#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wqt h MET 1 N 0.00 0.62 -0.02 3.23 2.86 -2.08 -3.14 114.93 116.40 2wqt h MET 1 Ca 0.00 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2wqt h MET 1 Cb 0.00 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.54 2wqt h MET 1 CO 0.00 0.51 0.00 0.25 1.06 0.00 0.00 176.91 178.73 2wqt n THR 2 N -4.69 0.01 -0.33 2.22 -2.24 -1.26 -4.34 114.28 103.65 2wqt n THR 2 Ca 0.01 -0.25 -0.03 0.00 -2.27 0.00 0.00 64.05 61.50 2wqt n THR 2 Cb 0.09 0.49 0.09 0.00 -2.10 0.00 0.00 70.33 68.90 2wqt n THR 2 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2wqt h LYS 3 N 2.33 1.20 -0.58 -0.78 3.64 -1.98 0.22 116.57 120.62 2wqt h LYS 3 Ca 0.00 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 2wqt h LYS 3 Cb 0.50 -0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 2wqt h LYS 3 CO 0.00 0.83 0.25 1.25 -2.27 0.00 0.00 179.45 179.50 2wqt h HIS 4 N 1.23 0.88 -0.88 1.91 2.76 -1.78 -1.61 115.15 117.65 2wqt h HIS 4 Ca 0.32 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.43 2wqt h HIS 4 Cb -0.09 -0.27 -0.04 0.00 1.55 0.00 0.00 27.41 28.57 2wqt h HIS 4 CO -0.00 0.70 0.51 1.15 -1.30 0.00 0.00 177.93 178.99 2wqt h THR 5 N 0.80 1.25 -0.35 6.26 2.02 -1.65 -2.04 112.91 119.20 2wqt h THR 5 Ca 0.20 -0.57 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 2wqt h THR 5 Cb 0.18 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.60 2wqt h THR 5 CO -0.02 0.27 0.19 -0.07 0.37 0.00 0.00 175.52 176.26 2wqt h LEU 6 N 1.22 0.44 -0.76 2.58 4.07 -0.62 -0.53 115.31 121.70 2wqt h LEU 6 Ca 0.31 -0.10 0.08 0.00 0.08 0.00 0.00 57.88 58.25 2wqt h LEU 6 Cb -0.02 -0.11 -0.06 0.00 1.08 0.00 0.00 40.66 41.55 2wqt h LEU 6 CO -0.06 0.41 0.43 -0.33 -1.08 0.00 0.00 178.44 177.82 2wqt h GLU 7 N 0.44 0.74 -0.21 1.13 4.39 -1.03 0.04 114.58 120.08 2wqt h GLU 7 Ca 0.12 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 2wqt h GLU 7 Cb 0.07 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 2wqt h GLU 7 CO -0.02 0.49 0.10 1.96 -1.16 0.00 0.00 179.01 180.38 2wqt h GLN 8 N 0.76 0.31 -0.62 2.33 4.20 -0.73 -1.63 115.11 119.73 2wqt h GLN 8 Ca 0.35 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.93 2wqt h GLN 8 Cb 0.26 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 2wqt h GLN 8 CO -0.21 0.34 0.06 -0.07 -0.67 0.00 0.00 178.83 178.28 2wqt h LEU 9 N 0.21 1.02 -0.60 1.46 3.38 -0.84 -1.39 115.31 118.55 2wqt h LEU 9 Ca 0.07 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.81 2wqt h LEU 9 Cb 0.14 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 2wqt h LEU 9 CO -0.01 1.05 0.32 0.00 0.09 0.00 0.00 178.44 179.89 2wqt h ALA 10 N 1.01 0.79 -0.67 1.53 0.00 -0.86 -1.29 119.26 119.77 2wqt h ALA 10 Ca 0.18 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2wqt h ALA 10 Cb 0.49 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2wqt h ALA 10 CO 0.02 -0.00 0.16 0.00 0.00 0.00 0.00 179.25 179.43 2wqt h ALA 11 N 1.31 1.03 -0.59 0.00 0.00 -1.04 -1.44 119.26 118.53 2wqt h ALA 11 Ca 0.26 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2wqt h ALA 11 Cb 0.15 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2wqt h ALA 11 CO -0.17 0.64 0.36 -0.44 0.00 0.00 0.00 179.25 179.64 2wqt h ASP 12 N 1.01 0.59 -0.51 0.00 3.32 -0.65 -0.68 116.42 119.50 2wqt h ASP 12 Ca 0.21 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.21 2wqt h ASP 12 Cb 0.35 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 2wqt h ASP 12 CO 0.00 0.42 0.11 -0.07 -1.72 0.00 0.00 179.24 177.98 2wqt h LEU 13 N 0.72 0.83 -0.33 1.55 4.07 -0.97 -0.27 115.31 120.90 2wqt h LEU 13 Ca 0.24 -0.16 -0.07 0.00 0.08 0.00 0.00 57.88 57.97 2wqt h LEU 13 Cb 0.01 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.52 2wqt h LEU 13 CO -0.10 0.82 -0.05 0.03 -1.08 0.00 0.00 178.44 178.07 2wqt h ARG 14 N 0.84 0.63 -0.65 1.13 3.08 -0.78 -2.66 114.38 115.97 2wqt h ARG 14 Ca 0.18 -0.23 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 2wqt h ARG 14 Cb 0.34 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 2wqt h ARG 14 CO 0.00 0.78 0.07 -0.09 -1.07 0.00 0.00 179.97 179.67 2wqt h ARG 15 N 0.41 1.10 -0.53 0.04 2.43 -1.00 -1.44 114.38 115.38 2wqt h ARG 15 Ca 0.09 -0.31 0.09 0.00 -0.81 0.00 0.00 59.98 59.04 2wqt h ARG 15 Cb 0.53 -0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 29.89 2wqt h ARG 15 CO 0.03 1.02 0.11 0.00 -1.51 0.00 0.00 179.97 179.62 2wqt h ALA 16 N 1.05 0.61 -0.22 2.80 0.00 -0.96 -1.11 119.26 121.42 2wqt h ALA 16 Ca 0.19 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 2wqt h ALA 16 Cb 0.48 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2wqt h ALA 16 CO 0.02 -0.30 -0.04 0.00 0.00 0.00 0.00 179.25 178.92 2wqt h ALA 17 N 1.41 0.30 -0.68 0.00 0.00 -1.17 -1.47 119.26 117.67 2wqt h ALA 17 Ca 0.27 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 54.99 2wqt h ALA 17 Cb 0.37 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2wqt h ALA 17 CO -0.35 0.08 0.45 0.93 0.00 0.00 0.00 179.25 180.36 2wqt h GLU 18 N 0.16 0.67 0.00 0.00 5.08 -0.95 -3.02 114.58 116.51 2wqt h GLU 18 Ca 0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2wqt h GLU 18 Cb 0.49 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2wqt h GLU 18 CO 0.02 0.44 -1.14 1.04 -1.00 0.00 0.00 179.01 178.37 2wqt n GLN 19 N -4.48 0.18 -2.84 2.33 6.02 -0.45 -4.97 117.38 113.18 2wqt n GLN 19 Ca 0.10 -0.04 -0.22 0.00 -0.01 0.00 0.00 57.00 56.84 2wqt n GLN 19 Cb 0.23 -1.53 0.02 0.00 1.02 0.00 0.00 30.24 29.99 2wqt n GLN 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wqt n GLY 20 N 1.43 -0.49 2.97 1.08 0.00 -0.59 -5.00 105.19 104.59 2wqt n GLY 20 Ca 0.02 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 2wqt n GLY 20 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wqt s GLU 21 N -5.50 1.93 0.45 1.61 2.02 -0.96 -5.06 118.70 113.18 2wqt s GLU 21 Ca 0.22 -0.68 -0.23 0.00 0.02 0.00 0.00 54.97 54.30 2wqt s GLU 21 Cb -0.10 -2.22 -0.08 0.00 0.10 0.00 0.00 34.13 31.84 2wqt s GLU 21 CO 0.27 -0.38 1.12 0.00 0.02 0.00 0.00 175.26 176.29 2wqt s ALA 22 N 1.48 2.99 0.42 5.21 0.00 -1.26 -4.45 121.76 126.15 2wqt s ALA 22 Ca 0.01 0.84 0.08 0.00 0.00 0.00 0.00 51.96 52.89 2wqt s ALA 22 Cb -0.15 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 2wqt s ALA 22 CO -0.09 -0.51 0.35 0.96 0.00 0.00 0.00 175.76 176.47 2wqt s ILE 23 N -1.61 2.54 0.54 0.00 -4.36 -0.08 -4.62 121.20 113.61 2wqt s ILE 23 Ca 0.62 -1.41 -0.19 0.00 -0.26 0.00 0.00 60.65 59.41 2wqt s ILE 23 Cb -0.26 -2.95 -0.06 0.00 1.25 0.00 0.00 42.46 40.44 2wqt s ILE 23 CO 0.31 0.00 1.11 0.00 0.24 0.00 0.00 174.94 176.60 2wqt s ALA 24 N -2.51 2.71 0.42 2.27 0.00 -1.26 -0.47 121.76 122.92 2wqt s ALA 24 Ca 0.46 0.75 -0.24 0.00 0.00 0.00 0.00 51.96 52.93 2wqt s ALA 24 Cb -0.02 -3.33 -0.10 0.00 0.00 0.00 0.00 23.12 19.67 2wqt s ALA 24 CO 0.27 -0.72 1.05 -2.30 0.00 0.00 0.00 175.76 174.06 2wqt n PRO 25 N -1.34 1.43 0.02 0.00 -0.02 -1.26 -4.87 135.00 128.96 2wqt n PRO 25 Ca 0.11 0.51 0.12 0.00 -2.02 0.00 0.00 63.50 62.23 2wqt n PRO 25 Cb 0.51 -2.10 0.32 0.00 -0.02 0.00 0.00 33.50 32.21 2wqt n PRO 25 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wqt n LEU 26 N 0.42 0.45 -0.22 2.45 4.32 -1.26 -4.57 117.00 118.59 2wqt n LEU 26 Ca 0.09 0.17 0.02 0.00 -0.02 0.00 0.00 56.01 56.27 2wqt n LEU 26 Cb 0.39 -0.29 0.13 0.00 -1.62 0.00 0.00 43.42 42.04 2wqt n LEU 26 CO 0.57 0.05 1.00 0.08 -1.22 0.00 0.00 177.39 177.86 2wqt h ARG 27 N 0.00 0.41 0.00 3.23 0.11 -1.92 -1.27 114.38 114.94 2wqt h ARG 27 Ca 0.00 -0.02 -0.10 0.00 0.10 0.00 0.00 59.98 59.95 2wqt h ARG 27 Cb 0.56 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 31.53 2wqt h ARG 27 CO 0.00 0.27 -0.48 -0.44 0.10 0.00 0.00 179.97 179.42 2wqt h ASP 28 N 0.42 0.00 1.17 0.08 3.32 -1.92 0.26 116.42 119.75 2wqt h ASP 28 Ca 0.34 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.27 2wqt h ASP 28 Cb 0.45 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 2wqt h ASP 28 CO -0.34 0.48 -0.56 -0.07 -1.72 0.00 0.00 179.24 177.03 2wqt h LEU 29 N 0.00 0.00 0.00 1.55 4.07 -1.55 -3.34 115.31 116.04 2wqt h LEU 29 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2wqt h LEU 29 Cb 0.89 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.63 2wqt h LEU 29 CO 0.06 0.56 -1.24 2.30 -1.08 0.00 0.00 178.44 179.05 2wqt n ILE 30 N -3.36 0.00 0.00 1.22 -5.35 -1.02 -5.10 119.36 105.74 2wqt n ILE 30 Ca 0.01 -0.25 0.00 0.00 -0.27 0.00 0.00 62.75 62.24 2wqt n ILE 30 Cb 0.70 0.45 0.00 0.00 -1.74 0.00 0.00 39.64 39.05 2wqt n ILE 30 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wqt n GLY 31 N 1.71 1.61 0.45 3.28 0.00 0.89 -4.55 105.19 108.59 2wqt n GLY 31 Ca -0.01 -1.29 0.28 0.00 0.00 0.00 0.00 46.02 45.01 2wqt n GLY 31 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2wqt h ILE 32 N 0.00 0.45 -1.18 -0.61 2.10 -1.90 -0.46 117.51 115.91 2wqt h ILE 32 Ca 0.00 -0.08 -0.55 0.00 1.08 0.00 0.00 64.86 65.31 2wqt h ILE 32 Cb 0.00 0.19 -0.42 