#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 2.80 -0.04 1.61 1.02 -1.26 -5.05 119.74 118.82 2vyx s LYS 3 Ca 0.00 1.46 0.02 0.00 0.02 0.00 0.00 55.97 57.47 2vyx s LYS 3 Cb 0.00 -1.95 0.01 0.00 -0.52 0.00 0.00 37.83 35.38 2vyx s LYS 3 CO 0.00 -1.26 -0.09 0.08 -0.92 0.00 0.00 175.35 173.17 2vyx s VAL 4 N -2.22 0.82 0.11 3.17 1.01 -1.26 -5.08 120.40 116.94 2vyx s VAL 4 Ca 0.69 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 62.40 2vyx s VAL 4 Cb -0.22 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 2vyx s VAL 4 CO 0.40 0.27 -0.03 -0.31 0.00 0.00 0.00 175.10 175.43 2vyx s TYR 5 N 0.56 2.88 -0.08 5.22 1.51 -1.26 -0.45 117.35 125.73 2vyx s TYR 5 Ca -0.09 -0.09 -0.00 0.00 -1.01 0.00 0.00 57.07 55.88 2vyx s TYR 5 Cb -0.13 -1.48 -0.03 0.00 -0.11 0.00 0.00 41.96 40.22 2vyx s TYR 5 CO 0.01 0.47 -0.06 0.21 -1.11 0.00 0.00 175.55 175.07 2vyx s LYS 6 N -2.38 2.93 -0.10 -0.62 2.47 -0.32 -4.90 119.74 116.82 2vyx s LYS 6 Ca 0.25 -0.54 -0.01 0.00 -1.56 0.00 0.00 55.97 54.10 2vyx s LYS 6 Cb -0.11 -2.66 -0.03 0.00 -1.46 0.00 0.00 37.83 33.57 2vyx s LYS 6 CO 0.17 0.59 -0.03 0.15 0.16 0.00 0.00 175.35 176.39 2vyx s LYS 7 N -0.60 3.07 0.06 4.03 1.02 -1.26 -1.31 119.74 124.75 2vyx s LYS 7 Ca 0.09 -0.48 0.07 0.00 0.02 0.00 0.00 55.97 55.67 2vyx s LYS 7 Cb -0.12 -2.75 -0.03 0.00 -0.52 0.00 0.00 37.83 34.41 2vyx s LYS 7 CO 0.02 0.58 -0.20 0.14 -0.92 0.00 0.00 175.35 174.96 2vyx s VAL 8 N -0.55 1.65 -0.34 3.17 -7.23 -0.45 -4.94 120.40 111.72 2vyx s VAL 8 Ca 0.09 -1.31 -0.13 0.00 -1.81 0.00 0.00 61.98 58.82 2vyx s VAL 8 Cb -0.12 -1.46 -0.02 0.00 0.56 0.00 0.00 36.38 35.34 2vyx s VAL 8 CO 0.02 0.10 0.27 -0.70 -0.31 0.00 0.00 175.10 174.48 2vyx s GLU 9 N -1.43 3.55 0.25 4.82 2.12 -1.26 -0.47 118.70 126.28 2vyx s GLU 9 Ca 0.07 -0.56 0.11 0.00 0.36 0.00 0.00 54.97 54.94 2vyx s GLU 9 Cb -0.09 -3.80 -0.05 0.00 0.26 0.00 0.00 34.13 30.46 2vyx s GLU 9 CO 0.03 -0.44 -0.14 -0.51 -0.54 0.00 0.00 175.26 173.66 2vyx s LEU 10 N 1.79 2.78 -0.24 2.70 1.43 0.05 -4.96 118.68 122.24 2vyx s LEU 10 Ca 0.07 -0.85 0.02 0.00 -1.03 0.00 0.00 54.13 52.34 2vyx s LEU 10 Cb -0.17 -1.34 0.05 0.00 0.03 0.00 0.00 46.19 44.76 2vyx s LEU 10 CO 0.11 0.05 -0.10 -0.69 0.23 0.00 0.00 176.35 175.94 2vyx s VAL 11 N -2.27 1.93 0.04 -1.59 1.01 -1.26 -0.54 120.40 117.72 2vyx s VAL 11 Ca 0.29 -1.37 -0.20 0.00 0.00 0.00 0.00 61.98 60.69 2vyx s VAL 11 Cb -0.06 -2.04 -0.06 0.00 0.00 0.00 0.00 36.38 34.22 2vyx s VAL 11 CO 0.16 0.04 0.59 -0.83 0.00 0.00 0.00 175.10 175.06 2vyx s GLY 12 N 1.23 2.66 0.10 4.51 