#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bye n GLU 2 N 0.00 -1.43 -2.22 1.61 -0.58 -1.26 -4.57 120.64 112.18 2bye n GLU 2 Ca 0.00 1.53 -0.32 0.00 -0.42 0.00 0.00 57.16 57.95 2bye n GLU 2 Cb 0.00 -5.09 -0.04 0.00 -0.57 0.00 0.00 31.44 25.74 2bye n GLU 2 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2bye s GLU 3 N -2.78 2.94 0.00 3.49 0.41 -1.26 -3.89 118.70 117.61 2bye s GLU 3 Ca 0.07 -1.23 0.00 0.00 -0.41 0.00 0.00 54.97 53.40 2bye s GLU 3 Cb -0.02 -5.30 0.00 0.00 -1.78 0.00 0.00 34.13 27.03 2bye s GLU 3 CO 0.64 -3.36 0.00 0.54 -0.49 0.00 0.00 175.26 172.60 2bye n ARG 4 N 8.44 0.00 -0.98 1.61 1.74 -1.26 -5.00 116.66 121.21 2bye n ARG 4 Ca 0.44 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.52 2bye n ARG 4 Cb 0.47 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.89 2bye n ARG 4 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2bye n LYS 5 N -1.67 0.00 -3.83 5.56 4.81 -1.26 -4.94 118.16 116.83 2bye n LYS 5 Ca 0.00 -1.15 -0.30 0.00 -0.87 0.00 0.00 58.31 55.99 2bye n LYS 5 Cb 0.00 0.05 -0.14 0.00 0.02 0.00 0.00 35.03 34.95 2bye n LYS 5 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2bye n LEU 7 N 4.12 -3.43 -4.59 0.00 4.77 -1.26 -4.35 117.00 112.27 2bye n LEU 7 Ca 0.03 -0.80 -0.42 0.00 -0.03 0.00 0.00 56.01 54.79 2bye n LEU 7 Cb 0.39 -2.39 -0.03 0.00 -2.33 0.00 0.00 43.42 39.06 2bye n LEU 7 CO 0.21 0.10 1.82 -1.10 -1.33 0.00 0.00 177.39 177.09 2bye s GLN 8 N -5.09 2.96 -0.40 3.23 1.11 -1.26 -1.89 119.66 118.33 2bye s GLN 8 Ca 0.25 1.77 -0.16 0.00 0.01 0.00 0.00 55.36 57.23 2bye s GLN 8 Cb -0.09 -4.38 0.01 0.00 -1.01 0.00 0.00 33.01 27.54 2bye s GLN 8 CO 0.85 -2.30 0.40 0.95 0.01 0.00 0.00 175.29 175.20 2bye s THR 9 N 8.80 5.13 -0.01 -0.19 -4.23 -1.26 -0.94 115.64 122.94 2bye s THR 9 Ca 0.95 -0.28 0.04 0.00 -1.18 0.00 0.00 61.69 61.23 2bye s THR 9 Cb -0.28 -3.96 -0.01 0.00 1.34 0.00 0.00 72.50 69.59 2bye s THR 9 CO 0.33 -0.32 -0.13 -1.00 -0.54 0.00 0.00 174.62 172.96 2bye s HIS 10 N 2.04 1.19 0.16 3.99 3.76 -1.17 -4.70 115.29 120.56 2bye s HIS 10 Ca 0.11 -0.23 -0.14 0.00 -0.15 0.00 0.00 55.06 54.66 2bye s HIS 10 Cb -0.17 -0.77 -0.07 0.00 1.11 0.00 0.00 32.58 32.68 2bye s HIS 10 CO 0.13 -0.02 0.55 0.50 -0.85 0.00 0.00 174.74 175.05 2bye s ARG 11 N -0.32 3.96 -0.13 1.40 3.52 -1.26 -0.38 118.95 125.73 2bye s ARG 11 Ca 0.05 0.47 -0.00 0.00 -0.13 0.00 0.00 55.73 56.12 2bye s ARG 11 Cb -0.05 -2.90 0.03 0.00 -1.56 0.00 0.00 34.95 30.47 2bye s ARG 11 CO -0.00 0.46 -0.10 0.54 -0.81 0.00 0.00 175.30 175.39 2bye s VAL 12 N -1.50 1.23 -0.27 7.11 0.11 -0.31 -4.92 120.40 121.85 2bye s VAL 12 Ca 0.39 -0.45 -0.29 0.00 -2.93 0.00 0.00 61.98 58.70 2bye s VAL 12 Cb -0.15 -1.23 -0.00 0.00 -1.53 0.00 0.00 36.38 33.47 2bye s VAL 12 CO 0.19 0.37 1.32 -0.89 -3.33 0.00 0.00 175.10 172.76 2bye s THR 13 N 1.62 4.13 -0.20 5.04 2.01 -1.26 -2.33 115.64 124.65 2bye s THR 13 Ca 0.04 1.30 -0.14 0.00 0.31 0.00 0.00 61.69 63.21 2bye s THR 13 Cb -0.13 -4.09 -0.04 0.00 0.01 0.00 0.00 72.50 68.24 2bye s THR 13 CO -0.09 -0.40 0.29 -0.69 -0.69 0.00 0.00 174.62 173.04 2bye s VAL 14 N 4.27 5.28 -0.41 3.82 1.01 0.79 -4.42 120.40 130.74 2bye s VAL 14 Ca 0.57 0.49 0.23 0.00 0.00 0.00 0.00 61.98 63.27 2bye s VAL 14 Cb -0.18 -3.63 -0.15 0.00 0.00 0.00 0.00 36.38 32.42 2bye s VAL 14 CO 0.22 0.32 0.89 1.41 0.00 0.00 0.00 175.10 177.95 2bye n HIS 15 N 4.13 0.34 -1.34 5.22 8.25 0.04 -1.40 115.22 130.46 2bye n HIS 15 Ca -0.11 0.10 -0.09 0.00 -0.26 0.00 0.00 57.72 57.35 2bye n HIS 15 Cb 0.52 -0.54 0.20 0.00 1.12 0.00 0.00 29.99 31.29 