#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qc3 s MET 1 N 0.00 0.39 -0.19 -1.40 -2.45 -1.11 -4.42 119.30 110.13 2qc3 s MET 1 Ca 0.00 0.61 -0.06 0.00 -1.25 0.00 0.00 55.69 54.99 2qc3 s MET 1 Cb 0.00 0.09 -0.03 0.00 1.25 0.00 0.00 34.83 36.14 2qc3 s MET 1 CO 0.00 -0.10 0.02 0.42 1.05 0.00 0.00 175.02 176.41 2qc3 s ILE 2 N 0.73 4.27 -0.19 10.11 1.09 -0.51 0.60 121.20 137.30 2qc3 s ILE 2 Ca -0.04 -0.21 -0.22 0.00 -1.10 0.00 0.00 60.65 59.08 2qc3 s ILE 2 Cb -0.05 -2.92 -0.02 0.00 -1.06 0.00 0.00 42.46 38.40 2qc3 s ILE 2 CO -0.05 0.45 0.68 0.00 -0.10 0.00 0.00 174.94 175.92 2qc3 s ALA 3 N 0.65 3.54 -0.30 9.38 0.00 0.83 -1.83 121.76 134.01 2qc3 s ALA 3 Ca 0.01 -0.19 -0.08 0.00 0.00 0.00 0.00 51.96 51.70 2qc3 s ALA 3 Cb -0.14 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 19.95 2qc3 s ALA 3 CO 0.02 -0.57 0.11 -0.51 0.00 0.00 0.00 175.76 174.80 2qc3 s LEU 4 N 1.96 3.96 -0.15 0.00 1.43 -0.36 0.32 118.68 125.85 2qc3 s LEU 4 Ca 0.31 -0.66 -0.02 0.00 -1.03 0.00 0.00 54.13 52.73 2qc3 s LEU 4 Cb -0.16 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 2qc3 s LEU 4 CO 0.11 -0.20 -0.08 -0.76 0.23 0.00 0.00 176.35 175.65 2qc3 s LEU 5 N 1.54 2.98 -0.25 1.79 1.43 0.58 -1.55 118.68 125.20 2qc3 s LEU 5 Ca 0.03 -0.24 -0.08 0.00 -1.03 0.00 0.00 54.13 52.82 2qc3 s LEU 5 Cb -0.17 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.32 2qc3 s LEU 5 CO 0.04 0.16 0.08 0.00 0.23 0.00 0.00 176.35 176.85 2qc3 s ALA 6 N 0.43 3.21 0.75 4.21 0.00 -0.01 -1.13 121.76 129.22 2qc3 s ALA 6 Ca -0.07 -1.09 -0.12 0.00 0.00 0.00 0.00 51.96 50.68 2qc3 s ALA 6 Cb -0.15 -2.09 0.05 0.00 0.00 0.00 0.00 23.12 20.92 2qc3 s ALA 6 CO 0.04 -0.43 1.11 -1.25 0.00 0.00 0.00 175.76 175.23 2qc3 s PRO 7 N 1.51 2.29 0.00 0.00 0.04 -1.26 -0.86 135.00 136.72 2qc3 s PRO 7 Ca 0.06 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.40 2qc3 s PRO 7 Cb -0.15 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2qc3 s PRO 7 CO 0.04 -1.63 0.00 0.41 0.04 0.00 0.00 177.00 175.86 2qc3 n GLY 8 N -0.78 4.28 3.69 0.56 0.00 -1.17 -3.29 105.19 108.48 2qc3 n GLY 8 Ca 0.10 -2.11 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 2qc3 n GLY 8 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qc3 s GLN 9 N -0.17 1.54 0.00 1.61 -0.21 -1.26 -3.77 119.66 117.39 2qc3 s GLN 9 Ca 0.00 1.72 0.00 0.00 0.02 0.00 0.00 55.36 57.10 2qc3 s GLN 9 Cb 0.00 -1.77 0.00 0.00 1.00 0.00 0.00 33.01 32.24 2qc3 s GLN 9 CO 0.00 -2.28 0.00 0.41 -2.12 0.00 0.00 175.29 171.30 2qc3 n GLY 10 N 0.44 1.39 0.01 3.09 0.00 -1.26 -4.90 105.19 103.95 2qc3 n GLY 10 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 2qc3 n GLY 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qc3 n SER 11 N 0.00 0.61 -4.74 1.61 3.41 -1.25 -5.00 113.62 108.27 2qc3 n SER 11 Ca 0.00 -0.20 -0.40 0.00 -0.26 0.00 0.00 58.87 58.01 2qc3 n SER 11 Cb 0.00 1.70 0.02 0.00 -0.26 0.00 0.00 64.21 65.67 2qc3 n SER 11 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qc3 n GLN 12 N -2.02 2.07 -3.80 4.33 0.00 -1.26 -4.88 117.38 111.82 2qc3 n GLN 12 Ca -0.02 0.74 -0.13 0.00 0.00 0.00 0.00 57.00 57.59 2qc3 n GLN 12 Cb 0.46 -2.53 -0.09 0.00 0.00 0.00 0.00 30.24 28.08 2qc3 n GLN 12 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2qc3 s THR 13 N -1.21 0.06 0.38 -0.39 -4.23 -1.26 -5.02 115.64 103.98 2qc3 s THR 13 Ca 0.62 -0.52 -0.26 0.00 -1.18 0.00 0.00 61.69 60.35 2qc3 s THR 13 Cb -0.47 -0.54 -0.11 0.00 1.34 0.00 0.00 72.50 72.72 2qc3 s THR 13 CO 0.57 -0.29 1.19 -1.84 -0.54 0.00 0.00 174.62 173.72 2qc3 n GLU 14 N 1.41 1.81 -1.02 3.99 0.28 -1.26 -1.58 120.64 124.27 2qc3 n GLU 14 Ca -0.22 0.64 -0.01 0.00 -0.16 0.00 0.00 57.16 57.42 2qc3 n GLU 14 Cb 0.56 -2.24 -0.00 0.00 1.43 0.00 0.00 31.44 31.19 2qc3 n GLU 14 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2qc3 n GLY 15 N 0.92 0.33 0.34 -1.84 0.00 -1.11 -4.89 105.19 98.93 2qc3 n GLY 15 Ca 0.07 -0.04 0.17 0.00 0.00 0.00 0.00 46.02 46.22 2qc3 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qc3 h MET 16 N 0.50 0.00 0.00 1.61 -0.00 -0.44 -1.77 114.93 114.84 2qc3 h MET 16 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 2qc3 h MET 16 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.07 2qc3 h MET 16 CO 0.02 0.00 -1.12 1.28 -0.00 0.00 0.00 176.91 177.09 2qc3 n LEU 17 N -3.71 0.60 -0.15 -0.10 4.77 -0.12 -4.54 117.00 113.75 2qc3 n LEU 17 Ca 0.01 -0.09 -0.09 0.00 -0.03 0.00 0.00 56.01 55.81 2qc3 n LEU 17 Cb 0.31 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.29 2qc3 n LEU 17 CO 0.26 0.07 0.58 0.28 -1.33 0.00 0.00 177.39 177.26 2qc3 h SER 18 N 0.00 -1.39 0.24 -1.43 0.02 -1.42 0.91 113.55 110.49 2qc3 h SER 18 Ca 0.00 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2qc3 h SER 18 Cb 0.72 0.62 0.00 0.00 0.14 0.00 0.00 62.40 63.88 2qc3 h SER 18 CO 0.00 -0.35 0.00 -0.81 -1.14 0.00 0.00 176.83 174.53 2qc3 n PRO 19 N -5.41 0.02 -0.06 3.45 -0.04 -1.26 -2.63 135.00 129.06 2qc3 n PRO 19 Ca 0.00 0.35 -0.03 0.00 -0.04 0.00 0.00 63.50 63.78 2qc3 n PRO 19 Cb 0.35 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.16 2qc3 n PRO 19 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2qc3 n TRP 20 N -1.47 0.00 1.08 0.54 7.02 0.17 -4.28 117.44 120.50 2qc3 n TRP 20 Ca 0.02 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.57 2qc3 n TRP 20 Cb 0.08 -0.74 0.39 0.00 -2.42 0.00 0.00 31.31 28.62 2qc3 n TRP 20 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2qc3 n LEU 21 N -2.51 0.00 0.04 -0.99 4.77 -0.38 -2.00 117.00 115.93 2qc3 n LEU 21 Ca -0.21 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.75 2qc3 n LEU 21 Cb 0.90 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.91 2qc3 n LEU 21 CO 0.39 0.00 -0.19 1.56 -1.33 0.00 0.00 177.39 177.83 2qc3 h GLN 22 N 0.00 0.00 -7.18 3.23 4.20 -1.75 -3.37 115.11 110.24 2qc3 h GLN 22 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 2qc3 h GLN 22 Cb 0.00 0.00 0.16 0.00 0.30 0.00 0.00 27.48 27.94 2qc3 h GLN 22 CO 0.00 0.41 0.38 -0.51 -0.67 0.00 0.00 178.83 178.45 2qc3 s LEU 23 N -6.01 3.30 -0.15 1.46 1.43 -0.85 -4.92 118.68 112.94 2qc3 s LEU 23 Ca -0.02 2.33 -0.29 0.00 -1.03 0.00 0.00 54.13 55.11 2qc3 s LEU 23 Cb 0.08 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.68 2qc3 s LEU 23 CO 0.80 -2.26 1.58 -2.16 0.23 0.00 0.00 176.35 174.54 2qc3 s PRO 24 N -3.96 4.01 0.00 1.29 0.04 -1.26 -2.20 135.00 132.92 2qc3 s PRO 24 Ca 0.74 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.64 2qc3 s PRO 24 Cb -0.28 -3.98 0.00 0.00 0.04 0.00 0.00 34.50 30.28 2qc3 s PRO 24 CO 0.46 -1.04 0.00 0.41 0.04 0.00 0.00 177.00 176.87 2qc3 n GLY 25 N 4.30 0.90 0.16 0.56 0.00 -1.26 -4.97 105.19 104.88 2qc3 n GLY 25 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 2qc3 n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qc3 h ALA 26 N 0.00 -0.98 -0.97 4.61 0.00 -1.73 -0.08 119.26 120.10 2qc3 h ALA 26 Ca 0.00 -0.07 0.26 0.00 0.00 0.00 0.00 54.91 55.10 2qc3 h ALA 26 Cb 0.00 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 17.94 2qc3 h ALA 26 CO 0.00 -0.97 0.53 0.00 0.00 0.00 0.00 179.25 178.80 2qc3 h ALA 27 N -1.64 1.74 -0.43 0.00 0.00 -1.77 0.25 119.26 117.40 2qc3 h ALA 27 Ca -0.03 0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 2qc3 h ALA 27 Cb 0.29 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2qc3 h ALA 27 CO 0.02 -0.39 -0.12 0.22 0.00 0.00 0.00 179.25 178.98 2qc3 h ASP 28 N 0.45 0.78 -0.32 0.00 1.82 -1.89 -2.16 116.42 115.09 2qc3 h ASP 28 Ca 0.65 -0.24 -0.16 0.00 -0.39 0.00 0.00 57.03 56.89 2qc3 h ASP 28 Cb 1.32 -0.21 -0.00 0.00 0.68 0.00 0.00 39.33 41.12 2qc3 h ASP 28 CO -0.54 0.92 -0.44 1.56 -1.61 0.00 0.00 179.24 179.13 2qc3 h GLN 29 N 0.71 0.86 -0.07 0.28 4.20 0.14 -2.26 115.11 118.97 2qc3 h GLN 29 Ca 0.12 -0.50 -0.03 0.00 0.06 0.00 0.00 58.65 58.30 2qc3 h GLN 29 Cb 0.61 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 2qc3 h GLN 29 CO 0.04 1.14 -0.10 0.82 -0.67 0.00 0.00 178.83 180.06 2qc3 h ILE 30 N 0.65 1.12 -0.19 2.54 1.08 -1.02 0.21 117.51 121.90 2qc3 h ILE 30 Ca 0.04 -0.52 -0.07 0.00 -0.39 0.00 0.00 64.86 63.92 2qc3 h ILE 30 Cb 1.04 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.97 2qc3 h ILE 30 CO 0.10 0.16 -0.14 0.00 -0.69 0.00 0.00 178.15 177.58 2qc3 h ALA 31 N 1.80 0.27 -0.69 1.87 0.00 -1.19 0.33 119.26 121.64 2qc3 h ALA 31 Ca 0.02 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 2qc3 h ALA 31 Cb 0.25 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2qc3 h ALA 31 CO 0.01 0.15 0.26 0.00 0.00 0.00 0.00 179.25 179.67 2qc3 h ALA 32 N 0.66 1.14 0.01 0.00 0.00 -0.75 -2.22 119.26 118.09 2qc3 h ALA 32 Ca 0.03 -0.19 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 2qc3 h ALA 32 Cb 0.66 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2qc3 h ALA 32 CO 0.04 0.61 -0.87 -1.49 0.00 0.00 0.00 179.25 177.54 2qc3 h TRP 33 N 1.01 0.10 -0.06 0.00 6.55 -0.51 -2.40 115.95 120.65 2qc3 h TRP 33 Ca 0.23 -0.06 -0.06 0.00 0.95 0.00 0.00 58.89 59.95 2qc3 h TRP 33 Cb 0.23 -0.01 -0.01 0.00 -0.86 0.00 0.00 29.16 28.51 2qc3 h TRP 33 CO 0.02 0.90 -0.26 0.77 -1.05 0.00 0.00 178.44 178.82 2qc3 h SER 34 N 0.03 0.09 -0.01 -3.49 0.02 -0.03 -0.98 113.55 109.18 2qc3 h SER 34 Ca -0.02 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 2qc3 h SER 34 Cb 1.52 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 64.03 2qc3 h SER 34 CO 0.12 0.36 -0.19 0.50 -1.14 0.00 0.00 176.83 176.48 2qc3 h LYS 35 N 0.09 0.15 -0.60 3.45 3.64 -1.29 0.29 116.57 122.29 2qc3 h LYS 35 Ca 0.01 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 2qc3 h LYS 35 Cb 0.51 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 2qc3 h LYS 35 CO 0.04 0.87 0.39 0.00 -2.27 0.00 0.00 179.45 178.47 2qc3 h ALA 36 N 0.28 1.55 -0.14 5.00 0.00 -1.23 -1.85 119.26 122.87 2qc3 h ALA 36 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qc3 h ALA 36 Cb 0.93 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2qc3 h ALA 36 CO 0.04 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.70 2qc3 n ALA 37 N -2.44 2.46 -4.04 0.00 0.00 -0.39 -4.58 120.51 111.51 2qc3 n ALA 37 Ca 0.06 -0.75 -0.28 0.00 0.00 0.00 0.00 53.44 52.46 2qc3 n ALA 37 Cb 0.05 -0.87 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2qc3 n ALA 37 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2qc3 n ASP 38 N 1.25 -0.77 -3.79 0.00 2.03 0.10 -4.95 116.55 110.43 2qc3 n ASP 38 Ca 0.16 -1.04 -0.13 0.00 0.52 0.00 0.00 54.79 54.31 2qc3 n ASP 38 Cb 0.57 -2.85 -0.13 0.00 -0.72 0.00 0.00 