#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 0.83 -0.92 1.61 0.00 -1.26 -5.12 120.64 115.77 2bye n GLU 2 Ca 0.00 0.07 0.09 0.00 0.00 0.00 0.00 57.16 57.32 2bye n GLU 2 Cb 0.00 -1.43 -0.05 0.00 0.00 0.00 0.00 31.44 29.96 2bye n GLU 2 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2bye n GLU 3 N -2.93 -2.21 -2.47 3.44 4.07 -1.26 -4.72 120.64 114.56 2bye n GLU 3 Ca -0.34 1.79 -0.43 0.00 -0.06 0.00 0.00 57.16 58.12 2bye n GLU 3 Cb 0.96 -2.47 -0.02 0.00 -0.06 0.00 0.00 31.44 29.85 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 -4.06 4.04 -1.31 5.31 3.52 -1.26 -4.91 118.95 120.28 2bye s ARG 4 Ca 0.00 1.32 -0.10 0.00 -0.13 0.00 0.00 55.73 56.83 2bye s ARG 4 Cb 0.00 -3.81 -0.07 0.00 -1.56 0.00 0.00 34.95 29.51 2bye s ARG 4 CO 0.00 -0.95 2.53 1.63 -0.81 0.00 0.00 175.30 177.70 2bye n LYS 5 N 7.00 2.93 -0.04 5.12 5.02 -1.26 -4.12 118.16 132.81 2bye n LYS 5 Ca 0.14 -1.96 -0.11 0.00 -2.02 0.00 0.00 58.31 54.35 2bye n LYS 5 Cb 0.46 -2.74 -0.14 0.00 -0.02 0.00 0.00 35.03 32.59 2bye n LYS 5 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bye s LEU 7 N -6.11 4.58 -0.49 0.00 1.43 -1.26 -4.66 118.68 112.17 2bye s LEU 7 Ca -0.09 -1.55 -0.12 0.00 -1.03 0.00 0.00 54.13 51.33 2bye s LEU 7 Cb 0.07 -1.81 0.12 0.00 0.03 0.00 0.00 46.19 44.61 2bye s LEU 7 CO 0.81 -0.40 0.40 -1.10 0.23 0.00 0.00 176.35 176.29 2bye s GLN 8 N 1.25 2.70 -0.61 1.70 -0.21 -1.26 -4.68 119.66 118.55 2bye s GLN 8 Ca 0.01 -1.70 -0.25 0.00 0.02 0.00 0.00 55.36 53.44 2bye s GLN 8 Cb -0.21 -4.06 0.04 0.00 1.00 0.00 0.00 33.01 29.78 2bye s GLN 8 CO -0.01 -1.21 1.07 0.95 -2.12 0.00 0.00 175.29 173.96 2bye s THR 9 N 1.47 4.17 -0.03 -0.19 -4.23 -1.26 -3.19 115.64 112.38 2bye s THR 9 Ca 0.04 0.35 0.01 0.00 -1.18 0.00 0.00 61.69 60.92 2bye s THR 9 Cb -0.27 -4.67 -0.03 0.00 1.34 0.00 0.00 72.50 68.86 2bye s THR 9 CO 0.01 -1.35 -0.04 -1.00 -0.54 0.00 0.00 174.62 171.70 2bye s HIS 10 N 4.52 3.00 0.10 3.99 3.76 -1.23 -4.82 115.29 124.60 2bye s HIS 10 Ca 0.33 0.05 -0.03 0.00 -0.15 0.00 0.00 55.06 55.26 2bye s HIS 10 Cb -0.11 -1.68 -0.05 0.00 1.11 0.00 0.00 32.58 31.85 2bye s HIS 10 CO 0.19 0.40 0.30 0.50 -0.85 0.00 0.00 174.74 175.28 2bye s ARG 11 N -1.23 3.54 -0.16 1.40 3.52 -1.26 -0.08 118.95 124.68 2bye s ARG 11 Ca 0.16 -0.24 -0.01 0.00 -0.13 0.00 0.00 55.73 55.52 2bye s ARG 11 Cb -0.11 -2.95 0.04 0.00 -1.56 0.00 0.00 34.95 30.37 2bye s ARG 11 CO 0.06 0.54 -0.03 0.54 -0.81 0.00 0.00 175.30 175.60 2bye s VAL 12 N -1.57 0.94 -0.27 7.11 0.11 -0.60 -4.95 120.40 121.17 2bye s VAL 12 Ca 0.37 -0.53 -0.29 0.00 -2.93 0.00 0.00 61.98 58.60 2bye s VAL 12 Cb -0.13 -1.16 -0.01 0.00 -1.53 0.00 0.00 36.38 33.56 2bye s VAL 12 CO 0.25 0.10 1.35 -0.89 -3.33 0.00 0.00 175.10 172.58 2bye s THR 13 N 1.70 4.08 -0.26 5.04 2.01 -1.26 -2.38 115.64 124.57 2bye s THR 13 Ca 0.01 1.22 -0.11 0.00 0.31 0.00 0.00 61.69 63.12 2bye s THR 13 Cb -0.15 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.25 2bye s THR 13 CO -0.07 -0.41 0.20 -0.69 -0.69 0.00 0.00 174.62 172.96 2bye s VAL 14 N 4.43 5.32 -0.76 3.82 1.01 0.60 -4.73 120.40 130.08 2bye s VAL 14 Ca 0.59 0.23 0.24 0.00 0.00 0.00 0.00 61.98 63.04 2bye s VAL 14 Cb -0.19 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 2bye s VAL 14 CO 0.23 0.29 1.25 1.41 0.00 0.00 0.00 175.10 178.28 2bye n HIS 15 N 4.69 0.27 0.05 5.22 8.25 -0.29 -1.51 115.22 131.89 2bye n HIS 15 Ca -0.14 0.08 0.03 0.00 -0.26 0.00 0.00 57.72 57.43 2bye n HIS 15 Cb 0.52 -0.43 -0.07 0.00 1.12 0.00 0.00 29.99 31.13 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 