0.00 -0.57 -4.84 107.32 110.41 2vyx s GLY 12 Ca -0.06 0.05 0.08 0.00 0.00 0.00 0.00 44.72 44.79 2vyx s GLY 12 CO -0.07 0.62 -0.19 -0.51 0.00 0.00 0.00 173.10 172.95 2vyx s THR 13 N -0.67 1.59 -0.23 0.90 -4.23 -1.25 -0.81 115.64 110.94 2vyx s THR 13 Ca 0.30 -1.53 -0.26 0.00 -1.18 0.00 0.00 61.69 59.01 2vyx s THR 13 Cb -0.19 -1.48 0.10 0.00 1.34 0.00 0.00 72.50 72.26 2vyx s THR 13 CO 0.18 -0.13 0.87 -0.55 -0.54 0.00 0.00 174.62 174.45 2vyx s SER 14 N -1.96 -0.58 0.00 3.99 0.15 -0.79 -4.50 113.70 110.01 2vyx s SER 14 Ca 0.06 1.00 0.27 0.00 0.70 0.00 0.00 55.95 57.98 2vyx s SER 14 Cb -0.09 0.97 0.92 0.00 -1.71 0.00 0.00 66.02 66.10 2vyx s SER 14 CO 0.04 -0.27 1.70 -0.62 1.20 0.00 0.00 173.24 175.29 2vyx n GLU 15 N 2.02 0.05 -0.07 5.44 1.02 -1.26 -0.38 120.64 127.46 2vyx n GLU 15 Ca -0.14 -0.02 -0.21 0.00 -0.02 0.00 0.00 57.16 56.78 2vyx n GLU 15 Cb 0.56 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.36 2vyx n GLU 15 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2vyx h GLU 16 N 0.04 0.06 0.00 3.49 4.39 -1.95 -3.46 114.58 117.15 2vyx h GLU 16 Ca 0.00 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2vyx h GLU 16 Cb 0.49 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2vyx h GLU 16 CO 0.00 1.05 0.00 0.41 -1.16 0.00 0.00 179.01 179.31 2vyx n GLY 17 N 1.55 -1.21 0.11 -3.84 0.00 -1.26 -5.02 105.19 95.53 2vyx n GLY 17 Ca -0.29 -0.91 -0.12 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.14 -0.69 0.99 3.38 -1.97 -2.22 115.31 114.66 2vyx h LEU 18 Ca 0.00 -0.39 0.12 0.00 0.09 0.00 0.00 57.88 57.70 2vyx h LEU 18 Cb 0.00 0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.70 2vyx h LEU 18 CO 0.00 0.37 0.26 -0.33 0.09 0.00 0.00 178.44 178.83 2vyx h GLU 19 N -0.71 0.42 -0.82 1.13 3.07 -1.99 -1.05 114.58 114.62 2vyx h GLU 19 Ca -0.02 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.78 2vyx h GLU 19 Cb 0.53 -0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 28.30 2vyx h GLU 19 CO 0.03 0.28 0.38 0.00 -1.40 0.00 0.00 179.01 178.29 2vyx h ALA 20 N 1.48 1.12 -0.30 3.43 0.00 -1.95 0.34 119.26 123.39 2vyx h ALA 20 Ca 0.36 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2vyx h ALA 20 Cb 0.50 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2vyx h ALA 20 CO -0.36 0.65 0.05 0.00 0.00 0.00 0.00 179.25 179.60 2vyx h ALA 21 N 1.24 0.39 -0.30 0.00 0.00 -0.74 -0.70 119.26 119.15 2vyx h ALA 21 Ca 0.28 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2vyx h ALA 21 Cb 0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2vyx h ALA 21 CO -0.03 0.08 0.11 0.82 0.00 0.00 0.00 179.25 180.23 2vyx h ILE 22 N 0.31 0.93 -0.43 0.00 2.04 -1.00 -2.66 117.51 116.71 2vyx h ILE 22 Ca 0.09 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 2vyx h ILE 22 Cb 0.33 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2vyx h ILE 22 CO 0.00 0.05 0.16 1.56 0.00 0.00 0.00 178.15 179.92 2vyx h GLN 23 N 0.25 0.60 -0.46 2.37 1.08 -0.75 -2.24 115.11 115.96 2vyx h GLN 23 Ca 0.13 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 2vyx h GLN 23 Cb 0.10 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 2vyx h GLN 23 CO -0.13 0.51 0.30 0.00 -0.95 0.00 0.00 178.83 178.55 2vyx h ALA 24 N 1.58 0.58 -0.20 3.87 0.00 -0.80 0.52 119.26 124.81 2vyx h ALA 24 Ca 0.15 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2vyx h ALA 24 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2vyx h ALA 24 CO -0.01 0.03 0.09 0.00 0.00 0.00 0.00 179.25 179.36 2vyx h ALA 25 N 1.16 0.26 -0.15 0.00 0.00 -1.14 -2.37 119.26 117.03 2vyx h ALA 25 Ca 0.17 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2vyx h ALA 25 Cb -0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2vyx h ALA 25 CO -0.04 -0.17 -0.33 -0.07 0.00 0.00 0.00 179.25 178.64 2vyx h LEU 26 N 0.19 0.30 -0.32 0.00 3.38 -1.25 -0.08 115.31 117.54 2vyx h LEU 26 Ca 0.07 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 2vyx h LEU 26 Cb 0.13 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2vyx h LEU 26 CO -0.01 0.62 -0.05 0.00 0.09 0.00 0.00 178.44 179.10 2vyx h ALA 27 N 1.40 0.44 -0.61 1.53 0.00 -0.85 -1.67 119.26 119.50 2vyx h ALA 27 Ca 0.03 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 2vyx h ALA 27 Cb 0.71 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2vyx h ALA 27 CO 0.05 0.24 0.03 -0.09 0.00 0.00 0.00 179.25 179.49 2vyx h ARG 28 N 0.38 1.04 -0.50 0.00 9.65 -1.26 -3.11 114.38 120.59 2vyx h ARG 28 Ca 0.08 -0.31 0.04 0.00 -1.10 0.00 0.00 59.98 58.70 2vyx h ARG 28 Cb 0.52 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.96 2vyx h ARG 28 CO 0.03 1.00 0.26 0.00 2.80 0.00 0.00 179.97 184.06 2vyx h ALA 29 N 1.06 0.63 0.00 2.80 0.00 -0.75 -2.34 119.26 120.67 2vyx h ALA 29 Ca 0.18 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2vyx h ALA 29 Cb 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2vyx h ALA 29 CO 0.02 -0.07 0.00 2.89 0.00 0.00 0.00 179.25 182.09 2vyx n ARG 30 N -4.86 0.13 0.21 0.00 1.85 -0.65 -0.87 116.66 112.47 2vyx n ARG 30 Ca 0.04 0.33 0.05 0.00 -1.00 0.00 0.00 57.85 57.27 2vyx n ARG 30 Cb 0.11 -1.73 0.46 0.00 -1.05 0.00 0.00 