#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aqh n GLY 3 N 0.00 0.09 0.35 3.38 0.00 -1.22 -3.75 105.19 104.04 2aqh n GLY 3 Ca 0.00 -1.74 0.10 0.00 0.00 0.00 0.00 46.02 44.38 2aqh n GLY 3 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2aqh h LEU 4 N 0.00 0.50 -3.02 0.99 5.85 -1.87 -2.54 115.31 115.23 2aqh h LEU 4 Ca 0.00 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2aqh h LEU 4 Cb 0.00 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 2aqh h LEU 4 CO 0.00 0.31 -0.35 0.18 -0.34 0.00 0.00 178.44 178.24 2aqh n LEU 5 N -4.48 2.72 -4.69 2.25 4.32 0.11 -4.74 117.00 112.48 2aqh n LEU 5 Ca 0.11 -3.69 -0.42 0.00 -0.02 0.00 0.00 56.01 51.99 2aqh n LEU 5 Cb 0.32 -0.51 -0.03 0.00 -1.62 0.00 0.00 43.42 41.58 2aqh n LEU 5 CO 0.33 1.22 1.31 -0.62 -1.22 0.00 0.00 177.39 178.41 2aqh s ASP 6 N -3.09 6.60 0.00 -1.43 3.68 -0.96 -1.33 116.67 120.14 2aqh s ASP 6 Ca 0.37 2.51 0.00 0.00 2.13 0.00 0.00 52.55 57.56 2aqh s ASP 6 Cb 0.35 -2.57 0.00 0.00 -1.45 0.00 0.00 42.92 39.25 2aqh s ASP 6 CO -0.04 -0.88 0.00 0.61 0.13 0.00 0.00 175.17 174.99 2aqh n GLY 7 N 3.95 1.98 3.75 2.66 0.00 -1.14 -4.94 105.19 111.45 2aqh n GLY 7 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2aqh n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2aqh s LYS 8 N -0.36 4.79 -0.24 1.61 1.02 -0.44 -4.86 119.74 121.25 2aqh s LYS 8 Ca 0.00 1.54 -0.09 0.00 0.02 0.00 0.00 55.97 57.44 2aqh s LYS 8 Cb 0.00 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 2aqh s LYS 8 CO 0.00 0.41 0.13 1.03 -0.92 0.00 0.00 175.35 175.99 2aqh s ARG 9 N -1.00 3.91 -0.04 1.68 0.52 -1.26 -0.30 118.95 122.45 2aqh s ARG 9 Ca 0.43 -0.35 -0.00 0.00 -0.52 0.00 0.00 55.73 55.28 2aqh s ARG 9 Cb -0.27 -3.46 0.03 0.00 0.52 0.00 0.00 34.95 31.77 2aqh s ARG 9 CO 0.33 -0.04 -0.00 0.42 0.02 0.00 0.00 175.30 176.03 2aqh s ILE 10 N 1.28 0.27 -0.12 1.52 1.01 -0.23 0.49 121.20 125.42 2aqh s ILE 10 Ca 0.06 0.08 -0.21 0.00 0.00 0.00 0.00 60.65 60.58 2aqh s ILE 10 Cb -0.14 -0.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.92 2aqh s ILE 10 CO 0.05 0.19 0.60 -0.22 0.00 0.00 0.00 174.94 175.56 2aqh s LEU 11 N 1.29 4.26 -0.25 2.97 1.98 -0.17 -1.54 118.68 127.22 2aqh s LEU 11 Ca -0.06 0.96 0.02 0.00 -2.89 0.00 0.00 54.13 52.17 2aqh s LEU 11 Cb -0.13 -2.89 0.06 0.00 0.66 0.00 0.00 46.19 43.89 2aqh s LEU 11 CO -0.02 -0.11 -0.10 -0.69 -1.89 0.00 0.00 176.35 173.54 2aqh s VAL 12 N 0.99 2.02 0.66 1.68 1.01 0.40 0.17 120.40 127.34 2aqh s VAL 12 Ca 0.31 -1.54 -0.06 0.00 0.00 0.00 0.00 61.98 60.69 2aqh s VAL 12 Cb -0.16 -2.17 0.04 0.00 0.00 0.00 0.00 36.38 34.09 2aqh s VAL 12 CO 0.13 -0.04 0.96 -0.94 0.00 0.00 0.00 175.10 175.21 2aqh s SER 13 N 1.17 5.07 0.00 3.32 1.04 -0.41 -1.72 113.70 122.17 2aqh s SER 13 Ca -0.08 0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.82 2aqh s SER 13 Cb -0.20 -1.24 0.00 0.00 0.10 0.00 0.00 66.02 64.68 2aqh s SER 13 CO -0.05 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 173.37 2aqh n GLY 14 N -2.77 0.76 3.69 7.32 0.00 -1.21 -3.94 105.19 109.03 2aqh n GLY 14 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2aqh n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2aqh s ILE 15 N -2.33 4.36 0.00 -0.61 1.01 -1.26 -4.50 121.20 117.86 2aqh s ILE 15 Ca 0.00 1.68 0.00 0.00 0.00 0.00 0.00 60.65 62.33 2aqh s ILE 15 Cb 0.00 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.39 2aqh s ILE 15 CO 0.00 0.03 0.00 0.00 0.00 0.00 0.00 174.94 174.97 2aqh n ILE 16 N 4.44 0.00 -4.34 2.92 0.13 -1.26 -4.64 119.36 116.61 2aqh n ILE 16 Ca 0.10 0.00 -0.21 0.00 -1.10 0.00 0.00 62.75 61.54 2aqh n ILE 16 Cb 0.47 -0.57 -0.08 0.00 -0.84 0.00 0.00 39.64 38.62 2aqh n ILE 16 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2aqh s THR 17 N -1.76 0.15 -1.10 9.51 -4.23 -1.26 -4.68 115.64 112.26 2aqh s THR 17 Ca 0.00 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.75 2aqh s THR 17 Cb 0.00 -2.45 0.25 0.00 1.34 0.00 0.00 72.50 71.64 2aqh s THR 17 CO 0.00 0.00 1.77 -0.90 -0.54 0.00 0.00 174.62 174.95 2aqh n ASP 18 N -1.43 0.00 -0.92 3.99 5.75 -1.26 -2.27 116.55 120.41 2aqh n ASP 18 Ca 0.04 0.36 0.12 0.00 -0.01 0.00 0.00 54.79 55.30 2aqh n ASP 18 Cb 0.63 -0.45 0.11 0.00 -1.03 0.00 0.00 41.12 40.38 2aqh n ASP 18 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2aqh n SER 19 N -1.45 2.89 -4.61 -1.12 3.41 -1.26 -4.77 113.62 106.71 2aqh n SER 19 Ca 0.07 -1.95 -0.49 0.00 -0.26 0.00 0.00 58.87 56.23 2aqh n SER 19 Cb 0.26 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.19 2aqh n SER 19 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2aqh n SER 20 N 1.23 2.03 -0.33 4.04 7.64 -0.96 -4.72 113.62 122.55 2aqh n SER 20 Ca 0.14 1.12 0.14 0.00 1.01 0.00 0.00 58.87 61.28 2aqh n SER 20 Cb 0.58 -1.27 0.33 0.00 -1.01 0.00 0.00 64.21 62.84 2aqh n SER 20 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2aqh h VAL 21 N 3.24 0.58 0.00 0.44 2.07 -1.90 -0.70 116.25 119.98 2aqh h VAL 21 Ca -0.46 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 2aqh h VAL 21 Cb 1.31 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2aqh h VAL 21 CO 0.79 0.11 -0.10 0.00 0.02 0.00 0.00 177.57 178.38 2aqh h ALA 22 N 1.69 1.12 -0.34 1.67 0.00 -1.86 -0.61 119.26 120.92 2aqh h ALA 22 Ca 0.59 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.35 2aqh h ALA 22 Cb 1.05 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2aqh h ALA 22 CO -0.46 0.13 -0.01 0.35 0.00 0.00 0.00 179.25 179.26 2aqh h PHE 23 N 0.00 0.67 -0.27 0.00 3.04 -1.39 0.84 116.94 119.83 2aqh h PHE 23 Ca -0.00 -0.12 -0.18 0.00 3.98 0.00 0.00 57.97 61.65 2aqh h PHE 23 Cb 0.44 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 38.77 2aqh h PHE 23 CO 0.00 0.73 -0.53 0.45 -2.02 0.00 0.00 178.31 176.94 2aqh h HIS 24 N 0.41 0.99 -0.27 0.41 3.86 -1.33 0.11 115.15 119.33 2aqh h HIS 24 Ca 0.10 -0.35 0.04 0.00 -1.16 0.00 0.00 60.37 59.00 2aqh h HIS 24 Cb 0.47 -0.19 -0.04 0.00 1.06 0.00 0.00 27.41 28.71 2aqh h HIS 24 CO 0.04 1.15 0.02 0.82 0.86 0.00 0.00 177.93 180.82 2aqh h ILE 25 N 0.61 0.83 -0.15 2.45 2.04 -1.04 -0.35 117.51 121.91 2aqh h ILE 25 Ca 0.02 -0.04 0.02 0.00 1.00 0.00 0.00 64.86 65.86 2aqh h ILE 25 Cb 1.12 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2aqh h ILE 25 CO 0.11 0.02 0.02 0.00 0.00 0.00 0.00 178.15 178.31 2aqh h ALA 26 N 1.22 0.14 0.19 1.87 0.00 -0.53 -0.64 119.26 121.51 2aqh h ALA 26 Ca 0.13 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2aqh h ALA 26 Cb 0.16 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2aqh h ALA 26 CO -0.20 -0.42 -0.17 -0.09 0.00 0.00 0.00 179.25 178.37 2aqh h ARG 27 N 0.08 -0.37 -0.70 0.00 2.43 -0.58 -0.55 114.38 114.69 2aqh h ARG 27 Ca 0.07 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2aqh h ARG 27 Cb 0.07 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 2aqh h ARG 27 CO -0.10 -0.24 0.39 0.28 -1.51 0.00 0.00 179.97 178.79 2aqh h VAL 28 N -0.38 1.21 -0.51 0.20 2.07 -0.96 0.00 116.25 117.88 2aqh h VAL 28 Ca -0.00 -0.51 0.02 0.00 0.82 0.00 0.00 66.70 67.03 2aqh h VAL 28 Cb 0.35 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 2aqh h VAL 28 CO -0.03 0.23 0.32 0.00 0.02 0.00 0.00 177.57 178.11 2aqh h ALA 29 N 1.20 0.66 -0.53 1.67 0.00 -0.84 -0.05 119.26 121.36 2aqh h ALA 29 Ca 0.25 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2aqh h ALA 29 Cb 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2aqh h ALA 29 CO -0.04 0.04 0.25 1.96 0.00 0.00 0.00 179.25 181.46 2aqh h GLN 30 N 0.64 0.77 -0.14 0.00 4.20 -0.75 -1.14 115.11 118.70 2aqh h GLN 30 Ca 0.20 -0.12 0.04 0.00 0.06 0.00 0.00 58.65 58.83 2aqh h GLN 30 Cb -0.01 