#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kdv n PRO -2 N 0.00 2.37 -0.97 0.11 -0.04 -1.26 -4.24 135.00 130.98 3kdv n PRO -2 Ca 0.00 -1.88 -0.11 0.00 -0.04 0.00 0.00 63.50 61.46 3kdv n PRO -2 Cb 0.00 -1.27 0.21 0.00 -0.04 0.00 0.00 33.50 32.40 3kdv n PRO -2 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3kdv n PHE -1 N 0.59 1.97 -3.79 0.54 3.72 -1.26 -5.11 117.46 114.11 3kdv n PHE -1 Ca 0.11 -1.62 -0.29 0.00 -0.05 0.00 0.00 57.45 55.60 3kdv n PHE -1 Cb 0.40 -0.68 -0.12 0.00 -0.94 0.00 0.00 39.48 38.14 3kdv n PHE -1 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3kdv s THR 0 N -3.22 2.12 0.26 4.37 -4.23 -1.26 -5.22 115.64 108.46 3kdv s THR 0 Ca 0.50 -3.46 -0.21 0.00 -1.18 0.00 0.00 61.69 57.35 3kdv s THR 0 Cb 0.43 -2.43 0.02 0.00 1.34 0.00 0.00 72.50 71.87 3kdv s THR 0 CO 0.06 -0.97 0.68 -0.76 -0.54 0.00 0.00 174.62 173.09 3kdv s LEU 2 N -0.59 -0.24 -0.09 4.79 1.02 -0.84 -4.35 118.68 118.39 3kdv s LEU 2 Ca 0.23 -0.57 -0.04 0.00 0.02 0.00 0.00 54.13 53.77 3kdv s LEU 2 Cb -0.12 2.63 0.04 0.00 0.02 0.00 0.00 46.19 48.76 3kdv s LEU 2 CO -0.10 -1.29 0.21 -1.00 0.02 0.00 0.00 176.35 174.20 3kdv s HIS 3 N -3.91 -0.27 -0.16 0.29 3.76 -1.26 -1.19 115.29 112.55 3kdv s HIS 3 Ca 0.11 0.68 0.01 0.00 -0.15 0.00 0.00 55.06 55.70 3kdv s HIS 3 Cb -0.05 0.00 0.00 0.00 1.11 0.00 0.00 32.58 33.65 3kdv s HIS 3 CO 0.05 -0.21 -0.17 -1.50 -0.85 0.00 0.00 174.74 172.06 3kdv s ILE 4 N 1.20 2.47 -0.25 0.60 2.07 -0.62 -4.93 121.20 121.75 3kdv s ILE 4 Ca -0.09 -0.83 -0.22 0.00 -1.41 0.00 0.00 60.65 58.10 3kdv s ILE 4 Cb -0.11 -2.03 -0.01 0.00 0.13 0.00 0.00 42.46 40.44 3kdv s ILE 4 CO -0.07 0.52 0.70 -0.70 -1.91 0.00 0.00 174.94 173.48 3kdv s GLU 5 N 0.88 4.14 0.17 3.50 2.12 -1.26 -1.02 118.70 127.23 3kdv s GLU 5 Ca -0.04 0.69 0.07 0.00 0.36 0.00 0.00 54.97 56.05 3kdv s GLU 5 Cb -0.15 -3.64 -0.04 0.00 0.26 0.00 0.00 34.13 30.55 3kdv s GLU 5 CO -0.02 -0.44 -0.01 -0.06 -0.54 0.00 0.00 175.26 174.19 3kdv s PHE 6 N 2.58 2.82 -0.14 5.30 0.08 -0.20 -4.35 117.98 124.08 3kdv s PHE 6 Ca 0.29 -0.15 -0.06 0.00 0.12 0.00 0.00 56.93 57.14 3kdv s PHE 6 Cb -0.15 -1.37 -0.04 0.00 -0.57 0.00 0.00 43.02 40.89 3kdv s PHE 6 CO 0.08 0.52 0.06 0.42 -0.10 0.00 0.00 175.22 176.20 3kdv s ILE 7 N -1.72 4.82 0.37 0.64 -1.09 0.07 -1.52 121.20 122.77 3kdv s ILE 7 Ca 0.27 -0.04 0.05 0.00 -2.23 0.00 0.00 60.65 58.70 3kdv s ILE 7 Cb -0.09 -3.12 0.06 0.00 -1.58 0.00 0.00 42.46 37.74 3kdv s ILE 7 CO 0.18 0.54 0.51 0.35 -1.23 0.00 0.00 174.94 175.29 3kdv n THR 8 N 2.79 0.00 -0.23 2.92 -2.24 -0.95 -1.67 114.28 114.90 3kdv n THR 8 Ca -0.18 -1.17 0.06 0.00 -2.27 0.00 0.00 64.05 60.50 3kdv n THR 8 Cb 0.53 -0.75 0.32 0.00 -2.10 0.00 0.00 70.33 68.33 3kdv n THR 8 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 3kdv h ASP 9 N -0.00 0.73 -0.24 3.42 2.03 -1.84 -0.31 116.42 120.21 3kdv h ASP 9 Ca -0.17 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.14 3kdv h ASP 9 Cb 0.77 -0.15 0.00 0.00 -0.83 0.00 0.00 39.33 39.12 3kdv h ASP 9 CO 0.24 0.46 0.00 0.18 -1.03 0.00 0.00 179.24 179.09 3kdv n LEU 10 N -4.49 1.46 0.00 0.15 4.77 -1.26 -4.95 117.00 112.68 3kdv n LEU 10 Ca 0.12 -0.70 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 3kdv n LEU 10 Cb 0.25 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3kdv n LEU 10 CO 0.33 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 3kdv n GLY 11 N 0.98 0.90 3.80 -0.72 0.00 -0.13 -5.04 105.19 104.97 3kdv n GLY 11 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 3kdv n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kdv s ALA 12 N -3.56 2.85 -0.62 4.61 0.00 -1.26 -4.56 121.76 119.22 3kdv s ALA 12 Ca 0.00 0.57 -0.19 0.00 0.00 0.00 0.00 51.96 52.34 3kdv s ALA 12 Cb 0.00 -3.25 0.10 0.00 0.00 0.00 0.00 23.12 19.97 3kdv s ALA 12 CO 0.00 -0.39 0.76 0.21 0.00 0.00 0.00 175.76 176.34 3kdv s LYS 13 N -3.37 3.08 -0.20 0.00 2.20 -1.26 -2.25 119.74 117.95 3kdv s LYS 13 Ca 0.67 -1.29 0.01 0.00 -0.36 0.00 0.00 55.97 55.00 3kdv s LYS 13 Cb -0.16 -4.29 0.04 0.00 -1.51 0.00 0.00 37.83 31.91 3kdv s LYS 13 CO 0.23 -1.59 -0.11 0.08 -0.36 0.00 0.00 175.35 173.60 3kdv s VAL 14 N 2.84 1.69 -0.12 4.02 1.01 -0.57 -4.97 120.40 124.29 3kdv s VAL 14 Ca 0.14 -1.00 -0.19 0.00 0.00 0.00 0.00 61.98 60.92 3kdv s VAL 