#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 2.02 -0.00 3.17 -0.00 -1.26 -5.09 115.29 114.13 2k48 s HIS 2 Ca 0.00 1.52 -0.04 0.00 -0.00 0.00 0.00 55.06 56.54 2k48 s HIS 2 Cb 0.00 -3.18 -0.00 0.00 -0.00 0.00 0.00 32.58 29.39 2k48 s HIS 2 CO 0.00 -2.56 0.08 -1.58 -0.00 0.00 0.00 174.74 170.68 2k48 s HIS 3 N -2.77 0.06 0.29 0.38 2.46 -1.26 -5.14 115.29 109.32 2k48 s HIS 3 Ca 0.65 -0.14 -0.07 0.00 0.47 0.00 0.00 55.06 55.96 2k48 s HIS 3 Cb -0.20 -0.07 -0.00 0.00 -0.13 0.00 0.00 32.58 32.18 2k48 s HIS 3 CO 0.58 -0.20 0.46 -1.01 -2.47 0.00 0.00 174.74 172.11 2k48 s HIS 4 N -1.03 0.73 -0.28 3.88 4.02 -1.26 -4.82 115.29 116.52 2k48 s HIS 4 Ca -0.11 -1.04 0.01 0.00 1.02 0.00 0.00 55.06 54.94 2k48 s HIS 4 Cb -0.06 0.04 0.08 0.00 -1.02 0.00 0.00 32.58 31.62 2k48 s HIS 4 CO 0.00 -1.06 0.03 -1.01 1.02 0.00 0.00 174.74 173.72 2k48 s HIS 5 N -3.50 2.38 0.57 1.40 3.76 -1.26 -5.02 115.29 113.61 2k48 s HIS 5 Ca 0.27 -1.98 0.26 0.00 -0.15 0.00 0.00 55.06 53.47 2k48 s HIS 5 Cb -0.00 -1.90 1.55 0.00 1.11 0.00 0.00 32.58 33.34 2k48 s HIS 5 CO 0.14 -0.84 2.08 1.25 -0.85 0.00 0.00 174.74 176.53 2k48 h HIS 6 N 7.94 0.00 0.00 1.40 2.76 -2.02 -1.06 115.15 124.18 2k48 h HIS 6 Ca -0.13 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.03 2k48 h HIS 6 Cb 1.04 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.00 2k48 h HIS 6 CO 0.43 0.00 -0.04 1.25 -1.30 0.00 0.00 177.93 178.27 2k48 h HIS 7 N 0.00 0.00 0.00 5.26 -0.00 -2.04 -3.46 115.15 114.90 2k48 h HIS 7 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.48 2k48 h HIS 7 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.95 2k48 h HIS 7 CO 0.00 0.04 0.00 0.41 -0.00 0.00 0.00 177.93 178.38 2k48 n GLY 8 N -1.33 0.70 3.69 5.26 0.00 -0.40 -5.11 105.19 108.00 2k48 n GLY 8 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.52 0.99 -1.18 1.61 5.02 -1.26 -4.99 118.16 116.84 2k48 n LYS 9 Ca 0.00 0.39 -0.32 0.00 -2.02 0.00 0.00 58.31 56.37 2k48 n LYS 9 Cb 0.00 -2.42 0.11 0.00 -0.02 0.00 0.00 35.03 32.70 2k48 n LYS 9 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2k48 s PRO 10 N -3.24 1.93 -0.24 1.97 0.04 -1.26 -4.57 135.00 129.63 2k48 s PRO 10 Ca 0.81 1.41 -0.22 0.00 0.04 0.00 0.00 61.00 63.04 2k48 s PRO 10 Cb -0.38 -1.84 0.06 0.00 0.04 0.00 0.00 34.50 32.38 2k48 s PRO 10 CO 0.42 -1.93 0.64 -1.50 0.04 0.00 0.00 177.00 174.67 2k48 s ILE 11 N -2.60 -0.00 0.37 0.56 1.10 -1.26 -4.90 121.20 114.46 2k48 s ILE 11 Ca 0.66 0.00 -0.28 0.00 -0.51 0.00 0.00 60.65 60.52 2k48 s ILE 11 Cb -0.21 -0.89 -0.10 0.00 0.15 0.00 0.00 42.46 41.41 2k48 s ILE 11 CO 0.53 0.00 1.37 -2.16 -2.11 0.00 0.00 174.94 172.57 2k48 s PRO 12 N 0.35 4.15 0.16 3.50 0.04 -1.26 -4.95 135.00 136.99 2k48 s PRO 12 Ca -0.00 2.34 -0.31 0.00 0.04 0.00 0.00 61.00 63.06 2k48 s PRO 12 Cb -0.04 -2.95 -0.11 0.00 0.04 0.00 0.00 34.50 31.44 2k48 s PRO 12 CO 0.01 -0.41 1.74 1.21 0.04 0.00 0.00 177.00 179.59 2k48 s ASN 13 N -0.42 6.45 0.07 6.66 3.84 -1.26 -4.91 114.94 125.37 2k48 s ASN 13 Ca 0.53 2.75 0.26 0.00 0.21 0.00 0.00 52.86 56.61 2k48 s ASN 13 Cb -0.42 -2.58 1.03 0.00 -0.55 0.00 0.00 41.25 38.72 2k48 s ASN 13 CO 0.56 -0.96 1.81 -0.81 -2.79 0.00 0.00 177.10 174.91 2k48 n PRO 14 N 4.81 0.08 -3.17 0.43 -0.04 -1.26 -4.93 135.00 130.93 2k48 n PRO 14 Ca 0.16 0.12 -0.20 0.00 -0.04 0.00 0.00 63.50 63.54 2k48 n PRO 14 Cb 0.37 -1.61 -0.01 0.00 -0.04 0.00 0.00 33.50 32.22 2k48 n PRO 14 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2k48 n LEU 15 N -1.76 -1.28 -3.69 1.53 7.94 -1.26 -4.88 117.00 113.60 2k48 n LEU 15 Ca 0.06 -0.24 -0.11 0.00 -1.11 0.00 0.00 56.01 54.62 2k48 n LEU 15 Cb 