#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 5.44 0.31 -3.46 -1.08 -1.26 -4.66 116.67 111.97 2k47 s ASP 2 Ca 0.00 -0.14 -0.00 0.00 -0.52 0.00 0.00 52.55 51.89 2k47 s ASP 2 Cb 0.00 -1.40 0.51 0.00 -1.46 0.00 0.00 42.92 40.56 2k47 s ASP 2 CO 0.00 0.09 1.95 1.62 0.52 0.00 0.00 175.17 179.34 2k47 h VAL 3 N 2.18 1.20 0.24 1.11 3.04 -0.34 0.02 116.25 123.69 2k47 h VAL 3 Ca -0.47 -0.47 -0.32 0.00 -1.01 0.00 0.00 66.70 64.43 2k47 h VAL 3 Cb 1.19 0.28 0.04 0.00 -2.01 0.00 0.00 31.29 30.79 2k47 h VAL 3 CO 0.63 0.21 -1.41 -0.25 -1.01 0.00 0.00 177.57 175.75 2k47 h TRP 4 N 0.93 0.95 0.47 3.17 2.91 -1.91 -3.35 115.95 119.12 2k47 h TRP 4 Ca 0.24 -0.69 -0.02 0.00 1.13 0.00 0.00 58.89 59.55 2k47 h TRP 4 Cb 0.00 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 28.62 2k47 h TRP 4 CO 0.00 1.54 -0.23 0.77 -1.03 0.00 0.00 178.44 179.50 2k47 h SER 5 N 0.09 -0.54 -2.66 2.65 0.02 -1.89 -3.33 113.55 107.89 2k47 h SER 5 Ca -0.24 0.01 -0.73 0.00 -0.84 0.00 0.00 61.79 59.99 2k47 h SER 5 Cb 2.11 0.14 -0.20 0.00 0.14 0.00 0.00 62.40 64.59 2k47 h SER 5 CO 0.26 -0.37 0.81 -0.76 -1.14 0.00 0.00 176.83 175.64 2k47 s LEU 6 N -10.06 5.43 0.00 5.07 2.01 -0.03 -4.72 118.68 116.39 2k47 s LEU 6 Ca -0.16 -2.49 0.00 0.00 0.01 0.00 0.00 54.13 51.48 2k47 s LEU 6 Cb 0.04 -2.35 0.00 0.00 0.01 0.00 0.00 46.19 43.88 2k47 s LEU 6 CO 0.63 -0.85 0.88 -1.20 1.01 0.00 0.00 176.35 176.82 2k47 n SER 7 N 5.63 1.76 -2.16 2.29 7.64 -1.25 -4.70 113.62 122.82 2k47 n SER 7 Ca 0.25 -1.76 -0.28 0.00 1.01 0.00 0.00 58.87 58.09 2k47 n SER 7 Cb 0.47 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.78 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 -0.38 2.58 -3.97 1.43 4.76 -1.26 -0.22 118.16 121.09 2k47 n LYS 8 Ca 0.00 -3.29 -0.31 0.00 -2.87 0.00 0.00 58.31 51.84 2k47 n LYS 8 Cb 0.20 -2.21 -0.15 0.00 -1.84 0.00 0.00 35.03 31.02 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 -4.23 1.73 0.46 -0.18 -4.23 -1.26 -5.03 115.64 102.90 2k47 s THR 9 Ca 0.59 -1.46 -0.03 0.00 -1.18 0.00 0.00 61.69 59.61 2k47 s THR 9 Cb 0.48 -2.01 -0.03 0.00 1.34 0.00 0.00 72.50 72.29 2k47 s THR 9 CO 0.03 -0.17 0.74 -0.94 -0.54 0.00 0.00 174.62 173.73 2k47 s SER 10 N 1.28 6.13 -0.03 3.99 1.04 -1.26 -4.21 113.70 120.64 2k47 s SER 10 Ca -0.04 0.72 0.02 0.00 0.48 0.00 0.00 55.95 57.13 2k47 s SER 10 Cb -0.19 -2.04 0.01 0.00 0.10 0.00 0.00 66.02 63.90 2k47 s SER 10 CO -0.07 -0.60 -0.07 -0.32 0.98 0.00 0.00 173.24 173.16 2k47 s MET 11 N -4.66 0.90 -0.27 4.02 1.75 -1.05 -4.94 119.30 115.04 2k47 s MET 11 Ca 0.47 -0.24 -0.22 0.00 -1.25 0.00 0.00 55.69 54.44 2k47 s MET 11 Cb -0.10 -0.85 -0.01 0.00 2.84 0.00 0.00 34.83 36.71 2k47 s MET 11 CO 0.42 0.05 0.73 0.99 -0.65 0.00 0.00 175.02 176.57 2k47 s THR 12 N 0.38 4.88 0.13 10.11 2.01 -1.26 -3.47 115.64 128.42 2k47 s THR 12 Ca -0.06 1.24 -0.05 0.00 0.31 0.00 0.00 61.69 63.14 2k47 s THR 12 Cb -0.10 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.30 2k47 s THR 12 CO 0.01 -0.10 0.37 -0.36 -0.69 0.00 0.00 174.62 173.84 2k47 s PHE 13 N 2.75 3.49 -0.30 4.92 0.08 0.14 -4.94 117.98 124.11 2k47 s PHE 13 Ca 0.30 0.57 0.01 0.00 0.12 0.00 0.00 56.93 57.93 2k47 s PHE 13 Cb -0.15 -2.01 0.09 0.00 -0.57 0.00 0.00 43.02 40.38 2k47 s PHE 13 CO 0.10 0.45 0.05 -1.14 -0.10 0.00 0.00 175.22 174.58 2k47 s GLN 14 N -2.54 1.13 0.51 0.44 2.00 -1.26 -2.87 119.66 117.07 2k47 s GLN 14 Ca 0.39 -1.31 -0.20 0.00 -2.00 0.00 0.00 55.36 52.24 2k47 s GLN 14 Cb -0.12 -2.51 -0.10 0.00 0.80 0.00 0.00 33.01 31.08 2k47 s GLN 14 CO 0.24 -0.89 0.59 -2.30 -0.50 0.00 0.00 175.29 172.42 2k47 n PRO 15 N 4.62 0.63 -0.02 1.67 -0.02 -1.26 -2.78 135.00 137.83 2k47 n PRO 15 Ca -0.02 0.24 -0.07 0.00 -2.02 0.00 0.00 63.50 61.62 2k47 n PRO 15 Cb 0.43 -1.68 0.11 0.00 -0.02 0.00 0.00 33.50 32.33 2k47 n PRO 15 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2k47 h LYS 16 N 0.56 0.61 -6.26 -0.52 1.79 -1.09 -3.45 116.57 108.21 2k47 h LYS 16 Ca -0.44 -0.29 -0.47 0.00 -2.18 0.00 0.00 60.65 57.27 2k47 h LYS 16 Cb 1.39 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 32.02 2k47 h LYS 16 CO 0.49 0.88 -0.38 0.15 -1.08 0.00 0.00 179.45 179.51 2k47 s LYS 17 N -4.34 2.84 0.12 3.15 1.02 -1.26 -5.04 119.74 116.22 2k47 s LYS 17 Ca -0.08 -1.23 0.03 0.00 0.02 0.00 0.00 55.97 54.71 2k47 s LYS 17 Cb 0.13 -2.61 -0.18 0.00 -0.52 0.00 0.00 37.83 34.65 2k47 s LYS 17 CO 0.83 0.00 1.27 0.00 -0.92 0.00 0.00 175.35 176.52 2k47 h ALA 18 N 1.03 0.33 -0.84 5.17 0.00 -2.00 -3.30 119.26 119.65 2k47 h ALA 18 Ca -0.44 -0.86 0.06 0.00 0.00 0.00 0.00 54.91 53.67 2k47 h ALA 18 Cb 1.26 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 2k47 h ALA 18 CO 0.55 1.10 0.51 1.03 0.00 0.00 0.00 179.25 182.44 2k47 h SER 19 N 0.04 0.80 -4.15 0.00 0.87 -1.98 -3.43 113.55 105.70 2k47 h SER 19 Ca -0.05 0.02 -0.50 0.00 -1.23 