#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k48 n HIS 2 N 0.00 0.00 -4.19 1.12 -0.00 -1.26 -5.11 115.22 105.78 2k48 n HIS 2 Ca 0.00 -0.17 -0.12 0.00 -0.00 0.00 0.00 57.72 57.43 2k48 n HIS 2 Cb 0.00 -0.05 -0.10 0.00 -0.00 0.00 0.00 29.99 29.84 2k48 n HIS 2 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2k48 s HIS 3 N -0.47 1.04 0.90 1.57 0.09 -1.26 -5.17 115.29 111.99 2k48 s HIS 3 Ca 0.05 -1.17 -0.10 0.00 -0.00 0.00 0.00 55.06 53.84 2k48 s HIS 3 Cb 0.04 -0.59 0.13 0.00 -0.00 0.00 0.00 32.58 32.17 2k48 s HIS 3 CO 0.00 -0.41 1.12 -3.38 -0.00 0.00 0.00 174.74 172.08 2k48 s HIS 4 N -3.90 1.86 0.30 1.40 -0.00 -1.26 -5.00 115.29 108.69 2k48 s HIS 4 Ca 0.26 1.68 -0.29 0.00 -0.00 0.00 0.00 55.06 56.70 2k48 s HIS 4 Cb 0.07 -3.25 -0.11 0.00 -0.00 0.00 0.00 32.58 29.30 2k48 s HIS 4 CO 0.04 -2.62 1.45 -1.01 -0.00 0.00 0.00 174.74 172.60 2k48 s HIS 5 N -2.71 2.89 -2.11 0.38 3.76 -1.26 -4.94 115.29 111.30 2k48 s HIS 5 Ca 0.65 1.09 0.27 0.00 -0.15 0.00 0.00 55.06 56.92 2k48 s HIS 5 Cb -0.21 -3.88 1.47 0.00 1.11 0.00 0.00 32.58 31.07 2k48 s HIS 5 CO 0.58 -2.74 1.96 0.72 -0.85 0.00 0.00 174.74 174.41 2k48 n HIS 6 N 1.61 0.02 -3.82 1.40 -0.00 -1.26 -4.85 115.22 108.32 2k48 n HIS 6 Ca 0.04 -0.01 -0.10 0.00 -0.00 0.00 0.00 57.72 57.65 2k48 n HIS 6 Cb 0.40 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 30.31 2k48 n HIS 6 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2k48 s HIS 7 N -1.98 0.02 -0.08 4.41 5.65 -1.26 -5.19 115.29 116.86 2k48 s HIS 7 Ca 0.40 -0.25 -0.32 0.00 0.25 0.00 0.00 55.06 55.13 2k48 s HIS 7 Cb 0.19 0.01 0.14 0.00 -1.18 0.00 0.00 32.58 31.74 2k48 s HIS 7 CO 0.32 -0.48 1.39 0.20 -0.65 0.00 0.00 174.74 175.52 2k48 s GLY 8 N -2.23 -0.47 0.65 1.59 0.00 -1.26 -5.18 107.32 100.43 2k48 s GLY 8 Ca -0.03 0.91 -0.16 0.00 0.00 0.00 0.00 44.72 45.44 2k48 s GLY 8 CO -0.05 0.18 1.14 0.54 0.00 0.00 0.00 173.10 174.90 2k48 s LYS 9 N -2.15 2.79 0.84 2.90 1.02 -1.26 -5.03 119.74 118.84 2k48 s LYS 9 Ca 0.15 1.53 -0.14 0.00 0.02 0.00 0.00 55.97 57.52 2k48 s LYS 9 Cb 0.07 -1.94 0.02 0.00 -0.52 0.00 0.00 37.83 35.46 2k48 s LYS 9 CO -0.06 -1.28 0.62 -2.30 -0.92 0.00 0.00 175.35 171.41 2k48 n PRO 10 N -2.21 0.02 -4.15 -1.68 -0.02 -1.26 -5.07 135.00 120.63 2k48 n PRO 10 Ca 0.11 0.06 -0.10 0.00 -2.02 0.00 0.00 63.50 61.56 2k48 n PRO 10 Cb 0.51 -1.97 -0.10 0.00 -0.02 0.00 0.00 33.50 31.92 2k48 n PRO 10 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2k48 s ILE 11 N -2.16 0.56 1.09 4.25 -4.36 -1.26 -5.17 121.20 114.14 2k48 s ILE 11 Ca 0.63 -1.89 -0.15 0.00 -0.26 0.00 0.00 60.65 58.98 2k48 s ILE 11 Cb -0.28 -1.63 0.15 0.00 1.25 0.00 0.00 42.46 41.95 2k48 s ILE 11 CO 0.60 -0.91 0.44 -2.65 0.24 0.00 0.00 174.94 172.67 2k48 n PRO 12 N 0.01 -1.52 -3.88 0.37 -0.02 -1.26 -5.10 135.00 123.60 2k48 n PRO 12 Ca -0.13 -0.41 -0.11 0.00 -2.02 0.00 0.00 63.50 60.83 2k48 n PRO 12 Cb 0.61 -1.91 -0.10 0.00 -0.02 0.00 0.00 33.50 32.08 2k48 n PRO 12 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2k48 s ASN 13 N -2.09 0.05 0.02 2.55 2.20 -1.26 -5.15 114.94 111.27 2k48 s ASN 13 Ca 0.60 -0.28 -0.30 0.00 -0.94 0.00 0.00 52.86 51.94 2k48 s ASN 13 Cb -0.18 0.22 -0.05 0.00 -2.00 0.00 0.00 41.25 39.23 2k48 s ASN 13 CO 0.66 -0.41 1.28 -2.16 -2.94 0.00 0.00 177.10 173.52 2k48 s PRO 14 N -1.72 4.35 0.00 3.55 0.04 -1.26 -4.89 135.00 135.07 2k48 s PRO 14 Ca -0.12 1.83 0.00 0.00 0.04 0.00 0.00 61.00 62.75 2k48 s PRO 14 Cb -0.06 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 31.02 2k48 s PRO 14 CO 0.00 -0.42 0.67 -0.11 0.04 0.00 0.00 177.00 177.18 2k48 n LEU 15 N 4.70 0.00 0.23 -3.56 7.94 -1.26 -4.96 117.00 120.10 2k48 n LEU 15 Ca 0.11 -0.74 0.10 0.00 -1.11 0.00 0.00 56.01 54.36 2k48 n LEU 15 Cb 0.45 0.00 0.57 0.00 0.53 0.00 0.00 43.42 44.98 2k48 n LEU 15 CO 0.57 0.40 0.87 -0.07 -1.11 0.00 0.00 177.39 178.05 2k48 h LEU 16 N 0.00 0.00 0.14 -1.96 3.38 -2.08 -3.47 115.31 111.32 2k48 h LEU 16 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2k48 h LEU 16 Cb 1.