0.33 -1.98 -0.11 0.00 0.53 0.00 0.00 43.42 42.19 2k48 n LEU 15 CO 0.26 0.09 0.00 -0.22 -1.11 0.00 0.00 177.39 176.41 2k48 s LEU 16 N -6.21 -0.11 0.00 -1.96 1.98 -1.26 -5.08 118.68 106.03 2k48 s LEU 16 Ca 0.31 0.82 0.00 0.00 -2.89 0.00 0.00 54.13 52.37 2k48 s LEU 16 Cb -0.16 1.19 0.00 0.00 0.66 0.00 0.00 46.19 47.88 2k48 s LEU 16 CO 0.38 -0.20 0.00 0.61 -1.89 0.00 0.00 176.35 175.25 2k48 n GLY 17 N 4.53 -2.01 3.18 7.98 0.00 -1.26 -4.75 105.19 112.87 2k48 n GLY 17 Ca -0.20 0.79 -0.09 0.00 0.00 0.00 0.00 46.02 46.52 2k48 n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k48 s LEU 18 N 0.00 1.74 0.00 0.99 1.43 -1.26 -5.09 118.68 116.49 2k48 s LEU 18 Ca 0.00 -0.95 0.07 0.00 -1.03 0.00 0.00 54.13 52.22 2k48 s LEU 18 Cb 0.00 0.62 0.11 0.00 0.03 0.00 0.00 46.19 46.95 2k48 s LEU 18 CO 0.00 -0.72 1.00 -0.67 0.23 0.00 0.00 176.35 176.19 2k48 n ASP 19 N -0.05 0.22 -2.01 2.29 2.03 -1.26 -5.03 116.55 112.74 2k48 n ASP 19 Ca -0.11 -1.92 -0.15 0.00 0.52 0.00 0.00 54.79 53.13 2k48 n ASP 19 Cb 0.62 -0.19 -0.03 0.00 -0.72 0.00 0.00 41.12 40.80 2k48 n ASP 19 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2k48 n SER 20 N 0.13 -4.34 0.31 1.67 7.64 -1.26 -4.88 113.62 112.89 2k48 n SER 20 Ca 0.01 0.23 0.19 0.00 1.01 0.00 0.00 58.87 60.31 2k48 n SER 20 Cb 0.80 -3.78 1.07 0.00 -1.01 0.00 0.00 64.21 61.28 2k48 n SER 20 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2k48 h THR 21 N 0.00 0.21 0.00 0.44 1.35 -2.01 -2.21 112.91 110.69 2k48 h THR 21 Ca -0.34 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.51 2k48 h THR 21 Cb 1.15 0.96 -0.00 0.00 -1.73 0.00 0.00 68.15 68.53 2k48 h THR 21 CO 0.44 0.00 -0.02 -0.08 -0.25 0.00 0.00 175.52 175.61 2k48 h GLU 22 N 0.00 0.00 0.00 4.72 4.81 -2.01 -1.03 114.58 121.08 2k48 h GLU 22 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2k48 h GLU 22 Cb 0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.47 2k48 h GLU 22 CO -0.00 0.02 0.00 -0.97 -0.73 0.00 0.00 179.01 177.33 2k48 h ASN 23 N 0.00 0.00 -0.26 1.04 -0.73 -1.80 -2.47 115.58 111.35 2k48 h ASN 23 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2k48 h ASN 23 Cb 0.10 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.69 2k48 h ASN 23 CO 0.00 0.00 0.00 0.18 -0.37 0.00 0.00 177.43 177.24 2k48 n LEU 24 N -2.47 2.86 0.11 0.34 7.99 -0.39 -4.80 117.00 120.64 2k48 n LEU 24 Ca -0.01 -2.15 0.16 0.00 -0.01 0.00 0.00 56.01 54.00 2k48 n LEU 24 Cb 0.11 -0.23 0.70 0.00 -0.11 0.00 0.00 43.42 43.89 2k48 n LEU 24 CO 0.15 0.68 1.14 0.22 -1.51 0.00 0.00 177.39 178.08 2k48 h TYR 25 N 1.58 0.00 -3.49 -1.77 3.20 -1.45 -3.42 116.97 111.61 2k48 h TYR 25 Ca 0.00 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.72 2k48 h TYR 25 Cb 0.78 0.00 -0.21 0.00 1.54 0.00 0.00 36.73 38.84 2k48 h TYR 25 CO 0.22 0.00 -0.50 0.12 -1.64 0.00 0.00 178.16 176.36 2k48 s PHE 26 N -4.96 0.01 0.00 -3.82 5.36 -1.26 -5.07 117.98 108.24 2k48 s PHE 26 Ca -0.05 -0.06 0.00 0.00 -0.96 0.00 0.00 56.93 55.86 2k48 s PHE 26 Cb 0.18 -0.03 0.00 0.00 -0.34 0.00 0.00 43.02 42.83 2k48 s PHE 26 CO 0.68 -0.26 0.28 0.94 -1.46 0.00 0.00 175.22 175.40 2k48 n GLN 27 N 1.66 0.00 -0.37 10.12 -0.06 -1.26 -5.11 117.38 122.36 2k48 n GLN 27 Ca -0.21 -0.28 -0.03 0.00 -2.00 0.00 0.00 57.00 54.48 2k48 n GLN 27 Cb 0.56 -0.38 0.02 0.00 -4.06 0.00 0.00 30.24 26.38 2k48 n GLN 27 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2k48 n GLY 28 N 0.00 -0.67 0.16 1.69 0.00 -1.26 -5.03 105.19 100.08 2k48 n GLY 28 Ca 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.27 2k48 n GLY 28 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2k48 n ILE 29 N -2.03 