#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aqk n GLY 3 N 0.00 0.04 0.34 3.38 0.00 -1.24 -3.74 105.19 103.96 2aqk n GLY 3 Ca 0.00 -1.78 0.01 0.00 0.00 0.00 0.00 46.02 44.25 2aqk n GLY 3 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2aqk h LEU 4 N 0.00 0.77 -3.20 0.99 5.85 -1.89 -2.60 115.31 115.23 2aqk h LEU 4 Ca 0.00 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 2aqk h LEU 4 Cb 0.00 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2aqk h LEU 4 CO 0.00 0.56 -0.10 0.18 -0.34 0.00 0.00 178.44 178.74 2aqk n LEU 5 N -4.43 3.49 -4.67 2.25 4.32 -0.09 -4.71 117.00 113.15 2aqk n LEU 5 Ca 0.07 -3.43 -0.42 0.00 -0.02 0.00 0.00 56.01 52.21 2aqk n LEU 5 Cb 0.04 -0.55 -0.03 0.00 -1.62 0.00 0.00 43.42 41.26 2aqk n LEU 5 CO 0.36 0.99 1.37 -0.62 -1.22 0.00 0.00 177.39 178.28 2aqk s ASP 6 N -2.53 6.62 0.00 -1.43 2.15 -0.94 -1.39 116.67 119.14 2aqk s ASP 6 Ca 0.40 2.40 0.00 0.00 0.43 0.00 0.00 52.55 55.78 2aqk s ASP 6 Cb 0.36 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 2aqk s ASP 6 CO 0.02 -0.92 0.00 0.61 -0.17 0.00 0.00 175.17 174.71 2aqk n GLY 7 N 4.11 1.48 3.74 2.66 0.00 -0.96 -4.93 105.19 111.29 2aqk n GLY 7 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2aqk n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2aqk s LYS 8 N -0.45 4.76 -0.22 1.61 3.01 -0.49 -4.83 119.74 123.13 2aqk s LYS 8 Ca 0.00 1.46 -0.11 0.00 -1.01 0.00 0.00 55.97 56.31 2aqk s LYS 8 Cb 0.00 -3.34 -0.05 0.00 -1.01 0.00 0.00 37.83 33.43 2aqk s LYS 8 CO 0.00 0.34 0.19 1.03 0.51 0.00 0.00 175.35 177.42 2aqk s ARG 9 N -0.47 4.14 -0.07 1.68 0.52 -1.26 0.04 118.95 123.53 2aqk s ARG 9 Ca 0.44 -0.17 -0.03 0.00 -0.52 0.00 0.00 55.73 55.46 2aqk s ARG 9 Cb -0.24 -3.49 0.04 0.00 0.52 0.00 0.00 34.95 31.78 2aqk s ARG 9 CO 0.31 0.14 0.12 0.42 0.02 0.00 0.00 175.30 176.31 2aqk s ILE 10 N 0.80 -0.17 -0.10 1.52 1.01 -0.41 -0.41 121.20 123.44 2aqk s ILE 10 Ca 0.10 0.34 -0.23 0.00 0.00 0.00 0.00 60.65 60.85 2aqk s ILE 10 Cb -0.13 -0.23 -0.03 0.00 0.01 0.00 0.00 42.46 42.08 2aqk s ILE 10 CO 0.03 0.14 0.71 -0.22 0.00 0.00 0.00 174.94 175.60 2aqk s LEU 11 N 1.99 4.27 -0.26 2.97 1.98 -0.49 -1.83 118.68 127.31 2aqk s LEU 11 Ca 0.01 1.14 0.03 0.00 -2.89 0.00 0.00 54.13 52.42 2aqk s LEU 11 Cb -0.12 -3.09 0.06 0.00 0.66 0.00 0.00 46.19 43.70 2aqk s LEU 11 CO -0.05 -0.18 -0.10 -0.69 -1.89 0.00 0.00 176.35 173.44 2aqk s VAL 12 N 1.16 2.25 0.79 1.68 1.01 -0.21 0.14 120.40 127.23 2aqk s VAL 12 Ca 0.37 -1.60 -0.10 0.00 0.00 0.00 0.00 61.98 60.65 2aqk s VAL 12 Cb -0.17 -2.32 0.10 0.00 0.00 0.00 0.00 36.38 33.99 2aqk s VAL 12 CO 0.16 -0.03 1.13 -0.94 0.00 0.00 0.00 175.10 175.42 2aqk s SER 13 N 1.12 4.32 0.00 3.32 1.04 -0.51 -1.57 113.70 121.42 2aqk s SER 13 Ca -0.08 0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.79 2aqk s SER 13 Cb -0.20 -0.89 0.00 0.00 0.10 0.00 0.00 66.02 65.03 2aqk s SER 13 CO -0.05 -1.96 0.00 0.61 0.98 0.00 0.00 173.24 172.83 2aqk n GLY 14 N -3.21 0.90 3.67 7.32 0.00 -1.23 -4.19 105.19 108.45 2aqk n GLY 14 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2aqk n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2aqk s ILE 15 N -2.69 3.65 0.00 -0.61 1.01 -1.26 -4.52 121.20 116.78 2aqk s ILE 15 Ca 0.00 0.92 0.00 0.00 0.00 0.00 0.00 60.65 61.57 2aqk s ILE 15 Cb 0.00 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.88 2aqk s ILE 15 CO 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 174.94 174.90 2aqk n ILE 16 N 5.09 0.00 -4.30 2.92 0.13 -1.26 -4.66 119.36 117.28 2aqk n ILE 16 Ca 0.15 0.00 -0.17 0.00 -1.10 0.00 0.00 62.75 61.63 2aqk n ILE 16 Cb 0.43 -0.51 -0.09 0.00 -0.84 0.00 0.00 39.64 38.63 2aqk n ILE 16 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2aqk s THR 17 N -1.57 0.24 -1.82 9.51 -4.23 -1.26 -4.73 115.64 111.76 2aqk s THR 17 Ca 0.00 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 58.82 2aqk s THR 17 Cb 0.00 -2.52 0.77 0.00 1.34 0.00 0.00 72.50 72.09 2aqk s THR 17 CO 0.00 0.00 2.13 -0.90 -0.54 0.00 0.00 174.62 175.31 2aqk n ASP 18 N -0.83 0.00 -1.01 3.99 5.75 -1.26 -2.11 116.55 121.08 2aqk n ASP 18 Ca 0.02 -0.71 0.09 0.00 -0.01 0.00 0.00 54.79 54.19 2aqk n ASP 18 Cb 0.65 -0.09 0.21 0.00 -1.03 0.00 0.00 41.12 40.86 2aqk n ASP 18 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2aqk n SER 19 N -1.09 3.33 -4.78 -1.12 3.41 -1.26 -4.82 113.62 107.30 2aqk n SER 19 Ca 0.20 -1.95 -0.41 0.00 -0.26 0.00 0.00 58.87 56.46 2aqk n SER 19 Cb 0.15 -0.30 -0.00 0.00 -0.26 0.00 0.00 64.21 63.80 2aqk n SER 19 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2aqk s SER 20 N -1.15 6.32 0.25 4.04 0.01 -0.90 -4.64 113.70 117.63 2aqk s SER 20 Ca 0.35 3.06 -0.06 0.00 1.31 0.00 0.00 55.95 60.61 2aqk s SER 20 Cb 0.19 -2.67 0.29 0.00 0.21 0.00 0.00 66.02 64.04 2aqk s SER 20 CO 0.26 -0.90 1.90 0.40 0.41 0.00 0.00 173.24 175.32 2aqk h ILE 21 N 3.02 1.19 0.00 1.44 2.04 -1.89 -1.36 117.51 121.94 2aqk h ILE 21 Ca -0.51 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 2aqk h ILE 21 Cb 1.24 -0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2aqk h ILE 21 CO 0.66 0.23 -0.06 0.00 0.00 0.00 0.00 178.15 178.97 2aqk h ALA 22 N 1.38 1.69 -0.13 1.87 0.00 -1.86 -1.14 119.26 121.07 2aqk h ALA 22 Ca 0.37 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.25 2aqk h ALA 22 Cb -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2aqk h ALA 22 CO -0.11 0.08 -0.06 0.35 0.00 0.00 0.00 179.25 179.51 2aqk h PHE 23 N 0.00 -0.14 -0.13 0.00 3.04 -1.51 -0.53 116.94 117.67 2aqk h PHE 23 Ca -0.00 0.01 -0.14 0.00 3.98 0.00 0.00 57.97 61.82 2aqk h PHE 23 Cb 0.13 0.08 -0.01 0.00 2.56 0.00 0.00 35.95 38.71 2aqk h PHE 23 CO 0.00 -0.10 -0.52 0.45 -2.02 0.00 0.00 178.31 176.12 2aqk h HIS 24 N -0.05 0.46 0.08 0.41 -0.00 -1.29 0.23 115.15 114.99 2aqk h HIS 24 Ca 0.07 -0.16 -0.00 0.00 -0.00 0.00 0.00 60.37 60.28 2aqk h HIS 24 Cb 0.16 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.48 2aqk h HIS 24 CO -0.19 0.82 -0.04 0.82 -0.00 0.00 0.00 177.93 179.33 2aqk h ILE 25 N 0.29 0.96 -0.40 2.45 2.04 -1.17 0.71 117.51 122.39 2aqk h ILE 25 Ca 0.01 -0.12 0.07 0.00 1.00 0.00 0.00 64.86 65.82 2aqk h ILE 25 Cb 1.01 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 38.07 2aqk h ILE 25 CO 0.09 0.03 0.01 0.00 0.00 0.00 0.00 178.15 178.28 2aqk h ALA 26 N 0.76 0.38 0.38 1.87 0.00 -0.86 0.24 119.26 122.01 2aqk h ALA 26 Ca -0.01 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2aqk h ALA 26 Cb 0.13 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2aqk h ALA 26 CO 0.02 -0.38 -0.26 -0.09 0.00 0.00 0.00 179.25 178.54 2aqk h ARG 27 N 0.12 -0.60 -0.84 0.00 2.43 -0.37 -1.21 114.38 113.91 2aqk h ARG 27 Ca 0.20 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 2aqk h ARG 27 Cb 0.27 0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.92 2aqk h ARG 27 CO -0.32 -0.40 0.55 0.28 -1.51 0.00 0.00 179.97 178.58 2aqk h VAL 28 N -0.62 1.22 -0.13 0.20 2.07 -0.61 -0.75 116.25 117.63 2aqk h VAL 28 Ca -0.04 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 2aqk h VAL 28 Cb 0.52 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 2aqk h VAL 28 CO 0.02 0.21 0.07 0.00 0.02 0.00 0.00 177.57 177.89 2aqk h ALA 29 N 1.47 0.16 -0.16 1.67 0.00 -0.24 -1.27 119.26 120.90 2aqk h ALA 29 Ca 0.31 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2aqk h ALA 29 Cb -0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2aqk h ALA 29 CO -0.07 -0.29 0.09 1.96 0.00 0.00 0.00 179.25 180.95 2aqk h GLN 30 N 0.09 0.22 -0.68 0.00 4.20 -1.01 -0.85 115.11 117.08 2aqk h GLN 30 Ca 0.04 -0.02 0.20 0.00 0.06 0.00 0.00 58.65 58.93 2aqk h GLN 30 Cb 0.10 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 2aqk h GLN 30 CO -0.01 0.22 0.57 0.93 -0.67 0.00 0.00 178.83 179.87 2aqk h GLU 31 N 0.17 0.00 -0.65 1.46 5.08 -1.00 -0.06 114.58 119.58 2aqk h GLU 31 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2aqk h GLU 31 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2aqk h GLU 31 CO -0.01 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.04 2aqk n GLN 32 N -4.00 3.66 0.00 2.33 1.13 -0.41 -4.52 117.38 115.57 2aqk n GLN 32 Ca 0.14 -2.88 0.00 0.00 -1.94 0.00 0.00 57.00 52.32 2aqk n GLN 32 Cb 0.83 -1.87 0.00 0.00 0.11 0.00 0.00 30.24 29.31 2aqk n GLN 32 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2aqk n GLY 33 N 1.15 0.51 3.79 1.08 0.00 -0.04 -0.91 105.19 110.77 2aqk n GLY 33 Ca 0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.93 2aqk n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqk s ALA 34 N -2.00 2.96 -0.21 4.61 0.00 -0.70 -2.27 121.76 124.16 2aqk s ALA 34 Ca 0.00 0.66 -0.07 0.00 0.00 0.00 0.00 51.96 52.55 2aqk s ALA 34 Cb 0.00 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 2aqk s ALA 34 CO 0.00 -0.29 0.06 -0.65 0.00 0.00 0.00 175.76 174.88 2aqk s GLN 35 N -2.92 3.83 0.17 0.00 1.11 0.11 -4.36 119.66 117.60 2aqk s GLN 35 Ca 0.63 -0.41 0.07 0.00 0.01 0.00 0.00 55.36 55.66 2aqk s GLN 35 Cb -0.19 -3.25 -0.04 0.00 -1.01 0.00 0.00 33.01 28.52 2aqk s GLN 35 CO 0.24 0.09 0.03 -0.51 0.01 0.00 0.00 175.29 175.15 2aqk s LEU 36 N 0.87 3.44 -0.08 2.90 1.43 -1.26 -1.29 118.68 124.70 2aqk s LEU 36 Ca 0.03 -0.32 0.04 0.00 -1.03 0.00 0.00 54.13 52.85 2aqk s LEU 