#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 4.13 0.30 6.43 1.11 -1.26 -4.87 116.67 122.51 2k47 s ASP 2 Ca 0.00 -1.55 0.05 0.00 0.18 0.00 0.00 52.55 51.24 2k47 s ASP 2 Cb 0.00 0.29 0.49 0.00 1.07 0.00 0.00 42.92 44.77 2k47 s ASP 2 CO 0.00 -0.78 1.75 1.62 1.18 0.00 0.00 175.17 178.94 2k47 h VAL 3 N 1.40 1.27 -0.01 -1.27 3.04 -0.27 -2.46 116.25 117.95 2k47 h VAL 3 Ca -0.43 -1.29 -0.22 0.00 -1.01 0.00 0.00 66.70 63.75 2k47 h VAL 3 Cb 1.30 1.47 -0.00 0.00 -2.01 0.00 0.00 31.29 32.04 2k47 h VAL 3 CO 0.74 0.40 -0.91 -0.25 -1.01 0.00 0.00 177.57 176.54 2k47 h TRP 4 N 0.30 0.54 0.04 3.17 2.91 -1.92 -3.28 115.95 117.71 2k47 h TRP 4 Ca 0.04 -0.29 -0.00 0.00 1.13 0.00 0.00 58.89 59.77 2k47 h TRP 4 Cb 0.68 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 29.27 2k47 h TRP 4 CO 0.02 1.10 -0.02 1.03 -1.03 0.00 0.00 178.44 179.54 2k47 h SER 5 N 0.21 -0.05 -3.22 2.65 0.87 -1.91 -3.33 113.55 108.78 2k47 h SER 5 Ca -0.07 -0.12 -0.77 0.00 -1.23 0.00 0.00 61.79 59.60 2k47 h SER 5 Cb 1.53 0.01 -0.24 0.00 -0.44 0.00 0.00 62.40 63.26 2k47 h SER 5 CO 0.15 0.09 0.59 -0.76 -0.53 0.00 0.00 176.83 176.37 2k47 s LEU 6 N -9.94 6.05 0.00 2.23 2.01 -0.94 -4.73 118.68 113.36 2k47 s LEU 6 Ca -0.14 -3.08 0.04 0.00 0.01 0.00 0.00 54.13 50.96 2k47 s LEU 6 Cb 0.05 -2.27 0.10 0.00 0.01 0.00 0.00 46.19 44.08 2k47 s LEU 6 CO 0.66 -0.53 0.98 -1.20 1.01 0.00 0.00 176.35 177.27 2k47 n SER 7 N 4.03 2.12 -0.27 2.29 7.64 -1.25 -4.56 113.62 123.61 2k47 n SER 7 Ca 0.24 -1.79 0.11 0.00 1.01 0.00 0.00 58.87 58.44 2k47 n SER 7 Cb 0.43 -0.07 -0.05 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 0.00 0.66 -2.61 1.43 4.76 -1.26 -0.49 118.16 120.64 2k47 n LYS 8 Ca 0.04 -0.54 -0.41 0.00 -2.87 0.00 0.00 58.31 54.53 2k47 n LYS 8 Cb 0.27 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.94 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 -2.72 3.87 0.82 -0.18 -4.23 -1.26 -4.88 115.64 107.07 2k47 s THR 9 Ca 0.14 0.04 -0.12 0.00 -1.18 0.00 0.00 61.69 60.57 2k47 s THR 9 Cb 0.17 -4.90 0.09 0.00 1.34 0.00 0.00 72.50 69.19 2k47 s THR 9 CO 0.71 -1.80 1.14 -0.44 -0.54 0.00 0.00 174.62 173.68 2k47 s SER 10 N 3.94 4.32 -0.01 3.99 0.01 -1.26 -4.61 113.70 120.07 2k47 s SER 10 Ca 0.35 0.99 0.02 0.00 1.31 0.00 0.00 55.95 58.62 2k47 s SER 10 Cb -0.08 -1.59 0.00 0.00 0.21 0.00 0.00 66.02 64.56 2k47 s SER 10 CO 0.09 -2.04 -0.07 -0.32 0.41 0.00 0.00 173.24 171.31 2k47 s MET 11 N -5.37 0.69 -0.28 12.44 1.75 -1.01 -4.91 119.30 122.61 2k47 s MET 11 Ca 0.62 -0.25 -0.17 0.00 -1.25 0.00 0.00 55.69 54.64 2k47 s MET 11 Cb -0.13 -0.67 -0.03 0.00 2.84 0.00 0.00 34.83 36.84 2k47 s MET 11 CO 0.52 0.11 0.47 0.99 -0.65 0.00 0.00 175.02 176.46 2k47 s THR 12 N 