32.46 30.25 2vyx n ARG 30 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 2vyx h LYS 31 N 0.00 0.00 0.00 2.89 1.57 -1.38 -3.37 116.57 116.28 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 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2vyx h LYS 31 CO 0.00 0.27 -0.34 0.25 -0.57 0.00 0.00 179.45 179.06 2vyx n THR 32 N -4.07 0.00 -4.37 -0.16 -2.24 -1.08 -5.08 114.28 97.28 2vyx n THR 32 Ca -0.02 -0.07 -0.33 0.00 -2.27 0.00 0.00 64.05 61.36 2vyx n THR 32 Cb 0.33 0.47 -0.10 0.00 -2.10 0.00 0.00 70.33 68.94 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 -1.30 3.40 0.19 3.22 1.43 -0.05 -5.12 118.68 120.45 2vyx s LEU 33 Ca 0.00 -0.02 0.10 0.00 -1.03 0.00 0.00 54.13 53.17 2vyx s LEU 33 Cb 0.00 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 2vyx s LEU 33 CO 0.00 0.30 -0.13 -0.13 0.23 0.00 0.00 176.35 176.62 2vyx s ARG 34 N -1.36 1.91 -1.18 1.70 0.52 -1.26 -4.44 118.95 114.83 2vyx s ARG 34 Ca 0.17 -1.37 -0.06 0.00 -0.52 0.00 0.00 55.73 53.96 2vyx s ARG 34 Cb -0.11 -2.06 0.01 0.00 0.52 0.00 0.00 34.95 33.31 2vyx s ARG 34 CO 0.08 0.42 1.02 0.72 0.02 0.00 0.00 175.30 177.55 2vyx n HIS 35 N 0.01 -2.42 -2.25 -0.53 8.25 -1.26 -4.50 115.22 112.51 2vyx n HIS 35 Ca -0.11 0.90 -0.42 0.00 -0.26 0.00 0.00 57.72 57.83 2vyx n HIS 35 Cb 0.56 -4.68 -0.03 0.00 1.12 0.00 0.00 29.99 26.96 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 -6.46 4.33 -0.01 2.41 1.43 -1.26 -1.56 118.68 117.56 2vyx s LEU 36 Ca 0.38 2.12 -0.01 0.00 -1.03 0.00 0.00 54.13 55.58 2vyx s LEU 36 Cb -0.17 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.48 2vyx s LEU 36 CO 0.66 -0.67 -0.03 0.47 0.23 0.00 0.00 176.35 177.01 2vyx n ASP 37 N 4.97 0.32 -4.06 2.29 8.00 0.03 -4.99 116.55 123.12 2vyx n ASP 37 Ca 0.12 0.05 -0.08 0.00 0.71 0.00 0.00 54.79 55.59 2vyx n ASP 37 Cb 0.44 -0.12 -0.10 0.00 -0.02 0.00 0.00 41.12 41.32 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 -2.05 0.46 0.19 1.24 -0.71 -1.13 -5.02 117.98 110.96 2vyx s PHE 38 Ca -0.03 -0.88 0.03 0.00 -1.04 0.00 0.00 56.93 55.01 2vyx s PHE 38 Cb 0.01 -0.33 -0.05 0.00 -1.21 0.00 0.00 43.02 41.44 2vyx s PHE 38 CO 0.04 -0.30 -0.01 -0.59 -1.34 0.00 0.00 175.22 173.01 2vyx s PHE 39 N -3.07 1.34 -0.08 3.49 -0.12 -1.26 -0.56 117.98 117.72 2vyx s PHE 39 Ca -0.00 -0.96 -0.03 0.00 -0.05 0.00 0.00 56.93 55.89 2vyx s PHE 39 Cb 0.02 -0.76 0.04 0.00 -0.63 0.00 0.00 43.02 41.69 2vyx s PHE 39 CO -0.07 -0.12 0.15 -1.21 -0.05 0.00 0.00 175.22 173.92 2vyx s GLU 40 N -3.88 0.05 -0.10 1.99 2.02 -0.17 -4.97 118.70 113.64 2vyx s GLU 