#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 0.34 -3.46 2.15 -1.26 -4.88 116.67 108.96 2k47 s ASP 2 Ca 0.00 0.37 0.02 0.00 0.43 0.00 0.00 52.55 53.37 2k47 s ASP 2 Cb 0.00 0.55 0.59 0.00 -0.30 0.00 0.00 42.92 43.77 2k47 s ASP 2 CO 0.00 -0.76 1.96 1.62 -0.17 0.00 0.00 175.17 177.82 2k47 h VAL 3 N 2.61 1.18 0.10 1.11 3.04 -0.12 -1.07 116.25 123.10 2k47 h VAL 3 Ca -0.30 -0.46 -0.28 0.00 -1.01 0.00 0.00 66.70 64.65 2k47 h VAL 3 Cb 1.21 0.42 0.02 0.00 -2.01 0.00 0.00 31.29 30.93 2k47 h VAL 3 CO 0.39 0.20 -1.19 -0.25 -1.01 0.00 0.00 177.57 175.71 2k47 h TRP 4 N 0.79 0.79 -0.01 3.17 2.91 -1.92 -3.32 115.95 118.35 2k47 h TRP 4 Ca 0.20 -0.50 -0.00 0.00 1.13 0.00 0.00 58.89 59.72 2k47 h TRP 4 Cb 0.03 -0.06 -0.00 0.00 -0.51 0.00 0.00 29.16 28.62 2k47 h TRP 4 CO 0.00 1.36 0.01 0.77 -1.03 0.00 0.00 178.44 179.55 2k47 h SER 5 N 0.21 0.02 -3.67 2.65 0.02 -1.86 -3.35 113.55 107.57 2k47 h SER 5 Ca -0.15 -0.12 -0.78 0.00 -0.84 0.00 0.00 61.79 59.89 2k47 h SER 5 Cb 1.87 -0.00 -0.25 0.00 0.14 0.00 0.00 62.40 64.15 2k47 h SER 5 CO 0.22 0.13 0.14 -0.76 -1.14 0.00 0.00 176.83 175.42 2k47 s LEU 6 N -9.95 6.59 0.00 5.07 1.43 -0.43 -4.77 118.68 116.62 2k47 s LEU 6 Ca -0.14 -2.59 0.00 0.00 -1.03 0.00 0.00 54.13 50.38 2k47 s LEU 6 Cb 0.05 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 44.04 2k47 s LEU 6 CO 0.67 -0.63 0.75 -1.20 0.23 0.00 0.00 176.35 176.17 2k47 n SER 7 N 4.26 1.29 -0.02 2.29 7.64 -1.26 -4.74 113.62 123.09 2k47 n SER 7 Ca 0.13 -1.57 -0.11 0.00 1.01 0.00 0.00 58.87 58.34 2k47 n SER 7 Cb 0.47 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.53 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 -0.28 0.65 -1.99 1.43 4.76 -1.26 -1.29 118.16 120.18 2k47 n LYS 8 Ca 0.00 0.29 -0.42 0.00 -2.87 0.00 0.00 58.31 55.32 2k47 n LYS 8 Cb 0.26 -1.78 -0.03 0.00 -1.84 0.00 0.00 35.03 31.65 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 -2.59 3.43 0.90 -0.18 -4.23 -1.26 -4.79 115.64 106.92 2k47 s THR 9 Ca -0.07 0.40 -0.12 0.00 -1.18 0.00 0.00 61.69 60.71 2k47 s THR 9 Cb 0.08 -3.68 0.17 0.00 1.34 0.00 0.00 72.50 70.41 2k47 s THR 9 CO 0.82 -0.51 1.24 -0.44 -0.54 0.00 0.00 174.62 175.19 2k47 s SER 10 N 6.79 3.50 -0.02 3.99 0.01 -1.26 -4.67 113.70 122.04 2k47 s SER 10 Ca 0.78 0.17 0.01 0.00 1.31 0.00 0.00 55.95 58.22 2k47 s SER 10 Cb -0.20 -0.33 0.02 0.00 0.21 0.00 0.00 66.02 65.72 2k47 s SER 10 CO 0.30 -2.48 -0.01 -0.32 0.41 0.00 0.00 173.24 171.15 2k47 s MET 11 N -5.70 0.31 -0.16 12.44 1.75 -1.11 -4.91 119.30 121.91 2k47 s MET 11 Ca 0.71 0.01 -0.21 0.00 -1.25 0.00 0.00 55.69 54.96 2k47 s MET 11 Cb -0.05 -0.43 -0.03 0.00 2.84 0.00 0.00 34.83 37.16 2k47 s MET 11 CO 0.51 -0.07 0.60 0.99 -0.65 0.00 0.00 175.02 176.40 