#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 1.47 -0.05 2.03 4.02 -1.26 -5.19 115.29 116.32 2k48 s HIS 2 Ca 0.00 -1.39 -0.08 0.00 1.02 0.00 0.00 55.06 54.61 2k48 s HIS 2 Cb 0.00 -0.75 0.01 0.00 -1.02 0.00 0.00 32.58 30.82 2k48 s HIS 2 CO 0.00 -0.58 0.20 -1.58 1.02 0.00 0.00 174.74 173.80 2k48 s HIS 3 N -3.78 -0.14 0.00 1.40 5.65 -1.26 -5.05 115.29 112.11 2k48 s HIS 3 Ca 0.38 0.32 0.00 0.00 0.25 0.00 0.00 55.06 56.01 2k48 s HIS 3 Cb 0.06 0.04 0.00 0.00 -1.18 0.00 0.00 32.58 31.50 2k48 s HIS 3 CO 0.17 -0.19 0.04 -2.39 -0.65 0.00 0.00 174.74 171.72 2k48 n HIS 4 N 2.35 0.00 0.34 3.88 -0.00 -1.26 -4.98 115.22 115.55 2k48 n HIS 4 Ca -0.17 0.00 0.14 0.00 -0.00 0.00 0.00 57.72 57.69 2k48 n HIS 4 Cb 0.57 0.03 0.59 0.00 -0.00 0.00 0.00 29.99 31.18 2k48 n HIS 4 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2k48 h HIS 5 N 0.00 0.00 -0.56 -1.40 -0.00 -2.10 -3.39 115.15 107.70 2k48 h HIS 5 Ca 0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 60.37 60.10 2k48 h HIS 5 Cb 0.58 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.96 2k48 h HIS 5 CO 0.00 0.00 0.77 -3.38 -0.00 0.00 0.00 177.93 175.32 2k48 s HIS 6 N -3.47 1.78 0.15 2.45 0.00 -1.26 -4.89 115.29 110.04 2k48 s HIS 6 Ca 0.03 0.77 -0.09 0.00 -3.00 0.00 0.00 55.06 52.76 2k48 s HIS 6 Cb 0.09 -3.94 -0.01 0.00 -4.00 0.00 0.00 32.58 24.73 2k48 s HIS 6 CO 0.43 -1.46 0.27 -1.58 -1.00 0.00 0.00 174.74 171.40 2k48 s HIS 7 N 11.20 0.34 -0.05 0.38 5.04 -1.26 -5.11 115.29 125.83 2k48 s HIS 7 Ca 0.72 -0.71 0.02 0.00 -1.54 0.00 0.00 55.06 53.54 2k48 s HIS 7 Cb -0.05 -0.05 0.06 0.00 0.04 0.00 0.00 32.58 32.58 2k48 s HIS 7 CO 0.06 -0.69 0.92 0.41 -2.34 0.00 0.00 174.74 173.10 2k48 n GLY 8 N -0.19 0.53 3.05 1.59 0.00 -1.26 -5.15 105.19 103.76 2k48 n GLY 8 Ca -0.09 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 2k48 n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k48 s LYS 9 N 0.02 0.50 0.90 1.61 -0.14 -1.26 -5.17 119.74 116.19 2k48 s LYS 9 Ca 0.01 -0.72 -0.12 0.00 -1.36 0.00 0.00 55.97 53.78 2k48 s LYS 9 Cb 0.06 -0.25 0.13 0.00 -1.68 0.00 0.00 37.83 36.09 2k48 s LYS 9 CO -0.02 0.04 1.11 -1.25 -0.76 0.00 0.00 175.35 174.47 2k48 s PRO 10 N -1.51 1.22 -0.12 -1.68 0.04 -1.26 -5.11 135.00 126.58 2k48 s PRO 10 Ca -0.10 0.51 -0.09 0.00 0.04 0.00 0.00 61.00 61.35 2k48 s PRO 10 Cb -0.10 -1.83 0.04 0.00 0.04 0.00 0.00 34.50 32.65 2k48 s PRO 10 CO 0.00 -2.19 0.31 -1.50 0.04 0.00 0.00 177.00 173.66 2k48 s ILE 11 N -3.12 -0.01 0.99 0.56 2.07 -1.26 -5.18 121.20 115.24 2k48 s ILE 11 Ca 0.63 0.04 -0.16 0.00 -1.41 0.00 0.00 60.65 59.75 2k48 s ILE 11 Cb -0.16 -0.44 0.21 0.00 0.13 0.00 0.00 42.46 42.19 2k48 s ILE 11 CO 0.55 0.02 1.29 -2.16 -1.91 0.00 0.00 174.94 172.73 2k48 s PRO 12 N 0.56 0.41 -0.03 3.50 0.04 -1.26 -5.12 135.00 133.09 2k48 s PRO 12 Ca -0.03 -0.34 0.01 0.00 0.04 0.00 0.00 61.00 60.68 2k48 s PRO 12 Cb -0.05 -1.81 0.01 0.00 0.04 0.00 0.00 34.50 32.70 2k48 s PRO 12 CO -0.03 -2.58 -0.04 -0.80 0.04 0.00 0.00 177.00 173.59 2k48 s ASN 13 N -4.74 0.70 0.57 6.66 -0.87 -1.26 -5.16 114.94 110.83 2k48 s ASN 13 Ca 0.73 -0.09 -0.15 0.00 -1.57 0.00 0.00 52.86 51.78 2k48 s ASN 13 Cb -0.05 -0.27 -0.05 0.00 -0.02 0.00 0.00 41.25 40.86 2k48 s ASN 13 CO 0.53 -0.02 1.02 -2.16 -2.57 0.00 0.00 177.10 173.90 2k48 s PRO 14 N 0.58 3.61 -0.02 -0.60 0.04 -1.26 -5.10 135.00 132.26 2k48 s PRO 14 Ca -0.07 1.03 -0.06 0.00 0.04 0.00 0.00 61.00 61.94 2k48 s PRO 14 Cb -0.10 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.36 2k48 s PRO 14 CO -0.00 -0.56 0.13 -0.51 0.04 0.00 0.00 177.00 176.10 2k48 s LEU 15 N -4.44 1.54 0.00 -3.56 1.43 -1.26 -5.05 118.68 107.34 2k48 s LEU 