#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 5.26 0.34 4.04 2.15 -1.26 -4.78 116.67 122.43 2k47 s ASP 2 Ca 0.00 -0.32 0.02 0.00 0.43 0.00 0.00 52.55 52.68 2k47 s ASP 2 Cb 0.00 -1.27 0.62 0.00 -0.30 0.00 0.00 42.92 41.98 2k47 s ASP 2 CO 0.00 -0.00 1.99 1.62 -0.17 0.00 0.00 175.17 178.61 2k47 h VAL 3 N 1.75 1.14 0.07 1.11 3.04 -0.09 -1.18 116.25 122.09 2k47 h VAL 3 Ca -0.47 -0.30 -0.28 0.00 -1.01 0.00 0.00 66.70 64.64 2k47 h VAL 3 Cb 1.23 0.17 0.02 0.00 -2.01 0.00 0.00 31.29 30.71 2k47 h VAL 3 CO 0.61 0.16 -1.15 -0.25 -1.01 0.00 0.00 177.57 175.93 2k47 h TRP 4 N 0.89 0.89 0.29 3.17 2.91 -1.95 -3.19 115.95 118.95 2k47 h TRP 4 Ca 0.26 -0.54 -0.01 0.00 1.13 0.00 0.00 58.89 59.74 2k47 h TRP 4 Cb -0.03 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 28.54 2k47 h TRP 4 CO -0.00 1.38 -0.20 0.77 -1.03 0.00 0.00 178.44 179.35 2k47 h SER 5 N 0.27 -0.52 -1.91 2.65 0.02 -1.83 -3.08 113.55 109.15 2k47 h SER 5 Ca -0.15 0.04 -0.79 0.00 -0.84 0.00 0.00 61.79 60.05 2k47 h SER 5 Cb 1.81 0.16 -0.22 0.00 0.14 0.00 0.00 62.40 64.30 2k47 h SER 5 CO 0.21 -0.32 1.49 0.18 -1.14 0.00 0.00 176.83 177.26 2k47 n LEU 6 N -5.33 7.53 -1.07 5.07 4.77 -0.49 -4.63 117.00 122.85 2k47 n LEU 6 Ca -0.09 -5.20 0.11 0.00 -0.03 0.00 0.00 56.01 50.79 2k47 n LEU 6 Cb 0.24 -1.24 0.26 0.00 -2.33 0.00 0.00 43.42 40.35 2k47 n LEU 6 CO 0.32 2.02 0.73 -1.54 -1.33 0.00 0.00 177.39 177.59 2k47 n SER 7 N 0.67 3.18 -1.90 -1.43 3.41 -1.17 -4.19 113.62 112.19 2k47 n SER 7 Ca 0.51 -1.96 -0.01 0.00 -0.26 0.00 0.00 58.87 57.15 2k47 n SER 7 Cb 0.26 -0.28 0.33 0.00 -0.26 0.00 0.00 64.21 64.26 2k47 n SER 7 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2k47 n LYS 8 N 1.28 4.00 -3.84 4.33 4.76 -1.26 -0.30 118.16 127.13 2k47 n LYS 8 Ca 0.20 -3.11 -0.36 0.00 -2.87 0.00 0.00 58.31 52.16 2k47 n LYS 8 Cb 0.54 -2.21 -0.13 0.00 -1.84 0.00 0.00 35.03 31.39 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 -2.93 3.61 0.43 -0.18 -4.23 -1.26 -5.00 115.64 106.08 2k47 s THR 9 Ca 0.54 -0.68 0.08 0.00 -1.18 0.00 0.00 61.69 60.45 2k47 s THR 9 Cb 0.43 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 71.48 2k47 s THR 9 CO 0.14 0.21 0.51 -0.94 -0.54 0.00 0.00 174.62 174.00 2k47 s SER 10 N 1.46 5.40 0.00 3.99 1.04 -1.26 -4.20 113.70 120.13 2k47 s SER 10 Ca 0.03 -0.57 0.01 0.00 0.48 0.00 0.00 55.95 55.90 2k47 s SER 10 Cb -0.16 -0.55 -0.00 0.00 0.10 0.00 0.00 66.02 65.40 2k47 s SER 10 CO -0.00 -0.76 -0.04 -0.32 0.98 0.00 0.00 173.24 173.09 2k47 s MET 11 N -4.29 0.32 -0.18 4.02 1.75 -1.19 -4.97 119.30 114.75 2k47 s MET 11 Ca 0.53 -0.18 -0.22 0.00 -1.25 0.00 0.00 55.69 54.56 2k47 s MET 11 Cb -0.07 -0.28 -0.02 0.00 2.84 0.00 0.00 34.83 37.29 2k47 s MET 11 CO 0.31 0.08 0.68 0.99 -0.65 0.00 0.00 175.02 176.43 2k47 s THR 12 N -0.20 5.00 -0.01 10.11 2.01 -1.26 -3.85 115.64 127.44 2k47 s THR 12 Ca 0.00 1.31 0.01 0.00 0.31 0.00 0.00 61.69 63.32 2k47 s THR 12 Cb -0.02 -3.99 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 2k47 s THR 12 CO -0.00 0.11 0.02 -0.36 -0.69 0.00 0.00 174.62 173.70 2k47 s PHE 13 N 1.82 3.13 -0.09 4.92 0.08 0.20 -4.96 117.98 123.08 2k47 s PHE 13 Ca 0.32 0.12 0.03 0.00 0.12 0.00 0.00 56.93 57.51 2k47 s PHE 13 Cb -0.16 -1.69 -0.01 0.00 -0.57 0.00 0.00 43.02 40.58 2k47 s PHE 13 CO 0.12 0.48 -0.18 -1.14 -0.10 0.00 0.00 175.22 174.40 2k47 s GLN 14 N -1.54 2.99 0.51 0.44 0.74 -1.26 -1.87 119.66 119.67 2k47 s GLN 14 Ca 0.20 -0.77 -0.20 0.00 0.05 0.00 0.00 55.36 54.63 2k47 s GLN 14 Cb -0.12 -2.42 -0.07 0.00 1.10 0.00 0.00 33.01 31.50 2k47 s GLN 14 CO 0.10 0.32 1.13 -1.25 -0.55 0.00 0.00 175.29 175.04 2k47 s PRO 15 N 0.04 3.52 0.16 1.67 0.04 -1.26 -1.43 135.00 137.74 2k47 s PRO 15 Ca -0.07 1.62 -0.06 0.00 0.04 0.00 0.00 61.00 62.53 2k47 s PRO 15 Cb -0.15 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.29 2k47 s PRO 15 CO 0.05 -0.71 1.44 0.87 0.04 0.00 0.00 177.00 178.68 2k47 h LYS 16 N 1.47 0.63 -6.05 4.56 1.79 -1.88 -3.46 116.57 113.63 2k47 h LYS 16 Ca -0.50 -0.44 -0.60 0.00 -2.18 0.00 0.00 60.65 56.93 2k47 h LYS 16 Cb 1.25 0.07 -0.12 0.00 -1.58 0.00 0.00 32.23 31.85 2k47 h LYS 16 CO 0.58 1.06 -0.67 -1.59 -1.08 0.00 0.00 179.45 177.76 2k47 s LYS 17 N -3.91 1.95 0.42 3.15 -2.85 -1.26 -5.04 119.74 112.20 2k47 s LYS 17 Ca -0.08 -1.77 0.11 0.00 -1.00 0.00 0.00 55.97 53.23 2k47 s LYS 17 Cb 0.10 -1.86 0.90 0.00 -2.06 0.00 0.00 37.83 34.92 2k47 s LYS 17 CO 0.86 0.20 1.97 0.00 0.10 0.00 0.00 175.35 178.48 2k47 h ALA 18 N 1.97 1.62 -0.55 0.59 0.00 -2.02 -2.86 119.26 118.00 2k47 h ALA 18 Ca -0.42 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.34 2k47 h ALA 18 Cb 1.25 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 2k47 h ALA 18 CO 0.66 0.28 0.35 0.77 0.00 0.00 0.00 179.25 181.31 2k47 h SER 19 N 0.16 0.60 -4.26 0.00 0.02 -1.98 -3.43 113.55 104.65 2k47 h SER 19 Ca 0.03 -0.01 -0.51 0.00 -0.84 0.00 0.00 61.79 60.46 2k47 h SER 19 Cb 0.29 -0.14 0.12 0.00 0.14 0.00 0.00 62.40 62.82 2k47 h SER 19 CO 0.02 0.43 0.34 -0.76 -1.14 0.00 0.00 176.83 175.71 2k47 s LEU 20 N -10.17 3.18 -0.04 5.07 1.43 -1.08 -5.06 118.68 112.01 2k47 s LEU 20 Ca -0.13 1.91 0.07 0.00 -1.03 0.00 0.00 54.13 54.95 2k47 s LEU 20 Cb 0.13 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.80 2k47 s LEU 20 CO 0.75 -1.89 -0.25 -1.58 0.23 0.00 0.00 176.35 173.61 2k47 s GLN 21 N -4.55 2.33 0.60 1.70 0.74 -1.26 -4.79 119.66 114.44 2k47 s GLN 21 Ca 0.64 -0.92 -0.18 0.00 0.05 0.00 0.00 55.36 54.95 2k47 s GLN 21 Cb -0.19 -2.10 -0.05 0.00 1.10 0.00 0.00 33.01 31.77 2k47 s GLN 21 CO 0.50 0.47 0.92 -2.30 -0.55 0.00 0.00 175.29 174.34 2k47 n PRO 22 N 2.68 0.84 -4.34 1.67 -0.02 -1.26 -4.68 135.00 129.89 2k47 n PRO 22 Ca -0.17 0.33 -0.29 0.00 -2.02 0.00 0.00 63.50 61.35 2k47 n PRO 22 Cb 0.51 -2.13 -0.12 0.00 -0.02 0.00 0.00 33.50 31.75 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 -1.84 2.59 -0.41 2.45 2.96 -0.78 -4.93 118.68 118.71 2k47 s LEU 23 Ca 0.76 -0.65 0.06 0.00 -0.22 0.00 0.00 54.13 54.08 2k47 s LEU 23 Cb -0.42 -1.42 0.17 0.00 0.50 0.00 0.00 46.19 45.03 2k47 s LEU 23 CO 0.47 0.17 0.55 -0.89 -1.32 0.00 0.00 176.35 175.33 2k47 s THR 24 N -1.23 -0.74 0.15 3.68 2.01 -1.26 0.60 115.64 118.85 2k47 s THR 24 Ca 0.18 -0.52 0.04 0.00 0.31 0.00 0.00 61.69 61.69 2k47 s THR 24 Cb -0.10 -0.25 -0.04 0.00 0.01 0.00 0.00 72.50 72.11 2k47 s THR 24 CO 0.09 -0.23 -0.09 -0.51 -0.69 0.00 0.00 174.62 173.20 2k47 s ILE 25 N 1.53 1.08 0.46 1.82 2.07 -1.25 -4.89 121.20 122.02 2k47 s ILE 25 Ca 0.19 -2.04 0.04 0.00 -1.41 0.00 0.00 60.65 57.43 2k47 s ILE 25 Cb -0.07 -1.87 -0.04 0.00 0.13 0.00 0.00 42.46 40.60 2k47 s ILE 25 CO -0.06 -0.72 0.03 -0.55 -1.91 0.00 0.00 174.94 171.73 2k47 s SER 26 N -3.16 4.06 0.04 4.50 0.15 -1.26 -3.19 113.70 114.84 2k47 s SER 26 Ca 0.17 -1.47 -0.23 0.00 0.70 0.00 0.00 55.95 55.12 2k47 s SER 26 Cb 0.03 0.04 -0.12 0.00 -1.71 0.00 0.00 66.02 64.26 2k47 s SER 26 CO 0.01 -0.66 1.35 -0.07 1.20 0.00 0.00 173.24 175.06 2k47 h LEU 27 N 1.52 -0.74 -1.63 3.45 3.38 -1.70 -1.68 115.31 117.90 2k47 h LEU 27 Ca -0.44 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.55 2k47 h LEU 27 Cb 1.28 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.22 2k47 h LEU 27 CO 0.76 -0.49 -0.00 -0.78 0.09 0.00 0.00 178.44 178.02 2k47 h ASP 28 N -0.79 0.20 0.10 -0.43 3.58 -0.98 -1.20 116.42 116.91 2k47 h ASP 28 Ca -0.07 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.35 2k47 h ASP 28 Cb 0.62 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.62 2k47 h ASP 28 CO 0.10 0.25 0.00 -0.62 -2.88 0.00 0.00 179.24 176.09 2k47 n GLU 29 N -4.40 0.87 -0.04 0.28 4.71 -1.16 -3.62 120.64 117.26 2k47 n GLU 29 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 2k47 n GLU 29 Cb 0.17 -1.50 0.01 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 -1.05 0.71 -3.90 -4.62 7.94 -0.51 -4.76 117.00 110.81 2k47 n LEU 30 Ca 0.21 -0.82 -0.11 0.00 -1.11 0.00 0.00 56.01 54.18 2k47 n LEU 30 Cb 0.13 -0.02 -0.13 0.00 0.53 0.00 0.00 43.42 43.93 2k47 n LEU 30 CO 0.18 0.20 -0.36 -0.36 -1.11 0.00 0.00 177.39 175.95 2k47 s PHE 31 N -0.43 0.08 -0.13 1.96 0.08 -0.88 -4.96 117.98 113.70 2k47 s PHE 31 Ca 0.01 -0.16 0.22 0.00 0.12 0.00 0.00 56.93 57.12 2k47 s PHE 31 Cb 0.01 -0.06 