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 2aqh h GLN 30 CO -0.08 0.64 0.11 0.93 -0.67 0.00 0.00 178.83 179.77 2aqh h GLU 31 N 0.72 0.00 -0.59 1.46 5.08 -0.32 -1.37 114.58 119.55 2aqh h GLU 31 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2aqh h GLU 31 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2aqh h GLU 31 CO -0.02 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.03 2aqh n GLN 32 N -4.22 2.57 0.00 2.33 1.13 -0.09 -4.27 117.38 114.82 2aqh n GLN 32 Ca 0.00 -2.13 0.00 0.00 -1.94 0.00 0.00 57.00 52.93 2aqh n GLN 32 Cb 0.23 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 29.05 2aqh n GLN 32 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2aqh n GLY 33 N 1.30 0.47 3.78 1.08 0.00 -0.52 0.04 105.19 111.34 2aqh n GLY 33 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2aqh n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqh s ALA 34 N -2.00 2.91 -0.26 4.61 0.00 -0.51 -2.87 121.76 123.64 2aqh s ALA 34 Ca 0.00 0.74 -0.11 0.00 0.00 0.00 0.00 51.96 52.59 2aqh s ALA 34 Cb 0.00 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.77 2aqh s ALA 34 CO 0.00 -0.45 0.17 -1.14 0.00 0.00 0.00 175.76 174.35 2aqh s GLN 35 N -2.95 4.01 0.04 0.00 -0.44 0.58 -4.38 119.66 116.53 2aqh s GLN 35 Ca 0.65 -0.29 0.01 0.00 -2.50 0.00 0.00 55.36 53.23 2aqh s GLN 35 Cb -0.22 -3.60 -0.04 0.00 -1.64 0.00 0.00 33.01 27.52 2aqh s GLN 35 CO 0.26 -0.05 0.12 -0.51 0.50 0.00 0.00 175.29 175.60 2aqh s LEU 36 N 1.39 3.99 -0.08 3.68 1.43 -1.26 -1.07 118.68 126.76 2aqh s LEU 36 Ca 0.07 0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.34 2aqh s LEU 36 Cb -0.15 -2.54 -0.01 0.00 0.03 0.00 0.00 46.19 43.53 2aqh s LEU 36 CO 0.08 0.21 -0.22 -0.69 0.23 0.00 0.00 176.35 175.95 2aqh s VAL 37 N -1.35 2.24 0.07 -1.59 1.01 -0.59 -3.96 120.40 116.23 2aqh s VAL 37 Ca 0.29 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.33 2aqh s VAL 37 Cb -0.12 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 2aqh s VAL 37 CO 0.21 0.56 -0.01 -0.76 0.00 0.00 0.00 175.10 175.09 2aqh s LEU 38 N 0.09 3.41 0.13 3.92 1.43 0.72 -0.45 118.68 127.93 2aqh s LEU 38 Ca -0.10 -0.16 0.11 0.00 -1.03 0.00 0.00 54.13 52.94 2aqh s LEU 38 Cb -0.16 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.92 2aqh s LEU 38 CO 0.06 0.20 -0.27 0.42 0.23 0.00 0.00 176.35 177.00 2aqh s THR 39 N -1.23 2.29 0.01 5.49 -4.23 -0.70 0.23 115.64 117.50 2aqh s THR 39 Ca 0.23 -1.75 -0.03 0.00 -1.18 0.00 0.00 61.69 58.96 2aqh s THR 39 Cb -0.12 -2.01 -0.01 0.00 1.34 0.00 0.00 72.50 71.70 2aqh s THR 39 CO 0.15 0.09 0.05 -0.83 -0.54 0.00 0.00 174.62 173.55 2aqh s GLY 40 N -2.06 0.14 0.00 3.99 0.00 -0.29 -3.36 107.32 105.73 2aqh s GLY 40 Ca 0.14 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.52 2aqh s GLY 40 CO 0.06 -0.44 0.00 0.33 0.00 0.00 0.00 173.10 173.05 2aqh n PHE 41 N 1.62 0.00 -0.09 1.90 7.35 -1.26 -0.57 117.46 126.42 2aqh n PHE 41 Ca -0.23 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.35 2aqh n PHE 41 Cb 0.55 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 40.28 2aqh n PHE 41 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2aqh n ASP 42 N -0.60 1.98 -4.10 -2.13 4.64 -1.26 -4.55 116.55 110.52 2aqh n ASP 42 Ca 0.00 -0.06 -0.40 0.00 -1.38 0.00 0.00 54.79 52.95 2aqh n ASP 42 Cb 0.00 0.20 -0.03 0.00 -1.04 0.00 0.00 41.12 40.25 2aqh n ASP 42 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 2aqh n ARG 43 N -2.85 3.36 0.05 -0.67 3.00 -1.26 -4.86 116.66 113.43 2aqh n ARG 43 Ca -0.30 -4.51 -0.04 0.00 -0.01 0.00 0.00 57.85 53.00 2aqh n ARG 43 Cb 0.92 -2.47 0.19 0.00 0.00 0.00 0.00 32.46 31.10 2aqh n ARG 43 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2aqh h LEU 44 N 5.92 0.40 0.11 0.55 4.07 -1.93 -0.32 115.31 124.11 2aqh h LEU 44 Ca 0.18 -0.16 -0.01 0.00 0.08 0.00 0.00 57.88 57.98 2aqh h LEU 44 Cb 0.77 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.40 2aqh h LEU 44 CO 1.02 0.73 -0.05 0.03 -1.08 0.00 0.00 178.44 179.09 2aqh h ARG 45 N 0.33 -0.14 -0.30 1.13 3.08 -1.99 0.23 114.38 116.72 2aqh h ARG 45 Ca 0.04 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.17 2aqh h ARG 45 Cb 0.78 0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.78 2aqh h ARG 45 CO 0.06 0.08 -0.25 1.25 -1.07 0.00 0.00 179.97 180.04 2aqh h LEU 46 N -0.34 -0.81 -0.81 3.04 5.85 -1.93 -1.91 115.31 118.40 2aqh h LEU 46 Ca -0.01 0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.81 2aqh h LEU 46 Cb 0.28 0.39 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 2aqh h LEU 46 CO 0.02 -0.28 0.28 0.40 -0.34 0.00 0.00 178.44 178.53 2aqh h ILE 47 N -0.23 1.26 -0.39 4.05 2.04 -0.76 0.65 117.51 124.14 2aqh h ILE 47 Ca 0.15 -0.85 0.01 0.00 1.00 0.00 0.00 64.86 65.17 2aqh h ILE 47 Cb 0.47 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 2aqh h ILE 47 CO -0.43 0.34 0.24 -0.61 0.00 0.00 0.00 178.15 177.70 2aqh h GLN 48 N 1.13 0.48 -0.63 2.37 5.75 -0.32 0.11 115.11 124.00 2aqh h GLN 48 Ca 0.25 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.70 2aqh h GLN 48 Cb 0.25 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 2aqh h GLN 48 CO -0.02 0.32 0.31 -0.09 -2.65 0.00 0.00 178.83 176.70 2aqh h ARG 49 N 0.49 0.91 -0.01 1.69 1.12 -0.48 -0.42 114.38 117.67 2aqh h ARG 49 Ca 0.15 -0.13 0.01 0.00 -1.11 0.00 0.00 59.98 58.89 2aqh h ARG 49 Cb -0.03 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 29.76 2aqh h ARG 49 CO -0.05 0.72 -0.03 0.82 -3.11 0.00 0.00 179.97 178.33 2aqh h ILE 50 N 0.87 0.93 0.00 1.20 1.08 -0.51 -3.03 117.51 118.05 2aqh h ILE 50 Ca 0.22 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.69 2aqh h ILE 50 Cb 0.11 0.93 0.00 0.00 -3.07 0.00 0.00 36.82 34.79 2aqh h ILE 50 CO -0.03 0.00 0.00 0.35 -0.69 0.00 0.00 178.15 177.78 2aqh n THR 51 N -5.13 0.56 -0.18 -0.27 -2.24 0.35 -2.11 114.28 105.26 2aqh n THR 51 Ca -0.06 0.00 0.29 0.00 -2.27 0.00 0.00 64.05 62.01 2aqh n THR 51 Cb 0.06 -0.76 0.73 0.00 -2.10 0.00 0.00 70.33 68.26 2aqh n THR 51 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2aqh h ASP 52 N 0.00 0.00 0.45 3.42 3.45 -0.95 0.23 116.42 123.02 2aqh h ASP 52 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2aqh h ASP 52 Cb 0.50 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.27 2aqh h ASP 52 CO 0.00 0.00 -0.09 0.54 -1.57 0.00 0.00 179.24 178.12 2aqh n ARG 53 N -4.18 0.56 -1.68 3.56 5.12 -0.90 -4.85 116.66 114.28 2aqh n ARG 53 Ca 0.19 -0.14 -0.38 0.00 -1.93 0.00 0.00 57.85 55.59 2aqh n ARG 53 Cb 0.99 -1.50 0.05 0.00 -1.16 0.00 0.00 32.46 30.85 2aqh n ARG 53 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2aqh n LEU 54 N -1.09 4.87 0.03 0.55 4.32 0.07 -4.87 117.00 120.86 2aqh n LEU 54 Ca 0.14 0.87 0.21 0.00 -0.02 0.00 0.00 56.01 57.21 2aqh n LEU 54 Cb 0.27 -1.49 0.73 0.00 -1.62 0.00 0.00 43.42 41.31 2aqh n LEU 54 CO 0.24 -1.23 1.19 -0.65 -1.22 0.00 0.00 177.39 175.72 2aqh h PRO 55 N 0.81 0.00 -4.56 3.23 0.11 -1.88 -3.42 132.00 126.28 2aqh h PRO 55 Ca -0.50 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.39 2aqh h PRO 55 Cb 1.34 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.28 2aqh h PRO 55 CO 0.53 0.00 -0.71 0.00 -0.21 0.00 0.00 178.00 177.62 2aqh s ALA 56 N -4.82 0.78 0.47 -0.75 0.00 -1.26 -5.11 121.76 111.06 2aqh s ALA 56 Ca -0.05 -1.12 -0.23 0.00 0.00 0.00 0.00 51.96 50.56 2aqh s ALA 56 Cb 0.18 0.13 -0.07 0.00 0.00 0.00 0.00 23.12 23.36 2aqh s ALA 56 CO 0.65 -0.17 1.18 0.15 0.00 0.00 0.00 175.76 177.57 2aqh s LYS 57 N -3.04 3.71 -0.15 0.00 3.01 -1.26 -4.98 119.74 117.03 2aqh s LYS 57 Ca 0.03 1.82 -0.10 0.00 -1.01 0.00 0.00 55.97 56.72 2aqh s LYS 57 Cb 0.00 -2.40 0.05 0.00 -1.01 0.00 0.00 37.83 34.47 2aqh