15 Ca 0.60 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 2k48 s LEU 15 Cb -0.13 0.59 0.00 0.00 0.03 0.00 0.00 46.19 46.68 2k48 s LEU 15 CO 0.37 -0.24 0.00 -0.11 0.23 0.00 0.00 176.35 176.60 2k48 n LEU 16 N 2.06 0.00 -0.04 1.79 7.94 -1.26 -5.18 117.00 122.31 2k48 n LEU 16 Ca -0.19 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.72 2k48 n LEU 16 Cb 0.57 0.10 -0.00 0.00 0.53 0.00 0.00 43.42 44.62 2k48 n LEU 16 CO 0.21 -0.10 -0.01 0.61 -1.11 0.00 0.00 177.39 176.99 2k48 n GLY 17 N -1.42 -1.56 3.29 -3.96 0.00 -1.26 -5.06 105.19 95.22 2k48 n GLY 17 Ca 0.00 -1.51 -0.13 0.00 0.00 0.00 0.00 46.02 44.37 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 -3.32 0.51 0.03 0.99 0.20 -1.26 -5.18 118.68 110.65 2k48 s LEU 18 Ca 0.00 0.62 -0.12 0.00 0.69 0.00 0.00 54.13 55.32 2k48 s LEU 18 Cb 0.00 1.41 0.01 0.00 -0.43 0.00 0.00 46.19 47.18 2k48 s LEU 18 CO 0.00 -0.24 0.25 -0.62 -0.29 0.00 0.00 176.35 175.45 2k48 s ASP 19 N -0.24 -0.06 0.00 3.68 2.15 -1.26 -5.06 116.67 115.88 2k48 s ASP 19 Ca -0.04 -0.24 0.00 0.00 0.43 0.00 0.00 52.55 52.71 2k48 s ASP 19 Cb -0.03 0.32 0.00 0.00 -0.30 0.00 0.00 42.92 42.91 2k48 s ASP 19 CO 0.02 -0.57 0.31 -1.54 -0.17 0.00 0.00 175.17 173.22 2k48 n SER 20 N 0.72 0.00 -4.55 -0.34 3.41 -1.26 -5.09 113.62 106.51 2k48 n SER 20 Ca -0.19 -1.00 -0.34 0.00 -0.26 0.00 0.00 58.87 57.08 2k48 n SER 20 Cb 0.59 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.50 2k48 n SER 20 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2k48 s THR 21 N 0.00 3.23 -0.28 6.66 2.01 -1.26 -4.90 115.64 121.10 2k48 s THR 21 Ca 0.00 0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.06 2k48 s THR 21 Cb 0.00 -3.59 0.15 0.00 0.01 0.00 0.00 72.50 69.07 2k48 s THR 21 CO 0.00 -0.56 0.38 -0.70 -0.69 0.00 0.00 174.62 173.04 2k48 s GLU 22 N 7.58 0.38 -0.16 4.92 2.12 -1.26 -5.15 118.70 127.13 2k48 s GLU 22 Ca 0.79 0.15 -0.19 0.00 0.36 0.00 0.00 54.97 56.09 2k48 s GLU 22 Cb -0.13 -0.42 0.05 0.00 0.26 0.00 0.00 34.13 33.88 2k48 s GLU 22 CO 0.19 -0.95 0.51 1.21 -0.54 0.00 0.00 175.26 175.67 2k48 s ASN 23 N 2.50 -0.51 0.00 -1.70 2.47 -1.26 -5.11 114.94 111.34 2k48 s ASN 23 Ca 0.10 0.89 0.00 0.00 0.42 0.00 0.00 52.86 54.27 2k48 s ASN 23 Cb -0.13 0.91 0.00 0.00 -1.45 0.00 0.00 41.25 40.57 2k48 s ASN 23 CO -0.28 -0.26 0.00 0.18 -3.72 0.00 0.00 177.10 173.03 2k48 n LEU 24 N 2.42 0.00 -3.93 3.21 4.77 -1.26 -5.08 117.00 117.12 2k48 n LEU 24 Ca -0.15 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.53 2k48 n LEU 24 Cb 0.56 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.64 2k48 n LEU 24 CO 0.13 0.00 -0.20 -1.22 -1.33 0.00 0.00 177.39 174.77 2k48 n TYR 25 N -0.83 -0.95 -4.20 -1.77 4.01 -1.26 -4.95 117.16 107.21 2k48 n TYR 25 Ca 0.00 0.17 -0.15 0.00 -0.16 0.00 0.00 57.90 57.76 2k48 n TYR 25 Cb 0.00 -1.98 -0.08 0.00 -0.31 0.00 0.00 39.34 36.97 2k48 n TYR 25 CO 0.00 0.00 0.00 -0.59 -0.46 0.00 0.00 176.86 175.81 2k48 s PHE 26 N -3.96 1.33 0.00 -0.72 -0.71 -1.26 -5.06 117.98 107.60 2k48 s PHE 26 Ca 0.23 -1.44 0.00 0.00 -1.04 0.00 0.00 56.93 54.69 2k48 s PHE 26 Cb -0.13 -0.50 0.00 0.00 -1.21 0.00 0.00 43.02 41.18 2k48 s PHE 26 CO 0.71 -0.83 1.33 1.04 -1.34 0.00 0.00 175.22 176.13 2k48 n GLN 27 N -0.47 0.70 0.00 1.99 6.02 -1.26 -4.70 117.38 119.67 2k48 n GLN 27 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 2k48 n GLN 27 Cb 0.64 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.75 2k48 n GLN 27 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2k48 n GLY 28 N 1.55 1.50 3.31 1.08 0.00 -1.26 -4.76 105.19 106.61 2k48 n GLY 28 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2k48 n GLY 28 