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 4.66 3.60 -1.41 0.00 -1.25 -4.60 105.19 107.50 2bye n GLY 16 Ca 0.00 -1.16 -0.37 0.00 0.00 0.00 0.00 46.02 44.48 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 -1.03 3.59 0.22 1.61 0.24 -1.26 -4.01 118.33 117.69 2bye n VAL 17 Ca 0.40 -0.50 0.11 0.00 -2.04 0.00 0.00 64.34 62.31 2bye n VAL 17 Cb 1.23 -1.08 0.43 0.00 -1.47 0.00 0.00 33.84 32.94 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 0.36 0.00 -7.18 7.34 0.13 -1.92 -3.45 132.00 127.29 2bye h PRO 18 Ca -0.48 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.22 2bye h PRO 18 Cb 1.37 0.00 0.20 0.00 0.13 0.00 0.00 31.00 32.70 2bye h PRO 18 CO 0.50 0.19 0.03 0.20 -0.23 0.00 0.00 178.00 178.69 2bye s GLY 19 N -4.28 1.53 0.36 1.56 0.00 -1.26 -4.94 107.32 100.29 2bye s GLY 19 Ca 0.02 -0.29 0.17 0.00 0.00 0.00 0.00 44.72 44.61 2bye s GLY 19 CO 0.63 0.46 1.73 -0.56 0.00 0.00 0.00 173.10 175.36 2bye h PRO 20 N -2.62 0.00 -6.91 2.90 0.13 -2.03 -3.45 132.00 120.02 2bye h PRO 20 Ca -0.59 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 63.99 2bye h PRO 20 Cb 1.34 0.00 0.19 0.00 0.13 0.00 0.00 31.00 32.66 2bye h PRO 20 CO 0.50 0.42 -0.14 0.39 -0.23 0.00 0.00 178.00 178.94 2bye n GLU 21 N -3.66 0.11 0.03 0.86 1.02 -1.26 -4.94 120.64 112.80 2bye n GLU 21 Ca -0.01 0.10 -0.12 0.00 -0.02 0.00 0.00 57.16 57.11 2bye n GLU 21 Cb 0.51 -2.09 -0.14 0.00 -0.02 0.00 0.00 31.44 29.71 2bye n GLU 21 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2bye h PRO 22 N -0.88 0.11 -1.76 3.49 0.13 -1.91 -3.44 132.00 127.73 2bye h PRO 22 Ca -0.45 -0.18 0.07 0.00 -0.87 0.00 0.00 66.00 64.56 2bye h PRO 22 Cb 1.31 0.07 -0.24 0.00 0.13 0.00 0.00 31.00 32.27 2bye h PRO 22 CO 0.42 0.87 0.21 -0.59 -0.23 0.00 0.00 178.00 178.68 2bye s PHE 23 N -2.62 -0.81 0.03 1.56 -0.71 -1.26 -4.56 117.98 109.62 2bye s PHE 23 Ca -0.06 1.62 -0.10 0.00 -1.04 0.00 0.00 56.93 57.35 2bye s PHE 23 Cb 0.08 0.48 0.01 0.00 -1.21 0.00 0.00 43.02 42.37 2bye s PHE 23 CO 0.83 -0.40 0.20 -0.08 -1.34 0.00 0.00 175.22 174.43 2bye s THR 24 N 1.44 0.10 -0.15 -4.49 -1.32 -0.49 -4.95 115.64 105.77 2bye s THR 24 Ca -0.09 -0.85 -0.01 0.00 -1.21 0.00 0.00 61.69 59.53 2bye s THR 24 Cb -0.04 -0.86 -0.01 0.00 -1.51 0.00 0.00 72.50 70.07 2bye s THR 24 CO -0.17 -0.47 -0.11 -0.69 -2.21 0.00 0.00 174.62 170.97 2bye s VAL 25 N -2.42 3.11 0.03 5.08 1.01 -1.26 -0.15 120.40 125.81 2bye s VAL 25 Ca -0.06 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2bye s VAL 25 Cb -0.02 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 2bye s VAL 25 CO -0.03 0.50 -0.11 -0.36 0.00 0.00 0.00 175.10 175.10 2bye s PHE 26 N 0.64 2.76 0.08 5.22 0.40 -0.98 -4.83 117.98 121.26 2bye s PHE 26 Ca -0.06 -0.13 -0.17 0.00 -0.60 0.00 0.00 56.93 55.97 2bye s PHE 26 Cb -0.15 -1.53 -0.07 0.00 0.51 0.00 0.00 43.02 41.78 2bye s PHE 26 CO 0.03 0.34 0.53 0.99 0.70 0.00 0.00 175.22 177.81 2bye s THR 27 N -1.01 4.83 0.20 0.64 2.01 -1.26 -1.16 115.64 119.89 2bye s THR 27 Ca 0.17 1.04 0.02 0.00 0.31 0.00 0.00 61.69 63.23 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 0.08 0.48 0.16 2.30 -0.69 0.00 0.00 174.62 176.95 2bye n ILE 28 N 1.51 0.00 -3.64 1.82 -5.35 0.48 -4.92 119.36 109.27 2bye n ILE 28 Ca -0.10 -0.79 -0.14 0.00 -0.27 0.00 0.00 62.75 61.46 2bye n ILE 28 Cb 0.51 -0.36 -0.07 0.00 -1.74 0.00 0.00 39.64 37.98 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 -2.19 -0.72 1.59 7.28 2.20 -1.24 -3.02 114.94 118.83 2bye s ASN 29 Ca 0.12 1.38 0.00 0.00 -0.94 0.00 0.00 52.86 53.42 2bye s ASN 29 Cb -0.01 1.40 0.00 0.00 -2.00 