#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 -0.59 0.30 -3.46 2.15 -1.26 -4.89 116.67 108.92 2k47 s ASP 2 Ca 0.00 0.27 0.02 0.00 0.43 0.00 0.00 52.55 53.27 2k47 s ASP 2 Cb 0.00 0.56 0.46 0.00 -0.30 0.00 0.00 42.92 43.64 2k47 s ASP 2 CO 0.00 -0.81 1.80 1.62 -0.17 0.00 0.00 175.17 177.61 2k47 h VAL 3 N 2.38 1.23 0.21 1.11 3.04 -0.26 0.62 116.25 124.58 2k47 h VAL 3 Ca -0.30 -0.98 -0.31 0.00 -1.01 0.00 0.00 66.70 64.10 2k47 h VAL 3 Cb 1.24 1.02 0.03 0.00 -2.01 0.00 0.00 31.29 31.57 2k47 h VAL 3 CO 0.38 0.33 -1.33 -0.25 -1.01 0.00 0.00 177.57 175.69 2k47 h TRP 4 N 0.57 0.93 0.14 3.17 2.91 -1.89 -3.33 115.95 118.45 2k47 h TRP 4 Ca 0.11 -0.66 -0.01 0.00 1.13 0.00 0.00 58.89 59.47 2k47 h TRP 4 Cb 0.45 -0.05 0.00 0.00 -0.51 0.00 0.00 29.16 29.06 2k47 h TRP 4 CO 0.02 1.51 -0.07 0.77 -1.03 0.00 0.00 178.44 179.64 2k47 h SER 5 N 0.09 -0.16 -3.22 2.65 0.02 -1.91 -3.34 113.55 107.68 2k47 h SER 5 Ca -0.23 -0.06 -0.76 0.00 -0.84 0.00 0.00 61.79 59.91 2k47 h SER 5 Cb 2.04 0.04 -0.23 0.00 0.14 0.00 0.00 62.40 64.39 2k47 h SER 5 CO 0.25 -0.05 0.47 -0.76 -1.14 0.00 0.00 176.83 175.60 2k47 s LEU 6 N -10.03 6.05 -0.02 5.07 1.43 0.20 -4.76 118.68 116.63 2k47 s LEU 6 Ca -0.14 -2.64 0.03 0.00 -1.03 0.00 0.00 54.13 50.35 2k47 s LEU 6 Cb 0.05 -2.28 0.04 0.00 0.03 0.00 0.00 46.19 44.03 2k47 s LEU 6 CO 0.65 -0.70 1.01 -1.20 0.23 0.00 0.00 176.35 176.33 2k47 n SER 7 N 4.73 1.98 -2.05 2.29 7.64 -1.25 -4.68 113.62 122.28 2k47 n SER 7 Ca 0.20 -2.13 -0.14 0.00 1.01 0.00 0.00 58.87 57.82 2k47 n SER 7 Cb 0.46 -0.06 0.25 0.00 -1.01 0.00 0.00 64.21 63.85 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 -0.62 2.98 -3.93 1.43 4.76 -1.26 -0.32 118.16 121.21 2k47 n LYS 8 Ca 0.02 -3.06 -0.35 0.00 -2.87 0.00 0.00 58.31 52.05 2k47 n LYS 8 Cb 0.31 -2.18 -0.14 0.00 -1.84 0.00 0.00 35.03 31.19 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 -3.14 2.95 0.44 -0.18 -4.23 -1.26 -5.01 115.64 105.21 2k47 s THR 9 Ca 0.55 -1.15 0.02 0.00 -1.18 0.00 0.00 61.69 59.94 2k47 s THR 9 Cb 0.46 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.72 2k47 s THR 9 CO 0.12 0.08 0.63 -0.94 -0.54 0.00 0.00 174.62 173.97 2k47 s SER 10 N 1.30 5.76 -0.03 3.99 1.04 -1.26 -4.02 113.70 120.48 2k47 s SER 10 Ca -0.02 0.08 0.01 0.00 0.48 0.00 0.00 55.95 56.51 2k47 s SER 10 Cb -0.18 -1.30 0.01 0.00 0.10 0.00 0.00 66.02 64.66 2k47 s SER 10 CO -0.03 -0.72 -0.05 -0.32 0.98 0.00 