1.41 -1.25 3.63 -1.41 0.00 -1.05 -4.71 105.19 101.81 2bye n GLY 16 Ca 0.04 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 2bye n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bye s VAL 17 N -3.03 4.05 0.00 1.61 0.11 -1.26 -4.32 120.40 117.57 2bye s VAL 17 Ca -0.02 1.20 0.00 0.00 -2.93 0.00 0.00 61.98 60.22 2bye s VAL 17 Cb 0.09 -4.04 0.00 0.00 -1.53 0.00 0.00 36.38 30.90 2bye s VAL 17 CO 0.81 -0.41 0.00 -0.81 -3.33 0.00 0.00 175.10 171.36 2bye n PRO 18 N 7.33 0.00 0.00 1.54 -0.04 -1.26 -4.28 135.00 138.29 2bye n PRO 18 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2bye n PRO 18 Cb 0.46 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 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 5.00 -0.90 0.22 0.55 0.00 -1.26 -3.54 105.19 105.26 2bye n GLY 19 Ca 0.00 -1.27 0.08 0.00 0.00 0.00 0.00 46.02 44.84 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 -6.85 1.61 0.13 -2.03 -3.44 132.00 121.42 2bye h PRO 20 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 2bye h PRO 20 Cb 0.00 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.15 2bye h PRO 20 CO 0.00 0.27 0.08 -1.21 -0.23 0.00 0.00 178.00 176.91 2bye s GLU 21 N -3.81 3.63 -0.10 0.86 2.02 -1.23 -5.01 118.70 115.06 2bye s GLU 21 Ca -0.01 0.27 0.09 0.00 0.02 0.00 0.00 54.97 55.34 2bye s GLU 21 Cb 0.12 -2.41 -0.24 0.00 0.10 0.00 0.00 34.13 31.70 2bye s GLU 21 CO 0.65 -0.10 0.46 -0.35 0.02 0.00 0.00 175.26 175.94 2bye n PRO 22 N -1.78 0.67 -3.71 0.39 -0.04 -1.26 -4.50 135.00 124.76 2bye n PRO 22 Ca 0.01 0.23 -0.11 0.00 -0.04 0.00 0.00 63.50 63.59 2bye n PRO 22 Cb 0.55 -1.72 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 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 -0.50 0.03 0.54 -0.71 -1.26 -4.66 117.98 108.86 2bye s PHE 23 Ca -0.11 1.10 0.03 0.00 -1.04 0.00 0.00 56.93 56.91 2bye s PHE 23 Cb 0.07 0.19 -0.02 0.00 -1.21 0.00 0.00 43.02 42.05 2bye s PHE 23 CO 0.80 -0.29 -0.08 -0.08 -1.34 0.00 0.00 175.22 174.23 2bye s THR 24 N 1.16 0.62 -0.14 -4.49 -1.32 -0.57 -4.91 115.64 105.99 2bye s THR 24 Ca -0.08 -0.92 -0.02 0.00 -1.21 0.00 0.00 61.69 59.46 2bye s THR 24 Cb -0.08 -0.63 -0.02 0.00 -1.51 0.00 0.00 72.50 70.26 2bye s THR 24 CO -0.09 -0.23 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.32 2bye s VAL 25 N -1.07 3.58 -0.00 5.08 1.01 -1.26 -0.29 120.40 127.45 2bye s VAL 25 Ca -0.06 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.51 2bye s VAL 25 Cb -0.08 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 2bye s VAL 25 CO 0.01 0.51 -0.19 -0.36 0.00 0.00 0.00 175.10 175.07 2bye s PHE 26 N 0.25 2.55 0.12 5.22 0.40 -1.00 -4.87 117.98 120.65 2bye s PHE 26 Ca -0.05 -0.27 -0.19 0.00 -0.60 0.00 0.00 56.93 55.82 2bye s PHE 26 Cb -0.14 -1.53 -0.07 0.00 0.51 0.00 0.00 43.02 41.79 2bye s PHE 26 CO 0.04 0.16 0.61 0.99 0.70 0.00 0.00 175.22 177.72 2bye s THR 27 N -0.79 4.69 0.22 0.64 2.01 -1.26 -1.56 115.64 119.59 2bye s THR 27 Ca 0.12 1.23 0.02 0.00 0.31 0.00 0.00 61.69 63.38 2bye s THR 27 Cb -0.10 -3.90 0.02 0.00 0.01 0.00 0.00 72.50 68.53 2bye s THR 27 CO 0.02 0.46 0.19 2.30 -0.69 0.00 0.00 174.62 176.90 2bye n ILE 28 N 1.43 0.00 -3.63 1.82 -5.35 0.89 -4.94 119.36 109.58 2bye n ILE 28 Ca -0.08 -0.87 -0.14 0.00 -0.27 0.00 0.00 62.75 61.39 2bye n ILE 28 Cb 0.51 -0.38 -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 -2.33 -0.73 1.64 7.28 4.22 -1.26 -3.57 114.94 120.19 2bye s ASN 29 Ca 0.14 1.40 0.00 0.00 -2.14 0.00 0.00 52.86 52.26 2bye s ASN 29 Cb -0.01 1.41 0.00 0.00 