s LYS 57 CO -0.03 -0.60 0.38 0.00 0.51 0.00 0.00 175.35 175.60 2aqh s ALA 58 N -1.52 -0.96 0.46 5.17 0.00 -1.26 -4.79 121.76 118.87 2aqh s ALA 58 Ca 0.64 1.35 -0.25 0.00 0.00 0.00 0.00 51.96 53.70 2aqh s ALA 58 Cb -0.30 -0.81 -0.08 0.00 0.00 0.00 0.00 23.12 21.93 2aqh s ALA 58 CO 0.36 -0.24 1.40 -0.35 0.00 0.00 0.00 175.76 176.93 2aqh n PRO 59 N 3.90 2.12 -4.72 0.00 -0.04 -1.25 -4.74 135.00 130.27 2aqh n PRO 59 Ca -0.21 0.76 -0.33 0.00 -0.04 0.00 0.00 63.50 63.68 2aqh n PRO 59 Cb 0.55 -2.59 -0.16 0.00 -0.04 0.00 0.00 33.50 31.27 2aqh n PRO 59 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2aqh s LEU 60 N -2.63 2.39 -0.02 1.53 2.96 -1.26 -0.20 118.68 121.45 2aqh s LEU 60 Ca 0.63 -0.48 0.07 0.00 -0.22 0.00 0.00 54.13 54.13 2aqh s LEU 60 Cb -0.45 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 44.69 2aqh s LEU 60 CO 0.56 0.11 -0.24 -0.76 -1.32 0.00 0.00 176.35 174.70 2aqh s LEU 61 N 0.65 2.17 0.16 -0.68 1.43 0.14 -4.96 118.68 117.58 2aqh s LEU 61 Ca -0.09 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.27 2aqh s LEU 61 Cb -0.16 -1.37 -0.07 0.00 0.03 0.00 0.00 46.19 44.61 2aqh s LEU 61 CO 0.02 0.32 1.18 -0.70 0.23 0.00 0.00 176.35 177.40 2aqh s GLU 62 N -0.69 4.50 -0.25 1.70 2.12 -1.26 -1.14 118.70 123.68 2aqh s GLU 62 Ca 0.10 1.82 -0.02 0.00 0.36 0.00 0.00 54.97 57.24 2aqh s GLU 62 Cb -0.10 -3.27 0.12 0.00 0.26 0.00 0.00 34.13 31.14 2aqh s GLU 62 CO -0.00 -0.09 0.28 -1.17 -0.54 0.00 0.00 175.26 173.73 2aqh s LEU 63 N 0.02 -0.24 -0.38 2.70 2.96 0.27 -4.83 118.68 119.18 2aqh s LEU 63 Ca 0.53 -0.43 -0.16 0.00 -0.22 0.00 0.00 54.13 53.86 2aqh s LEU 63 Cb -0.31 0.54 0.00 0.00 0.50 0.00 0.00 46.19 46.92 2aqh s LEU 63 CO 0.35 -0.35 0.39 -0.62 -1.32 0.00 0.00 176.35 174.79 2aqh s ASP 64 N 2.37 6.18 0.37 3.68 -1.08 -1.26 -4.05 116.67 122.88 2aqh s ASP 64 Ca 0.09 -0.47 0.27 0.00 -0.52 0.00 0.00 52.55 51.93 2aqh s ASP 64 Cb -0.15 -2.20 1.20 0.00 -1.46 0.00 0.00 42.92 40.31 2aqh s ASP 64 CO -0.23 -0.44 1.82 1.62 0.52 0.00 0.00 175.17 178.45 2aqh h VAL 65 N 5.62 0.00 -0.01 1.11 3.04 -1.97 0.89 116.25 124.93 2aqh h VAL 65 Ca -0.28 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.15 2aqh h VAL 65 Cb 1.13 1.04 0.00 0.00 -2.01 0.00 0.00 31.29 31.45 2aqh h VAL 65 CO 0.74 0.00 -0.06 0.00 -1.01 0.00 0.00 177.57 177.23 2aqh n GLN 66 N -2.51 1.43 -3.53 4.17 6.02 -1.26 -4.78 117.38 116.92 2aqh n GLN 66 Ca 0.01 -0.81 -0.42 0.00 -0.01 0.00 0.00 57.00 55.77 2aqh n GLN 66 Cb 0.21 -1.48 -0.10 0.00 1.02 0.00 0.00 30.24 29.89 2aqh n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2aqh s ASN 67 N -2.13 5.89 0.38 1.08 3.84 0.31 -4.95 114.94 119.35 2aqh s ASN 67 Ca 0.35 -1.11 0.05 0.00 0.21 0.00 0.00 52.86 52.36 2aqh s ASN 67 Cb 0.21 -2.08 0.74 0.00 -0.55 0.00 0.00 41.25 39.56 2aqh s ASN 67 CO 0.38 -0.47 2.00 -0.33 -2.79 0.00 0.00 177.10 175.89 2aqh h GLU 68 N 8.54 0.62 -0.44 0.43 3.07 -1.86 -1.98 114.58 122.95 2aqh h GLU 68 Ca -0.26 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.36 58.42 2aqh h GLU 68 Cb 1.11 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.87 2aqh h GLU 68 CO 0.73 0.46 -0.23 1.49 -1.40 0.00 0.00 179.01 180.06 2aqh h GLU 69 N 0.63 0.89 -0.68 2.33 4.22 -1.93 0.99 114.58 121.01 2aqh h GLU 69 Ca 0.16 -0.37 0.00 0.00 0.08 0.00 0.00 59.36 59.23 2aqh h GLU 69 Cb 0.02 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2aqh h GLU 69 CO -0.03 1.02 0.43 0.45 -2.18 0.00 0.00 179.01 178.71 2aqh h HIS 70 N 0.77 0.88 -0.24 0.92 3.86 -1.67 0.88 115.15 120.56 2aqh h HIS 70 Ca 0.10 0.01 -0.17 0.00 -1.16 0.00 0.00 60.37 59.15 2aqh h HIS 70 Cb 0.77 -0.29 -0.00 0.00 1.06 0.00 0.00 27.41 28.95 2aqh h HIS 70 CO 0.05 0.58 -0.54 -0.07 0.86 0.00 0.00 177.93 178.80 2aqh h LEU 71 N 0.93 0.78 -0.85 2.43 3.38 -1.18 -1.24 115.31 119.56 2aqh h LEU 71 Ca 0.25 -0.41 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 2aqh h LEU 71 Cb -0.07 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2aqh h LEU 71 CO -0.05 1.16 -0.13 0.00 0.09 0.00 0.00 178.44 179.51 2aqh h ALA 72 N 0.85 1.03 0.00 1.53 0.00 -0.46 -2.50 119.26 119.71 2aqh h ALA 72 Ca 0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2aqh h ALA 72 Cb 1.11 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2aqh h ALA 72 CO 0.11 0.58 -0.38 -1.13 0.00 0.00 0.00 179.25 178.43 2aqh n SER 73 N -4.16 0.44 0.07 0.00 3.41 0.27 -4.57 113.62 109.08 2aqh n SER 73 Ca 0.01 0.04 -0.11 0.00 -0.26 0.00 0.00 58.87 58.55 2aqh n SER 73 Cb 0.37 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.27 2aqh n SER 73 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2aqh h LEU 74 N 0.00 -0.44 -1.13 1.04 6.46 -0.74 -2.15 115.31 118.35 2aqh h LEU 74 Ca 0.00 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.82 2aqh h LEU 74 Cb 0.56 0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 40.63 2aqh h LEU 74 CO 0.00 -0.22 0.53 0.00 -0.62 0.00 0.00 178.44 178.13 2aqh h ALA 75 N 0.63 1.35 -0.40 1.25 0.00 -1.76 0.34 119.26 120.68 2aqh h ALA 75 Ca 0.04 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2aqh h ALA 75 Cb 0.32 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2aqh h ALA 75 CO -0.12 0.57 0.03 0.78 0.00 0.00 0.00 179.25 180.51 2aqh h GLY 76 N 1.15 0.74 0.97 0.00 0.00 -1.76 0.26 103.07 104.43 2aqh h GLY 76 Ca 0.30 -0.52 0.02 0.00 0.00 0.00 0.00 47.33 47.13 2aqh h GLY 76 CO -0.06 0.48 0.65 3.21 0.00 0.00 0.00 176.54 180.83 2aqh h ARG 77 N 0.52 1.28 -0.45 4.80 3.08 -1.07 0.23 114.38 122.76 2aqh h ARG 77 Ca 0.12 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 59.97 2aqh h ARG 77 Cb 0.43 -0.29 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2aqh h ARG 77 CO 0.02 0.84 -0.18 0.28 -1.07 0.00 0.00 179.97 179.85 2aqh h VAL 78 N 1.31 1.27 -0.57 2.04 2.07 -0.66 -1.37 116.25 120.34 2aqh h VAL 78 Ca 0.37 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 2aqh h VAL 78 Cb -0.11 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 2aqh h VAL 78 CO -0.09 0.46 0.32 0.74 0.02 0.00 0.00 177.57 179.02 2aqh h THR 79 N 0.76 1.18 -0.53 2.57 2.02 -0.37 -0.38 112.91 118.15 2aqh h THR 79 Ca 0.10 -0.45 0.10 0.00 0.77 0.00 0.00 66.41 66.93 2aqh h THR 79 Cb 0.75 0.44 -0.08 0.00 -1.74 0.00 0.00 68.15 67.52 2aqh h THR 79 CO 0.06 0.19 0.09 -0.33 0.37 0.00 0.00 175.52 175.91 2aqh h GLU 80 N 0.77 0.22 -0.34 6.66 5.08 -0.37 0.37 114.58 126.96 2aqh h GLU 80 Ca 0.20 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 2aqh h GLU 80 Cb 0.03 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2aqh h GLU 80 CO -0.03 0.15 -0.17 0.00 -1.00 0.00 0.00 179.01 177.95 2aqh h ALA 81 N 1.43 1.06 0.00 3.43 0.00 -0.53 -3.22 119.26 121.43 2aqh h ALA 81 Ca 0.27 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2aqh h ALA 81 Cb 0.39 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2aqh h ALA 81 CO -0.37 0.57 -0.89 0.44 0.00 0.00 0.00 179.25 179.01 2aqh n ILE 82 N -4.15 0.00 0.00 0.00 -5.35 -0.22 -4.98 119.36 104.66 2aqh n ILE 82 Ca 0.01 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 2aqh n ILE 82 Cb 0.38 0.97 0.00 0.00 -1.74 0.00 0.00 39.64 39.25 2aqh n ILE 82 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2aqh n GLY 83 N 1.43 1.81 3.61 3.28 0.00 0.13 -4.74 105.19 110.71 2aqh n GLY 83 Ca 0.03 -1.47 -0.40 0.00 0.00 0.00 0.00 46.02 44.18 2aqh n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqh n ALA 84 N 2.41 0.22 -0.66 4.61 0.00 -1.24 -1.50 120.51 124.36 2aqh n ALA 84 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2aqh n ALA 84 Cb 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.36 2aqh n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aqh n GLY 85 N 1.20 1.67 