0.00 173.24 173.10 2k47 s MET 11 N -4.49 0.75 -0.20 4.02 1.75 -1.03 -4.93 119.30 115.18 2k47 s MET 11 Ca 0.49 -0.14 -0.22 0.00 -1.25 0.00 0.00 55.69 54.57 2k47 s MET 11 Cb -0.10 -0.75 -0.02 0.00 2.84 0.00 0.00 34.83 36.80 2k47 s MET 11 CO 0.36 -0.02 0.70 0.99 -0.65 0.00 0.00 175.02 176.41 2k47 s THR 12 N 0.62 4.96 0.04 10.11 2.01 -1.26 -3.41 115.64 128.71 2k47 s THR 12 Ca -0.08 1.34 0.01 0.00 0.31 0.00 0.00 61.69 63.27 2k47 s THR 12 Cb -0.11 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 2k47 s THR 12 CO 0.00 0.07 0.10 -0.36 -0.69 0.00 0.00 174.62 173.74 2k47 s PHE 13 N 2.09 3.29 -0.12 4.92 0.08 0.13 -4.93 117.98 123.44 2k47 s PHE 13 Ca 0.32 0.17 0.03 0.00 0.12 0.00 0.00 56.93 57.56 2k47 s PHE 13 Cb -0.16 -1.70 0.01 0.00 -0.57 0.00 0.00 43.02 40.60 2k47 s PHE 13 CO 0.11 0.55 -0.20 -1.14 -0.10 0.00 0.00 175.22 174.43 2k47 s GLN 14 N -2.09 2.74 0.45 0.44 0.74 -1.26 -2.16 119.66 118.51 2k47 s GLN 14 Ca 0.27 -0.76 -0.24 0.00 0.05 0.00 0.00 55.36 54.68 2k47 s GLN 14 Cb -0.12 -2.19 -0.07 0.00 1.10 0.00 0.00 33.01 31.72 2k47 s GLN 14 CO 0.19 0.03 1.28 -1.25 -0.55 0.00 0.00 175.29 174.99 2k47 s PRO 15 N 0.71 3.73 0.18 1.67 0.04 -1.26 -1.98 135.00 138.10 2k47 s PRO 15 Ca -0.11 2.06 -0.06 0.00 0.04 0.00 0.00 61.00 62.94 2k47 s PRO 15 Cb -0.16 -2.55 0.08 0.00 0.04 0.00 0.00 34.50 31.91 2k47 s PRO 15 CO 0.02 -0.66 1.52 0.87 0.04 0.00 0.00 177.00 178.78 2k47 h LYS 16 N 2.24 0.71 -6.09 4.56 1.79 -1.89 -3.46 116.57 114.42 2k47 h LYS 16 Ca -0.50 -0.39 -0.61 0.00 -2.18 0.00 0.00 60.65 56.97 2k47 h LYS 16 Cb 1.26 0.02 -0.13 0.00 -1.58 0.00 0.00 32.23 31.80 2k47 h LYS 16 CO 0.61 1.01 -0.72 -1.59 -1.08 0.00 0.00 179.45 177.68 2k47 s LYS 17 N -4.21 1.78 0.33 3.15 -2.85 -1.26 -5.04 119.74 111.64 2k47 s LYS 17 Ca -0.09 -1.82 0.03 0.00 -1.00 0.00 0.00 55.97 53.09 2k47 s LYS 17 Cb 0.11 -1.77 0.64 0.00 -2.06 0.00 0.00 37.83 34.75 2k47 s LYS 17 CO 0.85 0.25 1.95 0.00 0.10 0.00 0.00 175.35 178.49 2k47 h ALA 18 N 2.13 1.60 -0.93 0.59 0.00 -2.03 -2.22 119.26 118.41 2k47 h ALA 18 Ca -0.41 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.54 2k47 h ALA 18 Cb 1.26 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 2k47 h ALA 18 CO 0.64 0.29 0.59 1.03 0.00 0.00 0.00 179.25 181.80 2k47 h SER 19 N 0.89 0.94 -4.27 0.00 0.87 -1.98 -3.42 113.55 106.57 2k47 h SER 19 Ca 0.33 0.01 -0.50 0.00 -1.23 0.00 0.00 61.79 60.40 2k47 h SER 19 Cb 0.19 -0.18 0.09 0.00 -0.44 0.00 0.00 62.40 62.05 2k47 h SER 19 CO -0.11 0.60 0.37 -0.76 -0.53 0.00 0.00 176.83 176.39 2k47 s LEU 20 N -10.19 3.29 0.14 2.23 1.43 -0.84 -5.08 118.68 109.66 2k47 s LEU 20 Ca -0.13 1.74 0.11 0.00 -1.03 0.00 0.00 54.13 54.82 2k47 s LEU 20 Cb 0.19 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.86 2k47 s LEU 20 CO 0.80 -1.39 -0.27 0.00 0.23 0.00 0.00 176.35 175.73 2k47 s GLN 21 N -4.57 1.42 1.02 1.70 0.00 -1.26 -4.73 119.66 113.23 2k47 s GLN 21 Ca 0.61 -1.37 -0.12 0.00 -0.00 0.00 0.00 55.36 54.48 2k47 s GLN 21 Cb -0.15 -1.90 0.20 0.00 0.00 0.00 0.00 33.01 31.16 2k47 s GLN 21 CO 0.47 0.44 1.08 -2.14 0.00 0.00 0.00 175.29 175.14 2k47 s PRO 22 N -2.13 0.24 -0.14 9.60 0.02 -1.26 -4.41 135.00 136.91 2k47 s PRO 22 Ca 0.15 0.81 -0.05 0.00 0.02 0.00 0.00 61.00 61.93 2k47 s PRO 22 Cb -0.10 -1.69 0.07 0.00 0.02 0.00 0.00 34.50 32.80 2k47 s PRO 22 CO 0.07 -2.93 0.26 -1.17 -0.33 0.00 0.00 177.00 172.89 2k47 s LEU 23 N -6.67 -0.30 -0.49 -5.54 0.20 -0.92 -4.93 118.68 100.04 2k47 s LEU 23 Ca 0.66 0.48 0.03 0.00 0.69 0.00 0.00 54.13 55.99 2k47 s LEU 23 Cb -0.21 0.68 0.13 0.00 -0.43 0.00 0.00 46.19 46.37 2k47 s LEU 23 CO 0.60 -0.25 0.25 -0.89 -0.29 0.00 0.00 176.35 175.77 2k47 s THR 24 N 2.42 2.13 0.11 3.68 2.01 -1.25 0.17 115.64 124.89 2k47 s THR 24 Ca 0.02 -3.04 0.05 0.00 0.31 0.00 0.00 61.69 59.03 2k47 s THR 24 Cb -0.13 -2.48 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 2k47 s THR 24 CO -0.09 -0.84 -0.12 -0.51 -0.69 0.00 0.00 174.62 172.37 2k47 s ILE 25 N -0.06 1.12 0.41 1.82 1.10 -1.22 -4.83 121.20 119.53 2k47 s ILE 25 Ca 0.17 -1.65 0.07 0.00 -0.51 0.00 0.00 60.65 58.74 2k47 s ILE 25 Cb -0.25 -1.41 -0.04 0.00 0.15 0.00 0.00 42.46 40.91 2k47 s ILE 25 CO -0.00 -0.47 0.24 -0.55 -2.11 0.00 0.00 174.94 172.04 2k47 s SER 26 N -2.40 4.64 0.04 4.50 0.15 -1.26 -2.47 113.70 116.89 2k47 s SER 26 Ca 0.06 -0.95 -0.17 0.00 0.70 0.00 0.00 55.95 55.59 2k47 s SER 26 Cb -0.04 -0.53 -0.08 0.00 -1.71 0.00 0.00 66.02 63.66 2k47 s SER 26 CO 0.01 -0.56 1.26 -0.07 1.20 0.00 0.00 173.24 175.09 2k47 h LEU 27 N 1.31 -0.66 -1.63 3.45 3.38 -1.68 -1.26 115.31 118.23 2k47 h LEU 27 Ca -0.42 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 2k47 h LEU 27 Cb 1.26 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.20 2k47 h LEU 27 CO 0.66 -0.32 0.15 -0.78 0.09 0.00 0.00 178.44 178.23 2k47 h ASP 28 N -0.49 0.35 0.32 -0.43 