0.00 0.00 61.79 60.03 2k47 h SER 19 Cb 1.76 -0.15 0.16 0.00 -0.44 0.00 0.00 62.40 63.73 2k47 h SER 19 CO 0.15 0.51 0.25 -0.76 -0.53 0.00 0.00 176.83 176.45 2k47 s LEU 20 N -10.21 2.59 -0.05 2.23 1.43 -1.24 -5.06 118.68 108.37 2k47 s LEU 20 Ca -0.13 1.78 0.07 0.00 -1.03 0.00 0.00 54.13 54.82 2k47 s LEU 20 Cb 0.18 -4.26 -0.01 0.00 0.03 0.00 0.00 46.19 42.13 2k47 s LEU 20 CO 0.79 -2.62 -0.25 0.00 0.23 0.00 0.00 176.35 174.50 2k47 s GLN 21 N -4.83 2.42 0.63 1.70 -2.07 -1.26 -4.88 119.66 111.38 2k47 s GLN 21 Ca 0.64 -0.91 -0.17 0.00 -1.82 0.00 0.00 55.36 53.09 2k47 s GLN 21 Cb -0.19 -2.13 -0.05 0.00 -1.09 0.00 0.00 33.01 29.55 2k47 s GLN 21 CO 0.57 0.44 0.72 -2.30 -1.32 0.00 0.00 175.29 173.40 2k47 n PRO 22 N 2.79 0.58 -4.29 9.60 -0.02 -1.26 -4.75 135.00 137.66 2k47 n PRO 22 Ca -0.17 0.24 -0.28 0.00 -2.02 0.00 0.00 63.50 61.26 2k47 n PRO 22 Cb 0.52 -1.94 -0.17 0.00 -0.02 0.00 0.00 33.50 31.89 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 -0.84 1.63 -0.51 2.45 0.20 -1.14 -4.92 118.68 115.55 2k47 s LEU 23 Ca 0.71 -0.41 0.03 0.00 0.69 0.00 0.00 54.13 55.15 2k47 s LEU 23 Cb -0.40 -1.06 0.14 0.00 -0.43 0.00 0.00 46.19 44.45 2k47 s LEU 23 CO 0.52 -0.02 0.30 -0.89 -0.29 0.00 0.00 176.35 175.97 2k47 s THR 24 N 1.18 1.99 0.17 3.68 2.01 -1.25 0.23 115.64 123.64 2k47 s THR 24 Ca -0.03 -3.14 0.09 0.00 0.31 0.00 0.00 61.69 58.93 2k47 s THR 24 Cb -0.14 -2.36 -0.04 0.00 0.01 0.00 0.00 72.50 69.96 2k47 s THR 24 CO -0.04 -0.91 -0.20 -0.51 -0.69 0.00 0.00 174.62 172.26 2k47 s ILE 25 N -0.22 1.97 0.44 1.82 1.10 -1.23 -4.81 121.20 120.28 2k47 s ILE 25 Ca 0.20 -1.93 0.06 0.00 -0.51 0.00 0.00 60.65 58.47 2k47 s ILE 25 Cb -0.19 -1.91 -0.04 0.00 0.15 0.00 0.00 42.46 40.47 2k47 s ILE 25 CO -0.05 -0.24 0.13 -0.55 -2.11 0.00 0.00 174.94 172.12 2k47 s SER 26 N -2.62 4.25 0.02 4.50 0.15 -1.26 -2.52 113.70 116.23 2k47 s SER 26 Ca 0.17 -1.28 -0.17 0.00 0.70 0.00 0.00 55.95 55.37 2k47 s SER 26 Cb -0.07 -0.18 -0.09 0.00 -1.71 0.00 0.00 66.02 63.97 2k47 s SER 26 CO 0.07 -0.64 1.21 -0.07 1.20 0.00 0.00 173.24 175.01 2k47 h LEU 27 N 1.43 -0.51 -1.59 3.45 3.38 -1.71 -2.15 115.31 117.61 2k47 h LEU 27 Ca -0.43 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 2k47 h LEU 27 Cb 1.27 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 2k47 h LEU 27 CO 0.72 -0.35 0.04 -0.78 0.09 0.00 0.00 178.44 178.16 2k47 h ASP 28 N -0.62 0.27 0.01 -0.43 1.82 -0.95 -1.28 116.42 115.25 2k47 h ASP 28 Ca -0.06 -0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.55 2k47 h ASP 28 Cb 0.46 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 40.40 2k47 h ASP 28 CO 0.10 0.29 0.00 1.21 -1.61 0.00 0.00 179.24 179.23 2k47 n GLU 29 N -4.40 0.91 -0.07 0.28 2.13 -1.20 -3.55 120.64 114.73 2k47 n GLU 29 Ca 0.00 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.83 2k47 n GLU 29 Cb 0.16 -1.50 0.01 0.00 0.27 0.00 0.00 31.44 30.38 2k47 n GLU 29 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2k47 n LEU 30 N -1.01 0.78 -4.01 4.31 7.94 -0.51 -4.76 117.00 119.74 2k47 n LEU 30 Ca 0.22 -0.97 -0.18 0.00 -1.11 0.00 0.00 56.01 53.96 2k47 n LEU 30 Cb 0.10 -0.04 -0.15 0.00 0.53 0.00 0.00 43.42 43.87 2k47 n LEU 30 CO 0.17 0.24 -0.43 -0.36 -1.11 0.00 0.00 177.39 175.89 2k47 s PHE 31 N -0.53 0.78 -0.17 1.96 0.08 -1.03 -4.96 117.98 114.12 2k47 s PHE 31 Ca 0.03 -0.15 0.19 0.00 0.12 0.00 0.00 56.93 57.12 2k47 s PHE 31 Cb 0.02 -0.50 0.46 0.00 -0.57 0.00 0.00 43.02 42.43 2k47 s PHE 31 CO 0.00 -0.02 1.16 -1.13 -0.10 0.00 0.00 175.22 175.14 2k47 n SER 32 N 2.89 2.02 -3.64 1.36 3.41 -1.26 -4.90 113.62 113.49 2k47 n SER 32 Ca -0.14 -2.67 -0.06 0.00 -0.26 0.00 0.00 58.87 55.75 2k47 n SER 32 Cb 0.57 -0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 64.04 2k47 n SER 32 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2k47 s SER 33 N -3.09 -0.31 0.22 4.04 1.04 -1.26 -5.04 113.70 109.30 2k47 s SER 33 Ca 0.36 0.58 -0.07 0.00 0.48 0.00 0.00 55.95 57.30 2k47 s SER 33 Cb 0.37 0.68 0.18 0.00 0.10 0.00 0.00 66.02 67.35 2k47 s SER 33 CO -0.07 -0.10 1.76 0.08 0.98 0.00 0.00 173.24 175.88 2k47 h ARG 34 N 4.15 1.12 -0.41 4.02 -0.00 -2.01 -2.78 114.38 118.47 2k47 h ARG 34 Ca -0.28 -0.24 -0.13 0.00 -0.00 0.00 0.00 59.98 59.33 2k47 h ARG 34 Cb 1.18 -0.16 -0.01 0.00 -0.00 0.00 0.00 29.97 30.98 2k47 h ARG 34 CO 0.15 0.96 -0.28 0.78 -0.00 0.00 0.00 179.97 181.58 2k47 h GLY 35 N 1.10 0.94 0.80 0.08 0.00 -2.00 -2.97 103.07 101.02 2k47 h GLY 35 Ca 0.23 -0.87 0.04 0.00 0.00 0.00 0.00 47.33 46.74 2k47 h GLY 35 CO -0.01 0.79 0.45 -2.09 0.00 0.00 0.00 176.54 175.68 2k47 h GLU 36 N 0.74 0.83 -0.53 4.80 4.57 -1.93 -1.82 114.58 121.24 2k47 h GLU 36 Ca 0.09 -0.05 0.08 0.00 -1.18 0.00 0.00 59.36 58.29 2k47 h GLU 36 Cb 0.83 -0.19 -0.06 0.00 -0.16 0.00 0.00 28.75 29.17 2k47 h GLU 36 CO 0.07 0.55 0.18 0.35 -1.18 