3.70 0.00 0.00 -1.26 -5.01 105.19 105.50 2aqh n GLY 85 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2aqh n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2aqh s ASN 86 N -3.33 5.29 0.28 1.61 0.02 -0.56 -5.12 114.94 113.12 2aqh s ASN 86 Ca 0.00 0.09 0.11 0.00 -1.02 0.00 0.00 52.86 52.04 2aqh s ASN 86 Cb 0.00 -1.46 -0.05 0.00 0.02 0.00 0.00 41.25 39.76 2aqh s ASN 86 CO 0.00 0.32 -0.17 -0.54 0.02 0.00 0.00 177.10 176.73 2aqh s LYS 87 N -1.32 1.64 0.36 -0.60 1.02 -1.26 -4.85 119.74 114.73 2aqh s LYS 87 Ca 0.18 -1.76 -0.27 0.00 0.02 0.00 0.00 55.97 54.13 2aqh s LYS 87 Cb -0.12 -1.64 -0.09 0.00 -0.52 0.00 0.00 37.83 35.47 2aqh s LYS 87 CO 0.08 0.27 1.20 -0.51 -0.92 0.00 0.00 175.35 175.47 2aqh s LEU 88 N -3.49 4.32 -0.03 3.17 1.43 0.46 -4.68 118.68 119.86 2aqh s LEU 88 Ca 0.29 2.45 0.20 0.00 -1.03 0.00 0.00 54.13 56.04 2aqh s LEU 88 Cb -0.03 -3.84 -0.31 0.00 0.03 0.00 0.00 46.19 42.03 2aqh s LEU 88 CO 0.14 -0.56 0.44 0.47 0.23 0.00 0.00 176.35 177.07 2aqh n ASP 89 N 0.47 0.40 -3.78 2.29 8.00 0.18 -0.01 116.55 124.10 2aqh n ASP 89 Ca 0.02 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.39 2aqh n ASP 89 Cb 0.45 1.92 -0.09 0.00 -0.02 0.00 0.00 41.12 43.38 2aqh n ASP 89 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2aqh s GLY 90 N -4.32 -0.11 -0.03 0.44 0.00 -0.69 -1.00 107.32 101.62 2aqh s GLY 90 Ca -0.07 0.20 0.01 0.00 0.00 0.00 0.00 44.72 44.85 2aqh s GLY 90 CO 0.84 0.01 -0.02 0.14 0.00 0.00 0.00 173.10 174.07 2aqh s VAL 91 N -1.45 0.27 -0.23 1.40 1.01 0.15 -1.00 120.40 120.56 2aqh s VAL 91 Ca -0.13 -0.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.84 2aqh s VAL 91 Cb -0.05 -0.32 0.03 0.00 0.00 0.00 0.00 36.38 36.03 2aqh s VAL 91 CO 0.03 0.15 -0.11 -0.69 0.00 0.00 0.00 175.10 174.48 2aqh s VAL 92 N 0.77 2.54 -0.42 2.92 1.01 0.13 -0.25 120.40 127.10 2aqh s VAL 92 Ca -0.08 -1.05 -0.18 0.00 0.00 0.00 0.00 61.98 60.67 2aqh s VAL 92 Cb -0.11 -2.25 0.02 0.00 0.00 0.00 0.00 36.38 34.04 2aqh s VAL 92 CO -0.01 0.29 0.49 -2.28 0.00 0.00 0.00 175.10 173.60 2aqh s HIS 93 N 1.29 3.14 -0.46 5.22 2.46 0.10 -1.29 115.29 125.76 2aqh s HIS 93 Ca 0.01 -0.28 0.09 0.00 0.47 0.00 0.00 55.06 55.35 2aqh s HIS 93 Cb -0.16 -3.02 0.37 0.00 -0.13 0.00 0.00 32.58 29.64 2aqh s HIS 93 CO -0.07 -0.75 0.89 0.45 -2.47 0.00 0.00 174.74 172.80 2aqh n SER 94 N 5.79 2.87 -4.17 9.88 2.88 -1.25 -1.78 113.62 127.83 2aqh n SER 94 Ca -0.06 -3.34 -0.25 0.00 -1.33 0.00 0.00 58.87 53.90 2aqh n SER 94 Cb 0.48 -0.56 -0.15 0.00 -0.75 0.00 0.00 64.21 63.22 2aqh n SER 94 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2aqh s ILE 95 N -3.74 1.39 -0.10 2.46 -4.36 -1.26 -4.15 121.20 111.44 2aqh s ILE 95 Ca 0.43 -0.76 -0.30 0.00 -0.26 0.00 0.00 60.65 59.76 2aqh s ILE 95 Cb 0.34 -1.15 0.09 0.00 1.25 0.00 0.00 42.46 42.99 2aqh s ILE 95 CO -0.10 0.39 0.81 -0.83 0.24 0.00 0.00 174.94 175.44 2aqh s GLY 96 N -0.43 -0.45 -0.26 6.27 0.00 -1.26 -4.52 107.32 106.67 2aqh s GLY 96 Ca 0.07 1.63 -0.26 0.00 0.00 0.00 0.00 44.72 46.16 2aqh s GLY 96 CO -0.01 1.02 1.00 -0.12 0.00 0.00 0.00 173.10 174.99 2aqh s PHE 97 N -1.10 -0.48 -0.09 1.90 5.36 -1.26 -4.93 117.98 117.37 2aqh s PHE 97 Ca -0.07 1.13 -0.04 0.00 -0.96 0.00 0.00 56.93 56.99 2aqh s PHE 97 Cb -0.00 0.37 0.04 0.00 -0.34 0.00 0.00 43.02 43.09 2aqh s PHE 97 CO 0.06 -0.27 0.19 1.41 -1.46 0.00 0.00 175.22 175.16 2aqh s MET 98 N -0.01 0.13 0.73 10.12 -2.45 -1.26 -4.29 119.30 122.27 2aqh s MET 98 Ca 0.02 0.48 -0.16 0.00 -1.25 0.00 0.00 55.69 54.78 2aqh s MET 98 Cb -0.04 -0.16 -0.01 0.00 1.25 0.00 0.00 34.83 35.86 2aqh s MET 98 CO -0.04 -0.19 0.74 -2.30 1.05 0.00 0.00 175.02 174.28 2aqh n PRO 99 N 4.44 0.36 -0.18 4.11 -0.02 -1.26 -4.83 135.00 137.61 2aqh n PRO 99 Ca -0.22 0.17 0.11 0.00 -2.02 0.00 0.00 63.50 61.54 2aqh n PRO 99 Cb 0.52 -2.02 0.42 0.00 -0.02 0.00 0.00 33.50 32.39 2aqh n PRO 99 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2aqh h GLN 100 N -0.38 0.59 0.00 -0.52 4.20 -1.98 0.13 115.11 117.14 2aqh h GLN 100 Ca -0.46 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.21 2aqh h GLN 100 Cb 1.34 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.99 2aqh h GLN 100 CO 0.44 0.39 -0.01 1.79 -0.67 0.00 0.00 178.83 180.77 2aqh h THR 101 N 0.61 0.58 -0.13 -0.54 1.35 -1.96 -0.95 112.91 111.86 2aqh h THR 101 Ca 0.35 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 66.16 2aqh h THR 101 Cb 0.55 1.03 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 2aqh h THR 101 CO -0.13 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 175.76 2aqh n GLY 102 N -1.28 -0.09 3.26 5.82 0.00 0.43 -4.08 105.19 109.25 2aqh n GLY 102 Ca -0.03 -0.31 -0.16 0.00 0.00 0.00 0.00 46.02 45.52 2aqh n GLY 102 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2aqh s MET 103 N -1.83 1.55 5.22 1.61 1.00 -0.36 -1.08 119.30 125.40 2aqh s MET 103 Ca 0.28 -1.85 0.00 0.00 0.00 0.00 0.00 55.69 54.12 2aqh s MET 103 Cb 0.15 0.31 0.00 0.00 0.00 0.00 0.00 34.83 35.29 2aqh s MET 103 CO 0.23 -0.55 0.00 0.41 0.00 0.00 0.00 175.02 175.10 2aqh n GLY 104 N -0.48 2.19 0.22 -0.03 0.00 0.28 -2.88 105.19 104.48 2aqh n GLY 104 Ca 0.05 -0.49 0.09 0.00 0.00 0.00 0.00 46.02 45.68 2aqh n GLY 104 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2aqh h ILE 105 N 0.00 0.61 -1.86 -0.61 1.08 -1.31 -3.40 117.51 112.01 2aqh h ILE 105 Ca 0.00 -1.14 -0.65 0.00 -0.39 0.00 0.00 64.86 62.68 2aqh h ILE 105 Cb 0.00 1.76 0.02 0.00 -3.07 0.00 0.00 36.82 35.53 2aqh h ILE 105 CO 0.00 0.24 1.07 -3.20 -0.69 0.00 0.00 178.15 175.56 2aqh n ASN 106 N -3.43 3.13 -4.56 1.72 2.85 -1.14 -4.82 115.26 109.01 2aqh n ASN 106 Ca -0.00 0.97 -0.50 0.00 -0.11 0.00 0.00 54.58 54.94 2aqh n ASN 106 Cb 0.43 -1.31 -0.04 0.00 1.24 0.00 0.00 39.78 40.10 2aqh n ASN 106 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2aqh n PRO 107 N 6.41 0.95 -0.28 1.20 -0.02 -1.26 -4.68 135.00 137.33 2aqh n PRO 107 Ca 0.24 0.34 0.09 0.00 -2.02 0.00 0.00 63.50 62.15 2aqh n PRO 107 Cb 0.25 -1.80 0.23 0.00 -0.02 0.00 0.00 33.50 32.16 2aqh n PRO 107 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2aqh h PHE 108 N 3.17 0.34 0.00 6.00 3.57 -1.89 0.54 116.94 128.68 2aqh h PHE 108 Ca -0.43 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.12 2aqh h PHE 108 Cb 1.36 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.08 2aqh h PHE 108 CO 0.54 -0.12 0.00 0.74 -2.23 0.00 0.00 178.31 177.23 2aqh h PHE 109 N 0.27 0.00 -0.01 0.41 0.04 -1.96 -3.07 116.94 112.62 2aqh h PHE 109 Ca 0.48 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.25 2aqh h PHE 109 Cb 0.89 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.04 2aqh h PHE 109 CO -0.25 0.00 -0.06 -0.25 -0.60 0.00 0.00 178.31 177.15 2aqh n ASP 110 N -2.77 1.42 -4.64 2.17 9.92 0.18 -4.84 116.55 117.98 2aqh n ASP 110 Ca 0.01 -1.36 -0.43 0.00 -0.53 0.00 0.00 54.79 52.48 2aqh n ASP 110 Cb 0.24 0.03 -0.02 0.00 -0.64 0.00 0.00 41.12 40.73 2aqh n ASP 110 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2aqh s ALA 111 N -2.12 3.48 0.42 2.24 0.00 -1.16 -4.98 121.76 119.64 2aqh s ALA 111 Ca 0.34 0.33 -0.25 0.00 0.00 0.00 0.00 51.96 52.39 2aqh s ALA 111 Cb 0.21 -3.72 -0.08 0.00 0.00 0.00 0.00 23.12 19.52 2aqh s ALA 111 CO 0.38 -1.55 1.20 -2.14 0.00 0.00 0.00 175.76 173.66 2aqh s PRO 112 N 3.97 3.95 0.42 0.00 0.02 -1.26 -4.82 135.00 137.28 2aqh s PRO 112 Ca 0.58 1.91 0.15 0.00 0.02 0.00 0.00 61.00 63.66 2aqh s PRO 112 Cb -0.20 -2.63 1.03 0.00 0.02 0.00 0.00 34.50 32.71 2aqh s PRO 112 CO 0.21 -0.42 1.92 -0.92 -0.33 0.00 0.00 177.00 177.45 2aqh h TYR 113 N 2.51 0.51 -0.93 6.54 3.20 -1.97 0.05 116.97 126.87 2aqh h TYR 113 Ca -0.49 