14 Cb -0.22 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 3kdv s VAL 14 CO 0.06 0.21 0.54 -0.89 0.00 0.00 0.00 175.10 175.02 3kdv s THR 15 N 1.38 5.14 -0.17 3.92 2.01 -1.26 -1.03 115.64 125.62 3kdv s THR 15 Ca -0.01 1.07 -0.04 0.00 0.31 0.00 0.00 61.69 63.03 3kdv s THR 15 Cb -0.16 -3.88 -0.02 0.00 0.01 0.00 0.00 72.50 68.45 3kdv s THR 15 CO -0.09 0.27 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.40 3kdv s VAL 16 N 0.90 3.85 0.15 3.82 1.01 -0.19 -4.93 120.40 125.02 3kdv s VAL 16 Ca 0.28 -0.36 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 3kdv s VAL 16 Cb -0.16 -2.70 -0.07 0.00 0.00 0.00 0.00 36.38 33.44 3kdv s VAL 16 CO 0.12 0.47 1.20 -1.81 0.00 0.00 0.00 175.10 175.08 3kdv s ASP 17 N 0.62 7.09 -0.04 3.32 1.01 -1.26 -1.58 116.67 125.82 3kdv s ASP 17 Ca -0.02 2.18 0.07 0.00 0.71 0.00 0.00 52.55 55.49 3kdv s ASP 17 Cb -0.14 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.17 3kdv s ASP 17 CO 0.02 -0.39 -0.25 -0.69 0.21 0.00 0.00 175.17 174.07 3kdv s VAL 18 N 0.23 2.11 0.24 -1.27 1.01 -0.33 -4.97 120.40 117.42 3kdv s VAL 18 Ca 0.54 -1.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 3kdv s VAL 18 Cb -0.32 -1.75 0.12 0.00 0.00 0.00 0.00 36.38 34.43 3kdv s VAL 18 CO 0.35 0.58 1.75 -0.08 0.00 0.00 0.00 175.10 177.69 3kdv h GLU 19 N 5.73 0.91 -1.68 2.72 4.81 -1.91 -2.22 114.58 122.94 3kdv h GLU 19 Ca -0.38 -0.23 0.26 0.00 -0.13 0.00 0.00 59.36 58.87 3kdv h GLU 19 Cb 1.15 -0.11 -0.14 0.00 0.63 0.00 0.00 28.75 30.27 3kdv h GLU 19 CO 0.47 0.86 0.73 -1.54 -0.73 0.00 0.00 179.01 178.81 3kdv s SER 20 N -6.58 -0.14 0.32 1.04 1.04 -1.26 -4.69 113.70 103.44 3kdv s SER 20 Ca -0.10 -0.12 0.10 0.00 0.48 0.00 0.00 55.95 56.31 3kdv s SER 20 Cb 0.15 0.23 0.89 0.00 0.10 0.00 0.00 66.02 67.39 3kdv s SER 20 CO 0.82 -0.40 1.73 0.00 0.98 0.00 0.00 173.24 176.37 3kdv h ALA 21 N 2.00 1.82 -0.02 5.32 0.00 -1.92 -1.24 119.26 125.22 3kdv h ALA 21 Ca -0.22 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3kdv h ALA 21 Cb 1.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3kdv h ALA 21 CO 0.26 -0.28 0.00 -0.40 0.00 0.00 0.00 179.25 178.83 3kdv n ASP 22 N -4.86 0.73 0.00 0.00 5.75 -1.26 -1.85 116.55 115.05 3kdv n ASP 22 Ca 0.27 -2.02 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 3kdv n ASP 22 Cb 0.75 -0.31 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 3kdv n ASP 22 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3kdv n LYS 23 N -0.16 -0.51 0.11 0.11 5.02 -0.47 -4.82 118.16 117.44 3kdv n LYS 23 Ca 0.01 -0.47 -0.14 0.00 -2.02 0.00 0.00 58.31 55.69 3kdv n LYS 23 Cb 0.17 -0.89 -0.07 0.00 -0.02 0.00 0.00 35.03 34.22 3kdv n LYS 23 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3kdv h LEU 24 N 0.00 -1.24 -0.93 -0.35 5.85 -1.43 -2.54 115.31 114.67 3kdv h LEU 24 Ca 0.00 0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.92 3kdv h LEU 24 Cb 0.15 0.47 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 3kdv h LEU 24 CO 0.00 -0.48 0.59 -0.07 -0.34 0.00 0.00 178.44 178.14 3kdv h LEU 25 N -0.64 0.94 -0.77 2.25 4.07 -1.88 0.10 115.31 119.39 3kdv h LEU 25 Ca 0.03 0.01 0.06 0.00 0.08 0.00 0.00 57.88 58.05 3kdv h LEU 25 Cb 0.67 -0.19 -0.06 0.00 1.08 0.00 0.00 40.66 42.17 3kdv h LEU 25 CO -0.25 0.60 0.46 0.44 -1.08 0.00 0.00 178.44 178.61 3kdv h ASP 26 N 1.07 0.72 0.07 -0.43 3.32 -1.86 0.78 116.42 120.09 3kdv h ASP 26 Ca 0.40 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.47 3kdv h ASP 26 Cb 0.17 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3kdv h ASP 26 CO -0.17 0.47 -0.03 0.58 -1.72 0.00 0.00 179.24 178.36 3kdv h VAL 27 N 0.86 1.22 -0.89 -1.35 2.07 -0.76 -1.00 116.25 116.39 3kdv h VAL 27 Ca 0.33 -1.09 0.21 0.00 0.82 0.00 0.00 66.70 66.97 3kdv h VAL 27 Cb 0.15 1.92 -0.17 0.00 -1.52 0.00 0.00 31.29 31.67 3kdv h VAL 27 CO -0.17 0.27 -0.08 1.56 0.02 0.00 0.00 177.57 179.17 3kdv h GLN 28 N -0.59 0.03 -0.43 1.57 4.20 -0.68 -1.66 115.11 117.54 3kdv h GLN 28 Ca -0.01 -0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.59 3kdv h GLN 28 Cb 0.50 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 3kdv h GLN 28 CO 0.02 0.02 -0.17 0.00 -0.67 0.00 0.00 178.83 178.02 3kdv h ARG 29 N 0.03 0.88 0.57 1.46 3.08 -0.63 -1.68 114.38 118.10 3kdv h ARG 29 Ca 0.48 -0.37 