2k47 s THR 12 N 0.70 5.06 -0.01 10.11 2.01 -1.26 -3.27 115.64 128.97 2k47 s THR 12 Ca -0.07 1.16 0.00 0.00 0.31 0.00 0.00 61.69 63.10 2k47 s THR 12 Cb -0.10 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 2k47 s THR 12 CO -0.01 0.17 0.03 -0.36 -0.69 0.00 0.00 174.62 173.77 2k47 s PHE 13 N 1.50 3.17 -0.13 4.92 0.08 0.19 -4.94 117.98 122.78 2k47 s PHE 13 Ca 0.29 0.15 -0.01 0.00 0.12 0.00 0.00 56.93 57.48 2k47 s PHE 13 Cb -0.16 -1.71 -0.02 0.00 -0.57 0.00 0.00 43.02 40.56 2k47 s PHE 13 CO 0.11 0.50 -0.12 -1.14 -0.10 0.00 0.00 175.22 174.48 2k47 s GLN 14 N -1.54 3.39 0.45 0.44 0.74 -1.26 -1.96 119.66 119.92 2k47 s GLN 14 Ca 0.20 -0.66 -0.24 0.00 0.05 0.00 0.00 55.36 54.71 2k47 s GLN 14 Cb -0.12 -2.66 -0.08 0.00 1.10 0.00 0.00 33.01 31.25 2k47 s GLN 14 CO 0.11 0.24 1.24 -1.25 -0.55 0.00 0.00 175.29 175.07 2k47 s PRO 15 N 0.29 3.78 0.25 1.67 0.04 -1.26 -1.87 135.00 137.90 2k47 s PRO 15 Ca -0.09 1.97 0.03 0.00 0.04 0.00 0.00 61.00 62.96 2k47 s PRO 15 Cb -0.15 -2.54 0.30 0.00 0.04 0.00 0.00 34.50 32.15 2k47 s PRO 15 CO 0.05 -0.59 1.61 0.87 0.04 0.00 0.00 177.00 178.98 2k47 h LYS 16 N 2.25 0.32 -5.55 4.56 1.79 -1.85 -3.46 116.57 114.64 2k47 h LYS 16 Ca -0.50 -0.19 -0.52 0.00 -2.18 0.00 0.00 60.65 57.27 2k47 h LYS 16 Cb 1.25 0.01 -0.14 0.00 -1.58 0.00 0.00 32.23 31.78 2k47 h LYS 16 CO 0.61 0.75 -0.66 -1.59 -1.08 0.00 0.00 179.45 177.48 2k47 s LYS 17 N -3.98 1.65 0.32 3.15 0.00 -1.26 -5.05 119.74 114.56 2k47 s LYS 17 Ca -0.05 -1.86 0.00 0.00 0.00 0.00 0.00 55.97 54.06 2k47 s LYS 17 Cb 0.12 -1.25 0.52 0.00 0.00 0.00 0.00 37.83 37.23 2k47 s LYS 17 CO 0.80 0.01 1.95 0.00 0.00 0.00 0.00 175.35 178.11 2k47 h ALA 18 N 2.16 1.42 -0.66 0.59 0.00 -2.02 -2.80 119.26 117.95 2k47 h ALA 18 Ca -0.41 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.47 2k47 h ALA 18 Cb 1.24 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 2k47 h ALA 18 CO 0.70 0.49 0.37 0.66 0.00 0.00 0.00 179.25 181.46 2k47 h SER 19 N 0.91 0.56 -4.21 0.00 4.64 -1.98 -3.43 113.55 110.05 2k47 h SER 19 Ca 0.24 0.03 -0.51 0.00 -0.47 0.00 0.00 61.79 61.07 2k47 h SER 19 Cb -0.01 -0.09 0.10 0.00 -0.31 0.00 0.00 62.40 62.10 2k47 h SER 19 CO -0.04 0.37 0.37 -0.76 -0.87 0.00 0.00 176.83 175.90 2k47 s LEU 20 N -10.25 3.37 -0.01 5.97 1.43 -1.06 -5.06 118.68 113.08 2k47 s LEU 20 Ca -0.13 1.98 0.08 0.00 -1.03 0.00 0.00 54.13 55.04 2k47 s LEU 20 Cb 0.16 -4.55 -0.02 0.00 0.03 0.00 0.00 46.19 41.81 2k47 s LEU 20 CO 0.76 -1.64 -0.26 -1.10 0.23 0.00 0.00 176.35 174.35 2k47 s GLN 21 N -4.14 2.00 0.75 1.70 -1.52 -1.26 -4.75 119.66 112.45 2k47 s GLN 21 Ca 0.67 -0.94 -0.15 0.00 -1.95 0.00 0.00 55.36 52.98 2k47 s GLN 21 Cb -0.20 -1.98 -0.01 0.00 -0.22 0.00 0.00 33.01 30.60 2k47 