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.45 2aqh h TYR 113 Cb 1.24 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 39.29 2aqh h TYR 113 CO 0.54 0.20 0.61 0.00 -1.64 0.00 0.00 178.16 177.87 2aqh h ALA 114 N 1.64 1.44 -0.01 1.82 0.00 -1.99 0.32 119.26 122.49 2aqh h ALA 114 Ca 0.37 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 2aqh h ALA 114 Cb 0.82 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2aqh h ALA 114 CO -0.12 0.44 -0.01 -0.44 0.00 0.00 0.00 179.25 179.12 2aqh h ASP 115 N 1.12 0.02 -0.50 0.00 3.32 -1.36 -2.46 116.42 116.57 2aqh h ASP 115 Ca 0.39 -0.47 0.09 0.00 0.02 0.00 0.00 57.03 57.06 2aqh h ASP 115 Cb 0.11 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.57 2aqh h ASP 115 CO -0.13 0.49 0.07 0.58 -1.72 0.00 0.00 179.24 178.52 2aqh h VAL 116 N -0.44 0.68 -0.74 -1.35 2.07 -0.93 -0.87 116.25 114.66 2aqh h VAL 116 Ca 0.00 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2aqh h VAL 116 Cb 0.48 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 2aqh h VAL 116 CO 0.00 0.04 0.44 -1.28 0.02 0.00 0.00 177.57 176.78 2aqh h SER 117 N 0.19 0.90 -0.43 0.57 0.87 -0.41 0.45 113.55 115.69 2aqh h SER 117 Ca 0.25 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.73 2aqh h SER 117 Cb 0.36 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 2aqh h SER 117 CO -0.36 0.71 0.22 0.50 -0.53 0.00 0.00 176.83 177.37 2aqh h LYS 118 N 1.02 0.61 -0.59 2.24 3.64 -1.03 0.31 116.57 122.76 2aqh h LYS 118 Ca 0.26 -0.08 0.05 0.00 -1.27 0.00 0.00 60.65 59.61 2aqh h LYS 118 Cb -0.02 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.64 2aqh h LYS 118 CO -0.05 0.50 0.33 0.78 -2.27 0.00 0.00 179.45 178.74 2aqh h GLY 119 N 0.56 0.85 1.62 5.01 0.00 0.21 -1.46 103.07 109.86 2aqh h GLY 119 Ca 0.15 -0.23 -0.16 0.00 0.00 0.00 0.00 47.33 47.09 2aqh h GLY 119 CO -0.02 0.16 -0.60 -2.22 0.00 0.00 0.00 176.54 173.85 2aqh h ILE 120 N 0.63 1.36 0.19 2.60 2.04 0.17 -0.07 117.51 124.41 2aqh h ILE 120 Ca 0.26 -1.93 0.01 0.00 1.00 0.00 0.00 64.86 64.20 2aqh h ILE 120 Cb 0.13 1.93 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 2aqh h ILE 120 CO -0.15 0.58 -0.32 -0.74 0.00 0.00 0.00 178.15 177.52 2aqh h HIS 121 N 0.29 -0.86 -0.21 1.37 2.76 0.06 0.12 115.15 118.68 2aqh h HIS 121 Ca -0.00 0.01 -0.19 0.00 -2.20 0.00 0.00 60.37 57.99 2aqh h HIS 121 Cb 1.13 0.35 0.00 0.00 1.55 0.00 0.00 27.41 30.45 2aqh h HIS 121 CO 0.03 -0.43 -0.64 0.82 -1.30 0.00 0.00 177.93 176.41 2aqh h ILE 122 N -0.58 1.29 0.00 6.26 2.04 -1.15 -0.58 117.51 124.79 2aqh h ILE 122 Ca 0.01 -1.86 -0.15 0.00 1.00 0.00 0.00 64.86 63.87 2aqh h ILE 122 Cb 0.58 1.81 -0.03 0.00 -0.74 0.00 0.00 36.82 38.44 2aqh h ILE 122 CO -0.14 0.59 -1.23 0.28 0.00 0.00 0.00 178.15 177.65 2aqh h SER 123 N 0.56 0.00 0.00 1.72 0.02 -0.99 -3.40 113.55 111.46 2aqh h SER 123 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2aqh h SER 123 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 2aqh h SER 123 CO 0.13 0.55 0.00 0.00 -1.14 0.00 0.00 176.83 176.37 2aqh n ALA 124 N -2.36 3.00 -0.36 3.77 0.00 0.25 -4.75 120.51 120.07 2aqh n ALA 124 Ca -0.07 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.40 2aqh n ALA 124 Cb 0.81 0.15 0.17 0.00 0.00 0.00 0.00 19.45 20.59 2aqh n ALA 124 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2aqh h TYR 125 N 0.00 1.15 -0.04 0.00 5.03 -1.08 -1.52 116.97 120.51 2aqh h TYR 125 Ca 0.00 0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.35 2aqh h TYR 125 Cb 0.00 -0.38 -0.00 0.00 1.55 0.00 0.00 36.73 37.90 2aqh h TYR 125 CO 0.00 0.58 0.07 0.66 -1.32 0.00 0.00 178.16 178.15 2aqh h SER 126 N 1.12 0.00 -0.48 -2.11 4.64 -1.30 0.45 113.55 115.87 2aqh h SER 126 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2aqh h SER 126 Cb 0.20 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.27 2aqh h SER 126 CO -0.18 0.00 0.32 0.22 -0.87 0.00 0.00 176.83 176.31 2aqh h TYR 127 N 0.00 0.61 -0.55 4.77 3.20 -1.55 0.26 116.97 123.70 2aqh h TYR 127 Ca 0.02 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.79 2aqh h TYR 127 Cb 0.15 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 2aqh h TYR 127 CO 0.00 0.39 -0.09 0.00 -1.64 0.00 0.00 178.16 176.83 2aqh h ALA 128 N 1.17 0.80 -0.20 1.82 0.00 -1.05 -2.10 119.26 119.70 2aqh h ALA 128 Ca 0.18 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.76 2aqh h ALA 128 Cb -0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2aqh h ALA 128 CO -0.04 0.67 0.07 0.77 0.00 0.00 0.00 179.25 180.72 2aqh h SER 129 N 0.92 0.08 -0.42 0.00 0.02 -0.97 0.17 113.55 113.34 2aqh h SER 129 Ca 0.15 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 2aqh h SER 129 Cb 0.65 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 2aqh h SER 129 CO 0.04 0.07 0.13 0.24 -1.14 0.00 0.00 176.83 176.18 2aqh h MET 130 N 0.16 0.66 -0.86 3.45 2.07 -0.49 -0.92 114.93 119.00 2aqh h MET 130 Ca 0.08 -0.14 -0.01 0.00 -2.07 0.00 0.00 59.70 57.56 2aqh h MET 130 Cb 0.05 -0.09 -0.04 0.00 -1.87 0.00 0.00 31.60 29.65 2aqh h MET 130 CO -0.09 0.65 0.48 0.00 1.07 0.00 0.00 176.91 179.02 2aqh h ALA 131 N 0.98 1.23 -0.31 6.32 0.00 -0.99 -0.65 119.26 125.83 2aqh h ALA 131 Ca 0.14 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2aqh h ALA 131 Cb 0.27 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2aqh h ALA 131 CO -0.00 0.63 0.19 -0.22 0.00 0.00 0.00 179.25 179.85 2aqh h LYS 132 N 1.20 0.42 -0.39 0.00 3.64 -0.31 -0.02 116.57 121.11 2aqh h LYS 132 Ca 0.30 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.58 2aqh h LYS 132 Cb 0.01 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 2aqh h LYS 132 CO -0.05 0.32 -0.05 0.00 -2.27 0.00 0.00 179.45 177.39 2aqh h ALA 133 N 1.08 1.19 0.00 5.00 0.00 -0.82 -3.36 119.26 122.35 2aqh h ALA 133 Ca 0.11 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 2aqh h ALA 133 Cb 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2aqh h ALA 133 CO -0.02 0.53 -1.84 1.28 0.00 0.00 0.00 179.25 179.19 2aqh n LEU 134 N -4.22 0.00 -0.35 0.00 4.77 -0.28 -4.32 117.00 112.59 2aqh n LEU 134 Ca 0.02 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.09 2aqh n LEU 134 Cb 0.30 0.18 0.27 0.00 -2.33 0.00 0.00 43.42 41.84 2aqh n LEU 134 CO 0.41 0.18 1.21 -0.07 -1.33 0.00 0.00 177.39 177.79 2aqh h LEU 135 N 0.00 0.85 -2.12 2.23 3.38 -1.14 -0.17 115.31 118.35 2aqh h LEU 135 Ca -0.20 0.07 0.08 0.00 0.09 0.00 0.00 57.88 57.92 2aqh h LEU 135 Cb 1.31 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 2aqh h LEU 135 CO 0.01 0.40 0.24 -0.65 0.09 0.00 0.00 178.44 178.53 2aqh h PRO 136 N 0.89 0.00 -0.37 1.13 0.11 -1.78 -2.01 132.00 129.97 2aqh h PRO 136 Ca 0.52 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.45 2aqh h PRO 136 Cb 0.65 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 31.65 2aqh h PRO 136 CO -0.31 0.00 -0.05 0.44 -0.21 0.00 0.00 178.00 177.86 2aqh n ILE 137 N -4.05 2.56 -4.57 4.15 -5.35 -0.11 -4.98 119.36 107.02 2aqh n ILE 137 Ca 0.04 -2.67 -0.34 0.00 -0.27 0.00 0.00 62.75 59.50 2aqh n ILE 137 Cb 0.39 -0.32 -0.11 0.00 -1.74 0.00 0.00 39.64 37.86 2aqh n ILE 137 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2aqh s MET 138 N -3.23 2.75 0.48 6.28 -1.94 -0.76 -0.40 119.30 122.48 2aqh s MET 138 Ca 0.45 -0.56 -0.21 0.00 -1.71 0.00 0.00 55.69 53.67 2aqh s MET 138 Cb 0.41 -2.60 -0.08 0.00 2.01 0.00 0.00 34.83 34.56 2aqh s MET 138 CO 0.01 0.66 1.06 -0.80 -0.01 0.00 0.00 175.02 175.93 2aqh s ASN 139 N -0.92 6.30 0.49 3.03 0.01 0.99 -4.91 114.94 119.93 2aqh s ASN 139 Ca 0.13 2.00 -0.22 0.00 -0.71 0.00 0.00 52.86 54.07 2aqh s ASN 139 Cb -0.11 -2.57 -0.09 0.00 0.41 0.00 0.00 41.25 38.89 2aqh s