#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vyx s LYS 3 N 0.00 1.09 -0.05 1.61 1.02 -1.26 -5.17 119.74 116.99 2vyx s LYS 3 Ca 0.00 -1.48 0.02 0.00 0.02 0.00 0.00 55.97 54.54 2vyx s LYS 3 Cb 0.00 -0.62 0.01 0.00 -0.52 0.00 0.00 37.83 36.70 2vyx s LYS 3 CO 0.00 0.06 -0.10 0.08 -0.92 0.00 0.00 175.35 174.46 2vyx s VAL 4 N -3.34 0.93 0.21 3.17 1.01 -1.26 -5.10 120.40 116.02 2vyx s VAL 4 Ca 0.18 -0.40 0.09 0.00 0.00 0.00 0.00 61.98 61.85 2vyx s VAL 4 Cb 0.03 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2vyx s VAL 4 CO 0.01 0.30 -0.03 -0.31 0.00 0.00 0.00 175.10 175.07 2vyx s TYR 5 N 0.49 2.73 0.04 5.22 1.51 -1.26 -1.03 117.35 125.04 2vyx s TYR 5 Ca -0.09 -0.19 0.08 0.00 -1.01 0.00 0.00 57.07 55.85 2vyx s TYR 5 Cb -0.13 -1.29 -0.03 0.00 -0.11 0.00 0.00 41.96 40.40 2vyx s TYR 5 CO 0.02 0.55 -0.20 0.21 -1.11 0.00 0.00 175.55 175.02 2vyx s LYS 6 N -3.16 2.00 -0.11 -0.62 2.20 -0.26 -4.89 119.74 114.90 2vyx s LYS 6 Ca 0.28 -1.02 -0.00 0.00 -0.36 0.00 0.00 55.97 54.87 2vyx s LYS 6 Cb -0.08 -2.13 -0.02 0.00 -1.51 0.00 0.00 37.83 34.08 2vyx s LYS 6 CO 0.18 0.53 -0.09 0.15 -0.36 0.00 0.00 175.35 175.76 2vyx s LYS 7 N -1.38 3.13 0.08 4.03 1.02 -1.26 -1.29 119.74 124.09 2vyx s LYS 7 Ca 0.14 -0.60 0.10 0.00 0.02 0.00 0.00 55.97 55.62 2vyx s LYS 7 Cb -0.10 -2.66 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 2vyx s LYS 7 CO 0.04 0.42 -0.25 0.14 -0.92 0.00 0.00 175.35 174.78 2vyx s VAL 8 N -0.17 2.07 -0.31 3.17 -7.23 -0.58 -4.93 120.40 112.42 2vyx s VAL 8 Ca 0.01 -1.52 -0.10 0.00 -1.81 0.00 0.00 61.98 58.56 2vyx s VAL 8 Cb -0.13 -1.81 -0.01 0.00 0.56 0.00 0.00 36.38 34.99 2vyx s VAL 8 CO 0.03 0.19 0.17 -0.70 -0.31 0.00 0.00 175.10 174.48 2vyx s GLU 9 N -1.61 3.41 0.24 4.82 2.12 -1.26 -0.75 118.70 125.67 2vyx s GLU 9 Ca 0.11 -0.68 0.11 0.00 0.36 0.00 0.00 54.97 54.88 2vyx s GLU 9 Cb -0.10 -3.60 -0.05 0.00 0.26 0.00 0.00 34.13 30.64 2vyx s GLU 9 CO 0.04 -0.40 -0.19 -0.51 -0.54 0.00 0.00 175.26 173.66 2vyx s LEU 10 N 1.64 2.61 -0.21 2.70 1.43 0.23 -4.97 118.68 122.12 2vyx s LEU 10 Ca 0.05 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.25 2vyx s LEU 10 Cb -0.17 -1.22 0.04 0.00 0.03 0.00 0.00 46.19 44.88 2vyx s LEU 10 CO 0.07 0.07 -0.11 -0.69 0.23 0.00 0.00 176.35 175.92 2vyx s VAL 11 N -2.15 1.75 0.06 -1.59 1.01 -1.26 -0.46 120.40 117.76 2vyx s VAL 11 Ca 0.27 -1.