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 3kdv h ARG 29 Cb 0.87 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.87 3kdv h ARG 29 CO -0.86 1.02 -0.47 0.37 -1.07 0.00 0.00 179.97 178.96 3kdv h GLN 30 N 0.71 -0.98 0.00 0.04 4.15 -0.26 -2.00 115.11 116.78 3kdv h GLN 30 Ca 0.10 0.07 -0.04 0.00 0.77 0.00 0.00 58.65 59.55 3kdv h GLN 30 Cb 0.73 0.22 -0.01 0.00 0.21 0.00 0.00 27.48 28.64 3kdv h GLN 30 CO 0.06 -0.65 -0.17 1.88 -1.93 0.00 0.00 178.83 178.01 3kdv h TYR 31 N -1.02 0.00 -0.78 3.99 0.05 -1.54 -2.99 116.97 114.68 3kdv h TYR 31 Ca -0.07 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.72 3kdv h TYR 31 Cb 0.86 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.56 3kdv h TYR 31 CO -0.20 0.17 0.52 0.78 -1.05 0.00 0.00 178.16 178.38 3kdv h GLY 32 N 2.66 1.10 2.00 3.88 0.00 -1.04 -2.41 103.07 109.26 3kdv h GLY 32 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 46.92 3kdv h GLY 32 CO 0.02 0.39 0.00 0.07 0.00 0.00 0.00 176.54 177.02 3kdv h ARG 33 N 1.05 0.00 -0.02 4.80 -0.00 -1.21 -1.80 114.38 117.20 3kdv h ARG 33 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.27 3kdv h ARG 33 Cb -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.87 3kdv h ARG 33 CO -0.07 0.00 -0.01 1.28 -0.00 0.00 0.00 179.97 181.17 3kdv n LEU 34 N -2.32 2.31 0.00 0.08 4.77 -0.94 -4.96 117.00 115.95 3kdv n LEU 34 Ca -0.00 -0.77 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 3kdv n LEU 34 Cb 0.11 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3kdv n LEU 34 CO 0.14 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3kdv n GLY 35 N 1.28 0.68 3.81 -0.72 0.00 -0.67 -4.69 105.19 104.87 3kdv n GLY 35 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 3kdv n GLY 35 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3kdv s TRP 36 N -2.51 3.21 0.19 1.61 0.52 -1.03 -4.56 118.94 116.37 3kdv s TRP 36 Ca 0.00 1.61 0.05 0.00 0.02 0.00 0.00 56.10 57.78 3kdv s TRP 36 Cb 0.00 -2.96 -0.05 0.00 -1.15 0.00 0.00 33.47 29.31 3kdv s TRP 36 CO 0.00 -0.41 -0.07 0.95 0.02 0.00 0.00 176.95 177.44 3kdv s THR 37 N -2.02 1.21 -0.06 2.01 -4.23 -0.67 -4.01 115.64 107.87 3kdv s THR 37 Ca 0.63 -2.07 -0.01 0.00 -1.18 0.00 0.00 61.69 59.06 3kdv s THR 37 Cb -0.14 -2.06 0.03 0.00 1.34 0.00 0.00 72.50 71.67 3kdv s THR 37 CO 0.18 -0.57 0.00 -0.55 -0.54 0.00 0.00 174.62 173.14 3kdv s SER 38 N -3.24 1.28 0.03 3.99 0.15 -1.26 -0.75 113.70 113.89 3kdv s SER 38 Ca 0.22 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.81 3kdv s SER 38 Cb 0.03 -0.37 0.00 0.00 -1.71 0.00 0.00 66.02 63.98 3kdv s SER 38 CO 0.04 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.92 3kdv n GLY 39 N 4.90 -2.14 3.92 9.45 0.00 -1.26 -4.94 105.19 115.12 3kdv n GLY 39 Ca -0.11 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.22 3kdv n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kdv s GLU 40 N -0.44 3.30 0.03 1.61 0.41 -1.26 -5.04 118.70 117.32 3kdv s GLU 40 Ca 0.00 -0.77 -0.30 0.00 -0.41 0.00 0.00 54.97 53.48 3kdv s GLU 40 Cb 0.00 -2.83 -0.05 0.00 -1.78 0.00 0.00 34.13 29.46 3kdv s GLU 40 CO 0.00 0.46 1.24 0.08 -0.49 0.00 0.00 175.26 176.55 3kdv s VAL 41 N -1.92 3.99 0.37 2.63 1.01 -1.26 -5.03 120.40 120.20 3kdv s VAL 41 Ca 0.34 1.40 -0.27 0.00 0.00 0.00 0.00 61.98 63.45 3kdv s VAL 41 Cb -0.09 -3.90 -0.09 0.00 0.00 0.00 0.00 36.38 32.30 3kdv s VAL 41 CO 0.28 0.06 1.21 -2.84 0.00 0.00 0.00 175.10 173.81 3kdv s PRO 42 N 1.55 4.16 -0.05 2.72 0.02 -1.26 -4.88 135.00 137.26 3kdv s PRO 42 Ca 0.59 1.97 -0.37 0.00 0.02 0.00 0.00 61.00 63.21 3kdv s PRO 42 Cb -0.29 -2.83 -0.15 0.00 0.02 0.00 0.00 34.50 31.25 3kdv s PRO 42 CO 0.27 -0.26 1.58 1.33 -0.33 0.00 0.00 177.00 179.58 3kdv n VAL 43 N 0.35 0.18 -2.16 3.83 0.24 -1.26 0.55 118.33 120.06 3kdv n VAL 43 Ca 0.03 -0.03 -0.07 0.00 -2.04 0.00 0.00 64.34 62.23 3kdv n VAL 43 Cb 0.45 -1.18 -0.00 0.00 -1.47 0.00 0.00 33.84 31.64 3kdv n VAL 43 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kdv n GLY 44 N 3.44 0.10 0.70 7.63 0.00 -1.26 -4.94 105.19 110.85 3kdv n GLY 44 Ca 0.21 -0.59 0.09 0.00 0.00 0.00 0.00 46.02 45.73 3kdv n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kdv n GLY 45 N -1.01 -2.90 3.71 -0.02 0.00 0.19 -4.68 105.19 100.49 3kdv n GLY 45 Ca -0.08 -1.26 -0.35 0.00 0.00 0.00 0.00 