0.00 0.00 179.01 178.98 2k47 h PHE 37 N 0.85 0.32 -0.12 0.92 3.04 -1.35 -0.28 116.94 120.33 2k47 h PHE 37 Ca 0.31 0.03 0.04 0.00 3.98 0.00 0.00 57.97 62.32 2k47 h PHE 37 Cb 0.09 -0.06 -0.04 0.00 2.56 0.00 0.00 35.95 38.49 2k47 h PHE 37 CO -0.05 0.09 -0.13 0.82 -2.02 0.00 0.00 178.31 177.02 2k47 h ILE 38 N 0.36 0.64 0.34 1.41 1.08 -1.20 -1.79 117.51 118.35 2k47 h ILE 38 Ca 0.26 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.71 2k47 h ILE 38 Cb 0.30 0.64 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 2k47 h ILE 38 CO -0.27 0.00 -0.17 -1.28 -0.69 0.00 0.00 178.15 175.74 2k47 h SER 39 N -0.16 -0.39 -0.84 1.72 0.87 -0.80 -3.14 113.55 110.80 2k47 h SER 39 Ca 0.09 0.01 0.31 0.00 -1.23 0.00 0.00 61.79 60.97 2k47 h SER 39 Cb 0.29 0.10 -0.11 0.00 -0.44 0.00 0.00 62.40 62.24 2k47 h SER 39 CO -0.21 -0.28 0.50 1.33 -0.53 0.00 0.00 176.83 177.64 2k47 n VAL 40 N -3.24 -0.23 0.00 2.23 0.24 -0.17 -4.61 118.33 112.55 2k47 n VAL 40 Ca -0.06 1.32 0.00 0.00 -2.04 0.00 0.00 64.34 63.56 2k47 n VAL 40 Cb 0.18 -2.15 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 -1.28 0.46 2.83 7.63 0.00 -1.15 -4.53 105.19 109.15 2k47 n GLY 41 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.87 2.34 0.00 -0.02 0.00 -0.68 -4.89 107.32 103.20 2k47 s GLY 42 Ca 0.00 -3.25 0.00 0.00 0.00 0.00 0.00 44.72 41.47 2k47 s GLY 42 CO 0.00 1.25 0.00 1.22 0.00 0.00 0.00 173.10 175.57 2k47 n ASP 43 N 2.79 0.00 0.00 1.64 9.92 -1.26 -4.26 116.55 125.38 2k47 n ASP 43 Ca 0.13 0.30 0.00 0.00 -0.53 0.00 0.00 54.79 54.69 2k47 n ASP 43 Cb 0.35 -0.30 0.00 0.00 -0.64 0.00 0.00 41.12 40.53 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 2.19 -1.41 3.50 0.44 0.00 -1.26 -4.91 105.19 103.75 2k47 n GLY 44 Ca 0.00 0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.64 3.22 0.27 1.61 3.00 -1.26 0.40 118.95 125.55 2k47 s ARG 45 Ca 0.00 -0.48 0.05 0.00 0.00 0.00 0.00 55.73 55.30 2k47 s ARG 45 Cb 0.00 -4.15 -0.03 0.00 0.00 0.00 0.00 34.95 30.78 2k47 s ARG 45 CO 0.00 -1.74 0.40 1.41 0.00 0.00 0.00 175.30 175.37 2k47 s MET 46 N 4.32 3.40 0.00 3.54 1.75 -1.26 -4.95 119.30 126.10 2k47 s MET 46 Ca 0.28 -0.74 0.00 0.00 -1.25 0.00 0.00 55.69 53.98 2k47 s MET 46 Cb -0.13 -2.85 0.00 0.00 2.84 0.00 0.00 34.83 34.68 2k47 s MET 46 CO 0.15 0.34 0.00 0.43 -0.65 0.00 0.00 175.02 175.29 2k47 n SER 47 N -1.49 0.00 0.00 1.11 7.64 -1.26 -4.88 113.62 114.74 2k47 n SER 47 