0.00 -1.09 0.00 0.00 36.82 35.50 2wqt h ILE 32 CO 0.00 0.04 -0.80 -0.90 -1.08 0.00 0.00 178.15 175.41 2wqt n ASP 33 N -4.48 4.50 -4.28 2.19 5.75 -1.26 -4.51 116.55 114.45 2wqt n ASP 33 Ca 0.27 -3.62 -0.44 0.00 -0.01 0.00 0.00 54.79 50.99 2wqt n ASP 33 Cb 1.05 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 40.72 2wqt n ASP 33 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2wqt n ASN 34 N -0.54 5.49 -0.20 -1.12 2.85 -0.18 -4.84 115.26 116.71 2wqt n ASN 34 Ca 0.38 -3.08 -0.07 0.00 -0.11 0.00 0.00 54.58 51.71 2wqt n ASN 34 Cb 0.78 -1.45 0.03 0.00 1.24 0.00 0.00 39.78 40.39 2wqt n ASN 34 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2wqt h ALA 35 N 6.54 0.73 -0.76 5.20 0.00 -1.89 -2.77 119.26 126.31 2wqt h ALA 35 Ca 0.26 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.20 2wqt h ALA 35 Cb 0.81 -0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.29 2wqt h ALA 35 CO 1.22 0.22 0.37 1.49 0.00 0.00 0.00 179.25 182.55 2wqt h GLU 36 N 0.77 0.57 -0.30 0.00 4.81 -2.00 -1.74 114.58 116.68 2wqt h GLU 36 Ca 0.20 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.32 2wqt h GLU 36 Cb 0.01 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 2wqt h GLU 36 CO -0.04 0.37 -0.12 0.00 -0.73 0.00 0.00 179.01 178.50 2wqt h ALA 37 N 1.48 0.42 -0.45 2.92 0.00 -1.91 -1.80 119.26 119.92 2wqt h ALA 37 Ca 0.39 -0.31 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2wqt h ALA 37 Cb 0.49 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 2wqt h ALA 37 CO -0.32 0.29 0.17 0.00 0.00 0.00 0.00 179.25 179.39 2wqt h ALA 38 N 0.77 0.54 -0.17 0.00 0.00 -1.17 -0.47 119.26 118.76 2wqt h ALA 38 Ca 0.07 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 2wqt h ALA 38 Cb 0.63 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2wqt h ALA 38 CO 0.04 -0.22 -0.18 1.88 0.00 0.00 0.00 179.25 180.77 2wqt h TYR 39 N 0.35 0.31 -0.55 0.00 -1.99 -1.31 -2.25 116.97 111.54 2wqt h TYR 39 Ca 0.21 -0.05 -0.08 0.00 2.00 0.00 0.00 58.73 60.81 2wqt h TYR 39 Cb 0.19 -0.08 -0.02 0.00 2.00 0.00 0.00 36.73 38.82 2wqt h TYR 39 CO -0.15 0.47 0.01 0.00 -0.00 0.00 0.00 178.16 178.50 2wqt h ALA 40 N 1.54 0.74 -0.22 3.88 0.00 -0.41 -0.40 119.26 124.40 2wqt h ALA 40 Ca 0.05 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2wqt h ALA 40 Cb 0.49 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2wqt h ALA 40 CO 0.03 0.55 0.13 0.82 0.00 0.00 0.00 179.25 180.79 2wqt h ILE 41 N 0.85 1.09 -0.71 0.00 2.04 -0.86 0.11 117.51 120.03 2wqt h ILE 41 Ca 0.16 -0.22 0.06 0.00 1.00 0.00 0.00 64.86 65.86 2wqt h ILE 41 Cb 0.52 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 2wqt h ILE 41 CO 0.03 0.09 0.40 -0.61 0.00 0.00 0.00 178.15 178.06 2wqt h GLN 42 N 0.27 0.72 -0.35 2.37 4.15 -1.29 -2.45 115.11 118.52 2wqt h GLN 42 Ca 0.08 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.44 2wqt h GLN 42 Cb 0.03 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.54 2wqt h GLN 42 CO -0.01 0.48 0.14 1.25 -1.93 0.00 0.00 178.83 178.75 2wqt h HIS 43 N 0.74 0.53 -0.48 3.99 2.76 -0.71 -0.81 115.15 121.17 2wqt h HIS 43 Ca 0.32 -0.04 0.10 0.00 -2.20 0.00 0.00 60.37 58.54 2wqt h HIS 43 Cb 0.19 -0.16 -0.09 0.00 1.55 0.00 0.00 27.41 28.90 2wqt h HIS 43 CO -0.07 0.50 -0.14 0.82 -1.30 0.00 0.00 177.93 177.74 2wqt h ILE 44 N 0.42 0.48 -0.18 6.26 1.08 -0.40 0.11 117.51 125.27 2wqt h ILE 44 Ca 0.12 0.00 -0.14 0.00 -0.39 0.00 0.00 64.86 64.45 2wqt h ILE 44 Cb 0.19 0.48 -0.01 0.00 -3.07 0.00 0.00 36.82 34.41 2wqt h ILE 44 CO -0.01 0.00 -0.47 0.78 -0.69 0.00 0.00 178.15 177.76 2wqt h ASN 45 N -0.03 0.49 -0.23 1.72 2.35 -1.18 -0.55 115.58 118.15 2wqt h ASN 45 Ca 0.23 -0.23 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 2wqt h ASN 45 Cb 0.38 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 2wqt h ASN 45 CO -0.51 0.88 0.04 0.58 -1.65 0.00 0.00 177.43 176.77 2wqt h VAL 46 N 0.36 1.22 -0.78 2.81 2.07 -0.78 -2.25 116.25 118.91 2wqt h VAL 46 Ca 0.02 -0.75 0.03 0.00 0.82 0.00 0.00 66.70 66.82 2wqt h VAL 46 Cb 0.96 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 2wqt h VAL 46 CO 0.08 0.23 0.50 -0.61 0.02 0.00 0.00 177.57 177.80 2wqt h GLN 47 N 0.18 0.96 -0.24 1.57 5.75 -0.75 -0.30 115.11 122.27 2wqt h GLN 47 Ca 0.07 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2wqt h GLN 47 Cb 0.32 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.64 2wqt h GLN 47 CO 0.00 0.63 0.14 1.25 -2.65 0.00 0.00 178.83 178.21 2wqt h HIS 48 N 0.99 0.33 -0.46 3.99 2.76 -1.05 -1.98 115.15 119.72 2wqt h HIS 48 Ca 0.30 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.37 2wqt h HIS 48 Cb -0.02 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 28.81 2wqt h HIS 48 CO -0.03 0.27 -0.11 -0.44 -1.30 0.00 0.00 177.93 176.33 2wqt h ASP 49 N 0.29 0.82 -0.81 3.26 5.19 -0.99 -2.87 116.42 121.32 2wqt h ASP 49 Ca 0.09 -0.25 -0.03 0.00 -0.62 0.00 0.00 57.03 56.22 2wqt h ASP 49 Cb 0.05 -0.22 -0.04 0.00 0.18 0.00 0.00 39.33 39.30 2wqt h ASP 49 CO -0.01 0.95 0.40 0.58 -3.12 0.00 0.00 179.24 178.04 2wqt h VAL 50 N 0.75 1.25 0.00 -1.35 2.07 -0.89 -1.58 116.25 116.50 2wqt h VAL 50 Ca 0.13 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 2wqt h VAL 50 Cb 0.61 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2wqt h VAL 50 CO 0.04 0.30 -0.02 0.00 0.02 0.00 0.00 177.57 177.90 2wqt h ALA 51 N 1.28 1.25 -0.55 1.67 0.00 -1.14 0.62 119.26 122.40 2wqt h ALA 51 Ca 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2wqt h ALA 51 Cb 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2wqt h ALA 51 CO -0.04 0.03 0.00 1.04 0.00 0.00 0.00 179.25 180.28 2wqt n GLN 52 N -3.47 2.38 -0.48 0.00 6.02 -0.67 -4.94 117.38 116.22 2wqt n GLN 52 Ca -0.03 -2.01 0.00 0.00 -0.01 0.00 0.00 57.00 54.95 2wqt n GLN 52 Cb 0.12 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 29.91 2wqt n GLN 52 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wqt n GLY 53 N 1.33 0.75 3.75 1.08 0.00 0.21 -5.04 105.19 107.26 2wqt n GLY 53 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2wqt n GLY 53 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wqt s ARG 54 N -0.52 4.34 -0.27 1.61 3.52 -0.75 -4.99 118.95 121.89 2wqt s ARG 54 Ca 0.00 2.17 -0.09 0.00 -0.13 0.00 0.00 55.73 57.67 2wqt s ARG 54 Cb 0.00 -3.14 -0.03 0.00 -1.56 0.00 0.00 34.95 30.21 2wqt s ARG 54 CO 0.00 -0.29 0.14 0.50 -0.81 0.00 0.00 175.30 174.83 2wqt s ARG 55 N -0.51 3.74 0.09 5.12 3.52 -1.26 -4.27 118.95 125.38 2wqt s ARG 55 Ca 0.56 -0.44 -0.31 0.00 -0.13 0.00 0.00 55.73 55.41 2wqt s ARG 55 Cb -0.39 -3.51 -0.07 0.00 -1.56 0.00 0.00 34.95 29.42 2wqt s ARG 55 CO 0.42 -0.22 1.32 0.08 -0.81 0.00 0.00 175.30 176.09 2wqt s VAL 56 N 1.68 3.58 -0.13 7.11 1.01 -1.26 -1.04 120.40 131.34 2wqt s VAL 56 Ca 0.06 1.13 0.03 0.00 0.00 0.00 0.00 61.98 63.21 2wqt s VAL 56 Cb -0.16 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 2wqt s VAL 56 CO 0.07 0.08 0.13 1.33 0.00 0.00 0.00 175.10 176.72 2wqt n VAL 57 N 3.96 0.00 -3.77 2.92 0.24 0.04 -4.86 118.33 116.86 2wqt n VAL 57 Ca 0.11 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 2wqt n VAL 57 Cb 0.44 0.90 0.00 0.00 -1.47 0.00 0.00 33.84 33.71 2wqt n VAL 57 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wqt n GLY 58 N 1.28 -0.58 3.23 7.63 0.00 -1.22 -1.00 105.19 114.54 2wqt n GLY 58 Ca 0.00 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.88 2wqt n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wqt s ARG 59 N -1.55 1.03 -0.04 1.61 1.81 -0.79 -1.12 118.95 119.89 2wqt s ARG 59 Ca 0.00 -1.46 0.06 0.00 -1.72 0.00 0.00 55.73 52.61 2wqt s ARG 59 Cb 0.00 -0.40 -0.02 0.00 -0.45 0.00 0.00 34.95 34.08 2wqt s ARG 59 CO 0.00 -0.02 -0.21 0.21 -0.68 0.00 0.00 175.30 174.60 2wqt s LYS 60 N -3.83 2.40 -0.18 3.54 2.36 0.31 -1.70 119.74 122.64 2wqt s LYS 60 Ca 0.18 -0.83 -0.08 0.00 -2.55 0.00 0.00 55.97 52.69 2wqt s LYS 60 Cb 0.05 -2.22 -0.04 0.00 -1.05 0.00 0.00 37.83 34.56 2wqt s LYS 60 CO 0.00 0.53 0.08 0.08 1.55 0.00 0.00 175.35 177.60 2wqt s VAL 61 N -0.52 4.95 0.39 4.02 1.01 0.52 -1.23 120.40 129.54 2wqt s VAL 61 Ca 0.07 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.12 2wqt s VAL 61 Cb -0.11 -3.23 -0.06 0.00 0.00 0.00 0.00 36.38 32.98 2wqt s VAL 61 CO 0.01 0.46 0.04 -0.83 0.00 0.00 0.00 175.10 174.78 2wqt s GLY 62 N 0.30 2.44 -1.19 4.51 0.00 -0.41 -3.43 107.32 109.54 2wqt s GLY 62 Ca 0.05 -1.75 -0.12 0.00 0.00 0.00 0.00 44.72 42.90 2wqt s GLY 62 CO -0.00 -1.97 0.76 1.04 0.00 0.00 0.00 173.10 172.92 2wqt n LEU 63 N -0.90 -3.27 -0.08 0.66 4.77 -1.26 -1.28 117.00 115.64 2wqt n LEU 63 Ca -0.06 -0.93 0.11 0.00 -0.03 0.00 0.00 56.01 55.10 2wqt n LEU 63 Cb 0.67 -2.56 0.03 0.00 -2.33 0.00 0.00 43.42 39.22 2wqt n LEU 63 CO 0.43 0.40 0.18 0.35 -1.33 0.00 0.00 177.39 177.42 2wqt n THR 64 N -4.08 0.00 -3.18 -5.08 -2.24 -1.26 -4.18 114.28 94.26 2wqt n THR 64 Ca -0.16 -0.04 -0.40 0.00 -2.27 0.00 0.00 64.05 61.18 2wqt n THR 64 Cb 0.62 0.78 -0.06 0.00 -2.10 0.00 0.00 70.33 69.57 