0.00 0.00 41.25 40.64 2bye s ASN 29 CO 0.08 -0.24 0.00 0.61 -2.94 0.00 0.00 177.10 174.61 2bye n GLY 30 N 2.77 2.36 2.55 0.45 0.00 -0.11 -3.39 105.19 109.82 2bye n GLY 30 Ca -0.14 0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 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 4.57 3.72 -0.02 0.00 -1.26 -4.46 105.19 107.74 2bye n GLY 31 Ca 0.00 -2.26 -0.42 0.00 0.00 0.00 0.00 46.02 43.34 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 -3.30 2.71 1.02 2.61 -4.23 -1.22 -5.01 115.64 108.22 2bye s THR 32 Ca 0.44 0.50 -0.16 0.00 -1.18 0.00 0.00 61.69 61.29 2bye s THR 32 Cb 0.29 -3.32 0.21 0.00 1.34 0.00 0.00 72.50 71.02 2bye s THR 32 CO -0.10 0.04 1.18 -0.54 -0.54 0.00 0.00 174.62 174.66 2bye s LYS 33 N 1.21 0.21 0.58 3.99 3.01 -1.26 -4.62 119.74 122.86 2bye s LYS 33 Ca 0.70 -0.03 0.36 0.00 -1.01 0.00 0.00 55.97 55.99 2bye s LYS 33 Cb -0.43 -1.76 1.66 0.00 -1.01 0.00 0.00 37.83 36.29 2bye s LYS 33 CO 0.31 -2.76 2.09 0.00 0.51 0.00 0.00 175.35 175.50 2bye h ALA 34 N -1.90 1.01 0.00 5.17 0.00 -1.77 0.54 119.26 122.31 2bye h ALA 34 Ca -0.47 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 2bye h ALA 34 Cb 1.29 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 2bye h ALA 34 CO 0.46 0.01 -0.09 1.57 0.00 0.00 0.00 179.25 181.20 2bye h LYS 35 N 0.00 0.00 0.00 0.00 2.10 -1.89 0.27 116.57 117.05 2bye h LYS 35 Ca -0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 2bye h LYS 35 Cb 0.37 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.70 2bye h LYS 35 CO 0.00 0.78 -0.06 1.96 -2.00 0.00 0.00 179.45 180.13 2bye h GLN 36 N -1.00 0.00 0.19 0.07 1.08 -1.90 -2.76 115.11 110.79 2bye h GLN 36 Ca -0.02 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 56.83 2bye h GLN 36 Cb 0.81 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.25 2bye h GLN 36 CO -0.01 0.06 -1.73 1.25 -0.95 0.00 0.00 178.83 177.45 2bye h LEU 37 N 0.00 0.64 -1.26 1.46 7.12 -0.89 -2.60 115.31 119.78 2bye h LEU 37 Ca -0.00 -0.94 0.20 0.00 0.13 0.00 0.00 57.88 57.27 2bye h LEU 37 Cb 0.21 -0.21 -0.09 0.00 -0.53 0.00 0.00 40.66 40.04 2bye h LEU 37 CO 0.01 1.79 0.61 0.25 -0.13 0.00 0.00 178.44 180.97 2bye h LEU 38 N 0.10 0.60 0.09 2.25 6.46 -0.19 0.62 115.31 125.25 2bye h LEU 38 Ca -0.34 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.51 2bye h LEU 38 Cb 2.10 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 41.95 2bye h LEU 38 CO 0.18 0.23 -0.28 -0.61 -0.62 0.00 0.00 178.44 177.34 2bye h GLN 39 N 0.59 -0.46 -0.29 1.25 4.15 -1.53 0.81 115.11 119.63 2bye h GLN 39 Ca 0.53 0.03 0.09 0.00 0.77 0.00 0.00 58.65 60.06 2bye h GLN 39 Cb 1.04 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.82 2bye h GLN 39 CO -0.28 -0.31 0.28 1.96 -1.93 0.00 0.00 178.83 178.56 2bye h GLN 40 N -0.48 0.00 0.00 1.69 1.08 0.48 0.75 115.11 118.63 2bye h GLN 40 Ca 0.04 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.07 2bye h GLN 40 Cb 0.52 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.93 2bye h GLN 40 CO -0.18 0.00 -0.86 0.82 -0.95 0.00 0.00 178.83 177.65 2bye h ILE 41 N 0.00 1.25 0.11 2.54 1.08 0.37 -3.37 117.51 119.50 2bye h ILE 41 Ca 0.14 -2.82 -0.37 0.00 -0.39 0.00 0.00 64.86 61.43 2bye h ILE 41 Cb 0.71 2.61 -0.02 0.00 -3.07 0.00 0.00 36.82 37.04 2bye h ILE 41 CO -0.00 0.71 -2.05 0.18 -0.69 0.00 0.00 178.15 176.30 2bye n LEU 42 N -3.26 2.68 -4.36 1.44 4.77 0.10 -4.81 117.00 113.57 2bye n LEU 42 Ca -0.01 0.17 -0.55 0.00 -0.03 0.00 0.00 56.01 55.60 2bye n LEU 42 Cb 0.86 -1.10 -0.09 0.00 -2.33 0.00 0.00 43.42 40.76 2bye n LEU 42 CO 0.44 0.86 1.77 1.07 -1.33 0.00 0.00 177.39 180.20 2bye n THR 43 N -3.46 0.11 0.50 -5.08 5.66 0.22 -4.63 114.28 107.60 2bye n THR 43 Ca -0.34 -0.15 0.13 0.00 -3.05 0.00 0.00 64.05 60.64 2bye n THR 43 Cb 1.04 -1.16 0.34 0.00 -1.55 0.00 0.00 70.33 69.00 2bye n THR 43 CO 0.00 0.00 0.00 0.78 -3.05 0.00 0.00 175.07 172.80 2bye h ASN 44 N 10.91 0.00 0.00 1.09 -0.26 -1.78 -3.48 115.58 122.07 2bye h ASN 44 Ca -0.20 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.54 2bye h ASN 44 Cb 1.36 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.62 2bye h ASN 44 CO 1.05 0.00 0.00 -0.62 -1.06 0.00 0.00 177.43 176.80 2bye n GLU 45 N -2.51 -0.24 0.00 0.81 1.02 -1.21 -4.84 120.64 113.67 2bye n GLU 45 Ca 0.05 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 2bye n GLU 45 Cb 0.46 -3.54 0.00 0.00 -0.02 0.00 0.00 31.44 28.33 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 -1.79 0.00 -0.23 3.49 6.02 -1.26 -4.05 117.38 119.57 2bye n GLN 46 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.04 2bye n GLN 46 Cb 0.06 -0.41 0.16 0.00 1.02 0.00 0.00 30.24 31.08 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 -0.18 2.16 0.00 1.08 2.03 -1.26 -4.92 116.55 115.47 2bye n ASP 47 Ca 0.00 -2.10 0.00 0.00 0.52 0.00 0.00 54.79 53.21 2bye n ASP 47 Cb 0.00 -0.31 0.00 0.00 -0.72 0.00 0.00 41.12 40.09 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 0.47 0.00 -2.90 5.18 5.41 -1.26 -4.87 119.36 121.39 2bye n ILE 48 Ca 0.12 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.44 2bye n ILE 48 Cb 0.38 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 39.27 2bye n ILE 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 2bye s LYS 49 N 0.00 3.71 0.00 0.38 -2.85 -1.26 -2.27 119.74 117.45 2bye s LYS 49 Ca 0.00 0.32 0.00 0.00 -1.00 0.00 0.00 55.97 55.29 2bye s LYS 49 Cb 0.00 -3.84 0.00 0.00 -2.06 0.00 0.00 37.83 31.93 2bye s LYS 49 CO 0.00 -0.96 0.00 -2.30 0.10 0.00 0.00 175.35 172.19 2bye n PRO 50 N 6.65 2.27 -2.43 1.78 -0.02 -1.26 -4.84 135.00 137.14 2bye n PRO 50 Ca 0.05 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.10 2bye n PRO 50 Cb 0.48 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.97 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 0.00 4.61 -2.33 -1.45 0.31 -1.26 -4.97 118.33 113.25 2bye n VAL 51 Ca 0.00 -4.69 -0.40 0.00 -0.01 0.00 0.00 64.34 59.24 2bye n VAL 51 Cb 0.00 -2.28 -0.03 0.00 -0.91 0.00 0.00 33.84 30.62 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 -0.36 3.58 0.00 2.52 -4.23 -1.26 -4.90 115.64 110.99 2bye s THR 52 Ca 0.39 0.36 0.00 0.00 -1.18 0.00 0.00 61.69 61.26 2bye s THR 52 Cb 0.10 -4.46 0.00 0.00 1.34 0.00 0.00 72.50 69.47 2bye s THR 52 CO 0.02 -1.39 0.00 1.07 -0.54 0.00 0.00 174.62 173.78 2bye n THR 53 N 6.78 0.00 0.41 3.99 5.66 -1.26 -4.97 114.28 124.88 2bye n THR 53 Ca 0.11 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.11 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 0.21 -4.76 1.09 8.00 -1.26 -4.80 116.55 115.03 2bye n ASP 54 Ca 0.00 -0.62 -0.36 0.00 0.71 0.00 0.00 54.79 54.52 2bye n ASP 54 Cb 0.00 -0.11 0.02 0.00 -0.02 0.00 0.00 41.12 41.01 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 -1.31 2.51 0.34 1.24 2.02 -1.26 -1.62 117.35 119.27 2bye s TYR 55 Ca 0.00 1.51 -0.15 0.00 -0.37 0.00 0.00 57.07 58.06 2bye s TYR 55 Cb 0.00 -3.46 0.03 0.00 -0.40 0.00 0.00 41.96 38.13 2bye s TYR 55 CO 0.00 -2.05 0.70 -0.59 -1.57 0.00 0.00 175.55 172.04 2bye s PHE 56 N -1.59 0.21 0.39 2.71 -0.71 -0.88 -4.93 117.98 113.19 2bye s PHE 56 Ca 0.74 -0.74 0.08 0.00 -1.04 0.00 0.00 56.93 55.96 2bye s PHE 56 Cb -0.30 0.61 -0.01 0.00 -1.21 0.00 0.00 43.02 42.11 2bye s PHE 56 CO 0.34 -1.37 0.47 -0.51 -1.34 0.00 0.00 175.22 172.80 2bye s LEU 57 N -3.05 3.64 0.08 -1.99 1.02 -1.16 0.44 118.68 117.66 2bye s LEU 57 Ca 0.17 -0.47 -0.24 0.00 0.02 0.00 0.00 54.13 53.61 2bye s LEU 57 Cb -0.04 -2.47 0.06 0.00 0.02 0.00 0.00 46.19 43.77 2bye s LEU 57 CO 0.11 -0.62 0.59 -0.04 0.02 0.00 0.00 176.35 176.42 2bye s MET 58 N -4.21 1.16 -0.16 1.70 -1.94 -0.36 0.72 119.30 116.20 2bye s MET 58 Ca 0.49 -0.26 -0.15 0.00 -1.71 0.00 0.00 55.69 54.07 2bye s MET 58 Cb -0.08 0.53 -0.04 0.00 2.01 0.00 0.00 34.83 37.25 2bye s MET 58 CO 0.30 -0.45 0.34 -1.21 -0.01 0.00 0.00 175.02 174.00 2bye s GLU 59 N -2.84 4.25 -0.39 2.03 2.02 -0.71 -0.52 118.70 122.55 2bye s GLU 59 Ca -0.03 0.17 -0.17 0.00 0.02 0.00 0.00 54.97 54.96 2bye s GLU 59 Cb -0.01 -3.45 0.01 0.00 0.10 0.00 0.00 34.13 30.78 2bye s GLU 59 CO -0.05 0.16 0.46 -1.21 0.02 0.00 0.00 175.26 174.65 2bye s GLU 60 N 0.68 3.36 -0.48 1.61 0.41 -0.14 -4.00 118.70 120.14 2bye s GLU 60 Ca 0.18 -0.48 -0.19 0.00 -0.41 0.00 0.00 54.97 54.08 2bye s GLU 60 Cb -0.14 -3.89 0.05 0.00 -1.78 0.00 0.00 34.13 28.38 2bye s GLU 60 CO 0.06 -0.74 0.57 0.15 -0.49 0.00 0.00 175.26 174.81 2bye s LYS 61 N 2.25 3.12 0.37 1.61 3.01 -1.26 -3.71 119.74 125.13 2bye s LYS 61 Ca 0.15 -0.86 -0.27 0.00 -1.01 0.00 0.00 55.97 53.98 2bye s LYS 61 Cb -0.16 -4.06 -0.09 0.00 -1.01 0.00 0.00 37.83 32.50 2bye s LYS 61 CO 0.14 -1.11 1.28 -0.47 0.51 0.00 0.00 175.35 175.69 2bye s TYR 62 N 2.46 2.99 -0.81 3.18 5.04 -1.26 -4.90 117.35 124.05 2bye s TYR 62 Ca 0.14 1.44 -0.25 0.00 -2.44 0.00 0.00 57.07 55.96 2bye s TYR 62 Cb -0.19 -3.62 0.00 0.00 0.35 0.00 0.00 41.96 38.50 2bye s TYR 62 CO 0.12 -1.82 1.64 0.12 -1.34 0.00 0.00 175.55 174.28 2bye s PHE 63 N -1.22 2.05 -0.73 4.97 5.36 -1.26 -4.63 117.98 122.52 2bye s PHE 63 Ca 0.53 0.16 0.07 0.00 -0.96 0.00 0.00 56.93 56.73 2bye s PHE 63 Cb -0.38 -4.35 0.15 0.00 -0.34 0.00 0.00 43.02 38.10 2bye s PHE 63 CO 0.49 -2.03 1.01 -0.89 -1.46 0.00 0.00 175.22 172.34 2bye n ILE 64 N 7.10 0.63 -2.06 3.12 5.41 -1.26 -5.03 119.36 127.27 2bye n ILE 64 Ca 0.24 -0.81 -0.42 0.00 1.00 0.00 0.00 62.75 62.75 2bye n ILE 64 Cb 0.50 0.74 -0.03 0.00 -0.71 0.00 0.00 39.64 40.14 2bye n ILE 64 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 2bye s SER 65 N -0.86 6.71 0.00 4.38 0.01 -1.26 -4.87 113.70 117.81 2bye s SER 65 Ca 0.13 2.27 0.00 0.00 1.31 0.00 0.00 55.95 59.66 2bye s SER 65 Cb 0.07 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.75 2bye s SER 65 CO 0.10 -0.85 0.28 0.29 0.41 0.00 0.00 173.24 173.48 2bye n LYS 66 N 6.08 1.38 0.00 12.44 5.02 -1.19 -4.85 118.16 137.04 2bye n LYS 66 Ca 0.15 -0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 2bye n LYS 66 Cb 0.42 -0.76 0.00 0.00 -0.02 0.00 0.00 35.03 34.67 2bye n LYS 66 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2bye n GLU 67 N -0.28 0.00 0.00 1.97 -0.58 0.13 -4.85 120.64 117.04 2bye n GLU 67 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2bye n GLU 67 Cb 0.03 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.90 2bye n GLU 67 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2bye n LYS 68 N 0.00 0.00 -3.69 3.49 4.76 -1.26 -3.99 118.16 117.47 2bye n LYS 68 Ca 0.00 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.09 2bye n LYS 68 Cb 0.00 0.00 -0.08 0.00 -1.84 0.00 0.00 35.03 33.11 2bye n LYS 68 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2bye s ASN 69 N -3.63 5.71 -1.73 4.39 2.47 -1.26 -4.78 114.94 116.10 2bye s ASN 69 Ca 0.00 -3.60 0.00 0.00 