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 2vyx s VAL 11 Cb -0.06 -1.82 -0.06 0.00 0.00 0.00 0.00 36.38 34.43 2vyx s VAL 11 CO 0.14 0.15 0.42 -0.83 0.00 0.00 0.00 175.10 174.98 2vyx s GLY 12 N 1.34 2.40 0.07 4.51 0.00 -0.52 -4.87 107.32 110.25 2vyx s GLY 12 Ca -0.02 -0.29 0.06 0.00 0.00 0.00 0.00 44.72 44.47 2vyx s GLY 12 CO -0.08 -0.02 -0.16 -0.51 0.00 0.00 0.00 173.10 172.33 2vyx s THR 13 N -1.30 1.30 -0.17 0.90 -4.23 -1.25 -1.04 115.64 109.85 2vyx s THR 13 Ca 0.31 -1.26 -0.26 0.00 -1.18 0.00 0.00 61.69 59.29 2vyx s THR 13 Cb -0.15 -1.20 0.07 0.00 1.34 0.00 0.00 72.50 72.56 2vyx s THR 13 CO 0.17 -0.08 0.66 -0.55 -0.54 0.00 0.00 174.62 174.28 2vyx s SER 14 N -1.55 -0.66 0.25 3.99 0.15 -0.74 -4.54 113.70 110.59 2vyx s SER 14 Ca 0.02 1.06 0.25 0.00 0.70 0.00 0.00 55.95 57.98 2vyx s SER 14 Cb -0.09 1.02 0.87 0.00 -1.71 0.00 0.00 66.02 66.11 2vyx s SER 14 CO 0.02 -0.39 1.75 -0.33 1.20 0.00 0.00 173.24 175.50 2vyx h GLU 15 N 4.24 0.00 0.05 5.44 5.08 -1.87 -0.54 114.58 126.99 2vyx h GLU 15 Ca -0.28 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 57.88 2vyx h GLU 15 Cb 1.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2vyx h GLU 15 CO 0.21 0.00 -1.06 0.93 -1.00 0.00 0.00 179.01 178.09 2vyx h GLU 16 N 0.00 0.11 0.00 2.33 4.39 -1.95 -3.46 114.58 116.00 2vyx h GLU 16 Ca 0.00 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.51 2vyx h GLU 16 Cb 0.61 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 2vyx h GLU 16 CO 0.00 1.09 0.00 0.41 -1.16 0.00 0.00 179.01 179.35 2vyx n GLY 17 N 1.61 -1.76 0.11 -3.84 0.00 -1.26 -5.01 105.19 95.03 2vyx n GLY 17 Ca -0.24 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 2vyx n GLY 17 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2vyx h LEU 18 N 0.00 0.25 -0.58 0.99 3.38 -1.96 -2.33 115.31 115.05 2vyx h LEU 18 Ca 0.00 -0.54 0.05 0.00 0.09 0.00 0.00 57.88 57.48 2vyx h LEU 18 Cb 0.00 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 2vyx h LEU 18 CO 0.00 0.74 0.31 -0.33 0.09 0.00 0.00 178.44 179.25 2vyx h GLU 19 N -0.23 0.57 -0.46 1.13 3.07 -1.99 -1.42 114.58 115.25 2vyx h GLU 19 Ca 0.01 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 2vyx h GLU 19 Cb 0.69 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.44 2vyx h GLU 19 CO 0.03 0.38 0.21 0.00 -1.40 0.00 0.00 179.01 178.23 2vyx h ALA 20 N 1.30 1.51 -0.42 3.43 0.00 -1.93 0.15 119.26 123.30 2vyx h ALA 20 Ca 0.26 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 2vyx h ALA 20 Cb 0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2vyx h ALA 20 CO -0.16 0.39 -0.16 0.00 0.00 0.00 0.00 179.25 179.31 2vyx h ALA 21 N 1.59 0.59 -0.27 0.00 0.00 -0.83 -0.47 119.26 119.87 2vyx h ALA 21 Ca 0.16 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2vyx h ALA 21 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2vyx