#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 5.48 0.25 -3.46 2.15 -1.26 -4.75 116.67 115.07 2k47 s ASP 2 Ca 0.00 -0.16 -0.01 0.00 0.43 0.00 0.00 52.55 52.81 2k47 s ASP 2 Cb 0.00 -1.41 0.29 0.00 -0.30 0.00 0.00 42.92 41.50 2k47 s ASP 2 CO 0.00 0.06 1.67 1.62 -0.17 0.00 0.00 175.17 178.35 2k47 h VAL 3 N 2.01 1.27 0.13 1.11 3.04 -0.37 -1.45 116.25 121.99 2k47 h VAL 3 Ca -0.48 -1.32 -0.29 0.00 -1.01 0.00 0.00 66.70 63.60 2k47 h VAL 3 Cb 1.20 1.30 0.02 0.00 -2.01 0.00 0.00 31.29 31.81 2k47 h VAL 3 CO 0.63 0.43 -1.25 -0.25 -1.01 0.00 0.00 177.57 176.12 2k47 h TRP 4 N 0.54 0.90 0.26 3.17 2.91 -1.91 -3.33 115.95 118.49 2k47 h TRP 4 Ca 0.08 -0.58 -0.01 0.00 1.13 0.00 0.00 58.89 59.50 2k47 h TRP 4 Cb 0.72 -0.07 0.00 0.00 -0.51 0.00 0.00 29.16 29.30 2k47 h TRP 4 CO 0.03 1.43 -0.12 1.03 -1.03 0.00 0.00 178.44 179.77 2k47 h SER 5 N 0.23 -0.29 -2.79 2.65 0.87 -1.93 -3.33 113.55 108.96 2k47 h SER 5 Ca -0.18 -0.07 -0.75 0.00 -1.23 0.00 0.00 61.79 59.56 2k47 h SER 5 Cb 1.92 0.08 -0.21 0.00 -0.44 0.00 0.00 62.40 63.75 2k47 h SER 5 CO 0.23 -0.11 0.86 -0.76 -0.53 0.00 0.00 176.83 176.52 2k47 s LEU 6 N -9.93 5.61 0.00 2.23 1.43 -0.55 -4.71 118.68 112.75 2k47 s LEU 6 Ca -0.15 -2.94 0.07 0.00 -1.03 0.00 0.00 54.13 50.08 2k47 s LEU 6 Cb 0.04 -2.33 0.12 0.00 0.03 0.00 0.00 46.19 44.06 2k47 s LEU 6 CO 0.63 -0.66 0.94 -1.20 0.23 0.00 0.00 176.35 176.28 2k47 n SER 7 N 4.83 2.08 0.02 2.29 7.64 -1.25 -4.53 113.62 124.69 2k47 n SER 7 Ca 0.28 -1.65 0.11 0.00 1.01 0.00 0.00 58.87 58.62 2k47 n SER 7 Cb 0.44 -0.07 0.06 0.00 -1.01 0.00 0.00 64.21 63.63 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 0.25 0.17 -2.30 1.43 4.76 -1.26 0.59 118.16 121.79 2k47 n LYS 8 Ca 0.06 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.07 2k47 n LYS 8 Cb 0.27 -1.56 -0.02 0.00 -1.84 0.00 0.00 35.03 31.88 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 -3.11 3.86 0.49 -0.18 -4.23 -1.26 -4.81 115.64 106.39 2k47 s THR 9 Ca 0.06 0.89 0.01 0.00 -1.18 0.00 0.00 61.69 61.48 2k47 s THR 9 Cb 0.15 -4.11 0.01 0.00 1.34 0.00 0.00 72.50 69.90 2k47 s THR 9 CO 0.78 -0.67 0.71 -0.94 -0.54 0.00 0.00 174.62 173.96 2k47 s SER 10 N 4.11 5.56 -0.00 3.99 1.04 -1.26 -4.27 113.70 122.87 2k47 s SER 10 Ca 0.64 0.09 0.02 0.00 0.48 0.00 0.00 55.95 57.17 2k47 s SER 10 Cb -0.15 -1.16 -0.01 0.00 0.10 0.00 0.00 66.02 64.80 2k47 s SER 10 CO 0.32 -0.91 -0.06 -0.32 0.98 0.00 0.00 173.24 173.25 2k47 s MET 11 N -4.63 0.46 -0.26 4.02 1.75 -1.12 -4.93 119.30 114.59 2k47 s MET 11 Ca 0.53 -0.25 -0.16 0.00 -1.25 0.00 0.00 55.69 54.56 2k47 s MET 11 Cb -0.10 -0.43 -0.03 0.00 2.84 0.00 0.00 34.83 37.11 2k47 s MET 11 CO 0.38 0.11 0.44 0.99 -0.65 0.00 0.00 175.02 176.29 2k47 s THR 12 N -0.24 5.13 -0.01 10.11 2.01 -1.26 -3.48 115.64 127.90 2k47 s THR 12 Ca 0.01 0.73 -0.03 0.00 0.31 0.00 0.00 61.69 62.72 2k47 s THR 12 Cb -0.03 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 2k47 s THR 12 CO -0.00 0.13 0.18 -0.36 -0.69 0.00 0.00 174.62 173.88 2k47 s PHE 13 N 2.12 3.54 -0.15 4.92 0.08 0.17 -4.94 117.98 123.72 2k47 s PHE 13 Ca 0.18 0.36 -0.00 0.00 0.12 0.00 0.00 56.93 57.59 2k47 s PHE 13 Cb -0.16 -1.83 -0.01 0.00 -0.57 0.00 0.00 43.02 40.46 2k47 s PHE 13 CO 0.09 0.65 -0.14 1.14 -0.10 0.00 0.00 175.22 176.86 2k47 s GLN 14 N -1.91 3.27 0.48 0.44 -2.07 -1.26 -2.20 119.66 116.41 2k47 s GLN 14 Ca 0.27 -0.72 -0.23 0.00 -1.82 0.00 0.00 55.36 52.85 2k47 s GLN 14 Cb -0.13 -2.65 -0.07 0.00 -1.09 0.00 0.00 33.01 29.07 2k47 s GLN 14 CO 0.18 0.05 1.22 -1.25 -1.32 0.00 0.00 175.29 174.17 2k47 s PRO 15 N 0.75 3.62 0.10 9.60 0.04 -1.26 -2.78 135.00 145.06 2k47 s PRO 15 Ca -0.06 1.92 -0.13 0.00 0.04 0.00 0.00 61.00 62.77 2k47 s PRO 15 Cb -0.15 -2.40 -0.17 0.00 0.04 0.00 0.00 34.50 31.82 2k47 s PRO 15 CO 0.01 -0.70 1.28 0.87 0.04 0.00 0.00 177.00 178.50 2k47 h LYS 16 N 1.95 0.77 -5.87 4.56 1.79 -1.84 -3.46 116.57 114.47 2k47 h LYS 16 Ca -0.50 -0.67 -0.57 0.00 -2.18 0.00 0.00 60.65 56.73 2k47 h LYS 16 Cb 1.26 0.15 -0.08 0.00 -1.58 0.00 0.00 32.23 31.98 2k47 h LYS 16 CO 0.60 1.27 -0.48 0.15 -1.08 0.00 0.00 179.45 179.91 2k47 s LYS 17 N -3.65 2.24 0.20 3.15 3.01 -1.26 -5.05 119.74 118.38 2k47 s LYS 17 Ca -0.10 -1.88 -0.08 0.00 -1.01 0.00 0.00 55.97 52.90 2k47 s LYS 17 Cb 0.08 -1.98 0.12 0.00 -1.01 0.00 0.00 37.83 35.05 2k47 s LYS 17 CO 0.91 -0.18 1.68 0.00 0.51 0.00 0.00 175.35 178.27 2k47 h ALA 18 N 1.35 0.90 -0.69 5.17 0.00 -2.03 -3.05 119.26 120.91 2k47 h ALA 18 Ca -0.42 -0.29 0.07 0.00 0.00 0.00 0.00 54.91 54.27 2k47 h ALA 18 Cb 1.26 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 2k47 h ALA 18 CO 0.69 0.66 0.37 1.03 0.00 0.00 0.00 179.25 182.00 2k47 h SER 19 N 0.97 0.53 -4.11 0.00 0.87 -1.99 -3.42 113.55 106.41 2k47 h SER 19 Ca 0.18 0.04 -0.52 0.00 -1.23 0.00 0.00 61.79 60.26 2k47 h SER 19 Cb 0.50 -0.06 0.10 0.00 -0.44 0.00 0.00 62.40 62.50 2k47 h SER 19 CO 0.02 0.33 0.45 -0.76 -0.53 0.00 0.00 176.83 176.34 2k47 s LEU 20 N -10.28 3.64 -0.03 2.23 1.43 -1.15 -5.05 118.68 109.48 2k47 s LEU 20 Ca -0.13 2.30 0.07 0.00 -1.03 0.00 0.00 54.13 55.34 2k47 s LEU 20 Cb 0.17 -4.59 -0.02 0.00 0.03 0.00 0.00 46.19 41.78 2k47 s LEU 20 CO 0.76 -1.53 -0.25 -1.10 0.23 0.00 0.00 176.35 174.46 2k47 s GLN 21 N -3.42 2.22 0.59 1.70 -1.52 -1.26 -4.75 119.66 113.21 2k47 s GLN 21 Ca 0.75 -0.90 -0.19 0.00 -1.95 0.00 0.00 55.36 53.07 2k47 s GLN 21 Cb -0.28 -2.09 -0.04 0.00 -0.22 0.00 0.00 33.01 30.37 2k47 s GLN 21 CO 0.33 0.54 1.11 -2.30 -0.25 0.00 0.00 