41.12 38.00 2qc3 n ASP 38 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2qc3 s LEU 39 N -7.07 1.10 -1.25 -2.67 2.96 0.78 -5.01 118.68 107.52 2qc3 s LEU 39 Ca 0.15 0.38 -0.17 0.00 -0.22 0.00 0.00 54.13 54.27 2qc3 s LEU 39 Cb -0.08 0.61 -0.01 0.00 0.50 0.00 0.00 46.19 47.21 2qc3 s LEU 39 CO 0.91 -0.09 2.04 -0.67 -1.32 0.00 0.00 176.35 177.22 2qc3 n ASP 40 N 3.31 3.70 0.03 3.68 -0.08 -1.26 -4.23 116.55 121.69 2qc3 n ASP 40 Ca -0.16 -2.81 0.13 0.00 -1.51 0.00 0.00 54.79 50.44 2qc3 n ASP 40 Cb 0.57 -1.56 0.58 0.00 2.34 0.00 0.00 41.12 43.05 2qc3 n ASP 40 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2qc3 h LEU 41 N 11.96 0.19 0.32 -2.67 3.38 -1.88 -2.15 115.31 124.46 2qc3 h LEU 41 Ca 0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.46 2qc3 h LEU 41 Cb 0.71 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 2qc3 h LEU 41 CO 1.77 0.12 -0.41 0.00 0.09 0.00 0.00 178.44 180.01 2qc3 h ALA 42 N 1.78 -0.86 -0.13 1.53 0.00 -1.84 0.73 119.26 120.47 2qc3 h ALA 42 Ca 0.19 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2qc3 h ALA 42 Cb 0.49 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2qc3 h ALA 42 CO -0.03 -1.03 -0.48 0.07 0.00 0.00 0.00 179.25 177.78 2qc3 h ARG 43 N -0.78 0.35 -0.79 0.00 0.11 -1.92 -2.71 114.38 108.63 2qc3 h ARG 43 Ca -0.02 -0.19 -0.01 0.00 0.10 0.00 0.00 59.98 59.85 2qc3 h ARG 43 Cb 0.73 0.01 -0.04 0.00 1.11 0.00 0.00 29.97 31.78 2qc3 h ARG 43 CO -0.12 0.75 0.44 -0.07 0.10 0.00 0.00 179.97 181.07 2qc3 h LEU 44 N 0.28 0.98 -0.55 0.08 3.38 -1.08 0.13 115.31 118.53 2qc3 h LEU 44 Ca 0.01 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2qc3 h LEU 44 Cb 0.95 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2qc3 h LEU 44 CO 0.08 0.79 -0.17 0.61 0.09 0.00 0.00 178.44 179.84 2qc3 n GLY 45 N -1.11 -0.53 0.94 0.83 0.00 0.22 -4.07 105.19 101.47 2qc3 n GLY 45 Ca 0.07 -0.39 -0.01 0.00 0.00 0.00 0.00 46.02 45.70 2qc3 n GLY 45 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qc3 n THR 46 N -0.51 1.01 -0.01 2.61 -2.24 -1.03 -0.95 114.28 113.16 2qc3 n THR 46 Ca 0.14 0.31 -0.18 0.00 -2.27 0.00 0.00 64.05 62.06 2qc3 n THR 46 Cb 0.34 -1.54 -0.14 0.00 -2.10 0.00 0.00 70.33 66.88 2qc3 n THR 46 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2qc3 n THR 47 N -3.37 1.72 -1.36 4.28 -2.24 -0.31 -2.82 114.28 110.18 2qc3 n THR 47 Ca -0.01 -0.69 -0.38 0.00 -2.27 0.00 0.00 64.05 60.69 2qc3 n THR 47 Cb 0.04 -1.52 0.03 0.00 -2.10 0.00 0.00 70.33 66.78 2qc3 n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qc3 n ALA 48 N -2.90 -2.06 -1.91 6.98 0.00 0.30 -4.89 120.51 116.03 2qc3 n ALA 48 Ca -0.29 -0.04 -0.34 0.00 0.00 0.00 0.00 53.44 52.77 2qc3 n ALA 48 Cb 1.05 -1.63 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 2qc3 n ALA 48 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qc3 s SER 49 N -1.10 7.00 0.51 0.00 1.04 -1.26 -4.49 113.70 115.41 2qc3 s SER 49 Ca 0.63 1.60 0.30 0.00 0.48 0.00 0.00 55.95 58.97 2qc3 s SER 49 Cb -0.47 -2.50 1.43 0.00 0.10 0.00 0.00 66.02 64.58 2qc3 s SER 49 CO 0.60 -0.22 1.86 0.74 0.98 0.00 0.00 173.24 177.20 2qc3 h THR 50 N 2.16 0.53 -0.18 2.02 2.02 -1.94 0.59 112.91 118.12 2qc3 h THR 50 Ca -0.48 -0.03 -0.10 0.00 0.77 0.00 0.00 66.41 66.58 2qc3 h THR 50 Cb 1.18 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 2qc3 h THR 50 CO 0.63 0.01 -0.26 -0.33 0.37 0.00 0.00 175.52 175.94 2qc3 h GLU 51 N 0.07 0.50 -0.25 6.66 5.08 -1.99 -2.13 114.58 122.51 2qc3 h GLU 51 Ca 0.47 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 58.44 2qc3 h GLU 51 Cb 1.75 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 31.01 2qc3 h GLU 51 CO -0.05 0.89 -0.23 1.49 -1.00 0.00 0.00 179.01 180.11 2qc3 h GLU 52 N 0.15 0.48 0.00 2.33 4.81 -1.31 -2.80 114.58 118.25 2qc3 h GLU 52 Ca 0.02 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 2qc3 h GLU 52 Cb 0.84 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.19 2qc3 h GLU 52 CO 0.06 0.68 -0.08 0.44 -0.73 0.00 0.00 179.01 179.39 2qc3 n ILE 53 N -4.13 0.06 1.11 2.32 -5.35 -0.53 -3.07 119.36 109.76 2qc3 n ILE 53 Ca -0.00 -0.03 0.13 0.00 -0.27 0.00 0.00 62.75 62.58 2qc3 n ILE 53 Cb 0.39 -0.40 0.63 0.00 -1.74 0.00 0.00 39.64 38.52 2qc3 n ILE 53 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 2qc3 n THR 54 N -1.57 0.15 -1.98 7.28 -1.04 -0.81 -2.82 114.28 113.50 2qc3 n THR 54 Ca 0.07 0.04 -0.42 0.00 -2.04 0.00 0.00 64.05 61.69 2qc3 n THR 54 Cb 0.35 -0.59 -0.03 0.00 -1.82 0.00 0.00 70.33 68.24 2qc3 n THR 54 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2qc3 s ASP 55 N -2.77 6.62 0.47 8.00 3.68 -1.17 -4.81 116.67 126.69 2qc3 s ASP 55 Ca 0.20 2.24 0.23 0.00 2.13 0.00 0.00 52.55 57.35 2qc3 s ASP 55 Cb 0.18 -2.53 1.25 0.00 -1.45 0.00 0.00 42.92 40.36 2qc3 s ASP 55 CO 0.44 -0.96 1.91 0.00 0.13 0.00 0.00 175.17 176.69 2qc3 h THR 56 N 5.62 0.68 0.00 1.71 1.03 -1.91 0.40 112.91 120.45 2qc3 h THR 56 Ca -0.40 -0.07 -0.01 0.00 -0.01 0.00 0.00 66.41 65.92 2qc3 h THR 56 Cb 1.18 0.44 -0.00 0.00 -1.07 0.00 0.00 68.15 68.71 2qc3 h THR 56 CO 0.95 0.04 -0.03 0.00 -0.01 0.00 0.00 175.52 176.48 2qc3 h ALA 57 N 1.63 1.06 0.00 0.00 0.00 -1.90 -2.94 119.26 117.11 2qc3 h ALA 57 Ca 0.39 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.93 2qc3 h ALA 57 Cb 1.22 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 2qc3 h ALA 57 CO -0.08 0.03 -2.22 0.28 0.00 0.00 0.00 179.25 177.26 2qc3 n VAL 58 N -3.21 1.20 0.08 0.00 0.31 0.12 -4.51 118.33 112.34 2qc3 n VAL 58 Ca -0.01 -0.35 0.05 0.00 -0.01 0.00 0.00 64.34 64.01 2qc3 n VAL 58 Cb 0.20 -1.62 0.47 0.00 -0.91 0.00 0.00 33.84 31.98 2qc3 n VAL 58 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qc3 h ALA 59 N -0.54 1.75 0.36 3.52 0.00 -0.83 -1.92 119.26 121.59 2qc3 h ALA 59 Ca -0.53 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 2qc3 h ALA 59 Cb 1.56 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2qc3 h ALA 59 CO -0.26 0.22 -0.17 1.96 0.00 0.00 0.00 179.25 181.00 2qc3 h GLN 60 N 0.37 -0.46 0.00 0.00 4.20 -1.76 0.17 115.11 117.62 2qc3 h GLN 60 Ca 0.10 0.03 -0.09 0.00 0.06 0.00 0.00 58.65 58.74 2qc3 h GLN 60 Cb 0.02 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2qc3 h GLN 60 CO -0.02 -0.21 -0.45 -1.00 -0.67 0.00 0.00 178.83 176.49 2qc3 h PRO 61 N -0.66 0.00 -0.26 1.46 0.13 -1.72 -2.13 132.00 128.82 2qc3 h PRO 61 Ca -0.05 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.03 2qc3 h PRO 61 Cb 0.47 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.59 2qc3 h PRO 61 CO 0.08 0.45 -0.04 1.25 -0.23 0.00 0.00 178.00 179.51 2qc3 h LEU 62 N 0.00 0.48 -0.43 1.56 5.85 -1.25 0.12 115.31 121.63 2qc3 h LEU 62 Ca -0.00 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.35 2qc3 h LEU 62 Cb 0.86 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 2qc3 h LEU 62 CO 0.06 0.71 0.17 0.40 -0.34 0.00 0.00 178.44 179.44 2qc3 h ILE 63 N 0.24 1.20 -0.67 4.05 2.04 -0.52 -0.63 117.51 123.22 2qc3 h ILE 63 Ca 0.07 -0.63 -0.06 0.00 1.00 0.00 0.00 64.86 65.24 2qc3 h ILE 63 Cb 0.49 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 2qc3 h ILE 63 CO 0.02 0.23 0.18 0.58 0.00 0.00 0.00 178.15 179.16 2qc3 h VAL 64 N 0.56 1.25 -0.39 1.67 2.07 -1.31 -1.40 116.25 118.70 2qc3 h VAL 64 Ca 0.14 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 2qc3 h VAL 64 Cb 0.19 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2qc3 h VAL 64 CO -0.01 0.35 0.20 0.00 0.02 0.00 0.00 177.57 178.12 2qc3 h ALA 65 N 1.19 0.50 -0.53 1.67 0.00 -0.36 -0.75 119.26 120.99 2qc3 h ALA 65 Ca 0.22 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2qc3 h ALA 65 Cb 0.32 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2qc3 h ALA 65 CO -0.00 0.05 0.30 0.00 0.00 0.00 0.00 179.25 179.60 2qc3 h ALA 66 N 1.05 0.68 -0.30 0.00 0.00 -0.89 -1.43 119.26 118.37 2qc3 h ALA 66 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2qc3 h ALA 66 Cb 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2qc3 h ALA 66 CO -0.02 0.18 0.19 1.15 0.00 0.00 0.00 179.25 180.76 2qc3 h THR 67 N 0.71 1.08 0.00 0.00 2.02 -0.94 -2.97 112.91 112.81 2qc3 h THR 67 Ca 0.19 -0.17 -0.11 0.00 0.77 0.00 0.00 66.41 67.08 2qc3 h THR 67 Cb 0.02 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 2qc3 h THR 67 CO -0.03 0.08 -0.54 -0.07 0.37 0.00 0.00 175.52 175.33 2qc3 h LEU 68 N 0.40 0.00 -0.49 2.58 3.38 -0.98 -1.81 115.31 118.39 2qc3 h LEU 68 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2qc3 h LEU 68 Cb -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2qc3 h LEU 68 CO -0.02 0.54 0.32 -0.07 0.09 0.00 0.00 178.44 179.30 2qc3 h LEU 69 N 0.00 0.57 -0.45 1.67 3.38 -1.13 0.88 115.31 120.23 2qc3 h LEU 69 Ca -0.01 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2qc3 h LEU 69 Cb 1.04 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 2qc3 h LEU 69 CO 0.07 0.42 0.15 0.00 0.09 0.00 0.00 178.44 179.17 2qc3 h ALA 70 N 1.17 0.58 -0.68 1.53 0.00 -1.37 -0.78 119.26 119.72 2qc3 h ALA 70 Ca 0.18 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2qc3 h ALA 70 Cb -0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2qc3 h ALA 70 CO -0.04 0.22 0.16 1.25 0.00 0.00 0.00 179.25 180.84 2qc3 h HIS 71 N 0.58 1.12 -0.03 0.00 -0.00 -0.79 0.99 115.15 117.03 2qc3 h HIS 71 Ca 0.15 -0.13 0.00 0.00 -0.00 0.00 0.00 60.37 60.39 2qc3 h HIS 71 Cb 0.24 -0.32 -0.00 0.00 -0.00 0.00 0.00 27.41 27.33 2qc3 h HIS 71 CO 0.01 0.92 0.02 1.96 -0.00 0.00 0.00 177.93 180.84 2qc3 h GLN 72 N 1.02 0.04 -0.60 5.26 1.08 0.12 0.33 115.11 122.36 2qc3 h GLN 72 Ca 0.21 -0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.34 2qc3 h GLN 72 Cb 0.36 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.76 2qc3 h GLN 72 CO 0.00 0.03 0.08 1.49 -0.95 0.00 0.00 178.83 179.48 2qc3 h GLU 73 N 0.04 0.99 -0.66 1.46 4.57 -0.95 0.20 114.58 120.23 2qc3 h GLU 73 Ca 0.01 -0.26 -0.03 0.00 -1.18 0.00 0.00 59.36 57.90 2qc3 h GLU 73 Cb -0.00 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.44 2qc3 h GLU 73 CO -0.01 0.92 0.27 1.25 -1.18 0.00 0.00 179.01 180.27 2qc3 h LEU 74 N 0.93 0.88 -0.68 1.64 5.85 -0.39 -1.36 115.31 122.17 2qc3 h LEU 74 Ca 0.18 -0.11 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 2qc3 h LEU 74 Cb 0.43 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 2qc3 h LEU 74 CO 0.01 0.78 -0.42 0.00 -0.34 0.00 0.00 178.44 178.47 2qc3 h ALA 75 N 1.35 0.86 -0.04 1.25 0.00 0.57 -2.73 119.26 120.52 2qc3 h ALA 75 Ca 0.22 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2qc3 h ALA 