ASN 139 CO 0.03 -0.82 0.90 -2.65 -1.51 0.00 0.00 177.10 173.05 2aqh n PRO 140 N -0.88 1.06 -0.99 -0.60 -0.02 -1.24 -1.44 135.00 130.89 2aqh n PRO 140 Ca 0.09 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2aqh n PRO 140 Cb 0.52 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 2aqh n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2aqh n GLY 141 N 1.33 0.86 3.70 -1.23 0.00 0.83 -4.98 105.19 105.70 2aqh n GLY 141 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2aqh n GLY 141 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2aqh s GLY 142 N -2.00 1.60 -0.13 -0.02 0.00 -0.52 -4.89 107.32 101.36 2aqh s GLY 142 Ca 0.00 -0.73 -0.06 0.00 0.00 0.00 0.00 44.72 43.93 2aqh s GLY 142 CO 0.00 -0.01 0.29 -0.45 0.00 0.00 0.00 173.10 172.94 2aqh s SER 143 N -3.94 -0.03 -0.12 1.64 0.15 -0.17 -1.37 113.70 109.87 2aqh s SER 143 Ca 0.68 0.65 -0.02 0.00 0.70 0.00 0.00 55.95 57.96 2aqh s SER 143 Cb -0.13 0.68 -0.03 0.00 -1.71 0.00 0.00 66.02 64.84 2aqh s SER 143 CO 0.55 -0.21 -0.03 -0.63 1.20 0.00 0.00 173.24 174.12 2aqh s ILE 144 N 1.93 3.96 -0.06 6.45 1.01 0.17 -0.67 121.20 133.98 2aqh s ILE 144 Ca -0.04 -0.36 0.01 0.00 0.00 0.00 0.00 60.65 60.27 2aqh s ILE 144 Cb -0.11 -2.69 0.02 0.00 0.01 0.00 0.00 42.46 39.69 2aqh s ILE 144 CO -0.10 0.55 -0.07 -0.69 0.00 0.00 0.00 174.94 174.63 2aqh s VAL 145 N -0.24 0.75 0.28 2.92 1.01 0.65 -0.71 120.40 125.06 2aqh s VAL 145 Ca 0.04 -0.24 0.11 0.00 0.00 0.00 0.00 61.98 61.90 2aqh s VAL 145 Cb -0.13 -0.74 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 2aqh s VAL 145 CO 0.02 0.28 -0.10 -0.83 0.00 0.00 0.00 175.10 174.47 2aqh s GLY 146 N 0.92 1.81 -0.16 4.51 0.00 -0.46 0.02 107.32 113.97 2aqh s GLY 146 Ca -0.11 -1.79 -0.12 0.00 0.00 0.00 0.00 44.72 42.70 2aqh s GLY 146 CO 0.01 -1.86 0.24 1.06 0.00 0.00 0.00 173.10 172.55 2aqh s MET 147 N -3.60 4.13 0.13 2.90 -1.94 -0.73 -0.85 119.30 119.34 2aqh s MET 147 Ca 0.31 0.01 0.08 0.00 -1.71 0.00 0.00 55.69 54.38 2aqh s MET 147 Cb -0.05 -3.39 -0.04 0.00 2.01 0.00 0.00 34.83 33.37 2aqh s MET 147 CO 0.17 0.34 -0.18 0.34 -0.01 0.00 0.00 175.02 175.68 2aqh s ASP 148 N 0.18 2.46 -0.18 3.03 2.15 0.85 -4.91 116.67 120.26 2aqh s ASP 148 Ca 0.15 -0.77 0.00 0.00 0.43 0.00 0.00 52.55 52.36 2aqh s ASP 148 Cb -0.13 -0.13 0.04 0.00 -0.30 0.00 0.00 42.92 42.40 2aqh s ASP 148 CO 0.03 -0.02 -0.08 0.12 -0.17 0.00 0.00 175.17 175.06 2aqh s PHE 149 N -1.66 2.00 -0.65 -5.34 5.36 -1.26 -1.64 117.98 114.80 2aqh s PHE 149 Ca 0.10 -1.28 -0.38 0.00 -0.96 0.00 0.00 56.93 54.40 2aqh s PHE 149 Cb -0.08 -1.46 -0.19 0.00 -0.34 0.00 0.00 43.02 40.96 2aqh s PHE 149 CO 0.05 -0.67 2.34 -3.47 -1.46 0.00 0.00 175.22 172.01 2aqh n ASP 150 N 4.80 0.77 -1.83 6.13 2.03 -1.26 -4.81 116.55 122.38 2aqh n ASP 150 Ca -0.13 0.45 0.08 0.00 0.52 0.00 0.00 54.79 55.71 2aqh n ASP 150 Cb 0.47 -0.96 0.40 0.00 -0.72 0.00 0.00 41.12 40.31 2aqh n ASP 150 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2aqh n PRO 151 N 7.94 4.61 0.26 -0.67 -0.04 -1.26 -4.59 135.00 141.24 2aqh n PRO 151 Ca 0.57 -3.10 0.15 0.00 -0.04 0.00 0.00 63.50 61.08 2aqh n PRO 151 Cb 0.03 -2.17 0.58 0.00 -0.04 0.00 0.00 33.50 31.89 2aqh n PRO 151 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2aqh h SER 152 N 4.08 0.00 -4.23 3.54 4.64 -1.94 -3.41 113.55 116.22 2aqh h SER 152 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 2aqh h SER 152 Cb 1.85 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.70 2aqh h SER 152 CO 0.42 0.04 -0.83 -0.13 -0.87 0.00 0.00 176.83 175.46 2aqh s ARG 153 N -3.60 1.21 0.74 4.77 0.52 -1.26 -5.14 118.95 116.18 2aqh s ARG 153 Ca 0.02 -1.05 -0.11 0.00 -0.52 0.00 0.00 55.73 54.07 2aqh s ARG 153 Cb 0.09 -1.40 0.03 0.00 0.52 0.00 0.00 34.95 34.18 2aqh s ARG 153 CO 0.58 0.34 1.07 0.00 0.02 0.00 0.00 175.30 177.31 2aqh s ALA 154 N -1.01 2.47 0.12 2.13 0.00 -1.26 -5.07 121.76 119.14 2aqh s ALA 154 Ca 0.06 0.10 -0.14 0.00 0.00 0.00 0.00 51.96 51.98 2aqh s ALA 154 Cb -0.09 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 19.85 2aqh s ALA 154 CO 0.03 -1.47 0.34 0.00 0.00 0.00 0.00 175.76 174.66 2aqh s MET 155 N -5.01 1.01 0.57 0.00 0.23 -1.26 -5.15 119.30 109.69 2aqh s MET 155 Ca 0.59 -0.78 -0.20 0.00 -1.03 0.00 0.00 55.69 54.28 2aqh s MET 155 Cb -0.15 0.43 -0.04 0.00 -1.53 0.00 0.00 34.83 33.54 2aqh s MET 155 CO 0.55 -0.38 1.24 -1.25 -2.03 0.00 0.00 175.02 173.16 2aqh s PRO 156 N -3.82 3.05 0.00 3.16 0.04 -1.26 -4.15 135.00 132.02 2aqh s PRO 156 Ca 0.04 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.00 2aqh s PRO 156 Cb 0.03 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2aqh s PRO 156 CO -0.12 -1.17 0.00 0.00 0.04 0.00 0.00 177.00 175.76 2aqh n ALA 157 N -1.38 0.00 0.21 8.56 0.00 -1.26 -4.50 120.51 122.13 2aqh n ALA 157 Ca 0.12 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.65 2aqh n ALA 157 Cb 0.48 0.00 0.38 0.00 0.00 0.00 0.00 19.45 20.31 2aqh n ALA 157 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2aqh h TYR 158 N 0.00 0.00 0.00 0.00 0.05 -1.90 0.81 116.97 115.93 2aqh h TYR 158 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2aqh h TYR 158 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 2aqh h TYR 158 CO 0.00 0.26 0.00 0.09 -1.05 0.00 0.00 178.16 177.46 2aqh n ASN 159 N -3.36 0.00 0.23 3.88 4.13 -1.26 -0.36 115.26 118.52 2aqh n ASN 159 Ca 0.01 0.00 0.15 0.00 1.68 0.00 0.00 54.58 56.42 2aqh n ASN 159 Cb 0.48 0.00 0.52 0.00 -1.54 0.00 0.00 39.78 39.25 2aqh n ASN 159 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 2aqh h TRP 160 N 0.00 0.00 -0.58 3.10 4.06 -1.41 -2.23 115.95 118.88 2aqh h TRP 160 Ca 0.00 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.86 2aqh h TRP 160 Cb 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.14 2aqh h TRP 160 CO 0.00 0.00 0.00 1.98 -3.56 0.00 0.00 178.44 176.86 2aqh h MET 161 N 0.00 1.01 -0.49 0.49 4.05 -0.83 0.92 114.93 120.08 2aqh h MET 161 Ca 0.00 -0.31 0.04 0.00 -0.28 0.00 0.00 59.70 59.15 2aqh h MET 161 Cb 0.60 -0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 31.26 2aqh h MET 161 CO 0.00 0.99 0.25 1.15 0.23 0.00 0.00 176.91 179.53 2aqh h THR 162 N 0.93 0.96 -0.31 -0.77 2.02 -1.14 0.64 112.91 115.24 2aqh h THR 162 Ca 0.17 -0.17 0.05 0.00 0.77 0.00 0.00 66.41 67.23 2aqh h THR 162 Cb 0.54 0.43 -0.05 0.00 -1.74 0.00 0.00 68.15 67.33 2aqh h THR 162 CO 0.03 0.09 0.02 0.58 0.37 0.00 0.00 175.52 176.61 2aqh h VAL 163 N 0.49 0.79 -0.93 3.16 2.07 -1.28 -0.11 116.25 120.45 2aqh h VAL 163 Ca 0.22 -0.04 0.11 0.00 0.82 0.00 0.00 66.70 67.80 2aqh h VAL 163 Cb 0.12 0.67 -0.08 0.00 -1.52 0.00 0.00 31.29 30.48 2aqh h VAL 163 CO -0.15 0.02 0.56 0.00 0.02 0.00 0.00 177.57 178.03 2aqh h ALA 164 N 1.26 1.36 -0.64 1.67 0.00 -0.33 -0.54 119.26 122.05 2aqh h ALA 164 Ca 0.15 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 2aqh h ALA 164 Cb 0.19 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2aqh h ALA 164 CO -0.24 0.18 0.05 0.87 0.00 0.00 0.00 179.25 180.12 2aqh h LYS 165 N 0.92 1.09 -0.71 0.00 1.79 -0.19 0.71 116.57 120.17 2aqh h LYS 165 Ca 0.45 -0.32 0.01 0.00 -2.18 0.00 0.00 60.65 58.61 2aqh h LYS 165 Cb 0.42 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 30.92 2aqh h LYS 165 CO -0.25 1.03 0.47 0.77 -1.08 0.00 0.00 179.45 180.38 2aqh h SER 166 N 1.00 0.82 -0.64 0.86 0.02 -0.21 0.11 113.55 115.51 2aqh h SER 166 Ca 0.19 -0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 61.07 2aqh h SER 166 Cb 0.51 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 2aqh h SER 166 CO 0.02 0.60 0.23 0.00 -1.14 0.00 0.00 176.83 176.55 2aqh h ALA 167 N 1.26 0.83 -0.51 3.77 0.00 -0.86 -2.40 119.26 