h ALA 21 CO -0.02 0.52 0.02 0.82 0.00 0.00 0.00 179.25 180.59 2vyx h ILE 22 N 0.68 1.24 -0.64 0.00 2.04 -0.79 -2.59 117.51 117.45 2vyx h ILE 22 Ca 0.10 -0.85 -0.00 0.00 1.00 0.00 0.00 64.86 65.10 2vyx h ILE 22 Cb 0.71 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 38.04 2vyx h ILE 22 CO 0.05 0.27 0.38 1.56 0.00 0.00 0.00 178.15 180.42 2vyx h GLN 23 N 0.26 0.87 -0.69 2.37 1.08 -0.68 -2.01 115.11 116.30 2vyx h GLN 23 Ca 0.08 -0.07 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 2vyx h GLN 23 Cb 0.38 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 2vyx h GLN 23 CO 0.01 0.61 0.19 0.00 -0.95 0.00 0.00 178.83 178.69 2vyx h ALA 24 N 1.54 1.03 -0.03 3.87 0.00 -0.86 0.74 119.26 125.55 2vyx h ALA 24 Ca 0.23 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2vyx h ALA 24 Cb -0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 2vyx h ALA 24 CO -0.04 0.64 0.01 0.00 0.00 0.00 0.00 179.25 179.86 2vyx h ALA 25 N 1.17 0.04 -0.16 0.00 0.00 -1.14 -2.64 119.26 116.53 2vyx h ALA 25 Ca 0.22 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 2vyx h ALA 25 Cb 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2vyx h ALA 25 CO -0.00 -0.36 -0.37 -0.07 0.00 0.00 0.00 179.25 178.45 2vyx h LEU 26 N -0.14 0.35 -0.73 0.00 3.38 -1.26 -0.73 115.31 116.18 2vyx h LEU 26 Ca 0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2vyx h LEU 26 Cb 0.20 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2vyx h LEU 26 CO -0.00 0.70 0.21 0.00 0.09 0.00 0.00 178.44 179.43 2vyx h ALA 27 N 1.33 0.96 -0.42 1.53 0.00 -0.85 -1.31 119.26 120.50 2vyx h ALA 27 Ca 0.03 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 2vyx h ALA 27 Cb 0.78 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2vyx h ALA 27 CO 0.06 0.67 -0.33 -0.09 0.00 0.00 0.00 179.25 179.56 2vyx h ARG 28 N 1.10 0.96 -0.67 0.00 9.65 -1.22 -3.14 114.38 121.06 2vyx h ARG 28 Ca 0.23 -0.47 0.04 0.00 -1.10 0.00 0.00 59.98 58.68 2vyx h ARG 28 Cb 0.34 -0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.87 2vyx h ARG 28 CO -0.00 1.13 0.40 0.00 2.80 0.00 0.00 179.97 184.30 2vyx h ALA 29 N 0.82 0.88 0.00 2.80 0.00 -0.85 -2.10 119.26 120.81 2vyx h ALA 29 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2vyx h ALA 29 Cb 0.92 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2vyx h ALA 29 CO 0.09 0.14 -0.04 -0.09 0.00 0.00 0.00 179.25 179.34 2vyx h ARG 30 N 0.77 0.00 0.00 0.00 2.43 -1.23 0.76 114.38 117.10 2vyx h ARG 30 Ca 0.28 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.40 2vyx h ARG 30 Cb 0.07 