0.42 0.00 0.00 52.86 49.68 2bye s ASN 69 Cb 0.00 -1.86 0.00 0.00 -1.45 0.00 0.00 41.25 37.94 2bye s ASN 69 CO 0.00 -0.20 0.00 1.21 -3.72 0.00 0.00 177.10 174.39 2bye n GLU 70 N 2.47 -1.45 -3.46 0.43 2.13 -1.26 -4.88 120.64 114.61 2bye n GLU 70 Ca 0.19 0.96 -0.41 0.00 0.66 0.00 0.00 57.16 58.56 2bye n GLU 70 Cb 0.37 -5.32 -0.03 0.00 0.27 0.00 0.00 31.44 26.73 2bye n GLU 70 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2bye s ARG 72 N -1.19 4.14 -1.06 0.00 6.06 -1.26 0.21 118.95 125.84 2bye s ARG 72 Ca 0.28 2.62 -0.17 0.00 -2.50 0.00 0.00 55.73 55.96 2bye s ARG 72 Cb -0.09 -4.01 0.13 0.00 0.06 0.00 0.00 34.95 31.04 2bye s ARG 72 CO -0.10 -0.93 1.30 0.21 -2.50 0.00 0.00 175.30 173.28 2bye s LYS 73 N 4.01 3.79 -0.29 5.12 2.20 -1.26 -4.65 119.74 128.67 2bye s LYS 73 Ca 0.87 -2.01 0.01 0.00 -0.36 0.00 0.00 55.97 54.48 2bye s LYS 73 Cb -0.44 -5.05 0.20 0.00 -1.51 0.00 0.00 37.83 31.03 2bye s LYS 73 CO 0.40 -1.84 0.71 -1.14 -0.36 0.00 0.00 175.35 173.13 2bye s GLN 74 N 2.60 0.45 -0.97 4.03 0.74 -1.26 -5.05 119.66 120.20 2bye s GLN 74 Ca 0.39 0.47 -0.24 0.00 0.05 0.00 0.00 55.36 56.03 2bye s GLN 74 Cb -0.03 0.22 -0.02 0.00 1.10 0.00 0.00 33.01 34.28 2bye s GLN 74 CO -0.05 -0.82 1.79 -2.14 -0.55 0.00 0.00 175.29 173.52 2bye s PRO 75 N 2.87 2.92 -1.16 1.67 0.02 -1.26 -4.90 135.00 135.14 2bye s PRO 75 Ca 0.15 -0.67 -0.18 0.00 0.02 0.00 0.00 61.00 60.32 2bye s PRO 75 Cb -0.08 -5.18 0.11 0.00 0.02 0.00 0.00 34.50 29.36 2bye s PRO 75 CO -0.25 -3.03 1.50 -0.59 -0.33 0.00 0.00 177.00 174.30 2bye s PHE 76 N 8.40 3.01 -0.23 6.54 -0.71 -1.26 -4.97 117.98 128.76 2bye s PHE 76 Ca 0.62 -1.60 -0.29 0.00 -1.04 0.00 0.00 56.93 54.62 2bye s PHE 76 Cb -0.04 -4.54 -0.01 0.00 -1.21 0.00 0.00 43.02 37.22 2bye s PHE 76 CO -0.02 -1.66 1.38 -0.65 -1.34 0.00 0.00 175.22 172.93 2bye s GLN 77 N 3.31 4.00 -0.24 1.99 -1.52 -1.26 -4.85 119.66 121.09 2bye s GLN 77 Ca 0.46 1.51 -0.08 0.00 -1.95 0.00 0.00 55.36 55.30 2bye s GLN 77 Cb -0.00 -3.89 -0.03 0.00 -0.22 0.00 0.00 33.01 28.87 2bye s GLN 77 CO -0.00 -1.02 0.09 -0.98 -0.25 0.00 0.00 175.29 173.12 2bye s ARG 78 N 4.07 3.77 0.21 2.91 1.70 -1.26 -5.01 118.95 125.34 2bye s ARG 78 Ca 0.60 -0.43 -0.24 0.00 -0.47 0.00 0.00 55.73 55.19 2bye s ARG 78 Cb -0.21 -3.36 -0.08 0.00 -0.57 0.00 0.00 34.95 30.73 2bye s ARG 78 CO 0.22 -0.09 0.80 0.00 -1.08 0.00 0.00 175.30 175.15 2bye s ALA 79 N 1.39 3.40 -0.40 7.88 0.00 -1.26 -1.74 121.76 131.02 2bye s ALA 79 Ca 0.06 0.36 -0.25 0.00 0.00 0.00 0.00 51.96 52.13 2bye s ALA 79 Cb -0.15 -2.97 0.02 0.00 0.00 0.00 0.00 23.12 20.02 2bye s ALA 79 CO 0.04 0.28 0.87 0.42 0.00 0.00 0.00 175.76 177.37 2bye s ILE 80 N -1.30 4.60 0.20 0.00 -1.09 0.22 -4.92 121.20 118.91 2bye s ILE 80 Ca 0.40 0.90 -0.07 0.00 -2.23 0.00 0.00 60.65 59.65 2bye s ILE 80 Cb -0.21 -4.32 -0.06 0.00 -1.58 0.00 0.00 42.46 36.28 2bye s ILE 80 CO 0.25 -0.61 0.47 -0.83 -1.23 0.00 0.00 174.94 173.00 2bye s GLY 81 N 2.00 2.23 0.52 6.18 0.00 -1.26 -3.00 107.32 113.99 2bye s GLY 81 Ca 0.35 -0.42 0.37 0.00 0.00 0.00 0.00 44.72 45.02 2bye s GLY 81 CO 0.21 -0.31 1.73 -2.55 0.00 0.00 0.00 173.10 172.18 2bye h PRO 82 N 2.60 0.05 -0.24 2.90 0.11 -1.97 0.59 132.00 136.05 2bye h PRO 82 Ca -0.47 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2bye h PRO 82 Cb 1.17 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2bye h PRO 82 CO 0.70 0.03 -0.01 0.93 -0.21 0.00 0.00 178.00 179.45 2bye h GLU 83 N 0.05 0.42 -6.34 1.05 4.39 -1.97 -3.30 114.58 108.89 2bye h GLU 83 Ca 0.68 -0.14 -0.54 0.00 0.34 0.00 0.00 59.36 59.70 2bye h GLU 83 