0.46 0.00 -0.57 0.00 0.00 43.02 42.86 2k47 s PHE 31 CO 0.00 -0.06 1.16 0.43 -0.10 0.00 0.00 175.22 176.65 2k47 n SER 32 N 2.61 1.54 -3.62 1.36 7.64 -1.26 -4.83 113.62 117.06 2k47 n SER 32 Ca -0.16 -2.34 -0.13 0.00 1.01 0.00 0.00 58.87 57.25 2k47 n SER 32 Cb 0.58 -0.39 -0.07 0.00 -1.01 0.00 0.00 64.21 63.33 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 -2.82 -0.65 0.01 6.43 0.15 -1.26 -5.04 113.70 110.52 2k47 s SER 33 Ca 0.33 1.18 -0.25 0.00 0.70 0.00 0.00 55.95 57.92 2k47 s SER 33 Cb 0.37 1.17 -0.17 0.00 -1.71 0.00 0.00 66.02 65.68 2k47 s SER 33 CO -0.10 -0.27 1.28 0.03 1.20 0.00 0.00 173.24 175.38 2k47 h ARG 34 N 4.48 -0.31 -0.47 5.44 2.47 -2.00 -2.73 114.38 121.25 2k47 h ARG 34 Ca -0.28 0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.44 2k47 h ARG 34 Cb 1.16 0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.53 2k47 h ARG 34 CO 0.11 0.01 0.20 0.78 0.56 0.00 0.00 179.97 181.63 2k47 h GLY 35 N -0.66 0.71 0.70 0.04 0.00 -2.00 -2.42 103.07 99.45 2k47 h GLY 35 Ca -0.03 -0.34 0.06 0.00 0.00 0.00 0.00 47.33 47.02 2k47 h GLY 35 CO 0.05 0.32 0.40 -2.09 0.00 0.00 0.00 176.54 175.23 2k47 h GLU 36 N 0.67 0.73 -0.80 4.80 4.81 -1.95 -1.57 114.58 121.26 2k47 h GLU 36 Ca 0.16 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2k47 h GLU 36 Cb 0.12 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 2k47 h GLU 36 CO -0.02 0.48 0.41 0.35 -0.73 0.00 0.00 179.01 179.50 2k47 h PHE 37 N 0.75 1.11 0.27 0.92 3.57 -1.12 -2.79 116.94 119.65 2k47 h PHE 37 Ca 0.31 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.78 2k47 h PHE 37 Cb 0.17 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 2k47 h PHE 37 CO -0.07 0.78 -0.33 0.82 -2.23 0.00 0.00 178.31 177.29 2k47 h ILE 38 N 1.12 0.31 0.15 1.41 1.08 -1.08 -1.42 117.51 119.07 2k47 h ILE 38 Ca 0.28 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.74 2k47 h ILE 38 Cb 0.06 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.12 2k47 h ILE 38 CO -0.04 0.00 -0.15 0.28 -0.69 0.00 0.00 178.15 177.55 2k47 h SER 39 N -0.65 -0.41 -1.00 1.72 0.02 -1.36 -2.90 113.55 108.97 2k47 h SER 39 Ca -0.01 0.03 0.36 0.00 -0.84 0.00 0.00 61.79 61.34 2k47 h SER 39 Cb 0.61 0.13 -0.12 0.00 0.14 0.00 0.00 62.40 63.17 2k47 h SER 39 CO -0.10 -0.20 0.62 1.33 -1.14 0.00 0.00 176.83 177.34 2k47 n VAL 40 N -3.21 -0.23 0.00 2.27 0.24 -1.06 -4.63 118.33 111.71 2k47 n VAL 40 Ca -0.04 1.45 0.00 0.00 -2.04 0.00 0.00 64.34 63.71 2k47 n VAL 40 Cb 0.14 -2.37 0.00 0.00 -1.47 0.00 0.00 33.84 30.14 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 -1.35 0.44 2.93 7.63 0.00 -1.10 -4.78 105.19 108.97 2k47 n GLY 41 Ca 0.31 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.65 2.14 0.00 -0.02 0.00 -0.55 -4.95 107.32 103.29 2k47 s GLY 42 Ca 0.00 -2.90 0.00 0.00 0.00 0.00 0.00 44.72 41.82 2k47 s GLY 42 CO 0.00 1.08 0.00 1.22 0.00 0.00 0.00 173.10 175.40 2k47 n ASP 43 N 3.59 0.00 0.00 1.64 9.92 -1.26 -4.26 116.55 126.17 2k47 n ASP 43 Ca 0.05 0.09 0.00 0.00 -0.53 0.00 0.00 54.79 54.39 2k47 n ASP 43 Cb 0.36 -0.11 0.00 0.00 -0.64 0.00 0.00 41.12 40.73 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 -1.05 3.48 0.44 0.00 -1.26 -4.98 105.19 104.19 2k47 n GLY 44 Ca 0.00 0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.70 3.21 0.57 1.61 0.52 -1.26 0.68 118.95 123.57 2k47 s ARG 45 Ca 0.00 -0.64 -0.06 0.00 -0.52 0.00 0.00 55.73 54.51 2k47 s ARG 45 Cb 0.00 -4.08 -0.00 0.00 0.52 0.00 0.00 34.95 31.39 2k47 s ARG 45 CO 0.00 -1.32 0.88 1.41 0.02 0.00 0.00 175.30 176.29 2k47 s MET 46 N 3.15 3.06 0.00 3.54 1.75 -1.26 -4.94 119.30 124.61 2k47 s MET 46 Ca 0.21 0.06 0.00 0.00 -1.25 0.00 0.00 55.69 54.71 2k47 s MET 46 Cb -0.17 -2.29 0.00 0.00 2.84 0.00 0.00 34.83 35.22 2k47 s MET 46 CO 0.15 -0.60 0.00 0.45 -0.65 0.00 0.00 175.02 174.37 2k47 n SER 47 N -2.52 0.00 0.00 1.11 2.88 -1.26 -4.94 113.62 108.89 2k47 n SER 47 Ca 0.04 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 2k47 n SER 47 Cb 0.57 -0.44 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 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 -2.02 0.00 0.14 0.66 -0.00 -1.26 -4.94 115.22 107.80 2k47 n HIS 48 Ca 0.00 0.00 -0.00 0.00 0.46 0.00 0.00 57.72 58.18 2k47 n HIS 48 Cb 0.00 0.00 0.16 0.00 -0.12 0.00 0.00 29.99 30.03 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 -0.24 1.57 1.79 -1.99 -3.28 116.57 114.43 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 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 2k47 h LYS 49 CO 0.00 0.60 0.08 1.49 -1.08 0.00 0.00 179.45 180.55 2k47 h GLU 50 N 0.00 0.36 0.29 3.15 4.22 -1.98 -2.15 114.58 118.48 2k47 h GLU 50 Ca -0.01 -0.07 -0.00 0.00 0.08 0.00 0.00 59.36 59.36 2k47 h GLU 50 Cb 1.17 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 2k47 h GLU 50 CO 0.08 0.43 -0.49 0.00 -2.18 0.00 0.00 179.01 176.86 2k47 h ALA 51 N 0.91 -1.05 -0.20 2.92 0.00 -1.92 -2.01 119.26 117.91 2k47 h ALA 51 Ca 0.08 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2k47 h ALA 51 Cb 0.21 0.79 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2k47 h ALA 51 CO -0.00 -1.13 0.08 0.82 0.00 0.00 0.00 179.25 179.01 2k47 h ILE 52 N -0.83 0.96 -0.76 0.00 1.08 -1.67 -2.45 117.51 113.85 2k47 h ILE 52 Ca -0.03 -0.06 0.22 0.00 -0.39 0.00 0.00 64.86 64.60 2k47 h ILE 52 Cb 0.77 0.