#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qex n ARG 2 N 0.00 2.12 -2.14 0.00 1.74 -1.26 -4.98 116.66 112.14 2qex n ARG 2 Ca 0.00 0.76 -0.31 0.00 -0.77 0.00 0.00 57.85 57.53 2qex n ARG 2 Cb 0.00 -2.59 -0.01 0.00 -1.02 0.00 0.00 32.46 28.85 2qex n ARG 2 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2qex s SER 3 N -0.54 6.38 0.47 0.55 1.04 -1.26 -4.93 113.70 115.41 2qex s SER 3 Ca 0.63 1.43 0.16 0.00 0.48 0.00 0.00 55.95 58.65 2qex s SER 3 Cb -0.45 -2.47 1.09 0.00 0.10 0.00 0.00 66.02 64.29 2qex s SER 3 CO 0.56 -0.74 2.03 0.00 0.98 0.00 0.00 173.24 176.08 2qex h ALA 4 N 0.21 1.72 -0.61 5.32 0.00 -2.03 -2.26 119.26 121.61 2qex h ALA 4 Ca -0.45 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.30 2qex h ALA 4 Cb 1.19 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 2qex h ALA 4 CO 0.62 0.18 0.29 1.88 0.00 0.00 0.00 179.25 182.22 2qex h TYR 5 N 0.00 0.85 0.00 0.00 -1.99 -2.02 -2.35 116.97 111.46 2qex h TYR 5 Ca -0.00 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.70 2qex h TYR 5 Cb 0.26 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 38.72 2qex h TYR 5 CO 0.00 0.63 0.00 0.66 -0.00 0.00 0.00 178.16 179.45 2qex h SER 6 N 0.86 0.00 0.49 3.88 4.64 -1.78 -2.01 113.55 119.63 2qex h SER 6 Ca 0.21 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.24 2qex h SER 6 Cb 0.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 2qex h SER 6 CO -0.03 0.00 -1.54 1.88 -0.87 0.00 0.00 176.83 176.27 2qex h TYR 7 N 0.00 0.33 -0.56 4.77 -1.99 -1.54 -2.78 116.97 115.20 2qex h TYR 7 Ca 0.00 -0.24 -0.10 0.00 2.00 0.00 0.00 58.73 60.39 2qex h TYR 7 Cb 0.07 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 38.76 2qex h TYR 7 CO 0.00 1.31 -0.03 0.82 -0.00 0.00 0.00 178.16 180.26 2qex h ILE 8 N 0.05 1.27 -0.09 -2.88 2.04 -1.45 -2.82 117.51 113.62 2qex h ILE 8 Ca -0.24 -1.17 -0.00 0.00 1.00 0.00 0.00 64.86 64.45 2qex h ILE 8 Cb 1.99 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 38.96 2qex h ILE 8 CO 0.14 0.42 0.06 -0.09 0.00 0.00 0.00 178.15 178.68 2qex h ARG 9 N 0.90 0.13 -0.68 2.37 2.43 -1.58 -2.89 114.38 115.06 2qex h ARG 9 Ca 0.16 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 2qex h ARG 9 Cb 0.58 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 2qex h ARG 9 CO 0.03 0.12 0.36 0.22 -1.51 0.00 0.00 179.97 179.19 2qex h ASP 10 N 0.09 0.84 -0.58 -3.80 1.82 -1.45 -2.26 116.42 111.09 2qex h ASP 10 Ca 0.03 -0.07 -0.07 0.00 -0.39 0.00 0.00 57.03 56.54 2qex h ASP 10 Cb 0.03 -0.21 -0.03 0.00 0.68 0.00 0.00 39.33 39.80 2qex h ASP 10 CO -0.01 0.69 0.12 0.00 -1.61 0.00 0.00 179.24 178.44 2qex h ALA 11 N 1.45 1.06 0.00 -0.78 0.00 -1.38 -2.68 119.26 116.91 2qex h ALA 11 Ca 0.24 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qex h ALA 11 Cb 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2qex h ALA 11 CO -0.04 0.61 0.00 0.91 0.00 0.00 0.00 179.25 180.74 2qex n TRP 12 N -4.24 0.00 0.07 0.00 7.02 -0.86 -2.08 117.44 117.35 2qex n TRP 12 Ca 0.04 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 56.46 2qex n TRP 12 Cb 0.26 0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.05 2qex n TRP 12 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 2qex h GLU 13 N 0.00 0.00 -2.59 -0.99 5.08 -1.34 -3.37 114.58 111.37 2qex h GLU 13 Ca 0.00 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.76 2qex h GLU 13 Cb 0.00 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.85 2qex h GLU 13 CO 0.00 0.94 -0.77 0.09 -1.00 0.00 0.00 179.01 178.27 2qex n ASN 14 N -3.33 1.68 0.00 1.42 3.02 -0.88 -4.93 115.26 112.24 2qex n ASN 14 Ca -0.00 -2.92 0.06 0.00 -0.03 0.00 0.00 54.58 51.69 2qex n ASN 14 Cb 0.92 -0.67 0.28 0.00 -0.61 0.00 0.00 39.78 39.71 2qex n ASN 14 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2qex n PRO 15 N 2.01 0.16 0.01 3.52 -0.04 -1.24 -2.06 135.00 137.36 2qex n PRO 15 Ca 0.25 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 63.99 2qex n PRO 15 Cb 0.42 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.30 2qex n PRO 15 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qex n GLY 16 N -0.33 -1.07 3.85 0.55 0.00 -1.26 -3.84 105.19 103.09 2qex n GLY 16 Ca 0.05 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.35 2qex n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qex s ASP 17 N -3.71 5.20 0.93 1.61 1.01 -0.87 -4.64 116.67 116.19 2qex s ASP 17 Ca 0.02 -0.56 0.00 0.00 0.71 0.00 0.00 52.55 52.72 2qex s ASP 17 Cb 0.15 -0.88 0.00 0.00 1.01 0.00 0.00 42.92 43.20 2qex s ASP 17 CO 0.86 -0.40 0.00 0.61 0.21 0.00 0.00 175.17 176.45 2qex n GLY 18 N -1.39 0.95 0.32 0.21 0.00 -1.26 -2.67 105.19 101.35 2qex n GLY 18 Ca -0.01 -0.76 -0.04 0.00 0.00 0.00 0.00 46.02 45.21 2qex n GLY 18 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2qex h GLN 19 N 0.00 1.08 -0.78 1.61 4.20 -1.97 -2.21 115.11 117.05 2qex h GLN 19 Ca 0.00 -0.10 0.20 0.00 0.06 0.00 0.00 58.65 58.81 2qex h GLN 19 Cb 0.00 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 27.51 2qex h GLN 19 CO 0.00 0.76 0.54 1.25 -0.67 0.00 0.00 178.83 180.71 2qex h LEU 20 N 1.09 0.17 0.10 1.46 5.85 -1.91 0.22 115.31 122.29 2qex h LEU 20 Ca 0.29 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 2qex h LEU 20 Cb -0.04 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2qex h LEU 20 CO -0.05 0.07 -0.05 0.00 -0.34 0.00 0.00 178.44 178.07 2qex h ALA 21 N 1.63 -0.13 -0.46 1.25 0.00 -1.17 -0.60 119.26 119.79 2qex h ALA 21 Ca 0.38 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 2qex h ALA 21 Cb 1.25 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 2qex h ALA 21 CO -0.07 -0.49 -0.04 1.49 0.00 0.00 0.00 179.25 180.14 2qex h GLU 22 N -0.30 0.78 0.28 0.00 4.81 -0.96 -2.42 114.58 116.77 2qex h GLU 22 Ca -0.01 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 58.98 2qex h GLU 22 Cb 0.25 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2qex h GLU 22 CO 0.02 0.82 -0.15 1.25 -0.73 0.00 0.00 179.01 180.23 2qex h LEU 23 N 0.73 -0.35 -0.97 1.64 6.46 -0.49 -2.51 115.31 119.81 2qex h LEU 23 Ca 0.13 0.02 0.07 0.00 -0.12 0.00 0.00 57.88 57.98 2qex h LEU 23 Cb 0.50 0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 40.46 2qex h LEU 23 CO 0.03 -0.24 0.62 1.56 -0.62 0.00 0.00 178.44 179.78 2qex h GLN 24 N -0.39 1.07 -0.53 1.25 1.08 -0.99 -0.69 115.11 115.91 2qex h GLN 24 Ca -0.03 -0.06 0.02 0.00 -1.45 0.00 0.00 58.65 57.12 2qex h GLN 24 Cb 0.31 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.47 2qex h GLN 24 CO 0.05 0.71 0.32 2.35 -0.95 0.00 0.00 178.83 181.30 2qex h TRP 25 N 1.10 0.60 0.52 2.96 7.01 -1.22 -2.39 115.95 124.53 