#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qs7 s LYS 7 N 0.00 2.97 -0.00 1.64 1.02 -1.26 -4.83 119.74 119.27 2qs7 s LYS 7 Ca 0.00 2.21 0.01 0.00 0.02 0.00 0.00 55.97 58.21 2qs7 s LYS 7 Cb 0.00 -2.15 -0.00 0.00 -0.52 0.00 0.00 37.83 35.16 2qs7 s LYS 7 CO 0.00 -1.32 -0.02 0.21 -0.92 0.00 0.00 175.35 173.30 2qs7 s LYS 8 N -3.03 0.19 -0.08 1.68 2.20 -1.26 -0.80 119.74 118.64 2qs7 s LYS 8 Ca 0.75 -0.08 0.02 0.00 -0.36 0.00 0.00 55.97 56.30 2qs7 s LYS 8 Cb -0.40 -0.18 0.01 0.00 -1.51 0.00 0.00 37.83 35.75 2qs7 s LYS 8 CO 0.46 0.05 -0.14 -1.17 -0.36 0.00 0.00 175.35 174.19 2qs7 s LEU 9 N -0.04 1.68 -0.04 5.43 2.96 -0.06 -1.47 118.68 127.15 2qs7 s LEU 9 Ca 0.01 -0.34 0.05 0.00 -0.22 0.00 0.00 54.13 53.62 2qs7 s LEU 9 Cb -0.01 -0.92 -0.01 0.00 0.50 0.00 0.00 46.19 45.75 2qs7 s LEU 9 CO -0.00 0.04 -0.18 -0.44 -1.32 0.00 0.00 176.35 174.45 2qs7 s SER 10 N 0.72 2.25 -0.05 3.68 0.01 -0.08 -0.88 113.70 119.35 2qs7 s SER 10 Ca -0.13 -0.36 0.02 0.00 1.31 0.00 0.00 55.95 56.78 2qs7 s SER 10 Cb -0.16 -0.55 0.02 0.00 0.21 0.00 0.00 66.02 65.54 2qs7 s SER 10 CO 0.03 0.18 -0.08 -0.63 0.41 0.00 0.00 173.24 173.15 2qs7 s ILE 11 N -0.08 0.77 -0.43 1.44 1.01 -0.07 -1.25 121.20 122.59 2qs7 s ILE 11 Ca -0.01 -0.27 -0.21 0.00 0.00 0.00 0.00 60.65 60.16 2qs7 s ILE 11 Cb -0.11 -0.74 0.02 0.00 0.01 0.00 0.00 42.46 41.65 2qs7 s ILE 11 CO 0.02 0.27 0.63 -0.63 0.00 0.00 0.00 174.94 175.23 2qs7 s ILE 12 N 0.76 4.84 -0.92 2.92 1.01 0.03 -0.75 121.20 129.08 2qs7 s ILE 12 Ca -0.12 0.13 -0.17 0.00 0.00 0.00 0.00 60.65 60.49 2qs7 s ILE 12 Cb -0.15 -4.19 0.17 0.00 0.01 0.00 0.00 42.46 38.30 2qs7 s ILE 12 CO 0.02 -0.57 1.03 -0.69 0.00 0.00 0.00 174.94 174.73 2qs7 s VAL 13 N 2.78 5.07 -0.06 2.92 1.01 0.80 -1.13 120.40 131.79 2qs7 s VAL 13 Ca 0.22 -1.98 -0.10 0.00 0.00 0.00 0.00 61.98 60.11 2qs7 s VAL 13 Cb -0.14 -4.69 -0.30 0.00 0.00 0.00 0.00 36.38 31.25 2qs7 s VAL 13 CO 0.18 -1.35 0.61 0.15 0.00 0.00 0.00 175.10 174.69 2qs7 h PHE 14 N 8.33 0.68 -4.24 5.22 3.57 -0.56 -1.92 116.94 128.02 2qs7 h PHE 14 Ca 0.15 -0.50 -0.49 0.00 3.53 0.00 0.00 57.97 60.66 2qs7 h PHE 14 Cb 1.02 -0.03 0.06 0.00 2.79 0.00 0.00 35.95 39.79 2qs7 h PHE 14 CO 1.11 1.70 0.38 -1.12 -2.23 0.00 0.00 178.31 178.15 2qs7 s SER 15 N -7.26 5.93 0.00 0.41 0.01 -0.39 -1.38 113.70 111.02 2qs7 s SER 15 Ca -0.17 1.69 0.00 0.00 1.31 0.00 0.00 55.95 58.78 2qs7 s SER 15 Cb 0.06 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.77 2qs7 s SER 15 CO 0.84 -1.07 0.73 0.61 0.41 0.00 0.00 173.24 174.76 2qs7 n GLY 16 N -1.44 0.49 3.86 3.44 0.00 -1.26 -2.99 105.19 107.28 2qs7 n GLY 16 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 2qs7 n GLY 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qs7 s THR 17 N -0.52 4.73 0.33 2.61 -4.23 -1.26 -4.85 115.64 112.44 2qs7 s THR 17 Ca 0.00 0.77 0.02 0.00 -1.18 0.00 0.00 61.69 61.29 2qs7 s THR 17 Cb 0.00 -3.69 0.21 0.00 1.34 0.00 0.00 72.50 70.35 2qs7 s THR 17 CO 0.00 -0.43 1.92 -0.29 -0.54 0.00 0.00 174.62 175.29 2qs7 h ILE 18 N 1.36 1.19 0.00 2.99 6.09 -1.23 -1.25 117.51 126.66 2qs7 h ILE 18 Ca -0.47 -0.56 -0.00 0.00 -1.37 0.00 0.00 64.86 62.45 2qs7 h ILE 18 Cb 1.18 0.53 -0.00 0.00 0.47 0.00 0.00 36.82 39.00 2qs7 h ILE 18 CO 0.64 0.23 -0.02 -2.24 -3.07 0.00 0.00 178.15 173.69 2qs7 h ASP 19 N 0.76 0.00 0.22 2.19 2.03 -1.94 -2.70 116.42 116.98 2qs7 h ASP 19 Ca 0.18 0.00 -0.30 0.00 -0.73 0.00 0.00 57.03 56.18 2qs7 h ASP 19 Cb 0.12 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.56 2qs7 h ASP 19 CO -0.02 0.02 -2.06 0.29 -1.03 0.00 0.00 179.24 176.44 2qs7 n LYS 20 N -3.14 0.66 -0.21 4.15 5.02 -0.77 -4.27 118.16 119.60 2qs7 n LYS 20 Ca -0.00 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 2qs7 n LYS 20 Cb 0.26 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 2qs7 n LYS 20 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qs7 n LEU 21 N -2.83 2.68 0.00 -0.35 4.77 -0.54 -2.97 117.00 117.76 2qs7 n LEU 21 Ca -0.24 -1.23 0.00 0.00 -0.03 0.00 0.00 56.01 54.51 2qs7 n LEU 21 Cb 1.06 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2qs7 n LEU 21 CO 0.44 0.50 0.00 -2.65 -1.33 0.00 0.00 177.39 174.34 2qs7 n PRO 23 N 1.46 0.00 -0.10 3.23 -0.02 -1.26 -1.68 135.00 136.64 2qs7 n PRO 23 Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.41 2qs7 n PRO 23 Cb 0.28 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.77 2qs7 n PRO 23 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2qs7 