#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bye h GLU 2 N 0.00 0.00 0.00 1.61 4.39 -2.09 -3.50 114.58 114.99 2bye h GLU 2 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2bye h GLU 2 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2bye h GLU 2 CO 0.00 0.35 0.00 -1.91 -1.16 0.00 0.00 179.01 176.29 2bye n GLU 3 N -4.62 0.00 -3.79 2.33 4.07 -1.26 -4.71 120.64 112.67 2bye n GLU 3 Ca -0.11 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.65 2bye n GLU 3 Cb 0.32 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.64 2bye n GLU 3 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 2bye s ARG 4 N 0.00 3.55 -1.04 5.31 3.52 -1.26 -5.02 118.95 124.01 2bye s ARG 4 Ca 0.00 -0.12 -0.23 0.00 -0.13 0.00 0.00 55.73 55.25 2bye s ARG 4 Cb 0.00 -3.08 0.02 0.00 -1.56 0.00 0.00 34.95 30.34 2bye s ARG 4 CO 0.00 0.65 1.62 0.15 -0.81 0.00 0.00 175.30 176.91 2bye s LYS 5 N -1.80 3.37 -0.21 5.12 1.02 -1.26 -4.63 119.74 121.35 2bye s LYS 5 Ca 0.28 -1.07 -0.16 0.00 0.02 0.00 0.00 55.97 55.03 2bye s LYS 5 Cb -0.13 -5.32 -0.08 0.00 -0.52 0.00 0.00 37.83 31.78 2bye s LYS 5 CO 0.16 -2.56 -0.30 0.00 -0.92 0.00 0.00 175.35 171.73 2bye s LEU 7 N -7.81 6.41 -0.79 0.00 1.43 -1.26 -4.58 118.68 112.08 2bye s LEU 7 Ca -0.31 -2.37 -0.25 0.00 -1.03 0.00 0.00 54.13 50.18 2bye s LEU 7 Cb 0.07 -2.23 0.05 0.00 0.03 0.00 0.00 46.19 44.11 2bye s LEU 7 CO 0.44 -0.71 1.25 -1.10 0.23 0.00 0.00 176.35 176.46 2bye s GLN 8 N 0.84 3.27 -0.17 1.70 -0.21 -1.26 -4.63 119.66 119.20 2bye s GLN 8 Ca 0.16 -0.59 -0.29 0.00 0.02 0.00 0.00 55.36 54.66 2bye s GLN 8 Cb -0.15 -4.45 -0.00 0.00 1.00 0.00 0.00 33.01 29.41 2bye s GLN 8 CO -0.05 -2.09 1.00 0.95 -2.12 0.00 0.00 175.29 172.98 2bye s THR 9 N 5.16 4.75 0.02 -0.19 -4.23 -1.26 -3.54 115.64 116.35 2bye s THR 9 Ca 0.35 1.98 0.08 0.00 -1.18 0.00 0.00 61.69 62.92 2bye s THR 9 Cb -0.08 -4.29 -0.03 0.00 1.34 0.00 0.00 72.50 69.45 2bye s THR 9 CO 0.08 -0.08 -0.23 -1.00 -0.54 0.00 0.00 174.62 172.84 2bye s HIS 10 N 2.62 2.41 0.02 3.99 3.76 -1.22 -4.87 115.29 121.99 2bye s HIS 10 Ca 0.45 -0.36 -0.00 0.00 -0.15 0.00 0.00 55.06 54.99 2bye s HIS 10 Cb -0.16 -1.46 -0.04 0.00 1.11 0.00 0.00 32.58 32.03 2bye s HIS 10 CO 0.11 0.12 0.12 0.50 -0.85 0.00 0.00 174.74 174.74 2bye s ARG 11 N -1.07 3.18 -0.13 1.40 3.52 -1.26 0.12 118.95 124.70 2bye s ARG 11 Ca 0.12 -0.48 -0.00 0.00 -0.13 0.00 0.00 55.73 55.24 2bye s ARG 11 Cb -0.10 -2.92 0.03 0.00 -1.56 0.00 0.00 34.95 30.40 2bye s ARG 11 CO 0.02 0.63 -0.06 0.54 -0.81 0.00 0.00 175.30 175.62 2bye s VAL 12 N -1.31 1.04 -0.06 7.11 0.11 -0.77 -4.95 120.40 121.57 2bye s VAL 12 Ca 0.27 -0.41 -0.30 0.00 -2.93 0.00 0.00 61.98 58.61 2bye s VAL 12 Cb -0.12 -1.13 -0.03 0.00 -1.53 0.00 0.00 36.38 33.57 2bye s VAL 12 CO 0.18 0.27 1.25 -0.89 -3.33 0.00 0.00 175.10 172.59 2bye s THR 13 N 1.69 4.15 -0.25 5.04 2.01 -1.26 -2.30 115.64 124.72 2bye s THR 13 Ca 0.03 1.48 -0.08 0.00 0.31 0.00 0.00 61.69 63.43 2bye s THR 13 Cb -0.14 -3.95 -0.03 0.00 0.01 0.00 0.00 72.50 68.39 2bye s THR 13 CO -0.08 -0.03 0.08 -0.69 -0.69 0.00 0.00 174.62 173.21 2bye s VAL 14 N 2.50 4.39 -1.88 3.82 1.01 0.49 -4.56 120.40 126.17 2bye s VAL 14 Ca 0.57 -0.15 0.24 0.00 0.00 0.00 0.00 61.98 62.65 2bye s VAL 14 Cb -0.25 -3.06 0.08 0.00 0.00 0.00 0.00 36.38 33.15 2bye s VAL 14 CO 0.22 0.33 1.26 1.41 0.00 0.00 0.00 175.10 178.32 2bye n HIS 15 N 4.93 0.00 -0.03 5.22 8.25 0.14 -1.43 115.22 132.30 2bye n HIS 15 Ca -0.16 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.23 2bye n HIS 15 Cb 0.51 -0.05 -0.14 0.00 