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2k48 s ILE 29 N 0.02 0.01 0.42 -0.61 1.10 -1.26 -5.17 121.20 115.71 2k48 s ILE 29 Ca 0.00 -0.08 -0.24 0.00 -0.51 0.00 0.00 60.65 59.82 2k48 s ILE 29 Cb 0.00 -0.61 -0.08 0.00 0.15 0.00 0.00 42.46 41.92 2k48 s ILE 29 CO 0.00 -0.04 1.15 -1.81 -2.11 0.00 0.00 174.94 172.12 2k48 s ASP 30 N -0.10 6.43 0.00 4.50 1.01 -1.26 -4.97 116.67 122.28 2k48 s ASP 30 Ca -0.03 2.28 0.27 0.00 0.71 0.00 0.00 52.55 55.78 2k48 s ASP 30 Cb -0.03 -2.60 1.23 0.00 1.01 0.00 0.00 42.92 42.52 2k48 s ASP 30 CO 0.02 -0.74 1.88 -0.81 0.21 0.00 0.00 175.17 175.73 2k48 n PRO 31 N -0.16 0.17 -0.30 8.23 -0.04 -1.26 -4.39 135.00 137.25 2k48 n PRO 31 Ca 0.06 0.04 0.15 0.00 -0.04 0.00 0.00 63.50 63.70 2k48 n PRO 31 Cb 0.48 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.83 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 0.84 -0.22 0.54 3.57 -1.99 -0.48 116.94 119.21 2k48 h PHE 32 Ca 0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 2k48 h PHE 32 Cb 0.36 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 2k48 h PHE 32 CO 0.00 0.23 0.09 1.79 -2.23 0.00 0.00 178.31 178.18 2k48 h THR 33 N 0.64 1.09 0.00 4.41 1.35 -1.99 -1.13 112.91 117.28 2k48 h THR 33 Ca 0.52 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 66.11 2k48 h THR 33 Cb 0.96 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 2k48 h THR 33 CO -0.27 0.10 -0.94 0.80 -0.25 0.00 0.00 175.52 174.96 2k48 n MET 34 N -4.45 0.22 -0.19 4.72 0.00 -0.28 -2.55 117.12 114.59 2k48 n MET 34 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.70 57.63 2k48 n MET 34 Cb 0.12 -1.57 0.07 0.00 0.00 0.00 0.00 33.22 31.83 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 0.98 -0.62 6.12 0.02 -0.61 -0.95 113.55 118.48 2k48 h SER 35 Ca 0.00 -0.26 -0.03 0.00 -0.84 0.00 0.00 61.79 60.66 2k48 h SER 35 Cb 0.68 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 2k48 h SER 35 CO 0.00 1.02 0.29 0.74 -1.14 0.00 0.00 176.83 177.74 2k48 h THR 36 N 0.93 1.22 -0.14 -2.27 2.02 -1.30 -1.95 112.91 111.43 2k48 h THR 36 Ca 0.17 -0.66 0.03 0.00 0.77 0.00 0.00 66.41 66.73 2k48 h THR 36 Cb 0.51 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 2k48 h THR 36 CO 0.02 0.27 -0.07 -0.07 0.37 0.00 0.00 175.52 176.05 2k48 h LEU 37 N 0.93 -0.22 -0.89 2.58 -0.00 -1.15 0.90 115.31 117.47 2k48 h LEU 37 Ca 0.22 0.06 -0.09 0.00 -0.00 0.00 0.00 57.88 58.07 2k48 h LEU 37 Cb 0.14 0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.91 2k48 h LEU 37 CO -0.02 -0.09 -0.11 1.56 -0.00 0.00 0.00 178.44 179.78 2k48 h GLN 38 N -0.05 0.70 -0.13 1.13 4.20 -0.74 0.18 115.11 120.40 2k48 h GLN 38 Ca 0.08 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 2k48 h GLN 38 Cb 0.17 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 2k48 h GLN 38 CO -0.18 0.79 0.02 1.49 -0.67 0.00 0.00 178.83 180.29 2k48 h GLU 39 N 0.64 0.22 0.15 1.46 4.57 -1.30 -2.96 114.58 117.35 2k48 h GLU 39 Ca 0.11 -0.06 -0.29 0.00 -1.18 0.00 0.00 59.36 57.95 2k48 h GLU 39 Cb 0.56 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 29.13 2k48 h GLU 39 CO 0.03 0.41 -1.30 1.25 -1.18 0.00 0.00 179.01 178.22 2k48 h LEU 40 N -0.01 0.48 -1.57 1.64 5.85 -0.30 0.22 115.31 121.61 2k48 h LEU 40 Ca 0.04 -0.53 -0.05 0.00 0.84 0.00 0.00 57.88 58.18 2k48 h LEU 40 Cb 0.30 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2k48 h LEU 40 CO 0.00 1.42 -0.22 -0.61 -0.34 0.00 0.00 178.44 178.69 2k48 h GLN 41 N 0.08 0.00 0.14 1.25 -0.00 -0.81 0.17 115.11 115.94 2k48 h GLN 41 Ca -0.16 0.00 -0.28 0.00 -0.00 0.00 0.00 58.65 58.20 2k48 h GLN 41 Cb 2.01 0.00 0.01 0.00 0.00 0.00 0.00 27.48 29.50 2k48 h GLN 41 CO 0.21 