0.00 -3.66 -0.61 0.13 0.13 -5.11 119.36 108.22 2k48 n ILE 29 Ca 0.02 0.00 -0.11 0.00 -1.10 0.00 0.00 62.75 61.56 2k48 n ILE 29 Cb 0.06 -0.04 -0.08 0.00 -0.84 0.00 0.00 39.64 38.75 2k48 n ILE 29 CO 0.00 0.00 0.00 -1.81 2.80 0.00 0.00 176.55 177.54 2k48 s ASP 30 N -2.90 -0.72 0.00 9.51 1.01 -1.17 -5.04 116.67 117.36 2k48 s ASP 30 Ca 0.00 1.27 0.29 0.00 0.71 0.00 0.00 52.55 54.82 2k48 s ASP 30 Cb 0.00 1.22 1.22 0.00 1.01 0.00 0.00 42.92 46.37 2k48 s ASP 30 CO 0.00 -0.22 1.91 -0.81 0.21 0.00 0.00 175.17 176.26 2k48 n PRO 31 N 3.52 0.01 0.25 8.23 -0.04 -1.26 -4.21 135.00 141.49 2k48 n PRO 31 Ca -0.17 -0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.44 2k48 n PRO 31 Cb 0.57 -1.50 0.84 0.00 -0.04 0.00 0.00 33.50 33.37 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 -0.76 0.54 3.57 -1.97 -0.50 116.94 117.82 2k48 h PHE 32 Ca 0.00 0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.65 2k48 h PHE 32 Cb 0.49 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 2k48 h PHE 32 CO 0.00 0.00 0.51 1.79 -2.23 0.00 0.00 178.31 178.38 2k48 h THR 33 N 0.00 0.78 0.00 4.41 1.35 -1.89 -1.56 112.91 116.00 2k48 h THR 33 Ca 0.04 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 2k48 h THR 33 Cb 0.23 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 66.99 2k48 h THR 33 CO -0.00 0.07 -0.14 -0.03 -0.25 0.00 0.00 175.52 175.17 2k48 h MET 34 N 0.40 0.00 -0.62 4.72 1.85 -1.40 -1.12 114.93 118.75 2k48 h MET 34 Ca 0.38 0.00 -0.07 0.00 -0.61 0.00 0.00 59.70 59.40 2k48 h MET 34 Cb 0.89 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 32.89 2k48 h MET 34 CO -0.12 0.00 0.12 0.77 -0.40 0.00 0.00 176.91 177.28 2k48 h SER 35 N 0.00 0.94 -0.19 1.39 0.02 -1.37 0.22 113.55 114.57 2k48 h SER 35 Ca 0.00 -0.20 -0.09 0.00 -0.84 0.00 0.00 61.79 60.66 2k48 h SER 35 Cb 0.91 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.19 2k48 h SER 35 CO 0.00 0.94 -0.16 0.74 -1.14 0.00 0.00 176.83 177.20 2k48 h THR 36 N 0.94 1.25 -0.14 -2.27 2.02 -1.36 -2.65 112.91 110.70 2k48 h THR 36 Ca 0.19 -1.16 0.02 0.00 0.77 0.00 0.00 66.41 66.24 2k48 h THR 36 Cb 0.39 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2k48 h THR 36 CO 0.01 0.38 -0.01 -0.07 0.37 0.00 0.00 175.52 176.20 2k48 h LEU 37 N 0.54 -0.08 -1.43 2.58 -0.00 -0.56 0.77 115.31 117.13 2k48 h LEU 37 Ca 0.09 0.03 -0.06 0.00 -0.00 0.00 0.00 57.88 57.95 2k48 h LEU 37 Cb 0.59 0.06 -0.01 0.00 -0.00 0.00 0.00 40.66 41.31 2k48 h LEU 37 CO 0.04 -0.02 -0.28 1.56 -0.00 0.00 0.00 178.44 179.74 2k48 h GLN 38 N 0.04 0.00 -0.02 1.13 1.08 -0.76 0.21 115.11 116.79 2k48 h GLN 38 Ca 0.07 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.21 2k48 h GLN 38 Cb 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 2k48 h GLN 38 CO -0.12 0.28 -0.21 1.49 -0.95 0.00 0.00 178.83 179.32 2k48 h GLU 39 N 0.00 0.17 0.17 1.46 4.57 -1.39 -3.26 114.58 116.31 2k48 h GLU 39 Ca -0.00 -0.16 -0.31 0.00 -1.18 0.00 0.00 59.36 57.71 2k48 h GLU 39 Cb 0.56 0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.20 2k48 h GLU 39 CO 0.04 0.86 -1.44 1.25 -1.18 0.00 0.00 179.01 178.53 2k48 h LEU 40 N -0.45 0.56 -1.71 1.64 5.85 -0.34 0.93 115.31 121.78 2k48 h LEU 40 Ca -0.02 -0.66 -0.04 0.00 0.84 0.00 0.00 57.88 58.00 2k48 h LEU 40 Cb 0.91 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2k48 h LEU 40 CO 0.04 1.53 -0.17 -0.61 -0.34 0.00 0.00 178.44 178.89 2k48 h GLN 41 N 0.10 0.00 0.17 1.25 -0.00 -0.82 0.17 115.11 115.99 2k48 h GLN 41 Ca -0.22 0.00 -0.31 0.00 -0.00 0.00 0.00 58.65 58.12 2k48 h GLN 41 Cb 2.06 0.00 0.03 0.00 0.00 0.00 0.00 27.48 29.56 2k48 h GLN 41 CO 0.21 0.17 -1.33 1.49 0.00 