2qex h TRP 25 Ca 0.43 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.42 2qex h TRP 25 Cb 0.22 -0.19 0.01 0.00 -2.10 0.00 0.00 29.16 27.09 2qex h TRP 25 CO -0.01 0.34 -0.25 1.96 -2.79 0.00 0.00 178.44 177.69 2qex h GLN 26 N 0.63 -0.68 -0.26 2.65 4.20 -0.94 -3.34 115.11 117.37 2qex h GLN 26 Ca 0.21 0.05 0.06 0.00 0.06 0.00 0.00 58.65 59.02 2qex h GLN 26 Cb 0.01 0.15 -0.08 0.00 0.30 0.00 0.00 27.48 27.87 2qex h GLN 26 CO -0.09 -0.38 -0.39 0.00 -0.67 0.00 0.00 178.83 177.31 2qex h ARG 27 N -1.05 -0.37 -1.08 1.46 3.08 -1.12 -2.45 114.38 112.86 2qex h ARG 27 Ca -0.07 0.02 0.30 0.00 0.07 0.00 0.00 59.98 60.30 2qex h ARG 27 Cb 0.61 0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.69 2qex h ARG 27 CO 0.12 -0.24 0.75 1.96 -1.07 0.00 0.00 179.97 181.49 2qex h GLN 28 N -0.38 0.11 -0.94 0.04 4.20 -1.57 0.22 115.11 116.79 2qex h GLN 28 Ca 0.12 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.83 2qex h GLN 28 Cb 0.58 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.29 2qex h GLN 28 CO -0.47 0.07 0.63 1.96 -0.67 0.00 0.00 178.83 180.35 2qex h GLN 29 N 0.11 1.24 0.06 1.46 4.20 -1.55 0.27 115.11 120.90 2qex h GLN 29 Ca 0.54 -0.07 -0.24 0.00 0.06 0.00 0.00 58.65 58.94 2qex h GLN 29 Cb 1.92 -0.28 -0.01 0.00 0.30 0.00 0.00 27.48 29.41 2qex h GLN 29 CO -0.09 0.82 -1.09 0.93 -0.67 0.00 0.00 178.83 178.74 2qex h GLU 30 N 1.28 0.17 -0.39 1.46 5.08 -0.73 -3.31 114.58 118.15 2qex h GLU 30 Ca 0.35 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2qex h GLU 30 Cb -0.15 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 2qex h GLU 30 CO -0.08 1.09 0.18 -1.49 -1.00 0.00 0.00 179.01 177.72 2qex h TRP 31 N 0.06 0.57 0.00 4.33 4.06 -0.17 -2.28 115.95 122.52 2qex h TRP 31 Ca -0.07 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.84 2qex h TRP 31 Cb 1.81 -0.17 0.00 0.00 -1.00 0.00 0.00 29.16 29.80 2qex h TRP 31 CO 0.04 0.49 0.00 0.00 -3.56 0.00 0.00 178.44 175.40 2qex h ARG 32 N 0.49 0.00 -0.02 0.49 3.08 -0.59 -0.97 114.38 116.85 2qex h ARG 32 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2qex h ARG 32 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2qex h ARG 32 CO -0.01 0.00 -0.10 0.09 -1.07 0.00 0.00 179.97 178.87 2qex n ASN 33 N -3.00 2.28 -2.89 7.04 3.02 -0.87 -4.95 115.26 115.89 2qex n ASN 33 Ca -0.03 -1.70 -0.08 0.00 -0.03 0.00 0.00 54.58 52.75 2qex n ASN 33 Cb 0.08 0.09 0.04 0.00 -0.61 0.00 0.00 39.78 39.39 2qex n ASN 33 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2qex n GLU 34 N 0.65 0.35 0.00 3.52 1.02 -0.37 -5.11 120.64 120.69 2qex n GLU 34 Ca 0.14 -0.95 0.00 0.00 -0.02 0.00 0.00 57.16 56.33 2qex n GLU 34 Cb 0.49 -0.24 0.00 0.00 -0.02 0.00 0.00 31.44 31.67 2qex n GLU 34 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qex n GLY 35 N 2.30 0.96 0.10 0.62 0.00 -1.26 -5.02 105.19 102.89 2qex n GLY 35 Ca 0.06 -1.51 -0.12 0.00 0.00 0.00 0.00 46.02 44.45 2qex n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qex n ALA 36 N -3.00 1.50 -3.74 4.61 0.00 -1.26 -4.70 120.51 113.92 2qex n ALA 36 Ca 0.00 -1.23 -0.28 0.00 0.00 0.00 0.00 53.44 51.93 2qex n ALA 36 Cb 0.00 -0.14 -0.16 0.00 0.00 0.00 0.00 19.45 19.15 2qex n ALA 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2qex s VAL 37 N -2.48 0.61 -0.25 0.00 1.01 -1.26 -2.52 120.40 115.51 2qex s VAL 37 Ca -0.16 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.14 2qex s VAL 37 Cb 0.07 -1.14 0.05 0.00 0.00 0.00 0.00 36.38 35.35 2qex s VAL 37 CO 0.74 -0.27 -0.10 -1.61 0.00 0.00 0.00 175.10 173.86 2qex s GLU 38 N 1.81 2.48 0.16 2.72 0.41 -0.72 -4.96 118.70 120.59 2qex s GLU 38 Ca 0.00 -1.20 -0.31 0.00 -0.41 0.00 0.00 54.97 53.05 2qex s GLU 38 Cb -0.17 -2.89 -0.09 0.00 -1.78 0.00 0.00 34.13 29.19 2qex s GLU 38 CO -0.10 -0.49 1.48 0.50 -0.49 0.00 0.00 175.26 176.15 2qex s ARG 39 N 1.19 4.27 -0.02 1.61 3.52 -1.26 -1.67 118.95 126.58 2qex s ARG 39 Ca -0.05 2.24 0.06 0.00 -0.13 0.00 0.00 55.73 57.85 2qex s ARG 39 Cb -0.18 -3.18 -0.01 0.00 -1.56 0.00 0.00 34.95 30.01 2qex s ARG 39 CO -0.06 -0.51 -0.20 0.96 -0.81 0.00 0.00 175.30 174.68 2qex s ILE 40 N 0.95 1.62 0.23 4.11 -4.36 -0.83 -4.95 121.20 117.97 2qex s ILE 40 Ca 0.66 -0.87 -0.07 0.00 -0.26 0.00 0.00 60.65 60.11 2qex s ILE 40 Cb -0.41 -1.36 0.19 0.00 1.25 0.00 0.00 42.46 42.14 2qex s ILE 40 CO 0.32 0.46 1.84 -0.33 0.24 0.00 0.00 174.94 177.47 2qex h GLU 41 N 5.76 1.24 -4.72 0.37 5.08 -1.95 -3.39 114.58 116.97 2qex h GLU 41 Ca -0.37 -0.16 -0.44 0.00 -1.00 0.00 0.00 59.36 57.39 2qex h GLU 41 Cb 1.15 -0.23 -0.30 0.00 0.50 0.00 0.00 28.75 29.86 2qex h GLU 41 CO 0.48 0.92 -0.79 1.03 -1.00 0.00 0.00 179.01 179.65 2qex s ARG 42 N -5.78 1.01 0.41 2.33 1.81 -1.26 -4.98 118.95 112.48 2qex s ARG 42 Ca -0.13 -0.35 -0.27 0.00 -1.72 0.00 0.00 55.73 53.27 2qex s ARG 42 Cb 0.16 -0.94 -0.10 0.00 -0.45 0.00 0.00 34.95 33.63 2qex s ARG 42 CO 0.83 0.15 1.43 -2.30 -0.68 0.00 0.00 175.30 174.73 2qex n PRO 43 N 3.17 2.40 0.21 3.54 -0.02 -1.26 -4.93 135.00 138.11 2qex n PRO 43 Ca -0.17 0.85 0.08 0.00 -2.02 0.00 0.00 63.50 62.24 2qex n PRO 43 Cb 0.55 -2.61 0.41 0.00 -0.02 0.00 0.00 33.50 31.83 2qex n PRO 43 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2qex h THR 44 N 2.57 0.72 -2.84 3.45 2.02 -2.00 -3.36 112.91 113.47 2qex h THR 44 Ca -0.50 -1.29 -0.61 0.00 0.77 0.00 0.00 66.41 64.78 2qex h THR 44 Cb 1.26 1.83 -0.40 0.00 -1.74 0.00 0.00 68.15 69.10 2qex h THR 44 CO 0.62 0.29 -0.75 -0.13 0.37 0.00 0.00 175.52 175.92 2qex s ARG 45 N -3.66 1.57 0.20 6.66 0.52 -1.26 -5.01 118.95 117.98 2qex s ARG 45 Ca 0.00 -2.49 -0.15 0.00 -0.52 0.00 0.00 55.73 52.57 2qex s ARG 45 Cb 0.11 -2.44 0.21 0.00 0.52 0.00 0.00 34.95 33.35 2qex s ARG 45 CO 0.66 -1.27 1.62 1.25 0.02 0.00 0.00 175.30 177.58 2qex h LEU 46 N 5.95 -0.66 -0.57 2.53 6.46 -1.98 -2.41 115.31 124.64 2qex h LEU 46 Ca 0.13 0.19 0.08 0.00 -0.12 0.00 0.00 57.88 58.15 2qex h LEU 46 Cb 0.86 0.41 -0.06 0.00 -0.73 0.00 0.00 40.66 41.14 2qex h LEU 46 CO 0.53 -0.22 0.23 -2.24 -0.62 0.00 0.00 178.44 176.12 2qex h ASP 47 N -0.03 0.25 -0.51 1.25 2.03 -1.95 -1.74 116.42 115.72 2qex h ASP 47 Ca 0.28 0.06 -0.10 0.00 -0.73 0.00 0.00 57.03 56.55 2qex h ASP 47 Cb 0.47 0.03 -0.02 0.00 -0.83 0.00 0.00 39.33 38.98 2qex h ASP 47 CO -0.63 0.16 -0.06 0.50 -1.03 0.00 0.00 179.24 178.18 2qex h LYS 48 N 0.42 0.94 0.86 4.15 1.63 -1.85 -1.81 116.57 120.92 2qex h LYS 48 Ca 0.28 -0.33 -0.04 0.00 -0.85 0.00 0.00 60.65 59.70 2qex h LYS 48 Cb 0.30 -0.07 0.01 0.00 -0.60 0.00 0.00 32.23 31.87 2qex h LYS 48 CO -0.26 0.99 -0.41 0.00 -3.45 0.00 0.00 179.45 176.32 2qex h ALA 49 N 0.92 -1.30 -0.92 5.00 0.00 -1.11 -1.33 119.26 120.52 2qex h ALA 49 Ca 0.14 -0.25 0.14 0.00 0.00 0.00 0.00 54.91 54.93 2qex h ALA 49 Cb 0.61 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 18.77 2qex h ALA 49 CO 0.04 -1.21 0.59 0.00 0.00 0.00 0.00 179.25 178.66 2qex h ARG 50 N -1.16 0.74 -0.56 0.00 3.08 -1.39 0.14 114.38 115.23 2qex h ARG 50 Ca -0.12 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 2qex h ARG 50 Cb 0.88 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 2qex h ARG 50 CO 0.19 0.49 0.26 1.03 -1.07 0.00 0.00 179.97 180.87 2qex h SER 51 N 0.77 0.71 1.60 7.04 0.87 -1.13 -2.70 113.55 120.70 2qex h SER 51 Ca 0.46 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.94 2qex h SER 51 Cb 0.66 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.44 2qex h SER 51 CO -0.22 0.61 -0.41 1.56 -0.53 0.00 0.00 176.83 177.85 2qex h GLN 52 N 0.79 0.00 0.00 2.24 4.20 0.39 -3.47 115.11 119.26 2qex h GLN 52 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2qex h GLN 52 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 2qex h GLN 52 CO -0.02 0.04 0.00 0.41 -0.67 0.00 0.00 178.83 178.59 2qex n GLY 53 N 1.14 0.63 3.49 3.46 0.00 -0.45 -4.86 105.19 108.60 2qex n GLY 53 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2qex n GLY 53 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2qex n TYR 54 N 0.00 -0.14 -3.71 1.61 9.36 -0.77 -4.92 117.16 118.58 2qex n TYR 54 Ca 0.00 0.56 -0.12 0.00 3.32 0.00 0.00 57.90 61.67 2qex n TYR 54 Cb 0.00 -2.04 -0.11 0.00 -0.63 0.00 0.00 39.34 36.56 2qex n TYR 54 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 2qex s LYS 55 N -1.78 0.40 -1.02 2.98 1.02 -1.26 -4.45 119.74 115.63 2qex s LYS 55 Ca 0.64 0.68 -0.23 0.00 0.02 0.00 0.00 55.97 57.08 2qex s LYS 55 Cb -0.56 0.06 -0.01 0.00 -0.52 0.00 0.00 37.83 36.80 2qex s LYS 55 CO 0.57 -0.12 1.75 0.00 -0.92 0.00 0.00 175.35 176.63 2qex s ALA 56 N 0.94 2.20 0.22 5.17 0.00 -1.26 -4.80 121.76 124.23 2qex s ALA 56 Ca -0.06 -1.99 -0.15 0.00 0.00 0.00 0.00 51.96 49.76 2qex s ALA 56 Cb -0.06 -4.57 0.01 0.00 0.00 0.00 0.00 23.12 18.49 2qex s ALA 56 CO -0.07 -4.31 0.49 0.21 0.00 0.00 0.00 175.76 172.08 2qex s LYS 57 N 5.97 1.45 0.04 0.00 2.20 -1.26 -5.13 119.74 123.02 2qex s LYS 57 Ca 0.60 -1.06 -0.31 0.00 -0.36 0.00 0.00 55.97 54.85 2qex s LYS 57 Cb -0.03 0.49 -0.06 0.00 -1.51 0.00 0.00 37.83 36.73 2qex s LYS 57 CO -0.01 -0.61 1.30 -0.65 -0.36 0.00 0.00 175.35 175.02 2qex s GLN 58 N -3.94 4.36 0.00 4.03 -0.21 -1.26 -3.07 119.66 119.56 2qex s GLN 58 Ca 0.15 1.88 0.00 0.00 0.02 0.00 0.00 55.36 57.41 2qex s GLN 58 Cb -0.01 -3.41 0.00 0.00 1.00 0.00 0.00 33.01 30.59 2qex s GLN 58 CO 0.03 -0.41 0.00 0.41 -2.12 0.00 0.00 175.29 173.20 2qex n GLY 59 N 3.41 0.76 3.35 3.09 0.00 -1.26 -4.50 105.19 110.04 2qex n GLY 59 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2qex n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qex s VAL 60 N -2.10 3.70 0.22 1.61 1.01 -1.17 -1.35 120.40 122.33 2qex s VAL 60 Ca 0.00 -0.46 0.11 0.00 0.00 0.00 0.00 61.98 61.63 2qex s VAL 60 Cb 0.00 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 2qex s VAL 60 CO 0.00 0.33 -0.21 -0.63 0.00 0.00 0.00 175.10 174.59 2qex s ILE 61 N 1.51 2.30 0.03 2.22 1.09 0.14 -4.87 121.20 123.62 2qex s ILE 61 Ca 0.05 -2.18 0.02 0.00 -1.10 0.00 0.00 60.65 57.44 2qex s ILE 61 Cb -0.15 -2.15 -0.02 0.00 -1.06 0.00 0.00 42.46 39.08 2qex s ILE 61 CO -0.01 -0.28 -0.07 -0.69 -0.10 0.00 0.00 174.94 173.80 2qex s VAL 62 N -2.12 0.47 -0.20 2.92 1.01 -1.26 -0.55 120.40 120.67 2qex s VAL 62 Ca 0.24 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.27 2qex s VAL 62 Cb -0.06 -0.51 0.07 0.00 0.00 0.00 0.00 36.38 35.88 2qex s VAL 62 CO 0.11 -0.26 0.48 0.00 0.00 0.00 0.00 175.10 175.43 2qex s ALA 63 N -1.05 -1.26 0.00 5.51 0.00 -0.91 -1.97 121.76 122.09 2qex s ALA 63 Ca -0.07 1.74 -0.26 0.00 0.00 0.00 0.00 51.96 53.38 2qex s ALA 63 Cb -0.08 -1.08 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 2qex s ALA 63 CO 0.00 -0.33 0.79 0.50 0.00 0.00 0.00 175.76 176.72 2qex s ARG 64 N 1.55 4.50 -0.12 0.00 3.52 -0.67 -1.88 118.95 125.86 2qex s ARG 64 Ca -0.09 1.09 0.00 0.00 -0.13 0.00 0.00 55.73 56.60 2qex s ARG 64 Cb -0.08 -3.41 0.02 0.00 -1.56 0.00 0.00 34.95 29.92 2qex s ARG 64 CO -0.15 0.15 -0.10 0.08 -0.81 0.00 0.00 175.30 174.47 2qex s VAL 65 N 0.43 1.19 -0.12 7.11 1.01 0.23 -1.76 120.40 128.49 2qex s VAL 65 Ca 0.41 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 61.89 2qex s VAL 65 Cb -0.20 -1.17 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 2qex s VAL 65 CO 0.23 0.39 0.20 -0.94 0.00 0.00 0.00 175.10 174.98 2qex s SER 66 N 1.54 6.42 0.05 3.32 1.04 -1.05 -2.33 113.70 122.70 2qex s SER 66 Ca 0.03 0.50 0.04 0.00 0.48 0.00 0.00 55.95 57.01 2qex s SER 66 Cb -0.13 -2.12 -0.02 0.00 0.10 0.00 0.00 66.02 63.85 2qex s SER 66 CO -0.08 0.31 -0.13 -0.69 0.98 0.00 0.00 173.24 173.63 2qex s VAL 67 N -0.55 0.99 0.45 5.02 1.01 -0.78 -4.89 120.40 121.65 2qex s VAL 67 Ca 0.15 -1.13 -0.24 0.00 0.00 0.00 0.00 61.98 60.77 2qex s VAL 67 Cb -0.13 -0.95 -0.07 0.00 0.00 0.00 0.00 36.38 35.23 2qex s VAL 67 CO 0.04 -0.16 1.21 0.00 0.00 0.00 0.00 175.10 176.19 2qex s ARG 68 N -1.46 3.76 0.47 2.72 3.03 -1.26 -0.37 118.95 125.85 2qex s ARG 68 Ca -0.02 1.91 -0.13 0.00 2.03 0.00 0.00 55.73 59.52 2qex s ARG 68 Cb -0.09 -2.49 -0.07 0.00 -1.03 0.00 0.00 34.95 31.27 2qex s ARG 68 CO 0.02 -0.59 0.88 0.15 -1.13 0.00 0.00 175.30 174.63 2qex s LYS 69 N -2.58 3.82 0.00 3.89 1.02 -0.86 -4.76 119.74 120.27 2qex s LYS 69 Ca 0.62 0.68 0.00 0.00 0.02 0.00 0.00 55.97 57.29 2qex s LYS 69 Cb -0.32 -2.26 0.00 0.00 -0.52 0.00 0.00 37.83 34.73 2qex s LYS 69 CO 0.39 -0.19 0.00 0.41 -0.92 0.00 0.00 175.35 175.04 2qex n GLY 70 N -1.60 -1.23 0.53 -3.33 0.00 -1.26 -4.94 105.19 93.36 2qex n GLY 70 Ca 0.04 -2.20 -0.04 0.00 0.00 0.00 0.00 46.02 43.83 2qex n GLY 70 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qex n SER 71 N 0.00 -0.20 -4.76 1.61 3.41 -1.26 -4.97 113.62 107.45 2qex n SER 71 Ca 0.00 -0.98 -0.39 0.00 -0.26 0.00 0.00 58.87 57.24 2qex n SER 71 Cb 0.00 -0.14 0.01 0.00 -0.26 0.00 0.00 64.21 63.82 2qex n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qex s ALA 72 N -3.81 3.06 -1.12 7.33 0.00 -0.96 -4.92 121.76 121.34 2qex s ALA 72 Ca 0.11 1.25 -0.06 0.00 0.00 0.00 0.00 51.96 53.26 2qex s ALA 72 Cb -0.00 -3.51 0.28 0.00 0.00 0.00 0.00 23.12 19.89 2qex s ALA 72 CO 0.07 -1.03 1.49 0.54 0.00 0.00 0.00 175.76 176.83 2qex n ARG 73 N -0.42 4.21 -3.74 0.00 3.00 -1.26 -4.96 116.66 113.50 2qex n ARG 73 Ca 0.07 -4.39 -0.33 0.00 -0.01 0.00 0.00 57.85 53.19 2qex