46.02 44.33 3kdv n GLY 45 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kdv s TYR 46 N -3.49 1.92 -0.27 1.61 1.51 -0.15 -4.67 117.35 113.82 3kdv s TYR 46 Ca 0.00 1.59 -0.00 0.00 -1.01 0.00 0.00 57.07 57.65 3kdv s TYR 46 Cb 0.00 -3.58 0.05 0.00 -0.11 0.00 0.00 41.96 38.32 3kdv s TYR 46 CO 0.00 -2.88 -0.06 -0.65 -1.11 0.00 0.00 175.55 170.85 3kdv s GLN 47 N -3.80 2.50 0.29 -0.62 -0.21 -1.26 -3.08 119.66 113.47 3kdv s GLN 47 Ca 0.77 -1.20 0.11 0.00 0.02 0.00 0.00 55.36 55.07 3kdv s GLN 47 Cb -0.33 -3.01 -0.05 0.00 1.00 0.00 0.00 33.01 30.62 3kdv s GLN 47 CO 0.46 -0.53 -0.17 -0.06 -2.12 0.00 0.00 175.29 172.87 3kdv s PHE 48 N 1.22 2.34 0.41 0.91 0.08 -1.17 -5.08 117.98 116.70 3kdv s PHE 48 Ca -0.05 -0.34 -0.24 0.00 0.12 0.00 0.00 56.93 56.42 3kdv s PHE 48 Cb -0.19 -1.06 -0.08 0.00 -0.57 0.00 0.00 43.02 41.12 3kdv s PHE 48 CO -0.04 0.69 1.14 -1.25 -0.10 0.00 0.00 175.22 175.67 3kdv s PRO 49 N -3.54 4.01 0.27 0.24 0.04 -1.26 -3.41 135.00 131.35 3kdv s PRO 49 Ca 0.30 1.76 -0.03 0.00 0.04 0.00 0.00 61.00 63.08 3kdv s PRO 49 Cb -0.04 -2.59 0.35 0.00 0.04 0.00 0.00 34.50 32.25 3kdv s PRO 49 CO 0.16 -0.33 1.84 1.25 0.04 0.00 0.00 177.00 179.96 3kdv h LEU 50 N 2.49 0.90 -2.43 -3.56 5.85 -1.54 -2.98 115.31 114.03 3kdv h LEU 50 Ca -0.49 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.10 3kdv h LEU 50 Cb 1.23 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 3kdv h LEU 50 CO 0.62 0.80 -0.03 -0.33 -0.34 0.00 0.00 178.44 179.16 3kdv h GLU 51 N 0.96 0.00 -0.39 1.25 5.08 -1.87 -2.62 114.58 116.98 3kdv h GLU 51 Ca 0.22 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.50 3kdv h GLU 51 Cb 0.19 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3kdv h GLU 51 CO -0.02 0.03 -0.11 -0.91 -1.00 0.00 0.00 179.01 177.00 3kdv h ASN 52 N 0.00 0.67 -0.96 1.42 2.35 -1.91 -3.40 115.58 113.75 3kdv h ASN 52 Ca -0.00 -0.19 0.20 0.00 -0.55 0.00 0.00 56.30 55.76 3kdv h ASN 52 Cb 0.14 -0.18 -0.18 0.00 0.05 0.00 0.00 38.32 38.15 3kdv h ASN 52 CO 0.00 0.81 -0.22 1.21 -1.65 0.00 0.00 177.43 177.58 3kdv n GLU 53 N -4.18 -0.09 0.30 0.81 0.00 -0.99 -0.71 120.64 115.79 3kdv n GLU 53 Ca 0.01 1.50 0.20 0.00 0.00 0.00 0.00 57.16 58.87 3kdv n GLU 53 Cb 0.35 -2.25 0.99 0.00 0.00 0.00 0.00 31.44 30.53 3kdv n GLU 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 3kdv h PRO 54 N 0.00 0.00 -1.59 5.31 0.11 -1.85 -3.25 132.00 130.74 3kdv h PRO 54 Ca 0.47 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 66.13 3kdv h PRO 54 Cb 0.74 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.50 3kdv h PRO 54 CO -0.99 0.00 -1.02 -0.40 -0.21 0.00 0.00 178.00 175.38 3kdv n ASP 55 N -3.02 -0.05 -4.57 -2.05 5.75 0.11 -5.10 116.55 107.63 3kdv n ASP 55 Ca -0.02 -3.04 -0.37 0.00 -0.01 0.00 0.00 54.79 51.36 3kdv n ASP 55 Cb 0.15 -0.11 -0.11 0.00 -1.03 0.00 0.00 41.12 40.02 3kdv n ASP 55 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 3kdv s PHE 56 N -1.50 3.20 -0.51 2.11 5.36 -1.19 -2.36 117.98 123.10 3kdv s PHE 56 Ca 0.36 -0.00 -0.27 0.00 -0.96 0.00 0.00 56.93 56.05 3kdv s PHE 56 Cb 0.28 -2.31 -0.03 0.00 -0.34 0.00 0.00 43.02 40.62 3kdv s PHE 56 CO -0.10 -0.16 1.95 0.34 -1.46 0.00 0.00 175.22 175.79 3kdv s ASP 57 N 1.56 5.29 0.27 6.13 -1.08 -1.04 -4.72 116.67 123.09 3kdv s ASP 57 Ca 0.07 0.76 0.24 0.00 -0.52 0.00 0.00 52.55 53.10 3kdv s ASP 57 Cb -0.15 -2.52 1.01 0.00 -1.46 0.00 0.00 42.92 39.79 3kdv s ASP 57 CO 0.08 -2.28 1.72 0.79 0.52 0.00 0.00 175.17 176.00 3kdv n TRP 58 N 12.62 0.84 0.33 -5.34 7.02 -1.26 -1.96 117.44 129.69 3kdv n TRP 58 Ca 0.24 0.34 0.15 0.00 -1.02 0.00 0.00 57.50 57.21 3kdv n TRP 58 Cb 0.51 -1.04 0.54 0.00 -2.42 0.00 0.00 31.31 28.89 3kdv n TRP 58 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 3kdv h SER 59 N 0.00 0.00 -0.23 -0.99 4.64 -1.87 -0.86 113.55 114.24 3kdv h SER 59 Ca 0.00 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.39 3kdv h SER 59 Cb 0.35 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 3kdv h SER 59 CO 0.00 0.00 0.20 -0.07 -0.87 0.00 0.00 176.83 176.09 3kdv h LEU 60 N 0.00 0.00 -3.02 5.97 3.38 -1.68 -2.71 115.31 117.25 3kdv h LEU 60 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3kdv h LEU 60 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3kdv h LEU 60 CO 0.00 0.00 