2wqt n THR 64 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2wqt s HIS 65 N -2.90 3.34 0.57 4.78 3.76 -1.26 -1.85 115.29 121.73 2wqt s HIS 65 Ca 0.11 0.81 0.37 0.00 -0.15 0.00 0.00 55.06 56.20 2wqt s HIS 65 Cb 0.17 -2.75 2.04 0.00 1.11 0.00 0.00 32.58 33.15 2wqt s HIS 65 CO 0.76 -0.19 2.27 -1.35 -0.85 0.00 0.00 174.74 175.39 2wqt h PRO 66 N 7.62 0.00 0.85 8.40 0.11 -1.88 -1.49 132.00 145.61 2wqt h PRO 66 Ca -0.31 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.76 2wqt h PRO 66 Cb 1.14 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.26 2wqt h PRO 66 CO 0.75 0.02 -0.44 0.87 -0.21 0.00 0.00 178.00 178.99 2wqt h LYS 67 N 0.00 -1.14 -0.62 1.05 1.57 -1.98 -2.49 116.57 112.96 2wqt h LYS 67 Ca -0.00 0.08 0.09 0.00 -1.87 0.00 0.00 60.65 58.94 2wqt h LYS 67 Cb 0.08 0.26 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 2wqt h LYS 67 CO 0.00 -0.76 0.41 0.28 -0.57 0.00 0.00 179.45 178.82 2wqt h VAL 68 N -1.18 0.94 -0.08 0.50 2.07 -1.80 -1.67 116.25 115.02 2wqt h VAL 68 Ca -0.12 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 2wqt h VAL 68 Cb 0.91 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 2wqt h VAL 68 CO 0.17 0.09 0.05 1.56 0.02 0.00 0.00 177.57 179.46 2wqt h GLN 69 N 0.50 0.11 0.01 1.57 4.20 -1.29 -3.01 115.11 117.21 2wqt h GLN 69 Ca 0.28 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.98 2wqt h GLN 69 Cb 0.44 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2wqt h GLN 69 CO -0.08 0.14 -0.01 1.96 -0.67 0.00 0.00 178.83 180.17 2wqt h GLN 70 N 0.06 -0.02 0.00 1.46 1.08 -0.95 -0.68 115.11 116.06 2wqt h GLN 70 Ca 0.03 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 2wqt h GLN 70 Cb 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 2wqt h GLN 70 CO -0.01 0.20 0.02 0.94 -0.95 0.00 0.00 178.83 179.03 2wqt n GLN 71 N -5.00 0.00 0.00 1.46 7.27 -0.68 -1.12 117.38 119.31 2wqt n GLN 71 Ca -0.08 0.10 0.00 0.00 0.07 0.00 0.00 57.00 57.10 2wqt n GLN 71 Cb 0.13 -1.52 0.00 0.00 2.41 0.00 0.00 30.24 31.26 2wqt n GLN 71 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 2wqt n LEU 72 N -1.05 0.62 0.00 1.69 4.32 -1.03 -5.04 117.00 116.50 2wqt n LEU 72 Ca 0.00 -0.62 0.00 0.00 -0.02 0.00 0.00 56.01 55.37 2wqt n LEU 72 Cb 0.02 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.82 2wqt n LEU 72 CO 0.00 0.15 0.00 0.61 -1.22 0.00 0.00 177.39 176.93 2wqt n GLY 73 N -0.10 0.67 3.34 -0.72 0.00 -0.28 -4.24 105.19 103.85 2wqt n GLY 73 Ca 0.00 -0.27 -0.17 0.00 0.00 0.00 0.00 46.02 45.58 2wqt n GLY 73 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wqt s VAL 74 N -2.00 0.89 0.00 1.61 -7.23 -0.31 -5.01 120.40 108.35 2wqt s VAL 74 Ca 0.00 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.16 2wqt s VAL 74 Cb 0.00 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.47 2wqt s VAL 74 CO 0.00 -0.20 0.89 -0.90 -0.31 0.00 0.00 175.10 174.58 2wqt n ASP 75 N -0.46 1.71 -4.69 4.85 5.68 -1.26 -3.62 116.55 118.76 2wqt n ASP 75 Ca -0.03 -1.80 -0.30 0.00 -0.50 0.00 0.00 54.79 52.16 2wqt n ASP 75 Cb 0.65 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.55 2wqt n ASP 75 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 2wqt s GLN 76 N -0.80 2.55 0.00 0.11 -1.52 -1.26 -5.13 119.66 113.61 2wqt s GLN 76 Ca 0.00 -0.83 0.00 0.00 -1.95 0.00 0.00 55.36 52.58 2wqt s GLN 76 Cb 0.00 -2.54 0.00 0.00 -0.22 0.00 0.00 33.01 30.25 2wqt s GLN 76 CO 0.00 0.54 0.00 -0.35 -0.25 0.00 0.00 175.29 175.23 2wqt n PRO 77 N 0.58 2.20 -3.87 2.91 -0.04 -1.26 -4.95 135.00 130.57 2wqt n PRO 77 Ca -0.11 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.24 2wqt n PRO 77 Cb 0.52 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.87 2wqt n PRO 77 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2wqt s ASP 78 N -1.00 0.00 0.04 3.54 3.68 -0.40 -4.97 116.67 117.56 2wqt s ASP 78 Ca 0.00 -0.11 0.03 0.00 2.13 0.00 0.00 52.55 54.60 2wqt s ASP 78 Cb 0.00 0.22 -0.02 0.00 -1.45 0.00 0.00 42.92 41.67 2wqt s ASP 78 CO 0.00 -0.28 -0.10 0.72 0.13 0.00 0.00 175.17 175.64 2wqt s PHE 79 N -1.03 0.86 0.24 -5.34 -0.71 -1.26 -1.29 117.98 109.46 2wqt s PHE 79 Ca -0.11 -0.42 0.03 0.00 -1.04 0.00 0.00 56.93 55.40 2wqt s PHE 79 Cb -0.06 -0.51 -0.05 0.00 -1.21 0.00 0.00 43.02 41.19 2wqt s PHE 79 CO 0.01 -0.02 0.01 0.20 -1.34 0.00 0.00 175.22 174.08 2wqt s GLY 80 N -1.36 1.63 -0.13 1.99 0.00 -0.36 -4.38 107.32 104.71 2wqt s GLY 80 Ca -0.05 -1.81 -0.04 0.00 0.00 0.00 0.00 44.72 42.82 2wqt s GLY 80 CO 0.01 -1.68 0.02 -1.59 0.00 0.00 0.00 173.10 169.86 2wqt s THR 81 N -3.44 4.44 -0.13 0.90 2.01 -1.26 -0.53 115.64 117.63 2wqt s THR 81 Ca 0.30 -0.18 -0.05 0.00 0.31 0.00 0.00 61.69 62.08 2wqt s THR 81 Cb 0.06 -2.93 -0.04 0.00 0.01 0.00 0.00 72.50 69.61 2wqt s THR 81 CO 0.10 0.54 0.04 -0.76 -0.69 0.00 0.00 174.62 173.85 2wqt s LEU 82 N -0.27 3.73 0.08 4.42 1.43 -0.28 -4.91 118.68 122.89 2wqt s LEU 82 Ca 0.07 0.13 0.06 0.00 -1.03 0.00 0.00 54.13 53.36 2wqt s LEU 82 Cb -0.12 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 2wqt s LEU 82 CO 0.02 0.29 -0.07 -0.36 0.23 0.00 0.00 176.35 176.46 2wqt s PHE 83 N -0.33 2.83 0.29 0.29 0.08 -1.26 -0.78 117.98 119.09 2wqt s PHE 83 Ca 0.08 -0.10 0.03 0.00 0.12 0.00 0.00 56.93 57.06 2wqt s PHE 83 Cb -0.12 -1.49 0.71 0.00 -0.57 0.00 0.00 43.02 41.55 2wqt s PHE 83 CO 0.02 0.43 1.69 0.00 -0.10 0.00 0.00 175.22 177.26 2wqt h ALA 84 N 3.71 1.39 0.00 5.36 0.00 -1.42 0.79 119.26 129.09 2wqt h ALA 84 Ca -0.48 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2wqt h ALA 84 Cb 1.17 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2wqt h ALA 84 CO 0.54 -0.35 0.00 -0.40 0.00 0.00 0.00 179.25 179.04 2wqt n ASP 85 N -5.07 0.00 -0.00 0.00 5.75 -1.26 -1.88 116.55 114.09 2wqt n ASP 85 Ca 0.21 0.41 0.14 0.00 -0.01 0.00 0.00 54.79 55.55 2wqt n ASP 85 Cb 0.64 -0.45 0.60 0.00 -1.03 0.00 0.00 41.12 40.88 2wqt n ASP 85 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 2wqt n MET 86 N -1.45 0.01 -3.20 0.11 2.81 0.27 -4.84 117.12 110.83 2wqt n MET 86 Ca 0.04 -0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.52 2wqt n MET 86 Cb 0.14 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.08 2wqt n MET 86 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2wqt s TYR 88 N 2.46 3.42 0.65 0.00 2.02 0.70 -4.99 117.35 121.61 2wqt s TYR 88 Ca 0.21 0.30 -0.11 0.00 -0.37 0.00 0.00 57.07 57.10 2wqt s TYR 88 Cb -0.15 -1.80 -0.02 0.00 -0.40 0.00 0.00 41.96 39.59 2wqt s TYR 88 CO 0.12 0.61 1.06 0.20 -1.57 0.00 0.00 175.55 175.96 2wqt s GLY 89 N -1.67 1.65 0.19 0.71 0.00 -1.26 -1.98 107.32 104.96 2wqt s GLY 89 Ca 0.23 -0.19 -0.33 0.00 0.00 0.00 0.00 44.72 44.44 2wqt s GLY 89 CO 0.14 0.12 1.34 1.34 0.00 0.00 0.00 173.10 176.04 2wqt n ASP 90 N -2.85 2.21 -2.32 1.64 4.64 -0.50 -2.78 116.55 116.59 2wqt n ASP 90 Ca 0.06 1.13 -0.17 0.00 -1.38 0.00 0.00 54.79 54.43 2wqt n ASP 90 Cb 0.55 -1.33 0.02 0.00 -1.04 0.00 0.00 41.12 39.32 2wqt n ASP 90 CO 0.00 0.00 0.00 -3.20 -0.82 0.00 0.00 177.20 173.18 2wqt n ASN 91 N 2.30 -5.11 -4.88 1.67 4.05 0.46 -4.96 115.26 108.79 2wqt n ASN 91 Ca 0.14 -0.19 -0.21 0.00 0.45 0.00 0.00 54.58 54.77 2wqt n ASN 91 Cb 0.28 -4.00 0.07 0.00 1.23 0.00 0.00 39.78 37.35 2wqt n ASN 91 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 177.26 173.51 2wqt s GLU 92 N -5.34 2.15 -0.22 1.20 2.12 -1.12 -4.87 118.70 112.62 2wqt s GLU 92 Ca 0.20 -1.23 -0.07 0.00 0.36 0.00 0.00 54.97 54.22 2wqt s GLU 92 Cb -0.09 -2.51 -0.04 0.00 0.26 0.00 0.00 34.13 31.76 2wqt s GLU 92 CO 0.25 -1.00 0.07 0.42 -0.54 0.00 0.00 175.26 174.46 2wqt s ILE 93 N -2.84 4.58 -0.20 -3.70 1.01 -1.26 -2.23 121.20 116.57 2wqt s ILE 93 Ca 0.62 -0.09 -0.09 0.00 0.00 0.00 0.00 60.65 61.09 2wqt s ILE 93 Cb -0.07 -3.11 -0.05 0.00 0.01 0.00 0.00 42.46 39.25 2wqt s ILE 93 CO 0.40 0.39 0.11 -0.63 0.00 0.00 0.00 174.94 175.21 2wqt s ILE 94 N 1.04 5.16 0.15 2.92 1.01 0.79 -4.94 121.20 127.33 2wqt s ILE 94 Ca 0.04 0.10 -0.31 0.00 0.00 0.00 0.00 60.65 60.48 2wqt s ILE 94 Cb -0.14 -3.35 -0.11 0.00 0.01 0.00 0.00 42.46 38.87 2wqt s ILE 94 CO 0.03 0.44 1.76 -2.84 0.00 0.00 0.00 174.94 174.33 2wqt s PRO 95 N 0.46 4.14 0.46 2.79 0.02 -1.26 -1.32 135.00 140.29 2wqt s PRO 95 Ca 0.06 2.56 0.12 0.00 0.02 0.00 0.00 61.00 63.77 2wqt s PRO 95 Cb -0.12 -3.41 1.06 0.00 0.02 0.00 0.00 34.50 32.06 2wqt s PRO 95 CO -0.00 -0.79 2.07 0.35 -0.33 0.00 0.00 177.00 178.30 2wqt h PHE 96 N 7.90 0.30 0.00 6.54 3.57 -1.90 -1.94 116.94 131.40 2wqt h PHE 96 Ca -0.45 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.06 2wqt h PHE 96 Cb 1.21 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.85 2wqt h PHE 96 CO 0.73 0.17 0.00 -1.13 -2.23 0.00 0.00 178.31 175.86 2wqt n SER 97 N -4.49 0.59 -0.17 0.41 3.41 -1.26 -3.89 113.62 108.23 2wqt n SER 97 Ca 0.03 0.59 -0.04 0.00 -0.26 0.00 0.00 58.87 59.19 2wqt n SER 97 Cb 0.17 -0.74 0.06 0.00 -0.26 0.00 0.00 64.21 63.43 2wqt n SER 97 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2wqt h ARG 98 N 