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 2k48 h LEU 16 CO 0.00 0.21 -0.05 0.61 0.09 0.00 0.00 178.44 179.29 2k48 n GLY 17 N -0.44 0.61 3.42 0.83 0.00 -1.26 -5.02 105.19 103.32 2k48 n GLY 17 Ca -0.01 -0.79 -0.14 0.00 0.00 0.00 0.00 46.02 45.07 2k48 n GLY 17 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2k48 s LEU 18 N -0.67 1.09 0.23 0.99 2.34 -1.26 -5.20 118.68 116.20 2k48 s LEU 18 Ca 0.00 -1.45 0.01 0.00 0.06 0.00 0.00 54.13 52.75 2k48 s LEU 18 Cb 0.00 1.15 -0.04 0.00 -0.56 0.00 0.00 46.19 46.74 2k48 s LEU 18 CO 0.00 -1.16 0.16 1.51 -1.06 0.00 0.00 176.35 175.80 2k48 s ASP 19 N -3.22 0.58 0.27 1.48 -4.77 -1.26 -5.14 116.67 104.61 2k48 s ASP 19 Ca 0.33 -1.47 -0.30 0.00 -3.30 0.00 0.00 52.55 47.81 2k48 s ASP 19 Cb 0.01 0.40 -0.13 0.00 -1.09 0.00 0.00 42.92 42.11 2k48 s ASP 19 CO 0.19 -0.88 1.33 -1.20 0.70 0.00 0.00 175.17 175.32 2k48 n SER 20 N -0.56 2.59 0.00 2.11 7.64 -1.26 -4.95 113.62 119.19 2k48 n SER 20 Ca 0.03 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.07 2k48 n SER 20 Cb 0.65 -1.42 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 2k48 n SER 20 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2k48 n THR 21 N 1.32 0.00 -1.99 0.44 -1.04 -1.26 -5.06 114.28 106.69 2k48 n THR 21 Ca 0.10 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.73 2k48 n THR 21 Cb 0.32 -0.52 0.02 0.00 -1.82 0.00 0.00 70.33 68.33 2k48 n THR 21 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 2k48 s GLU 22 N -1.60 3.31 0.00 -2.82 -1.05 -1.26 -4.98 118.70 110.31 2k48 s GLU 22 Ca 0.00 1.99 0.00 0.00 -0.15 0.00 0.00 54.97 56.81 2k48 s GLU 22 Cb 0.00 -2.24 0.00 0.00 -0.44 0.00 0.00 34.13 31.45 2k48 s GLU 22 CO 0.00 -0.98 0.35 0.27 0.95 0.00 0.00 175.26 175.85 2k48 n ASN 23 N -0.97 0.00 -3.76 0.83 6.94 -1.26 -5.10 115.26 111.94 2k48 n ASN 23 Ca 0.10 -1.00 -0.13 0.00 -0.02 0.00 0.00 54.58 53.53 2k48 n ASN 23 Cb 0.47 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.78 2k48 n ASN 23 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2k48 s LEU 24 N 0.00 0.78 0.07 -4.53 0.20 -1.26 -5.18 118.68 108.76 2k48 s LEU 24 Ca 0.00 0.60 -0.16 0.00 0.69 0.00 0.00 54.13 55.26 2k48 s LEU 24 Cb 0.00 1.11 0.03 0.00 -0.43 0.00 0.00 46.19 46.90 2k48 s LEU 24 CO 0.00 -0.14 0.37 -0.72 -0.29 0.00 0.00 176.35 175.57 2k48 s TYR 25 N 0.04 -0.18 0.00 5.38 1.13 -1.26 -5.08 117.35 117.37 2k48 s TYR 25 Ca -0.01 0.03 0.00 0.00 -1.41 0.00 0.00 57.07 55.68 2k48 s TYR 25 Cb -0.03 0.18 0.00 0.00 -1.10 0.00 0.00 41.96 41.01 2k48 s TYR 25 CO 0.01 -0.58 0.00 1.97 -2.51 0.00 0.00 175.55 174.43 2k48 n PHE 26 N 0.31 0.00 -1.94 -3.49 1.16 -1.26 -5.12 117.46 107.13 2k48 n PHE 26 Ca -0.18 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 54.98 2k48 n PHE 26 Cb 0.61 0.01 -0.03 0.00 -1.61 0.00 0.00 39.48 38.46 2k48 n PHE 26 CO 0.00 0.00 0.00 -1.14 -1.87 0.00 0.00 176.76 173.75 2k48 s GLN 27 N 0.00 4.20 0.00 3.97 0.74 -1.26 -4.86 119.66 122.44 2k48 s GLN 27 Ca 0.00 2.31 0.00 0.00 0.05 0.00 0.00 55.36 57.72 2k48 s GLN 27 Cb 0.00 -3.65 0.00 0.00 1.10 0.00 0.00 33.01 30.46 2k48 s GLN 27 CO 0.00 -0.74 0.00 0.41 -0.55 0.00 0.00 175.29 174.41 2k48 n GLY 28 N 4.01 -0.80 3.28 2.59 0.00 -1.26 -5.18 105.19 107.84 2k48 n GLY 28 Ca 0.16 -1.08 -0.15 0.00 0.00 0.00 0.00 46.02 44.95 2k48 n GLY 28 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k48 s ILE 29 N -3.00 0.69 0.04 -0.61 -4.36 -1.26 -5.19 121.20 107.51 2k48 