0.00 0.00 178.83 179.38 2k48 h GLU 42 N 0.00 0.49 -0.75 1.69 4.57 -1.58 -3.03 114.58 115.97 2k48 h GLU 42 Ca -0.00 -0.76 0.01 0.00 -1.18 0.00 0.00 59.36 57.43 2k48 h GLU 42 Cb 0.42 0.27 -0.04 0.00 -0.16 0.00 0.00 28.75 29.24 2k48 h GLU 42 CO 0.02 1.35 0.49 -0.97 -1.18 0.00 0.00 179.01 178.72 2k48 h ASN 43 N 0.17 0.84 -0.19 1.04 -1.24 -0.06 0.15 115.58 116.28 2k48 h ASN 43 Ca -0.20 -0.02 0.05 0.00 0.71 0.00 0.00 56.30 56.84 2k48 h ASN 43 Cb 2.02 -0.20 -0.07 0.00 0.73 0.00 0.00 38.32 40.80 2k48 h ASN 43 CO 0.24 0.60 -0.43 0.40 -1.29 0.00 0.00 177.43 176.95 2k48 h ILE 44 N 0.99 0.13 -0.51 2.57 1.08 -0.78 0.12 117.51 121.10 2k48 h ILE 44 Ca 0.28 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.65 2k48 h ILE 44 Cb -0.08 0.13 -0.02 0.00 -3.07 0.00 0.00 36.82 33.78 2k48 h ILE 44 CO -0.07 0.00 -0.08 0.74 -0.69 0.00 0.00 178.15 178.05 2k48 h THR 45 N -0.46 1.27 -0.07 -0.27 2.02 -1.26 0.51 112.91 114.66 2k48 h THR 45 Ca 0.09 -1.21 -0.21 0.00 0.77 0.00 0.00 66.41 65.85 2k48 h THR 45 Cb 0.62 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 2k48 h THR 45 CO -0.44 0.42 -0.83 0.00 0.37 0.00 0.00 175.52 175.05 2k48 h ALA 46 N 0.92 0.43 0.00 6.16 0.00 -0.61 0.98 119.26 127.13 2k48 h ALA 46 Ca 0.14 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2k48 h ALA 46 Cb 0.63 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2k48 h ALA 46 CO 0.04 0.75 -0.02 1.25 0.00 0.00 0.00 179.25 181.27 2k48 h HIS 47 N 0.34 0.00 0.09 0.00 6.17 -0.67 0.71 115.15 121.79 2k48 h HIS 47 Ca -0.06 0.00 -0.22 0.00 0.71 0.00 0.00 60.37 60.80 2k48 h HIS 47 Cb 1.44 0.00 0.02 0.00 2.52 0.00 0.00 27.41 31.39 2k48 h HIS 47 CO 0.06 0.02 -0.92 0.93 0.71 0.00 0.00 177.93 178.74 2k48 h GLU 48 N 0.00 0.46 -0.57 5.26 5.08 0.34 -1.56 114.58 123.59 2k48 h GLU 48 Ca -0.00 -0.62 -0.10 0.00 -1.00 0.00 0.00 59.36 57.64 2k48 h GLU 48 Cb 0.70 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 2k48 h GLU 48 CO 0.00 1.26 -0.04 1.96 -1.00 0.00 0.00 179.01 181.18 2k48 h GLN 49 N -0.05 1.02 0.00 2.33 4.20 -0.73 0.30 115.11 122.19 2k48 h GLN 49 Ca -0.14 -0.34 -0.02 0.00 0.06 0.00 0.00 58.65 58.21 2k48 h GLN 49 Cb 1.65 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 29.35 2k48 h GLN 49 CO 0.18 1.03 -0.09 1.96 -0.67 0.00 0.00 178.83 181.24 2k48 h GLN 50 N 0.93 0.00 0.06 1.46 4.20 -0.95 0.20 115.11 121.01 2k48 h GLN 50 Ca 0.16 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.66 2k48 h GLN 50 Cb 0.60 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.40 2k48 h GLN 50 CO 0.04 0.09 -0.84 1.25 -0.67 0.00 0.00 178.83 178.69 2k48 h LEU 51 N 0.00 0.64 -0.71 1.46 5.85 -0.01 0.18 115.31 122.71 2k48 h LEU 51 Ca -0.00 -0.82 -0.00 0.00 0.84 0.00 0.00 57.88 57.90 2k48 h LEU 51 Cb 0.26 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 2k48 h LEU 51 CO 0.01 1.38 0.43 -0.37 -0.34 0.00 0.00 178.44 179.56 2k48 h VAL 52 N -0.03 1.20 -0.43 1.05 -1.51 -0.32 0.40 116.25 116.62 2k48 h VAL 52 Ca -0.12 -0.45 -0.10 0.00 -1.23 0.00 0.00 66.70 64.80 2k48 h VAL 52 Cb 1.57 0.21 -0.02 0.00 -2.13 0.00 0.00 31.29 30.92 2k48 h VAL 52 CO 0.16 0.21 -0.13 0.74 -1.23 0.00 0.00 177.57 177.32 2k48 h THR 53 N 0.97 1.26 -0.40 7.19 2.02 -1.01 0.99 112.91 123.93 2k48 h THR 53 Ca 0.26 -1.21 -0.05 0.00 0.77 0.00 0.00 66.41 66.18 2k48 h THR 53 Cb -0.03 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 2k48 h THR 53 CO -0.05 0.41 0.05 0.00 0.37 0.00 0.00 175.52 176.31 2k48 h ALA 54 N 1.13 1.34 -0.32 6.16 0.00 -0.02 0.72 119.26 128.29 2k48 h ALA 54 Ca 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2k48 h ALA 54 Cb 0.63 