3.58 -1.00 -1.14 116.42 117.61 2k47 h ASP 28 Ca -0.03 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.40 2k47 h ASP 28 Cb 0.42 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2k47 h ASP 28 CO -0.02 0.29 0.00 1.21 -2.88 0.00 0.00 179.24 177.84 2k47 n GLU 29 N -4.45 0.66 0.00 0.28 4.07 -1.14 -3.57 120.64 116.49 2k47 n GLU 29 Ca 0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.12 2k47 n GLU 29 Cb 0.10 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 29.98 2k47 n GLU 29 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 2k47 n LEU 30 N -1.16 1.20 -3.99 4.31 7.94 -0.48 -4.79 117.00 120.04 2k47 n LEU 30 Ca 0.18 -1.20 -0.16 0.00 -1.11 0.00 0.00 56.01 53.72 2k47 n LEU 30 Cb 0.18 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 43.99 2k47 n LEU 30 CO 0.21 0.30 -0.41 -0.36 -1.11 0.00 0.00 177.39 176.02 2k47 s PHE 31 N -0.55 0.56 -0.17 1.96 0.08 -0.92 -4.96 117.98 113.98 2k47 s PHE 31 Ca 0.00 -0.17 0.20 0.00 0.12 0.00 0.00 56.93 57.08 2k47 s PHE 31 Cb 0.00 -0.35 0.46 0.00 -0.57 0.00 0.00 43.02 42.56 2k47 s PHE 31 CO 0.00 -0.02 1.16 0.43 -0.10 0.00 0.00 175.22 176.69 2k47 n SER 32 N 2.65 1.88 -3.64 1.36 7.64 -1.26 -4.85 113.62 117.40 2k47 n SER 32 Ca -0.15 -2.53 -0.09 0.00 1.01 0.00 0.00 58.87 57.11 2k47 n SER 32 Cb 0.57 -0.40 -0.07 0.00 -1.01 0.00 0.00 64.21 63.30 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 -3.06 -0.64 0.15 6.43 0.15 -1.26 -5.03 113.70 110.44 2k47 s SER 33 Ca 0.34 1.14 -0.12 0.00 0.70 0.00 0.00 55.95 58.01 2k47 s SER 33 Cb 0.36 1.20 0.02 0.00 -1.71 0.00 0.00 66.02 65.89 2k47 s SER 33 CO -0.08 -0.19 1.61 0.08 1.20 0.00 0.00 173.24 175.86 2k47 h ARG 34 N 5.27 0.85 -0.47 5.44 0.11 -2.00 -1.97 114.38 121.63 2k47 h ARG 34 Ca -0.29 -0.26 -0.11 0.00 0.10 0.00 0.00 59.98 59.42 2k47 h ARG 34 Cb 1.18 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 32.16 2k47 h ARG 34 CO 0.12 0.88 -0.16 0.78 0.10 0.00 0.00 179.97 181.68 2k47 h GLY 35 N 0.72 0.98 0.95 0.08 0.00 -2.00 -2.76 103.07 101.03 2k47 h GLY 35 Ca 0.14 -0.81 0.02 0.00 0.00 0.00 0.00 47.33 46.69 2k47 h GLY 35 CO 0.02 0.74 0.59 -2.09 0.00 0.00 0.00 176.54 175.80 2k47 h GLU 36 N 0.80 1.14 -0.75 4.80 4.57 -1.93 -1.84 114.58 121.37 2k47 h GLU 36 Ca 0.12 -0.07 0.05 0.00 -1.18 0.00 0.00 59.36 58.28 2k47 h GLU 36 Cb 0.70 -0.26 -0.05 0.00 -0.16 0.00 0.00 28.75 28.98 2k47 h GLU 36 CO 0.05 0.75 0.45 0.35 -1.18 0.00 0.00 179.01 