#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eyh s HIS 8 N 0.00 0.20 0.27 -1.77 -3.43 -1.26 -5.13 115.29 104.17 2eyh s HIS 8 Ca 0.00 -0.37 -0.18 0.00 -0.80 0.00 0.00 55.06 53.72 2eyh s HIS 8 Cb 0.00 -0.14 -0.09 0.00 -1.43 0.00 0.00 32.58 30.92 2eyh s HIS 8 CO 0.00 -0.13 0.74 0.15 -2.00 0.00 0.00 174.74 173.50 2eyh s LYS 9 N -1.01 4.16 0.08 -0.38 1.02 -1.26 -4.32 119.74 118.02 2eyh s LYS 9 Ca -0.11 0.80 0.05 0.00 0.02 0.00 0.00 55.97 56.73 2eyh s LYS 9 Cb -0.07 -2.69 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 2eyh s LYS 9 CO -0.01 0.29 -0.13 -1.21 -0.92 0.00 0.00 175.35 173.37 2eyh s GLU 10 N -2.40 0.82 0.53 1.68 2.02 0.77 -4.92 118.70 117.19 2eyh s GLU 10 Ca 0.48 -1.00 -0.21 0.00 0.02 0.00 0.00 54.97 54.26 2eyh s GLU 10 Cb -0.14 -0.73 -0.06 0.00 0.10 0.00 0.00 34.13 33.30 2eyh s GLU 10 CO 0.19 0.15 1.22 -1.25 0.02 0.00 0.00 175.26 175.60 2eyh s PRO 11 N -1.99 3.35 0.17 0.39 0.04 -1.26 0.89 135.00 136.60 2eyh s PRO 11 Ca -0.00 1.89 -0.16 0.00 0.04 0.00 0.00 61.00 62.76 2eyh s PRO 11 Cb -0.08 -2.20 0.03 0.00 0.04 0.00 0.00 34.50 32.28 2eyh s PRO 11 CO 0.02 -0.92 0.47 0.00 0.04 0.00 0.00 177.00 176.61 2eyh s ALA 12 N -1.52 -0.86 -0.06 8.56 0.00 -0.90 -4.63 121.76 122.36 2eyh s ALA 12 Ca 0.70 -0.23 0.05 0.00 0.00 0.00 0.00 51.96 52.48 2eyh s ALA 12 Cb -0.32 0.82 -0.00 0.00 0.00 0.00 0.00 23.12 23.62 2eyh s ALA 12 CO 0.37 -0.75 -0.20 0.99 0.00 0.00 0.00 175.76 176.16 2eyh s THR 13 N -3.86 1.71 0.34 0.00 2.01 -0.64 -4.12 115.64 111.07 2eyh s THR 13 Ca 0.08 -0.86 -0.29 0.00 0.31 0.00 0.00 61.69 60.93 2eyh s THR 13 Cb 0.00 -1.47 -0.11 0.00 0.01 0.00 0.00 72.50 70.93 2eyh s THR 13 CO -0.05 0.48 1.52 -0.22 -0.69 0.00 0.00 174.62 175.66 2eyh s LEU 14 N 0.06 4.34 -0.14 4.42 2.96 -1.26 0.11 118.68 129.17 2eyh s LEU 14 Ca -0.07 2.98 -0.09 0.00 -0.22 0.00 0.00 54.13 56.74 2eyh s LEU 14 Cb -0.14 -3.65 -0.06 0.00 0.50 0.00 0.00 46.19 42.84 2eyh s LEU 14 CO 0.04 -0.87 -0.21 -0.38 -1.32 0.00 0.00 176.35 173.61 2eyh n ILE 15 N 1.23 1.01 -3.64 6.68 5.41 0.23 -4.73 119.36 125.55 2eyh n ILE 15 Ca 0.04 -0.12 -0.07 0.00 1.00 0.00 0.00 62.75 63.60 2eyh n ILE 15 Cb 0.39 -1.79 -0.07 0.00 -0.71 0.00 0.00 39.64 37.45 2eyh n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2eyh s LYS 16 N -2.35 0.69 0.15 0.38 2.20 -0.74 -5.01 119.74 115.05 2eyh s LYS 16 Ca -0.22 1.16 -0.30 0.00 -0.36 0.00 0.00 55.97 56.25 2eyh s LYS 16 Cb 0.07 0.15 -0.07 0.00 -1.51 0.00 0.00 37.83 36.48 2eyh s LYS 16 CO 0.28 -0.14 1.03 0.00 -0.36 0.00 0.00 175.35 176.16 2eyh s ALA 17 N 1.53 3.31 -0.09 3.13 0.00 -1.26 -0.38 121.76 128.00 2eyh s ALA 17 Ca -0.09 0.70 0.04 0.00 0.00 0.00 0.00 51.96 52.60 2eyh s ALA 17 Cb -0.05 -3.31 -0.08 0.00 0.00 0.00 0.00 23.12 19.68 2eyh s ALA 17 CO -0.18 -0.11 -0.03 -0.89 0.00 0.00 0.00 175.76 174.54 2eyh n ILE 18 N 2.57 0.56 -3.83 0.00 5.41 -0.61 -4.92 119.36 118.54 2eyh n ILE 18 Ca 0.02 -0.28 -0.04 0.00 1.00 0.00 0.00 62.75 63.46 2eyh n ILE 18 Cb 0.48 -0.83 0.01 0.00 -0.71 0.00 0.00 39.64 38.59 2eyh n ILE 18 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2eyh s ASP 19 N -4.50 -0.05 0.30 4.38 2.15 -0.75 -4.96 116.67 113.24 2eyh s ASP 19 Ca -0.09 -0.68 0.04 0.00 0.43 0.00 0.00 52.55 52.26 2eyh s ASP 19 Cb 0.03 0.56 0.67 0.00 -0.30 0.00 0.00 42.92 43.88 2eyh s ASP 19 CO 0.28 -1.09 1.81 1.23 -0.17 0.00 0.00 175.17 177.22 2eyh h GLY 20 N 2.00 1.67 -0.96 2.66 0.00 -1.84 -2.93 103.07 103.68 2eyh h GLY 20 Ca -0.27 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.68 2eyh h GLY 20 CO 0.33 0.05 0.00 2.09 0.00 0.00 0.00 176.54 179.01 2eyh n ASP 21 N -4.68 2.37 -3.79 0.19 3.85 -1.26 -4.80 116.55 108.42 2eyh n ASP 21 Ca 0.21 -1.74 -0.14 0.00 -0.71 0.00 0.00 54.79 52.41 2eyh n ASP 21 Cb 0.47 -0.11 -0.15 0.00 -1.35 0.00 0.00 41.12 39.98 2eyh n ASP 21 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 2eyh s THR 22 N -0.91 -0.05 0.02 2.12 2.01 -1.11 -1.14 115.64 116.59 2eyh s THR 22 Ca 0.16 0.17 0.03 0.00 0.31 0.00 0.00 61.69 62.36 2eyh s THR 22 Cb 0.09 -0.08 -0.02 0.00 0.01 0.00 0.00 72.50 72.51 2eyh s THR 22 CO 0.13 0.07 -0.08 0.54 -0.69 0.00 0.00 174.62 174.59 2eyh s VAL 23 N 0.86 0.64 -0.21 3.82 0.11 -0.74 -1.58 120.40 123.30 2eyh s VAL 23 Ca -0.07 -0.75 -0.13 0.00 -2.93 0.00 0.00 61.98 58.10 2eyh s VAL 23 Cb -0.10 -0.62 -0.05 0.00 -1.53 0.00 0.00 36.38 34.09 2eyh s VAL 23 CO -0.03 -0.10 0.27 -0.75 -3.33 0.00 0.00 175.10 171.16 2eyh s LYS 24 N -0.94 4.14 0.15 1.54 2.20 0.49 -0.47 119.74 126.86 2eyh s LYS 24 Ca -0.03 -0.04 0.07 0.00 -0.36 0.00 0.00 55.97 55.61 2eyh s LYS 24 Cb -0.07 -3.52 -0.04 0.00 -1.51 0.00 0.00 37.83 32.69 