#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qex s ARG 2 N 0.00 0.38 -0.10 -0.52 3.52 -1.26 -1.83 118.95 119.14 2qex s ARG 2 Ca 0.00 1.08 0.02 0.00 -0.13 0.00 0.00 55.73 56.70 2qex s ARG 2 Cb 0.00 0.39 -0.02 0.00 -1.56 0.00 0.00 34.95 33.76 2qex s ARG 2 CO 0.00 -0.28 -0.15 0.14 -0.81 0.00 0.00 175.30 174.20 2qex s VAL 3 N 2.67 2.93 -0.19 7.11 -7.23 -0.85 -5.01 120.40 119.84 2qex s VAL 3 Ca -0.01 -0.73 -0.04 0.00 -1.81 0.00 0.00 61.98 59.40 2qex s VAL 3 Cb -0.12 -2.19 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 2qex s VAL 3 CO -0.14 0.55 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.54 2qex s GLU 4 N 0.00 3.50 -0.23 4.82 2.02 -1.26 -2.30 118.70 125.25 2qex s GLU 4 Ca -0.05 -0.58 -0.05 0.00 0.02 0.00 0.00 54.97 54.31 2qex s GLU 4 Cb -0.14 -2.97 -0.01 0.00 0.10 0.00 0.00 34.13 31.11 2qex s GLU 4 CO 0.04 -0.01 -0.01 -0.51 0.02 0.00 0.00 175.26 174.80 2qex s LEU 5 N 1.01 3.09 -0.30 1.80 1.43 -0.15 -4.96 118.68 120.60 2qex s LEU 5 Ca 0.01 -0.37 -0.25 0.00 -1.03 0.00 0.00 54.13 52.49 2qex s LEU 5 Cb -0.15 -1.79 0.00 0.00 0.03 0.00 0.00 46.19 44.28 2qex s LEU 5 CO 0.01 -0.04 0.85 -1.61 0.23 0.00 0.00 176.35 175.79 2qex s GLU 6 N 1.51 4.02 0.12 1.70 2.02 -1.26 0.11 118.70 126.93 2qex s GLU 6 Ca 0.06 0.75 -0.30 0.00 0.02 0.00 0.00 54.97 55.50 2qex s GLU 6 Cb -0.15 -3.71 -0.06 0.00 0.10 0.00 0.00 34.13 30.30 2qex s GLU 6 CO -0.01 -0.69 1.10 -1.50 0.02 0.00 0.00 175.26 174.17 2qex s ILE 7 N 3.07 4.08 1.07 -1.63 2.07 -1.03 -4.98 121.20 123.85 2qex s ILE 7 Ca 0.35 1.67 -0.13 0.00 -1.41 0.00 0.00 60.65 61.13 2qex s ILE 7 Cb -0.14 -4.07 0.18 0.00 0.13 0.00 0.00 42.46 38.56 2qex s ILE 7 CO 0.12 0.23 0.74 -2.65 -1.91 0.00 0.00 174.94 171.47 2qex n PRO 8 N 2.94 -1.46 0.08 3.50 -0.02 -1.26 -4.93 135.00 133.85 2qex n PRO 8 Ca 0.04 -0.39 -0.07 0.00 -2.02 0.00 0.00 63.50 61.06 2qex n PRO 8 Cb 0.47 -2.07 0.05 0.00 -0.02 0.00 0.00 33.50 31.93 2qex n PRO 8 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2qex h GLU 9 N -2.19 0.26 -0.62 -0.52 4.11 -2.00 -3.16 114.58 110.46 2qex h GLU 9 Ca -0.53 -0.22 0.00 0.00 0.07 0.00 0.00 59.36 58.68 2qex h GLU 9 Cb 1.31 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.58 2qex h GLU 9 CO 0.42 0.88 0.39 0.22 0.07 0.00 0.00 179.01 180.99 2qex h ASP 10 N 0.18 0.73 -3.84 3.06 1.82 -1.99 -3.45 116.42 112.93 2qex h ASP 10 Ca -0.02 -0.04 -0.47 0.00 -0.39 0.00 0.00 57.03 56.10 2qex h ASP 10 Cb 1.29 -0.18 0.07 0.00 0.68 0.00 0.00 39.33 41.18 2qex h ASP 10 CO 0.11 0.56 0.23 -0.69 -1.61 0.00 0.00 179.24 177.85 2qex s VAL 11 N -6.04 3.13 -0.20 2.25 1.01 -1.20 -4.66 120.40 114.69 2qex s VAL 11 Ca -0.13 -0.02 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 2qex s VAL 11 Cb 0.13 -3.30 0.10 0.00 0.00 0.00 0.00 36.38 33.31 2qex s VAL 11 CO 0.76 -0.32 0.41 -0.62 0.00 0.00 0.00 175.10 175.33 2qex s ASP 12 N -4.39 -0.17 -0.11 3.32 -1.08 -0.72 -4.80 116.67 108.73 2qex s ASP 12 Ca 0.57 0.85 0.02 0.00 -0.52 0.00 0.00 52.55 53.47 2qex s ASP 12 Cb -0.11 1.30 -0.01 0.00 -1.46 0.00 0.00 42.92 42.64 2qex s ASP 12 CO 0.46 -0.24 -0.17 0.00 0.52 0.00 0.00 175.17 175.73 2qex s ALA 13 N 2.60 2.45 0.04 3.66 0.00 -1.26 -1.44 121.76 127.80 2qex s ALA 13 Ca 0.01 -0.93 0.07 0.00 0.00 0.00 0.00 51.96 51.12 2qex s ALA 13 Cb -0.13 -1.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.93 2qex s ALA 13 CO -0.13 0.28 -0.21 -2.00 0.00 0.00 0.00 175.76 173.71 2qex s GLU 14 N 0.28 1.41 -0.01 0.00 2.12 -0.50 -5.00 118.70 116.99 2qex s GLU 14 Ca -0.13 -0.92 0.05 0.00 0.36 0.00 0.00 54.97 54.34 2qex s GLU 14 Cb -0.16 -1.51 -0.01 0.00 0.26 0.00 0.00 34.13 32.71 2qex s GLU 14 CO 0.07 0.39 -0.17 -1.14 -0.54 0.00 0.00 175.26 173.86 2qex s GLN 15 N -1.12 1.42 -0.11 4.30 0.74 -1.26 -0.82 119.66 122.81 2qex s GLN 15 Ca 0.07 -0.62 -0.02 0.00 0.05 0.00 0.00 55.36 54.84 2qex s GLN 15 Cb -0.09 -1.37 0.04 0.00 1.10 0.00 0.00 33.01 32.69 2qex s GLN 15 CO 0.02 0.37 0.02 0.34 -0.55 0.00 0.00 175.29 175.49 2qex s ASP 16 N -0.40 1.94 1.94 6.67 -1.08 -0.66 -5.04 116.67 120.05 2qex s ASP 16 Ca 0.07 -0.29 0.00 0.00 -0.52 0.00 0.00 52.55 51.80 2qex s ASP 16 Cb -0.07 -0.45 0.00 0.00 -1.46 0.00 0.00 42.92 40.94 2qex s ASP 16 CO -0.01 -0.23 0.00 1.41 0.52 0.00 0.00 175.17 176.86 2qex n HIS 17 N 5.14 0.00 1.31 -5.34 8.25 -1.26 -1.51 115.22 121.81 2qex n HIS 17 Ca -0.07 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.52 2qex n HIS 17 Cb 0.49 0.00 0.38 0.00 1.12 0.00 0.00 29.99 31.98 2qex n HIS 17 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2qex n LEU 18 N 0.00 2.02 -4.84 2.41 4.77 -1.26 -4.89 117.00 115.20 2qex n LEU 18 Ca 0.00 -0.68 -0.38 0.00 -0.03 0.00 0.00 56.01 54.92 2qex n LEU 18 Cb 0.00 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2qex n LEU 18 CO 0.00 0.34 0.06 -1.81 -1.33 0.00 0.00 177.39 174.65 2qex s ASP 19 N -1.98 6.74 -0.05 -1.43 1.01 -0.57 -1.23 116.67 119.16 2qex s ASP 19 Ca 0.35 0.88 0.04 0.00 0.71 0.00 0.00 52.55 54.53 2qex s ASP 19 Cb 0.21 -2.22 0.00 0.00 1.01 0.00 0.00 42.92 41.92 2qex s ASP 19 CO 0.32 0.33 -0.17 -0.63 0.21 0.00 0.00 175.17 175.23 2qex s ILE 20 N -1.09 1.45 -0.10 0.77 1.01 -0.57 -1.65 121.20 121.03 2qex s ILE 20 Ca 0.23 -0.71 0.03 0.00 0.00 0.00 0.00 60.65 60.19 2qex s ILE 20 Cb -0.16 -1.26 -0.01 0.00 0.01 0.00 0.00 42.46 41.04 2qex s ILE 20 CO 0.12 0.42 -0.18 -0.89 0.00 0.00 0.00 174.94 174.41 2qex s THR 21 N 0.19 2.66 -0.23 2.92 2.01 -0.00 -1.21 115.64 121.97 2qex s THR 21 Ca -0.07 -0.82 0.01 0.00 0.31 0.00 0.00 61.69 61.11 2qex s THR 21 Cb -0.13 -2.06 0.05 0.00 0.01 0.00 0.00 72.50 70.37 2qex s THR 21 CO 0.03 0.55 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.75 2qex s VAL 22 N 0.07 1.68 -0.08 3.82 1.01 0.13 -1.41 120.40 125.63 2qex s VAL 22 Ca -0.08 -1.24 -0.01 0.00 0.00 0.00 0.00 61.98 60.65 2qex s VAL 22 Cb -0.15 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 2qex s VAL 22 CO 0.05 -0.01 -0.01 -1.61 0.00 0.00 0.00 175.10 173.52 2qex s GLU 23 N 1.34 2.94 0.05 2.72 2.02 -0.52 -0.92 118.70 126.32 2qex s GLU 23 Ca -0.05 -0.44 -0.00 0.00 0.02 0.00 0.00 54.97 54.50 2qex s GLU 23 Cb -0.18 -2.76 0.00 0.00 0.10 0.00 0.00 34.13 31.29 2qex s GLU 23 CO -0.07 0.69 0.07 0.41 0.02 0.00 0.00 175.26 176.39 2qex n GLY 24 N 2.11 3.05 0.19 -1.39 0.00 0.20 -1.75 105.19 107.60 2qex n GLY 24 Ca -0.18 -1.43 0.01 0.00 0.00 0.00 0.00 46.02 44.42 2qex n GLY 24 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qex h ASP 25 N 0.28 0.10 -0.03 1.61 3.32 -1.61 -2.78 116.42 117.30 2qex h ASP 25 Ca -0.04 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2qex h ASP 25 Cb 0.17 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2qex h ASP 25 CO 0.05 0.48 0.00 -3.20 -1.72 0.00 0.00 179.24 174.85 2qex n ASN 26 N -4.07 1.21 0.00 6.45 5.15 -0.07 -5.04 115.26 118.90 2qex n ASN 26 Ca -0.02 -1.43 0.00 0.00 -0.60 0.00 0.00 54.58 52.54 2qex n ASN 26 Cb 0.43 -0.01 0.00 0.00 -0.53 0.00 0.00 39.78 39.67 2qex n ASN 26 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2qex n GLY 27 N 1.13 0.79 3.06 8.20 0.00 -1.05 -4.68 105.19 112.64 2qex n GLY 27 Ca 0.20 -1.86 -0.10 0.00 0.00 0.00 0.00 46.02 44.25 2qex n GLY 27 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qex s SER 28 N -4.00 0.16 -0.05 1.61 1.04 -1.26 0.59 113.70 111.79 2qex s SER 28 Ca 0.00 -0.42 -0.02 0.00 0.48 0.00 0.00 55.95 55.99 2qex s SER 28 Cb 0.00 0.17 0.03 0.00 0.10 0.00 0.00 66.02 66.32 2qex s SER 28 CO 0.00 -0.38 0.08 -0.69 0.98 0.00 0.00 173.24 173.23 2qex s VAL 29 N -1.77 -0.11 -0.16 5.02 1.01 -0.10 -4.81 120.40 119.48 2qex s VAL 29 Ca -0.12 0.30 -0.00 0.00 0.00 0.00 0.00 61.98 62.15 2qex s VAL 29 Cb -0.07 -0.17 -0.00 0.00 0.00 0.00 0.00 36.38 36.14 2qex s VAL 29 CO -0.01 0.12 -0.14 -0.89 0.00 0.00 0.00 175.10 174.18 2qex s THR 30 N 1.63 2.77 0.48 3.92 2.01 -1.26 -0.69 115.64 124.49 2qex s THR 30 Ca -0.03 -0.74 0.03 0.00 0.31 0.00 0.00 61.69 61.26 2qex s THR 30 Cb -0.12 -2.17 -0.03 0.00 0.01 0.00 0.00 72.50 70.18 2qex s THR 30 CO -0.04 0.51 0.02 -0.13 -0.69 0.00 0.00 174.62 174.29 2qex s ARG 31 N 0.81 2.11 -0.23 4.92 0.52 -0.35 -4.95 118.95 121.78 2qex s ARG 31 Ca -0.05 -2.31 0.00 0.00 -0.52 0.00 0.00 55.73 52.85 2qex s ARG 31 Cb -0.15 -1.45 0.06 0.00 0.52 0.00 0.00 34.95 33.93 2qex s ARG 31 CO 0.00 -0.31 -0.03 0.50 0.02 0.00 0.00 175.30 175.48 2qex s ARG 32 N -3.83 1.45 -0.59 3.54 3.52 -1.26 -1.51 118.95 120.27 2qex s ARG 32 Ca 0.14 -0.94 -0.12 0.00 -0.13 0.00 0.00 55.73 54.68 2qex s ARG 32 Cb 0.03 -2.52 0.15 0.00 -1.56 0.00 0.00 34.95 31.06 2qex s ARG 32 CO 0.07 -0.63 0.51 -0.51 -0.81 0.00 0.00 175.30 173.93 2qex s LEU 33 N 1.45 6.08 -0.15 -0.88 1.43 -0.37 -5.00 118.68 121.24 2qex s LEU 33 Ca -0.04 -2.15 0.01 0.00 -1.03 0.00 0.00 54.13 50.92 2qex s LEU 33 Cb -0.19 -2.11 0.02 0.00 0.03 0.00 0.00 46.19 43.94 2qex s LEU 33 CO -0.07 -0.69 -0.16 0.86 0.23 0.00 0.00 176.35 176.52 2qex s TRP 34 N 1.02 2.29 -0.28 0.29 -0.00 -1.26 -4.86 118.94 116.15 2qex s TRP 34 Ca 0.09 -1.26 -0.23 0.00 -0.00 0.00 0.00 56.10 54.70 2qex s TRP 34 Cb -0.23 -1.65 0.09 0.00 -0.00 0.00 0.00 33.47 31.68 2qex s TRP 34 CO -0.02 -0.66 0.80 -0.47 -0.00 0.00 0.00 176.95 176.61 2qex s TYR 35 N 1.31 -0.75 -0.44 5.86 5.04 -1.26 -5.12 117.35 121.98 2qex s TYR 35 Ca 0.02 1.74 -0.45 0.00 -2.44 0.00 0.00 57.07 55.94 2qex s TYR 35 Cb -0.13 0.36 -0.19 0.00 0.35 0.00 0.00 41.96 42.35 2qex s TYR 35 CO -0.09 -0.37 1.66 -2.30 -1.34 0.00 0.00 175.55 173.12 2qex n PRO 36 N 2.95 0.31 -1.82 4.97 -0.02 -1.26 -2.14 135.00 137.98 2qex n PRO 36 Ca -0.15 0.11 -0.20 0.00 -2.02 0.00 0.00 63.50 61.24 2qex n PRO 36 Cb 0.56 -1.66 -0.06 0.00 -0.02 0.00 0.00 33.50 32.31 2qex n PRO 36 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2qex n ASP 37 N 4.53 -5.42 -4.45 2.55 8.00 -1.26 -4.99 116.55 115.51 2qex n ASP 37 Ca 0.31 0.35 -0.36 0.00 0.71 0.00 0.00 54.79 55.80 2qex n ASP 37 Cb -0.01 -4.72 -0.12 0.00 -0.02 0.00 0.00 41.12 36.25 2qex n ASP 37 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qex s ILE 38 N -2.79 4.13 -0.23 0.53 1.01 -0.91 -4.29 121.20 118.65 2qex s ILE 38 Ca 0.00 -0.24 -0.07 0.00 0.00 0.00 0.00 60.65 60.34 2qex s ILE 38 Cb 0.00 -2.90 -0.03 0.00 0.01 0.00 0.00 42.46 39.54 2qex s ILE 38 CO 0.00 0.39 0.07 -1.81 0.00 0.00 0.00 174.94 173.59 2qex s ASP 39 N 1.27 5.25 -0.15 3.58 1.01 0.16 -4.76 116.67 123.03 2qex s ASP 39 Ca 0.04 -0.14 -0.03 0.00 0.71 0.00 0.00 52.55 53.13 2qex s ASP 39 Cb -0.15 -1.93 -0.03 0.00 1.01 0.00 0.00 42.92 41.83 2qex s ASP 39 CO 0.02 0.02 -0.05 -0.69 0.21 0.00 0.00 175.17 174.68 2qex s VAL 40 N 1.29 3.81 0.16 -1.27 1.01 -1.25 -0.89 120.40 123.26 2qex s VAL 40 Ca 0.05 -0.39 -0.08 0.00 0.00 0.00 0.00 61.98 61.56 2qex s VAL 40 Cb -0.15 -2.66 -0.01 0.00 0.00 0.00 0.00 36.38 33.56 2qex s VAL 40 CO 0.03 0.50 0.25 -0.94 0.00 0.00 0.00 175.10 174.95 2qex s SER 41 N 0.29 0.08 -0.28 3.32 1.04 -0.27 -4.98 113.70 112.90 2qex s SER 41 Ca -0.04 -0.92 -0.04 0.00 0.48 0.00 0.00 55.95 55.43 2qex s SER 41 Cb -0.14 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.42 2qex s SER 41 CO 0.03 -0.87 0.01 -0.69 0.98 0.00 0.00 173.24 172.70 2qex s VAL 42 N -3.98 3.28 -0.91 5.02 1.01 -1.26 -0.75 120.40 122.81 2qex s VAL 42 Ca 0.18 -1.