s GLN 21 CO 0.42 0.54 0.66 -2.30 -0.25 0.00 0.00 175.29 174.36 2k47 n PRO 22 N 2.33 0.27 -4.02 2.91 -0.02 -1.26 -4.65 135.00 130.55 2k47 n PRO 22 Ca -0.16 0.14 -0.28 0.00 -2.02 0.00 0.00 63.50 61.18 2k47 n PRO 22 Cb 0.51 -1.96 -0.17 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 -1.37 1.42 -0.34 2.45 0.20 -0.83 -4.93 118.68 115.29 2k47 s LEU 23 Ca 0.67 -0.37 0.00 0.00 0.69 0.00 0.00 54.13 55.12 2k47 s LEU 23 Cb -0.33 -0.97 0.11 0.00 -0.43 0.00 0.00 46.19 44.56 2k47 s LEU 23 CO 0.57 -0.08 0.11 -0.89 -0.29 0.00 0.00 176.35 175.77 2k47 s THR 24 N 1.53 1.18 0.08 3.68 2.01 -1.26 0.55 115.64 123.42 2k47 s THR 24 Ca 0.03 -1.74 -0.14 0.00 0.31 0.00 0.00 61.69 60.15 2k47 s THR 24 Cb -0.13 -1.88 0.02 0.00 0.01 0.00 0.00 72.50 70.53 2k47 s THR 24 CO -0.08 -0.70 0.33 -0.51 -0.69 0.00 0.00 174.62 172.97 2k47 s ILE 25 N 1.30 0.09 0.43 1.82 1.10 -1.20 -4.86 121.20 119.87 2k47 s ILE 25 Ca 0.11 -0.71 0.01 0.00 -0.51 0.00 0.00 60.65 59.56 2k47 s ILE 25 Cb -0.19 -1.11 0.01 0.00 0.15 0.00 0.00 42.46 41.33 2k47 s ILE 25 CO -0.18 -0.39 0.12 -0.24 -2.11 0.00 0.00 174.94 172.13 2k47 n SER 26 N 0.14 2.91 0.32 4.50 2.88 -1.26 -2.77 113.62 120.34 2k47 n SER 26 Ca -0.17 -2.73 -0.15 0.00 -1.33 0.00 0.00 58.87 54.49 2k47 n SER 26 Cb 0.62 0.18 -0.07 0.00 -0.75 0.00 0.00 64.21 64.18 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 -0.92 -1.35 2.46 3.38 -1.82 -0.56 115.31 116.50 2k47 h LEU 27 Ca -0.33 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 2k47 h LEU 27 Cb 1.04 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 2k47 h LEU 27 CO 0.53 -0.56 0.16 -0.78 0.09 0.00 0.00 178.44 177.88 2k47 h ASP 28 N -0.90 0.55 0.59 -0.43 3.58 -1.52 -1.41 116.42 116.88 2k47 h ASP 28 Ca -0.08 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.31 2k47 h ASP 28 Cb 0.72 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2k47 h ASP 28 CO 0.08 0.51 -0.01 -0.62 -2.88 0.00 0.00 179.24 176.32 2k47 n GLU 29 N -4.36 0.40 -0.03 0.28 4.71 -1.18 -3.62 120.64 116.83 2k47 n GLU 29 Ca 0.03 -0.01 0.01 0.00 -0.01 0.00 0.00 57.16 57.18 2k47 n GLU 29 Cb 0.15 -1.50 0.02 0.00 -1.01 0.00 0.00 31.44 29.10 2k47 n GLU 29 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 2k47 n LEU 30 N -1.29 1.57 -3.98 -4.62 7.94 -0.23 -4.78 117.00 111.61 2k47 n LEU 30 Ca 0.14 -1.72 -0.17 0.00 -1.11 0.00 0.00 56.01 53.14 2k47 n LEU 30 Cb 0.25 -0.06 -0.15 0.00 0.53 0.00 0.00 43.42 43.99 2k47 n LEU 30 CO 0.24 0.42 -0.41 -0.36 -1.11 0.00 0.00 177.39 176.16 2k47 s PHE 31 N -1.04 0.60 -0.34 1.96 0.08 -0.73 -4.95 117.98 113.56 2k47 s PHE 31 Ca 0.05 -0.12 0.14 0.00 0.12 0.00 0.00 56.93 57.12 2k47 s PHE 31 Cb 0.04 -0.39 0.46 0.00 -0.57 0.00 0.00 43.02 42.56 2k47 s PHE 31 CO 0.00 -0.02 1.05 -1.13 -0.10 0.00 0.00 175.22 175.03 2k47 n SER 32 N 2.95 2.76 0.00 1.36 3.41 -1.26 -4.86 113.62 117.98 2k47 n SER 32 Ca -0.13 -2.98 0.00 0.00 -0.26 0.00 0.00 58.87 55.50 2k47 n SER 32 Cb 0.57 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2k47 n SER 32 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2k47 n SER 33 N -0.35 0.00 0.02 4.04 2.88 -1.26 -4.99 113.62 113.96 2k47 n SER 33 Ca 0.21 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.63 2k47 n SER 33 Cb 0.79 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 64.18 2k47 n SER 33 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 2k47 h ARG 34 N 0.00 0.02 -0.18 -1.46 1.12 -2.01 -2.63 114.38 109.24 2k47 h ARG 34 Ca 0.00 -0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 58.84 2k47 h ARG 34 Cb 0.00 -0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 29.94 2k47 h ARG 34 CO 0.00 0.12 -0.02 0.78 -3.11 0.00 0.00 179.97 177.74 2k47 h GLY 35 N -0.08 0.29 0.86 2.80 0.00 -2.00 -2.36 103.07 102.59 2k47 h GLY 35 Ca 0.01 -0.15 0.03 0.00 0.00 0.00 0.00 47.33 47.22 2k47 h GLY 35 CO -0.00 0.14 0.49 -2.09 0.00 0.00 0.00 176.54 175.08 2k47 h GLU 36 N 0.26 0.93 -0.61 4.80 4.57 -1.86 -1.64 114.58 121.03 2k47 h GLU 36 Ca 0.06 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 2k47 h GLU 36 Cb 0.22 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 28.57 2k47 h GLU 36 CO 0.01 0.62 0.30 0.35 -1.18 0.00 0.00 179.01 179.10 2k47 h PHE 37 N 0.96 0.87 0.06 0.92 3.57 -1.13 -2.18 116.94 120.02 2k47 h PHE 37 Ca 0.31 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.79 2k47 h PHE 37 Cb 0.02 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.46 2k47 h PHE 37 CO -0.03 0.66 -0.17 0.82 -2.23 0.00 0.00 178.31 177.36 2k47 h ILE 38 N 0.83 0.60 0.24 1.41 1.08 -1.18 -1.90 117.51 118.59 2k47 h ILE 38 Ca 0.21 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.67 2k47 h ILE 38 Cb 0.11 0.60 -0.00 0.00 -3.07 0.00 0.00 36.82 34.46 2k47 h ILE 38 CO -0.03 0.00 -0.16 0.28 -0.69 0.00 0.00 178.15 177.55 2k47 h SER 39 N -0.31 -0.41 -0.86 1.72 0.02 -1.19 -3.05 113.55 109.48 2k47 h SER 39 Ca 0.03 0.02 0.33 0.00 -0.84 0.00 0.00 61.79 61.34 2k47 h SER 39 Cb 0.35 0.12 -0.12 0.00 0.14 0.00 0.00 62.40 62.89 2k47 h SER 39 CO -0.12 -0.24 0.51 1.33 -1.14 0.00 0.00 176.83 177.18 2k47 n VAL 40 N -3.23 -0.25 0.00 2.27 0.24 -0.83 -4.63 118.33 111.90 2k47 n VAL 40 Ca -0.05 1.41 0.00 0.00 -2.04 0.00 0.00 64.34 63.67 2k47 n VAL 40 Cb 0.16 -2.30 0.00 0.00 -1.47 0.00 0.00 33.84 30.23 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 3.03 7.63 0.00 -1.15 -4.62 105.19 109.27 2k47 n GLY 41 Ca 0.29 0.00 -0.32 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 -0.64 1.94 