#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 0.15 -3.58 1.61 4.07 -1.26 -5.14 120.64 116.49 2bye n GLU 2 Ca 0.00 -0.85 -0.41 0.00 -0.06 0.00 0.00 57.16 55.84 2bye n GLU 2 Cb 0.00 -0.08 -0.11 0.00 -0.06 0.00 0.00 31.44 31.19 2bye n GLU 2 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2bye s GLU 3 N 0.75 2.80 0.18 5.31 8.01 -1.26 -4.89 118.70 129.60 2bye s GLU 3 Ca 0.25 -1.16 0.19 0.00 0.01 0.00 0.00 54.97 54.26 2bye s GLU 3 Cb 0.14 -3.78 -0.02 0.00 -4.31 0.00 0.00 34.13 26.17 2bye s GLU 3 CO -0.10 -0.77 1.06 0.00 0.01 0.00 0.00 175.26 175.46 2bye h ARG 4 N 8.46 0.00 -1.64 1.61 2.47 -2.09 -3.43 114.38 119.77 2bye h ARG 4 Ca -0.25 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.25 2bye h ARG 4 Cb 1.10 0.00 -0.27 0.00 -1.65 0.00 0.00 29.97 29.15 2bye h ARG 4 CO 0.70 0.19 -0.56 0.21 0.56 0.00 0.00 179.97 181.06 2bye s LYS 5 N -3.12 0.55 0.38 0.04 2.47 -1.26 -5.15 119.74 113.65 2bye s LYS 5 Ca -0.00 -0.21 0.06 0.00 -1.56 0.00 0.00 55.97 54.26 2bye s LYS 5 Cb 0.08 -0.34 0.06 0.00 -1.46 0.00 0.00 37.83 36.17 2bye s LYS 5 CO 0.78 -1.11 0.53 0.00 0.16 0.00 0.00 175.35 175.71 2bye n LEU 7 N 0.00 5.80 -4.57 0.00 7.99 -1.26 -4.47 117.00 120.49 2bye n LEU 7 Ca 0.11 -4.34 -0.40 0.00 -0.01 0.00 0.00 56.01 51.37 2bye n LEU 7 Cb 0.40 -1.62 -0.03 0.00 -0.11 0.00 0.00 43.42 42.06 2bye n LEU 7 CO 0.26 0.84 1.62 -1.10 -1.51 0.00 0.00 177.39 177.49 2bye s GLN 8 N 2.08 2.82 -0.72 3.23 -0.21 -1.26 -4.47 119.66 121.13 2bye s GLN 8 Ca 0.45 0.96 -0.12 0.00 0.02 0.00 0.00 55.36 56.67 2bye s GLN 8 Cb 0.05 -4.34 0.19 0.00 1.00 0.00 0.00 33.01 29.90 2bye s GLN 8 CO 0.01 -2.48 0.64 0.95 -2.12 0.00 0.00 175.29 172.28 2bye s THR 9 N 8.61 5.11 -0.07 -0.19 -4.23 -1.26 -1.49 115.64 122.12 2bye s THR 9 Ca 0.74 -2.36 0.01 0.00 -1.18 0.00 0.00 61.69 58.90 2bye s THR 9 Cb -0.16 -4.21 -0.03 0.00 1.34 0.00 0.00 72.50 69.44 2bye s THR 9 CO 0.26 -0.96 -0.07 -1.00 -0.54 0.00 0.00 174.62 172.30 2bye s HIS 10 N 0.43 2.92 0.12 3.99 3.76 -1.22 -4.76 115.29 120.53 2bye s HIS 10 Ca 0.15 0.01 -0.17 0.00 -0.15 0.00 0.00 55.06 54.90 2bye s HIS 10 Cb -0.16 -1.70 -0.07 0.00 1.11 0.00 0.00 32.58 31.76 2bye s HIS 10 CO -0.06 0.33 0.57 0.50 -0.85 0.00 0.00 174.74 175.23 2bye s ARG 11 N -0.82 4.10 -0.13 1.40 3.52 -1.26 -0.23 118.95 125.53 2bye s ARG 11 Ca 0.12 0.64 0.00 0.00 -0.13 0.00 0.00 55.73 56.36 2bye s ARG 11 Cb -0.11 -3.07 0.02 0.00 -1.56 0.00 0.00 34.95 30.23 2bye s ARG 11 CO 0.01 0.55 -0.11 0.54 -0.81 0.00 0.00 175.30 175.48 2bye s VAL 12 N -1.30 1.31 -0.22 7.11 0.11 -0.39 -4.92 120.40 122.10 2bye s VAL 12 Ca 0.34 -0.47 -0.29 0.00 -2.93 0.00 0.00 61.98 58.62 2bye s VAL 12 Cb -0.17 -1.26 -0.01 0.00 -1.53 0.00 0.00 36.38 33.41 2bye s VAL 12 CO 0.19 0.41 1.32 -0.89 -3.33 0.00 0.00 175.10 172.81 2bye s THR 13 N 1.52 4.15 -0.19 5.04 2.01 -1.26 -2.43 115.64 124.47 2bye s THR 13 Ca 0.03 1.34 -0.11 0.00 0.31 0.00 0.00 61.69 63.27 2bye s THR 13 Cb -0.13 -4.02 -0.05 0.00 0.01 0.00 0.00 72.50 68.31 2bye s THR 13 CO -0.08 -0.29 0.16 -0.69 -0.69 0.00 0.00 174.62 173.03 2bye s VAL 14 N 4.05 5.39 -2.06 3.82 1.01 0.64 -4.23 120.40 129.02 2bye s VAL 14 Ca 0.57 0.26 0.21 0.00 0.00 0.00 0.00 61.98 63.02 2bye s VAL 14 Cb -0.20 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.71 2bye s VAL 14 CO 0.20 0.44 1.05 1.41 0.00 0.00 0.00 175.10 178.20 2bye n HIS 15 N 3.49 0.00 -2.01 5.22 8.25 0.12 -1.14 115.22 129.14 2bye n HIS 15 Ca -0.15 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.26 2bye n HIS 15 Cb 0.52 0.00 0.10 0.00 1.12 0.00 0.00 29.99 31.73 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 