0.00 2.30 0.09 0.00 0.00 178.44 180.83 3kdv n ILE 61 N -4.08 1.88 -1.10 1.22 -5.35 -0.82 -4.92 119.36 106.19 3kdv n ILE 61 Ca 0.03 -2.19 0.00 0.00 -0.27 0.00 0.00 62.75 60.31 3kdv n ILE 61 Cb 0.34 -0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.03 3kdv n ILE 61 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3kdv n GLY 62 N -1.33 0.51 3.62 3.28 0.00 -1.02 -4.82 105.19 105.42 3kdv n GLY 62 Ca 0.16 -0.89 -0.25 0.00 0.00 0.00 0.00 46.02 45.04 3kdv n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kdv s ALA 63 N -2.00 3.10 0.01 4.61 0.00 -0.39 -4.60 121.76 122.49 3kdv s ALA 63 Ca 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.42 3kdv s ALA 63 Cb 0.00 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.31 3kdv s ALA 63 CO 0.00 0.37 -0.03 -0.98 0.00 0.00 0.00 175.76 175.12 3kdv s ARG 64 N -3.28 0.23 0.37 0.00 1.70 -0.94 -3.64 118.95 113.40 3kdv s ARG 64 Ca 0.29 -0.39 -0.27 0.00 -0.47 0.00 0.00 55.73 54.89 3kdv s ARG 64 Cb -0.08 0.00 -0.09 0.00 -0.57 0.00 0.00 34.95 34.22 3kdv s ARG 64 CO 0.18 -0.01 1.25 -1.59 -1.08 0.00 0.00 175.30 174.05 3kdv s LYS 65 N -0.89 4.15 -0.24 3.89 -2.85 -1.26 -0.82 119.74 121.72 3kdv s LYS 65 Ca -0.09 2.05 -0.14 0.00 -1.00 0.00 0.00 55.97 56.80 3kdv s LYS 65 Cb -0.06 -2.85 0.08 0.00 -2.06 0.00 0.00 37.83 32.93 3kdv s LYS 65 CO -0.00 -0.30 0.60 -0.46 0.10 0.00 0.00 175.35 175.28 3kdv s TRP 66 N -1.27 -0.93 -0.26 1.78 -0.00 -1.26 -4.89 118.94 112.12 3kdv s TRP 66 Ca 0.54 1.87 -0.14 0.00 -0.00 0.00 0.00 56.10 58.36 3kdv s TRP 66 Cb -0.36 0.52 -0.04 0.00 -0.00 0.00 0.00 33.47 33.59 3kdv s TRP 66 CO 0.46 -0.47 0.33 0.99 -0.00 0.00 0.00 176.95 178.26 3kdv s THR 67 N 1.62 5.22 0.65 5.86 2.01 -1.26 -4.57 115.64 125.16 3kdv s THR 67 Ca -0.10 0.49 -0.10 0.00 0.31 0.00 0.00 61.69 62.29 3kdv s THR 67 Cb -0.06 -3.66 0.15 0.00 0.01 0.00 0.00 72.50 68.94 3kdv s THR 67 CO -0.18 0.20 0.88 -0.46 -0.69 0.00 0.00 174.62 174.37 3kdv n ASN 68 N 5.10 0.21 -4.77 3.53 0.23 -1.17 -4.96 115.26 113.44 3kdv n ASN 68 Ca -0.10 -1.41 -0.41 0.00 -0.53 0.00 0.00 54.58 52.13 3kdv n ASN 68 Cb 0.51 -0.66 0.00 0.00 -2.08 0.00 0.00 39.78 37.55 3kdv n ASN 68 CO 0.00 0.00 0.00 -2.65 -0.93 0.00 0.00 177.26 173.68 3kdv n PRO 69 N -2.83 2.59 0.00 -0.53 -0.02 -1.26 -4.17 135.00 128.78 3kdv n PRO 69 Ca 0.11 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 3kdv n PRO 69 Cb 0.40 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.24 3kdv n PRO 69 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3kdv n GLU 70 N 0.37 0.00 -3.49 -0.52 1.02 -1.26 -4.61 120.64 112.15 3kdv n GLU 70 Ca 0.02 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.89 3kdv n GLU 70 Cb 0.39 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.72 3kdv n GLU 70 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3kdv n GLY 71 N 0.00 3.47 3.16 0.62 0.00 -1.26 -5.06 105.19 106.12 3kdv n GLY 71 Ca 0.00 -2.07 -0.27 0.00 0.00 0.00 0.00 46.02 43.67 3kdv n GLY 71 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3kdv s GLU 72 N -1.27 1.97 0.38 1.61 2.12 -1.26 -5.01 118.70 117.24 3kdv s GLU 72 Ca 0.33 -0.67 -0.08 0.00 0.36 0.00 0.00 54.97 54.90 3kdv s GLU 72 Cb 0.08 -1.69 -0.06 0.00 0.26 0.00 0.00 34.13 32.71 3kdv s GLU 72 CO -0.12 0.27 0.71 -1.21 -0.54 0.00 0.00 175.26 174.36 3kdv s GLU 73 N 0.01 3.71 -0.04 4.30 2.02 -1.26 -3.03 118.70 124.41 3kdv s GLU 73 Ca -0.04 0.30 0.01 0.00 0.02 0.00 0.00 54.97 55.26 3kdv s GLU 73 Cb -0.12 -2.46 0.02 0.00 0.10 0.00 0.00 34.13 31.67 3kdv s GLU 73 CO 0.03 0.01 -0.05 0.96 0.02 0.00 0.00 175.26 176.23 3kdv s ILE 75 N -2.34 0.54 -0.13 -1.63 -4.36 -0.98 -4.63 121.20 107.67 3kdv s ILE 75 Ca 0.49 -0.14 -0.17 0.00 -0.26 0.00 0.00 60.65 60.57 3kdv s ILE 75 Cb -0.10 -0.56 -0.04 0.00 1.25 0.00 0.00 42.46 43.01 3kdv s ILE 75 CO 0.33 0.22 0.43 -0.76 0.24 0.00 0.00 174.94 175.40 3kdv s LEU 76 N 0.82 4.27 -0.20 0.37 1.43 0.00 -1.68 118.68 123.70 3kdv s LEU 76 Ca -0.11 0.74 -0.04 0.00 -1.03 0.00 0.00 54.13 53.68 3kdv s LEU 76 Cb -0.14 -2.62 0.10 0.00 0.03 0.00 0.00 46.19 43.57 3kdv s LEU 76 CO 0.00 0.03 0.35 -2.28 0.23 0.00 0.00 176.35 174.68 3kdv s HIS 77 N 0.57 -0.68 -1.33 0.29 2.46 -0.71 -2.21 115.29 113.68 3kdv s HIS 77 Ca 0.24 0.99 -0.01 0.00 0.47 0.00 0.00 55.06 56.75 3kdv s HIS 77 Cb -0.15 