#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qa4 n PRO 2 N 0.00 0.71 0.26 1.97 -0.02 -1.26 -4.90 135.00 131.76 2qa4 n PRO 2 Ca 0.00 0.29 0.16 0.00 -2.02 0.00 0.00 63.50 61.93 2qa4 n PRO 2 Cb 0.00 -2.16 0.59 0.00 -0.02 0.00 0.00 33.50 31.91 2qa4 n PRO 2 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qa4 h ALA 3 N 0.16 1.00 -0.24 3.55 0.00 -2.02 -3.06 119.26 118.64 2qa4 h ALA 3 Ca -0.48 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.50 2qa4 h ALA 3 Cb 1.36 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2qa4 h ALA 3 CO 0.49 0.00 0.18 0.66 0.00 0.00 0.00 179.25 180.58 2qa4 h SER 4 N 0.00 0.00 1.08 0.00 4.64 -1.99 -0.69 113.55 116.58 2qa4 h SER 4 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qa4 h SER 4 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2qa4 h SER 4 CO 0.00 0.00 0.00 0.24 -0.87 0.00 0.00 176.83 176.20 2qa4 h MET 5 N 0.00 0.00 0.00 4.77 2.86 -1.91 -3.37 114.93 117.28 2qa4 h MET 5 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2qa4 h MET 5 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 2qa4 h MET 5 CO -0.00 0.00 0.00 0.66 1.06 0.00 0.00 176.91 178.63 2qa4 n TYR 6 N -2.98 0.00 1.00 -0.22 4.02 -0.68 -4.93 117.16 113.37 2qa4 n TYR 6 Ca 0.01 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 58.00 2qa4 n TYR 6 Cb 0.32 0.00 0.53 0.00 -0.02 0.00 0.00 39.34 40.16 2qa4 n TYR 6 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 2qa4 n ARG 7 N 0.00 0.33 -4.24 -0.72 1.85 -0.35 -4.65 116.66 108.88 2qa4 n ARG 7 Ca 0.00 0.08 -0.30 0.00 -1.00 0.00 0.00 57.85 56.63 2qa4 n ARG 7 Cb 0.49 -1.50 -0.09 0.00 -1.05 0.00 0.00 32.46 30.30 2qa4 n ARG 7 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2qa4 s ASP 8 N -2.51 4.67 -1.02 2.89 1.01 -1.26 -2.25 116.67 118.19 2qa4 s ASP 8 Ca 0.21 -0.26 -0.05 0.00 0.71 0.00 0.00 52.55 53.15 2qa4 s ASP 8 Cb 0.14 -1.02 0.07 0.00 1.01 0.00 0.00 42.92 43.12 2qa4 s ASP 8 CO 0.30 0.20 2.61 -0.38 0.21 0.00 0.00 175.17 178.11 2qa4 n ILE 9 N 0.83 4.50 -0.01 0.77 5.41 -1.26 -4.55 119.36 125.04 2qa4 n ILE 9 Ca -0.13 -3.66 0.03 0.00 1.00 0.00 0.00 62.75 59.99 2qa4 n ILE 9 Cb 0.52 -1.97 -0.13 0.00 -0.71 0.00 0.00 39.64 37.35 2qa4 n ILE 9 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2qa4 n ASP 10 N 1.65 0.31 -4.61 4.38 5.75 -1.26 -4.99 116.55 117.78 2qa4 n ASP 10 Ca 0.59 0.13 -0.28 0.00 -0.01 0.00 0.00 54.79 55.22 2qa4 n ASP 10 Cb 0.37 1.10 0.12 0.00 -1.03 0.00 0.00 41.12 41.68 2qa4 n ASP 10 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2qa4 s LYS 11 N -3.07 1.53 0.50 0.11 1.02 -1.26 -5.08 119.74 113.49 2qa4 s LYS 11 Ca -0.06 -0.32 -0.08 0.00 0.02 0.00 0.00 55.97 55.53 2qa4 s LYS 11 Cb 0.10 -2.02 0.13 0.00 -0.52 0.00 0.00 37.83 35.52 2qa4 s LYS 11 CO 0.85 -1.77 0.42 -2.30 -0.92 0.00 0.00 175.35 171.64 2qa4 n PRO 12 N -3.31 -2.03 -3.11 -1.68 -0.02 -1.26 -4.92 135.00 118.67 2qa4 n PRO 12 Ca 0.11 -0.68 -0.45 0.00 -2.02 0.00 0.00 63.50 60.46 2qa4 n PRO 12 Cb 0.60 -0.67 -0.01 0.00 -0.02 0.00 0.00 33.50 33.40 2qa4 n PRO 12 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qa4 s ALA 13 N -2.88 3.91 -1.29 3.55 0.00 -1.26 -4.95 121.76 118.85 2qa4 s ALA 13 Ca 0.28 -3.21 -0.17 0.00 0.00 0.00 0.00 51.96 48.86 2qa4 s ALA 13 Cb -0.03 -3.84 0.09 0.00 0.00 0.00 0.00 23.12 19.33 2qa4 s ALA 13 CO 0.22 -2.62 1.69 -0.47 0.00 0.00 0.00 175.76 174.58 2qa4 s TYR 14 N 1.15 2.89 0.00 0.00 5.04 -1.26 -4.55 117.35 120.62 2qa4 s TYR 14 Ca 0.30 -1.71 0.00 0.00 -2.44 0.00 0.00 57.07 53.22 2qa4 s TYR 14 Cb -0.07 -4.69 0.00 0.00 0.35 0.00 0.00 41.96 37.55 2qa4 s TYR 14 CO -0.07 -1.75 0.12 0.25 -1.34 0.00 0.00 175.55 172.76 2qa4 n THR 15 N 6.12 0.00 -2.11 4.34 -2.24 -1.26 -1.31 114.28 117.82 2qa4 n THR 15 Ca 0.47 -0.24 -0.41 0.00 -2.27 0.00 0.00 64.05 61.60 2qa4 n THR 15 Cb 0.45 1.26 -0.03 0.00 -2.10 0.00 0.00 70.33 69.92 2qa4 n THR 15 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2qa4 s ARG 16 N -0.24 3.16 0.52 -0.78 1.81 -1.26 -4.88 118.95 117.28 2qa4 s ARG 16 Ca 0.00 1.01 0.28 0.00 -1.72 0.00 0.00 55.73 55.30 2qa4 s ARG 16 Cb 0.00 -4.22 1.45 0.00 -0.45 0.00 0.00 34.95 31.73 2qa4 s ARG 16 CO 0.00 -2.08 2.07 0.00 -0.68 0.00 0.00 175.30 174.61 2qa4 h ARG 17 N 12.98 0.00 0.00 3.54 2.47 -1.96 -2.85 114.38 128.56 2qa4 h ARG 17 Ca -0.30 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.42 2qa4 h ARG 17 Cb 1.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.47 2qa4 h ARG 17 CO 1.11 0.12 0.00 -0.85 0.56 0.00 0.00 179.97 180.91 2qa4 n GLU 18 N -3.62 0.38 0.00 0.04 0.00 -1.26 -3.22 120.64 112.97 2qa4 n GLU 18 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.19 2qa4 n GLU 18 Cb 0.24 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.18 2qa4 n GLU 18 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2qa4 n TYR 19 N -1.26 0.00 -4.30 -1.84 0.53 -1.08 -5.02 117.16 104.18 2qa4 n TYR 19 Ca 0.12 0.00 -0.34 0.00 -1.02 0.00 0.00 57.90 56.66 2qa4 n TYR 19 Cb 0.19 0.00 -0.09 0.00 -1.03 0.00 0.00 39.34 38.41 2qa4 n TYR 19 CO 0.00 0.00 0.00 0.42 -1.02 0.00 0.00 176.86 176.26 2qa4 s ILE 20 N -1.37 4.39 0.01 -0.72 1.01 -1.16 -5.12 121.20 118.24 2qa4 s ILE 20 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.34 2qa4 s ILE 20 Cb 0.00 -2.89 -0.01 0.00 0.01 0.00 0.00 42.46 39.58 2qa4 s ILE 20 CO 0.00 0.54 -0.01 0.42 0.00 0.00 0.00 174.94 175.89 2qa4 s THR 21 N -0.96 0.03 0.00 2.92 -4.23 -1.26 -4.83 115.64 107.31 2qa4 