1.31 4.52 3.70 -1.41 0.00 -1.24 -4.69 105.19 107.38 2bye n GLY 16 Ca 0.09 -1.64 -0.32 0.00 0.00 0.00 0.00 46.02 44.15 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 -3.24 2.28 -0.23 1.61 -7.23 -1.26 -4.17 120.40 108.16 2bye s VAL 17 Ca 0.40 0.11 0.24 0.00 -1.81 0.00 0.00 61.98 60.92 2bye s VAL 17 Cb 0.38 -2.37 0.29 0.00 0.56 0.00 0.00 36.38 35.24 2bye s VAL 17 CO -0.05 -0.10 1.67 1.55 -0.31 0.00 0.00 175.10 177.86 2bye h PRO 18 N -1.26 0.00 -7.21 4.82 0.13 -1.91 -3.46 132.00 123.11 2bye h PRO 18 Ca -0.45 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.21 2bye h PRO 18 Cb 1.27 0.00 0.20 0.00 0.13 0.00 0.00 31.00 32.60 2bye h PRO 18 CO 0.45 0.11 0.11 0.20 -0.23 0.00 0.00 178.00 178.64 2bye s GLY 19 N -4.26 1.60 0.37 1.56 0.00 -1.26 -4.93 107.32 100.40 2bye s GLY 19 Ca 0.05 0.11 0.17 0.00 0.00 0.00 0.00 44.72 45.04 2bye s GLY 19 CO 0.66 0.70 1.76 -0.56 0.00 0.00 0.00 173.10 175.66 2bye h PRO 20 N -2.25 0.00 -6.96 2.90 0.13 -2.03 -3.45 132.00 120.34 2bye h PRO 20 Ca -0.54 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.04 2bye h PRO 20 Cb 1.31 0.00 0.18 0.00 0.13 0.00 0.00 31.00 32.62 2bye h PRO 20 CO 0.48 0.40 0.06 0.39 -0.23 0.00 0.00 178.00 179.10 2bye n GLU 21 N -3.70 0.40 0.11 0.86 1.02 -1.26 -4.93 120.64 113.14 2bye n GLU 21 Ca -0.01 0.19 -0.20 0.00 -0.02 0.00 0.00 57.16 57.12 2bye n GLU 21 Cb 0.48 -2.20 -0.13 0.00 -0.02 0.00 0.00 31.44 29.56 2bye n GLU 21 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2bye h PRO 22 N -0.43 0.45 -2.41 3.49 0.11 -1.93 -3.44 132.00 127.82 2bye h PRO 22 Ca -0.47 -0.69 -0.07 0.00 0.11 0.00 0.00 66.00 64.88 2bye h PRO 22 Cb 1.33 0.25 -0.25 0.00 0.11 0.00 0.00 31.00 32.44 2bye h PRO 22 CO 0.46 1.32 -0.18 -0.59 -0.21 0.00 0.00 178.00 178.79 2bye s PHE 23 N -2.76 -0.77 0.02 0.65 -0.71 -1.26 -4.37 117.98 108.78 2bye s PHE 23 Ca -0.07 1.59 -0.02 0.00 -1.04 0.00 0.00 56.93 57.39 2bye s PHE 23 Cb 0.06 0.40 -0.02 0.00 -1.21 0.00 0.00 43.02 42.25 2bye s PHE 23 CO 0.91 -0.41 0.02 -0.08 -1.34 0.00 0.00 175.22 174.32 2bye s THR 24 N 1.48 0.12 -0.15 -4.49 -1.32 -0.29 -4.92 115.64 106.07 2bye s THR 24 Ca -0.10 -0.97 -0.02 0.00 -1.21 0.00 0.00 61.69 59.40 2bye s THR 24 Cb -0.07 -0.48 -0.02 0.00 -1.51 0.00 0.00 72.50 70.41 2bye s THR 24 CO -0.15 -0.53 -0.08 -0.69 -2.21 0.00 0.00 174.62 170.96 2bye s VAL 25 N -1.80 3.51 0.07 5.08 1.01 -1.26 -0.26 120.40 126.75 2bye s VAL 25 Ca -0.12 -0.50 0.08 0.00 0.00 0.00 0.00 61.98 61.44 2bye s VAL 25 Cb -0.07 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 2bye s VAL 25 CO -0.02 0.51 -0.18 -0.36 0.00 0.00 0.00 175.10 175.05 2bye s PHE 26 N 0.38 2.54 0.06 5.22 0.40 -1.02 -4.84 117.98 120.72 2bye s PHE 26 Ca -0.07 -0.26 -0.17 0.00 -0.60 0.00 0.00 56.93 55.82 2bye s PHE 26 Cb -0.15 -1.41 -0.06 0.00 0.51 0.00 0.00 43.02 41.90 2bye s PHE 26 CO 0.04 0.31 0.52 0.99 0.70 0.00 0.00 175.22 177.77 2bye s THR 27 N -1.01 4.84 0.21 0.64 2.01 -1.26 -1.26 115.64 119.81 2bye s THR 27 Ca 0.16 1.06 0.02 0.00 0.31 0.00 0.00 61.69 63.24 2bye s THR 27 Cb -0.11 -3.82 0.02 0.00 0.01 0.00 0.00 72.50 68.60 2bye s THR 27 CO 0.07 0.53 0.18 2.30 -0.69 0.00 0.00 174.62 177.02 2bye n ILE 28 N 1.66 0.00 -3.60 1.82 -5.35 0.67 -4.93 119.36 109.64 2bye n ILE 28 Ca -0.11 -0.83 -0.15 0.00 -0.27 0.00 0.00 62.75 61.39 2bye n ILE 28 Cb 0.51 -0.40 -0.07 0.00 -1.74 0.00 0.00 39.64 37.95 2bye n ILE 28 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2bye s ASN 29 N -2.27 -0.66 1.86 7.28 2.20 -1.23 -3.45 114.94 118.67 2bye s ASN 29 Ca 0.14 1.04 0.00 0.00 -0.94 0.00 0.00 52.86 53.10 2bye