#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k47 s ASP 2 N 0.00 5.02 0.30 -3.46 1.01 -1.26 -4.73 116.67 113.54 2k47 s ASP 2 Ca 0.00 -0.41 0.02 0.00 0.71 0.00 0.00 52.55 52.87 2k47 s ASP 2 Cb 0.00 -1.13 0.47 0.00 1.01 0.00 0.00 42.92 43.27 2k47 s ASP 2 CO 0.00 0.01 1.79 1.62 0.21 0.00 0.00 175.17 178.80 2k47 h VAL 3 N 1.86 1.23 0.19 -1.27 3.04 -0.38 -0.68 116.25 120.26 2k47 h VAL 3 Ca -0.47 -1.03 -0.31 0.00 -1.01 0.00 0.00 66.70 63.89 2k47 h VAL 3 Cb 1.23 1.10 0.02 0.00 -2.01 0.00 0.00 31.29 31.63 2k47 h VAL 3 CO 0.60 0.34 -1.45 -0.50 -1.01 0.00 0.00 177.57 175.55 2k47 h TRP 4 N 0.52 0.74 0.27 3.17 6.55 -1.92 -3.35 115.95 121.92 2k47 h TRP 4 Ca 0.10 -0.54 -0.01 0.00 0.95 0.00 0.00 58.89 59.38 2k47 h TRP 4 Cb 0.50 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 28.77 2k47 h TRP 4 CO 0.02 1.56 -0.13 0.77 -1.05 0.00 0.00 178.44 179.61 2k47 h SER 5 N -0.03 -0.30 -2.92 -3.49 0.02 -1.92 -3.30 113.55 101.61 2k47 h SER 5 Ca -0.28 -0.01 -0.77 0.00 -0.84 0.00 0.00 61.79 59.90 2k47 h SER 5 Cb 2.00 0.08 -0.23 0.00 0.14 0.00 0.00 62.40 64.38 2k47 h SER 5 CO 0.19 -0.20 0.85 -0.76 -1.14 0.00 0.00 176.83 175.77 2k47 s LEU 6 N -10.10 5.74 -0.01 5.07 2.01 -0.27 -4.73 118.68 116.41 2k47 s LEU 6 Ca -0.15 -3.25 0.11 0.00 0.01 0.00 0.00 54.13 50.85 2k47 s LEU 6 Cb 0.05 -2.30 0.31 0.00 0.01 0.00 0.00 46.19 44.25 2k47 s LEU 6 CO 0.64 -0.53 1.25 -1.20 1.01 0.00 0.00 176.35 177.53 2k47 n SER 7 N 4.18 2.94 -2.16 2.29 7.64 -1.25 -4.58 113.62 122.69 2k47 n SER 7 Ca 0.29 -2.05 -0.26 0.00 1.01 0.00 0.00 58.87 57.86 2k47 n SER 7 Cb 0.41 -0.24 0.13 0.00 -1.01 0.00 0.00 64.21 63.51 2k47 n SER 7 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2k47 n LYS 8 N 0.43 2.45 -3.88 1.43 4.76 -1.26 -0.80 118.16 121.28 2k47 n LYS 8 Ca 0.12 -3.20 -0.34 0.00 -2.87 0.00 0.00 58.31 52.02 2k47 n LYS 8 Cb 0.44 -2.19 -0.13 0.00 -1.84 0.00 0.00 35.03 31.31 2k47 n LYS 8 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2k47 s THR 9 N -3.96 2.89 0.66 -0.18 -4.23 -1.26 -5.02 115.64 104.53 2k47 s THR 9 Ca 0.59 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 59.01 2k47 s THR 9 Cb 0.48 -2.95 0.02 0.00 1.34 0.00 0.00 72.50 71.39 2k47 s THR 9 CO 0.05 -0.53 1.00 -0.44 -0.54 0.00 0.00 174.62 174.16 2k47 s SER 10 N 1.42 5.41 0.00 3.99 0.01 -1.26 -4.14 113.70 119.14 2k47 s SER 10 Ca 0.06 0.86 -0.01 0.00 1.31 0.00 0.00 55.95 58.16 2k47 s SER 10 Cb -0.21 -1.72 -0.01 0.00 0.21 0.00 0.00 66.02 64.29 2k47 s SER 