0.00 0.45 -5.15 4.33 9.65 -1.73 -3.42 114.38 118.51 2wqt h ARG 98 Ca 0.00 -0.03 -0.66 0.00 -1.10 0.00 0.00 59.98 58.20 2wqt h ARG 98 Cb 0.52 -0.10 -0.28 0.00 -1.39 0.00 0.00 29.97 28.72 2wqt h ARG 98 CO 0.00 0.30 -0.75 0.08 2.80 0.00 0.00 179.97 182.39 2wqt s VAL 99 N -6.13 3.13 -0.14 0.20 1.01 -1.25 -5.06 120.40 112.16 2wqt s VAL 99 Ca -0.13 -0.60 -0.29 0.00 0.00 0.00 0.00 61.98 60.95 2wqt s VAL 99 Cb 0.14 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 34.14 2wqt s VAL 99 CO 0.73 0.48 1.08 -0.22 0.00 0.00 0.00 175.10 177.17 2wqt s LEU 100 N 0.94 4.20 -1.04 3.92 2.96 -1.26 -3.89 118.68 124.51 2wqt s LEU 100 Ca -0.02 1.56 -0.11 0.00 -0.22 0.00 0.00 54.13 55.34 2wqt s LEU 100 Cb -0.15 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 2wqt s LEU 100 CO -0.00 -0.57 0.83 0.00 -1.32 0.00 0.00 176.35 175.29 2wqt n GLN 101 N 5.58 -1.68 -2.76 1.98 6.02 -1.26 -1.13 117.38 124.12 2wqt n GLN 101 Ca 0.11 0.76 -0.37 0.00 -0.01 0.00 0.00 57.00 57.48 2wqt n GLN 101 Cb 0.47 -4.97 -0.06 0.00 1.02 0.00 0.00 30.24 26.70 2wqt n GLN 101 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2wqt s PRO 102 N -4.93 4.62 0.02 -1.09 0.04 -1.25 -4.05 135.00 128.36 2wqt s PRO 102 Ca 0.40 1.37 0.02 0.00 0.04 0.00 0.00 61.00 62.82 2wqt s PRO 102 Cb -0.10 -2.87 -0.01 0.00 0.04 0.00 0.00 34.50 31.56 2wqt s PRO 102 CO 0.80 0.30 -0.06 1.03 0.04 0.00 0.00 177.00 179.12 2wqt s ARG 103 N -1.92 0.42 0.09 4.56 3.00 -0.35 -1.82 118.95 122.93 2wqt s ARG 103 Ca 0.49 -0.44 0.06 0.00 0.00 0.00 0.00 55.73 55.83 2wqt s ARG 103 Cb -0.20 -0.28 -0.04 0.00 0.00 0.00 0.00 34.95 34.43 2wqt s ARG 103 CO 0.25 0.06 -0.05 0.96 0.00 0.00 0.00 175.30 176.52 2wqt s ILE 104 N -0.75 3.68 0.03 1.52 -5.25 -0.71 0.34 121.20 120.07 2wqt s ILE 104 Ca -0.05 -1.11 -0.00 0.00 -0.99 0.00 0.00 60.65 58.50 2wqt s ILE 104 Cb -0.06 -2.73 -0.03 0.00 2.95 0.00 0.00 42.46 42.60 2wqt s ILE 104 CO 0.00 0.13 -0.03 -1.83 -1.79 0.00 0.00 174.94 171.42 2wqt s GLU 105 N -2.21 0.40 0.06 0.37 -1.05 -0.43 -1.66 118.70 114.18 2wqt s GLU 105 Ca 0.23 -0.79 -0.18 0.00 -0.15 0.00 0.00 54.97 54.08 2wqt s GLU 105 Cb -0.11 0.14 -0.06 0.00 -0.44 0.00 0.00 34.13 33.65 2wqt s GLU 105 CO 0.15 -0.07 0.52 0.00 0.95 0.00 0.00 175.26 176.81 2wqt s ALA 106 N -2.21 3.62 0.09 -0.84 0.00 -1.26 -0.56 121.76 120.60 2wqt s ALA 106 Ca -0.09 -0.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.78 2wqt s ALA 106 Cb -0.05 -2.55 -0.03 0.00 0.00 0.00 0.00 23.12 20.49 2wqt s ALA 106 CO -0.04 0.43 0.08 -1.21 0.00 0.00 0.00 175.76 175.02 2wqt s GLU 107 N -1.15 0.79 -0.23 0.00 2.02 0.11 -0.85 118.70 119.40 2wqt s GLU 107 Ca 0.28 -1.20 -0.11 0.00 0.02 0.00 0.00 54.97 53.96 2wqt s GLU 107 Cb -0.18 0.27 -0.05 0.00 0.10 0.00 0.00 34.13 34.26 2wqt s GLU 107 CO 0.17 -0.21 0.16 0.42 0.02 0.00 0.00 175.26 175.82 2wqt s ILE 108 N -3.94 5.37 -0.08 -1.63 1.01 -1.26 -1.11 121.20 119.56 2wqt s ILE 108 Ca 0.11 0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.91 2wqt s ILE 108 Cb 0.07 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 2wqt s ILE 108 CO -0.07 0.37 0.13 0.00 0.00 0.00 0.00 174.94 175.38 2wqt s ALA 109 N 0.86 3.82 0.02 9.38 0.00 0.62 -1.85 121.76 134.62 2wqt s ALA 109 Ca 0.08 -0.70 0.09 0.00 0.00 0.00 0.00 51.96 51.42 2wqt s ALA 109 Cb -0.13 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.09 2wqt s ALA 109 CO 0.03 0.65 -0.25 -0.51 0.00 0.00 0.00 175.76 175.68 2wqt s LEU 110 N -1.29 2.13 -0.03 0.00 1.43 0.04 -1.12 118.68 119.83 2wqt s LEU 110 Ca 0.18 -0.54 0.06 0.00 -1.03 0.00 0.00 54.13 52.81 2wqt s LEU 110 Cb -0.12 -1.26 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 2wqt s LEU 110 CO 0.08 0.27 -0.22 -0.69 0.23 0.00 0.00 176.35 176.02 2wqt s VAL 111 N -0.74 2.36 -0.10 -1.59 1.01 -0.38 -0.42 120.40 120.55 2wqt s VAL 111 Ca 0.11 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 2wqt s VAL 111 Cb -0.10 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 2wqt s VAL 111 CO 0.01 0.58 0.12 -0.76 0.00 0.00 0.00 175.10 175.05 2wqt s LEU 112 N -0.58 4.23 0.36 3.92 1.43 -1.01 0.47 118.68 127.50 2wqt s LEU 112 Ca 0.09 0.39 0.18 0.00 -1.03 0.00 0.00 54.13 53.76 2wqt s LEU 112 Cb -0.11 -2.09 0.58 0.00 0.03 0.00 0.00 46.19 44.61 2wqt s LEU 112 CO 0.00 0.39 1.68 0.78 0.23 0.00 0.00 176.35 179.43 2wqt h ASN 113 N 4.87 0.00 -5.18 2.29 2.35 -0.77 -0.68 115.58 118.46 2wqt h ASN 113 Ca -0.53 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.16 2wqt h ASN 113 Cb 1.22 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 39.48 2wqt h ASN 113 CO 0.59 0.40 -0.12 0.00 -1.65 0.00 0.00 177.43 176.65 2wqt s ARG 114 N -3.49 1.35 0.55 0.81 3.03 -1.26 -4.68 118.95 115.26 2wqt s ARG 114 Ca 0.01 -1.05 -0.20 0.00 2.03 0.00 0.00 55.73 56.51 2wqt s ARG 114 Cb 0.10 0.46 -0.05 0.00 -1.03 0.00 0.00 34.95 34.44 2wqt s ARG 114 CO 0.69 -0.55 1.21 -0.51 -1.13 0.00 0.00 175.30 175.02 2wqt s ASP 115 N -2.94 5.49 -0.65 -2.89 1.01 -1.26 -3.45 116.67 111.98 2wqt s ASP 115 Ca 0.15 2.40 0.05 0.00 0.71 0.00 0.00 52.55 55.86 2wqt s ASP 115 Cb 0.00 -2.60 0.17 0.00 1.01 0.00 0.00 42.92 41.50 2wqt s ASP 115 CO 0.01 -1.39 0.47 -0.76 0.21 0.00 0.00 175.17 173.70 2wqt s LEU 116 N -3.71 4.21 0.34 1.23 1.43 -0.47 -4.91 118.68 116.81 2wqt s LEU 116 Ca 0.73 -3.71 0.18 0.00 -1.03 0.00 0.00 54.13 50.30 2wqt s LEU 116 Cb -0.31 -1.42 0.31 0.00 0.03 0.00 0.00 46.19 44.80 2wqt s LEU 116 CO 0.35 -0.10 1.56 1.55 0.23 0.00 0.00 176.35 179.94 2wqt h PRO 117 N 5.44 0.00 -6.25 1.29 0.13 -1.94 -3.37 132.00 127.30 2wqt h PRO 117 Ca 0.17 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.74 2wqt h PRO 117 Cb 0.78 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.89 2wqt h PRO 117 CO 0.66 0.35 0.82 0.00 -0.23 0.00 0.00 178.00 179.60 2wqt s ALA 118 N -3.17 3.58 -1.46 -0.56 0.00 -1.26 -4.84 121.76 114.06 2wqt s ALA 118 Ca 0.04 0.61 0.24 0.00 0.00 0.00 0.00 51.96 52.84 2wqt s ALA 118 Cb 0.08 -3.58 1.22 0.00 0.00 0.00 0.00 23.12 20.84 2wqt s ALA 118 CO 0.71 -0.97 1.79 0.25 0.00 0.00 0.00 175.76 177.54 2wqt n THR 119 N 4.96 0.23 -1.90 0.00 -2.24 -1.26 -2.99 114.28 111.07 2wqt n THR 119 Ca 0.13 0.06 -0.01 0.00 -2.27 0.00 0.00 64.05 61.96 2wqt n THR 119 Cb 0.45 -0.66 0.13 0.00 -2.10 0.00 0.00 70.33 68.15 2wqt n THR 119 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2wqt n ASP 120 N -1.27 2.22 -4.70 3.42 3.85 -1.26 -4.77 116.55 114.04 2wqt n ASP 120 Ca 0.12 -3.46 -0.43 0.00 -0.71 0.00 0.00 54.79 50.31 2wqt n ASP 120 Cb 0.19 -0.45 -0.02 0.00 -1.35 0.00 0.00 41.12 39.49 2wqt n ASP 120 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2wqt n ILE 121 N -0.74 1.34 -3.79 2.12 3.06 -1.16 -5.00 119.36 115.20 2wqt n ILE 121 Ca 0.21 -0.34 -0.22 0.00 -2.50 0.00 0.00 62.75 59.90 2wqt n ILE 121 Cb 0.83 -1.64 -0.02 0.00 0.54 0.00 0.00 39.64 39.35 2wqt n ILE 121 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 2wqt s THR 122 N -0.42 5.21 0.24 9.51 -4.23 -1.26 -4.98 115.64 119.72 2wqt s THR 122 Ca 0.62 -0.82 -0.07 0.00 -1.18 0.00 0.00 61.69 60.25 2wqt s THR 122 Cb -0.58 -3.86 0.25 0.00 1.34 0.00 0.00 72.50 69.65 2wqt s THR 122 CO 0.54 -0.39 1.65 0.15 -0.54 0.00 0.00 174.62 176.03 2wqt h PHE 123 N 1.07 0.06 -0.26 3.99 3.57 -1.94 -1.04 116.94 122.39 2wqt h PHE 123 Ca -0.51 0.05 -0.10 0.00 3.53 0.00 0.00 57.97 60.94 2wqt h PHE 123 Cb 1.23 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 2wqt h PHE 123 CO 0.47 -0.18 -0.26 0.38 -2.23 0.00 0.00 178.31 176.49 2wqt h ASP 124 N 0.15 0.50 -0.04 0.41 2.03 -2.00 -2.75 116.42 114.73 2wqt h ASP 124 Ca 0.40 -0.17 -0.11 0.00 -0.73 0.00 0.00 57.03 56.42 2wqt h ASP 124 Cb 0.70 -0.14 -0.01 0.00 -0.83 0.00 0.00 39.33 39.05 2wqt h ASP 124 CO -0.60 0.75 -0.33 -0.33 -1.03 0.00 0.00 179.24 177.71 2wqt h GLU 125 N 0.44 0.51 -0.57 4.15 5.08 -1.63 -2.81 114.58 119.75 2wqt h GLU 125 Ca 0.06 -0.22 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 2wqt h GLU 125 Cb 0.68 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2wqt h GLU 125 CO 0.05 0.77 0.09 1.25 -1.00 0.00 0.00 179.01 180.17 2wqt h LEU 126 N 0.44 0.87 -0.68 1.33 5.85 -1.13 -2.89 115.31 119.10 2wqt h LEU 126 Ca 0.05 -0.19 0.13 0.00 0.84 0.00 0.00 57.88 58.71 2wqt h LEU 126 Cb 0.78 -0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.49 2wqt h LEU 126 CO 0.06 0.88 0.20 1.88 -0.34 0.00 0.00 178.44 181.12 2wqt h TYR 127 N 0.87 0.32 0.00 1.25 0.05 -1.22 0.75 116.97 118.98 2wqt h TYR 127 Ca 0.18 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.99 2wqt h TYR 127 Cb 0.39 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.09 2wqt h TYR 127 CO 0.02 -0.01 0.00 -1.71 -1.05 0.00 0.00 178.16 175.42 2wqt n ASN 128 N -5.09 0.23 -0.16 3.88 2.85 -1.09 -2.67 115.26 113.21 2wqt n ASN 128 Ca 0.12 0.56 0.11 0.00 -0.11 0.00 0.00 54.58 55.26 2wqt n ASN 128 Cb 0.38 -0.61 -0.00 0.00 1.24 0.00 0.00 39.78 40.79 2wqt n ASN 128 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2wqt n ALA 129 N -1.59 4.14 -2.67 5.20 0.00 0.24 -4.89 120.51 120.93 2wqt