s ASN 29 Cb -0.01 0.99 0.00 0.00 -2.00 0.00 0.00 41.25 40.23 2bye s ASN 29 CO 0.09 -0.39 0.00 0.61 -2.94 0.00 0.00 177.10 174.46 2bye n GLY 30 N 1.92 1.66 2.26 0.45 0.00 -0.56 -3.29 105.19 107.64 2bye n GLY 30 Ca -0.16 0.29 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 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 3.35 3.71 -0.02 0.00 -1.26 -4.20 105.19 106.77 2bye n GLY 31 Ca 0.00 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.48 3.79 0.86 2.61 -4.23 -1.21 -5.05 115.64 110.94 2bye s THR 32 Ca 0.36 1.29 -0.09 0.00 -1.18 0.00 0.00 61.69 62.07 2bye s THR 32 Cb 0.16 -3.83 0.19 0.00 1.34 0.00 0.00 72.50 70.36 2bye s THR 32 CO -0.09 0.10 1.17 2.29 -0.54 0.00 0.00 174.62 177.55 2bye n LYS 33 N 3.93 -0.77 0.27 3.99 2.85 -1.26 -4.35 118.16 122.82 2bye n LYS 33 Ca 0.10 -2.31 0.13 0.00 -1.05 0.00 0.00 58.31 55.18 2bye n LYS 33 Cb 0.45 -1.05 0.78 0.00 -0.65 0.00 0.00 35.03 34.57 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 -1.28 1.43 0.00 0.58 0.00 -1.72 -0.63 119.26 117.65 2bye h ALA 34 Ca -0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 2bye h ALA 34 Cb 1.18 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2bye h ALA 34 CO 0.32 0.09 -0.10 -0.22 0.00 0.00 0.00 179.25 179.35 2bye h LYS 35 N 0.00 0.00 -0.07 0.00 1.63 -1.85 0.21 116.57 116.50 2bye h LYS 35 Ca -0.00 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.82 2bye h LYS 35 Cb 0.19 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.82 2bye h LYS 35 CO 0.01 0.75 0.11 1.96 -3.45 0.00 0.00 179.45 178.82 2bye h GLN 36 N -1.00 0.00 0.17 1.90 4.20 -1.93 -2.08 115.11 116.38 2bye h GLN 36 Ca -0.02 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.36 2bye h GLN 36 Cb 0.78 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.57 2bye h GLN 36 CO -0.01 0.00 -1.61 1.25 -0.67 0.00 0.00 178.83 177.79 2bye h LEU 37 N 0.00 0.56 -1.31 1.46 7.12 -0.97 -2.54 115.31 119.63 2bye h LEU 37 Ca 0.03 -0.76 0.18 0.00 0.13 0.00 0.00 57.88 57.46 2bye h LEU 37 Cb 0.25 -0.18 -0.08 0.00 -0.53 0.00 0.00 40.66 40.11 2bye h LEU 37 CO -0.00 1.63 0.60 0.25 -0.13 0.00 0.00 178.44 180.79 2bye h LEU 38 N 0.10 0.59 0.18 2.25 7.12 0.10 0.20 115.31 125.84 2bye h LEU 38 Ca -0.28 0.06 0.01 0.00 0.13 0.00 0.00 57.88 57.79 2bye h LEU 38 Cb 2.08 -0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 42.12 2bye h LEU 38 CO 0.19 0.25 -0.27 -0.61 -0.13 0.00 0.00 178.44 177.87 2bye h GLN 39 N 0.59 -0.50 -0.37 1.25 4.15 -1.44 0.28 115.11 119.07 2bye h GLN 39 Ca 0.49 0.03 0.11 0.00 0.77 0.00 0.00 58.65 60.06 2bye h GLN 39 Cb 0.96 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.75 2bye h GLN 39 CO -0.24 -0.33 0.33 1.96 -1.93 0.00 0.00 178.83 178.62 2bye h GLN 40 N -0.52 0.00 0.15 1.69 1.08 -0.24 0.40 115.11 117.66 2bye h GLN 40 Ca 0.01 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 56.93 2bye h GLN 40 Cb 0.52 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.96 2bye h GLN 40 CO -0.12 0.00 -1.38 0.82 -0.95 0.00 0.00 178.83 177.20 2bye h ILE 41 N 0.00 1.12 -0.84 2.54 5.03 -0.44 -3.30 117.51 121.63 2bye h ILE 41 Ca 0.18 -2.48 0.10 0.00 -0.12 0.00 0.00 64.86 62.54 2bye h ILE 41 Cb 0.83 2.85 -0.07 0.00 -3.03 0.00 0.00 36.82 37.40 2bye h ILE 41 CO -0.00 0.75 0.48 -0.07 -0.68 0.00 0.00 178.15 178.63 2bye h LEU 42 N -0.19 0.69 -8.06 1.44 3.38 0.89 -3.43 115.31 110.03 2bye h LEU 42 Ca -0.28 0.05 -0.41 0.00 0.09 0.00 0.00 57.88 57.33 2bye h LEU 42 Cb 1.85 -0.09 -0.09 0.00 0.09 0.00 0.00 40.66 42.42 2bye h LEU 42 CO 0.12 0.39 1.76 0.41 0.09 0.00 0.00 178.44 181.22 2bye n THR 43 N -4.73 -0.01 