#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 0.00 -0.00 1.61 2.13 -1.26 -4.79 120.64 118.33 2bye n GLU 2 Ca 0.00 0.46 -0.00 0.00 0.66 0.00 0.00 57.16 58.28 2bye n GLU 2 Cb 0.00 -1.06 -0.00 0.00 0.27 0.00 0.00 31.44 30.65 2bye n GLU 2 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 2bye n GLU 3 N -1.88 3.92 -3.35 5.31 -0.00 -1.26 -5.05 120.64 118.33 2bye n GLU 3 Ca 0.00 -0.00 -0.22 0.00 -0.00 0.00 0.00 57.16 56.94 2bye n GLU 3 Cb 0.00 -1.00 -0.00 0.00 -0.00 0.00 0.00 31.44 30.44 2bye n GLU 3 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 2bye s ARG 4 N -2.00 3.26 -0.32 3.44 1.70 -1.26 -5.10 118.95 118.67 2bye s ARG 4 Ca -0.00 -0.60 -0.01 0.00 -0.47 0.00 0.00 55.73 54.65 2bye s ARG 4 Cb 0.00 -2.70 0.13 0.00 -0.57 0.00 0.00 34.95 31.81 2bye s ARG 4 CO 0.00 0.03 0.22 -1.59 -1.08 0.00 0.00 175.30 172.88 2bye s LYS 5 N -4.32 0.40 -0.35 3.89 0.00 -1.26 -2.83 119.74 115.28 2bye s LYS 5 Ca 0.43 -0.80 0.14 0.00 0.00 0.00 0.00 55.97 55.74 2bye s LYS 5 Cb -0.10 -1.07 0.45 0.00 0.00 0.00 0.00 37.83 37.12 2bye s LYS 5 CO 0.35 -1.11 1.02 0.00 0.00 0.00 0.00 175.35 175.60 2bye s LEU 7 N -3.34 3.63 -1.42 0.00 2.01 -1.26 -4.23 118.68 114.07 2bye s LEU 7 Ca 0.34 1.02 -0.08 0.00 0.01 0.00 0.00 54.13 55.41 2bye s LEU 7 Cb 0.43 -3.97 0.02 0.00 0.01 0.00 0.00 46.19 42.68 2bye s LEU 7 CO -0.03 -0.57 1.03 0.00 1.01 0.00 0.00 176.35 177.79 2bye n GLN 8 N -2.10 -7.04 -2.81 1.70 6.02 -1.26 -0.13 117.38 111.76 2bye n GLN 8 Ca 0.01 0.83 -0.43 0.00 -0.01 0.00 0.00 57.00 57.40 2bye n GLN 8 Cb 0.55 -5.82 -0.04 0.00 1.02 0.00 0.00 30.24 25.95 2bye n GLN 8 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2bye s THR 9 N -3.28 4.25 -0.13 5.09 -4.23 -1.26 -3.46 115.64 112.61 2bye s THR 9 Ca 0.53 -0.30 -0.04 0.00 -1.18 0.00 0.00 61.69 60.70 2bye s THR 9 Cb -0.24 -4.73 -0.03 0.00 1.34 0.00 0.00 72.50 68.84 2bye s THR 9 CO 0.65 -1.52 0.00 -1.00 -0.54 0.00 0.00 174.62 172.21 2bye s HIS 10 N 4.27 3.13 0.04 3.99 3.76 -1.14 -4.83 115.29 124.51 2bye s HIS 10 Ca 0.25 -0.02 -0.18 0.00 -0.15 0.00 0.00 55.06 54.96 2bye s HIS 10 Cb -0.15 -1.92 -0.06 0.00 1.11 0.00 0.00 32.58 31.56 2bye s HIS 10 CO 0.10 0.21 0.51 0.50 -0.85 0.00 0.00 174.74 175.21 2bye s ARG 11 N -0.12 4.11 -0.19 1.40 3.52 -1.26 -0.24 118.95 126.18 2bye s ARG 11 Ca 0.04 0.62 0.01 0.00 -0.13 0.00 0.00 55.73 56.28 2bye s ARG 11 Cb -0.13 -3.24 0.03 0.00 -1.56 0.00 0.00 34.95 30.05 2bye s ARG 11 CO 0.02 0.64 -0.16 0.54 -0.81 0.00 0.00 175.30 175.53 2bye s VAL 12 N -1.04 1.91 -0.13 7.11 0.11 -0.64 -4.92 120.40 122.81 2bye s VAL 12 Ca 0.27 -0.98 -0.29 0.00 -2.93 0.00 0.00 61.98 58.05 2bye s VAL 12 Cb -0.18 -1.81 -0.02 0.00 -1.53 0.00 0.00 36.38 32.83 2bye s VAL 12 CO 0.17 0.39 1.28 -0.89 -3.33 0.00 0.00 175.10 172.72 2bye s THR 13 N 1.32 4.20 -0.17 5.04 2.01 -1.26 -2.36 115.64 124.42 2bye s THR 13 Ca 0.02 1.48 -0.08 0.00 0.31 0.00 0.00 61.69 63.42 2bye s THR 13 Cb -0.14 -3.95 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 2bye s THR 13 CO -0.11 -0.10 0.10 -0.69 -0.69 0.00 0.00 174.62 173.13 2bye s VAL 14 N 3.22 5.10 -0.69 3.82 1.01 0.77 -4.33 120.40 129.29 2bye s VAL 14 Ca 0.57 0.07 0.21 0.00 0.00 0.00 0.00 61.98 62.83 2bye s VAL 14 Cb -0.23 -3.29 -0.26 0.00 0.00 0.00 0.00 36.38 32.60 2bye s VAL 14 CO 0.18 0.49 0.76 1.41 0.00 0.00 0.00 175.10 177.94 2bye n HIS 15 N 3.19 0.00 -1.30 5.22 8.25 0.66 -1.27 115.22 129.96 2bye n HIS 15 Ca -0.17 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.29 2bye n HIS 15 Cb 0.53 -0.15 0.21 0.00 1.12 0.00 0.00 29.99 31.70 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 