0.06 5.09 0.04 10.11 2.01 -1.26 -3.25 115.64 128.44 2k47 s THR 12 Ca -0.00 0.69 -0.10 0.00 0.31 0.00 0.00 61.69 62.58 2k47 s THR 12 Cb -0.06 -3.81 -0.05 0.00 0.01 0.00 0.00 72.50 68.59 2k47 s THR 12 CO -0.00 0.06 0.37 -0.36 -0.69 0.00 0.00 174.62 173.99 2k47 s PHE 13 N 2.25 3.61 -0.29 4.92 0.08 0.12 -4.95 117.98 123.72 2k47 s PHE 13 Ca 0.19 0.78 -0.08 0.00 0.12 0.00 0.00 56.93 57.94 2k47 s PHE 13 Cb -0.16 -2.14 -0.00 0.00 -0.57 0.00 0.00 43.02 40.15 2k47 s PHE 13 CO 0.10 0.57 0.11 -0.65 -0.10 0.00 0.00 175.22 175.25 2k47 s GLN 14 N -1.67 3.27 0.57 0.44 -0.21 -1.26 -2.93 119.66 117.87 2k47 s GLN 14 Ca 0.29 -0.75 -0.21 0.00 0.02 0.00 0.00 55.36 54.72 2k47 s GLN 14 Cb -0.14 -3.44 -0.04 0.00 1.00 0.00 0.00 33.01 30.38 2k47 s GLN 14 CO 0.16 -0.40 1.31 -2.30 -2.12 0.00 0.00 175.29 171.94 2k47 n PRO 15 N 4.92 1.50 0.07 2.91 -0.02 -1.26 -1.30 135.00 141.82 2k47 n PRO 15 Ca -0.14 0.56 -0.22 0.00 -2.02 0.00 0.00 63.50 61.68 2k47 n PRO 15 Cb 0.49 -2.52 -0.13 0.00 -0.02 0.00 0.00 33.50 31.32 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 1.17 0.60 -6.05 -0.52 1.79 -1.81 -3.46 116.57 108.29 2k47 h LYS 16 Ca -0.51 -0.78 -0.54 0.00 -2.18 0.00 0.00 60.65 56.64 2k47 h LYS 16 Cb 1.32 0.25 -0.07 0.00 -1.58 0.00 0.00 32.23 32.15 2k47 h LYS 16 CO 0.56 1.34 -0.51 0.15 -1.08 0.00 0.00 179.45 179.91 2k47 s LYS 17 N -3.02 2.35 0.26 3.15 1.02 -1.26 -5.04 119.74 117.20 2k47 s LYS 17 Ca -0.10 -1.62 -0.00 0.00 0.02 0.00 0.00 55.97 54.26 2k47 s LYS 17 Cb 0.05 -2.15 0.33 0.00 -0.52 0.00 0.00 37.83 35.55 2k47 s LYS 17 CO 0.92 0.02 1.70 0.00 -0.92 0.00 0.00 175.35 177.07 2k47 h ALA 18 N 1.46 1.04 -0.86 5.17 0.00 -2.01 -3.04 119.26 121.01 2k47 h ALA 18 Ca -0.43 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.18 2k47 h ALA 18 Cb 1.25 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 2k47 h ALA 18 CO 0.64 0.58 0.55 0.77 0.00 0.00 0.00 179.25 181.79 2k47 h SER 19 N 0.56 0.91 -4.19 0.00 0.02 -1.99 -3.43 113.55 105.42 2k47 h SER 19 Ca 0.09 -0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.52 2k47 h SER 19 Cb 0.64 -0.20 0.12 0.00 0.14 0.00 0.00 62.40 63.11 2k47 h SER 19 CO 0.05 0.62 0.38 -0.76 -1.14 0.00 0.00 176.83 175.97 2k47 s LEU 20 N -10.17 3.35 -0.06 5.07 1.43 -1.15 -5.05 118.68 112.10 2k47 s LEU 20 Ca -0.13 2.13 0.06 0.00 -1.03 0.00 0.00 54.13 55.16 2k47 s LEU 20 Cb 0.17 -4.57 -0.01 0.00 0.03 0.00 0.00 46.19 41.82 2k47 s LEU 20 CO 0.79 -1.90 -0.24 -1.10 0.23 0.00 0.00 176.35 174.13 2k47 s GLN 21 N -4.04 2.57 0.20 1.70 -1.52 -1.26 -4.84 119.66 112.46 2k47 s GLN 21 Ca 0.70 -0.89 -0.32 0.00 -1.95 0.00 0.00 55.36 52.89 2k47 s GLN 21 Cb -0.24 -2.18 -0.14 0.00 -0.22 0.00 0.00 33.01 30.23 2k47 s GLN 21 CO 0.43 0.39 