2eyh s LYS 24 CO 0.00 0.05 -0.16 -0.51 -0.36 0.00 0.00 175.35 174.38 2eyh s LEU 25 N 1.06 2.45 -0.35 5.43 1.43 0.21 -0.60 118.68 128.31 2eyh s LEU 25 Ca 0.13 -0.87 -0.21 0.00 -1.03 0.00 0.00 54.13 52.15 2eyh s LEU 25 Cb -0.14 -0.67 0.00 0.00 0.03 0.00 0.00 46.19 45.42 2eyh s LEU 25 CO 0.05 -0.11 0.68 -0.32 0.23 0.00 0.00 176.35 176.88 2eyh s MET 26 N -2.92 3.73 -0.10 1.70 -2.45 0.12 -0.68 119.30 118.70 2eyh s MET 26 Ca 0.14 0.17 -0.00 0.00 -1.25 0.00 0.00 55.69 54.75 2eyh s MET 26 Cb -0.04 -3.80 0.02 0.00 1.25 0.00 0.00 34.83 32.27 2eyh s MET 26 CO 0.05 -0.74 -0.07 -0.47 1.05 0.00 0.00 175.02 174.83 2eyh s TYR 27 N 2.81 1.36 -1.58 4.11 5.04 -0.54 -1.62 117.35 126.92 2eyh s TYR 27 Ca 0.27 -0.63 -0.14 0.00 -2.44 0.00 0.00 57.07 54.12 2eyh s TYR 27 Cb -0.14 -1.14 0.11 0.00 0.35 0.00 0.00 41.96 41.13 2eyh s TYR 27 CO 0.15 -0.46 0.87 1.63 -1.34 0.00 0.00 175.55 176.40 2eyh n LYS 28 N 4.81 -4.47 -0.65 4.97 4.76 -1.26 -1.54 118.16 124.77 2eyh n LYS 28 Ca -0.13 0.50 0.00 0.00 -2.87 0.00 0.00 58.31 55.81 2eyh n LYS 28 Cb 0.50 -5.27 0.00 0.00 -1.84 0.00 0.00 35.03 28.42 2eyh n LYS 28 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2eyh n GLY 29 N -1.59 1.24 3.65 0.72 0.00 -1.26 -5.02 105.19 102.92 2eyh n GLY 29 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 2eyh n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2eyh s GLN 30 N -0.15 2.83 0.33 1.61 -0.21 -0.59 -5.09 119.66 118.39 2eyh s GLN 30 Ca 0.00 -0.53 -0.28 0.00 0.02 0.00 0.00 55.36 54.57 2eyh s GLN 30 Cb 0.00 -2.68 -0.10 0.00 1.00 0.00 0.00 33.01 31.24 2eyh s GLN 30 CO 0.00 0.66 1.19 -2.14 -2.12 0.00 0.00 175.29 172.88 2eyh s PRO 31 N -1.08 4.38 -0.19 2.91 0.02 -1.26 -1.47 135.00 138.31 2eyh s PRO 31 Ca 0.15 1.95 -0.16 0.00 0.02 0.00 0.00 61.00 62.95 2eyh s PRO 31 Cb -0.11 -3.00 0.05 0.00 0.02 0.00 0.00 34.50 31.45 2eyh s PRO 31 CO 0.05 -0.07 0.49 1.41 -0.33 0.00 0.00 177.00 178.55 2eyh s MET 32 N -1.81 0.56 -0.10 5.54 1.75 0.15 -4.92 119.30 120.47 2eyh s MET 32 Ca 0.49 0.70 -0.22 0.00 -1.25 0.00 0.00 55.69 55.42 2eyh s MET 32 Cb -0.34 0.25 -0.03 0.00 2.84 0.00 0.00 34.83 37.55 2eyh s MET 32 CO 0.44 -0.08 0.66 0.99 -0.65 0.00 0.00 175.02 176.38 2eyh s THR 33 N 0.38 5.06 -0.13 10.11 2.01 -1.26 -0.62 115.64 131.19 2eyh s THR 33 Ca -0.01 1.33 -0.04 0.00 0.31 0.00 0.00 61.69 63.29 2eyh s THR 33 Cb -0.04 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 2eyh s THR 33 CO -0.01 0.23 0.01 -0.36 -0.69 0.00 0.00 174.62 173.80 2eyh s PHE 34 N 1.02 3.15 -0.20 4.92 0.40 0.38 -0.93 117.98 126.72 2eyh s PHE 34 Ca 0.34 0.04 -0.10 0.00 -0.60 0.00 0.00 56.93 56.61 2eyh s PHE 34 Cb -0.17 -1.90 -0.05 0.00 0.51 0.00 0.00 43.02 41.41 2eyh s PHE 34 CO 0.15 0.27 0.14 0.50 0.70 0.00 0.00 175.22 176.98 2eyh s ARG 35 N -0.27 4.19 -0.11 0.44 6.06 0.39 -1.79 118.95 127.87 2eyh s ARG 35 Ca 0.06 -0.20 -0.29 0.00 -2.50 0.00 0.00 55.73 52.79 2eyh s ARG 35 Cb -0.12 -3.42 -0.04 0.00 0.06 0.00 0.00 34.95 31.43 2eyh s ARG 35 CO 0.02 0.30 1.55 -0.51 -2.50 0.00 0.00 175.30 174.16 2eyh s LEU 36 N 0.37 4.21 0.39 -0.88 2.01 -0.29 -2.77 118.68 121.71 2eyh s LEU 36 Ca 0.08 1.98 -0.27 0.00 0.01 0.00 0.00 54.13 55.94 2eyh s LEU 36 Cb -0.11 -3.53 -0.10 0.00 0.01 0.00 0.00 46.19 42.46 2eyh s LEU 36 CO -0.02 -0.95 1.42 -0.76 1.01 0.00 0.00 176.35 177.06 2eyh s LEU 37 N 4.12 4.27 0.00 1.79 1.43 -0.39 -3.58 118.68 126.33 2eyh s LEU 37 Ca 0.68 2.91 0.00 0.00 -1.03 0.00 0.00 54.13 56.70 2eyh s LEU 37 Cb -0.29 -3.76 0.00 0.00 0.03 0.00 0.00 46.19 42.17 2eyh s LEU 37 CO 0.26 -0.89 0.00 0.18 0.23 0.00 0.00 176.35 176.12 2eyh n LEU 38 N 0.31 0.40 -4.15 1.79 4.77 -1.26 -4.91 117.00 113.95 2eyh n LEU 38 Ca 0.02 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.78 2eyh n LEU 38 Cb 0.41 -1.13 -0.14 0.00 -2.33 0.00 0.00 43.42 40.22 2eyh n LEU 38 CO 0.61 -0.35 -0.48 0.68 -1.33 0.00 0.00 177.39 176.52 2eyh s VAL 39 N -1.89 1.20 -0.24 4.08 -7.23 -1.23 -0.42 120.40 114.67 2eyh s VAL 39 Ca 0.00 -0.85 -0.03 0.00 -1.81 0.00 0.00 61.98 59.28 2eyh s VAL 39 Cb 0.00 -1.04 0.01 0.00 0.56 0.00 0.00 36.38 35.90 2eyh s VAL 39 CO 0.00 0.18 -0.03 -1.81 -0.31 0.00 0.00 175.10 173.13 2eyh s ASP 40 N -0.78 4.42 0.22 4.85 1.01 0.19 -4.75 116.67 121.83 2eyh s ASP 40 Ca 0.04 -0.62 0.05 0.00 0.71 0.00 0.00 52.55 52.73 2eyh s ASP 40 Cb -0.07 -1.73 -0.03 0.00 1.01 0.00 0.00 42.92 42.10 2eyh s ASP 40 CO 0.00 -0.09 0.32 0.42 0.21 0.00 0.00 175.17 176.04 2eyh s THR 41 N 1.43 5.15 0.50 -1.27 -4.23 -1.26 -1.21 115.64 114.74 2eyh s THR 41 Ca 0.03 -0.99 -0.23 0.00 -1.18 0.00 0.00 61.69 59.32 2eyh s THR 41 Cb -0.16 -3.77 -0.06 0.00 1.34 0.00 