s THR 21 Ca 0.16 -0.23 0.00 0.00 -1.18 0.00 0.00 61.69 60.43 2qa4 s THR 21 Cb -0.11 -0.07 0.00 0.00 1.34 0.00 0.00 72.50 73.65 2qa4 s THR 21 CO 0.05 -0.13 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 2qa4 n GLY 22 N 2.70 1.07 3.67 3.99 0.00 -1.26 -4.75 105.19 110.61 2qa4 n GLY 22 Ca -0.15 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 2qa4 n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qa4 s ILE 23 N -2.00 4.77 0.08 -0.61 1.01 -1.26 -4.75 121.20 118.44 2qa4 s ILE 23 Ca 0.00 1.89 -0.31 0.00 0.00 0.00 0.00 60.65 62.23 2qa4 s ILE 23 Cb 0.00 -4.25 -0.07 0.00 0.01 0.00 0.00 42.46 38.15 2qa4 s ILE 23 CO 0.00 -0.08 1.39 -2.84 0.00 0.00 0.00 174.94 173.41 2qa4 s PRO 24 N 2.65 4.31 0.93 2.79 0.02 -1.26 -5.00 135.00 139.43 2qa4 s PRO 24 Ca 0.43 2.04 -0.10 0.00 0.02 0.00 0.00 61.00 63.38 2qa4 s PRO 24 Cb -0.16 -3.34 0.14 0.00 0.02 0.00 0.00 34.50 31.16 2qa4 s PRO 24 CO 0.10 -0.47 1.07 0.41 -0.33 0.00 0.00 177.00 177.78 2qa4 n GLY 25 N 3.53 -0.58 3.75 0.52 0.00 -1.26 -4.71 105.19 106.44 2qa4 n GLY 25 Ca 0.12 -0.73 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 2qa4 n GLY 25 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qa4 s SER 26 N -2.57 4.90 0.05 1.61 0.15 -1.26 -4.95 113.70 111.63 2qa4 s SER 26 Ca 0.66 2.30 0.17 0.00 0.70 0.00 0.00 55.95 59.79 2qa4 s SER 26 Cb -0.23 -2.59 -0.15 0.00 -1.71 0.00 0.00 66.02 61.35 2qa4 s SER 26 CO 0.59 -1.79 0.77 0.29 1.20 0.00 0.00 173.24 174.31 2qa4 n LYS 27 N -2.06 0.63 -1.62 5.44 5.02 -1.26 -4.88 118.16 119.43 2qa4 n LYS 27 Ca 0.13 0.19 -0.46 0.00 -2.02 0.00 0.00 58.31 56.15 2qa4 n LYS 27 Cb 0.50 -1.78 -0.04 0.00 -0.02 0.00 0.00 35.03 33.69 2qa4 n LYS 27 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2qa4 n ILE 28 N -2.84 0.49 0.00 -0.18 5.41 -1.26 -4.92 119.36 116.06 2qa4 n ILE 28 Ca -0.10 -0.25 0.00 0.00 1.00 0.00 0.00 62.75 63.40 2qa4 n ILE 28 Cb 0.84 -2.16 0.00 0.00 -0.71 0.00 0.00 39.64 37.61 2qa4 n ILE 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qa4 n ALA 29 N 8.91 -0.03 -2.72 -1.39 0.00 -1.26 -4.96 120.51 119.07 2qa4 n ALA 29 Ca 0.27 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.43 2qa4 n ALA 29 Cb 0.36 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.74 2qa4 n ALA 29 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2qa4 s GLN 30 N -0.56 2.62 -0.22 0.00 -0.21 -1.26 -5.03 119.66 115.00 2qa4 s GLN 30 Ca 0.00 -0.91 -0.01 0.00 0.02 0.00 0.00 55.36 54.45 2qa4 s GLN 30 Cb 0.00 -2.53 -0.13 0.00 1.00 0.00 0.00 33.01 31.35 2qa4 s GLN 30 CO 0.00 0.50 -0.22 0.72 -2.12 0.00 0.00 175.29 174.18 2qa4 n HIS 31 N 0.12 0.00 -3.59 0.91 8.25 -1.26 -4.90 115.22 114.76 2qa4 n HIS 31 Ca -0.10 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 56.97 2qa4 n HIS 31 Cb 0.54 -0.82 -0.11 0.00 1.12 0.00 0.00 29.99 30.71 2qa4 n HIS 31 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2qa4 s LYS 32 N -2.43 3.52 0.49 -0.41 1.02 -1.26 -1.94 119.74 118.72 2qa4 s LYS 32 Ca -0.30 -0.62 0.06 0.00 0.02 0.00 0.00 55.97 55.14 2qa4 s LYS 32 Cb 0.09 -3.69 -0.00 0.00 -0.52 0.00 0.00 37.83 33.70 2qa4 s LYS 32 CO 0.47 -0.39 0.30 -1.64 -0.92 0.00 0.00 175.35 173.17 2qa4 s MET 33 N 1.69 2.28 7.62 1.68 -1.94 -0.20 -4.87 119.30 125.56 2qa4 s MET 33 Ca 0.06 -1.94 0.00 0.00 -1.71 0.00 0.00 55.69 52.09 2qa4 s MET 33 Cb -0.17 -2.05 0.00 0.00 2.01 0.00 0.00 34.83 34.62 2qa4 s MET 33 CO 0.09 -0.39 0.00 0.41 -0.01 0.00 0.00 175.02 175.12 2qa4 n GLY 34 N -1.53 2.45 3.08 -0.03 0.00 -1.26 -3.04 105.19 104.85 2qa4 n GLY 34 Ca -0.03 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 2qa4 n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qa4 s ARG 35 N 0.00 2.23 0.00 1.61 0.52 -0.36 -4.94 118.95 118.02 2qa4 s ARG 35 Ca 0.00 -2.29 0.23 0.00 -0.52 0.00 0.00 55.73 53.15 2qa4 s ARG 35 Cb 0.00 -3.59 1.01 0.00 0.52 0.00 0.00 34.95 32.89 2qa4 s ARG 35 CO 0.00 -1.12 1.74 0.36 0.02 0.00 0.00 175.30 176.30 2qa4 n LYS 36 N 3.81 0.06 0.11 3.54 2.85 -1.26 -2.69 118.16 124.57 2qa4 n LYS 36 Ca 0.04 0.10 0.07 0.00 -1.05 0.00 0.00 58.31 57.47 2qa4 n LYS 36 Cb 0.38 -1.50 0.01 0.00 -0.65 0.00 0.00 35.03 33.27 2qa4 n LYS 36 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 2qa4 h GLN 37 N 0.00 0.00 -6.43 -1.58 4.20 -1.97 -3.45 115.11 105.87 2qa4 h GLN 37 Ca 0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 2qa4 h GLN 37 Cb 0.36 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 2qa4 h GLN 37 CO 0.00 0.16 -0.02 0.21 -0.67 0.00 0.00 178.83 178.52 2qa4 s LYS 38 N -3.15 4.05 0.55 1.46 2.20 -1.10 -5.07 119.74 118.69 2qa4 s LYS 38 Ca 0.01 0.60 -0.11 0.00 -0.36 0.00 0.00 55.97 56.11 2qa4 s LYS 38 Cb 0.08 -2.86 -0.05 0.00 -1.51 0.00 0.00 37.83 33.49 2qa4 s LYS 38 CO 0.77 0.42 0.96 -0.51 -0.36 0.00 0.00 175.35 176.63 2qa4 s ASP 39 N -1.78 6.36 0.53 1.43 1.01 -1.26 -4.96 116.67 118.00 2qa4 s ASP 39 Ca 0.41 1.35 0.31 0.00 0.71 0.00 0.00 52.55 55.34 2qa4 s ASP 39 Cb -0.15 -2.43 1.38 0.00 1.01 0.00 0.00 42.92 42.73 2qa4 s ASP 39 CO 0.20 -0.71 2.00 0.00 0.21 0.00 0.00 175.17 176.86 2qa4 h ALA 40 N 0.20 1.06 0.00 5.23 0.00 -1.97 -2.27 119.26 121.51 2qa4 h ALA 40 Ca -0.45 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.21 2qa4 h ALA 40 Cb 1.19 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2qa4 h ALA 40 CO 0.62 0.10 -0.81 -0.44 0.00 0.00 0.00 179.25 178.72 2qa4 h ASP 41 N 0.00 0.00 0.00 0.00 3.32 -2.01 -3.27 116.42 114.45 2qa4 h ASP 