75 Cb 0.16 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2qc3 h ALA 75 CO -0.02 0.64 0.02 -0.09 0.00 0.00 0.00 179.25 179.80 2qc3 h ARG 76 N 0.44 0.06 0.00 0.00 2.43 0.37 -2.73 114.38 114.95 2qc3 h ARG 76 Ca 0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2qc3 h ARG 76 Cb 0.91 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2qc3 h ARG 76 CO 0.08 0.18 0.00 0.54 -1.51 0.00 0.00 179.97 179.26 2qc3 n ARG 77 N -4.99 0.61 -1.65 0.20 1.74 -0.61 -4.89 116.66 107.07 2qc3 n ARG 77 Ca -0.07 0.02 -0.14 0.00 -0.77 0.00 0.00 57.85 56.89 2qc3 n ARG 77 Cb 0.09 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 29.99 2qc3 n ARG 77 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qc3 h VAL 79 N 0.00 0.69 -0.32 0.00 2.07 -1.86 -0.82 116.25 116.01 2qc3 h VAL 79 Ca -0.30 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2qc3 h VAL 79 Cb 1.00 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2qc3 h VAL 79 CO 0.42 0.08 0.00 0.18 0.02 0.00 0.00 177.57 178.26 2qc3 n LEU 80 N -4.52 3.06 -4.65 2.57 4.77 -1.26 -4.57 117.00 112.40 2qc3 n LEU 80 Ca 0.19 -1.54 -0.42 0.00 -0.03 0.00 0.00 56.01 54.21 2qc3 n LEU 80 Cb 0.68 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 2qc3 n LEU 80 CO 0.30 0.68 1.56 0.00 -1.33 0.00 0.00 177.39 178.61 2qc3 s ALA 81 N -1.24 3.45 0.00 -1.18 0.00 -0.32 -1.57 121.76 120.91 2qc3 s ALA 81 Ca 0.30 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.37 2qc3 s ALA 81 Cb 0.18 -3.85 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2qc3 s ALA 81 CO 0.24 -1.72 0.00 0.41 0.00 0.00 0.00 175.76 174.69 2qc3 n GLY 82 N 4.62 0.61 3.57 0.00 0.00 -1.26 -5.08 105.19 107.65 2qc3 n GLY 82 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 2qc3 n GLY 82 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qc3 s LYS 83 N -0.60 3.39 0.25 1.61 1.02 -0.61 -5.09 119.74 119.71 2qc3 s LYS 83 Ca 0.00 -0.48 -0.30 0.00 0.02 0.00 0.00 55.97 55.21 2qc3 s LYS 83 Cb 0.00 -2.86 -0.09 0.00 -0.52 0.00 0.00 37.83 34.36 2qc3 s LYS 83 CO 0.00 0.42 1.16 -0.51 -0.92 0.00 0.00 175.35 175.50 2qc3 s ASP 84 N -0.12 7.14 0.19 2.83 1.11 -1.26 -4.95 116.67 121.61 2qc3 s ASP 84 Ca 0.03 2.30 0.04 0.00 0.18 0.00 0.00 52.55 55.10 2qc3 s ASP 84 Cb -0.13 -2.62 -0.05 0.00 1.07 0.00 0.00 42.92 41.19 2qc3 s ASP 84 CO 0.02 -0.28 -0.04 0.68 1.18 0.00 0.00 175.17 176.73 2qc3 s VAL 85 N -0.71 1.06 -0.07 -1.27 -7.23 -1.26 -1.42 120.40 109.50 2qc3 s VAL 85 Ca 0.48 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.62 2qc3 s VAL 85 Cb -0.33 -2.13 0.02 0.00 0.56 0.00 0.00 36.38 34.50 2qc3 s VAL 85 CO 0.41 -0.50 -0.08 -0.51 -0.31 0.00 0.00 175.10 174.10 2qc3 s ILE 86 N -3.40 0.88 -0.01 -0.62 -1.16 -0.76 -3.92 121.20 112.21 2qc3 s ILE 86 Ca 0.23 -0.30 0.02 0.00 -0.51 0.00 0.00 60.65 60.09 2qc3 s ILE 86 Cb 0.04 -0.86 -0.04 0.00 0.61 0.00 0.00 42.46 42.22 2qc3 s ILE 86 CO 0.05 0.31 -0.01 -0.69 -2.81 0.00 0.00 174.94 171.79 2qc3 s VAL 87 N 0.99 4.07 -0.19 4.00 1.01 0.96 -1.22 120.40 130.01 2qc3 s VAL 87 Ca -0.09 -0.61 -0.24 0.00 0.00 0.00 0.00 61.98 61.04 2qc3 s VAL 87 Cb -0.15 -2.80 0.06 0.00 0.00 0.00 0.00 36.38 33.50 2qc3 s VAL 87 CO 0.00 0.39 0.64 0.00 0.00 0.00 0.00 175.10 176.13 2qc3 s ALA 88 N -1.06 -1.59 0.11 5.51 0.00 -0.59 -1.27 121.76 122.87 2qc3 s ALA 88 Ca 0.19 1.65 0.04 0.00 0.00 0.00 0.00 51.96 53.83 2qc3 s ALA 88 Cb -0.11 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 2qc3 s ALA 88 CO 0.09 -0.31 -0.10 0.20 0.00 0.00 0.00 175.76 175.64 2qc3 s GLY 89 N -0.04 0.89 -0.24 0.00 0.00 -1.26 -0.83 107.32 105.85 2qc3 s GLY 89 Ca -0.03 -1.26 -0.08 0.00 0.00 0.00 0.00 44.72 43.36 2qc3 s GLY 89 CO 0.03 -1.34 0.08 -1.58 0.00 0.00 0.00 173.10 170.29 2qc3 s HIS 90 N -2.67 3.13 0.00 1.90 2.46 -0.04 -4.26 115.29 115.81 2qc3 s HIS 90 Ca 0.08 -0.26 0.00 0.00 0.47 0.00 0.00 55.06 55.34 2qc3 s HIS 90 Cb -0.01 -2.21 0.00 0.00 -0.13 0.00 0.00 32.58 30.23 2qc3 s HIS 90 CO -0.00 -0.23 0.00 0.43 -2.47 0.00 0.00 174.74 172.47 2qc3 n SER 91 N 4.61 0.00 0.30 9.88 7.64 -1.26 -0.18 113.62 134.61 2qc3 n SER 91 Ca -0.16 0.00 0.17 0.00 1.01 0.00 0.00 58.87 59.89 2qc3 n SER 91 Cb 0.52 0.00 0.95 0.00 -1.01 0.00 0.00 64.21 64.66 2qc3 n SER 91 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 2qc3 h VAL 92 N 0.00 0.39 -0.04 0.44 3.04 -1.94 -1.44 116.25 116.69 2qc3 h VAL 92 Ca 0.00 -0.13 0.01 0.00 -1.01 0.00 0.00 66.70 65.57 2qc3 h VAL 92 Cb 0.00 1.09 -0.00 0.00 -2.01 0.00 0.00 31.29 30.37 2qc3 h VAL 92 CO 0.00 0.03 0.11 1.23 -1.01 0.00 0.00 177.57 177.92 2qc3 h GLY 93 N 0.25 0.00 1.38 3.17 0.00 -0.55 -1.77 103.07 105.55 2qc3 h GLY 93 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.36 2qc3 h GLY 93 CO 0.00 0.00 0.36 0.83 0.00 0.00 0.00 176.54 177.73 2qc3 h GLU 94 N 0.00 0.63 -0.68 4.80 5.08 -1.40 -0.04 114.58 122.97 2qc3 h GLU 94 Ca 0.02 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2qc3 h GLU 94 Cb 0.23 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2qc3 h GLU 94 CO -0.00 0.41 0.32 0.82 -1.00 0.00 0.00 179.01 179.56 2qc3 h ILE 95 N 0.65 1.23 -0.45 3.13 2.04 -1.53 0.21 117.51 122.79 2qc3 h ILE 95 Ca 0.21 -0.66 -0.10 0.00 1.00 0.00 0.00 64.86 65.32 2qc3 h ILE 95 Cb 0.06 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2qc3 h ILE 95 CO -0.05 0.27 -0.10 0.00 0.00 0.00 0.00 178.15 178.26 2qc3 h ALA 96 N 1.15 0.62 -0.98 1.87 0.00 -1.54 -2.37 119.26 118.00 2qc3 h ALA 96 Ca 0.23 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2qc3 h ALA 96 Cb 0.13 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 2qc3 h ALA 96 CO -0.03 0.51 0.65 0.00 0.00 0.00 0.00 179.25 180.37 2qc3 h ALA 97 N 0.87 1.36 -0.61 0.00 0.00 -0.41 0.12 119.26 120.58 2qc3 h ALA 97 Ca 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2qc3 h ALA 97 Cb 0.64 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2qc3 h ALA 97 CO 0.04 0.55 0.29 1.88 0.00 0.00 0.00 179.25 182.01 2qc3 h TYR 98 N 1.25 0.89 -0.54 0.00 -1.99 -0.32 0.76 116.97 117.02 2qc3 h TYR 98 Ca 0.39 -0.05 -0.12 0.00 2.00 0.00 0.00 58.73 60.95 2qc3 h TYR 98 Cb -0.01 -0.27 -0.02 0.00 2.00 0.00 0.00 36.73 38.43 2qc3 h TYR 98 CO -0.00 0.68 -0.13 0.00 -0.00 0.00 0.00 178.16 178.71 2qc3 h ALA 99 N 1.12 0.75 -0.73 3.88 0.00 -0.84 0.16 119.26 123.60 2qc3 h ALA 99 Ca 0.21 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2qc3 h ALA 99 Cb 0.13 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2qc3 h ALA 99 CO -0.03 0.68 0.39 0.82 0.00 0.00 0.00 179.25 181.11 2qc3 h ILE 100 N 0.92 1.22 -0.03 0.00 2.04 -0.37 -1.41 117.51 119.88 2qc3 h ILE 100 Ca 0.14 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.43 2qc3 h ILE 100 Cb 0.70 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2qc3 h ILE 100 CO 0.05 0.25 0.00 0.00 0.00 0.00 0.00 178.15 178.45 2qc3 n ALA 101 N -2.36 2.50 -1.10 1.87 0.00 0.22 -4.90 120.51 116.76 2qc3 n ALA 101 Ca 0.06 -0.06 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2qc3 n ALA 101 Cb 0.10 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 2qc3 n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qc3 n GLY 102 N 0.57 0.62 0.14 0.00 0.00 -0.53 0.23 105.19 106.22 2qc3 n GLY 102 Ca 0.02 -0.36 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 2qc3 n GLY 102 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2qc3 h VAL 103 N 0.00 1.43 -4.02 1.61 2.07 -0.88 -3.40 116.25 113.06 2qc3 h VAL 103 Ca -0.07 -2.64 -0.19 0.00 0.82 0.00 0.00 66.70 64.62 2qc3 h VAL 103 Cb 0.39 2.60 -0.19 0.00 -1.52 0.00 0.00 31.29 32.57 2qc3 h VAL 103 CO 0.10 0.78 -0.70 0.27 0.02 0.00 0.00 177.57 178.04 2qc3 s ILE 104 N -3.05 0.30 0.58 4.57 -4.36 -1.23 -1.39 121.20 116.61 2qc3 s ILE 104 Ca -0.05 -1.27 -0.17 0.00 -0.26 0.00 0.00 60.65 58.89 2qc3 s ILE 104 Cb 0.08 -0.78 -0.04 0.00 1.25 0.00 0.00 42.46 42.97 2qc3 s ILE 104 CO 0.88 -0.63 1.10 0.00 0.24 0.00 0.00 174.94 176.53 2qc3 s ALA 105 N -2.24 2.64 0.21 2.27 0.00 -1.26 -4.15 121.76 119.23 2qc3 s ALA 105 Ca -0.06 0.64 -0.10 0.00 0.00 0.00 0.00 51.96 52.44 2qc3 s ALA 105 Cb -0.04 -3.31 0.17 0.00 0.00 0.00 0.00 23.12 19.94 2qc3 s ALA 105 CO -0.03 -0.90 1.86 0.00 0.00 0.00 0.00 175.76 176.69 2qc3 h ALA 106 N 0.73 0.92 -0.72 0.00 0.00 -1.99 0.14 119.26 118.33 2qc3 h ALA 106 Ca -0.48 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.34 2qc3 h ALA 106 Cb 1.25 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 2qc3 h ALA 106 CO 0.56 0.26 0.24 0.38 0.00 0.00 0.00 179.25 180.69 2qc3 h ASP 107 N 0.91 1.04 0.17 0.00 2.03 -1.96 -1.36 116.42 117.25 2qc3 h ASP 107 Ca 0.28 -0.20 -0.13 0.00 -0.73 0.00 0.00 57.03 56.24 2qc3 h ASP 107 Cb -0.03 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 38.18 2qc3 h ASP 107 CO -0.09 0.97 -0.48 0.44 -1.03 0.00 0.00 179.24 179.05 2qc3 h ASP 108 N 1.06 0.40 -0.20 4.15 3.32 -1.83 -2.40 116.42 120.93 2qc3 h ASP 108 Ca 0.23 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 2qc3 h ASP 108 Cb 0.29 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2qc3 h ASP 108 CO -0.01 0.82 0.10 0.00 -1.72 0.00 0.00 179.24 178.42 2qc3 h ALA 109 N 1.20 0.25 -0.49 3.45 0.00 -0.24 0.89 119.26 124.32 2qc3 h ALA 109 Ca 0.02 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2qc3 h ALA 109 Cb 0.95 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2qc3 h ALA 109 CO 0.08 -0.19 0.19 0.28 0.00 0.00 0.00 179.25 179.61 2qc3 h VAL 110 N 0.19 1.21 -0.50 0.00 2.07 -1.19 0.59 116.25 118.62 2qc3 h VAL 110 Ca 0.07 -0.67 -0.07 0.00 0.82 0.00 0.00 66.70 66.86 2qc3 h VAL 110 Cb 0.11 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2qc3 h VAL 110 CO -0.01 0.25 0.05 0.00 0.02 0.00 0.00 177.57 177.88 2qc3 h ALA 111 N 1.04 1.14 -0.34 1.67 0.00 -1.30 0.42 119.26 121.89 2qc3 h ALA 111 Ca 0.16 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 2qc3 h ALA 111 Cb 0.