0.22 -1.26 1.49 0.00 0.00 0.00 178.83 179.49 2k48 h GLU 42 N 0.00 0.39 -0.70 1.69 4.57 -1.36 -3.03 114.58 116.14 2k48 h GLU 42 Ca -0.00 -0.60 -0.01 0.00 -1.18 0.00 0.00 59.36 57.57 2k48 h GLU 42 Cb 0.49 0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 29.26 2k48 h GLU 42 CO 0.03 1.27 0.40 -0.97 -1.18 0.00 0.00 179.01 178.57 2k48 h ASN 43 N 0.13 0.85 -0.23 1.04 -0.73 0.13 0.17 115.58 116.94 2k48 h ASN 43 Ca -0.16 -0.08 0.06 0.00 1.87 0.00 0.00 56.30 57.99 2k48 h ASN 43 Cb 1.96 -0.21 -0.07 0.00 0.27 0.00 0.00 38.32 40.26 2k48 h ASN 43 CO 0.22 0.68 -0.35 0.40 -0.37 0.00 0.00 177.43 178.00 2k48 h ILE 44 N 0.95 0.22 -0.51 2.57 1.08 -0.78 0.12 117.51 121.16 2k48 h ILE 44 Ca 0.25 0.00 -0.12 0.00 -0.39 0.00 0.00 64.86 64.60 2k48 h ILE 44 Cb -0.00 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 33.95 2k48 h ILE 44 CO -0.04 0.00 -0.15 0.74 -0.69 0.00 0.00 178.15 178.00 2k48 h THR 45 N -0.37 1.27 -0.00 -0.27 2.02 -1.27 0.60 112.91 114.88 2k48 h THR 45 Ca 0.11 -1.31 -0.23 0.00 0.77 0.00 0.00 66.41 65.76 2k48 h THR 45 Cb 0.57 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2k48 h THR 45 CO -0.43 0.46 -0.95 0.00 0.37 0.00 0.00 175.52 174.97 2k48 h ALA 46 N 0.94 0.34 0.00 6.16 0.00 -0.53 0.27 119.26 126.44 2k48 h ALA 46 Ca 0.13 -0.70 -0.04 0.00 0.00 0.00 0.00 54.91 54.29 2k48 h ALA 46 Cb 0.72 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2k48 h ALA 46 CO 0.06 0.80 -0.21 1.25 0.00 0.00 0.00 179.25 181.14 2k48 h HIS 47 N 0.26 0.00 -0.09 0.00 6.17 -0.72 0.13 115.15 120.90 2k48 h HIS 47 Ca -0.08 0.00 -0.24 0.00 0.71 0.00 0.00 60.37 60.75 2k48 h HIS 47 Cb 1.58 0.00 0.02 0.00 2.52 0.00 0.00 27.41 31.53 2k48 h HIS 47 CO 0.07 0.21 -0.89 0.93 0.71 0.00 0.00 177.93 178.95 2k48 h GLU 48 N 0.00 0.76 -0.09 5.26 5.08 0.34 -0.87 114.58 125.06 2k48 h GLU 48 Ca -0.00 -0.70 -0.19 0.00 -1.00 0.00 0.00 59.36 57.47 2k48 h GLU 48 Cb 0.93 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 2k48 h GLU 48 CO 0.03 1.29 -0.74 1.96 -1.00 0.00 0.00 179.01 180.55 2k48 h GLN 49 N 0.48 0.48 0.00 2.33 7.50 -0.83 0.33 115.11 125.41 2k48 h GLN 49 Ca -0.09 -0.39 -0.03 0.00 0.50 0.00 0.00 58.65 58.64 2k48 h GLN 49 Cb 1.53 0.08 -0.00 0.00 0.05 0.00 0.00 27.48 29.14 2k48 h GLN 49 CO 0.18 1.03 -0.13 1.96 -1.50 0.00 0.00 178.83 180.36 2k48 h GLN 50 N 0.33 0.00 -0.02 1.46 4.20 -0.80 0.27 115.11 120.54 2k48 h GLN 50 Ca -0.04 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.61 2k48 h GLN 50 Cb 1.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.11 2k48 h GLN 50 CO 0.13 0.13 -0.23 1.25 -0.67 0.00 0.00 178.83 179.44 2k48 h LEU 51 N 0.00 0.24 -1.04 1.46 5.85 -0.01 0.21 115.31 122.02 2k48 h LEU 51 Ca -0.00 -0.72 0.04 0.00 0.84 0.00 0.00 57.88 58.04 2k48 h LEU 51 Cb 0.40 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 2k48 h LEU 51 CO 0.02 0.92 0.64 -0.37 -0.34 0.00 0.00 178.44 179.32 2k48 h VAL 52 N -0.43 1.16 -0.48 1.05 -1.51 -0.24 0.15 116.25 115.95 2k48 h VAL 52 Ca -0.02 -0.42 -0.10 0.00 -1.23 0.00 0.00 66.70 64.93 2k48 h VAL 52 Cb 0.94 -0.18 -0.02 0.00 -2.13 0.00 0.00 31.29 29.91 2k48 h VAL 52 CO 0.05 0.23 -0.07 0.74 -1.23 0.00 0.00 177.57 177.28 2k48 h THR 53 N 1.23 1.27 -0.59 7.19 2.02 -0.99 0.35 112.91 123.39 2k48 h THR 53 Ca 0.40 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 2k48 h THR 53 Cb 0.02 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 2k48 h THR 53 CO -0.13 0.41 0.33 0.00 0.37 0.00 0.00 175.52 176.51 2k48 h ALA 54 N 0.90 1.47 -0.55 6.16 0.00 0.85 0.72 119.26 128.81 2k48 h ALA 54 Ca 0.13 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2k48 h ALA 54 Cb 0.61 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2k48 