175.29 174.72 2k47 n PRO 22 N 2.50 1.13 -4.35 2.91 -0.02 -1.26 -4.65 135.00 131.25 2k47 n PRO 22 Ca -0.16 0.43 -0.30 0.00 -2.02 0.00 0.00 63.50 61.45 2k47 n PRO 22 Cb 0.51 -2.31 -0.11 0.00 -0.02 0.00 0.00 33.50 31.57 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 -2.65 2.90 -0.43 2.45 2.96 -0.93 -4.92 118.68 118.05 2k47 s LEU 23 Ca 0.75 -0.41 0.05 0.00 -0.22 0.00 0.00 54.13 54.31 2k47 s LEU 23 Cb -0.42 -1.71 0.17 0.00 0.50 0.00 0.00 46.19 44.74 2k47 s LEU 23 CO 0.47 0.20 0.53 -0.89 -1.32 0.00 0.00 176.35 175.34 2k47 s THR 24 N -1.12 -0.55 0.09 3.68 2.01 -1.25 0.44 115.64 118.94 2k47 s THR 24 Ca 0.19 -1.09 -0.07 0.00 0.31 0.00 0.00 61.69 61.02 2k47 s THR 24 Cb -0.11 -0.43 -0.01 0.00 0.01 0.00 0.00 72.50 71.96 2k47 s THR 24 CO 0.11 -0.41 0.16 -0.51 -0.69 0.00 0.00 174.62 173.28 2k47 s ILE 25 N 1.10 0.14 0.52 1.82 2.07 -1.23 -4.88 121.20 120.74 2k47 s ILE 25 Ca 0.24 -1.32 0.02 0.00 -1.41 0.00 0.00 60.65 58.17 2k47 s ILE 25 Cb -0.05 -1.45 0.02 0.00 0.13 0.00 0.00 42.46 41.11 2k47 s ILE 25 CO -0.07 -0.66 0.15 -1.54 -1.91 0.00 0.00 174.94 170.92 2k47 n SER 26 N -0.05 3.15 0.26 4.50 3.41 -1.26 -2.80 113.62 120.81 2k47 n SER 26 Ca -0.14 -3.08 -0.16 0.00 -0.26 0.00 0.00 58.87 55.24 2k47 n SER 26 Cb 0.62 0.20 -0.08 0.00 -0.26 0.00 0.00 64.21 64.69 2k47 n SER 26 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2k47 h LEU 27 N 0.00 -1.20 -1.03 1.04 3.38 -1.68 0.13 115.31 115.95 2k47 h LEU 27 Ca -0.39 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 2k47 h LEU 27 Cb 1.26 0.39 -0.04 0.00 0.09 0.00 0.00 40.66 42.37 2k47 h LEU 27 CO 0.64 -0.58 0.48 -0.78 0.09 0.00 0.00 178.44 178.29 2k47 h ASP 28 N -0.87 1.02 1.39 -0.43 3.58 -0.18 -0.81 116.42 120.12 2k47 h ASP 28 Ca -0.06 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.32 2k47 h ASP 28 Cb 0.76 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2k47 h ASP 28 CO -0.05 0.81 0.00 -0.33 -2.88 0.00 0.00 179.24 176.79 2k47 h GLU 29 N 1.16 0.00 -0.23 0.28 4.39 -1.70 -3.22 114.58 115.27 2k47 h GLU 29 Ca 0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.00 2k47 h GLU 29 Cb -0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2k47 h GLU 29 CO -0.05 0.00 0.00 -0.11 -1.16 0.00 0.00 179.01 177.69 2k47 n LEU 30 N -2.88 2.76 -4.02 1.33 7.94 0.44 -4.86 117.00 117.71 2k47 n LEU 30 Ca 0.03 -2.17 -0.19 0.00 -1.11 0.00 0.00 56.01 52.56 2k47 n LEU 30 Cb 0.39 -0.21 -0.15 0.00 0.53 0.00 0.00 43.42 43.98 2k47 n LEU 30 CO 0.29 0.66 -0.43 -0.36 -1.11 0.00 0.00 177.39 176.44 2k47 s PHE 31 N -1.31 0.84 -0.26 1.96 0.08 -0.38 -4.93 117.98 113.99 2k47 s PHE 31 Ca 0.20 -0.17 0.18 0.00 0.12 0.00 0.00 56.93 57.25 2k47 s PHE 31 Cb 0.12 -0.56 0.49 0.00 -0.57 0.00 0.00 43.02 42.50 2k47 s PHE 31 