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2qc3 h ALA 111 CO -0.01 0.56 -0.29 1.25 0.00 0.00 0.00 179.25 180.76 2qc3 h LEU 112 N 0.76 0.74 -0.54 0.00 5.85 -0.51 -1.67 115.31 119.95 2qc3 h LEU 112 Ca 0.16 -0.29 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 2qc3 h LEU 112 Cb 0.40 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 2qc3 h LEU 112 CO 0.01 0.99 -0.01 0.00 -0.34 0.00 0.00 178.44 179.09 2qc3 h ALA 113 N 1.06 0.73 -0.54 1.25 0.00 -0.34 -0.89 119.26 120.53 2qc3 h ALA 113 Ca 0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2qc3 h ALA 113 Cb 0.80 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2qc3 h ALA 113 CO 0.07 0.57 0.21 0.00 0.00 0.00 0.00 179.25 180.10 2qc3 h ALA 114 N 0.95 1.36 -0.34 0.00 0.00 -0.59 -0.65 119.26 119.99 2qc3 h ALA 114 Ca 0.15 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2qc3 h ALA 114 Cb 0.55 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2qc3 h ALA 114 CO 0.03 0.48 -0.21 1.15 0.00 0.00 0.00 179.25 180.70 2qc3 h THR 115 N 0.77 1.29 -0.95 0.00 2.02 -1.02 -1.47 112.91 113.55 2qc3 h THR 115 Ca 0.18 -1.35 0.03 0.00 0.77 0.00 0.00 66.41 66.05 2qc3 h THR 115 Cb 0.16 1.42 -0.05 0.00 -1.74 0.00 0.00 68.15 67.94 2qc3 h THR 115 CO -0.02 0.44 0.62 -0.09 0.37 0.00 0.00 175.52 176.85 2qc3 h ARG 116 N 0.52 1.18 -0.06 6.66 2.43 -0.60 -0.00 114.38 124.50 2qc3 h ARG 116 Ca 0.07 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2qc3 h ARG 116 Cb 0.76 -0.27 -0.00 0.00 -0.42 0.00 0.00 29.97 30.05 2qc3 h ARG 116 CO 0.06 0.78 -0.09 0.78 -1.51 0.00 0.00 179.97 179.99 2qc3 h GLY 117 N 1.21 0.19 1.01 2.80 0.00 -0.94 -1.87 103.07 105.47 2qc3 h GLY 117 Ca 0.37 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.47 2qc3 h GLY 117 CO -0.11 0.19 0.39 0.00 0.00 0.00 0.00 176.54 177.01 2qc3 h ALA 118 N 0.52 0.91 -0.41 3.60 0.00 -1.06 -0.05 119.26 122.76 2qc3 h ALA 118 Ca 0.01 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2qc3 h ALA 118 Cb 0.64 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2qc3 h ALA 118 CO 0.02 0.43 -0.10 0.93 0.00 0.00 0.00 179.25 180.53 2qc3 h GLU 119 N 0.98 0.79 -0.30 0.00 4.39 -1.04 -2.31 114.58 117.09 2qc3 h GLU 119 Ca 0.25 -0.30 -0.13 0.00 0.34 0.00 0.00 59.36 59.52 2qc3 h GLU 119 Cb 0.04 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2qc3 h GLU 119 CO -0.04 0.91 -0.34 0.52 -1.16 0.00 0.00 179.01 178.90 2qc3 h MET 120 N 0.61 0.66 -0.45 2.33 2.86 -1.17 -1.37 114.93 118.38 2qc3 h MET 120 Ca 0.10 -0.31 0.05 0.00 -2.06 0.00 0.00 59.70 57.48 2qc3 h MET 120 Cb 0.62 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.23 2qc3 h MET 120 CO 0.04 0.91 0.19 0.00 1.06 0.00 0.00 176.91 179.11 2qc3 h ALA 121 N 1.07 0.56 -0.44 6.32 0.00 -0.92 0.36 119.26 126.20 2qc3 h ALA 121 Ca 0.06 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2qc3 h ALA 121 Cb 0.85 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 2qc3 h ALA 121 CO 0.07 -0.18 0.21 -0.22 0.00 0.00 0.00 179.25 179.13 2qc3 h LYS 122 N 0.39 0.40 -0.36 0.00 3.64 -1.07 -2.38 116.57 117.20 2qc3 h LYS 122 Ca 0.20 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 2qc3 h LYS 122 Cb 0.16 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2qc3 h LYS 122 CO -0.18 0.27 0.07 0.00 -2.27 0.00 0.00 179.45 177.34 2qc3 h ALA 123 N 1.25 1.47 0.00 5.00 0.00 -0.16 -2.06 119.26 124.75 2qc3 h ALA 123 Ca 0.20 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2qc3 h ALA 123 Cb 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2qc3 h ALA 123 CO -0.15 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.49 2qc3 h ALA 125 N 2.04 0.68 0.00 0.00 0.00 -1.36 -3.34 119.26 117.29 2qc3 h ALA 125 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qc3 h ALA 125 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2qc3 h ALA 125 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.50 2qc3 n THR 126 N -2.64 0.31 -3.62 0.00 -2.24 -0.64 -4.82 114.28 100.64 2qc3 n THR 126 Ca 0.02 -0.13 -0.15 0.00 -2.27 0.00 0.00 64.05 61.52 2qc3 n THR 126 Cb 0.51 -0.56 -0.07 0.00 -2.10 0.00 0.00 70.33 68.11 2qc3 n THR 126 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2qc3 s GLU 127 N -3.05 0.85 -0.78 -0.78 2.56 -1.25 -5.09 118.70 111.15 2qc3 s GLU 127 Ca 0.12 0.67 -0.24 0.00 0.00 0.00 0.00 54.97 55.52 2qc3 s GLU 127 Cb 0.16 0.41 0.05 0.00 2.00 0.00 0.00 34.13 36.75 2qc3 s GLU 127 CO 0.55 -0.17 1.21 -1.25 -0.56 0.00 0.00 175.26 175.05 2qc3 s PRO 128 N -0.19 3.27 0.39 4.30 0.04 -1.26 -4.80 135.00 136.76 2qc3 s PRO 128 Ca -0.04 -0.70 0.05 0.00 0.04 0.00 0.00 61.00 60.35 2qc3 s PRO 128 Cb -0.03 -4.47 -0.07 0.00 0.04 0.00 0.00 34.50 29.97 2qc3 s PRO 128 CO 0.04 -2.03 0.03 0.95 0.04 0.00 0.00 177.00 176.03 2qc3 s THR 129 N 4.86 1.57 0.00 1.26 -4.23 -1.26 -1.25 115.64 116.59 2qc3 s THR 129 Ca 0.33 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 2qc3 s THR 129 Cb -0.09 -2.82 0.00 0.00 1.34 0.00 0.00 72.50 70.94 2qc3 s THR 129 CO 0.07 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.76 2qc3 n GLY 130 N -0.90 1.62 2.98 3.99 0.00 -0.17 -3.83 105.19 108.88 2qc3 n GLY 130 Ca -0.05 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 2qc3 n GLY 130 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qc3 s MET 131 N -1.96 0.26 -0.05 1.61 -1.94 -1.26 -2.49 119.30 113.48 2qc3 s MET 131 Ca 0.00 -0.39 -0.02 0.00 -1.71 0.00 0.00 55.69 53.57 2qc3 s MET 131 Cb 0.00 0.10 0.04 0.00 2.01 0.00 0.00 34.83 36.98 2qc3 s MET 131 CO 0.00 -0.05 0.10 -1.12 -0.01 0.00 0.00 175.02 173.94 2qc3 s SER 132 N -1.04 0.01 0.38 3.03 0.01 0.57 -0.21 113.70 116.45 2qc3 s SER 132 Ca -0.11 0.19 -0.25 0.00 1.31 0.00 0.00 55.95 57.09 2qc3 s SER 132 Cb -0.07 0.08 -0.09 0.00 0.21 0.00 0.00 66.02 66.15 2qc3 s SER 132 CO -0.00 -0.15 1.07 0.00 0.41 0.00 0.00 173.24 174.57 2qc3 s ALA 133 N 1.19 3.14 -0.21 1.44 0.00 0.89 0.14 121.76 128.35 2qc3 s ALA 133 Ca -0.08 0.77 -0.01 0.00 0.00 0.00 0.00 51.96 52.63 2qc3 s ALA 133 Cb -0.12 -3.29 0.06 0.00 0.00 0.00 0.00 23.12 19.76 2qc3 s ALA 133 CO -0.05 -0.25 -0.00 0.08 0.00 0.00 0.00 175.76 175.54 2qc3 s VAL 134 N -1.55 0.99 -0.10 0.00 1.01 0.57 -0.74 120.40 120.59 2qc3 s VAL 134 Ca 0.56 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 2qc3 s VAL 134 Cb -0.25 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 2qc3 s VAL 134 CO 0.31 -0.17 -0.04 -0.76 0.00 0.00 0.00 175.10 174.44 2qc3 s LEU 135 N 1.64 3.31 0.00 3.92 1.43 0.47 -2.42 118.68 127.03 2qc3 s LEU 135 Ca -0.03 -0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 2qc3 s LEU 135 Cb -0.18 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.29 2qc3 s LEU 135 CO -0.07 0.31 0.00 0.61 0.23 0.00 0.00 176.35 177.42 2qc3 n GLY 136 N 2.61 -1.35 0.00 -3.19 0.00 -0.42 0.09 105.19 102.93 2qc3 n GLY 136 Ca -0.18 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2qc3 n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qc3 n GLY 137 N 0.00 -1.96 3.65 -0.02 0.00 -1.19 -4.52 105.19 101.15 2qc3 n GLY 137 Ca 0.00 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.09 2qc3 n GLY 137 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qc3 s ASP 138 N -4.79 6.98 0.18 1.61 -1.08 -1.26 -4.90 116.67 113.41 2qc3 s ASP 138 Ca 0.00 1.42 -0.22 0.00 -0.52 0.00 0.00 52.55 53.23 2qc3 s ASP 138 Cb 0.00 -2.54 0.10 0.00 -1.46 0.00 0.00 42.92 39.02 2qc3 s ASP 138 CO 0.00 -0.77 1.58 -0.08 0.52 0.00 0.00 175.17 176.41 2qc3 h GLU 139 N 7.99 -0.17 -0.24 4.34 4.81 -1.98 0.16 114.58 129.49 2qc3 h GLU 139 Ca -0.22 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.06 2qc3 h GLU 139 Cb 1.08 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.46 2qc3 h GLU 139 CO 0.99 -0.11 -0.00 1.15 -0.73 0.00 0.00 179.01 180.30 2qc3 h THR 140 N -0.18 0.83 -0.74 0.32 2.02 -1.99 0.18 112.91 113.35 2qc3 h THR 140 Ca 0.22 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.37 2qc3 h THR 140 Cb 0.56 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 2qc3 h THR 140 CO -0.70 0.01 0.46 -0.33 0.37 0.00 0.00 175.52 175.33 2qc3 h GLU 141 N 0.07 1.00 0.34 6.66 4.39 -1.67 0.11 114.58 125.48 2qc3 h GLU 141 Ca 0.11 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 2qc3 h GLU 141 Cb 0.14 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2qc3 h GLU 141 CO -0.19 0.69 -0.16 0.28 -1.16 0.00 0.00 179.01 178.47 2qc3 h VAL 142 N 1.01 0.68 -0.27 3.13 2.07 -0.27 0.38 116.25 122.97 2qc3 h VAL 142 Ca 0.27 -0.33 0.03 0.00 0.82 0.00 0.00 66.70 67.49 2qc3 h VAL 142 Cb -0.06 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 2qc3 h VAL 142 CO -0.05 0.07 0.09 -0.07 0.02 0.00 0.00 177.57 177.62 2qc3 h LEU 143 N -0.64 0.09 -0.65 2.57 3.38 -0.86 -0.42 115.31 118.79 2qc3 h LEU 143 Ca -0.05 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.03 2qc3 h LEU 143 Cb 0.46 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 2qc3 h LEU 143 CO 0.08 0.09 0.32 -1.28 0.09 0.00 0.00 178.44 177.73 2qc3 h SER 144 N 0.21 0.42 -0.85 -0.43 0.87 -0.74 -0.94 113.55 112.09 2qc3 h SER 144 Ca 0.12 0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.71 2qc3 h SER 144 Cb 0.09 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.00 2qc3 h SER 144 CO -0.13 0.26 0.45 -0.09 -0.53 0.00 0.00 176.83 176.78 2qc3 h ARG 145 N 0.57 1.21 -0.39 2.24 9.65 -0.05 -1.88 114.38 125.72 2qc3 h ARG 145 Ca 0.31 -0.16 0.02 0.00 -1.10 0.00 0.00 59.98 59.06 2qc3 h ARG 145 Cb 0.30 -0.23 -0.03 0.00 -1.39 0.00 0.00 29.97 28.62 2qc3 h ARG 145 CO -0.24 0.90 0.22 -0.07 2.80 0.00 0.00 179.97 183.58 2qc3 h LEU 146 N 1.21 0.34 -0.96 3.80 3.38 0.26 -2.13 115.31 121.20 2qc3 h LEU 146 Ca 0.30 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.24 2qc3 h LEU 146 Cb 0.06 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2qc3 h LEU 146 CO -0.04 0.25 0.25 -0.08 0.09 0.00 0.00 178.44 178.91 2qc3 h GLU 147 N 0.44 1.01 -0.39 1.13 4.22 -1.09 0.75 114.58 120.65 2qc3 h GLU 147 Ca 0.16 -0.18 0.05 0.00 0.08 0.00 0.00 59.36 59.47 2qc3 h GLU 147 Cb 0.03 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2qc3 h GLU 147 CO -0.09 0.83 0.27 1.96 -2.18 0.00 0.00 179.01 179.80 2qc3 h GLN 148 N 0.98 0.31 -0.68 1.92 4.20 -0.73 -1.88 115.11 119.23 2qc3 h GLN 148 Ca 0.23 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.92 2qc3 h GLN 148 Cb 0.22 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2qc3 h GLN 148 CO -0.02 0.20 0.00 1.28 -0.67 0.00 0.00 178.83 179.63 2qc3 n LEU 149 N -4.48 3.73 -1.82 1.46 4.77 -0.77 -4.94 117.00 114.95 2qc3 n LEU 149 Ca 0.05 -1.85 -0.16 0.00 -0.03 0.00 0.00 56.01 54.02 2qc3 n LEU 149 Cb 0.23 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 40.86 2qc3 n LEU 149 CO 0.35 0.92 -0.21 0.47 -1.33 0.00 0.00 177.39 177.59 2qc3 n ASP 150 N 1.55 -4.81 -4.87 -1.43 8.00 -0.71 -4.79 116.55 109.49 2qc3 n ASP 150 Ca 0.23 -0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.40 2qc3 n ASP 150 Cb 0.59 -3.92 -0.05 0.00 -0.02 0.00 0.00 41.12 37.72 2qc3 n ASP 150 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2qc3 s LEU 151 N -4.61 4.23 -0.10 0.64 1.43 0.19 -4.77 118.68 115.67 2qc3 s LEU 151 Ca 0.00 0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 53.32 2qc3 s LEU 151 Cb 0.00 -2.62 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 