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2vyx h ARG 30 CO -0.13 0.04 -0.24 0.87 -1.51 0.00 0.00 179.97 179.00 2vyx h LYS 31 N 0.00 0.00 0.00 0.20 1.57 -1.33 -3.37 116.57 113.64 2vyx h LYS 31 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2vyx h LYS 31 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2vyx h LYS 31 CO 0.00 0.24 -0.31 0.25 -0.57 0.00 0.00 179.45 179.06 2vyx n THR 32 N -3.67 0.00 -4.51 -0.16 -2.24 -1.02 -5.08 114.28 97.61 2vyx n THR 32 Ca -0.01 -0.05 -0.33 0.00 -2.27 0.00 0.00 64.05 61.38 2vyx n THR 32 Cb 0.36 0.42 -0.10 0.00 -2.10 0.00 0.00 70.33 68.90 2vyx n THR 32 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2vyx s LEU 33 N -1.16 3.25 0.18 3.22 1.43 0.23 -5.12 118.68 120.71 2vyx s LEU 33 Ca 0.00 -0.04 0.09 0.00 -1.03 0.00 0.00 54.13 53.15 2vyx s LEU 33 Cb 0.00 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 2vyx s LEU 33 CO 0.00 0.33 -0.10 -0.13 0.23 0.00 0.00 176.35 176.68 2vyx s ARG 34 N -1.11 2.05 -0.89 1.70 0.52 -1.26 -4.48 118.95 115.47 2vyx s ARG 34 Ca 0.15 -1.28 -0.05 0.00 -0.52 0.00 0.00 55.73 54.03 2vyx s ARG 34 Cb -0.11 -2.15 0.01 0.00 0.52 0.00 0.00 34.95 33.22 2vyx s ARG 34 CO 0.05 0.43 0.65 0.72 0.02 0.00 0.00 175.30 177.17 2vyx n HIS 35 N 0.02 -1.67 -2.27 -0.53 8.25 -1.26 -4.51 115.22 113.25 2vyx n HIS 35 Ca -0.11 0.56 -0.42 0.00 -0.26 0.00 0.00 57.72 57.49 2vyx n HIS 35 Cb 0.56 -3.47 -0.03 0.00 1.12 0.00 0.00 29.99 28.17 2vyx n HIS 35 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2vyx s LEU 36 N -4.83 4.30 -0.05 2.41 1.43 -1.26 -1.80 118.68 118.88 2vyx s LEU 36 Ca 0.32 2.03 -0.02 0.00 -1.03 0.00 0.00 54.13 55.43 2vyx s LEU 36 Cb -0.14 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.50 2vyx s LEU 36 CO 0.40 -0.70 -0.06 0.47 0.23 0.00 0.00 176.35 176.68 2vyx n ASP 37 N 5.50 0.59 -3.90 2.29 8.00 -0.28 -5.00 116.55 123.75 2vyx n ASP 37 Ca 0.13 0.05 -0.09 0.00 0.71 0.00 0.00 54.79 55.59 2vyx n ASP 37 Cb 0.44 -0.14 -0.07 0.00 -0.02 0.00 0.00 41.12 41.33 2vyx n ASP 37 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2vyx s PHE 38 N -2.09 0.27 0.07 1.24 -0.71 -1.10 -5.01 117.98 110.64 2vyx s PHE 38 Ca -0.07 -0.66 -0.04 0.00 -1.04 0.00 0.00 56.93 55.12 2vyx s PHE 38 Cb 0.03 -0.05 -0.03 0.00 -1.21 0.00 0.00 43.02 41.76 2vyx s PHE 38 CO 0.09 -0.64 0.05 -0.59 -1.34 0.00 0.00 175.22 172.79 2vyx s PHE 39 N -3.91 0.42 -0.06 3.49 -0.71 -1.26 -0.49 117.98 115.46 2vyx s PHE 39 Ca 0.11 -0.92 -0.02 0.00 -1.04 0.00 0.00 56.93 55.06 2vyx s PHE 39 Cb 0.04 -0.28 0.04 0.00 -1.21 0.00 0.00 43.02 41.60 2vyx s PHE 39 CO -0.05 -0.44 0.10 -1.21 -1.34 0.00 0.00 175.22 