40 Ca 0.25 0.48 -0.30 0.00 0.02 0.00 0.00 54.97 55.42 2vyx s GLU 40 Cb 0.05 -0.24 -0.02 0.00 0.10 0.00 0.00 34.13 34.03 2vyx s GLU 40 CO 0.05 -0.25 1.06 0.08 0.02 0.00 0.00 175.26 176.22 2vyx s VAL 41 N 1.85 4.65 -0.16 2.63 1.01 -1.26 -0.08 120.40 129.04 2vyx s VAL 41 Ca -0.02 1.93 -0.09 0.00 0.00 0.00 0.00 61.98 63.80 2vyx s VAL 41 Cb -0.12 -4.24 -0.23 0.00 0.00 0.00 0.00 36.38 31.79 2vyx s VAL 41 CO -0.06 -0.00 0.23 0.29 0.00 0.00 0.00 175.10 175.56 2vyx n LYS 42 N 5.11 0.70 -3.52 2.72 5.02 0.80 -4.95 118.16 124.03 2vyx n LYS 42 Ca 0.09 0.32 -0.11 0.00 -2.02 0.00 0.00 58.31 56.60 2vyx n LYS 42 Cb 0.48 -1.69 -0.02 0.00 -0.02 0.00 0.00 35.03 33.78 2vyx n LYS 42 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2vyx s GLU 43 N -2.51 1.36 -0.18 1.97 -1.05 -1.07 -5.01 118.70 112.22 2vyx s GLU 43 Ca -0.26 -0.57 0.01 0.00 -0.15 0.00 0.00 54.97 53.99 2vyx s GLU 43 Cb 0.07 0.58 0.03 0.00 -0.44 0.00 0.00 34.13 34.38 2vyx s GLU 43 CO 0.70 -0.60 -0.13 0.42 0.95 0.00 0.00 175.26 176.60 2vyx s ILE 44 N -3.74 1.69 0.24 1.83 1.01 -1.26 -0.70 121.20 120.26 2vyx s ILE 44 Ca 0.03 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.80 2vyx s ILE 44 Cb -0.02 -1.68 -0.01 0.00 0.01 0.00 0.00 42.46 40.76 2vyx s ILE 44 CO -0.08 0.29 0.06 0.54 0.00 0.00 0.00 174.94 175.75 2vyx n ARG 45 N 4.69 0.87 -3.59 2.79 1.74 0.47 -5.01 116.66 118.63 2vyx n ARG 45 Ca -0.16 -1.97 0.00 0.00 -0.77 0.00 0.00 57.85 54.95 2vyx n ARG 45 Cb 0.48 0.94 0.00 0.00 -1.02 0.00 0.00 32.46 32.86 2vyx n ARG 45 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2vyx n GLY 46 N 0.82 -2.03 3.66 -0.13 0.00 -1.26 -0.61 105.19 105.63 2vyx n GLY 46 Ca -0.05 -1.17 -0.23 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.18 3.25 -0.03 2.61 -4.23 -0.41 -4.97 115.64 109.68 2vyx s THR 47 Ca 0.00 -1.89 0.06 0.00 -1.18 0.00 0.00 61.69 58.68 2vyx s THR 47 Cb 0.00 -2.85 -0.01 0.00 1.34 0.00 0.00 72.50 70.98 2vyx s THR 47 CO 0.00 -0.32 -0.21 -0.63 -0.54 0.00 0.00 174.62 172.92 2vyx s ILE 48 N -2.37 1.71 0.00 2.99 1.01 -1.26 -0.51 121.20 122.77 2vyx s ILE 48 Ca 0.33 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 60.08 2vyx s ILE 48 Cb -0.05 -1.44 0.00 0.00 0.01 0.00 0.00 42.46 40.98 2vyx s ILE 48 CO 0.20 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.24 2vyx n GLY 49 N 2.80 4.63 0.36 6.18 0.00 0.93 -4.74 105.19 115.35 2vyx n GLY 49 Ca -0.17 -1.69 0.10 0.00 0.00 0.00 0.00 46.02 44.27 2vyx n GLY 49 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2vyx h GLU 50 N 0.00 0.84 -0.64 1.61 4.81 -2.00 -2.43 