36 Cb -0.14 -2.08 0.00 0.00 0.03 0.00 0.00 46.19 44.00 2aqk s LEU 36 CO 0.02 0.09 -0.20 -0.69 0.23 0.00 0.00 176.35 175.81 2aqk s VAL 37 N -1.72 1.68 0.08 -1.59 1.01 -0.76 -3.87 120.40 115.23 2aqk s VAL 37 Ca 0.28 -0.82 0.05 0.00 0.00 0.00 0.00 61.98 61.49 2aqk s VAL 37 Cb -0.10 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 2aqk s VAL 37 CO 0.20 0.48 -0.02 -0.76 0.00 0.00 0.00 175.10 175.00 2aqk s LEU 38 N 0.33 3.40 0.15 3.92 1.43 0.14 -1.04 118.68 127.01 2aqk s LEU 38 Ca -0.14 -0.19 0.07 0.00 -1.03 0.00 0.00 54.13 52.85 2aqk s LEU 38 Cb -0.16 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 2aqk s LEU 38 CO 0.06 0.19 -0.16 0.42 0.23 0.00 0.00 176.35 177.09 2aqk s THR 39 N -1.26 1.63 -0.11 5.49 -4.23 -0.61 -0.15 115.64 116.40 2aqk s THR 39 Ca 0.24 -1.87 -0.14 0.00 -1.18 0.00 0.00 61.69 58.74 2aqk s THR 39 Cb -0.12 -1.75 0.03 0.00 1.34 0.00 0.00 72.50 72.01 2aqk s THR 39 CO 0.16 -0.38 0.37 -0.83 -0.54 0.00 0.00 174.62 173.41 2aqk s GLY 40 N -2.65 -0.26 0.00 3.99 0.00 -0.59 -3.56 107.32 104.25 2aqk s GLY 40 Ca 0.14 0.89 0.00 0.00 0.00 0.00 0.00 44.72 45.74 2aqk s GLY 40 CO 0.05 0.72 0.00 0.33 0.00 0.00 0.00 173.10 174.20 2aqk n PHE 41 N 2.39 0.00 -0.13 1.90 -0.00 -1.25 -0.49 117.46 119.88 2aqk n PHE 41 Ca -0.15 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.08 2aqk n PHE 41 Cb 0.57 0.00 -0.10 0.00 -0.00 0.00 0.00 39.48 39.95 2aqk n PHE 41 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 2aqk n ASP 42 N -0.25 1.99 -4.14 -2.13 4.64 -1.26 -4.49 116.55 110.91 2aqk n ASP 42 Ca 0.00 0.07 -0.43 0.00 -1.38 0.00 0.00 54.79 53.05 2aqk n ASP 42 Cb 0.00 -0.56 0.00 0.00 -1.04 0.00 0.00 41.12 39.53 2aqk n ASP 42 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 2aqk n ARG 43 N -3.65 3.74 -0.07 -0.67 5.12 -1.26 -4.83 116.66 115.04 2aqk n ARG 43 Ca -0.47 -4.00 -0.03 0.00 -1.93 0.00 0.00 57.85 51.42 2aqk n ARG 43 Cb 0.92 -2.80 0.21 0.00 -1.16 0.00 0.00 32.46 29.62 2aqk n ARG 43 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 2aqk h LEU 44 N 7.62 0.67 0.39 0.55 -0.00 -1.92 -0.24 115.31 122.37 2aqk h LEU 44 Ca 0.30 -0.15 -0.02 0.00 -0.00 0.00 0.00 57.88 58.01 2aqk h LEU 44 Cb 0.73 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 41.22 2aqk h LEU 44 CO 1.36 0.74 -0.19 0.03 -0.00 0.00 0.00 178.44 180.38 2aqk h ARG 45 N 0.66 -0.50 -0.62 1.13 3.08 -1.99 0.10 114.38 116.24 2aqk h ARG 45 Ca 0.13 0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.31 2aqk h ARG 45 Cb 0.41 0.11 -0.11 0.00 0.08 0.00 0.00 29.97 30.47 2aqk h ARG 45 CO 0.02 -0.31 -0.45 1.25 -1.07 0.00 0.00 179.97 179.41 2aqk h LEU 46 N -0.56 -1.55 -0.65 3.04 5.85 -1.93 -1.88 115.31 117.63 2aqk h LEU 46 Ca -0.05 0.25 -0.09 0.00 0.84 0.00 0.00 57.88 58.83 2aqk h LEU 46 Cb 0.42 0.70 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 2aqk h LEU 46 CO 0.09 -0.33 0.02 0.40 -0.34 0.00 0.00 178.44 178.27 2aqk h ILE 47 N -0.21 1.26 -0.90 4.05 2.04 -0.85 -1.11 117.51 121.80 2aqk h ILE 47 Ca 0.18 -1.13 0.09 0.00 1.00 0.00 0.00 64.86 64.99 2aqk h ILE 47 Cb 0.56 0.77 -0.07 0.00 -0.74 0.00 0.00 36.82 37.34 2aqk h ILE 47 CO -0.71 0.41 0.55 -0.61 0.00 0.00 0.00 178.15 177.79 2aqk h GLN 48 N 0.98 0.93 -0.24 2.37 5.75 -0.53 0.31 115.11 124.68 2aqk h GLN 48 Ca 0.18 -0.06 -0.18 0.00 -0.15 0.00 0.00 58.65 58.44 2aqk h GLN 48 Cb 0.54 -0.21 -0.00 0.00 1.07 0.00 0.00 27.48 28.88 2aqk h GLN 48 CO 0.03 0.61 -0.58 -0.09 -2.65 0.00 0.00 178.83 176.15 2aqk h ARG 49 N 0.95 0.77 -0.36 1.69 1.12 -0.50 -1.09 114.38 116.95 2aqk h ARG 49 Ca 0.42 -0.50 -0.02 0.00 -1.11 0.00 0.00 59.98 58.76 2aqk h ARG 49 Cb 0.30 0.07 -0.02 0.00 -0.01 0.00 0.00 29.97 30.31 2aqk h ARG 49 CO -0.22 1.13 0.15 0.82 -3.11 0.00 0.00 179.97 178.74 2aqk h ILE 50 N 0.58 1.19 0.00 1.20 2.04 -0.90 -3.25 117.51 118.37 2aqk h ILE 50 Ca 0.00 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.29 2aqk h ILE 50 Cb 1.18 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.14 2aqk h ILE 50 CO 0.12 0.20 0.00 0.35 0.00 0.00 0.00 178.15 178.83 2aqk n THR 51 N -4.68 0.70 -0.03 -0.27 -2.24 0.11 -1.86 114.28 106.00 2aqk n THR 51 Ca -0.01 -0.05 0.24 0.00 -2.27 0.00 0.00 64.05 61.96 2aqk n THR 51 Cb 0.14 -0.85 0.68 0.00 -2.10 0.00 0.00 70.33 68.20 2aqk n THR 51 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2aqk h ASP 52 N 0.00 0.00 0.50 3.42 3.45 -1.25 0.22 116.42 122.77 2aqk h ASP 52 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2aqk h ASP 52 Cb 0.57 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.34 2aqk h ASP 52 CO 0.00 0.00 -0.29 0.54 -1.57 0.00 0.00 179.24 177.92 2aqk n ARG 53 N -3.67 0.30 -1.71 3.56 5.12 -0.78 -4.85 116.66 114.64 2aqk n ARG 53 Ca 0.13 -0.14 -0.41 0.00 -1.93 0.00 0.00 57.85 55.51 2aqk n ARG 53 Cb 0.91 -1.50 0.02 0.00 -1.16 0.00 0.00 32.46 30.73 2aqk n ARG 53 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2aqk n LEU 54 N -1.22 4.25 0.00 0.55 4.77 0.78 -4.87 117.00 121.27 2aqk n LEU 54 Ca 0.09 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.16 2aqk n LEU 54 Cb 0.33 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 39.90 2aqk n LEU 54 CO 0.30 -0.60 0.48 -2.65 -1.33 0.00 0.00 177.39 173.58 2aqk n PRO 55 N -0.07 0.00 -3.88 3.23 -0.02 -1.26 -4.65 135.00 128.35 2aqk n PRO 55 Ca 0.07 0.43 -0.09 0.00 -2.02 0.00 0.00 63.50 61.89 2aqk n PRO 55 Cb 0.40 -1.52 -0.08 0.00 -0.02 0.00 0.00 33.50 32.28 2aqk n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2aqk s ALA 56 N -2.86 -0.15 0.45 3.55 0.00 -1.26 -5.07 121.76 116.41 2aqk s ALA 56 Ca 0.00 -0.67 -0.23 0.00 0.00 0.00 0.00 51.96 51.06 2aqk s ALA 56 Cb 0.00 0.45 -0.08 0.00 0.00 0.00 0.00 23.12 23.50 2aqk s ALA 56 CO 0.00 -0.49 1.16 0.15 0.00 0.00 0.00 175.76 176.58 2aqk s LYS 57 N -3.81 3.84 -0.08 0.00 -0.14 -1.26 -4.96 119.74 113.33 2aqk s LYS 57 Ca 0.05 1.76 -0.04 0.00 -1.36 0.00 0.00 55.97 56.39 2aqk s LYS 57 Cb 0.05 -2.46 0.04 0.00 -1.68 0.00 0.00 37.83 33.78 2aqk s LYS 57 CO -0.11 -0.48 0.18 0.00 -0.76 0.00 0.00 175.35 174.18 2aqk s ALA 58 N -1.54 -0.35 0.26 5.17 0.00 -1.26 -4.68 121.76 119.36 2aqk s ALA 58 Ca 0.62 0.77 -0.31 0.00 0.00 0.00 0.00 51.96 53.05 2aqk s ALA 58 Cb -0.28 -0.51 -0.12 0.00 0.00 0.00 0.00 23.12 22.21 2aqk s ALA 58 CO 0.35 -0.17 1.58 -0.35 0.00 0.00 0.00 175.76 177.17 2aqk n PRO 59 N 4.21 2.56 -4.30 0.00 -0.04 -1.25 -4.75 135.00 131.43 2aqk n PRO 59 Ca -0.26 0.91 -0.35 0.00 -0.04 0.00 0.00 63.50 63.77 2aqk n PRO 59 Cb 0.52 -2.68 -0.10 0.00 -0.04 0.00 0.00 33.50 31.20 2aqk n PRO 59 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2aqk s LEU 60 N 0.02 3.56 0.01 1.53 2.96 -1.26 0.28 118.68 125.78 2aqk s LEU 60 Ca 0.68 0.07 0.05 0.00 -0.22 0.00 0.00 54.13 54.71 2aqk s LEU 60 Cb -0.54 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.29 2aqk s LEU 60 CO 0.45 0.29 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.85 2aqk s LEU 61 N -0.35 2.08 0.08 -0.68 1.43 0.78 -4.95 118.68 117.08 2aqk s LEU 61 Ca 0.07 -0.35 -0.30 0.00 -1.03 0.00 0.00 54.13 52.52 2aqk s LEU 61 Cb -0.12 -0.78 -0.05 0.00 0.03 0.00 0.00 46.19 45.26 2aqk s LEU 61 CO 0.02 0.15 1.01 -0.70 0.23 0.00 0.00 176.35 177.07 2aqk s GLU 62 N -0.65 4.61 -0.21 1.70 2.12 -1.26 -1.54 118.70 123.47 2aqk s GLU 62 Ca 0.05 1.52 -0.04 0.00 0.36 0.00 0.00 54.97 56.86 2aqk s GLU 62 Cb -0.07 -3.38 0.11 0.00 0.26 0.00 0.00 34.13 31.05 2aqk s GLU 62 CO 0.00 0.07 0.32 -1.17 -0.54 0.00 0.00 175.26 173.94 2aqk s LEU 63 N 0.35 -0.43 -0.30 2.70 2.96 0.35 -4.85 118.68 119.46 2aqk s LEU 63 Ca 0.50 0.23 -0.10 0.00 -0.22 0.00 0.00 54.13 54.54 2aqk s LEU 63 Cb -0.24 0.86 -0.02 0.00 0.50 0.00 0.00 46.19 47.29 2aqk s LEU 63 CO 0.30 -0.29 0.16 -0.62 -1.32 0.00 0.00 176.35 174.58 2aqk s ASP 64 N 2.47 5.63 0.31 3.68 3.68 -1.26 -3.96 116.67 127.22 2aqk s ASP 64 Ca 0.08 -0.37 0.26 0.00 2.13 0.00 0.00 52.55 54.65 2aqk s ASP 64 Cb -0.15 -2.03 0.96 0.00 -1.45 0.00 0.00 42.92 40.26 2aqk s ASP 64 CO -0.13 -0.15 1.77 1.62 0.13 0.00 0.00 175.17 178.40 2aqk h VAL 65 N 5.57 0.00 -0.01 1.11 3.04 -1.97 0.13 116.25 124.12 2aqk h VAL 65 Ca -0.34 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 64.96 2aqk h VAL 65 Cb 1.16 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.69 2aqk h VAL 65 CO 0.60 0.00 -0.08 0.00 -1.01 0.00 0.00 177.57 177.08 2aqk n GLN 66 N -2.45 1.43 -3.40 4.17 6.02 -1.26 -4.80 117.38 117.10 2aqk n GLN 66 Ca 0.03 -0.84 -0.44 0.00 -0.01 0.00 0.00 57.00 55.74 2aqk n GLN 66 Cb 0.31 -1.48 -0.08 0.00 1.02 0.00 0.00 30.24 30.01 2aqk n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2aqk s ASN 67 N -2.15 6.14 0.35 1.08 3.84 0.45 -4.94 114.94 119.71 2aqk s ASN 67 Ca 0.34 -1.15 0.05 0.00 0.21 0.00 0.00 52.86 52.31 2aqk s ASN 67 Cb 0.20 -2.18 0.71 0.00 -0.55 0.00 0.00 41.25 39.43 2aqk s ASN 67 CO 0.39 -0.59 1.94 -0.08 -2.79 0.00 0.00 177.10 175.96 2aqk h GLU 68 N 8.73 0.78 -0.17 0.43 4.57 -1.87 -2.12 114.58 124.93 2aqk h GLU 68 Ca -0.28 -0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 57.73 2aqk h GLU 68 Cb 1.11 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 2aqk h GLU 68 CO 0.83 0.51 -0.37 1.49 -1.18 0.00 0.00 179.01 180.30 2aqk h GLU 69 N 0.80 0.55 -0.64 1.92 4.22 -1.93 0.39 114.58 119.89 2aqk h GLU 69 Ca 0.34 -0.37 0.12 0.00 0.08 0.00 0.00 59.36 