121.34 2aqh h ALA 167 Ca 0.26 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2aqh h ALA 167 Cb -0.10 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 2aqh h ALA 167 CO -0.06 0.47 0.30 1.25 0.00 0.00 0.00 179.25 181.22 2aqh h LEU 168 N 0.91 0.49 -0.81 0.00 6.46 -0.20 0.18 115.31 122.34 2aqh h LEU 168 Ca 0.21 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 58.00 2aqh h LEU 168 Cb 0.24 -0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 40.03 2aqh h LEU 168 CO -0.01 0.35 0.53 -0.33 -0.62 0.00 0.00 178.44 178.35 2aqh h GLU 169 N 0.61 1.01 -0.33 1.25 5.08 -0.90 0.13 114.58 121.44 2aqh h GLU 169 Ca 0.20 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 2aqh h GLU 169 Cb 0.02 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 2aqh h GLU 169 CO -0.09 0.67 0.14 1.03 -1.00 0.00 0.00 179.01 179.76 2aqh h SER 170 N 1.04 0.44 -0.19 1.42 0.87 -0.88 -2.81 113.55 113.44 2aqh h SER 170 Ca 0.31 -0.15 0.02 0.00 -1.23 0.00 0.00 61.79 60.74 2aqh h SER 170 Cb -0.04 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 2aqh h SER 170 CO -0.10 0.47 0.07 0.58 -0.53 0.00 0.00 176.83 177.33 2aqh h VAL 171 N 0.38 0.96 -0.96 2.23 2.07 -0.23 -2.24 116.25 118.46 2aqh h VAL 171 Ca 0.11 -0.06 0.20 0.00 0.82 0.00 0.00 66.70 67.78 2aqh h VAL 171 Cb 0.16 0.78 -0.11 0.00 -1.52 0.00 0.00 31.29 30.59 2aqh h VAL 171 CO -0.01 0.03 0.55 -1.13 0.02 0.00 0.00 177.57 177.03 2aqh h ASN 172 N 0.17 0.65 -0.25 0.57 -1.24 -0.68 0.25 115.58 115.05 2aqh h ASN 172 Ca 0.08 0.12 -0.06 0.00 0.71 0.00 0.00 56.30 57.15 2aqh h ASN 172 Cb 0.04 0.01 -0.02 0.00 0.73 0.00 0.00 38.32 39.09 2aqh h ASN 172 CO -0.08 0.18 -0.03 0.03 -1.29 0.00 0.00 177.43 176.24 2aqh h ARG 173 N 0.64 0.59 -0.01 6.67 3.08 -1.14 -0.29 114.38 123.91 2aqh h ARG 173 Ca 0.58 -0.15 -0.22 0.00 0.07 0.00 0.00 59.98 60.26 2aqh h ARG 173 Cb 0.97 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.95 2aqh h ARG 173 CO -0.43 0.64 -0.91 0.74 -1.07 0.00 0.00 179.97 178.94 2aqh h PHE 174 N 0.56 0.61 -0.71 3.04 0.04 -0.80 -3.17 116.94 116.52 2aqh h PHE 174 Ca 0.11 -0.33 -0.05 0.00 2.80 0.00 0.00 57.97 60.51 2aqh h PHE 174 Cb 0.41 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.45 2aqh h PHE 174 CO 0.02 1.14 0.25 0.28 -0.60 0.00 0.00 178.31 179.40 2aqh h VAL 175 N 0.24 1.25 -0.93 -0.55 2.07 -0.24 -1.94 116.25 116.15 2aqh h VAL 175 Ca -0.07 -0.81 0.08 0.00 0.82 0.00 0.00 66.70 66.71 2aqh h VAL 175 Cb 1.54 0.43 -0.07 0.00 -1.52 0.00 0.00 31.29 31.67 2aqh h VAL 175 CO 0.16 0.32 0.58 0.00 0.02 0.00 0.00 177.57 178.65 2aqh h ALA 176 N 1.24 1.32 -0.21 1.67 0.00 -1.09 0.55 119.26 122.73 2aqh h ALA 176 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2aqh h ALA 176 Cb 0.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2aqh h ALA 176 CO -0.01 0.28 0.14 0.00 0.00 0.00 0.00 179.25 179.65 2aqh h ARG 177 N 1.00 0.29 -0.19 0.00 3.08 -1.33 0.17 114.38 117.39 2aqh h ARG 177 Ca 0.42 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.43 2aqh h ARG 177 Cb 0.28 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 2aqh h ARG 177 CO -0.21 0.20 0.03 0.93 -1.07 0.00 0.00 179.97 179.86 2aqh h GLU 178 N 0.28 0.31 -0.38 0.04 4.39 -1.01 -3.18 114.58 115.04 2aqh h GLU 178 Ca 0.08 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2aqh h GLU 178 Cb -0.02 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 2aqh h GLU 178 CO -0.02 0.47 0.19 0.00 -1.16 0.00 0.00 179.01 178.50 2aqh h ALA 179 N 0.83 1.64 -0.67 3.43 0.00 0.19 -2.20 119.26 122.49 2aqh h ALA 179 Ca 0.06 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2aqh h ALA 179 Cb 0.31 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2aqh h ALA 179 CO 0.00 0.30 0.44 0.78 0.00 0.00 0.00 179.25 180.78 2aqh h GLY 180 N 0.61 0.92 1.42 0.00 0.00 -0.75 0.11 103.07 105.38 2aqh h GLY 180 Ca 0.13 -0.33 0.06 0.00 0.00 0.00 0.00 47.33 47.20 2aqh h GLY 180 CO -0.02 0.30 0.23 0.50 0.00 0.00 0.00 176.54 177.55 2aqh h LYS 181 N 0.84 0.00 -0.44 4.80 1.57 -1.47 -1.39 116.57 120.48 2aqh h LYS 181 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2aqh h LYS 181 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2aqh h LYS 181 CO -0.07 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.47 2aqh n TYR 182 N -3.79 0.57 -1.43 -1.35 4.02 0.14 -4.91 117.16 110.41 2aqh n TYR 182 Ca 0.02 -0.29 -0.09 0.00 -0.01 0.00 0.00 57.90 57.53 2aqh n TYR 182 Cb 0.36 -0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.65 2aqh n TYR 182 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2aqh n GLY 183 N 1.50 0.85 3.55 2.72 0.00 -0.52 -3.72 105.19 109.56 2aqh n GLY 183 Ca 0.20 -0.62 -0.34 0.00 0.00 0.00 0.00 46.02 45.26 2aqh n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aqh s VAL 184 N -2.34 3.66 0.18 1.61 1.01 0.06 -0.12 120.40 124.46 2aqh s VAL 184 Ca 0.00 -0.48 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2aqh s VAL 184 Cb 0.00 -2.51 -0.06 0.00 0.00 0.00 0.00 36.38 33.80 2aqh s VAL 184 CO 0.00 0.58 0.45 -0.13 0.00 0.00 0.00 175.10 176.00 2aqh s ARG 185 N -0.54 3.69 -0.07 2.72 0.52 -0.47 -2.72 118.95 122.08 2aqh s ARG 185 Ca 0.08 0.06 0.01 0.00 -0.52 0.00 0.00 55.73 55.36 2aqh s ARG 185 Cb -0.12 -2.76 0.02 0.00 0.52 0.00 0.00 34.95 32.61 2aqh s ARG 185 CO 0.02 0.40 -0.07 0.45 0.02 0.00 0.00 175.30 176.13 2aqh s SER 186 N -2.41 1.47 0.06 0.23 0.15 -1.26 0.42 113.70 112.37 2aqh s SER 186 Ca 0.44 -0.20 -0.12 0.00 0.70 0.00 0.00 55.95 56.77 2aqh s SER 186 Cb -0.12 -0.62 0.01 0.00 -1.71 0.00 0.00 66.02 63.58 2aqh s SER 186 CO 0.23 -0.06 0.26 0.20 1.20 0.00 0.00 173.24 175.07 2aqh s ASN 187 N 1.12 -0.04 0.05 5.45 -0.87 0.11 0.16 114.94 120.93 2aqh s ASN 187 Ca -0.07 -0.36 0.04 0.00 -1.57 0.00 0.00 52.86 50.89 2aqh s ASN 187 Cb -0.14 0.35 -0.04 0.00 -0.02 0.00 0.00 41.25 41.40 2aqh s ASN 187 CO -0.01 -0.65 -0.00 -0.76 -2.57 0.00 0.00 177.10 173.11 2aqh s LEU 188 N -2.33 3.47 -0.34 0.60 1.02 0.33 -1.35 118.68 120.08 2aqh s LEU 188 Ca -0.02 -0.11 -0.10 0.00 0.02 0.00 0.00 54.13 53.92 2aqh s LEU 188 Cb 0.01 -2.12 0.01 0.00 0.02 0.00 0.00 46.19 44.10 2aqh s LEU 188 CO -0.06 0.22 0.18 -0.69 0.02 0.00 0.00 176.35 176.01 2aqh s VAL 189 N -1.22 4.64 -0.51 -1.59 1.01 -0.03 -0.26 120.40 122.44 2aqh s VAL 189 Ca 0.23 -0.57 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 2aqh s VAL 189 Cb -0.12 -3.45 0.04 0.00 0.00 0.00 0.00 36.38 32.85 2aqh s VAL 189 CO 0.15 -0.05 0.87 0.00 0.00 0.00 0.00 175.10 176.07 2aqh s ALA 190 N 1.60 3.22 0.21 5.51 0.00 0.84 -0.10 121.76 133.03 2aqh s ALA 190 Ca 0.04 -1.18 -0.06 0.00 0.00 0.00 0.00 51.96 50.75 2aqh s ALA 190 Cb -0.18 -3.62 -0.06 0.00 0.00 0.00 0.00 23.12 19.26 2aqh s ALA 190 CO 0.07 -2.19 0.47 0.00 0.00 0.00 0.00 175.76 174.11 2aqh s ALA 191 N 3.62 3.68 1.19 0.00 0.00 -0.65 -0.03 121.76 129.57 2aqh s ALA 191 Ca 0.29 -0.47 -0.15 0.00 0.00 0.00 0.00 51.96 51.63 2aqh s ALA 191 Cb -0.13 -2.27 0.25 0.00 0.00 0.00 0.00 23.12 20.97 2aqh s ALA 191 CO 0.20 0.52 0.66 0.41 0.00 0.00 0.00 175.76 177.55 2aqh n GLY 192 N -0.23 -2.37 3.72 0.00 0.00 -0.58 -4.61 105.19 101.13 2aqh n GLY 192 Ca -0.01 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 2aqh n GLY 192 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2aqh s PRO 193 N -4.09 4.27 -0.11 1.61 0.04 -1.26 -5.00 135.00 130.46 2aqh s PRO 193 Ca 0.64 2.22 0.02 0.00 0.04 0.00 0.00 61.00 63.92 2aqh s PRO 193 Cb -0.20 -3.19 -0.01 0.00 0.04 0.00 0.00 34.50 31.13 2aqh s PRO 193 CO 0.65 -0.50 -0.18 0.42 0.04 0.00 0.00 177.00 177.42 2aqh s ILE 194 N 1.00 2.58 -1.01 0.56 -1.09 -1.26 -4.25 121.20 117.74 2aqh s ILE 194 Ca 0.66 -0.84 -0.20 0.00 -2.23 0.00 0.00 60.65 58.04 2aqh s