h VAL 24 N 0.00 0.90 -0.63 -1.45 2.07 -1.90 0.26 116.25 115.49 2qs7 h VAL 24 Ca 0.00 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2qs7 h VAL 24 Cb 0.00 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2qs7 h VAL 24 CO 0.00 0.05 0.34 1.23 0.02 0.00 0.00 177.57 179.21 2qs7 h GLY 25 N 0.25 0.95 0.94 2.17 0.00 -1.55 -1.15 103.07 104.68 2qs7 h GLY 25 Ca 0.15 -0.43 -0.13 0.00 0.00 0.00 0.00 47.33 46.92 2qs7 h GLY 25 CO -0.16 0.42 -0.39 -2.22 0.00 0.00 0.00 176.54 174.19 2qs7 h ILE 26 N 0.87 1.33 -0.32 2.60 2.04 -1.77 -0.77 117.51 121.48 2qs7 h ILE 26 Ca 0.22 -1.61 -0.01 0.00 1.00 0.00 0.00 64.86 64.46 2qs7 h ILE 26 Cb 0.05 1.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 2qs7 h ILE 26 CO -0.04 0.50 0.18 -0.07 0.00 0.00 0.00 178.15 178.72 2qs7 h LEU 27 N 0.30 0.41 -0.33 1.44 3.38 -0.45 -0.75 115.31 119.30 2qs7 h LEU 27 Ca 0.01 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2qs7 h LEU 27 Cb 0.99 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 2qs7 h LEU 27 CO 0.09 0.38 0.19 0.74 0.09 0.00 0.00 178.44 179.93 2qs7 h THR 28 N 0.40 1.13 -0.18 0.22 2.02 -1.12 -0.14 112.91 115.24 2qs7 h THR 28 Ca 0.11 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 2qs7 h THR 28 Cb 0.06 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 2qs7 h THR 28 CO -0.02 0.13 0.04 -1.28 0.37 0.00 0.00 175.52 174.76 2qs7 h SER 29 N 0.42 0.28 -0.30 4.18 0.87 -1.06 -0.88 113.55 117.07 2qs7 h SER 29 Ca 0.12 -0.24 -0.05 0.00 -1.23 0.00 0.00 61.79 60.40 2qs7 h SER 29 Cb 0.04 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 2qs7 h SER 29 CO -0.02 0.44 0.00 1.23 -0.53 0.00 0.00 176.83 177.95 2qs7 h GLY 30 N 0.10 0.57 0.89 5.77 0.00 -1.08 -1.64 103.07 107.68 2qs7 h GLY 30 Ca 0.06 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 46.95 2qs7 h GLY 30 CO 0.00 0.38 0.07 0.00 0.00 0.00 0.00 176.54 177.00 2qs7 h ALA 31 N 0.84 0.37 -0.65 3.60 0.00 -0.99 -2.15 119.26 120.28 2qs7 h ALA 31 Ca 0.09 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2qs7 h ALA 31 Cb 0.43 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2qs7 h ALA 31 CO 0.01 0.02 0.43 0.00 0.00 0.00 0.00 179.25 179.71 2qs7 h ALA 32 N 0.90 0.83 0.00 0.00 0.00 -1.14 -0.66 119.26 119.19 2qs7 h ALA 32 Ca 0.09 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2qs7 h ALA 32 Cb 0.28 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2qs7 h ALA 32 CO 0.00 0.24 -0.16 0.00 0.00 0.00 0.00 179.25 179.32 2qs7 h ALA 33 N 1.25 1.39 -0.03 0.00 0.00 -1.14 -1.64 119.26 119.09 2qs7 h ALA 33 Ca 0.24 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2qs7 h ALA 33 Cb -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2qs7 h ALA 33 CO -0.06 0.20 0.00 0.45 0.00 0.00 0.00 179.25 179.84 2qs7 n SER 34 N -3.85 0.82 0.00 0.00 2.88 -0.65 -4.92 113.62 107.90 2qs7 n SER 34 Ca -0.02 -1.35 0.00 0.00 -1.33 0.00 0.00 58.87 56.17 2qs7 n SER 34 Cb 0.26 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 2qs7 n SER 34 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qs7 n GLY 35 N 1.06 0.80 3.81 0.46 0.00 -0.62 -5.06 105.19 105.64 2qs7 n GLY 35 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2qs7 n GLY 35 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qs7 s TYR 36 N -2.11 3.15 -0.04 1.61 1.51 -0.35 -4.55 117.35 116.57 2qs7 s TYR 36 Ca 0.00 1.57 -0.24 0.00 -1.01 0.00 0.00 57.07 57.40 2qs7 s TYR 36 Cb 0.00 -2.96 -0.04 0.00 -0.11 0.00 0.00 41.96 38.85 2qs7 s TYR 36 CO 0.00 -0.54 0.71 -2.00 -1.11 0.00 0.00 175.55 172.61 2qs7 s GLU 37 N -3.35 4.44 -0.08 -0.62 2.12 0.02 -4.34 118.70 116.89 2qs7 s GLU 37 Ca 0.64 0.91 0.04 0.00 0.36 0.00 0.00 54.97 56.92 2qs7 s GLU 37 Cb -0.13 -3.43 0.00 0.00 0.26 0.00 0.00 34.13 30.83 2qs7 s GLU 37 CO 0.20 0.12 -0.21 0.08 -0.54 0.00 0.00 175.26 174.90 2qs7 s VAL 38 N 0.60 1.81 -0.13 3.70 1.01 0.00 -0.88 120.40 126.52 2qs7 s VAL 38 Ca 0.38 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.49 2qs7 s VAL 38 Cb -0.18 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 34.63 2qs7 s VAL 38 CO 0.19 0.51 -0.22 0.20 0.00 0.00 0.00 175.10 175.78 2qs7 s ASN 39 N 0.28 3.16 -0.10 3.32 0.01 -0.06 -0.92 114.94 120.63 2qs7 s ASN 39 Ca -0.14 -0.58 0.02 0.00 -0.71 0.00 0.00 52.86 51.45 2qs7 s ASN 39 Cb -0.16 -1.45 -0.02 0.00 0.41 0.00 0.00 41.25 40.03 2qs7 s ASN 39 CO 0.06 0.10 -0.15 -0.76 -1.51 0.00 0.00 177.10 174.84 2qs7 s LEU 40 N 0.69 2.63 -0.29 