s ILE 29 Ca 0.00 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.39 2k48 s ILE 29 Cb 0.00 -2.33 -0.03 0.00 1.25 0.00 0.00 42.46 41.35 2k48 s ILE 29 CO 0.00 -0.29 -0.02 -1.81 0.24 0.00 0.00 174.94 173.06 2k48 s ASP 30 N -3.24 0.36 0.00 4.36 1.01 -1.26 -5.06 116.67 112.85 2k48 s ASP 30 Ca 0.29 -0.76 0.03 0.00 0.71 0.00 0.00 52.55 52.82 2k48 s ASP 30 Cb 0.07 0.16 0.19 0.00 1.01 0.00 0.00 42.92 44.35 2k48 s ASP 30 CO 0.08 -0.47 0.83 -0.81 0.21 0.00 0.00 175.17 175.01 2k48 n PRO 31 N 0.76 0.68 -0.07 8.23 -0.04 -1.26 -4.13 135.00 139.17 2k48 n PRO 31 Ca -0.18 0.00 0.24 0.00 -0.04 0.00 0.00 63.50 63.51 2k48 n PRO 31 Cb 0.58 -1.07 0.71 0.00 -0.04 0.00 0.00 33.50 33.68 2k48 n PRO 31 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2k48 h PHE 32 N 0.00 0.00 -0.20 0.54 3.57 -1.99 0.06 116.94 118.92 2k48 h PHE 32 Ca 0.00 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 2k48 h PHE 32 Cb 0.00 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 2k48 h PHE 32 CO 0.00 0.00 0.14 1.79 -2.23 0.00 0.00 178.31 178.01 2k48 h THR 33 N 0.00 0.92 0.00 4.41 1.35 -1.99 -1.05 112.91 116.55 2k48 h THR 33 Ca 0.32 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 66.17 2k48 h THR 33 Cb 1.30 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 2k48 h THR 33 CO -0.00 0.01 -1.03 0.80 -0.25 0.00 0.00 175.52 175.04 2k48 n MET 34 N -4.49 0.23 -0.15 4.72 0.00 -0.03 -2.73 117.12 114.67 2k48 n MET 34 Ca 0.02 -0.02 -0.05 0.00 -0.00 0.00 0.00 57.70 57.65 2k48 n MET 34 Cb 0.26 -1.56 0.12 0.00 0.00 0.00 0.00 33.22 32.04 2k48 n MET 34 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 175.97 176.74 2k48 h SER 35 N 0.00 0.86 -0.63 6.12 0.02 -0.90 -0.83 113.55 118.19 2k48 h SER 35 Ca 0.00 -0.20 -0.03 0.00 -0.84 0.00 0.00 61.79 60.71 2k48 h SER 35 Cb 0.68 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.96 2k48 h SER 35 CO 0.00 0.90 0.27 0.74 -1.14 0.00 0.00 176.83 177.60 2k48 h THR 36 N 0.85 1.23 -0.11 -2.27 2.02 -1.31 -2.00 112.91 111.31 2k48 h THR 36 Ca 0.17 -0.70 0.03 0.00 0.77 0.00 0.00 66.41 66.68 2k48 h THR 36 Cb 0.44 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.25 2k48 h THR 36 CO 0.02 0.28 -0.08 -0.07 0.37 0.00 0.00 175.52 176.04 2k48 h LEU 37 N 0.95 -0.25 -1.01 2.58 -0.00 -1.20 0.98 115.31 117.35 2k48 h LEU 37 Ca 0.22 0.06 -0.08 0.00 -0.00 0.00 0.00 57.88 58.08 2k48 h LEU 37 Cb 0.17 0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.95 2k48 h LEU 37 CO -0.02 -0.11 -0.13 1.56 -0.00 0.00 0.00 178.44 179.74 2k48 h GLN 38 N -0.08 0.56 -0.12 1.13 4.20 -0.78 0.16 115.11 120.17 2k48 h GLN 38 Ca 0.07 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.58 2k48 h GLN 38 Cb 0.19 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 2k48 h GLN 38 CO -0.17 0.68 -0.03 1.49 -0.67 0.00 0.00 178.83 180.14 2k48 h GLU 39 N 0.51 0.23 0.16 1.46 4.57 -1.31 -3.10 114.58 117.10 2k48 h GLU 39 Ca 0.09 -0.09 -0.29 0.00 -1.18 0.00 0.00 59.36 57.89 2k48 h GLU 39 Cb 0.53 -0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.12 2k48 h GLU 39 CO 0.03 0.54 -1.32 1.25 -1.18 0.00 0.00 179.01 178.33 2k48 h LEU 40 N -0.08 0.52 -1.61 1.64 5.85 -0.25 0.27 115.31 121.65 2k48 h LEU 40 Ca 0.03 -0.57 -0.04 0.00 0.84 0.00 0.00 57.88 58.14 2k48 h LEU 40 Cb 0.45 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2k48 h LEU 40 CO 0.01 1.45 -0.21 -0.61 -0.34 0.00 0.00 178.44 178.74 2k48 h GLN 41 N 0.09 0.00 0.16 1.25 -0.00 -0.87 0.16 115.11 115.90 2k48 h GLN 41 Ca -0.17 0.00 -0.29 0.00 -0.00 0.00 0.00 58.65 58.19 2k48 h GLN 41 Cb 2.02 0.00 0.02 0.00 0.00 0.00 0.00 27.48 29.52 2k48 h GLN 41 CO 0.22 0.21 -1.29 1.49 0.00 0.00 0.00 178.83 179.46 2k48 h GLU 42 N 0.00 0.44 -0.70 1.69 4.81 -1.44 -3.08 114.58 