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.26 2k47 h ILE 52 CO -0.16 0.03 0.60 0.25 -0.69 0.00 0.00 178.15 178.18 2k47 h LEU 53 N 0.18 0.00 -1.99 1.44 5.85 -1.12 -0.15 115.31 119.51 2k47 h LEU 53 Ca 0.09 0.00 0.25 0.00 0.84 0.00 0.00 57.88 59.06 2k47 h LEU 53 Cb 0.05 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2k47 h LEU 53 CO -0.08 0.00 0.64 -0.07 -0.34 0.00 0.00 178.44 178.59 2k47 h LEU 54 N 0.00 0.00 -0.90 2.25 4.07 -0.86 -1.79 115.31 118.08 2k47 h LEU 54 Ca 0.36 0.00 0.18 0.00 0.08 0.00 0.00 57.88 58.50 2k47 h LEU 54 Cb 1.56 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 43.19 2k47 h LEU 54 CO -0.00 0.00 0.46 1.23 -1.08 0.00 0.00 178.44 179.05 2k47 h GLY 55 N 0.00 1.52 0.10 0.83 0.00 -1.20 -1.40 103.07 102.93 2k47 h GLY 55 Ca 0.41 -0.25 0.16 0.00 0.00 0.00 0.00 47.33 47.66 2k47 h GLY 55 CO -0.00 -0.12 0.39 1.41 0.00 0.00 0.00 176.54 178.22 2k47 h LEU 56 N 0.58 0.41 -1.16 3.11 3.38 -1.55 0.18 115.31 120.26 2k47 h LEU 56 Ca 0.52 0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.56 2k47 h LEU 56 Cb 0.84 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 2k47 h LEU 56 CO -0.42 0.14 0.13 0.03 0.09 0.00 0.00 178.44 178.41 2k47 h ARG 57 N 0.52 0.71 0.07 1.13 2.47 -1.44 0.33 114.38 118.18 2k47 h ARG 57 Ca 0.47 -0.13 -0.00 0.00 -1.26 0.00 0.00 59.98 59.06 2k47 h ARG 57 Cb 0.74 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.94 2k47 h ARG 57 CO -0.41 0.64 -0.04 -0.92 0.56 0.00 0.00 179.97 179.80 2k47 h TYR 58 N 0.70 -0.09 0.00 3.04 3.20 -0.61 -3.01 116.97 120.20 2k47 h TYR 58 Ca 0.16 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2k47 h TYR 58 Cb 0.24 0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.54 2k47 h TYR 58 CO 0.01 0.17 0.00 1.63 -1.64 0.00 0.00 178.16 178.33 2k47 n LYS 59 N -5.01 0.02 -2.70 1.82 4.76 -0.28 -4.96 118.16 111.81 2k47 n LYS 59 Ca -0.08 0.06 -0.00 0.00 -2.87 0.00 0.00 58.31 55.42 2k47 n LYS 59 Cb 0.17 -1.53 0.00 0.00 -1.84 0.00 0.00 35.03 31.83 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 -1.03 -0.84 1.97 4.76 0.10 -4.99 118.16 116.57 2k47 n LYS 60 Ca 0.06 1.26 -0.04 0.00 -2.87 0.00 0.00 58.31 56.72 2k47 n LYS 60 Cb 0.32 -4.78 -0.04 0.00 -1.84 0.00 0.00 35.03 28.69 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 -1.61 -0.60 0.31 -0.35 -0.00 -0.57 -4.98 117.00 109.20 2k47 n LEU 61 Ca -0.00 -1.21 0.19 0.00 -0.00 0.00 0.00 56.01 54.99 2k47 n LEU 61 Cb 0.50 0.02 1.03 0.00 -0.00 0.00 0.00 43.42 44.97 2k47 n LEU 61 CO 0.41 1.10 1.16 0.22 -0.00 0.00 0.00 177.39 180.28 2k47 h TYR 62 N 0.02 0.00 0.14 1.47 3.20 -1.95 0.27 116.97 120.12 2k47 h TYR 62 Ca -0.33 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.53 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 -0.07 -0.97 -1.64 0.00 0.00 178.16 175.37 2k47 h ASN 63 N 0.00 -0.15 0.14 -2.11 -1.24 -1.94 -3.35 115.58 106.93 2k47 h ASN 63 Ca 0.02 