41 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qa4 h ASP 41 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 2qa4 h ASP 41 CO 0.01 0.81 0.00 0.47 -1.72 0.00 0.00 179.24 178.81 2qa4 n ASP 42 N -3.37 0.36 -4.11 6.45 8.00 -0.85 -4.72 116.55 118.30 2qa4 n ASP 42 Ca 0.00 -1.25 -0.22 0.00 0.71 0.00 0.00 54.79 54.03 2qa4 n ASP 42 Cb 0.84 -0.18 -0.15 0.00 -0.02 0.00 0.00 41.12 41.61 2qa4 n ASP 42 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2qa4 s TYR 43 N -1.43 1.27 0.00 1.24 1.51 -1.24 -5.00 117.35 113.71 2qa4 s TYR 43 Ca 0.00 -0.24 -0.05 0.00 -1.01 0.00 0.00 57.07 55.77 2qa4 s TYR 43 Cb 0.00 -0.81 -0.03 0.00 -0.11 0.00 0.00 41.96 41.01 2qa4 s TYR 43 CO 0.00 -0.02 0.71 -1.35 -1.11 0.00 0.00 175.55 173.78 2qa4 h PRO 44 N 5.77 -0.17 -6.24 -1.71 0.11 -1.84 -3.45 132.00 124.46 2qa4 h PRO 44 Ca -0.34 0.01 -0.56 0.00 0.11 0.00 0.00 66.00 65.22 2qa4 h PRO 44 Cb 1.16 0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2qa4 h PRO 44 CO 0.49 -0.11 0.06 0.08 -0.21 0.00 0.00 178.00 178.31 2qa4 s VAL 45 N -2.70 4.74 -0.12 3.15 1.01 -1.14 -4.63 120.40 120.72 2qa4 s VAL 45 Ca -0.03 1.42 -0.01 0.00 0.00 0.00 0.00 61.98 63.37 2qa4 s VAL 45 Cb 0.00 -4.01 0.03 0.00 0.00 0.00 0.00 36.38 32.40 2qa4 s VAL 45 CO 0.08 0.44 -0.04 -1.58 0.00 0.00 0.00 175.10 174.00 2qa4 s GLN 46 N -0.46 1.19 -0.08 2.72 0.74 -1.04 -1.12 119.66 121.61 2qa4 s GLN 46 Ca 0.34 -0.20 0.03 0.00 0.05 0.00 0.00 55.36 55.57 2qa4 s GLN 46 Cb -0.20 -1.51 -0.02 0.00 1.10 0.00 0.00 33.01 32.38 2qa4 s GLN 46 CO 0.21 -0.33 -0.17 0.42 -0.55 0.00 0.00 175.29 174.87 2qa4 s ILE 47 N 1.78 2.81 0.03 -2.34 1.01 0.59 -0.31 121.20 124.77 2qa4 s ILE 47 Ca 0.04 -0.79 0.07 0.00 0.00 0.00 0.00 60.65 59.97 2qa4 s ILE 47 Cb -0.13 -2.11 -0.02 0.00 0.01 0.00 0.00 42.46 40.21 2qa4 s ILE 47 CO -0.07 0.56 -0.21 -0.44 0.00 0.00 0.00 174.94 174.78 2qa4 s SER 48 N -0.24 2.51 -0.32 3.58 0.01 0.46 0.42 113.70 120.12 2qa4 s SER 48 Ca 0.00 -0.50 -0.13 0.00 1.31 0.00 0.00 55.95 56.63 2qa4 s SER 48 Cb -0.13 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 65.85 2qa4 s SER 48 CO 0.03 0.19 0.28 -0.22 0.41 0.00 0.00 173.24 173.92 2qa4 s LEU 49 N -1.04 4.33 -0.19 2.44 2.96 0.15 -1.01 118.68 126.32 2qa4 s LEU 49 Ca 0.08 -0.19 -0.09 0.00 -0.22 0.00 0.00 54.13 53.71 2qa4 s LEU 49 Cb -0.09 -2.22 -0.05 0.00 0.50 0.00 0.00 46.19 44.33 2qa4 s LEU 49 CO 0.01 -0.22 0.11 -0.63 -1.32 0.00 0.00 176.35 174.31 2qa4 s ILE 50 N 1.85 5.21 -0.03 6.68 1.01 0.01 -1.35 121.20 134.59 2qa4 s ILE 50 Ca 0.09 0.12 -0.29 0.00 0.00 0.00 0.00 60.65 60.57 2qa4 s ILE 50 Cb -0.17 -3.36 -0.03 0.00 0.01 0.00 0.00 42.46 38.91 2qa4 s ILE 50 CO 0.11 0.46 0.94 -0.69 0.00 0.00 0.00 174.94 175.76 2qa4 s VAL 51 N 0.28 4.88 -1.95 2.92 1.01 -0.87 -0.95 120.40 125.72 2qa4 s VAL 51 Ca 0.07 1.96 0.26 0.00 0.00 0.00 0.00 61.98 64.27 2qa4 s VAL 51 Cb -0.11 -4.28 0.27 0.00 0.00 0.00 0.00 36.38 32.26 2qa4 s VAL 51 CO -0.01 0.15 1.52 -0.62 0.00 0.00 0.00 175.10 176.14 2qa4 n GLU 52 N 4.06 1.07 -4.05 2.72 1.02 -0.36 0.14 120.64 125.24 2qa4 n GLU 52 Ca 0.05 -0.69 -0.12 0.00 -0.02 0.00 0.00 57.16 56.39 2qa4 n GLU 52 Cb 0.51 -1.49 -0.11 0.00 -0.02 0.00 0.00 31.44 30.33 2qa4 n GLU 52 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2qa4 s GLU 53 N -2.40 0.51 -0.98 3.49 2.02 -1.26 -4.69 118.70 115.38 2qa4 s GLU 53 Ca 0.26 -0.77 -0.23 0.00 0.02 0.00 0.00 54.97 54.24 2qa4 s GLU 53 Cb 0.19 -0.21 0.05 0.00 0.10 0.00 0.00 34.13 34.26 2qa4 s GLU 53 CO 0.49 0.03 1.42 0.99 0.02 0.00 0.00 175.26 178.21 2qa4 s THR 54 N -1.55 3.91 0.44 3.63 2.01 -1.26 -3.68 115.64 119.14 2qa4 s THR 54 Ca -0.10 -0.63 0.03 0.00 0.31 0.00 0.00 61.69 61.30 2qa4 s THR 54 Cb -0.09 -5.04 -0.03 0.00 0.01 0.00 0.00 72.50 67.35 2qa4 s THR 54 CO -0.00 -1.92 0.06 0.68 -0.69 0.00 0.00 174.62 172.74 2qa4 s VAL 55 N 5.03 1.06 -0.13 3.82 -7.23 -0.65 -4.46 120.40 117.83 2qa4 s VAL 55 Ca 0.44 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.60 2qa4 s VAL 55 Cb -0.01 -2.41 -0.02 0.00 0.56 0.00 0.00 36.38 34.50 2qa4 s VAL 55 CO -0.07 0.00 -0.09 -1.10 -0.31 0.00 0.00 175.10 173.53 2qa4 s GLN 56 N -3.80 3.44 -0.19 4.82 -0.21 -0.96 -0.84 119.66 121.93 2qa4 s GLN 56 Ca 0.20 -0.62 0.01 0.00 0.02 0.00 0.00 55.36 54.97 2qa4 s GLN 56 Cb 0.04 -2.73 0.04 0.00 1.00 0.00 0.00 33.01 31.36 2qa4 s GLN 56 CO 0.11 0.25 -0.13 -0.51 -2.12 0.00 0.00 175.29 172.89 2qa4 s LEU 57 N 0.28 2.20 0.47 2.90 1.43 -0.60 -4.53 118.68 120.82 2qa4 s LEU 57 Ca -0.07 -0.79 -0.23 0.00 -1.03 0.00 0.00 54.13 52.02 2qa4 s LEU 57 Cb -0.15 -1.28 -0.07 0.00 0.03 0.00 0.00 46.19 44.71 2qa4 s LEU 57 CO 0.04 -0.10 1.17 -0.13 0.23 0.00 0.00 176.35 177.56 2qa4 s ARG 58 N 1.38 3.71 0.44 1.70 0.52 -1.26 -0.24 118.95 125.20 2qa4 s ARG 58 Ca 0.01 1.77 0.23 0.00 -0.52 0.00 0.00 55.73 57.22 2qa4 s ARG 58 Cb -0.15 -2.37 1.23 0.00 0.52 0.00 0.00 34.95 34.17 2qa4 s ARG 58 CO -0.09 -0.59 1.81 1.12 0.02 0.00 0.00 175.30 177.57 2qa4 h HIS 59 N 1.97 0.44 0.00 -0.53 2.07 -1.87 0.65 115.15 117.87 2qa4 h HIS 59 Ca -0.49 0.01 -0.03 0.00 -2.85 0.00 0.00 60.37 57.01 2qa4 h HIS 59 Cb 1.25 -0.13 -0.00 0.00 2.57 0.00 0.00 27.41 31.10 2qa4 h HIS 59 CO 0.53 0.06 -0.13 0.78 -3.07 0.00 0.00 177.93 176.10 2qa4 h GLY 60 N 0.28 0.00 1.25 6.13 0.00 -1.91 0.23 103.07 109.05 2qa4 h GLY 60 Ca 0.54 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.56 2qa4 h GLY 60 CO -0.19 0.00 -1.52 0.23 0.00 0.00 0.00 176.54 