Cb 2.55 -0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 31.10 2bye h GLU 83 CO -0.08 0.61 1.11 -1.21 -1.16 0.00 0.00 179.01 178.28 2bye s GLU 84 N -4.96 3.17 0.15 2.33 2.02 0.20 -4.90 118.70 116.72 2bye s GLU 84 Ca -0.14 0.21 -0.29 0.00 0.02 0.00 0.00 54.97 54.77 2bye s GLU 84 Cb 0.07 -4.18 -0.07 0.00 0.10 0.00 0.00 34.13 30.06 2bye s GLU 84 CO 0.74 -2.12 0.91 -1.21 0.02 0.00 0.00 175.26 173.61 2bye s GLU 85 N 5.78 4.71 0.43 1.61 2.02 -1.26 -4.42 118.70 127.58 2bye s GLU 85 Ca 0.47 1.39 0.11 0.00 0.02 0.00 0.00 54.97 56.97 2bye s GLU 85 Cb -0.10 -3.33 0.96 0.00 0.10 0.00 0.00 34.13 31.75 2bye s GLU 85 CO 0.21 0.35 2.01 -0.84 0.02 0.00 0.00 175.26 177.01 2bye h ILE 86 N 3.71 1.11 0.00 -1.63 3.07 -1.88 0.29 117.51 122.18 2bye h ILE 86 Ca -0.44 -0.44 0.00 0.00 1.55 0.00 0.00 64.86 65.53 2bye h ILE 86 Cb 1.21 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.80 2bye h ILE 86 CO 0.70 0.14 0.00 0.24 -1.05 0.00 0.00 178.15 178.18 2bye h MET 87 N 0.20 0.00 0.03 0.16 2.86 -1.92 0.20 114.93 116.46 2bye h MET 87 Ca 0.05 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.47 2bye h MET 87 Cb 0.19 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 2bye h MET 87 CO 0.01 0.00 -0.98 1.96 1.06 0.00 0.00 176.91 178.95 2bye h GLN 88 N 0.00 0.23 0.04 1.72 4.20 -1.33 -2.46 115.11 117.52 2bye h GLN 88 Ca 0.00 -0.29 -0.00 0.00 0.06 0.00 0.00 58.65 58.42 2bye h GLN 88 Cb 0.54 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.42 2bye h GLN 88 CO 0.00 1.04 -0.02 0.82 -0.67 0.00 0.00 178.83 180.00 2bye h ILE 89 N 0.11 1.34 -0.12 2.54 1.08 -1.03 -3.26 117.51 118.18 2bye h ILE 89 Ca -0.07 -1.49 -0.15 0.00 -0.39 0.00 0.00 64.86 62.76 2bye h ILE 89 Cb 1.65 2.29 -0.01 0.00 -3.07 0.00 0.00 36.82 37.68 2bye h ILE 89 CO 0.15 0.36 -0.58 -0.07 -0.69 0.00 0.00 178.15 177.33 2bye h LEU 90 N -0.75 0.42 0.00 1.44 3.38 -0.73 -2.58 115.31 116.48 2bye h LEU 90 Ca -0.01 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2bye h LEU 90 Cb 0.64 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2bye h LEU 90 CO 0.01 0.90 0.00 -1.20 0.09 0.00 0.00 178.44 178.24 2bye n SER 91 N -3.92 0.00 -0.00 -0.43 7.64 -0.92 -3.11 113.62 112.88 2bye n SER 91 Ca -0.03 0.23 -0.08 0.00 1.01 0.00 0.00 58.87 60.00 2bye n SER 91 Cb 0.61 -0.40 -0.06 0.00 -1.01 0.00 0.00 64.21 63.35 2bye n SER 91 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2bye h SER 92 N 0.00 -0.10 0.00 6.43 0.02 -1.49 -3.47 113.55 114.94 2bye h SER 92 Ca 0.00 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2bye h SER 92 Cb 0.33 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2bye h SER 92 CO 0.00 0.54 0.00 1.87 -1.14 0.00 0.00 176.83 178.10 2bye n TRP 93 N -4.82 0.00 -1.65 3.45 -0.00 -1.18 -4.91 117.44 108.33 2bye n TRP 93 Ca -0.06 0.00 -0.61 0.00 -0.00 0.00 0.00 57.50 56.84 2bye n TRP 93 Cb 0.23 0.00 -0.09 0.00 -0.00 0.00 0.00 31.31 31.45 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 0.00 1.83 -1.84 5.87 3.72 -1.26 -4.81 117.46 120.98 2bye n PHE 94 Ca 0.00 0.73 -0.41 0.00 -0.05 0.00 0.00 57.45 57.72 2bye n PHE 94 Cb 0.00 -2.38 -0.01 0.00 -0.94 0.00 0.00 39.48 36.15 2bye n PHE 94 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2bye s PRO 95 N 3.88 4.15 0.00 -1.08 0.04 -1.26 -4.98 135.00 135.74 2bye s PRO 95 Ca 1.04 2.52 0.00 0.00 0.04 0.00 0.00 61.00 64.59 2bye s PRO 95 Cb -1.24 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 30.28 2bye s PRO 95 CO 0.70 -0.55 0.38 0.39 0.04 0.00 0.00 177.00 177.95 2bye n GLU 96 N 1.67 0.00 0.01 4.56 1.02 -1.26 -4.89 120.64 121.76 2bye n