0.60 1.43 0.41 -0.89 118.68 123.26 2qs7 s LEU 40 Ca -0.10 -0.32 0.03 0.00 -1.03 0.00 0.00 54.13 52.71 2qs7 s LEU 40 Cb -0.16 -1.56 0.08 0.00 0.03 0.00 0.00 46.19 44.57 2qs7 s LEU 40 CO 0.01 0.22 -0.05 -0.36 0.23 0.00 0.00 176.35 176.41 2qs7 s PHE 41 N 0.01 3.47 -0.20 0.29 0.08 0.07 -0.08 117.98 121.62 2qs7 s PHE 41 Ca -0.05 -2.59 -0.20 0.00 0.12 0.00 0.00 56.93 54.21 2qs7 s PHE 41 Cb -0.14 -2.33 -0.03 0.00 -0.57 0.00 0.00 43.02 39.95 2qs7 s PHE 41 CO 0.04 -0.91 0.60 -0.06 -0.10 0.00 0.00 175.22 174.80 2qs7 s PHE 42 N 1.02 3.37 0.06 0.36 0.40 0.08 -0.14 117.98 123.13 2qs7 s PHE 42 Ca -0.01 0.89 -0.00 0.00 -0.60 0.00 0.00 56.93 57.20 2qs7 s PHE 42 Cb -0.20 -2.77 -0.04 0.00 0.51 0.00 0.00 43.02 40.53 2qs7 s PHE 42 CO -0.06 -0.16 -0.04 -0.08 0.70 0.00 0.00 175.22 175.58 2qs7 s THR 43 N 1.84 0.31 0.00 0.64 -1.32 -0.72 -1.21 115.64 115.18 2qs7 s THR 43 Ca 0.27 -1.82 0.00 0.00 -1.21 0.00 0.00 61.69 58.94 2qs7 s THR 43 Cb -0.16 -1.53 0.00 0.00 -1.51 0.00 0.00 72.50 69.30 2qs7 s THR 43 CO 0.10 -0.97 0.00 0.49 -2.21 0.00 0.00 174.62 172.03 2qs7 n PHE 44 N 0.11 0.00 0.18 9.09 3.01 -1.26 -1.10 117.46 127.48 2qs7 n PHE 44 Ca -0.14 0.00 0.02 0.00 1.01 0.00 0.00 57.45 58.34 2qs7 n PHE 44 Cb 0.61 0.00 0.33 0.00 -0.01 0.00 0.00 39.48 40.41 2qs7 n PHE 44 CO 0.00 0.00 0.00 -1.49 1.01 0.00 0.00 176.76 176.28 2qs7 h TRP 45 N 0.00 0.00 -0.10 1.38 -0.00 -1.62 -2.01 115.95 113.61 2qs7 h TRP 45 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 58.89 58.78 2qs7 h TRP 45 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.15 2qs7 h TRP 45 CO 0.00 0.41 -0.44 0.78 -0.00 0.00 0.00 178.44 179.19 2qs7 h GLY 46 N 1.27 0.25 1.30 1.49 0.00 0.14 -2.34 103.07 105.18 2qs7 h GLY 46 Ca -0.00 -0.25 -0.15 0.00 0.00 0.00 0.00 47.33 46.93 2qs7 h GLY 46 CO 0.05 0.22 -0.40 -2.00 0.00 0.00 0.00 176.54 174.41 2qs7 h LEU 47 N 0.19 0.82 -0.87 3.11 5.85 -1.12 -2.68 115.31 120.60 2qs7 h LEU 47 Ca 0.01 -0.37 0.06 0.00 0.84 0.00 0.00 57.88 58.42 2qs7 h LEU 47 Cb 0.85 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 2qs7 h LEU 47 CO 0.07 1.12 0.54 -0.61 -0.34 0.00 0.00 178.44 179.22 2qs7 h GLN 48 N 0.63 0.95 0.00 1.25 5.75 -1.22 -2.13 115.11 120.35 2qs7 h GLN 48 Ca 0.05 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 2qs7 h GLN 48 Cb 0.96 -0.22 -0.00 0.00 1.07 0.00 0.00 27.48 29.29 2qs7 h GLN 48 CO 0.09 0.63 -0.03 0.00 -2.65 0.00 0.00 178.83 176.87 2qs7 h ALA 49 N 1.41 1.07 -0.53 3.38 0.00 -1.09 -2.48 119.26 121.03 2qs7 h ALA 49 Ca 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2qs7 h ALA 49 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2qs7 h ALA 49 CO -0.18 0.03 0.00 0.44 0.00 0.00 0.00 179.25 179.55 2qs7 n ILE 50 N -3.22 1.63 -2.74 0.00 -5.35 -0.81 -4.37 119.36 104.51 2qs7 n ILE 50 Ca -0.01 -1.24 -0.36 0.00 -0.27 0.00 0.00 62.75 60.87 2qs7 n ILE 50 Cb 0.19 0.19 -0.06 0.00 -1.74 0.00 0.00 39.64 38.22 2qs7 n ILE 50 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2qs7 s THR 51 N -1.71 4.14 0.28 7.28 -4.23 -0.93 -1.11 115.64 119.35 2qs7 s THR 51 Ca 0.43 1.64 0.01 0.00 -1.18 0.00 0.00 61.69 62.60 2qs7 s THR 51 Cb 0.28 -3.85 0.28 0.00 1.34 0.00 0.00 72.50 70.55 2qs7 s THR 51 CO 0.21 0.01 1.84 0.11 -0.54 0.00 0.00 174.62 176.25 2qs7 h LYS 52 N 2.75 0.97 -0.58 3.99 1.57 -1.11 -1.40 116.57 122.75 2qs7 h LYS 52 Ca -0.48 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.28 2qs7 h LYS 52 Cb 1.19 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 33.25 2qs7 h LYS 52 CO 0.63 0.64 0.35 0.00 -0.57 0.00 0.00 179.45 180.50 2qs7 h ARG 53 N 1.00 0.66 -0.31 3.15 3.08 -1.92 -1.09 114.38 118.94 2qs7 h ARG 53 Ca 0.50 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 60.40 2qs7 h ARG 53 Cb 0.49 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 2qs7 h ARG 53 CO -0.27 0.44 -0.23 1.03 -1.07 0.00 0.00 179.97 179.87 2qs7 h SER 54 N 0.68 0.74 -0.34 7.04 0.87 -1.60 -2.31 113.55 118.63 2qs7 h SER 54 Ca 0.24 -0.44 -0.05 0.00 -1.23 0.00 0.00 61.79 60.30 2qs7 h SER 54 Cb 0.04 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 2qs7 h SER 54 CO -0.11 1.02 0.04 -0.07 -0.53 0.00 0.00 176.83 177.19 2qs7 h LEU 55 N 0.45 0.63 -0.37 2.23 3.38 -1.08 -2.68 115.31 117.88 2qs7 h LEU 55 Ca 0.06 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2qs7 h LEU 55 Cb 0.79 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2qs7 h LEU 55 CO 0.06 0.68 -0.24 0.59 0.09 0.00 0.00 178.44 179.62 