59.54 2aqk h GLU 69 Cb 0.30 0.05 -0.12 0.00 0.50 0.00 0.00 28.75 29.48 2aqk h GLU 69 CO -0.12 0.98 -0.26 0.45 -2.18 0.00 0.00 179.01 177.88 2aqk h HIS 70 N 0.19 -0.66 -0.34 0.92 3.86 -1.77 0.17 115.15 117.53 2aqk h HIS 70 Ca 0.00 0.07 -0.15 0.00 -1.16 0.00 0.00 60.37 59.13 2aqk h HIS 70 Cb 0.98 0.39 -0.00 0.00 1.06 0.00 0.00 27.41 29.83 2aqk h HIS 70 CO 0.10 -0.34 -0.36 -0.07 0.86 0.00 0.00 177.93 178.11 2aqk h LEU 71 N -0.09 0.91 -1.41 2.43 3.38 -1.15 -1.28 115.31 118.10 2aqk h LEU 71 Ca 0.28 -0.47 0.02 0.00 0.09 0.00 0.00 57.88 57.80 2aqk h LEU 71 Cb 0.53 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 2aqk h LEU 71 CO -0.70 1.20 0.41 0.00 0.09 0.00 0.00 178.44 179.44 2aqk h ALA 72 N 0.74 1.61 -0.01 1.53 0.00 0.17 -2.35 119.26 120.95 2aqk h ALA 72 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2aqk h ALA 72 Cb 0.95 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2aqk h ALA 72 CO 0.09 0.34 -0.46 -1.13 0.00 0.00 0.00 179.25 178.09 2aqk n SER 73 N -4.45 1.51 -0.03 0.00 3.41 0.57 -4.64 113.62 109.99 2aqk n SER 73 Ca 0.07 -1.19 -0.12 0.00 -0.26 0.00 0.00 58.87 57.37 2aqk n SER 73 Cb 0.09 0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 64.37 2aqk n SER 73 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2aqk h LEU 74 N 1.65 0.18 -0.92 1.04 7.12 -0.66 -2.08 115.31 121.64 2aqk h LEU 74 Ca 0.00 -0.32 0.04 0.00 0.13 0.00 0.00 57.88 57.73 2aqk h LEU 74 Cb 0.63 -0.05 -0.06 0.00 -0.53 0.00 0.00 40.66 40.66 2aqk h LEU 74 CO 0.00 0.46 0.60 0.00 -0.13 0.00 0.00 178.44 179.37 2aqk h ALA 75 N 0.73 1.24 0.47 1.25 0.00 -1.76 -0.28 119.26 120.90 2aqk h ALA 75 Ca 0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2aqk h ALA 75 Cb 0.37 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2aqk h ALA 75 CO 0.01 0.44 -0.27 0.78 0.00 0.00 0.00 179.25 180.20 2aqk h GLY 76 N 1.14 -0.74 0.32 0.00 0.00 -1.81 -0.98 103.07 100.99 2aqk h GLY 76 Ca 0.38 0.30 0.19 0.00 0.00 0.00 0.00 47.33 48.20 2aqk h GLY 76 CO -0.14 -0.27 0.60 3.21 0.00 0.00 0.00 176.54 179.94 2aqk h ARG 77 N -0.70 0.50 -0.22 4.80 3.08 -1.09 -0.10 114.38 120.66 2aqk h ARG 77 Ca -0.06 -0.03 -0.21 0.00 0.07 0.00 0.00 59.98 59.76 2aqk h ARG 77 Cb 0.57 -0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.51 2aqk h ARG 77 CO 0.06 0.33 -0.67 0.28 -1.07 0.00 0.00 179.97 178.91 2aqk h VAL 78 N 0.52 1.27 0.00 2.04 2.07 -0.62 -1.77 116.25 119.77 2aqk h VAL 78 Ca 0.48 -1.85 -0.10 0.00 0.82 0.00 0.00 66.70 66.05 2aqk h VAL 78 Cb 1.04 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 2aqk h VAL 78 CO -0.22 0.60 -0.48 0.71 0.02 0.00 0.00 177.57 178.20 2aqk h THR 79 N 0.60 1.14 -0.07 2.57 1.35 0.09 -1.02 112.91 117.57 2aqk h THR 79 Ca -0.02 -1.78 0.03 0.00 -0.55 0.00 0.00 66.41 64.09 2aqk h THR 79 Cb 1.29 2.02 -0.04 0.00 -1.73 0.00 0.00 68.15 69.69 2aqk h THR 79 CO 0.14 0.47 -0.15 -0.08 -0.25 0.00 0.00 175.52 175.66 2aqk h GLU 80 N 0.00 -0.21 -0.03 4.72 4.81 -0.98 1.26 114.58 124.15 2aqk h GLU 80 Ca -0.00 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.16 2aqk h GLU 80 Cb 0.98 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 2aqk h GLU 80 CO 0.06 -0.14 -0.37 0.00 -0.73 0.00 0.00 179.01 177.84 2aqk h ALA 81 N 0.79 1.32 0.00 2.92 0.00 -0.92 -3.18 119.26 120.20 2aqk h ALA 81 Ca 0.07 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2aqk h ALA 81 Cb 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2aqk h ALA 81 CO -0.20 0.49 -0.62 0.44 0.00 0.00 0.00 179.25 179.37 2aqk n ILE 82 N -4.09 0.00 0.00 0.00 -5.35 -0.42 -4.95 119.36 104.55 2aqk n ILE 82 Ca -0.02 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.25 2aqk n ILE 82 Cb 0.42 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.29 2aqk n ILE 82 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2aqk n GLY 83 N 1.31 0.57 3.67 3.28 0.00 0.43 -4.73 105.19 109.72 2aqk n GLY 83 Ca 0.02 -1.47 -0.43 0.00 0.00 0.00 0.00 46.02 44.14 2aqk n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqk n ALA 84 N 1.06 0.84 -0.95 4.61 0.00 -1.21 -1.19 120.51 123.67 2aqk n ALA 84 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2aqk n ALA 84 Cb 0.00 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.27 2aqk n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aqk n GLY 85 N 0.91 0.54 3.60 0.00 0.00 -1.26 -5.00 105.19 103.98 2aqk n GLY 85 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 2aqk n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2aqk s ASN 86 N -2.32 4.93 0.17 1.61 0.02 -0.33 -5.12 114.94 113.90 2aqk s ASN 86 Ca 0.00 0.01 0.10 0.00 -1.02 0.00 0.00 52.86 51.95 2aqk s ASN 86 Cb 0.00 -1.47 -0.04 0.00 0.02 0.00 0.00 41.25 39.75 2aqk s ASN 86 CO 0.00 0.31 -0.22 -0.75 0.02 0.00 0.00 177.10 176.46 2aqk s LYS 87 N -0.48 1.38 0.30 -0.60 2.47 -1.26 -4.81 119.74 116.74 2aqk s LYS 87 Ca 0.08 -1.44 -0.29 0.00 -1.56 0.00 0.00 55.97 52.76 2aqk s LYS 87 Cb -0.12 -1.61 -0.10 0.00 -1.46 0.00 0.00 37.83 34.54 2aqk s LYS 87 CO 0.02 0.35 1.19 -0.51 0.16 0.00 0.00 175.35 176.55 2aqk s LEU 88 N -2.57 4.50 0.00 5.43 1.43 0.19 -4.75 118.68 122.91 2aqk s LEU 88 Ca 0.17 2.45 0.22 0.00 -1.03 0.00 0.00 54.13 55.94 2aqk s LEU 88 Cb -0.07 -3.64 -0.20 0.00 0.03 0.00 0.00 46.19 42.31 2aqk s LEU 88 CO 0.08 -0.31 0.78 0.47 0.23 0.00 0.00 176.35 177.60 2aqk n ASP 89 N 1.03 0.55 -3.65 2.29 8.00 0.45 -0.55 116.55 124.68 2aqk n ASP 89 Ca -0.01 -0.45 -0.14 0.00 0.71 0.00 0.00 54.79 54.90 2aqk n ASP 89 Cb 0.43 1.31 -0.08 0.00 -0.02 0.00 0.00 41.12 42.77 2aqk n ASP 89 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2aqk s GLY 90 N -3.70 -0.47 -0.02 0.44 0.00 -0.90 -1.64 107.32 101.03 2aqk s GLY 90 Ca 0.01 1.62 0.00 0.00 0.00 0.00 0.00 44.72 46.36 2aqk s GLY 90 CO 0.87 1.37 0.03 0.14 0.00 0.00 0.00 173.10 175.50 2aqk s VAL 91 N 0.03 -0.01 -0.19 1.40 1.01 -0.51 -1.39 120.40 120.73 2aqk s VAL 91 Ca -0.02 0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.17 2aqk s VAL 91 Cb -0.04 -0.12 0.03 0.00 0.00 0.00 0.00 36.38 36.25 2aqk s VAL 91 CO 0.02 0.11 -0.18 -0.69 0.00 0.00 0.00 175.10 174.36 2aqk s VAL 92 N 1.11 2.01 -0.31 2.92 1.01 0.12 -0.22 120.40 127.05 2aqk s VAL 92 Ca -0.09 -1.02 -0.13 0.00 0.00 0.00 0.00 61.98 60.74 2aqk s VAL 92 Cb -0.13 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 2aqk s VAL 92 CO -0.03 0.43 0.25 -2.28 0.00 0.00 0.00 175.10 173.47 2aqk s HIS 93 N 1.28 3.22 -0.34 5.22 2.46 0.45 -1.42 115.29 126.16 2aqk s HIS 93 Ca 0.03 0.03 0.16 0.00 0.47 0.00 0.00 55.06 55.74 2aqk s HIS 93 Cb -0.14 -2.48 0.45 0.00 -0.13 0.00 0.00 32.58 30.28 2aqk s HIS 93 CO -0.11 -0.27 0.96 0.00 -2.47 0.00 0.00 174.74 172.85 2aqk n ALA 94 N 5.15 3.59 -2.54 1.58 0.00 -1.26 -1.89 120.51 125.14 2aqk n ALA 94 Ca -0.12 -3.34 -0.32 0.00 0.00 0.00 0.00 53.44 49.66 2aqk n ALA 94 Cb 0.51 -0.88 -0.15 0.00 0.00 0.00 0.00 19.45 18.93 2aqk n ALA 94 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2aqk s ILE 95 N -3.45 2.39 -0.25 0.00 1.01 -1.26 -4.15 121.20 115.49 2aqk s ILE 95 Ca 0.31 -0.96 -0.26 0.00 0.00 0.00 0.00 60.65 59.74 2aqk s ILE 95 Cb 0.44 -1.89 0.13 0.00 0.01 0.00 0.00 42.46 41.15 2aqk s ILE 95 CO -0.00 0.58 1.05 -0.83 0.00 0.00 0.00 174.94 175.73 2aqk s GLY 96 N -0.44 -0.15 -0.24 6.18 0.00 -1.26 -4.52 107.32 106.89 2aqk s GLY 96 Ca 0.05 2.57 -0.27 0.00 0.00 0.00 0.00 44.72 47.07 2aqk s GLY 96 CO 0.01 1.65 1.04 -0.12 0.00 0.00 0.00 173.10 175.67 2aqk s PHE 97 N -0.11 -0.43 -0.08 1.90 5.36 -1.26 -4.92 117.98 118.44 2aqk s PHE 97 Ca 0.02 0.96 -0.03 0.00 -0.96 0.00 0.00 56.93 56.92 2aqk s PHE 97 Cb -0.04 0.39 0.05 0.00 -0.34 0.00 0.00 43.02 43.08 2aqk s PHE 97 CO -0.05 -0.26 0.17 1.41 -1.46 0.00 0.00 175.22 175.03 2aqk s MET 98 N -0.20 0.06 0.64 10.12 -2.45 -1.26 -4.24 119.30 121.97 2aqk s MET 98 Ca 0.02 0.52 -0.17 0.00 -1.25 0.00 0.00 55.69 54.80 2aqk s MET 98 Cb -0.04 -0.22 -0.12 0.00 1.25 0.00 0.00 34.83 35.70 2aqk s MET 98 CO -0.04 -0.26 -0.04 -2.30 1.05 0.00 0.00 175.02 173.43 2aqk n PRO 99 N 4.95 0.12 0.16 4.11 -0.02 -1.26 -4.81 135.00 138.25 2aqk n PRO 99 Ca -0.12 0.05 0.05 0.00 -2.02 0.00 0.00 63.50 61.46 2aqk n PRO 99 Cb 0.50 -1.24 0.51 0.00 -0.02 0.00 0.00 33.50 33.25 2aqk n PRO 99 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2aqk h GLN 100 N -0.22 0.18 0.00 -0.52 4.20 -1.97 0.94 115.11 117.73 2aqk h GLN 100 Ca -0.43 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.25 2aqk h GLN 100 Cb 1.40 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 29.14 2aqk h GLN 100 CO 0.39 0.20 -0.05 1.79 -0.67 0.00 0.00 178.83 180.50 2aqk h THR 101 N 0.18 0.22 -0.12 -0.54 1.35 -1.96 -1.79 112.91 110.25 2aqk h THR 101 Ca 0.04 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 2aqk h THR 101 Cb 0.13 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 2aqk h THR 101 CO 0.00 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 2aqk n GLY 102 N -0.53 0.24 3.42 5.82 0.00 0.32 -3.96 105.19 110.51 2aqk n GLY 102 Ca -0.01 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 2aqk n GLY 102 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2aqk s MET 103 N -1.85 1.83 4.22 1.61 1.00 -0.67 -0.79 119.30 124.65 2aqk s MET 103 Ca 0.34 -2.09 0.00 0.00 0.00 0.00 0.00 55.69 53.94 2aqk s MET 103 Cb 0.19 -0.26 0.00 0.00 0.00 