0.50 0.22 -1.04 0.13 -4.71 114.28 104.64 2bye n THR 43 Ca 0.14 -0.29 0.13 0.00 -2.04 0.00 0.00 64.05 61.99 2bye n THR 43 Cb 0.28 -0.54 0.31 0.00 -1.82 0.00 0.00 70.33 68.56 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 12.16 0.00 -0.31 8.00 2.35 -1.84 -3.48 115.58 132.46 2bye h ASN 44 Ca -0.02 -0.02 -0.13 0.00 -0.55 0.00 0.00 56.30 55.57 2bye h ASN 44 Cb 1.22 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.53 2bye h ASN 44 CO 1.45 0.01 -0.12 -0.62 -1.65 0.00 0.00 177.43 176.50 2bye n GLU 45 N -2.47 -0.95 0.00 0.81 -0.58 -1.26 -4.86 120.64 111.34 2bye n GLU 45 Ca 0.05 0.63 0.00 0.00 -0.42 0.00 0.00 57.16 57.42 2bye n GLU 45 Cb 0.46 -4.56 0.00 0.00 -0.57 0.00 0.00 31.44 26.77 2bye n GLU 45 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2bye n GLN 46 N -1.83 0.00 -0.54 3.49 1.13 -1.26 -4.21 117.38 114.16 2bye n GLN 46 Ca -0.07 0.00 0.05 0.00 -1.94 0.00 0.00 57.00 55.04 2bye n GLN 46 Cb 0.34 -0.19 0.26 0.00 0.11 0.00 0.00 30.24 30.76 2bye n GLN 46 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2bye n ASP 47 N 0.00 3.87 0.00 1.08 2.03 -1.26 -4.96 116.55 117.31 2bye n ASP 47 Ca 0.00 -2.53 0.00 0.00 0.52 0.00 0.00 54.79 52.78 2bye n ASP 47 Cb 0.00 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 39.82 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 0.46 0.00 -0.87 5.18 5.41 -1.26 -4.88 119.36 123.41 2bye n ILE 48 Ca 0.18 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.80 2bye n ILE 48 Cb 0.81 0.00 -0.13 0.00 -0.71 0.00 0.00 39.64 39.61 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 0.00 0.38 5.02 -1.26 -3.72 118.16 118.58 2bye n LYS 49 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2bye n LYS 49 Cb 0.00 -0.59 0.00 0.00 -0.02 0.00 0.00 35.03 34.42 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 3.20 0.49 -3.99 1.97 -0.02 -1.26 -5.02 135.00 130.38 2bye n PRO 50 Ca 0.38 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.55 2bye n PRO 50 Cb 0.10 0.00 -0.15 0.00 -0.02 0.00 0.00 33.50 33.43 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 -0.21 2.30 -0.62 -1.45 1.01 -1.26 -5.07 120.40 115.10 2bye s VAL 51 Ca 0.00 -2.57 -0.23 0.00 0.00 0.00 0.00 61.98 59.18 2bye s VAL 51 Cb 0.00 -2.68 0.06 0.00 0.00 0.00 0.00 36.38 33.76 2bye s VAL 51 CO 0.00 -0.66 0.94 0.42 0.00 0.00 0.00 175.10 175.81 2bye s THR 52 N 0.62 4.36 0.00 3.92 -4.23 -1.26 -4.97 115.64 114.08 2bye s THR 52 Ca 0.13 -0.18 0.00 0.00 -1.18 0.00 0.00 61.69 60.46 2bye s THR 52 Cb -0.21 -4.63 0.00 0.00 1.34 0.00 0.00 72.50 69.01 2bye s THR 52 CO -0.06 -1.33 0.00 1.07 -0.54 0.00 0.00 174.62 173.75 2bye n THR 53 N 5.99 0.00 0.55 3.99 5.66 -1.26 -4.93 114.28 124.27 2bye n THR 53 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 2bye n THR 53 Cb 0.46 -0.08 0.00 0.00 -1.55 0.00 0.00 70.33 69.16 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 0.07 -4.76 1.09 9.92 -1.26 -4.83 116.55 116.78 2bye n ASP 54 Ca 0.00 -0.62 -0.37 0.00 -0.53 0.00 0.00 54.79 53.27 2bye n ASP 54 Cb 0.00 -0.03 0.02 0.00 -0.64 0.00 0.00 41.12 40.46 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 -1.77 2.58 0.28 1.24 2.02 -1.26 -0.38 117.35 120.05 2bye s TYR 55 Ca 0.00 1.46 -0.07 0.00 -0.37 0.00 0.00 57.07 58.10 2bye s TYR 55 Cb 0.00 -3.57 0.03 0.00 -0.40 0.00 0.00 41.96 38.02 2bye s TYR 55 CO 0.00 -2.17 0.49 1.97 -1.57 0.00 0.00 175.55 174.28 2bye n PHE 56 N -0.83 -1.66 -4.11 2.71 1.16 -0.51 -4.89 117.46 109.32 2bye n PHE 56 Ca 0.09 -1.57 -0.24 0.00 -1.87 0.00 0.00 57.45 53.86 2bye n PHE 56 Cb 0.47 0.57 -0.07 0.00 -1.61 0.00 0.00 39.48 38.84 2bye n PHE 56 