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2k48 h ALA 54 CO 0.04 0.46 0.12 0.00 0.00 0.00 0.00 179.25 179.87 2k48 h ARG 55 N 0.59 0.48 0.00 0.00 2.47 -0.19 0.45 114.38 118.18 2k48 h ARG 55 Ca 0.13 -0.09 -0.03 0.00 -1.26 0.00 0.00 59.98 58.72 2k48 h ARG 55 Cb 0.30 -0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 28.54 2k48 h ARG 55 CO 0.00 0.50 -0.17 0.37 0.56 0.00 0.00 179.97 181.24 2k48 h GLN 56 N 0.36 0.00 0.24 0.04 4.15 -0.15 0.71 115.11 120.46 2k48 h GLN 56 Ca 0.10 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.21 2k48 h GLN 56 Cb 0.20 0.00 0.04 0.00 0.21 0.00 0.00 27.48 27.93 2k48 h GLN 56 CO -0.01 0.17 -1.40 0.87 -1.93 0.00 0.00 178.83 176.53 2k48 h LYS 57 N 0.00 0.50 -0.31 1.69 6.56 0.62 -2.43 116.57 123.20 2k48 h LYS 57 Ca -0.00 -0.86 -0.07 0.00 -1.06 0.00 0.00 60.65 58.65 2k48 h LYS 57 Cb 0.33 0.32 -0.02 0.00 -0.57 0.00 0.00 32.23 32.29 2k48 h LYS 57 CO 0.02 1.41 -0.12 1.37 -2.06 0.00 0.00 179.45 180.07 2k48 h LEU 58 N 0.07 0.51 -1.29 2.94 8.10 -0.64 -0.99 115.31 124.01 2k48 h LEU 58 Ca -0.25 -0.14 -0.07 0.00 0.11 0.00 0.00 57.88 57.54 2k48 h LEU 58 Cb 2.09 -0.14 -0.01 0.00 -0.44 0.00 0.00 40.66 42.17 2k48 h LEU 58 CO 0.25 0.67 -0.24 0.07 -4.11 0.00 0.00 178.44 175.09 2k48 h LYS 59 N 0.49 0.18 0.00 0.17 5.09 -0.86 0.21 116.57 121.84 2k48 h LYS 59 Ca 0.09 -0.05 -0.04 0.00 0.09 0.00 0.00 60.65 60.74 2k48 h LYS 59 Cb 0.51 -0.02 -0.01 0.00 0.10 0.00 0.00 32.23 32.81 2k48 h LYS 59 CO 0.03 0.42 -0.18 0.22 -2.09 0.00 0.00 179.45 177.85 2k48 h ASP 60 N 0.17 0.00 0.78 7.07 3.58 -0.97 0.90 116.42 127.95 2k48 h ASP 60 Ca 0.03 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.23 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 0.04 0.18 -1.16 0.00 -2.88 0.00 0.00 179.24 175.42 2k48 h ALA 61 N 1.82 0.22 -0.38 -0.78 0.00 0.23 -2.38 119.26 117.99 2k48 h ALA 61 Ca -0.00 -0.91 -0.12 0.00 0.00 0.00 0.00 54.91 53.88 2k48 h ALA 61 Cb 0.71 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2k48 h ALA 61 CO 0.02 1.11 -0.23 0.93 0.00 0.00 0.00 179.25 181.08 2k48 h GLU 62 N 0.04 0.76 -0.86 0.00 5.08 -0.48 -1.93 114.58 117.19 2k48 h GLU 62 Ca -0.09 -0.31 0.08 0.00 -1.00 0.00 0.00 59.36 58.04 2k48 h GLU 62 Cb 1.89 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 31.05 2k48 h GLU 62 CO 0.17 0.92 0.56 -0.22 -1.00 0.00 0.00 179.01 179.44 2k48 h LYS 63 N 0.66 0.87 -0.30 2.33 1.63 -0.86 0.85 116.57 121.76 2k48 h LYS 63 Ca 0.09 -0.05 -0.16 0.00 -0.85 0.00 0.00 60.65 59.68 2k48 h LYS 63 Cb 0.74 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 32.16 2k48 h LYS 63 CO 0.06 0.58 -0.44 0.00 -3.45 0.00 0.00 179.45 176.19 2k48 h ALA 64 N 1.55 0.65 0.00 5.00 0.00 -0.81 -0.67 119.26 124.98 2k48 h ALA 64 Ca 0.38 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2k48 h ALA 64 Cb 0.31 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2k48 h ALA 64 CO -0.15 0.67 -0.15 -0.24 0.00 0.00 0.00 179.25 179.38 2k48 h VAL 65 N 0.62 0.28 -0.64 0.00 3.04 -1.18 0.15 116.25 118.51 2k48 h VAL 65 Ca 0.04 -1.23 -0.07 0.00 -1.01 0.00 0.00 66.70 64.44 2k48 h VAL 65 Cb 1.01 1.99 -0.03 0.00 -2.01 0.00 0.00 31.29 32.25 2k48 h VAL 65 CO 0.10 0.15 0.14 -0.08 -1.01 0.00 0.00 177.57 176.86 2k48 h GLU 66 N 0.00 1.02 0.00 4.17 4.57 -0.44 -3.26 114.58 120.64 2k48 h GLU 66 Ca -0.00 -0.24 -0.09 0.00 -1.18 0.00 0.00 59.36 57.85 2k48 h GLU 66 Cb 0.98 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.41 2k48 h GLU 66 CO 0.02 0.92 -1.61 1.55 -1.18 0.00 0.00 179.01 178.71 2k48 n VAL 67 N -4.24 0.33 -2.97 0.32 3.14 -0.29 -4.79 118.33 109.83 2k48 n VAL 67 Ca 0.05 -0.34 -0.15 0.00 -2.96 0.00 0.00 64.34 60.93 2k48 n VAL 67 