0.00 0.00 34.83 34.75 2aqk s MET 103 CO 0.29 -0.53 0.00 0.41 0.00 0.00 0.00 175.02 175.19 2aqk n GLY 104 N -0.78 2.74 0.17 -0.03 0.00 0.18 -3.08 105.19 104.39 2aqk n GLY 104 Ca -0.01 -0.20 0.05 0.00 0.00 0.00 0.00 46.02 45.86 2aqk n GLY 104 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2aqk h ILE 105 N 0.00 0.85 -1.84 -0.61 1.08 -1.41 -3.41 117.51 112.17 2aqk h ILE 105 Ca 0.00 -1.82 -0.66 0.00 -0.39 0.00 0.00 64.86 61.99 2aqk h ILE 105 Cb 0.00 2.15 0.02 0.00 -3.07 0.00 0.00 36.82 35.92 2aqk h ILE 105 CO 0.00 0.42 0.96 -3.20 -0.69 0.00 0.00 178.15 175.64 2aqk n ASN 106 N -3.37 2.90 -4.71 1.72 5.15 -1.18 -4.84 115.26 110.93 2aqk n ASN 106 Ca 0.01 1.03 -0.43 0.00 -0.60 0.00 0.00 54.58 54.59 2aqk n ASN 106 Cb 0.61 -1.27 -0.01 0.00 -0.53 0.00 0.00 39.78 38.57 2aqk n ASN 106 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 2aqk n PRO 107 N 5.64 2.21 -0.28 1.20 -0.02 -1.26 -4.71 135.00 137.78 2aqk n PRO 107 Ca 0.23 0.78 0.10 0.00 -2.02 0.00 0.00 63.50 62.59 2aqk n PRO 107 Cb 0.22 -2.40 0.24 0.00 -0.02 0.00 0.00 33.50 31.55 2aqk n PRO 107 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2aqk h PHE 108 N 2.93 0.23 0.00 6.00 3.57 -1.89 -0.18 116.94 127.61 2aqk h PHE 108 Ca -0.46 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.09 2aqk h PHE 108 Cb 1.27 0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.05 2aqk h PHE 108 CO 0.52 -0.20 0.00 0.74 -2.23 0.00 0.00 178.31 177.14 2aqk h PHE 109 N 0.19 0.00 -0.00 0.41 0.04 -1.95 -3.10 116.94 112.53 2aqk h PHE 109 Ca 0.50 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.27 2aqk h PHE 109 Cb 0.96 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.11 2aqk h PHE 109 CO -0.31 0.00 -0.26 -0.25 -0.60 0.00 0.00 178.31 176.89 2aqk n ASP 110 N -2.41 0.56 -4.66 2.17 8.00 -0.08 -4.85 116.55 115.27 2aqk n ASP 110 Ca 0.02 -0.40 -0.43 0.00 0.71 0.00 0.00 54.79 54.69 2aqk n ASP 110 Cb 0.26 0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.36 2aqk n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2aqk s ALA 111 N -2.72 3.64 0.40 2.24 0.00 -1.17 -4.97 121.76 119.17 2aqk s ALA 111 Ca 0.20 0.65 -0.25 0.00 0.00 0.00 0.00 51.96 52.55 2aqk s ALA 111 Cb 0.19 -3.66 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 2aqk s ALA 111 CO 0.57 -1.23 1.20 -2.14 0.00 0.00 0.00 175.76 174.16 2aqk s PRO 112 N 3.60 4.03 0.32 0.00 0.02 -1.26 -4.87 135.00 136.84 2aqk s PRO 112 Ca 0.62 1.93 0.06 0.00 0.02 0.00 0.00 61.00 63.62 2aqk s PRO 112 Cb -0.26 -2.70 0.71 0.00 0.02 0.00 0.00 34.50 32.26 2aqk s PRO 112 CO 0.21 -0.36 1.83 -0.92 -0.33 0.00 0.00 177.00 177.42 2aqk h TYR 113 N 2.66 1.00 -0.95 6.54 3.20 -1.98 0.11 116.97 127.55 2aqk h TYR 113 Ca -0.49 0.03 0.20 0.00 3.14 0.00 0.00 58.73 61.61 2aqk h TYR 113 Cb 1.24 -0.31 -0.11 0.00 1.54 0.00 0.00 36.73 39.08 2aqk h TYR 113 CO 0.54 0.34 0.52 0.00 -1.64 0.00 0.00 178.16 177.92 2aqk h ALA 114 N 1.59 1.57 -0.14 1.82 0.00 -1.98 0.39 119.26 122.51 2aqk h ALA 114 Ca 0.50 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.44 2aqk h ALA 114 Cb 0.70 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2aqk h ALA 114 CO -0.27 -0.19 -0.25 -0.44 0.00 0.00 0.00 179.25 178.10 2aqk h ASP 115 N 0.60 0.46 -0.20 0.00 3.32 -1.18 -2.53 116.42 116.89 2aqk h ASP 115 Ca 0.57 -0.55 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 2aqk h ASP 115 Cb 0.97 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 2aqk h ASP 115 CO -0.44 0.92 0.09 0.58 -1.72 0.00 0.00 179.24 178.67 2aqk h VAL 116 N 0.02 1.14 -0.88 -1.35 2.07 -0.77 -2.13 116.25 114.35 2aqk h VAL 116 Ca 0.01 -0.41 0.10 0.00 0.82 0.00 0.00 66.70 67.22 2aqk h VAL 116 Cb 0.83 1.04 -0.08 0.00 -1.52 0.00 0.00 31.29 31.57 2aqk h VAL 116 CO 0.06 0.14 0.52 -1.28 0.02 0.00 0.00 177.57 177.02 2aqk h SER 117 N 0.19 0.75 -0.46 0.57 0.87 -0.33 0.19 113.55 115.34 2aqk h SER 117 Ca 0.07 0.05 -0.05 0.00 -1.23 0.00 0.00 61.79 60.63 2aqk h SER 117 Cb 0.13 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 2aqk h SER 117 CO -0.01 0.42 0.09 0.50 -0.53 0.00 0.00 176.83 177.30 2aqk h LYS 118 N 0.85 0.75 -0.74 2.24 3.64 -1.13 0.12 116.57 122.30 2aqk h LYS 118 Ca 0.43 -0.19 -0.05 0.00 -1.27 0.00 0.00 60.65 59.57 2aqk h LYS 118 Cb 0.41 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 2aqk h LYS 118 CO -0.26 0.76 0.26 0.78 -2.27 0.00 0.00 179.45 178.73 2aqk h GLY 119 N 0.62 1.21 1.37 5.01 0.00 -0.68 -1.14 103.07 109.45 2aqk h GLY 119 Ca 0.14 -0.69 -0.16 0.00 0.00 0.00 0.00 47.33 46.63 2aqk h GLY 119 CO 0.01 0.65 -0.48 -2.22 0.00 0.00 0.00 176.54 174.49 2aqk h ILE 120 N 1.08 1.30 0.19 2.60 2.04 -0.51 0.25 117.51 124.46 2aqk h ILE 120 Ca 0.24 -1.68 0.01 0.00 1.00 0.00 0.00 64.86 64.43 2aqk h ILE 120 Cb 0.26 1.62 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 2aqk h ILE 120 CO -0.01 0.54 -0.48 -0.74 0.00 0.00 0.00 178.15 177.45 2aqk h HIS 121 N 0.54 -1.38 -0.12 1.37 2.76 -0.53 0.28 115.15 118.07 2aqk h HIS 121 Ca 0.03 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.17 2aqk h HIS 121 Cb 1.03 0.58 -0.00 0.00 1.55 0.00 0.00 27.41 30.56 2aqk h HIS 121 CO 0.05 -0.58 -0.14 0.82 -1.30 0.00 0.00 177.93 176.78 2aqk h ILE 122 N -0.77 1.36 0.00 6.26 2.04 -1.15 0.10 117.51 125.36 2aqk h ILE 122 Ca -0.01 -1.32 -0.16 0.00 1.00 0.00 0.00 64.86 64.38 2aqk h ILE 122 Cb 0.76 1.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 2aqk h ILE 122 CO -0.23 0.38 -0.76 0.28 0.00 0.00 0.00 178.15 177.82 2aqk h SER 123 N -0.10 0.00 0.00 1.72 0.02 -0.49 -3.37 113.55 111.33 2aqk h SER 123 Ca 0.02 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2aqk h SER 123 Cb 0.67 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 2aqk h SER 123 CO 0.03 0.76 -0.21 0.00 -1.14 0.00 0.00 176.83 176.27 2aqk n ALA 124 N -2.31 2.98 -0.09 3.77 0.00 0.78 -4.73 120.51 120.91 2aqk n ALA 124 Ca 0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2aqk n ALA 124 Cb 0.82 0.30 0.14 0.00 0.00 0.00 0.00 19.45 20.71 2aqk n ALA 124 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2aqk h TYR 125 N -0.01 0.83 -0.08 0.00 5.03 -0.93 -1.40 116.97 120.42 2aqk h TYR 125 Ca -0.00 -0.14 0.02 0.00 2.58 0.00 0.00 58.73 61.19 2aqk h TYR 125 Cb 0.21 -0.22 -0.00 0.00 1.55 0.00 0.00 36.73 38.27 2aqk h TYR 125 CO -0.00 0.81 0.21 0.66 -1.32 0.00 0.00 178.16 178.52 2aqk h SER 126 N 0.70 0.00 -0.41 -2.11 4.64 -0.95 0.03 113.55 115.45 2aqk h SER 126 Ca 0.12 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.37 2aqk h SER 126 Cb 0.54 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2aqk h SER 126 CO 0.03 0.00 0.01 0.22 -0.87 0.00 0.00 176.83 176.22 2aqk h TYR 127 N 0.00 0.86 -0.15 4.77 3.20 -1.52 -1.19 116.97 122.95 2aqk h TYR 127 Ca 0.04 -0.12 -0.17 0.00 3.14 0.00 0.00 58.73 61.62 2aqk h TYR 127 Cb 0.46 -0.24 0.01 0.00 1.54 0.00 0.00 36.73 38.51 2aqk h TYR 127 CO 0.00 0.79 -0.56 0.00 -1.64 0.00 0.00 178.16 176.75 2aqk h ALA 128 N 1.25 0.27 -0.59 1.82 0.00 -1.13 -2.40 119.26 118.48 2aqk h ALA 128 Ca 0.15 -0.52 0.05 0.00 0.00 0.00 0.00 54.91 54.59 2aqk h ALA 128 Cb 0.45 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 2aqk h ALA 128 CO 0.02 0.49 0.31 0.77 0.00 0.00 0.00 179.25 180.84 2aqk h SER 129 N 0.31 0.45 -0.45 0.00 0.02 -1.30 0.83 113.55 113.41 2aqk h SER 129 Ca -0.03 0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.85 2aqk h SER 129 Cb 1.19 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.67 2aqk h SER 129 CO 0.12 0.30 -0.13 0.24 -1.14 0.00 0.00 176.83 176.21 2aqk h MET 130 N 0.58 0.88 -0.21 3.45 2.07 -1.25 -0.65 114.93 119.81 2aqk h MET 130 Ca 0.27 -0.35 -0.11 0.00 -2.07 0.00 0.00 59.70 57.44 2aqk h MET 130 Cb 0.17 -0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 29.85 2aqk h MET 130 CO -0.18 0.99 -0.33 0.00 1.07 0.00 0.00 176.91 178.46 2aqk h ALA 131 N 0.86 1.05 -0.18 6.32 0.00 -0.87 -1.02 119.26 125.41 2aqk h ALA 131 Ca 0.11 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2aqk h ALA 131 Cb 0.68 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2aqk h ALA 131 CO 0.05 0.59 0.04 -0.22 0.00 0.00 0.00 179.25 179.70 2aqk h LYS 132 N 0.38 0.29 -0.58 0.00 3.64 -0.57 1.00 116.57 120.72 2aqk h LYS 132 Ca 0.05 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 2aqk h LYS 132 Cb 0.76 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.52 2aqk h LYS 132 CO 0.06 0.43 0.26 0.00 -2.27 0.00 0.00 179.45 177.93 2aqk h ALA 133 N 0.84 1.36 0.00 5.00 0.00 -1.04 -3.36 119.26 122.06 2aqk h ALA 133 Ca 0.06 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 2aqk h ALA 133 Cb 0.28 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2aqk h ALA 133 CO 0.00 0.49 -1.97 1.28 0.00 0.00 0.00 179.25 179.05 2aqk n LEU 134 N -4.35 0.00 -0.32 0.00 4.77 -0.40 -4.36 117.00 112.35 2aqk n LEU 134 Ca 0.05 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.06 2aqk n LEU 134 Cb 0.14 0.21 0.18 0.00 -2.33 0.00 0.00 43.42 41.62 2aqk n LEU 134 CO 0.38 0.21 1.19 -0.07 -1.33 0.00 0.00 177.39 177.77 2aqk h LEU 135 N 0.00 0.81 -1.88 2.23 3.38 -0.95 -0.10 115.31 118.80 2aqk h LEU 135 Ca -0.23 0.04 0.26 0.00 0.09 0.00 0.00 57.88 58.03 2aqk h LEU 135 Cb 1.43 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 42.01 2aqk h LEU 135 CO 0.01 0.47 0.66 -0.65 0.09 0.00 