2qs7 n ASN 56 N -4.27 0.81 -4.76 -0.43 3.02 -0.43 -4.95 115.26 104.26 2qs7 n ASN 56 Ca 0.02 -0.71 -0.40 0.00 -0.03 0.00 0.00 54.58 53.46 2qs7 n ASN 56 Cb 0.25 0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.52 2qs7 n ASN 56 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2qs7 n SER 57 N -0.83 3.27 0.03 6.41 2.88 -0.87 -4.90 113.62 119.60 2qs7 n SER 57 Ca 0.12 1.12 0.12 0.00 -1.33 0.00 0.00 58.87 58.90 2qs7 n SER 57 Cb 0.33 -1.60 0.27 0.00 -0.75 0.00 0.00 64.21 62.46 2qs7 n SER 57 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qs7 n GLN 58 N -0.16 0.12 -2.10 -1.46 3.00 -1.26 -4.92 117.38 110.60 2qs7 n GLN 58 Ca 0.05 0.04 -0.41 0.00 -0.01 0.00 0.00 57.00 56.67 2qs7 n GLN 58 Cb 0.41 -1.58 -0.02 0.00 0.00 0.00 0.00 30.24 29.05 2qs7 n GLN 58 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2qs7 s GLN 59 N -3.07 4.33 0.27 -1.09 1.11 -1.26 -4.94 119.66 115.01 2qs7 s GLN 59 Ca 0.09 2.20 -0.31 0.00 0.01 0.00 0.00 55.36 57.36 2qs7 s GLN 59 Cb 0.16 -3.12 -0.12 0.00 -1.01 0.00 0.00 33.01 28.92 2qs7 s GLN 59 CO 0.69 -0.30 1.59 -0.35 0.01 0.00 0.00 175.29 176.92 2qs7 n PRO 60 N 2.00 2.61 -1.49 2.91 -0.04 -1.26 -4.91 135.00 134.82 2qs7 n PRO 60 Ca 0.05 0.93 -0.39 0.00 -0.04 0.00 0.00 63.50 64.05 2qs7 n PRO 60 Cb 0.41 -2.71 0.03 0.00 -0.04 0.00 0.00 33.50 31.20 2qs7 n PRO 60 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2qs7 n PRO 61 N 2.47 0.61 -3.49 0.54 -0.04 -1.26 -4.94 135.00 128.89 2qs7 n PRO 61 Ca 0.10 0.23 -0.38 0.00 -0.04 0.00 0.00 63.50 63.42 2qs7 n PRO 61 Cb 0.35 -1.75 -0.09 0.00 -0.04 0.00 0.00 33.50 31.97 2qs7 n PRO 61 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2qs7 s GLN 62 N -2.10 4.05 0.39 0.54 -2.07 -1.26 -4.93 119.66 114.28 2qs7 s GLN 62 Ca 0.69 -0.07 -0.12 0.00 -1.82 0.00 0.00 55.36 54.03 2qs7 s GLN 62 Cb -0.47 -3.60 -0.07 0.00 -1.09 0.00 0.00 33.01 27.78 2qs7 s GLN 62 CO 0.54 -0.13 0.77 0.42 -1.32 0.00 0.00 175.29 175.57 2qs7 s ILE 63 N 1.61 4.75 0.12 3.63 -1.09 -1.26 -0.63 121.20 128.32 2qs7 s ILE 63 Ca 0.12 0.73 -0.33 0.00 -2.23 0.00 0.00 60.65 58.95 2qs7 s ILE 63 Cb -0.15 -3.70 -0.12 0.00 -1.58 0.00 0.00 42.46 36.91 2qs7 s ILE 63 CO 0.08 -0.44 1.71 -0.67 -1.23 0.00 0.00 174.94 174.40 2qs7 n ASP 64 N -1.05 3.52 0.10 3.58 -0.08 -1.26 -4.84 116.55 116.52 2qs7 n ASP 64 Ca 0.03 1.04 0.20 0.00 -1.51 0.00 0.00 54.79 54.55 2qs7 n ASP 64 Cb 0.54 -1.47 0.76 0.00 2.34 0.00 0.00 41.12 43.28 2qs7 n ASP 64 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2qs7 h LYS 65 N 7.21 0.00 0.00 -0.67 1.57 -2.00 -0.37 116.57 122.31 2qs7 h LYS 65 Ca -0.46 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.31 2qs7 h LYS 65 Cb 1.24 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 2qs7 h LYS 65 CO 0.92 0.00 -0.06 -0.91 -0.57 0.00 0.00 179.45 178.84 2qs7 h ASN 66 N 0.00 0.00 -0.07 0.86 2.35 -2.05 -3.15 115.58 113.52 2qs7 h ASN 66 Ca 0.18 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.82 2qs7 h ASN 66 Cb 0.97 0.00 -0.18 0.00 0.05 0.00 0.00 38.32 39.17 2qs7 h ASN 66 CO -0.00 0.06 -0.73 -1.22 -1.65 0.00 0.00 177.43 173.89 2qs7 n TYR 67 N -3.34 0.25 -0.09 1.19 4.01 -0.16 -4.89 117.16 114.13 2qs7 n TYR 67 Ca -0.01 -1.25 -0.06 0.00 -0.16 0.00 0.00 57.90 56.41 2qs7 n TYR 67 Cb 0.21 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 39.02 2qs7 n TYR 67 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 2qs7 h GLU 68 N 1.15 -0.08 -1.09 -0.72 5.08 -1.48 -2.97 114.58 114.47 2qs7 h GLU 68 Ca -0.05 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2qs7 h GLU 68 Cb 1.34 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.61 2qs7 h GLU 68 CO 0.10 -0.05 0.00 1.04 -1.00 0.00 0.00 179.01 179.09 2qs7 n GLN 69 N -5.32 0.00 0.00 2.33 6.02 -1.26 -4.36 117.38 114.78 2qs7 n GLN 69 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 2qs7 n GLN 69 Cb 0.23 -0.99 0.00 0.00 1.02 0.00 0.00 30.24 30.50 2qs7 n GLN 69 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qs7 n GLY 71 N 0.64 1.29 0.26 1.08 0.00 -1.12 -4.77 105.19 102.56 2qs7 n GLY 71 Ca 0.00 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.02 2qs7 n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qs7 h PRO 72 N 0.00 0.41 -3.89 1.61 0.13 -1.93 -3.42 132.00 124.91 2qs7 h PRO 72 Ca 0.00 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2qs7 h PRO 72 Cb 0.00 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.04 2qs7 h PRO 72 CO 0.00 0.27 0.49 -0.89 -0.23 0.00 0.00 178.00 177.64 2qs7 n ILE 73 N -5.00 0.00 0.00 -3.56 5.41 -1.26 -4.41 119.36 110.54 2qs7 n ILE 73 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.86 2qs7 n ILE 73 Cb 0.34 -0.78 0.00 0.00 -0.71 0.00 0.00 39.64 38.49 2qs7 n ILE 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qs7 n GLN 76 N 3.63 0.00 0.00 0.38 -0.00 -1.26 -5.07 117.38 115.07 2qs7 n GLN 76 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 2qs7 n GLN 76 Cb 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 30.24 30.18 2qs7 n GLN 76 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2qs7 n LYS 77 N 0.00 0.47 0.00 2.61 5.02 -1.26 -1.34 118.16 123.66 2qs7 n LYS 77 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2qs7 n LYS 77 Cb 0.00 -1.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 2qs7 n LYS 77 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qs7 n GLN 79 N 0.66 0.00 0.00 1.97 -0.00 -1.26 -4.73 117.38 114.01 2qs7 n GLN 79 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 2qs7 n GLN 79 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.45 2qs7 n GLN 79 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 2qs7 n GLU 80 N 0.00 0.36 -2.38 2.61 2.13 -0.45 -4.63 120.64 118.28 2qs7 n GLU 80 Ca 0.00 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.80 2qs7 n GLU 80 Cb 0.00 -1.24 0.08 0.00 0.27 0.00 0.00 31.44 30.55 2qs7 n GLU 80 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2qs7 n LYS 82 N 0.54 0.91 -2.34 5.31 5.02 -1.26 -5.23 118.16 121.10 2qs7 n LYS 82 Ca 0.00 -0.95 -0.42 0.00 -2.02 0.00 0.00 58.31 54.92 2qs7 n LYS 82 Cb 0.13 0.22 -0.03 0.00 -0.02 0.00 0.00 35.03 35.33 2qs7 n LYS 82 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 2qs7 s TYR 83 N 0.10 3.38 0.00 2.13 5.04 -1.26 -5.25 117.35 121.49 2qs7 s TYR 83 Ca 0.08 1.23 0.00 0.00 -2.44 0.00 0.00 57.07 55.94 2qs7 s TYR 83 Cb 0.30 -3.49 0.00 0.00 0.35 0.00 0.00 41.96 39.11 2qs7 s TYR 83 CO -0.08 -1.56 0.00 -2.30 -1.34 0.00 0.00 175.55 170.26 2qs7 n PRO 84 N 3.64 1.01 -0.01 4.97 -0.02 -1.26 -4.80 135.00 138.52 2qs7 n PRO 84 Ca 0.09 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.35 2qs7 n PRO 84 Cb 0.45 0.00 -0.13 0.00 -0.02 0.00 0.00 33.50 33.79 2qs7 n PRO 84 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 2qs7 h TRP 86 N 0.00 0.38 0.00 6.00 5.08 -1.97 -3.46 115.95 121.98 2qs7 h TRP 86 Ca 0.00 -0.28 -0.10 0.00 1.08 0.00 0.00 58.89 59.59 2qs7 h TRP 86 Cb 0.00 -0.02 -0.01 0.00 -3.00 0.00 0.00 29.16 26.13 2qs7 h TRP 86 CO 0.00 1.67 -0.48 1.12 -1.28 0.00 0.00 178.44 179.47 2qs7 h HIS 87 N -0.24 0.00 -0.41 0.12 2.07 -1.98 -2.08 115.15 112.62 2qs7 h HIS 87 Ca -0.38 0.00 -0.13 0.00 -2.85 0.00 0.00 60.37 57.01 2qs7 h HIS 87 Cb 1.82 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.79 2qs7 h HIS 87 CO 0.09 0.48 -0.26 1.96 -3.07 0.00 0.00 177.93 177.13 2qs7 h GLN 88 N 0.00 0.86 -0.79 5.12 4.20 -1.99 -1.20 115.11 121.32 2qs7 h GLN 88 Ca -0.00 -0.38 -0.03 0.00 0.06 0.00 0.00 58.65 58.29 2qs7 h GLN 88 Cb 0.92 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.64 2qs7 h GLN 88 CO 0.06 1.02 0.37 -0.07 -0.67 0.00 0.00 178.83 179.55 2qs7 h LEU 89 N 0.74 1.03 -0.15 1.46 3.38 -1.81 -0.01 115.31 119.96 2qs7 h LEU 89 Ca 0.09 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2qs7 h LEU 89 Cb 0.81 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 2qs7 h LEU 89 CO 0.07 0.88 -0.05 0.58 0.09 0.00 0.00 178.44 180.01 2qs7 h VAL 90 N 1.13 1.30 -0.73 1.22 2.07 -1.13 -1.24 116.25 118.86 2qs7 h VAL 90 Ca 0.27 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 2qs7 h VAL 90 Cb 0.12 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 2qs7 h VAL 90 CO -0.03 0.30 0.30 -0.61 0.02 0.00 0.00 177.57 177.55 2qs7 h GLN 91 N -0.00 1.08 -0.55 1.57 5.75 -1.04 -0.50 115.11 121.42 2qs7 h GLN 91 Ca 0.04 -0.19 -0.07 0.00 -0.15 0.00 0.00 58.65 58.28 2qs7 h GLN 91 Cb 0.49 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.84 2qs7 h GLN 91 CO 0.02 0.88 0.07 1.96 -2.65 0.00 0.00 178.83 179.11 2qs7 h GLN 92 N 1.04 0.88 -0.85 1.69 1.08 -0.98 -2.43 115.11 115.53 2qs7 h GLN 92 Ca 0.24 -0.21 -0.03 0.00 -1.45 0.00 0.00 58.65 57.20 2qs7 h GLN 92 Cb 0.20 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.47 2qs7 h GLN 92 CO -0.02 0.83 0.41 0.00 -0.95 0.00 0.00 178.83 179.10 2qs7 h ALA 93 N 1.25 1.10 -0.68 3.87 0.00 -0.26 -1.36 119.26 123.18 2qs7 h ALA 93 Ca 0.17 