1.43 4.65 3.51 -1.41 0.00 -1.24 -4.67 105.19 107.45 2bye n GLY 16 Ca 0.02 -1.17 -0.34 0.00 0.00 0.00 0.00 46.02 44.52 2bye n GLY 16 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bye n VAL 17 N -0.96 1.28 0.20 1.61 0.24 -1.26 -4.02 118.33 115.41 2bye n VAL 17 Ca 0.29 -0.28 0.09 0.00 -2.04 0.00 0.00 64.34 62.41 2bye n VAL 17 Cb 0.99 -0.83 0.28 0.00 -1.47 0.00 0.00 33.84 32.81 2bye n VAL 17 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2bye h PRO 18 N -0.90 0.00 -7.21 7.34 0.13 -1.91 -3.46 132.00 125.99 2bye h PRO 18 Ca -0.45 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.26 2bye h PRO 18 Cb 1.31 0.00 0.20 0.00 0.13 0.00 0.00 31.00 32.64 2bye h PRO 18 CO 0.41 0.21 0.03 0.20 -0.23 0.00 0.00 178.00 178.63 2bye s GLY 19 N -4.30 1.52 0.35 1.56 0.00 -1.26 -4.94 107.32 100.25 2bye s GLY 19 Ca 0.03 -0.50 0.18 0.00 0.00 0.00 0.00 44.72 44.44 2bye s GLY 19 CO 0.67 0.30 1.66 -0.56 0.00 0.00 0.00 173.10 175.17 2bye h PRO 20 N -2.68 0.00 -7.16 2.90 0.13 -2.03 -3.45 132.00 119.71 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 1.33 0.00 0.17 0.00 0.13 0.00 0.00 31.00 32.63 2bye h PRO 20 CO 0.45 0.40 0.43 0.39 -0.23 0.00 0.00 178.00 179.43 2bye n GLU 21 N -3.42 0.65 0.13 0.86 1.02 -1.26 -4.94 120.64 113.67 2bye n GLU 21 Ca 0.00 0.29 -0.21 0.00 -0.02 0.00 0.00 57.16 57.23 2bye n GLU 21 Cb 0.57 -2.49 -0.15 0.00 -0.02 0.00 0.00 31.44 29.35 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 -0.19 0.41 -2.76 3.49 0.11 -1.92 -3.44 132.00 127.70 2bye h PRO 22 Ca -0.49 -0.71 -0.13 0.00 0.11 0.00 0.00 66.00 64.78 2bye h PRO 22 Cb 1.32 0.26 -0.26 0.00 0.11 0.00 0.00 31.00 32.43 2bye h PRO 22 CO 0.49 1.34 -0.33 -0.59 -0.21 0.00 0.00 178.00 178.71 2bye s PHE 23 N -2.63 -0.50 -0.00 0.65 -0.71 -1.26 -4.45 117.98 109.08 2bye s PHE 23 Ca -0.07 1.12 -0.18 0.00 -1.04 0.00 0.00 56.93 56.76 2bye s PHE 23 Cb 0.05 0.19 0.03 0.00 -1.21 0.00 0.00 43.02 42.09 2bye s PHE 23 CO 0.92 -0.28 0.38 -0.08 -1.34 0.00 0.00 175.22 174.82 2bye s THR 24 N 1.04 0.05 -0.15 -4.49 -1.32 -0.40 -4.94 115.64 105.42 2bye s THR 24 Ca -0.07 -0.42 -0.02 0.00 -1.21 0.00 0.00 61.69 59.97 2bye s THR 24 Cb -0.07 -0.78 -0.02 0.00 -1.51 0.00 0.00 72.50 70.13 2bye s THR 24 CO -0.08 -0.23 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.32 2bye s VAL 25 N -1.67 3.39 -0.01 5.08 1.01 -1.26 -0.17 120.40 126.77 2bye s VAL 25 Ca -0.11 -0.53 0.05 0.00 0.00 0.00 0.00 61.98 61.39 2bye s VAL 25 Cb -0.03 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 2bye s VAL 25 CO 0.03 0.50 -0.14 -0.36 0.00 0.00 0.00 175.10 175.14 2bye s PHE 26 N 0.48 2.70 0.11 5.22 0.40 -0.99 -4.85 117.98 121.05 2bye s PHE 26 Ca -0.07 -0.16 -0.24 0.00 -0.60 0.00 0.00 56.93 55.86 2bye s PHE 26 Cb -0.15 -1.57 -0.07 0.00 0.51 0.00 0.00 43.02 41.74 2bye s PHE 26 CO 0.04 0.26 0.73 0.99 0.70 0.00 0.00 175.22 177.93 2bye s THR 27 N -0.86 4.56 0.45 0.64 2.01 -1.26 -1.61 115.64 119.56 2bye s THR 27 Ca 0.14 1.57 0.07 0.00 0.31 0.00 0.00 61.69 63.78 2bye s THR 27 Cb -0.11 -4.08 -0.01 0.00 0.01 0.00 0.00 72.50 68.32 2bye s THR 27 CO 0.04 0.48 0.37 0.27 -0.69 0.00 0.00 174.62 175.09 2bye s ILE 28 N -0.80 2.35 -0.17 1.82 -5.25 0.67 -4.94 121.20 114.88 2bye s ILE 28 Ca 0.35 -1.42 -0.21 0.00 -0.99 0.00 0.00 60.65 58.38 2bye s ILE 28 Cb -0.22 -2.77 0.05 0.00 2.95 0.00 0.00 42.46 42.48 2bye s ILE 28 CO 0.24 0.00 0.57 0.54 -1.79 0.00 0.00 174.94 174.49 2bye s ASN 29 N -4.15 -0.57 -1.35 4.36 2.20 -1.26 -2.89 114.94 111.28 2bye s ASN 29 Ca 0.44 0.98 0.00 0.00 -0.94 0.00 0.00 52.86 53.34 2bye s ASN 29 Cb -0.02 0.98 0.00 0.00 -2.00 