n ALA 129 Ca 0.03 -0.57 -0.42 0.00 0.00 0.00 0.00 53.44 52.48 2wqt n ALA 129 Cb 0.17 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 2wqt n ALA 129 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2wqt s ILE 130 N -2.82 4.79 -0.20 0.00 1.01 -1.09 -0.07 121.20 122.83 2wqt s ILE 130 Ca 0.13 1.90 -0.18 0.00 0.00 0.00 0.00 60.65 62.49 2wqt s ILE 130 Cb 0.17 -4.25 -0.15 0.00 0.01 0.00 0.00 42.46 38.24 2wqt s ILE 130 CO 0.74 -0.03 0.10 1.21 0.00 0.00 0.00 174.94 176.95 2wqt n GLU 131 N 5.41 0.54 -4.20 2.79 2.13 0.18 -4.73 120.64 122.75 2wqt n GLU 131 Ca 0.08 0.55 -0.17 0.00 0.66 0.00 0.00 57.16 58.29 2wqt n GLU 131 Cb 0.48 -1.73 -0.13 0.00 0.27 0.00 0.00 31.44 30.34 2wqt n GLU 131 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2wqt s TRP 132 N -2.34 0.85 -0.09 4.31 0.52 -1.09 -4.58 118.94 116.52 2wqt s TRP 132 Ca -0.26 -0.34 0.04 0.00 0.02 0.00 0.00 56.10 55.56 2wqt s TRP 132 Cb 0.05 -0.51 -0.00 0.00 -1.15 0.00 0.00 33.47 31.86 2wqt s TRP 132 CO 0.50 -0.02 -0.24 0.54 0.02 0.00 0.00 176.95 177.75 2wqt s VAL 133 N -0.87 2.07 0.04 4.03 0.11 0.40 -1.25 120.40 124.93 2wqt s VAL 133 Ca -0.02 -1.03 -0.03 0.00 -2.93 0.00 0.00 61.98 57.97 2wqt s VAL 133 Cb -0.07 -1.78 -0.02 0.00 -1.53 0.00 0.00 36.38 32.98 2wqt s VAL 133 CO 0.01 0.56 0.02 -1.48 -3.33 0.00 0.00 175.10 170.88 2wqt s LEU 134 N 0.23 2.13 0.33 2.54 2.34 -0.27 -1.70 118.68 124.28 2wqt s LEU 134 Ca -0.16 -0.67 -0.26 0.00 0.06 0.00 0.00 54.13 53.10 2wqt s LEU 134 Cb -0.17 0.35 -0.10 0.00 -0.56 0.00 0.00 46.19 45.71 2wqt s LEU 134 CO 0.08 -0.49 0.94 -2.16 -1.06 0.00 0.00 176.35 173.66 2wqt s PRO 135 N -2.74 4.56 0.04 1.48 0.04 -1.26 -0.27 135.00 136.84 2wqt s PRO 135 Ca -0.04 1.31 -0.02 0.00 0.04 0.00 0.00 61.00 62.28 2wqt s PRO 135 Cb -0.01 -2.76 -0.02 0.00 0.04 0.00 0.00 34.50 31.75 2wqt s PRO 135 CO -0.05 0.26 0.02 0.00 0.04 0.00 0.00 177.00 177.27 2wqt s ALA 136 N -1.65 0.17 -0.07 8.56 0.00 -0.27 -1.02 121.76 127.49 2wqt s ALA 136 Ca 0.51 -0.77 0.02 0.00 0.00 0.00 0.00 51.96 51.71 2wqt s ALA 136 Cb -0.18 0.23 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 2wqt s ALA 136 CO 0.23 -0.29 -0.10 -0.51 0.00 0.00 0.00 175.76 175.10 2wqt s LEU 137 N -2.17 2.98 -0.22 0.00 1.43 -0.05 -0.72 118.68 119.94 2wqt s LEU 137 Ca -0.05 -0.11 -0.04 0.00 -1.03 0.00 0.00 54.13 52.90 2wqt s LEU 137 Cb -0.01 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.56 2wqt s LEU 137 CO -0.05 0.33 -0.04 -0.70 0.23 0.00 0.00 176.35 176.12 2wqt s GLU 138 N -0.65 3.39 -0.68 1.70 2.12 0.27 -0.69 118.70 124.17 2wqt s GLU 138 Ca 0.10 -0.62 -0.20 0.00 0.36 0.00 0.00 54.97 54.61 2wqt s GLU 138 Cb -0.11 -3.00 0.11 0.00 0.26 0.00 0.00 34.13 31.39 2wqt s GLU 138 CO 0.01 -0.17 0.85 0.08 -0.54 0.00 0.00 175.26 175.49 2wqt s VAL 139 N 1.41 4.72 0.52 3.70 1.01 -0.03 -1.31 120.40 130.41 2wqt s VAL 139 Ca 0.05 -1.01 -0.15 0.00 0.00 0.00 0.00 61.98 60.87 2wqt s VAL 139 Cb -0.14 -4.59 -0.07 0.00 0.00 0.00 0.00 36.38 31.57 2wqt s VAL 139 CO -0.03 -1.28 0.98 0.68 0.00 0.00 0.00 175.10 175.45 2wqt s VAL 140 N 2.91 4.57 0.09 2.92 -7.23 0.15 -1.58 120.40 122.24 2wqt s VAL 140 Ca 0.18 1.13 -0.06 0.00 -1.81 0.00 0.00 61.98 61.42 2wqt s VAL 140 Cb -0.18 -3.74 -0.02 0.00 0.56 0.00 0.00 36.38 33.00 2wqt s VAL 140 CO 0.04 -0.74 0.13 -0.83 -0.31 0.00 0.00 175.10 173.39 2wqt s GLY 141 N -3.23 0.32 -0.08 2.32 0.00 -0.31 -1.22 107.32 105.13 2wqt s GLY 141 Ca 0.58 -0.89 0.02 0.00 0.00 0.00 0.00 44.72 44.43 2wqt s GLY 141 CO 0.34 -1.00 -0.13 -0.45 0.00 0.00 0.00 173.10 171.86 2wqt s SER 142 N -2.91 1.96 0.00 1.64 0.15 -0.29 -4.25 113.70 110.01 2wqt s SER 142 Ca 0.09 -0.33 0.29 0.00 0.70 0.00 0.00 55.95 56.70 2wqt s SER 142 Cb 0.06 -0.89 1.33 0.00 -1.71 0.00 0.00 66.02 64.81 2wqt s SER 142 CO -0.08 0.03 1.90 0.54 1.20 0.00 0.00 173.24 176.83 2wqt n ARG 143 N 3.92 1.43 -4.22 5.44 3.00 -1.26 -4.52 116.66 120.44 2wqt n ARG 143 Ca -0.21 -0.64 -0.34 0.00 -0.01 0.00 0.00 57.85 56.65 2wqt n ARG 143 Cb 0.52 -1.49 -0.10 0.00 0.00 0.00 0.00 32.46 31.39 2wqt n ARG 143 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2wqt s ILE 144 N -2.01 4.41 -0.13 0.55 1.01 -1.26 -0.90 121.20 122.87 2wqt s ILE 144 Ca 0.41 -0.18 -0.33 0.00 0.00 0.00 0.00 60.65 60.55 2wqt s ILE 144 Cb 0.21 -2.94 -0.16 0.00 0.01 0.00 0.00 42.46 39.59 2wqt s ILE 144 CO 0.35 0.51 0.98 -1.14 0.00 0.00 0.00 174.94 175.64 2wqt n ARG 145 N 3.14 0.00 -2.89 2.79 0.63 0.38 -2.79 116.66 117.93 2wqt n ARG 145 Ca -0.17 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.59 2wqt n ARG 145 Cb 0.53 -1.18 -0.00 0.00 0.45 0.00 0.00 32.46 32.26 2wqt n ARG 145 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2wqt n ASP 146 N 1.82 -3.59 -1.91 6.15 8.00 -1.26 -0.99 116.55 124.78 2wqt n ASP 146 Ca 0.19 -0.06 -0.12 0.00 0.71 0.00 0.00 54.79 55.50 2wqt n ASP 146 Cb 0.03 -3.02 -0.03 0.00 -0.02 0.00 0.00 41.12 38.07 2wqt n ASP 146 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2wqt n TRP 147 N -3.58 -0.92 -2.47 1.24 7.02 -1.12 -4.86 117.44 112.76 2wqt n TRP 147 Ca -0.07 0.00 -0.39 0.00 -1.02 0.00 0.00 57.50 56.02 2wqt n TRP 147 Cb 0.57 -2.63 -0.02 0.00 -2.42 0.00 0.00 31.31 26.81 2wqt n TRP 147 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2wqt s SER 148 N -2.04 6.36 -0.07 -0.99 0.15 -0.16 -4.93 113.70 112.03 2wqt s SER 148 Ca 0.00 -1.83 0.04 0.00 0.70 0.00 0.00 55.95 54.86 2wqt s SER 148 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 2wqt s SER 148 CO 0.00 -1.65 -0.18 -0.51 1.20 0.00 0.00 173.24 172.10 2wqt s ILE 149 N 5.79 1.56 0.49 6.45 1.10 -1.26 -4.78 121.20 130.54 2wqt s ILE 149 Ca 0.54 -0.75 0.06 0.00 -0.51 0.00 0.00 60.65 60.00 2wqt s ILE 149 Cb 0.01 -1.36 0.01 0.00 0.15 0.00 0.00 42.46 41.27 2wqt s ILE 149 CO 0.01 0.45 0.36 -1.10 -2.11 0.00 0.00 174.94 172.54 2wqt s GLN 150 N 0.32 2.32 0.17 3.50 -1.52 -1.26 -4.98 119.66 118.22 2wqt s GLN 150 Ca -0.12 -1.87 -0.21 0.00 -1.95 0.00 0.00 55.36 51.21 2wqt s GLN 150 Cb -0.15 -2.15 0.09 0.00 -0.22 0.00 0.00 33.01 30.59 2wqt s GLN 150 CO 0.05 -0.42 1.60 0.35 -0.25 0.00 0.00 175.29 176.62 2wqt h PHE 151 N 0.94 -0.81 -0.30 0.91 3.57 -1.89 -1.18 116.94 118.18 2wqt h PHE 151 Ca -0.39 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.15 2wqt h PHE 151 Cb 1.28 0.42 -0.02 0.00 2.79 0.00 0.00 35.95 40.43 2wqt h PHE 151 CO 0.80 -0.36 0.10 -0.24 -2.23 0.00 0.00 178.31 176.38 2wqt h VAL 152 N -0.20 1.13 -0.08 1.41 3.04 -1.93 -2.18 116.25 117.45 2wqt h VAL 152 Ca 0.20 -0.41 -0.01 0.00 -1.01 0.00 0.00 66.70 65.47 2wqt h VAL 152 Cb 0.52 0.79 -0.00 0.00 -2.01 0.00 0.00 31.29 30.59 2wqt h VAL 152 CO -0.57 0.15 -0.01 0.44 -1.01 0.00 0.00 177.57 176.58 2wqt h ASP 153 N 0.42 0.14 0.03 3.17 3.32 -1.62 -2.86 116.42 119.02 2wqt h ASP 153 Ca 0.10 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 2wqt h ASP 153 Cb 0.11 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2wqt h ASP 153 CO -0.01 0.44 -0.01 0.74 -1.72 0.00 0.00 179.24 178.67 2wqt h THR 154 N -0.15 1.03 -0.21 0.35 2.02 -1.15 -2.11 112.91 112.69 2wqt h THR 154 Ca 0.02 -0.19 0.04 0.00 0.77 0.00 0.00 66.41 67.06 2wqt h THR 154 Cb 0.37 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 67.90 2wqt h THR 154 CO 0.01 0.05 -0.06 0.58 0.37 0.00 0.00 175.52 176.47 2wqt h VAL 155 N -0.12 0.78 -0.99 3.16 2.07 -1.48 0.33 116.25 120.00 2wqt h VAL 155 Ca -0.00 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.59 2wqt h VAL 155 Cb 0.11 0.78 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 2wqt h VAL 155 CO 0.01 0.00 0.63 0.00 0.02 0.00 0.00 177.57 178.23 2wqt h ALA 156 N 1.20 1.38 -0.12 1.67 0.00 -1.50 -1.94 119.26 119.95 2wqt h ALA 156 Ca 0.10 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2wqt h ALA 156 Cb 0.17 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2wqt h ALA 156 CO -0.22 0.40 0.09 -3.47 0.00 0.00 0.00 179.25 176.05 2wqt n ASP 157 N -4.53 4.05 -3.75 0.00 4.64 -0.09 -3.75 116.55 113.12 2wqt n ASP 157 Ca 0.15 -2.34 -0.24 0.00 -1.38 0.00 0.00 54.79 50.98 2wqt n ASP 157 Cb 0.20 -0.76 0.04 0.00 -1.04 0.00 0.00 41.12 39.56 2wqt n ASP 157 CO 0.00 0.00 0.00 -3.20 -0.82 0.00 0.00 177.20 173.18 2wqt n ASN 158 N 0.64 -2.83 -3.61 1.67 5.15 -0.73 -2.03 115.26 113.51 2wqt n ASN 158 Ca 0.08 -0.78 -0.27 0.00 -0.60 0.00 0.00 54.58 53.01 2wqt n ASN 158 Cb 0.60 -4.12 0.01 0.00 -0.53 0.00 0.00 39.78 35.73 2wqt n ASN 158 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2wqt n ALA 159 N -4.46 -1.15 -4.04 5.20 0.00 0.98 -1.89 120.51 115.15 2wqt n ALA 159 Ca -0.16 0.14 -0.32 0.00 0.00 0.00 0.00 53.44 53.10 2wqt n ALA 159 Cb 0.62 -3.60 -0.00 0.00 0.00 0.00 0.00 19.45 16.47 2wqt n ALA 159 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2wqt n SER 160 N -2.54 -3.24 -4.78 0.00 7.64 -0.86 -4.88 113.62 104.97 2wqt n SER 160 Ca 0.01 -0.92 -0.37 0.00 1.01 0.00 0.00 58.87 58.60 2wqt n SER 160 Cb 0.54 -3.28 -0.02 0.00 -1.01 0.00 0.00 64.21 60.43 2wqt n SER 160 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wqt