bye s TYR 99 N 0.00 3.33 -0.04 1.61 5.04 0.50 -5.05 117.35 122.74 2bye s TYR 99 Ca 0.00 1.63 0.04 0.00 -2.44 0.00 0.00 57.07 56.30 2bye s TYR 99 Cb 0.00 -3.28 -0.00 0.00 0.35 0.00 0.00 41.96 39.03 2bye s TYR 99 CO 0.00 -0.83 -0.15 0.00 -1.34 0.00 0.00 175.55 173.23 2bye s MET 100 N -2.01 1.60 -0.48 4.97 0.23 -1.26 -4.95 119.30 117.40 2bye s MET 100 Ca 0.52 -0.54 0.06 0.00 -1.03 0.00 0.00 55.69 54.70 2bye s MET 100 Cb -0.29 -1.40 0.22 0.00 -1.53 0.00 0.00 34.83 31.82 2bye s MET 100 CO 0.37 0.21 0.74 0.41 -2.03 0.00 0.00 175.02 174.72 2bye n GLY 101 N 3.18 0.31 3.77 3.16 0.00 -1.26 -5.04 105.19 109.32 2bye n GLY 101 Ca -0.18 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 2bye n GLY 101 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bye s ARG 102 N 0.49 3.85 -0.07 1.61 6.06 -1.26 -5.03 118.95 124.60 2bye s ARG 102 Ca 0.32 -0.21 -0.16 0.00 -2.50 0.00 0.00 55.73 53.18 2bye s ARG 102 Cb 0.12 -3.29 -0.05 0.00 0.06 0.00 0.00 34.95 31.79 2bye s ARG 102 CO -0.16 0.48 0.42 0.42 -2.50 0.00 0.00 175.30 173.96 2bye s ILE 103 N -0.18 5.14 -0.27 4.11 1.01 -1.26 -2.62 121.20 127.13 2bye s ILE 103 Ca 0.10 0.84 -0.01 0.00 0.00 0.00 0.00 60.65 61.58 2bye s ILE 103 Cb -0.12 -3.74 0.04 0.00 0.01 0.00 0.00 42.46 38.66 2bye s ILE 103 CO 0.01 0.45 -0.05 0.68 0.00 0.00 0.00 174.94 176.02 2bye s VAL 104 N -0.14 2.74 -0.28 2.92 -7.23 -0.16 -0.35 120.40 117.90 2bye s VAL 104 Ca 0.23 -1.30 -0.28 0.00 -1.81 0.00 0.00 61.98 58.82 2bye s VAL 104 Cb -0.15 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.25 2bye s VAL 104 CO 0.11 0.04 1.88 -0.22 -0.31 0.00 0.00 175.10 176.59 2bye s LEU 105 N 1.25 3.54 0.48 1.32 2.96 -1.26 -1.25 118.68 125.72 2bye s LEU 105 Ca -0.04 1.50 0.07 0.00 -0.22 0.00 0.00 54.13 55.44 2bye s LEU 105 Cb -0.19 -3.52 0.01 0.00 0.50 0.00 0.00 46.19 42.99 2bye s LEU 105 CO -0.03 -1.71 0.40 -0.54 -1.32 0.00 0.00 176.35 173.15 2bye s LYS 106 N 5.70 2.36 0.39 1.98 -0.14 0.12 -4.19 119.74 125.96 2bye s LYS 106 Ca 0.84 -1.79 0.08 0.00 -1.36 0.00 0.00 55.97 53.74 2bye s LYS 106 Cb -0.26 -2.24 -0.06 0.00 -1.68 0.00 0.00 37.83 33.60 2bye s LYS 106 CO 0.34 -0.42 0.09 0.95 -0.76 0.00 0.00 175.35 175.54 2bye s THR 107 N -2.63 2.34 -0.45 2.17 -4.23 -1.26 -1.33 115.64 110.24 2bye s THR 107 Ca 0.42 -1.85 -0.07 0.00 -1.18 0.00 0.00 61.69 59.01 2bye s THR 107 Cb -0.02 -2.94 -0.21 0.00 1.34 0.00 0.00 72.50 70.67 2bye s THR 107 CO 0.25 -0.06 3.34 1.67 -0.54 0.00 0.00 174.62 179.29 2bye n GLN 108 N -1.09 2.41 0.00 3.99 -0.06 0.42 -4.83 117.38 118.22 2bye n GLN 108 Ca -0.03 -1.30 0.00 0.00 -2.00 0.00 0.00 57.00 53.67 2bye n GLN 108 Cb 0.64 -2.21 0.00 0.00 -4.06 0.00 0.00 30.24 24.61 2bye n GLN 108 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2bye n GLN 109 N 2.84 0.00 0.00 3.69 10.64 -1.26 -5.06 117.38 128.22 2bye n GLN 109 Ca 0.52 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.69 2bye n GLN 109 Cb 0.70 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.08 2bye n GLN 109 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62