0.00 -0.02 0.00 -0.73 -4.92 107.32 102.95 2k47 s GLY 42 Ca 0.00 -2.51 0.00 0.00 0.00 0.00 0.00 44.72 42.21 2k47 s GLY 42 CO 0.00 0.94 0.00 1.22 0.00 0.00 0.00 173.10 175.26 2k47 n ASP 43 N 4.29 0.00 0.00 1.64 9.92 -1.26 -4.36 116.55 126.78 2k47 n ASP 43 Ca 0.03 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.29 2k47 n ASP 43 Cb 0.42 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.90 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 2.52 -1.49 3.45 0.44 0.00 -1.26 -4.93 105.19 103.91 2k47 n GLY 44 Ca 0.00 0.38 -0.44 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.74 3.37 0.60 1.61 3.00 -1.26 0.61 118.95 126.14 2k47 s ARG 45 Ca 0.00 -1.36 -0.03 0.00 0.00 0.00 0.00 55.73 54.35 2k47 s ARG 45 Cb 0.00 -4.61 0.04 0.00 0.00 0.00 0.00 34.95 30.38 2k47 s ARG 45 CO 0.00 -1.78 0.87 1.41 0.00 0.00 0.00 175.30 175.80 2k47 s MET 46 N 3.26 2.52 0.00 3.54 1.75 -1.26 -4.96 119.30 124.15 2k47 s MET 46 Ca 0.27 -0.46 0.00 0.00 -1.25 0.00 0.00 55.69 54.26 2k47 s MET 46 Cb -0.11 -2.35 0.00 0.00 2.84 0.00 0.00 34.83 35.21 2k47 s MET 46 CO -0.01 -0.86 0.00 0.43 -0.65 0.00 0.00 175.02 173.93 2k47 n SER 47 N -2.56 0.00 0.04 1.11 7.64 -1.26 -4.88 113.62 113.71 2k47 n SER 47 Ca 0.07 0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.99 2k47 n SER 47 Cb 0.59 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 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 -1.34 -2.00 0.26 1.43 -0.00 -1.26 -4.92 115.22 107.39 2k47 n HIS 48 Ca 0.00 0.28 0.15 0.00 0.46 0.00 0.00 57.72 58.61 2k47 n HIS 48 Cb 0.00 0.93 0.61 0.00 -0.12 0.00 0.00 29.99 31.41 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 0.16 1.57 3.64 -1.98 -3.25 116.57 116.72 2k47 h LYS 49 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 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 0.07 -0.08 0.93 -2.27 0.00 0.00 179.45 178.10 2k47 h GLU 50 N 0.00 -0.21 -0.20 1.90 4.39 -1.98 -3.08 114.58 115.39 2k47 h GLU 50 Ca -0.00 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.75 2k47 h GLU 50 Cb 0.58 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 29.21 2k47 h GLU 50 CO 0.01 0.21 -0.51 0.00 -1.16 0.00 0.00 179.01 177.55 2k47 h ALA 51 N -0.09 -0.77 -0.50 3.43 0.00 -1.91 -2.01 119.26 117.41 2k47 h ALA 51 Ca -0.02 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.94 2k47 h ALA 51 Cb 0.52 0.97 -0.06 0.00 0.00 0.00 0.00 17.79 19.22 2k47 h ALA 51 CO 0.04 -1.03 0.15 0.82 0.00 0.00 0.00 179.25 179.23 2k47 h ILE 52 N -0.51 0.78 -0.69 0.00 1.08 -1.69 -2.14 117.51 114.34 2k47 h ILE 52 Ca 0.06 -0.11 0.20 0.00 -0.39 0.00 0.00 64.86 64.62 2k47 h ILE 52 Cb 0.65 0.45 -0.03 0.00 -3.07 0.00 0.00 36.82 34.82 2k47 h ILE 52 CO -0.47 0.06 0.63 0.25 -0.69 0.00 