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.03 2k47 h ASN 63 Cb 0.25 0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.34 2k47 h ASN 63 CO -0.00 -0.07 -0.42 0.00 -1.29 0.00 0.00 177.43 175.65 2k47 n GLN 64 N -2.70 0.86 0.04 6.67 6.02 -1.20 -4.11 117.38 122.97 2k47 n GLN 64 Ca -0.02 -0.62 -0.14 0.00 -0.01 0.00 0.00 57.00 56.21 2k47 n GLN 64 Cb 0.07 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.81 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 3.66 0.40 0.00 -1.58 0.00 -1.11 0.37 119.26 121.00 2k47 h ALA 65 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2k47 h ALA 65 Cb 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2k47 h ALA 65 CO 0.00 0.76 -0.15 -0.09 0.00 0.00 0.00 179.25 179.77 2k47 h ARG 66 N 0.32 0.00 0.04 0.00 2.43 -1.74 -3.08 114.38 112.34 2k47 h ARG 66 Ca -0.07 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.78 2k47 h ARG 66 Cb 1.48 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.99 2k47 h ARG 66 CO 0.16 0.00 -1.78 0.28 -1.51 0.00 0.00 179.97 177.12 2k47 n VAL 67 N -2.78 1.61 0.25 0.20 0.31 -1.19 -4.16 118.33 112.57 2k47 n VAL 67 Ca 0.04 -0.31 0.12 0.00 -0.01 0.00 0.00 64.34 64.17 2k47 n VAL 67 Cb 0.50 -1.88 0.65 0.00 -0.91 0.00 0.00 33.84 32.21 2k47 n VAL 67 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2k47 h LYS 68 N -0.59 0.00 -6.10 5.55 1.79 -1.05 -3.44 116.57 112.72 2k47 h LYS 68 Ca -0.44 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.44 2k47 h LYS 68 Cb 1.62 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 32.13 2k47 h LYS 68 CO -0.14 0.16 -0.75 0.71 -1.08 0.00 0.00 179.45 178.34 2k47 s TYR 69 N -4.07 2.21 -0.93 -1.35 2.02 -1.16 -2.82 117.35 111.23 2k47 s TYR 69 Ca -0.02 -0.37 -0.24 0.00 -0.37 0.00 0.00 57.07 56.07 2k47 s TYR 69 Cb 0.13 -0.97 0.05 0.00 -0.40 0.00 0.00 41.96 40.76 2k47 s TYR 69 CO 0.60 0.66 1.39 0.45 -1.57 0.00 0.00 175.55 177.08 2k47 s SER 70 N -3.48 6.40 0.00 2.29 0.15 -0.51 -4.67 113.70 113.87 2k47 s SER 70 Ca 0.29 -1.18 0.00 0.00 0.70 0.00 0.00 55.95 55.76 2k47 s SER 70 Cb -0.04 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2k47 s SER 70 CO 0.14 -1.59 0.00 0.18 1.20 0.00 0.00 173.24 173.17 2k47 n LEU 71 N 8.94 0.00 -4.26 3.45 4.32 -1.26 -4.31 117.00 123.88 2k47 n LEU 71 Ca 0.24 0.00 -0.35 0.00 -0.02 0.00 0.00 56.01 55.88 2k47 n LEU 71 Cb 0.50 -0.08 -0.14 0.00 -1.62 0.00 0.00 43.42 42.08 2k47 n LEU 71 CO 0.67 -0.39 -0.41 -0.76 -1.22 0.00 0.00 177.39 175.28 2k47 s LEU 72 N -4.40 2.86 0.00 2.23 2.01 -1.26 -5.10 118.68 115.02 2k47 s LEU 72 Ca 0.00 -0.55 0.00 0.00 0.01 0.00 0.00 54.13 53.59 2k47 s LEU 72 Cb 0.00 -1.69 0.00 0.00 0.01 0.00 0.00 46.19 44.51 2k47 s LEU 72 CO 0.00 -0.05 0.07 -0.62 1.01 0.00 0.00 176.35 176.76