CO 0.10 -0.03 1.14 -1.13 -0.10 0.00 0.00 175.22 175.20 2k47 n SER 32 N 2.96 2.61 -3.65 1.36 3.41 -1.26 -4.83 113.62 114.22 2k47 n SER 32 Ca -0.15 -2.62 -0.02 0.00 -0.26 0.00 0.00 58.87 55.83 2k47 n SER 32 Cb 0.56 -0.43 -0.07 0.00 -0.26 0.00 0.00 64.21 64.02 2k47 n SER 32 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2k47 s SER 33 N -3.64 -0.09 0.06 4.04 0.15 -1.26 -5.00 113.70 107.95 2k47 s SER 33 Ca 0.35 0.17 -0.23 0.00 0.70 0.00 0.00 55.95 56.95 2k47 s SER 33 Cb 0.35 0.42 -0.14 0.00 -1.71 0.00 0.00 66.02 64.94 2k47 s SER 33 CO -0.02 -0.03 1.56 0.03 1.20 0.00 0.00 173.24 175.98 2k47 h ARG 34 N 3.80 0.11 -0.53 5.44 3.08 -2.00 -1.78 114.38 122.50 2k47 h ARG 34 Ca -0.27 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 2k47 h ARG 34 Cb 1.19 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 2k47 h ARG 34 CO 0.19 0.28 0.28 0.78 -1.07 0.00 0.00 179.97 180.43 2k47 h GLY 35 N -0.08 0.77 1.00 0.04 0.00 -2.00 -1.91 103.07 100.89 2k47 h GLY 35 Ca 0.02 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2k47 h GLY 35 CO -0.00 0.32 0.35 -2.09 0.00 0.00 0.00 176.54 175.12 2k47 h GLU 36 N 0.73 0.95 -0.61 4.80 4.57 -1.90 -1.90 114.58 121.22 2k47 h GLU 36 Ca 0.19 -0.12 0.04 0.00 -1.18 0.00 0.00 59.36 58.29 2k47 h GLU 36 Cb 0.03 -0.18 -0.05 0.00 -0.16 0.00 0.00 28.75 28.40 2k47 h GLU 36 CO -0.03 0.73 0.35 0.35 -1.18 0.00 0.00 179.01 179.23 2k47 h PHE 37 N 0.92 0.64 -0.12 0.92 3.57 -0.56 -1.16 116.94 121.15 2k47 h PHE 37 Ca 0.23 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.78 2k47 h PHE 37 Cb 0.07 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 2k47 h PHE 37 CO -0.00 0.33 -0.05 0.82 -2.23 0.00 0.00 178.31 177.17 2k47 h ILE 38 N 0.66 0.82 0.29 1.41 1.08 -0.95 -2.10 117.51 118.73 2k47 h ILE 38 Ca 0.26 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.72 2k47 h ILE 38 Cb 0.11 0.82 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 2k47 h ILE 38 CO -0.15 0.00 -0.17 0.28 -0.69 0.00 0.00 178.15 177.43 2k47 h SER 39 N -0.04 -0.41 -0.84 1.72 0.02 -0.89 -3.09 113.55 110.02 2k47 h SER 39 Ca 0.07 0.02 0.32 0.00 -0.84 0.00 0.00 61.79 61.35 2k47 h SER 39 Cb 0.14 0.12 -0.12 0.00 0.14 0.00 0.00 62.40 62.68 2k47 h SER 39 CO -0.14 -0.26 0.50 1.33 -1.14 0.00 0.00 176.83 177.11 2k47 n VAL 40 N -3.26 -0.25 0.00 2.27 0.24 -0.48 -4.63 118.33 112.22 2k47 n VAL 40 Ca -0.05 1.38 0.00 0.00 -2.04 0.00 0.00 64.34 63.63 2k47 n VAL 40 Cb 0.17 -2.25 0.00 0.00 -1.47 0.00 0.00 33.84 30.29 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 0.54 3.12 7.63 0.00 -1.17 -4.66 105.19 109.38 2k47 n GLY 41 Ca 0.28 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.92 2.01 0.00 -0.02 0.00 -0.80 -4.93 107.32 102.66 2k47 s GLY 42 Ca 0.00 -2.56 