2qc3 s LEU 151 CO 0.00 0.23 0.05 -0.69 0.23 0.00 0.00 176.35 176.17 2qc3 s VAL 152 N -1.35 4.69 -1.30 -1.59 1.01 0.80 -4.02 120.40 118.64 2qc3 s VAL 152 Ca 0.29 -0.10 -0.16 0.00 0.00 0.00 0.00 61.98 62.01 2qc3 s VAL 152 Cb -0.13 -3.01 0.10 0.00 0.00 0.00 0.00 36.38 33.34 2qc3 s VAL 152 CO 0.20 0.60 1.76 -0.81 0.00 0.00 0.00 175.10 176.85 2qc3 n PRO 153 N 2.23 3.22 0.31 2.72 -0.04 -1.26 -0.47 135.00 141.72 2qc3 n PRO 153 Ca -0.19 -3.33 0.19 0.00 -0.04 0.00 0.00 63.50 60.13 2qc3 n PRO 153 Cb 0.54 -3.30 1.05 0.00 -0.04 0.00 0.00 33.50 31.75 2qc3 n PRO 153 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qc3 h ALA 154 N 7.05 1.30 -3.55 0.55 0.00 -1.59 -3.40 119.26 119.62 2qc3 h ALA 154 Ca 0.43 -0.00 -0.42 0.00 0.00 0.00 0.00 54.91 54.92 2qc3 h ALA 154 Cb 0.81 0.00 -0.33 0.00 0.00 0.00 0.00 17.79 18.27 2qc3 h ALA 154 CO 1.49 -0.01 -0.78 -0.80 0.00 0.00 0.00 179.25 179.15 2qc3 s ASN 155 N -5.70 1.05 -0.37 0.00 0.02 -1.04 0.00 114.94 108.91 2qc3 s ASN 155 Ca -0.05 -0.16 0.02 0.00 -1.02 0.00 0.00 52.86 51.66 2qc3 s ASN 155 Cb 0.14 -0.44 0.11 0.00 0.02 0.00 0.00 41.25 41.08 2qc3 s ASN 155 CO 0.48 -0.01 0.11 -0.13 0.02 0.00 0.00 177.10 177.57 2qc3 s ARG 156 N 0.67 1.30 -0.14 -0.60 1.81 -0.45 -1.83 118.95 119.70 2qc3 s ARG 156 Ca -0.10 -1.76 0.11 0.00 -1.72 0.00 0.00 55.73 52.26 2qc3 s ARG 156 Cb -0.13 -2.78 -0.23 0.00 -0.45 0.00 0.00 34.95 31.36 2qc3 s ARG 156 CO 0.01 -1.00 0.27 0.09 -0.68 0.00 0.00 175.30 173.98 2qc3 n ASN 157 N 4.19 0.80 -3.60 0.23 3.02 -0.51 -1.04 115.26 118.36 2qc3 n ASN 157 Ca 0.03 0.15 0.02 0.00 -0.03 0.00 0.00 54.58 54.75 2qc3 n ASN 157 Cb 0.40 0.24 -0.00 0.00 -0.61 0.00 0.00 39.78 39.80 2qc3 n ASN 157 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qc3 s ALA 158 N -2.54 -2.34 0.15 5.41 0.00 -1.10 -3.75 121.76 117.59 2qc3 s ALA 158 Ca -0.13 0.81 -0.33 0.00 0.00 0.00 0.00 51.96 52.31 2qc3 s ALA 158 Cb 0.07 0.30 -0.13 0.00 0.00 0.00 0.00 23.12 23.36 2qc3 s ALA 158 CO 0.79 -1.05 1.67 0.00 0.00 0.00 0.00 175.76 177.17 2qc3 n ALA 159 N -0.49 1.78 -0.99 0.00 0.00 -1.26 -0.33 120.51 119.22 2qc3 n ALA 159 Ca -0.09 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2qc3 n ALA 159 Cb 0.63 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.65 2qc3 n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qc3 n GLY 160 N 3.73 0.36 2.75 0.00 0.00 -1.26 -4.93 105.19 105.84 2qc3 n GLY 160 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2qc3 n GLY 160 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qc3 s GLN 161 N -0.62 1.04 0.17 1.61 -0.21 0.55 -1.30 119.66 120.90 2qc3 s GLN 161 Ca 0.00 -1.57 0.06 0.00 0.02 0.00 0.00 55.36 53.87 2qc3 s GLN 161 Cb 0.00 -2.26 -0.04 0.00 1.00 0.00 0.00 33.01 31.70 2qc3 s GLN 161 CO 0.00 -1.06 -0.13 0.42 -2.12 0.00 0.00 175.29 172.40 2qc3 s ILE 162 N 0.98 1.44 -0.13 1.08 1.09 -1.02 -1.42 121.20 123.22 2qc3 s ILE 162 Ca 0.13 -2.06 0.00 0.00 -1.10 0.00 0.00 60.65 57.63 2qc3 s ILE 162 Cb -0.21 -1.87 0.02 0.00 -1.06 0.00 0.00 42.46 39.35 2qc3 s ILE 162 CO -0.12 -0.62 -0.12 -0.69 -0.10 0.00 0.00 174.94 173.29 2qc3 s VAL 163 N -2.95 1.37 0.17 2.92 1.01 -0.76 -0.31 120.40 121.85 2qc3 s VAL 163 Ca 0.18 -0.51 -0.09 0.00 0.00 0.00 0.00 61.98 61.55 2qc3 s VAL 163 Cb -0.00 -1.31 -0.07 0.00 0.00 0.00 0.00 36.38 35.00 2qc3 s VAL 163 CO 0.04 0.43 0.49 0.00 0.00 0.00 0.00 175.10 176.05 2qc3 s ALA 164 N 1.53 3.64 -0.04 5.51 0.00 0.12 -1.63 121.76 130.89 2qc3 s ALA 164 Ca 0.04 -0.33 -0.10 0.00 0.00 0.00 0.00 51.96 51.57 2qc3 s ALA 164 Cb -0.13 -2.36 0.02 0.00 0.00 0.00 0.00 23.12 20.65 2qc3 s ALA 164 CO -0.09 0.54 0.23 0.00 0.00 0.00 0.00 175.76 176.44 2qc3 s ALA 165 N -1.66 -0.57 0.00 0.00 0.00 0.38 -0.32 121.76 119.60 2qc3 s ALA 165 Ca 0.42 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.72 2qc3 s ALA 165 Cb -0.12 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.88 2qc3 s ALA 165 CO 0.21 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.20 2qc3 n GLY 166 N 2.03 -0.52 3.77 0.00 0.00 -1.04 -0.14 105.19 109.28 2qc3 n GLY 166 Ca -0.18 -0.91 -0.40 0.00 0.00 0.00 0.00 46.02 44.53 2qc3 n GLY 166 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qc3 s ARG 167 N -1.46 4.13 0.39 1.61 0.52 -1.26 -1.00 118.95 121.88 2qc3 s ARG 167 Ca 0.00 2.20 0.13 0.00 -0.52 0.00 0.00 55.73 57.54 2qc3 s ARG 167 Cb 0.00 -2.89 0.96 0.00 0.52 0.00 0.00 34.95 33.54 2qc3 s ARG 167 CO 0.00 -0.37 1.88 -0.07 0.02 0.00 0.00 175.30 176.75 2qc3 h LEU 168 N 2.97 0.51 -0.62 2.53 3.38 -1.45 0.14 115.31 122.78 2qc3 h LEU 168 Ca -0.49 0.04 0.08 0.00 0.09 0.00 0.00 57.88 57.60 2qc3 h LEU 168 Cb 1.24 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.86 2qc3 h LEU 168 CO 0.64 0.24 0.27 0.74 0.09 0.00 0.00 178.44 180.42 2qc3 h THR 169 N 0.53 0.83 0.00 0.22 2.02 -1.89 0.16 112.91 114.77 2qc3 h THR 169 Ca 0.43 -0.17 -0.21 0.00 0.77 0.00 0.00 66.41 67.24 2qc3 h THR 169 Cb 0.90 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 2qc3 h THR 169 CO -0.18 0.09 -0.90 0.00 0.37 0.00 0.00 175.52 174.91 2qc3 h ALA 170 N 1.39 0.46 -0.14 6.16 0.00 -1.08 -2.93 119.26 123.12 2qc3 h ALA 170 Ca 0.30 -0.71 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 2qc3 h ALA 170 Cb 0.32 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2qc3 h ALA 170 CO -0.26 0.87 -0.17 -0.07 0.00 0.00 0.00 179.25 179.62 2qc3 h LEU 171 N 0.16 0.21 -0.28 0.00 3.38 -0.33 -2.14 115.31 116.32 2qc3 h LEU 171 Ca -0.06 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.71 2qc3 h LEU 171 Cb 1.53 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.22 2qc3 h LEU 171 CO 0.14 0.40 -0.43 -0.33 0.09 0.00 0.00 178.44 178.31 2qc3 h GLU 172 N 0.21 0.78 0.00 1.13 5.08 -0.66 -2.07 114.58 119.06 2qc3 h GLU 172 Ca 0.04 -0.47 -0.04 0.00 -1.00 0.00 0.00 59.36 57.89 2qc3 h GLU 172 Cb 0.43 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2qc3 h GLU 172 CO 0.03 1.10 -0.19 0.87 -1.00 0.00 0.00 179.01 179.82 2qc3 h LYS 173 N 0.54 0.00 -0.06 2.33 1.57 -1.30 -0.49 116.57 119.16 2qc3 h LYS 173 Ca 0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2qc3 h LYS 173 Cb 1.03 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.34 2qc3 h LYS 173 CO 0.10 0.19 -0.05 1.25 -0.57 0.00 0.00 179.45 180.36 2qc3 h LEU 174 N 0.00 0.15 -1.38 2.94 5.85 -1.08 -2.88 115.31 118.90 2qc3 h LEU 174 Ca -0.00 -0.48 -0.06 0.00 0.84 0.00 0.00 57.88 58.17 2qc3 h LEU 174 Cb 0.42 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2qc3 h LEU 174 CO 0.02 0.60 -0.31 0.00 -0.34 0.00 0.00 178.44 178.41 2qc3 h ALA 175 N 0.56 1.40 -0.51 1.25 0.00 -1.05 -2.53 119.26 118.38 2qc3 h ALA 175 Ca 0.01 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 2qc3 h ALA 175 Cb 0.55 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2qc3 h ALA 175 CO 0.01 0.39 -0.13 0.93 0.00 0.00 0.00 179.25 180.45 2qc3 h GLU 176 N 0.00 0.98 -2.11 0.00 5.08 -1.03 -3.36 114.58 114.14 2qc3 h GLU 176 Ca -0.00 -0.38 -0.58 0.00 -1.00 0.00 0.00 59.36 57.40 2qc3 h GLU 176 Cb 0.58 -0.06 -0.40 0.00 0.50 0.00 0.00 28.75 29.37 2qc3 h GLU 176 CO 0.04 1.05 -0.91 -0.25 -1.00 0.00 0.00 179.01 177.95 2qc3 n ASP 177 N -4.18 1.48 -4.76 1.42 9.92 -1.09 -5.11 116.55 114.23 2qc3 n ASP 177 Ca 0.01 -2.96 -0.37 0.00 -0.53 0.00 0.00 54.79 50.94 2qc3 n ASP 177 Cb 0.41 -0.65 0.01 0.00 -0.64 0.00 0.00 41.12 40.25 2qc3 n ASP 177 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2qc3 s PRO 178 N -1.59 3.47 0.56 -0.24 0.04 -0.97 -4.87 135.00 131.41 2qc3 s PRO 178 Ca 0.36 1.85 -0.21 0.00 0.04 0.00 0.00 61.00 63.04 2qc3 s PRO 178 Cb 0.15 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 2qc3 s PRO 178 CO -0.08 -0.81 1.34 -2.14 0.04 0.00 0.00 177.00 175.34 2qc3 s PRO 179 N -2.91 3.04 0.05 0.56 0.02 -1.26 -4.83 135.00 129.67 2qc3 s PRO 179 Ca 0.68 2.18 -0.38 0.00 0.02 0.00 0.00 61.00 63.51 2qc3 s PRO 179 Cb -0.30 -2.17 -0.18 0.00 0.02 0.00 0.00 34.50 31.86 2qc3 s PRO 179 CO 0.36 -1.25 1.14 0.00 -0.33 0.00 0.00 177.00 176.91 2qc3 n ALA 180 N -1.20 -2.51 -0.09 -1.55 0.00 -1.26 -1.10 120.51 112.80 2qc3 n ALA 180 Ca 0.11 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.11 2qc3 n ALA 180 Cb 0.46 -1.88 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2qc3 n ALA 180 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qc3 n LYS 181 N 1.82 0.00 -3.06 0.00 5.02 -1.26 -4.04 118.16 116.64 2qc3 n LYS 181 Ca 0.19 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 56.08 2qc3 n LYS 181 Cb 0.14 -2.60 -0.05 0.00 -0.02 0.00 0.00 35.03 32.50 2qc3 n LYS 181 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qc3 s ALA 182 N -2.26 3.38 -0.20 7.82 0.00 -0.26 -3.18 121.76 127.07 2qc3 s ALA 182 Ca 0.00 0.16 -0.11 0.00 0.00 0.00 0.00 51.96 52.02 2qc3 s ALA 182 Cb 0.00 -2.92 -0.05 0.00 0.00 0.00 0.00 23.12 20.15 2qc3 s ALA 182 CO 0.00 0.03 0.16 1.03 0.00 0.00 0.00 175.76 176.98 2qc3 s ARG 183 N 0.24 4.18 -0.18 0.00 0.52 0.11 -4.66 118.95 119.16 2qc3 s ARG 183 Ca 0.36 -0.18 -0.02 0.00 -0.52 0.00 0.00 55.73 55.37 2qc3 s ARG 183 Cb -0.19 -3.44 -0.01 0.00 0.52 0.00 0.00 34.95 31.83 2qc3 s ARG 183 CO 0.20 0.25 -0.09 0.08 0.02 0.00 0.00 175.30 175.76 2qc3 s VAL 184 N 0.50 3.12 -0.14 3.52 1.01 -1.26 -0.40 120.40 126.74 2qc3 s VAL 184 Ca 0.09 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 2qc3 s VAL 184 Cb -0.12 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 33.93 2qc3 s VAL 184 CO -0.00 0.47 -0.03 0.00 0.00 0.00 0.00 175.10 175.54 2qc3 s ARG 185 N 1.06 1.18 0.27 2.72 1.70 0.09 -4.97 118.95 120.99 2qc3 s ARG 185 Ca 0.00 -0.35 -0.30 0.00 -0.47 0.00 0.00 55.73 54.61 2qc3 s ARG 185 Cb -0.15 -1.77 -0.11 0.00 -0.57 0.00 0.00 34.95 32.36 2qc3 s ARG 185 CO -0.02 -0.41 1.50 0.00 -1.08 0.00 0.00 175.30 175.29 2qc3 s ALA 186 N 1.74 3.67 0.19 7.88 0.00 -1.26 -0.08 121.76 133.91 2qc3 s ALA 186 Ca 0.02 1.42 -0.06 0.00 0.00 0.00 0.00 51.96 53.34 2qc3 s ALA 186 Cb -0.15 -3.59 -0.06 0.00 0.00 0.00 0.00 23.12 19.32 2qc3 s ALA 186 CO -0.07 -0.84 0.45 -0.51 0.00 0.00 0.00 175.76 174.79 2qc3 s LEU 187 N -0.43 4.20 -1.50 0.00 1.43 0.70 -4.86 118.68 118.23 2qc3 s LEU 187 Ca 0.61 0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 54.27 2qc3 s LEU 187 Cb -0.44 -3.44 0.00 0.00 0.03 0.00 0.00 46.19 42.34 2qc3 s LEU 187 CO 0.45 -0.03 2.48 0.61 0.23 0.00 0.00 176.35 180.10 2qc3 n GLY 188 N -0.19 4.42 3.31 -3.19 0.00 -1.26 -4.63 105.19 103.65 2qc3 n GLY 188 Ca -0.02 -1.61 -0.23 0.00 0.00 0.00 0.00 46.02 44.17 2qc3 n GLY 188 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qc3 