1.38 -2.30 -0.25 0.00 0.00 175.29 174.94 2k47 n PRO 22 N 2.93 1.80 -3.63 2.91 -0.02 -1.26 -4.76 135.00 132.98 2k47 n PRO 22 Ca -0.17 0.64 -0.37 0.00 -2.02 0.00 0.00 63.50 61.58 2k47 n PRO 22 Cb 0.52 -2.29 -0.10 0.00 -0.02 0.00 0.00 33.50 31.61 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 0.38 4.06 -0.39 2.45 0.20 -1.15 -4.88 118.68 119.35 2k47 s LEU 23 Ca 0.72 0.05 0.02 0.00 0.69 0.00 0.00 54.13 55.61 2k47 s LEU 23 Cb -0.72 -2.11 0.12 0.00 -0.43 0.00 0.00 46.19 43.05 2k47 s LEU 23 CO 0.48 0.01 0.18 -0.89 -0.29 0.00 0.00 176.35 175.83 2k47 s THR 24 N 1.41 1.40 0.11 3.68 2.01 -1.26 0.14 115.64 123.15 2k47 s THR 24 Ca 0.07 -2.22 -0.12 0.00 0.31 0.00 0.00 61.69 59.73 2k47 s THR 24 Cb -0.15 -2.01 0.01 0.00 0.01 0.00 0.00 72.50 70.37 2k47 s THR 24 CO 0.08 -0.79 0.30 -0.51 -0.69 0.00 0.00 174.62 173.00 2k47 s ILE 25 N 0.76 0.10 0.39 1.82 1.10 -1.20 -4.88 121.20 119.30 2k47 s ILE 25 Ca 0.14 -0.94 0.00 0.00 -0.51 0.00 0.00 60.65 59.35 2k47 s ILE 25 Cb -0.22 -1.32 0.00 0.00 0.15 0.00 0.00 42.46 41.07 2k47 s ILE 25 CO -0.08 -0.47 0.03 -0.24 -2.11 0.00 0.00 174.94 172.08 2k47 n SER 26 N -0.15 2.99 0.37 4.50 2.88 -1.26 -2.40 113.62 120.55 2k47 n SER 26 Ca -0.15 -2.67 -0.17 0.00 -1.33 0.00 0.00 58.87 54.55 2k47 n SER 26 Cb 0.63 0.24 -0.09 0.00 -0.75 0.00 0.00 64.21 64.24 2k47 n SER 26 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2k47 h LEU 27 N 0.00 -1.14 -1.48 2.46 3.38 -1.79 0.16 115.31 116.89 2k47 h LEU 27 Ca -0.32 0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 2k47 h LEU 27 Cb 0.97 0.34 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 2k47 h LEU 27 CO 0.52 -0.67 -0.14 -0.78 0.09 0.00 0.00 178.44 177.46 2k47 h ASP 28 N -1.06 0.15 0.59 -0.43 3.58 -1.10 -1.28 116.42 116.87 2k47 h ASP 28 Ca -0.09 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.33 2k47 h ASP 28 Cb 0.86 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.87 2k47 h ASP 28 CO 0.07 0.31 -0.07 -0.62 -2.88 0.00 0.00 179.24 176.06 2k47 n GLU 29 N -4.29 0.38 -0.08 0.28 1.02 -1.13 -3.82 120.64 113.00 2k47 n GLU 29 Ca -0.01 -0.07 0.01 0.00 -0.02 0.00 0.00 57.16 57.08 2k47 n GLU 29 Cb 0.26 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.20 2k47 n GLU 29 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2k47 n LEU 30 N -1.25 1.08 -3.93 -4.62 7.94 0.03 -4.75 117.00 111.50 2k47 n LEU 30 Ca 0.12 -1.33 -0.13 0.00 -1.11 0.00 0.00 56.01 53.56 2k47 n LEU 30 Cb 0.28 -0.06 -0.14 0.00 0.53 0.00 0.00 43.42 44.03 2k47 n LEU 30 CO 0.25 0.32 -0.38 -0.36 -1.11 0.00 0.00 177.39 176.11 2k47 s PHE 31 N -0.79 0.25 -0.24 1.96 0.08 -0.56 -4.94 117.98 113.74 2k47 s PHE 31 Ca 0.05 -0.13 0.19 0.00 0.12 0.00 0.00 56.93 57.16 2k47 s