0.00 0.00 41.25 40.21 2bye s ASN 29 CO 0.26 -0.29 0.00 0.61 -2.94 0.00 0.00 177.10 174.74 2bye n GLY 30 N 2.30 1.33 2.03 0.45 0.00 0.82 -3.55 105.19 108.58 2bye n GLY 30 Ca -0.15 -0.29 -0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.04 -0.67 3.76 -0.02 0.00 -1.25 -5.01 105.19 100.96 2bye n GLY 31 Ca -0.13 0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.76 3.82 0.85 2.61 -4.23 -1.23 -5.05 115.64 109.65 2bye s THR 32 Ca 0.01 1.69 -0.09 0.00 -1.18 0.00 0.00 61.69 62.12 2bye s THR 32 Cb -0.00 -4.02 0.16 0.00 1.34 0.00 0.00 72.50 69.97 2bye s THR 32 CO 0.26 0.30 1.18 -1.59 -0.54 0.00 0.00 174.62 174.23 2bye s LYS 33 N -1.66 1.15 0.50 3.99 -2.85 -1.26 -4.34 119.74 115.27 2bye s LYS 33 Ca 0.47 -0.67 0.28 0.00 -1.00 0.00 0.00 55.97 55.05 2bye s LYS 33 Cb -0.26 -2.05 1.20 0.00 -2.06 0.00 0.00 37.83 34.65 2bye s LYS 33 CO 0.33 -1.96 1.93 0.00 0.10 0.00 0.00 175.35 175.75 2bye h ALA 34 N -1.14 1.05 0.01 0.59 0.00 -1.78 -1.91 119.26 116.08 2bye h ALA 34 Ca -0.41 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 2bye h ALA 34 Cb 1.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2bye h ALA 34 CO 0.41 0.16 -0.10 1.57 0.00 0.00 0.00 179.25 181.28 2bye h LYS 35 N 0.00 0.03 0.00 0.00 2.10 -1.88 0.22 116.57 117.04 2bye h LYS 35 Ca -0.00 -0.05 -0.01 0.00 -2.00 0.00 0.00 60.65 58.59 2bye h LYS 35 Cb 0.58 0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.93 2bye h LYS 35 CO 0.02 1.03 -0.03 0.37 -2.00 0.00 0.00 179.45 178.83 2bye h GLN 36 N -0.93 0.00 0.08 0.07 5.75 -1.95 -2.07 115.11 116.06 2bye h GLN 36 Ca -0.02 0.00 -0.29 0.00 -0.15 0.00 0.00 58.65 58.19 2bye h GLN 36 Cb 1.07 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.60 2bye h GLN 36 CO 0.01 0.03 -1.52 1.25 -2.65 0.00 0.00 178.83 175.95 2bye h LEU 37 N 0.00 0.26 -1.35 -2.39 7.12 -1.27 -2.76 115.31 114.92 2bye h LEU 37 Ca -0.00 -0.39 0.14 0.00 0.13 0.00 0.00 57.88 57.76 2bye h LEU 37 Cb 0.09 -0.09 -0.07 0.00 -0.53 0.00 0.00 40.66 40.07 2bye h LEU 37 CO 0.00 1.33 0.56 0.25 -0.13 0.00 0.00 178.44 180.45 2bye h LEU 38 N 0.05 0.60 0.21 2.25 7.12 0.16 0.22 115.31 125.92 2bye h LEU 38 Ca -0.23 0.04 0.01 0.00 0.13 0.00 0.00 57.88 57.83 2bye h LEU 38 Cb 1.98 -0.08 -0.03 0.00 -0.53 0.00 0.00 40.66 42.00 2bye h LEU 38 CO 0.14 0.31 -0.33 -0.61 -0.13 0.00 0.00 178.44 177.82 2bye h GLN 39 N 0.64 -0.59 -0.53 1.25 4.15 -1.51 0.22 115.11 118.75 2bye h GLN 39 Ca 0.43 0.04 0.13 0.00 0.77 0.00 0.00 58.65 60.02 2bye h GLN 39 Cb 0.74 0.13 -0.03 0.00 0.21 0.00 0.00 27.48 28.54 2bye h GLN 39 CO -0.19 -0.39 0.37 1.96 -1.93 0.00 0.00 178.83 178.65 2bye h GLN 40 N -0.61 0.14 0.09 1.69 1.08 -0.41 0.31 115.11 117.40 2bye h GLN 40 Ca 0.01 -0.01 -0.27 0.00 -1.45 0.00 0.00 58.65 56.93 2bye h GLN 40 Cb 0.60 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 28.01 2bye h GLN 40 CO -0.13 0.09 -1.15 0.82 -0.95 0.00 0.00 178.83 177.51 2bye h ILE 41 N 0.15 1.39 -0.04 2.54 5.03 -0.35 -3.07 117.51 123.16 2bye h ILE 41 Ca 0.25 -2.65 -0.02 0.00 -0.12 0.00 0.00 64.86 62.32 2bye h ILE 41 Cb 0.79 2.69 -0.00 0.00 -3.03 0.00 0.00 36.82 37.27 2bye h ILE 41 CO -0.03 0.79 -0.08 -0.07 -0.68 0.00 0.00 178.15 178.07 2bye h LEU 42 N 0.19 0.05 -8.29 1.44 3.38 0.16 -3.43 115.31 108.81 2bye h LEU 42 Ca -0.14 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.69 2bye h LEU 42 Cb 1.83 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 42.54 2bye h LEU 42 CO 0.20 0.14 0.63 0.41 0.09 0.00 0.00 178.44 179.92 2bye n THR 43 N -4.41 -0.01 0.73 0.22 -1.04 0.88 -4.68 114.28 105.98 2bye n THR 43 Ca -0.02 -0.52 0.12 0.00 -2.04 0.00 0.00 