0.00 0.00 0.00 0.00 0.00 44.72 42.16 2k47 s GLY 42 CO 0.00 1.03 0.00 1.22 0.00 0.00 0.00 173.10 175.35 2k47 n ASP 43 N 4.56 0.00 0.00 1.64 9.92 -1.26 -4.41 116.55 127.00 2k47 n ASP 43 Ca -0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.24 2k47 n ASP 43 Cb 0.41 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.88 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 2.49 -1.51 3.47 0.44 0.00 -1.26 -4.90 105.19 103.92 2k47 n GLY 44 Ca 0.00 0.37 -0.43 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 -0.95 3.16 0.45 1.61 3.00 -1.26 0.38 118.95 125.34 2k47 s ARG 45 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 55.73 55.05 2k47 s ARG 45 Cb 0.00 -4.18 -0.00 0.00 0.00 0.00 0.00 34.95 30.76 2k47 s ARG 45 CO 0.00 -1.74 0.67 1.41 0.00 0.00 0.00 175.30 175.63 2k47 s MET 46 N 4.07 3.08 0.00 3.54 1.75 -1.26 -4.98 119.30 125.50 2k47 s MET 46 Ca 0.24 -0.49 0.00 0.00 -1.25 0.00 0.00 55.69 54.19 2k47 s MET 46 Cb -0.16 -2.56 0.00 0.00 2.84 0.00 0.00 34.83 34.95 2k47 s MET 46 CO 0.12 -0.26 0.00 0.45 -0.65 0.00 0.00 175.02 174.69 2k47 n SER 47 N -2.07 0.00 0.00 1.11 2.88 -1.26 -4.97 113.62 109.32 2k47 n SER 47 Ca 0.01 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 2k47 n SER 47 Cb 0.58 -0.50 0.00 0.00 -0.75 0.00 0.00 64.21 63.54 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 -2.21 0.00 0.14 0.66 -0.00 -1.26 -4.94 115.22 107.61 2k47 n HIS 48 Ca 0.00 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.20 2k47 n HIS 48 Cb 0.00 0.00 0.06 0.00 -0.12 0.00 0.00 29.99 29.93 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 0.16 1.57 1.79 -1.97 -3.34 116.57 114.77 2k47 h LYS 49 Ca 0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 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 0.51 -0.07 0.93 -1.08 0.00 0.00 179.45 179.73 2k47 h GLU 50 N 0.00 -0.20 -0.17 3.15 5.08 -1.97 -2.17 114.58 118.31 2k47 h GLU 50 Ca -0.01 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.41 2k47 h GLU 50 Cb 1.35 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 30.57 2k47 h GLU 50 CO 0.07 0.12 -0.43 0.00 -1.00 0.00 0.00 179.01 177.77 2k47 h ALA 51 N 0.24 -0.59 -0.32 3.43 0.00 -1.92 -1.53 119.26 118.56 2k47 h ALA 51 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2k47 h ALA 51 Cb 0.41 0.81 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2k47 h ALA 51 CO 0.04 -0.93 0.21 0.82 0.00 0.00 0.00 179.25 179.38 2k47 h ILE 52 N -0.48 1.10 -0.85 0.00 1.08 -1.70 -2.58 117.51 114.09 2k47 h ILE 52 Ca 0.08 -0.21 0.25 0.00 -0.39 0.00 0.00 64.86 64.59 2k47 h ILE 52 Cb 0.62 0.65 -0.03 0.00 -3.07 0.00 0.00 36.82 34.99 2k47 h ILE 52 CO -0.42 0.10 0.62 0.25 -0.69 0.00 0.00 178.15 178.00 2k47 h LEU 53 N 0.43 0.00 -1.71 1.44 5.85 -0.63 -0.29 115.31 120.41 2k47 h LEU 53 Ca 0.12 0.00 0.25 0.00 0.84 0.00 0.00 57.88 59.09 2k47 h LEU 53 Cb -0.02 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.95 2k47 h LEU 53 CO -0.02 0.00 0.66 -0.07 -0.34 0.00 0.00 178.44 178.67 2k47 h LEU 54 N 0.00 0.22 -0.80 2.25 4.07 -0.88 -2.04 115.31 118.13 2k47 h LEU 54 Ca 0.40 0.03 0.18 0.00 0.08 0.00 0.00 57.88 58.58 2k47 h LEU 54 Cb 1.64 -0.01 -0.12 0.00 1.08 0.00 0.00 40.66 43.25 2k47 h LEU 54 CO -0.00 0.07 0.25 1.23 -1.08 0.00 0.00 178.44 178.91 2k47 h GLY 55 N 0.21 1.21 -0.03 0.83 0.00 -1.22 -1.57 103.07 102.50 2k47 h GLY 55 Ca 0.49 -0.08 0.13 0.00 0.00 0.00 0.00 47.33 47.87 2k47 h GLY 55 CO -0.12 -0.22 0.02 1.41 0.00 0.00 0.00 176.54 177.62 2k47 h LEU 56 N 0.32 -0.23 -1.40 3.11 3.38 -1.59 0.12 115.31 119.02 2k47 h LEU 56 Ca 0.47 0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.55 2k47 h LEU 56 Cb 0.84 0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2k47 h LEU 56 CO -0.52 -0.10 -0.05 0.03 0.09 0.00 0.00 178.44 177.89 2k47 h ARG 57 N 0.13 0.33 -0.18 1.13 2.47 -1.46 0.36 114.38 117.16 2k47 h ARG 57 Ca 0.32 -0.07 -0.02 0.00 -1.26 0.00 0.00 59.98 58.96 2k47 h ARG 57 Cb 0.52 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.78 2k47 h ARG 57 CO -0.51 0.40 0.04 -0.92 0.56 0.00 0.00 179.97 179.54 2k47 h TYR 58 N 0.32 0.31 -0.00 3.04 3.20 -0.62 -2.85 116.97 120.38 2k47 h TYR 58 Ca 0.07 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2k47 h TYR 58 Cb 0.30 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.48 2k47 h TYR 58 CO 0.01 0.44 -0.06 1.63 -1.64 0.00 0.00 178.16 178.53 2k47 n LYS 59 N -4.78 0.14 -2.73 1.82 4.76 -0.32 -4.97 118.16 112.08 2k47 n LYS 59 Ca -0.04 -0.02 -0.01 0.00 -2.87 0.00 0.00 58.31 55.36 2k47 n LYS 59 Cb 0.18 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.87 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 -1.41 -1.11 -1.01 1.97 4.76 0.11 -4.99 118.16 116.48 2k47 n LYS 60 Ca 0.09 1.21 -0.03 0.00 -2.87 0.00 0.00 58.31 56.71 2k47 n LYS 60 Cb 0.31 -4.84 -0.02 0.00 -1.84 0.00 0.00 35.03 28.65 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 -1.74 -0.60 0.24 -0.35 -0.00 -0.46 -4.98 117.00 109.11 2k47 n LEU 61 Ca -0.01 -1.30 0.16 0.00 -0.00 0.00 0.00 56.01 54.87 2k47 n LEU 61 Cb 0.51 0.08 0.83 0.00 -0.00 0.00 0.00 43.42 44.84 2k47 n LEU 61 CO 0.42 1.11 0.98 0.22 -0.00 0.00 0.00 177.39 180.12 2k47 h TYR 62 N 0.09 0.00 0.19 1.47 3.20 -1.94 -1.32 116.97 118.66 2k47 h TYR 62 Ca -0.30 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.56 2k47 h TYR 62 Cb 1.03 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.30 2k47 h TYR 62 CO -0.11 0.00 -0.09 -0.91 -1.64 0.00 0.00 178.16 175.41 2k47 h ASN 63 N 0.00 -0.22 0.12 -2.11 2.35 -1.94 -3.33 115.58 110.45 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 0.10 0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.52 2k47 h ASN 63 CO 0.00 -0.11 -0.41 0.00 -1.65 0.00 0.00 177.43 175.27 2k47 n GLN 64 N -2.98 0.93 0.02 0.81 10.64 -1.23 -4.35 117.38 121.23 2k47 n GLN 64 Ca -0.03 -0.68 -0.18 0.00 -1.83 0.00 0.00 57.00 54.27 2k47 n GLN 64 Cb 0.10 -1.49 -0.12 0.00 -0.86 0.00 0.00 30.24 27.88 2k47 n GLN 64 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k47 h ALA 65 N 3.71 0.03 0.00 2.61 0.00 -1.40 -1.73 119.26 122.48 2k47 h ALA 65 Ca 0.00 -0.62 -0.04 0.00 0.00 0.00 0.00 54.91 54.25 2k47 h ALA 65 Cb 0.62 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2k47 h ALA 65 CO 0.00 0.39 -0.20 -0.09 0.00 0.00 0.00 179.25 179.34 2k47 h ARG 66 N -0.14 0.00 0.04 0.00 2.43 -1.76 -2.85 114.38 112.09 2k47 h ARG 66 Ca -0.10 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.76 2k47 h ARG 66 Cb 1.45 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.96 2k47 h ARG 66 CO 0.14 0.20 -1.72 -0.24 -1.51 0.00 0.00 179.97 176.84 2k47 h VAL 67 N 0.00 0.86 0.00 0.20 3.04 -1.76 -3.35 116.25 115.24 2k47 h VAL 67 Ca -0.00 -2.67 0.00 0.00 -1.01 0.00 0.00 66.70 63.02 2k47 h VAL 67 Cb 0.44 2.48 0.00 0.00 -2.01 0.00 0.00 31.29 32.20 2k47 h VAL 67 CO 0.03 0.62 0.00 0.29 -1.01 0.00 0.00 177.57 177.50 2k47 n LYS 68 N -3.18 0.14 -4.15 4.17 5.02 -0.65 -4.81 118.16 114.70 2k47 n LYS 68 Ca -0.19 0.31 -0.10 0.00 -2.02 0.00 0.00 58.31 56.31 2k47 n LYS 68 Cb 1.05 -1.74 -0.10 0.00 -0.02 0.00 0.00 35.03 34.22 2k47 n LYS 68 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2k47 s TYR 69 N -3.18 0.80 -0.89 2.13 1.51 -1.09 -2.48 117.35 114.16 2k47 s TYR 69 Ca 0.07 -1.07 -0.25 0.00 -1.01 0.00 0.00 57.07 54.82 2k47 s TYR 69 Cb 0.11 -0.49 -0.02 0.00 -0.11 0.00 0.00 41.96 41.45 2k47 s TYR 69 CO 0.41 -0.33 1.78 0.45 -1.11 0.00 0.00 175.55 176.74 2k47 s SER 70 N -3.02 5.55 0.00 2.29 0.15 -1.12 -4.64 113.70 112.91 2k47 s SER 70 Ca 0.15 -0.73 0.00 0.00 0.70 0.00 0.00 55.95 56.07 2k47 s SER 70 Cb 0.07 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 2k47 s SER 70 CO -0.04 -2.35 0.00 0.18 1.20 0.00 0.00 173.24 172.24 2k47 n LEU 71 N 12.33 0.00 -3.93 3.45 4.32 -1.26 -4.70 117.00 127.22 2k47 n LEU 71 Ca 0.34 0.00 -0.29 0.00 -0.02 0.00 0.00 56.01 56.04 2k47 n LEU 71 Cb 0.49 0.00 -0.12 0.00 -1.62 0.00 0.00 43.42 42.17 2k47 n LEU 71 CO 0.63 -0.21 -0.02 -0.76 -1.22 0.00 0.00 177.39 175.81 2k47 s LEU 72 N -3.26 4.83 0.00 2.23 2.01 -1.26 -5.00 118.68 118.23 2k47 s LEU 72 Ca 0.00 -3.71 0.00 0.00 0.01 0.00 0.00 54.13 50.43 2k47 s LEU 72 Cb 0.00 -1.67 0.00 0.00 0.01 0.00 0.00 46.19 44.53 2k47 s LEU 72 CO 0.00 -0.12 0.00 -1.84 1.01 0.00 0.00 176.35 175.40