PHE 31 Cb 0.04 -0.16 0.48 0.00 -0.57 0.00 0.00 43.02 42.81 2k47 s PHE 31 CO 0.00 -0.03 1.14 0.43 -0.10 0.00 0.00 175.22 176.67 2k47 n SER 32 N 2.75 2.38 -3.64 1.36 7.64 -1.26 -4.81 113.62 118.04 2k47 n SER 32 Ca -0.14 -2.56 -0.06 0.00 1.01 0.00 0.00 58.87 57.12 2k47 n SER 32 Cb 0.58 -0.43 -0.07 0.00 -1.01 0.00 0.00 64.21 63.29 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 -3.53 -0.48 0.06 6.43 0.15 -1.26 -5.03 113.70 110.05 2k47 s SER 33 Ca 0.35 0.84 -0.22 0.00 0.70 0.00 0.00 55.95 57.61 2k47 s SER 33 Cb 0.35 1.02 -0.14 0.00 -1.71 0.00 0.00 66.02 65.54 2k47 s SER 33 CO -0.03 -0.14 1.55 -0.09 1.20 0.00 0.00 173.24 175.73 2k47 h ARG 34 N 5.10 0.14 -0.45 5.44 2.43 -2.00 -2.43 114.38 122.61 2k47 h ARG 34 Ca -0.28 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 58.82 2k47 h ARG 34 Cb 1.19 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.69 2k47 h ARG 34 CO 0.15 0.32 0.12 0.78 -1.51 0.00 0.00 179.97 179.83 2k47 h GLY 35 N -0.06 0.71 0.82 2.80 0.00 -2.01 -2.33 103.07 103.01 2k47 h GLY 35 Ca 0.03 -0.38 0.04 0.00 0.00 0.00 0.00 47.33 47.02 2k47 h GLY 35 CO -0.00 0.36 0.46 -2.09 0.00 0.00 0.00 176.54 175.27 2k47 h GLU 36 N 0.65 0.85 -0.75 4.80 4.57 -1.91 -1.81 114.58 120.98 2k47 h GLU 36 Ca 0.15 -0.05 0.08 0.00 -1.18 0.00 0.00 59.36 58.36 2k47 h GLU 36 Cb 0.23 -0.19 -0.07 0.00 -0.16 0.00 0.00 28.75 28.56 2k47 h GLU 36 CO -0.00 0.56 0.41 0.35 -1.18 0.00 0.00 179.01 179.15 2k47 h PHE 37 N 0.87 0.75 0.09 0.92 3.57 -0.93 -1.40 116.94 120.81 2k47 h PHE 37 Ca 0.30 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.85 2k47 h PHE 37 Cb 0.06 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.55 2k47 h PHE 37 CO -0.04 0.31 -0.21 0.82 -2.23 0.00 0.00 178.31 176.96 2k47 h ILE 38 N 0.72 0.52 0.29 1.41 1.08 -1.18 -1.57 117.51 118.78 2k47 h ILE 38 Ca 0.35 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.81 2k47 h ILE 38 Cb 0.31 0.52 0.00 0.00 -3.07 0.00 0.00 36.82 34.58 2k47 h ILE 38 CO -0.23 0.00 -0.16 0.28 -0.69 0.00 0.00 178.15 177.35 2k47 h SER 39 N -0.38 -0.40 -0.84 1.72 0.02 -1.06 -3.08 113.55 109.52 2k47 h SER 39 Ca 0.03 0.02 0.32 0.00 -0.84 0.00 0.00 61.79 61.32 2k47 h SER 39 Cb 0.42 0.11 -0.12 0.00 0.14 0.00 0.00 62.40 62.95 2k47 h SER 39 CO -0.13 -0.26 0.50 1.33 -1.14 0.00 0.00 176.83 177.13 2k47 n VAL 40 N -3.24 -0.24 0.00 2.27 0.24 -0.57 -4.63 118.33 112.16 2k47 n VAL 40 Ca -0.05 1.37 0.00 0.00 -2.04 0.00 0.00 64.34 63.62 2k47 n VAL 40 Cb 0.17 -2.24 0.00 0.00 -1.47 0.00 0.00 33.84 30.30 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 -1.27 0.44 2.99 7.63 0.00 -1.11 -4.45 105.19 109.42 2k47 n GLY 41 Ca 0.28 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.49 1.96 0.00 -0.02 0.00 -0.61 -4.82 107.32 103.34 2k47 s GLY 42 Ca 0.00 -2.59 0.00 0.00 0.00 0.00 0.00 44.72 42.13 2k47 s GLY 42 CO 0.00 0.99 0.00 1.22 0.00 0.00 0.00 173.10 175.31 2k47 n ASP 43 N 4.13 0.00 0.00 1.64 9.92 -1.26 -4.36 116.55 126.61 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 0.41 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.89 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 2.66 -0.60 3.40 0.44 0.00 -1.26 -4.93 105.19 104.89 2k47 n GLY 44 Ca 0.00 0.14 -0.45 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.41 3.26 0.95 1.61 3.00 -1.26 0.50 118.95 126.60 2k47 s ARG 45 Ca 0.00 -1.52 -0.14 0.00 0.00 0.00 0.00 55.73 54.07 2k47 s ARG 45 Cb 0.00 -4.44 0.16 0.00 0.00 0.00 0.00 34.95 30.67 2k47 s ARG 45 CO 0.00 -1.60 1.17 1.41 0.00 0.00 0.00 175.30 176.28 2k47 s MET 46 N 2.52 0.83 0.00 3.54 1.75 -1.26 -4.99 119.30 121.69 2k47 s MET 46 Ca 0.19 0.11 0.00 0.00 -1.25 0.00 0.00 55.69 54.74 2k47 s MET 46 Cb -0.17 -1.82 0.00 0.00 2.84 0.00 0.00 34.83 35.68 2k47 s MET 46 CO 0.01 -2.37 0.00 0.45 -0.65 0.00 0.00 175.02 172.46 2k47 n SER 47 N -3.85 0.00 0.00 1.11 2.88 -1.26 -5.00 113.62 107.50 2k47 n SER 47 Ca 0.09 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 2k47 n SER 47 Cb 0.59 -0.37 0.00 0.00 -0.75 0.00 0.00 64.21 63.69 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 -1.98 0.00 0.09 0.66 -0.00 -1.26 -4.94 115.22 107.79 2k47 n HIS 48 Ca 0.00 0.00 -0.01 0.00 0.46 0.00 0.00 57.72 58.17 2k47 n HIS 48 Cb 0.00 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 29.83 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 0.37 1.57 1.79 -1.97 -3.38 116.57 114.95 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 0.54 -0.18 1.49 -1.08 0.00 0.00 179.45 180.22 2k47 h GLU 50 N 0.00 -0.47 -0.55 3.15 4.81 -1.98 -2.70 114.58 116.83 2k47 h GLU 50 Ca -0.07 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.30 2k47 h GLU 50 Cb 1.55 0.11 -0.11 0.00 0.63 0.00 0.00 28.75 30.93 2k47 h GLU 50 CO 0.07 -0.17 -0.29 0.00 -0.73 0.00 0.00 179.01 177.89 2k47 h ALA 51 N -0.31 0.03 -0.30 2.92 0.00 -1.88 -0.84 119.26 118.88 2k47 h ALA 51 Ca -0.05 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2k47 h ALA 51 Cb 0.52 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2k47 h ALA 51 CO 0.08 -0.63 0.17 0.82 0.00 0.00 0.00 179.25 179.69 2k47 h ILE 52 N -0.15 1.13 -0.80 0.00 1.08 -1.73 -2.75 117.51 114.28 2k47 h ILE 52 Ca 0.24 -0.33 0.23 0.00 -0.39 0.00 0.00 64.86 64.61 2k47 h ILE 52 Cb 0.53 0.80 -0.03 0.00 -3.07 0.00 0.00 36.82 35.04 2k47 h ILE 52 CO -0.64 0.13 0.62 0.25 -0.69 0.00 0.00 178.15 177.82 2k47 h LEU 53 N 0.37 0.00 -1.30 1.44 5.85 -0.81 -1.06 115.31 119.80 2k47 h LEU 53 Ca 0.11 