64.05 61.59 2bye n THR 43 Cb 0.18 -1.64 0.48 0.00 -1.82 0.00 0.00 70.33 67.53 2bye n THR 43 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2bye n ASN 44 N 15.62 0.20 -0.25 8.00 3.02 -1.26 -4.91 115.26 135.67 2bye n ASN 44 Ca 0.51 0.53 -0.03 0.00 -0.03 0.00 0.00 54.58 55.56 2bye n ASN 44 Cb 0.37 -0.58 -0.01 0.00 -0.61 0.00 0.00 39.78 38.95 2bye n ASN 44 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2bye n GLU 45 N -1.70 -0.22 0.00 3.52 -0.58 -1.26 -4.97 120.64 115.43 2bye n GLU 45 Ca 0.05 0.53 0.00 0.00 -0.42 0.00 0.00 57.16 57.32 2bye n GLU 45 Cb 0.29 -4.16 0.00 0.00 -0.57 0.00 0.00 31.44 27.00 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 -2.63 0.00 0.00 3.49 1.13 -1.26 -4.59 117.38 113.52 2bye n GLN 46 Ca -0.03 0.00 0.05 0.00 -1.94 0.00 0.00 57.00 55.08 2bye n GLN 46 Cb 0.17 0.00 0.30 0.00 0.11 0.00 0.00 30.24 30.82 2bye n GLN 46 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2bye n ASP 47 N 0.00 0.00 -1.27 1.08 9.92 -1.26 -4.85 116.55 120.17 2bye n ASP 47 Ca 0.00 -1.51 -0.15 0.00 -0.53 0.00 0.00 54.79 52.60 2bye n ASP 47 Cb 0.00 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.42 2bye n ASP 47 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 2bye n ILE 48 N -0.67 0.00 -3.46 0.53 5.41 -1.26 -4.90 119.36 115.01 2bye n ILE 48 Ca 0.08 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.56 2bye n ILE 48 Cb 0.03 -1.52 -0.09 0.00 -0.71 0.00 0.00 39.64 37.36 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 -1.68 1.99 0.00 0.38 5.02 -1.26 -4.77 118.16 117.84 2bye n LYS 49 Ca -0.15 -4.32 0.00 0.00 -2.02 0.00 0.00 58.31 51.82 2bye n LYS 49 Cb 0.54 -2.05 0.00 0.00 -0.02 0.00 0.00 35.03 33.50 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 1.21 0.22 -3.21 1.97 -0.02 -1.26 -4.92 135.00 128.99 2bye n PRO 50 Ca 0.27 0.00 -0.45 0.00 -2.02 0.00 0.00 63.50 61.30 2bye n PRO 50 Cb 0.42 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.90 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 -0.45 5.56 -0.65 -1.45 1.01 -1.26 -5.00 120.40 118.16 2bye s VAL 51 Ca 0.00 -2.78 -0.27 0.00 0.00 0.00 0.00 61.98 58.93 2bye s VAL 51 Cb 0.00 -4.65 0.01 0.00 0.00 0.00 0.00 36.38 31.74 2bye s VAL 51 CO 0.00 -1.26 1.54 0.42 0.00 0.00 0.00 175.10 175.79 2bye s THR 52 N 0.16 3.59 0.00 3.92 -4.23 -1.26 -4.90 115.64 112.92 2bye s THR 52 Ca 0.30 0.38 0.00 0.00 -1.18 0.00 0.00 61.69 61.19 2bye s THR 52 Cb -0.08 -4.43 0.00 0.00 1.34 0.00 0.00 72.50 69.33 2bye s THR 52 CO -0.07 -1.34 0.00 1.07 -0.54 0.00 0.00 174.62 173.74 2bye n THR 53 N 6.81 0.00 0.14 3.99 5.66 -1.26 -4.96 114.28 124.65 2bye n THR 53 Ca 0.12 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 61.12 2bye n THR 53 Cb 0.50 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.31 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 8.00 -1.26 -4.81 116.55 114.81 2bye n ASP 54 Ca 0.00 -0.11 -0.39 0.00 0.71 0.00 0.00 54.79 55.00 2bye n ASP 54 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.10 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 -2.00 2.76 0.27 1.24 2.02 -1.26 -0.39 117.35 119.99 2bye s TYR 55 Ca 0.02 1.39 -0.10 0.00 -0.37 0.00 0.00 57.07 58.01 2bye s TYR 55 Cb 0.01 -3.70 -0.00 0.00 -0.40 0.00 0.00 41.96 37.86 2bye s TYR 55 CO 0.01 -2.21 0.46 -0.59 -1.57 0.00 0.00 175.55 171.66 2bye s PHE 56 N -1.26 0.57 0.39 2.71 -0.71 -0.92 -4.89 117.98 113.87 2bye s PHE 56 Ca 0.58 -0.90 0.07 0.00 -1.04 0.00 0.00 56.93 55.64 2bye s PHE 56 Cb -0.39 0.10 -0.00 0.00 -1.21 0.00 0.00 43.02 41.52 2bye s PHE 56 CO 0.50 -1.02 0.49 -0.51 -1.34 0.00 0.00 175.22 173.33 2bye