172.27 2vyx s GLU 40 N -3.91 -0.01 0.01 1.99 2.02 -0.29 -4.97 118.70 113.53 2vyx s GLU 40 Ca 0.07 0.41 -0.30 0.00 0.02 0.00 0.00 54.97 55.17 2vyx s GLU 40 Cb 0.07 -0.35 -0.04 0.00 0.10 0.00 0.00 34.13 33.91 2vyx s GLU 40 CO -0.10 -0.28 1.19 0.08 0.02 0.00 0.00 175.26 176.17 2vyx s VAL 41 N 1.92 4.19 -0.23 2.63 1.01 -1.26 -0.49 120.40 128.17 2vyx s VAL 41 Ca 0.00 1.55 0.02 0.00 0.00 0.00 0.00 61.98 63.56 2vyx s VAL 41 Cb -0.12 -4.00 -0.16 0.00 0.00 0.00 0.00 36.38 32.11 2vyx s VAL 41 CO -0.04 0.07 -0.20 0.29 0.00 0.00 0.00 175.10 175.22 2vyx n LYS 42 N 4.49 0.60 -3.81 2.72 4.76 0.91 -4.95 118.16 122.89 2vyx n LYS 42 Ca 0.10 0.13 -0.12 0.00 -2.87 0.00 0.00 58.31 55.55 2vyx n LYS 42 Cb 0.47 -1.47 -0.09 0.00 -1.84 0.00 0.00 35.03 32.10 2vyx n LYS 42 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2vyx s GLU 43 N -2.47 0.65 -0.16 1.97 2.02 -1.09 -4.99 118.70 114.65 2vyx s GLU 43 Ca -0.31 -0.41 0.00 0.00 0.02 0.00 0.00 54.97 54.28 2vyx s GLU 43 Cb 0.08 0.28 0.02 0.00 0.10 0.00 0.00 34.13 34.61 2vyx s GLU 43 CO 0.55 -0.18 -0.14 0.42 0.02 0.00 0.00 175.26 175.92 2vyx s ILE 44 N -1.87 1.63 0.20 -1.63 1.01 -1.26 -0.77 121.20 118.51 2vyx s ILE 44 Ca -0.10 -0.70 0.03 0.00 0.00 0.00 0.00 60.65 59.87 2vyx s ILE 44 Cb -0.04 -1.54 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 2vyx s ILE 44 CO 0.00 0.44 0.21 -2.11 0.00 0.00 0.00 174.94 173.48 2vyx n ARG 45 N 4.75 0.30 -3.13 2.79 1.85 -0.11 -5.01 116.66 118.10 2vyx n ARG 45 Ca -0.17 -1.83 0.00 0.00 -1.00 0.00 0.00 57.85 54.85 2vyx n ARG 45 Cb 0.50 1.58 0.00 0.00 -1.05 0.00 0.00 32.46 33.49 2vyx n ARG 45 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2vyx n GLY 46 N -0.36 -1.32 3.61 2.89 0.00 -1.26 -0.21 105.19 108.55 2vyx n GLY 46 Ca 0.03 -1.04 -0.23 0.00 0.00 0.00 0.00 46.02 44.78 2vyx n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vyx s THR 47 N -2.05 3.19 -0.06 2.61 -4.23 -0.31 -4.98 115.64 109.81 2vyx s THR 47 Ca 0.00 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.56 2vyx s THR 47 Cb 0.00 -2.74 -0.01 0.00 1.34 0.00 0.00 72.50 71.09 2vyx s THR 47 CO 0.00 -0.36 -0.24 -0.63 -0.54 0.00 0.00 174.62 172.85 2vyx s ILE 48 N -2.38 2.00 0.00 2.99 1.01 -1.26 -0.59 121.20 122.98 2vyx s ILE 48 Ca 0.32 -1.04 0.00 0.00 0.00 0.00 0.00 60.65 59.93 2vyx s ILE 48 Cb -0.06 -1.70 0.00 0.00 0.01 0.00 0.00 42.46 40.72 2vyx s ILE 48 CO 0.19 0.56 0.00 0.61 0.00 0.00 0.00 174.94 176.30 2vyx n GLY 49 N 2.99 5.50 0.05 6.18 0.00 -0.26 -4.79 105.19 114.86 2vyx n GLY 49 Ca -0.18 -1.89 0.09 0.00 0.00 0.00 0.00 46.02 44.05 2vyx n GLY 49 