Cb 0.26 -0.20 -0.01 0.00 -1.06 0.00 0.00 33.84 32.83 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 -2.12 -1.72 -2.52 6.55 2.03 0.50 -5.07 116.55 114.19 2k48 n ASP 68 Ca -0.09 -2.95 0.00 0.00 0.52 0.00 0.00 54.79 52.27 2k48 n ASP 68 Cb 0.55 0.76 0.00 0.00 -0.72 0.00 0.00 41.12 41.70 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 1.89 0.00 -2.42 -0.67 -0.04 -1.23 -4.55 135.00 127.97 2k48 n PRO 69 Ca 0.17 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.28 2k48 n PRO 69 Cb 0.57 -1.44 -0.02 0.00 -0.04 0.00 0.00 33.50 32.57 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 2.79 6.18 0.58 3.54 1.01 -1.26 -4.93 116.67 124.58 2k48 s ASP 70 Ca 0.00 2.06 0.28 0.00 0.71 0.00 0.00 52.55 55.60 2k48 s ASP 70 Cb 0.00 -2.57 1.61 0.00 1.01 0.00 0.00 42.92 42.97 2k48 s ASP 70 CO 0.00 -0.90 2.10 0.44 0.21 0.00 0.00 175.17 177.02 2k48 h ASP 71 N 1.61 0.00 -0.70 0.27 3.32 -2.01 0.14 116.42 119.05 2k48 h ASP 71 Ca -0.50 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.50 2k48 h ASP 71 Cb 1.24 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.76 2k48 h ASP 71 CO 0.59 0.00 0.22 1.62 -1.72 0.00 0.00 179.24 179.95 2k48 h VAL 72 N 0.00 1.26 0.00 -1.35 3.04 -1.96 -1.10 116.25 116.14 2k48 h VAL 72 Ca 0.09 -0.88 -0.04 0.00 -1.01 0.00 0.00 66.70 64.86 2k48 h VAL 72 Cb 0.48 0.51 -0.01 0.00 -2.01 0.00 0.00 31.29 30.26 2k48 h VAL 72 CO -0.00 0.34 -0.20 0.78 -1.01 0.00 0.00 177.57 177.48 2k48 h ASN 73 N 1.03 0.00 0.04 3.17 2.35 -1.00 0.70 115.58 121.86 2k48 h ASN 73 Ca 0.23 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.79 2k48 h ASN 73 Cb 0.30 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.69 2k48 h ASN 73 CO -0.01 0.20 -0.76 0.11 -1.65 0.00 0.00 177.43 175.33 2k48 h LYS 74 N 0.00 0.45 -0.24 0.81 1.57 -1.51 -1.88 116.57 115.77 2k48 h LYS 74 Ca -0.00 -0.53 -0.08 0.00 -1.87 0.00 0.00 60.65 58.17 2k48 h LYS 74 Cb 0.61 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 2k48 h LYS 74 CO 0.03 1.18 -0.18 0.77 -0.57 0.00 0.00 179.45 180.68 2k48 h SER 75 N -0.05 0.41 0.22 0.86 0.02 -0.55 -1.73 113.55 112.74 2k48 h SER 75 Ca -0.10 -0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 60.68 2k48 h SER 75 Cb 1.48 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.90 2k48 h SER 75 CO 0.15 0.61 -0.22 0.74 -1.14 0.00 0.00 176.83 176.96 2k48 h THR 76 N 0.39 1.17 0.11 -2.27 2.02 0.31 0.10 112.91 114.73 2k48 h THR 76 Ca 0.07 -0.79 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 2k48 h THR 76 Cb 0.54 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 2k48 h THR 76 CO 0.04 0.23 -0.05 0.25 0.37 0.00 0.00 175.52 176.35 2k48 h LEU 77 N 0.01 -0.13 -2.22 2.58 7.12 -0.46 -1.10 115.31 121.12 2k48 h LEU 77 Ca 0.00 -0.22 0.04 0.00 0.13 0.00 0.00 57.88 57.84 2k48 h LEU 77 Cb 0.41 0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.56 2k48 h LEU 77 CO 0.03 0.15 0.14 1.56 -0.13 0.00 0.00 178.44 180.19 2k48 h GLN 78 N -0.41 0.00 -0.02 1.25 4.20 -0.92 0.27 115.11 119.47 2k48 h GLN 78 Ca -0.02 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.55 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 -0.54 -0.97 -0.67 0.00 0.00 178.83 176.68 2k48 h ASN 79 N 0.00 0.51 -0.33 1.46 -0.73 -0.95 0.86 115.58 116.40 2k48 h ASN 79 Ca 0.07 -0.73 -0.14 0.00 1.87 0.00 0.00 56.30 57.37 2k48 h ASN 79 Cb 0.35 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.78 2k48 h ASN 79 CO -0.00 1.17 -0.29 0.03 -0.37 0.00 0.00 177.43 177.97 2k48 h ARG 80 N -0.10 0.85 -0.08 6.67 2.47 0.22 -1.29 114.38 123.13 2k48 h ARG 80 Ca -0.06 -0.39 -0.03 0.00 -1.26 0.00 0.00 59.98 58.24 2k48 h ARG 80 Cb 1.23 