0.00 178.44 179.02 2aqk h PRO 136 N 0.92 0.09 -0.70 1.13 0.11 -1.78 -1.35 132.00 130.42 2aqk h PRO 136 Ca 0.42 -0.01 -0.46 0.00 0.11 0.00 0.00 66.00 66.06 2aqk h PRO 136 Cb 0.32 -0.02 -0.28 0.00 0.11 0.00 0.00 31.00 31.13 2aqk h PRO 136 CO -0.23 0.06 -0.05 0.44 -0.21 0.00 0.00 178.00 178.02 2aqk n ILE 137 N -4.33 2.87 -5.01 4.15 -5.35 -0.07 -4.97 119.36 106.66 2aqk n ILE 137 Ca 0.20 -3.28 -0.32 0.00 -0.27 0.00 0.00 62.75 59.08 2aqk n ILE 137 Cb 0.94 -0.84 -0.14 0.00 -1.74 0.00 0.00 39.64 37.86 2aqk n ILE 137 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2aqk s MET 138 N -3.53 2.27 0.48 6.28 -1.94 -0.51 0.56 119.30 122.90 2aqk s MET 138 Ca 0.53 -0.84 -0.21 0.00 -1.71 0.00 0.00 55.69 53.46 2aqk s MET 138 Cb 0.44 -2.21 -0.07 0.00 2.01 0.00 0.00 34.83 34.99 2aqk s MET 138 CO 0.01 0.58 1.11 -0.80 -0.01 0.00 0.00 175.02 175.92 2aqk s ASN 139 N -0.81 6.17 0.63 3.03 0.01 0.29 -4.90 114.94 119.36 2aqk s ASN 139 Ca 0.11 2.14 -0.17 0.00 -0.71 0.00 0.00 52.86 54.23 2aqk s ASN 139 Cb -0.10 -2.58 -0.07 0.00 0.41 0.00 0.00 41.25 38.90 2aqk s ASN 139 CO 0.01 -0.90 0.51 -2.65 -1.51 0.00 0.00 177.10 172.56 2aqk n PRO 140 N -0.76 0.44 -0.99 -0.60 -0.02 -1.24 -1.49 135.00 130.34 2aqk n PRO 140 Ca 0.09 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2aqk n PRO 140 Cb 0.50 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 2aqk n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2aqk n GLY 141 N 1.76 1.01 3.63 -1.23 0.00 0.45 -4.98 105.19 105.84 2aqk n GLY 141 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2aqk n GLY 141 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2aqk s GLY 142 N -2.00 1.60 -0.25 -0.02 0.00 -0.56 -4.86 107.32 101.25 2aqk s GLY 142 Ca 0.00 -0.96 -0.07 0.00 0.00 0.00 0.00 44.72 43.69 2aqk s GLY 142 CO 0.00 -0.09 0.52 -0.45 0.00 0.00 0.00 173.10 173.07 2aqk s SER 143 N -3.99 -0.64 -0.15 1.64 0.15 -0.65 -1.31 113.70 108.76 2aqk s SER 143 Ca 0.71 1.16 -0.08 0.00 0.70 0.00 0.00 55.95 58.45 2aqk s SER 143 Cb -0.09 1.76 -0.04 0.00 -1.71 0.00 0.00 66.02 65.93 2aqk s SER 143 CO 0.56 -0.23 0.12 -0.63 1.20 0.00 0.00 173.24 174.26 2aqk s ILE 144 N 2.73 5.35 -0.04 6.45 1.01 0.21 -1.43 121.20 135.48 2aqk s ILE 144 Ca -0.01 0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.81 2aqk s ILE 144 Cb -0.12 -3.36 0.02 0.00 0.01 0.00 0.00 42.46 39.00 2aqk s ILE 144 CO -0.16 0.56 -0.04 -0.69 0.00 0.00 0.00 174.94 174.60 2aqk s VAL 145 N -0.52 0.50 0.39 2.92 1.01 0.69 -1.71 120.40 123.68 2aqk s VAL 145 Ca 0.12 -0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.06 2aqk s VAL 145 Cb -0.12 -0.52 -0.07 0.00 0.00 0.00 0.00 36.38 35.67 2aqk s VAL 145 CO 0.02 0.21 0.02 -0.83 0.00 0.00 0.00 175.10 174.52 2aqk s GLY 146 N 0.80 2.38 -0.19 4.51 0.00 -0.75 0.17 107.32 114.24 2aqk s GLY 146 Ca -0.10 -2.20 -0.04 0.00 0.00 0.00 0.00 44.72 42.37 2aqk s GLY 146 CO 0.00 -2.04 -0.03 1.06 0.00 0.00 0.00 173.10 172.10 2aqk s MET 147 N -3.73 3.54 0.17 2.90 -1.94 -0.79 -0.82 119.30 118.62 2aqk s MET 147 Ca 0.36 -0.56 0.10 0.00 -1.71 0.00 0.00 55.69 53.87 2aqk s MET 147 Cb 0.07 -3.00 -0.04 0.00 2.01 0.00 0.00 34.83 33.86 2aqk s MET 147 CO 0.19 0.00 -0.18 0.34 -0.01 0.00 0.00 175.02 175.36 2aqk s ASP 148 N 1.00 3.83 -0.18 3.03 2.15 0.11 -4.93 116.67 121.67 2aqk s ASP 148 Ca 0.01 -0.68 -0.01 0.00 0.43 0.00 0.00 52.55 52.30 2aqk s ASP 148 Cb -0.15 -0.49 0.05 0.00 -0.30 0.00 0.00 42.92 42.04 2aqk s ASP 148 CO 0.01 0.13 -0.03 0.12 -0.17 0.00 0.00 175.17 175.23 2aqk s PHE 149 N -1.52 1.62 -0.42 -5.34 5.36 -1.26 -1.39 117.98 115.03 2aqk s PHE 149 Ca 0.21 -1.11 -0.40 0.00 -0.96 0.00 0.00 56.93 54.68 2aqk s PHE 149 Cb -0.09 -1.27 -0.15 0.00 -0.34 0.00 0.00 43.02 41.17 2aqk s PHE 149 CO 0.12 -0.63 2.14 -3.47 -1.46 0.00 0.00 175.22 171.92 2aqk n ASP 150 N 4.89 1.50 -1.45 6.13 4.64 -1.26 -4.82 116.55 126.18 2aqk n ASP 150 Ca -0.11 0.57 0.08 0.00 -1.38 0.00 0.00 54.79 53.95 2aqk n ASP 150 Cb 0.47 -1.09 0.34 0.00 -1.04 0.00 0.00 41.12 39.80 2aqk n ASP 150 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2aqk n PRO 151 N 7.73 4.01 0.27 -0.67 -0.04 -1.26 -4.62 135.00 140.41 2aqk n PRO 151 Ca 0.47 -3.01 0.17 0.00 -0.04 0.00 0.00 63.50 61.09 2aqk n PRO 151 Cb 0.10 -2.06 0.67 0.00 -0.04 0.00 0.00 33.50 32.17 2aqk n PRO 151 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2aqk h SER 152 N 3.07 0.00 -4.39 3.54 4.64 -1.94 -3.42 113.55 115.06 2aqk h SER 152 Ca 0.00 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.88 2aqk h SER 152 Cb 1.72 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.58 2aqk h SER 152 CO 0.36 0.00 -0.79 -0.13 -0.87 0.00 0.00 176.83 175.40 2aqk s ARG 153 N -3.64 0.90 0.60 4.77 0.52 -1.26 -5.14 118.95 115.70 2aqk s ARG 153 Ca 0.01 -0.92 -0.15 0.00 -0.52 0.00 0.00 55.73 54.15 2aqk s ARG 153 Cb 0.09 -0.94 -0.04 0.00 0.52 0.00 0.00 34.95 34.58 2aqk s ARG 153 CO 0.54 0.22 1.05 0.00 0.02 0.00 0.00 175.30 177.12 2aqk s ALA 154 N -1.12 2.79 0.09 2.13 0.00 -1.26 -5.07 121.76 119.31 2aqk s ALA 154 Ca 0.00 0.31 -0.09 0.00 0.00 0.00 0.00 51.96 52.19 2aqk s ALA 154 Cb -0.09 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.82 2aqk s ALA 154 CO 0.02 -0.78 0.20 0.00 0.00 0.00 0.00 175.76 175.20 2aqk s MET 155 N -4.22 0.85 0.62 0.00 0.23 -1.26 -5.15 119.30 110.37 2aqk s MET 155 Ca 0.62 -0.93 -0.19 0.00 -1.03 0.00 0.00 55.69 54.16 2aqk s MET 155 Cb -0.15 0.35 -0.02 0.00 -1.53 0.00 0.00 34.83 33.48 2aqk s MET 155 CO 0.39 -0.27 1.30 -2.14 -2.03 0.00 0.00 175.02 172.27 2aqk s PRO 156 N -3.79 2.70 0.00 3.16 0.02 -1.26 -4.14 135.00 131.70 2aqk s PRO 156 Ca 0.04 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.14 2aqk s PRO 156 Cb 0.04 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.63 2aqk s PRO 156 CO -0.11 -1.48 0.00 0.00 -0.33 0.00 0.00 177.00 175.08 2aqk n ALA 157 N -1.71 0.00 0.24 -1.55 0.00 -1.26 -4.54 120.51 111.69 2aqk n ALA 157 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.71 2aqk n ALA 157 Cb 0.48 0.00 0.50 0.00 0.00 0.00 0.00 19.45 20.43 2aqk n ALA 157 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2aqk h TYR 158 N 0.00 0.00 0.00 0.00 -1.99 -1.91 0.51 116.97 113.58 2aqk h TYR 158 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2aqk h TYR 158 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2aqk h TYR 158 CO 0.00 0.14 0.00 0.09 -0.00 0.00 0.00 178.16 178.39 2aqk n ASN 159 N -3.27 0.00 0.19 3.88 4.13 -1.26 -0.13 115.26 118.80 2aqk n ASN 159 Ca 0.01 0.00 0.08 0.00 1.68 0.00 0.00 54.58 56.35 2aqk n ASN 159 Cb 0.40 0.00 0.23 0.00 -1.54 0.00 0.00 39.78 38.87 2aqk n ASN 159 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 2aqk h TRP 160 N 0.00 0.00 -0.97 3.10 4.06 -1.28 -2.59 115.95 118.27 2aqk h TRP 160 Ca 0.00 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 2aqk h TRP 160 Cb 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.11 2aqk h TRP 160 CO 0.00 0.25 0.60 1.98 -3.56 0.00 0.00 178.44 177.71 2aqk h MET 161 N 0.00 1.30 -0.56 0.49 4.05 -0.66 0.23 114.93 119.77 2aqk h MET 161 Ca -0.00 -0.10 0.06 0.00 -0.28 0.00 0.00 59.70 59.37 2aqk h MET 161 Cb 1.04 -0.28 -0.05 0.00 -0.80 0.00 0.00 31.60 31.51 2aqk h MET 161 CO 0.03 0.89 0.27 1.15 0.23 0.00 0.00 176.91 179.49 2aqk h THR 162 N 1.33 0.91 -0.47 -0.77 2.02 -1.06 0.90 112.91 115.78 2aqk h THR 162 Ca 0.35 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.36 2aqk h THR 162 Cb -0.09 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.65 2aqk h THR 162 CO -0.07 0.09 0.30 0.58 0.37 0.00 0.00 175.52 176.80 2aqk h VAL 163 N 0.52 1.13 -0.82 3.16 2.07 -1.28 -0.49 116.25 120.53 2aqk h VAL 163 Ca 0.26 -0.24 0.07 0.00 0.82 0.00 0.00 66.70 67.61 2aqk h VAL 163 Cb 0.20 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.36 2aqk h VAL 163 CO -0.20 0.12 0.49 0.00 0.02 0.00 0.00 177.57 178.01 2aqk h ALA 164 N 1.16 1.14 -0.62 1.67 0.00 -0.04 -1.37 119.26 121.20 2aqk h ALA 164 Ca 0.17 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2aqk h ALA 164 Cb -0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2aqk h ALA 164 CO -0.04 0.19 0.26 0.87 0.00 0.00 0.00 179.25 180.53 2aqk h LYS 165 N 0.87 0.92 -0.86 0.00 1.79 -0.31 -1.11 116.57 117.87 2aqk h LYS 165 Ca 0.37 -0.16 0.06 0.00 -2.18 0.00 0.00 60.65 58.74 2aqk h LYS 165 Cb 0.23 -0.15 -0.06 0.00 -1.58 0.00 0.00 32.23 30.67 2aqk h LYS 165 CO -0.20 0.77 0.53 0.77 -1.08 0.00 0.00 179.45 180.25 2aqk h SER 166 N 0.86 0.84 -0.63 0.86 0.02 -0.78 -0.77 113.55 113.96 2aqk h SER 166 Ca 0.21 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 2aqk h SER 166 Cb 0.19 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 2aqk h SER 166 CO -0.02 0.54 0.28 0.00 -1.14 0.00 0.00 176.83 176.50 2aqk h ALA 167 N 1.40 0.82 -0.50 3.77 0.00 -0.96 -2.68 119.26 121.11 2aqk h ALA 167 Ca 0.37 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.15 2aqk h ALA 167 Cb 0.16 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2aqk h ALA 167 CO -0.17 0.40 0.30 1.25 0.00 0.00 0.00 179.25 181.03 2aqk h LEU 168 N 0.87 0.49 -0.81 0.00 6.46 -0.52 0.35 115.31 122.15 2aqk h LEU 168 Ca 0.21 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 58.00 2aqk h LEU 168 Cb 0.15 -0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 39.94 2aqk h