0.00 72.50 69.85 2eyh s THR 41 CO -0.03 -0.28 1.35 -2.84 -0.54 0.00 0.00 174.62 172.28 2eyh s PRO 42 N -3.81 3.44 0.27 3.99 0.02 -1.26 -4.96 135.00 132.70 2eyh s PRO 42 Ca 0.34 2.22 0.08 0.00 0.02 0.00 0.00 61.00 63.66 2eyh s PRO 42 Cb -0.09 -2.43 -0.04 0.00 0.02 0.00 0.00 34.50 31.96 2eyh s PRO 42 CO 0.28 -0.95 0.11 -1.21 -0.33 0.00 0.00 177.00 174.91 2eyh s GLU 43 N -2.69 2.59 -0.20 5.54 2.02 -1.26 -4.34 118.70 120.36 2eyh s GLU 43 Ca 0.66 -1.28 0.13 0.00 0.02 0.00 0.00 54.97 54.51 2eyh s GLU 43 Cb -0.40 -2.35 -0.21 0.00 0.10 0.00 0.00 34.13 31.27 2eyh s GLU 43 CO 0.49 0.33 -0.00 0.25 0.02 0.00 0.00 175.26 176.35 2eyh n THR 44 N -1.07 1.29 -3.47 3.63 -2.24 -1.26 -1.13 114.28 110.02 2eyh n THR 44 Ca -0.06 -0.72 -0.43 0.00 -2.27 0.00 0.00 64.05 60.57 2eyh n THR 44 Cb 0.59 -0.70 -0.08 0.00 -2.10 0.00 0.00 70.33 68.03 2eyh n THR 44 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2eyh s LYS 45 N -2.45 2.78 0.00 -0.78 1.02 -1.26 -4.12 119.74 114.93 2eyh s LYS 45 Ca -0.15 -1.50 0.00 0.00 0.02 0.00 0.00 55.97 54.35 2eyh s LYS 45 Cb 0.06 -4.01 0.00 0.00 -0.52 0.00 0.00 37.83 33.36 2eyh s LYS 45 CO 0.71 -1.07 0.00 0.72 -0.92 0.00 0.00 175.35 174.79 2eyh n HIS 46 N 5.07 0.00 0.07 3.18 8.25 -1.26 -5.03 115.22 125.50 2eyh n HIS 46 Ca -0.11 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.36 2eyh n HIS 46 Cb 0.42 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.57 2eyh n HIS 46 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2eyh n PRO 47 N 0.00 0.00 -0.32 -0.41 -0.04 -1.26 -0.33 135.00 132.64 2eyh n PRO 47 Ca 0.00 0.45 0.18 0.00 -0.04 0.00 0.00 63.50 64.10 2eyh n PRO 47 Cb 0.00 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.33 2eyh n PRO 47 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 2eyh h LYS 48 N 0.00 0.14 0.00 0.54 2.10 -2.00 -3.34 116.57 114.01 2eyh h LYS 48 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2eyh h LYS 48 Cb 0.03 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2eyh h LYS 48 CO 0.00 0.09 -0.29 1.63 -2.00 0.00 0.00 179.45 178.88 2eyh n LYS 49 N -5.27 0.17 0.00 0.07 5.02 -1.01 -5.14 118.16 112.01 2eyh n LYS 49 Ca 0.26 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 2eyh n LYS 49 Cb 0.86 -0.65 0.00 0.00 -0.02 0.00 0.00 35.03 35.22 2eyh n LYS 49 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2eyh n GLY 50 N 1.96 1.08 3.30 0.72 0.00 0.55 -4.83 105.19 107.98 2eyh n GLY 50 Ca 0.00 -1.04 -0.44 0.00 0.00 0.00 0.00 46.02 44.54 2eyh n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2eyh s VAL 51 N 0.00 5.59 1.06 1.61 1.01 -1.26 -4.06 120.40 124.36 2eyh s VAL 51 Ca 0.00 -3.14 -0.13 0.00 0.00 0.00 0.00 61.98 58.71 2eyh s VAL 51 Cb 0.00 -4.41 0.17 0.00 0.00 0.00 0.00 36.38 32.14 2eyh s VAL 51 CO 0.00 -1.11 0.70 -0.62 0.00 0.00 0.00 175.10 174.07 2eyh n GLU 52 N 3.12 -1.42 -2.34 2.72 1.02 -0.29 -4.86 120.64 118.58 2eyh n GLU 52 Ca 0.19 -0.38 -0.43 0.00 -0.02 0.00 0.00 57.16 56.53 2eyh n GLU 52 Cb 0.41 -2.05 -0.02 0.00 -0.02 0.00 0.00 31.44 29.76 2eyh n GLU 52 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2eyh s LYS 53 N -4.10 3.96 0.00 3.49 2.47 -1.26 -2.01 119.74 122.29 2eyh s LYS 53 Ca 0.63 1.44 0.00 0.00 -1.56 0.00 0.00 55.97 56.48 2eyh s LYS 53 Cb -0.21 -3.89 0.00 0.00 -1.46 0.00 0.00 37.83 32.27 2eyh s LYS 53 CO 0.64 -1.07 0.00 0.66 0.16 0.00 0.00 175.35 175.74 2eyh n TYR 54 N 7.60 0.00 0.38 4.03 4.01 -1.26 -4.84 117.16 127.08 2eyh n TYR 54 Ca 0.15 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.71 2eyh n TYR 54 Cb 0.46 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.40 2eyh n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2eyh h GLY 55 N 0.00 -0.97 0.66 2.72 0.00 -1.60 0.68 103.07 104.57 2eyh h GLY 55 Ca 0.00 0.36 0.10 0.00 0.00 0.00 0.00 47.33 47.79 2eyh h GLY 55 CO 0.00 -0.35 0.59 -2.55 0.00 0.00 0.00 176.54 174.23 2eyh h PRO 56 N -0.94 0.90 -0.39 4.80 0.11 -1.88 -0.61 132.00 133.99 2eyh h PRO 56 Ca -0.09 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.87 2eyh h PRO 56 Cb 0.71 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 2eyh h PRO 56 CO 0.16 0.59 -0.09 0.93 -0.21 0.00 0.00 178.00 179.37 2eyh h GLU 57 N 0.92 0.76 -0.57 1.05 3.07 -1.86 0.59 114.58 118.54 2eyh h GLU 57 Ca 0.43 -0.29 -0.10 0.00 -0.50 0.00 0.00 59.36 58.90 2eyh h GLU 57 Cb 0.42 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 2eyh h GLU 57 CO -0.20 0.89 -0.04 0.00 -1.40 0.00 0.00 179.01 178.27 2eyh h ALA 58 N 0.84 0.77 -0.32 3.43 0.00 0.11 -2.24 119.26 121.85 2eyh h ALA 58 Ca 0.10 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2eyh h ALA 58 Cb 0.62 