175.07 2qa4 h SER 61 N 0.00 0.49 0.21 0.19 0.87 -0.04 -2.06 113.55 113.21 2qa4 h SER 61 Ca -0.00 -0.63 -0.01 0.00 -1.23 0.00 0.00 61.79 59.91 2qa4 h SER 61 Cb 0.54 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2qa4 h SER 61 CO 0.02 1.52 -0.10 -0.07 -0.53 0.00 0.00 176.83 177.67 2qa4 h LEU 62 N 0.09 -0.24 0.13 2.23 -0.00 -1.12 -2.50 115.31 113.89 2qa4 h LEU 62 Ca -0.24 -0.27 0.02 0.00 -0.00 0.00 0.00 57.88 57.39 2qa4 h LEU 62 Cb 2.04 0.06 -0.04 0.00 -0.00 0.00 0.00 40.66 42.73 2qa4 h LEU 62 CO 0.19 0.18 -0.28 -0.08 -0.00 0.00 0.00 178.44 178.44 2qa4 h GLU 63 N -0.71 -0.49 0.00 1.13 4.57 -1.09 0.54 114.58 118.53 2qa4 h GLU 63 Ca -0.03 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2qa4 h GLU 63 Cb 0.49 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.19 2qa4 h GLU 63 CO 0.05 -0.32 0.00 0.00 -1.18 0.00 0.00 179.01 177.55 2qa4 n ALA 64 N -2.64 1.32 -0.11 2.92 0.00 -0.77 0.12 120.51 121.35 2qa4 n ALA 64 Ca -0.07 0.16 -0.12 0.00 0.00 0.00 0.00 53.44 53.41 2qa4 n ALA 64 Cb 0.31 -1.36 -0.14 0.00 0.00 0.00 0.00 19.45 18.25 2qa4 n ALA 64 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2qa4 n SER 65 N -2.28 0.73 -0.07 0.00 3.41 -0.70 -3.91 113.62 110.81 2qa4 n SER 65 Ca 0.00 -0.04 -0.13 0.00 -0.26 0.00 0.00 58.87 58.44 2qa4 n SER 65 Cb 0.12 0.53 -0.01 0.00 -0.26 0.00 0.00 64.21 64.60 2qa4 n SER 65 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2qa4 h ARG 66 N 0.00 0.81 -0.02 4.33 2.43 0.47 -2.38 114.38 120.02 2qa4 h ARG 66 Ca -0.55 -0.49 0.03 0.00 -0.81 0.00 0.00 59.98 58.17 2qa4 h ARG 66 Cb 2.11 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 31.66 2qa4 h ARG 66 CO -0.01 1.12 -0.26 1.25 -1.51 0.00 0.00 179.97 180.56 2qa4 h LEU 67 N 0.63 -0.76 -0.51 3.80 5.85 -0.51 0.13 115.31 123.94 2qa4 h LEU 67 Ca 0.03 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2qa4 h LEU 67 Cb 1.09 0.31 0.00 0.00 0.37 0.00 0.00 40.66 42.44 2qa4 h LEU 67 CO 0.11 -0.32 0.00 0.77 -0.34 0.00 0.00 178.44 178.66 2qa4 h SER 68 N -0.38 0.00 0.26 1.25 4.64 -1.67 0.20 113.55 117.84 2qa4 h SER 68 Ca 0.07 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.05 2qa4 h SER 68 Cb 0.48 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.61 2qa4 h SER 68 CO -0.24 0.00 -1.50 0.00 -0.87 0.00 0.00 176.83 174.22 2qa4 h ALA 69 N 2.22 -0.16 0.18 5.18 0.00 -0.97 -3.20 119.26 122.51 2qa4 h ALA 69 Ca 0.00 -0.87 -0.24 0.00 0.00 0.00 0.00 54.91 53.80 2qa4 h ALA 69 Cb 0.65 0.19 0.03 0.00 0.00 0.00 0.00 17.79 18.65 2qa4 h ALA 69 CO 0.00 0.70 -1.07 -0.97 0.00 0.00 0.00 179.25 177.92 2qa4 h ASN 70 N 0.15 0.58 -0.26 0.00 -0.73 -0.89 -3.10 115.58 111.34 2qa4 h ASN 70 Ca -0.26 -0.94 0.07 0.00 1.87 0.00 0.00 56.30 57.04 2qa4 h ASN 70 Cb 2.18 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 40.57 2qa4 h ASN 70 CO 0.28 1.51 0.19 -0.09 -0.37 0.00 0.00 177.43 178.94 2qa4 h ARG 71 N -0.21 0.00 -0.04 6.67 2.43 -0.76 -0.87 114.38 121.61 2qa4 h ARG 71 Ca -0.19 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 58.89 2qa4 h ARG 71 Cb 1.82 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 31.37 2qa4 h ARG 71 CO 0.18 0.00 -0.33 1.25 -1.51 0.00 0.00 179.97 179.56 2qa4 h HIS 72 N 0.00 0.42 -1.00 2.20 2.76 -1.62 -2.47 115.15 115.43 2qa4 h HIS 72 Ca 0.12 -0.20 0.07 0.00 -2.20 0.00 0.00 60.37 58.17 2qa4 h HIS 72 Cb 0.50 -0.06 -0.07 0.00 1.55 0.00 0.00 27.41 29.33 2qa4 h HIS 72 CO 0.00 0.96 0.65 -0.07 -1.30 0.00 0.00 177.93 178.16 2qa4 h LEU 73 N -0.24 1.02 0.22 0.26 3.38 -1.13 -1.99 115.31 116.84 2qa4 h LEU 73 Ca -0.03 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2qa4 h LEU 73 Cb 1.02 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2qa4 h LEU 73 CO 0.07 0.63 -0.11 0.40 0.09 0.00 0.00 178.44 179.53 2qa4 h ILE 74 N 1.15 0.85 -0.67 1.22 2.04 -1.26 0.36 117.51 121.19 2qa4 h ILE 74 Ca 0.44 -0.47 0.20 0.00 1.00 0.00 0.00 64.86 66.03 2qa4 h ILE 74 Cb 0.22 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 2qa4 h ILE 74 CO -0.19 0.10 0.50 0.50 0.00 0.00 0.00 178.15 179.07 2qa4 h LYS 75 N -0.54 0.00 0.00 2.37 3.64 -1.03 -0.63 116.57 120.38 2qa4 h LYS 75 Ca -0.03 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 58.98 2qa4 h LYS 75 Cb 0.40 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.15 2qa4 h LYS 75 CO 0.05 0.00 -2.38 0.39 -2.27 0.00 0.00 179.45 175.24 2qa4 n GLU 76 N -4.26 0.71 -0.06 1.90 -0.58 -0.78 -4.68 120.64 112.89 2qa4 n GLU 76 Ca 0.13 0.07 0.06 0.00 -0.42 0.00 0.00 57.16 57.01 2qa4 n GLU 76 Cb 0.76 -1.50 0.09 0.00 -0.57 0.00 0.00 31.44 30.22 2qa4 n GLU 76 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2qa4 n LEU 77 N -2.99 2.37 0.00 -4.62 4.77 0.12 -5.10 117.00 111.55 2qa4 n LEU 77 Ca -0.38 -1.32 0.00 0.00 -0.03 0.00 0.00 56.01 54.28 2qa4 n LEU 77 Cb 1.05 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 2qa4 n LEU 77 CO 0.33 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 2qa4 n GLY 78 N 0.69 2.19 0.00 -0.72 0.00 -0.26 -3.27 105.19 103.83 2qa4 n GLY 78 Ca 0.09 -1.73 0.03 0.00 0.00 0.00 0.00 46.02 44.42 2qa4 n GLY 78 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qa4 n GLU 79 N 1.98 0.02 -2.73 1.61 1.02 -1.26 -1.74 120.64 119.54 2qa4 n GLU 79 Ca 0.00 0.35 -0.04 0.00 -0.02 0.00 0.00 57.16 57.45 2qa4 n GLU 79 Cb 0.00 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 29.99 2qa4 n GLU 79 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2qa4 n GLU 80 N -1.45 1.39 -1.49 3.49 1.02 -1.26 -5.03 120.64 117.31 2qa4 n GLU 80 Ca 0.02 -2.82 -0.29 0.00 -0.02 0.00 0.00 57.16 54.05 2qa4 n GLU 80 Cb 0.07 -0.94 0.12 0.00 -0.02 0.00 0.00 31.44 30.67 2qa4 n GLU 80 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2qa4 s GLY 81 N -2.78 1.60 -1.13 0.62 0.00 -0.71 -4.96 107.32 99.96 2qa4 s GLY 81 Ca 0.24 -0.35 -0.18 0.00 0.00 0.00 0.00 44.72 44.43 2qa4 s GLY 81 CO -0.03 0.15 1.45 -0.35 0.00 0.00 0.00 173.10 174.32 2qa4 s ASP 82 N -3.89 6.81 0.09 1.64 2.15 -1.26 -4.61 116.67 117.60 2qa4 s ASP 82 Ca 0.63 -2.36 -0.27 0.00 0.43 0.00 0.00 52.55 50.98 2qa4 s ASP 82 Cb -0.15 -2.48 0.08 0.00 -0.30 0.00 0.00 42.92 40.07 2qa4 s ASP 82 CO 0.54 -1.07 0.97 -0.72 -0.17 0.00 0.00 175.17 174.72 2qa4 s TYR 83 N 3.14 -0.18 -0.27 -5.34 -0.85 -1.26 -4.39 117.35 108.19 2qa4 s TYR 83 Ca 0.44 -0.06 -0.03 0.00 -0.52 0.00 0.00 57.07 56.90 2qa4 s TYR 83 Cb -0.01 0.60 0.15 0.00 0.38 0.00 0.00 41.96 43.09 2qa4 s TYR 83 CO -0.02 -0.70 0.53 -1.59 -1.52 0.00 0.00 175.55 172.25 2qa4 s LYS 84 N -3.16 0.48 -0.00 -3.49 -2.85 -0.91 -1.22 119.74 108.58 2qa4 s LYS 84 Ca 0.10 0.95 0.01 0.00 -1.00 0.00 0.00 55.97 56.04 2qa4 s LYS 84 Cb -0.01 0.29 -0.04 0.00 -2.06 0.00 0.00 37.83 36.02 2qa4 s LYS 84 CO -0.01 -0.52 -0.00 1.41 0.10 0.00 0.00 175.35 176.32 2qa4 s MET 85 N 2.75 2.78 -0.01 1.78 1.75 -1.17 -0.82 119.30 126.36 2qa4 s MET 85 Ca 0.12 -0.61 0.01 0.00 -1.25 0.00 0.00 55.69 53.96 2qa4 s MET 85 Cb -0.14 -2.66 0.01 0.00 2.84 0.00 0.00 34.83 34.87 2qa4 s MET 85 CO -0.18 0.63 -0.04 0.99 -0.65 0.00 0.00 175.02 175.77 2qa4 s THR 86 N -1.07 0.34 -0.56 10.11 2.01 -0.03 -1.03 115.64 125.40 2qa4 s THR 86 Ca 0.19 -0.13 -0.18 0.00 0.31 0.00 0.00 61.69 61.88 2qa4 s THR 86 Cb -0.11 -0.32 0.11 0.00 0.01 0.00 0.00 72.50 72.18 2qa4 s THR 86 CO 0.10 0.12 0.61 -0.22 -0.69 0.00 0.00 174.62 174.54 2qa4 s LEU 87 N 0.22 5.62 0.13 4.42 2.96 -0.82 -1.03 118.68 130.19 2qa4 s LEU 87 Ca -0.02 -1.49 -0.08 0.00 -0.22 0.00 0.00 54.13 52.32 2qa4 s LEU 87 Cb -0.05 -2.28 -0.08 0.00 0.50 0.00 0.00 46.19 44.28 2qa4 s LEU 87 CO -0.00 -0.98 1.35 0.08 -1.32 0.00 0.00 176.35 175.47 2qa4 h ARG 88 N 9.05 0.62 -6.97 1.98 0.11 -1.76 -3.46 114.38 113.94 2qa4 h ARG 88 Ca -0.29 -0.53 -0.46 0.00 0.10 0.00 0.00 59.98 58.80 2qa4 h ARG 88 Cb 1.09 0.12 -0.01 0.00 1.11 0.00 0.00 29.97 32.28 2qa4 h ARG 88 CO 1.05 1.15 0.36 0.15 0.10 0.00 0.00 179.97 182.78 2qa4 s LYS 89 N -3.64 4.32 -0.01 0.08 -0.14 -1.26 -5.07 119.74 114.02 2qa4 s LYS 89 Ca -0.08 1.31 0.08 0.00 -1.36 0.00 0.00 55.97 55.91 2qa4 s LYS 89 Cb 0.09 -2.49 -0.02 0.00 -1.68 0.00 0.00 37.83 33.73 2qa4 s LYS 89 CO 0.88 0.03 -0.25 -0.06 -0.76 0.00 0.00 175.35 175.19 2qa4 s PHE 90 N -1.83 2.25 -0.94 3.18 0.40 -1.26 -5.05 117.98 114.73 2qa4 s PHE 90 Ca 0.57 -0.42 -0.24 0.00 -0.60 0.00 0.00 56.93 56.24 2qa4 s PHE 90 Cb -0.16 -1.42 0.01 0.00 0.51 0.00 0.00 43.02 41.95 2qa4 s PHE 90 CO 0.21 -0.00 1.65 -1.25 0.70 0.00 0.00 175.22 176.52 2qa4 s PRO 91 N -0.73 3.12 -0.23 0.24 0.04 -1.26 -4.38 135.00 131.80 2qa4 s PRO 91 Ca 0.10 -0.66 0.01 0.00 0.04 0.00 0.00 61.00 60.49 2qa4 s PRO 91 Cb -0.10 -5.12 -0.15 0.00 0.04 0.00 0.00 34.50 29.18 2qa4 s PRO 91 CO -0.00 -2.67 -0.21 0.72 0.04 0.00 0.00 177.00 174.87 2qa4 n HIS 92 N 11.04 0.00 -1.73 0.56 8.25 -0.96 -4.60 115.22 127.78 2qa4 n HIS 92 Ca 0.33 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.36 2qa4 n HIS 92 Cb 0.49 -0.89 -0.03 0.00 1.12 0.00 0.00 29.99 30.68 2qa4 n HIS 92 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2qa4 s GLN 93 N -2.46 3.13 0.31 -0.41 2.00 -0.39 -4.60 119.66 117.24 2qa4 s GLN 93 Ca -0.31 1.80 -0.29 0.00 -2.00 0.00 0.00 55.36 54.56 2qa4 s GLN 93 Cb 0.08 -4.33 -0.10 0.00 0.80 0.00 0.00 33.01 29.47 2qa4 s GLN 93 CO 0.53 -2.10 1.13 0.08 -0.50 0.00 0.00 175.29 174.42 2qa4 s VAL 94 N 8.10 3.38 -0.12 1.34 1.01 -0.43 0.20 120.40 133.88 2qa4 s VAL 94 Ca 0.94 1.34 -0.03 0.00 0.00 0.00 0.00 61.98 64.24 2qa4 s VAL 94 Cb -0.29 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 2qa4 s VAL 94 CO 0.34 0.28 -0.02 -0.76 0.00 0.00 0.00 175.10 174.95 2qa4 s LEU 95 N -1.68 3.44 0.45 3.92 1.43 -0.54 -4.83 118.68 120.87 2qa4 s LEU 95 Ca 0.47 0.03 0.07 0.00 -1.03 0.00 0.00 54.13 53.67 2qa4 s LEU 95 Cb -0.32 -1.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 2qa4 s LEU 95 CO 0.41 0.29 0.34 -0.13 0.23 0.00 0.00 176.35 177.49 2qa4 s ARG 96 N -0.34 2.37 -0.29 1.70 0.52 -1.26 -1.77 118.95 119.88 2qa4 s ARG 96 Ca 0.06 -1.75 -0.17 0.00 -0.52 0.00 0.00 55.73 53.35 2qa4 s ARG 96 Cb -0.12 -2.20 0.15 0.00 0.52 0.00 0.00 34.95 33.30 2qa4 s ARG 96 CO 0.02 -0.29 1.04 -2.00 0.02 0.00 0.00 175.30 174.09 2qa4 s GLU 97 N -4.11 0.34 -0.46 3.54 2.12 -1.18 -4.86 118.70 114.09 2qa4 s GLU 97 Ca 0.43 0.55 -0.23 0.00 0.36 0.00 0.00 54.97 56.07 2qa4 s GLU 97 Cb -0.01 0.08 0.03 0.00 0.26 0.00 0.00 34.13 34.49 2qa4 s GLU 97 CO 0.25 -0.07 0.80 1.21 -0.54 0.00 0.00 175.26 176.91 2qa4 s ASN 98 N 1.11 6.40 -0.52 -1.70 2.47 -1.26 -2.02 114.94 119.42 2qa4 s ASN 98 Ca -0.07 -0.14 0.07 0.00 0.42 0.00 0.00 52.86 53.15 2qa4 s ASN 98 Cb -0.04 -2.39 0.26 0.00 -1.45 0.00 0.00 41.25 37.63 2qa4 s ASN 98 CO -0.13 -0.94 0.66 2.29 -3.72 0.00 0.00 177.10 175.26 2qa4 n LYS 99 N 6.76 1.71 -0.03 0.43 2.85 -1.26 -5.06 118.16 123.56 2qa4 n LYS 99 Ca 0.02 -4.00 0.00 0.00 -1.05 0.00 0.00 58.31 53.28 2qa4 n LYS 99 Cb 0.48 -1.78 0.00 0.00 -0.65 0.00 0.00 35.03 33.08 