1.28 0.00 0.00 41.25 43.93 2bye s ASN 29 CO 0.09 -0.26 0.00 0.61 -2.04 0.00 0.00 177.10 175.50 2bye n GLY 30 N 2.61 3.53 2.44 0.45 0.00 -1.19 -3.51 105.19 109.51 2bye n GLY 30 Ca -0.14 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 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 4.38 3.77 -0.02 0.00 -1.26 -4.26 105.19 107.80 2bye n GLY 31 Ca 0.00 -2.39 -0.39 0.00 0.00 0.00 0.00 46.02 43.24 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 -2.51 3.03 0.47 2.61 -4.23 -1.23 -5.06 115.64 108.72 2bye s THR 32 Ca 0.40 0.91 0.07 0.00 -1.18 0.00 0.00 61.69 61.88 2bye s THR 32 Cb 0.19 -3.52 -0.00 0.00 1.34 0.00 0.00 72.50 70.51 2bye s THR 32 CO -0.06 0.12 0.34 -1.59 -0.54 0.00 0.00 174.62 172.88 2bye s LYS 33 N -2.18 2.33 0.63 3.99 0.00 -1.26 -4.47 119.74 118.78 2bye s LYS 33 Ca 0.55 -1.84 0.32 0.00 0.00 0.00 0.00 55.97 55.01 2bye s LYS 33 Cb -0.33 -2.14 1.78 0.00 0.00 0.00 0.00 37.83 37.13 2bye s LYS 33 CO 0.42 -0.37 2.07 0.00 0.00 0.00 0.00 175.35 177.47 2bye h ALA 34 N 1.01 1.53 0.00 0.59 0.00 -1.72 0.12 119.26 120.78 2bye h ALA 34 Ca -0.40 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 2bye h ALA 34 Cb 1.28 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2bye h ALA 34 CO 0.61 -0.30 -0.28 1.57 0.00 0.00 0.00 179.25 180.84 2bye h LYS 35 N 0.00 0.00 0.00 0.00 2.10 -1.82 0.31 116.57 117.16 2bye h LYS 35 Ca 0.05 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.70 2bye h LYS 35 Cb 0.53 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.86 2bye h LYS 35 CO -0.00 0.85 -0.03 1.96 -2.00 0.00 0.00 179.45 180.23 2bye h GLN 36 N -1.00 0.00 0.13 0.07 7.50 -1.85 -2.49 115.11 117.48 2bye h GLN 36 Ca -0.07 0.00 -0.31 0.00 0.50 0.00 0.00 58.65 58.76 2bye h GLN 36 Cb 0.93 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.46 2bye h GLN 36 CO -0.04 0.03 -1.56 1.25 -1.50 0.00 0.00 178.83 177.01 2bye h LEU 37 N 0.00 0.44 -1.32 1.46 7.12 -0.77 -2.50 115.31 119.74 2bye h LEU 37 Ca -0.00 -0.61 0.14 0.00 0.13 0.00 0.00 57.88 57.53 2bye h LEU 37 Cb 0.16 -0.14 -0.07 0.00 -0.53 0.00 0.00 40.66 40.08 2bye h LEU 37 CO 0.00 1.51 0.56 0.25 -0.13 0.00 0.00 178.44 180.63 2bye h LEU 38 N 0.08 0.64 0.20 2.25 7.12 0.06 0.21 115.31 125.86 2bye h LEU 38 Ca -0.26 0.03 0.01 0.00 0.13 0.00 0.00 57.88 57.80 2bye h LEU 38 Cb 2.03 -0.09 -0.03 0.00 -0.53 0.00 0.00 40.66 42.04 2bye h LEU 38 CO 0.17 0.33 -0.31 -0.61 -0.13 0.00 0.00 178.44 177.89 2bye h GLN 39 N 0.68 -0.56 -0.58 1.25 4.15 -1.50 0.17 115.11 118.73 2bye h GLN 39 Ca 0.43 0.04 0.12 0.00 0.77 0.00 0.00 58.65 60.01 2bye h GLN 39 Cb 0.68 0.13 -0.03 0.00 0.21 0.00 0.00 27.48 28.46 2bye h GLN 39 CO -0.19 -0.37 0.40 1.96 -1.93 0.00 0.00 178.83 178.70 2bye h GLN 40 N -0.58 0.24 -0.01 1.69 1.08 -0.25 0.61 115.11 117.88 2bye h GLN 40 Ca 0.01 -0.01 -0.25 0.00 -1.45 0.00 0.00 58.65 56.95 2bye h GLN 40 Cb 0.57 -0.05 0.01 0.00 -0.05 0.00 0.00 27.48 27.96 2bye h GLN 40 CO -0.13 0.16 -0.99 0.82 -0.95 0.00 0.00 178.83 177.74 2bye h ILE 41 N 0.24 1.31 -0.38 2.54 5.03 -0.28 -2.92 117.51 123.06 2bye h ILE 41 Ca 0.28 -2.28 -0.02 0.00 -0.12 0.00 0.00 64.86 62.72 2bye h ILE 41 Cb 0.75 2.35 -0.02 0.00 -3.03 0.00 0.00 36.82 36.87 2bye h ILE 41 CO -0.06 0.70 0.13 -0.07 -0.68 0.00 0.00 178.15 178.18 2bye h LEU 42 N 0.36 0.48 -8.46 1.44 3.38 0.14 -3.43 115.31 109.22 2bye h LEU 42 Ca -0.11 -0.05 -0.38 0.00 0.09 0.00 0.00 57.88 57.43 2bye h LEU 42 Cb 1.63 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.24 2bye h LEU 42 CO 0.19 0.46 1.15 -0.89 0.09 0.00 0.00 178.44 179.43 