n ARG 73 Cb 0.45 -2.59 -0.05 0.00 0.00 0.00 0.00 32.46 30.27 2qex n ARG 73 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 2qex s LYS 74 N -2.05 3.59 0.07 5.56 2.20 -1.26 -5.09 119.74 122.75 2qex s LYS 74 Ca 0.32 -0.12 -0.17 0.00 -0.36 0.00 0.00 55.97 55.65 2qex s LYS 74 Cb 0.03 -2.98 -0.06 0.00 -1.51 0.00 0.00 37.83 33.31 2qex s LYS 74 CO 0.07 0.57 0.51 1.03 -0.36 0.00 0.00 175.35 177.16 2qex s ARG 75 N -2.24 4.06 0.46 4.03 0.52 -1.26 -4.99 118.95 119.54 2qex s ARG 75 Ca 0.34 0.58 -0.23 0.00 -0.52 0.00 0.00 55.73 55.90 2qex s ARG 75 Cb -0.13 -3.16 -0.07 0.00 0.52 0.00 0.00 34.95 32.10 2qex s ARG 75 CO 0.21 0.62 1.18 0.50 0.02 0.00 0.00 175.30 177.84 2qex s ARG 76 N -1.29 3.73 0.33 3.54 3.52 -1.26 -4.96 118.95 122.56 2qex s ARG 76 Ca 0.29 1.81 -0.27 0.00 -0.13 0.00 0.00 55.73 57.44 2qex s ARG 76 Cb -0.18 -2.41 -0.13 0.00 -1.56 0.00 0.00 34.95 30.67 2qex s ARG 76 CO 0.17 -0.59 1.07 -2.39 -0.81 0.00 0.00 175.30 172.75 2qex n HIS 77 N -0.49 1.46 0.55 5.12 1.44 -1.26 -4.94 115.22 117.09 2qex n HIS 77 Ca 0.07 0.64 0.06 0.00 -2.01 0.00 0.00 57.72 56.48 2qex n HIS 77 Cb 0.48 -2.28 -0.03 0.00 0.12 0.00 0.00 29.99 28.27 2qex n HIS 77 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2qex n LYS 78 N 0.55 2.53 -2.57 -1.40 5.02 -1.26 -5.03 118.16 116.00 2qex n LYS 78 Ca 0.08 -0.35 -0.06 0.00 -2.02 0.00 0.00 58.31 55.97 2qex n LYS 78 Cb 0.35 -1.10 -0.02 0.00 -0.02 0.00 0.00 35.03 34.23 2qex n LYS 78 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qex n ALA 79 N -0.73 0.15 -1.66 7.82 0.00 -1.26 -5.12 120.51 119.70 2qex n ALA 79 Ca 0.04 -0.50 -0.46 0.00 0.00 0.00 0.00 53.44 52.52 2qex n ALA 79 Cb 0.22 0.35 -0.03 0.00 0.00 0.00 0.00 19.45 19.99 2qex n ALA 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qex n GLY 80 N 1.11 0.88 3.30 0.00 0.00 -1.26 -5.01 105.19 104.21 2qex n GLY 80 Ca -0.01 0.57 -0.13 0.00 0.00 0.00 0.00 46.02 46.45 2qex n GLY 80 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qex s ARG 81 N 0.14 0.48 0.48 1.61 3.00 -1.26 -5.15 118.95 118.25 2qex s ARG 81 Ca 0.73 0.58 -0.19 0.00 0.00 0.00 0.00 55.73 56.85 2qex s ARG 81 Cb -0.68 0.23 -0.09 0.00 0.00 0.00 0.00 34.95 34.41 2qex s ARG 81 CO 0.45 -0.06 0.98 -0.98 0.00 0.00 0.00 175.30 175.69 2qex s ARG 82 N 0.25 3.99 0.45 3.54 1.70 -1.26 -4.89 118.95 122.73 2qex s ARG 82 Ca -0.00 1.10 0.32 0.00 -0.47 0.00 0.00 55.73 56.68 2qex s ARG 82 Cb -0.03 -2.14 1.47 0.00 -0.57 0.00 0.00 34.95 33.68 2qex s ARG 82 CO 0.00 -0.24 1.60 0.66 -1.08 0.00 0.00 175.30 176.25 2qex h SER 83 N 1.38 0.21 0.02 -2.89 4.64 -2.01 0.96 113.55 115.85 2qex h SER 83 Ca -0.48 0.14 -0.01 0.00 -0.47 0.00 0.00 61.79 60.97 2qex h SER 83 Cb 1.19 0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 63.41 2qex h SER 83 CO 0.61 -0.20 -0.03 0.50 -0.87 0.00 0.00 176.83 176.84 2qex h LYS 84 N 0.05 0.03 -0.37 4.77 3.11 -2.04 -2.88 116.57 119.23 2qex h LYS 84 Ca 0.85 -0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 58.66 2qex h LYS 84 Cb 2.74 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 33.95 2qex h LYS 84 CO -0.41 0.06 0.02 0.54 -2.81 0.00 0.00 179.45 176.85 2qex n ARG 85 N -4.49 3.36 -0.27 1.90 5.12 0.33 -4.49 116.66 118.12 2qex n ARG 85 Ca -0.03 -2.96 0.12 0.00 -1.93 0.00 0.00 57.85 53.05 2qex n ARG 85 Cb 0.12 -1.97 0.26 0.00 -1.16 0.00 0.00 32.46 29.72 2qex n ARG 85 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2qex n GLN 86 N -0.28 2.61 -2.24 5.56 6.02 -1.09 -4.88 117.38 123.08 2qex n GLN 86 Ca 0.25 -2.46 -0.34 0.00 -0.01 0.00 0.00 57.00 54.44 2qex n GLN 86 Cb 1.01 -1.54 -0.00 0.00 1.02 0.00 0.00 30.24 30.73 2qex n GLN 86 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2qex s GLY 87 N -1.27 2.39 0.18 1.08 0.00 -1.26 -4.84 107.32 103.59 2qex s GLY 87 Ca 0.43 0.59 0.00 0.00 0.00 0.00 0.00 44.72 45.75 2qex s GLY 87 CO 0.32 0.92 0.00 -0.62 0.00 0.00 0.00 173.10 173.73 2qex n VAL 88 N -1.52 0.13 -0.20 1.40 0.31 -1.26 -4.87 118.33 112.31 2qex n VAL 88 Ca 0.10 0.04 -0.07 0.00 -0.01 0.00 0.00 64.34 64.40 2qex n VAL 88 Cb 0.52 -0.67 0.03 0.00 -0.91 0.00 0.00 33.84 32.81 2qex n VAL 88 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2qex h THR 89 N 0.00 1.19 -0.21 2.52 2.02 -1.93 -3.21 112.91 113.29 2qex h THR 89 Ca 0.00 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.71 2qex h THR 89 Cb 0.05 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 2qex h THR 89 CO 0.00 0.20 0.00 0.54 0.37 0.00 0.00 175.52 176.63 2qex n ARG 90 N -4.59 2.04 -2.75 6.66 1.74 -1.26 -4.90 116.66 113.59 2qex n ARG 90 Ca 0.04 -1.55 -0.42 0.00 -0.77 0.00 0.00 57.85 55.15 2qex n ARG 90 Cb 0.08 -1.45 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 2qex n ARG 90 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2qex s ILE 91 N -1.74 4.86 0.28 0.55 1.01 -1.21 -5.01 121.20 119.94 2qex s ILE 91 Ca 0.34 1.99 0.11 0.00 0.00 0.00 0.00 60.65 63.09 2qex s ILE 91 Cb 0.20 -4.29 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 2qex s ILE 91 CO 0.29 0.18 -0.17 0.42 0.00 0.00 0.00 174.94 175.66 2qex s THR 92 N 0.91 2.33 0.41 2.92 -4.23 -1.26 -2.28 115.64 114.44 2qex s THR 92 Ca 0.50 -2.34 -0.11 0.00 -1.18 0.00 0.00 61.69 58.56 2qex s THR 92 Cb -0.21 -2.33 -0.06 0.00 1.34 0.00 0.00 72.50 71.23 2qex s THR 92 CO 0.27 -0.39 0.78 -0.13 -0.54 0.00 0.00 174.62 174.61 2qex s ARG 93 N -3.55 3.79 0.00 3.99 0.52 -1.26 -4.81 118.95 117.62 2qex s ARG 93 Ca 0.30 0.49 0.28 0.00 -0.52 0.00 0.00 55.73 56.27 2qex s ARG 93 Cb -0.03 -2.38 1.14 0.00 0.52 0.00 0.00 34.95 34.19 2qex s ARG 93 CO 0.14 -0.04 1.86 0.54 0.02 0.00 0.00 175.30 177.82 2qex n ARG 94 N -1.30 0.00 -3.87 3.54 1.74 -1.26 -4.77 116.66 110.74 2qex n ARG 94 Ca 0.03 -0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.74 2qex n ARG 94 Cb 0.54 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.42 2qex n ARG 94 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2qex s LYS 95 N -3.00 3.45 0.24 5.56 2.20 -1.26 -5.01 119.74 121.93 2qex s LYS 95 Ca 0.14 -0.12 -0.08 0.00 -0.36 0.00 0.00 55.97 55.55 2qex s LYS 95 Cb 0.19 -3.19 -0.07 0.00 -1.51 0.00 0.00 37.83 33.25 2qex s LYS 95 CO 0.55 0.78 0.55 0.16 -0.36 0.00 0.00 175.35 177.03 2qex s ASP 96 N -1.05 6.57 0.43 1.43 -4.77 -1.26 -4.95 116.67 113.07 2qex s ASP 96 Ca 0.15 0.86 0.28 0.00 -3.30 0.00 0.00 52.55 50.54 2qex s ASP 96 Cb -0.12 -2.20 1.35 0.00 -1.09 0.00 0.00 42.92 40.86 2qex s ASP 96 CO 0.05 -0.11 1.67 0.40 0.70 0.00 0.00 175.17 177.88 2qex h ILE 97 N 1.82 0.23 -0.22 2.11 2.04 -1.97 0.28 117.51 121.80 2qex h ILE 97 Ca -0.47 -0.05 -0.11 0.00 1.00 0.00 0.00 64.86 65.22 2qex h ILE 97 Cb 1.17 