2qa4 n LYS 99 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2qa4 n ASP 111 N 1.02 -1.76 0.00 -5.58 -0.08 -1.26 -5.11 116.55 103.78 2qa4 n ASP 111 Ca 0.26 0.02 0.00 0.00 -1.51 0.00 0.00 54.79 53.56 2qa4 n ASP 111 Cb 0.47 0.90 0.00 0.00 2.34 0.00 0.00 41.12 44.83 2qa4 n ASP 111 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2qa4 n GLY 112 N -0.67 2.23 0.12 0.27 0.00 -1.26 -4.96 105.19 100.91 2qa4 n GLY 112 Ca 0.00 -0.23 0.12 0.00 0.00 0.00 0.00 46.02 45.91 2qa4 n GLY 112 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qa4 h MET 113 N 0.00 0.00 -6.98 1.61 2.86 -2.02 -3.43 114.93 106.97 2qa4 h MET 113 Ca 0.00 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.11 2qa4 h MET 113 Cb 0.00 0.00 0.10 0.00 0.06 0.00 0.00 31.60 31.76 2qa4 h MET 113 CO 0.00 0.00 0.63 0.50 1.06 0.00 0.00 176.91 179.10 2qa4 s ARG 114 N -3.22 3.77 -1.61 1.72 3.52 -1.26 -2.49 118.95 119.38 2qa4 s ARG 114 Ca 0.05 2.22 -0.12 0.00 -0.13 0.00 0.00 55.73 57.75 2qa4 s ARG 114 Cb 0.11 -2.64 0.10 0.00 -1.56 0.00 0.00 34.95 30.96 2qa4 s ARG 114 CO 0.71 -0.68 0.62 0.00 -0.81 0.00 0.00 175.30 175.14 2qa4 n ALA 115 N -0.15 -1.54 -0.03 6.12 0.00 -1.26 -4.89 120.51 118.76 2qa4 n ALA 115 Ca 0.05 -0.12 0.04 0.00 0.00 0.00 0.00 53.44 53.41 2qa4 n ALA 115 Cb 0.43 -2.68 0.40 0.00 0.00 0.00 0.00 19.45 17.61 2qa4 n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qa4 h ALA 116 N 0.88 1.68 -1.31 0.00 0.00 -1.77 -3.45 119.26 115.30 2qa4 h ALA 116 Ca -0.61 -0.03 -0.79 0.00 0.00 0.00 0.00 54.91 53.48 2qa4 h ALA 116 Cb 1.38 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 19.00 2qa4 h ALA 116 CO 0.73 0.30 0.85 0.34 0.00 0.00 0.00 179.25 181.47 2qa4 n PHE 117 N -4.47 1.93 -0.49 0.00 7.35 -1.26 -4.49 117.46 116.03 2qa4 n PHE 117 Ca 0.04 0.75 -0.31 0.00 -0.76 0.00 0.00 57.45 57.17 2qa4 n PHE 117 Cb 0.06 -2.38 0.28 0.00 0.35 0.00 0.00 39.48 37.79 2qa4 n PHE 117 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2qa4 s GLY 118 N 3.53 1.44 0.15 7.13 0.00 -1.26 -4.90 107.32 113.40 2qa4 s GLY 118 Ca 1.02 -0.90 0.09 0.00 0.00 0.00 0.00 44.72 44.93 2qa4 s GLY 118 CO 0.71 0.11 -0.16 -1.59 0.00 0.00 0.00 173.10 172.17 2qa4 s LYS 119 N -5.20 1.83 -0.11 2.90 -2.85 -0.86 -4.78 119.74 110.67 2qa4 s LYS 119 Ca 0.69 -1.25 -0.29 0.00 -1.00 0.00 0.00 55.97 54.12 2qa4 s LYS 119 Cb -0.11 -2.09 -0.05 0.00 -2.06 0.00 0.00 37.83 33.51 2qa4 s LYS 119 CO 0.57 0.46 1.80 0.42 0.10 0.00 0.00 175.35 178.69 2qa4 s ILE 120 N -1.38 3.40 -0.03 3.79 1.09 -1.26 -3.10 121.20 123.71 2qa4 s ILE 120 Ca 0.20 0.47 0.06 0.00 -1.10 0.00 0.00 60.65 60.28 2qa4 s ILE 120 Cb -0.10 -3.37 -0.09 0.00 -1.06 0.00 0.00 42.46 37.84 2qa4 s ILE 120 CO 0.12 -0.12 0.10 1.33 -0.10 0.00 0.00 174.94 176.26 2qa4 n VAL 121 N 6.15 0.17 -2.40 2.92 0.24 -0.73 -4.82 118.33 119.87 2qa4 n VAL 121 Ca 0.20 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.31 2qa4 n VAL 121 Cb 0.44 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.67 2qa4 n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qa4 n GLY 122 N 2.32 1.84 3.13 7.63 0.00 -1.19 -4.82 105.19 114.10 2qa4 n GLY 122 Ca -0.05 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.25 2qa4 n GLY 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qa4 s THR 123 N -2.29 0.13 0.04 2.61 -4.23 -1.26 -1.47 115.64 109.16 2qa4 s THR 123 Ca 0.00 -1.05 -0.17 0.00 -1.18 0.00 0.00 61.69 59.29 2qa4 s THR 123 Cb 0.00 -0.91 0.03 0.00 1.34 0.00 0.00 72.50 72.97 2qa4 s THR 123 CO 0.00 -0.58 0.39 0.00 -0.54 0.00 0.00 174.62 173.90 2qa4 s ALA 124 N -2.62 -0.96 0.07 3.99 0.00 0.13 -2.59 121.76 119.79 2qa4 s ALA 124 Ca -0.05 0.29 -0.09 0.00 0.00 0.00 0.00 51.96 52.11 2qa4 s ALA 124 Cb -0.01 0.31 -0.06 0.00 0.00 0.00 0.00 23.12 23.36 2qa4 s ALA 124 CO -0.04 -0.43 0.37 0.00 0.00 0.00 0.00 175.76 175.66 2qa4 s ALA 125 N -2.35 3.75 -0.39 0.00 0.00 0.66 -1.27 121.76 122.17 2qa4 s ALA 125 Ca -0.06 -0.43 -0.08 0.00 0.00 0.00 0.00 51.96 51.39 2qa4 s ALA 125 Cb -0.01 -2.22 0.06 0.00 0.00 0.00 0.00 23.12 20.95 2qa4 s ALA 125 CO -0.02 0.59 0.20 1.03 0.00 0.00 0.00 175.76 177.56 2qa4 s ARG 126 N -1.93 2.59 -0.24 0.00 0.52 -1.26 -1.56 118.95 117.06 2qa4 s ARG 126 Ca 0.32 -1.36 -0.08 0.00 -0.52 0.00 0.00 55.73 54.10 2qa4 s ARG 126 Cb -0.14 -3.66 -0.03 0.00 0.52 0.00 0.00 34.95 31.64 2qa4 s ARG 126 CO 0.18 -0.84 0.08 0.08 0.02 0.00 0.00 175.30 174.82 2qa4 s VAL 127 N 1.41 4.53 0.03 3.52 1.01 -0.02 -5.02 120.40 125.86 2qa4 s VAL 127 Ca 0.02 -0.10 -0.29 0.00 0.00 0.00 0.00 61.98 61.60 2qa4 s VAL 127 Cb -0.21 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 2qa4 s VAL 127 CO 0.02 0.35 0.94 -1.10 0.00 0.00 0.00 175.10 175.32 2qa4 s GLN 128 N 1.40 4.59 0.36 2.72 -1.52 -1.26 -1.64 119.66 124.31 2qa4 s GLN 128 Ca 0.06 1.37 -0.26 0.00 -1.95 0.00 0.00 55.36 54.58 2qa4 s GLN 128 Cb -0.15 -3.43 -0.12 0.00 -0.22 0.00 0.00 33.01 29.09 2qa4 s GLN 128 CO 0.04 0.05 0.94 0.00 -0.25 0.00 0.00 175.29 176.08 2qa4 n ALA 129 N 3.51 -0.24 0.00 6.09 0.00 -1.24 -1.95 120.51 126.68 2qa4 n ALA 129 Ca 0.04 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.77 2qa4 n ALA 129 Cb 0.50 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.94 2qa4 n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qa4 n GLY 130 N 1.29 3.08 3.82 0.00 0.00 0.38 -4.91 105.19 108.85 2qa4 n GLY 130 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 2qa4 n GLY 130 