h ALA 54 CO 0.04 0.44 0.25 0.00 0.00 0.00 0.00 179.25 179.98 2k48 h ARG 55 N 0.82 0.81 -0.54 0.00 -0.00 -0.44 -0.04 114.38 114.99 2k48 h ARG 55 Ca 0.21 -0.13 -0.08 0.00 -0.50 0.00 0.00 59.98 59.48 2k48 h ARG 55 Cb 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 29.97 29.81 2k48 h ARG 55 CO -0.04 0.68 0.00 0.37 0.00 0.00 0.00 179.97 180.99 2k48 h GLN 56 N 0.75 0.93 -0.43 0.04 4.15 0.74 0.18 115.11 121.47 2k48 h GLN 56 Ca 0.19 -0.27 -0.15 0.00 0.77 0.00 0.00 58.65 59.19 2k48 h GLN 56 Cb 0.15 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 2k48 h GLN 56 CO -0.02 0.92 -0.31 0.87 -1.93 0.00 0.00 178.83 178.36 2k48 h LYS 57 N 0.85 0.97 -0.27 1.69 1.79 0.43 -0.98 116.57 121.06 2k48 h LYS 57 Ca 0.16 -0.46 -0.08 0.00 -2.18 0.00 0.00 60.65 58.09 2k48 h LYS 57 Cb 0.50 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.13 2k48 h LYS 57 CO 0.02 1.13 -0.16 1.37 -1.08 0.00 0.00 179.45 180.73 2k48 h LEU 58 N 0.81 0.46 -1.17 2.94 8.10 -0.76 -0.88 115.31 124.80 2k48 h LEU 58 Ca 0.08 -0.13 -0.07 0.00 0.11 0.00 0.00 57.88 57.87 2k48 h LEU 58 Cb 0.89 -0.12 -0.01 0.00 -0.44 0.00 0.00 40.66 40.98 2k48 h LEU 58 CO 0.08 0.65 -0.22 0.50 -4.11 0.00 0.00 178.44 175.34 2k48 h LYS 59 N 0.43 0.30 0.00 0.17 3.64 -0.62 0.20 116.57 120.69 2k48 h LYS 59 Ca 0.08 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 2k48 h LYS 59 Cb 0.53 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2k48 h LYS 59 CO 0.03 0.51 -0.15 0.22 -2.27 0.00 0.00 179.45 177.79 2k48 h ASP 60 N 0.27 0.00 0.77 4.20 3.58 -0.67 0.18 116.42 124.76 2k48 h ASP 60 Ca 0.05 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.25 2k48 h ASP 60 Cb 0.55 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.59 2k48 h ASP 60 CO 0.04 0.15 -1.17 0.00 -2.88 0.00 0.00 179.24 175.38 2k48 h ALA 61 N 1.85 0.22 -0.44 -0.78 0.00 0.23 -2.34 119.26 118.00 2k48 h ALA 61 Ca -0.00 -0.92 -0.10 0.00 0.00 0.00 0.00 54.91 53.89 2k48 h ALA 61 Cb 0.53 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2k48 h ALA 61 CO 0.02 1.10 -0.14 0.93 0.00 0.00 0.00 179.25 181.17 2k48 h GLU 62 N 0.04 0.81 -0.87 0.00 5.08 -0.29 -1.83 114.58 117.53 2k48 h GLU 62 Ca -0.09 -0.29 0.07 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 31.03 2k48 h GLU 62 CO 0.17 0.90 0.56 -0.22 -1.00 0.00 0.00 179.01 179.43 2k48 h LYS 63 N 0.73 0.92 -0.32 2.33 1.63 -0.69 0.99 116.57 122.15 2k48 h LYS 63 Ca 0.12 -0.06 -0.15 0.00 -0.85 0.00 0.00 60.65 59.71 2k48 h LYS 63 Cb 0.64 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 32.05 2k48 h LYS 63 CO 0.04 0.61 -0.41 0.00 -3.45 0.00 0.00 179.45 176.25 2k48 h ALA 64 N 1.54 0.67 0.00 5.00 0.00 -0.78 -0.77 119.26 124.92 2k48 h ALA 64 Ca 0.38 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2k48 h ALA 64 Cb 0.25 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2k48 h ALA 64 CO -0.14 0.67 -0.15 -0.24 0.00 0.00 0.00 179.25 179.39 2k48 h VAL 65 N 0.64 0.28 -0.58 0.00 3.04 -1.16 0.14 116.25 118.62 2k48 h VAL 65 Ca 0.05 -1.23 -0.06 0.00 -1.01 0.00 0.00 66.70 64.45 2k48 h VAL 65 Cb 0.97 1.99 -0.03 0.00 -2.01 0.00 0.00 31.29 32.21 2k48 h VAL 65 CO 0.09 0.15 0.11 -0.08 -1.01 0.00 0.00 177.57 176.83 2k48 h GLU 66 N 0.00 0.92 0.00 4.17 4.57 -0.41 -3.27 114.58 120.56 2k48 h GLU 66 Ca -0.00 -0.22 -0.08 0.00 -1.18 0.00 0.00 59.36 57.88 2k48 h GLU 66 Cb 0.98 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.43 2k48 h GLU 66 CO 0.02 0.85 -1.56 1.55 -1.18 0.00 0.00 179.01 178.69 2k48 n VAL 67 N -4.24 0.31 -2.96 0.32 3.14 -0.33 -4.80 118.33 109.77 2k48 n VAL 67 Ca 0.04 -0.31 -0.15 0.00 -2.96 0.00 0.00 64.34 60.96 2k48 n VAL 67 Cb 0.26 -0.21 -0.01 0.00 -1.06 0.00 0.00 33.84 32.82 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 -2.09 -1.71 -2.55 6.55 2.03 0.49 -5.07 116.55 114.20 2k48 n ASP 68 Ca -0.08 -2.96 0.00 0.00 0.52 0.00 0.00 54.79 52.26 2k48 n ASP 68 Cb 0.52 0.77 0.00 0.00 -0.72 0.00 0.00 41.12 41.69 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 1.84 0.00 -2.47 -0.67 -0.04 -1.23 -4.57 135.00 127.86 2k48 n PRO 69 Ca 0.16 -0.02 -0.34 0.00 -0.04 0.00 0.00 63.50 63.25 2k48 n PRO 69 Cb 0.57 -1.48 -0.03 0.00 -0.04 0.00 0.00 33.50 32.53 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 2.95 6.20 0.62 3.54 1.01 -1.26 -4.93 116.67 124.80 2k48 s ASP 70 Ca 0.00 2.00 0.34 0.00 0.71 0.00 0.00 52.55 55.60 2k48 s ASP 70 Cb 0.00 -2.57 1.90 0.00 1.01 0.00 0.00 42.92 43.27 2k48 s ASP 70 CO 0.00 -0.88 2.18 0.44 0.21 0.00 0.00 175.17 177.13 2k48 h ASP 71 N 1.52 0.00 -0.56 0.27 3.32 -2.01 0.14 116.42 119.11 2k48 h ASP 71 Ca -0.50 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.45 2k48 h ASP 71 Cb 1.23 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 2k48 h ASP 71 CO 0.59 0.00 -0.05 1.62 -1.72 0.00 0.00 179.24 179.68 2k48 h VAL 72 N 0.00 1.27 0.00 -1.35 3.04 -1.96 -1.22 116.25 116.03 2k48 h VAL 72 Ca 0.03 -1.19 -0.06 0.00 -1.01 0.00 0.00 66.70 64.47 2k48 h VAL 72 Cb 0.28 0.91 -0.01 0.00 -2.01 0.00 0.00 31.29 30.46 2k48 h VAL 72 CO -0.00 0.42 -0.28 0.78 -1.01 0.00 0.00 177.57 177.49 2k48 h ASN 73 N 0.90 0.00 0.00 3.17 2.35 -1.00 0.74 115.58 121.73 2k48 h ASN 73 Ca 0.15 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.65 2k48 h ASN 73 Cb 0.61 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.00 2k48 h ASN 73 CO 0.04 0.28 -0.97 0.11 -1.65 0.00 0.00 177.43 175.23 2k48 h LYS 74 N 0.00 0.66 -0.15 0.81 1.57 -1.54 -1.83 116.57 116.09 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 0.72 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.22 2k48 h LYS 74 CO 0.04 1.29 -0.40 0.77 -0.57 0.00 0.00 179.45 180.58 2k48 h SER 75 N 0.31 0.35 0.30 0.86 0.02 -0.48 -2.07 113.55 112.85 2k48 h SER 75 Ca -0.12 -0.15 -0.05 0.00 -0.84 0.00 0.00 61.79 60.63 2k48 h SER 75 Cb 1.64 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 64.07 2k48 h SER 75 CO 0.19 0.72 -0.24 0.74 -1.14 0.00 0.00 176.83 177.10 2k48 h THR 76 N 0.28 1.06 0.12 -2.27 2.02 0.39 -0.34 112.91 114.17 2k48 h THR 76 Ca 0.03 -0.86 -0.01 0.00 0.77 0.00 0.00 66.41 66.34 2k48 h THR 76 Cb 0.83 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.72 2k48 h THR 76 CO 0.07 0.24 -0.06 0.25 0.37 0.00 0.00 175.52 176.39 2k48 h LEU 77 N 0.00 -0.13 -2.27 2.58 7.12 -0.62 -1.21 115.31 120.77 2k48 h LEU 77 Ca -0.00 -0.22 0.03 0.00 0.13 0.00 0.00 57.88 57.82 2k48 h LEU 77 Cb 0.46 0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 40.62 2k48 h LEU 77 CO 0.03 0.15 0.10 1.56 -0.13 0.00 0.00 178.44 180.15 2k48 h GLN 78 N -0.42 0.00 -0.05 1.25 4.20 -1.02 0.27 115.11 119.35 2k48 h GLN 78 Ca -0.02 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.59 2k48 h GLN 78 Cb 0.34 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.13 2k48 h GLN 78 CO 0.03 0.00 -0.39 -0.97 -0.67 0.00 0.00 178.83 176.82 2k48 h ASN 79 N 0.00 0.43 -0.39 1.46 -0.73 -1.04 0.67 115.58 115.98 2k48 h ASN 79 Ca 0.05 -0.69 -0.14 0.00 1.87 0.00 0.00 56.30 57.39 2k48 h ASN 79 Cb 0.24 -0.13 -0.01 0.00 0.27 0.00 0.00 38.32 38.69 2k48 h ASN 79 CO -0.00 1.05 -0.27 0.03 -0.37 0.00 0.00 177.43 177.87 2k48 h ARG 80 N -0.17 0.91 0.00 6.67 2.47 0.14 -1.48 114.38 122.91 2k48 h ARG 80 Ca -0.04 -0.41 -0.03 0.00 -1.26 0.00 0.00 59.98 58.25 2k48 h ARG 80 Cb 1.07 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 29.37 2k48 h