0.05 0.01 0.00 -0.13 0.00 0.00 32.58 32.36 3kdv s HIS 77 CO 0.09 -0.56 0.73 0.54 -2.47 0.00 0.00 174.74 173.06 3kdv n ARG 78 N 5.36 -4.97 -1.00 2.88 1.74 -1.26 -1.88 116.66 117.53 3kdv n ARG 78 Ca -0.06 0.62 0.00 0.00 -0.77 0.00 0.00 57.85 57.64 3kdv n ARG 78 Cb 0.50 -5.20 0.00 0.00 -1.02 0.00 0.00 32.46 26.73 3kdv n ARG 78 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3kdv n GLY 79 N -1.59 0.31 3.49 -0.13 0.00 -1.26 -5.00 105.19 101.00 3kdv n GLY 79 Ca -0.27 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.44 3kdv n GLY 79 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3kdv s HIS 80 N -1.63 2.63 -0.18 1.61 3.76 -0.79 -5.12 115.29 115.57 3kdv s HIS 80 Ca 0.00 -0.21 -0.12 0.00 -0.15 0.00 0.00 55.06 54.58 3kdv s HIS 80 Cb 0.00 -1.49 -0.05 0.00 1.11 0.00 0.00 32.58 32.15 3kdv s HIS 80 CO 0.00 0.28 0.20 0.00 -0.85 0.00 0.00 174.74 174.37 3kdv s ALA 81 N -0.95 3.65 0.11 -1.40 0.00 -1.26 -1.74 121.76 120.17 3kdv s ALA 81 Ca 0.15 -0.59 0.10 0.00 0.00 0.00 0.00 51.96 51.61 3kdv s ALA 81 Cb -0.11 -2.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.71 3kdv s ALA 81 CO 0.06 0.12 -0.22 0.71 0.00 0.00 0.00 175.76 176.43 3kdv s TYR 82 N 0.42 2.44 -0.02 0.00 2.02 -0.68 -4.73 117.35 116.80 3kdv s TYR 82 Ca 0.11 -0.32 0.04 0.00 -0.37 0.00 0.00 57.07 56.54 3kdv s TYR 82 Cb -0.12 -1.32 -0.03 0.00 -0.40 0.00 0.00 41.96 40.09 3kdv s TYR 82 CO 0.00 0.34 -0.14 -0.98 -1.57 0.00 0.00 175.55 173.20 3kdv s ARG 83 N -1.98 2.41 0.01 -0.62 1.70 -1.26 -2.32 118.95 116.89 3kdv s ARG 83 Ca 0.16 -0.76 -0.30 0.00 -0.47 0.00 0.00 55.73 54.35 3kdv s ARG 83 Cb -0.10 -2.35 -0.04 0.00 -0.57 0.00 0.00 34.95 31.89 3kdv s ARG 83 CO 0.08 0.60 1.15 0.50 -1.08 0.00 0.00 175.30 176.54 3kdv s ARG 84 N -0.98 4.44 -0.15 3.89 3.52 -1.26 -4.19 118.95 124.21 3kdv s ARG 84 Ca 0.13 1.65 -0.05 0.00 -0.13 0.00 0.00 55.73 57.34 3kdv s ARG 84 Cb -0.11 -3.44 0.07 0.00 -1.56 0.00 0.00 34.95 29.92 3kdv s ARG 84 CO 0.03 -0.27 0.27 -0.98 -0.81 0.00 0.00 175.30 173.53 3kdv s ARG 85 N 1.42 0.17 0.76 5.12 1.70 -0.25 -5.00 118.95 122.88 3kdv s ARG 85 Ca 0.56 0.68 -0.12 0.00 -0.47 0.00 0.00 55.73 56.38 3kdv s ARG 85 Cb -0.26 -0.20 0.05 0.00 -0.57 0.00 0.00 34.95 33.97 3kdv s ARG 85 CO 0.26 -0.35 1.11 -1.21 -1.08 0.00 0.00 175.30 174.03 3kdv s GLU 86 N 2.42 2.37 0.09 3.89 2.02 -1.26 -1.05 118.70 127.18 3kdv s GLU 86 Ca 0.03 0.48 -0.08 0.00 0.02 0.00 0.00 54.97 55.42 3kdv s GLU 86 Cb -0.13 -1.96 -0.00 0.00 0.10 0.00 0.00 34.13 32.14 3kdv s GLU 86 CO -0.10 -1.39 0.19 -0.51 0.02 0.00 0.00 175.26 173.47 3kdv s LEU 87 N -5.58 1.43 -0.29 1.80 1.43 0.61 -4.89 118.68 113.18 3kdv s LEU 87 Ca 0.60 -0.70 0.04 0.00 -1.03 0.00 0.00 54.13 53.04 3kdv s LEU 87 Cb -0.13 1.00 0.20 0.00 0.03 0.00 0.00 46.19 47.30 3kdv s LEU 87 CO 0.52 -0.74 0.63 -1.61 0.23 0.00 0.00 176.35 175.38 3kdv s GLU 88 N -3.88 0.53 -0.23 1.70 0.41 -1.26 -3.62 118.70 112.34 3kdv s GLU 88 Ca 0.06 0.56 0.00 0.00 -0.41 0.00 0.00 54.97 55.19 3kdv s GLU 88 Cb 0.05 0.26 0.03 0.00 -1.78 0.00 0.00 34.13 32.70 3kdv s GLU 88 CO -0.10 -0.95 -0.11 0.08 -0.49 0.00 0.00 175.26 173.69 3kdv s VAL 90 N 2.84 2.45 -0.04 2.63 1.01 -1.26 -5.24 120.40 122.79 3kdv s VAL 90 Ca 0.12 -1.18 -0.29 0.00 0.00 0.00 0.00 61.98 60.63 3kdv s VAL 90 Cb -0.10 -2.25 0.10 0.00 0.00 0.00 0.00 36.38 34.13 3kdv s VAL 90 CO -0.25 0.22 0.84 -1.81 0.00 0.00 0.00 175.10 174.10 3kdv s ASP 91 N 1.25 -0.45 0.07 3.32 1.11 -1.24 -3.54 116.67 117.19 3kdv s ASP 91 Ca -0.01 0.27 0.09 0.00 0.18 0.00 0.00 52.55 53.08 3kdv s ASP 91 Cb -0.17 0.42 -0.03 0.00 1.07 0.00 0.00 42.92 44.21 3kdv s ASP 91 CO -0.07 -0.58 -0.23 -0.44 1.18 0.00 0.00 175.17 175.04 3kdv s SER 92 N -1.82 3.49 -0.11 0.27 0.01 -1.26 -0.29 113.70 113.99 3kdv s SER 92 Ca -0.01 -0.57 -0.08 0.00 1.31 0.00 0.00 55.95 56.60 3kdv s SER 92 Cb -0.01 -0.41 0.04 0.00 0.21 0.00 0.00 66.02 65.85 3kdv s SER 92 CO -0.02 0.23 0.28 -0.60 0.41 0.00 0.00 173.24 173.54 3kdv s ARG 93 N -1.60 0.30 -0.13 12.44 3.52 -0.22 -1.16 118.95 132.11 3kdv s ARG 93 Ca 0.14 0.48 -0.01 0.00 -0.13 0.00 0.00 55.73 56.20 3kdv s ARG 93 Cb -0.10 0.05 -0.02 0.00 -1.56 0.00 0.00 34.95 33.32 3kdv s ARG 93 CO 0.05 -0.09 -0.08 0.15 -0.81 0.00 0.00 175.30 174.51 3kdv s LYS 94 N 0.63 3.37 -0.12 5.12 -0.14 -0.27 -1.09 119.74 