114.58 116.77 2vyx h GLU 50 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2vyx h GLU 50 Cb 0.00 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.19 2vyx h GLU 50 CO 0.00 0.56 0.00 0.00 -0.73 0.00 0.00 179.01 178.84 2vyx n ALA 51 N -2.34 2.98 0.00 2.92 0.00 -1.26 -5.04 120.51 117.77 2vyx n ALA 51 Ca 0.21 -1.33 0.00 0.00 0.00 0.00 0.00 53.44 52.33 2vyx n ALA 51 Cb 0.47 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.90 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 1.05 0.98 3.68 0.00 0.00 -0.92 -4.94 105.19 105.05 2vyx n GLY 52 Ca 0.22 -1.34 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 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 0.50 -0.06 1.61 0.31 -1.26 -0.05 118.33 119.38 2vyx n VAL 53 Ca 0.00 -0.09 -0.03 0.00 -0.01 0.00 0.00 64.34 64.21 2vyx n VAL 53 Cb 0.00 -2.13 -0.01 0.00 -0.91 0.00 0.00 33.84 30.79 2vyx n VAL 53 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2vyx h LYS 54 N 9.15 0.00 -4.11 5.55 3.64 -1.09 -3.44 116.57 126.28 2vyx h LYS 54 Ca -0.48 0.00 -0.41 0.00 -1.27 0.00 0.00 60.65 58.50 2vyx h LYS 54 Cb 1.24 0.00 -0.33 0.00 -0.41 0.00 0.00 32.23 32.72 2vyx h LYS 54 CO 0.94 0.00 -0.77 -2.00 -2.27 0.00 0.00 179.45 175.35 2vyx s GLU 55 N -1.94 0.84 0.14 1.90 2.12 -1.20 -4.45 118.70 116.11 2vyx s GLU 55 Ca -0.09 -0.14 -0.27 0.00 0.36 0.00 0.00 54.97 54.83 2vyx s GLU 55 Cb 0.01 -0.82 -0.07 0.00 0.26 0.00 0.00 34.13 33.51 2vyx s GLU 55 CO 0.13 -0.04 0.84 0.71 -0.54 0.00 0.00 175.26 176.36 2vyx s TYR 56 N 0.75 3.87 -0.23 5.30 1.51 0.49 -1.29 117.35 127.76 2vyx s TYR 56 Ca -0.10 1.69 -0.02 0.00 -1.01 0.00 0.00 57.07 57.63 2vyx s TYR 56 Cb -0.13 -2.88 0.07 0.00 -0.11 0.00 0.00 41.96 38.91 2vyx s TYR 56 CO 0.00 0.39 0.04 -0.65 -1.11 0.00 0.00 175.55 174.22 2vyx s GLN 57 N -0.68 0.80 -0.26 -0.62 -0.21 0.22 -1.89 119.66 117.02 2vyx s GLN 57 Ca 0.40 -0.64 -0.07 0.00 0.02 0.00 0.00 55.36 55.07 2vyx s GLN 57 Cb -0.23 -2.14 -0.02 0.00 1.00 0.00 0.00 33.01 31.62 2vyx s GLN 57 CO 0.27 -0.71 0.06 0.08 -2.12 0.00 0.00 175.29 172.87 2vyx s VAL 58 N 1.75 4.16 -0.20 1.09 1.01 0.01 -0.40 120.40 127.82 2vyx s VAL 58 Ca 0.01 -0.30 -0.21 0.00 0.00 0.00 0.00 61.98 61.47 2vyx s VAL 58 Cb -0.17 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 2vyx s VAL 58 CO -0.12 0.29 0.66 -0.69 0.00 0.00 0.00 175.10 175.25 2vyx s VAL 59 N 1.58 5.00 -0.02 2.92 1.01 0.12 -1.51 120.40 129.50 2vyx s VAL 59 Ca 0.06 1.25 0.04 0.00 0.00 0.00 0.00 61.98 63.33 2vyx s VAL 59 Cb -0.15 -3.97 -0.01 0.00 0.00 0.00 0.00 36.38 32.25 2vyx s VAL 59 