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qs7 h ALA 93 Cb 0.39 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2qs7 h ALA 93 CO 0.01 0.67 0.40 0.87 0.00 0.00 0.00 179.25 181.20 2qs7 h LYS 94 N 1.22 0.91 -0.19 0.00 1.57 -0.66 0.29 116.57 119.71 2qs7 h LYS 94 Ca 0.29 -0.08 -0.17 0.00 -1.87 0.00 0.00 60.65 58.82 2qs7 h LYS 94 Cb 0.12 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 2qs7 h LYS 94 CO -0.04 0.65 -0.58 0.93 -0.57 0.00 0.00 179.45 179.84 2qs7 h GLU 95 N 0.93 0.60 0.19 3.15 5.08 -1.03 -3.34 114.58 120.16 2qs7 h GLU 95 Ca 0.24 -0.40 -0.25 0.00 -1.00 0.00 0.00 59.36 57.96 2qs7 h GLU 95 Cb -0.03 0.05 0.03 0.00 0.50 0.00 0.00 28.75 29.30 2qs7 h GLU 95 CO -0.05 1.01 -1.12 0.82 -1.00 0.00 0.00 179.01 178.68 2qs7 h ILE 96 N 0.45 1.40 -0.83 3.13 5.03 -0.72 -3.49 117.51 122.47 2qs7 h ILE 96 Ca 0.00 -2.60 0.00 0.00 -0.12 0.00 0.00 64.86 62.14 2qs7 h ILE 96 Cb 1.14 3.12 0.00 0.00 -3.03 0.00 0.00 36.82 38.06 2qs7 h ILE 96 CO 0.11 0.76 0.00 0.61 -0.68 0.00 0.00 178.15 178.95 2qs7 n GLY 97 N 1.70 5.58 3.22 5.37 0.00 0.97 -5.00 105.19 117.03 2qs7 n GLY 97 Ca -0.16 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 2qs7 n GLY 97 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qs7 s GLU 98 N 1.70 2.87 -0.08 1.61 2.56 -1.26 -4.63 118.70 121.48 2qs7 s GLU 98 Ca 0.00 -2.21 0.03 0.00 0.00 0.00 0.00 54.97 52.78 2qs7 s GLU 98 Cb 0.00 -4.04 0.01 0.00 2.00 0.00 0.00 34.13 32.10 2qs7 s GLU 98 CO 0.00 -1.22 -0.16 0.08 -0.56 0.00 0.00 175.26 173.40 2qs7 s VAL 99 N 0.56 1.40 -0.06 3.70 1.01 -1.26 -0.82 120.40 124.94 2qs7 s VAL 99 Ca 0.13 -0.64 0.05 0.00 0.00 0.00 0.00 61.98 61.53 2qs7 s VAL 99 Cb -0.20 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.92 2qs7 s VAL 99 CO -0.04 0.41 -0.23 -0.54 0.00 0.00 0.00 175.10 174.71 2qs7 s LYS 100 N 0.57 2.42 -0.20 2.72 -0.14 -0.10 -4.83 119.74 120.17 2qs7 s LYS 100 Ca -0.16 -0.83 -0.02 0.00 -1.36 0.00 0.00 55.97 53.60 2qs7 s LYS 100 Cb -0.16 -2.03 -0.00 0.00 -1.68 0.00 0.00 37.83 33.96 2qs7 s LYS 100 CO 0.05 0.32 -0.09 0.08 -0.76 0.00 0.00 175.35 174.95 2qs7 s VAL 101 N -0.05 2.97 0.07 3.17 1.01 -1.26 -0.44 120.40 125.87 2qs7 s VAL 101 Ca -0.05 -0.63 0.08 0.00 0.00 0.00 0.00 61.98 61.38 2qs7 s VAL 101 Cb -0.14 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 2qs7 s VAL 101 CO 0.04 0.46 -0.20 -0.36 0.00 0.00 0.00 175.10 175.04 2qs7 s PHE 102 N 1.37 2.50 -0.09 5.22 0.08 0.89 -0.04 117.98 127.91 2qs7 s PHE 102 Ca 0.05 -0.29 0.01 0.00 0.12 0.00 0.00 56.93 56.82 2qs7 s PHE 102 Cb -0.14 -1.40 -0.03 0.00 -0.57 0.00 0.00 43.02 40.89 2qs7 s PHE 102 CO -0.06 0.29 -0.10 0.00 -0.10 0.00 0.00 175.22 175.26 2qs7 s ALA 103 N -0.99 2.83 -0.18 5.36 0.00 -0.31 -0.74 121.76 127.72 2qs7 s ALA 103 Ca 0.15 -0.90 -0.29 0.00 0.00 0.00 0.00 51.96 50.92 2qs7 s ALA 103 Cb -0.10 -1.21 -0.02 0.00 0.00 0.00 0.00 23.12 21.79 2qs7 s ALA 103 CO 0.07 0.45 1.33 0.00 0.00 0.00 0.00 175.76 177.61 2qs7 h SER 105 N 8.67 0.18 -0.08 0.00 4.64 -1.45 -3.23 113.55 122.28 2qs7 h SER 105 Ca -0.28 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 60.95 2qs7 h SER 105 Cb 1.11 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2qs7 h SER 105 CO 0.98 0.53 -0.03 0.74 -0.87 0.00 0.00 176.83 178.18 2qs7 h THR 106 N 0.16 1.31 0.00 2.95 2.02 -1.92 -2.94 112.91 114.48 2qs7 h THR 106 Ca 0.02 -0.99 0.00 0.00 0.77 0.00 0.00 66.41 66.21 2qs7 h THR 106 Cb 0.69 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.91 2qs7 h THR 106 CO 0.05 0.28 0.00 0.41 0.37 0.00 0.00 175.52 176.63 2qs7 n THR 107 N -4.78 0.00 0.00 3.16 -1.04 -1.22 -1.96 114.28 108.44 2qs7 n THR 107 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 2qs7 n THR 107 Cb 0.24 -0.65 0.00 0.00 -1.82 0.00 0.00 70.33 68.11 2qs7 n THR 107 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2qs7 n GLU 109 N 1.37 0.00 -0.10 -2.82 1.02 -1.11 -1.07 120.64 117.93 2qs7 n GLU 109 Ca 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.16 2qs7 n GLU 109 Cb 0.00 0.00 0.34 0.00 -0.02 0.00 0.00 31.44 31.76 2qs7 n GLU 109 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2qs7 h PHE 110 N 0.00 0.71 -0.48 -0.32 0.04 -1.70 -2.97 116.94 112.21 2qs7 h PHE 110 Ca 0.00 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.78 2qs7 h PHE 110 Cb 0.00 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 37.91 2qs7 h PHE 110 CO 0.00 0.45 0.00 1.19 -0.60 0.00 0.00 178.31 179.35 2qs7 n PHE 111 N -4.44 0.64 -3.29 -0.55 3.72 -0.23 -4.99 117.46 108.32 2qs7 n PHE 111 Ca 0.05 -0.47 -0.24 0.00 -0.05 0.00 0.00 57.45 56.75 2qs7 n PHE 111 Cb 0.05 -0.01 0.05 0.00 -0.94 0.00 0.00 39.48 38.63 2qs7 n PHE 111 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qs7 n GLY 112 N 0.99 -0.53 3.80 1.37 0.00 -1.13 -4.99 105.19 104.70 2qs7 n GLY 112 Ca 0.17 0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.99 2qs7 n GLY 112 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qs7 s ILE 113 N -3.22 5.19 0.31 -0.61 1.01 -1.26 -5.03 121.20 117.59 2qs7 s ILE 113 Ca 0.43 0.69 0.08 0.00 0.00 0.00 0.00 60.65 61.84 2qs7 s ILE 113 Cb -0.19 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 2qs7 s ILE 113 CO 0.53 0.51 0.17 -0.54 0.00 0.00 0.00 174.94 175.61 2qs7 s LYS 114 N -0.46 2.57 0.42 2.79 1.02 -1.26 -4.59 119.74 120.22 2qs7 s LYS 114 Ca 0.21 -1.36 0.08 0.00 0.02 0.00 0.00 55.97 54.92 2qs7 s LYS 114 Cb -0.15 -2.33 0.91 0.00 -0.52 0.00 0.00 37.83 35.74 2qs7 s LYS 114 CO 0.09 0.20 2.07 -0.09 -0.92 0.00 0.00 175.35 176.70 2qs7 h ARG 115 N 1.50 0.47 0.00 1.68 9.65 -1.98 -1.01 114.38 124.69 2qs7 h ARG 115 Ca -0.45 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.39 2qs7 h ARG 115 Cb 1.25 -0.11 -0.00 0.00 -1.39 0.00 0.00 29.97 29.72 2qs7 h ARG 115 CO 0.61 0.31 -0.07 0.93 2.80 0.00 0.00 179.97 184.56 2qs7 h GLU 116 N 0.49 0.00 0.00 0.20 3.07 -2.00 -1.61 114.58 114.73 2qs7 h GLU 116 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 2qs7 h GLU 116 Cb -0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 2qs7 h GLU 116 CO -0.03 0.07 0.00 -0.25 -1.40 0.00 0.00 179.01 177.40 2qs7 n ASP 117 N -3.80 0.66 -4.86 1.42 8.00 -0.38 -4.88 116.55 112.71 2qs7 n ASP 117 Ca -0.02 0.58 -0.32 0.00 0.71 0.00 0.00 54.79 55.74 2qs7 n ASP 117 Cb 0.16 -0.75 -0.05 0.00 -0.02 0.00 0.00 41.12 40.46 2qs7 n ASP 117 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2qs7 s LEU 118 N -4.28 4.05 0.67 0.64 1.43 -0.61 -0.59 118.68 119.99 2qs7 s LEU 118 Ca 0.10 1.16 -0.17 0.00 -1.03 0.00 0.00 54.13 54.19 2qs7 s LEU 118 Cb 0.12 -3.97 -0.01 0.00 0.03 0.00 0.00 46.19 42.36 2qs7 s LEU 118 CO 0.54 -0.20 1.04 0.00 0.23 0.00 0.00 176.35 177.95 2qs7 n ALA 119 N -0.47 0.23 0.26 4.21 0.00 -0.27 -4.65 120.51 119.82 2qs7 n ALA 119 Ca 0.03 -0.08 0.09 0.00 0.00 0.00 0.00 53.44 53.48 2qs7 n ALA 119 Cb 0.53 -2.16 0.67 0.00 0.00 0.00 0.00 19.45 18.48 2qs7 n ALA 119 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qs7 h GLU 120 N 0.16 0.00 0.00 0.00 4.39 -1.96 -2.44 114.58 114.73 2qs7 h GLU 120 Ca -0.49 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.21 2qs7 h GLU 120 Cb 1.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.00 2qs7 h GLU 120 CO 0.50 0.06 0.00 1.97 -1.16 0.00 0.00 179.01 180.38 2qs7 n PHE 121 N -4.26 0.00 -2.53 4.33 -1.74 -1.26 -4.71 117.46 107.29 2qs7 n PHE 121 Ca -0.03 0.00 -0.42 0.00 -0.56 0.00 0.00 57.45 56.44 2qs7 n PHE 121 Cb 0.14 -0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.11 2qs7 n PHE 121 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 2qs7 s VAL 122 N -2.01 4.40 -0.01 1.97 1.01 -0.92 -4.56 120.40 120.29 2qs7 s VAL 122 Ca 0.38 1.71 -0.07 0.00 0.00 0.00 0.00 61.98 64.00 2qs7 s VAL 122 Cb 0.17 -4.10 -0.30 0.00 0.00 0.00 0.00 36.38 32.16 2qs7 s VAL 122 CO 0.29 0.04 0.82 0.44 0.00 0.00 0.00 175.10 176.69 2qs7 h ASP 123 N 7.20 0.51 -4.92 3.32 3.32 -0.74 -3.49 116.42 121.61 2qs7 h ASP 123 Ca -0.36 -0.70 0.06 0.00 0.02 0.00 0.00 57.03 56.05 2qs7 h ASP 123 Cb 1.17 -0.17 -0.12 0.00 0.22 0.00 0.00 39.33 40.44 2qs7 h ASP 123 CO 0.85 1.58 0.34 -0.62 -1.72 0.00 0.00 179.24 179.67 2qs7 s ASP 124 N -7.15 -0.41 -0.20 6.45 -1.08 -1.16 -5.04 116.67 108.07 2qs7 s ASP 124 Ca -0.11 -0.13 -0.04 0.00 -0.52 0.00 0.00 52.55 51.75 2qs7 s ASP 124 Cb 0.06 0.53 -0.02 0.00 -1.46 0.00 0.00 42.92 42.03 2qs7 s ASP 124 CO 0.86 -0.89 -0.03 -0.69 0.52 0.00 0.00 175.17 174.94 2qs7 s VAL 125 N -3.50 3.67 0.19 1.11 1.01 -1.26 -1.16 120.40 120.45 2qs7 s VAL 125 Ca 0.05 -0.41 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 2qs7 s VAL 125 Cb -0.02 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 2qs7 s VAL 125 CO -0.07 0.43 0.21 0.68 0.00 0.00 0.00 175.10 176.35 2qs7 s VAL 126 N 1.12 0.03 0.58 2.92 -7.23 -0.18 -4.89 120.40 112.75 2qs7 s VAL 126 Ca 0.02 -1.78 0.10 0.00 -1.81 0.00 0.00 61.98 58.51 2qs7 s VAL 126 Cb -0.15 -2.27 0.09 0.00 0.56 0.00 0.00 36.38 34.62 2qs7 s VAL 126 CO 0.00 -0.13 