s LEU 57 N -3.08 3.71 -0.18 -1.99 1.02 -1.26 0.33 118.68 117.24 2bye s LEU 57 Ca 0.25 -0.41 -0.22 0.00 0.02 0.00 0.00 54.13 53.78 2bye s LEU 57 Cb -0.00 -2.56 0.06 0.00 0.02 0.00 0.00 46.19 43.71 2bye s LEU 57 CO 0.12 -0.61 0.58 -0.04 0.02 0.00 0.00 176.35 176.42 2bye s MET 58 N -4.23 0.74 -0.38 1.70 -1.94 -0.73 0.62 119.30 115.07 2bye s MET 58 Ca 0.50 0.64 -0.22 0.00 -1.71 0.00 0.00 55.69 54.90 2bye s MET 58 Cb -0.08 0.36 0.01 0.00 2.01 0.00 0.00 34.83 37.12 2bye s MET 58 CO 0.31 -0.13 0.73 -1.21 -0.01 0.00 0.00 175.02 174.71 2bye s GLU 59 N -0.06 3.62 -0.11 2.03 0.41 0.24 -0.45 118.70 124.37 2bye s GLU 59 Ca -0.03 0.09 0.01 0.00 -0.41 0.00 0.00 54.97 54.63 2bye s GLU 59 Cb -0.04 -3.85 -0.02 0.00 -1.78 0.00 0.00 34.13 28.45 2bye s GLU 59 CO 0.03 -0.88 -0.12 -2.00 -0.49 0.00 0.00 175.26 171.79 2bye s GLU 60 N 2.99 3.17 -0.36 1.61 2.12 0.31 -1.30 118.70 127.24 2bye s GLU 60 Ca 0.28 -0.67 -0.06 0.00 0.36 0.00 0.00 54.97 54.89 2bye s GLU 60 Cb -0.13 -2.59 0.06 0.00 0.26 0.00 0.00 34.13 31.73 2bye s GLU 60 CO 0.18 0.33 0.14 0.15 -0.54 0.00 0.00 175.26 175.52 2bye s LYS 61 N 0.04 2.46 -0.46 4.30 3.01 -1.26 -2.85 119.74 124.97 2bye s LYS 61 Ca -0.04 -1.39 0.07 0.00 -1.01 0.00 0.00 55.97 53.59 2bye s LYS 61 Cb -0.14 -3.51 0.26 0.00 -1.01 0.00 0.00 37.83 33.43 2bye s LYS 61 CO 0.04 -0.81 0.87 0.98 0.51 0.00 0.00 175.35 176.94 2bye n TYR 62 N 4.76 -2.60 -0.79 3.18 4.19 -1.26 -4.79 117.16 119.85 2bye n TYR 62 Ca -0.10 -2.22 0.00 0.00 3.31 0.00 0.00 57.90 58.89 2bye n TYR 62 Cb 0.43 1.17 0.00 0.00 0.49 0.00 0.00 39.34 41.43 2bye n TYR 62 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 2bye n PHE 63 N 1.29 0.00 0.63 2.98 7.35 -1.26 -4.77 117.46 123.67 2bye n PHE 63 Ca 0.11 -0.04 0.10 0.00 -0.76 0.00 0.00 57.45 56.86 2bye n PHE 63 Cb 0.63 -0.00 0.13 0.00 0.35 0.00 0.00 39.48 40.58 2bye n PHE 63 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 2bye n ILE 64 N -0.04 0.20 0.00 -2.13 5.41 -1.26 -4.98 119.36 116.56 2bye n ILE 64 Ca 0.00 -0.60 0.00 0.00 1.00 0.00 0.00 62.75 63.15 2bye n ILE 64 Cb 0.29 1.25 0.00 0.00 -0.71 0.00 0.00 39.64 40.47 2bye n ILE 64 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2bye n SER 65 N 1.21 0.00 -3.60 4.38 7.64 -1.26 -4.56 113.62 117.43 2bye n SER 65 Ca 0.14 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.98 2bye n SER 65 Cb 0.53 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 2bye n SER 65 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2bye s LYS 66 N 0.00 0.30 0.26 1.43 2.20 -1.26 -5.09 119.74 117.58 2bye s LYS 66 Ca 0.00 -0.11 -0.02 0.00 -0.36 0.00 0.00 55.97 55.48 2bye s LYS 66 Cb 0.00 0.14 0.06 0.00 -1.51 0.00 0.00 37.83 36.52 2bye s LYS 66 CO 0.00 -0.13 0.35 -0.85 -0.36 0.00 0.00 175.35 174.36 2bye n GLU 67 N -0.06 0.03 -0.05 4.03 0.00 -1.26 -5.05 120.64 118.28 2bye n GLU 67 Ca 0.00 -0.74 -0.00 0.00 0.00 0.00 0.00 57.16 56.43 2bye n GLU 67 Cb 0.58 -0.30 -0.00 0.00 0.00 0.00 0.00 31.44 31.72 2bye n GLU 67 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 2bye h LYS 68 N 0.00 0.00 -4.11 3.44 1.79 -2.02 -3.49 116.57 112.18 2bye h LYS 68 Ca -0.11 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.25 2bye h LYS 68 Cb 0.37 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 30.87 2bye h LYS 68 CO 0.10 0.00 -0.59 0.54 -1.08 0.00 0.00 179.45 178.42 2bye s ASN 69 N -5.52 0.38 0.43 0.86 2.20 -1.26 -5.15 114.94 106.88 2bye s ASN 69 Ca -0.00 -0.90 -0.21 0.00 -0.94 0.00 0.00 52.86 50.81 2bye s ASN 69 Cb 0.00 0.24 -0.10 0.00 -2.00 0.00 0.00 41.25 39.39 2bye s ASN 69 CO 0.00 -0.64 0.97 -0.70 -2.94 