2bye s THR 43 N -5.23 3.22 -1.00 0.22 2.01 0.19 -4.55 115.64 110.51 2bye s THR 43 Ca -0.08 0.01 0.22 0.00 0.31 0.00 0.00 61.69 62.16 2bye s THR 43 Cb 0.16 -3.55 -0.15 0.00 0.01 0.00 0.00 72.50 68.97 2bye s THR 43 CO 0.75 -0.53 1.07 0.59 -0.69 0.00 0.00 174.62 175.81 2bye n ASN 44 N 14.75 0.83 -0.79 3.53 5.03 -1.26 -4.97 115.26 132.39 2bye n ASN 44 Ca 0.32 -0.75 -0.09 0.00 0.87 0.00 0.00 54.58 54.93 2bye n ASN 44 Cb 0.51 0.76 -0.03 0.00 -1.02 0.00 0.00 39.78 39.99 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 -1.50 -0.67 0.00 3.52 1.02 -1.26 -4.92 120.64 116.83 2bye n GLU 45 Ca 0.04 0.76 0.00 0.00 -0.02 0.00 0.00 57.16 57.95 2bye n GLU 45 Cb 0.33 -4.68 0.00 0.00 -0.02 0.00 0.00 31.44 27.07 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 -2.58 0.00 -0.13 3.49 6.02 -1.26 -4.03 117.38 118.90 2bye n GLN 46 Ca -0.10 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 56.94 2bye n GLN 46 Cb 0.36 -0.32 0.14 0.00 1.02 0.00 0.00 30.24 31.44 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 0.00 1.45 0.00 1.08 2.03 -1.26 -4.92 116.55 114.93 2bye n ASP 47 Ca 0.00 -1.97 0.00 0.00 0.52 0.00 0.00 54.79 53.34 2bye n ASP 47 Cb 0.00 -0.17 0.00 0.00 -0.72 0.00 0.00 41.12 40.23 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 0.28 0.00 -3.39 5.18 5.41 -1.26 -4.76 119.36 120.83 2bye n ILE 48 Ca 0.10 0.00 -0.45 0.00 1.00 0.00 0.00 62.75 63.40 2bye n ILE 48 Cb 0.23 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 39.12 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 3.13 0.00 0.38 2.20 -1.26 -4.06 119.74 120.13 2bye s LYS 49 Ca 0.00 -2.11 0.00 0.00 -0.36 0.00 0.00 55.97 53.50 2bye s LYS 49 Cb 0.00 -4.24 0.00 0.00 -1.51 0.00 0.00 37.83 32.08 2bye s LYS 49 CO 0.00 -1.28 0.00 -2.30 -0.36 0.00 0.00 175.35 171.41 2bye n PRO 50 N 4.51 2.05 -1.73 4.03 -0.02 -1.26 -4.76 135.00 137.81 2bye n PRO 50 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.07 2bye n PRO 50 Cb 0.43 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 33.91 2bye n PRO 50 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2bye n VAL 51 N -0.46 3.48 -2.35 -1.45 0.31 -1.26 -4.91 118.33 111.68 2bye n VAL 51 Ca 0.00 -3.01 -0.38 0.00 -0.01 0.00 0.00 64.34 60.94 2bye n VAL 51 Cb 0.00 -2.61 -0.03 0.00 -0.91 0.00 0.00 33.84 30.29 2bye n VAL 51 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2bye s THR 52 N 3.15 3.65 0.00 2.52 -4.23 -1.26 -4.88 115.64 114.59 2bye s THR 52 Ca 0.47 -0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.89 2bye s THR 52 Cb 0.14 -4.59 0.00 0.00 1.34 0.00 0.00 72.50 69.39 2bye s THR 52 CO -0.09 -1.52 0.00 1.07 -0.54 0.00 0.00 174.62 173.54 2bye n THR 53 N 6.96 0.00 0.17 3.99 5.66 -1.26 -4.97 114.28 124.83 2bye n THR 53 Ca 0.21 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.21 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 0.08 -4.76 1.09 8.00 -1.26 -4.79 116.55 114.91 2bye n ASP 54 Ca 0.00 -0.26 -0.38 0.00 0.71 0.00 0.00 54.79 54.87 2bye n ASP 54 Cb 0.00 -0.04 0.00 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 -1.35 2.73 0.36 1.24 2.02 -1.26 -1.03 117.35 120.06 2bye s TYR 55 Ca 0.00 1.48 -0.09 0.00 -0.37 0.00 0.00 57.07 58.09 2bye s TYR 55 Cb 0.00 -3.52 0.03 0.00 -0.40 0.00 0.00 41.96 38.07 2bye s TYR 55 CO 0.00 -1.91 0.61 -0.59 -1.57 0.00 0.00 175.55 172.10 2bye s PHE 56 N -1.45 0.61 0.36 2.71 -0.71 -0.92 -4.93 117.98 113.66 2bye s PHE 56 Ca 0.64 -1.04 0.08 0.00 -1.04 0.00 0.00 56.93 55.57 2bye s PHE 56 Cb -0.33 0.34 -0.03 0.00 -1.21 0.00 0.00 43.02 41.79 2bye s PHE 56 