10 CO -0.05 -1.26 0.02 -0.32 0.41 0.00 0.00 173.24 172.04 2k47 s MET 11 N -5.18 0.22 -0.19 12.44 1.75 -0.81 -4.91 119.30 122.61 2k47 s MET 11 Ca 0.56 -0.32 -0.16 0.00 -1.25 0.00 0.00 55.69 54.53 2k47 s MET 11 Cb -0.11 0.08 -0.04 0.00 2.84 0.00 0.00 34.83 37.61 2k47 s MET 11 CO 0.48 -0.04 0.39 0.99 -0.65 0.00 0.00 175.02 176.19 2k47 s THR 12 N -0.85 5.21 0.02 10.11 2.01 -1.26 -3.17 115.64 127.72 2k47 s THR 12 Ca -0.09 0.70 -0.12 0.00 0.31 0.00 0.00 61.69 62.48 2k47 s THR 12 Cb -0.06 -3.72 -0.06 0.00 0.01 0.00 0.00 72.50 68.68 2k47 s THR 12 CO -0.00 0.27 0.38 -0.36 -0.69 0.00 0.00 174.62 174.22 2k47 s PHE 13 N 1.19 3.66 -0.22 4.92 0.40 0.17 -4.92 117.98 123.18 2k47 s PHE 13 Ca 0.19 0.87 -0.00 0.00 -0.60 0.00 0.00 56.93 57.39 2k47 s PHE 13 Cb -0.15 -2.20 0.03 0.00 0.51 0.00 0.00 43.02 41.21 2k47 s PHE 13 CO 0.08 0.60 -0.12 -1.14 0.70 0.00 0.00 175.22 175.34 2k47 s GLN 14 N -1.43 2.82 0.46 0.44 0.74 -1.26 -2.85 119.66 118.58 2k47 s GLN 14 Ca 0.27 -0.97 -0.24 0.00 0.05 0.00 0.00 55.36 54.47 2k47 s GLN 14 Cb -0.15 -2.82 -0.07 0.00 1.10 0.00 0.00 33.01 31.06 2k47 s GLN 14 CO 0.15 -0.35 1.25 -1.25 -0.55 0.00 0.00 175.29 174.53 2k47 s PRO 15 N 1.28 3.70 0.22 1.67 0.04 -1.26 -1.07 135.00 139.58 2k47 s PRO 15 Ca 0.01 1.99 0.01 0.00 0.04 0.00 0.00 61.00 63.05 2k47 s PRO 15 Cb -0.16 -2.50 0.19 0.00 0.04 0.00 0.00 34.50 32.08 2k47 s PRO 15 CO -0.07 -0.66 1.54 0.87 0.04 0.00 0.00 177.00 178.72 2k47 h LYS 16 N 2.15 0.40 -5.26 4.56 1.79 -1.71 -3.46 116.57 115.03 2k47 h LYS 16 Ca -0.50 -0.26 -0.49 0.00 -2.18 0.00 0.00 60.65 57.23 2k47 h LYS 16 Cb 1.26 0.03 -0.14 0.00 -1.58 0.00 0.00 32.23 31.80 2k47 h LYS 16 CO 0.60 0.85 -0.61 -1.59 -1.08 0.00 0.00 179.45 177.63 2k47 s LYS 17 N -3.90 1.68 0.32 3.15 -2.85 -1.26 -5.05 119.74 111.83 2k47 s LYS 17 Ca -0.06 -1.93 0.01 0.00 -1.00 0.00 0.00 55.97 52.99 2k47 s LYS 17 Cb 0.12 -0.93 0.54 0.00 -2.06 0.00 0.00 37.83 35.50 2k47 s LYS 17 CO 0.82 -0.18 1.95 0.00 0.10 0.00 0.00 175.35 178.04 2k47 h ALA 18 N 2.08 1.43 -0.83 0.59 0.00 -2.02 -2.60 119.26 117.91 2k47 h ALA 18 Ca -0.41 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.50 2k47 h ALA 18 Cb 1.24 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.71 2k47 h ALA 18 CO 0.71 0.47 0.48 0.77 0.00 0.00 0.00 179.25 181.67 2k47 h SER 19 N 0.86 0.69 -4.06 0.00 0.02 -1.99 -3.42 113.55 105.66 2k47 h SER 19 Ca 0.22 0.05 -0.46 0.00 -0.84 0.00 0.00 61.79 60.75 2k47 h SER 19 Cb 0.02 -0.09 0.01 0.00 