0.80 -0.83 -0.31 0.00 0.00 175.10 174.64 2qs7 s GLY 127 N -3.08 1.72 0.13 2.32 0.00 -1.26 -1.09 107.32 106.06 2qs7 s GLY 127 Ca 0.30 -2.16 -0.20 0.00 0.00 0.00 0.00 44.72 42.66 2qs7 s GLY 127 CO 0.08 -1.68 1.69 -2.08 0.00 0.00 0.00 173.10 171.10 2qs7 h VAL 128 N 0.15 0.71 -0.55 1.40 2.07 -1.99 -2.23 116.25 115.81 2qs7 h VAL 128 Ca -0.30 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.26 2qs7 h VAL 128 Cb 1.29 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 2qs7 h VAL 128 CO 0.41 0.00 0.36 0.00 0.02 0.00 0.00 177.57 178.36 2qs7 h ALA 129 N 1.10 1.73 -0.54 1.67 0.00 -1.99 -0.82 119.26 120.41 2qs7 h ALA 129 Ca 0.10 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2qs7 h ALA 129 Cb 0.22 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2qs7 h ALA 129 CO -0.24 0.21 0.29 1.15 0.00 0.00 0.00 179.25 180.66 2qs7 h THR 130 N 0.63 1.18 -0.11 0.00 2.02 -1.81 -0.79 112.91 114.03 2qs7 h THR 130 Ca 0.22 -0.47 0.04 0.00 0.77 0.00 0.00 66.41 66.96 2qs7 h THR 130 Cb 0.10 0.51 -0.06 0.00 -1.74 0.00 0.00 68.15 66.96 2qs7 h THR 130 CO -0.06 0.20 -0.47 0.15 0.37 0.00 0.00 175.52 175.71 2qs7 h PHE 131 N 0.73 -1.35 -0.81 3.16 3.57 -1.00 -1.12 116.94 120.12 2qs7 h PHE 131 Ca 0.19 0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.79 2qs7 h PHE 131 Cb 0.06 0.61 -0.05 0.00 2.79 0.00 0.00 35.95 39.35 2qs7 h PHE 131 CO -0.01 -0.51 0.50 -0.07 -2.23 0.00 0.00 178.31 175.99 2qs7 h LEU 132 N -0.54 0.80 -0.17 0.59 4.07 -1.02 -0.02 115.31 119.01 2qs7 h LEU 132 Ca 0.06 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.02 2qs7 h LEU 132 Cb 0.66 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 2qs7 h LEU 132 CO -0.40 0.53 0.08 0.44 -1.08 0.00 0.00 178.44 178.01 2qs7 h ASP 133 N 0.94 0.22 -0.47 -0.43 3.32 -0.74 -2.01 116.42 117.25 2qs7 h ASP 133 Ca 0.34 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 2qs7 h ASP 133 Cb 0.10 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 2qs7 h ASP 133 CO -0.15 0.29 0.18 0.03 -1.72 0.00 0.00 179.24 177.88 2qs7 h ARG 134 N 0.14 0.77 0.00 3.56 3.08 -0.82 -3.04 114.38 118.07 2qs7 h ARG 134 Ca 0.06 -0.12 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 2qs7 h ARG 134 Cb 0.13 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2qs7 h ARG 134 CO -0.01 0.65 -0.24 0.00 -1.07 0.00 0.00 179.97 179.31 2qs7 h ALA 135 N 1.45 0.92 -2.00 0.04 0.00 -0.89 -3.47 119.26 115.31 2qs7 h ALA 135 Ca 0.18 -0.22 -0.63 0.00 0.00 0.00 0.00 54.91 54.24 2qs7 h ALA 135 Cb 0.19 -0.04 0.05 0.00 0.00 0.00 0.00 17.79 18.00 2qs7 h ALA 135 CO -0.01 0.30 0.66 -1.91 0.00 0.00 0.00 179.25 178.29 2qs7 n GLU 136 N -3.27 1.71 -0.07 0.00 2.13 -0.77 -1.74 120.64 118.63 2qs7 n GLU 136 Ca 0.01 0.62 0.00 0.00 0.66 0.00 0.00 57.16 58.45 2qs7 n GLU 136 Cb 0.52 -2.33 0.00 0.00 0.27 0.00 0.00 31.44 29.89 2qs7 n GLU 136 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qs7 n GLY 137 N 3.08 1.36 0.53 8.31 0.00 -1.26 -5.04 105.19 112.16 2qs7 n GLY 137 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 2qs7 n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qs7 n GLY 138 N -2.00 3.64 3.73 -0.02 0.00 -0.71 -4.91 105.19 104.92 2qs7 n GLY 138 Ca 0.00 -2.21 -0.41 0.00 0.00 0.00 0.00 46.02 43.40 2qs7 n GLY 138 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qs7 s THR 139 N -0.88 4.47 -0.04 2.61 2.01 -0.54 -4.95 115.64 118.32 2qs7 s THR 139 Ca 0.02 2.01 0.02 0.00 0.31 0.00 0.00 61.69 64.04 2qs7 s THR 139 Cb -0.00 -4.29 0.01 0.00 0.01 0.00 0.00 72.50 68.23 2qs7 s THR 139 CO 0.01 0.35 -0.07 -0.89 -0.69 0.00 0.00 174.62 173.34 2qs7 s THR 140 N -0.20 0.66 0.07 -0.82 2.01 -1.26 -0.90 115.64 115.20 2qs7 s THR 140 Ca 0.45 -0.25 0.06 0.00 0.31 0.00 0.00 61.69 62.26 2qs7 s THR 140 Cb -0.23 -0.63 -0.03 0.00 0.01 0.00 0.00 72.50 71.62 2qs7 s THR 140 CO 0.29 0.23 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.53 2qs7 s LEU 141 N 0.53 2.24 -0.23 4.42 1.43 -0.38 -4.99 118.68 121.71 2qs7 s LEU 141 Ca -0.08 -0.58 -0.01 0.00 -1.03 0.00 0.00 54.13 52.43 2qs7 s LEU 141 Cb -0.11 -0.70 0.02 0.00 0.03 0.00 0.00 46.19 45.43 2qs7 s LEU 141 CO 0.01 0.02 -0.10 0.12 0.23 0.00 0.00 176.35 176.63 2qs7 s PHE 142 N -1.06 2.99 -0.19 0.29 2.19 -1.26 -0.79 117.98 120.14 2qs7 s PHE 142 Ca 0.03 -1.55 0.02 0.00 0.33 0.00 0.00 56.93 55.75 2qs7 s PHE 142 Cb -0.09 -2.02 0.01 0.00 -1.31 0.00 0.00 43.02 39.61 2qs7 s PHE 142 CO 0.02 -0.74 0.55 -0.89 1.83 0.00 0.00 175.22 176.00