179.44 2k47 h PHE 37 N 1.17 0.84 0.02 0.92 3.57 -1.11 -1.07 116.94 121.28 2k47 h PHE 37 Ca 0.34 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.89 2k47 h PHE 37 Cb -0.07 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.37 2k47 h PHE 37 CO -0.01 0.44 -0.15 0.82 -2.23 0.00 0.00 178.31 177.18 2k47 h ILE 38 N 0.85 0.65 0.29 1.41 1.08 -1.07 -0.96 117.51 119.75 2k47 h ILE 38 Ca 0.32 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.77 2k47 h ILE 38 Cb 0.11 0.65 0.00 0.00 -3.07 0.00 0.00 36.82 34.51 2k47 h ILE 38 CO -0.15 0.00 -0.14 0.28 -0.69 0.00 0.00 178.15 177.45 2k47 h SER 39 N -0.25 -0.32 -0.66 1.72 0.02 -1.03 -3.15 113.55 109.87 2k47 h SER 39 Ca 0.04 0.01 0.28 0.00 -0.84 0.00 0.00 61.79 61.28 2k47 h SER 39 Cb 0.31 0.08 -0.12 0.00 0.14 0.00 0.00 62.40 62.81 2k47 h SER 39 CO -0.13 -0.23 0.35 1.33 -1.14 0.00 0.00 176.83 177.01 2k47 n VAL 40 N -3.04 -0.28 0.00 2.27 0.24 -0.44 -4.62 118.33 112.46 2k47 n VAL 40 Ca -0.05 1.35 0.00 0.00 -2.04 0.00 0.00 64.34 63.60 2k47 n VAL 40 Cb 0.15 -2.18 0.00 0.00 -1.47 0.00 0.00 33.84 30.34 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 0.33 3.00 7.63 0.00 -1.12 -4.42 105.19 109.44 2k47 n GLY 41 Ca 0.25 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 -0.57 2.16 0.00 -0.02 0.00 -0.38 -4.83 107.32 103.68 2k47 s GLY 42 Ca 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 44.72 41.87 2k47 s GLY 42 CO 0.00 0.98 0.00 1.22 0.00 0.00 0.00 173.10 175.30 2k47 n ASP 43 N 3.80 0.00 0.00 1.64 9.92 -1.26 -4.30 116.55 126.35 2k47 n ASP 43 Ca 0.04 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.30 2k47 n ASP 43 Cb 0.38 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.86 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 2.59 -1.41 3.48 0.44 0.00 -1.26 -4.84 105.19 104.19 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 -0.62 3.41 0.65 1.61 3.00 -1.26 0.46 118.95 126.20 2k47 s ARG 45 Ca 0.00 -1.24 -0.04 0.00 0.00 0.00 0.00 55.73 54.45 2k47 s ARG 45 Cb 0.00 -4.71 0.05 0.00 0.00 0.00 0.00 34.95 30.29 2k47 s ARG 45 CO 0.00 -1.89 0.93 1.41 0.00 0.00 0.00 175.30 175.75 2k47 s MET 46 N 3.74 2.30 0.00 3.54 1.75 -1.26 -4.99 119.30 124.38 2k47 s MET 46 Ca 0.32 -0.48 0.00 0.00 -1.25 0.00 0.00 55.69 54.28 2k47 s MET 46 Cb -0.08 -2.29 0.00 0.00 2.84 0.00 0.00 34.83 35.30 2k47 s MET 46 CO -0.01 -1.06 0.00 0.43 -0.65 0.00 0.00 175.02 173.73 2k47 n SER 47 N -2.71 0.00 