CO 0.40 -1.32 0.29 -0.51 -1.34 0.00 0.00 175.22 172.74 2bye s LEU 57 N -3.15 3.46 -0.28 -1.99 1.02 -1.05 0.11 118.68 116.80 2bye s LEU 57 Ca 0.23 -0.64 -0.24 0.00 0.02 0.00 0.00 54.13 53.50 2bye s LEU 57 Cb -0.03 -2.05 0.10 0.00 0.02 0.00 0.00 46.19 44.23 2bye s LEU 57 CO 0.16 -0.45 0.89 0.00 0.02 0.00 0.00 176.35 176.97 2bye s MET 58 N -4.01 0.65 -0.58 1.70 0.23 -0.95 0.10 119.30 116.44 2bye s MET 58 Ca 0.43 0.80 -0.20 0.00 -1.03 0.00 0.00 55.69 55.68 2bye s MET 58 Cb -0.04 0.30 0.08 0.00 -1.53 0.00 0.00 34.83 33.64 2bye s MET 58 CO 0.26 -0.08 0.76 -2.00 -2.03 0.00 0.00 175.02 171.93 2bye s GLU 59 N 0.40 3.11 -0.06 3.16 -6.30 -0.31 -0.92 118.70 117.78 2bye s GLU 59 Ca 0.01 -1.00 0.03 0.00 -2.50 0.00 0.00 54.97 51.50 2bye s GLU 59 Cb -0.05 -4.19 -0.03 0.00 0.00 0.00 0.00 34.13 29.86 2bye s GLU 59 CO -0.04 -1.51 -0.12 -1.83 0.02 0.00 0.00 175.26 171.78 2bye s GLU 60 N 3.09 2.61 -0.54 4.30 -1.05 -0.84 -2.41 118.70 123.86 2bye s GLU 60 Ca 0.16 -0.65 -0.24 0.00 -0.15 0.00 0.00 54.97 54.10 2bye s GLU 60 Cb -0.20 -2.45 0.04 0.00 -0.44 0.00 0.00 34.13 31.08 2bye s GLU 60 CO 0.10 0.62 0.90 0.15 0.95 0.00 0.00 175.26 177.98 2bye s LYS 61 N -0.71 3.32 0.20 -4.83 -0.14 -1.26 -2.59 119.74 113.73 2bye s LYS 61 Ca 0.11 -0.31 0.09 0.00 -1.36 0.00 0.00 55.97 54.50 2bye s LYS 61 Cb -0.11 -4.05 -0.04 0.00 -1.68 0.00 0.00 37.83 31.95 2bye s LYS 61 CO 0.01 -1.43 -0.09 -0.47 -0.76 0.00 0.00 175.35 172.61 2bye s TYR 62 N 3.76 2.63 0.00 3.18 5.04 -1.26 -4.59 117.35 126.11 2bye s TYR 62 Ca 0.29 -0.23 0.00 0.00 -2.44 0.00 0.00 57.07 54.69 2bye s TYR 62 Cb -0.13 -1.25 0.00 0.00 0.35 0.00 0.00 41.96 40.92 2bye s TYR 62 CO 0.19 0.54 0.00 1.19 -1.34 0.00 0.00 175.55 176.13 2bye n PHE 63 N -0.16 0.00 -3.39 4.97 3.72 -1.26 -4.71 117.46 116.64 2bye n PHE 63 Ca -0.10 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.91 2bye n PHE 63 Cb 0.56 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 39.01 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 -0.44 4.37 2.07 -1.26 -4.97 121.20 126.14 2bye s ILE 64 Ca 0.00 0.41 0.08 0.00 -1.41 0.00 0.00 60.65 59.73 2bye s ILE 64 Cb 0.00 -3.74 0.25 0.00 0.13 0.00 0.00 42.46 39.10 2bye s ILE 64 CO 0.00 0.08 0.56 -0.24 -1.91 0.00 0.00 174.94 173.43 2bye n SER 65 N 5.36 0.84 -2.74 4.50 2.88 -1.26 -4.95 113.62 118.25 2bye n SER 65 Ca -0.09 -2.83 -0.04 0.00 -1.33 0.00 0.00 58.87 54.58 2bye n SER 65 Cb 0.50 -0.65 0.02 0.00 -0.75 0.00 0.00 64.21 63.34 2bye n SER 65 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2bye n LYS 66 N 1.30 0.47 -1.46 -1.46 2.85 -1.26 -5.16 118.16 113.44 2bye n LYS 66 Ca 0.23 -1.76 -0.08 0.00 -1.05 0.00 0.00 58.31 55.64 2bye n LYS 66 Cb 0.51 -1.15 0.04 0.00 -0.65 0.00 0.00 35.03 33.77 2bye n LYS 66 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2bye n GLU 67 N 2.74 0.47 -2.87 -1.58 4.71 -1.26 -5.02 120.64 117.82 2bye n GLU 67 Ca 0.16 -1.07 -0.43 0.00 -0.01 0.00 0.00 57.16 55.81 2bye n GLU 67 Cb 0.58 -0.21 -0.04 0.00 -1.01 0.00 0.00 31.44 30.76 2bye n GLU 67 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 2bye s LYS 68 N -3.31 3.23 0.22 3.49 2.47 -1.26 -4.88 119.74 119.70 2bye s LYS 68 Ca 0.25 -0.53 0.00 0.00 -1.56 0.00 0.00 55.97 54.13 2bye s LYS 68 Cb -0.02 -4.12 0.00 0.00 -1.46 0.00 0.00 37.83 32.23 2bye s LYS 68 CO 0.16 -1.58 0.00 0.09 0.16 0.00 0.00 175.35 174.18 2bye n ASN 69 N 7.44 -5.06 -4.56 1.43 4.13 -1.26 -4.56 115.26 112.82 2bye n ASN 69 Ca -0.01 0.39 -0.35 0.00 1.68 0.00 0.00 54.58 56.29 2bye n ASN 69 Cb 0.47 -2.60 -0.04 0.00 -1.54 0.00 