CO 0.03 0.09 -0.13 -0.22 0.00 0.00 0.00 175.10 174.86 2vyx s LEU 60 N 1.99 1.98 -0.18 3.92 2.96 0.30 -0.14 118.68 129.50 2vyx s LEU 60 Ca 0.30 -0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 53.87 2vyx s LEU 60 Cb -0.16 -0.72 -0.05 0.00 0.50 0.00 0.00 46.19 45.77 2vyx s LEU 60 CO 0.10 0.15 0.13 -1.61 -1.32 0.00 0.00 176.35 173.80 2vyx s GLU 61 N -0.20 3.98 -0.13 1.98 2.02 0.89 -0.77 118.70 126.46 2vyx s GLU 61 Ca 0.03 -0.21 0.02 0.00 0.02 0.00 0.00 54.97 54.83 2vyx s GLU 61 Cb -0.07 -3.34 0.01 0.00 0.10 0.00 0.00 34.13 30.83 2vyx s GLU 61 CO -0.00 0.42 -0.20 0.08 0.02 0.00 0.00 175.26 175.58 2vyx s VAL 62 N 0.01 1.91 -0.17 2.63 1.01 0.38 -1.00 120.40 125.18 2vyx s VAL 62 Ca 0.09 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.13 2vyx s VAL 62 Cb -0.11 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 2vyx s VAL 62 CO -0.00 0.52 0.01 -0.83 0.00 0.00 0.00 175.10 174.79 2vyx s GLY 63 N 0.88 1.80 0.02 4.51 0.00 0.27 -1.34 107.32 113.48 2vyx s GLY 63 Ca -0.06 -0.78 0.04 0.00 0.00 0.00 0.00 44.72 43.91 2vyx s GLY 63 CO -0.02 -0.03 -0.13 -0.11 0.00 0.00 0.00 173.10 172.82 2vyx s PHE 64 N 0.34 1.10 0.07 1.90 -0.12 -0.43 -0.79 117.98 120.05 2vyx s PHE 64 Ca -0.01 -0.30 -0.31 0.00 -0.05 0.00 0.00 56.93 56.26 2vyx s PHE 64 Cb -0.13 -0.67 -0.06 0.00 -0.63 0.00 0.00 43.02 41.53 2vyx s PHE 64 CO 0.02 0.01 1.20 0.50 -0.05 0.00 0.00 175.22 176.89 2vyx s ARG 65 N -0.86 4.44 -0.01 1.99 3.52 -0.60 -1.18 118.95 126.25 2vyx s ARG 65 Ca 0.02 1.78 -0.30 0.00 -0.13 0.00 0.00 55.73 57.09 2vyx s ARG 65 Cb -0.07 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.94 2vyx s ARG 65 CO 0.01 -0.24 1.16 -0.51 -0.81 0.00 0.00 175.30 174.91 2vyx s LEU 66 N 0.96 4.32 0.44 -0.88 1.43 0.41 -4.75 118.68 120.61 2vyx s LEU 66 Ca 0.58 1.86 -0.22 0.00 -1.03 0.00 0.00 54.13 55.32 2vyx s LEU 66 Cb -0.30 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.27 2vyx s LEU 66 CO 0.30 -0.49 1.06 -1.83 0.23 0.00 0.00 176.35 175.61 2vyx s GLU 67 N 1.62 3.96 -0.01 1.70 -1.05 -1.26 -4.74 118.70 118.92 2vyx s GLU 67 Ca 0.56 1.49 0.21 0.00 -0.15 0.00 0.00 54.97 57.09 2vyx s GLU 67 Cb -0.26 -2.34 -0.23 0.00 -0.44 0.00 0.00 34.13 30.86 2vyx s GLU 67 CO 0.25 -0.32 0.81 0.39 0.95 0.00 0.00 175.26 177.34 2vyx n GLU 68 N -0.49 0.17 0.00 -4.83 1.02 -1.26 -5.13 120.64 110.12 2vyx n GLU 68 Ca 0.07 -0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 2vyx n GLU 68 Cb 0.50 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 2vyx n GLU 68 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56