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2eyh h ALA 58 CO 0.04 0.64 0.11 1.03 0.00 0.00 0.00 179.25 181.07 2eyh h SER 59 N 0.92 0.46 -0.88 0.00 0.87 -1.06 -1.53 113.55 112.33 2eyh h SER 59 Ca 0.16 -0.19 0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2eyh h SER 59 Cb 0.60 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.39 2eyh h SER 59 CO 0.04 0.52 0.58 0.00 -0.53 0.00 0.00 176.83 177.44 2eyh h ALA 60 N 0.95 1.13 -0.04 6.23 0.00 -0.78 -1.69 119.26 125.06 2eyh h ALA 60 Ca 0.11 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2eyh h ALA 60 Cb 0.22 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2eyh h ALA 60 CO -0.01 0.50 0.02 0.35 0.00 0.00 0.00 179.25 180.11 2eyh h PHE 61 N 1.18 0.06 -0.65 0.00 3.57 -1.10 -1.08 116.94 118.92 2eyh h PHE 61 Ca 0.33 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.76 2eyh h PHE 61 Cb -0.11 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 2eyh h PHE 61 CO -0.01 0.17 0.13 0.77 -2.23 0.00 0.00 178.31 177.14 2eyh h SER 62 N -0.06 0.99 0.21 0.41 0.02 -1.18 -2.20 113.55 111.74 2eyh h SER 62 Ca 0.01 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 60.76 2eyh h SER 62 Cb 0.13 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 2eyh h SER 62 CO -0.00 0.97 -0.26 0.50 -1.14 0.00 0.00 176.83 176.89 2eyh h LYS 63 N 0.98 -0.51 -0.87 3.45 3.64 -1.19 -0.61 116.57 121.47 2eyh h LYS 63 Ca 0.20 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.59 2eyh h LYS 63 Cb 0.39 0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2eyh h LYS 63 CO 0.01 -0.34 0.44 0.87 -2.27 0.00 0.00 179.45 178.16 2eyh h LYS 64 N -0.53 1.23 -0.12 1.90 1.79 -1.09 0.13 116.57 119.88 2eyh h LYS 64 Ca 0.01 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 2eyh h LYS 64 Cb 0.51 -0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 30.92 2eyh h LYS 64 CO -0.09 0.93 0.08 1.98 -1.08 0.00 0.00 179.45 181.27 2eyh h MET 65 N 1.22 0.16 0.00 3.15 4.05 -1.16 0.31 114.93 122.66 2eyh h MET 65 Ca 0.30 -0.01 -0.15 0.00 -0.28 0.00 0.00 59.70 59.56 2eyh h MET 65 Cb 0.08 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.82 2eyh h MET 65 CO -0.04 0.10 -0.74 -0.39 0.23 0.00 0.00 176.91 176.07 2eyh h VAL 66 N 0.16 1.34 -0.07 -5.77 -1.51 -0.84 -3.18 116.25 106.38 2eyh h VAL 66 Ca 0.05 -2.70 -0.15 0.00 -1.23 0.00 0.00 66.70 62.67 2eyh h VAL 66 Cb -0.01 2.54 -0.01 0.00 -2.13 0.00 0.00 31.29 31.67 2eyh h VAL 66 CO -0.01 0.72 -0.61 -0.33 -1.23 0.00 0.00 177.57 176.11 2eyh h GLU 67 N 0.00 0.24 -0.55 5.19 5.08 -0.36 -3.13 114.58 121.06 2eyh h GLU 67 Ca -0.01 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2eyh h GLU 67 Cb 1.48 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.76 2eyh h GLU 67 CO 0.10 0.78 0.00 0.09 -1.00 0.00 0.00 179.01 178.97 2eyh n ASN 68 N -3.87 2.97 -4.83 1.42 3.02 0.10 -4.94 115.26 109.13 2eyh n ASN 68 Ca -0.02 -2.07 -0.34 0.00 -0.03 0.00 0.00 54.58 52.11 2eyh n ASN 68 Cb 0.62 -0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 39.35 2eyh n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2eyh s ALA 69 N -1.40 3.38 0.10 5.41 0.00 -1.19 -4.96 121.76 123.10 2eyh s ALA 69 Ca 0.35 0.10 0.02 0.00 0.00 0.00 0.00 51.96 52.43 2eyh s ALA 69 Cb 0.19 -2.79 -0.24 0.00 0.00 0.00 0.00 23.12 20.29 2eyh s ALA 69 CO 0.23 0.33 1.22 0.87 0.00 0.00 0.00 175.76 178.41 2eyh h LYS 70 N 2.88 0.12 -4.06 0.00 1.57 -1.92 -3.46 116.57 111.71 2eyh h LYS 70 Ca -0.48 -0.21 -0.35 0.00 -1.87 0.00 0.00 60.65 57.74 2eyh h LYS 70 Cb 1.18 0.08 -0.31 0.00 0.08 0.00 0.00 32.23 33.26 2eyh h LYS 70 CO 0.65 1.10 -0.76 0.15 -0.57 0.00 0.00 179.45 180.02 2eyh s LYS 71 N -2.70 0.50 -0.09 3.15 1.02 -1.26 -5.02 119.74 115.34 2eyh s LYS 71 Ca -0.01 -0.09 0.01 0.00 0.02 0.00 0.00 55.97 55.90 2eyh s LYS 71 Cb 0.09 -0.54 -0.02 0.00 -0.52 0.00 0.00 37.83 36.83 2eyh s LYS 71 CO 0.85 -0.01 -0.11 0.42 -0.92 0.00 0.00 175.35 175.57 2eyh s ILE 72 N 0.48 3.26 0.06 2.17 -1.09 -1.26 -0.81 121.20 124.00 2eyh s ILE 72 Ca -0.05 -0.62 0.04 0.00 -2.23 0.00 0.00 60.65 57.79 2eyh s ILE 72 Cb -0.09 -2.34 -0.03 0.00 -1.58 0.00 0.00 42.46 38.43 2eyh s ILE 72 CO -0.00 0.56 -0.13 -1.61 -1.23 0.00 0.00 174.94 172.53 2eyh s GLU 73 N -0.22 0.77 0.04 2.79 2.02 -0.53 -2.12 118.70 121.45 2eyh s GLU 73 Ca 0.02 -0.86 0.07 0.00 0.02 0.00 0.00 54.97 54.21 2eyh s GLU 73 Cb -0.13 -0.74 -0.03 0.00 0.10 0.00 0.00 34.13 33.33 2eyh s GLU 73 CO 0.03 0.17 -0.19 0.14 0.02 0.00 0.00 175.26 175.43 2eyh s VAL 74 N -1.18 2.75 -0.26 2.63 -7.23 0.26 -0.98 120.40 116.39 2eyh s VAL 74 Ca -0.03 -1.18 0.00 0.00 -1.81 0.00 0.00 61.98 58.96 2eyh s VAL 74 Cb -0.09 -2.15 0.07 0.00 0.56 0.00 0.00 36.38 34.77 2eyh s VAL 74 CO 0.02 0.35 0.01 -0.70 -0.31 0.00 0.00 175.10 174.46 2eyh s GLU 75 N -1.39 1.26 0.58 4.82 2.12 -0.41 -0.16 118.70 125.51 2eyh s GLU 75 Ca 0.14 -1.04 -0.17 0.00 0.36 0.00 0.00 54.97 54.27 2eyh s GLU 75 Cb -0.10 -2.46 -0.04 0.00 0.26 0.00 0.00 34.13 31.78 2eyh s GLU 75 CO 0.05 -0.73 1.07 -0.06 -0.54 0.00 0.00 175.26 175.05 2eyh s PHE 76 N 1.45 2.87 0.00 5.30 0.40 -1.26 -0.96 117.98 125.78 2eyh s PHE 76 Ca 0.00 1.54 0.00 0.00 -0.60 0.00 0.00 56.93 57.87 2eyh s PHE 76 Cb -0.18 -3.10 0.00 0.00 0.51 0.00 0.00 43.02 40.25 2eyh s PHE 76 CO -0.11 -1.24 0.00 -3.47 0.70 0.00 0.00 175.22 171.10 2eyh n ASP 77 N -1.76 0.00 0.15 1.36 -0.08 -1.26 -4.70 116.55 110.25 2eyh n ASP 77 Ca 0.10 -0.77 0.12 0.00 -1.51 0.00 0.00 54.79 52.73 2eyh n ASP 77 Cb 0.52 0.00 0.24 0.00 2.34 0.00 0.00 41.12 44.22 2eyh n ASP 77 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2eyh h LYS 78 N 0.00 0.00 0.00 -0.67 1.57 -1.97 -3.47 116.57 112.03 2eyh h LYS 78 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2eyh h LYS 78 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2eyh h LYS 78 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 2eyh n GLY 79 N 1.22 2.56 3.79 3.86 0.00 -1.26 -4.97 105.19 110.38 2eyh n GLY 79 Ca 0.04 -1.74 -0.34 0.00 0.00 0.00 0.00 46.02 43.97 2eyh n GLY 79 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2eyh s GLN 80 N 4.82 3.80 0.00 1.61 -2.07 -1.26 -4.93 119.66 121.63 2eyh s GLN 80 Ca 0.00 1.41 0.16 0.00 -1.82 0.00 0.00 55.36 55.11 2eyh s GLN 80 Cb 0.00 -2.14 0.03 0.00 -1.09 0.00 0.00 33.01 29.81 2eyh s GLN 80 CO 0.00 -0.44 0.87 0.54 -1.32 0.00 0.00 175.29 174.94 2eyh n ARG 81 N -0.88 1.60 -4.17 9.60 1.74 -1.26 -4.83 116.66 118.46 2eyh n ARG 81 Ca 0.09 -0.96 -0.14 0.00 -0.77 0.00 0.00 57.85 56.06 2eyh n ARG 81 Cb 0.52 -1.26 -0.11 0.00 -1.02 0.00 0.00 32.46 30.59 2eyh n ARG 81 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2eyh s THR 82 N -1.69 0.90 0.58 0.55 -4.23 -1.26 -0.34 115.64 110.15 2eyh s THR 82 Ca 0.14 -1.62 0.09 0.00 -1.18 0.00 0.00 61.69 59.13 2eyh s THR 82 Cb 0.13 -1.33 0.08 0.00 1.34 0.00 0.00 72.50 72.72 2eyh s THR 82 CO 0.33 -0.56 0.75 1.51 -0.54 0.00 0.00 174.62 176.11 2eyh s ASP 83 N -2.42 5.02 0.19 3.99 1.47 -0.42 -4.89 116.67 119.62 2eyh s ASP 83 Ca 0.05 -0.91 0.13 0.00 1.18 0.00 0.00 52.55 52.99 2eyh s ASP 83 Cb -0.03 0.35 0.70 0.00 -0.34 0.00 0.00 42.92 43.61 2eyh s ASP 83 CO -0.00 -1.34 1.40 2.29 0.68 0.00 0.00 175.17 178.20 2eyh n LYS 84 N -2.20 0.08 -0.18 2.11 2.85 -1.26 -0.49 118.16 119.07 2eyh n LYS 84 Ca 0.14 0.58 0.11 0.00 -1.05 0.00 0.00 58.31 58.09 2eyh n LYS 84 Cb 0.62 -1.77 0.20 0.00 -0.65 0.00 0.00 35.03 33.43 2eyh n LYS 84 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2eyh n TYR 85 N -1.95 0.48 -0.64 5.58 4.02 -1.26 -4.92 117.16 118.46 2eyh n TYR 85 Ca -0.01 -0.25 0.00 0.00 -0.01 0.00 0.00 57.90 57.63 2eyh n TYR 85 Cb 0.02 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.34 2eyh n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2eyh n GLY 86 N 1.41 0.75 3.73 2.72 0.00 0.36 -5.04 105.19 109.12 2eyh n GLY 86 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2eyh n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2eyh s ARG 87 N -0.36 4.71 0.37 1.61 0.52 -1.26 -4.76 118.95 119.79 2eyh s ARG 87 Ca 0.00 1.44 -0.27 0.00 -0.52 0.00 0.00 55.73 56.38 2eyh s ARG 87 Cb 0.00 -3.36 -0.11 0.00 0.52 0.00 0.00 34.95 32.00 2eyh s ARG 87 CO 0.00 0.27 1.27 0.41 0.02 0.00 0.00 175.30 177.27 2eyh n GLY 88 N 2.12 0.53 3.24 -3.53 0.00 -0.11 -1.30 105.19 106.14 2eyh n GLY 88 Ca 0.01 0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.93 2eyh n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2eyh s LEU 89 N -1.23 4.01 0.21 0.99 1.43 0.54 -0.46 118.68 124.18 2eyh s LEU 89 Ca 0.58 -1.11 -0.19 0.00 -1.03 0.00 0.00 54.13 52.38 2eyh s LEU 89 Cb -0.55 -1.80 0.03 0.00 0.03 0.00 0.00 46.19 43.91 2eyh s LEU 89 CO 0.61 -0.27 0.57 0.00 0.23 0.00 0.00 176.35 177.49 2eyh s ALA 90 N 1.36 -1.02 -0.10 4.21 0.00 -1.12 -4.38 121.76 120.71 2eyh s ALA 90 Ca -0.02 -0.21 -0.21 0.00 0.00 0.00 0.00 51.96 51.52 2eyh s ALA 90 Cb -0.19 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 2eyh s ALA 90 CO 0.01 -0.85 0.59 0.71 0.00 0.00 0.00 175.76 176.21 2eyh s TYR 91 N -3.88 3.53 -0.12 0.00 2.02 -0.13 -1.26 117.35 117.50 2eyh s TYR 91 Ca 0.10 1.05 -0.03 0.00 -0.37 0.00 0.00 57.07 57.81 2eyh s TYR 91 Cb -0.02 -2.68 -0.03 0.00 -0.40 0.00 0.00 41.96 38.83 2eyh s TYR 91 CO -0.01 0.11 -0.01 0.42 -1.57 0.00 0.00 175.55 174.49 2eyh s ILE 92 N 0.81 4.21 -0.12 2.71 -1.09 -1.26 -1.29 121.20 125.17 2eyh s ILE 92 Ca 0.31 -0.27 0.02 0.00 -2.23 0.00 0.00 60.65 58.49 2eyh s ILE 92 Cb -0.16 -2.81 -0.01 0.00 -1.58 0.00 0.00 42.46 37.90 2eyh s ILE 92 CO 0.14 0.55 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.90 2eyh s TYR 93 N -0.30 2.68 -0.26 3.97 2.02 -0.15 -0.41 117.35 124.90 2eyh s TYR 93 Ca 0.06 -0.87 -0.03 0.00 -0.37 0.00 0.00 57.07 55.86 2eyh s TYR 93 Cb -0.12 -1.78 0.01 0.00 -0.40 0.00 0.00 41.96 39.67 2eyh s TYR 93 CO 0.02 -0.33 -0.02 0.00 -1.57 0.00 0.00 175.55 173.66 2eyh s ALA 94 N 0.36 2.82 -1.42 3.71 0.00 0.26 -1.46 121.76 126.03 2eyh s ALA 94 Ca -0.15 -1.40 -0.10 0.00 0.00 0.00 0.00 51.96 50.31 2eyh s ALA 94 Cb -0.17 -1.82 0.01 0.00 0.00 0.00 0.00 23.12 21.14 2eyh s ALA 94 CO 0.07 -0.77 0.28 -0.25 0.00 0.00 0.00 175.76 175.09 2eyh n ASP 95 N 4.75 -0.83 0.00 0.00 10.43 0.01 -1.34 116.55 129.56 2eyh n ASP 95 Ca -0.16 -1.23 0.00 0.00 2.57 0.00 0.00 54.79 55.97 2eyh n ASP 95 Cb 0.48 -1.92 0.00 0.00 1.84 0.00 0.00 41.12 41.52 2eyh n ASP 95 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2eyh n GLY 96 N -2.33 2.23 3.46 0.44 0.00 -1.26 -5.01 105.19 102.72 2eyh n GLY 96 Ca -0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 2eyh n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eyh s LYS 97 N -0.17 3.61 -0.15 1.61 1.02 -0.45 -5.05 119.74 120.16 2eyh s LYS 97 Ca 0.00 -0.55 -0.29 0.00 0.02 0.00 0.00 55.97 55.15 2eyh s LYS 97 Cb 0.00 -2.93 -0.03 0.00 -0.52 0.00 0.00 37.83 34.35 2eyh s LYS 97 CO 0.00 0.15 1.49 1.41 -0.92 0.00 0.00 175.35 177.48 2eyh s MET 98 N 0.60 4.08 0.27 1.68 -2.45 -1.26 -0.58 119.30 121.64 2eyh s MET 98 Ca -0.03 1.82 -0.04 0.00 -1.25 0.00 0.00 55.69 56.20 2eyh s MET 98 Cb -0.14 -3.92 0.33 0.00 1.25 0.00 0.00 34.83 32.35 2eyh s MET 98 CO 0.02 -0.93 1.88 0.28 1.05 0.00 0.00 175.02 177.32 2eyh h VAL 99 N 5.72 1.23 -0.76 10.11 2.07 -1.10 -1.11 116.25 132.41 2eyh h VAL 99 Ca -0.33 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 66.58 2eyh h VAL 99 Cb 1.14 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 2eyh h VAL 99 CO 0.98 0.27 0.50 0.78 0.02 0.00 0.00 177.57 180.12 2eyh h ASN 100 N 1.08 0.85 -0.27 0.57 4.21 -1.91 -1.73 115.58 118.38 2eyh h ASN 100 Ca 0.27 -0.02 -0.09 0.00 1.21 0.00 0.00 56.30 57.66 2eyh h ASN 100 Cb 0.07 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.06 2eyh h ASN 100 CO -0.04 0.61 -0.20 -0.08 -1.29 0.00 0.00 177.43 176.43 2eyh h GLU 101 N 1.00 0.61 -0.99 0.81 4.22 -1.81 -2.99 114.58 115.43 2eyh h GLU 101 Ca 0.28 -0.30 0.04 0.00 0.08 0.00 0.00 59.36 59.46 2eyh h GLU 101 Cb -0.09 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.11 2eyh h GLU 101 CO -0.07 0.89 0.65 0.00 -2.18 0.00 0.00 179.01 178.29 2eyh h ALA 102 N 0.71 1.31 -0.73 2.92 0.00 -0.82 0.40 119.26 123.04 2eyh h ALA 102 Ca 0.05 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2eyh h ALA 102 Cb 0.75 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2eyh h ALA 102 CO 0.05 0.55 0.35 -0.07 0.00 0.00 0.00 179.25 180.13 2eyh h LEU 103 N 1.26 0.94 -0.00 0.00 -0.00 -1.29 -1.74 115.31 114.47 2eyh h LEU 103 Ca 0.39 -0.10 -0.23 0.00 -0.00 0.00 0.00 57.88 57.94 2eyh h LEU 103 Cb -0.01 -0.24 0.02 0.00 -0.00 0.00 0.00 40.66 40.43 2eyh h LEU 103 CO -0.12 0.79 -0.88 0.58 -0.00 0.00 0.00 178.44 178.81 2eyh h VAL 104 N 1.04 1.33 -0.60 1.22 2.07 -1.08 0.12 116.25 120.34 2eyh h VAL 104 Ca 0.25 -2.18 0.10 0.00 0.82 0.00 0.00 66.70 65.70 2eyh h VAL 104 Cb 0.10 2.45 -0.04 0.00 -1.52 0.00 0.00 31.29 32.28 2eyh h VAL 104 CO -0.03 0.66 0.40 -0.09 0.02 0.00 0.00 177.57 178.53 2eyh h ARG 105 N 0.22 0.40 -0.17 1.57 9.65 0.08 -1.42 114.38 124.71 2eyh h ARG 105 Ca -0.11 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.75 2eyh h ARG 105 Cb 1.55 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 30.04 2eyh h ARG 105 CO 0.17 0.27 0.00 1.04 2.80 0.00 0.00 179.97 184.25 2eyh n GLN 106 N -4.47 1.62 -2.07 0.20 1.13 -0.69 -4.36 117.38 108.74 2eyh n GLN 106 Ca 0.10 -0.95 -0.14 0.00 -1.94 0.00 0.00 57.00 54.07 2eyh n GLN 106 Cb 0.37 -1.34 -0.02 0.00 0.11 0.00 0.00 30.24 29.36 2eyh n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2eyh n GLY 107 N 1.05 0.17 0.67 1.08 0.00 -0.54 -4.43 105.19 103.19 2eyh n GLY 107 Ca 0.14 -0.31 0.07 0.00 0.00 0.00 0.00 46.02 45.92 2eyh n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2eyh n LEU 108 N -1.92 2.72 -3.62 0.99 4.77 0.38 -1.30 117.00 119.02 2eyh n LEU 108 Ca -0.16 -1.63 -0.15 0.00 -0.03 0.00 0.00 56.01 54.04 2eyh n LEU 108 Cb 0.59 -0.17 -0.07 0.00 -2.33 0.00 0.00 43.42 41.44 2eyh n LEU 108 CO 0.20 0.63 0.24 0.00 -1.33 0.00 0.00 177.39 177.13 2eyh s ALA 109 N -1.03 -1.27 0.22 -1.18 0.00 -1.08 -4.41 121.76 113.01 2eyh s ALA 109 Ca 0.23 0.71 0.05 0.00 0.00 0.00 0.00 51.96 52.95 2eyh s ALA 109 Cb 0.13 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.38 2eyh s ALA 109 CO 0.18 -0.38 0.32 0.15 0.00 0.00 0.00 175.76 176.02 2eyh s LYS 110 N -1.72 3.36 -0.05 0.00 1.02 -0.35 -4.45 119.74 117.55 2eyh s LYS 110 Ca -0.10 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 54.83 2eyh s LYS 110 Cb -0.02 -2.86 -0.04 0.00 -0.52 0.00 0.00 37.83 34.40 2eyh s LYS 110 CO 0.04 0.44 1.31 0.08 -0.92 0.00 0.00 175.35 176.30 2eyh s VAL 111 N -1.95 4.01 1.24 3.17 1.01 -1.26 -0.64 120.40 125.98 2eyh s VAL 111 Ca 0.34 1.34 -0.20 0.00 0.00 0.00 0.00 61.98 63.45 2eyh s VAL 111 Cb -0.09 -3.86 0.30 0.00 0.00 0.00 0.00 36.38 32.73 2eyh s VAL 111 CO 0.28 -0.02 1.10 0.00 0.00 0.00 0.00 175.10 176.46 2eyh s ALA 112 N 2.56 0.51 0.15 5.51 0.00 0.44 -4.79 121.76 126.13 2eyh s ALA 112 Ca 0.60 -1.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.23 2eyh s ALA 112 Cb -0.27 -2.86 -0.08 0.00 0.00 0.00 0.00 23.12 19.91 2eyh s ALA 112 CO 0.23 -3.74 1.27 0.71 0.00 0.00 0.00 175.76 174.23 2eyh s TYR 113 N -2.98 3.34 -0.14 0.00 4.12 -1.26 -4.95 117.35 115.48 2eyh s TYR 113 Ca 0.72 1.25 -0.09 0.00 0.02 0.00 0.00 57.07 58.96 2eyh s TYR 113 Cb -0.09 -3.53 -0.04 0.00 -1.52 0.00 0.00 41.96 36.78 2eyh s TYR 113 CO 0.56 -1.66 0.16 0.08 0.02 0.00 0.00 175.55 174.71 2eyh s VAL 114 N 0.41 5.43 -0.34 0.71 1.01 -1.26 -4.97 120.40 121.40 2eyh s VAL 114 Ca 0.57 0.27 -0.02 0.00 0.00 0.00 0.00 61.98 62.80 2eyh s VAL 114 Cb -0.34 -3.46 0.07 0.00 0.00 0.00 0.00 36.38 32.65 2eyh s VAL 114 CO 0.35 0.54 0.08 -0.31 0.00 0.00 0.00 175.10 175.75 2eyh s TYR 115 N -0.47 3.39 0.61 5.22 1.51 -1.26 -5.07 117.35 121.28 2eyh s TYR 115 Ca 0.13 -2.06 -0.18 0.00 -1.01 0.00 0.00 57.07 53.95 2eyh s TYR 115 Cb -0.12 -2.52 -0.03 0.00 -0.11 0.00 0.00 41.96 39.18 2eyh s TYR 115 CO 0.03 -0.86 1.22 0.15 -1.11 0.00 0.00 175.55 174.97 2eyh s LYS 116 N 1.21 2.87 -0.15 -0.62 1.02 -1.26 0.08 119.74 122.89 2eyh s LYS 116 Ca 0.00 1.84 0.08 0.00 0.02 0.00 0.00 55.97 57.91 2eyh s LYS 116 Cb -0.21 -1.91 0.48 0.00 -0.52 0.00 0.00 37.83 35.67 2eyh s LYS 116 CO -0.02 -1.29 1.27 -0.35 -0.92 0.00 0.00 175.35 174.04 2eyh n PRO 117 N -1.71 3.19 -2.35 -1.68 -0.04 -1.26 -4.99 135.00 126.16 2eyh n PRO 117 Ca 0.14 -1.87 -0.43 0.00 -0.04 0.00 0.00 63.50 61.30 2eyh n PRO 117 Cb 0.50 -1.94 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 2eyh n PRO 117 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2eyh n ASN 118 N 0.30 5.03 -0.50 3.54 3.02 0.11 -4.28 115.26 122.49 2eyh n ASN 118 Ca 0.18 -3.08 0.00 0.00 -0.03 0.00 0.00 54.58 51.65 2eyh n ASN 118 Cb 0.85 -1.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.52 2eyh n ASN 118 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2eyh n ASN 119 N 4.16 0.00 -0.20 6.41 6.94 -1.26 -4.40 115.26 126.91 2eyh n ASN 119 Ca 0.40 -1.62 -0.00 0.00 -0.02 0.00 0.00 54.58 53.35 2eyh n ASN 119 Cb 0.37 -0.12 0.10 0.00 -2.36 0.00 0.00 39.78 37.77 2eyh n ASN 119 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 2eyh h THR 120 N 6.21 0.76 -0.49 5.53 2.02 -1.97 -1.75 112.91 123.21 2eyh h THR 120 Ca 0.00 -0.13 -0.07 0.00 0.77 0.00 0.00 66.41 66.97 2eyh h THR 120 Cb 1.25 0.34 -0.04 0.00 -1.74 0.00 0.00 68.15 67.95 2eyh h THR 120 CO 0.00 0.07 0.09 1.41 0.37 0.00 0.00 175.52 177.46 2eyh n HIS 121 N -5.02 1.70 -0.24 3.16 8.25 -1.26 -4.51 115.22 117.31 2eyh n HIS 121 Ca 0.08 -0.73 -0.06 0.00 -0.26 0.00 0.00 57.72 56.76 2eyh n HIS 121 Cb 0.27 -0.48 0.05 0.00 1.12 0.00 0.00 29.99 30.95 2eyh n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2eyh h GLU 122 N 2.54 0.91 -0.05 -0.41 4.81 -1.70 -2.51 114.58 118.17 2eyh h GLU 122 Ca 0.09 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2eyh h GLU 122 Cb 1.76 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.95 2eyh h GLU 122 CO 0.46 0.66 0.02 1.96 -0.73 0.00 0.00 179.01 181.37 2eyh h GLN 123 N 0.90 0.07 -0.51 1.92 4.20 -1.82 -1.45 115.11 118.43 2eyh h GLN 123 Ca 0.24 -0.01 0.10 0.00 0.06 0.00 0.00 58.65 59.03 2eyh h GLN 123 Cb -0.01 -0.01 -0.08 0.00 0.30 0.00 0.00 27.48 27.68 2eyh h GLN 123 CO -0.04 0.22 0.02 1.25 -0.67 0.00 0.00 178.83 179.61 2eyh h HIS 124 N -0.10 0.01 -0.54 2.96 2.76 -1.88 -1.60 115.15 116.76 2eyh h HIS 124 Ca 0.02 0.04 -0.11 0.00 -2.20 0.00 0.00 60.37 58.11 2eyh h HIS 124 Cb 0.18 0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 2eyh h HIS 124 CO -0.02 -0.10 -0.11 -0.07 -1.30 0.00 0.00 177.93 176.34 2eyh h LEU 125 N 