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 2qex h ILE 97 CO 0.68 0.03 -0.34 -0.61 0.00 0.00 0.00 178.15 177.91 2qex h GLN 98 N 0.16 0.47 0.00 2.37 4.15 -1.99 -1.17 115.11 119.10 2qex h GLN 98 Ca 0.76 -0.21 -0.04 0.00 0.77 0.00 0.00 58.65 59.92 2qex h GLN 98 Cb 2.31 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 29.98 2qex h GLN 98 CO -0.37 0.75 -0.19 -0.09 -1.93 0.00 0.00 178.83 177.01 2qex h ARG 99 N 0.40 0.00 -0.03 1.69 2.43 -0.83 -2.47 114.38 115.57 2qex h ARG 99 Ca 0.05 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.04 2qex h ARG 99 Cb 0.79 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.35 2qex h ARG 99 CO 0.06 0.19 -0.69 0.28 -1.51 0.00 0.00 179.97 178.31 2qex h VAL 100 N 0.00 1.37 -0.67 0.20 2.07 -0.87 -2.97 116.25 115.38 2qex h VAL 100 Ca -0.00 -2.05 -0.04 0.00 0.82 0.00 0.00 66.70 65.43 2qex h VAL 100 Cb 1.01 2.42 -0.03 0.00 -1.52 0.00 0.00 31.29 33.17 2qex h VAL 100 CO 0.02 0.61 0.26 0.00 0.02 0.00 0.00 177.57 178.49 2qex h ALA 101 N 0.39 1.18 -0.70 1.67 0.00 -1.18 -2.01 119.26 118.61 2qex h ALA 101 Ca -0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2qex h ALA 101 Cb 1.36 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 2qex h ALA 101 CO 0.14 0.59 0.29 0.93 0.00 0.00 0.00 179.25 181.20 2qex h GLU 102 N 0.98 1.02 -0.01 0.00 5.08 -1.46 -2.49 114.58 117.70 2qex h GLU 102 Ca 0.23 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2qex h GLU 102 Cb 0.20 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 2qex h GLU 102 CO -0.02 0.82 -0.01 0.93 -1.00 0.00 0.00 179.01 179.73 2qex h GLU 103 N 1.01 0.03 -0.07 2.33 5.08 -1.26 -2.26 114.58 119.43 2qex h GLU 103 Ca 0.24 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.60 2qex h GLU 103 Cb 0.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2qex h GLU 103 CO -0.02 0.55 0.12 0.00 -1.00 0.00 0.00 179.01 178.66 2qex h ARG 104 N -0.50 0.00 0.09 2.33 3.08 -1.32 -1.47 114.38 116.60 2qex h ARG 104 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 2qex h ARG 104 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 2qex h ARG 104 CO 0.00 0.00 -0.91 0.00 -1.07 0.00 0.00 179.97 178.00 2qex h ALA 105 N 1.83 0.05 -0.05 0.04 0.00 -1.39 -3.20 119.26 116.54 2qex h ALA 105 Ca 0.03 -0.84 -0.02 0.00 0.00 0.00 0.00 54.91 54.08 2qex h ALA 105 Cb 0.27 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2qex h ALA 105 CO -0.00 0.49 -0.08 1.03 0.00 0.00 0.00 179.25 180.69 2qex h SER 106 N -0.52 0.06 0.58 0.00 0.87 -0.70 -1.99 113.55 111.85 2qex h SER 106 Ca -0.19 -0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.22 2qex h SER 106 Cb 1.53 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.46 2qex h SER 106 CO 0.06 0.16 -0.67 0.03 -0.53 0.00 0.00 176.83 175.87 2qex h ARG 107 N 0.07 0.08 -0.07 2.24 3.08 -1.42 -3.04 114.38 115.32 2qex h ARG 107 Ca 0.02 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 59.90 2qex h ARG 107 Cb 0.19 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 2qex h ARG 107 CO 0.01 0.72 -0.42 1.15 -1.07 0.00 0.00 179.97 180.36 2qex h THR 108 N 0.06 1.31 -2.92 2.04 2.02 -1.36 -3.32 112.91 110.74 2qex h THR 108 Ca -0.01 -1.52 -0.63 0.00 0.77 0.00 0.00 66.41 65.02 2qex h THR 108 Cb 1.19 1.73 -0.41 0.00 -1.74 0.00 0.00 68.15 68.92 2qex h THR 108 CO 0.09 0.45 -0.49 0.49 0.37 0.00 0.00 175.52 176.43 2qex n PHE 109 N -4.02 3.46 0.00 3.16 3.01 -1.03 -4.96 117.46 117.08 2qex n PHE 109 Ca -0.02 -4.23 0.00 0.00 1.01 0.00 0.00 57.45 54.21 2qex n PHE 109 Cb 0.47 -0.69 0.00 0.00 -0.01 0.00 0.00 39.48 39.26 2qex n PHE 109 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2qex n PRO 110 N 1.74 0.00 -0.04 -1.08 -0.04 -1.21 -2.01 135.00 132.35 2qex n PRO 110 Ca 0.22 0.41 0.02 0.00 -0.04 0.00 0.00 63.50 64.11 2qex n PRO 110 Cb 0.36 -1.54 -0.14 0.00 -0.04 0.00 0.00 33.50 32.15 2qex n PRO 110 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2qex n ASN 111 N -1.40 0.76 -4.91 3.54 6.94 -1.26 -5.00 115.26 113.92 2qex n ASN 111 Ca 0.00 0.00 -0.27 0.00 -0.02 0.00 0.00 54.58 54.29 2qex n ASN 111 Cb 0.04 1.45 0.06 0.00 -2.36 0.00 0.00 39.78 38.96 2qex n ASN 111 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2qex s LEU 112 N -4.71 2.92 -0.01 -4.53 1.43 -0.85 -4.47 118.68 108.45 2qex s LEU 112 Ca -0.08 0.72 0.04 0.00 -1.03 0.00 0.00 54.13 53.79 2qex s LEU 112 Cb 0.09 -3.44 -0.01 0.00 0.03 0.00 0.00 46.19 42.87 2qex s LEU 112 CO 0.74 -1.42 -0.13 -0.13 0.23 0.00 0.00 176.35 175.64 2qex s ARG 113 N -5.24 1.13 0.19 1.70 0.52 -0.54 -4.90 118.95 111.82 2qex s ARG 113 Ca 0.58 -0.47 -0.31 0.00 -0.52 0.00 0.00 55.73 55.01 2qex s ARG 113 Cb -0.11 -1.08 -0.09 0.00 0.52 0.00 0.00 34.95 34.19 2qex s ARG 113 CO 0.47 0.27 1.42 0.08 0.02 0.00 0.00 175.30 177.55 2qex s VAL 114 N -0.23 2.94 -0.25 3.52 1.01 -1.26 -1.02 120.40 125.10 2qex s VAL 114 Ca 0.04 0.73 -0.12 0.00 0.00 0.00 0.00 61.98 62.63 2qex s VAL 114 Cb -0.06 -3.47 -0.11 0.00 0.00 0.00 0.00 36.38 32.74 2qex s VAL 114 CO -0.00 0.09 -0.32 -0.11 0.00 0.00 0.00 175.10 174.76 2qex n LEU 115 N 3.07 1.79 0.00 3.92 -0.00 0.12 -4.87 117.00 121.03 2qex n LEU 115 Ca 0.09 0.29 0.00 0.00 -0.00 0.00 0.00 56.01 56.39 2qex n LEU 115 Cb 0.41 -0.73 0.00 0.00 -0.00 0.00 0.00 43.42 43.10 2qex n LEU 115 CO 0.60 0.53 0.30 -3.20 -0.00 0.00 0.00 177.39 175.61 2qex n ASN 116 N -4.08 -0.43 -3.60 1.96 2.85 -1.20 -4.70 115.26 106.06 2qex n ASN 116 Ca -0.49 -1.16 -0.07 0.00 -0.11 0.00 0.00 54.58 52.76 2qex n ASN 116 Cb 0.85 0.68 -0.02 0.00 1.24 0.00 0.00 39.78 42.53 2qex n ASN 116 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 2qex s SER 117 N -1.81 -0.30 0.21 1.20 1.04 -1.26 -1.00 113.70 111.78 2qex s SER 117 Ca 0.08 -0.15 -0.09 0.00 0.48 0.00 0.00 55.95 56.27 2qex s SER 117 Cb -0.00 0.43 -0.01 0.00 0.10 0.00 0.00 66.02 66.54 2qex s SER 117 CO 0.01 -0.74 0.34 -0.72 0.98 0.00 0.00 173.24 173.10 2qex s TYR 118 N -3.21 0.56 0.04 5.02 -0.85 -1.08 -4.98 117.35 112.84 2qex s TYR 118 Ca 0.08 -0.89 -0.13 0.00 -0.52 0.00 0.00 57.07 55.61 2qex s TYR 118 Cb -0.01 -0.06 -0.06 0.00 0.38 0.00 0.00 41.96 42.21 2qex s TYR 118 CO -0.05 -0.83 0.41 0.45 -1.52 0.00 0.00 175.55 174.02 2qex s SER 119 N -3.04 6.74 -0.16 -0.18 0.15 -1.26 -1.21 113.70 114.75 2qex s SER 119 Ca 0.25 0.90 0.14 0.00 0.70 0.00 0.00 55.95 57.94 2qex s SER 119 Cb 0.02 -2.22 0.37 0.00 -1.71 0.00 0.00 66.02 62.47 2qex s SER 119 CO 0.07 0.25 1.19 1.33 1.20 0.00 0.00 173.24 177.28 2qex n VAL 120 N 1.39 1.86 0.00 4.45 0.24 -0.43 -4.90 118.33 120.93 2qex n VAL 120 Ca -0.11 -2.65 0.00 0.00 -2.04 0.00 0.00 64.34 59.54 2qex n VAL 120 Cb 0.52 -0.11 0.00 0.00 -1.47 0.00 0.00 