#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k48 s HIS 2 N 0.00 0.57 -0.38 2.03 2.46 -1.26 -5.12 115.29 113.59 2k48 s HIS 2 Ca 0.00 -0.91 0.13 0.00 0.47 0.00 0.00 55.06 54.75 2k48 s HIS 2 Cb 0.00 -0.12 0.41 0.00 -0.13 0.00 0.00 32.58 32.74 2k48 s HIS 2 CO 0.00 -0.76 0.92 0.72 -2.47 0.00 0.00 174.74 173.15 2k48 n HIS 3 N -0.26 1.61 -0.55 3.88 8.25 -1.26 -5.12 115.22 121.78 2k48 n HIS 3 Ca -0.04 -3.25 -0.30 0.00 -0.26 0.00 0.00 57.72 53.87 2k48 n HIS 3 Cb 0.63 -0.35 0.27 0.00 1.12 0.00 0.00 29.99 31.66 2k48 n HIS 3 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2k48 s HIS 4 N -3.05 0.29 0.37 4.41 -3.43 -1.26 -5.11 115.29 107.51 2k48 s HIS 4 Ca 0.37 0.78 0.04 0.00 -0.80 0.00 0.00 55.06 55.44 2k48 s HIS 4 Cb 0.40 -3.04 -0.02 0.00 -1.43 0.00 0.00 32.58 28.50 2k48 s HIS 4 CO -0.05 -4.42 0.15 -2.39 -2.00 0.00 0.00 174.74 166.02 2k48 n HIS 5 N -5.25 0.03 -0.96 0.38 1.44 -1.26 -5.17 115.22 104.43 2k48 n HIS 5 Ca 0.09 -2.44 -0.29 0.00 -2.01 0.00 0.00 57.72 53.07 2k48 n HIS 5 Cb 0.58 0.03 0.21 0.00 0.12 0.00 0.00 29.99 30.92 2k48 n HIS 5 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2k48 s HIS 6 N -3.00 1.70 0.87 -1.40 2.46 -1.26 -5.03 115.29 109.63 2k48 s HIS 6 Ca 0.21 0.98 -0.13 0.00 0.47 0.00 0.00 55.06 56.59 2k48 s HIS 6 Cb 0.01 -3.22 0.08 0.00 -0.13 0.00 0.00 32.58 29.31 2k48 s HIS 6 CO 0.15 -3.36 0.90 0.72 -2.47 0.00 0.00 174.74 170.68 2k48 n HIS 7 N -4.51 0.20 -3.45 3.88 -0.00 -1.26 -5.04 115.22 105.04 2k48 n HIS 7 Ca 0.05 0.35 -0.00 0.00 -0.00 0.00 0.00 57.72 58.12 2k48 n HIS 7 Cb 0.57 -1.97 0.00 0.00 -0.00 0.00 0.00 29.99 28.59 2k48 n HIS 7 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2k48 n GLY 8 N 0.84 1.27 3.70 -1.41 0.00 -1.26 -5.17 105.19 103.17 2k48 n GLY 8 Ca 0.11 -0.94 -0.39 0.00 0.00 0.00 0.00 46.02 44.80 2k48 n GLY 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k48 n LYS 9 N -0.06 1.52 -1.29 1.61 5.02 -1.26 -4.99 118.16 118.72 2k48 n LYS 9 Ca -0.00 0.56 -0.36 0.00 -2.02 0.00 0.00 58.31 56.49 2k48 n LYS 9 Cb 0.05 -2.44 0.08 0.00 -0.02 0.00 0.00 35.03 32.71 2k48 n LYS 9 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2k48 n PRO 10 N -0.84 0.38 -4.06 1.97 -0.02 -1.26 -5.07 135.00 126.10 2k48 n PRO 10 Ca 0.11 0.18 -0.10 0.00 -2.02 0.00 0.00 63.50 61.67 2k48 n PRO 10 Cb 0.44 -2.05 -0.11 0.00 -0.02 0.00 0.00 33.50 31.77 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 -1.89 0.34 0.66 4.25 -4.36 -1.26 -5.17 121.20 113.77 2k48 s ILE 11 Ca 0.69 -1.36 -0.13 0.00 -0.26 0.00 0.00 60.65 59.60 2k48 s ILE 11 Cb -0.34 -0.91 -0.01 0.00 1.25 0.00 0.00 42.46 42.45 2k48 s ILE 11 CO 0.54 -0.66 1.06 -2.16 0.24 0.00 0.00 174.94 173.96 2k48 s PRO 12 N -2.52 3.02 -0.35 0.37 0.04 -1.26 -5.07 135.00 129.23 2k48 s PRO 12 Ca -0.04 1.11 0.01 0.00 0.04 0.00 0.00 61.00 62.12 2k48 s PRO 12 Cb -0.03 -2.00 0.14 0.00 0.04 0.00 0.00 34.50 32.66 2k48 s PRO 12 CO -0.04 -1.04 0.26 0.54 0.04 0.00 0.00 177.00 176.76 2k48 s ASN 13 N -3.25 2.39 0.55 6.66 4.22 -1.26 -5.04 114.94 119.21 2k48 s ASN 13 Ca 0.61 -1.92 0.26 0.00 -2.14 0.00 0.00 52.86 49.67 2k48 s ASN 13 Cb -0.16 -0.07 1.45 0.00 1.28 0.00 0.00 41.25 43.76 2k48 s ASN 13 CO 0.47 -0.30 2.01 -0.65 -2.04 0.00 0.00 177.10 176.59 2k48 h PRO 14 N 7.12 0.00 -5.25 3.55 0.11 -2.09 -3.46 132.00 131.98 2k48 h PRO 14 Ca 0.04 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.79 2k48 h PRO 14 Cb 1.00 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.04 2k48 h PRO 14 CO 0.25 0.00 -0.52 1.28 -0.21 0.00 0.00 178.00 178.80 2k48 n LEU 15 N -4.19 -1.51 -4.14 2.35 4.77 -1.26 -4.98 117.00 108.05 2k48 n LEU 15 Ca 0.07 -0.31 -0.09 0.00 -0.03 0.00 0.00 56.01 55.65 2k48 n LEU 15 