116.29 2k48 h GLU 42 Ca -0.00 -0.68 0.00 0.00 -0.13 0.00 0.00 59.36 58.55 2k48 h GLU 42 Cb 0.46 0.24 -0.03 0.00 0.63 0.00 0.00 28.75 30.05 2k48 h GLU 42 CO 0.03 1.31 0.45 -0.97 -0.73 0.00 0.00 179.01 179.10 2k48 h ASN 43 N 0.15 0.82 -0.06 1.04 -0.73 0.27 0.14 115.58 117.21 2k48 h ASN 43 Ca -0.18 -0.04 0.02 0.00 1.87 0.00 0.00 56.30 57.98 2k48 h ASN 43 Cb 1.99 -0.21 -0.06 0.00 0.27 0.00 0.00 38.32 40.31 2k48 h ASN 43 CO 0.23 0.62 -0.53 0.40 -0.37 0.00 0.00 177.43 177.77 2k48 h ILE 44 N 0.95 0.00 -0.57 2.57 1.08 -0.81 0.13 117.51 120.86 2k48 h ILE 44 Ca 0.25 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.61 2k48 h ILE 44 Cb -0.08 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 33.66 2k48 h ILE 44 CO -0.05 0.00 -0.08 0.74 -0.69 0.00 0.00 178.15 178.06 2k48 h THR 45 N -0.63 1.27 -0.28 -0.27 2.02 -1.33 0.46 112.91 114.15 2k48 h THR 45 Ca 0.02 -1.25 -0.18 0.00 0.77 0.00 0.00 66.41 65.78 2k48 h THR 45 Cb 0.70 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2k48 h THR 45 CO -0.39 0.44 -0.52 0.00 0.37 0.00 0.00 175.52 175.42 2k48 h ALA 46 N 0.94 0.53 0.00 6.16 0.00 -0.65 0.73 119.26 126.98 2k48 h ALA 46 Ca 0.15 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2k48 h ALA 46 Cb 0.66 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2k48 h ALA 46 CO 0.05 0.68 0.00 1.25 0.00 0.00 0.00 179.25 181.23 2k48 h HIS 47 N 0.64 0.00 0.20 0.00 6.17 -0.59 0.19 115.15 121.76 2k48 h HIS 47 Ca 0.02 0.00 -0.30 0.00 0.71 0.00 0.00 60.37 60.80 2k48 h HIS 47 Cb 1.12 0.00 0.03 0.00 2.52 0.00 0.00 27.41 31.08 2k48 h HIS 47 CO 0.07 0.00 -1.29 0.93 0.71 0.00 0.00 177.93 178.35 2k48 h GLU 48 N 0.00 0.52 -0.38 5.26 5.08 0.35 -1.49 114.58 123.91 2k48 h GLU 48 Ca 0.00 -0.83 -0.12 0.00 -1.00 0.00 0.00 59.36 57.41 2k48 h GLU 48 Cb 0.59 0.30 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 2k48 h GLU 48 CO 0.00 1.39 -0.26 1.96 -1.00 0.00 0.00 179.01 181.10 2k48 h GLN 49 N 0.07 0.78 0.00 2.33 4.20 -0.72 0.24 115.11 122.02 2k48 h GLN 49 Ca -0.22 -0.33 -0.03 0.00 0.06 0.00 0.00 58.65 58.13 2k48 h GLN 49 Cb 2.00 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 29.75 2k48 h GLN 49 CO 0.24 0.95 -0.15 1.96 -0.67 0.00 0.00 178.83 181.17 2k48 h GLN 50 N 0.67 0.00 -0.00 1.46 4.20 -0.72 0.81 115.11 121.53 2k48 h GLN 50 Ca 0.09 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 2k48 h GLN 50 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 2k48 h GLN 50 CO 0.06 0.15 -0.01 1.25 -0.67 0.00 0.00 178.83 179.61 2k48 h LEU 51 N 0.00 0.02 -1.18 1.46 5.85 -0.09 0.19 115.31 121.55 2k48 h LEU 51 Ca -0.00 -0.66 0.04 0.00 0.84 0.00 0.00 57.88 58.09 2k48 h LEU 51 Cb 0.34 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 2k48 h LEU 51 CO 0.02 0.68 0.56 -0.37 -0.34 0.00 0.00 178.44 178.99 2k48 h VAL 52 N -0.65 1.13 -0.58 1.05 -1.51 -0.43 0.74 116.25 116.00 2k48 h VAL 52 Ca -0.00 -0.36 -0.10 0.00 -1.23 0.00 0.00 66.70 65.01 2k48 h VAL 52 Cb 0.68 -0.02 -0.02 0.00 -2.13 0.00 0.00 31.29 29.80 2k48 h VAL 52 CO 0.00 0.19 -0.01 0.74 -1.23 0.00 0.00 177.57 177.26 2k48 h THR 53 N 1.05 1.27 -0.56 7.19 2.02 -0.87 0.13 112.91 123.13 2k48 h THR 53 Ca 0.35 -1.15 0.00 0.00 0.77 0.00 0.00 66.41 66.37 2k48 h THR 53 Cb 0.06 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 2k48 h THR 53 CO -0.11 0.42 0.36 0.00 0.37 0.00 0.00 175.52 176.56 2k48 h ALA 54 N 0.97 1.57 -0.50 6.16 0.00 0.13 0.72 119.26 128.32 2k48 h ALA 54 Ca 0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2k48 h ALA 54 Cb 0.57 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2k48 h ALA 54 CO 0.03 0.39 0.21 0.00 0.00 0.00 0.00 179.25 179.88 2k48 h ARG 55 N 0.77 0.74 -0.48 0.00 -0.00 -0.44 -0.27 114.38 114.70 2k48 h ARG 55 Ca 0.21 -0.13 -0.09 0.00 -0.50 0.00 0.00 59.98 59.47 2k48 h ARG 55 Cb -0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 29.97 29.76 2k48 h ARG 55 CO -0.04 0.65 -0.06 0.37 0.00 0.00 0.00 179.97 180.90 2k48 h GLN 56 N 0.67 0.84 -0.40 0.04 4.15 0.59 -0.14 115.11 120.86 2k48 h GLN 56 Ca 0.17 -0.26 -0.15 0.00 0.77 0.00 0.00 58.65 59.18 2k48 h GLN 56 Cb 0.18 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 2k48 h GLN 56 CO -0.02 0.88 -0.33 0.87 -1.93 0.00 0.00 178.83 178.30 2k48 h LYS 57 N 0.77 0.92 -0.34 1.69 1.79 0.42 -1.29 116.57 120.52 2k48 h LYS 57 Ca 0.14 -0.45 -0.07 0.00 -2.18 0.00 0.00 60.65 58.09 2k48 h LYS 57 Cb 0.54 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.17 2k48 h LYS 57 CO 0.03 1.10 -0.09 1.37 -1.08 0.00 0.00 179.45 180.79 2k48 h LEU 58 N 0.77 0.55 -1.16 2.94 8.10 -0.75 -0.95 115.31 124.80 2k48 h LEU 58 Ca 0.08 -0.14 -0.07 0.00 0.11 0.00 0.00 57.88 57.86 2k48 h LEU 58 Cb 0.91 -0.15 -0.01 0.00 -0.44 0.00 0.00 40.66 40.96 2k48 h LEU 58 CO 0.08 0.69 -0.19 0.50 -4.11 0.00 0.00 178.44 175.41 2k48 h LYS 59 N 0.54 0.35 0.00 0.17 3.64 -0.73 0.11 116.57 120.64 2k48 h LYS 59 Ca 0.10 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2k48 h LYS 59 Cb 0.47 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2k48 h LYS 59 CO 0.03 0.53 -0.12 0.22 -2.27 0.00 0.00 179.45 177.84 2k48 h ASP 60 N 0.32 0.00 0.79 4.20 3.58 -0.70 0.18 116.42 124.79 2k48 h ASP 60 Ca 0.06 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.26 2k48 h ASP 60 Cb 0.52 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.56 2k48 h ASP 60 CO 0.03 0.12 -1.15 0.00 -2.88 0.00 0.00 179.24 175.36 2k48 h ALA 61 N 1.88 0.21 -0.45 -0.78 0.00 0.21 -2.28 119.26 118.06 2k48 h ALA 61 Ca -0.00 -0.91 -0.10 0.00 0.00 0.00 0.00 54.91 53.90 2k48 h ALA 61 Cb 0.46 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2k48 h ALA 61 CO 0.02 1.10 -0.14 0.93 0.00 0.00 0.00 179.25 181.15 2k48 h GLU 62 N 0.04 0.83 -0.90 0.00 5.08 -0.40 -1.94 114.58 117.29 2k48 h GLU 62 Ca -0.08 -0.30 0.08 0.00 -1.00 0.00 0.00 59.36 58.05 2k48 h GLU 62 Cb 1.89 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 31.02 2k48 h GLU 62 CO 0.17 0.93 0.58 -0.22 -1.00 0.00 0.00 179.01 179.47 2k48 h LYS 63 N 0.74 0.95 -0.29 2.33 1.63 -0.69 0.74 116.57 121.98 2k48 h LYS 63 Ca 0.12 -0.06 -0.14 0.00 -0.85 0.00 0.00 60.65 59.72 2k48 h LYS 63 Cb 0.65 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 32.06 2k48 h LYS 63 CO 0.05 0.63 -0.40 0.00 -3.45 0.00 0.00 179.45 176.27 2k48 h ALA 64 N 1.53 0.76 0.00 5.00 0.00 -0.75 -0.76 119.26 125.04 2k48 h ALA 64 Ca 0.40 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2k48 h ALA 64 Cb 0.27 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2k48 h ALA 64 CO -0.16 0.66 -0.16 -0.24 0.00 0.00 0.00 179.25 179.35 2k48 h VAL 65 N 0.56 0.30 -0.50 0.00 3.04 -1.15 0.16 116.25 118.65 2k48 h VAL 65 Ca 0.05 -1.30 -0.06 0.00 -1.01 0.00 0.00 66.70 64.37 2k48 h VAL 65 Cb 0.93 2.05 -0.02 0.00 -2.01 0.00 0.00 31.29 32.23 2k48 h VAL 65 CO 0.08 0.16 0.06 -0.08 -1.01 0.00 0.00 177.57 176.78 2k48 h GLU 66 N 0.00 0.80 0.00 4.17 4.57 -0.41 -3.27 114.58 120.44 2k48 h GLU 66 Ca -0.00 -0.19 -0.06 0.00 -1.18 0.00 0.00 59.36 57.93 2k48 h GLU 66 Cb 1.03 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.51 2k48 h GLU 66 CO 0.02 0.77 -1.44 1.55 -1.18 0.00 0.00 179.01 178.73 2k48 n VAL 67 N -4.24 0.22 -2.96 0.32 3.14 -0.33 -4.81 118.33 109.66 2k48 n VAL 67 Ca 0.03 -0.25 -0.15 0.00 -2.96 0.00 0.00 64.34 61.01 2k48 n VAL 67 Cb 0.27 -0.14 -0.01 0.00 -1.06 0.00 0.00 33.84 32.90 2k48 n VAL 67 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2k48 n ASP 68 N -1.99 -1.51 -2.47 6.55 2.03 0.55 -5.07 116.55 114.64 2k48 n