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2bye s LEU 57 N 0.00 3.15 0.07 5.98 1.02 -1.23 0.21 118.68 127.88 2bye s LEU 57 Ca 0.16 -0.98 -0.20 0.00 0.02 0.00 0.00 54.13 53.13 2bye s LEU 57 Cb -0.02 -1.53 0.05 0.00 0.02 0.00 0.00 46.19 44.70 2bye s LEU 57 CO 0.12 -0.46 0.48 -0.04 0.02 0.00 0.00 176.35 176.48 2bye s MET 58 N -3.88 1.04 -0.28 1.70 -1.94 -0.35 0.58 119.30 116.17 2bye s MET 58 Ca 0.40 -0.37 -0.15 0.00 -1.71 0.00 0.00 55.69 53.86 2bye s MET 58 Cb 0.02 0.47 -0.03 0.00 2.01 0.00 0.00 34.83 37.29 2bye s MET 58 CO 0.23 -0.39 0.37 -1.83 -0.01 0.00 0.00 175.02 173.38 2bye s GLU 59 N -2.82 3.95 -0.52 2.03 -1.05 0.63 -0.68 118.70 120.24 2bye s GLU 59 Ca -0.03 -0.04 -0.18 0.00 -0.15 0.00 0.00 54.97 54.57 2bye s GLU 59 Cb -0.00 -3.68 0.08 0.00 -0.44 0.00 0.00 34.13 30.09 2bye s GLU 59 CO -0.05 -0.31 0.58 -1.21 0.95 0.00 0.00 175.26 175.22 2bye s GLU 60 N 2.06 3.06 -0.13 -4.83 2.02 -0.79 -3.77 118.70 116.32 2bye s GLU 60 Ca 0.14 -1.14 -0.07 0.00 0.02 0.00 0.00 54.97 53.92 2bye s GLU 60 Cb -0.16 -4.15 0.05 0.00 0.10 0.00 0.00 34.13 29.97 2bye s GLU 60 CO 0.10 -1.25 0.31 0.21 0.02 0.00 0.00 175.26 174.66 2bye s LYS 61 N 2.34 0.28 0.49 1.61 2.47 -1.26 -3.46 119.74 122.20 2bye s LYS 61 Ca 0.11 0.65 0.08 0.00 -1.56 0.00 0.00 55.97 55.25 2bye s LYS 61 Cb -0.22 -0.07 0.04 0.00 -1.46 0.00 0.00 37.83 36.11 2bye s LYS 61 CO 0.09 -0.17 0.62 0.71 0.16 0.00 0.00 175.35 176.76 2bye s TYR 62 N 1.38 2.15 -1.45 4.03 2.02 -1.26 -4.81 117.35 119.41 2bye s TYR 62 Ca -0.09 -0.58 0.28 0.00 -0.37 0.00 0.00 57.07 56.31 2bye s TYR 62 Cb -0.10 -2.25 0.98 0.00 -0.40 0.00 0.00 41.96 40.19 2bye s TYR 62 CO -0.10 -0.68 1.71 1.19 -1.57 0.00 0.00 175.55 176.11 2bye n PHE 63 N -1.96 0.00 -1.85 2.71 3.72 -1.26 -4.89 117.46 113.93 2bye n PHE 63 Ca 0.10 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.36 2bye n PHE 63 Cb 0.61 -0.23 -0.03 0.00 -0.94 0.00 0.00 39.48 38.89 2bye n PHE 63 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 2bye n ILE 64 N -1.08 -0.34 -0.19 4.37 5.41 -1.26 -4.89 119.36 121.38 2bye n ILE 64 Ca 0.11 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.83 2bye n ILE 64 Cb 0.31 -1.83 0.17 0.00 -0.71 0.00 0.00 39.64 37.58 2bye n ILE 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2bye h SER 65 N 0.00 0.87 -1.57 4.38 0.02 -2.00 -3.47 113.55 111.79 2bye h SER 65 Ca -0.31 -0.13 0.04 0.00 -0.84 0.00 0.00 61.79 60.55 2bye h SER 65 Cb 1.08 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 2bye h SER 65 CO 0.40 0.79 0.20 2.29 -1.14 0.00 0.00 176.83 179.37 2bye n LYS 66 N -4.30 0.35 -2.16 3.45 2.85 -1.26 -5.18 118.16 111.91 2bye n LYS 66 Ca 0.05 -0.74 -0.28 0.00 -1.05 0.00 0.00 58.31 56.29 2bye n LYS 66 Cb 0.18 0.97 0.16 0.00 -0.65 0.00 0.00 35.03 35.69 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 -2.03 0.94 1.54 -1.58 2.02 -1.26 -4.89 118.70 113.45 2bye s GLU 67 Ca 0.08 -0.67 0.00 0.00 0.02 0.00 0.00 54.97 54.40 2bye s GLU 67 Cb -0.02 -2.01 0.00 0.00 0.10 0.00 0.00 34.13 32.21 2bye s GLU 67 CO 0.03 -2.12 0.00 1.63 0.02 0.00 0.00 175.26 174.82 2bye n LYS 68 N -3.47 -0.50 -2.87 1.61 4.01 -1.26 -4.66 118.16 111.02 2bye n LYS 68 Ca 0.15 0.33 -0.41 0.00 -0.51 0.00 0.00 58.31 57.87 2bye n LYS 68 Cb 0.60 -0.60 -0.04 0.00 -0.51 0.00 0.00 35.03 34.48 2bye n LYS 68 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 2bye s ASN 69 N -4.48 7.14 1.17 4.39 3.84 -1.26 -5.04 114.94 120.70 2bye s ASN 69 Ca 0.00 1.39 -0.19 0.00 0.21 0.00 0.00 52.86 54.27 2bye s ASN 69 Cb 0.00 -2.49 0.27 0.00 -0.55 0.00 0.00 41.25 38.49 2bye s ASN 69 CO 0.00 -0.24 