33.84 32.78 2qex n VAL 120 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qex n GLY 121 N -1.05 -1.50 3.57 7.63 0.00 -1.24 -4.84 105.19 107.76 2qex n GLY 121 Ca 0.16 -2.15 -0.08 0.00 0.00 0.00 0.00 46.02 43.95 2qex n GLY 121 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2qex s GLN 122 N -0.27 0.53 0.00 1.61 -2.07 -1.26 -1.16 119.66 117.04 2qex s GLN 122 Ca 0.00 -0.05 0.00 0.00 -1.82 0.00 0.00 55.36 53.49 2qex s GLN 122 Cb 0.00 0.25 0.00 0.00 -1.09 0.00 0.00 33.01 32.17 2qex s GLN 122 CO 0.00 -0.20 0.00 -0.40 -1.32 0.00 0.00 175.29 173.37 2qex n ASP 123 N 0.24 0.27 0.14 12.60 5.68 -0.88 -5.00 116.55 129.60 2qex n ASP 123 Ca -0.06 0.00 0.13 0.00 -0.50 0.00 0.00 54.79 54.35 2qex n ASP 123 Cb 0.59 0.00 0.47 0.00 -1.14 0.00 0.00 41.12 41.04 2qex n ASP 123 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 2qex h GLY 124 N 0.00 0.00 0.00 6.12 0.00 -2.04 -3.37 103.07 103.78 2qex h GLY 124 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qex h GLY 124 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 176.54 175.58 2qex n ARG 125 N -2.35 0.26 -3.46 4.80 1.85 -1.26 -4.97 116.66 111.53 2qex n ARG 125 Ca 0.03 -0.58 -0.12 0.00 -1.00 0.00 0.00 57.85 56.18 2qex n ARG 125 Cb 0.31 -0.54 -0.02 0.00 -1.05 0.00 0.00 32.46 31.16 2qex n ARG 125 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 2qex s GLN 126 N -0.09 1.25 -0.01 2.89 -2.07 -1.26 -2.02 119.66 118.35 2qex s GLN 126 Ca 0.00 -0.52 0.07 0.00 -1.82 0.00 0.00 55.36 53.09 2qex s GLN 126 Cb 0.00 0.57 -0.02 0.00 -1.09 0.00 0.00 33.01 32.47 2qex s GLN 126 CO 0.00 -0.54 -0.21 0.15 -1.32 0.00 0.00 175.29 173.37 2qex s LYS 127 N -3.76 1.63 -0.07 9.60 1.02 0.50 -2.07 119.74 126.59 2qex s LYS 127 Ca 0.01 -0.77 0.03 0.00 0.02 0.00 0.00 55.97 55.26 2qex s LYS 127 Cb -0.01 -1.61 -0.02 0.00 -0.52 0.00 0.00 37.83 35.67 2qex s LYS 127 CO -0.13 0.44 -0.14 -1.58 -0.92 0.00 0.00 175.35 173.02 2qex s TRP 128 N -0.54 2.73 0.12 3.18 0.51 -0.31 -1.86 118.94 122.79 2qex s TRP 128 Ca 0.08 -0.26 0.04 0.00 -2.12 0.00 0.00 56.10 53.83 2qex s TRP 128 Cb -0.08 -1.68 -0.04 0.00 -0.81 0.00 0.00 33.47 30.86 2qex s TRP 128 CO -0.00 0.10 -0.09 -1.01 -0.51 0.00 0.00 176.95 175.44 2qex s HIS 129 N -0.49 1.12 -0.24 -1.98 3.76 -0.99 -1.32 115.29 115.17 2qex s HIS 129 Ca 0.06 -0.79 0.01 0.00 -0.15 0.00 0.00 55.06 54.20 2qex s HIS 129 Cb -0.12 -0.60 0.06 0.00 1.11 0.00 0.00 32.58 33.03 2qex s HIS 129 CO 0.02 0.00 -0.08 -1.21 -0.85 0.00 0.00 174.74 172.62 2qex s GLU 130 N -3.63 1.85 0.23 1.40 2.02 -0.35 -0.60 118.70 119.62 2qex s GLU 130 Ca 0.14 -1.07 -0.16 0.00 0.02 0.00 0.00 54.97 53.89 2qex s GLU 130 Cb 0.03 -2.65 -0.08 0.00 0.10 0.00 0.00 34.13 31.52 2qex s GLU 130 CO -0.01 -0.57 0.66 0.08 0.02 0.00 0.00 175.26 175.44 2qex s VAL 131 N 1.31 4.71 -0.24 2.63 1.01 -0.79 -2.65 120.40 126.38 2qex s VAL 131 Ca -0.06 1.00 -0.05 0.00 0.00 0.00 0.00 61.98 62.87 2qex s VAL 131 Cb -0.19 -3.74 -0.00 0.00 0.00 0.00 0.00 36.38 32.45 2qex s VAL 131 CO -0.06 0.09 -0.00 -0.63 0.00 0.00 0.00 175.10 174.50 2qex s ILE 132 N -1.65 3.57 0.19 2.22 1.01 -0.17 -2.14 121.20 124.23 2qex s ILE 132 Ca 0.45 -0.55 0.08 0.00 0.00 0.00 0.00 60.65 60.62 2qex s ILE 132 Cb -0.14 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 2qex s ILE 132 CO 0.20 0.31 -0.02 -0.76 0.00 0.00 0.00 174.94 174.67 2qex s LEU 133 N 1.48 3.24 -0.03 2.97 1.02 0.29 0.15 118.68 127.80 2qex s LEU 133 Ca 0.04 -0.46 0.02 0.00 0.02 0.00 0.00 54.13 53.75 2qex s LEU 133 Cb -0.15 -1.88 0.01 0.00 0.02 0.00 0.00 46.19 44.19 2qex s LEU 133 CO -0.01 0.08 -0.06 -0.63 0.02 0.00 0.00 176.35 175.75 2qex s ILE 134 N -1.80 0.58 -0.55 -0.59 -1.09 -0.19 -0.68 121.20 116.86 2qex s ILE 134 Ca 0.27 -0.21 -0.26 0.00 -2.23 0.00 0.00 60.65 58.23 2qex s ILE 134 Cb -0.09 -0.55 0.04 0.00 -1.58 0.00 0.00 42.46 40.28 2qex s ILE 134 CO 0.18 0.21 1.03 -0.62 -1.23 0.00 0.00 174.94 174.51 2qex s ASP 135 N 0.50 6.39 0.00 3.58 -1.08 -0.45 -1.46 116.67 124.14 2qex s ASP 135 Ca -0.07 -0.16 0.14 0.00 -0.52 0.00 0.00 52.55 51.95 2qex s ASP 135 Cb -0.10 -2.48 0.66 0.00 -1.46 0.00 0.00 42.92 39.54 2qex s ASP 135 CO 0.00 -1.30 1.44 -0.81 0.52 0.00 0.00 175.17 175.02 2qex n PRO 136 N 7.78 0.08 -0.00 4.34 -0.04 -1.26 -2.93 135.00 142.97 2qex n PRO 136 Ca 0.04 0.21 0.09 0.00 -0.04 0.00 0.00 63.50 63.81 2qex n PRO 136 Cb 0.48 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.32 2qex n PRO 136 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2qex n ASN 137 N -1.41 0.79 -4.71 3.54 3.02 -1.26 -4.83 115.26 110.40 2qex n ASN 137 Ca 0.05 -0.72 -0.42 0.00 -0.03 0.00 0.00 54.58 53.46 2qex n ASN 137 Cb 0.15 1.23 -0.03 0.00 -0.61 0.00 0.00 39.78 40.52 2qex n ASN 137 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2qex s HIS 138 N -2.97 3.63 -0.28 3.10 2.46 -1.15 -4.93 115.29 115.15 2qex s HIS 138 Ca 0.04 1.66 0.24 0.00 0.47 0.00 0.00 55.06 57.46 2qex s HIS 138 Cb 0.14 -3.11 1.14 0.00 -0.13 0.00 0.00 32.58 30.62 2qex s HIS 138 CO 0.80 -0.04 1.72 -1.00 -2.47 0.00 0.00 174.74 173.76 2qex h PRO 139 N 6.84 0.00 -0.03 2.88 0.13 -1.92 -2.30 132.00 137.61 2qex h PRO 139 Ca -0.40 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.62 2qex h PRO 139 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2qex h PRO 139 CO 0.77 0.00 -0.50 0.00 -0.23 0.00 0.00 178.00 178.04 2qex h ALA 140 N 2.12 1.12 0.13 -0.56 0.00 -1.92 -2.99 119.26 117.16 2qex h ALA 140 Ca 0.00 -0.46 -0.34 0.00 0.00 0.00 0.00 54.91 54.11 2qex h ALA 140 Cb 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2qex h ALA 140 CO 0.00 0.63 -1.81 0.82 0.00 0.00 0.00 179.25 178.90 2qex h ILE 141 N 0.05 0.84 0.00 0.00 2.04 -1.66 -3.32 117.51 115.47 2qex h ILE 141 Ca -0.00 -2.51 0.00 0.00 1.00 0.00 0.00 64.86 63.35 2qex h ILE 141 Cb 0.90 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 39.61 2qex h ILE 141 CO 0.07 0.83 0.00 0.00 0.00 0.00 0.00 178.15 179.05 2qex n GLN 142 N -3.47 0.12 -0.13 2.37 6.02 -0.94 -1.10 117.38 120.25 2qex n GLN 142 Ca -0.25 0.55 0.04 0.00 -0.01 0.00 0.00 57.00 57.33 2qex n GLN 142 Cb 1.06 -1.84 0.11 0.00 1.02 0.00 0.00 30.24 30.58 2qex n GLN 142 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2qex n ASN 143 N -2.09 2.64 -4.55 1.08 3.02 -1.14 -4.86 115.26 109.36 2qex n ASN 143 Ca -0.00 -2.13 -0.42 0.00 -0.03 0.00 0.00 54.58 52.00 2qex n ASN 143 Cb 0.07 -0.18 -0.08 0.00 -0.61 0.00 0.00 39.78 38.99 2qex n ASN 143 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2qex s ASP 144 N -1.16 6.31 0.00 6.41 -1.08 -0.25 -4.92 116.67 121.97 2qex s ASP 144 Ca 0.17 -0.11 0.07 0.00 -0.52 0.00 0.00 52.55 52.16 2qex s ASP 144 Cb 