0.00 0.00 177.10 173.79 2bye s GLU 70 N -3.90 4.18 0.00 3.55 -6.30 -1.26 -4.89 118.70 110.08 2bye s GLU 70 Ca 0.06 1.20 0.00 0.00 -2.50 0.00 0.00 54.97 53.73 2bye s GLU 70 Cb 0.07 -2.23 0.00 0.00 0.00 0.00 0.00 34.13 31.97 2bye s GLU 70 CO -0.10 -0.08 0.00 0.00 0.02 0.00 0.00 175.26 175.09 2bye n ARG 72 N -1.39 0.00 -2.14 0.00 0.63 -1.26 -5.13 116.66 107.37 2bye n ARG 72 Ca 0.00 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.55 2bye n ARG 72 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2bye n ARG 72 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2bye s LYS 73 N -1.04 3.69 0.03 -0.14 0.00 -1.26 -5.04 119.74 115.97 2bye s LYS 73 Ca 0.00 1.92 0.02 0.00 0.00 0.00 0.00 55.97 57.91 2bye s LYS 73 Cb 0.00 -2.44 -0.02 0.00 0.00 0.00 0.00 37.83 35.37 2bye s LYS 73 CO 0.00 -0.65 -0.07 -0.65 0.00 0.00 0.00 175.35 173.98 2bye s GLN 74 N -2.65 0.50 -1.16 1.78 -0.21 -1.26 -5.03 119.66 111.64 2bye s GLN 74 Ca 0.64 -0.59 -0.22 0.00 0.02 0.00 0.00 55.36 55.20 2bye s GLN 74 Cb -0.32 -0.33 -0.06 0.00 1.00 0.00 0.00 33.01 33.30 2bye s GLN 74 CO 0.39 0.07 1.91 -2.14 -2.12 0.00 0.00 175.29 173.40 2bye s PRO 75 N -1.16 2.67 -0.67 2.91 0.02 -1.26 -4.91 135.00 132.61 2bye s PRO 75 Ca -0.06 -1.14 -0.24 0.00 0.02 0.00 0.00 61.00 59.58 2bye s PRO 75 Cb -0.08 -5.25 0.06 0.00 0.02 0.00 0.00 34.50 29.25 2bye s PRO 75 CO 0.00 -3.70 1.03 0.12 -0.33 0.00 0.00 177.00 174.12 2bye s PHE 76 N 10.10 2.60 -0.30 6.54 5.36 -1.26 -4.86 117.98 136.16 2bye s PHE 76 Ca 0.67 -0.42 -0.25 0.00 -0.96 0.00 0.00 56.93 55.97 2bye s PHE 76 Cb -0.01 -4.35 0.00 0.00 -0.34 0.00 0.00 43.02 38.32 2bye s PHE 76 CO 0.10 -1.72 0.87 -0.65 -1.46 0.00 0.00 175.22 172.36 2bye s GLN 77 N 4.41 4.03 -0.29 10.12 1.11 -1.26 -4.51 119.66 133.26 2bye s GLN 77 Ca 0.25 0.78 -0.06 0.00 0.01 0.00 0.00 55.36 56.34 2bye s GLN 77 Cb -0.15 -3.71 0.01 0.00 -1.01 0.00 0.00 33.01 28.15 2bye s GLN 77 CO 0.12 -0.70 0.07 0.50 0.01 0.00 0.00 175.29 175.28 2bye s ARG 78 N 3.11 3.08 0.35 2.91 6.06 -0.42 -4.94 118.95 129.09 2bye s ARG 78 Ca 0.36 -0.86 -0.28 0.00 -2.50 0.00 0.00 55.73 52.45 2bye s ARG 78 Cb -0.14 -3.35 -0.09 0.00 0.06 0.00 0.00 34.95 31.43 2bye s ARG 78 CO 0.12 -0.44 1.23 0.00 -2.50 0.00 0.00 175.30 173.71 2bye s ALA 79 N 1.49 3.36 -0.31 6.12 0.00 -1.26 -0.59 121.76 130.57 2bye s ALA 79 Ca 0.02 1.10 -0.18 0.00 0.00 0.00 0.00 51.96 52.91 2bye s ALA 79 Cb -0.17 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.51 2bye s ALA 79 CO 0.02 -0.53 0.51 0.42 0.00 0.00 0.00 175.76 176.18 2bye s ILE 80 N -1.23 5.05 0.04 0.00 -1.09 0.20 -4.92 121.20 119.25 2bye s ILE 80 Ca 0.51 0.58 0.00 0.00 -2.23 0.00 0.00 60.65 59.52 2bye s ILE 80 Cb -0.36 -3.89 -0.04 0.00 -1.58 0.00 0.00 42.46 36.59 2bye s ILE 80 CO 0.46 -0.07 0.13 -0.83 -1.23 0.00 0.00 174.94 173.40 2bye s GLY 81 N 1.67 2.08 0.58 6.18 0.00 -1.26 -4.07 107.32 112.50 2bye s GLY 81 Ca 0.20 -0.89 0.30 0.00 0.00 0.00 0.00 44.72 44.33 2bye s GLY 81 CO 0.11 -0.83 1.78 -2.55 0.00 0.00 0.00 173.10 171.62 2bye h PRO 82 N 3.55 0.00 -0.68 2.90 0.11 -1.97 0.19 132.00 136.11 2bye h PRO 82 Ca -0.47 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.72 2bye h PRO 82 Cb 1.17 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.21 2bye h PRO 82 CO 0.68 0.00 0.34 0.93 -0.21 0.00 0.00 178.00 179.74 2bye h GLU 83 N 0.00 0.57 -6.24 1.05 4.39 -2.00 -3.41 114.58 108.95 2bye h GLU 83 Ca 0.35 -0.03 -0.55 0.00 0.34 0.00 0.00 59.36 59.47 2bye h GLU 83 Cb 1.73 -0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 30.22 2bye h GLU 83 CO -0.00 0.38 0.28 -1.21 -1.16 0.00 0.00 179.01 