0.14 0.00 0.00 62.40 62.49 2k47 h SER 19 CO -0.04 0.39 0.38 -0.76 -1.14 0.00 0.00 176.83 175.66 2k47 s LEU 20 N -10.27 3.90 -0.01 5.07 1.43 -0.98 -5.07 118.68 112.75 2k47 s LEU 20 Ca -0.12 1.89 0.08 0.00 -1.03 0.00 0.00 54.13 54.94 2k47 s LEU 20 Cb 0.19 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.87 2k47 s LEU 20 CO 0.78 -0.66 -0.25 -1.10 0.23 0.00 0.00 176.35 175.35 2k47 s GLN 21 N -3.15 2.07 1.03 1.70 -0.21 -1.26 -4.75 119.66 115.10 2k47 s GLN 21 Ca 0.65 -0.95 -0.13 0.00 0.02 0.00 0.00 55.36 54.94 2k47 s GLN 21 Cb -0.15 -2.06 0.13 0.00 1.00 0.00 0.00 33.01 31.93 2k47 s GLN 21 CO 0.19 0.55 0.62 -2.30 -2.12 0.00 0.00 175.29 172.23 2k47 n PRO 22 N 2.25 -1.08 -3.99 2.91 -0.02 -1.26 -4.69 135.00 129.11 2k47 n PRO 22 Ca -0.16 -0.28 -0.11 0.00 -2.02 0.00 0.00 63.50 60.93 2k47 n PRO 22 Cb 0.51 -2.01 -0.12 0.00 -0.02 0.00 0.00 33.50 31.86 2k47 n PRO 22 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2k47 s LEU 23 N -3.72 2.18 -0.24 2.45 0.20 -1.13 -4.92 118.68 113.49 2k47 s LEU 23 Ca 0.61 -0.39 -0.04 0.00 0.69 0.00 0.00 54.13 55.00 2k47 s LEU 23 Cb -0.20 -0.01 0.09 0.00 -0.43 0.00 0.00 46.19 45.64 2k47 s LEU 23 CO 0.64 -0.20 0.13 -0.89 -0.29 0.00 0.00 176.35 175.75 2k47 s THR 24 N -1.08 -0.11 0.10 3.68 2.01 -1.26 0.46 115.64 119.44 2k47 s THR 24 Ca -0.10 -0.50 -0.15 0.00 0.31 0.00 0.00 61.69 61.24 2k47 s THR 24 Cb -0.08 -0.82 0.03 0.00 0.01 0.00 0.00 72.50 71.64 2k47 s THR 24 CO -0.00 -0.53 0.37 -0.51 -0.69 0.00 0.00 174.62 173.26 2k47 s ILE 25 N 2.14 0.08 0.51 1.82 2.07 -1.19 -4.91 121.20 121.71 2k47 s ILE 25 Ca 0.07 -0.63 0.03 0.00 -1.41 0.00 0.00 60.65 58.70 2k47 s ILE 25 Cb -0.16 -1.12 -0.01 0.00 0.13 0.00 0.00 42.46 41.30 2k47 s ILE 25 CO -0.26 -0.35 0.09 -0.55 -1.91 0.00 0.00 174.94 171.96 2k47 s SER 26 N -2.57 4.22 0.04 4.50 0.15 -1.26 -1.92 113.70 116.86 2k47 s SER 26 Ca 0.01 -1.53 -0.17 0.00 0.70 0.00 0.00 55.95 54.96 2k47 s SER 26 Cb 0.01 0.40 -0.08 0.00 -1.71 0.00 0.00 66.02 64.64 2k47 s SER 26 CO -0.09 -0.86 1.26 -0.07 1.20 0.00 0.00 173.24 174.68 2k47 h LEU 27 N 1.27 -0.66 -1.61 3.45 3.38 -1.71 0.97 115.31 120.41 2k47 h LEU 27 Ca -0.43 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2k47 h LEU 27 Cb 1.31 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.25 2k47 h LEU 27 CO 0.71 -0.31 0.25 -0.78 0.09 0.00 0.00 178.44 178.40 2k47 h ASP 28 N -0.46 0.44 1.53 -0.43 3.58 -1.24 0.39 116.42 120.23 2k47 h ASP 28 Ca -0.03 