0.00 178.15 177.93 2k47 h LEU 53 N 0.31 0.00 -1.88 1.44 5.85 -1.27 -0.80 115.31 118.96 2k47 h LEU 53 Ca 0.25 0.00 0.28 0.00 0.84 0.00 0.00 57.88 59.25 2k47 h LEU 53 Cb 0.30 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 2k47 h LEU 53 CO -0.28 0.00 0.71 -0.07 -0.34 0.00 0.00 178.44 178.46 2k47 h LEU 54 N 0.00 0.09 -0.76 2.25 4.07 -1.27 -2.09 115.31 117.59 2k47 h LEU 54 Ca 0.33 0.01 0.15 0.00 0.08 0.00 0.00 57.88 58.45 2k47 h LEU 54 Cb 1.59 -0.00 -0.10 0.00 1.08 0.00 0.00 40.66 43.23 2k47 h LEU 54 CO -0.00 0.02 0.29 1.23 -1.08 0.00 0.00 178.44 178.90 2k47 h GLY 55 N 0.08 1.15 -0.04 0.83 0.00 -1.35 -1.82 103.07 101.92 2k47 h GLY 55 Ca 0.50 -0.14 0.18 0.00 0.00 0.00 0.00 47.33 47.86 2k47 h GLY 55 CO -0.06 -0.12 0.31 1.41 0.00 0.00 0.00 176.54 178.09 2k47 h LEU 56 N 0.43 0.24 -1.11 3.11 3.38 -1.61 0.20 115.31 119.94 2k47 h LEU 56 Ca 0.42 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.52 2k47 h LEU 56 Cb 0.66 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.50 2k47 h LEU 56 CO -0.42 0.03 0.46 0.03 0.09 0.00 0.00 178.44 178.63 2k47 h ARG 57 N 0.39 1.07 -0.17 1.13 -0.00 -1.51 0.30 114.38 115.60 2k47 h ARG 57 Ca 0.47 -0.10 -0.01 0.00 -0.50 0.00 0.00 59.98 59.84 2k47 h ARG 57 Cb 0.81 -0.22 -0.01 0.00 0.00 0.00 0.00 29.97 30.55 2k47 h ARG 57 CO -0.48 0.76 0.08 -0.92 0.00 0.00 0.00 179.97 179.41 2k47 h TYR 58 N 1.09 0.24 0.00 3.04 3.20 -0.58 -2.81 116.97 121.15 2k47 h TYR 58 Ca 0.28 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.14 2k47 h TYR 58 Cb -0.02 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.18 2k47 h TYR 58 CO 0.01 0.27 -0.09 1.63 -1.64 0.00 0.00 178.16 178.33 2k47 n LYS 59 N -4.89 0.01 -2.71 1.82 4.76 -0.59 -4.97 118.16 111.60 2k47 n LYS 59 Ca -0.04 0.01 -0.03 0.00 -2.87 0.00 0.00 58.31 55.38 2k47 n LYS 59 Cb 0.10 -1.51 0.01 0.00 -1.84 0.00 0.00 35.03 31.79 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 -1.54 -1.19 -0.84 1.97 4.76 0.97 -4.99 118.16 117.31 2k47 n LYS 60 Ca 0.07 1.08 -0.05 0.00 -2.87 0.00 0.00 58.31 56.54 2k47 n LYS 60 Cb 0.34 -4.72 -0.05 0.00 -1.84 0.00 0.00 35.03 28.77 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 -1.92 -0.69 0.27 -0.35 -0.00 -0.69 -4.97 117.00 108.64 2k47 n LEU 61 Ca -0.01 -1.40 0.18 0.00 -0.00 0.00 0.00 56.01 54.78 2k47 n LEU 61 Cb 0.53 0.00 0.95 0.00 -0.00 0.00 0.00 43.42 44.90 2k47 n LEU 61 CO 0.41 1.20 1.04 0.22 -0.00 0.00 0.00 177.39 180.27 2k47 h TYR 62 N 0.00 0.00 0.04 1.47 3.20 -1.94 -1.64 116.97 118.10 2k47 h TYR 62 Ca -0.39 0.00 -0.00 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 39.41 2k47 h TYR 62 CO -0.14 0.00 -0.02 -0.91 -1.64 0.00 0.00 178.16 175.45 2k47 h ASN 63 N 0.00 -0.04 0.26 -2.11 2.35 -1.94 -3.38 