1.12 0.00 0.00 29.99 31.44 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 1.40 -1.03 3.68 -1.41 0.00 -1.06 -4.75 105.19 102.02 2bye n GLY 16 Ca 0.10 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 2bye n GLY 16 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2bye n VAL 17 N -2.90 0.48 0.00 1.61 3.14 -1.26 -4.39 118.33 115.01 2bye n VAL 17 Ca -0.20 -0.09 0.00 0.00 -2.96 0.00 0.00 64.34 61.10 2bye n VAL 17 Cb 1.03 -2.18 0.00 0.00 -1.06 0.00 0.00 33.84 31.63 2bye n VAL 17 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 2bye n PRO 18 N 6.15 0.00 0.00 1.45 -0.04 -1.26 -4.57 135.00 136.73 2bye n PRO 18 Ca 0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 2bye n PRO 18 Cb 0.38 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.84 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 4.26 -0.41 0.16 0.55 0.00 -1.26 -3.57 105.19 104.91 2bye n GLY 19 Ca 0.00 -1.09 0.04 0.00 0.00 0.00 0.00 46.02 44.97 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 -7.34 1.61 0.13 -2.02 -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 0.46 0.40 -1.21 -0.23 0.00 0.00 178.00 177.42 2bye s GLU 21 N -3.22 3.47 -0.10 0.86 2.02 -1.23 -5.00 118.70 115.50 2bye s GLU 21 Ca 0.02 0.82 0.07 0.00 0.02 0.00 0.00 54.97 55.91 2bye s GLU 21 Cb 0.09 -2.06 -0.24 0.00 0.10 0.00 0.00 34.13 32.02 2bye s GLU 21 CO 0.72 -0.67 0.46 -0.35 0.02 0.00 0.00 175.26 175.44 2bye n PRO 22 N -2.73 0.68 -3.70 0.39 -0.04 -1.26 -4.70 135.00 123.64 2bye n PRO 22 Ca 0.06 0.24 -0.14 0.00 -0.04 0.00 0.00 63.50 63.63 2bye n PRO 22 Cb 0.54 -1.72 -0.09 0.00 -0.04 0.00 0.00 33.50 32.19 2bye n PRO 22 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2bye s PHE 23 N -2.57 -0.45 -0.04 0.54 -0.71 -1.26 -4.61 117.98 108.88 2bye s PHE 23 Ca -0.12 1.00 -0.04 0.00 -1.04 0.00 0.00 56.93 56.73 2bye s PHE 23 Cb 0.07 0.19 0.01 0.00 -1.21 0.00 0.00 43.02 42.08 2bye s PHE 23 CO 0.80 -0.33 0.12 -0.08 -1.34 0.00 0.00 175.22 174.39 2bye s THR 24 N -0.31 0.01 -0.20 -4.49 -1.32 -0.51 -4.94 115.64 103.88 2bye s THR 24 Ca -0.05 -0.07 -0.06 0.00 -1.21 0.00 0.00 61.69 60.30 2bye s THR 24 Cb -0.03 -0.20 -0.03 0.00 -1.51 0.00 0.00 72.50 70.72 2bye s THR 24 CO 0.03 -0.04 0.03 -0.69 -2.21 0.00 0.00 174.62 171.74 2bye s VAL 25 N -0.08 4.33 -0.03 5.08 1.01 -1.26 -0.38 120.40 129.07 2bye s VAL 25 Ca -0.01 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.79 2bye s VAL 25 Cb -0.02 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 2bye s VAL 25 CO 0.00 0.43 -0.04 -0.36 0.00 0.00 0.00 175.10 175.13 2bye s PHE 26 N 0.80 2.99 0.13 5.22 0.08 -0.97 -4.85 117.98 121.38 2bye s PHE 26 Ca 0.02 0.05 -0.21 0.00 0.12 0.00 0.00 56.93 56.91 2bye s PHE 26 Cb -0.14 -1.68 -0.07 0.00 -0.57 0.00 0.00 43.02 40.56 2bye s PHE 26 CO 0.02 0.40 0.66 0.99 -0.10 0.00 0.00 175.22 177.19 2bye s THR 27 N -0.95 4.59 0.26 0.64 2.01 -1.26 -1.84 115.64 119.09 2bye s THR 27 Ca 0.16 1.36 0.03 0.00 0.31 0.00 0.00 61.69 63.55 2bye s THR 27 Cb -0.11 -3.96 0.03 0.00 0.01 0.00 0.00 72.50 68.47 2bye s THR 27 CO 0.06 0.46 0.23 2.30 -0.69 0.00 0.00 174.62 176.98 2bye n ILE 28 N 1.44 0.00 -3.63 1.82 -5.35 0.12 -4.95 119.36 108.81 2bye n ILE 28 Ca -0.07 -1.01 -0.12 0.00 -0.27 0.00 0.00 62.75 61.28 2bye n ILE 28 Cb 0.50 -0.37 -0.07 0.00 -1.74 0.00 0.00 39.64 37.96 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 -2.56 -0.62 0.00 7.28 4.22 -1.26 -3.43 114.94 118.58 2bye s ASN 29 Ca 0.17 1.16 0.00 0.00 -2.14 0.00 0.00 52.86 52.05 2bye s ASN 29 Cb -0.01 1.16 0.00 0.00 1.28 0.00 0.00 41.25 43.68 2bye s