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qa4 s GLU 131 N -0.73 1.77 -0.26 1.61 2.02 -0.82 -4.76 118.70 117.53 2qa4 s GLU 131 Ca 0.00 0.38 -0.08 0.00 0.02 0.00 0.00 54.97 55.29 2qa4 s GLU 131 Cb 0.00 -1.90 -0.02 0.00 0.10 0.00 0.00 34.13 32.30 2qa4 s GLU 131 CO 0.00 -1.78 0.09 1.14 0.02 0.00 0.00 175.26 174.73 2qa4 s GLN 132 N -5.30 3.60 -0.04 1.61 -2.07 -1.26 -2.06 119.66 114.14 2qa4 s GLN 132 Ca 0.62 -0.52 -0.14 0.00 -1.82 0.00 0.00 55.36 53.49 2qa4 s GLN 132 Cb -0.14 -3.40 -0.32 0.00 -1.09 0.00 0.00 33.01 28.07 2qa4 s GLN 132 CO 0.53 -0.24 0.77 1.25 -1.32 0.00 0.00 175.29 176.27 2qa4 h LEU 133 N 8.27 0.63 -8.46 2.60 5.85 -1.60 -3.43 115.31 119.17 2qa4 h LEU 133 Ca -0.37 -0.92 -0.55 0.00 0.84 0.00 0.00 57.88 56.88 2qa4 h LEU 133 Cb 1.17 -0.21 -0.27 0.00 0.37 0.00 0.00 40.66 41.73 2qa4 h LEU 133 CO 0.58 1.70 -0.83 -0.36 -0.34 0.00 0.00 178.44 179.19 2qa4 s PHE 134 N -2.55 1.67 -0.21 1.25 0.40 -1.22 -2.43 117.98 114.89 2qa4 s PHE 134 Ca -0.14 -0.35 -0.04 0.00 -0.60 0.00 0.00 56.93 55.79 2qa4 s PHE 134 Cb 0.04 -1.02 0.08 0.00 0.51 0.00 0.00 43.02 42.64 2qa4 s PHE 134 CO 0.86 0.05 0.16 0.99 0.70 0.00 0.00 175.22 177.98 2qa4 s THR 135 N -0.70 -0.19 -0.08 0.64 2.01 -0.19 0.31 115.64 117.43 2qa4 s THR 135 Ca 0.06 -0.28 0.00 0.00 0.31 0.00 0.00 61.69 61.79 2qa4 s THR 135 Cb -0.08 -0.71 -0.03 0.00 0.01 0.00 0.00 72.50 71.69 2qa4 s THR 135 CO 0.01 -0.35 -0.07 0.00 -0.69 0.00 0.00 174.62 173.52 2qa4 s ALA 136 N 2.21 2.96 0.03 7.40 0.00 0.17 -0.85 121.76 133.67 2qa4 s ALA 136 Ca 0.05 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.18 2qa4 s ALA 136 Cb -0.16 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 2qa4 s ALA 136 CO -0.17 0.51 -0.13 0.71 0.00 0.00 0.00 175.76 176.69 2qa4 s TYR 137 N -0.61 2.71 0.00 0.00 1.51 0.00 -0.30 117.35 120.65 2qa4 s TYR 137 Ca 0.09 -0.16 0.00 0.00 -1.01 0.00 0.00 57.07 55.99 2qa4 s TYR 137 Cb -0.12 -1.53 0.00 0.00 -0.11 0.00 0.00 41.96 40.21 2qa4 s TYR 137 CO 0.02 0.31 0.00 0.00 -1.11 0.00 0.00 175.55 174.77 2qa4 s ASN 139 N -0.98 4.65 0.30 0.00 0.01 -1.26 -2.87 114.94 114.78 2qa4 s ASN 139 Ca 0.00 -0.09 0.27 0.00 -0.71 0.00 0.00 52.86 52.33 2qa4 s ASN 139 Cb 0.00 -1.12 0.92 0.00 0.41 0.00 0.00 41.25 41.46 2qa4 s ASN 139 CO 0.00 0.32 0.83 0.52 -1.51 0.00 0.00 177.10 177.26 2qa4 n VAL 140 N 1.84 -0.00 0.01 1.60 0.31 -1.26 -0.23 118.33 120.59 2qa4 n VAL 140 Ca -0.16 0.80 -0.18 0.00 -0.01 0.00 0.00 64.34 64.78 2qa4 n VAL 140 Cb 0.53 -1.33 -0.12 0.00 -0.91 0.00 0.00 33.84 32.01 2qa4 n VAL 140 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2qa4 h GLU 141 N 0.00 0.36 0.00 5.55 5.08 -2.00 -3.32 114.58 120.25 2qa4 h GLU 141 Ca 0.50 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2qa4 h GLU 141 Cb 2.01 0.13 0.00 0.00 0.50 0.00 0.00 28.75 31.39 2qa4 h GLU 141 CO -0.01 1.12 0.00 -0.25 -1.00 0.00 0.00 179.01 178.87 2qa4 n ASP 142 N -4.22 0.00 -0.17 1.42 8.00 0.68 -4.23 116.55 118.03 2qa4 n ASP 142 Ca -0.11 -0.95 0.10 0.00 0.71 0.00 0.00 54.79 54.54 2qa4 n ASP 142 Cb 0.70 0.00 0.42 0.00 -0.02 0.00 0.00 41.12 42.22 2qa4 n ASP 142 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qa4 h ALA 143 N 3.81 1.87 -0.03 2.24 0.00 -1.66 -2.28 119.26 123.22 2qa4 h ALA 143 Ca 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 2qa4 h ALA 143 Cb 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2qa4 h ALA 143 CO 0.00 -0.03 -0.64 0.93 0.00 0.00 0.00 179.25 179.51 2qa4 h GLU 144 N 0.60 0.12 -0.17 0.00 4.39 -1.87 -2.44 114.58 115.22 2qa4 h GLU 144 Ca 0.34 -0.09 -0.22 0.00 0.34 0.00 0.00 59.36 59.72 2qa4 h GLU 144 Cb 0.51 0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.18 2qa4 h GLU 144 CO -0.12 0.72 -0.76 0.45 -1.16 0.00 0.00 179.01 178.15 2qa4 h HIS 145 N 0.09 1.08 -0.12 4.33 3.86 -1.73 -2.33 115.15 120.33 2qa4 h HIS 145 Ca -0.01 -0.47 -0.09 0.00 -1.16 0.00 0.00 60.37 58.65 2qa4 h HIS 145 Cb 1.15 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 29.44 2qa4 h HIS 145 CO 0.01 1.30 -0.31 -0.24 0.86 0.00 0.00 177.93 179.55 2qa4 h VAL 146 N 0.56 1.26 -0.04 2.45 3.04 -1.42 0.18 116.25 122.28 2qa4 h VAL 146 Ca -0.05 -1.26 -0.11 0.00 -1.01 0.00 0.00 66.70 64.28 2qa4 h VAL 146 Cb 1.39 1.52 -0.01 0.00 -2.01 0.00 0.00 31.29 32.18 2qa4 h VAL 146 CO 0.16 0.38 -0.50 0.11 -1.01 0.00 0.00 177.57 176.71 2qa4 h LYS 147 N 0.19 0.10 0.00 4.17 1.57 -1.29 -2.06 116.57 119.24 2qa4 h LYS 147 Ca 0.03 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 2qa4 h LYS 147 Cb 0.65 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 2qa4 h LYS 147 CO 0.05 0.58 -0.55 1.49 -0.57 0.00 0.00 179.45 180.45 2qa4 h GLU 148 N 0.08 0.00 0.00 3.15 4.57 -0.89 -2.27 114.58 119.22 2qa4 h GLU 148 Ca 0.00 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.11 2qa4 h GLU 148 Cb 0.91 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.49 2qa4 h GLU 148 CO 0.07 0.55 -0.32 0.00 -1.18 0.00 0.00 179.01 178.13 2qa4 h ALA 149 N 1.45 1.41 0.00 2.92 0.00 -0.01 -2.22 119.26 122.81 2qa4 h ALA 149 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2qa4 h ALA 149 Cb 1.40 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2qa4 h ALA 149 CO 0.07 0.40 -1.01 1.19 0.00 0.00 0.00 179.25 179.90 2qa4 n PHE 150 N -4.06 0.52 0.32 0.00 0.99 -0.87 -2.82 117.46 111.54 2qa4 n PHE 150 Ca -0.02 0.15 0.13 0.00 -0.00 0.00 0.00 57.45 57.71 2qa4 n PHE 150 Cb 0.37 -0.65 0.32 0.00 -1.00 0.00 0.00 39.48 38.52 2qa4 n PHE 150 