Ca -0.07 0.29 0.00 0.00 1.01 0.00 0.00 58.87 60.10 2k47 n SER 47 Cb 0.57 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2k47 n SER 47 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2k47 n HIS 48 N -2.04 -0.09 0.25 1.43 -0.00 -1.26 -4.94 115.22 108.58 2k47 n HIS 48 Ca 0.00 0.00 0.07 0.00 0.46 0.00 0.00 57.72 58.25 2k47 n HIS 48 Cb 0.00 0.02 0.59 0.00 -0.12 0.00 0.00 29.99 30.48 2k47 n HIS 48 CO 0.00 0.00 0.00 -0.22 0.46 0.00 0.00 176.34 176.58 2k47 h LYS 49 N 0.00 0.00 0.10 1.57 1.63 -1.98 -2.83 116.57 115.06 2k47 h LYS 49 Ca 0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2k47 h LYS 49 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2k47 h LYS 49 CO 0.00 0.07 -0.05 0.93 -3.45 0.00 0.00 179.45 176.95 2k47 h GLU 50 N 0.00 -0.13 -0.26 1.90 5.08 -1.98 -2.70 114.58 116.49 2k47 h GLU 50 Ca -0.00 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2k47 h GLU 50 Cb 0.12 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.32 2k47 h GLU 50 CO 0.01 0.05 -0.38 0.00 -1.00 0.00 0.00 179.01 177.69 2k47 h ALA 51 N 0.59 -0.41 -0.41 3.43 0.00 -1.84 -1.78 119.26 118.83 2k47 h ALA 51 Ca -0.01 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2k47 h ALA 51 Cb 0.24 0.76 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2k47 h ALA 51 CO 0.02 -0.84 0.25 0.82 0.00 0.00 0.00 179.25 179.51 2k47 h ILE 52 N -0.38 1.06 -0.88 0.00 1.08 -1.60 -2.47 117.51 114.32 2k47 h ILE 52 Ca 0.12 -0.18 0.26 0.00 -0.39 0.00 0.00 64.86 64.67 2k47 h ILE 52 Cb 0.58 0.51 -0.04 0.00 -3.07 0.00 0.00 36.82 34.80 2k47 h ILE 52 CO -0.46 0.09 0.65 0.25 -0.69 0.00 0.00 178.15 177.99 2k47 h LEU 53 N 0.51 0.00 -1.35 1.44 5.85 -0.98 -1.13 115.31 119.65 2k47 h LEU 53 Ca 0.16 0.00 0.34 0.00 0.84 0.00 0.00 57.88 59.22 2k47 h LEU 53 Cb -0.02 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 40.90 2k47 h LEU 53 CO -0.06 0.00 0.73 -0.07 -0.34 0.00 0.00 178.44 178.70 2k47 h LEU 54 N 0.00 0.37 -0.90 2.25 4.07 -1.07 -1.25 115.31 118.79 2k47 h LEU 54 Ca 0.42 0.11 0.21 0.00 0.08 0.00 0.00 57.88 58.70 2k47 h LEU 54 Cb 1.72 0.07 -0.12 0.00 1.08 0.00 0.00 40.66 43.41 2k47 h LEU 54 CO -0.00 -0.04 0.42 1.23 -1.08 0.00 0.00 178.44 178.97 2k47 h GLY 55 N 0.26 1.54 0.32 0.83 0.00 -1.40 -0.47 103.07 104.16 2k47 h GLY 55 Ca 0.70 -0.20 0.15 0.00 0.00 0.00 0.00 47.33 47.97 2k47 h GLY 55 CO -0.37 -0.22 0.59 1.41 0.00 0.00 0.00 176.54 177.94 2k47 h LEU 56 N 