Cb 0.52 -2.13 -0.10 0.00 -2.33 0.00 0.00 43.42 39.39 2k48 n LEU 15 CO 0.34 0.13 -0.35 -0.76 -1.33 0.00 0.00 177.39 175.42 2k48 s LEU 16 N -6.37 2.29 0.00 2.23 1.43 -1.26 -5.18 118.68 111.82 2k48 s LEU 16 Ca 0.35 -1.07 -0.22 0.00 -1.03 0.00 0.00 54.13 52.16 2k48 s LEU 16 Cb -0.18 0.14 0.07 0.00 0.03 0.00 0.00 46.19 46.25 2k48 s LEU 16 CO 0.43 -0.60 0.99 0.61 0.23 0.00 0.00 176.35 178.01 2k48 n GLY 17 N -0.01 0.39 3.20 -3.19 0.00 -1.26 -5.19 105.19 99.14 2k48 n GLY 17 Ca -0.11 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.76 2k48 n GLY 17 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k48 s LEU 18 N 0.00 1.05 -0.01 0.99 2.96 -1.26 -5.18 118.68 117.23 2k48 s LEU 18 Ca 0.23 -0.01 -0.15 0.00 -0.22 0.00 0.00 54.13 53.98 2k48 s LEU 18 Cb -0.01 1.11 0.02 0.00 0.50 0.00 0.00 46.19 47.82 2k48 s LEU 18 CO 0.01 -0.44 0.31 -0.62 -1.32 0.00 0.00 176.35 174.29 2k48 s ASP 19 N -1.40 -0.18 0.23 3.68 2.15 -1.26 -5.19 116.67 114.70 2k48 s ASP 19 Ca -0.13 0.05 -0.16 0.00 0.43 0.00 0.00 52.55 52.74 2k48 s ASP 19 Cb -0.06 0.32 0.01 0.00 -0.30 0.00 0.00 42.92 42.90 2k48 s ASP 19 CO 0.03 -0.47 0.54 -0.94 -0.17 0.00 0.00 175.17 174.16 2k48 s SER 20 N -1.43 -0.18 0.01 -0.34 1.04 -1.26 -5.19 113.70 106.35 2k48 s SER 20 Ca -0.12 -0.71 -0.00 0.00 0.48 0.00 0.00 55.95 55.60 2k48 s SER 20 Cb -0.05 0.61 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 2k48 s SER 20 CO 0.03 -1.15 -0.01 -0.89 0.98 0.00 0.00 173.24 172.20 2k48 s THR 21 N -3.95 0.07 0.84 2.02 2.01 -1.26 -5.17 115.64 110.21 2k48 s THR 21 Ca 0.15 -0.58 -0.10 0.00 0.31 0.00 0.00 61.69 61.47 2k48 s THR 21 Cb -0.02 -0.18 0.10 0.00 0.01 0.00 0.00 72.50 72.41 2k48 s THR 21 CO 0.04 -0.32 1.12 -1.61 -0.69 0.00 0.00 174.62 173.17 2k48 s GLU 22 N -0.94 1.63 0.30 4.92 0.41 -1.26 -5.08 118.70 118.68 2k48 s GLU 22 Ca -0.10 1.39 -0.06 0.00 -0.41 0.00 0.00 54.97 55.79 2k48 s GLU 22 Cb -0.06 -1.81 -0.00 0.00 -1.78 0.00 0.00 34.13 30.47 2k48 s GLU 22 CO -0.01 -2.15 0.44 0.54 -0.49 0.00 0.00 175.26 173.60 2k48 s ASN 23 N -2.97 0.51 -0.31 -0.19 2.20 -1.26 -5.08 114.94 107.85 2k48 s ASN 23 Ca 0.65 -1.30 0.19 0.00 -0.94 0.00 0.00 52.86 51.45 2k48 s ASN 23 Cb -0.20 0.61 0.47 0.00 -2.00 0.00 0.00 41.25 40.13 2k48 s ASN 23 CO 0.56 -1.21 1.06 -0.11 -2.94 0.00 0.00 177.10 174.47 2k48 n LEU 24 N -0.48 1.06 0.01 3.54 -0.00 -1.26 -4.98 117.00 114.90 2k48 n LEU 24 Ca 0.00 -3.44 0.06 0.00 -0.00 0.00 0.00 56.01 52.63 2k48 n LEU 24 Cb 0.62 0.40 0.26 0.00 -0.00 0.00 0.00 43.42 44.70 2k48 n LEU 24 CO 0.28 1.43 0.69 -1.22 -0.00 0.00 0.00 177.39 178.57 2k48 n TYR 25 N -0.35 0.07 -1.70 1.96 4.01 -1.26 -4.84 117.16 115.06 2k48 n TYR 25 Ca 0.06 0.03 -0.44 0.00 -0.16 0.00 0.00 57.90 57.39 2k48 n TYR 25 Cb 0.82 -0.55 -0.03 0.00 -0.31 0.00 0.00 39.34 39.27 2k48 n TYR 25 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2k48 n PHE 26 N -1.57 2.47 -3.67 -0.72 7.35 -1.26 -5.02 117.46 115.04 2k48 n PHE 26 Ca 0.03 0.27 -0.14 0.00 -0.76 0.00 0.00 57.45 56.84 2k48 n PHE 26 Cb 0.13 -2.56 -0.08 0.00 0.35 0.00 0.00 39.48 37.33 2k48 n PHE 26 CO 0.00 0.00 0.00 -1.14 -0.76 0.00 0.00 176.76 174.86 2k48 s GLN 27 N 0.24 0.72 0.00 -4.13 0.74 -1.26 -5.18 119.66 110.80 2k48 s GLN 27 Ca 0.72 0.51 0.00 0.00 0.05 0.00 0.00 55.36 56.64 2k48 s GLN 27 Cb -0.59 0.34 0.00 0.00 1.10 0.00 0.00 33.01 33.86 2k48 s GLN 27 CO 0.43 -0.14 0.00 0.41 -0.55 0.00 0.00 175.29 175.44 2k48 n GLY 28 N 2.19 -0.74 3.70 2.59 0.00 -1.26 -5.17 105.19 106.50 2k48 n GLY 28 Ca -0.16 -0.