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.11 2qex s VAL 42 Cb 0.04 -2.76 0.29 0.00 0.00 0.00 0.00 36.38 33.95 2qex s VAL 42 CO 0.00 0.04 1.24 -0.67 0.00 0.00 0.00 175.10 175.72 2qex n ASP 43 N 4.72 5.55 0.00 3.32 2.03 0.30 -4.98 116.55 127.49 2qex n ASP 43 Ca -0.15 -3.45 0.00 0.00 0.52 0.00 0.00 54.79 51.71 2qex n ASP 43 Cb 0.46 -1.04 0.00 0.00 -0.72 0.00 0.00 41.12 39.82 2qex n ASP 43 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2qex n GLY 44 N 1.02 0.77 0.01 0.27 0.00 -1.26 -2.74 105.19 103.25 2qex n GLY 44 Ca 0.29 0.57 0.11 0.00 0.00 0.00 0.00 46.02 46.98 2qex n GLY 44 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qex n ASP 45 N 2.91 0.77 -4.13 1.61 5.75 -1.26 -4.99 116.55 117.21 2qex n ASP 45 Ca 0.00 -0.64 -0.09 0.00 -0.01 0.00 0.00 54.79 54.04 2qex n ASP 45 Cb 0.00 0.63 -0.10 0.00 -1.03 0.00 0.00 41.12 40.62 2qex n ASP 45 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2qex s THR 46 N -2.99 0.48 -0.14 2.12 -4.23 -1.11 -2.45 115.64 107.32 2qex s THR 46 Ca 0.10 -1.81 -0.06 0.00 -1.18 0.00 0.00 61.69 58.73 2qex s THR 46 Cb 0.17 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.44 2qex s THR 46 CO 0.78 -0.89 0.09 -0.69 -0.54 0.00 0.00 174.62 173.37 2qex s VAL 47 N -3.58 5.08 -0.11 2.29 1.01 0.12 -0.54 120.40 124.67 2qex s VAL 47 Ca 0.08 0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.14 2qex s VAL 47 Cb 0.05 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 2qex s VAL 47 CO -0.07 0.55 -0.20 -0.69 0.00 0.00 0.00 175.10 174.70 2qex s VAL 48 N -0.47 2.43 -0.29 2.92 1.01 0.07 -0.98 120.40 125.10 2qex s VAL 48 Ca 0.11 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.23 2qex s VAL 48 Cb -0.12 -1.96 0.07 0.00 0.00 0.00 0.00 36.38 34.37 2qex s VAL 48 CO 0.02 0.55 -0.05 -0.63 0.00 0.00 0.00 175.10 174.98 2qex s ILE 49 N 0.34 2.16 0.06 2.22 1.01 -0.97 -1.11 121.20 124.91 2qex s ILE 49 Ca -0.16 -1.85 0.02 0.00 0.00 0.00 0.00 60.65 58.66 2qex s ILE 49 Cb -0.17 -2.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.88 2qex s ILE 49 CO 0.08 -0.23 -0.07 -1.83 0.00 0.00 0.00 174.94 172.89 2qex s GLU 50 N 1.05 0.63 0.00 2.79 -1.05 -0.07 -2.00 118.70 120.06 2qex s GLU 50 Ca -0.02 -0.99 -0.20 0.00 -0.15 0.00 0.00 54.97 53.61 2qex s GLU 50 Cb -0.20 -0.21 0.04 0.00 -0.44 0.00 0.00 34.13 33.32 2qex s GLU 50 CO -0.06 0.01 0.45 0.45 0.95 0.00 0.00 175.26 177.05 2qex s SER 51 N -2.19 -0.35 0.37 0.83 0.15 -0.76 0.40 113.70 112.16 2qex s SER 51 Ca -0.01 0.21 0.23 0.00 0.70 0.00 0.00 55.95 57.07 2qex s SER 51 Cb -0.03 0.42 0.25 0.00 -1.71 0.00 0.00 66.02 64.94 2qex s SER 51 CO -0.02 -0.58 1.45 0.44 1.20 0.00 0.00 173.24 175.73 2qex h ASP 52 N 3.29 0.00 -3.56 5.45 3.32 -1.86 -1.39 116.42 121.67 2qex h ASP 52 Ca -0.30 -0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.24 2qex h ASP 52 Cb 1.18 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.71 2qex h ASP 52 CO 0.41 0.00 0.00 -1.61 -1.72 0.00 0.00 179.24 176.32 2qex s GLU 53 N -3.25 3.84 0.00 3.56 2.02 -1.26 -4.74 118.70 118.86 2qex s GLU 53 Ca 0.05 0.41 0.00 0.00 0.02 0.00 0.00 54.97 55.45 2qex s GLU 53 Cb 0.06 -2.52 0.00 0.00 0.10 0.00 0.00 34.13 31.77 2qex s GLU 53 CO 0.70 0.17 0.77 -0.40 0.02 0.00 0.00 175.26 176.53 2qex n ASP 54 N -0.57 1.11 -4.74 -0.19 5.75 -1.26 -4.30 116.55 112.35 2qex n ASP 54 Ca 0.02 -1.55 -0.32 0.00 -0.01 0.00 0.00 54.79 52.93 2qex n ASP 54 Cb 0.53 0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.72 2qex n ASP 54 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2qex s ASN 55 N -0.55 4.26 0.33 -1.12 2.20 -1.26 -4.68 114.94 114.12 2qex s ASN 55 Ca 0.00 2.02 0.12 0.00 -0.94 0.00 0.00 52.86 54.06 2qex s ASN 55 Cb 0.00 -2.55 0.98 0.00 -2.00 0.00 0.00 41.25 37.68 2qex s ASN 55 CO 0.00 -2.20 1.70 0.00 -2.94 0.00 0.00 177.10 173.66 2qex h ALA 56 N -0.90 1.88 -0.14 3.54 0.00 -1.98 -0.11 119.26 121.54 2qex h ALA 56 Ca -0.45 0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 2qex h ALA 56 Cb 1.25 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2qex h ALA 56 CO 0.50 -0.41 -0.57 0.87 0.00 0.00 0.00 179.25 179.64 2qex h LYS 57 N 0.47 0.43 -0.07 0.00 1.57 -2.00 -1.74 116.57 115.23 2qex h LYS 57 Ca 0.68 -0.28 -0.12 0.00 -1.87 0.00 0.00 60.65 59.06 2qex h LYS 57 Cb 1.43 0.04 0.01 0.00 0.08 0.00 0.00 32.23 33.78 2qex h LYS 57 CO -0.53 0.88 -0.43 1.15 -0.57 0.00 0.00 179.45 179.96 2qex h THR 58 N 0.33 1.40 -0.34 -0.16 2.02 -1.50 -3.09 112.91 111.58 2qex h THR 58 Ca 0.00 -1.82 -0.01 0.00 0.77 0.00 0.00 66.41 65.35 2qex h THR 58 Cb 1.09 2.32 -0.02 0.00 -1.74 0.00 0.00 68.15 69.81 2qex h THR 58 CO 0.10 0.53 0.17 0.24 0.37 0.00 0.00 175.52 176.93 2qex h MET 59 N -0.05 0.47 0.18 6.66 2.86 -1.09 -1.11 114.93 122.86 2qex h MET 59 Ca -0.03 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 2qex h MET 59 Cb 1.09 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.65 2qex h MET 59 CO 0.09 0.37 -0.09 0.77 1.06 0.00 0.00 176.91 179.11 2qex h SER 60 N 0.48 -0.21 0.04 1.22 0.02 -1.28 -2.81 113.55 111.01 2qex h SER 60 Ca 0.12 -0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.95 2qex h SER 60 Cb 0.05 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 2qex h SER 60 CO -0.02 -0.14 -0.41 0.74 -1.14 0.00 0.00 176.83 175.87 2qex h THR 61 N -0.25 1.30 -0.48 -2.27 2.02 -1.39 -2.71 112.91 109.13 2qex h THR 61 Ca -0.02 -1.56 0.02 0.00 0.77 0.00 0.00 66.41 65.61 2qex h THR 61 Cb 0.20 1.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.17 2qex h THR 61 CO 0.04 0.48 0.30 0.40 0.37 0.00 0.00 175.52 177.11 2qex h ILE 62 N 0.39 1.08 -0.17 3.11 2.04 -1.14 -0.34 117.51 122.48 2qex h ILE 62 Ca 0.03 -0.21 -0.08 0.00 1.00 0.00 0.00 64.86 65.61 2qex h ILE 62 Cb 0.88 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 2qex h ILE 62 CO 0.07 0.11 -0.23 1.23 0.00 0.00 0.00 178.15 179.33 2qex h GLY 63 N 0.60 0.32 0.96 5.37 0.00 -1.42 -2.57 103.07 106.33 2qex h GLY 63 Ca 0.19 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.20 2qex h GLY 63 CO -0.07 0.22 -0.05 -0.84 0.00 0.00 0.00 176.54 175.80 2qex h THR 64 N 0.27 1.27 -0.66 4.70 2.02 -1.04 -2.81 112.91 116.66 2qex h THR 64 Ca 0.04 -1.11 -0.01 0.00 0.77 0.00 0.00 66.41 66.10 2qex h THR 64 Cb 0.56 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 2qex h THR 64 CO 0.04 0.37 0.35 -0.26 0.37 0.00 0.00 175.52 176.39 2qex h PHE 65 N 0.55 0.89 0.59 3.16 0.05 -0.78 -2.13 116.94 119.28 2qex h PHE 65 Ca 0.11 -0.02 -0.03 0.00 3.82 0.00 0.00 57.97 61.85 2qex h PHE 65 Cb 0.56 -0.29 0.01 0.00 2.00 