0.46 0.81 -1.18 3.11 3.38 -1.45 0.22 115.31 120.66 2k47 h LEU 56 Ca 0.55 0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.53 2k47 h LEU 56 Cb 1.00 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2k47 h LEU 56 CO -0.49 0.37 -0.29 0.03 0.09 0.00 0.00 178.44 178.15 2k47 h ARG 57 N 0.85 0.00 0.00 1.13 2.47 -1.25 0.36 114.38 117.95 2k47 h ARG 57 Ca 0.51 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 59.23 2k47 h ARG 57 Cb 0.64 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.96 2k47 h ARG 57 CO -0.32 0.29 -0.00 -0.92 0.56 0.00 0.00 179.97 179.58 2k47 h TYR 58 N 0.00 -0.00 0.00 3.04 3.20 -0.46 -3.29 116.97 119.46 2k47 h TYR 58 Ca -0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2k47 h TYR 58 Cb 0.74 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.01 2k47 h TYR 58 CO 0.00 0.74 0.00 0.87 -1.64 0.00 0.00 178.16 178.13 2k47 h LYS 59 N -0.76 0.00 -4.01 1.82 1.79 -0.99 -3.49 116.57 110.94 2k47 h LYS 59 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k47 h LYS 59 Cb 0.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 2k47 h LYS 59 CO 0.00 0.00 -0.08 1.63 -1.08 0.00 0.00 179.45 179.92 2k47 n LYS 60 N -2.46 -0.75 -0.92 3.15 4.76 0.11 -5.02 118.16 117.03 2k47 n LYS 60 Ca 0.05 1.04 -0.04 0.00 -2.87 0.00 0.00 58.31 56.48 2k47 n LYS 60 Cb 0.44 -3.33 -0.03 0.00 -1.84 0.00 0.00 35.03 30.27 2k47 n LYS 60 CO 0.00 0.00 0.00 1.47 -1.37 0.00 0.00 177.40 177.50 2k47 n LEU 61 N -0.98 -0.65 0.23 -0.35 -0.00 -0.38 -4.98 117.00 109.90 2k47 n LEU 61 Ca 0.02 -1.34 0.16 0.00 -0.00 0.00 0.00 56.01 54.85 2k47 n LEU 61 Cb 0.39 0.03 0.84 0.00 -0.00 0.00 0.00 43.42 44.67 2k47 n LEU 61 CO 0.22 1.15 0.97 0.22 -0.00 0.00 0.00 177.39 179.95 2k47 h TYR 62 N 0.05 0.00 0.00 1.47 3.20 -1.96 -1.49 116.97 118.24 2k47 h TYR 62 Ca -0.35 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.52 2k47 h TYR 62 Cb 1.08 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.35 2k47 h TYR 62 CO -0.12 0.00 0.00 0.09 -1.64 0.00 0.00 178.16 176.49 2k47 n ASN 63 N -2.58 0.00 -0.03 -2.11 3.02 -1.26 -3.98 115.26 108.31 2k47 n ASN 63 Ca -0.02 0.67 0.12 0.00 -0.03 0.00 0.00 54.58 55.32 2k47 n ASN 63 Cb 0.05 -0.46 0.31 0.00 -0.61 0.00 0.00 39.78 39.07 2k47 n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k47 n GLN 64 N -1.89 0.12 -0.02 3.52 3.00 -1.23 -4.12 117.38 116.77 2k47 n GLN 64 Ca 0.00 -0.06 -0.17 0.00 -0.01 0.00 0.00 