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.63 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 2.07 0.20 -0.61 -4.36 -1.26 -5.11 121.20 109.14 2k48 s ILE 29 Ca 0.00 -1.83 -0.32 0.00 -0.26 0.00 0.00 60.65 58.24 2k48 s ILE 29 Cb 0.00 -2.90 -0.13 0.00 1.25 0.00 0.00 42.46 40.68 2k48 s ILE 29 CO 0.00 0.00 1.57 0.47 0.24 0.00 0.00 174.94 177.22 2k48 n ASP 30 N -1.16 3.29 0.00 4.36 8.00 -1.26 -5.03 116.55 124.75 2k48 n ASP 30 Ca -0.04 1.10 0.00 0.00 0.71 0.00 0.00 54.79 56.56 2k48 n ASP 30 Cb 0.66 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.28 2k48 n ASP 30 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2k48 n PRO 31 N 3.05 0.04 -1.25 -0.24 -0.04 -1.26 -4.84 135.00 130.45 2k48 n PRO 31 Ca 0.14 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.52 2k48 n PRO 31 Cb 0.32 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.74 2k48 n PRO 31 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2k48 n PHE 32 N 0.00 0.00 -0.34 0.54 3.72 -1.26 -4.90 117.46 115.22 2k48 n PHE 32 Ca 0.00 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.43 2k48 n PHE 32 Cb 0.00 -2.27 0.20 0.00 -0.94 0.00 0.00 39.48 36.47 2k48 n PHE 32 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 2k48 h THR 33 N 0.00 1.09 0.00 4.37 1.35 -1.95 -1.11 112.91 116.66 2k48 h THR 33 Ca -0.18 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2k48 h THR 33 Cb 0.95 -0.13 0.00 0.00 -1.73 0.00 0.00 68.15 67.24 2k48 h THR 33 CO 0.26 0.20 -0.19 0.80 -0.25 0.00 0.00 175.52 176.34 2k48 n MET 34 N -4.49 0.06 -0.09 4.72 0.00 -1.26 -1.75 117.12 114.31 2k48 n MET 34 Ca 0.15 0.03 -0.13 0.00 -0.00 0.00 0.00 57.70 57.75 2k48 n MET 34 Cb 0.18 -1.55 -0.01 0.00 0.00 0.00 0.00 33.22 31.84 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 0.95 -0.23 6.12 0.02 -1.63 -1.38 113.55 117.40 2k48 h SER 35 Ca 0.00 -0.46 -0.04 0.00 -0.84 0.00 0.00 61.79 60.45 2k48 h SER 35 Cb 0.55 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 2k48 h SER 35 CO 0.00 1.25 0.02 0.74 -1.14 0.00 0.00 176.83 177.70 2k48 h THR 36 N 0.70 1.19 0.02 -2.27 2.02 -1.20 -1.91 112.91 111.46 2k48 h THR 36 Ca 0.04 -0.72 0.01 0.00 0.77 0.00 0.00 66.41 66.52 2k48 h THR 36 Cb 1.03 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 2k48 h THR 36 CO 0.10 0.25 -0.08 -0.07 0.37 0.00 0.00 175.52 176.09 2k48 h LEU 37 N 0.49 -0.22 -1.34 2.58 -0.00 -1.04 0.11 115.31 115.89 2k48 h LEU 37 Ca 0.11 0.03 -0.07 0.00 -0.00 0.00 0.00 57.88 57.95 2k48 h LEU 37 Cb 0.29 0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 41.03 2k48 h LEU 37 CO 0.01 -0.12 -0.33 1.56 -0.00 0.00 0.00 178.44 179.56 2k48 h GLN 38 N -0.15 0.00 -0.08 1.13 4.20 -0.75 0.24 115.11 119.70 2k48 h GLN 38 Ca 0.02 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.68 2k48 h GLN 38 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 2k48 h GLN 38 CO -0.07 0.33 -0.17 1.49 -0.67 0.00 0.00 178.83 179.74 2k48 h GLU 39 N 0.00 0.25 0.16 1.46 4.57 -1.28 -3.10 114.58 116.64 2k48 h GLU 39 Ca -0.00 -0.17 -0.30 0.00 -1.18 0.00 0.00 59.36 57.71 2k48 h GLU 39 Cb 0.61 0.02 0.01 0.00 -0.16 0.00 0.00 28.75 29.24 2k48 h GLU 39 CO 0.04 0.77 -1.36 1.25 -1.18 0.00 0.00 179.01 178.53 2k48 h LEU 40 N -0.23 0.52 -1.62 1.64 5.85 -0.32 0.10 115.31 121.25 2k48 h LEU 40 Ca 0.00 -0.59 -0.04 0.00 0.84 0.00 0.00 57.88 58.09 2k48 h LEU 40 Cb 0.77 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 2k48 h LEU 40 CO 0.04 1.47 -0.20 -0.61 -0.34 0.00 0.00 178.44 178.80 2k48 h GLN 41 N 0.09 0.00 0.16 1.25 -0.00 -0.73 0.20 115.11 116.08 2k48 h GLN 41 Ca -0.19 0.00 -0.29 0.00 -0.00 0.00 0.00 58.65 58.17 2k48 h GLN 41 Cb 2.03 0.00 0.01 0.00 0.00 0.00 0.00 27.48 29.52 2k48 h GLN 41 CO 0.21 0.20 -1.29 1.49 0.00 0.00 0.00 178.83 179.44 2k48 h GLU 42 N 0.00 0.36 -0.72 1.69 4.57 -1.47 -2.95 114.58 116.06 2k48 h GLU 42 Ca -0.00 -0.59 -0.02 0.00 -1.18 