0.00 0.00 35.95 38.22 2qex h PHE 65 CO 0.04 0.63 -0.29 0.37 -0.18 0.00 0.00 178.31 178.89 2qex h GLN 66 N 0.92 -0.77 -0.17 1.51 4.15 -1.25 -1.88 115.11 117.62 2qex h GLN 66 Ca 0.23 0.05 0.04 0.00 0.77 0.00 0.00 58.65 59.74 2qex h GLN 66 Cb 0.04 0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2qex h GLN 66 CO -0.04 -0.50 0.12 0.77 -1.93 0.00 0.00 178.83 177.26 2qex h SER 67 N -0.84 0.04 -0.31 -0.69 0.02 -1.34 -0.60 113.55 109.83 2qex h SER 67 Ca -0.08 -0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.74 2qex h SER 67 Cb 0.63 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 2qex h SER 67 CO 0.13 0.03 -0.30 0.45 -1.14 0.00 0.00 176.83 176.01 2qex h HIS 68 N 0.05 0.90 -0.24 3.45 3.86 -1.17 -2.25 115.15 119.75 2qex h HIS 68 Ca 0.08 -0.27 -0.17 0.00 -1.16 0.00 0.00 60.37 58.86 2qex h HIS 68 Cb 0.25 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.53 2qex h HIS 68 CO -0.00 1.03 -0.53 0.82 0.86 0.00 0.00 177.93 180.11 2qex h ILE 69 N 0.51 1.30 -0.42 2.45 2.04 -0.44 -2.33 117.51 120.61 2qex h ILE 69 Ca 0.05 -1.74 -0.10 0.00 1.00 0.00 0.00 64.86 64.07 2qex h ILE 69 Cb 0.87 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.61 2qex h ILE 69 CO 0.07 0.55 -0.13 -0.33 0.00 0.00 0.00 178.15 178.32 2qex h GLU 70 N 0.54 0.77 0.00 2.37 5.08 -1.18 -1.44 114.58 120.72 2qex h GLU 70 Ca 0.02 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.06 2qex h GLU 70 Cb 1.09 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 2qex h GLU 70 CO 0.11 0.86 -0.27 -0.91 -1.00 0.00 0.00 179.01 177.80 2qex h ASN 71 N 0.69 0.00 0.79 1.42 4.21 -1.27 -1.56 115.58 119.86 2qex h ASN 71 Ca 0.11 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 57.45 2qex h ASN 71 Cb 0.61 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.79 2qex h ASN 71 CO 0.04 0.27 -0.83 0.24 -1.29 0.00 0.00 177.43 175.86 2qex h MET 72 N 0.00 0.03 -0.22 0.81 2.86 -0.76 -0.94 114.93 116.71 2qex h MET 72 Ca -0.00 -0.03 -0.17 0.00 -2.06 0.00 0.00 59.70 57.44 2qex h MET 72 Cb 0.54 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 2qex h MET 72 CO 0.04 0.84 -0.54 0.74 1.06 0.00 0.00 176.91 179.04 2qex h PHE 73 N 0.01 0.81 -0.11 -0.22 0.05 -0.64 -3.06 116.94 113.78 2qex h PHE 73 Ca -0.01 -0.29 -0.06 0.00 3.82 0.00 0.00 57.97 61.43 2qex h PHE 73 Cb 1.46 -0.15 -0.00 0.00 2.00 0.00 0.00 35.95 39.25 2qex h PHE 73 CO 0.00 1.05 -0.17 1.25 -0.18 0.00 0.00 178.31 180.26 2qex h HIS 74 N 0.50 0.39 -0.66 -0.55 2.76 -1.18 -3.03 115.15 113.37 2qex h HIS 74 Ca 0.01 -0.13 0.07 0.00 -2.20 0.00 0.00 60.37 58.12 2qex h HIS 74 Cb 1.11 -0.08 -0.04 0.00 1.55 0.00 0.00 27.41 29.95 2qex h HIS 74 CO 0.05 0.77 0.44 0.78 -1.30 0.00 0.00 177.93 178.67 2qex h GLY 75 N -0.10 0.82 1.97 5.26 0.00 -1.21 0.16 103.07 109.97 2qex h GLY 75 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2qex h GLY 75 CO 0.04 0.19 -0.02 -0.39 0.00 0.00 0.00 176.54 176.36 2qex h VAL 76 N 0.64 0.00 0.00 4.60 -1.51 -1.55 -3.15 116.25 115.29 2qex h VAL 76 Ca 0.29 -0.59 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 2qex h VAL 76 Cb 0.30 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.04 2qex h VAL 76 CO -0.09 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.60 2qex n THR 77 N -2.44 0.00 -0.10 7.19 -2.24 -0.84 -0.89 114.28 114.97 2qex n THR 77 Ca 0.05 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.71 2qex n THR 77 Cb 0.45 -0.62 -0.04 0.00 -2.10 0.00 0.00 70.33 68.02 2qex n THR 77 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2qex h GLU 78 N 0.00 0.60 0.00 -0.78 5.08 -1.47 -3.40 114.58 114.61 2qex h GLU 78 Ca 0.00 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2qex h GLU 78 Cb 0.00 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2qex h GLU 78 CO 0.00 0.84 0.00 0.41 -1.00 0.00 0.00 179.01 179.26 2qex n GLY 79 N -0.03 0.03 3.73 -3.84 0.00 0.43 -4.98 105.19 100.53 2qex n GLY 79 Ca -0.03 -1.72 -0.35 0.00 0.00 0.00 0.00 46.02 43.92 2qex n GLY 79 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qex s TRP 80 N -2.74 3.25 -0.06 1.61 0.52 -0.11 -4.77 118.94 116.63 2qex s TRP 80 Ca 0.00 0.25 -0.03 0.00 0.02 0.00 0.00 56.10 56.34 2qex s TRP 80 Cb 0.00 -1.80 0.04 0.00 -1.15 0.00 0.00 33.47 30.56 2qex s TRP 80 CO 0.00 0.53 0.11 -1.21 0.02 0.00 0.00 176.95 176.40 2qex s GLU 81 N -1.09 -0.02 -0.11 4.98 2.02 -1.26 -1.96 118.70 121.27 2qex s GLU 81 Ca 0.16 0.48 -0.00 0.00 0.02 0.00 0.00 54.97 55.62 2qex s GLU 81 Cb -0.12 -0.37 -0.02 0.00 0.10 0.00 0.00 34.13 33.72 2qex s GLU 81 CO 0.05 -0.31 -0.10 0.71 0.02 0.00 0.00 175.26 175.63 2qex s TYR 82 N 2.21 2.87 -0.11 1.61 1.51 0.11 -3.83 117.35 121.72 2qex s TYR 82 Ca 0.04 -0.33 0.01 0.00 -1.01 0.00 0.00 57.07 55.78 2qex s TYR 82 Cb -0.12 -1.81 -0.01 0.00 -0.11 0.00 0.00 41.96 39.91 2qex s TYR 82 CO -0.05 0.02 -0.16 0.20 -1.11 0.00 0.00 175.55 174.46 2qex s GLY 83 N -0.09 1.49 0.35 0.71 0.00 -0.71 0.08 107.32 109.16 2qex s GLY 83 Ca -0.00 -0.92 0.09 0.00 0.00 0.00 0.00 44.72 43.88 2qex s GLY 83 CO 0.03 -0.31 -0.07 1.06 0.00 0.00 0.00 173.10 173.81 2qex s MET 84 N 0.19 1.86 -0.03 2.90 -1.94 0.75 -0.03 119.30 122.99 2qex s MET 84 Ca -0.09 -1.95 0.01 0.00 -1.71 0.00 0.00 55.69 51.95 2qex s MET 84 Cb -0.16 -1.71 0.02 0.00 2.01 0.00 0.00 34.83 34.99 2qex s MET 84 CO 0.06 0.11 -0.05 -1.21 -0.01 0.00 0.00 175.02 173.92 2qex s GLU 85 N -3.63 0.75 -0.13 2.03 2.02 -0.60 0.40 118.70 119.54 2qex s GLU 85 Ca 0.33 -0.12 -0.19 0.00 0.02 0.00 0.00 54.97 55.01 2qex s GLU 85 Cb 0.03 -0.75 -0.04 0.00 0.10 0.00 0.00 34.13 33.47 2qex s GLU 85 CO 0.17 -0.04 0.50 0.54 0.02 0.00 0.00 175.26 176.45 2qex s VAL 86 N 0.69 5.17 -0.02 2.63 0.11 -1.10 -1.37 120.40 126.51 2qex s VAL 86 Ca -0.09 0.99 0.03 0.00 -2.93 0.00 0.00 61.98 59.98 2qex s VAL 86 Cb -0.12 -3.84 -0.00 0.00 -1.53 0.00 0.00 36.38 30.89 2qex s VAL 86 CO 0.00 0.30 -0.09 0.12 -3.33 0.00 0.00 175.10 172.10 2qex s PHE 87 N 0.79 