0.00 0.34 0.00 0.84 0.00 0.00 57.88 59.17 2k47 h LEU 53 Cb 0.06 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 40.97 2k47 h LEU 53 CO -0.02 0.00 0.72 -0.07 -0.34 0.00 0.00 178.44 178.73 2k47 h LEU 54 N 0.00 0.39 -0.73 2.25 4.07 -1.15 -1.87 115.31 118.28 2k47 h LEU 54 Ca 0.38 0.13 0.16 0.00 0.08 0.00 0.00 57.88 58.63 2k47 h LEU 54 Cb 1.62 0.08 -0.11 0.00 1.08 0.00 0.00 40.66 43.33 2k47 h LEU 54 CO -0.00 -0.06 0.12 1.23 -1.08 0.00 0.00 178.44 178.65 2k47 h GLY 55 N 0.26 0.95 -0.25 0.83 0.00 -1.39 -2.21 103.07 101.26 2k47 h GLY 55 Ca 0.71 0.01 0.13 0.00 0.00 0.00 0.00 47.33 48.18 2k47 h GLY 55 CO -0.41 -0.23 -0.12 1.41 0.00 0.00 0.00 176.54 177.19 2k47 h LEU 56 N 0.21 -0.53 -1.68 3.11 3.38 -1.57 0.26 115.31 118.49 2k47 h LEU 56 Ca 0.41 0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.53 2k47 h LEU 56 Cb 0.71 0.37 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2k47 h LEU 56 CO -0.55 -0.20 -0.11 0.03 0.09 0.00 0.00 178.44 177.71 2k47 h ARG 57 N 0.02 0.07 -0.20 1.13 3.08 -1.58 0.26 114.38 117.17 2k47 h ARG 57 Ca 0.32 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.30 2k47 h ARG 57 Cb 0.49 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 2k47 h ARG 57 CO -0.64 0.18 -0.08 -0.92 -1.07 0.00 0.00 179.97 177.45 2k47 h TYR 58 N 0.07 0.46 0.00 3.04 3.20 -0.45 -3.04 116.97 120.24 2k47 h TYR 58 Ca 0.01 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.78 2k47 h TYR 58 Cb 0.24 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.40 2k47 h TYR 58 CO 0.00 0.68 -0.06 1.63 -1.64 0.00 0.00 178.16 178.77 2k47 n LYS 59 N -4.59 0.02 -2.40 1.82 4.76 -0.35 -4.97 118.16 112.46 2k47 n LYS 59 Ca -0.05 0.02 -0.02 0.00 -2.87 0.00 0.00 58.31 55.39 2k47 n LYS 59 Cb 0.30 -1.53 0.01 0.00 -1.84 0.00 0.00 35.03 31.98 2k47 n LYS 59 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2k47 n LYS 60 N -1.56 -0.88 -0.89 1.97 3.00 0.82 -5.00 118.16 115.62 2k47 n LYS 60 Ca 0.07 0.90 -0.04 0.00 -0.00 0.00 0.00 58.31 59.24 2k47 n LYS 60 Cb 0.35 -3.89 -0.03 0.00 0.00 0.00 0.00 35.03 31.45 2k47 n LYS 60 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 2k47 n LEU 61 N -1.72 -0.60 0.20 3.14 -0.00 -0.61 -4.98 117.00 112.43 2k47 n LEU 61 Ca -0.01 -1.25 0.13 0.00 -0.00 0.00 0.00 56.01 54.88 2k47 n LEU 61 Cb 0.52 0.03 0.68 0.00 -0.00 0.00 0.00 43.42 44.65 2k47 n LEU 61 CO 0.30 1.11 0.90 0.22 -0.00 0.00 0.00 177.39 179.92 2k47 h TYR 62 N 0.04 0.00 0.04 1.47 3.20 -1.93 -0.56 116.97 119.22 2k47 h TYR 62 Ca -0.33 0.00 -0.00 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 -0.02 -0.91 -1.64 0.00 0.00 178.16 175.48 2k47 h ASN 63 N 0.00 -0.04 0.22 -2.11 2.35 -1.93 -3.38 115.58 110.69 2k47 h ASN 63 