ARG 80 CO 0.08 1.06 -0.13 -0.09 0.56 0.00 0.00 179.97 181.45 2k48 h ARG 81 N 0.77 0.00 -0.06 0.04 2.43 -0.64 -0.72 114.38 116.20 2k48 h ARG 81 Ca 0.09 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.12 2k48 h ARG 81 Cb 0.83 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 2k48 h ARG 81 CO 0.07 0.13 -0.61 0.00 -1.51 0.00 0.00 179.97 178.05 2k48 h ALA 82 N 1.87 0.86 -0.07 2.80 0.00 -0.38 0.06 119.26 124.40 2k48 h ALA 82 Ca -0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 2k48 h ALA 82 Cb 0.23 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2k48 h ALA 82 CO 0.02 0.73 -0.02 0.00 0.00 0.00 0.00 179.25 179.98 2k48 h ALA 83 N 1.21 0.10 -0.98 0.00 0.00 -0.33 0.46 119.26 119.72 2k48 h ALA 83 Ca -0.01 -0.22 0.18 0.00 0.00 0.00 0.00 54.91 54.86 2k48 h ALA 83 Cb 1.11 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.78 2k48 h ALA 83 CO 0.09 -0.17 0.61 0.28 0.00 0.00 0.00 179.25 180.07 2k48 h VAL 84 N -0.22 0.73 -0.40 0.00 2.07 -1.09 0.22 116.25 117.57 2k48 h VAL 84 Ca 0.02 -0.25 -0.12 0.00 0.82 0.00 0.00 66.70 67.16 2k48 h VAL 84 Cb 0.44 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 2k48 h VAL 84 CO 0.01 0.13 -0.24 -1.28 0.02 0.00 0.00 177.57 176.21 2k48 h SER 85 N 0.73 0.84 0.19 0.57 0.87 -0.77 0.29 113.55 116.27 2k48 h SER 85 Ca 0.54 -0.32 0.01 0.00 -1.23 0.00 0.00 61.79 60.80 2k48 h SER 85 Cb 0.89 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.59 2k48 h SER 85 CO -0.32 1.05 -0.28 0.74 -0.53 0.00 0.00 176.83 177.48 2k48 h THR 86 N 0.71 0.39 -0.61 2.23 2.02 0.11 -0.19 112.91 117.57 2k48 h THR 86 Ca 0.09 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.24 2k48 h THR 86 Cb 0.77 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 2k48 h THR 86 CO 0.06 0.00 0.24 -0.07 0.37 0.00 0.00 175.52 176.12 2k48 h LEU 87 N -0.54 0.84 -0.26 2.58 -0.00 -0.54 0.55 115.31 117.95 2k48 h LEU 87 Ca 0.01 -0.17 -0.14 0.00 -0.00 0.00 0.00 57.88 57.57 2k48 h LEU 87 Cb 0.54 -0.22 -0.00 0.00 -0.00 0.00 0.00 40.66 40.98 2k48 h LEU 87 CO -0.12 0.79 -0.40 -0.33 -0.00 0.00 0.00 178.44 178.38 2k48 h GLU 88 N 0.85 0.73 -0.20 1.13 4.39 -0.40 0.15 114.58 121.22 2k48 h GLU 88 Ca 0.20 -0.44 0.02 0.00 0.34 0.00 0.00 59.36 59.49 2k48 h GLU 88 Cb 0.21 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 2k48 h GLU 88 CO -0.02 1.06 0.06 1.15 -1.16 0.00 0.00 179.01 180.10 2k48 h THR 89 N 0.46 0.94 0.39 1.13 2.02 -0.84 -1.06 112.91 115.96 2k48 h THR 89 Ca 0.02 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 2k48 h THR 89 Cb 0.99 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.15 2k48 h THR 89 CO 0.09 0.03 -0.51 0.50 0.37 0.00 0.00 175.52 176.00 2k48 h LYS 90 N 0.15 -0.89 0.00 6.66 1.63 -0.84 -1.55 116.57 121.72 2k48 h LYS 90 Ca 0.09 0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.92 2k48 h LYS 90 Cb 0.06 0.20 -0.00 0.00 -0.60 0.00 0.00 32.23 31.89 2k48 h LYS 90 CO -0.10 -0.60 -0.13 -0.07 -3.45 0.00 0.00 179.45 175.10 2k48 h LEU 91 N -0.93 0.00 -0.00 5.20 -0.00 -0.35 0.66 115.31 119.89 2k48 h LEU 91 Ca -0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.83 2k48 h LEU 91 Cb 0.83 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.49 2k48 h LEU 91 CO -0.12 0.13 -0.00 1.23 -0.00 0.00 0.00 178.44 179.68 2k48 h GLY 92 N 0.60 0.01 1.80 0.83 0.00 -1.09 0.11 103.07 105.34 2k48 h GLY 92 Ca -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.28 2k48 h GLY 92 CO 0.02 0.01 -0.06 1.05 0.00 0.00 0.00 176.54 177.55 2k48 h GLU 93 N -0.34 0.25 0.05 4.80 -0.00 0.03 -1.07 114.58 118.30 2k48 h GLU 93 Ca 0.00 -0.05 -0.00 0.00 -0.00 0.00 0.00 59.36 59.31 2k48 h GLU 93 Cb 0.35 -0.04 0.00 0.00 -0.00 0.00 