ASN 29 CO 0.11 -0.23 0.00 0.61 -2.04 0.00 0.00 177.10 175.55 2bye n GLY 30 N 2.37 1.70 1.49 0.45 0.00 -1.23 -3.43 105.19 106.54 2bye n GLY 30 Ca -0.13 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.41 3.06 -0.02 0.00 -1.26 -4.54 105.19 102.02 2bye n GLY 31 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.25 -1.98 -1.29 2.61 -2.24 -1.22 -4.86 114.28 103.05 2bye n THR 32 Ca 0.00 0.26 -0.29 0.00 -2.27 0.00 0.00 64.05 61.75 2bye n THR 32 Cb 0.00 -2.86 0.16 0.00 -2.10 0.00 0.00 70.33 65.53 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 -0.19 0.65 0.64 -0.78 0.00 -1.26 -4.68 119.74 114.11 2bye s LYS 33 Ca -0.02 0.44 0.28 0.00 0.00 0.00 0.00 55.97 56.68 2bye s LYS 33 Cb 0.00 -1.77 1.52 0.00 0.00 0.00 0.00 37.83 37.58 2bye s LYS 33 CO 0.06 -2.57 1.88 0.00 0.00 0.00 0.00 175.35 174.72 2bye h ALA 34 N -1.77 1.63 0.00 0.59 0.00 -1.77 -0.40 119.26 117.54 2bye h ALA 34 Ca -0.53 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 2bye h ALA 34 Cb 1.33 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2bye h ALA 34 CO 0.59 -0.48 -0.34 1.57 0.00 0.00 0.00 179.25 180.59 2bye h LYS 35 N 0.00 0.00 0.00 0.00 2.10 -1.84 0.22 116.57 117.05 2bye h LYS 35 Ca 0.07 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.72 2bye h LYS 35 Cb 0.88 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.21 2bye h LYS 35 CO -0.00 0.86 -0.01 1.96 -2.00 0.00 0.00 179.45 180.26 2bye h GLN 36 N -1.00 0.00 0.12 0.07 7.50 -1.74 -2.08 115.11 117.98 2bye h GLN 36 Ca -0.09 0.00 -0.30 0.00 0.50 0.00 0.00 58.65 58.76 2bye h GLN 36 Cb 0.96 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.49 2bye h GLN 36 CO -0.05 0.01 -1.47 1.25 -1.50 0.00 0.00 178.83 177.07 2bye h LEU 37 N 0.00 0.40 -1.44 1.46 7.12 -1.05 -2.68 115.31 119.12 2bye h LEU 37 Ca -0.00 -0.52 0.12 0.00 0.13 0.00 0.00 57.88 57.61 2bye h LEU 37 Cb 0.06 -0.13 -0.05 0.00 -0.53 0.00 0.00 40.66 40.00 2bye h LEU 37 CO 0.00 1.43 0.51 0.25 -0.13 0.00 0.00 178.44 180.50 2bye h LEU 38 N 0.07 0.54 0.27 2.25 7.12 0.14 0.14 115.31 125.85 2bye h LEU 38 Ca -0.22 0.02 0.01 0.00 0.13 0.00 0.00 57.88 57.82 2bye h LEU 38 Cb 2.01 -0.09 -0.03 0.00 -0.53 0.00 0.00 40.66 42.02 2bye h LEU 38 CO 0.17 0.31 -0.33 -0.61 -0.13 0.00 0.00 178.44 177.84 2bye h GLN 39 N 0.59 -0.63 -0.62 1.25 4.15 -1.47 0.16 115.11 118.54 2bye h GLN 39 Ca 0.37 0.04 0.15 0.00 0.77 0.00 0.00 58.65 59.98 2bye h GLN 39 Cb 0.61 0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.41 2bye h GLN 39 CO -0.14 -0.42 0.43 1.96 -1.93 0.00 0.00 178.83 178.74 2bye h GLN 40 N -0.65 0.19 0.10 1.69 1.08 -0.45 0.41 115.11 117.48 2bye h GLN 40 Ca -0.00 -0.01 -0.29 0.00 -1.45 0.00 0.00 58.65 56.90 2bye h GLN 40 Cb 0.62 -0.04 0.02 0.00 -0.05 0.00 0.00 27.48 28.03 2bye h GLN 40 CO -0.10 0.13 -1.20 0.82 -0.95 0.00 0.00 178.83 177.52 2bye h ILE 41 N 0.20 1.32 -0.40 2.54 5.03 -0.62 -3.00 117.51 122.58 2bye h ILE 41 Ca 0.30 -2.51 0.02 0.00 -0.12 0.00 0.00 64.86 62.54 2bye h ILE 41 Cb 0.91 2.67 -0.02 0.00 -3.03 0.00 0.00 36.82 37.35 2bye h ILE 41 CO -0.05 0.76 0.27 -0.07 -0.68 0.00 0.00 178.15 178.37 2bye h LEU 42 N 0.26 0.41 -8.28 1.44 3.38 0.15 -3.42 115.31 109.24 2bye h LEU 42 Ca -0.17 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 2bye h LEU 42 Cb 1.88 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.52 2bye h LEU 42 CO 0.23 0.29 0.17 -0.89 0.09 0.00 0.00 178.44 178.32 2bye s THR 43 N -5.44 3.10 -0.79 0.22 2.01 0.12 -4.57 115.64 110.29 2bye s THR 43 Ca -0.08 -0.10 0.23 0.00 0.31 0.00 0.00 61.69 62.05 2bye s THR 43 Cb 0.18 -3.33 -0.13 0.00 0.01 0.00 0.00 72.50 69.23 2bye s THR 43 CO 0.73 -0.21 1.05 0.59 -0.69 0.00 0.00 174.62 176.09 2bye n ASN 44 N 17.89 0.68 -2.65 3.53 5.03 -1.26 -5.01 115.26 133.47 2bye n ASN 44 Ca 0.45 -0.45 -0.10 0.00 0.87 0.00 0.00 54.58 55.35 2bye n ASN 44 Cb 0.44 0.79 0.05 0.00 -1.02 0.00 0.00 39.78 40.04 2bye n ASN 44 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2bye n GLU 45 N -1.73 -2.55 0.00 3.52 1.02 -1.26 -4.96 120.64 114.68 2bye n GLU 45 Ca 0.03 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.75 2bye n GLU 45 Cb 0.39 -4.52 0.00 0.00 -0.02 0.00 0.00 31.44 27.29 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 -2.81 0.00 -0.35 3.49 6.02 -1.26 -4.45 117.38 118.02 2bye n GLN 46 Ca -0.10 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 56.96 2bye n GLN 46 Cb 0.59 -0.04 0.23 0.00 1.02 0.00 0.00 30.24 32.04 2bye n GLN 46 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2bye n ASP 47 N -0.05 3.07 0.00 1.08 2.03 -1.26 -4.89 116.55 116.54 2bye n ASP 47 Ca 0.00 -2.18 0.00 0.00 0.52 0.00 0.00 54.79 53.13 2bye n ASP 47 Cb 0.00 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.98 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 0.78 0.00 -3.75 5.18 5.41 -1.26 -4.91 119.36 120.81 2bye n ILE 48 Ca 0.17 0.00 -0.36 0.00 1.00 0.00 0.00 62.75 63.56 2bye n ILE 48 Cb 0.55 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 39.38 2bye n ILE 48 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2bye s LYS 49 N 0.00 2.44 0.00 0.38 2.20 -1.26 -4.51 119.74 118.99 2bye s LYS 49 Ca 0.00 -2.45 0.00 0.00 -0.36 0.00 0.00 55.97 53.16 2bye s LYS 49 Cb 0.00 -3.67 0.00 0.00 -1.51 0.00 0.00 37.83 32.65 2bye s LYS 49 CO 0.00 -1.15 0.00 -2.30 -0.36 0.00 0.00 175.35 171.54 2bye n PRO 50 N 3.58 0.38 -2.98 4.03 -0.02 -1.26 -4.90 135.00 133.83 2bye n PRO 50 Ca 0.06 0.00 -0.44 0.00 -2.02 0.00 0.00 63.50 61.10 2bye n PRO 50 Cb 0.38 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 33.86 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 -0.41 5.12 -0.71 -1.45 1.01 -1.26 -4.97 120.40 117.72 2bye s VAL 51 Ca 0.00 -2.69 -0.26 0.00 0.00 0.00 0.00 61.98 59.03 2bye s VAL 51 Cb 0.00 -4.88 0.00 0.00 0.00 0.00 0.00 36.38 31.50 2bye s VAL 51 CO 0.00 -1.58 1.61 0.42 0.00 0.00 0.00 175.10 175.55 2bye s THR 52 N 1.33 3.55 0.00 3.92 -4.23 -1.26 -4.86 115.64 114.09 2bye s THR 52 Ca 0.41 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 61.10 2bye s THR 52 Cb -0.04 -4.42 0.00 0.00 1.34 0.00 0.00 72.50 69.39 2bye s THR 52 CO -0.01 -1.37 0.00 1.07 -0.54 0.00 0.00 174.62 173.77 2bye n THR 53 N 6.91 0.00 0.00 3.99 5.66 -1.26 -4.97 114.28 124.61 2bye n THR 53 Ca 0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.16 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 -4.76 1.09 8.00 -1.26 -4.76 116.55 114.86 2bye n ASP 54 Ca 0.00 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.10 2bye n ASP 54 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 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 -1.57 3.41 0.20 1.24 2.02 -1.26 -1.10 117.35 120.30 2bye s TYR 55 Ca 0.00 1.63 0.03 0.00 -0.37 0.00 0.00 57.07 58.36 2bye s TYR 55 Cb 0.00 -3.35 -0.01 0.00 -0.40 0.00 0.00 41.96 38.20 2bye s TYR 55 CO 0.00 -0.85 0.21 1.97 -1.57 0.00 0.00 175.55 175.32 2bye n PHE 56 N 0.90 -0.69 -4.15 2.71 -1.74 -0.92 -4.94 117.46 108.65 2bye n PHE 56 Ca 0.00 -1.57 -0.24 0.00 -0.56 0.00 0.00 57.45 55.08 2bye n PHE 56 Cb 0.45 0.23 -0.07 0.00 1.52 0.00 0.00 39.48 41.61 2bye n PHE 56 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2bye