0.00 1.11 7.64 -1.26 -4.96 113.62 113.44 2k47 n SER 47 Ca 0.08 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.97 2k47 n SER 47 Cb 0.60 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2k47 n SER 47 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k47 n HIS 48 N -1.24 -0.72 0.09 1.43 1.44 -1.26 -4.94 115.22 110.03 2k47 n HIS 48 Ca 0.00 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.77 2k47 n HIS 48 Cb 0.00 0.14 -0.01 0.00 0.12 0.00 0.00 29.99 30.24 2k47 n HIS 48 CO 0.00 0.00 0.00 -0.22 -2.81 0.00 0.00 176.34 173.31 2k47 h LYS 49 N 0.00 0.00 0.02 -1.40 3.64 -1.99 -3.38 116.57 113.46 2k47 h LYS 49 Ca 0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2k47 h LYS 49 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2k47 h LYS 49 CO 0.00 0.19 -0.01 0.93 -2.27 0.00 0.00 179.45 178.29 2k47 h GLU 50 N 0.00 -0.02 -0.08 1.90 5.08 -1.98 -2.99 114.58 116.49 2k47 h GLU 50 Ca -0.06 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 2k47 h GLU 50 Cb 1.29 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.48 2k47 h GLU 50 CO 0.03 0.31 -0.34 0.00 -1.00 0.00 0.00 179.01 178.01 2k47 h ALA 51 N 0.62 -0.45 -0.38 3.43 0.00 -1.88 -2.52 119.26 118.09 2k47 h ALA 51 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2k47 h ALA 51 Cb 0.34 0.62 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 2k47 h ALA 51 CO 0.00 -0.83 0.21 0.82 0.00 0.00 0.00 179.25 179.45 2k47 h ILE 52 N -0.44 1.02 -0.90 0.00 1.08 -1.75 -2.61 117.51 113.91 2k47 h ILE 52 Ca 0.08 -0.15 0.26 0.00 -0.39 0.00 0.00 64.86 64.66 2k47 h ILE 52 Cb 0.57 0.56 -0.04 0.00 -3.07 0.00 0.00 36.82 34.84 2k47 h ILE 52 CO -0.33 0.08 0.71 0.25 -0.69 0.00 0.00 178.15 178.17 2k47 h LEU 53 N 0.42 0.00 -1.28 1.44 5.85 -1.29 -1.38 115.31 119.07 2k47 h LEU 53 Ca 0.15 0.00 0.37 0.00 0.84 0.00 0.00 57.88 59.24 2k47 h LEU 53 Cb 0.03 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 40.93 2k47 h LEU 53 CO -0.08 0.00 0.73 -0.07 -0.34 0.00 0.00 178.44 178.67 2k47 h LEU 54 N 0.00 0.36 -0.73 2.25 4.07 -1.35 -1.97 115.31 117.93 2k47 h LEU 54 Ca 0.43 0.14 0.16 0.00 0.08 0.00 0.00 57.88 58.69 2k47 h LEU 54 Cb 1.84 0.11 -0.12 0.00 1.08 0.00 0.00 40.66 43.57 2k47 h LEU 54 CO -0.00 -0.12 0.12 1.23 -1.08 0.00 0.00 178.44 178.58 2k47 h GLY 55 N 0.21 0.96 -0.02 0.83 0.00 -1.46 -1.47 103.07 102.12 2k47 h GLY 55 Ca 0.75 0.01 0.18 0.00 0.00 0.00 0.00 47.33 48.27 2k47 h GLY 55 CO -0.45 -0.23 0.34 1.41 0.00 0.00 0.00 176.54 177.61 2k47 h LEU 56 N 0.21 0.30 -1.15 3.11 3.38 -1.60 0.17 115.31 119.72 2k47 h LEU 56 Ca 0.41 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.47 2k47 h LEU 56 Cb 0.72 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 2k47 h LEU 56 CO -0.56 0.06 0.15 0.03 0.09 0.00 0.00 178.44 178.22 2k47 h ARG 57 N 0.43 0.75 -0.12 1.13 2.47 -1.44 0.12 114.38 117.72 2k47 h ARG 57 Ca 0.48 -0.13 -0.02 0.00 -1.26 0.00 0.00 59.98 59.05 2k47 h ARG 57 Cb 0.82 -0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 29.01 2k47 h ARG 57 CO -0.47 0.66 -0.01 -0.92 0.56 0.00 0.00 179.97 179.79 2k47 h TYR 58 N 0.74 0.25 0.00 3.04 3.20 -0.62 -3.04 116.97 120.53 2k47 h TYR 58 Ca 0.17 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.99 2k47 h TYR 58 Cb 0.22 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.43 2k47 h TYR 58 CO 0.01 0.48 0.00 1.63 -1.64 0.00 0.00 178.16 178.64 2k47 n LYS 59 N -4.77 0.02 -2.62 1.82 4.76 -0.38 -4.96 118.16 112.03 2k47 n LYS 59 Ca -0.06 0.04 -0.04 0.00 -2.87 0.00 0.00 58.31 55.38 2k47 n LYS 59 Cb 0.22 -1.52 0.02 0.00 -1.84 0.00 0.00 35.03 31.90 2k47 n LYS 59 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2k47 n LYS 60 N -1.56 -1.16 -0.99 1.97 4.76 0.33 -4.99 118.16 116.53 2k47 n LYS 60 Ca 0.07 0.95 -0.04 0.00 -2.87 0.00 0.00 58.31 56.41 2k47 n LYS 60 Cb 0.33 -4.44 -0.03 0.00 -1.84 0.00 0.00 35.03 29.04 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 -1.99 -0.72 0.18 -0.35 -0.00 -0.64 -4.97 117.00 108.52 2k47 n LEU 61 Ca -0.02 -1.49 0.13 0.00 -0.00 0.00 0.00 56.01 54.63 2k47 n LEU 61 Cb 0.53 0.04 0.64 0.00 -0.00 0.00 0.00 43.42 44.63 2k47 n LEU 61 CO 0.38 1.22 0.88 0.22 -0.00 0.00 0.00 177.39 180.09 2k47 h TYR 62 N 0.07 0.00 0.28 1.47 3.20 -1.94 -0.95 116.97 119.10 2k47 h TYR 62 Ca -0.38 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.47 2k47 h TYR 62 Cb 1.13 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.40 2k47 h TYR 62 CO -0.13 0.00 -0.13 -0.91 -1.64 0.00 0.00 178.16 175.35 2k47 h ASN 63 N 0.00 -0.31 0.34 -2.11 2.35 -1.93 -3.35 115.58 110.56 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 0.11 0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.56 2k47 h ASN 63 CO 0.00 -0.08 -1.14 0.00 -1.65 0.00 0.00 177.43 174.56 2k47 n GLN 64 N -3.80 0.30 -0.10 0.81 1.13 -1.22 -4.34 117.38 110.17 2k47 n GLN 64 Ca -0.05 -0.02 -0.12 0.00 -1.94 0.00 0.00 57.00 54.87 2k47 n GLN 64 Cb 0.15 -1.58 -0.04 0.00 0.11 0.00 0.00 30.24 28.88 2k47 n GLN 64 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k47 h ALA 65 N 2.53 0.40 -0.36 -1.58 0.00 -1.36 0.31 119.26 119.19 2k47 h ALA 65 Ca 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 2k47 h ALA 65 Cb 0.74 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2k47 h ALA 65 CO 0.00 0.27 0.09 -0.09 0.00 0.00 0.00 179.25 179.52 2k47 h ARG 66 N 0.33 0.52 0.13 0.00 2.43 -1.76 -0.48 114.38 115.56 2k47 h ARG 66 Ca 0.06 -0.08 -0.34 0.00 -0.81 0.00 0.00 59.98 58.81 2k47 h ARG 66 Cb 0.64 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 2k47 h ARG 66 CO 0.04 0.48 -1.78 -0.39 -1.51 0.00 0.00 179.97 176.80 2k47 h VAL 67 N 0.51 0.87 -0.03 0.20 -1.51 -1.73 -3.33 116.25 111.23 2k47 h VAL 67 Ca 0.12 -2.54 -0.01 0.00 -1.23 0.00 0.00 66.70 63.05 2k47 h VAL 67 Cb 0.19 2.64 -0.00 0.00 -2.13 0.00 0.00 31.29 31.99 2k47 h VAL 67 CO -0.00 0.83 -0.02 0.11 -1.23 0.00 0.00 177.57 177.26 2k47 h LYS 68 N 0.08 0.06 -6.33 5.19 1.57 -0.31 -3.45 116.57 113.39 2k47 h LYS 68 Ca -0.34 -0.03 -0.51 0.00 -1.87 0.00 0.00 60.65 57.90 2k47 h LYS 68 Cb 2.05 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.35 2k47 h LYS 68 CO 0.13 0.47 -0.29 0.71 -0.57 0.00 0.00 179.45 179.90 2k47 s TYR 69 N -4.53 3.48 -1.01 -1.35 2.02 -0.20 -3.06 117.35 112.71 2k47 s TYR 69 Ca -0.15 0.31 -0.23 0.00 -0.37 0.00 0.00 57.07 56.63 2k47 s TYR 69 Cb 0.03 -1.84 -0.02 0.00 -0.40 0.00 0.00 41.96 39.72 2k47 s TYR 69 CO 0.69 0.30 1.81 0.45 -1.57 0.00 0.00 175.55 177.22 2k47 s SER 70 N -3.54 5.58 0.00 2.29 0.15 -0.84 -4.60 113.70 112.74 2k47 s SER 70 Ca 0.39 -1.17 0.00 0.00 0.70 0.00 0.00 55.95 55.87 2k47 s SER 70 Cb -0.10 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2k47 s SER 70 CO 0.31 -2.39 0.00 0.18 1.20 0.00 0.00 173.24 172.54 2k47 n LEU 71 N 12.41 0.00 -3.83 3.45 4.32 -1.25 -4.49 117.00 127.60 2k47 n LEU 71 Ca 0.40 0.00 -0.28 0.00 -0.02 0.00 0.00 56.01 56.11 2k47 n LEU 71 Cb 0.48 0.00 -0.12 0.00 -1.62 0.00 0.00 43.42 42.16 2k47 n LEU 71 CO 0.64 -0.11 -0.07 -0.76 -1.22 0.00 0.00 177.39 175.87 2k47 s LEU 72 N -2.64 4.35 0.00 2.23 1.02 -1.25 -5.11 118.68 117.28 2k47 s LEU 72 Ca 0.00 -3.75 0.11 0.00 0.02 0.00 0.00 54.13 50.52 2k47 s LEU 72 Cb 0.00 -1.47 0.09 0.00 0.02 0.00 0.00 46.19 44.83 2k47 s LEU 72 CO 0.00 -0.10 0.86 -0.62 0.02 0.00 0.00 176.35 176.52