n GLY 162 N 0.41 0.66 3.23 0.00 0.00 -0.95 -4.17 105.19 104.36 2wqt n GLY 162 Ca 0.06 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 2wqt n GLY 162 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wqt s VAL 163 N 0.10 0.05 0.05 1.61 -7.23 -0.62 -4.89 120.40 109.49 2wqt s VAL 163 Ca 0.00 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.15 2wqt s VAL 163 Cb 0.00 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.40 2wqt s VAL 163 CO 0.00 0.00 0.01 -0.72 -0.31 0.00 0.00 175.10 174.08 2wqt s TYR 164 N -3.98 0.41 -0.02 2.82 1.13 0.04 -0.85 117.35 116.90 2wqt s TYR 164 Ca 0.39 -0.90 0.03 0.00 -1.41 0.00 0.00 57.07 55.19 2wqt s TYR 164 Cb 0.06 -0.30 -0.00 0.00 -1.10 0.00 0.00 41.96 40.62 2wqt s TYR 164 CO 0.15 -0.38 -0.12 0.54 -2.51 0.00 0.00 175.55 173.23 2wqt s VAL 165 N -3.56 0.96 -0.10 -3.49 0.11 0.14 -0.22 120.40 114.24 2wqt s VAL 165 Ca 0.03 -0.49 0.01 0.00 -2.93 0.00 0.00 61.98 58.60 2wqt s VAL 165 Cb 0.05 -0.82 -0.02 0.00 -1.53 0.00 0.00 36.38 34.06 2wqt s VAL 165 CO -0.09 0.28 -0.11 -0.63 -3.33 0.00 0.00 175.10 171.22 2wqt s ILE 166 N -0.09 3.25 0.00 7.04 1.01 -0.84 -0.87 121.20 130.70 2wqt s ILE 166 Ca 0.01 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 60.04 2wqt s ILE 166 Cb -0.07 -2.34 0.00 0.00 0.01 0.00 0.00 42.46 40.06 2wqt s ILE 166 CO 0.00 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.10 2wqt n GLY 167 N 2.98 3.51 3.80 6.18 0.00 -0.19 -1.40 105.19 120.07 2wqt n GLY 167 Ca -0.18 -1.72 -0.04 0.00 0.00 0.00 0.00 46.02 44.09 2wqt n GLY 167 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wqt s GLY 168 N 0.00 -0.09 0.69 -0.02 0.00 -1.08 -4.68 107.32 102.14 2wqt s GLY 168 Ca 0.00 -0.07 -0.11 0.00 0.00 0.00 0.00 44.72 44.53 2wqt s GLY 168 CO 0.00 0.66 1.06 -4.14 0.00 0.00 0.00 173.10 170.68 2wqt s PRO 169 N -2.91 2.91 0.07 2.90 0.02 -1.25 -1.15 135.00 135.58 2wqt s PRO 169 Ca 0.15 1.01 -0.30 0.00 0.02 0.00 0.00 61.00 61.88 2wqt s PRO 169 Cb -0.02 -1.98 -0.05 0.00 0.02 0.00 0.00 34.50 32.46 2wqt s PRO 169 CO 0.04 -1.13 1.10 0.00 -0.33 0.00 0.00 177.00 176.69 2wqt s ALA 170 N -2.95 3.31 0.09 -1.55 0.00 -1.26 -4.65 121.76 114.75 2wqt s ALA 170 Ca 0.59 0.74 0.09 0.00 0.00 0.00 0.00 51.96 53.38 2wqt s ALA 170 Cb -0.15 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 2wqt s ALA 170 CO 0.53 -0.31 -0.23 -0.65 0.00 0.00 0.00 175.76 175.09 2wqt s GLN 171 N 0.74 1.69 0.37 0.00 -1.52 -0.69 -4.98 119.66 115.27 2wqt s GLN 171 Ca 0.54 -1.20 -0.18 0.00 -1.95 0.00 0.00 55.36 52.58 2wqt s GLN 171 Cb -0.27 -2.02 -0.10 0.00 -0.22 0.00 0.00 33.01 30.41 2wqt s GLN 171 CO 0.30 0.49 0.84 1.03 -0.25 0.00 0.00 175.29 177.69 2wqt s ARG 172 N -1.81 4.13 0.34 2.91 1.81 -1.26 -0.45 118.95 124.62 2wqt s ARG 172 Ca 0.15 0.89 0.12 0.00 -1.72 0.00 0.00 55.73 55.17 2wqt s ARG 172 Cb -0.10 -2.34 0.60 0.00 -0.45 0.00 0.00 34.95 32.65 2wqt s ARG 172 CO 0.06 0.08 1.75 -1.00 -0.68 0.00 0.00 175.30 175.51 2wqt h PRO 173 N 2.16 0.00 -6.25 3.54 0.13 -1.85 -3.41 132.00 126.32 2wqt h PRO 173 Ca -0.48 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.04 2wqt h PRO 173 Cb 1.18 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.32 2wqt h PRO 173 CO 0.63 0.46 1.15 0.00 -0.23 0.00 0.00 178.00 180.01 2wqt n ALA 174 N -2.44 0.98 0.00 -0.56 0.00 -1.26 -1.72 120.51 115.50 2wqt n ALA 174 Ca -0.02 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2wqt n ALA 174 Cb 0.48 -2.54 0.00 0.00 0.00 0.00 0.00 19.45 17.40 2wqt n ALA 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wqt n GLY 175 N 4.58 2.55 3.72 0.00 0.00 -1.26 -5.02 105.19 109.76 2wqt n GLY 175 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 2wqt n GLY 175 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wqt s LEU 176 N 0.00 4.38 -0.61 0.99 1.43 -0.70 -4.98 118.68 119.19 2wqt s LEU 176 Ca 0.00 2.46 -0.24 0.00 -1.03 0.00 0.00 54.13 55.32 2wqt s LEU 176 Cb 0.00 -3.60 0.05 0.00 0.03 0.00 0.00 46.19 42.67 2wqt s LEU 176 CO 0.00 -0.68 0.99 -0.62 0.23 0.00 0.00 176.35 176.27 2wqt s ASP 177 N 0.86 6.25 0.06 2.29 3.68 -1.26 -4.87 116.67 123.69 2wqt s ASP 177 Ca 0.64 -0.62 0.23 0.00 2.13 0.00 0.00 52.55 54.93 2wqt s ASP 177 Cb -0.39 -2.44 0.07 0.00 -1.45 0.00 0.00 42.92 38.70 2wqt s ASP 177 CO 0.34 -1.38 1.05 0.18 0.13 0.00 0.00 175.17 175.48 2wqt n LEU 178 N 7.77 0.62 -0.08 -1.34 4.77 -1.26 -4.24 117.00 123.24 2wqt n LEU 178 Ca -0.00 0.01 -0.19 0.00 -0.03 0.00 0.00 56.01 55.79 2wqt n LEU 178 Cb 0.47 -0.10 -0.12 0.00 -2.33 0.00 0.00 43.42 41.33 2wqt n LEU 178 CO 0.65 0.03 -0.20 0.50 -1.33 0.00 0.00 177.39 177.04 2wqt h LYS 179 N 0.00 0.03 -0.92 3.23 3.64 -1.92 -3.40 116.57 117.23 2wqt h LYS 179 Ca 0.00 -0.06 -0.59 0.00 -1.27 0.00 0.00 60.65 58.73 2wqt h LYS 179 Cb 0.74 0.02 -0.30 0.00 -0.41 0.00 0.00 32.23 32.28 2wqt h LYS 179 CO 0.00 1.03 0.57 0.09 -2.27 0.00 0.00 179.45 178.87 2wqt n ASN 180 N -4.42 6.05 -4.48 4.20 4.13 -1.26 -2.20 115.26 117.27 2wqt n ASN 180 Ca -0.24 -3.74 -0.43 0.00 1.68 0.00 0.00 54.58 51.85 2wqt n ASN 180 Cb 0.64 -0.85 -0.04 0.00 -1.54 0.00 0.00 39.78 37.99 2wqt n ASN 180 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2wqt s ALA 182 N 3.79 3.27 -0.07 0.00 0.00 -1.26 -2.57 121.76 124.93 2wqt s ALA 182 Ca 0.25 1.06 0.04 0.00 0.00 0.00 0.00 51.96 53.30 2wqt s ALA 182 Cb -0.15 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.56 2wqt s ALA 182 CO 0.14 -0.55 -0.17 1.41 0.00 0.00 0.00 175.76 176.59 2wqt s MET 183 N -2.07 2.10 -0.04 0.00 0.00 0.17 -0.70 119.30 118.75 2wqt s MET 183 Ca 0.54 -0.62 0.05 0.00 0.00 0.00 0.00 55.69 55.65 2wqt s MET 183 Cb -0.34 -1.71 -0.01 0.00 0.00 0.00 0.00 34.83 32.78 2wqt s MET 183 CO 0.43 0.16 -0.18 0.15 0.00 0.00 0.00 175.02 175.58 2wqt s LYS 184 N 0.32 1.86 -0.06 4.11 -0.14 -0.74 -2.10 119.74 122.99 2wqt s LYS 184 Ca -0.11 -0.65 0.04 0.00 -1.36 0.00 0.00 55.97 53.89 2wqt s LYS 184 Cb -0.15 -1.62 0.00 0.00 -1.68 0.00 0.00 37.83 34.38 2wqt s LYS 184 CO 0.04 0.27 -0.17 1.41 -0.76 0.00 0.00 175.35 176.14 2wqt s MET 185 N -0.03 1.97 0.05 1.68 1.75 -0.24 -0.28 119.30 124.21 2wqt s MET 185 Ca -0.03 -0.61 0.05 0.00 -1.25 0.00 0.00 55.69 53.85 2wqt s MET 185 Cb -0.11 -1.65 -0.04 0.00 2.84 0.00 0.00 34.83 35.87 2wqt s MET 185 CO 0.02 0.19 -0.08 0.95 -0.65 0.00 0.00 175.02 175.45 2wqt s THR 186 N 0.22 3.51 -0.16 10.11 -4.23 0.61 -0.92 115.64 124.79 2wqt s THR 186 Ca -0.08 -0.98 -0.02 0.00 -1.18 0.00 0.00 61.69 59.43 2wqt s THR 186 Cb -0.14 -2.57 -0.01 0.00 1.34 0.00 0.00 72.50 71.12 2wqt s THR 186 CO 0.04 0.28 -0.10 -0.60 -0.54 0.00 0.00 174.62 173.70 2wqt s ARG 187 N -1.74 3.41 -1.64 3.99 3.52 -0.40 -1.59 118.95 124.50 2wqt s ARG 187 Ca 0.19 -0.65 -0.09 0.00 -0.13 0.00 0.00 55.73 55.05 2wqt s ARG 187 Cb -0.11 -2.76 0.09 0.00 -1.56 0.00 0.00 34.95 30.60 2wqt s ARG 187 CO 0.10 0.10 0.33 0.09 -0.81 0.00 0.00 175.30 175.11 2wqt n ASN 188 N 3.87 -0.54 -0.01 -2.12 3.02 0.47 -1.72 115.26 118.22 2wqt n ASN 188 Ca -0.18 -1.20 -0.00 0.00 -0.03 0.00 0.00 54.58 53.17 2wqt n ASN 188 Cb 0.52 -1.96 -0.00 0.00 -0.61 0.00 0.00 39.78 37.73 2wqt n ASN 188 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2wqt n ASN 189 N -2.76 -3.23 -4.06 6.41 3.02 -1.26 -5.04 115.26 108.34 2wqt n ASN 189 Ca -0.15 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.18 2wqt n ASN 189 Cb 0.60 -0.75 -0.15 0.00 -0.61 0.00 0.00 39.78 38.87 2wqt n ASN 189 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2wqt s GLU 190 N -0.32 1.12 0.18 3.52 -1.05 -0.70 -5.03 118.70 116.42 2wqt s GLU 190 Ca 0.00 -0.42 -0.33 0.00 -0.15 0.00 0.00 54.97 54.07 2wqt s GLU 190 Cb 0.00 -1.05 -0.13 0.00 -0.44 0.00 0.00 34.13 32.51 2wqt s GLU 190 CO 0.00 0.21 1.57 -1.91 0.95 0.00 0.00 175.26 176.08 2wqt n GLU 191 N 3.03 2.23 0.00 -4.83 2.13 -1.26 -1.28 120.64 120.66 2wqt n GLU 191 Ca -0.16 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.46 2wqt n GLU 191 Cb 0.55 -2.56 0.00 0.00 0.27 0.00 0.00 31.44 29.69 2wqt n GLU 191 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 2wqt n VAL 192 N 3.21 0.00 -3.57 6.31 0.24 -0.10 -4.86 118.33 119.56 2wqt n VAL 192 Ca 0.16 -0.13 -0.17 0.00 -2.04 0.00 0.00 64.34 62.16 2wqt n VAL 192 Cb 0.30 0.64 -0.07 0.00 -1.47 0.00 0.00 33.84 33.25 2wqt n VAL 192 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2wqt s SER 193 N -0.76 -0.62 0.22 -1.34 0.15 -1.16 -4.94 113.70 105.26 2wqt s SER 193 Ca 0.00 0.78 -0.16 0.00 0.70 0.00 0.00 55.95 57.27 2wqt s SER 193 Cb 0.00 0.68 0.02 0.00 -1.71 0.00 0.00 66.02 65.01 2wqt s SER 193 CO 0.00 -0.52 0.53 -0.94 1.20 0.00 0.00 173.24 173.51 2wqt s SER 194 N -0.89 -0.20 0.00 5.45 1.04 -1.26 -1.08 113.70 116.76 2wqt s SER 194 Ca -0.09 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.70 2wqt s SER 194 Cb -0.02 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.70 2wqt s SER 194 CO 0.08 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 173.79 2wqt n GLY 195 N -0.36 -0.57 3.54 7.32 0.00 -0.89 -4.35 105.19 109.87 2wqt n GLY 195 Ca -0.07 -0.71 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 2wqt n GLY 195 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wqt s ARG 196 N -0.76 1.36 0.45 1.61 1.70 -1.00 -0.66 118.95 121.65 2wqt s ARG 196 Ca 0.00 -0.59 0.25 0.00 -0.47 0.00 0.00 55.73 54.93 2wqt s ARG 196 Cb 0.00 0.57 1.27 0.00 -0.57 0.00 0.00 34.95 36.23 2wqt s ARG 196 CO 0.00 -0.61 1.77 0.78 -1.08 0.00 0.00 175.30 176.16 2wqt h GLY 197 N 2.00 0.85 2.00 3.88 0.00 -1.44 -1.51 103.07 108.85 2wqt h GLY 197 Ca -0.29 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 46.90 2wqt h GLY 197 CO 0.34 -0.12 0.00 1.48 0.00 0.00 0.00 176.54 178.23 2wqt h SER 198 N 0.24 0.00 1.13 0.19 4.64 -1.63 -2.44 113.55 115.69 2wqt h SER 198 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 2wqt h SER 198 Cb 1.