ASP 68 Ca -0.06 -2.99 0.00 0.00 0.52 0.00 0.00 54.79 52.26 2k48 n ASP 68 Cb 0.43 0.68 0.00 0.00 -0.72 0.00 0.00 41.12 41.51 2k48 n ASP 68 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2k48 n PRO 69 N 1.65 0.00 -2.43 -0.67 -0.04 -1.23 -4.57 135.00 127.70 2k48 n PRO 69 Ca 0.15 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.27 2k48 n PRO 69 Cb 0.58 -1.46 -0.02 0.00 -0.04 0.00 0.00 33.50 32.56 2k48 n PRO 69 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2k48 s ASP 70 N 2.76 6.10 0.63 3.54 1.01 -1.26 -4.93 116.67 124.53 2k48 s ASP 70 Ca 0.00 2.02 0.35 0.00 0.71 0.00 0.00 52.55 55.63 2k48 s ASP 70 Cb 0.00 -2.57 1.97 0.00 1.01 0.00 0.00 42.92 43.34 2k48 s ASP 70 CO 0.00 -0.95 2.20 0.44 0.21 0.00 0.00 175.17 177.07 2k48 h ASP 71 N 1.42 0.00 -0.54 0.27 3.32 -2.01 0.13 116.42 119.01 2k48 h ASP 71 Ca -0.50 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.45 2k48 h ASP 71 Cb 1.24 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 2k48 h ASP 71 CO 0.58 0.00 -0.08 1.62 -1.72 0.00 0.00 179.24 179.64 2k48 h VAL 72 N 0.00 1.27 0.00 -1.35 3.04 -1.95 -1.26 116.25 115.99 2k48 h VAL 72 Ca 0.03 -1.23 -0.05 0.00 -1.01 0.00 0.00 66.70 64.43 2k48 h VAL 72 Cb 0.26 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 30.49 2k48 h VAL 72 CO -0.00 0.43 -0.26 0.78 -1.01 0.00 0.00 177.57 177.51 2k48 h ASN 73 N 0.89 0.00 0.00 3.17 2.35 -1.02 0.73 115.58 121.70 2k48 h ASN 73 Ca 0.14 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.65 2k48 h ASN 73 Cb 0.64 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.03 2k48 h ASN 73 CO 0.04 0.26 -0.97 0.11 -1.65 0.00 0.00 177.43 175.22 2k48 h LYS 74 N 0.00 0.66 -0.13 0.81 1.57 -1.55 -1.93 116.57 116.00 2k48 h LYS 74 Ca -0.00 -0.71 -0.11 0.00 -1.87 0.00 0.00 60.65 57.96 2k48 h LYS 74 Cb 0.71 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 2k48 h LYS 74 CO 0.03 1.29 -0.43 0.77 -0.57 0.00 0.00 179.45 180.55 2k48 h SER 75 N 0.31 0.31 0.31 0.86 0.02 -0.48 -2.16 113.55 112.72 2k48 h SER 75 Ca -0.12 -0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 60.65 2k48 h SER 75 Cb 1.64 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 64.08 2k48 h SER 75 CO 0.19 0.70 -0.23 0.74 -1.14 0.00 0.00 176.83 177.09 2k48 h THR 76 N 0.24 1.02 0.11 -2.27 2.02 0.39 -0.32 112.91 114.10 2k48 h THR 76 Ca 0.02 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.36 2k48 h THR 76 Cb 0.86 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 2k48 h THR 76 CO 0.07 0.23 -0.05 0.25 0.37 0.00 0.00 175.52 176.38 2k48 h LEU 77 N 0.00 -0.12 -2.23 2.58 7.12 -0.69 -1.23 115.31 120.74 2k48 h LEU 77 Ca -0.00 -0.21 0.02 0.00 0.13 0.00 0.00 57.88 57.81 2k48 h LEU 77 Cb 0.45 0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 40.61 2k48 h LEU 77 CO 0.03 0.15 0.07 1.56 -0.13 0.00 0.00 178.44 180.12 2k48 h GLN 78 N -0.40 0.00 -0.08 1.25 4.20 -1.09 0.26 115.11 119.25 2k48 h GLN 78 Ca -0.01 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 2k48 h GLN 78 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 2k48 h GLN 78 CO 0.02 0.00 -0.30 -0.97 -0.67 0.00 0.00 178.83 176.92 2k48 h ASN 79 N 0.00 0.40 -0.32 1.46 -0.73 -1.04 0.83 115.58 116.18 2k48 h ASN 79 Ca 0.03 -0.63 -0.13 0.00 1.87 0.00 0.00 56.30 57.45 2k48 h ASN 79 Cb 0.17 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 38.63 2k48 h ASN 79 CO -0.00 0.96 -0.28 0.03 -0.37 0.00 0.00 177.43 177.77 2k48 h ARG 80 N -0.13 0.83 -0.15 6.67 2.47 0.14 -1.02 114.38 123.18 2k48 h ARG 80 Ca -0.01 -0.37 -0.03 0.00 -1.26 0.00 0.00 59.98 58.30 2k48 h ARG 80 Cb 0.93 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.22 2k48 h ARG 80 CO 0.06 1.01 -0.06 -0.09 0.56 0.00 0.00 179.97 181.45 2k48 h ARG 81 N 