0.00 0.00 59.36 57.56 2k48 h GLU 42 Cb 0.47 0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 2k48 h GLU 42 CO 0.03 1.28 0.37 -0.97 -1.18 0.00 0.00 179.01 178.53 2k48 h ASN 43 N 0.11 0.92 -0.17 1.04 -1.24 -0.04 0.17 115.58 116.36 2k48 h ASN 43 Ca -0.16 -0.12 0.05 0.00 0.71 0.00 0.00 56.30 56.78 2k48 h ASN 43 Cb 2.00 -0.24 -0.07 0.00 0.73 0.00 0.00 38.32 40.75 2k48 h ASN 43 CO 0.22 0.78 -0.38 0.40 -1.29 0.00 0.00 177.43 177.16 2k48 h ILE 44 N 1.00 0.19 -0.56 2.57 1.08 -0.74 0.81 117.51 121.87 2k48 h ILE 44 Ca 0.25 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.61 2k48 h ILE 44 Cb 0.08 0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.01 2k48 h ILE 44 CO -0.04 0.00 -0.06 0.74 -0.69 0.00 0.00 178.15 178.10 2k48 h THR 45 N -0.43 1.27 -0.05 -0.27 2.02 -1.23 0.54 112.91 114.76 2k48 h THR 45 Ca 0.09 -1.21 -0.23 0.00 0.77 0.00 0.00 66.41 65.83 2k48 h THR 45 Cb 0.59 0.92 0.02 0.00 -1.74 0.00 0.00 68.15 67.94 2k48 h THR 45 CO -0.41 0.43 -0.88 0.00 0.37 0.00 0.00 175.52 175.03 2k48 h ALA 46 N 0.94 0.18 0.00 6.16 0.00 -0.56 0.75 119.26 126.73 2k48 h ALA 46 Ca 0.15 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2k48 h ALA 46 Cb 0.62 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2k48 h ALA 46 CO 0.04 0.63 -0.03 1.25 0.00 0.00 0.00 179.25 181.14 2k48 h HIS 47 N 0.37 0.00 0.03 0.00 6.17 -0.79 0.15 115.15 121.07 2k48 h HIS 47 Ca -0.10 0.00 -0.19 0.00 0.71 0.00 0.00 60.37 60.79 2k48 h HIS 47 Cb 1.53 0.00 0.02 0.00 2.52 0.00 0.00 27.41 31.48 2k48 h HIS 47 CO 0.10 0.03 -0.77 0.93 0.71 0.00 0.00 177.93 178.93 2k48 h GLU 48 N 0.00 0.46 -0.61 5.26 5.08 0.33 -1.33 114.58 123.76 2k48 h GLU 48 Ca -0.00 -0.54 -0.08 0.00 -1.00 0.00 0.00 59.36 57.73 2k48 h GLU 48 Cb 0.53 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 2k48 h GLU 48 CO 0.00 1.19 0.05 1.96 -1.00 0.00 0.00 179.01 181.22 2k48 h GLN 49 N -0.03 1.03 0.00 2.33 4.20 -0.59 0.33 115.11 122.38 2k48 h GLN 49 Ca -0.11 -0.29 -0.02 0.00 0.06 0.00 0.00 58.65 58.29 2k48 h GLN 49 Cb 1.49 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 29.15 2k48 h GLN 49 CO 0.15 0.98 -0.11 1.96 -0.67 0.00 0.00 178.83 181.14 2k48 h GLN 50 N 0.96 0.00 0.10 1.46 4.20 -0.80 0.58 115.11 121.61 2k48 h GLN 50 Ca 0.18 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.63 2k48 h GLN 50 Cb 0.48 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.28 2k48 h GLN 50 CO 0.02 0.11 -1.07 1.25 -0.67 0.00 0.00 178.83 178.46 2k48 h LEU 51 N 0.00 0.77 -0.83 1.46 5.85 0.17 0.20 115.31 122.92 2k48 h LEU 51 Ca -0.00 -0.83 -0.01 0.00 0.84 0.00 0.00 57.88 57.87 2k48 h LEU 51 Cb 0.31 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 2k48 h LEU 51 CO 0.01 1.52 0.47 -0.37 -0.34 0.00 0.00 178.44 179.73 2k48 h VAL 52 N 0.12 1.24 -0.48 1.05 -1.51 -0.23 0.11 116.25 116.56 2k48 h VAL 52 Ca -0.16 -0.59 -0.08 0.00 -1.23 0.00 0.00 66.70 64.64 2k48 h VAL 52 Cb 1.77 0.12 -0.02 0.00 -2.13 0.00 0.00 31.29 31.03 2k48 h VAL 52 CO 0.21 0.27 -0.01 0.74 -1.23 0.00 0.00 177.57 177.55 2k48 h THR 53 N 1.16 1.26 -0.43 7.19 2.02 -0.93 0.80 112.91 123.97 2k48 h THR 53 Ca 0.29 -1.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.39 2k48 h THR 53 Cb 0.02 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 2k48 h THR 53 CO -0.05 0.38 0.23 0.00 0.37 0.00 0.00 175.52 176.45 2k48 h ALA 54 N 0.92 1.60 -0.34 6.16 0.00 0.03 0.74 119.26 128.37 2k48 h ALA 54 Ca 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2k48 h ALA 54 Cb 0.52 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2k48 h ALA 54 CO 0.03 0.34 0.17 0.00 0.00 0.00 0.00 179.25 179.79 2k48 h ARG 55 N 0.60 0.49 -0.32 0.00 2.47 -0.24 -0.52 114.38 116.86 2k48 h ARG 55 