0.10 -2.27 0.35 0.00 -1.46 0.00 0.00 42.92 39.64 2qex s ASP 144 CO 0.09 -0.54 1.17 0.47 0.52 0.00 0.00 175.17 176.88 2qex n ASP 145 N 5.82 0.00 -0.09 -0.34 8.00 -1.26 -0.20 116.55 128.48 2qex n ASP 145 Ca -0.04 0.33 -0.09 0.00 0.71 0.00 0.00 54.79 55.70 2qex n ASP 145 Cb 0.49 -0.39 -0.14 0.00 -0.02 0.00 0.00 41.12 41.06 2qex n ASP 145 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2qex n ASP 146 N -1.39 0.51 -0.07 -2.24 8.00 -1.26 -4.70 116.55 115.40 2qex n ASP 146 Ca 0.03 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.54 2qex n ASP 146 Cb 0.07 0.95 0.00 0.00 -0.02 0.00 0.00 41.12 42.13 2qex n ASP 146 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2qex n LEU 147 N -2.67 0.91 0.25 0.64 4.77 -0.97 -4.75 117.00 115.18 2qex n LEU 147 Ca -0.30 -0.87 0.10 0.00 -0.03 0.00 0.00 56.01 54.91 2qex n LEU 147 Cb 1.09 0.00 0.68 0.00 -2.33 0.00 0.00 43.42 42.86 2qex n LEU 147 CO 0.39 0.21 1.09 0.77 -1.33 0.00 0.00 177.39 178.51 2qex h SER 148 N 0.34 0.00 -0.38 -1.43 4.64 -0.66 -2.82 113.55 113.24 2qex h SER 148 Ca 0.00 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.43 2qex h SER 148 Cb 0.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 2qex h SER 148 CO 0.00 0.00 0.28 4.11 -0.87 0.00 0.00 176.83 180.35 2qex h TRP 149 N 0.00 0.00 0.00 4.77 5.08 -1.85 -1.51 115.95 122.44 2qex h TRP 149 Ca 0.02 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.99 2qex h TRP 149 Cb 0.07 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.23 2qex h TRP 149 CO 0.00 0.00 0.00 1.51 -1.28 0.00 0.00 178.44 178.67 2qex n ILE 150 N -4.40 0.00 -0.02 0.12 3.06 -1.06 -2.86 119.36 114.20 2qex n ILE 150 Ca 0.06 0.00 0.04 0.00 -2.50 0.00 0.00 62.75 60.35 2qex n ILE 150 Cb 0.47 -0.39 -0.12 0.00 0.54 0.00 0.00 39.64 40.13 2qex n ILE 150 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2qex n ALA 152 N -2.16 1.11 -0.30 0.00 0.00 -1.13 -4.91 120.51 113.12 2qex n ALA 152 Ca -0.08 0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.48 2qex n ALA 152 Cb 0.54 -2.30 0.29 0.00 0.00 0.00 0.00 19.45 17.98 2qex n ALA 152 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2qex h ASP 153 N 0.83 0.82 0.12 0.00 3.32 -1.95 -0.12 116.42 119.45 2qex h ASP 153 Ca -0.50 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2qex h ASP 153 Cb 1.33 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2qex h ASP 153 CO 0.54 0.48 0.00 -0.90 -1.72 0.00 0.00 179.24 177.64 2qex n ASP 154 N -4.53 0.00 -0.72 6.45 5.68 -1.26 -1.30 116.55 120.86 2qex n ASP 154 Ca 0.16 -0.24 0.11 0.00 -0.50 0.00 0.00 54.79 54.32 2qex n ASP 154 Cb 0.31 -0.12 0.05 0.00 -1.14 0.00 0.00 41.12 40.22 2qex n ASP 154 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2qex n GLN 155 N -1.12 1.79 -1.81 0.11 1.13 -0.06 -4.88 117.38 112.53 2qex n GLN 155 Ca 0.09 -1.48 -0.42 0.00 -1.94 0.00 0.00 57.00 53.26 2qex n GLN 155 Cb 0.08 -1.43 -0.03 0.00 0.11 0.00 0.00 30.24 28.98 2qex n GLN 155 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2qex s ALA 156 N -2.05 3.84 -1.28 -1.58 0.00 -0.42 -2.42 121.76 117.85 2qex s ALA 156 Ca 0.22 1.52 -0.02 0.00 0.00 0.00 0.00 51.96 53.68 2qex s ALA 156 Cb 0.18 -3.66 0.01 0.00 0.00 0.00 0.00 23.12 19.65 2qex s ALA 156 CO 0.38 -0.89 0.16 -0.25 0.00 0.00 0.00 175.76 175.16 2qex n ASP 157 N 3.45 -4.49 -0.24 0.00 8.00 -1.26 -4.87 116.55 117.14 2qex n ASP 157 Ca 0.13 0.00 0.26 0.00 0.71 0.00 0.00 54.79 55.89 2qex n ASP 157 Cb 0.37 -3.75 0.63 0.00 -0.02 0.00 0.00 41.12 38.35 2qex n ASP 157 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 2qex h ARG 158 N -0.33 0.18 -0.34 -1.24 0.11 -1.82 -2.40 114.38 108.53 2qex h ARG 158 Ca -0.38 -0.01 -0.09 0.00 0.10 0.00 0.00 59.98 59.60 2qex h ARG 158 Cb 1.27 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 32.30 2qex h ARG 158 CO 0.45 0.12 -0.12 -0.24 0.10 0.00 0.00 179.97 180.27 2qex h VAL 159 N 0.18 1.28 0.00 0.08 3.04 -1.89 -2.06 116.25 116.89 2qex h VAL 159 Ca 0.49 -1.21 0.00 0.00 -1.01 0.00 0.00 66.70 64.97 2qex h VAL 159 Cb 1.61 1.36 0.00 0.00 -2.01 0.00 0.00 31.29 32.25 2qex h VAL 159 CO -0.11 0.40 0.00 0.49 -1.01 0.00 0.00 177.57 177.34 2qex n PHE 160 N -4.38 0.16 -0.41 3.17 3.01 -0.91 -2.02 117.46 116.09 2qex n PHE 160 Ca -0.02 0.07 0.06 0.00 1.01 0.00 0.00 57.45 58.56 2qex n PHE 160 Cb 0.37 -0.61 0.16 0.00 -0.01 0.00 0.00 39.48 39.39 2qex n PHE 160 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2qex n ARG 161 N -1.65 2.83 -1.27 -1.08 1.74 -1.17 -5.00 116.66 111.05 2qex n ARG 161 Ca 0.02 -2.22 -0.09 0.00 -0.77 0.00 0.00 57.85 54.80 2qex n ARG 161 Cb 0.13 -1.40 -0.04 0.00 -1.02 0.00 0.00 32.46 30.14 2qex n ARG 161 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qex n GLY 162 N 0.03 1.07 0.46 -0.13 0.00 -0.86 -4.91 105.19 100.85 2qex n GLY 162 Ca 0.13 -0.50 0.06 0.00 0.00 0.00 0.00 46.02 45.70 2qex n GLY 162 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qex n LEU 163 N -1.04 1.33 -4.90 0.99 4.77 -0.78 -3.18 117.00 114.18 2qex n LEU 163 Ca -0.09 -0.64 -0.28 0.00 -0.03 0.00 0.00 56.01 54.97 2qex n LEU 163 Cb 0.33 -0.15 0.04 0.00 -2.33 0.00 0.00 43.42 41.31 2qex n LEU 163 CO 0.14 0.32 0.64 0.28 -1.33 0.00 0.00 177.39 177.44 2qex s THR 164 N -1.71 3.42 0.06 -5.08 -1.32 -1.26 -4.85 115.64 104.91 2qex s THR 164 Ca 0.21 0.18 -0.30 0.00 -1.21 0.00 0.00 61.69 60.57 2qex s THR 164 Cb 0.11 -3.41 -0.18 0.00 -1.51 0.00 0.00 72.50 67.51 2qex s THR 164 CO 0.15 -0.48 1.53 1.23 -2.21 0.00 0.00 174.62 174.84 2qex h GLY 165 N -0.44 -0.80 2.00 6.08 0.00 -1.89 0.10 103.07 108.13 2qex h GLY 165 Ca -0.45 0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 2qex h GLY 165 CO 0.62 -0.29 -0.03 0.00 0.00 0.00 0.00 176.54 176.84 2qex h ALA 166 N -0.46 1.33 0.27 3.60 0.00 -1.94 -2.28 119.26 119.78 2qex h ALA 166 Ca -0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2qex h ALA 166 Cb 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2qex h ALA 166 CO 0.13 0.03 -0.13 0.78 0.00 0.00 0.00 179.25 180.06 2qex h GLY 167 N 0.25 -0.38 1.35 0.00 0.00 -1.64 -2.35 103.07 100.29 2qex h GLY 167 Ca -0.00 0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.52 2qex h GLY 167 CO 0.00 -0.14 0.33 3.21 0.00 0.00 0.00 176.54 179.94 2qex h ARG 168 N -0.86 0.46 -0.13 4.80 3.08 -0.27 -1.44 114.38 120.01 2qex h ARG 168 Ca -0.04 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 2qex h ARG 168 Cb 0.51 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2qex h ARG 168 CO 0.06 0.31 -0.29 0.00 -1.07 0.00 0.00 179.97 178.98 2qex h ARG 169 N 0.48 0.43 0.00 0.04 3.08 -1.48 -2.74 114.38 114.19 2qex h ARG 169 Ca 0.21 