0.14 1.03 -1.28 0.26 3.38 -1.35 -1.92 115.31 115.57 2eyh h LEU 125 Ca 0.26 -0.34 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 2eyh h LEU 125 Cb 0.38 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2eyh h LEU 125 CO -0.41 1.14 -0.20 0.03 0.09 0.00 0.00 178.44 179.09 2eyh h ARG 126 N 0.91 0.24 -0.56 1.13 3.08 -0.76 0.26 114.38 118.69 2eyh h ARG 126 Ca 0.14 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 2eyh h ARG 126 Cb 0.67 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 2eyh h ARG 126 CO 0.05 0.44 0.05 0.87 -1.07 0.00 0.00 179.97 180.31 2eyh h LYS 127 N 0.23 0.94 -0.09 0.04 1.57 -1.10 -0.28 116.57 117.88 2eyh h LYS 127 Ca 0.04 -0.27 -0.16 0.00 -1.87 0.00 0.00 60.65 58.39 2eyh h LYS 127 Cb 0.48 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 2eyh h LYS 127 CO 0.03 0.93 -0.64 0.77 -0.57 0.00 0.00 179.45 179.97 2eyh h SER 128 N 0.83 0.40 -0.54 0.86 0.02 -0.52 -2.65 113.55 111.94 2eyh h SER 128 Ca 0.16 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 60.78 2eyh h SER 128 Cb 0.46 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 2eyh h SER 128 CO 0.02 0.93 -0.04 -0.08 -1.14 0.00 0.00 176.83 176.52 2eyh h GLU 129 N 0.25 0.98 -0.73 3.45 4.81 -0.23 -0.91 114.58 122.20 2eyh h GLU 129 Ca -0.01 -0.34 0.03 0.00 -0.13 0.00 0.00 59.36 58.91 2eyh h GLU 129 Cb 1.18 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.43 2eyh h GLU 129 CO 0.11 1.01 0.46 0.00 -0.73 0.00 0.00 179.01 179.86 2eyh h ALA 130 N 0.94 0.96 -0.14 2.92 0.00 -1.01 -1.64 119.26 121.29 2eyh h ALA 130 Ca 0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2eyh h ALA 130 Cb 0.59 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2eyh h ALA 130 CO 0.04 0.25 0.07 0.37 0.00 0.00 0.00 179.25 179.97 2eyh h GLN 131 N 0.90 0.21 -0.63 0.00 5.75 -1.24 -1.72 115.11 118.37 2eyh h GLN 131 Ca 0.30 -0.03 0.02 0.00 -0.15 0.00 0.00 58.65 58.79 2eyh h GLN 131 Cb 0.02 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.50 2eyh h GLN 131 CO -0.11 0.25 0.42 0.00 -2.65 0.00 0.00 178.83 176.73 2eyh h ALA 132 N 0.95 1.62 -0.13 3.38 0.00 -0.85 -0.59 119.26 123.63 2eyh h ALA 132 Ca 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2eyh h ALA 132 Cb 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2eyh h ALA 132 CO -0.01 0.33 0.05 0.87 0.00 0.00 0.00 179.25 180.49 2eyh h LYS 133 N 0.79 0.20 -0.53 0.00 6.56 -1.13 -0.82 116.57 121.63 2eyh h LYS 133 Ca 0.24 -0.04 0.03 0.00 -1.06 0.00 0.00 60.65 59.83 2eyh h LYS 133 Cb 0.01 -0.03 -0.03 0.00 -0.57 0.00 0.00 32.23 31.61 2eyh h LYS 133 CO -0.06 0.30 0.35 -0.22 -2.06 0.00 0.00 179.45 177.76 2eyh h LYS 134 N 0.05 0.58 -0.05 3.15 3.64 -0.95 -0.41 116.57 122.58 2eyh h LYS 134 Ca 0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2eyh h LYS 134 Cb 0.18 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2eyh h LYS 134 CO -0.00 0.38 0.00 0.39 -2.27 0.00 0.00 179.45 177.95 2eyh n GLU 135 N -4.47 1.73 -3.96 1.90 1.02 -0.26 -4.95 120.64 111.64 2eyh n GLU 135 Ca 0.06 -1.07 -0.29 0.00 -0.02 0.00 0.00 57.16 55.84 2eyh n GLU 135 Cb 0.15 -1.46 0.01 0.00 -0.02 0.00 0.00 31.44 30.11 2eyh n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2eyh n LYS 136 N 0.29 -4.43 -2.95 3.49 5.02 -0.16 -4.94 118.16 114.48 2eyh n LYS 136 Ca 0.18 0.51 -0.40 0.00 -2.02 0.00 0.00 58.31 56.58 2eyh n LYS 136 Cb 0.37 -5.15 -0.05 0.00 -0.02 0.00 0.00 35.03 30.17 2eyh n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2eyh s LEU 137 N -7.12 4.48 0.00 -0.35 1.43 -0.74 -3.51 118.68 112.88 2eyh s LEU 137 Ca 0.44 1.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.05 2eyh s LEU 137 Cb -0.23 -3.28 0.00 0.00 0.03 0.00 0.00 46.19 42.71 2eyh s LEU 137 CO 0.86 0.04 0.00 0.59 0.23 0.00 0.00 176.35 178.07 2eyh n ASN 138 N 2.62 0.00 -0.19 2.29 3.02 -1.26 -0.52 115.26 121.21 2eyh n ASN 138 Ca -0.02 0.00 0.29 0.00 -0.03 0.00 0.00 54.58 54.81 2eyh n ASN 138 Cb 0.50 0.00 0.71 0.00 -0.61 0.00 0.00 39.78 40.38 2eyh n ASN 138 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2eyh h ILE 139 N 0.00 0.55 -0.59 2.41 2.04 -1.51 0.15 117.51 120.56 2eyh h ILE 139 Ca 0.00 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2eyh h ILE 139 Cb 0.00 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2eyh h ILE 139 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 178.15 178.94 2eyh n TRP 140 N -4.28 0.93 1.92 1.37 7.02 0.32 -5.14 117.44 119.58 2eyh n TRP 140 Ca 0.19 -0.43 0.15 0.00 -1.02 0.00 0.00 57.50 56.39 2eyh n TRP 140 Cb 0.97 -0.06 0.91 0.00 -2.42 0.00 0.00 31.31 30.71 2eyh n TRP 140 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12