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.38 2k47 h ASP 28 Cb 0.40 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.34 2k47 h ASP 28 CO -0.04 0.33 -0.14 -0.08 -2.88 0.00 0.00 179.24 176.43 2k47 h GLU 29 N 0.52 0.00 0.00 0.28 4.57 -1.73 -3.35 114.58 114.87 2k47 h GLU 29 Ca 0.14 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 58.07 2k47 h GLU 29 Cb -0.05 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.50 2k47 h GLU 29 CO -0.03 0.14 -1.95 -0.11 -1.18 0.00 0.00 179.01 175.88 2k47 n LEU 30 N -3.17 1.37 -4.82 1.64 0.00 0.32 -4.85 117.00 107.49 2k47 n LEU 30 Ca 0.02 -0.04 -0.38 0.00 0.00 0.00 0.00 56.01 55.61 2k47 n LEU 30 Cb 0.51 -0.10 -0.06 0.00 0.00 0.00 0.00 43.42 43.77 2k47 n LEU 30 CO 0.34 0.55 0.11 -0.36 0.00 0.00 0.00 177.39 178.02 2k47 s PHE 31 N -2.34 3.71 -0.05 1.96 0.08 0.13 -4.98 117.98 116.49 2k47 s PHE 31 Ca -0.14 0.98 0.15 0.00 0.12 0.00 0.00 56.93 58.04 2k47 s PHE 31 Cb 0.05 -2.32 0.28 0.00 -0.57 0.00 0.00 43.02 40.47 2k47 s PHE 31 CO 0.48 0.59 1.13 0.43 -0.10 0.00 0.00 175.22 177.75 2k47 n SER 32 N 2.01 1.00 -3.67 1.36 7.64 -1.26 -4.68 113.62 116.02 2k47 n SER 32 Ca -0.13 -2.47 -0.11 0.00 1.01 0.00 0.00 58.87 57.17 2k47 n SER 32 Cb 0.52 -0.33 -0.09 0.00 -1.01 0.00 0.00 64.21 63.31 2k47 n SER 32 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2k47 s SER 33 N -2.03 -0.68 0.05 6.43 0.15 -1.26 -5.05 113.70 111.31 2k47 s SER 33 Ca 0.24 1.19 -0.24 0.00 0.70 0.00 0.00 55.95 57.85 2k47 s SER 33 Cb 0.26 1.13 -0.17 0.00 -1.71 0.00 0.00 66.02 65.53 2k47 s SER 33 CO -0.08 -0.21 1.57 -0.09 1.20 0.00 0.00 173.24 175.63 2k47 h ARG 34 N 6.20 -0.04 -0.76 5.44 2.43 -1.99 -1.53 114.38 124.13 2k47 h ARG 34 Ca -0.31 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.84 2k47 h ARG 34 Cb 1.19 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.71 2k47 h ARG 34 CO 0.19 0.14 0.38 0.78 -1.51 0.00 0.00 179.97 179.94 2k47 h GLY 35 N -0.21 1.14 1.01 2.80 0.00 -2.00 -2.21 103.07 103.60 2k47 h GLY 35 Ca -0.00 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 46.79 2k47 h GLY 35 CO 0.01 0.51 0.49 -2.09 0.00 0.00 0.00 176.54 175.46 2k47 h GLU 36 N 1.07 1.04 -0.69 4.80 4.57 -1.94 -2.11 114.58 121.32 2k47 h GLU 36 Ca 0.26 -0.08 0.06 0.00 -1.18 0.00 0.00 59.36 58.42 2k47 h GLU 36 Cb 0.08 -0.22 -0.05 0.00 -0.16 0.00 0.00 28.75 28.39 2k47 h GLU 36 CO -0.04 0.71 0.39 0.35 -1.18 0.00 0.00 179.01 179.24 2k47 h PHE 37 N 1.05 0.72 -0.14 0.92 3.57 -0.69 -0.57 116.94 121.80 2k47 h PHE 