0.70 0.22 -0.06 0.04 2.43 -0.67 -0.77 114.38 116.28 2k48 h ARG 81 Ca 0.08 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 2k48 h ARG 81 Cb 0.83 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 2k48 h ARG 81 CO 0.07 0.30 -0.56 0.00 -1.51 0.00 0.00 179.97 178.27 2k48 h ALA 82 N 1.73 0.96 -0.04 2.80 0.00 -0.36 -0.48 119.26 123.86 2k48 h ALA 82 Ca 0.05 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2k48 h ALA 82 Cb 0.25 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2k48 h ALA 82 CO 0.01 0.70 -0.01 0.00 0.00 0.00 0.00 179.25 179.95 2k48 h ALA 83 N 1.29 0.05 -0.99 0.00 0.00 -0.30 0.53 119.26 119.85 2k48 h ALA 83 Ca -0.00 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 54.89 2k48 h ALA 83 Cb 1.03 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.71 2k48 h ALA 83 CO 0.08 -0.24 0.61 0.28 0.00 0.00 0.00 179.25 179.99 2k48 h VAL 84 N -0.29 0.71 -0.42 0.00 2.07 -1.08 0.24 116.25 117.48 2k48 h VAL 84 Ca 0.01 -0.24 -0.12 0.00 0.82 0.00 0.00 66.70 67.17 2k48 h VAL 84 Cb 0.41 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2k48 h VAL 84 CO 0.00 0.13 -0.22 -1.28 0.02 0.00 0.00 177.57 176.22 2k48 h SER 85 N 0.70 0.87 0.20 0.57 0.87 -0.89 0.24 113.55 116.11 2k48 h SER 85 Ca 0.55 -0.32 0.01 0.00 -1.23 0.00 0.00 61.79 60.80 2k48 h SER 85 Cb 0.94 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.63 2k48 h SER 85 CO -0.33 1.06 -0.28 0.74 -0.53 0.00 0.00 176.83 177.49 2k48 h THR 86 N 0.74 0.40 -0.65 2.23 2.02 0.12 -0.56 112.91 117.22 2k48 h THR 86 Ca 0.10 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.25 2k48 h THR 86 Cb 0.76 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 2k48 h THR 86 CO 0.06 0.00 0.30 -0.07 0.37 0.00 0.00 175.52 176.19 2k48 h LEU 87 N -0.54 0.85 -0.21 2.58 -0.00 -0.52 0.78 115.31 118.25 2k48 h LEU 87 Ca 0.01 -0.14 -0.08 0.00 -0.00 0.00 0.00 57.88 57.67 2k48 h LEU 87 Cb 0.53 -0.22 -0.00 0.00 -0.00 0.00 0.00 40.66 40.97 2k48 h LEU 87 CO -0.11 0.75 -0.19 -0.33 -0.00 0.00 0.00 178.44 178.56 2k48 h GLU 88 N 0.89 0.51 -0.15 1.13 4.39 -0.50 0.10 114.58 120.95 2k48 h GLU 88 Ca 0.22 -0.26 0.02 0.00 0.34 0.00 0.00 59.36 59.69 2k48 h GLU 88 Cb 0.13 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2k48 h GLU 88 CO -0.03 0.83 0.00 1.15 -1.16 0.00 0.00 179.01 179.81 2k48 h THR 89 N 0.19 0.90 0.17 1.13 2.02 -0.92 -1.43 112.91 114.97 2k48 h THR 89 Ca 0.04 -0.02 0.01 0.00 0.77 0.00 0.00 66.41 67.21 2k48 h THR 89 Cb 0.73 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.93 2k48 h THR 89 CO 0.05 0.01 -0.52 0.50 0.37 0.00 0.00 175.52 175.92 2k48 h LYS 90 N 0.06 -0.76 -0.09 6.66 1.63 -0.80 -1.68 116.57 121.59 2k48 h LYS 90 Ca 0.07 0.05 -0.05 0.00 -0.85 0.00 0.00 60.65 59.88 2k48 h LYS 90 Cb 0.08 0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 31.88 2k48 h LYS 90 CO -0.12 -0.50 -0.16 -0.07 -3.45 0.00 0.00 179.45 175.15 2k48 h LEU 91 N -0.78 0.14 -0.23 5.20 -0.00 -0.35 0.71 115.31 119.99 2k48 h LEU 91 Ca -0.01 -0.03 -0.03 0.00 -0.00 0.00 0.00 57.88 57.80 2k48 h LEU 91 Cb 0.77 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 41.39 2k48 h LEU 91 CO -0.26 0.31 0.01 1.23 -0.00 0.00 0.00 178.44 179.74 2k48 h GLY 92 N 0.70 0.43 1.67 0.83 0.00 -1.17 0.67 103.07 106.19 2k48 h GLY 92 Ca 0.03 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 46.99 2k48 h GLY 92 CO 0.02 0.29 -0.09 1.05 0.00 0.00 0.00 176.54 177.81 2k48 h GLU 93 N 0.18 0.41 0.11 4.80 -0.00 -0.07 -1.18 114.58 118.84 2k48 h GLU 93 Ca 0.07 -0.10 -0.01 0.00 -0.00 0.00 0.00 59.36 59.32 2k48 h GLU 93 Cb 0.39 -0.05 0.00 0.00 -0.00 0.00 0.00 28.75 29.08 2k48 h GLU 93 CO 0.01 0.51 -0.06 1.25 -0.00 0.00 0.00 179.01 180.73 2k48 h LEU 94 N 0.39 -0.13 -1.86 3.06 5.85 0.36 