s LEU 57 N 0.00 3.16 -0.19 5.98 1.02 -1.25 0.17 118.68 127.57 2bye s LEU 57 Ca 0.21 -0.92 -0.28 0.00 0.02 0.00 0.00 54.13 53.17 2bye s LEU 57 Cb 0.01 -1.57 0.09 0.00 0.02 0.00 0.00 46.19 44.74 2bye s LEU 57 CO 0.15 -0.37 0.84 0.00 0.02 0.00 0.00 176.35 176.99 2bye s MET 58 N -3.84 0.77 -0.56 1.70 0.23 -1.10 -0.11 119.30 116.39 2bye s MET 58 Ca 0.38 0.53 -0.19 0.00 -1.03 0.00 0.00 55.69 55.39 2bye s MET 58 Cb 0.00 0.37 0.09 0.00 -1.53 0.00 0.00 34.83 33.76 2bye s MET 58 CO 0.22 -0.17 0.66 -1.21 -2.03 0.00 0.00 175.02 172.49 2bye s GLU 59 N -0.38 3.07 -0.02 3.16 0.41 -0.76 -2.17 118.70 122.02 2bye s GLU 59 Ca -0.03 -1.19 0.07 0.00 -0.41 0.00 0.00 54.97 53.42 2bye s GLU 59 Cb -0.03 -4.21 -0.02 0.00 -1.78 0.00 0.00 34.13 28.10 2bye s GLU 59 CO 0.02 -1.41 -0.23 -1.83 -0.49 0.00 0.00 175.26 171.31 2bye s GLU 60 N 2.61 1.87 -0.51 1.61 -1.05 -0.78 -2.75 118.70 119.70 2bye s GLU 60 Ca 0.12 -0.84 -0.20 0.00 -0.15 0.00 0.00 54.97 53.91 2bye s GLU 60 Cb -0.23 -1.81 0.05 0.00 -0.44 0.00 0.00 34.13 31.70 2bye s GLU 60 CO 0.08 0.50 0.67 0.15 0.95 0.00 0.00 175.26 177.61 2bye s LYS 61 N -0.57 3.16 0.22 -4.83 -0.14 -1.26 -0.85 119.74 115.48 2bye s LYS 61 Ca 0.09 -0.77 0.06 0.00 -1.36 0.00 0.00 55.97 53.99 2bye s LYS 61 Cb -0.09 -4.08 -0.04 0.00 -1.68 0.00 0.00 37.83 31.94 2bye s LYS 61 CO -0.01 -1.24 0.20 -0.47 -0.76 0.00 0.00 175.35 173.08 2bye s TYR 62 N 2.82 3.18 0.00 3.18 5.04 -1.26 -4.42 117.35 125.88 2bye s TYR 62 Ca 0.18 -0.07 0.00 0.00 -2.44 0.00 0.00 57.07 54.74 2bye s TYR 62 Cb -0.18 -1.46 0.00 0.00 0.35 0.00 0.00 41.96 40.67 2bye s TYR 62 CO 0.13 0.51 0.00 1.19 -1.34 0.00 0.00 175.55 176.05 2bye n PHE 63 N -0.97 0.00 -3.40 4.97 3.72 -1.26 -4.57 117.46 115.95 2bye n PHE 63 Ca -0.08 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.92 2bye n PHE 63 Cb 0.57 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 39.02 2bye n PHE 63 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 2bye s ILE 64 N 0.00 5.17 -0.26 4.37 2.07 -1.26 -4.87 121.20 126.41 2bye s ILE 64 Ca 0.00 0.21 0.18 0.00 -1.41 0.00 0.00 60.65 59.63 2bye s ILE 64 Cb 0.00 -3.78 0.44 0.00 0.13 0.00 0.00 42.46 39.24 2bye s ILE 64 CO 0.00 -0.02 1.29 -1.20 -1.91 0.00 0.00 174.94 173.10 2bye n SER 65 N 5.38 0.16 -3.52 4.50 7.64 -1.26 -4.84 113.62 121.68 2bye n SER 65 Ca -0.09 -2.10 -0.35 0.00 1.01 0.00 0.00 58.87 57.35 2bye n SER 65 Cb 0.50 0.05 -0.02 0.00 -1.01 0.00 0.00 64.21 63.73 2bye n SER 65 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2bye n LYS 66 N -0.90 3.90 -1.90 1.43 2.85 -1.26 -5.05 118.16 117.23 2bye n LYS 66 Ca -0.05 -4.69 -0.30 0.00 -1.05 0.00 0.00 58.31 52.22 2bye n LYS 66 Cb 0.85 -2.37 0.05 0.00 -0.65 0.00 0.00 35.03 32.90 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 -3.23 2.84 -0.27 -1.58 0.41 -1.26 -5.02 118.70 110.59 2bye s GLU 67 Ca 0.39 0.44 -0.15 0.00 -0.41 0.00 0.00 54.97 55.24 2bye s GLU 67 Cb 0.16 -2.03 -0.04 0.00 -1.78 0.00 0.00 34.13 30.45 2bye s GLU 67 CO -0.03 -1.03 0.37 0.21 -0.49 0.00 0.00 175.26 174.28 2bye s LYS 68 N -5.35 4.01 0.11 1.61 2.47 -1.26 -4.97 119.74 116.35 2bye s LYS 68 Ca 0.58 0.03 0.00 0.00 -1.56 0.00 0.00 55.97 55.02 2bye s LYS 68 Cb -0.11 -3.66 0.00 0.00 -1.46 0.00 0.00 37.83 32.60 2bye s LYS 68 CO 0.51 -0.28 0.00 0.09 0.16 0.00 0.00 175.35 175.83 2bye n ASN 69 N 5.33 -2.42 -1.67 1.43 3.02 -1.26 -4.37 115.26 115.32 2bye n ASN 69 Ca -0.08 0.20 -0.12 0.00 -0.03 0.00 0.00 54.58 54.54 2bye n ASN 69 Cb 0.51 -1.25 0.06 0.00 -0.61 0.00 0.00 39.78 38.48 2bye n ASN 69 