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.93 2wqt h SER 198 CO -0.22 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 175.41 2wqt h GLU 199 N 0.00 0.00 -3.67 4.77 5.08 -1.56 -2.56 114.58 116.63 2wqt h GLU 199 Ca 0.00 0.00 -0.79 0.00 -1.00 0.00 0.00 59.36 57.57 2wqt h GLU 199 Cb 0.37 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.36 2wqt h GLU 199 CO 0.00 0.00 0.60 0.00 -1.00 0.00 0.00 179.01 178.61 2wqt n LEU 201 N 2.97 -1.76 0.00 0.00 4.77 -0.77 -1.87 117.00 120.34 2wqt n LEU 201 Ca 0.26 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2wqt n LEU 201 Cb 0.39 -2.32 0.00 0.00 -2.33 0.00 0.00 43.42 39.16 2wqt n LEU 201 CO 0.50 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 2wqt n GLY 202 N -1.20 2.78 3.64 -0.72 0.00 -0.97 -4.76 105.19 103.96 2wqt n GLY 202 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2wqt n GLY 202 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wqt s HIS 203 N -0.88 -0.30 0.44 1.61 5.65 -0.78 -4.29 115.29 116.73 2wqt s HIS 203 Ca 0.00 0.60 0.21 0.00 0.25 0.00 0.00 55.06 56.12 2wqt s HIS 203 Cb 0.00 0.18 1.18 0.00 -1.18 0.00 0.00 32.58 32.76 2wqt s HIS 203 CO 0.00 -0.15 1.83 -1.35 -0.65 0.00 0.00 174.74 174.42 2wqt h PRO 204 N 5.61 0.31 0.00 2.88 0.11 -1.67 0.18 132.00 139.41 2wqt h PRO 204 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2wqt h PRO 204 Cb 1.17 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2wqt h PRO 204 CO 0.21 0.21 0.00 -0.07 -0.21 0.00 0.00 178.00 178.14 2wqt h LEU 205 N 0.32 0.00 -0.52 2.35 3.38 -1.93 -2.38 115.31 116.53 2wqt h LEU 205 Ca 0.51 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.38 2wqt h LEU 205 Cb 1.42 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.15 2wqt h LEU 205 CO -0.18 0.00 -0.07 0.78 0.09 0.00 0.00 178.44 179.07 2wqt h ASN 206 N 0.00 0.97 -0.76 -0.43 2.35 -0.94 0.85 115.58 117.62 2wqt h ASN 206 Ca 0.00 -0.34 -0.02 0.00 -0.55 0.00 0.00 56.30 55.39 2wqt h ASN 206 Cb 0.49 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.56 2wqt h ASN 206 CO 0.00 1.07 0.39 0.00 -1.65 0.00 0.00 177.43 177.25 2wqt h ALA 207 N 0.93 0.97 -0.51 -0.83 0.00 -1.47 0.17 119.26 118.51 2wqt h ALA 207 Ca 0.14 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2wqt h ALA 207 Cb 0.62 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2wqt h ALA 207 CO 0.04 0.51 0.05 0.00 0.00 0.00 0.00 179.25 179.85 2wqt h ALA 208 N 1.20 0.68 -0.03 0.00 0.00 -1.24 -1.24 119.26 118.63 2wqt h ALA 208 Ca 0.26 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2wqt h ALA 208 Cb 0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2wqt h ALA 208 CO -0.04 0.45 0.01 0.28 0.00 0.00 0.00 179.25 179.95 2wqt h VAL 209 N 0.74 1.11 -0.56 0.00 2.07 -0.56 0.31 116.25 119.36 2wqt h VAL 209 Ca 0.15 -0.32 0.10 0.00 0.82 0.00 0.00 66.70 67.45 2wqt h VAL 209 Cb 0.44 1.27 -0.08 0.00 -1.52 0.00 0.00 31.29 31.41 2wqt h VAL 209 CO 0.02 0.09 0.13 -0.25 0.02 0.00 0.00 177.57 177.58 2wqt h TRP 210 N -0.08 0.22 -0.22 1.57 7.01 -0.87 -1.97 115.95 121.60 2wqt h TRP 210 Ca 0.01 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.01 2wqt h TRP 210 Cb 0.13 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.17 2wqt h TRP 210 CO -0.03 0.00 0.02 1.25 -2.79 0.00 0.00 178.44 176.90 2wqt h LEU 211 N 0.28 0.36 -0.79 0.65 5.85 -0.98 -2.15 115.31 118.53 2wqt h LEU 211 Ca 0.28 -0.28 0.10 0.00 0.84 0.00 0.00 57.88 58.82 2wqt h LEU 211 Cb 0.39 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 2wqt h LEU 211 CO -0.35 0.55 0.43 0.00 -0.34 0.00 0.00 178.44 178.73 2wqt h ALA 212 N 0.82 1.12 0.12 1.25 0.00 -0.56 -0.72 119.26 121.28 2wqt h ALA 212 Ca 0.06 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2wqt h ALA 212 Cb 0.35 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2wqt h ALA 212 CO 0.01 0.04 -0.06 0.00 0.00 0.00 0.00 179.25 179.24 2wqt h ARG 213 N 0.72 -0.15 -0.17 0.00 3.08 -1.28 -1.88 114.38 114.69 2wqt h ARG 213 Ca 0.38 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.50 2wqt h ARG 213 Cb 0.38 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.40 2wqt h ARG 213 CO -0.26 0.12 -0.32 0.87 -1.07 0.00 0.00 179.97 179.31 2wqt h LYS 214 N -0.42 -0.35 -0.89 0.04 1.79 -1.01 -0.37 116.57 115.35 2wqt h LYS 214 Ca -0.02 0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.51 2wqt h LYS 214 Cb 0.34 0.08 -0.05 0.00 -1.58 0.00 0.00 32.23 31.02 2wqt h LYS 214 CO 0.03 -0.24 0.57 0.52 -1.08 0.00 0.00 179.45 179.25 2wqt h MET 215 N -0.37 1.08 -0.67 3.15 2.86 -1.14 -0.00 114.93 119.84 2wqt h MET 215 Ca 0.11 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.64 2wqt h MET 215 Cb 0.54 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.93 2wqt h MET 215 CO -0.38 0.72 0.24 0.00 1.06 0.00 0.00 176.91 178.55 2wqt h ALA 216 N 1.37 0.88 0.00 6.32 0.00 -0.84 -0.90 119.26 126.09 2wqt h ALA 216 Ca 0.35 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2wqt h ALA 216 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2wqt h ALA 216 CO -0.12 0.53 0.00 0.66 0.00 0.00 0.00 179.25 180.32 2wqt h SER 217 N 0.97 0.00 0.14 0.00 4.64 -0.07 -2.49 113.55 116.74 2wqt h SER 217 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2wqt h SER 217 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 2wqt h SER 217 CO -0.01 0.00 -0.02 0.18 -0.87 0.00 0.00 176.83 176.10 2wqt n LEU 218 N -3.05 0.37 -0.26 5.97 4.32 -0.11 -4.91 117.00 119.33 2wqt n LEU 218 Ca 0.03 -0.05 -0.03 0.00 -0.02 0.00 0.00 56.01 55.93 2wqt n LEU 218 Cb 0.46 -0.07 -0.01 0.00 -1.62 0.00 0.00 43.42 42.17 2wqt n LEU 218 CO 0.32 0.06 -0.03 0.61 -1.22 0.00 0.00 177.39 177.13 2wqt n GLY 219 N 1.13 0.64 2.50 -0.72 0.00 -0.94 -4.97 105.19 102.83 2wqt n GLY 219 Ca 0.20 -0.46 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 2wqt n GLY 219 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wqt n GLU 220 N -2.43 2.41 -1.70 1.61 1.02 -0.37 -5.03 120.64 116.15 2wqt n GLU 220 Ca -0.03 -4.49 -0.38 0.00 -0.02 0.00 0.00 57.16 52.23 2wqt n GLU 220 Cb 0.17 -2.11 0.05 0.00 -0.02 0.00 0.00 31.44 29.53 2wqt n GLU 220 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2wqt n PRO 221 N 0.64 1.35 -1.82 3.49 -0.02 -1.20 -4.42 135.00 133.03 2wqt n PRO 221 Ca 0.29 0.51 -0.41 0.00 -2.02 0.00 0.00 63.50 61.86 2wqt n PRO 221 Cb 0.43 -2.44 -0.02 0.00 -0.02 0.00 0.00 33.50 31.46 2wqt n PRO 221 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2wqt s LEU 222 N -3.13 4.35 0.16 2.45 1.43 -1.26 -4.87 118.68 117.80 2wqt s LEU 222 Ca 0.75 2.92 -0.01 0.00 -1.03 0.00 0.00 54.13 56.75 2wqt s LEU 222 Cb -0.42 -3.64 -0.04 0.00 0.03 0.00 0.00 46.19 42.12 2wqt s LEU 222 CO 0.47 -0.88 0.34 -0.13 0.23 0.00 0.00 176.35 176.39 2wqt s ARG 223 N -0.65 3.52 0.26 1.70 0.52 -1.26 -1.37 118.95 121.67 2wqt s ARG 223 Ca 0.61 -0.32 -0.30 0.00 -0.52 0.00 0.00 55.73 55.20 2wqt s ARG 223 Cb -0.47 -2.89 -0.13 0.00 0.52 0.00 0.00 34.95 31.98 2wqt s ARG 223 CO 0.49 0.47 1.30 -2.37 0.02 0.00 0.00 175.30 175.20 2wqt n THR 224 N -0.30 1.34 0.00 0.02 5.66 -1.22 -1.95 114.28 117.83 2wqt n THR 224 Ca -0.04 -0.33 0.00 0.00 -3.05 0.00 0.00 64.05 60.62 2wqt n THR 224 Cb 0.53 -1.36 0.00 0.00 -1.55 0.00 0.00 70.33 67.95 2wqt n THR 224 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2wqt n GLY 225 N 1.68 2.32 3.71 1.09 0.00 -0.26 -4.92 105.19 108.81 2wqt n GLY 225 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2wqt n GLY 225 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wqt n ASP 226 N 0.00 2.10 -4.71 1.61 10.43 -0.82 -4.66 116.55 120.51 2wqt n ASP 226 Ca 0.00 0.91 -0.35 0.00 2.57 0.00 0.00 54.79 57.92 2wqt n ASP 226 Cb 0.00 -1.53 -0.09 0.00 1.84 0.00 0.00 41.12 41.34 2wqt n ASP 226 CO 0.00 0.00 0.00 -0.51 -1.07 0.00 0.00 177.20 175.62 2wqt s ILE 227 N -1.35 4.51 -0.14 0.53 2.07 -0.17 -2.40 121.20 124.24 2wqt s ILE 227 Ca 0.75 -0.17 0.01 0.00 -1.41 0.00 0.00 60.65 59.84 2wqt s ILE 227 Cb -0.41 -2.92 0.02 0.00 0.13 0.00 0.00 42.46 39.27 2wqt s ILE 227 CO 0.47 0.60 -0.18 -0.63 -1.91 0.00 0.00 174.94 173.28 2wqt s ILE 228 N -0.81 1.81 -0.34 2.00 1.01 0.44 -1.89 121.20 123.42 2wqt s ILE 228 Ca 0.12 -0.80 -0.20 0.00 0.00 0.00 0.00 60.65 59.77 2wqt s ILE 228 Cb -0.12 -1.64 -0.00 0.00 0.01 0.00 0.00 42.46 40.71 2wqt s ILE 228 CO 0.02 0.50 0.60 -0.76 0.00 0.00 0.00 174.94 175.30 2wqt s LEU 229 N 1.14 4.25 0.00 2.97 1.43 -0.69 -0.78 118.68 127.00 2wqt s LEU 229 Ca -0.01 0.17 0.26 0.00 -1.03 0.00 0.00 54.13 53.52 2wqt s LEU 229 Cb -0.14 -2.74 1.16 0.00 0.03 0.00 0.00 46.19 44.50 2wqt s LEU 229 CO -0.07 -0.53 1.79 0.35 0.23 0.00 0.00 176.35 178.12 2wqt n THR 230 N 5.50 0.06 0.00 5.49 -2.24 -0.77 -0.36 114.28 121.95 2wqt n THR 230 Ca -0.02 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2wqt n THR 230 Cb 0.49 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 2wqt n THR 230 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wqt n GLY 231 N 1.07 2.94 3.73 3.38 0.00 -1.22 -4.76 105.19 110.33 2wqt n GLY 231 Ca 0.19 -1.96 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 2wqt n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wqt s ALA 232 N -2.99 3.70 -0.29 4.61 0.00 -1.26 -4.32 121.76 121.22 2wqt s ALA 232 Ca 0.00 1.34 0.21 0.00 0.00 0.00 0.00 51.96 53.51 2wqt s ALA 232 Cb 0.00 -3.59 0.11 0.00 0.00 0.00 0.00 23.12 19.64 2wqt s ALA 232 CO 0.00 -0.76 1.27 -0.07 0.00 0.00 0.00 175.76 176.20 2wqt h LEU 233 N 6.01 0.00 -8.17 0.00 3.38 -1.31 -3.40 115.31 111.82 2wqt h LEU 233 Ca -0.44 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 2wqt h LEU 233 Cb 1.21 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.91 2wqt h LEU 233 CO 0.85 0.12 0.06 -0.83 0.09 0.00 0.00 178.44 178.73 2wqt s GLY 234 N -4.37 0.54 0.45 0.83 0.00 -1.26 -2.38 107.32 101.13 2wqt s GLY 234 Ca 0.02 -0.85 -0.25 0.00 0.00 0.00 0.00 44.72 43.65 2wqt s GLY 234 CO 0.74 -0.49 1.35 -4.14 0.00 0.00 0.00 173.10 170.57 2wqt s PRO 235 N -3.27 3.71 0.64 2.90 0.02 -1.26 -4.68 135.00 133.05 2wqt s PRO 235 Ca 0.19 2.25 -0.15 0.00 0.02 0.00 0.00 61.00 63.31 2wqt s PRO 235 Cb -0.03 -2.61 -0.01 0.00 0.02 0.00 0.00 34.50 31.86 2wqt s PRO 235 CO 0.12 -0.74 1.08 0.00 -0.33 0.00 0.00 177.00 177.13 2wqt s MET 236 N -2.46 3.04 0.10 5.54 0.23 -1.26 -4.82 119.30 119.66 2wqt s MET 236 Ca 0.61 1.24 0.05 0.00 -1.03 0.00 0.00 55.69 56.57 2wqt s MET 236 Cb -0.40 -1.99 -0.03 0.00 -1.53 0.00 0.00 34.83 30.87 2wqt s MET 236 CO 0.51 -1.04 -0.14 0.14 -2.03 0.00 0.00 175.02 172.45 2wqt s VAL 237 N -2.51 1.22 0.29 5.16 -7.23 -0.66 -4.95 120.40 111.73 2wqt s VAL 237 Ca 0.64 -1.53 -0.29 0.00 -1.81 0.00 0.00 61.98 58.98 2wqt s VAL 237 Cb -0.17 -1.33 -0.10 0.00 0.56 0.00 0.00 36.38 35.34 2wqt s VAL 237 CO 0.42 -0.33 1.21 0.00 -0.31 0.00 0.00 175.10 176.08 2wqt s ALA 238 N -1.77 3.46 -0.16 1.32 0.00 -1.26 -1.73 121.76 121.61 2wqt s ALA 238 Ca 0.04 1.07 -0.13 0.00 0.00 0.00 0.00 51.96 52.94 2wqt s ALA 238 Cb -0.07 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 2wqt s ALA 238 CO 0.02 -0.40 0.27 0.08 0.00 0.00 0.00 175.76 175.73 2wqt s VAL 239 N -1.00 5.32 0.20 0.00 1.01 -0.76 -4.89 120.40 120.28 2wqt s VAL 239 Ca 0.48 0.49 0.10 0.00 0.00 0.00 0.00 61.98 63.04 2wqt s VAL 239 Cb -0.36 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2wqt s VAL 239 CO 0.46 0.41 -0.11 0.20 0.00 0.00 0.00 175.10 176.06 2wqt s ASN 240 N 0.36 4.15 0.12 3.32 0.02 -1.26 -4.74 114.94 116.91 2wqt s ASN 240 Ca 0.15 -0.66 -0.35 0.00 -1.02 0.00 0.00 52.86 50.99 2wqt s ASN 240 Cb -0.13 -0.65 -0.17 0.00 0.02 0.00 0.00 41.25 40.32 2wqt s ASN 240 CO 0.03 0.09 1.10 0.00 0.02 0.00 0.00 177.10 178.34 2wqt n ALA 241 N -0.12 -1.71 -0.01 0.60 0.00 -1.26 -1.65 120.51 116.36 2wqt n ALA 241 Ca -0.10 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2wqt n ALA 241 Cb 0.56 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 18.09 2wqt n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wqt n GLY 242 N 1.99 2.68 3.77 0.00 0.00 0.33 -4.98 105.19 108.98 2wqt n GLY 242 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2wqt n GLY 242 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wqt n ASP 243 N 0.00 3.86 -4.22 1.61 10.43 -0.66 -4.62 116.55 122.95 2wqt n ASP 243 Ca 0.00 1.20 -0.34 0.00 2.57 0.00 0.00 54.79 58.22 2wqt n ASP 243 Cb 0.00 -1.62 -0.15 0.00 1.84 0.00 0.00 41.12 41.20 2wqt n ASP 243 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 2wqt s ARG 244 N -1.61 3.06 -0.05 -1.24 3.52 -1.26 -1.02 118.95 120.36 2wqt s ARG 244 Ca 0.56 -0.82 -0.01 0.00 -0.13 0.00 0.00 55.73 55.34 2wqt s ARG 244 Cb -0.48 -2.91 -0.03 0.00 -1.56 0.00 0.00 34.95 29.97 2wqt s ARG 244 CO 0.59 -0.29 0.02 -0.06 -0.81 0.00 0.00 175.30 174.75 2wqt s PHE 245 N 1.37 3.16 -0.07 5.12 0.40 0.30 -0.40 117.98 127.87 2wqt s PHE 245 Ca 0.03 0.17 -0.03 0.00 -0.60 0.00 0.00 56.93 56.50 2wqt s PHE 245 Cb -0.15 -1.74 0.04 0.00 0.51 0.00 0.00 43.02 41.68 2wqt s PHE 245 CO -0.06 0.49 0.15 -2.00 0.70 0.00 0.00 175.22 174.50 2wqt s GLU 246 N -1.24 0.09 -0.01 0.44 2.12 -0.62 -1.17 118.70 118.31 2wqt s GLU 246 Ca 0.17 0.40 0.07 0.00 0.36 0.00 0.00 54.97 55.97 2wqt s GLU 246 Cb -0.11 -0.19 -0.02 0.00 0.26 0.00 0.00 34.13 34.07 2wqt s GLU 246 CO 0.07 -0.18 -0.23 0.00 -0.54 0.00 0.00 175.26 174.38 2wqt s ALA 247 N 1.29 2.34 -0.14 6.30 0.00 -0.04 -0.28 121.76 131.22 2wqt s ALA 247 Ca -0.08 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 50.77 2wqt s ALA 247 Cb -0.12 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2wqt s ALA 247 CO -0.06 0.54 -0.16 -1.01 0.00 0.00 0.00 175.76 175.07 2wqt s HIS 248 N -0.70 2.76 -0.26 0.00 3.76 0.62 -1.68 115.29 119.79 2wqt s HIS 248 Ca 0.11 -0.92 -0.01 0.00 -0.15 0.00 0.00 55.06 54.09 2wqt s HIS 248 Cb -0.10 -1.85 0.04 0.00 1.11 0.00 0.00 32.58 31.78 2wqt s HIS 248 CO 0.00 -0.39 -0.06 0.42 -0.85 0.00 0.00 174.74 173.87 2wqt s ILE 249 N 0.60 2.74 0.10 0.60 1.01 0.03 -1.79 121.20 124.49 2wqt s ILE 249 Ca -0.09 -1.20 -0.34 0.00 0.00 0.00 0.00 60.65 59.02 2wqt s ILE 249 Cb -0.16 -2.46 -0.13 0.00 0.01 0.00 0.00 42.46 39.72 2wqt s ILE 249 CO 0.03 0.11 1.67 1.21 0.00 0.00 0.00 174.94 177.97 2wqt n GLU 250 N 4.62 2.21 -0.47 2.79 2.13 0.12 -1.38 120.64 130.66 2wqt n GLU 250 Ca -0.16 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.47 2wqt n GLU 250 Cb 0.46 -2.60 0.00 0.00 0.27 0.00 0.00 31.44 29.57 2wqt n GLU 250 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wqt n GLY 251 N 3.73 2.02 0.84 8.31 0.00 -1.26 -4.52 105.19 114.31 2wqt n GLY 251 Ca 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.16 2wqt n GLY 251 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2wqt n ILE 252 N -2.00 0.66 -0.17 -0.61 5.41 -0.59 -4.86 119.36 117.19 2wqt n ILE 252 Ca 0.00 0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.82 2wqt n ILE 252 Cb 0.00 -1.64 0.00 0.00 -0.71 0.00 0.00 39.64 37.29 2wqt n ILE 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wqt n GLY 253 N 2.80 -0.12 3.20 7.39 0.00 -0.48 -3.92 105.19 114.05 2wqt n GLY 253 Ca -0.08 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 44.79 2wqt n GLY 253 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wqt s SER 254 N -4.00 -0.02 0.02 1.61 1.04 -0.30 -0.79 113.70 111.26 2wqt s SER 254 Ca 0.00 -0.28 0.03 0.00 0.48 0.00 0.00 55.95 56.18 2wqt s SER 254 Cb 0.00 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 66.40 2wqt s SER 254 CO 0.00 -0.55 -0.09 -0.69 0.98 0.00 0.00 173.24 172.89 2wqt s VAL 255 N -2.38 0.69 0.04 5.02 1.01 -0.67 -2.64 120.40 121.46 2wqt s VAL 255 Ca -0.06 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2wqt s VAL 255 Cb -0.02 -0.66 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 2wqt s VAL 255 CO -0.03 -0.08 -0.08 0.00 0.00 0.00 0.00 175.10 174.91 2wqt s ALA 256 N -0.79 0.61 -0.05 5.51 0.00 -1.26 -0.86 121.76 124.92 2wqt s ALA 256 Ca -0.02 -0.68 -0.10 0.00 0.00 0.00 0.00 51.96 51.16 2wqt s ALA 256 Cb -0.07 -0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.07 2wqt s ALA 256 CO 0.00 0.02 0.24 0.00 0.00 0.00 0.00 175.76 176.02 2wqt s ALA 257 N -1.13 -0.59 -0.02 0.00 0.00 -0.32 -0.40 121.76 119.30 2wqt s ALA 257 Ca -0.07 0.42 0.07 0.00 0.00 0.00 0.00 51.96 52.38 2wqt s ALA 257 Cb -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.84 2wqt s ALA 257 CO 0.00 -0.17 -0.24 0.99 0.00 0.00 0.00 175.76 176.34 2wqt s THR 258 N -0.56 1.89 -0.10 0.00 2.01 -0.94 -0.53 115.64 117.40 2wqt s THR 258 Ca -0.07 -1.01 -0.06 0.00 0.31 0.00 0.00 61.69 60.86 2wqt s THR 258 Cb -0.04 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 2wqt s THR 258 CO 0.01 0.53 0.13 -0.36 -0.69 0.00 0.00 174.62 174.24 2wqt s PHE 259 N -0.50 3.53 0.00 4.92 0.08 -0.19 -0.15 117.98 125.67 2wqt s PHE 259 Ca 0.08 0.46 0.00 0.00 0.12 0.00 0.00 56.93 57.58 2wqt s PHE 259 Cb -0.10 -1.90 0.00 0.00 -0.57 0.00 0.00 43.02 40.45 2wqt s PHE 259 CO -0.00 0.69 0.00 -1.13 -0.10 0.00 0.00 175.22 174.68 2wqt n SER 260 N 1.85 -0.18 -0.37 1.36 3.41 -0.44 -2.27 113.62 116.98 2wqt n SER 260 Ca -0.18 -0.09 0.05 0.00 -0.26 0.00 0.00 58.87 58.38 2wqt n SER 260 Cb 0.54 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.53 2wqt n SER 260 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68