LEU 168 CO -0.02 0.35 0.52 -0.33 -0.62 0.00 0.00 178.44 178.34 2aqk h GLU 169 N 0.60 1.01 -0.10 1.25 5.08 -1.09 0.16 114.58 121.49 2aqk h GLU 169 Ca 0.20 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 2aqk h GLU 169 Cb 0.01 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.03 2aqk h GLU 169 CO -0.09 0.67 -0.01 1.03 -1.00 0.00 0.00 179.01 179.61 2aqk h SER 170 N 1.04 0.18 -0.56 1.42 0.87 -1.00 -2.73 113.55 112.77 2aqk h SER 170 Ca 0.32 -0.33 0.09 0.00 -1.23 0.00 0.00 61.79 60.64 2aqk h SER 170 Cb -0.03 -0.05 -0.07 0.00 -0.44 0.00 0.00 62.40 61.81 2aqk h SER 170 CO -0.10 0.46 0.18 0.58 -0.53 0.00 0.00 176.83 177.42 2aqk h VAL 171 N -0.11 0.76 -0.70 2.23 2.07 -0.03 -1.74 116.25 118.72 2aqk h VAL 171 Ca 0.03 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.46 2aqk h VAL 171 Cb 0.37 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.49 2aqk h VAL 171 CO 0.01 0.06 0.47 -1.13 0.02 0.00 0.00 177.57 176.99 2aqk h ASN 172 N 0.34 0.75 -0.13 0.57 -1.24 -0.60 0.35 115.58 115.63 2aqk h ASN 172 Ca 0.28 -0.01 -0.07 0.00 0.71 0.00 0.00 56.30 57.21 2aqk h ASN 172 Cb 0.35 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 39.20 2aqk h ASN 172 CO -0.30 0.52 -0.12 0.03 -1.29 0.00 0.00 177.43 176.27 2aqk h ARG 173 N 0.88 0.47 -0.03 6.67 3.08 -1.01 -0.45 114.38 123.99 2aqk h ARG 173 Ca 0.28 -0.13 -0.21 0.00 0.07 0.00 0.00 59.98 59.98 2aqk h ARG 173 Cb 0.02 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 2aqk h ARG 173 CO -0.07 0.59 -0.85 0.74 -1.07 0.00 0.00 179.97 179.30 2aqk h PHE 174 N 0.44 0.59 -0.61 3.04 0.04 -0.84 -3.17 116.94 116.42 2aqk h PHE 174 Ca 0.08 -0.30 -0.08 0.00 2.80 0.00 0.00 57.97 60.48 2aqk h PHE 174 Cb 0.48 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 2aqk h PHE 174 CO 0.01 1.09 0.07 0.28 -0.60 0.00 0.00 178.31 179.17 2aqk h VAL 175 N 0.25 1.26 -0.74 -0.55 2.07 -0.02 -2.20 116.25 116.31 2aqk h VAL 175 Ca -0.06 -1.03 0.12 0.00 0.82 0.00 0.00 66.70 66.55 2aqk h VAL 175 Cb 1.47 0.70 -0.09 0.00 -1.52 0.00 0.00 31.29 31.86 2aqk h VAL 175 CO 0.15 0.38 0.33 0.00 0.02 0.00 0.00 177.57 178.45 2aqk h ALA 176 N 1.12 1.04 -0.40 1.67 0.00 -1.09 0.71 119.26 122.32 2aqk h ALA 176 Ca 0.19 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.21 2aqk h ALA 176 Cb 0.45 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2aqk h ALA 176 CO 0.02 -0.14 0.22 0.00 0.00 0.00 0.00 179.25 179.34 2aqk h ARG 177 N 0.51 0.43 -0.31 0.00 3.08 -1.38 0.22 114.38 116.93 2aqk h ARG 177 Ca 0.39 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 60.30 2aqk h ARG 177 Cb 0.53 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2aqk h ARG 177 CO -0.35 0.28 -0.25 0.93 -1.07 0.00 0.00 179.97 179.52 2aqk h GLU 178 N 0.44 0.71 -0.27 0.04 4.39 -0.99 -3.23 114.58 115.67 2aqk h GLU 178 Ca 0.16 -0.35 -0.07 0.00 0.34 0.00 0.00 59.36 59.44 2aqk h GLU 178 Cb 0.04 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2aqk h GLU 178 CO -0.09 0.97 -0.12 0.00 -1.16 0.00 0.00 179.01 178.61 2aqk h ALA 179 N 0.73 1.30 -0.52 3.43 0.00 0.57 -2.77 119.26 122.00 2aqk h ALA 179 Ca 0.06 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.76 2aqk h ALA 179 Cb 0.80 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2aqk h ALA 179 CO 0.06 0.47 0.35 0.78 0.00 0.00 0.00 179.25 180.91 2aqk h GLY 180 N 0.89 0.61 2.00 0.00 0.00 -0.42 0.55 103.07 106.70 2aqk h GLY 180 Ca 0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 2aqk h GLY 180 CO 0.03 0.16 -0.05 0.50 0.00 0.00 0.00 176.54 177.18 2aqk h LYS 181 N 0.51 0.00 -0.34 4.80 1.57 -1.59 -2.03 116.57 119.48 2aqk h LYS 181 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2aqk h LYS 181 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2aqk h LYS 181 CO -0.06 0.05 0.00 0.66 -0.57 0.00 0.00 179.45 179.53 2aqk n TYR 182 N -3.81 0.44 -1.65 -1.35 4.01 0.06 -4.91 117.16 109.95 2aqk n TYR 182 Ca -0.03 -0.22 -0.15 0.00 -0.16 0.00 0.00 57.90 57.35 2aqk n TYR 182 Cb 0.14 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.12 2aqk n TYR 182 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2aqk n GLY 183 N 1.27 1.03 3.59 2.72 0.00 -0.76 -3.69 105.19 109.34 2aqk n GLY 183 Ca 0.17 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 2aqk n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aqk s VAL 184 N -2.59 4.06 0.30 1.61 1.01 -0.48 -0.41 120.40 123.90 2aqk s VAL 184 Ca 0.00 -0.32 -0.12 0.00 0.00 0.00 0.00 61.98 61.54 2aqk s VAL 184 Cb 0.00 -2.73 -0.08 0.00 0.00 0.00 0.00 36.38 33.57 2aqk s VAL 184 CO 0.00 0.55 0.67 -0.13 0.00 0.00 0.00 175.10 176.19 2aqk s ARG 185 N -0.28 3.87 -0.04 2.72 0.52 -0.43 -2.87 118.95 122.45 2aqk s ARG 185 Ca 0.05 0.46 0.01 0.00 -0.52 0.00 0.00 55.73 55.73 2aqk s ARG 185 Cb -0.12 -2.51 0.02 0.00 0.52 0.00 0.00 34.95 32.86 2aqk s ARG 185 CO 0.02 0.18 -0.04 0.45 0.02 0.00 0.00 175.30 175.93 2aqk s SER 186 N -2.51 0.79 0.05 0.23 0.15 -1.26 -0.62 113.70 110.54 2aqk s SER 186 Ca 0.51 -0.11 -0.24 0.00 0.70 0.00 0.00 55.95 56.81 2aqk s SER 186 Cb -0.11 -0.36 0.06 0.00 -1.71 0.00 0.00 66.02 63.91 2aqk s SER 186 CO 0.22 -0.04 0.57 0.20 1.20 0.00 0.00 173.24 175.39 2aqk s ASN 187 N 0.77 -0.51 0.05 5.45 0.01 -0.70 0.89 114.94 120.91 2aqk s ASN 187 Ca -0.10 0.25 0.04 0.00 -0.71 0.00 0.00 52.86 52.34 2aqk s ASN 187 Cb -0.13 0.53 -0.04 0.00 0.41 0.00 0.00 41.25 42.02 2aqk s ASN 187 CO -0.00 -0.75 -0.01 -0.76 -1.51 0.00 0.00 177.10 174.07 2aqk s LEU 188 N -1.98 3.42 -0.33 0.60 1.02 -0.17 -1.80 118.68 119.44 2aqk s LEU 188 Ca -0.05 -0.13 -0.11 0.00 0.02 0.00 0.00 54.13 53.86 2aqk s LEU 188 Cb -0.01 -2.08 -0.01 0.00 0.02 0.00 0.00 46.19 44.11 2aqk s LEU 188 CO -0.02 0.22 0.20 -0.69 0.02 0.00 0.00 176.35 176.09 2aqk s VAL 189 N -1.20 5.00 -0.63 -1.59 1.01 -0.00 -0.98 120.40 122.02 2aqk s VAL 189 Ca 0.22 -0.30 -0.26 0.00 0.00 0.00 0.00 61.98 61.65 2aqk s VAL 189 Cb -0.12 -3.56 0.04 0.00 0.00 0.00 0.00 36.38 32.75 2aqk s VAL 189 CO 0.14 0.03 1.10 0.00 0.00 0.00 0.00 175.10 176.37 2aqk s ALA 190 N 1.68 3.00 0.31 5.51 0.00 0.27 0.04 121.76 132.57 2aqk s ALA 190 Ca 0.05 -1.27 -0.06 0.00 0.00 0.00 0.00 51.96 50.68 2aqk s ALA 190 Cb -0.17 -3.97 -0.06 0.00 0.00 0.00 0.00 23.12 18.92 2aqk s ALA 190 CO 0.09 -2.76 0.60 0.00 0.00 0.00 0.00 175.76 173.69 2aqk s ALA 191 N 4.69 3.56 1.04 0.00 0.00 -0.49 0.25 121.76 130.81 2aqk s ALA 191 Ca 0.33 -0.47 -0.14 0.00 0.00 0.00 0.00 51.96 51.68 2aqk s ALA 191 Cb -0.11 -2.39 0.21 0.00 0.00 0.00 0.00 23.12 20.83 2aqk s ALA 191 CO 0.18 0.20 1.11 0.20 0.00 0.00 0.00 175.76 177.45 2aqk s GLY 192 N -3.12 1.57 0.18 0.00 0.00 -0.75 -4.55 107.32 100.65 2aqk s GLY 192 Ca 0.46 -0.54 -0.32 0.00 0.00 0.00 0.00 44.72 44.32 2aqk s GLY 192 CO 0.30 0.13 1.68 -4.14 0.00 0.00 0.00 173.10 171.06 2aqk s PRO 193 N -5.12 4.16 -0.04 2.90 0.02 -1.26 -4.98 135.00 130.67 2aqk s PRO 193 Ca 0.67 2.51 0.07 0.00 0.02 0.00 0.00 61.00 64.27 2aqk s PRO 193 Cb -0.16 -3.15 -0.01 0.00 0.02 0.00 0.00 34.50 31.19 2aqk s PRO 193 CO 0.57 -0.71 -0.25 0.42 -0.33 0.00 0.00 177.00 176.70 2aqk s ILE 194 N 1.32 2.04 -1.19 2.83 -1.09 -1.26 -4.27 121.20 119.58 2aqk s ILE 194 Ca 0.74 -1.07 -0.21 0.00 -2.23 0.00 0.00 60.65 57.87 2aqk s ILE 194 Cb -0.47 -1.71 -0.05 0.00 -1.58 0.00 0.00 42.46 38.65 2aqk s ILE 194 CO 0.32 0.57 1.89 0.54 -1.23 0.00 0.00 174.94 177.03 2aqk n ARG 195 N 2.78 2.10 -2.36 2.79 5.12 0.27 -4.75 116.66 122.61 2aqk n ARG 195 Ca -0.17 -2.65 -0.26 0.00 -1.93 0.00 0.00 57.85 52.85 2aqk n ARG 195 Cb 0.52 -3.57 0.05 0.00 -1.16 0.00 0.00 32.46 28.29 2aqk n ARG 195 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2aqk s THR 196 N 8.23 3.04 0.13 0.55 -1.32 -1.26 -4.78 115.64 120.22 2aqk s THR 196 Ca 0.62 -0.18 -0.21 0.00 -1.21 0.00 0.00 61.69 60.71 2aqk s THR 196 Cb 0.03 -3.23 -0.02 0.00 -1.51 0.00 0.00 72.50 67.76 2aqk s THR 196 CO 0.11 -0.24 1.68 0.25 -2.21 0.00 0.00 174.62 174.21 2aqk h LEU 197 N -0.30 -0.37 -0.60 9.08 6.46 -1.91 -0.52 115.31 127.16 2aqk h LEU 197 Ca -0.45 0.08 0.12 0.00 -0.12 0.00 0.00 57.88 57.51 2aqk h LEU 197 Cb 1.28 0.19 -0.11 0.00 -0.73 0.00 0.00 40.66 41.29 2aqk h LEU 197 CO 0.60 -0.15 -0.18 0.00 -0.62 0.00 0.00 178.44 178.09 2aqk h ALA 198 N 0.99 0.33 -0.25 1.25 0.00 -1.97 -0.97 119.26 118.65 2aqk h ALA 198 Ca 0.10 0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.26 2aqk h ALA 198 Cb 0.26 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2aqk h ALA 198 CO -0.23 -0.46 0.09 0.52 0.00 0.00 0.00 179.25 179.16 2aqk h MET 199 N -0.03 0.20 -0.66 0.00 2.86 -1.74 -1.52 114.93 114.04 2aqk h MET 199 Ca 0.28 -0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.99 2aqk h MET 199 Cb 0.46 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 32.02 2aqk h MET 199 CO -0.63 0.13 0.33 0.77 1.06 0.00 0.00 176.91 178.57 2aqk h SER 200 N 0.21 0.45 -0.35 1.22 0.02 -0.71 0.00 113.55 114.39 2aqk h SER 200 Ca 0.11 0.05 0.08 0.00 -0.84 0.00 0.00 61.79 61.18 2aqk h SER 200 Cb 0.07 -0.03 -0.08 0.00 0.14 0.00 0.00 62.40 62.51 2aqk h SER 200 CO -0.11 0.28 -0.18 0.00 -1.14 0.00 0.00 176.83 175.68 2aqk h ALA 201 N 1.38 0.08 -0.39 3.77 0.00 -0.90 -0.38 119.26 122.83 2aqk h ALA 201 Ca 0.31 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.32 2aqk h ALA 201 Cb 0.28 