1.14 -1.61 -2.79 0.00 0.00 177.10 173.59 2bye s GLU 70 N 1.19 -0.98 -0.00 0.43 2.02 -1.26 -4.88 118.70 115.22 2bye s GLU 70 Ca 0.44 -0.10 -0.30 0.00 0.02 0.00 0.00 54.97 55.03 2bye s GLU 70 Cb -0.19 -1.63 -0.08 0.00 0.10 0.00 0.00 34.13 32.33 2bye s GLU 70 CO 0.21 -3.55 2.00 0.00 0.02 0.00 0.00 175.26 173.95 2bye n ARG 72 N 7.73 0.13 0.26 0.00 0.63 -1.26 -3.15 116.66 120.99 2bye n ARG 72 Ca 0.21 0.09 0.11 0.00 -0.92 0.00 0.00 57.85 57.34 2bye n ARG 72 Cb 0.42 -1.64 0.72 0.00 0.45 0.00 0.00 32.46 32.40 2bye n ARG 72 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 2bye h LYS 73 N 0.00 0.00 -3.40 -0.14 1.57 -2.02 -3.25 116.57 109.33 2bye h LYS 73 Ca 0.00 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.10 2bye h LYS 73 Cb 0.62 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 32.56 2bye h LYS 73 CO 0.00 0.07 -0.36 -1.14 -0.57 0.00 0.00 179.45 177.46 2bye s GLN 74 N -4.62 2.67 0.00 3.15 2.00 -1.19 -4.97 119.66 116.70 2bye s GLN 74 Ca -0.04 -2.87 -0.03 0.00 -2.00 0.00 0.00 55.36 50.42 2bye s GLN 74 Cb 0.15 -3.69 -0.12 0.00 0.80 0.00 0.00 33.01 30.15 2bye s GLN 74 CO 0.62 -1.21 2.48 -2.30 -0.50 0.00 0.00 175.29 174.38 2bye n PRO 75 N 2.89 1.31 -2.38 1.67 -0.02 -1.23 -4.81 135.00 132.42 2bye n PRO 75 Ca 0.13 -0.44 -0.36 0.00 -2.02 0.00 0.00 63.50 60.81 2bye n PRO 75 Cb 0.36 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.31 2bye n PRO 75 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2bye s PHE 76 N 0.77 2.34 0.08 6.00 5.36 -1.26 -4.87 117.98 126.40 2bye s PHE 76 Ca 0.29 -0.50 0.01 0.00 -0.96 0.00 0.00 56.93 55.78 2bye s PHE 76 Cb 0.14 -4.47 -0.04 0.00 -0.34 0.00 0.00 43.02 38.31 2bye s PHE 76 CO 0.00 -1.78 -0.05 1.14 -1.46 0.00 0.00 175.22 173.07 2bye s GLN 77 N 5.49 0.77 -0.30 10.12 -2.07 -1.26 -4.93 119.66 127.47 2bye s GLN 77 Ca 0.56 -1.30 -0.10 0.00 -1.82 0.00 0.00 55.36 52.70 2bye s GLN 77 Cb -0.01 -0.08 -0.01 0.00 -1.09 0.00 0.00 33.01 31.82 2bye s GLN 77 CO -0.01 -0.05 0.15 0.50 -1.32 0.00 0.00 175.29 174.56 2bye s ARG 78 N -3.86 3.41 -0.03 9.60 6.06 -1.25 -4.98 118.95 127.90 2bye s ARG 78 Ca 0.10 -0.67 -0.29 0.00 -2.50 0.00 0.00 55.73 52.37 2bye s ARG 78 Cb 0.06 -3.55 -0.03 0.00 0.06 0.00 0.00 34.95 31.49 2bye s ARG 78 CO -0.06 -0.38 0.96 0.00 -2.50 0.00 0.00 175.30 173.31 2bye s ALA 79 N 1.62 3.22 -0.14 6.12 0.00 -1.26 -0.27 121.76 131.06 2bye s ALA 79 Ca 0.05 0.47 -0.28 0.00 0.00 0.00 0.00 51.96 52.20 2bye s ALA 79 Cb -0.17 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.62 2bye s ALA 79 CO 0.06 -0.29 0.96 0.42 0.00 0.00 0.00 175.76 176.92 2bye s ILE 80 N 1.17 4.80 0.50 0.00 1.01 0.20 -4.90 121.20 123.98 2bye s ILE 80 Ca 0.50 1.93 0.08 0.00 0.00 0.00 0.00 60.65 63.15 2bye s ILE 80 Cb -0.20 -4.26 0.04 0.00 0.01 0.00 0.00 42.46 38.04 2bye s ILE 80 CO 0.25 -0.01 0.57 -0.83 0.00 0.00 0.00 174.94 174.92 2bye s GLY 81 N 1.12 2.01 0.30 6.18 0.00 -1.26 -3.47 107.32 112.20 2bye s GLY 81 Ca 0.45 -1.80 0.00 0.00 0.00 0.00 0.00 44.72 43.37 2bye s GLY 81 CO 0.15 -1.71 1.84 -2.55 0.00 0.00 0.00 173.10 170.83 2bye h PRO 82 N 0.60 0.73 -0.97 2.90 0.11 -1.97 -2.51 132.00 130.89 2bye h PRO 82 Ca -0.36 -0.15 0.08 0.00 0.11 0.00 0.00 66.00 65.68 2bye h PRO 82 Cb 1.28 -0.11 -0.07 0.00 0.11 0.00 0.00 31.00 32.21 2bye h PRO 82 CO 0.49 0.69 0.62 0.93 -0.21 0.00 0.00 178.00 180.52 2bye h GLU 83 N 0.71 1.05 -6.07 1.05 3.07 -2.00 -3.37 114.58 109.01 2bye h GLU 83 Ca 0.15 -0.06 -0.57 0.00 -0.50 0.00 0.00 59.36 58.38 2bye h GLU 83 Cb 0.31 -0.24 -0.10 0.00 -0.84 0.00 0.00 28.75 27.88 2bye h GLU 83 CO 0.00 0.69 0.86 -1.21 -1.40 0.00 0.00 