37 Ca 0.28 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.85 2k47 h PHE 37 Cb -0.08 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.40 2k47 h PHE 37 CO -0.01 0.35 -0.13 0.82 -2.23 0.00 0.00 178.31 177.11 2k47 h ILE 38 N 0.72 0.64 0.29 1.41 1.08 -0.92 -1.36 117.51 119.37 2k47 h ILE 38 Ca 0.31 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.76 2k47 h ILE 38 Cb 0.18 0.64 0.00 0.00 -3.07 0.00 0.00 36.82 34.57 2k47 h ILE 38 CO -0.18 0.00 -0.14 0.28 -0.69 0.00 0.00 178.15 177.43 2k47 h SER 39 N -0.15 -0.33 -0.64 1.72 0.02 -0.96 -3.17 113.55 110.04 2k47 h SER 39 Ca 0.09 0.01 0.27 0.00 -0.84 0.00 0.00 61.79 61.32 2k47 h SER 39 Cb 0.28 0.08 -0.12 0.00 0.14 0.00 0.00 62.40 62.79 2k47 h SER 39 CO -0.23 -0.23 0.35 1.33 -1.14 0.00 0.00 176.83 176.91 2k47 n VAL 40 N -3.08 -0.27 0.00 2.27 0.24 -0.27 -4.62 118.33 112.59 2k47 n VAL 40 Ca -0.05 1.31 0.00 0.00 -2.04 0.00 0.00 64.34 63.56 2k47 n VAL 40 Cb 0.15 -2.12 0.00 0.00 -1.47 0.00 0.00 33.84 30.40 2k47 n VAL 40 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k47 n GLY 41 N -1.17 0.43 2.97 7.63 0.00 -1.10 -4.69 105.19 109.26 2k47 n GLY 41 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 2k47 n GLY 41 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k47 s GLY 42 N -0.72 2.07 0.00 -0.02 0.00 -0.53 -4.91 107.32 103.21 2k47 s GLY 42 Ca 0.00 -2.77 0.00 0.00 0.00 0.00 0.00 44.72 41.95 2k47 s GLY 42 CO 0.00 1.03 0.00 1.22 0.00 0.00 0.00 173.10 175.35 2k47 n ASP 43 N 3.83 0.00 0.00 1.64 9.92 -1.26 -4.30 116.55 126.38 2k47 n ASP 43 Ca 0.04 0.06 0.00 0.00 -0.53 0.00 0.00 54.79 54.36 2k47 n ASP 43 Cb 0.38 -0.09 0.00 0.00 -0.64 0.00 0.00 41.12 40.77 2k47 n ASP 43 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2k47 n GLY 44 N 2.37 -1.33 3.44 0.44 0.00 -1.26 -4.93 105.19 103.91 2k47 n GLY 44 Ca 0.00 0.31 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 2k47 n GLY 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k47 s ARG 45 N -0.97 3.12 0.65 1.61 3.00 -1.26 0.37 118.95 125.47 2k47 s ARG 45 Ca 0.00 -0.97 -0.05 0.00 0.00 0.00 0.00 55.73 54.71 2k47 s ARG 45 Cb 0.00 -4.27 0.04 0.00 0.00 0.00 0.00 34.95 30.72 2k47 s ARG 45 CO 0.00 -1.77 0.94 1.41 0.00 0.00 0.00 175.30 175.88 2k47 s MET 46 N 3.75 2.43 0.00 3.54 1.75 -1.26 -4.96 119.30 124.55 2k47 s MET 46 Ca 0.21 -0.29 0.00 0.00 -1.25 0.00 0.00 55.69 54.35 2k47 s MET 46 Cb -0.18 -2.25 0.00 0.00 2.84 0.00 0.00 34.83 35.24 2k47 s MET 46 CO 0.08 -1.01 0.00 0.45 -0.65 0.00 0.00 175.02 173.89 2k47 n SER 47 N -2.73 0.00 0.00 1.11 2.88 -1.26 -4.94 113.62 108.67 2k47 n SER 47 Ca 0.07 0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2k47 n SER 47 Cb 0.60 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 2k47 n SER 47 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2k47 n HIS 48 N -2.03 0.00 0.15 0.66 -0.00 -1.26 -4.94 115.22 107.81 2k47 n HIS 48 Ca 0.00 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.20 2k47 n HIS 48 Cb 0.00 0.00 0.19 0.00 -0.12 0.00 0.00 29.99 30.06 2k47 n HIS 48 CO 0.00 0.00 0.00 0.87 0.46 0.00 0.00 176.34 177.67 2k47 h LYS 49 N 0.00 0.00 0.35 1.57 1.79 -1.97 -3.32 116.57 114.99 2k47 h LYS 49 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2k47 h LYS 49 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2k47 h LYS 49 CO 0.00 0.51 -0.17 0.93 -1.08 0.00 0.00 179.45 179.64 2k47 h GLU 50 N 0.00 -0.46 -0.46 3.15 5.08 -1.98 -2.44 114.58 117.47 2k47 h GLU 50 Ca -0.01 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.46 2k47 h GLU 50 Cb 1.14 0.10 -0.10 0.00 0.50 0.00 0.00 28.75 30.40 2k47 h GLU 50 CO 0.07 -0.17 -0.41 0.00 -1.00 0.00 0.00 179.01 177.50 2k47 h ALA 51 N -0.21 -0.36 -0.28 3.43 0.00 -1.91 -0.87 119.26 119.07 2k47 h ALA 51 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2k47 h ALA 51 Cb 0.50 0.88 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2k47 h ALA 51 CO 0.08 -0.83 0.18 0.82 0.00 0.00 0.00 179.25 179.50 2k47 h ILE 52 N -0.29 1.08 -0.62 0.00 1.08 -1.68 -2.70 117.51 114.39 2k47 h ILE 52 Ca 0.16 -0.16 0.18 0.00 -0.39 0.00 0.00 64.86 64.65 2k47 h ILE 52 Cb 0.57 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 34.99 2k47 h ILE 52 CO -0.60 0.08 0.45 0.25 -0.69 0.00 0.00 178.15 177.63 2k47 h LEU 53 N 0.37 0.00 -1.68 1.44 5.85 -0.68 -1.00 115.31 119.61 2k47 h LEU 53 Ca 0.10 0.00 0.25 0.00 0.84 0.00 0.00 57.88 59.07 2k47 h LEU 53 Cb -0.03 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 2k47 h LEU 53 CO -0.02 0.00 0.65 -0.07 -0.34 0.00 0.00 178.44 178.66 2k47 h LEU 54 N 0.00 0.25 -0.87 2.25 4.07 -0.95 -1.99 115.31 118.06 2k47 h LEU 54 Ca 0.29 0.03 0.21 0.00 0.08 0.00 0.00 57.88 58.50 2k47 h LEU 54 Cb 1.19 -0.01 -0.12 0.00 1.08 0.00 0.00 40.66 42.80 2k47 h LEU 54 CO -0.00 0.08 0.34 1.23 -1.08 0.00 0.00 178.44 179.01 2k47 h GLY 55 N 0.24 1.44 0.05 0.83 0.00 -1.35 -0.95 103.07 103.33 2k47 h GLY 55 Ca 0.49 -0.13 0.13 0.00 0.00 0.00 0.00 47.33 47.82 2k47 h GLY 55 