0.90 0.01 1.54 5.36 -0.80 -4.93 117.98 120.85 2qex s PHE 87 Ca 0.27 -0.20 -0.13 0.00 -0.96 0.00 0.00 56.93 55.91 2qex s PHE 87 Cb -0.15 -0.62 0.02 0.00 -0.34 0.00 0.00 43.02 41.92 2qex s PHE 87 CO 0.11 -0.06 0.26 1.52 -1.46 0.00 0.00 175.22 175.59 2qex s TYR 88 N 0.03 -0.09 -0.22 10.12 -0.85 -1.26 -1.01 117.35 124.06 2qex s TYR 88 Ca -0.00 0.04 -0.16 0.00 -0.52 0.00 0.00 57.07 56.43 2qex s TYR 88 Cb -0.06 0.05 -0.09 0.00 0.38 0.00 0.00 41.96 42.24 2qex s TYR 88 CO 0.00 -0.41 -0.29 -1.13 -1.52 0.00 0.00 175.55 172.20 2qex n SER 89 N 1.01 1.93 -0.02 -0.18 3.41 -1.26 -4.96 113.62 113.55 2qex n SER 89 Ca -0.20 0.37 -0.04 0.00 -0.26 0.00 0.00 58.87 58.73 2qex n SER 89 Cb 0.57 -0.80 -0.01 0.00 -0.26 0.00 0.00 64.21 63.70 2qex n SER 89 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2qex n HIS 90 N -4.38 0.00 -2.89 7.33 -0.00 -1.26 -5.00 115.22 109.02 2qex n HIS 90 Ca -0.32 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 56.98 2qex n HIS 90 Cb 0.67 -0.24 -0.04 0.00 -0.00 0.00 0.00 29.99 30.38 2qex n HIS 90 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 2qex s PHE 91 N -2.38 3.43 -0.42 1.57 0.40 -1.26 -4.98 117.98 114.34 2qex s PHE 91 Ca -0.14 1.27 -0.27 0.00 -0.60 0.00 0.00 56.93 57.19 2qex s PHE 91 Cb 0.02 -3.01 -0.04 0.00 0.51 0.00 0.00 43.02 40.49 2qex s PHE 91 CO 0.20 -0.23 2.13 -2.14 0.70 0.00 0.00 175.22 175.89 2qex s PRO 92 N 2.10 2.69 0.22 0.24 0.02 -1.26 -4.66 135.00 134.34 2qex s PRO 92 Ca 0.39 1.40 -0.30 0.00 0.02 0.00 0.00 61.00 62.50 2qex s PRO 92 Cb -0.17 -4.42 -0.08 0.00 0.02 0.00 0.00 34.50 29.85 2qex s PRO 92 CO 0.13 -2.62 1.08 1.41 -0.33 0.00 0.00 177.00 176.67 2qex s MET 93 N 7.06 4.64 -0.28 5.54 1.75 -1.26 -4.82 119.30 131.93 2qex s MET 93 Ca 0.89 1.72 -0.02 0.00 -1.25 0.00 0.00 55.69 57.03 2qex s MET 93 Cb -0.21 -3.25 0.04 0.00 2.84 0.00 0.00 34.83 34.25 2qex s MET 93 CO 0.28 0.17 -0.02 -0.65 -0.65 0.00 0.00 175.02 174.16 2qex s GLN 94 N -0.81 2.66 -0.20 4.11 -0.21 -0.37 -4.99 119.66 119.84 2qex s GLN 94 Ca 0.47 -1.11 -0.06 0.00 0.02 0.00 0.00 55.36 54.68 2qex s GLN 94 Cb -0.30 -3.12 -0.03 0.00 1.00 0.00 0.00 33.01 30.56 2qex s GLN 94 CO 0.37 -0.51 0.03 0.08 -2.12 0.00 0.00 175.29 173.14 2qex s VAL 95 N 1.31 4.30 0.07 1.09 1.01 -1.26 -0.84 120.40 126.08 2qex s VAL 95 Ca -0.02 -0.20 -0.06 0.00 0.00 0.00 0.00 61.98 61.71 2qex s VAL 95 Cb -0.18 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.23 2qex s VAL 95 CO -0.02 0.42 0.10 0.20 0.00 0.00 0.00 175.10 175.80 2qex s ASN 96 N 0.92 0.26 -0.39 3.32 -0.87 -0.10 -5.03 114.94 113.06 2qex s ASN 96 Ca 0.02 -0.78 -0.09 0.00 -1.57 0.00 0.00 52.86 50.44 2qex s ASN 96 Cb -0.14 0.28 0.05 0.00 -0.02 0.00 0.00 41.25 41.43 2qex s ASN 96 CO 0.02 -0.68 0.21 -0.69 -2.57 0.00 0.00 177.10 173.40 2qex s VAL 97 N -3.87 4.28 -0.30 1.60 1.01 -1.26 0.16 120.40 122.02 2qex s VAL 97 Ca 0.06 -1.15 0.03 0.00 0.00 0.00 0.00 61.98 60.92 2qex s VAL 97 Cb 0.06 -3.50 0.08 0.00 0.00 0.00 0.00 36.38 33.02 2qex s VAL 97 CO -0.11 -0.35 -0.03 -1.61 0.00 0.00 0.00 175.10 173.00 2qex s GLU 98 N 1.47 1.85 4.55 2.72 2.02 -0.26 -4.95 118.70 126.10 2qex s GLU 98 Ca 0.02 -1.59 0.00 0.00 0.02 0.00 0.00 54.97 53.42 2qex s GLU 98 Cb -0.21 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.00 2qex s GLU 98 CO 0.04 -0.75 0.00 0.41 0.02 0.00 0.00 175.26 174.98 2qex n GLY 99 N 4.36 1.19 1.23 -1.39 0.00 -1.26 -3.50 105.19 105.81 2qex n GLY 99 Ca -0.05 -0.82 -0.06 0.00 0.00 0.00 0.00 46.02 45.09 2qex n GLY 99 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qex n ASP 100 N 5.20 2.72 -3.98 1.61 8.00 -1.26 -5.00 116.55 123.84 2qex n ASP 100 Ca 0.00 -3.81 -0.10 0.00 0.71 0.00 0.00 54.79 51.60 2qex n ASP 100 Cb 0.00 -0.62 -0.06 0.00 -0.02 0.00 0.00 41.12 40.42 2qex n ASP 100 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2qex s GLU 101 N -3.30 1.37 -0.17 -1.24 -1.05 -1.23 -1.47 118.70 111.60 2qex s GLU 101 Ca 0.45 -1.23 -0.02 0.00 -0.15 0.00 0.00 54.97 54.03 2qex s GLU 101 Cb 0.41 0.42 -0.01 0.00 -0.44 0.00 0.00 34.13 34.51 2qex s GLU 101 CO -0.01 -0.54 -0.10 0.54 0.95 0.00 0.00 175.26 176.10 2qex s VAL 102 N -4.00 3.13 -0.08 1.83 0.11 -0.60 -1.11 120.40 119.68 2qex s VAL 102 Ca 0.21 -0.60 -0.02 0.00 -2.93 0.00 0.00 61.98 58.63 2qex s VAL 102 Cb 0.01 -2.36 -0.03 0.00 -1.53 0.00 0.00 36.38 32.46 2qex s VAL 102 CO 0.05 0.48 0.03 -0.69 -3.33 0.00 0.00 175.10 171.65 2qex s VAL 103 N 0.90 4.54 -0.15 2.04 1.01 0.12 -2.49 120.40 126.37 2qex s VAL 103 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.76 2qex s VAL 103 Cb -0.15 -2.94 0.03 0.00 0.00 0.00 0.00 36.38 33.32 2qex s VAL 103 CO 0.00 0.58 -0.11 -0.63 0.00 0.00 0.00 175.10 174.94 2qex s ILE 104 N -0.94 1.40 0.19 2.22 1.01 0.28 -0.92 121.20 124.44 2qex s ILE 104 Ca 0.14 -0.62 0.08 0.00 0.00 0.00 0.00 60.65 60.25 2qex s ILE 104 Cb -0.11 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 2qex s ILE 104 CO 0.04 0.34 -0.00 -1.61 0.00 0.00 0.00 174.94 173.71 2qex s GLU 105 N 1.54 2.37 -1.47 2.79 2.02 -0.02 -0.25 118.70 125.68 2qex s GLU 105 Ca 0.03 -1.17 -0.08 0.00 0.02 0.00 0.00 54.97 53.77 2qex s GLU 105 Cb -0.14 -2.31 0.02 0.00 0.10 0.00 0.00 34.13 31.81 2qex s GLU 105 CO -0.09 0.44 0.82 -1.71 0.02 0.00 0.00 175.26 174.74 2qex n ASN 106 N -0.26 -5.82 -4.66 -0.19 4.05 -1.25 -1.24 115.26 105.89 2qex n ASN 106 Ca -0.09 -0.44 -0.43 0.00 0.45 0.00 0.00 54.58 54.07 2qex n ASN 106 Cb 0.56 -4.66 -0.02 0.00 1.23 0.00 0.00 39.78 36.89 2qex n ASN 106 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 2qex s PHE 107 N -3.21 2.91 -1.94 1.20 5.36 -1.26 -3.12 117.98 117.91 2qex s PHE 107 Ca 0.45 1.06 0.00 0.00 -0.96 0.00 0.00 56.93 57.48 2qex s PHE 107 Cb -0.21 -3.48 0.00 0.00 -0.34 0.00 0.00 43.02 39.00 2qex s PHE 107 CO 0.55 -1.57 0.00 -0.11 -1.46 0.00 0.00 175.22 172.63 2qex n LEU 108 N 6.52 -1.41 0.00 6.12 7.94 -1.26 -1.13 117.00 133.78 2qex n LEU 108 Ca 