s VAL 189 N 2.45 1.78 -0.59 1.61 -7.23 -1.26 -5.05 120.40 112.12 2qc3 s VAL 189 Ca 0.55 -1.77 0.25 0.00 -1.81 0.00 0.00 61.98 59.20 2qc3 s VAL 189 Cb 0.15 -1.73 0.26 0.00 0.56 0.00 0.00 36.38 35.62 2qc3 s VAL 189 CO -0.07 -0.21 1.74 0.00 -0.31 0.00 0.00 175.10 176.24 2qc3 n ALA 190 N 0.61 1.92 -3.60 1.32 0.00 -1.26 -4.75 120.51 114.74 2qc3 n ALA 190 Ca -0.16 0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.36 2qc3 n ALA 190 Cb 0.56 -1.42 0.02 0.00 0.00 0.00 0.00 19.45 18.60 2qc3 n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qc3 n GLY 191 N 0.54 0.94 3.56 0.00 0.00 -1.25 -4.59 105.19 104.38 2qc3 n GLY 191 Ca 0.04 -1.11 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 2qc3 n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qc3 s ALA 192 N -1.72 3.37 0.74 4.61 0.00 -1.25 -4.14 121.76 123.37 2qc3 s ALA 192 Ca 0.15 -2.92 -0.14 0.00 0.00 0.00 0.00 51.96 49.04 2qc3 s ALA 192 Cb -0.02 -4.54 0.04 0.00 0.00 0.00 0.00 23.12 18.60 2qc3 s ALA 192 CO 0.05 -3.24 1.17 -0.06 0.00 0.00 0.00 175.76 173.67 2qc3 s PHE 193 N 3.84 2.18 -1.42 0.00 2.99 -1.26 -3.47 117.98 120.83 2qc3 s PHE 193 Ca 0.51 1.61 -0.09 0.00 0.00 0.00 0.00 56.93 58.95 2qc3 s PHE 193 Cb 0.02 -3.34 0.04 0.00 0.00 0.00 0.00 43.02 39.74 2qc3 s PHE 193 CO 0.04 -2.33 1.01 0.72 -0.00 0.00 0.00 175.22 174.66 2qc3 n HIS 194 N -2.89 -2.43 -4.13 0.36 8.25 -1.20 -4.86 115.22 108.32 2qc3 n HIS 194 Ca 0.12 0.94 -0.12 0.00 -0.26 0.00 0.00 57.72 58.39 2qc3 n HIS 194 Cb 0.51 -4.45 -0.07 0.00 1.12 0.00 0.00 29.99 27.10 2qc3 n HIS 194 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2qc3 s THR 195 N -3.36 0.00 0.65 1.59 -4.23 -1.19 -3.50 115.64 105.59 2qc3 s THR 195 Ca 0.50 -1.76 0.40 0.00 -1.18 0.00 0.00 61.69 59.65 2qc3 s THR 195 Cb -0.24 -2.43 0.42 0.00 1.34 0.00 0.00 72.50 71.59 2qc3 s THR 195 CO 0.79 0.00 2.33 -0.33 -0.54 0.00 0.00 174.62 176.87 2qc3 h GLU 196 N 2.38 0.00 0.00 3.99 4.39 -1.88 -1.63 114.58 121.84 2qc3 h GLU 196 Ca -0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.39 2qc3 h GLU 196 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 2qc3 h GLU 196 CO 0.44 0.00 0.00 0.74 -1.16 0.00 0.00 179.01 179.03 2qc3 h PHE 197 N 0.00 0.00 -0.01 4.33 -1.00 -1.92 0.18 116.94 118.52 2qc3 h PHE 197 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2qc3 h PHE 197 Cb 0.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.59 2qc3 h PHE 197 CO 0.00 0.00 -0.18 -1.33 -1.61 0.00 0.00 178.31 175.19 2qc3 n MET 198 N -2.34 1.10 -0.32 1.51 2.81 -0.61 -4.45 117.12 114.82 2qc3 n MET 198 Ca -0.00 -0.65 0.22 0.00 -1.81 0.00 0.00 57.70 55.46 2qc3 n MET 198 Cb 0.12 -1.49 0.43 0.00 -0.71 0.00 0.00 33.22 31.58 2qc3 n MET 198 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qc3 h ALA 199 N 3.89 1.73 0.00 3.04 0.00 -0.79 0.30 119.26 127.43 2qc3 h ALA 199 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2qc3 h ALA 199 Cb 0.51 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2qc3 h ALA 199 CO 0.00 -0.63 0.00 -0.35 0.00 0.00 0.00 179.25 178.27 2qc3 n PRO 200 N -5.20 0.09 0.06 0.00 -0.04 -1.26 -1.56 135.00 127.09 2qc3 n PRO 200 Ca 0.29 0.46 0.12 0.00 -0.04 0.00 0.00 63.50 64.34 2qc3 n PRO 200 Cb 0.95 -1.73 0.23 0.00 -0.04 0.00 0.00 33.50 32.91 2qc3 n PRO 200 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qc3 n ALA 201 N -1.65 2.89 -0.07 0.55 0.00 0.10 -4.30 120.51 118.04 2qc3 n ALA 201 Ca 0.01 -0.23 -0.07 0.00 0.00 0.00 0.00 53.44 53.15 2qc3 n ALA 201 Cb 0.11 -1.22 -0.01 0.00 0.00 0.00 0.00 19.45 18.33 2qc3 n ALA 201 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2qc3 h LEU 202 N 0.00 -0.09 -0.14 0.00 3.38 -1.36 -2.08 115.31 115.02 2qc3 h LEU 202 Ca 0.00 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.08 2qc3 h LEU 202 Cb 0.70 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.49 2qc3 h LEU 202 CO 0.00 -0.01 -0.31 0.44 0.09 0.00 0.00 178.44 178.65 2qc3 h ASP 203 N 0.09 -0.97 -0.40 -0.43 3.45 -1.77 1.00 116.42 117.40 2qc3 h ASP 203 Ca 0.13 0.14 -0.06 0.00 0.43 0.00 0.00 57.03 57.67 2qc3 h ASP 203 Cb 0.16 0.41 -0.01 0.00 -0.56 0.00 0.00 39.33 39.33 2qc3 h ASP 203 CO -0.21 -0.35 0.02 1.23 -1.57 0.00 0.00 179.24 178.36 2qc3 h GLY 204 N -0.38 0.75 0.97 2.75 0.00 -1.82 -0.59 103.07 104.75 2qc3 h GLY 204 Ca 0.10 -0.54 -0.06 0.00 0.00 0.00 0.00 47.33 46.83 2qc3 h GLY 204 CO -0.35 0.50 0.05 -2.75 0.00 0.00 0.00 176.54 173.99 2qc3 h PHE 205 N 0.53 0.81 -0.62 5.60 3.57 -1.04 -1.68 116.94 124.11 2qc3 h PHE 205 Ca 0.12 -0.12 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 2qc3 h PHE 205 Cb 0.45 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 2qc3 h PHE 205 CO 0.03 0.78 0.24 0.00 -2.23 0.00 0.00 178.31 177.13 2qc3 h ALA 206 N 0.94 0.81 -0.43 2.41 0.00 0.11 -1.74 119.26 121.36 2qc3 h ALA 206 Ca 0.13 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2qc3 h ALA 206 Cb 0.42 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2qc3 h ALA 206 CO 0.01 0.44 0.07 0.00 0.00 0.00 0.00 179.25 179.77 2qc3 h ALA 207 N 1.09 0.57 -0.20 0.00 0.00 -0.98 -1.78 119.26 117.96 2qc3 h ALA 207 Ca 0.21 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qc3 h ALA 207 Cb 0.22 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2qc3 h ALA 207 CO -0.01 0.29 0.13 0.00 0.00 0.00 0.00 179.25 179.65 2qc3 h ALA 208 N 0.94 0.25 -0.83 0.00 0.00 -1.15 -2.90 119.26 115.56 2qc3 h ALA 208 Ca 0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2qc3 h ALA 208 Cb 0.38 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2qc3 h ALA 208 CO 0.01 -0.27 0.51 0.00 0.00 0.00 0.00 179.25 179.50 2qc3 h ALA 209 N 1.07 1.06 0.00 0.00 0.00 -1.20 -2.69 119.26 117.50 2qc3 h ALA 209 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2qc3 h ALA 209 Cb -0.03 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.43 2qc3 h ALA 209 CO -0.02 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.76 2qc3 n ALA 210 N -2.36 1.40 0.93 0.00 0.00 -0.68 -2.28 120.51 117.52 2qc3 n ALA 210 Ca 0.09 0.14 0.10 0.00 0.00 0.00 0.00 53.44 53.76 2qc3 n ALA 210 Cb 0.05 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.12 2qc3 n ALA 210 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2qc3 n ASN 211 N -2.26 1.73 -4.80 0.00 3.02 -1.02 -4.96 115.26 106.97 2qc3 n ASN 211 Ca 0.01 -1.37 -0.38 0.00 -0.03 0.00 0.00 54.58 52.81 2qc3 n ASN 211 Cb 0.15 0.59 -0.06 0.00 -0.61 0.00 0.00 39.78 39.84 2qc3 n ASN 211 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qc3 s ILE 212 N -2.45 4.49 0.06 2.41 1.01 -0.96 -5.03 121.20 120.73 2qc3 s ILE 212 Ca 0.15 1.46 -0.30 0.00 0.00 0.00 0.00 60.65 61.96 2qc3 s ILE 212 Cb 0.16 -3.98 -0.05 0.00 0.01 0.00 0.00 42.46 38.60 2qc3 s ILE 212 CO 0.59 0.37 1.13 0.00 0.00 0.00 0.00 174.94 177.03 2qc3 s ALA 213 N -1.33 3.33 0.37 9.38 0.00 -1.26 -5.03 121.76 127.22 2qc3 s ALA 213 Ca 0.39 0.77 0.04 0.00 0.00 0.00 0.00 51.96 53.16 2qc3 s ALA 213 Cb -0.20 -3.41 -0.06 0.00 0.00 0.00 0.00 23.12 19.46 2qc3 s ALA 213 CO 0.23 -0.35 0.05 0.95 0.00 0.00 0.00 175.76 176.64 2qc3 s THR 214 N 0.87 1.29 0.05 0.00 -4.23 -1.26 -4.54 115.64 107.82 2qc3 s THR 214 Ca 0.56 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.92 2qc3 s THR 214 Cb -0.27 -2.73 0.02 0.00 1.34 0.00 0.00 72.50 70.86 2qc3 s THR 214 CO 0.30 0.00 0.33 0.00 -0.54 0.00 0.00 174.62 174.71 2qc3 s ALA 215 N -3.12 -0.75 0.46 3.99 0.00 -0.49 -5.01 121.76 116.85 2qc3 s ALA 215 Ca 0.32 0.03 -0.24 0.00 0.00 0.00 0.00 51.96 52.07 2qc3 s ALA 215 Cb 0.08 0.37 -0.07 0.00 0.00 0.00 0.00 23.12 23.49 2qc3 s ALA 215 CO 0.15 -0.45 1.35 -0.51 0.00 0.00 0.00 175.76 176.30 2qc3 s ASP 216 N -2.15 5.88 0.37 0.00 -0.00 -1.26 -4.22 116.67 115.29 2qc3 s ASP 216 Ca -0.04 2.75 -0.28 0.00 -0.00 0.00 0.00 52.55 54.98 2qc3 s ASP 216 Cb -0.00 -2.64 -0.11 0.00 -0.00 0.00 0.00 42.92 40.16 2qc3 s ASP 216 CO -0.04 -1.15 1.45 -0.81 -0.00 0.00 0.00 175.17 174.61 2qc3 n PRO 217 N -0.33 2.56 0.00 8.23 -0.04 -1.26 -4.63 135.00 139.54 2qc3 n PRO 217 Ca 0.06 0.90 0.14 0.00 -0.04 0.00 0.00 63.50 64.56 2qc3 n PRO 217 Cb 0.44 -2.61 0.52 0.00 -0.04 0.00 0.00 33.50 31.81 2qc3 n PRO 217 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2qc3 n THR 218 N 0.39 0.00 -4.00 0.52 -2.24 0.14 -4.89 114.28 104.20 2qc3 n THR 218 Ca 0.02 -0.12 -0.10 0.00 -2.27 0.00 0.00 64.05 61.58 2qc3 n THR 218 Cb 0.38 0.20 -0.08 0.00 -2.10 0.00 0.00 70.33 68.74 2qc3 n THR 218 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qc3 s ALA 219 N -2.36 0.17 -0.09 6.98 0.00 -1.25 -5.04 121.76 120.17 2qc3 s ALA 219 Ca 0.30 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 50.96 2qc3 s ALA 219 Cb 0.20 0.87 -0.06 0.00 0.00 0.00 0.00 23.12 24.13 2qc3 s ALA 219 CO 0.46 -0.62 1.93 0.99 0.00 0.00 0.00 175.76 178.52 2qc3 s THR 220 N -3.99 3.21 -0.23 0.00 2.01 -1.25 -4.89 115.64 110.50 2qc3 s THR 220 Ca 0.19 0.25 -0.01 0.00 0.31 0.00 0.00 61.69 62.42 2qc3 s THR 220 Cb 0.04 -3.20 0.02 0.00 0.01 0.00 0.00 72.50 69.37 2qc3 s THR 220 CO 0.01 -0.07 -0.09 -0.22 -0.69 0.00 0.00 174.62 173.55 2qc3 s LEU 221 N 5.61 2.93 0.48 4.42 2.96 -1.26 -0.03 118.68 133.79 2qc3 s LEU 221 Ca 0.87 -0.79 -0.05 0.00 -0.22 0.00 0.00 54.13 53.94 2qc3 s LEU 221 Cb -0.35 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 2qc3 s LEU 221 CO 0.36 -0.09 0.78 -0.76 -1.32 0.00 0.00 176.35 175.32 2qc3 s LEU 222 N 1.32 3.64 0.01 -0.68 1.43 -0.40 -0.68 118.68 123.33 2qc3 s LEU 222 Ca 0.01 0.91 0.07 0.00 -1.03 0.00 0.00 54.13 54.09 2qc3 s LEU 222 Cb -0.16 -3.86 -0.02 0.00 0.03 0.00 0.00 46.19 42.18 2qc3 s LEU 222 CO -0.06 -0.57 -0.20 -0.55 0.23 0.00 0.00 176.35 175.20 2qc3 s SER 223 N -4.09 2.42 0.46 2.29 0.15 -0.93 -4.67 113.70 109.32 2qc3 s SER 223 Ca 0.47 -0.44 0.31 0.00 0.70 0.00 0.00 55.95 56.99 2qc3 s SER 223 Cb -0.10 -0.24 1.52 0.00 -1.71 0.00 0.00 66.02 65.50 2qc3 s SER 223 CO 0.44 0.21 1.95 0.78 1.20 0.00 0.00 173.24 177.82 2qc3 h ASN 224 N 5.27 0.00 -0.05 5.45 -0.26 -1.88 0.28 115.58 124.39 2qc3 h ASN 224 Ca -0.41 0.00 0.03 0.00 -0.56 0.00 0.00 56.30 55.37 2qc3 h ASN 224 Cb 1.15 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 38.37 2qc3 h ASN 224 CO 0.46 0.00 -0.16 -0.09 -1.06 0.00 0.00 177.43 176.58 2qc3 h ARG 225 N 0.00 -0.23 0.00 0.81 2.43 -1.89 0.29 114.38 115.78 2qc3 h ARG 225 Ca 0.00 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2qc3 h ARG 225 Cb 0.21 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 2qc3 h ARG 225 CO 0.00 -0.15 -0.20 -0.40 -1.51 0.00 0.00 179.97 177.71 2qc3 n ASP 226 N -5.30 