127.24 3kdv s LYS 94 Ca -0.04 -0.60 -0.33 0.00 -1.36 0.00 0.00 55.97 53.64 3kdv s LYS 94 Cb -0.05 -2.73 0.14 0.00 -1.68 0.00 0.00 37.83 33.51 3kdv s LYS 94 CO -0.04 0.31 1.39 -1.59 -0.76 0.00 0.00 175.35 174.66 3kdv s LYS 96 N 0.13 0.11 0.43 1.68 -2.85 -0.84 -1.75 119.74 116.64 3kdv s LYS 96 Ca -0.04 -0.06 -0.23 0.00 -1.00 0.00 0.00 55.97 54.64 3kdv s LYS 96 Cb -0.14 0.04 -0.09 0.00 -2.06 0.00 0.00 37.83 35.58 3kdv s LYS 96 CO 0.04 -0.05 1.07 -0.48 0.10 0.00 0.00 175.35 176.02 3kdv s LEU 97 N -2.78 4.05 0.00 2.77 2.34 -1.26 -1.49 118.68 122.31 3kdv s LEU 97 Ca 0.14 2.06 -0.03 0.00 0.06 0.00 0.00 54.13 56.36 3kdv s LEU 97 Cb 0.05 -4.28 0.06 0.00 -0.56 0.00 0.00 46.19 41.46 3kdv s LEU 97 CO -0.05 -0.63 0.36 -2.65 -1.06 0.00 0.00 176.35 172.32 3kdv n PRO 98 N -0.33 -0.09 0.00 1.48 -0.02 -1.26 -4.76 135.00 130.01 3kdv n PRO 98 Ca 0.06 -0.69 0.00 0.00 -2.02 0.00 0.00 63.50 60.85 3kdv n PRO 98 Cb 0.50 -0.33 0.00 0.00 -0.02 0.00 0.00 33.50 33.65 3kdv n PRO 98 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kdv n ALA 99 N -3.15 0.00 -2.63 3.55 0.00 -1.26 -5.11 120.51 111.91 3kdv n ALA 99 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.97 3kdv n ALA 99 Cb 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.57 3kdv n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kdv s ALA 100 N -1.00 3.62 0.00 0.00 0.00 -1.26 -4.91 121.76 118.21 3kdv s ALA 100 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 51.61 3kdv s ALA 100 Cb 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 20.03 3kdv s ALA 100 CO 0.00 -0.82 0.00 1.55 0.00 0.00 0.00 175.76 176.49 3kdv n VAL 101 N 5.18 0.00 -4.90 0.00 3.14 -1.26 -5.07 118.33 115.42 3kdv n VAL 101 Ca 0.01 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.10 3kdv n VAL 101 Cb 0.49 0.00 -0.17 0.00 -1.06 0.00 0.00 33.84 33.10 3kdv n VAL 101 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 3kdv s LYS 102 N -3.27 2.50 0.00 1.45 2.47 -1.26 -5.00 119.74 116.63 3kdv s LYS 102 Ca 0.00 -0.68 0.00 0.00 -1.56 0.00 0.00 55.97 53.73 3kdv s LYS 102 Cb 0.00 -1.95 0.00 0.00 -1.46 0.00 0.00 37.83 34.42 3kdv s LYS 102 CO 0.00 0.09 0.00 2.48 0.16 0.00 0.00 175.35 178.08 3kdv n TYR 103 N 3.72 0.00 -1.82 4.03 -0.00 -1.26 -5.17 117.16 116.65 3kdv n TYR 103 Ca -0.20 0.00 -0.30 0.00 -0.00 0.00 0.00 57.90 57.40 3kdv n TYR 103 Cb 0.52 0.00 0.07 0.00 -0.00 0.00 0.00 39.34 39.93 3kdv n TYR 103 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 3kdv s SER 104 N 2.00 5.02 -0.52 9.48 1.04 -1.26 -5.04 113.70 124.41 3kdv s SER 104 Ca 0.00 1.07 -0.17 0.00 0.48 0.00 0.00 55.95 57.33 3kdv s SER 104 Cb 0.00 -1.78 0.09 0.00 0.10 0.00 0.00 66.02 64.42 3kdv s SER 104 CO 0.00 -1.61 0.55 0.00 0.98 0.00 0.00 173.24 173.16 3kdv s ARG 105 N -5.38 3.04 0.00 4.02 1.04 -1.26 -4.51 118.95 115.91 3kdv s ARG 105 Ca 0.60 -1.27 0.00 0.00 -1.04 0.00 0.00 55.73 54.02 3kdv s ARG 105 Cb -0.12 -4.18 0.00 0.00 -2.04 0.00 0.00 34.95 28.61 3kdv s ARG 105 CO 0.52 -1.25 0.00 0.41 -0.04 0.00 0.00 175.30 174.93 3kdv n GLY 106 N 5.22 2.15 3.44 3.88 0.00 -1.26 -4.96 105.19 113.67 3kdv n GLY 106 Ca -0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.76 3kdv n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kdv s ALA 107 N -2.97 -1.54 -0.12 4.61 0.00 -1.26 -4.49 121.76 115.99 3kdv s ALA 107 Ca 0.00 0.87 0.03 0.00 0.00 0.00 0.00 51.96 52.86 3kdv s ALA 107 Cb 0.00 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.42 3kdv s ALA 107 CO 0.00 -0.49 -0.23 -1.59 0.00 0.00 0.00 175.76 173.46 3kdv s LYS 108 N -2.10 3.05 -0.07 0.00 0.00 -0.55 -4.46 119.74 115.61 3kdv s LYS 108 Ca -0.07 -0.86 0.03 0.00 0.00 0.00 0.00 55.97 55.07 3kdv s LYS 108 Cb -0.01 -2.37 -0.02 0.00 0.00 0.00 0.00 37.83 35.43 3kdv s LYS 108 CO 0.01 0.10 -0.14 0.54 0.00 0.00 0.00 175.35 175.86 3kdv s ASN 109 N 0.54 4.00 0.04 0.03 2.20 -1.26 -1.99 114.94 118.49 3kdv s ASN 109 Ca -0.14 -0.24 -0.19 0.00 -0.94 0.00 0.00 52.86 51.36 3kdv s ASN 109 Cb -0.17 -1.04 -0.16 0.00 -2.00 0.00 0.00 41.25 37.88 3kdv s ASN 109 CO 0.04 0.30 1.26 0.74 -2.94 0.00 0.00 177.10 176.51 3kdv h THR 110 N 4.63 1.37 -1.93 0.54 2.02 -1.72 -3.04 112.91 114.78 3kdv h THR 110 Ca -0.41 -1.66 0.02 0.00 0.77 0.00 0.00 66.41 65.12 3kdv h THR 110 Cb 1.17 2.09 -0.22 0.00 -1.74 0.00 