0.14 0.41 0.00 0.00 -1.11 0.00 0.00 56.01 55.45 2qex n LEU 108 Cb 0.45 -2.63 0.00 0.00 0.53 0.00 0.00 43.42 41.77 2qex n LEU 108 CO 0.55 -0.88 0.00 0.61 -1.11 0.00 0.00 177.39 176.56 2qex n GLY 109 N -0.42 0.73 3.69 -3.96 0.00 -1.18 -4.96 105.19 99.08 2qex n GLY 109 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 2qex n GLY 109 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qex n GLU 110 N -2.12 0.19 -0.08 1.61 1.02 -0.29 -4.95 120.64 116.02 2qex n GLU 110 Ca 0.00 0.14 -0.14 0.00 -0.02 0.00 0.00 57.16 57.15 2qex n GLU 110 Cb 0.00 -2.44 -0.14 0.00 -0.02 0.00 0.00 31.44 28.84 2qex n GLU 110 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2qex n LYS 111 N -3.27 0.68 -2.86 3.49 5.02 -1.26 -3.87 118.16 116.09 2qex n LYS 111 Ca 0.14 0.13 -0.41 0.00 -2.02 0.00 0.00 58.31 56.14 2qex n LYS 111 Cb 0.50 -1.59 -0.04 0.00 -0.02 0.00 0.00 35.03 33.88 2qex n LYS 111 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qex s ALA 112 N -2.53 3.35 0.05 7.82 0.00 -1.26 -4.88 121.76 124.32 2qex s ALA 112 Ca -0.18 0.25 -0.30 0.00 0.00 0.00 0.00 51.96 51.72 2qex s ALA 112 Cb 0.07 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.94 2qex s ALA 112 CO 0.75 -0.37 1.11 -2.14 0.00 0.00 0.00 175.76 175.11 2qex s PRO 113 N 1.44 4.49 0.01 0.00 0.02 -1.26 -4.72 135.00 134.98 2qex s PRO 113 Ca 0.43 1.64 -0.21 0.00 0.02 0.00 0.00 61.00 62.87 2qex s PRO 113 Cb -0.18 -3.38 -0.06 0.00 0.02 0.00 0.00 34.50 30.90 2qex s PRO 113 CO 0.19 -0.16 0.62 1.03 -0.33 0.00 0.00 177.00 178.36 2qex s ARG 114 N 0.95 4.34 0.19 5.54 0.52 0.66 -4.88 118.95 126.27 2qex s ARG 114 Ca 0.56 0.80 -0.07 0.00 -0.52 0.00 0.00 55.73 56.49 2qex s ARG 114 Cb -0.26 -3.33 -0.02 0.00 0.52 0.00 0.00 34.95 31.85 2qex s ARG 114 CO 0.29 0.38 0.27 -0.98 0.02 0.00 0.00 175.30 175.29 2qex s ARG 115 N -0.27 1.25 -0.20 3.54 1.70 -1.26 0.99 118.95 124.70 2qex s ARG 115 Ca 0.32 -1.34 -0.22 0.00 -0.47 0.00 0.00 55.73 54.01 2qex s ARG 115 Cb -0.19 0.36 0.06 0.00 -0.57 0.00 0.00 34.95 34.61 2qex s ARG 115 CO 0.18 -0.46 0.61 -0.08 -1.08 0.00 0.00 175.30 174.48 2qex s THR 116 N -4.04 0.00 0.09 4.99 -1.32 -1.04 -5.02 115.64 109.30 2qex s THR 116 Ca 0.25 -0.02 -0.26 0.00 -1.21 0.00 0.00 61.69 60.45 2qex s THR 116 Cb 0.04 -0.86 -0.06 0.00 -1.51 0.00 0.00 72.50 70.10 2qex s THR 116 CO 0.06 -0.01 0.81 -0.89 -2.21 0.00 0.00 174.62 172.37 2qex s THR 117 N 0.07 4.58 0.27 5.08 2.01 -1.26 -1.55 115.64 124.83 2qex s THR 117 Ca -0.02 1.74 -0.30 0.00 0.31 0.00 0.00 61.69 63.42 2qex s THR 117 Cb -0.04 -4.16 -0.09 0.00 0.01 0.00 0.00 72.50 68.21 2qex s THR 117 CO 0.02 0.40 1.08 -0.63 -0.69 0.00 0.00 174.62 174.80 2qex s ILE 118 N -0.35 3.58 -0.34 1.82 1.01 -0.54 -4.95 121.20 121.43 2qex s ILE 118 Ca 0.39 1.58 -0.25 0.00 0.00 0.00 0.00 60.65 62.37 2qex s ILE 118 Cb -0.22 -4.00 0.01 0.00 0.01 0.00 0.00 42.46 38.26 2qex s ILE 118 CO 0.25 0.37 0.87 -1.00 0.00 0.00 0.00 174.94 175.44 2qex s HIS 119 N -1.10 3.14 0.00 3.97 3.76 -1.26 -4.93 115.29 118.87 2qex s HIS 119 Ca 0.44 0.81 0.00 0.00 -0.15 0.00 0.00 55.06 56.16 2qex s HIS 119 Cb -0.31 -3.46 0.00 0.00 1.11 0.00 0.00 32.58 29.92 2qex s HIS 119 CO 0.40 -0.71 0.00 0.41 -0.85 0.00 0.00 174.74 173.99 2qex n GLY 120 N 4.27 3.27 1.75 -2.22 0.00 -1.26 -3.12 105.19 107.89 2qex n GLY 120 Ca 0.06 -0.19 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 2qex n GLY 120 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qex n ASP 121 N 3.17 4.91 -4.79 1.61 8.00 -1.26 -4.94 116.55 123.25 2qex n ASP 121 Ca 0.00 -2.93 -0.38 0.00 0.71 0.00 0.00 54.79 52.19 2qex n ASP 121 Cb 0.00 -0.86 -0.06 0.00 -0.02 0.00 0.00 41.12 40.18 2qex n ASP 121 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2qex s THR 122 N -1.98 4.41 -0.24 -3.53 2.01 -1.18 -4.74 115.64 110.39 2qex s THR 122 Ca 0.30 1.57 0.00 0.00 0.31 0.00 0.00 61.69 63.87 2qex s THR 122 Cb 0.24 -4.02 0.03 0.00 0.01 0.00 0.00 72.50 68.77 2qex s THR 122 CO 0.02 0.34 -0.11 -1.81 -0.69 0.00 0.00 174.62 172.38 2qex s ASP 123 N -1.42 4.07 -0.29 3.53 1.01 0.23 -4.93 116.67 118.87 2qex s ASP 123 Ca 0.41 -0.96 -0.10 0.00 0.71 0.00 0.00 52.55 52.60 2qex s ASP 123 Cb -0.20 -1.59 -0.03 0.00 1.01 0.00 0.00 42.92 42.11 2qex s ASP 123 CO 0.24 -0.11 0.17 -0.69 0.21 0.00 0.00 175.17 174.99 2qex s VAL 124 N 1.26 5.00 -0.17 -1.27 1.01 -1.26 -2.15 120.40 122.81 2qex s VAL 124 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.89 2qex s VAL 124 Cb -0.17 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2qex s VAL 124 CO -0.07 0.18 -0.15 -1.61 0.00 0.00 0.00 175.10 173.45 2qex s GLU 125 N 1.70 3.17 -0.12 2.72 2.02 -0.78 -4.98 118.70 122.43 2qex s GLU 125 Ca 0.06 -0.76 -0.05 0.00 0.02 0.00 0.00 54.97 54.25 2qex s GLU 125 Cb -0.16 -2.65 -0.04 0.00 0.10 0.00 0.00 34.13 31.38 2qex s GLU 125 CO 0.09 -0.06 0.05 -1.50 0.02 0.00 0.00 175.26 173.85 2qex s ILE 126 N 1.01 4.72 -0.38 -1.63 2.07 -1.26 -1.52 121.20 124.20 2qex s ILE 126 Ca -0.02 -0.08 0.01 0.00 -1.41 0.00 0.00 60.65 59.15 2qex s ILE 126 Cb -0.15 -3.04 0.14 0.00 0.13 0.00 0.00 42.46 39.54 2qex s ILE 126 CO -0.03 0.57 0.23 -0.62 -1.91 0.00 0.00 174.94 173.17 2qex s ASP 127 N -0.52 3.03 1.62 4.50 -1.08 0.41 -5.02 116.67 119.60 2qex s ASP 127 Ca 0.10 -2.34 0.00 0.00 -0.52 0.00 0.00 52.55 49.79 2qex s ASP 127 Cb -0.12 -0.54 0.00 0.00 -1.46 0.00 0.00 42.92 40.80 2qex s ASP 127 CO 0.02 -0.29 0.00 0.61 0.52 0.00 0.00 175.17 176.03 2qex n GLY 128 N 3.85 2.08 1.71 2.66 0.00 -1.26 -2.03 105.19 112.19 2qex n GLY 128 Ca 0.12 0.08 -0.05 0.00 0.00 0.00 0.00 46.02 46.17 2qex n GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qex n GLU 129 N 3.91 3.15 -4.38 1.61 -0.58 -1.26 -4.93 120.64 118.15 2qex n GLU 129 Ca 0.00 -3.06 -0.19 0.00 -0.42 0.00 0.00 57.16 53.48 2qex n GLU 129 Cb 0.00 -2.09 -0.15 0.00 -0.57 0.00 0.00 31.44 28.63 2qex n GLU 129 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2qex s GLU 130 