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2k47 h ASN 63 Cb 0.09 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2k47 h ASN 63 CO 0.00 0.04 -0.35 1.67 -1.65 0.00 0.00 177.43 177.15 2k47 n GLN 64 N -2.54 0.76 0.02 0.81 7.27 -1.22 -4.18 117.38 118.30 2k47 n GLN 64 Ca -0.01 -0.49 -0.17 0.00 0.07 0.00 0.00 57.00 56.41 2k47 n GLN 64 Cb 0.02 -1.49 -0.07 0.00 2.41 0.00 0.00 30.24 31.11 2k47 n GLN 64 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2k47 h ALA 65 N 3.60 0.29 0.00 1.69 0.00 -1.30 -1.56 119.26 121.98 2k47 h ALA 65 Ca 0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 54.91 54.23 2k47 h ALA 65 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2k47 h ALA 65 CO 0.00 0.71 -0.19 -0.09 0.00 0.00 0.00 179.25 179.67 2k47 h ARG 66 N 0.44 0.00 0.09 0.00 2.43 -1.73 -2.98 114.38 112.62 2k47 h ARG 66 Ca -0.08 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.74 2k47 h ARG 66 Cb 1.51 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 31.03 2k47 h ARG 66 CO 0.17 0.19 -1.95 1.33 -1.51 0.00 0.00 179.97 178.21 2k47 n VAL 67 N -3.31 1.73 0.24 0.20 0.24 -1.21 -4.15 118.33 112.08 2k47 n VAL 67 Ca 0.01 -0.69 0.11 0.00 -2.04 0.00 0.00 64.34 61.72 2k47 n VAL 67 Cb 0.44 -1.54 0.58 0.00 -1.47 0.00 0.00 33.84 31.86 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 0.05 0.00 -5.76 7.34 1.79 -1.31 -3.45 116.57 115.23 2k47 h LYS 68 Ca -0.40 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.55 2k47 h LYS 68 Cb 2.03 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 32.54 2k47 h LYS 68 CO 0.08 0.19 -0.72 0.71 -1.08 0.00 0.00 179.45 178.63 2k47 s TYR 69 N -3.96 2.01 -1.19 -1.35 1.51 -1.13 -2.30 117.35 110.94 2k47 s TYR 69 Ca -0.01 -0.53 -0.18 0.00 -1.01 0.00 0.00 57.07 55.33 2k47 s TYR 69 Cb 0.12 -1.00 0.10 0.00 -0.11 0.00 0.00 41.96 41.07 2k47 s TYR 69 CO 0.62 0.46 1.55 -1.12 -1.11 0.00 0.00 175.55 175.95 2k47 s SER 70 N -3.44 6.82 -0.12 2.29 0.01 -0.42 -4.71 113.70 114.13 2k47 s SER 70 Ca 0.28 -2.37 -0.11 0.00 1.31 0.00 0.00 55.95 55.06 2k47 s SER 70 Cb -0.00 -2.51 -0.04 0.00 0.21 0.00 0.00 66.02 63.68 2k47 s SER 70 CO 0.11 -1.11 -0.21 0.18 0.41 0.00 0.00 173.24 172.62 2k47 n LEU 71 N 7.60 1.37 -4.34 2.44 4.32 -1.26 -4.26 117.00 122.88 2k47 n LEU 71 Ca 0.40 0.33 -0.46 0.00 -0.02 0.00 0.00 56.01 56.26 2k47 n LEU 71 Cb 0.46 -0.70 -0.02 0.00 -1.62 0.00 0.00 43.42 41.54 2k47 n LEU 71 CO 0.69 -0.38 0.53 -0.76 -1.22 0.00 0.00 177.39 176.24 2k47 s LEU 72 N -7.13 6.61 0.00 2.23 2.01 -1.26 -5.02 118.68 116.12 2k47 s LEU 72 Ca -0.18 -2.85 0.21 0.00 0.01 0.00 0.00 54.13 51.32 2k47 s LEU 72 Cb 0.02 -2.22 0.16 0.00 0.01 0.00 0.00 46.19 44.17 2k47 s LEU 72 CO 0.26 -0.53 1.16 -0.62 1.01 0.00 0.00 176.35 177.63