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2bye n GLU 70 N -2.25 1.61 -2.38 3.52 0.00 -1.26 -4.79 120.64 115.10 2bye n GLU 70 Ca -0.00 -1.33 -0.37 0.00 0.00 0.00 0.00 57.16 55.46 2bye n GLU 70 Cb 0.19 -1.52 -0.03 0.00 0.00 0.00 0.00 31.44 30.08 2bye n GLU 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2bye n ARG 72 N 8.43 1.78 -0.24 0.00 1.74 -1.26 -3.80 116.66 123.32 2bye n ARG 72 Ca 0.46 -1.23 0.07 0.00 -0.77 0.00 0.00 57.85 56.38 2bye n ARG 72 Cb 0.47 -1.47 0.19 0.00 -1.02 0.00 0.00 32.46 30.62 2bye n ARG 72 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2bye n LYS 73 N 0.46 2.07 -3.26 5.56 5.02 -1.26 -4.84 118.16 121.90 2bye n LYS 73 Ca 0.16 -1.53 -0.39 0.00 -2.02 0.00 0.00 58.31 54.53 2bye n LYS 73 Cb 0.43 -1.37 -0.07 0.00 -0.02 0.00 0.00 35.03 34.00 2bye n LYS 73 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2bye s GLN 74 N -1.48 4.16 -0.74 1.97 -0.21 -1.25 -5.02 119.66 117.09 2bye s GLN 74 Ca 0.28 0.37 -0.27 0.00 0.02 0.00 0.00 55.36 55.76 2bye s GLN 74 Cb 0.15 -3.58 0.03 0.00 1.00 0.00 0.00 33.01 30.61 2bye s GLN 74 CO 0.18 -0.18 1.33 -2.14 -2.12 0.00 0.00 175.29 172.37 2bye s PRO 75 N 1.75 3.16 -0.07 2.91 0.02 -1.26 -4.84 135.00 136.66 2bye s PRO 75 Ca 0.23 -0.21 -0.18 0.00 0.02 0.00 0.00 61.00 60.86 2bye s PRO 75 Cb -0.15 -4.24 -0.29 0.00 0.02 0.00 0.00 34.50 29.83 2bye s PRO 75 CO 0.09 -2.20 0.71 0.74 -0.33 0.00 0.00 177.00 176.01 2bye h PHE 76 N 10.42 0.52 -3.33 6.54 0.04 -1.96 -3.44 116.94 125.73 2bye h PHE 76 Ca -0.26 -0.38 -0.59 0.00 2.80 0.00 0.00 57.97 59.54 2bye h PHE 76 Cb 1.06 -0.02 -0.08 0.00 2.20 0.00 0.00 35.95 39.11 2bye h PHE 76 CO 1.13 1.47 0.64 -1.14 -0.60 0.00 0.00 178.31 179.80 2bye s GLN 77 N -2.47 4.05 -0.13 1.51 0.74 -1.26 -4.75 119.66 117.35 2bye s GLN 77 Ca -0.17 0.90 0.03 0.00 0.05 0.00 0.00 55.36 56.17 2bye s GLN 77 Cb 0.03 -3.72 0.01 0.00 1.10 0.00 0.00 33.01 30.43 2bye s GLN 77 CO 0.80 -0.76 -0.22 0.50 -0.55 0.00 0.00 175.29 175.06 2bye s ARG 78 N 3.28 3.05 0.19 1.67 3.52 -1.11 -5.03 118.95 124.52 2bye s ARG 78 Ca 0.39 -0.85 -0.22 0.00 -0.13 0.00 0.00 55.73 54.93 2bye s ARG 78 Cb -0.13 -2.41 -0.08 0.00 -1.56 0.00 0.00 34.95 30.76 2bye s ARG 78 CO 0.13 0.06 0.73 0.00 -0.81 0.00 0.00 175.30 175.40 2bye s ALA 79 N 0.65 3.44 -0.25 6.12 0.00 -1.26 -1.82 121.76 128.63 2bye s ALA 79 Ca -0.11 0.23 -0.14 0.00 0.00 0.00 0.00 51.96 51.93 2bye s ALA 79 Cb -0.16 -2.86 -0.04 0.00 0.00 0.00 0.00 23.12 20.06 2bye s ALA 79 CO 0.02 0.32 0.35 0.42 0.00 0.00 0.00 175.76 176.87 2bye s ILE 80 N -1.35 5.21 0.55 0.00 -1.09 0.85 -4.94 121.20 120.42 2bye s ILE 80 Ca 0.39 0.54 0.03 0.00 -2.23 0.00 0.00 60.65 59.38 2bye s ILE 80 Cb -0.19 -3.68 0.03 0.00 -1.58 0.00 0.00 42.46 37.04 2bye s ILE 80 CO 0.23 0.20 0.23 -0.83 -1.23 0.00 0.00 174.94 173.53 2bye s GLY 81 N 1.45 2.73 0.40 6.18 0.00 -1.26 -3.82 107.32 113.01 2bye s GLY 81 Ca 0.15 -0.62 0.09 0.00 0.00 0.00 0.00 44.72 44.34 2bye s GLY 81 CO 0.09 -2.08 1.97 -2.55 0.00 0.00 0.00 173.10 170.53 2bye h PRO 82 N 0.95 0.31 -0.09 2.90 0.11 -1.97 -2.87 132.00 131.34 2bye h PRO 82 Ca -0.40 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 2bye h PRO 82 Cb 1.32 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2bye h PRO 82 CO 0.64 0.35 -0.23 0.93 -0.21 0.00 0.00 178.00 179.48 2bye h GLU 83 N 0.30 0.31 -5.45 1.05 5.08 -1.99 -3.35 114.58 110.53 2bye h GLU 83 Ca 0.07 -0.22 -0.18 0.00 -1.00 0.00 0.00 59.36 58.03 2bye h GLU 83 Cb 0.23 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2bye h GLU 83 CO 0.01 0.83 0.52 -1.21 -1.00 0.00 0.00 