N -3.04 0.83 0.18 3.49 2.02 -0.86 -2.70 118.70 118.61 2qex s GLU 130 Ca 0.52 -0.32 0.09 0.00 0.02 0.00 0.00 54.97 55.28 2qex s GLU 130 Cb 0.42 -0.79 -0.04 0.00 0.10 0.00 0.00 34.13 33.82 2qex s GLU 130 CO 0.10 0.17 -0.19 -0.51 0.02 0.00 0.00 175.26 174.85 2qex s LEU 131 N -0.06 2.46 -0.22 1.80 1.43 0.16 -0.44 118.68 123.81 2qex s LEU 131 Ca 0.01 -0.89 -0.03 0.00 -1.03 0.00 0.00 54.13 52.19 2qex s LEU 131 Cb -0.05 -0.90 0.11 0.00 0.03 0.00 0.00 46.19 45.37 2qex s LEU 131 CO -0.00 -0.01 0.30 0.28 0.23 0.00 0.00 176.35 177.15 2qex s THR 132 N -2.09 -0.46 0.01 5.49 -1.32 -0.58 -0.18 115.64 116.51 2qex s THR 132 Ca 0.19 -0.09 -0.18 0.00 -1.21 0.00 0.00 61.69 60.40 2qex s THR 132 Cb -0.06 -0.74 -0.06 0.00 -1.51 0.00 0.00 72.50 70.14 2qex s THR 132 CO 0.08 -0.16 0.50 -0.69 -2.21 0.00 0.00 174.62 172.14 2qex s VAL 133 N 2.43 4.93 0.05 5.08 1.01 0.11 -1.86 120.40 132.15 2qex s VAL 133 Ca 0.09 1.05 -0.27 0.00 0.00 0.00 0.00 61.98 62.85 2qex s VAL 133 Cb -0.16 -3.82 0.07 0.00 0.00 0.00 0.00 36.38 32.47 2qex s VAL 133 CO -0.14 0.51 0.64 -0.94 0.00 0.00 0.00 175.10 175.17 2qex s SER 134 N -0.70 -0.62 0.00 3.32 1.04 -0.92 -0.71 113.70 115.12 2qex s SER 134 Ca 0.27 0.38 0.00 0.00 0.48 0.00 0.00 55.95 57.08 2qex s SER 134 Cb -0.18 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2qex s SER 134 CO 0.15 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.21 2qex n GLY 135 N 0.31 -0.72 0.13 7.32 0.00 -0.83 -0.60 105.19 110.81 2qex n GLY 135 Ca -0.18 -1.18 -0.22 0.00 0.00 0.00 0.00 46.02 44.44 2qex n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qex h PRO 136 N 0.00 0.33 -6.34 1.61 0.13 -1.83 -0.25 132.00 125.64 2qex h PRO 136 Ca 0.00 -0.56 -0.55 0.00 -0.87 0.00 0.00 66.00 64.02 2qex h PRO 136 Cb 0.00 0.21 -0.05 0.00 0.13 0.00 0.00 31.00 31.29 2qex h PRO 136 CO 0.00 1.27 1.17 0.34 -0.23 0.00 0.00 178.00 180.54 2qex s ASP 137 N -7.14 5.99 0.34 1.44 -1.08 -1.26 -4.24 116.67 110.72 2qex s ASP 137 Ca -0.16 0.61 0.04 0.00 -0.52 0.00 0.00 52.55 52.52 2qex s ASP 137 Cb 0.04 -2.54 0.62 0.00 -1.46 0.00 0.00 42.92 39.58 2qex s ASP 137 CO 0.82 -1.76 1.89 -0.29 0.52 0.00 0.00 175.17 176.36 2qex h ILE 138 N 6.56 1.19 0.39 4.11 2.10 -1.88 -0.90 117.51 129.08 2qex h ILE 138 Ca -0.28 -0.74 -0.02 0.00 1.08 0.00 0.00 64.86 64.90 2qex h ILE 138 Cb 1.12 0.90 0.00 0.00 -1.09 0.00 0.00 36.82 37.76 2qex h ILE 138 CO 1.14 0.26 -0.19 -0.33 -1.08 0.00 0.00 178.15 177.94 2qex h GLU 139 N 0.52 -0.51 0.09 2.19 4.39 -1.99 0.23 114.58 119.51 2qex h GLU 139 Ca 0.11 0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.85 2qex h GLU 139 Cb 0.30 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 2qex h GLU 139 CO 0.01 -0.31 -0.10 0.00 -1.16 0.00 0.00 179.01 177.44 2qex h ALA 140 N 0.04 -0.19 -0.46 3.43 0.00 -1.84 -1.57 119.26 118.66 2qex h ALA 140 Ca -0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2qex h ALA 140 Cb 0.42 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2qex h ALA 140 CO 0.09 -0.62 0.21 0.28 0.00 0.00 0.00 179.25 179.20 2qex h VAL 141 N -0.22 1.19 -0.42 0.00 2.07 -1.14 -1.87 116.25 115.85 2qex h VAL 141 Ca 0.01 -0.57 0.05 0.00 0.82 0.00 0.00 66.70 67.01 2qex h VAL 141 Cb 0.22 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 2qex h VAL 141 CO -0.04 0.22 0.17 1.23 0.02 0.00 0.00 177.57 179.17 2qex h GLY 142 N 0.60 0.56 0.87 2.17 0.00 -0.31 -1.88 103.07 105.07 2qex h GLY 142 Ca 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2qex h GLY 142 CO -0.02 0.05 -0.11 1.46 0.00 0.00 0.00 176.54 177.92 2qex h GLN 143 N 0.35 -0.30 -0.73 4.80 1.08 -1.17 -2.51 115.11 116.63 2qex h GLN 143 Ca 0.19 0.02 0.16 0.00 -1.45 0.00 0.00 58.65 57.57 2qex h GLN 143 Cb 0.15 0.07 -0.12 0.00 -0.05 0.00 0.00 27.48 27.53 2qex h GLN 143 CO -0.18 -0.10 0.05 1.15 -0.95 0.00 0.00 178.83 178.81 2qex h THR 144 N -0.45 0.41 0.57 -0.54 2.02 -1.10 0.43 112.91 114.24 2qex h THR 144 Ca -0.03 -0.05 -0.03 0.00 0.77 0.00 0.00 66.41 67.07 2qex h THR 144 Cb 0.34 0.25 0.01 0.00 -1.74 0.00 0.00 68.15 67.01 2qex h THR 144 CO 0.05 0.03 -0.27 0.00 0.37 0.00 0.00 175.52 175.70 2qex h ALA 145 N 1.66 -0.76 -0.87 6.16 0.00 -1.28 -2.81 119.26 121.36 2qex h ALA 145 Ca 0.40 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 55.24 2qex h ALA 145 Cb 0.70 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 2qex h ALA 145 CO -0.60 -0.91 0.56 0.00 0.00 0.00 0.00 179.25 178.30 2qex h ALA 146 N -0.38 1.71 0.00 0.00 0.00 -0.73 -0.42 119.26 119.44 2qex h ALA 146 Ca -0.08 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2qex h ALA 146 Cb 0.60 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2qex h ALA 146 CO 0.13 0.10 -0.18 -0.44 0.00 0.00 0.00 179.25 178.87 2qex h ASP 147 N 0.81 0.00 -0.23 0.00 3.32 -0.02 0.72 116.42 121.03 2qex h ASP 147 Ca 0.41 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.36 2qex h ASP 147 Cb 0.48 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.03 2qex h ASP 147 CO -0.18 0.18 -0.26 0.40 -1.72 0.00 0.00 179.24 177.66 2qex h ILE 148 N 0.00 1.32 -0.25 0.35 2.04 -0.82 -1.74 117.51 118.41 2qex h ILE 148 Ca -0.00 -1.44 -0.13 0.00 1.00 0.00 0.00 64.86 64.29 2qex h ILE 148 Cb 0.33 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2qex h ILE 148 CO 0.02 0.45 -0.38 -0.08 0.00 0.00 0.00 178.15 178.16 2qex h GLU 149 N 0.27 0.57 0.00 2.37 4.81 -1.27 -2.69 114.58 118.64 2qex h GLU 149 Ca 0.03 -0.28 -0.04 0.00 -0.13 0.00 0.00 59.36 58.94 2qex h GLU 149 Cb 0.82 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 2qex h GLU 149 CO 0.06 0.86 -0.20 1.96 -0.73 0.00 0.00 179.01 180.97 2qex h GLN 150 N 0.48 0.00 0.00 1.92 1.08 -0.84 -3.12 115.11 114.63 2qex h GLN 150 Ca 0.05 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.23 2qex h GLN 150 Cb 0.88 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.30 2qex h GLN 150 CO 0.08 0.20 -0.09 1.25 -0.95 0.00 0.00 178.83 179.31 2qex