57.00 56.75 2k47 n GLN 64 Cb 0.00 -1.50 -0.08 0.00 0.00 0.00 0.00 30.24 28.66 2k47 n GLN 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2k47 h ALA 65 N 3.10 0.23 0.00 -1.58 0.00 -1.46 0.21 119.26 119.77 2k47 h ALA 65 Ca 0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 2k47 h ALA 65 Cb 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2k47 h ALA 65 CO 0.00 0.57 -0.16 -0.09 0.00 0.00 0.00 179.25 179.56 2k47 h ARG 66 N 0.35 0.00 0.07 0.00 2.43 -1.72 -1.06 114.38 114.45 2k47 h ARG 66 Ca -0.06 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.75 2k47 h ARG 66 Cb 1.36 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.87 2k47 h ARG 66 CO 0.15 0.16 -2.09 1.55 -1.51 0.00 0.00 179.97 178.23 2k47 n VAL 67 N -4.15 1.66 0.04 0.20 3.14 -1.20 -4.12 118.33 113.90 2k47 n VAL 67 Ca -0.02 -0.68 -0.05 0.00 -2.96 0.00 0.00 64.34 60.63 2k47 n VAL 67 Cb 0.24 -1.46 0.15 0.00 -1.06 0.00 0.00 33.84 31.72 2k47 n VAL 67 CO 0.00 0.00 0.00 0.11 -6.46 0.00 0.00 176.83 170.48 2k47 h LYS 68 N 0.04 0.40 -6.36 1.45 1.57 -0.88 -3.45 116.57 109.34 2k47 h LYS 68 Ca -0.45 -0.21 -0.61 0.00 -1.87 0.00 0.00 60.65 57.52 2k47 h LYS 68 Cb 2.02 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 34.21 2k47 h LYS 68 CO 0.04 0.76 -0.69 0.71 -0.57 0.00 0.00 179.45 179.70 2k47 s TYR 69 N -4.16 2.68 -1.04 -1.35 1.51 -0.41 -0.50 117.35 114.08 2k47 s TYR 69 Ca -0.06 -0.21 -0.23 0.00 -1.01 0.00 0.00 57.07 55.57 2k47 s TYR 69 Cb 0.13 -1.28 0.01 0.00 -0.11 0.00 0.00 41.96 40.71 2k47 s TYR 69 CO 0.80 0.54 1.70 0.45 -1.11 0.00 0.00 175.55 177.93 2k47 s SER 70 N -3.06 5.97 0.00 2.29 0.15 -1.12 -4.63 113.70 113.31 2k47 s SER 70 Ca 0.27 -1.38 0.00 0.00 0.70 0.00 0.00 55.95 55.54 2k47 s SER 70 Cb -0.08 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 2k47 s SER 70 CO 0.17 -2.01 0.00 0.18 1.20 0.00 0.00 173.24 172.78 2k47 n LEU 71 N 10.97 0.00 -3.83 3.45 4.32 -1.26 -4.58 117.00 126.07 2k47 n LEU 71 Ca 0.39 0.00 -0.30 0.00 -0.02 0.00 0.00 56.01 56.08 2k47 n LEU 71 Cb 0.49 -0.01 -0.15 0.00 -1.62 0.00 0.00 43.42 42.13 2k47 n LEU 71 CO 0.66 -0.15 -0.35 -0.76 -1.22 0.00 0.00 177.39 175.56 2k47 s LEU 72 N -2.92 2.66 0.00 2.23 2.01 -1.26 -5.08 118.68 116.32 2k47 s LEU 72 Ca 0.00 -1.54 0.00 0.00 0.01 0.00 0.00 54.13 52.60 2k47 s LEU 72 Cb 0.00 -1.05 0.00 0.00 0.01 0.00 0.00 46.19 45.15 2k47 s LEU 72 CO 0.00 -0.36 0.00 -1.84 1.01 0.00 0.00 176.35 175.16