179.01 178.16 2bye s GLU 84 N -3.87 2.04 0.14 2.33 8.01 -1.08 -4.93 118.70 121.34 2bye s GLU 84 Ca -0.14 -0.37 -0.30 0.00 0.01 0.00 0.00 54.97 54.16 2bye s GLU 84 Cb 0.04 -5.03 -0.08 0.00 -4.31 0.00 0.00 34.13 24.75 2bye s GLU 84 CO 0.76 -4.21 1.27 -1.21 0.01 0.00 0.00 175.26 171.87 2bye s GLU 85 N 7.59 4.42 0.47 1.61 2.02 -1.26 -4.39 118.70 129.15 2bye s GLU 85 Ca 0.77 1.93 0.18 0.00 0.02 0.00 0.00 54.97 57.87 2bye s GLU 85 Cb -0.06 -3.26 1.12 0.00 0.10 0.00 0.00 34.13 32.03 2bye s GLU 85 CO 0.09 -0.24 2.01 -0.84 0.02 0.00 0.00 175.26 176.29 2bye h ILE 86 N 4.05 0.98 0.00 -1.63 3.07 -1.92 0.45 117.51 122.51 2bye h ILE 86 Ca -0.43 -0.63 -0.03 0.00 1.55 0.00 0.00 64.86 65.32 2bye h ILE 86 Cb 1.21 1.35 -0.00 0.00 -0.27 0.00 0.00 36.82 39.11 2bye h ILE 86 CO 0.79 0.17 -0.12 0.24 -1.05 0.00 0.00 178.15 178.19 2bye h MET 87 N 0.00 0.00 0.09 0.16 2.86 -1.89 -0.31 114.93 115.84 2bye h MET 87 Ca -0.00 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.38 2bye h MET 87 Cb 0.34 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 2bye h MET 87 CO 0.02 0.12 -1.15 1.96 1.06 0.00 0.00 176.91 178.92 2bye h GLN 88 N 0.00 0.25 0.05 1.72 4.20 -1.30 -2.37 115.11 117.65 2bye h GLN 88 Ca -0.00 -0.38 -0.00 0.00 0.06 0.00 0.00 58.65 58.32 2bye h GLN 88 Cb 0.21 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.13 2bye h GLN 88 CO 0.02 1.16 -0.02 0.82 -0.67 0.00 0.00 178.83 180.13 2bye h ILE 89 N 0.08 1.12 0.00 2.54 1.08 -0.93 -2.69 117.51 118.72 2bye h ILE 89 Ca -0.11 -0.56 -0.09 0.00 -0.39 0.00 0.00 64.86 63.72 2bye h ILE 89 Cb 1.87 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 37.09 2bye h ILE 89 CO 0.18 0.14 -0.44 -0.07 -0.69 0.00 0.00 178.15 177.28 2bye h LEU 90 N -0.31 0.00 -0.05 1.44 3.38 -1.15 -2.20 115.31 116.41 2bye h LEU 90 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bye h LEU 90 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2bye h LEU 90 CO 0.01 0.44 0.00 -1.54 0.09 0.00 0.00 178.44 177.44 2bye n SER 91 N -3.55 0.41 -0.83 -0.43 3.41 -0.89 -2.75 113.62 108.99 2bye n SER 91 Ca -0.00 0.55 0.10 0.00 -0.26 0.00 0.00 58.87 59.25 2bye n SER 91 Cb 0.55 -0.65 0.11 0.00 -0.26 0.00 0.00 64.21 63.96 2bye n SER 91 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2bye n SER 92 N -1.89 2.78 -4.06 4.04 7.64 -0.86 -4.83 113.62 116.44 2bye n SER 92 Ca 0.06 -1.84 -0.33 0.00 1.01 0.00 0.00 58.87 57.77 2bye n SER 92 Cb 0.36 -0.07 -0.14 0.00 -1.01 0.00 0.00 64.21 63.36 2bye n SER 92 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 2bye s TRP 93 N -1.51 3.69 -0.33 1.43 -0.00 -1.00 -5.05 118.94 116.17 2bye s TRP 93 Ca 0.25 -2.77 -0.03 0.00 -0.00 0.00 0.00 56.10 53.56 2bye s TRP 93 Cb 0.17 -3.05 0.06 0.00 -0.00 0.00 0.00 33.47 30.65 2bye s TRP 93 CO 0.25 -0.96 0.06 -0.06 -0.00 0.00 0.00 176.95 176.24 2bye s PHE 94 N 0.99 3.34 -0.42 5.86 0.08 -1.26 -4.91 117.98 121.66 2bye s PHE 94 Ca 0.10 -1.91 -0.27 0.00 0.12 0.00 0.00 56.93 54.97 2bye s PHE 94 Cb -0.21 -2.38 -0.05 0.00 -0.57 0.00 0.00 43.02 39.81 2bye s PHE 94 CO -0.06 -0.83 2.19 -2.14 -0.10 0.00 0.00 175.22 174.27 2bye s PRO 95 N 1.25 2.62 -1.32 0.24 0.02 -1.26 -4.87 135.00 131.68 2bye s PRO 95 Ca -0.02 1.44 -0.16 0.00 0.02 0.00 0.00 61.00 62.28 2bye s PRO 95 Cb -0.20 -4.44 0.01 0.00 0.02 0.00 0.00 34.50 29.88 2bye s PRO 95 CO -0.01 -2.69 2.09 0.39 -0.33 0.00 0.00 177.00 176.45 2bye n GLU 96 N 8.90 2.67 -0.97 5.54 1.02 -1.26 -4.12 120.64 132.43 2bye n GLU 96 Ca 0.30 -2.60 0.00 0.00 -0.02 0.00 0.00 57.16 54.84 2bye n GLU 96 Cb 0.51 -3.29 0.00 0.00 -0.02 0.00 0.00 31.44 28.64 2bye n GLU 96 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2bye n GLU 97 N 6.69 -1.60 -3.91 3.49 4.71 -1.26 -4.91 120.64 123.85 2bye n GLU 97 Ca 0.51 0.40 -0.29 0.00 -0.01 0.00 0.00 57.16 57.77 2bye n GLU 97 Cb 0.41 -4.69 -0.13 0.00 -1.01 0.00 0.00 31.44 26.02 2bye n GLU 97 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2bye s GLY 98 N -2.00 2.74 -0.23 0.62 0.00 -1.26 -4.90 107.32 102.30 2bye s GLY 98 Ca 0.00 -3.60 0.11 0.00 0.00 0.00 0.00 44.72 41.22 2bye s GLY 98 CO 0.00 1.06 1.60 1.58 0.00 0.00 0.00 173.10 177.33 2bye n TYR 99 N 2.48 1.91 -3.12 1.90 0.18 -1.26 -4.51 117.16 114.73 2bye n TYR 99 Ca 0.14 -0.77 -0.39 0.00 1.88 0.00 0.00 57.90 58.76 2bye n TYR 99 Cb 0.34 -0.51 -0.06 0.00 -0.38 0.00 0.00 39.34 38.73 2bye n TYR 99 CO 0.00 0.00 0.00 -1.64 -2.08 0.00 0.00 176.86 173.14 2bye s MET 100 N -2.55 4.37 0.00 -3.48 -1.94 -1.26 -4.99 119.30 109.46 2bye s MET 100 Ca 0.47 0.94 0.00 0.00 -1.71 0.00 0.00 55.69 55.39 2bye s MET 100 Cb 0.36 -3.21 0.00 0.00 2.01 0.00 0.00 34.83 33.99 2bye s MET 100 CO 0.13 0.58 0.00 0.41 -0.01 0.00 0.00 175.02 176.13 2bye n GLY 101 N 1.55 4.23 3.13 -0.03 0.00 -1.26 -4.86 105.19 107.96 2bye n GLY 101 Ca -0.07 -1.25 -0.12 0.00 0.00 0.00 0.00 46.02 44.58 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 -3.04 0.45 -0.22 1.61 1.70 -0.03 -4.89 118.95 114.54 2bye s ARG 102 Ca 0.00 -0.13 -0.15 0.00 -0.47 0.00 0.00 55.73 54.98 2bye s ARG 102 Cb 0.00 0.20 -0.04 0.00 -0.57 0.00 0.00 34.95 34.54 2bye s ARG 102 CO 0.00 -0.10 0.35 0.42 -1.08 0.00 0.00 175.30 174.89 2bye s ILE 103 N -0.89 5.22 -0.18 4.99 1.01 -1.25 -1.87 121.20 128.24 2bye s ILE 103 Ca -0.10 0.60 -0.07 0.00 0.00 0.00 0.00 60.65 61.08 2bye s ILE 103 Cb -0.05 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 2bye s ILE 103 CO 0.02 0.25 0.04 -0.69 0.00 0.00 0.00 174.94 174.56 2bye s VAL 104 N 1.37 4.60 -0.54 2.92 1.01 -0.92 -0.68 120.40 128.16 2bye s VAL 104 Ca 0.16 -0.10 -0.27 0.00 0.00 0.00 0.00 61.98 61.77 2bye s VAL 104 Cb -0.15 -3.07 -0.00 0.00 0.00 0.00 0.00 36.38 33.17 2bye s VAL 104 CO 0.08 0.46 1.62 -0.22 0.00 0.00 0.00 175.10 177.04 2bye s LEU 105 N 0.39 3.37 0.70 3.92 2.96 -1.26 -2.70 118.68 126.07 2bye s LEU 105 Ca 0.02 0.45 0.02 0.00 -0.22 0.00 0.00 54.13 54.39 2bye s LEU 105 Cb -0.13 -2.94 0.13 0.00 0.50 0.00 0.00 46.19 43.75 2bye s LEU 105 CO 0.01 -1.93 0.97 -0.54 -1.32 0.00 0.00 176.35 173.53 2bye s LYS 106 N 6.04 1.73 0.25 1.98 -0.14 0.13 -4.63 119.74 125.10 2bye s LYS 106 Ca 0.61 -1.29 0.06 0.00 -1.36 0.00 0.00 55.97 53.99 2bye s LYS 106 Cb -0.13 -2.39 -0.05 0.00 -1.68 0.00 0.00 37.83 33.57 2bye s LYS 106 CO 0.25 -1.39 -0.06 0.95 -0.76 0.00 0.00 175.35 174.34 2bye s THR 107 N -3.07 1.51 0.00 2.17 -4.23 -1.26 -2.15 115.64 108.61 2bye s THR 107 Ca 0.66 -2.12 -0.01 0.00 -1.18 0.00 0.00 61.69 59.05 2bye s THR 107 Cb -0.05 -2.34 -0.03 0.00 1.34 0.00 0.00 72.50 71.43 2bye s THR 107 CO 0.44 -0.37 1.41 0.00 -0.54 0.00 0.00 174.62 175.55 2bye n GLN 108 N -0.50 0.71 -1.69 3.99 1.13 -0.26 -4.84 117.38 115.92 2bye n GLN 108 Ca -0.06 -0.10 -0.45 0.00 -1.94 0.00 0.00 57.00 54.45 2bye n GLN 108 Cb 0.63 -1.30 -0.04 0.00 0.11 0.00 0.00 30.24 29.64 2bye n GLN 108 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2bye n GLN 109 N 1.87 2.39 0.00 -1.09 10.64 -1.26 -5.13 117.38 124.80 2bye n GLN 109 Ca 0.04 0.86 0.05 0.00 -1.83 0.00 0.00 57.00 56.13 2bye n GLN 109 Cb 0.34 -2.67 0.04 0.00 -0.86 0.00 0.00 30.24 27.10 2bye n GLN 109 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62