0.00 0.00 -3.80 3.85 -1.16 -4.62 116.55 105.53 2qc3 n ASP 226 Ca -0.04 -1.39 0.00 0.00 -0.71 0.00 0.00 54.79 52.65 2qc3 n ASP 226 Cb 0.21 -0.08 0.00 0.00 -1.35 0.00 0.00 41.12 39.91 2qc3 n ASP 226 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2qc3 n GLY 227 N 0.00 0.19 3.88 6.12 0.00 0.98 -4.72 105.19 111.64 2qc3 n GLY 227 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2qc3 n GLY 227 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qc3 s LYS 228 N -1.23 3.25 0.46 1.61 -0.14 -1.25 -4.49 119.74 117.95 2qc3 s LYS 228 Ca 0.00 -0.58 -0.23 0.00 -1.36 0.00 0.00 55.97 53.81 2qc3 s LYS 228 Cb 0.00 -2.91 -0.07 0.00 -1.68 0.00 0.00 37.83 33.17 2qc3 s LYS 228 CO 0.00 0.57 1.15 -1.25 -0.76 0.00 0.00 175.35 175.06 2qc3 s PRO 229 N -2.68 3.76 -0.29 -1.68 0.04 -1.26 -2.20 135.00 130.70 2qc3 s PRO 229 Ca 0.33 1.72 -0.08 0.00 0.04 0.00 0.00 61.00 63.01 2qc3 s PRO 229 Cb -0.12 -2.38 -0.01 0.00 0.04 0.00 0.00 34.50 32.03 2qc3 s PRO 229 CO 0.26 -0.54 0.11 0.14 0.04 0.00 0.00 177.00 177.01 2qc3 s VAL 230 N -1.59 4.35 -0.99 -0.36 -7.23 0.14 -4.92 120.40 109.80 2qc3 s VAL 230 Ca 0.64 -0.42 0.24 0.00 -1.81 0.00 0.00 61.98 60.62 2qc3 s VAL 230 Cb -0.27 -3.17 -0.07 0.00 0.56 0.00 0.00 36.38 33.42 2qc3 s VAL 230 CO 0.33 0.15 1.24 0.35 -0.31 0.00 0.00 175.10 176.85 2qc3 n THR 231 N 4.93 0.01 -4.23 5.32 -2.24 -1.26 -4.50 114.28 112.31 2qc3 n THR 231 Ca -0.15 -0.01 -0.19 0.00 -2.27 0.00 0.00 64.05 61.43 2qc3 n THR 231 Cb 0.49 0.49 -0.12 0.00 -2.10 0.00 0.00 70.33 69.10 2qc3 n THR 231 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qc3 s SER 232 N -3.03 2.01 0.17 3.42 1.04 -1.26 -4.48 113.70 111.56 2qc3 s SER 232 Ca 0.10 -0.72 -0.17 0.00 0.48 0.00 0.00 55.95 55.64 2qc3 s SER 232 Cb 0.17 -0.08 0.09 0.00 0.10 0.00 0.00 66.02 66.30 2qc3 s SER 232 CO 0.76 -0.08 1.67 0.00 0.98 0.00 0.00 173.24 176.57 2qc3 h ALA 233 N 3.90 0.25 -0.24 5.32 0.00 -1.91 0.78 119.26 127.36 2qc3 h ALA 233 Ca -0.41 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 2qc3 h ALA 233 Cb 1.19 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 2qc3 h ALA 233 CO 0.45 -0.46 0.15 0.00 0.00 0.00 0.00 179.25 179.39 2qc3 h ALA 234 N 1.38 0.31 -0.40 0.00 0.00 -1.96 -0.13 119.26 118.46 2qc3 h ALA 234 Ca 0.19 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2qc3 h ALA 234 Cb 0.30 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2qc3 h ALA 234 CO -0.41 -0.20 0.24 0.00 0.00 0.00 0.00 179.25 178.88 2qc3 h ALA 235 N 1.06 0.51 -0.14 0.00 0.00 -1.85 -0.59 119.26 118.25 2qc3 h ALA 235 Ca 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qc3 h ALA 235 Cb -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2qc3 h ALA 235 CO -0.02 0.00 0.09 0.00 0.00 0.00 0.00 179.25 179.33 2qc3 h ALA 236 N 1.11 0.18 -0.44 0.00 0.00 -0.59 -1.40 119.26 118.11 2qc3 h ALA 236 Ca 0.14 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2qc3 h ALA 236 Cb 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2qc3 h ALA 236 CO -0.03 -0.33 -0.03 0.52 0.00 0.00 0.00 179.25 179.38 2qc3 h MET 237 N 0.18 0.80 -0.87 0.00 2.86 -0.86 -0.03 114.93 117.01 2qc3 h MET 237 Ca 0.05 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2qc3 h MET 237 Cb -0.01 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 2qc3 h MET 237 CO -0.01 0.88 0.56 -0.44 1.06 0.00 0.00 176.91 178.95 2qc3 h ASP 238 N 0.63 1.02 -0.46 1.22 3.32 -1.04 -0.86 116.42 120.25 2qc3 h ASP 238 Ca 0.12 -0.05 -0.13 0.00 0.02 0.00 0.00 57.03 57.00 2qc3 h ASP 238 Cb 0.54 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2qc3 h ASP 238 CO 0.03 0.76 -0.20 0.74 -1.72 0.00 0.00 179.24 178.85 2qc3 h THR 239 N 1.19 1.27 -0.42 0.35 2.02 -1.05 -1.92 112.91 114.35 2qc3 h THR 239 Ca 0.32 -1.36 0.00 0.00 0.77 0.00 0.00 66.41 66.13 2qc3 h THR 239 Cb -0.10 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 2qc3 h THR 239 CO -0.06 0.47 0.27 0.25 0.37 0.00 0.00 175.52 176.81 2qc3 h LEU 240 N 0.84 0.50 -0.16 2.58 5.85 -0.41 0.25 115.31 124.76 2qc3 h LEU 240 Ca 0.11 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2qc3 h LEU 240 Cb 0.77 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 2qc3 h LEU 240 CO 0.06 0.39 0.07 0.58 -0.34 0.00 0.00 178.44 179.20 2qc3 h VAL 241 N 0.56 1.14 -0.42 1.05 2.07 -1.09 -2.82 116.25 116.73 2qc3 h VAL 241 Ca 0.15 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 2qc3 h VAL 241 Cb -0.03 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 2qc3 h VAL 241 CO -0.03 0.13 0.25 -1.28 0.02 0.00 0.00 177.57 176.66 2qc3 h SER 242 N 0.12 0.50 0.00 0.57 0.87 -1.11 -2.03 113.55 112.47 2qc3 h SER 242 Ca 0.05 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2qc3 h SER 242 Cb 0.14 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 2qc3 h SER 242 CO -0.01 0.39 0.05 1.56 -0.53 0.00 0.00 176.83 178.30 2qc3 h GLN 243 N 0.58 0.00 -1.00 2.24 1.08 -0.68 -2.55 115.11 114.78 2qc3 h GLN 243 Ca 0.15 0.00 0.16 0.00 -1.45 0.00 0.00 58.65 57.51 2qc3 h GLN 243 Cb -0.01 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 27.32 2qc3 h GLN 243 CO -0.03 0.00 0.62 1.25 -0.95 0.00 0.00 178.83 179.72 2qc3 h LEU 244 N 0.00 0.85 -2.90 1.46 5.85 -1.44 -2.08 115.31 117.05 2qc3 h LEU 244 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2qc3 h LEU 244 Cb 0.11 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2qc3 h LEU 244 CO 0.00 0.37 0.00 0.35 -0.34 0.00 0.00 178.44 178.82 2qc3 n THR 245 N -4.71 1.00 -4.21 1.05 -2.24 -0.96 -3.26 114.28 100.96 2qc3 n THR 245 Ca 0.21 -1.00 -0.29 0.00 -2.27 0.00 0.00 64.05 60.70 2qc3 n THR 245 Cb 0.48 0.50 -0.09 0.00 -2.10 0.00 0.00 70.33 69.11 2qc3 n THR 245 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2qc3 s GLN 246 N -1.00 2.24 0.60 -0.78 -1.52 -0.78 -3.15 119.66 115.26 2qc3 s GLN 246 Ca 0.21 -1.02 -0.19 0.00 -1.95 0.00 0.00 55.36 52.40 2qc3 s GLN 246 Cb 0.11 -2.35 -0.04 0.00 -0.22 0.00 0.00 33.01 30.52 2qc3 s GLN 246 CO 0.14 0.50 1.22 -2.30 -0.25 0.00 0.00 175.29 174.60 2qc3 n PRO 247 N 0.51 1.24 -3.14 2.91 -0.02 -1.23 -4.61 135.00 130.67 2qc3 n PRO 247 Ca -0.12 0.47 -0.43 0.00 -2.02 0.00 0.00 63.50 61.40 2qc3 n PRO 247 Cb 0.53 -2.43 -0.07 0.00 -0.02 0.00 0.00 33.50 31.51 2qc3 n PRO 247 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2qc3 s VAL 248 N -1.38 4.85 -1.27 -1.45 1.01 0.10 -4.54 120.40 117.72 2qc3 s VAL 248 Ca 0.77 -0.08 -0.07 0.00 0.00 0.00 0.00 61.98 62.59 2qc3 s VAL 248 Cb -0.41 -4.22 0.17 0.00 0.00 0.00 0.00 36.38 31.92 2qc3 s VAL 248 CO 0.45 -0.64 2.01 0.54 0.00 0.00 0.00 175.10 177.46 2qc3 n ARG 249 N 6.20 4.11 -0.07 2.72 5.12 0.10 -1.34 116.66 133.50 2qc3 n ARG 249 Ca -0.03 -3.65 0.01 0.00 -1.93 0.00 0.00 57.85 52.25 2qc3 n ARG 249 Cb 0.47 -2.77 0.31 0.00 -1.16 0.00 0.00 32.46 29.31 2qc3 n ARG 249 CO 0.00 0.00 0.00 2.35 -1.93 0.00 0.00 177.63 178.05 2qc3 h TRP 250 N 5.26 0.68 -0.94 -1.55 2.91 -1.54 -1.95 115.95 118.82 2qc3 h TRP 250 Ca 0.49 -0.02 0.06 0.00 1.13 0.00 0.00 58.89 60.55 2qc3 h TRP 250 Cb 0.50 -0.22 -0.06 0.00 -0.51 0.00 0.00 29.16 28.88 2qc3 h TRP 250 CO 1.35 0.51 0.61 0.38 -1.03 0.00 0.00 178.44 180.27 2qc3 h ASP 251 N 0.69 0.96 0.61 2.65 -0.00 -1.17 -1.25 116.42 118.92 2qc3 h ASP 251 Ca 0.17 0.00 -0.12 0.00 -0.00 0.00 0.00 57.03 57.08 2qc3 h ASP 251 Cb 0.09 -0.20 -0.02 0.00 -0.00 0.00 0.00 39.33 39.20 2qc3 h ASP 251 CO -0.02 0.63 -0.58 -0.07 -0.00 0.00 0.00 179.24 179.19 2qc3 h LEU 252 N 1.10 0.00 -0.24 0.15 3.38 -1.64 -2.22 115.31 115.83 2qc3 h LEU 252 Ca 0.40 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.30 2qc3 h LEU 252 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2qc3 h LEU 252 CO -0.14 0.58 -0.10 0.00 0.09 0.00 0.00 178.44 178.87 2qc3 h THR 254 N 0.22 1.27 -0.56 0.00 2.02 -1.28 -1.32 112.91 113.26 2qc3 h THR 254 Ca 0.06 -1.29 -0.04 0.00 0.77 0.00 0.00 66.41 65.90 2qc3 h THR 254 Cb 0.59 1.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.46 2qc3 h THR 254 CO 0.03 0.40 0.18 0.00 0.37 0.00 0.00 175.52 176.50 2qc3 h ALA 255 N 1.41 1.27 -0.15 6.16 0.00 -1.24 -1.53 119.26 125.17 2qc3 h ALA 255 Ca 0.04 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 2qc3 h ALA 255 Cb 0.68 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2qc3 h ALA 255 CO 0.05 0.52 -0.50 1.15 0.00 0.00 0.00 179.25 180.47 2qc3 h THR 256 N 0.81 1.33 -0.80 0.00 2.02 -0.55 -2.64 112.91 113.09 2qc3 h THR 256 Ca 0.19 -1.74 -0.04 0.00 0.77 0.00 0.00 66.41 65.59 2qc3 h THR 256 Cb 0.22 1.76 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 2qc3 h THR 256 CO -0.01 0.53 0.34 -0.07 0.37 0.00 0.00 175.52 176.68 2qc3 h LEU 257 N 0.33 1.08 -0.83 2.58 3.38 -0.51 -2.13 115.31 119.21 2qc3 h LEU 257 Ca 0.01 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.84 2qc3 h LEU 257 Cb 1.00 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 2qc3 h LEU 257 CO 0.09 0.94 0.55 -0.09 0.09 0.00 0.00 178.44 180.02 2qc3 h ARG 258 N 1.15 1.08 -0.90 1.13 2.43 -1.07 -1.90 114.38 116.31 2qc3 h ARG 258 Ca 0.27 -0.06 0.11 0.00 -0.81 0.00 0.00 59.98 59.49 2qc3 h ARG 258 Cb 0.19 -0.24 -0.07 0.00 -0.42 0.00 0.00 29.97 29.42 2qc3 h ARG 258 CO -0.03 0.71 0.58 0.93 -1.51 0.00 0.00 179.97 180.66 2qc3 h GLU 259 N 1.11 0.80 -7.57 0.20 5.08 -1.03 -3.42 114.58 109.75 2qc3 h GLU 259 Ca 0.31 -0.05 -0.45 0.00 -1.00 0.00 0.00 59.36 58.16 2qc3 h GLU 259 Cb -0.11 -0.18 0.13 0.00 0.50 0.00 0.00 28.75 29.08 2qc3 h GLU 259 CO -0.07 0.53 0.32 -1.01 -1.00 0.00 0.00 179.01 177.78 2qc3 s HIS 260 N -5.78 1.92 -1.07 4.33 3.76 -0.71 -4.97 115.29 112.76 2qc3 s HIS 260 Ca -0.11 0.24 -0.03 0.00 -0.15 0.00 0.00 55.06 55.02 2qc3 s HIS 260 Cb 0.21 -3.67 0.24 0.00 1.11 0.00 0.00 32.58 30.48 2qc3 s HIS 260 CO 0.79 -2.17 2.08 2.41 -0.85 0.00 0.00 174.74 177.00 2qc3 n THR 261 N -3.39 5.47 -1.90 1.30 -1.04 -1.26 -4.96 114.28 108.50 2qc3 n THR 261 Ca 0.13 -5.14 -0.42 0.00 -2.04 0.00 0.00 64.05 56.58 2qc3 n THR 261 Cb 0.60 -1.69 -0.03 0.00 -1.82 0.00 0.00 70.33 67.39 2qc3 n THR 261 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2qc3 s VAL 262 N -3.28 3.40 -1.63 12.58 0.11 -1.26 -2.73 120.40 127.58 2qc3 s VAL 262 Ca 0.46 0.47 0.17 0.00 -2.93 0.00 0.00 61.98 60.15 2qc3 s VAL 262 Cb 0.22 -3.35 0.01 0.00 -1.53 0.00 0.00 36.38 31.73 2qc3 s VAL 262 CO -0.15 -0.10 0.91 0.35 -3.33 0.00 0.00 175.10 172.78 2qc3 n THR 263 N 6.02 0.00 -3.57 5.04 -2.24 0.20 -4.91 114.28 114.81 2qc3 n THR 263 Ca 0.20 -0.34 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 2qc3 n THR 263 Cb 0.43 1.22 -0.06 0.00 -2.10 0.00 0.00 70.33 69.82 