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.53 2k48 h ARG 80 CO 0.11 1.03 -0.09 -0.09 0.56 0.00 0.00 179.97 181.49 2k48 h ARG 81 N 0.72 0.12 -0.07 0.04 2.43 -0.65 -0.61 114.38 116.37 2k48 h ARG 81 Ca 0.08 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.09 2k48 h ARG 81 Cb 0.85 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 2k48 h ARG 81 CO 0.07 0.22 -0.57 0.00 -1.51 0.00 0.00 179.97 178.18 2k48 h ALA 82 N 1.79 0.91 -0.01 2.80 0.00 -0.39 -0.13 119.26 124.23 2k48 h ALA 82 Ca 0.03 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 2k48 h ALA 82 Cb 0.24 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2k48 h ALA 82 CO 0.01 0.71 -0.00 0.00 0.00 0.00 0.00 179.25 179.97 2k48 h ALA 83 N 1.24 0.01 -0.98 0.00 0.00 -0.34 0.59 119.26 119.79 2k48 h ALA 83 Ca -0.00 -0.19 0.20 0.00 0.00 0.00 0.00 54.91 54.91 2k48 h ALA 83 Cb 1.05 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.75 2k48 h ALA 83 CO 0.09 -0.29 0.62 0.28 0.00 0.00 0.00 179.25 179.94 2k48 h VAL 84 N -0.36 0.69 -0.40 0.00 2.07 -1.06 0.22 116.25 117.42 2k48 h VAL 84 Ca 0.00 -0.22 -0.14 0.00 0.82 0.00 0.00 66.70 67.16 2k48 h VAL 84 Cb 0.38 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2k48 h VAL 84 CO 0.00 0.12 -0.31 -1.28 0.02 0.00 0.00 177.57 176.12 2k48 h SER 85 N 0.63 0.93 0.14 0.57 0.87 -0.83 0.26 113.55 116.11 2k48 h SER 85 Ca 0.54 -0.39 0.02 0.00 -1.23 0.00 0.00 61.79 60.74 2k48 h SER 85 Cb 1.02 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 62.69 2k48 h SER 85 CO -0.31 1.16 -0.30 0.74 -0.53 0.00 0.00 176.83 177.59 2k48 h THR 86 N 0.75 0.36 -0.58 2.23 2.02 0.12 -0.17 112.91 117.63 2k48 h THR 86 Ca 0.08 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 2k48 h THR 86 Cb 0.88 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 2k48 h THR 86 CO 0.08 0.00 0.29 -0.07 0.37 0.00 0.00 175.52 176.19 2k48 h LEU 87 N -0.53 0.75 -0.23 2.58 -0.00 -0.59 0.43 115.31 117.72 2k48 h LEU 87 Ca 0.03 -0.12 -0.11 0.00 -0.00 0.00 0.00 57.88 57.68 2k48 h LEU 87 Cb 0.55 -0.19 -0.00 0.00 -0.00 0.00 0.00 40.66 41.02 2k48 h LEU 87 CO -0.16 0.65 -0.30 -0.33 -0.00 0.00 0.00 178.44 178.30 2k48 h GLU 88 N 0.79 0.61 -0.16 1.13 4.39 -0.44 0.14 114.58 121.03 2k48 h GLU 88 Ca 0.20 -0.35 0.03 0.00 0.34 0.00 0.00 59.36 59.58 2k48 h GLU 88 Cb 0.09 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 2k48 h GLU 88 CO -0.03 0.95 -0.03 1.15 -1.16 0.00 0.00 179.01 179.90 2k48 h THR 89 N 0.31 0.85 0.33 1.13 2.02 -0.87 -1.23 112.91 115.44 2k48 h THR 89 Ca 0.03 -0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 2k48 h THR 89 Cb 0.88 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 2k48 h THR 89 CO 0.07 0.00 -0.50 0.50 0.37 0.00 0.00 175.52 175.97 2k48 h LYS 90 N 0.01 -0.83 0.00 6.66 1.63 -0.85 -1.64 116.57 121.55 2k48 h LYS 90 Ca 0.08 0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.90 2k48 h LYS 90 Cb 0.11 0.19 -0.00 0.00 -0.60 0.00 0.00 32.23 31.93 2k48 h LYS 90 CO -0.16 -0.56 -0.16 -0.07 -3.45 0.00 0.00 179.45 175.05 2k48 h LEU 91 N -0.86 0.00 0.05 5.20 -0.00 -0.36 0.71 115.31 120.04 2k48 h LEU 91 Ca -0.04 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.84 2k48 h LEU 91 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 2k48 h LEU 91 CO -0.15 0.16 -0.02 1.23 -0.00 0.00 0.00 178.44 179.66 2k48 h GLY 92 N 0.57 -0.07 1.62 0.83 0.00 -1.13 0.11 103.07 104.99 2k48 h GLY 92 Ca -0.00 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 2k48 h GLY 92 CO 0.02 -0.03 0.13 1.05 0.00 0.00 0.00 176.54 177.71 2k48 h GLU 93 N -0.36 0.50 0.11 4.80 -0.00 -0.06 -1.32 114.58 118.25 2k48 h GLU 93 Ca -0.01 -0.06 -0.01 0.00 -0.00 0.00 0.00 59.36 59.28 2k48 h GLU 93 Cb 0.32 -0.09 0.00 0.00 -0.00 0.00 0.00 28.75 28.98 2k48 h GLU 93 CO 0.01 0.43 -0.05 1.25 -0.00 0.00 0.00 179.01 180.65 2k48 h LEU 94 N 0.50 -0.12 -1.82 3.06 5.85 0.36 0.19 115.31 123.33 2k48 h LEU 94 Ca 0.12 -0.45 -0.02 0.00 0.84 0.00 0.00 57.88 58.38 2k48 h LEU 94 Cb 0.13 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 2k48 h LEU 94 CO -0.01 0.46 -0.06 0.11 -0.34 0.00 0.00 178.44 178.60 2k48 h LYS 95 N -0.79 0.04 -0.01 1.25 1.57 -0.75 0.28 116.57 118.17 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 0.56 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 2k48 h LYS 95 CO 0.02 0.10 -0.89 -0.09 -0.57 0.00 0.00 179.45 178.03 2k48 h ARG 96 N 0.04 0.33 -0.71 3.15 1.12 -1.20 -1.22 114.38 115.90 2k48 h ARG 96 Ca 0.01 -0.34 0.05 0.00 -1.11 0.00 0.00 59.98 58.58 2k48 h ARG 96 Cb 0.13 0.09 -0.05 0.00 -0.01 0.00 0.00 29.97 30.14 2k48 h ARG 96 CO 0.01 1.03 0.43 1.96 -3.11 0.00 0.00 179.97 180.28 2k48 h GLN 97 N 0.19 0.78 0.15 0.20 4.20 0.68 -1.74 115.11 119.57 2k48 h GLN 97 Ca -0.06 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.60 2k48 h GLN 97 Cb 1.51 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 29.11 2k48 h GLN 97 CO 0.15 0.52 -0.12 -0.07 -0.67 0.00 0.00 178.83 178.64 2k48 h LEU 98 N 0.81 -0.31 -2.30 1.46 4.07 -0.90 0.19 115.31 118.32 2k48 h LEU 98 Ca 0.30 0.03 0.04 0.00 0.08 0.00 0.00 57.88 58.33 2k48 h LEU 98 Cb 0.10 0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 2k48 h LEU 98 CO -0.14 -0.19 0.17 0.00 -1.08 0.00 0.00 178.44 177.19 2k48 h ALA 99 N 0.56 1.68 0.15 1.53 0.00 -0.69 0.39 119.26 122.87 2k48 h ALA 99 Ca -0.00 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 2k48 h ALA 99 Cb 0.25 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.07 2k48 h ALA 99 CO -0.01 -0.23 -0.92 0.22 0.00 0.00 0.00 179.25 178.30 2k48 h ASP 100 N 0.00 0.50 -0.03 0.00 3.58 -0.89 -3.25 116.42 116.32 2k48 h ASP 100 Ca 0.06 -0.94 0.03 0.00 0.42 0.00 0.00 57.03 56.60 2k48 h ASP 100 Cb 0.39 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 41.24 2k48 h ASP 100 CO -0.00 1.44 -0.19 -0.07 -2.88 0.00 0.00 179.24 177.54 2k48 h LEU 101 N -0.32 -0.56 -0.34 2.28 4.07 0.56 -3.11 115.31 117.89 2k48 h LEU 101 Ca -0.17 0.08 -0.05 0.00 0.08 0.00 0.00 57.88 57.83 2k48 h LEU 101 Cb 1.70 0.24 -0.01 0.00 1.08 0.00 0.00 40.66 43.67 2k48 h LEU 101 CO 0.16 -0.25 0.03 0.58 -1.08 0.00 0.00 178.44 177.87 2k48 h VAL 102 N -0.29 1.25 0.00 1.22 2.07 -0.46 0.11 116.25 120.15 2k48 h VAL 102 Ca 0.07 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.68 2k48 h VAL 102 Cb 0.38 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2k48 h VAL 102 CO -0.20 0.30 0.00 0.00 0.02 0.00 0.00 177.57 177.69 2k48 n ALA 103 N -2.37 1.75 0.00 1.67 0.00 -1.21 -1.57 120.51 118.78 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 0.25 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 -0.85 1.31 0.26 0.00 0.00 -0.22 -4.65 120.51 116.36 2k48 n ALA 104 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.60 2k48 n ALA 104 Cb 0.02 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.20 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 0.18 -2.83 115.11 115.53 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 0.11 0.00 1.63 0.09 0.00 0.00 178.83 180.66 2k48 n LYS 106 N -3.72 0.19 0.00 0.06 5.02 -1.21 -4.88 118.16 113.62 2k48 n LYS 106 Ca -0.02 0.14 0.08 0.00 -2.02 0.00 0.00 58.31 56.49 2k48 n LYS 106 Cb 0.22 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.79 2k48 n LYS 106 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16