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2vyx n GLU 50 N 0.00 0.08 -0.34 1.61 -0.58 -1.26 -2.42 120.64 117.73 2vyx n GLU 50 Ca 0.00 0.30 0.08 0.00 -0.42 0.00 0.00 57.16 57.12 2vyx n GLU 50 Cb 0.00 -1.64 0.24 0.00 -0.57 0.00 0.00 31.44 29.47 2vyx n GLU 50 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2vyx n ALA 51 N -1.61 2.50 0.00 0.62 0.00 -1.26 -5.09 120.51 115.68 2vyx n ALA 51 Ca 0.03 -1.42 0.00 0.00 0.00 0.00 0.00 53.44 52.05 2vyx n ALA 51 Cb 0.21 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 18.98 2vyx n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vyx n GLY 52 N 0.74 0.98 3.68 0.00 0.00 -1.01 -4.95 105.19 104.61 2vyx n GLY 52 Ca 0.18 -1.53 -0.45 0.00 0.00 0.00 0.00 46.02 44.22 2vyx n GLY 52 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2vyx n VAL 53 N 0.00 0.21 -0.10 1.61 0.31 -1.26 -1.10 118.33 118.00 2vyx n VAL 53 Ca 0.00 -0.04 -0.18 0.00 -0.01 0.00 0.00 64.34 64.12 2vyx n VAL 53 Cb 0.00 -1.77 -0.09 0.00 -0.91 0.00 0.00 33.84 31.07 2vyx n VAL 53 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2vyx n LYS 54 N 4.66 0.54 -3.72 5.55 4.81 0.24 -4.74 118.16 125.51 2vyx n LYS 54 Ca 0.18 0.54 -0.17 0.00 -0.87 0.00 0.00 58.31 57.99 2vyx n LYS 54 Cb 0.31 -1.71 -0.16 0.00 0.02 0.00 0.00 35.03 33.49 2vyx n LYS 54 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2vyx s GLU 55 N -2.35 -0.01 0.28 1.64 2.12 -1.22 -4.45 118.70 114.71 2vyx s GLU 55 Ca -0.26 0.35 -0.28 0.00 0.36 0.00 0.00 54.97 55.14 2vyx s GLU 55 Cb 0.05 -0.32 -0.09 0.00 0.26 0.00 0.00 34.13 34.03 2vyx s GLU 55 CO 0.48 -0.24 0.95 0.71 -0.54 0.00 0.00 175.26 176.62 2vyx s TYR 56 N 1.65 3.82 -0.11 5.30 1.51 -0.21 -1.16 117.35 128.15 2vyx s TYR 56 Ca -0.03 1.84 -0.02 0.00 -1.01 0.00 0.00 57.07 57.86 2vyx s TYR 56 Cb -0.12 -2.97 0.04 0.00 -0.11 0.00 0.00 41.96 38.79 2vyx s TYR 56 CO -0.04 0.28 0.00 -0.65 -1.11 0.00 0.00 175.55 174.03 2vyx s GLN 57 N -1.60 0.69 -0.20 -0.62 -0.21 0.71 -1.79 119.66 116.64 2vyx s GLN 57 Ca 0.46 -0.06 -0.03 0.00 0.02 0.00 0.00 55.36 55.74 2vyx s GLN 57 Cb -0.23 -1.33 -0.01 0.00 1.00 0.00 0.00 33.01 32.44 2vyx s GLN 57 CO 0.29 -0.39 -0.07 0.08 -2.12 0.00 0.00 175.29 173.08 2vyx s VAL 58 N 1.92 3.24 -0.17 1.09 1.01 -0.20 -0.93 120.40 126.36 2vyx s VAL 58 Ca 0.03 -0.55 -0.18 0.00 0.00 0.00 0.00 61.98 61.28 2vyx s VAL 58 Cb -0.14 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 2vyx s VAL 58 CO -0.06 0.45 0.50 -0.69 0.00 0.00 0.00 175.10 175.30 2vyx s VAL 59 N 1.24 5.13 -0.03 2.92 1.01 0.05 -1.44 120.40 129.29 2vyx s VAL 59 Ca 0.03 0.96 0.01 0.00 0.00 0.00 0.00 61.98 62.97 2vyx s VAL 59 