0.22 115.31 123.20 2k48 h LEU 94 Ca 0.08 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.36 2k48 h LEU 94 Cb 0.40 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 2k48 h LEU 94 CO 0.02 0.40 -0.09 0.11 -0.34 0.00 0.00 178.44 178.54 2k48 h LYS 95 N -0.72 0.00 -0.05 1.25 1.57 -0.83 0.40 116.57 118.20 2k48 h LYS 95 Ca -0.02 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.53 2k48 h LYS 95 Cb 0.54 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.86 2k48 h LYS 95 CO 0.03 0.09 -0.91 -0.09 -0.57 0.00 0.00 179.45 178.00 2k48 h ARG 96 N 0.00 0.60 -0.68 3.15 1.12 -1.13 -0.66 114.38 116.78 2k48 h ARG 96 Ca -0.00 -0.58 0.08 0.00 -1.11 0.00 0.00 59.98 58.37 2k48 h ARG 96 Cb 0.17 0.15 -0.07 0.00 -0.01 0.00 0.00 29.97 30.21 2k48 h ARG 96 CO 0.01 1.20 0.34 1.96 -3.11 0.00 0.00 179.97 180.37 2k48 h GLN 97 N 0.37 0.58 0.20 0.20 4.20 0.71 -0.97 115.11 120.40 2k48 h GLN 97 Ca -0.08 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 2k48 h GLN 97 Cb 1.54 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 29.19 2k48 h GLN 97 CO 0.17 0.38 -0.12 -0.07 -0.67 0.00 0.00 178.83 178.52 2k48 h LEU 98 N 0.59 -0.31 -2.24 1.46 4.07 -0.90 0.18 115.31 118.17 2k48 h LEU 98 Ca 0.33 0.02 0.05 0.00 0.08 0.00 0.00 57.88 58.36 2k48 h LEU 98 Cb 0.32 0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 2k48 h LEU 98 CO -0.25 -0.20 0.21 0.00 -1.08 0.00 0.00 178.44 177.12 2k48 h ALA 99 N 0.48 1.75 0.12 1.53 0.00 -0.32 0.41 119.26 123.23 2k48 h ALA 99 Ca -0.02 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 2k48 h ALA 99 Cb 0.26 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.08 2k48 h ALA 99 CO 0.02 -0.30 -0.78 0.22 0.00 0.00 0.00 179.25 178.41 2k48 h ASP 100 N 0.00 0.40 -0.04 0.00 3.58 -0.80 -3.24 116.42 116.32 2k48 h ASP 100 Ca 0.08 -0.95 0.03 0.00 0.42 0.00 0.00 57.03 56.62 2k48 h ASP 100 Cb 0.50 -0.13 -0.04 0.00 1.72 0.00 0.00 39.33 41.38 2k48 h ASP 100 CO -0.00 1.37 -0.21 -0.07 -2.88 0.00 0.00 179.24 177.45 2k48 h LEU 101 N -0.45 -0.64 -0.32 2.28 4.07 0.55 -3.09 115.31 117.71 2k48 h LEU 101 Ca -0.14 0.10 -0.05 0.00 0.08 0.00 0.00 57.88 57.86 2k48 h LEU 101 Cb 1.58 0.27 -0.01 0.00 1.08 0.00 0.00 40.66 43.58 2k48 h LEU 101 CO 0.12 -0.28 -0.00 0.58 -1.08 0.00 0.00 178.44 177.78 2k48 h VAL 102 N -0.32 1.26 0.00 1.22 2.07 -0.42 0.98 116.25 121.04 2k48 h VAL 102 Ca 0.07 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.63 2k48 h VAL 102 Cb 0.42 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2k48 h VAL 102 CO -0.23 0.31 0.00 0.00 0.02 0.00 0.00 177.57 177.68 2k48 n ALA 103 N -2.38 1.79 0.00 1.67 0.00 -1.21 -1.76 120.51 118.63 2k48 n ALA 103 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2k48 n ALA 103 Cb 0.27 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.64 2k48 n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k48 n ALA 104 N -0.76 1.39 0.29 0.00 0.00 -0.37 -4.67 120.51 116.39 2k48 n ALA 104 Ca 0.03 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.61 2k48 n ALA 104 Cb 0.02 0.00 0.86 0.00 0.00 0.00 0.00 19.45 20.32 2k48 n ALA 104 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2k48 h GLN 105 N 0.00 0.00 0.00 0.00 3.07 -0.03 -2.41 115.11 115.75 2k48 h GLN 105 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2k48 h GLN 105 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 2k48 h GLN 105 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 178.83 179.79 2k48 h LYS 106 N 0.00 0.00 -0.02 0.06 1.57 -1.82 -3.49 116.57 112.87 2k48 h LYS 106 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2k48 h LYS 106 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2k48 h LYS 106 CO -0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16