Ca 0.15 -0.07 -0.07 0.00 -1.26 0.00 0.00 59.98 58.74 2k48 h ARG 55 Cb 0.03 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.24 2k48 h ARG 55 CO -0.02 0.43 -0.09 0.37 0.56 0.00 0.00 179.97 181.22 2k48 h GLN 56 N 0.42 0.53 -0.24 0.04 4.15 0.62 0.81 115.11 121.45 2k48 h GLN 56 Ca 0.12 -0.15 -0.19 0.00 0.77 0.00 0.00 58.65 59.20 2k48 h GLN 56 Cb 0.10 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.73 2k48 h GLN 56 CO -0.02 0.63 -0.61 0.87 -1.93 0.00 0.00 178.83 177.78 2k48 h LYS 57 N 0.50 0.81 -0.24 1.69 1.79 0.56 -0.48 116.57 121.19 2k48 h LYS 57 Ca 0.10 -0.55 -0.12 0.00 -2.18 0.00 0.00 60.65 57.89 2k48 h LYS 57 Cb 0.46 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 2k48 h LYS 57 CO 0.03 1.17 -0.36 1.37 -1.08 0.00 0.00 179.45 180.58 2k48 h LEU 58 N 0.60 0.56 -1.27 2.94 -0.00 -0.82 -0.58 115.31 116.75 2k48 h LEU 58 Ca -0.00 -0.23 -0.06 0.00 -0.00 0.00 0.00 57.88 57.58 2k48 h LEU 58 Cb 1.21 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 41.70 2k48 h LEU 58 CO 0.13 0.88 -0.18 0.07 -0.00 0.00 0.00 178.44 179.33 2k48 h LYS 59 N 0.45 0.27 0.00 0.17 5.09 -0.72 0.14 116.57 121.97 2k48 h LYS 59 Ca 0.05 -0.07 -0.07 0.00 0.09 0.00 0.00 60.65 60.65 2k48 h LYS 59 Cb 0.84 -0.03 -0.01 0.00 0.10 0.00 0.00 32.23 33.13 2k48 h LYS 59 CO 0.07 0.45 -0.31 0.22 -2.09 0.00 0.00 179.45 177.79 2k48 h ASP 60 N 0.25 0.00 0.94 7.07 3.58 -0.80 0.49 116.42 127.95 2k48 h ASP 60 Ca 0.05 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.28 2k48 h ASP 60 Cb 0.48 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.50 2k48 h ASP 60 CO 0.03 0.31 -1.05 0.00 -2.88 0.00 0.00 179.24 175.65 2k48 h ALA 61 N 1.69 0.32 -0.56 -0.78 0.00 -0.18 -2.41 119.26 117.34 2k48 h ALA 61 Ca -0.00 -0.92 -0.10 0.00 0.00 0.00 0.00 54.91 53.88 2k48 h ALA 61 Cb 0.83 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2k48 h ALA 61 CO 0.04 1.22 -0.06 0.93 0.00 0.00 0.00 179.25 181.38 2k48 h GLU 62 N 0.01 1.02 0.00 0.00 5.08 -0.55 -1.30 114.58 118.84 2k48 h GLU 62 Ca -0.03 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 57.98 2k48 h GLU 62 Cb 1.80 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.97 2k48 h GLU 62 CO 0.14 1.04 -0.00 -0.22 -1.00 0.00 0.00 179.01 178.96 2k48 h LYS 63 N 0.92 0.00 0.09 2.33 1.63 -0.92 -0.18 116.57 120.45 2k48 h LYS 63 Ca 0.15 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 59.81 2k48 h LYS 63 Cb 0.62 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.26 2k48 h LYS 63 CO 0.04 0.00 -0.65 0.00 -3.45 0.00 0.00 179.45 175.39 2k48 h ALA 64 N 2.00 -0.03 0.00 5.00 0.00 -0.73 -3.09 119.26 122.41 2k48 h ALA 64 Ca -0.00 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2k48 h ALA 64 Cb 0.01 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2k48 h ALA 64 CO 0.00 0.32 0.00 -0.24 0.00 0.00 0.00 179.25 179.33 2k48 h VAL 65 N -0.57 0.00 -0.16 0.00 3.04 -1.16 -0.14 116.25 117.25 2k48 h VAL 65 Ca -0.12 -0.25 -0.01 0.00 -1.01 0.00 0.00 66.70 65.30 2k48 h VAL 65 Cb 1.46 1.22 -0.01 0.00 -2.01 0.00 0.00 31.29 31.95 2k48 h VAL 65 CO 0.09 0.00 0.05 -0.08 -1.01 0.00 0.00 177.57 176.62 2k48 h GLU 66 N 0.00 0.25 0.11 4.17 4.57 -1.10 -3.22 114.58 119.36 2k48 h GLU 66 Ca 0.00 -0.05 -0.34 0.00 -1.18 0.00 0.00 59.36 57.79 2k48 h GLU 66 Cb 0.26 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.79 2k48 h GLU 66 CO 0.00 0.36 -1.82 -0.39 -1.18 0.00 0.00 179.01 175.98 2k48 h VAL 67 N 0.08 0.81 -1.38 0.32 -1.51 -1.33 -3.43 116.25 109.80 2k48 h VAL 67 Ca 0.05 -2.52 -0.33 0.00 -1.23 0.00 0.00 66.70 62.68 2k48 h VAL 67 Cb 0.22 2.58 -0.24 0.00 -2.13 0.00 0.00 31.29 31.71 2k48 h VAL 67 CO -0.00 0.81 -0.69 -0.67 -1.23 0.00 0.00 177.57 175.78 2k48 n