CO -0.13 -0.27 0.10 1.41 0.00 0.00 0.00 176.54 177.65 2k47 h LEU 56 N 0.36 -0.08 -1.10 3.11 3.38 -1.58 0.15 115.31 119.55 2k47 h LEU 56 Ca 0.54 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.63 2k47 h LEU 56 Cb 1.02 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 2k47 h LEU 56 CO -0.54 -0.04 0.44 0.03 0.09 0.00 0.00 178.44 178.42 2k47 h ARG 57 N 0.22 1.06 -0.08 1.13 -0.00 -1.35 0.33 114.38 115.69 2k47 h ARG 57 Ca 0.34 -0.11 -0.02 0.00 -0.50 0.00 0.00 59.98 59.69 2k47 h ARG 57 Cb 0.54 -0.22 -0.00 0.00 0.00 0.00 0.00 29.97 30.29 2k47 h ARG 57 CO -0.46 0.77 -0.03 -0.92 0.00 0.00 0.00 179.97 179.32 2k47 h TYR 58 N 1.08 0.18 0.00 3.04 5.03 -0.89 -3.01 116.97 122.40 2k47 h TYR 58 Ca 0.28 -0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.54 2k47 h TYR 58 Cb -0.00 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 38.23 2k47 h TYR 58 CO 0.01 0.50 0.00 0.87 -1.32 0.00 0.00 178.16 178.21 2k47 h LYS 59 N -0.18 0.00 -3.98 1.82 1.79 -0.55 -3.48 116.57 111.99 2k47 h LYS 59 Ca 0.02 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.44 2k47 h LYS 59 Cb 0.44 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.13 2k47 h LYS 59 CO 0.01 0.00 -0.17 1.63 -1.08 0.00 0.00 179.45 179.84 2k47 n LYS 60 N -2.58 -0.72 -0.91 3.15 5.02 0.11 -5.00 118.16 117.23 2k47 n LYS 60 Ca 0.02 0.64 -0.04 0.00 -2.02 0.00 0.00 58.31 56.92 2k47 n LYS 60 Cb 0.29 -3.25 -0.03 0.00 -0.02 0.00 0.00 35.03 32.02 2k47 n LYS 60 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 2k47 n LEU 61 N -1.74 -0.60 0.22 -0.35 -0.00 -0.57 -4.98 117.00 108.98 2k47 n LEU 61 Ca -0.01 -1.25 0.15 0.00 -0.00 0.00 0.00 56.01 54.90 2k47 n LEU 61 Cb 0.52 0.04 0.78 0.00 -0.00 0.00 0.00 43.42 44.76 2k47 n LEU 61 CO 0.23 1.11 0.95 0.22 -0.00 0.00 0.00 177.39 179.89 2k47 h TYR 62 N 0.05 0.00 0.20 1.47 3.20 -1.93 -0.49 116.97 119.48 2k47 h TYR 62 Ca -0.32 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.54 2k47 h TYR 62 Cb 1.04 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.31 2k47 h TYR 62 CO -0.11 0.00 -0.10 -0.91 -1.64 0.00 0.00 178.16 175.40 2k47 h ASN 63 N 0.00 -0.23 0.15 -2.11 2.35 -1.93 -3.36 115.58 110.45 2k47 h ASN 63 Ca 0.00 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2k47 h ASN 63 Cb 0.06 0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.49 2k47 h ASN 63 CO 0.00 -0.03 -0.48 0.00 -1.65 0.00 0.00 177.43 175.27 2k47 n GLN 64 N -3.45 0.72 -0.03 0.81 10.64 -1.21 -4.29 117.38 120.56 2k47 