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2aqk h ALA 201 CO -0.23 -0.56 0.14 0.82 0.00 0.00 0.00 179.25 179.43 2aqk h ILE 202 N -0.12 1.20 -0.90 0.00 2.04 -0.90 0.41 117.51 119.23 2aqk h ILE 202 Ca 0.18 -0.64 0.09 0.00 1.00 0.00 0.00 64.86 65.49 2aqk h ILE 202 Cb 0.39 0.89 -0.07 0.00 -0.74 0.00 0.00 36.82 37.29 2aqk h ILE 202 CO -0.42 0.23 0.58 0.58 0.00 0.00 0.00 178.15 179.12 2aqk h VAL 203 N 0.49 0.98 -0.22 1.67 2.07 -0.72 -0.92 116.25 119.59 2aqk h VAL 203 Ca 0.13 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2aqk h VAL 203 Cb 0.21 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 2aqk h VAL 203 CO -0.01 0.17 0.00 0.61 0.02 0.00 0.00 177.57 178.36 2aqk n GLY 204 N -1.40 0.23 0.00 2.17 0.00 -0.18 -4.58 105.19 101.44 2aqk n GLY 204 Ca 0.15 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2aqk n GLY 204 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aqk n GLY 205 N 1.02 1.10 0.30 -0.02 0.00 -0.35 -4.98 105.19 102.26 2aqk n GLY 205 Ca 0.13 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.33 2aqk n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqk h ALA 206 N 0.00 1.07 -0.25 4.61 0.00 -1.10 -0.34 119.26 123.25 2aqk h ALA 206 Ca 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2aqk h ALA 206 Cb 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2aqk h ALA 206 CO 0.00 0.03 -0.01 1.28 0.00 0.00 0.00 179.25 180.55 2aqk n LEU 207 N -3.21 3.76 0.00 0.00 4.32 -1.26 -4.98 117.00 115.63 2aqk n LEU 207 Ca -0.01 -3.19 0.00 0.00 -0.02 0.00 0.00 56.01 52.79 2aqk n LEU 207 Cb 0.19 -0.55 0.00 0.00 -1.62 0.00 0.00 43.42 41.44 2aqk n LEU 207 CO 0.25 0.80 0.00 0.61 -1.22 0.00 0.00 177.39 177.83 2aqk n GLY 208 N -0.76 2.70 0.24 -0.72 0.00 -0.14 -1.04 105.19 105.48 2aqk n GLY 208 Ca 0.23 -1.70 -0.14 0.00 0.00 0.00 0.00 46.02 44.42 2aqk n GLY 208 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2aqk h GLU 209 N 0.00 0.82 -0.14 1.61 4.57 -1.94 -1.28 114.58 118.23 2aqk h GLU 209 Ca 0.00 -0.45 -0.15 0.00 -1.18 0.00 0.00 59.36 57.57 2aqk h GLU 209 Cb 0.00 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 2aqk h GLU 209 CO 0.00 1.09 -0.56 1.49 -1.18 0.00 0.00 179.01 179.84 2aqk h GLU 210 N 0.60 0.42 -0.41 1.92 4.57 -1.96 0.33 114.58 120.06 2aqk h GLU 210 Ca 0.05 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 57.94 2aqk h GLU 210 Cb 0.96 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.56 2aqk h GLU 210 CO 0.09 0.87 0.21 0.00 -1.18 0.00 0.00 179.01 179.00 2aqk h ALA 211 N 1.07 0.52 -0.37 2.92 0.00 -1.80 0.20 119.26 121.80 2aqk h ALA 211 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2aqk h ALA 211 Cb 1.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2aqk h ALA 211 CO 0.10 0.06 0.15 0.78 0.00 0.00 0.00 179.25 180.34 2aqk h GLY 212 N 0.52 0.59 0.60 0.00 0.00 -0.87 -0.95 103.07 102.97 2aqk h GLY 212 Ca 0.14 -0.32 0.09 0.00 0.00 0.00 0.00 47.33 47.24 2aqk h GLY 212 CO -0.02 0.30 0.56 0.00 0.00 0.00 0.00 176.54 177.38 2aqk h ALA 213 N 1.00 1.29 -0.15 3.60 0.00 0.10 -2.31 119.26 122.79 2aqk h ALA 213 Ca 0.12 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 2aqk h ALA 213 Cb 0.17 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2aqk h ALA 213 CO -0.01 0.24 -0.51 1.96 0.00 0.00 0.00 179.25 180.93 2aqk h GLN 214 N 0.96 0.41 0.00 0.00 4.20 0.34 -2.14 115.11 118.88 2aqk h GLN 214 Ca 0.42 -0.24 -0.18 0.00 0.06 0.00 0.00 58.65 58.71 2aqk h GLN 214 Cb 0.30 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 2aqk h GLN 214 CO -0.22 0.83 -0.84 0.82 -0.67 0.00 0.00 178.83 178.75 2aqk h ILE 215 N 0.32 1.58 -0.21 2.54 1.08 -1.12 0.26 117.51 121.96 2aqk h ILE 215 Ca 0.01 -2.82 -0.12 0.00 -0.39 0.00 0.00 64.86 61.54 2aqk h ILE 215 Cb 1.01 2.53 -0.00 0.00 -3.07 0.00 0.00 36.82 37.29 2aqk h ILE 215 CO 0.09 0.81 -0.33 -0.61 -0.69 0.00 0.00 178.15 177.41 2aqk h GLN 216 N 0.02 0.60 -0.87 2.37 4.15 -1.21 0.10 115.11 120.27 2aqk h GLN 216 Ca -0.01 -0.36 -0.00 0.00 0.77 0.00 0.00 58.65 59.04 2aqk h GLN 216 Cb 1.48 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 29.16 2aqk h GLN 216 CO 0.11 0.97 0.54 -0.07 -1.93 0.00 0.00 178.83 178.45 2aqk h LEU 217 N 0.29 1.03 -0.33 -2.39 3.38 -1.08 -0.33 115.31 115.87 2aqk h LEU 217 Ca 0.02 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 57.98 2aqk h LEU 217 Cb 0.92 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 2aqk h LEU 217 CO 0.08 0.77 0.09 0.25 0.09 0.00 0.00 178.44 179.72 2aqk h LEU 218 N 1.19 0.08 -0.28 1.67 7.12 -0.29 -0.33 115.31 124.47 2aqk h LEU 218 Ca 0.31 0.04 -0.01 0.00 0.13 0.00 0.00 57.88 58.35 2aqk h LEU 218 Cb -0.08 0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.08 2aqk h LEU 218 CO -0.06 0.08 0.12 -0.33 -0.13 0.00 0.00 178.44 178.12 2aqk h GLU 219 N 0.22 0.41 -0.61 1.25 5.08 -0.13 -1.45 114.58 119.36 2aqk h GLU 219 Ca 0.15 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 2aqk h GLU 219 Cb 0.14 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 2aqk h GLU 219 CO -0.17 0.42 0.09 0.93 -1.00 0.00 0.00 179.01 179.28 2aqk h GLU 220 N 0.31 0.99 -0.23 2.33 5.08 -0.90 -2.62 114.58 119.53 2aqk h GLU 220 Ca 0.09 -0.25 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 2aqk h GLU 220 Cb 0.15 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2aqk h GLU 220 CO -0.01 0.92 -0.18 0.78 -1.00 0.00 0.00 179.01 179.52 2aqk h GLY 221 N 1.03 0.44 0.95 -3.84 0.00 -0.76 -1.74 103.07 99.14 2aqk h GLY 221 Ca 0.19 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 2aqk h GLY 221 CO 0.01 0.29 -0.09 -0.25 0.00 0.00 0.00 176.54 176.50 2aqk h TRP 222 N 0.37 -0.23 -0.43 5.60 2.91 -0.91 0.41 115.95 123.67 2aqk h TRP 222 Ca 0.07 -0.00 -0.10 0.00 1.13 0.00 0.00 58.89 59.98 2aqk h TRP 222 Cb 0.53 0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 29.24 2aqk h TRP 222 CO 0.01 -0.14 -0.15 0.22 -1.03 0.00 0.00 178.44 177.35 2aqk h ASP 223 N -0.23 0.80 -0.35 2.65 -0.00 -1.37 0.13 116.42 118.06 2aqk h ASP 223 Ca -0.01 -0.26 0.02 0.00 -0.00 0.00 0.00 57.03 56.78 2aqk h ASP 223 Cb 0.19 -0.22 -0.03 0.00 -0.00 0.00 0.00 39.33 39.28 2aqk h ASP 223 CO 0.01 0.96 0.19 1.56 -0.00 0.00 0.00 179.24 181.95 2aqk h GLN 224 N 0.72 0.37 0.00 0.28 4.20 -1.02 -3.25 115.11 116.41 2aqk h GLN 224 Ca 0.11 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 2aqk h GLN 224 Cb 0.65 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 2aqk h GLN 224 CO 0.05 0.24 -0.82 0.07 -0.67 0.00 0.00 178.83 177.70 2aqk h ARG 225 N 0.38 0.00 -5.99 1.46 0.11 -0.71 -3.44 114.38 106.18 2aqk h ARG 225 Ca 0.14 0.00 -0.64 0.00 0.10 0.00 0.00 59.98 59.58 2aqk h ARG 225 Cb 0.03 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.10 2aqk h ARG 225 CO -0.08 0.02 1.44 0.00 0.10 0.00 0.00 179.97 181.45 2aqk n ALA 226 N -2.18 1.32 0.33 0.08 0.00 0.43 -4.56 120.51 115.94 2aqk n ALA 226 Ca 0.00 -0.12 0.20 0.00 0.00 0.00 0.00 53.44 53.53 2aqk n ALA 226 Cb 0.56 -2.67 1.08 0.00 0.00 0.00 0.00 19.45 18.42 2aqk n ALA 226 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2aqk h PRO 227 N 13.24 0.00 -0.35 0.00 0.11 -1.75 0.67 132.00 143.92 2aqk h PRO 227 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2aqk h PRO 227 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2aqk h PRO 227 CO 1.00 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 179.23 2aqk n ILE 228 N -3.10 0.88 -0.03 4.15 -5.35 -1.18 -5.09 119.36 109.64 2aqk n ILE 228 Ca -0.02 -0.94 0.00 0.00 -0.27 0.00 0.00 62.75 61.52 2aqk n ILE 228 Cb 0.18 0.59 -0.00 0.00 -1.74 0.00 0.00 39.64 38.67 2aqk n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2aqk n GLY 229 N 0.65 -2.22 2.73 3.28 0.00 0.23 -4.97 105.19 104.90 2aqk n GLY 229 Ca 0.12 -1.47 -0.17 0.00 0.00 0.00 0.00 46.02 44.50 2aqk n GLY 229 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2aqk s TRP 230 N -2.41 0.03 -0.49 1.61 -0.11 -1.26 -4.46 118.94 111.85 2aqk s TRP 230 Ca 0.00 0.20 -0.07 0.00 1.22 0.00 0.00 56.10 57.46 2aqk s TRP 230 Cb 0.00 -0.33 0.13 0.00 -1.50 0.00 0.00 33.47 31.76 2aqk s TRP 230 CO 0.00 -0.14 0.34 1.21 -4.62 0.00 0.00 176.95 173.74 2aqk s ASN 231 N 1.55 5.55 0.38 5.86 2.47 -1.26 -4.61 114.94 124.88 2aqk s ASN 231 Ca -0.03 -2.13 0.25 0.00 0.42 0.00 0.00 52.86 51.37 2aqk s ASN 231 Cb -0.13 -1.94 1.38 0.00 -1.45 0.00 0.00 41.25 39.11 2aqk s ASN 231 CO -0.03 -0.59 1.78 0.00 -3.72 0.00 0.00 177.10 174.53 2aqk h MET 232 N 8.08 0.00 0.00 0.43 -0.00 -1.97 -1.58 114.93 119.88 2aqk h MET 232 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.56 2aqk h MET 232 Cb 1.04 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.64 2aqk h MET 232 CO 0.78 0.00 -0.54 1.63 -0.00 0.00 0.00 176.91 178.78 2aqk n LYS 233 N -2.39 0.02 -3.94 -0.10 5.02 -1.26 0.98 118.16 116.49 2aqk n LYS 233 Ca -0.02 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.94 2aqk n LYS 233 Cb 0.04 -1.51 -0.14 0.00 -0.02 0.00 0.00 35.03 33.40 2aqk n LYS 233 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2aqk s ASP 234 N -3.08 4.86 0.00 4.39 3.68 -0.60 -4.91 116.67 121.01 2aqk s ASP 234 Ca 0.10 -1.65 0.25 0.00 2.13 0.00 0.00 52.55 53.39 2aqk s ASP 234 Cb 0.17 -1.69 1.08 0.00 -1.45 0.00 0.00 42.92 41.03 2aqk s ASP 234 CO 0.71 -0.33 1.80 0.00 0.13 0.00 0.00 175.17 177.48 2aqk n ALA 235 N 4.50 