ASP 68 N -3.41 -2.19 -2.68 4.19 2.03 -0.12 -5.07 116.55 109.29 2k48 n ASP 68 Ca -0.25 -2.78 -0.02 0.00 0.52 0.00 0.00 54.79 52.26 2k48 n ASP 68 Cb 1.05 0.86 -0.01 0.00 -0.72 0.00 0.00 41.12 42.31 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 2.63 0.18 -2.51 -0.67 -0.04 -1.21 -4.55 135.00 128.83 2k48 n PRO 69 Ca 0.21 -0.28 -0.35 0.00 -0.04 0.00 0.00 63.50 63.04 2k48 n PRO 69 Cb 0.54 -1.73 -0.03 0.00 -0.04 0.00 0.00 33.50 32.23 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 3.65 6.41 0.62 3.54 1.01 -1.26 -4.93 116.67 125.71 2k48 s ASP 70 Ca 0.05 1.99 0.33 0.00 0.71 0.00 0.00 52.55 55.63 2k48 s ASP 70 Cb 0.02 -2.57 1.87 0.00 1.01 0.00 0.00 42.92 43.25 2k48 s ASP 70 CO -0.00 -0.73 2.17 0.44 0.21 0.00 0.00 175.17 177.25 2k48 h ASP 71 N 1.82 0.00 -0.49 0.27 3.32 -2.00 0.12 116.42 119.46 2k48 h ASP 71 Ca -0.49 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.46 2k48 h ASP 71 Cb 1.22 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 2k48 h ASP 71 CO 0.60 0.00 -0.08 1.62 -1.72 0.00 0.00 179.24 179.66 2k48 h VAL 72 N 0.00 1.27 0.00 -1.35 3.04 -1.96 -1.04 116.25 116.21 2k48 h VAL 72 Ca 0.04 -1.20 -0.06 0.00 -1.01 0.00 0.00 66.70 64.47 2k48 h VAL 72 Cb 0.32 1.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.64 2k48 h VAL 72 CO -0.00 0.42 -0.28 0.78 -1.01 0.00 0.00 177.57 177.48 2k48 h ASN 73 N 0.77 0.00 0.34 3.17 2.35 -1.05 0.67 115.58 121.84 2k48 h ASN 73 Ca 0.13 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.64 2k48 h ASN 73 Cb 0.62 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.00 2k48 h ASN 73 CO 0.04 0.28 -1.00 0.11 -1.65 0.00 0.00 177.43 175.21 2k48 h LYS 74 N 0.00 0.42 -0.07 0.81 1.57 -1.54 -1.97 116.57 115.79 2k48 h LYS 74 Ca -0.00 -0.49 -0.19 0.00 -1.87 0.00 0.00 60.65 58.10 2k48 h LYS 74 Cb 0.69 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 2k48 h LYS 74 CO 0.04 1.15 -0.75 0.77 -0.57 0.00 0.00 179.45 180.08 2k48 h SER 75 N 0.22 0.50 0.14 0.86 0.02 -0.22 -2.66 113.55 112.41 2k48 h SER 75 Ca -0.10 -0.34 -0.02 0.00 -0.84 0.00 0.00 61.79 60.49 2k48 h SER 75 Cb 1.65 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 64.04 2k48 h SER 75 CO 0.17 1.09 -0.11 0.74 -1.14 0.00 0.00 176.83 177.58 2k48 h THR 76 N 0.28 0.97 0.28 -2.27 2.02 0.24 -0.18 112.91 114.24 2k48 h THR 76 Ca -0.04 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 2k48 h THR 76 Cb 1.34 1.21 0.00 0.00 -1.74 0.00 0.00 68.15 68.97 2k48 h THR 76 CO 0.13 0.11 -0.13 0.25 0.37 0.00 0.00 175.52 176.24 2k48 h LEU 77 N 0.00 -0.32 -2.44 2.58 7.12 -1.01 -1.27 115.31 119.98 2k48 h LEU 77 Ca -0.00 -0.14 0.01 0.00 0.13 0.00 0.00 57.88 57.88 2k48 h LEU 77 Cb 0.21 0.08 -0.00 0.00 -0.53 0.00 0.00 40.66 40.42 2k48 h LEU 77 CO 0.01 -0.03 0.05 1.56 -0.13 0.00 0.00 178.44 179.91 2k48 h GLN 78 N -0.61 0.00 -0.06 1.25 4.20 -1.08 0.28 115.11 119.08 2k48 h GLN 78 Ca -0.04 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 2k48 h GLN 78 Cb 0.44 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.23 2k48 h GLN 78 CO 0.06 0.00 -0.38 -0.97 -0.67 0.00 0.00 178.83 176.88 2k48 h ASN 79 N 0.00 0.43 -0.42 1.46 -0.73 -1.03 0.93 115.58 116.22 2k48 h ASN 79 Ca 0.02 -0.68 -0.11 0.00 1.87 0.00 0.00 56.30 57.40 2k48 h ASN 79 Cb 0.12 -0.13 -0.01 0.00 0.27 0.00 0.00 38.32 38.57 2k48 h ASN 79 CO -0.00 1.04 -0.18 0.03 -0.37 0.00 0.00 177.43 177.95 2k48 h ARG 80 N -0.15 0.86 0.00 6.67 2.47 0.13 -1.36 114.38 123.00 2k48 h ARG 80 Ca -0.03 -0.37 -0.03 0.00 -1.26 0.00 0.00 59.98 58.30 2k48 h ARG 80 Cb 1.05 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 29.33 2k48 h ARG 80 CO 0.08 1.01 -0.13 -0.09 0.56 0.00 0.00 179.97 181.39 2k48 h ARG 81 N 0.68 0.00 -0.07 0.04 2.43 -0.64 -1.26 114.38 115.55 2k48 h ARG 81 Ca 0.09 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 59.08 2k48 h ARG 81 Cb 0.74 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2k48 h ARG 81 CO 0.06 0.13 -0.75 0.00 -1.51 0.00 0.00 179.97 177.89 2k48 h ALA 82 N 1.87 0.56 -0.25 2.80 0.00 -0.34 -1.28 119.26 122.61 2k48 h ALA 82 Ca -0.00 -0.62 -0.02 0.00 0.00 0.00 0.00 54.91 54.27 2k48 h ALA 82 Cb 0.30 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2k48 h ALA 82 CO 0.02 0.77 0.08 0.00 0.00 0.00 0.00 179.25 180.12 2k48 h ALA 83 N 0.91 0.33 -0.99 0.00 0.00 -0.40 0.74 119.26 119.84 2k48 h ALA 83 Ca -0.04 -0.14 0.19 0.00 0.00 0.00 0.00 54.91 54.93 2k48 h ALA 83 Cb 1.34 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.93 2k48 h ALA 83 CO 0.13 -0.05 0.61 0.28 0.00 0.00 0.00 179.25 180.23 2k48 h VAL 84 N 0.24 0.70 -0.30 0.00 2.07 -1.20 0.20 116.25 117.96 2k48 h VAL 84 Ca 0.08 -0.24 -0.13 0.00 0.82 0.00 0.00 66.70 67.23 2k48 h VAL 84 Cb 0.23 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.92 2k48 h VAL 84 CO -0.00 0.13 -0.35 -1.28 0.02 0.00 0.00 177.57 176.09 2k48 h SER 85 N 0.71 0.71 0.17 0.57 0.87 -0.62 0.29 113.55 116.25 2k48 h SER 85 Ca 0.56 -0.30 0.01 0.00 -1.23 0.00 0.00 61.79 60.84 2k48 h SER 85 Cb 0.95 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.68 2k48 h SER 85 CO -0.35 1.00 -0.26 0.74 -0.53 0.00 0.00 176.83 177.43 2k48 h THR 86 N 0.57 0.43 -0.61 2.23 2.02 1.00 -0.01 112.91 118.53 2k48 h THR 86 Ca 0.06 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.20 2k48 h THR 86 Cb 0.87 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 2k48 h THR 86 CO 0.08 0.00 0.25 -0.07 0.37 0.00 0.00 175.52 176.14 2k48 h LEU 87 N -0.50 0.85 -0.19 2.58 -0.00 -0.56 0.65 115.31 118.13 2k48 h LEU 87 Ca 0.02 -0.17 -0.17 0.00 -0.00 0.00 0.00 57.88 57.56 2k48 h LEU 87 Cb 0.50 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 40.95 2k48 h LEU 87 CO -0.12 0.79 -0.53 -0.33 -0.00 0.00 0.00 178.44 178.25 2k48 h GLU 88 N 0.86 0.69 -0.28 1.13 4.39 -0.40 0.15 114.58 121.12 2k48 h GLU 88 Ca 0.20 -0.49 0.02 0.00 0.34 0.00 0.00 59.36 59.43 2k48 h GLU 88 Cb 0.20 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.91 2k48 h GLU 88 CO -0.02 1.11 0.12 1.15 -1.16 0.00 0.00 179.01 180.21 2k48 h THR 89 N 0.40 0.96 0.51 1.13 2.02 -0.82 -0.50 112.91 116.61 2k48 h THR 89 Ca -0.01 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 2k48 h THR 89 Cb 1.15 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.22 2k48 h THR 89 CO 0.11 0.05 -0.50 0.50 0.37 0.00 0.00 175.52 176.06 2k48 h LYS 90 N 0.26 -0.97 0.00 6.66 1.63 -0.83 -1.50 116.57 121.82 2k48 h LYS 90 Ca 0.12 0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 59.96 2k48 h LYS 90 Cb 0.06 0.22 -0.00 0.00 -0.60 0.00 0.00 32.23 31.91 2k48 h LYS 90 CO -0.10 -0.64 -0.12 -0.07 -3.45 0.00 0.00 179.45 175.07 2k48 h LEU 91 N -1.00 0.00 0.10 5.20 -0.00 -0.37 0.66 115.31 119.90 2k48 h LEU 91 Ca -0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.81 2k48 h LEU 91 Cb 0.86 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.52 2k48 h LEU 91 CO -0.05 0.12 -0.05 1.23 -0.00 0.00 0.00 178.44 179.69 2k48 h GLY 92 N 0.45 -0.15 1.46 0.83 0.00 -0.99 0.11 103.07 104.78 2k48 h GLY 92 Ca -0.00 0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 2k48 h GLY 92 CO 0.02 -0.05 0.15 1.05 0.00 0.00 0.00 176.54 177.70 2k48 h GLU 93 N -0.39 0.69 0.11 4.80 -0.00 0.06 -0.92 114.58 118.93 2k48 h GLU 93 Ca -0.01 -0.11 -0.01 0.00 -0.00 0.00 0.00 59.36 59.23 2k48 h GLU 93 Cb 0.32 -0.12 0.00 0.00 -0.00 0.00 0.00 28.75 28.95 2k48 h GLU 93 CO 0.02 0.61 -0.05 1.25 -0.00 0.00 0.00 179.01 180.84 2k48 