2qc3 n THR 263 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qc3 s ALA 264 N -1.93 -1.86 -0.11 6.98 0.00 -1.19 -4.33 121.76 119.32 2qc3 s ALA 264 Ca 0.15 1.59 0.03 0.00 0.00 0.00 0.00 51.96 53.72 2qc3 s ALA 264 Cb 0.14 -0.62 -0.00 0.00 0.00 0.00 0.00 23.12 22.63 2qc3 s ALA 264 CO 0.41 -0.32 -0.21 0.42 0.00 0.00 0.00 175.76 176.06 2qc3 s ILE 265 N -0.75 2.33 -0.14 0.00 -1.09 0.20 -0.12 121.20 121.63 2qc3 s ILE 265 Ca -0.04 -0.92 0.01 0.00 -2.23 0.00 0.00 60.65 57.47 2qc3 s ILE 265 Cb -0.02 -1.92 0.02 0.00 -1.58 0.00 0.00 42.46 38.96 2qc3 s ILE 265 CO 0.03 0.55 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.45 2qc3 s VAL 266 N 0.41 1.60 -0.18 2.92 1.01 0.15 0.33 120.40 126.63 2qc3 s VAL 266 Ca -0.15 -0.66 -0.05 0.00 0.00 0.00 0.00 61.98 61.11 2qc3 s VAL 266 Cb -0.17 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 2qc3 s VAL 266 CO 0.07 0.46 0.01 -0.70 0.00 0.00 0.00 175.10 174.94 2qc3 s GLU 267 N 1.36 3.73 0.57 2.72 2.12 -0.25 -0.31 118.70 128.65 2qc3 s GLU 267 Ca 0.02 -0.47 -0.10 0.00 0.36 0.00 0.00 54.97 54.79 2qc3 s GLU 267 Cb -0.13 -3.07 -0.04 0.00 0.26 0.00 0.00 34.13 31.14 2qc3 s GLU 267 CO -0.09 0.15 0.95 -0.06 -0.54 0.00 0.00 175.26 175.67 2qc3 s PHE 268 N 0.65 3.60 0.61 5.30 0.40 -0.29 -1.19 117.98 127.06 2qc3 s PHE 268 Ca 0.00 1.16 -0.14 0.00 -0.60 0.00 0.00 56.93 57.35 2qc3 s PHE 268 Cb -0.14 -2.60 -0.03 0.00 0.51 0.00 0.00 43.02 40.76 2qc3 s PHE 268 CO 0.02 -0.54 1.04 -1.25 0.70 0.00 0.00 175.22 175.18 2qc3 s PRO 269 N -4.97 3.40 -0.57 0.24 0.04 -1.06 -2.94 135.00 129.15 2qc3 s PRO 269 Ca 0.53 1.00 -0.28 0.00 0.04 0.00 0.00 61.00 62.30 2qc3 s PRO 269 Cb -0.11 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2qc3 s PRO 269 CO 0.50 -0.73 1.48 -1.25 0.04 0.00 0.00 177.00 177.04 2qc3 s PRO 270 N -4.52 3.21 0.06 0.56 0.04 -1.26 -2.80 135.00 130.29 2qc3 s PRO 270 Ca 0.60 0.48 -0.36 0.00 0.04 0.00 0.00 61.00 61.76 2qc3 s PRO 270 Cb -0.13 -4.16 -0.19 0.00 0.04 0.00 0.00 34.50 30.06 2qc3 s PRO 270 CO 0.43 -2.04 0.88 0.00 0.04 0.00 0.00 177.00 176.32 2qc3 n ALA 271 N 9.98 -3.38 -2.31 8.56 0.00 -1.15 -4.79 120.51 127.42 2qc3 n ALA 271 Ca 0.13 0.54 0.00 0.00 0.00 0.00 0.00 53.44 54.11 2qc3 n ALA 271 Cb 0.49 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.25 2qc3 n ALA 271 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qc3 n GLY 272 N 1.64 1.82 0.00 0.00 0.00 -1.26 -4.95 105.19 102.43 2qc3 n GLY 272 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2qc3 n GLY 272 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qc3 n THR 273 N 0.00 0.28 -0.34 2.61 -2.24 -1.26 -4.77 114.28 108.56 2qc3 n THR 273 Ca 0.00 -0.54 -0.03 0.00 -2.27 0.00 0.00 64.05 61.21 2qc3 n THR 273 Cb 0.00 0.99 0.10 0.00 -2.10 0.00 0.00 70.33 69.32 2qc3 n THR 273 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2qc3 h LEU 274 N 0.00 1.03 -0.15 3.22 3.38 -1.99 -1.33 115.31 119.47 2qc3 h LEU 274 Ca 0.00 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.98 2qc3 h LEU 274 Cb 0.27 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 2qc3 h LEU 274 CO 0.00 0.74 -0.07 0.28 0.09 0.00 0.00 178.44 179.47 2qc3 h SER 275 N 1.21 -0.24 -0.66 -0.43 0.02 -1.97 0.26 113.55 111.74 2qc3 h SER 275 Ca 0.34 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.33 2qc3 h SER 275 Cb -0.11 0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 2qc3 h SER 275 CO -0.08 -0.10 0.33 1.23 -1.14 0.00 0.00 176.83 177.07 2qc3 h GLY 276 N -0.06 1.02 0.90 -3.77 0.00 -1.81 0.07 103.07 99.42 2qc3 h GLY 276 Ca 0.08 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 2qc3 h GLY 276 CO -0.19 0.47 0.09 -2.22 0.00 0.00 0.00 176.54 174.69 2qc3 h ILE 277 N 0.92 1.19 -0.13 2.60 5.03 -0.87 -2.82 117.51 123.43 2qc3 h ILE 277 Ca 0.23 -0.62 -0.02 0.00 -0.12 0.00 0.00 64.86 64.33 2qc3 h ILE 277 Cb 0.10 1.07 -0.01 0.00 -3.03 0.00 0.00 36.82 34.95 2qc3 h ILE 277 CO -0.03 0.21 -0.03 0.00 -0.68 0.00 0.00 178.15 177.61 2qc3 h ALA 278 N 0.93 1.71 -0.58 1.87 0.00 -0.17 -2.73 119.26 120.28 2qc3 h ALA 278 Ca 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2qc3 h ALA 278 Cb 0.23 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2qc3 h ALA 278 CO -0.00 0.22 0.33 0.87 0.00 0.00 0.00 179.25 180.67 2qc3 h LYS 279 N 0.18 0.81 -0.89 0.00 1.57 -0.73 -1.74 116.57 115.77 2qc3 h LYS 279 Ca 0.04 -0.09 0.19 0.00 -1.87 0.00 0.00 60.65 58.93 2qc3 h LYS 279 Cb 0.19 -0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.27 2qc3 h LYS 279 CO 0.01 0.61 0.58 -0.09 -0.57 0.00 0.00 179.45 179.99 2qc3 h ARG 280 N 0.79 0.44 0.00 3.15 2.43 -1.38 -2.37 114.38 117.45 2qc3 h ARG 280 Ca 0.21 -0.03 -0.33 0.00 -0.81 0.00 0.00 59.98 59.02 2qc3 h ARG 280 Cb 0.02 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.41 2qc3 h ARG 280 CO -0.04 0.29 -2.15 0.39 -1.51 0.00 0.00 179.97 176.96 2qc3 n GLU 281 N -4.53 0.67 -2.95 0.20 -0.58 -1.15 -4.48 120.64 107.82 2qc3 n GLU 281 Ca 0.19 0.09 -0.39 0.00 -0.42 0.00 0.00 57.16 56.62 2qc3 n GLU 281 Cb 0.65 -1.61 -0.00 0.00 -0.57 0.00 0.00 31.44 29.90 2qc3 n GLU 281 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2qc3 n LEU 282 N -2.83 6.20 -4.75 -4.62 4.77 -0.66 -4.93 117.00 110.17 2qc3 n LEU 282 Ca -0.27 -5.34 -0.41 0.00 -0.03 0.00 0.00 56.01 49.96 2qc3 n LEU 282 Cb 1.11 -1.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 2qc3 n LEU 282 CO 0.44 1.91 1.00 -0.13 -1.33 0.00 0.00 177.39 179.27 2qc3 s ARG 283 N -3.28 4.36 0.00 3.23 0.52 -1.08 -2.55 118.95 120.15 2qc3 s ARG 283 Ca 0.36 2.17 0.00 0.00 -0.52 0.00 0.00 55.73 57.74 2qc3 s ARG 283 Cb 0.12 -3.12 0.00 0.00 0.52 0.00 0.00 34.95 32.48 2qc3 s ARG 283 CO 0.00 -0.23 0.00 0.41 0.02 0.00 0.00 175.30 175.50 2qc3 n GLY 284 N 1.54 0.84 3.60 -3.53 0.00 -1.26 -5.03 105.19 101.35 2qc3 n GLY 284 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 2qc3 n GLY 284 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qc3 s VAL 285 N -2.86 5.27 0.40 1.61 1.01 -1.06 -5.07 120.40 119.71 2qc3 s VAL 285 Ca 0.00 0.31 -0.25 0.00 0.00 0.00 0.00 61.98 62.04 2qc3 s VAL 285 Cb 0.00 -3.59 -0.08 0.00 0.00 0.00 0.00 36.38 32.71 2qc3 s VAL 285 CO 0.00 0.23 1.20 -2.16 0.00 0.00 0.00 175.10 174.37 2qc3 s PRO 286 N 1.78 4.02 0.17 2.72 0.04 -1.26 -4.80 135.00 137.67 2qc3 s PRO 286 Ca 0.10 1.91 0.11 0.00 0.04 0.00 0.00 61.00 63.15 2qc3 s PRO 286 Cb -0.16 -2.68 -0.04 0.00 0.04 0.00 0.00 34.50 31.66 2qc3 s PRO 286 CO 0.10 -0.37 -0.24 0.00 0.04 0.00 0.00 177.00 176.53 2qc3 s ALA 287 N -1.38 2.39 -0.08 8.56 0.00 -1.26 -0.63 121.76 129.36 2qc3 s ALA 287 Ca 0.57 -1.56 -0.00 0.00 0.00 0.00 0.00 51.96 50.97 2qc3 s ALA 287 Cb -0.32 -0.32 0.02 0.00 0.00 0.00 0.00 23.12 22.51 2qc3 s ALA 287 CO 0.41 0.42 -0.04 1.03 0.00 0.00 0.00 175.76 177.58 2qc3 s ARG 288 N -2.51 1.03 -0.48 0.00 1.81 0.15 -4.93 118.95 114.03 2qc3 s ARG 288 Ca 0.18 -0.09 -0.18 0.00 -1.72 0.00 0.00 55.73 53.92 2qc3 s ARG 288 Cb -0.08 -1.17 0.06 0.00 -0.45 0.00 0.00 34.95 33.31 2qc3 s ARG 288 CO 0.08 -0.22 0.52 0.00 -0.68 0.00 0.00 175.30 175.00 2qc3 s ALA 289 N 1.55 3.45 -0.53 2.13 0.00 -1.26 -1.09 121.76 126.01 2qc3 s ALA 289 Ca -0.00 -1.84 -0.28 0.00 0.00 0.00 0.00 51.96 49.84 2qc3 s ALA 289 Cb -0.13 -3.21 0.03 0.00 0.00 0.00 0.00 23.12 19.81 2qc3 s ALA 289 CO -0.04 -1.85 1.12 0.08 0.00 0.00 0.00 175.76 175.06 2qc3 s VAL 290 N 2.21 4.17 0.00 0.00 1.01 -0.34 -4.76 120.40 122.69 2qc3 s VAL 290 Ca 0.11 0.90 0.00 0.00 0.00 0.00 0.00 61.98 62.99 2qc3 s VAL 290 Cb -0.21 -4.64 0.00 0.00 0.00 0.00 0.00 36.38 31.54 2qc3 s VAL 290 CO 0.10 -1.16 0.27 2.29 0.00 0.00 0.00 175.10 176.60 2qc3 n LYS 291 N 8.00 0.51 -3.63 2.72 -0.00 -1.26 -2.55 118.16 121.95 2qc3 n LYS 291 Ca 0.08 -0.27 -0.15 0.00 -0.00 0.00 0.00 58.31 57.97 2qc3 n LYS 291 Cb 0.49 -0.74 -0.07 0.00 -0.00 0.00 0.00 35.03 34.71 2qc3 n LYS 291 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2qc3 s SER 292 N -0.15 -0.53 0.60 -5.58 1.04 -1.26 -4.99 113.70 102.83 2qc3 s SER 292 Ca 0.00 0.72 0.29 0.00 0.48 0.00 0.00 55.95 57.44 2qc3 s SER 292 Cb 0.00 0.71 1.52 0.00 0.10 0.00 0.00 66.02 68.35 2qc3 s SER 292 CO 0.00 -0.43 1.92 -0.65 0.98 0.00 0.00 173.24 175.07 2qc3 h PRO 293 N 3.99 0.00 0.00 4.02 0.11 -1.98 0.13 132.00 138.28 2qc3 h PRO 293 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2qc3 h PRO 293 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2qc3 h PRO 293 CO 0.30 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.09 2qc3 n ALA 294 N -2.27 2.06 -0.01 -0.75 0.00 -1.26 -2.01 120.51 116.27 2qc3 n ALA 294 Ca 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 53.44 53.50 2qc3 n ALA 294 Cb 0.58 -1.02 -0.05 0.00 0.00 0.00 0.00 19.45 18.96 2qc3 n ALA 294 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2qc3 n ASP 295 N -0.53 3.45 0.00 0.00 10.43 0.45 -4.57 116.55 125.78 2qc3 n ASP 295 Ca 0.01 0.00 0.01 0.00 2.57 0.00 0.00 54.79 57.38 2qc3 n ASP 295 Cb 0.00 1.11 0.06 0.00 1.84 0.00 0.00 41.12 44.13 2qc3 n ASP 295 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2qc3 n LEU 296 N -1.89 0.00 -0.06 0.64 4.77 -0.85 -3.03 117.00 116.57 2qc3 n LEU 296 Ca -0.04 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.88 2qc3 n LEU 296 Cb 0.34 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.41 2qc3 n LEU 296 CO 0.14 0.00 -0.43 -0.90 -1.33 0.00 0.00 177.39 174.87 2qc3 n ASP 297 N -0.61 1.49 -0.41 -1.43 5.75 -1.26 -4.46 116.55 115.63 2qc3 n ASP 297 Ca 0.02 0.38 0.37 0.00 -0.01 0.00 0.00 54.79 55.55 2qc3 n ASP 297 Cb 0.01 -0.73 0.72 0.00 -1.03 0.00 0.00 41.12 40.09 2qc3 n ASP 297 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 2qc3 h GLU 298 N -0.79 0.06 -1.02 0.11 4.57 -1.85 -0.77 114.58 114.89 2qc3 h GLU 298 Ca 0.00 -0.00 0.29 0.00 -1.18 0.00 0.00 59.36 58.46 2qc3 h GLU 298 Cb 0.63 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.16 2qc3 h GLU 298 CO 0.00 0.04 0.72 -0.07 -1.18 0.00 0.00 179.01 178.52 2qc3 h LEU 299 N 0.06 0.11 0.48 1.64 3.38 -1.78 -1.55 115.31 117.65 2qc3 h LEU 299 Ca 0.66 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.63 2qc3 h LEU 299 Cb 2.48 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.23 2qc3 h LEU 299 CO -0.09 0.03 -0.23 0.00 0.09 0.00 0.00 178.44 178.24 2qc3 h ALA 300 N 1.52 -0.64 0.00 1.53 0.00 -1.37 -3.48 119.26 116.81 2qc3 h ALA 300 Ca 0.51 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2qc3 h ALA 300 Cb 1.82 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.86 2qc3 h ALA 300 CO -0.07 -0.71 0.00 0.09 0.00 0.00 0.00 179.25 178.56