n GLN 64 Ca -0.03 -0.52 -0.17 0.00 -1.83 0.00 0.00 57.00 54.44 2k47 n GLN 64 Cb 0.11 -1.49 -0.07 0.00 -0.86 0.00 0.00 30.24 27.93 2k47 n GLN 64 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k47 h ALA 65 N 3.55 0.32 0.00 2.61 0.00 -1.27 0.11 119.26 124.59 2k47 h ALA 65 Ca 0.00 -0.59 -0.05 0.00 0.00 0.00 0.00 54.91 54.27 2k47 h ALA 65 Cb 0.59 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2k47 h ALA 65 CO 0.00 0.68 -0.23 -0.09 0.00 0.00 0.00 179.25 179.61 2k47 h ARG 66 N 0.56 0.00 0.07 0.00 2.43 -1.75 -2.32 114.38 113.36 2k47 h ARG 66 Ca -0.04 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.78 2k47 h ARG 66 Cb 1.37 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.89 2k47 h ARG 66 CO 0.16 0.23 -2.02 1.33 -1.51 0.00 0.00 179.97 178.15 2k47 n VAL 67 N -4.14 1.67 0.33 0.20 0.24 -1.19 -4.16 118.33 111.28 2k47 n VAL 67 Ca -0.02 -0.70 0.15 0.00 -2.04 0.00 0.00 64.34 61.73 2k47 n VAL 67 Cb 0.30 -1.41 0.60 0.00 -1.47 0.00 0.00 33.84 31.85 2k47 n VAL 67 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2k47 h LYS 68 N 0.04 0.00 -4.67 7.34 1.57 -0.73 -3.45 116.57 116.68 2k47 h LYS 68 Ca -0.42 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.12 2k47 h LYS 68 Cb 2.03 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 34.18 2k47 h LYS 68 CO 0.06 0.00 -0.70 0.71 -0.57 0.00 0.00 179.45 178.94 2k47 s TYR 69 N -3.51 0.88 -1.00 -1.35 1.51 -0.88 -1.93 117.35 111.07 2k47 s TYR 69 Ca 0.03 -0.84 -0.23 0.00 -1.01 0.00 0.00 57.07 55.02 2k47 s TYR 69 Cb 0.09 -0.51 0.05 0.00 -0.11 0.00 0.00 41.96 41.48 2k47 s TYR 69 CO 0.48 -0.13 1.46 0.45 -1.11 0.00 0.00 175.55 176.70 2k47 s SER 70 N -2.80 6.43 -0.00 2.29 0.15 -0.23 -4.68 113.70 114.85 2k47 s SER 70 Ca 0.08 -1.36 -0.02 0.00 0.70 0.00 0.00 55.95 55.35 2k47 s SER 70 Cb 0.03 -2.57 -0.01 0.00 -1.71 0.00 0.00 66.02 61.76 2k47 s SER 70 CO -0.04 -1.58 -0.04 0.18 1.20 0.00 0.00 173.24 172.97 2k47 n LEU 71 N 9.11 0.41 -4.15 3.45 4.32 -1.26 -4.45 117.00 124.43 2k47 n LEU 71 Ca 0.32 0.06 -0.38 0.00 -0.02 0.00 0.00 56.01 55.98 2k47 n LEU 71 Cb 0.51 -0.29 -0.09 0.00 -1.62 0.00 0.00 43.42 41.93 2k47 n LEU 71 CO 0.66 -0.52 -0.02 -0.76 -1.22 0.00 0.00 177.39 175.54 2k47 s LEU 72 N -5.67 5.49 0.00 2.23 2.01 -1.26 -5.03 118.68 116.44 2k47 s LEU 72 Ca -0.03 -2.32 0.25 0.00 0.01 0.00 0.00 54.13 52.04 2k47 s LEU 72 Cb 0.00 -1.92 0.43 0.00 0.01 0.00 0.00 46.19 44.72 2k47 s LEU 72 CO 0.05 -0.53 1.39 -0.62 1.01 0.00 0.00 176.35 177.65