GLU 96 Ca 0.06 0.27 -0.01 0.00 -0.02 0.00 0.00 57.16 57.46 2bye n GLU 96 Cb 0.39 -1.02 -0.00 0.00 -0.02 0.00 0.00 31.44 30.79 2bye n GLU 96 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2bye n GLU 97 N -1.31 0.05 0.00 3.49 0.00 -1.26 -5.10 120.64 116.51 2bye n GLU 97 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.18 2bye n GLU 97 Cb 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 31.44 31.04 2bye n GLU 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2bye n GLY 98 N 3.15 0.98 0.33 8.31 0.00 -1.26 -5.05 105.19 111.65 2bye n GLY 98 Ca -0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 0.00 -2.30 1.61 4.11 -1.26 -4.74 117.16 114.58 2bye n TYR 99 Ca 0.00 -0.21 -0.34 0.00 -0.00 0.00 0.00 57.90 57.35 2bye n TYR 99 Cb 0.00 -0.06 -0.04 0.00 -0.00 0.00 0.00 39.34 39.24 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 -0.59 3.06 -0.18 -3.48 -1.94 -1.26 -4.88 119.30 110.03 2bye s MET 100 Ca 0.06 -0.68 -0.07 0.00 -1.71 0.00 0.00 55.69 53.29 2bye s MET 100 Cb 0.05 -5.19 0.08 0.00 2.01 0.00 0.00 34.83 31.78 2bye s MET 100 CO 0.01 -2.79 0.39 0.20 -0.01 0.00 0.00 175.02 172.81 2bye s GLY 101 N 6.51 -0.31 -0.16 -0.03 0.00 -1.24 -4.34 107.32 107.75 2bye s GLY 101 Ca 0.58 1.41 -0.30 0.00 0.00 0.00 0.00 44.72 46.41 2bye s GLY 101 CO -0.05 2.11 0.98 1.09 0.00 0.00 0.00 173.10 177.23 2bye s ARG 102 N 2.22 0.62 -0.10 2.90 3.03 -1.25 -4.94 118.95 121.43 2bye s ARG 102 Ca -0.04 0.16 -0.19 0.00 2.03 0.00 0.00 55.73 57.70 2bye s ARG 102 Cb -0.11 0.29 -0.04 0.00 -1.03 0.00 0.00 34.95 34.06 2bye s ARG 102 CO -0.12 -0.19 0.50 0.42 -1.13 0.00 0.00 175.30 174.78 2bye s ILE 103 N -1.08 5.15 -0.24 4.99 1.01 -1.25 -0.97 121.20 128.81 2bye s ILE 103 Ca -0.02 1.01 0.00 0.00 0.00 0.00 0.00 60.65 61.64 2bye s ILE 103 Cb -0.01 -3.84 0.04 0.00 0.01 0.00 0.00 42.46 38.66 2bye s ILE 103 CO 0.02 0.34 -0.09 0.68 0.00 0.00 0.00 174.94 175.89 2bye s VAL 104 N 0.49 2.53 -0.37 2.92 -7.23 0.32 -0.78 120.40 118.28 2bye s VAL 104 Ca 0.27 -1.22 -0.28 0.00 -1.81 0.00 0.00 61.98 58.94 2bye s VAL 104 Cb -0.16 -2.33 -0.02 0.00 0.56 0.00 0.00 36.38 34.44 2bye s VAL 104 CO 0.12 0.16 1.84 -0.22 -0.31 0.00 0.00 175.10 176.69 2bye s LEU 105 N 1.25 3.47 0.00 1.32 2.96 -1.26 -1.23 118.68 125.19 2bye s LEU 105 Ca -0.02 1.17 0.05 0.00 -0.22 0.00 0.00 54.13 55.11 2bye s LEU 105 Cb -0.17 -3.33 0.05 0.00 0.50 0.00 0.00 46.19 43.24 2bye s LEU 105 CO -0.06 -1.86 0.44 0.29 -1.32 0.00 0.00 176.35 173.84 2bye n LYS 106 N 8.57 0.81 -4.28 1.98 4.76 0.17 -4.33 118.16 125.83 2bye n LYS 106 Ca 0.23 -1.90 -0.21 0.00 -2.87 0.00 0.00 58.31 53.56 2bye n LYS 106 Cb 0.48 -0.08 -0.12 0.00 -1.84 0.00 0.00 35.03 33.47 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 -1.23 1.60 0.00 -0.18 -4.23 -1.26 -2.06 115.64 108.28 2bye s THR 107 Ca 0.33 -1.73 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 2bye s THR 107 Cb -0.03 -1.64 0.00 0.00 1.34 0.00 0.00 72.50 72.18 2bye s THR 107 CO 0.21 -0.28 1.10 0.00 -0.54 0.00 0.00 174.62 175.11 2bye n GLN 108 N 0.60 0.83 -4.28 3.99 1.13 -0.64 -4.81 117.38 114.21 2bye n GLN 108 Ca -0.16 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.61 2bye n GLN 108 Cb 0.56 -1.08 -0.11 0.00 0.11 0.00 0.00 30.24 29.72 2bye n GLN 108 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 2bye s GLN 109 N 0.22 1.92 0.00 -1.09 0.74 -1.26 -5.09 119.66 115.10 2bye s GLN 109 Ca 0.00 -1.11 0.14 0.00 0.05 0.00 0.00 55.36 54.44 2bye s GLN 109 Cb 0.00 -2.19 0.86 0.00 1.10 0.00 0.00 33.01 32.78 2bye s GLN 109 CO 0.00 0.49 1.28 -0.85 -0.55 0.00 0.00 175.29 175.66