179.01 177.95 2bye s GLU 84 N -6.02 3.21 -0.11 2.33 2.02 -0.95 -4.99 118.70 114.19 2bye s GLU 84 Ca -0.12 -0.37 -0.29 0.00 0.02 0.00 0.00 54.97 54.21 2bye s GLU 84 Cb 0.20 -4.17 -0.01 0.00 0.10 0.00 0.00 34.13 30.25 2bye s GLU 84 CO 0.81 -1.95 0.96 -1.21 0.02 0.00 0.00 175.26 173.89 2bye s GLU 85 N 5.02 4.41 0.41 1.61 2.02 -1.26 -3.87 118.70 127.04 2bye s GLU 85 Ca 0.32 1.31 0.15 0.00 0.02 0.00 0.00 54.97 56.77 2bye s GLU 85 Cb -0.11 -3.54 0.89 0.00 0.10 0.00 0.00 34.13 31.47 2bye s GLU 85 CO 0.15 -0.29 1.90 -0.84 0.02 0.00 0.00 175.26 176.20 2bye h ILE 86 N 5.09 1.13 0.00 -1.63 3.07 -1.86 -0.66 117.51 122.64 2bye h ILE 86 Ca -0.31 -1.00 -0.02 0.00 1.55 0.00 0.00 64.86 65.08 2bye h ILE 86 Cb 1.15 1.55 -0.00 0.00 -0.27 0.00 0.00 36.82 39.25 2bye h ILE 86 CO 0.84 0.28 -0.08 -0.03 -1.05 0.00 0.00 178.15 178.11 2bye h MET 87 N 0.00 0.00 0.10 0.16 4.05 -1.92 0.74 114.93 118.05 2bye h MET 87 Ca -0.00 0.00 -0.27 0.00 -0.28 0.00 0.00 59.70 59.15 2bye h MET 87 Cb 0.53 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 31.34 2bye h MET 87 CO 0.04 0.08 -1.17 1.96 0.23 0.00 0.00 176.91 178.05 2bye h GLN 88 N 0.00 0.43 0.07 0.39 4.20 -1.50 -2.37 115.11 116.33 2bye h GLN 88 Ca -0.00 -0.59 -0.00 0.00 0.06 0.00 0.00 58.65 58.12 2bye h GLN 88 Cb 0.33 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.31 2bye h GLN 88 CO 0.01 1.24 -0.04 0.82 -0.67 0.00 0.00 178.83 180.20 2bye h ILE 89 N 0.18 0.98 -0.21 2.54 1.08 -0.70 -0.79 117.51 120.60 2bye h ILE 89 Ca -0.14 -0.20 -0.07 0.00 -0.39 0.00 0.00 64.86 64.06 2bye h ILE 89 Cb 1.85 1.11 -0.01 0.00 -3.07 0.00 0.00 36.82 36.70 2bye h ILE 89 CO 0.21 0.05 -0.18 -0.07 -0.69 0.00 0.00 178.15 177.46 2bye h LEU 90 N -0.19 0.36 -1.46 1.44 -0.00 -1.05 -1.86 115.31 112.54 2bye h LEU 90 Ca -0.01 -0.10 -0.05 0.00 -0.00 0.00 0.00 57.88 57.73 2bye h LEU 90 Cb 0.16 -0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 40.72 2bye h LEU 90 CO 0.02 0.56 -0.22 -1.28 -0.00 0.00 0.00 178.44 177.51 2bye h SER 91 N 0.34 0.00 -0.58 -0.43 0.87 -1.10 -2.30 113.55 110.34 2bye h SER 91 Ca 0.06 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2bye h SER 91 Cb 0.52 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 2bye h SER 91 CO 0.03 0.22 0.00 -0.24 -0.53 0.00 0.00 176.83 176.32 2bye n SER 92 N -3.63 3.71 -4.56 6.23 2.88 -0.33 -4.85 113.62 113.06 2bye n SER 92 Ca -0.01 -2.00 -0.43 0.00 -1.33 0.00 0.00 58.87 55.10 2bye n SER 92 Cb 0.35 -0.39 -0.05 0.00 -0.75 0.00 0.00 64.21 63.38 2bye n SER 92 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 2bye s TRP 93 N -1.23 2.98 0.41 0.66 -0.11 -0.87 -5.02 118.94 115.77 2bye s TRP 93 Ca 0.45 0.32 -0.25 0.00 1.22 0.00 0.00 56.10 57.84 2bye s TRP 93 Cb 0.24 -3.74 -0.08 0.00 -1.50 0.00 0.00 33.47 28.39 2bye s TRP 93 CO 0.33 -0.99 1.17 -0.06 -4.62 0.00 0.00 176.95 172.78 2bye s PHE 94 N 3.45 3.03 0.55 5.86 0.08 -1.26 -4.78 117.98 124.91 2bye s PHE 94 Ca 0.33 1.55 0.23 0.00 0.12 0.00 0.00 56.93 59.15 2bye s PHE 94 Cb -0.11 -3.40 1.53 0.00 -0.57 0.00 0.00 43.02 40.47 2bye s PHE 94 CO 0.23 -1.36 2.19 -1.35 -0.10 0.00 0.00 175.22 174.83 2bye h PRO 95 N 2.56 0.00 0.00 0.24 0.11 -1.98 0.52 132.00 133.45 2bye h PRO 95 Ca -0.49 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 2bye h PRO 95 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2bye h PRO 95 CO 0.62 0.00 -0.02 0.93 -0.21 0.00 0.00 178.00 179.32 2bye h GLU 96 N 0.00 0.00 0.00 1.05 5.08 -2.03 -3.27 114.58 115.41 2bye h GLU 96 Ca 0.01 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2bye h GLU 96 Cb 0.