Cb -0.14 -3.83 0.02 0.00 0.00 0.00 0.00 36.38 32.42 2vyx s VAL 59 CO -0.02 0.23 -0.03 -0.22 0.00 0.00 0.00 175.10 175.05 2vyx s LEU 60 N 1.29 1.48 -0.05 3.92 2.96 0.39 -0.06 118.68 128.60 2vyx s LEU 60 Ca 0.25 -0.08 -0.15 0.00 -0.22 0.00 0.00 54.13 53.93 2vyx s LEU 60 Cb -0.15 -0.30 -0.05 0.00 0.50 0.00 0.00 46.19 46.18 2vyx s LEU 60 CO 0.10 -0.04 0.39 -1.61 -1.32 0.00 0.00 176.35 173.87 2vyx s GLU 61 N 0.63 4.01 -0.13 1.98 2.02 0.35 -0.60 118.70 126.96 2vyx s GLU 61 Ca -0.07 0.34 0.01 0.00 0.02 0.00 0.00 54.97 55.27 2vyx s GLU 61 Cb -0.10 -3.28 0.02 0.00 0.10 0.00 0.00 34.13 30.86 2vyx s GLU 61 CO -0.01 0.54 -0.15 0.08 0.02 0.00 0.00 175.26 175.75 2vyx s VAL 62 N -0.57 1.58 -0.17 2.63 1.01 0.07 -1.14 120.40 123.80 2vyx s VAL 62 Ca 0.22 -0.66 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 2vyx s VAL 62 Cb -0.16 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 2vyx s VAL 62 CO 0.11 0.46 0.03 -0.83 0.00 0.00 0.00 175.10 174.87 2vyx s GLY 63 N 1.24 1.85 0.02 4.51 0.00 0.36 -1.53 107.32 113.76 2vyx s GLY 63 Ca -0.00 -0.77 0.03 0.00 0.00 0.00 0.00 44.72 43.98 2vyx s GLY 63 CO -0.07 -0.02 -0.09 -0.11 0.00 0.00 0.00 173.10 172.82 2vyx s PHE 64 N 0.29 0.76 -0.03 1.90 -0.12 -0.41 -1.12 117.98 119.25 2vyx s PHE 64 Ca 0.01 -0.28 -0.30 0.00 -0.05 0.00 0.00 56.93 56.32 2vyx s PHE 64 Cb -0.13 -0.47 -0.03 0.00 -0.63 0.00 0.00 43.02 41.77 2vyx s PHE 64 CO 0.01 -0.02 0.99 0.50 -0.05 0.00 0.00 175.22 176.65 2vyx s ARG 65 N -0.78 4.52 0.05 1.99 3.52 -0.74 -1.10 118.95 126.40 2vyx s ARG 65 Ca -0.01 1.42 -0.30 0.00 -0.13 0.00 0.00 55.73 56.71 2vyx s ARG 65 Cb -0.06 -3.48 -0.05 0.00 -1.56 0.00 0.00 34.95 29.80 2vyx s ARG 65 CO 0.00 -0.13 1.10 -0.51 -0.81 0.00 0.00 175.30 174.96 2vyx s LEU 66 N 1.28 4.38 0.39 -0.88 1.43 -0.20 -4.72 118.68 120.36 2vyx s LEU 66 Ca 0.51 1.88 -0.26 0.00 -1.03 0.00 0.00 54.13 55.23 2vyx s LEU 66 Cb -0.20 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 42.35 2vyx s LEU 66 CO 0.25 -0.37 1.25 -1.61 0.23 0.00 0.00 176.35 176.11 2vyx s GLU 67 N 0.93 4.05 0.13 1.70 2.02 -1.26 -4.74 118.70 121.53 2vyx s GLU 67 Ca 0.55 2.05 0.20 0.00 0.02 0.00 0.00 54.97 57.79 2vyx s GLU 67 Cb -0.26 -2.77 -0.07 0.00 0.10 0.00 0.00 34.13 31.13 2vyx s GLU 67 CO 0.29 -0.39 0.92 0.39 0.02 0.00 0.00 175.26 176.49 2vyx n GLU 68 N 0.20 0.61 0.00 1.61 1.02 -1.26 -5.12 120.64 117.71 2vyx n GLU 68 Ca 0.03 0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 2vyx n GLU 68 Cb 0.44 -1.81 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 2vyx n GLU 68 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56