2.15 -0.22 3.66 0.00 -1.26 -4.33 120.51 125.01 2aqk n ALA 235 Ca -0.07 -0.09 -0.00 0.00 0.00 0.00 0.00 53.44 53.28 2aqk n ALA 235 Cb 0.42 -1.40 0.11 0.00 0.00 0.00 0.00 19.45 18.58 2aqk n ALA 235 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2aqk h THR 236 N 0.00 0.85 -0.37 0.00 2.02 -1.94 0.12 112.91 113.59 2aqk h THR 236 Ca 0.00 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.00 2aqk h THR 236 Cb 0.42 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 2aqk h THR 236 CO 0.00 0.10 0.25 -0.65 0.37 0.00 0.00 175.52 175.58 2aqk h PRO 237 N 0.54 0.49 -0.08 6.66 0.11 -1.98 0.13 132.00 137.87 2aqk h PRO 237 Ca 0.31 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.36 2aqk h PRO 237 Cb 0.32 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.32 2aqk h PRO 237 CO -0.25 0.32 -0.07 0.28 -0.21 0.00 0.00 178.00 178.07 2aqk h VAL 238 N 0.50 1.36 -0.91 3.15 2.07 -1.63 -2.51 116.25 118.27 2aqk h VAL 238 Ca 0.14 -1.19 0.01 0.00 0.82 0.00 0.00 66.70 66.47 2aqk h VAL 238 Cb -0.06 1.98 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 2aqk h VAL 238 CO -0.03 0.33 0.59 0.00 0.02 0.00 0.00 177.57 178.49 2aqk h ALA 239 N 0.58 1.15 -0.45 1.67 0.00 -0.07 -1.06 119.26 121.08 2aqk h ALA 239 Ca 0.01 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2aqk h ALA 239 Cb 0.57 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2aqk h ALA 239 CO 0.02 0.57 -0.02 0.87 0.00 0.00 0.00 179.25 180.69 2aqk h LYS 240 N 1.24 0.75 -0.08 0.00 1.57 -0.79 -2.05 116.57 117.21 2aqk h LYS 240 Ca 0.33 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2aqk h LYS 240 Cb -0.13 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 2aqk h LYS 240 CO -0.07 0.77 0.01 1.15 -0.57 0.00 0.00 179.45 180.75 2aqk h THR 241 N 0.70 1.22 -0.75 -0.16 2.02 -0.91 0.35 112.91 115.37 2aqk h THR 241 Ca 0.14 -0.67 0.13 0.00 0.77 0.00 0.00 66.41 66.77 2aqk h THR 241 Cb 0.46 1.51 -0.09 0.00 -1.74 0.00 0.00 68.15 68.29 2aqk h THR 241 CO 0.02 0.19 0.34 0.58 0.37 0.00 0.00 175.52 177.02 2aqk h VAL 242 N -0.10 0.73 -0.69 3.16 2.07 -1.10 -1.33 116.25 118.98 2aqk h VAL 242 Ca 0.03 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.33 2aqk h VAL 242 Cb 0.29 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.19 2aqk h VAL 242 CO 0.00 0.09 0.28 0.00 0.02 0.00 0.00 177.57 177.96 2aqk h ALA 244 N 1.13 0.66 0.00 0.00 0.00 0.77 -0.71 119.26 121.11 2aqk h ALA 244 Ca 0.23 0.22 -0.11 0.00 0.00 0.00 0.00 54.91 55.25 2aqk h ALA 244 Cb 0.21 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2aqk h ALA 244 CO -0.02 -0.41 -0.54 -0.07 0.00 0.00 0.00 179.25 178.21 2aqk h LEU 245 N 0.09 0.00 -0.55 0.00 3.38 -0.91 -2.98 115.31 114.35 2aqk h LEU 245 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2aqk h LEU 245 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2aqk h LEU 245 CO -0.61 0.54 0.00 -0.07 0.09 0.00 0.00 178.44 178.39 2aqk h LEU 246 N 0.00 0.00 0.00 1.67 3.38 0.05 -3.46 115.31 116.95 2aqk h LEU 246 Ca -0.01 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2aqk h LEU 246 Cb 1.03 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.81 2aqk h LEU 246 CO 0.07 0.00 0.06 -1.54 0.09 0.00 0.00 178.44 177.12 2aqk n SER 247 N -2.82 0.20 -1.17 -0.43 3.41 -0.37 -4.79 113.62 107.65 2aqk n SER 247 Ca 0.03 -1.21 0.09 0.00 -0.26 0.00 0.00 58.87 57.52 2aqk n SER 247 Cb 0.40 -0.20 0.27 0.00 -0.26 0.00 0.00 64.21 64.43 2aqk n SER 247 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2aqk n ASP 248 N -3.08 3.40 -0.47 4.04 8.00 -1.26 -4.36 116.55 122.82 2aqk n ASP 248 Ca 0.04 -2.07 0.12 0.00 0.71 0.00 0.00 54.79 53.60 2aqk n ASP 248 Cb 0.14 -0.43 0.25 0.00 -0.02 0.00 0.00 41.12 41.06 2aqk n ASP 248 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2aqk n TRP 249 N 1.21 0.00 -2.95 1.24 7.02 -1.26 -4.08 117.44 118.62 2aqk n TRP 249 Ca 0.21 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.48 2aqk n TRP 249 Cb 0.56 -0.05 -0.02 0.00 -2.42 0.00 0.00 31.31 29.38 2aqk n TRP 249 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2aqk n LEU 250 N -0.03 2.51 0.03 -0.99 4.77 -1.26 -4.96 117.00 117.07 2aqk n LEU 250 Ca 0.13 -5.06 0.12 0.00 -0.03 0.00 0.00 56.01 51.17 2aqk n LEU 250 Cb 0.42 0.14 0.49 0.00 -2.33 0.00 0.00 43.42 42.15 2aqk n LEU 250 CO 0.23 2.20 0.88 -0.81 -1.33 0.00 0.00 177.39 178.56 2aqk n PRO 251 N -0.02 0.07 -0.21 3.23 -0.04 -1.26 -2.97 135.00 133.80 2aqk n PRO 251 Ca 0.26 0.14 0.06 0.00 -0.04 0.00 0.00 63.50 63.93 2aqk n PRO 251 Cb 0.60 -1.60 0.16 0.00 -0.04 0.00 0.00 33.50 32.62 2aqk n PRO 251 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2aqk n ALA 252 N -1.58 2.43 -3.93 0.55 0.00 -1.26 -4.95 120.51 111.77 2aqk n ALA 252 Ca 0.05 -1.76 -0.33 0.00 0.00 0.00 0.00 53.44 51.40 2aqk n ALA 252 Cb 0.31 -0.44 -0.16 0.00 0.00 0.00 0.00 19.45 19.16 2aqk n ALA 252 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2aqk s THR 253 N -1.93 2.35 0.04 0.00 -1.32 -1.16 -5.10 115.64 108.52 2aqk s THR 253 Ca 0.27 -0.85 -0.23 0.00 -1.21 0.00 0.00 61.69 59.67 2aqk s THR 253 Cb 0.20 -2.00 0.05 0.00 -1.51 0.00 0.00 72.50 69.24 2aqk s THR 253 CO 0.08 0.52 0.53 0.28 -2.21 0.00 0.00 174.62 173.82 2aqk s THR 254 N 1.26 0.03 -0.48 5.08 -1.32 -1.26 -4.61 115.64 114.34 2aqk s THR 254 Ca 0.04 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.30 2aqk s THR 254 Cb -0.14 -0.97 0.00 0.00 -1.51 0.00 0.00 72.50 69.89 2aqk s THR 254 CO -0.10 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 172.80 2aqk n GLY 255 N 0.46 0.68 3.70 6.08 0.00 0.26 -4.94 105.19 111.43 2aqk n GLY 255 Ca -0.18 -0.34 -0.27 0.00 0.00 0.00 0.00 46.02 45.22 2aqk n GLY 255 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aqk s ASP 256 N -2.47 4.15 -0.10 1.61 -1.08 -1.22 -4.47 116.67 113.10 2aqk s ASP 256 Ca 0.00 -1.30 0.01 0.00 -0.52 0.00 0.00 52.55 50.74 2aqk s ASP 256 Cb 0.00 -0.25 0.02 0.00 -1.46 0.00 0.00 42.92 41.23 2aqk s ASP 256 CO 0.00 -0.58 -0.11 -0.63 0.52 0.00 0.00 175.17 174.37 2aqk s ILE 257 N -2.70 1.17 -0.16 4.11 1.01 -1.26 -1.00 121.20 122.37 2aqk s ILE 257 Ca 0.33 -0.43 -0.06 0.00 0.00 0.00 0.00 60.65 60.49 2aqk s ILE 257 Cb 0.06 -1.11 -0.04 0.00 0.01 0.00 0.00 42.46 41.38 2aqk s ILE 257 CO 0.18 0.38 0.05 -0.63 0.00 0.00 0.00 174.94 174.91 2aqk s ILE 258 N 1.19 4.68 -0.40 2.92 -1.09 -0.15 -4.93 121.20 123.41 2aqk s ILE 258 Ca -0.04 -0.08 -0.13 0.00 -2.23 0.00 0.00 60.65 58.17 2aqk s ILE 258 Cb -0.14 -3.07 0.03 0.00 -1.58 0.00 0.00 42.46 37.70 2aqk s ILE 258 CO -0.03 0.50 0.26 -0.31 -1.23 0.00 0.00 174.94 174.14 2aqk s TYR 259 N 0.02 3.25 -0.92 3.97 1.51 -1.26 0.95 117.35 124.87 2aqk s TYR 259 Ca 0.05 -0.86 -0.02 0.00 -1.01 0.00 0.00 57.07 55.23 2aqk s TYR 259 Cb -0.12 -2.60 0.25 0.00 -0.11 0.00 0.00 41.96 39.38 2aqk s TYR 259 CO 0.01 -0.66 0.96 0.00 -1.11 0.00 0.00 175.55 174.75 2aqk n ALA 260 N 5.07 4.18 -1.31 3.71 0.00 0.14 -4.68 120.51 127.62 2aqk n ALA 260 Ca -0.11 -4.68 0.00 0.00 0.00 0.00 0.00 53.44 48.65 2aqk n ALA 260 Cb 0.46 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.13 2aqk n ALA 260 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2aqk n ASP 261 N 1.89 0.12 0.00 0.00 5.75 -1.26 -1.81 116.55 121.25 2aqk n ASP 261 Ca 0.24 -1.42 0.00 0.00 -0.01 0.00 0.00 54.79 53.60 2aqk n ASP 261 Cb 0.37 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 2aqk n ASP 261 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2aqk n GLY 262 N -0.05 0.84 1.99 6.12 0.00 -1.26 -2.55 105.19 110.29 2aqk n GLY 262 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2aqk n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aqk n GLY 263 N -2.26 0.50 0.32 -0.02 0.00 -1.26 -2.78 105.19 99.69 2aqk n GLY 263 Ca 0.00 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.12 2aqk n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqk h ALA 264 N 0.00 2.20 0.00 4.61 0.00 -1.74 -1.54 119.26 122.79 2aqk h ALA 264 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2aqk h ALA 264 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2aqk h ALA 264 CO 0.00 -0.27 0.00 -2.39 0.00 0.00 0.00 179.25 176.59 2aqk n HIS 265 N -4.46 0.00 0.74 0.00 1.44 -1.26 -2.78 115.22 108.89 2aqk n HIS 265 Ca 0.04 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.87 2aqk n HIS 265 Cb 0.33 -0.32 0.17 0.00 0.12 0.00 0.00 29.99 30.29 2aqk n HIS 265 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 2aqk n THR 266 N -1.32 0.22 -4.75 0.61 -2.24 -0.58 -4.90 114.28 101.32 2aqk n THR 266 Ca 0.11 -0.59 -0.24 0.00 -2.27 0.00 0.00 64.05 61.06 2aqk n THR 266 Cb 0.22 1.21 -0.15 0.00 -2.10 0.00 0.00 70.33 69.51 2aqk n THR 266 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2aqk s GLN 267 N -1.78 1.32 -0.16 -0.78 -1.52 -1.12 -5.04 119.66 110.58 2aqk s GLN 267 Ca 0.33 -0.63 -0.11 0.00 -1.95 0.00 0.00 55.36 53.01 2aqk s GLN 267 Cb 0.21 -1.29 -0.23 0.00 -0.22 0.00 0.00 33.01 31.48 2aqk s GLN 267 CO 0.31 0.35 0.26 -0.11 -0.25 0.00 0.00 175.29 175.84 2aqk n LEU 268 N 2.56 2.40 0.00 2.90 7.94 -1.26 -4.99 117.00 126.55 2aqk n LEU 268 Ca -0.15 0.26 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 2aqk n LEU 268 Cb 0.54 -1.05 0.00 0.00 0.53 0.00 0.00 43.42 43.44 2aqk n LEU 268 CO 0.24 0.68 0.00 -0.11 -1.11 0.00 0.00 177.39 177.09