0.00 39.78 36.06 2bye n ASN 69 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 2bye s GLU 70 N -1.93 3.07 -0.72 3.52 1.03 -1.26 -4.91 118.70 117.50 2bye s GLU 70 Ca 0.00 -0.63 -0.21 0.00 0.03 0.00 0.00 54.97 54.16 2bye s GLU 70 Cb 0.00 -5.12 0.09 0.00 -0.80 0.00 0.00 34.13 28.29 2bye s GLU 70 CO 0.00 -2.75 0.99 0.00 -1.33 0.00 0.00 175.26 172.17 2bye n ARG 72 N 7.34 1.85 0.00 0.00 1.74 -1.26 -4.54 116.66 121.79 2bye n ARG 72 Ca 0.02 0.02 0.15 0.00 -0.77 0.00 0.00 57.85 57.27 2bye n ARG 72 Cb 0.46 -1.15 0.70 0.00 -1.02 0.00 0.00 32.46 31.45 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 -2.43 0.64 -3.45 5.56 5.02 -1.26 -4.65 118.16 117.58 2bye n LYS 73 Ca -0.11 -0.13 -0.42 0.00 -2.02 0.00 0.00 58.31 55.62 2bye n LYS 73 Cb 0.67 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 34.09 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 -2.45 3.11 -0.28 1.97 -0.21 -1.26 -5.05 119.66 115.48 2bye s GLN 74 Ca 0.31 -0.89 -0.29 0.00 0.02 0.00 0.00 55.36 54.51 2bye s GLN 74 Cb 0.20 -3.94 0.01 0.00 1.00 0.00 0.00 33.01 30.28 2bye s GLN 74 CO 0.46 -0.70 1.18 -2.14 -2.12 0.00 0.00 175.29 171.97 2bye s PRO 75 N 1.76 4.05 0.13 2.91 0.02 -1.26 -4.89 135.00 137.72 2bye s PRO 75 Ca 0.06 1.24 0.24 0.00 0.02 0.00 0.00 61.00 62.56 2bye s PRO 75 Cb -0.18 -3.78 0.24 0.00 0.02 0.00 0.00 34.50 30.79 2bye s PRO 75 CO 0.11 -0.93 1.23 0.74 -0.33 0.00 0.00 177.00 177.82 2bye h PHE 76 N 8.48 0.00 -2.97 6.54 0.04 -1.96 -3.44 116.94 123.63 2bye h PHE 76 Ca -0.23 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 59.97 2bye h PHE 76 Cb 1.08 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.19 2bye h PHE 76 CO 0.84 0.00 1.00 -1.14 -0.60 0.00 0.00 178.31 178.41 2bye s GLN 77 N -3.21 3.98 -0.29 1.51 0.74 -1.26 -4.33 119.66 116.79 2bye s GLN 77 Ca 0.05 1.50 -0.01 0.00 0.05 0.00 0.00 55.36 56.94 2bye s GLN 77 Cb 0.13 -3.89 0.05 0.00 1.10 0.00 0.00 33.01 30.40 2bye s GLN 77 CO 0.74 -1.04 -0.02 0.50 -0.55 0.00 0.00 175.29 174.92 2bye s ARG 78 N 4.11 2.38 0.09 1.67 3.52 -1.01 -5.03 118.95 124.68 2bye s ARG 78 Ca 0.60 -1.29 -0.24 0.00 -0.13 0.00 0.00 55.73 54.67 2bye s ARG 78 Cb -0.21 -3.13 -0.07 0.00 -1.56 0.00 0.00 34.95 29.99 2bye s ARG 78 CO 0.23 -0.62 0.72 0.00 -0.81 0.00 0.00 175.30 174.82 2bye s ALA 79 N 1.22 3.45 -0.31 6.12 0.00 -1.26 -1.16 121.76 129.82 2bye s ALA 79 Ca -0.06 0.24 -0.08 0.00 0.00 0.00 0.00 51.96 52.07 2bye s ALA 79 Cb -0.20 -2.89 0.01 0.00 0.00 0.00 0.00 23.12 20.04 2bye s ALA 79 CO -0.02 0.21 0.11 0.42 0.00 0.00 0.00 175.76 176.48 2bye s ILE 80 N -0.62 4.15 0.30 0.00 -1.09 0.11 -4.93 121.20 119.13 2bye s ILE 80 Ca 0.35 -0.71 0.03 0.00 -2.23 0.00 0.00 60.65 58.09 2bye s ILE 80 Cb -0.21 -3.18 0.03 0.00 -1.58 0.00 0.00 42.46 37.52 2bye s ILE 80 CO 0.23 0.01 0.22 0.61 -1.23 0.00 0.00 174.94 174.78 2bye n GLY 81 N 4.90 2.90 0.32 6.18 0.00 -1.26 -2.54 105.19 115.69 2bye n GLY 81 Ca -0.14 -2.24 0.13 0.00 0.00 0.00 0.00 46.02 43.76 2bye n GLY 81 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2bye h PRO 82 N 0.00 0.09 -0.27 1.61 0.11 -1.96 -1.93 132.00 129.64 2bye h PRO 82 Ca -0.19 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.82 2bye h PRO 82 Cb 0.71 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 2bye h PRO 82 CO 0.31 0.06 -0.19 0.93 -0.21 0.00 0.00 178.00 178.89 2bye h GLU 83 N 0.09 0.61 -5.65 1.05 5.08 -1.98 -3.37 114.58 110.40 2bye h GLU 83 Ca 0.13 -0.29 -0.26 0.00 -1.00 0.00 0.00 59.36 57.95 2bye h GLU 83 Cb 0.42 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 2bye