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 2qa4 h ARG 151 N 0.00 0.00 0.00 -1.08 2.43 -0.80 -2.89 114.38 112.04 2qa4 h ARG 151 Ca 0.00 0.00 -0.38 0.00 -0.81 0.00 0.00 59.98 58.79 2qa4 h ARG 151 Cb 0.84 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.32 2qa4 h ARG 151 CO 0.00 0.00 -2.44 0.54 -1.51 0.00 0.00 179.97 176.56 2qa4 n ARG 152 N -2.88 0.66 -0.22 0.20 1.74 -1.08 -4.25 116.66 110.83 2qa4 n ARG 152 Ca 0.04 0.10 -0.02 0.00 -0.77 0.00 0.00 57.85 57.20 2qa4 n ARG 152 Cb 0.46 -1.52 0.09 0.00 -1.02 0.00 0.00 32.46 30.47 2qa4 n ARG 152 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qa4 h ALA 153 N 0.34 0.86 0.00 7.54 0.00 -1.55 -2.11 119.26 124.34 2qa4 h ALA 153 Ca -0.57 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2qa4 h ALA 153 Cb 2.02 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.70 2qa4 h ALA 153 CO -0.05 0.01 0.00 0.10 0.00 0.00 0.00 179.25 179.31 2qa4 h TYR 154 N 0.64 0.00 0.00 0.00 -0.00 -1.74 -2.90 116.97 112.96 2qa4 h TYR 154 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.02 2qa4 h TYR 154 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.93 2qa4 h TYR 154 CO -0.09 0.00 0.00 0.09 -0.00 0.00 0.00 178.16 178.16 2qa4 n ASN 155 N -2.66 0.00 -0.12 0.10 3.02 -0.79 -2.92 115.26 111.88 2qa4 n ASN 155 Ca 0.04 -0.78 0.03 0.00 -0.03 0.00 0.00 54.58 53.84 2qa4 n ASN 155 Cb 0.42 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.64 2qa4 n ASN 155 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2qa4 n LYS 156 N -0.86 1.34 -4.47 3.52 5.02 -1.10 -5.03 118.16 116.58 2qa4 n LYS 156 Ca 0.11 -1.59 -0.21 0.00 -2.02 0.00 0.00 58.31 54.60 2qa4 n LYS 156 Cb 0.05 -0.98 -0.14 0.00 -0.02 0.00 0.00 35.03 33.93 2qa4 n LYS 156 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2qa4 s ILE 157 N -1.26 1.03 0.27 -0.18 -4.36 -1.15 -4.71 121.20 110.84 2qa4 s ILE 157 Ca 0.11 -0.74 -0.06 0.00 -0.26 0.00 0.00 60.65 59.69 2qa4 s ILE 157 Cb 0.09 -0.90 0.43 0.00 1.25 0.00 0.00 42.46 43.34 2qa4 s ILE 157 CO 0.01 0.15 1.47 0.41 0.24 0.00 0.00 174.94 177.23 2qa4 n THR 158 N 2.39 -0.40 -1.37 8.37 -1.04 -1.26 -4.72 114.28 116.25 2qa4 n THR 158 Ca -0.16 2.15 -0.29 0.00 -2.04 0.00 0.00 64.05 63.72 2qa4 n THR 158 Cb 0.55 -3.00 0.15 0.00 -1.82 0.00 0.00 70.33 66.21 2qa4 n THR 158 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2qa4 s PRO 159 N -6.16 0.97 0.14 -2.82 0.04 -1.26 -5.05 135.00 120.86 2qa4 s PRO 159 Ca -0.14 0.46 -0.11 0.00 0.04 0.00 0.00 61.00 61.25 2qa4 s PRO 159 Cb 0.26 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.93 2qa4 s PRO 159 CO 0.74 -2.35 0.49 -1.12 0.04 0.00 0.00 177.00 174.80 2qa4 s SER 160 N -3.74 6.70 0.42 6.66 0.01 -1.26 -4.95 113.70 117.54 2qa4 s SER 160 Ca 0.64 0.92 0.06 0.00 1.31 0.00 0.00 55.95 58.88 2qa4 s SER 160 Cb -0.16 -2.23 -0.07 0.00 0.21 0.00 0.00 66.02 63.77 2qa4 s SER 160 CO 0.55 0.09 0.03 0.00 0.41 0.00 0.00 173.24 174.32 2qa4 s ARG 162 N -3.75 0.40 -0.66 0.00 3.52 -0.12 -4.91 118.95 113.42 2qa4 s ARG 162 Ca 0.32 -0.28 -0.28 0.00 -0.13 0.00 0.00 55.73 55.36 2qa4 s ARG 162 Cb 0.09 -1.98 0.03 0.00 -1.56 0.00 0.00 34.95 31.52 2qa4 s ARG 162 CO 0.17 -0.66 1.26 0.42 -0.81 0.00 0.00 175.30 175.68 2qa4 s ILE 163 N 1.98 3.84 -0.21 4.11 1.01 -1.26 -0.81 121.20 129.86 2qa4 s ILE 163 Ca 0.00 0.62 -0.06 0.00 0.00 0.00 0.00 60.65 61.21 2qa4 s ILE 163 Cb -0.17 -4.80 -0.03 0.00 0.01 0.00 0.00 42.46 37.47 2qa4 s ILE 163 CO -0.09 -1.60 0.04 -0.62 0.00 0.00 0.00 174.94 172.67 2qa4 s ASP 164 N 3.53 5.16 -0.27 3.58 -1.08 -0.18 -5.00 116.67 122.42 2qa4 s ASP 164 Ca 0.40 -0.12 -0.10 0.00 -0.52 0.00 0.00 52.55 52.21 2qa4 s ASP 164 Cb -0.08 -1.89 -0.05 0.00 -1.46 0.00 0.00 42.92 39.44 2qa4 s ASP 164 CO 0.20 0.07 0.16 -0.55 0.52 0.00 0.00 175.17 175.57 2qa4 s SER 165 N 0.98 5.88 0.00 -0.34 0.15 -1.26 -0.40 113.70 118.70 2qa4 s SER 165 Ca 0.03 -0.03 0.00 0.00 0.70 0.00 0.00 55.95 56.65 2qa4 s SER 165 Cb -0.14 -2.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.09 2qa4 s SER 165 CO 0.02 -0.03 0.00 -1.20 1.20 0.00 0.00 173.24 173.23 2qa4 n SER 166 N 4.92 0.00 -4.54 5.45 7.64 0.58 -4.76 113.62 122.91 2qa4 n SER 166 Ca -0.15 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.31 2qa4 n SER 166 Cb 0.52 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.69 2qa4 n SER 166 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2qa4 s PRO 167 N 0.00 3.38 -0.32 1.43 0.02 -1.24 -4.86 135.00 133.41 2qa4 s PRO 167 Ca 0.00 -0.09 -0.10 0.00 0.02 0.00 0.00 61.00 60.83 2qa4 s PRO 167 Cb 0.00 -4.06 0.19 0.00 0.02 0.00 0.00 34.50 30.65 2qa4 s PRO 167 CO 0.00 -1.66 1.08 0.00 -0.33 0.00 0.00 177.00 176.09 2qa4 s ALA 168 N 4.56 -4.60 -0.37 -1.55 0.00 -1.26 -2.50 121.76 116.05 2qa4 s ALA 168 Ca 0.35 1.32 0.04 0.00 0.00 0.00 0.00 51.96 53.68 2qa4 s ALA 168 Cb -0.10 -3.03 0.55 0.00 0.00 0.00 0.00 23.12 20.54 2qa4 s ALA 168 CO 0.21 -2.52 1.72 0.41 0.00 0.00 0.00 175.76 175.58 2qa4 n GLY 169 N 3.58 3.88 3.02 0.00 0.00 -1.26 -4.72 105.19 109.68 2qa4 n GLY 169 Ca 0.05 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.88 2qa4 n GLY 169 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qa4 s ASN 170 N -0.83 5.09 0.00 1.61 0.02 -1.26 -5.26 114.94 114.31 2qa4 s ASN 170 Ca 0.46 -3.34 0.05 0.00 -1.02 0.00 0.00 52.86 49.00 2qa4 s ASN 170 Cb 0.38 -1.76 0.04 0.00 0.02 0.00 0.00 41.25 39.92 2qa4 s ASN 170 CO 0.09 -0.22 0.64 0.00 0.02 0.00 0.00 177.10 177.63