h LEU 151 N 0.00 0.00 -3.49 1.46 5.85 -0.96 -2.37 115.31 115.81 2qex h LEU 151 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2qex h LEU 151 Cb 0.62 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.65 2qex h LEU 151 CO 0.03 0.09 0.00 0.35 -0.34 0.00 0.00 178.44 178.56 2qex n THR 152 N -3.40 2.60 -1.74 1.05 -2.24 -1.18 -4.97 114.28 104.39 2qex n THR 152 Ca -0.01 -1.38 -0.42 0.00 -2.27 0.00 0.00 64.05 59.97 2qex n THR 152 Cb 0.25 -0.20 -0.01 0.00 -2.10 0.00 0.00 70.33 68.26 2qex n THR 152 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2qex n ARG 153 N 0.70 2.54 -3.91 -0.78 0.63 -0.89 -4.91 116.66 110.04 2qex n ARG 153 Ca 0.27 0.90 -0.21 0.00 -0.92 0.00 0.00 57.85 57.89 2qex n ARG 153 Cb 1.14 -2.62 -0.17 0.00 0.45 0.00 0.00 32.46 31.26 2qex n ARG 153 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 2qex s ILE 154 N -0.47 0.37 -0.07 5.15 2.07 -1.26 -5.03 121.20 121.95 2qex s ILE 154 Ca 0.60 0.05 0.06 0.00 -1.41 0.00 0.00 60.65 59.95 2qex s ILE 154 Cb -0.52 -0.48 -0.09 0.00 0.13 0.00 0.00 42.46 41.51 2qex s ILE 154 CO 0.55 0.22 0.02 0.59 -1.91 0.00 0.00 174.94 174.41 2qex n ASN 155 N 4.63 3.27 0.02 4.50 3.02 -1.26 -4.73 115.26 124.70 2qex n ASN 155 Ca -0.16 -0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.36 2qex n ASN 155 Cb 0.50 0.63 0.23 0.00 -0.61 0.00 0.00 39.78 40.53 2qex n ASN 155 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 2qex h ASP 156 N 0.00 0.47 -1.56 6.41 2.03 -2.04 -3.46 116.42 118.26 2qex h ASP 156 Ca -0.19 -0.14 -0.61 0.00 -0.73 0.00 0.00 57.03 55.36 2qex h ASP 156 Cb 1.43 -0.13 -0.11 0.00 -0.83 0.00 0.00 39.33 39.68 2qex h ASP 156 CO 0.01 0.67 -0.56 -0.54 -1.03 0.00 0.00 179.24 177.79 2qex s LYS 157 N -4.62 2.06 -0.24 4.15 1.02 -1.26 -5.09 119.74 115.76 2qex s LYS 157 Ca -0.07 -2.04 -0.29 0.00 0.02 0.00 0.00 55.97 53.59 2qex s LYS 157 Cb 0.14 -1.75 -0.03 0.00 -0.52 0.00 0.00 37.83 35.67 2qex s LYS 157 CO 0.78 -0.09 1.83 0.34 -0.92 0.00 0.00 175.35 177.29 2qex s ASP 158 N -3.79 6.03 0.51 2.83 -1.08 -1.26 -4.88 116.67 115.02 2qex s ASP 158 Ca 0.35 1.64 0.19 0.00 -0.52 0.00 0.00 52.55 54.21 2qex s ASP 158 Cb 0.08 -2.53 1.29 0.00 -1.46 0.00 0.00 42.92 40.30 2qex s ASP 158 CO 0.19 -1.54 2.11 0.58 0.52 0.00 0.00 175.17 177.02 2qex h VAL 159 N 6.55 0.93 -0.10 1.11 2.07 -1.89 -0.28 116.25 124.63 2qex h VAL 159 Ca -0.36 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 66.86 2qex h VAL 159 Cb 1.18 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 2qex h VAL 159 CO 1.00 0.07 -0.16 0.03 0.02 0.00 0.00 177.57 178.53 2qex h ARG 160 N 0.00 0.16 0.02 1.57 3.08 -2.01 -3.25 114.38 113.95 2qex h ARG 160 Ca -0.00 -0.04 -0.39 0.00 0.07 0.00 0.00 59.98 59.62 2qex h ARG 160 Cb 0.13 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.10 2qex h ARG 160 CO 0.01 0.33 -2.23 0.28 -1.07 0.00 0.00 179.97 177.28 2qex n VAL 161 N -4.28 1.56 -3.09 2.04 0.31 -0.75 -4.67 118.33 109.45 2qex n VAL 161 Ca -0.01 -0.44 -0.44 0.00 -0.01 0.00 0.00 64.34 63.44 2qex n VAL 161 Cb 0.27 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 2qex n VAL 161 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2qex n PHE 162 N -3.81 4.54 0.09 3.52 3.01 -0.19 -4.83 117.46 119.78 2qex n PHE 162 Ca -0.44 -3.46 0.05 0.00 1.01 0.00 0.00 57.45 54.61 2qex n PHE 162 Cb 0.92 -1.80 0.23 0.00 -0.01 0.00 0.00 39.48 38.82 2qex n PHE 162 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 2qex n GLN 163 N 3.41 2.94 -2.13 -1.08 6.02 -1.23 -4.62 117.38 120.68 2qex n GLN 163 Ca 0.29 -1.78 -0.38 0.00 -0.01 0.00 0.00 57.00 55.12 2qex n GLN 163 Cb 0.39 -1.78 -0.00 0.00 1.02 0.00 0.00 30.24 29.87 2qex n GLN 163 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2qex s ASP 164 N -0.61 6.10 0.00 1.08 1.11 -1.26 -4.85 116.67 118.23 2qex s ASP 164 Ca 0.31 2.48 0.00 0.00 0.18 0.00 0.00 52.55 55.52 2qex s ASP 164 Cb 0.22 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.59 2qex s ASP 164 CO 0.12 -0.98 0.00 0.61 1.18 0.00 0.00 175.17 176.10 2qex n GLY 165 N 0.58 2.93 3.84 0.21 0.00 -0.18 -4.97 105.19 107.59 2qex n GLY 165 Ca 0.07 -1.66 -0.38 0.00 0.00 0.00 0.00 46.02 44.05 2qex n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qex s VAL 166 N -1.95 5.03 0.03 1.61 1.01 -1.26 -1.90 120.40 122.97 2qex s VAL 166 Ca 0.00 0.79 0.03 0.00 0.00 0.00 0.00 61.98 62.80 2qex s VAL 166 Cb 0.00 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 2qex s VAL 166 CO 0.00 0.53 -0.10 -0.31 0.00 0.00 0.00 175.10 175.22 2qex s TYR 167 N -1.13 0.91 -0.05 5.22 1.51 -0.47 -4.39 117.35 118.95 2qex s TYR 167 Ca 0.25 -0.33 -0.30 0.00 -1.01 0.00 0.00 57.07 55.68 2qex s TYR 167 Cb -0.16 -0.55 -0.06 0.00 -0.11 0.00 0.00 41.96 41.08 2qex s TYR 167 CO 0.14 -0.01 1.67 0.42 -1.11 0.00 0.00 175.55 176.66 2qex s ILE 168 N -0.83 3.55 -0.21 2.71 -1.09 -1.26 -1.56 121.20 122.51 2qex s ILE 168 Ca -0.01 0.67 -0.16 0.00 -2.23 0.00 0.00 60.65 58.91 2qex s ILE 168 Cb -0.07 -3.43 -0.12 0.00 -1.58 0.00 0.00 42.46 37.26 2qex s ILE 168 CO 0.01 -0.06 -0.13 0.41 -1.23 0.00 0.00 174.94 173.94 2qex n THR 169 N 5.47 1.50 -4.95 2.92 -1.04 0.96 -4.94 114.28 114.20 2qex n THR 169 Ca 0.17 -0.06 -0.29 0.00 -2.04 0.00 0.00 64.05 61.84 2qex n THR 169 Cb 0.43 -2.12 -0.17 0.00 -1.82 0.00 0.00 70.33 66.65 2qex n THR 169 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2qex s ARG 170 N -2.48 2.35 -0.09 -2.82 0.52 -0.62 -4.99 118.95 110.82 2qex s ARG 170 Ca -0.29 -0.68 0.00 0.00 -0.52 0.00 0.00 55.73 54.24 2qex s ARG 170 Cb 0.08 -1.87 -0.03 0.00 0.52 0.00 0.00 34.95 33.65 2qex s ARG 170 CO 0.46 0.16 -0.09 0.15 0.02 0.00 0.00 175.30 176.00 2qex s LYS 171 N 0.35 2.98 0.00 3.54 1.02 -1.26 -1.73 119.74 124.64 2qex s LYS 171 Ca -0.14 -0.60 0.27 0.00 0.02 0.00 0.00 55.97 55.53 2qex s LYS 171 Cb -0.16 -2.61 1.62 0.00 -0.52 0.00 0.00 37.83 36.17 2qex s LYS 171 CO 0.06 0.50 1.97 -0.35 -0.92 0.00 0.00 175.35 176.60