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 2bye h GLU 96 CO -0.00 0.02 -0.84 0.39 -1.00 0.00 0.00 179.01 177.57 2bye n GLU 97 N -3.12 0.50 0.00 2.33 1.02 -0.06 -4.91 120.64 116.40 2bye n GLU 97 Ca 0.00 0.34 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 2bye n GLU 97 Cb 0.30 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 2bye n GLU 97 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bye n GLY 98 N 1.52 0.43 0.26 0.62 0.00 -0.03 -1.21 105.19 106.78 2bye n GLY 98 Ca -0.12 0.29 0.06 0.00 0.00 0.00 0.00 46.02 46.25 2bye n GLY 98 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2bye h TYR 99 N 0.00 0.12 -3.06 1.61 -0.00 -1.90 -3.38 116.97 110.36 2bye h TYR 99 Ca 0.00 -0.00 -0.60 0.00 -0.00 0.00 0.00 58.73 58.13 2bye h TYR 99 Cb 0.00 -0.04 -0.12 0.00 -0.00 0.00 0.00 36.73 36.57 2bye h TYR 99 CO 0.00 0.14 0.64 1.41 -0.00 0.00 0.00 178.16 180.35 2bye s MET 100 N -5.02 3.31 0.00 0.10 1.75 -0.35 -4.89 119.30 114.21 2bye s MET 100 Ca -0.05 -0.29 0.00 0.00 -1.25 0.00 0.00 55.69 54.10 2bye s MET 100 Cb 0.17 -4.08 0.00 0.00 2.84 0.00 0.00 34.83 33.75 2bye s MET 100 CO 0.69 -1.60 0.00 0.41 -0.65 0.00 0.00 175.02 173.87 2bye n GLY 101 N 5.16 3.59 3.60 2.11 0.00 -1.26 -4.94 105.19 113.45 2bye n GLY 101 Ca 0.02 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 2bye n GLY 101 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2bye s ARG 102 N -2.28 0.57 -0.32 1.61 3.03 -1.23 -4.98 118.95 115.35 2bye s ARG 102 Ca 0.00 0.35 -0.22 0.00 2.03 0.00 0.00 55.73 57.88 2bye s ARG 102 Cb 0.00 0.27 0.00 0.00 -1.03 0.00 0.00 34.95 34.19 2bye s ARG 102 CO 0.00 -0.14 0.73 0.42 -1.13 0.00 0.00 175.30 175.19 2bye s ILE 103 N -0.53 4.83 -0.40 4.99 -1.09 -1.26 -1.89 121.20 125.86 2bye s ILE 103 Ca 0.00 0.99 -0.13 0.00 -2.23 0.00 0.00 60.65 59.28 2bye s ILE 103 Cb -0.02 -4.12 0.03 0.00 -1.58 0.00 0.00 42.46 36.77 2bye s ILE 103 CO -0.01 -0.26 0.25 0.54 -1.23 0.00 0.00 174.94 174.23 2bye s VAL 104 N 2.88 4.83 -0.39 2.92 0.11 0.15 0.10 120.40 131.00 2bye s VAL 104 Ca 0.30 -0.84 -0.29 0.00 -2.93 0.00 0.00 61.98 58.22 2bye s VAL 104 Cb -0.14 -3.73 0.00 0.00 -1.53 0.00 0.00 36.38 30.98 2bye s VAL 104 CO 0.13 -0.30 1.52 -0.22 -3.33 0.00 0.00 175.10 172.90 2bye s LEU 105 N 1.59 3.56 0.00 2.54 2.96 -1.26 -1.21 118.68 126.87 2bye s LEU 105 Ca 0.03 0.96 0.06 0.00 -0.22 0.00 0.00 54.13 54.95 2bye s LEU 105 Cb -0.20 -3.53 0.06 0.00 0.50 0.00 0.00 46.19 43.02 2bye s LEU 105 CO 0.08 -1.51 0.46 0.29 -1.32 0.00 0.00 176.35 174.34 2bye n LYS 106 N 8.18 0.70 -4.42 1.98 4.76 0.13 -4.36 118.16 125.14 2bye n LYS 106 Ca 0.18 -3.21 -0.27 0.00 -2.87 0.00 0.00 58.31 52.15 2bye n LYS 106 Cb 0.48 0.24 -0.13 0.00 -1.84 0.00 0.00 35.03 33.77 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 -2.56 1.98 -0.45 -0.18 -4.23 -1.26 -1.43 115.64 107.51 2bye s THR 107 Ca 0.35 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 2bye s THR 107 Cb -0.03 -1.76 0.00 0.00 1.34 0.00 0.00 72.50 72.05 2bye s THR 107 CO 0.22 0.07 0.47 0.00 -0.54 0.00 0.00 174.62 174.83 2bye n GLN 108 N 1.14 0.60 -3.91 3.99 6.02 0.48 -4.74 117.38 120.96 2bye n GLN 108 Ca -0.18 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.54 2bye n GLN 108 Cb 0.53 -1.25 -0.03 0.00 1.02 0.00 0.00 30.24 30.52 2bye n GLN 108 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2bye s GLN 109 N -0.23 3.45 0.00 -1.09 2.00 -1.26 -5.11 119.66 117.42 2bye s GLN 109 Ca 0.00 -0.55 0.24 0.00 -2.00 0.00 0.00 55.36 53.05 2bye s GLN 109 Cb 0.00 -2.95 0.22 0.00 0.80 0.00 0.00 33.01 31.08 2bye s GLN 109 CO 0.00 0.51 1.28 -1.91 -0.50 0.00 0.00 175.29 174.67