0.00 28.75 29.06 2k48 h GLU 93 CO 0.00 0.33 -0.02 1.25 -0.00 0.00 0.00 179.01 180.57 2k48 h LEU 94 N 0.24 -0.06 -1.95 3.06 5.85 0.24 0.18 115.31 122.88 2k48 h LEU 94 Ca 0.05 -0.60 -0.01 0.00 0.84 0.00 0.00 57.88 58.16 2k48 h LEU 94 Cb 0.27 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 2k48 h LEU 94 CO 0.01 0.66 -0.06 0.11 -0.34 0.00 0.00 178.44 178.82 2k48 h LYS 95 N -0.87 0.00 -0.03 1.25 1.57 -0.76 0.37 116.57 118.11 2k48 h LYS 95 Ca -0.01 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.54 2k48 h LYS 95 Cb 0.65 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.97 2k48 h LYS 95 CO 0.01 0.06 -0.94 -0.09 -0.57 0.00 0.00 179.45 177.92 2k48 h ARG 96 N 0.00 0.56 -0.67 3.15 1.12 -1.17 -0.23 114.38 117.13 2k48 h ARG 96 Ca -0.00 -0.57 0.07 0.00 -1.11 0.00 0.00 59.98 58.37 2k48 h ARG 96 Cb 0.12 0.15 -0.06 0.00 -0.01 0.00 0.00 29.97 30.17 2k48 h ARG 96 CO 0.01 1.19 0.36 1.96 -3.11 0.00 0.00 179.97 180.38 2k48 h GLN 97 N 0.33 0.64 0.16 0.20 4.20 0.50 -1.06 115.11 120.08 2k48 h GLN 97 Ca -0.09 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.58 2k48 h GLN 97 Cb 1.57 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 29.20 2k48 h GLN 97 CO 0.17 0.42 -0.15 -0.07 -0.67 0.00 0.00 178.83 178.54 2k48 h LEU 98 N 0.66 -0.38 -2.26 1.46 4.07 -0.90 0.17 115.31 118.12 2k48 h LEU 98 Ca 0.31 0.04 0.05 0.00 0.08 0.00 0.00 57.88 58.35 2k48 h LEU 98 Cb 0.23 0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 2k48 h LEU 98 CO -0.20 -0.23 0.21 0.00 -1.08 0.00 0.00 178.44 177.14 2k48 h ALA 99 N 0.48 1.70 0.11 1.53 0.00 -0.24 0.44 119.26 123.27 2k48 h ALA 99 Ca -0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2k48 h ALA 99 Cb 0.31 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2k48 h ALA 99 CO -0.03 -0.29 -0.70 0.22 0.00 0.00 0.00 179.25 178.45 2k48 h ASP 100 N 0.00 0.35 -0.03 0.00 3.58 -0.76 -3.25 116.42 116.31 2k48 h ASP 100 Ca 0.08 -0.95 0.03 0.00 0.42 0.00 0.00 57.03 56.61 2k48 h ASP 100 Cb 0.50 -0.11 -0.04 0.00 1.72 0.00 0.00 39.33 41.39 2k48 h ASP 100 CO -0.00 1.33 -0.22 -0.07 -2.88 0.00 0.00 179.24 177.40 2k48 h LEU 101 N -0.51 -0.65 -0.34 2.28 4.07 0.57 -3.09 115.31 117.63 2k48 h LEU 101 Ca -0.13 0.10 -0.06 0.00 0.08 0.00 0.00 57.88 57.86 2k48 h LEU 101 Cb 1.51 0.28 -0.01 0.00 1.08 0.00 0.00 40.66 43.51 2k48 h LEU 101 CO 0.10 -0.28 -0.03 0.58 -1.08 0.00 0.00 178.44 177.73 2k48 h VAL 102 N -0.33 1.27 0.00 1.22 2.07 -0.37 0.39 116.25 120.49 2k48 h VAL 102 Ca 0.07 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.55 2k48 h VAL 102 Cb 0.43 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 2k48 h VAL 102 CO -0.22 0.34 0.00 0.00 0.02 0.00 0.00 177.57 177.71 2k48 n ALA 103 N -2.40 1.79 0.00 1.67 0.00 -1.21 -1.78 120.51 118.58 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 0.30 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.83 1.84 0.21 0.00 0.00 -0.37 -4.65 120.51 116.70 2k48 n ALA 104 Ca 0.04 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.63 2k48 n ALA 104 Cb 0.02 0.07 0.79 0.00 0.00 0.00 0.00 19.45 20.33 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 -0.16 -2.45 115.11 115.57 2k48 h GLN 105 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.70 2k48 h GLN 105 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.85 2k48 h GLN 105 CO 0.00 0.00 -0.20 0.87 0.09 0.00 0.00 178.83 179.59 2k48 h LYS 106 N 0.00 0.00 0.00 0.06 1.57 -1.81 -3.49 116.57 112.90 2k48 h LYS 106 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2k48 h LYS 106 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 2k48 h LYS 106 CO -0.00 0.20 0.00 1.28 -0.57 0.00 0.00 179.45 180.36