177.29 2bye s GLU 84 N -6.07 4.49 -0.13 2.33 2.02 0.68 -5.03 118.70 116.99 2bye s GLU 84 Ca -0.13 1.20 -0.03 0.00 0.02 0.00 0.00 54.97 56.03 2bye s GLU 84 Cb 0.17 -3.47 -0.03 0.00 0.10 0.00 0.00 34.13 30.91 2bye s GLU 84 CO 0.76 -0.04 -0.01 -1.21 0.02 0.00 0.00 175.26 174.78 2bye s GLU 85 N 1.04 3.47 0.35 1.61 2.02 -1.26 -4.10 118.70 121.83 2bye s GLU 85 Ca 0.46 -0.47 0.04 0.00 0.02 0.00 0.00 54.97 55.02 2bye s GLU 85 Cb -0.19 -2.90 0.65 0.00 0.10 0.00 0.00 34.13 31.79 2bye s GLU 85 CO 0.23 0.40 1.96 -0.84 0.02 0.00 0.00 175.26 177.03 2bye h ILE 86 N 4.78 1.17 0.00 -1.63 3.07 -1.87 -0.21 117.51 122.81 2bye h ILE 86 Ca -0.38 -0.49 -0.03 0.00 1.55 0.00 0.00 64.86 65.51 2bye h ILE 86 Cb 1.19 0.58 -0.00 0.00 -0.27 0.00 0.00 36.82 38.31 2bye h ILE 86 CO 0.61 0.20 -0.12 0.24 -1.05 0.00 0.00 178.15 178.03 2bye h MET 87 N 0.66 0.00 0.04 0.16 2.86 -1.95 0.75 114.93 117.44 2bye h MET 87 Ca 0.16 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.58 2bye h MET 87 Cb 0.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 2bye h MET 87 CO -0.02 0.12 -1.02 1.96 1.06 0.00 0.00 176.91 179.01 2bye h GLN 88 N 0.00 0.13 -0.11 1.72 4.20 -1.43 -2.30 115.11 117.32 2bye h GLN 88 Ca -0.00 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.49 2bye h GLN 88 Cb 0.31 0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 2bye h GLN 88 CO 0.02 1.03 -0.02 0.82 -0.67 0.00 0.00 178.83 180.01 2bye h ILE 89 N 0.05 1.28 0.00 2.54 1.08 -0.53 0.97 117.51 122.90 2bye h ILE 89 Ca -0.05 -0.91 -0.04 0.00 -0.39 0.00 0.00 64.86 63.46 2bye h ILE 89 Cb 1.72 1.66 -0.01 0.00 -3.07 0.00 0.00 36.82 37.13 2bye h ILE 89 CO 0.15 0.26 -0.21 -0.07 -0.69 0.00 0.00 178.15 177.59 2bye h LEU 90 N -0.09 0.00 -0.40 1.44 -0.00 -1.01 -1.00 115.31 114.25 2bye h LEU 90 Ca 0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.80 2bye h LEU 90 Cb 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.06 2bye h LEU 90 CO 0.01 0.21 -0.54 0.28 -0.00 0.00 0.00 178.44 178.40 2bye h SER 91 N 0.00 0.00 -0.28 -0.43 0.02 -1.09 -3.09 113.55 108.68 2bye h SER 91 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2bye h SER 91 Cb 0.48 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.02 2bye h SER 91 CO 0.03 0.54 0.00 -0.24 -1.14 0.00 0.00 176.83 176.01 2bye n SER 92 N -3.39 3.24 0.00 3.07 2.88 0.31 -4.35 113.62 115.38 2bye n SER 92 Ca 0.01 -2.44 0.00 0.00 -1.33 0.00 0.00 58.87 55.11 2bye n SER 92 Cb 0.67 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 2bye n SER 92 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 2bye n TRP 93 N 0.31 0.00 -1.65 0.66 -0.00 -1.06 -5.01 117.44 110.68 2bye n TRP 93 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.63 2bye n TRP 93 Cb 0.70 -0.35 0.00 0.00 -0.00 0.00 0.00 31.31 31.66 2bye n TRP 93 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 2bye n PHE 94 N -1.54 -3.74 -0.32 5.87 3.72 -1.26 -4.28 117.46 115.91 2bye n PHE 94 Ca 0.00 2.23 -0.04 0.00 -0.05 0.00 0.00 57.45 59.59 2bye n PHE 94 Cb 0.00 -3.27 0.04 0.00 -0.94 0.00 0.00 39.48 35.31 2bye n PHE 94 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 2bye n PRO 95 N 1.33 -1.86 0.00 -1.08 -0.02 -1.26 -2.82 135.00 129.30 2bye n PRO 95 Ca 0.00 -0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.24 2bye n PRO 95 Cb 0.00 -0.26 0.00 0.00 -0.02 0.00 0.00 33.50 33.22 2bye n PRO 95 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2bye n GLU 96 N -2.27 0.00 -0.10 -0.52 2.13 -1.26 -3.76 120.64 114.86 2bye n GLU 96 Ca 0.02 0.00 -0.20 0.00 0.66 0.00 0.00 57.16 57.64 2bye n GLU 96 Cb 0.09 