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 2qex h ARG 169 Cb 0.22 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.31 2qex h ARG 169 CO -0.05 0.89 -0.06 -0.97 -1.07 0.00 0.00 179.97 178.71 2qex h ASN 170 N 0.03 0.00 -0.05 7.04 -1.24 -0.82 0.67 115.58 121.21 2qex h ASN 170 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2qex h ASN 170 Cb 0.89 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.94 2qex h ASN 170 CO 0.06 0.06 0.00 0.54 -1.29 0.00 0.00 177.43 176.80 2qex n ARG 171 N -3.88 1.15 -3.38 6.67 1.74 -0.60 -4.91 116.66 113.44 2qex n ARG 171 Ca -0.03 -0.23 -0.18 0.00 -0.77 0.00 0.00 57.85 56.65 2qex n ARG 171 Cb 0.15 -1.18 0.08 0.00 -1.02 0.00 0.00 32.46 30.49 2qex n ARG 171 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qex n GLY 172 N 0.73 -0.34 0.61 -0.13 0.00 0.23 -4.87 105.19 101.42 2qex n GLY 172 Ca 0.08 0.10 0.05 0.00 0.00 0.00 0.00 46.02 46.25 2qex n GLY 172 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qex n LEU 173 N -4.14 2.82 0.40 0.99 4.77 -1.05 -4.70 117.00 116.11 2qex n LEU 173 Ca -0.19 -1.92 -0.17 0.00 -0.03 0.00 0.00 56.01 53.70 2qex n LEU 173 Cb 0.63 -0.21 -0.08 0.00 -2.33 0.00 0.00 43.42 41.43 2qex n LEU 173 CO 0.58 0.70 0.50 0.28 -1.33 0.00 0.00 177.39 178.12 2qex h SER 174 N 1.99 -0.87 -3.88 -1.43 0.02 -1.84 -3.44 113.55 104.11 2qex h SER 174 Ca 0.00 0.01 -0.51 0.00 -0.84 0.00 0.00 61.79 60.45 2qex h SER 174 Cb 0.70 0.23 0.05 0.00 0.14 0.00 0.00 62.40 63.52 2qex h SER 174 CO 0.00 -0.54 0.55 -0.83 -1.14 0.00 0.00 176.83 174.87 2qex s GLY 175 N -2.25 2.98 -0.00 -3.77 0.00 -1.26 -4.96 107.32 98.06 2qex s GLY 175 Ca -0.17 1.07 0.20 0.00 0.00 0.00 0.00 44.72 45.83 2qex s GLY 175 CO 0.53 1.67 0.81 0.28 0.00 0.00 0.00 173.10 176.40 2qex n LYS 176 N 0.70 0.38 0.00 2.90 5.02 -1.26 -4.80 118.16 121.10 2qex n LYS 176 Ca 0.01 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2qex n LYS 176 Cb 0.44 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 2qex n LYS 176 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qex n GLY 177 N 1.46 1.72 3.61 0.72 0.00 -1.26 -4.98 105.19 106.46 2qex n GLY 177 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 2qex n GLY 177 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qex n LYS 178 N 0.00 1.34 -0.99 1.61 4.81 -1.26 -2.57 118.16 121.10 2qex n LYS 178 Ca 0.00 0.48 0.00 0.00 -0.87 0.00 0.00 58.31 57.92 2qex n LYS 178 Cb 0.00 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.02 2qex n LYS 178 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qex n GLY 179 N 1.19 0.85 0.44 3.14 0.00 -1.26 -4.89 105.19 104.67 2qex n GLY 179 Ca 0.09 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.19 2qex n GLY 179 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qex n SER 180 N -0.00 1.89 0.07 1.61 3.41 -1.06 -4.76 113.62 114.78 2qex n SER 180 Ca 0.00 -3.62 -0.04 0.00 -0.26 0.00 0.00 58.87 54.95 2qex n SER 180 Cb 0.00 -0.49 0.17 0.00 -0.26 0.00 0.00 64.21 63.63 2qex n SER 180 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2qex h GLU 181 N 0.68 0.32 -0.00 4.33 3.07 -1.90 -3.21 114.58 117.87 2qex h GLU 181 Ca -0.00 -0.17 0.00 0.00 -0.50 0.00 0.00 59.36 58.69 2qex h GLU 181 Cb 1.01 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.93 2qex h GLU 181 CO 0.00 0.72 -0.84 1.63 -1.40 0.00 0.00 179.01 179.11 2qex n LYS 182 N -3.99 0.35 -0.05 2.33 5.02 -1.26 -4.57 118.16 115.99 2qex n LYS 182 Ca -0.02 -0.29 -0.21 0.00 -2.02 0.00 0.00 58.31 55.77 2qex n LYS 182 Cb 0.52 -1.49 -0.13 0.00 -0.02 0.00 0.00 35.03 33.91 2qex n LYS 182 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2qex n THR 183 N -1.07 1.66 -3.67 -0.18 -2.24 -1.23 -4.54 114.28 103.01 2qex n THR 183 Ca 0.06 -0.53 -0.34 0.00 -2.27 0.00 0.00 64.05 60.96 2qex n THR 183 Cb 0.37 -1.71 -0.05 0.00 -2.10 0.00 0.00 70.33 66.84 2qex n THR 183 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2qex s ARG 184 N -2.52 3.66 0.00 -0.78 3.52 -1.21 -1.61 118.95 120.01 2qex s ARG 184 Ca -0.28 0.02 0.31 0.00 -0.13 0.00 0.00 55.73 55.66 2qex s ARG 184 Cb 0.08 -3.00 1.76 0.00 -1.56 0.00 0.00 34.95 32.23 2qex s ARG 184 CO 0.68 0.57 2.15 -0.35 -0.81 0.00 0.00 175.30 177.55 2qex n PRO 185 N 0.81 1.00 -3.59 5.12 -0.04 -1.26 -4.91 135.00 132.13 2qex n PRO 185 Ca -0.08 -0.10 -0.06 0.00 -0.04 0.00 0.00 63.50 63.22 2qex n PRO 185 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 2qex n PRO 185 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2qex s SER 186 N -2.07 -0.21 0.01 3.54 1.04 -0.63 -5.04 113.70 110.33 2qex s SER 186 Ca 0.44 0.12 -0.23 0.00 0.48 0.00 0.00 55.95 56.77 2qex s SER 186 Cb 0.22 0.19 -0.18 0.00 0.10 0.00 0.00 66.02 66.35 2qex s SER 186 CO 0.38 -0.26 1.30 -0.07 0.98 0.00 0.00 173.24 175.57 2qex h LEU 187 N 2.17 0.18 -0.87 2.42 3.38 -1.79 -3.15 115.31 117.66 2qex h LEU 187 Ca -0.13 -0.49 0.05 0.00 0.09 0.00 0.00 57.88 57.40 2qex h LEU 187 Cb 1.18 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.82 2qex h LEU 187 CO 0.26 0.63 0.55 -0.09 0.09 0.00 0.00 178.44 179.88 2qex h ARG 188 N -0.27 1.01 0.00 1.13 2.43 -1.92 -1.84 114.38 114.94 2qex h ARG 188 Ca 0.01 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.05 2qex h ARG 188 Cb 0.58 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2qex h ARG 188 CO 0.02 0.67 -0.33 0.66 -1.51 0.00 0.00 179.97 179.48 2qex h SER 189 N 1.05 0.00 -0.43 -3.80 4.64 -1.94 -2.55 113.55 110.51 2qex h SER 189 Ca 0.36 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.53 2qex h SER 189 Cb 0.07 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.08 2qex h SER 189 CO -0.14 0.33 0.18 0.59 -0.87 0.00 0.00 176.83 176.92 2qex n ASN 190 N -4.08 3.49 -1.20 4.97 3.02 -0.81 -4.89 115.26 115.76 2qex n ASN 190 Ca -0.02 -2.69 -0.15 0.00 -0.03 0.00 0.00 54.58 51.69 2qex n ASN 190 Cb 0.37 -0.64 -0.05 0.00 -0.61 0.00 0.00 39.78 38.85 2qex n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qex n GLY 191 N -0.04 1.20 3.04 7.41 0.00 -0.96 -3.88 105.19 111.97 2qex n GLY 191 Ca 0.24 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 2qex n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qex n GLY 192 N -1.17 -1.01 1.39 -0.02 0.00 -0.76 -5.00 105.19 98.63 2qex n GLY 192 Ca -0.15 0.48 -0.08 0.00 0.00 0.00 0.00 46.02 46.27 2qex n GLY 192 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qex n LYS 193 N -2.74 2.40 0.00 1.61 5.02 -1.25 -5.09 118.16 118.11 2qex n LYS 193 Ca -0.05 -3.62 0.00 0.00 -2.02 0.00 0.00 58.31 52.62 2qex n LYS 193 Cb 0.58 -1.82 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2qex n LYS 193 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88