h GLU 83 CO -0.01 0.88 0.68 -1.21 -1.00 0.00 0.00 179.01 178.34 2bye s GLU 84 N -4.49 2.30 -0.37 2.33 8.01 -0.73 -4.93 118.70 120.83 2bye s GLU 84 Ca -0.13 0.10 -0.29 0.00 0.01 0.00 0.00 54.97 54.66 2bye s GLU 84 Cb 0.08 -4.89 0.02 0.00 -4.31 0.00 0.00 34.13 25.03 2bye s GLU 84 CO 0.80 -3.56 1.12 -1.21 0.01 0.00 0.00 175.26 172.42 2bye s GLU 85 N 7.55 3.94 0.55 1.61 2.02 -1.26 -3.81 118.70 129.30 2bye s GLU 85 Ca 0.77 0.94 0.30 0.00 0.02 0.00 0.00 54.97 56.99 2bye s GLU 85 Cb -0.09 -3.80 1.62 0.00 0.10 0.00 0.00 34.13 31.95 2bye s GLU 85 CO 0.05 -1.07 2.14 -0.84 0.02 0.00 0.00 175.26 175.56 2bye h ILE 86 N 5.91 0.49 -0.31 -1.63 3.07 -1.90 0.80 117.51 123.94 2bye h ILE 86 Ca -0.22 -0.35 -0.02 0.00 1.55 0.00 0.00 64.86 65.82 2bye h ILE 86 Cb 1.06 1.23 -0.02 0.00 -0.27 0.00 0.00 36.82 38.83 2bye h ILE 86 CO 1.06 0.07 0.12 0.24 -1.05 0.00 0.00 178.15 178.59 2bye h MET 87 N 0.00 0.43 0.07 0.16 2.86 -1.91 -0.23 114.93 116.31 2bye h MET 87 Ca -0.00 -0.05 -0.25 0.00 -2.06 0.00 0.00 59.70 57.34 2bye h MET 87 Cb 0.23 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.81 2bye h MET 87 CO 0.01 0.36 -1.08 1.96 1.06 0.00 0.00 176.91 179.22 2bye h GLN 88 N 0.43 0.31 0.10 1.72 4.20 -1.23 -2.55 115.11 118.09 2bye h GLN 88 Ca 0.11 -0.42 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 2bye h GLN 88 Cb 0.10 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2bye h GLN 88 CO -0.01 1.14 -0.05 0.82 -0.67 0.00 0.00 178.83 180.06 2bye h ILE 89 N 0.13 0.91 0.00 2.54 1.08 -1.05 -0.92 117.51 120.21 2bye h ILE 89 Ca -0.10 -0.05 -0.09 0.00 -0.39 0.00 0.00 64.86 64.22 2bye h ILE 89 Cb 1.77 0.95 -0.01 0.00 -3.07 0.00 0.00 36.82 36.45 2bye h ILE 89 CO 0.18 0.01 -0.43 -0.07 -0.69 0.00 0.00 178.15 177.16 2bye h LEU 90 N -0.16 0.00 0.00 1.44 3.38 -1.09 0.24 115.31 119.11 2bye h LEU 90 Ca -0.01 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 2bye h LEU 90 Cb 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2bye h LEU 90 CO 0.02 0.43 -0.79 0.77 0.09 0.00 0.00 178.44 178.96 2bye h SER 91 N 0.00 0.00 0.10 -0.43 4.64 -1.36 -3.36 113.55 113.14 2bye h SER 91 Ca -0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 2bye h SER 91 Cb 0.97 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.00 2bye h SER 91 CO 0.06 0.46 -2.24 -0.24 -0.87 0.00 0.00 176.83 174.00 2bye n SER 92 N -3.07 0.17 -4.63 4.97 2.88 -0.36 -4.87 113.62 108.69 2bye n SER 92 Ca -0.02 0.08 -0.39 0.00 -1.33 0.00 0.00 58.87 57.21 2bye n SER 92 Cb 0.74 0.84 -0.07 0.00 -0.75 0.00 0.00 64.21 64.97 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 -2.56 3.31 -0.27 0.66 -0.00 0.81 -5.05 118.94 115.84 2bye s TRP 93 Ca -0.09 0.65 -0.05 0.00 -0.00 0.00 0.00 56.10 56.61 2bye s TRP 93 Cb 0.07 -2.67 0.01 0.00 -0.00 0.00 0.00 33.47 30.88 2bye s TRP 93 CO 0.83 -0.19 0.02 -0.06 -0.00 0.00 0.00 176.95 177.54 2bye s PHE 94 N 1.98 3.10 -0.91 5.86 0.08 -1.26 -4.75 117.98 122.07 2bye s PHE 94 Ca 0.21 -1.19 -0.24 0.00 0.12 0.00 0.00 56.93 55.83 2bye s PHE 94 Cb -0.15 -2.17 0.01 0.00 -0.57 0.00 0.00 43.02 40.14 2bye s PHE 94 CO 0.09 -0.63 1.64 -2.14 -0.10 0.00 0.00 175.22 174.09 2bye s PRO 95 N 1.43 3.10 -0.73 0.24 0.02 -1.26 -4.94 135.00 132.85 2bye s PRO 95 Ca 0.02 -0.59 -0.27 0.00 0.02 0.00 0.00 61.00 60.19 2bye s PRO 95 Cb -0.17 -5.05 0.02 0.00 0.02 0.00 0.00 34.50 29.32 2bye s PRO 95 CO -0.01 -2.66 1.44 -1.21 -0.33 0.00 0.00 177.00 174.23 2bye s GLU 96 N 5.95 3.07 0.00 5.54 2.02 -1.26 -4.50 118.70 129.52 2bye s GLU 96 Ca 0.55 -0.10 0.00 0.00 0.02 0.00 0.00 54.97 