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.73 2bye n GLU 96 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2bye n GLU 97 N 0.00 0.48 -1.20 5.31 1.02 -1.26 -4.62 120.64 120.36 2bye n GLU 97 Ca 0.00 0.20 -0.24 0.00 -0.02 0.00 0.00 57.16 57.11 2bye n GLU 97 Cb 0.00 -1.31 0.01 0.00 -0.02 0.00 0.00 31.44 30.13 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 1.62 4.53 0.31 0.62 0.00 -1.13 -4.53 105.19 106.60 2bye n GLY 98 Ca -0.37 -1.61 0.02 0.00 0.00 0.00 0.00 46.02 44.07 2bye n GLY 98 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2bye n TYR 99 N 0.27 0.22 -4.34 1.61 4.11 -1.23 -4.34 117.16 113.46 2bye n TYR 99 Ca 0.42 -0.11 -0.20 0.00 -0.00 0.00 0.00 57.90 58.02 2bye n TYR 99 Cb 0.56 -0.01 -0.16 0.00 -0.00 0.00 0.00 39.34 39.74 2bye n TYR 99 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.86 175.22 2bye s MET 100 N -1.78 0.91 -0.20 -3.48 -1.94 -1.26 -5.07 119.30 106.48 2bye s MET 100 Ca 0.10 -0.27 -0.31 0.00 -1.71 0.00 0.00 55.69 53.51 2bye s MET 100 Cb 0.06 -0.86 0.15 0.00 2.01 0.00 0.00 34.83 36.19 2bye s MET 100 CO 0.07 0.08 1.15 0.20 -0.01 0.00 0.00 175.02 176.51 2bye s GLY 101 N 0.28 -0.16 -0.04 -0.03 0.00 -1.26 -4.95 107.32 101.15 2bye s GLY 101 Ca -0.04 2.17 -0.17 0.00 0.00 0.00 0.00 44.72 46.68 2bye s GLY 101 CO 0.00 0.93 0.38 1.09 0.00 0.00 0.00 173.10 175.50 2bye s ARG 102 N -1.42 0.68 -0.22 2.90 1.70 -1.13 -4.98 118.95 116.48 2bye s ARG 102 Ca 0.04 0.01 -0.09 0.00 -0.47 0.00 0.00 55.73 55.22 2bye s ARG 102 Cb -0.01 0.31 -0.04 0.00 -0.57 0.00 0.00 34.95 34.64 2bye s ARG 102 CO -0.03 -0.18 0.10 0.42 -1.08 0.00 0.00 175.30 174.53 2bye s ILE 103 N -1.02 4.94 -0.32 4.99 1.01 -1.25 -0.53 121.20 129.03 2bye s ILE 103 Ca -0.11 0.03 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 2bye s ILE 103 Cb -0.04 -3.28 0.06 0.00 0.01 0.00 0.00 42.46 39.21 2bye s ILE 103 CO 0.04 0.39 0.04 0.68 0.00 0.00 0.00 174.94 176.09 2bye s VAL 104 N 0.88 3.06 -0.33 2.92 -7.23 0.40 -0.25 120.40 119.86 2bye s VAL 104 Ca 0.05 -1.50 -0.28 0.00 -1.81 0.00 0.00 61.98 58.45 2bye s VAL 104 Cb -0.13 -2.82 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 2bye s VAL 104 CO 0.03 -0.21 1.92 -0.22 -0.31 0.00 0.00 175.10 176.30 2bye s LEU 105 N 1.23 3.47 0.00 1.32 2.96 -1.26 -1.78 118.68 124.63 2bye s LEU 105 Ca -0.03 1.36 0.04 0.00 -0.22 0.00 0.00 54.13 55.28 2bye s LEU 105 Cb -0.20 -3.41 0.06 0.00 0.50 0.00 0.00 46.19 43.14 2bye s LEU 105 CO -0.01 -1.85 0.45 0.29 -1.32 0.00 0.00 176.35 173.90 2bye n LYS 106 N 8.57 0.64 -4.99 1.98 4.76 0.15 -4.38 118.16 124.90 2bye n LYS 106 Ca 0.25 -1.58 -0.27 0.00 -2.87 0.00 0.00 58.31 53.84 2bye n LYS 106 Cb 0.47 -0.19 -0.16 0.00 -1.84 0.00 0.00 35.03 33.31 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 -1.06 1.60 0.00 -0.18 -4.23 -1.26 -2.15 115.64 108.35 2bye s THR 107 Ca 0.33 -0.86 0.00 0.00 -1.18 0.00 0.00 61.69 59.98 2bye s THR 107 Cb -0.02 -1.33 0.00 0.00 1.34 0.00 0.00 72.50 72.48 2bye s THR 107 CO 0.21 0.45 1.44 1.67 -0.54 0.00 0.00 174.62 177.85 2bye n GLN 108 N 2.65 0.85 -0.70 3.99 -0.06 0.48 -4.76 117.38 119.83 2bye n GLN 108 Ca -0.16 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.84 2bye n GLN 108 Cb 0.53 -1.08 0.00 0.00 -4.06 0.00 0.00 30.24 25.63 2bye n GLN 108 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2bye n GLN 109 N 1.27 1.87 0.00 3.69 1.13 -1.26 -5.01 117.38 119.07 2bye n GLN 109 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2bye n GLN 109 Cb 0.42 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.77 2bye n GLN 109 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71