0.00 68.15 69.45 3kdv h THR 110 CO 0.52 0.50 0.11 1.51 0.37 0.00 0.00 175.52 178.52 3kdv s ASP 111 N -6.50 -0.83 0.16 4.18 3.84 -1.24 -0.97 116.67 115.31 3kdv s ASP 111 Ca -0.13 1.40 0.04 0.00 -0.00 0.00 0.00 52.55 53.86 3kdv s ASP 111 Cb 0.05 1.37 -0.04 0.00 -1.38 0.00 0.00 42.92 42.92 3kdv s ASP 111 CO 0.80 -0.23 0.18 -2.16 -0.00 0.00 0.00 175.17 173.77 3kdv s PRO 112 N 1.22 3.07 -0.53 2.11 0.05 -1.18 -1.11 135.00 138.63 3kdv s PRO 112 Ca -0.07 -0.78 0.07 0.00 0.05 0.00 0.00 61.00 60.27 3kdv s PRO 112 Cb -0.05 -2.75 0.29 0.00 0.05 0.00 0.00 34.50 32.04 3kdv s PRO 112 CO -0.13 0.50 0.75 0.39 0.05 0.00 0.00 177.00 178.55 3kdv n GLU 113 N -0.41 2.08 -1.95 4.56 1.02 -0.31 -3.03 120.64 122.59 3kdv n GLU 113 Ca -0.08 -4.21 -0.41 0.00 -0.02 0.00 0.00 57.16 52.44 3kdv n GLU 113 Cb 0.54 -1.94 -0.01 0.00 -0.02 0.00 0.00 31.44 30.01 3kdv n GLU 113 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3kdv s HIS 114 N -2.43 2.87 0.31 -0.32 3.76 -1.22 -3.52 115.29 114.73 3kdv s HIS 114 Ca 0.41 1.16 -0.29 0.00 -0.15 0.00 0.00 55.06 56.20 3kdv s HIS 114 Cb 0.22 -3.87 -0.11 0.00 1.11 0.00 0.00 32.58 29.93 3kdv s HIS 114 CO -0.08 -2.62 1.43 0.54 -0.85 0.00 0.00 174.74 173.17 3kdv s VAL 115 N -0.71 2.44 0.00 -0.90 0.11 -1.23 -2.63 120.40 117.48 3kdv s VAL 115 Ca 0.54 0.41 0.00 0.00 -2.93 0.00 0.00 61.98 60.00 3kdv s VAL 115 Cb -0.43 -3.26 0.00 0.00 -1.53 0.00 0.00 36.38 31.16 3kdv s VAL 115 CO 0.53 0.08 0.00 0.54 -3.33 0.00 0.00 175.10 172.92 3kdv n ARG 116 N 1.37 0.00 -2.36 1.54 5.12 -1.26 -4.64 116.66 116.43 3kdv n ARG 116 Ca 0.03 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.53 3kdv n ARG 116 Cb 0.40 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.67 3kdv n ARG 116 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 3kdv s GLU 117 N -1.82 4.30 -0.76 5.56 -1.05 -1.26 -4.26 118.70 119.41 3kdv s GLU 117 Ca 0.00 1.78 -0.17 0.00 -0.15 0.00 0.00 54.97 56.43 3kdv s GLU 117 Cb 0.00 -3.63 -0.19 0.00 -0.44 0.00 0.00 34.13 29.87 3kdv s GLU 117 CO 0.00 -0.56 2.00 1.17 0.95 0.00 0.00 175.26 178.82 3kdv n LYS 118 N 5.66 0.19 -1.54 -4.83 4.81 -1.26 -4.75 118.16 116.44 3kdv n LYS 118 Ca 0.13 -0.67 -0.30 0.00 -0.87 0.00 0.00 58.31 56.60 3kdv n LYS 118 Cb 0.45 -2.54 -0.07 0.00 0.02 0.00 0.00 35.03 32.90 3kdv n LYS 118 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3kdv n ALA 119 N 12.89 0.62 -0.01 3.14 0.00 -1.26 -4.75 120.51 131.14 3kdv n ALA 119 Ca 0.42 -0.98 0.00 0.00 0.00 0.00 0.00 53.44 52.88 3kdv n ALA 119 Cb 0.38 -3.08 0.00 0.00 0.00 0.00 0.00 19.45 16.75 3kdv n ALA 119 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3kdv n ASP 120 N 15.48 0.00 -0.11 0.00 8.00 -1.26 -4.07 116.55 134.58 3kdv n ASP 120 Ca 0.45 0.00 0.10 0.00 0.71 0.00 0.00 54.79 56.04 3kdv n ASP 120 Cb 0.43 -0.34 0.52 0.00 -0.02 0.00 0.00 41.12 41.72 3kdv n ASP 120 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kdv n GLY 121 N -0.35 -0.74 0.32 0.44 0.00 -1.26 -3.92 105.19 99.68 3kdv n GLY 121 Ca 0.00 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 3kdv n GLY 121 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3kdv h GLU 122 N 0.46 -0.37 0.00 1.61 4.11 -1.97 0.78 114.58 119.19 3kdv h GLU 122 Ca 0.00 0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.46 3kdv h GLU 122 Cb 0.10 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3kdv h GLU 122 CO 0.00 -0.25 0.00 1.19 0.07 0.00 0.00 179.01 180.02 3kdv n PHE 123 N -5.40 0.00 -1.84 2.06 3.72 -1.25 -4.83 117.46 109.92 3kdv n PHE 123 Ca -0.03 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.06 3kdv n PHE 123 Cb 0.32 -0.49 0.02 0.00 -0.94 0.00 0.00 39.48 38.39 3kdv n PHE 123 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3kdv s GLU 124 N -2.97 3.42 -1.60 -1.08 8.01 0.26 -2.48 118.70 122.26 3kdv s GLU 124 Ca 0.05 0.73 -0.10 0.00 0.01 0.00 0.00 54.97 55.65 3kdv s GLU 124 Cb 0.06 -2.06 -0.08 0.00 -4.31 0.00 0.00 34.13 27.74 3kdv s GLU 124 CO 0.16 -0.69 2.88 0.66 0.01 0.00 0.00 175.26 178.28 3kdv n TYR 125 N -2.83 2.53 0.00 1.61 4.01 -0.99 -4.18 117.16 117.31 3kdv n TYR 125 Ca 0.06 -3.07 0.00 0.00 -0.16 0.00 0.00 57.90 54.73 3kdv n TYR 125 Cb 0.54 -2.50 0.00 0.00 -0.31 0.00 0.00 39.34 37.08 3kdv n TYR 125 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68