115.58 110.72 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 0.05 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.43 2k47 h ASN 63 CO 0.00 -0.02 -0.28 0.00 -1.65 0.00 0.00 177.43 175.48 2k47 n GLN 64 N -2.22 0.77 0.19 0.81 6.02 -1.23 -4.12 117.38 117.61 2k47 n GLN 64 Ca -0.01 -0.45 0.03 0.00 -0.01 0.00 0.00 57.00 56.56 2k47 n GLN 64 Cb 0.02 -1.49 0.38 0.00 1.02 0.00 0.00 30.24 30.17 2k47 n GLN 64 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k47 h ALA 65 N 3.62 1.40 0.00 -1.58 0.00 -1.46 0.76 119.26 121.99 2k47 h ALA 65 Ca 0.00 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 2k47 h ALA 65 Cb 0.51 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2k47 h ALA 65 CO 0.00 0.43 -0.72 0.00 0.00 0.00 0.00 179.25 178.97 2k47 h ARG 66 N 0.00 0.00 0.13 0.00 3.08 -1.74 -2.77 114.38 113.07 2k47 h ARG 66 Ca -0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.69 2k47 h ARG 66 Cb 0.63 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 2k47 h ARG 66 CO 0.05 0.59 -1.91 -0.39 -1.07 0.00 0.00 179.97 177.24 2k47 h VAL 67 N 0.00 0.70 -0.11 2.04 -1.51 -1.71 -3.38 116.25 112.28 2k47 h VAL 67 Ca -0.02 -2.36 -0.14 0.00 -1.23 0.00 0.00 66.70 62.94 2k47 h VAL 67 Cb 1.50 2.54 -0.01 0.00 -2.13 0.00 0.00 31.29 33.19 2k47 h VAL 67 CO 0.08 0.86 -0.56 0.11 -1.23 0.00 0.00 177.57 176.84 2k47 h LYS 68 N 0.01 0.34 -6.26 5.19 1.79 -0.99 -3.45 116.57 113.20 2k47 h LYS 68 Ca -0.40 -0.21 -0.60 0.00 -2.18 0.00 0.00 60.65 57.25 2k47 h LYS 68 Cb 2.00 0.03 -0.16 0.00 -1.58 0.00 0.00 32.23 32.52 2k47 h LYS 68 CO 0.09 0.81 -0.78 0.71 -1.08 0.00 0.00 179.45 179.19 2k47 s TYR 69 N -3.89 2.21 -0.87 -1.35 2.02 -1.05 -2.56 117.35 111.86 2k47 s TYR 69 Ca -0.05 -0.37 -0.25 0.00 -0.37 0.00 0.00 57.07 56.03 2k47 s TYR 69 Cb 0.12 -1.01 0.04 0.00 -0.40 0.00 0.00 41.96 40.70 2k47 s TYR 69 CO 0.81 0.59 1.38 0.45 -1.57 0.00 0.00 175.55 177.21 2k47 s SER 70 N -3.16 6.29 0.00 2.29 0.15 -0.78 -4.47 113.70 114.02 2k47 s SER 70 Ca 0.25 -0.92 0.00 0.00 0.70 0.00 0.00 55.95 55.99 2k47 s SER 70 Cb -0.06 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2k47 s SER 70 CO 0.12 -1.71 0.00 0.18 1.20 0.00 0.00 173.24 173.04 2k47 n LEU 71 N 9.27 0.00 -4.34 3.45 4.32 -1.26 -4.36 117.00 124.08 2k47 n LEU 71 Ca 0.18 0.00 -0.46 0.00 -0.02 0.00 0.00 56.01 55.71 2k47 n LEU 71 Cb 0.50 -0.07 -0.04 0.00 -1.62 0.00 0.00 43.42 42.20 2k47 n LEU 71 CO 0.68 -0.44 0.35 -0.76 -1.22 0.00 0.00 177.39 176.01 2k47 s LEU 72 N -4.65 6.25 0.00 2.23 2.01 -1.26 -5.09 118.68 118.17 2k47 s LEU 72 Ca 0.00 -2.14 0.11 0.00 0.01 0.00 0.00 54.13 52.11 2k47 s LEU 72 Cb 0.00 -2.23 0.09 0.00 0.01 0.00 0.00 46.19 44.05 2k47 s LEU 72 CO 0.00 -0.79 0.85 -0.62 1.01 0.00 0.00 176.35 176.80