55.44 2bye s GLU 96 Cb -0.04 -4.32 0.00 0.00 0.10 0.00 0.00 34.13 29.86 2bye s GLU 96 CO -0.02 -2.31 0.00 0.39 0.02 0.00 0.00 175.26 173.34 2bye n GLU 97 N 9.29 0.00 -2.65 1.61 4.71 -1.26 -4.83 120.64 127.51 2bye n GLU 97 Ca 0.10 0.00 -0.43 0.00 -0.01 0.00 0.00 57.16 56.82 2bye n GLU 97 Cb 0.50 0.00 -0.02 0.00 -1.01 0.00 0.00 31.44 30.90 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 0.00 2.17 -0.07 0.62 0.00 -1.26 -4.90 107.32 103.88 2bye s GLY 98 Ca 0.00 0.36 0.04 0.00 0.00 0.00 0.00 44.72 45.12 2bye s GLY 98 CO 0.00 2.02 0.88 1.58 0.00 0.00 0.00 173.10 177.58 2bye n TYR 99 N 5.35 0.63 -1.63 1.90 4.11 -1.26 -4.80 117.16 121.46 2bye n TYR 99 Ca 0.10 -0.22 -0.36 0.00 -0.00 0.00 0.00 57.90 57.42 2bye n TYR 99 Cb 0.48 -0.22 -0.03 0.00 -0.00 0.00 0.00 39.34 39.56 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 -1.54 2.17 0.00 -3.48 -1.94 -1.26 -4.72 119.30 108.53 2bye s MET 100 Ca 0.16 1.28 0.00 0.00 -1.71 0.00 0.00 55.69 55.43 2bye s MET 100 Cb 0.13 -4.56 0.00 0.00 2.01 0.00 0.00 34.83 32.41 2bye s MET 100 CO 0.05 -3.21 0.00 0.41 -0.01 0.00 0.00 175.02 172.26 2bye n GLY 101 N 5.96 3.34 3.58 -0.03 0.00 -1.26 -4.86 105.19 111.92 2bye n GLY 101 Ca 0.34 -0.91 -0.15 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.12 0.92 -0.27 1.61 1.70 -1.07 -4.96 118.95 114.77 2bye s ARG 102 Ca 0.00 0.63 -0.18 0.00 -0.47 0.00 0.00 55.73 55.71 2bye s ARG 102 Cb 0.00 0.44 -0.03 0.00 -0.57 0.00 0.00 34.95 34.79 2bye s ARG 102 CO 0.00 -0.20 0.51 0.42 -1.08 0.00 0.00 175.30 174.95 2bye s ILE 103 N -0.37 5.06 -0.17 4.99 1.01 -1.24 -1.99 121.20 128.49 2bye s ILE 103 Ca -0.05 0.82 -0.09 0.00 0.00 0.00 0.00 60.65 61.34 2bye s ILE 103 Cb -0.03 -3.84 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 2bye s ILE 103 CO 0.05 0.06 0.14 -0.69 0.00 0.00 0.00 174.94 174.49 2bye s VAL 104 N 2.32 5.45 -0.58 2.92 1.01 -0.10 -1.14 120.40 130.27 2bye s VAL 104 Ca 0.21 0.20 -0.28 0.00 0.00 0.00 0.00 61.98 62.11 2bye s VAL 104 Cb -0.16 -3.44 0.01 0.00 0.00 0.00 0.00 36.38 32.79 2bye s VAL 104 CO 0.10 0.51 1.41 -0.22 0.00 0.00 0.00 175.10 176.89 2bye s LEU 105 N -0.18 3.38 0.62 3.92 2.96 -1.26 -2.24 118.68 125.87 2bye s LEU 105 Ca 0.11 0.20 0.07 0.00 -0.22 0.00 0.00 54.13 54.29 2bye s LEU 105 Cb -0.11 -2.99 0.10 0.00 0.50 0.00 0.00 46.19 43.69 2bye s LEU 105 CO 0.00 -1.74 0.85 -0.54 -1.32 0.00 0.00 176.35 173.61 2bye s LYS 106 N 5.56 2.13 0.26 1.98 -0.14 0.12 -4.64 119.74 125.01 2bye s LYS 106 Ca 0.51 -1.56 0.08 0.00 -1.36 0.00 0.00 55.97 53.64 2bye s LYS 106 Cb -0.10 -2.57 -0.05 0.00 -1.68 0.00 0.00 37.83 33.42 2bye s LYS 106 CO 0.24 -1.03 -0.12 0.95 -0.76 0.00 0.00 175.35 174.63 2bye s THR 107 N -2.79 1.90 0.00 2.17 -4.23 -1.26 -2.17 115.64 109.26 2bye s THR 107 Ca 0.63 -2.22 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2bye s THR 107 Cb -0.05 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.48 2bye s THR 107 CO 0.40 -0.41 1.42 0.00 -0.54 0.00 0.00 174.62 175.50 2bye n GLN 108 N -0.54 0.73 -1.74 3.99 1.13 -0.20 -4.85 117.38 115.90 2bye n GLN 108 Ca -0.06 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.58 2bye n GLN 108 Cb 0.62 -1.13 -0.03 0.00 0.11 0.00 0.00 30.24 29.81 2bye n GLN 108 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 2bye s GLN 109 N 0.52 4.12 0.00 -1.09 -2.07 -1.26 -5.11 119.66 114.77 2bye s GLN 109 Ca 0.00 2.60 0.24 0.00 -1.82 0.00 0.00 55.36 56.38 2bye s GLN 109 Cb 0.00 -3.06 0.19 0.00 -1.09 0.00 0.00 33.01 29.05 2bye s GLN 109 CO 0.00 -0.72 1.26 0.39 -1.32 0.00 0.00 175.29 174.89