h LEU 94 N 0.68 -0.12 -1.60 3.06 5.85 0.25 0.24 115.31 123.68 2k48 h LEU 94 Ca 0.16 -0.37 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 2k48 h LEU 94 Cb 0.20 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2k48 h LEU 94 CO -0.01 0.33 -0.18 0.11 -0.34 0.00 0.00 178.44 178.34 2k48 h LYS 95 N -0.60 0.02 -0.07 1.25 1.57 -0.73 0.07 116.57 118.09 2k48 h LYS 95 Ca -0.01 -0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.55 2k48 h LYS 95 Cb 0.48 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 2k48 h LYS 95 CO 0.02 0.21 -0.81 -0.09 -0.57 0.00 0.00 179.45 178.21 2k48 h ARG 96 N 0.02 0.51 -0.59 3.15 9.65 -1.04 -1.08 114.38 125.01 2k48 h ARG 96 Ca 0.00 -0.46 0.06 0.00 -1.10 0.00 0.00 59.98 58.49 2k48 h ARG 96 Cb 0.34 0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.97 2k48 h ARG 96 CO 0.02 1.09 0.29 1.96 2.80 0.00 0.00 179.97 186.14 2k48 h GLN 97 N 0.33 0.53 -0.00 0.20 4.20 0.31 -1.54 115.11 119.14 2k48 h GLN 97 Ca -0.05 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.64 2k48 h GLN 97 Cb 1.42 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 29.06 2k48 h GLN 97 CO 0.15 0.35 -0.09 -0.07 -0.67 0.00 0.00 178.83 178.50 2k48 h LEU 98 N 0.55 -0.25 -2.26 1.46 4.07 -0.91 0.17 115.31 118.15 2k48 h LEU 98 Ca 0.27 0.04 0.05 0.00 0.08 0.00 0.00 57.88 58.31 2k48 h LEU 98 Cb 0.21 0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.05 2k48 h LEU 98 CO -0.20 -0.13 0.18 0.00 -1.08 0.00 0.00 178.44 177.22 2k48 h ALA 99 N 0.83 1.76 0.16 1.53 0.00 -0.46 0.43 119.26 123.51 2k48 h ALA 99 Ca 0.03 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.73 2k48 h ALA 99 Cb 0.19 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.02 2k48 h ALA 99 CO -0.09 -0.26 -0.95 0.22 0.00 0.00 0.00 179.25 178.17 2k48 h ASP 100 N 0.00 0.51 0.01 0.00 3.58 -0.72 -3.22 116.42 116.59 2k48 h ASP 100 Ca 0.07 -0.94 0.03 0.00 0.42 0.00 0.00 57.03 56.61 2k48 h ASP 100 Cb 0.44 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.28 2k48 h ASP 100 CO -0.00 1.45 -0.20 -0.07 -2.88 0.00 0.00 179.24 177.54 2k48 h LEU 101 N -0.30 -0.59 -0.35 2.28 4.07 0.49 -3.12 115.31 117.79 2k48 h LEU 101 Ca -0.17 0.08 -0.07 0.00 0.08 0.00 0.00 57.88 57.81 2k48 h LEU 101 Cb 1.72 0.24 -0.01 0.00 1.08 0.00 0.00 40.66 43.69 2k48 h LEU 101 CO 0.16 -0.27 -0.04 0.58 -1.08 0.00 0.00 178.44 177.79 2k48 h VAL 102 N -0.33 1.27 0.00 1.22 2.07 -0.37 -0.00 116.25 120.10 2k48 h VAL 102 Ca 0.05 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.51 2k48 h VAL 102 Cb 0.40 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2k48 h VAL 102 CO -0.18 0.35 0.00 0.00 0.02 0.00 0.00 177.57 177.76 2k48 n ALA 103 N -2.41 1.80 0.00 1.67 0.00 -1.21 -1.46 120.51 118.91 2k48 n ALA 103 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2k48 n ALA 103 Cb 0.31 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.70 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 -0.69 1.37 0.25 0.00 0.00 -0.26 -4.68 120.51 116.50 2k48 n ALA 104 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.56 2k48 n ALA 104 Cb 0.01 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.11 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 0.09 -3.02 115.11 115.25 2k48 h GLN 105 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.69 2k48 h GLN 105 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.55 2k48 h GLN 105 CO 0.00 0.14 -0.23 0.87 0.09 0.00 0.00 178.83 179.69 2k48 h LYS 106 N 0.00 0.00 0.00 0.06 1.57 -1.82 -3.48 116.57 112.90 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 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2k48 h LYS 106 CO 0.02 0.23 0.00 1.28 -0.57 0.00 0.00 179.45 180.41