ILE 194 Cb -0.40 -2.03 -0.09 0.00 -1.58 0.00 0.00 42.46 38.35 2aqh s ILE 194 CO 0.32 0.55 1.98 0.54 -1.23 0.00 0.00 174.94 177.10 2aqh n ARG 195 N 3.41 1.92 -1.60 2.79 5.12 0.14 -4.69 116.66 123.76 2aqh n ARG 195 Ca -0.18 -2.18 -0.29 0.00 -1.93 0.00 0.00 57.85 53.26 2aqh n ARG 195 Cb 0.53 -3.14 0.10 0.00 -1.16 0.00 0.00 32.46 28.79 2aqh n ARG 195 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2aqh s THR 196 N 5.31 2.67 0.17 0.55 -1.32 -1.26 -4.74 115.64 117.03 2aqh s THR 196 Ca 0.56 0.22 -0.17 0.00 -1.21 0.00 0.00 61.69 61.09 2aqh s THR 196 Cb 0.12 -3.01 0.12 0.00 -1.51 0.00 0.00 72.50 68.22 2aqh s THR 196 CO 0.07 -0.29 1.65 -0.07 -2.21 0.00 0.00 174.62 173.78 2aqh h LEU 197 N -1.18 -0.47 -0.27 9.08 3.38 -1.90 0.12 115.31 124.07 2aqh h LEU 197 Ca -0.48 0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.64 2aqh h LEU 197 Cb 1.29 0.30 -0.02 0.00 0.09 0.00 0.00 40.66 42.32 2aqh h LEU 197 CO 0.61 -0.16 0.15 0.00 0.09 0.00 0.00 178.44 179.13 2aqh h ALA 198 N 1.40 0.33 -0.59 1.53 0.00 -1.95 0.27 119.26 120.25 2aqh h ALA 198 Ca 0.21 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2aqh h ALA 198 Cb 0.35 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 2aqh h ALA 198 CO -0.47 -0.23 0.37 1.98 0.00 0.00 0.00 179.25 180.90 2aqh h MET 199 N 0.32 0.80 -0.25 0.00 1.85 -1.69 0.18 114.93 116.14 2aqh h MET 199 Ca 0.11 -0.07 0.04 0.00 -0.61 0.00 0.00 59.70 59.17 2aqh h MET 199 Cb -0.00 -0.17 -0.04 0.00 0.43 0.00 0.00 31.60 31.82 2aqh h MET 199 CO -0.05 0.56 0.01 0.77 -0.40 0.00 0.00 176.91 177.80 2aqh h SER 200 N 0.80 -0.07 -0.62 1.39 0.02 -0.38 0.39 113.55 115.08 2aqh h SER 200 Ca 0.21 0.05 0.07 0.00 -0.84 0.00 0.00 61.79 61.28 2aqh h SER 200 Cb -0.04 0.09 -0.06 0.00 0.14 0.00 0.00 62.40 62.53 2aqh h SER 200 CO -0.04 -0.00 0.31 0.00 -1.14 0.00 0.00 176.83 175.95 2aqh h ALA 201 N 1.21 0.82 -0.33 3.77 0.00 0.10 0.15 119.26 124.98 2aqh h ALA 201 Ca 0.12 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 2aqh h ALA 201 Cb 0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2aqh h ALA 201 CO -0.19 -0.06 -0.39 -0.84 0.00 0.00 0.00 179.25 177.78 2aqh h ILE 202 N 0.56 1.28 -0.74 0.00 -0.00 -0.24 -0.12 117.51 118.25 2aqh h ILE 202 Ca 0.29 -1.56 0.06 0.00 -0.00 0.00 0.00 64.86 63.65 2aqh h ILE 202 Cb 0.24 1.45 -0.06 0.00 -0.00 0.00 0.00 36.82 38.45 2aqh h ILE 202 CO -0.22 0.51 0.43 0.58 -0.00 0.00 0.00 178.15 179.46 2aqh h VAL 203 N 0.64 0.99 0.00 0.16 2.07 -0.48 -0.85 116.25 118.78 2aqh h VAL 203 Ca 0.05 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2aqh h VAL 203 Cb 0.94 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2aqh h VAL 203 CO 0.09 0.14 0.00 0.61 0.02 0.00 0.00 177.57 178.43 2aqh n GLY 204 N -1.30 -0.67 0.33 2.17 0.00 0.47 -4.59 105.19 101.60 2aqh n GLY 204 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2aqh n GLY 204 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aqh n GLY 205 N 0.25 0.84 0.34 -0.02 0.00 -0.32 -4.99 105.19 101.28 2aqh n GLY 205 Ca 0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 2aqh n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqh h ALA 206 N 0.00 2.16 -0.53 4.61 0.00 -1.14 -1.07 119.26 123.29 2aqh h ALA 206 Ca 0.00 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.66 2aqh h ALA 206 Cb 0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 17.79 17.63 2aqh h ALA 206 CO 0.00 -0.26 0.14 1.28 0.00 0.00 0.00 179.25 180.41 2aqh n LEU 207 N -4.46 4.90 0.00 0.00 4.32 -1.26 -5.01 117.00 115.50 2aqh n LEU 207 Ca 0.06 -3.57 0.00 0.00 -0.02 0.00 0.00 56.01 52.48 2aqh n LEU 207 Cb 0.36 -0.68 0.00 0.00 -1.62 0.00 0.00 43.42 41.48 2aqh n LEU 207 CO 0.35 1.08 0.00 0.61 -1.22 0.00 0.00 177.39 178.21 2aqh n GLY 208 N -0.94 2.57 0.25 -0.72 0.00 -0.41 -0.84 105.19 105.11 2aqh n GLY 208 Ca 0.38 -1.63 -0.09 0.00 0.00 0.00 0.00 46.02 44.68 2aqh n GLY 208 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2aqh h GLU 209 N 0.00 0.83 -0.58 1.61 4.57 -1.94 -1.28 114.58 117.79 2aqh h GLU 209 Ca 0.00 -0.22 -0.05 0.00 -1.18 0.00 0.00 59.36 57.91 2aqh h GLU 209 Cb 0.00 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 2aqh h GLU 209 CO 0.00 0.82 0.15 0.93 -1.18 0.00 0.00 179.01 179.73 2aqh h GLU 210 N 0.71 0.92 -0.98 1.92 3.07 -1.95 0.93 114.58 119.20 2aqh h GLU 210 Ca 0.15 -0.22 0.02 0.00 -0.50 0.00 0.00 59.36 58.81 2aqh h GLU 210 Cb 0.39 -0.12 -0.05 0.00 -0.84 0.00 0.00 28.75 28.12 2aqh h GLU 210 CO 0.01 0.85 0.65 0.00 -1.40 0.00 0.00 179.01 179.11 2aqh h ALA 211 N 1.03 1.25 -0.21 3.43 0.00 -1.78 0.13 119.26 123.12 2aqh h ALA 211 Ca 0.18 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2aqh h ALA 211 Cb 0.33 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2aqh h ALA 211 CO 0.00 0.61 0.07 0.78 0.00 0.00 0.00 179.25 180.71 2aqh h GLY 212 N 1.31 0.34 1.00 0.00 0.00 -0.40 -0.19 103.07 105.13 2aqh h GLY 212 Ca 0.37 -0.20 0.01 0.00 0.00 0.00 0.00 47.33 47.50 2aqh h GLY 212 CO -0.09 0.19 0.33 0.00 0.00 0.00 0.00 176.54 176.97 2aqh h ALA 213 N 0.90 0.64 -0.46 3.60 0.00 -0.55 -0.56 119.26 122.83 2aqh h ALA 213 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2aqh h ALA 213 Cb 0.22 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2aqh h ALA 213 CO -0.00 0.08 0.20 1.96 0.00 0.00 0.00 179.25 181.48 2aqh h GLN 214 N 0.68 0.68 -0.25 0.00 4.20 -0.75 -0.98 115.11 118.70 2aqh h GLN 214 Ca 0.19 -0.12 -0.09 0.00 0.06 0.00 0.00 58.65 58.69 2aqh h GLN 214 Cb -0.07 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 2aqh h GLN 214 CO -0.04 0.61 -0.22 0.82 -0.67 0.00 0.00 178.83 179.33 2aqh h ILE 215 N 0.61 1.25 -0.60 2.54 1.08 -0.76 0.19 117.51 121.82 2aqh h ILE 215 Ca 0.16 -1.17 -0.10 0.00 -0.39 0.00 0.00 64.86 63.35 2aqh h ILE 215 Cb 0.17 1.30 -0.02 0.00 -3.07 0.00 0.00 36.82 35.20 2aqh h ILE 215 CO -0.01 0.37 -0.03 -0.61 -0.69 0.00 0.00 178.15 177.18 2aqh h GLN 216 N 0.40 1.08 -0.54 2.37 4.15 -0.77 -0.26 115.11 121.54 2aqh h GLN 216 Ca 0.07 -0.36 -0.05 0.00 0.77 0.00 0.00 58.65 59.07 2aqh h GLN 216 Cb 0.60 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 2aqh h GLN 216 CO 0.04 1.06 0.14 -0.07 -1.93 0.00 0.00 178.83 178.07 2aqh h LEU 217 N 0.97 0.82 -0.14 -2.39 3.38 -0.53 -1.47 115.31 115.95 2aqh h LEU 217 Ca 0.17 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.95 2aqh h LEU 217 Cb 0.60 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 2aqh h LEU 217 CO 0.04 0.83 -0.15 0.25 0.09 0.00 0.00 178.44 179.50 2aqh h LEU 218 N 0.76 -0.47 -0.91 1.67 7.12 -0.32 -0.42 115.31 122.75 2aqh h LEU 218 Ca 0.17 0.09 -0.10 0.00 0.13 0.00 0.00 57.88 58.17 2aqh h LEU 218 Cb 0.33 0.23 -0.01 0.00 -0.53 0.00 0.00 40.66 40.68 2aqh h LEU 218 CO 0.00 -0.19 -0.32 1.05 -0.13 0.00 0.00 178.44 178.85 2aqh h GLU 219 N -0.18 0.42 -0.24 1.25 4.11 -0.83 -0.65 114.58 118.47 2aqh h GLU 219 Ca 0.10 -0.18 -0.03 0.00 0.07 0.00 0.00 59.36 59.33 2aqh h GLU 219 Cb 0.32 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2aqh h GLU 219 CO -0.25 0.70 0.05 0.93 0.07 0.00 0.00 179.01 180.51 2aqh h GLU 220 N 0.37 0.39 -0.24 1.06 5.08 -0.99 -2.73 114.58 117.51 2aqh h GLU 220 Ca 0.05 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 2aqh h GLU 220 Cb 0.74 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 2aqh h GLU 220 CO 0.06 0.50 -0.14 0.78 -1.00 0.00 0.00 179.01 179.21 2aqh h GLY 221 N 0.21 0.43 0.99 -3.84 0.00 -0.90 -1.99 103.07 97.96 2aqh h GLY 221 Ca 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 2aqh h GLY 221 CO 0.00 0.27 -0.08 -0.25 0.00 0.00 0.00 176.54 176.48 2aqh h TRP 222 N 0.37 -0.21 -0.81 5.60 2.91 -0.92 0.23 115.95 123.11 2aqh h TRP 222 Ca 0.07 -0.00 -0.03 0.00 1.13 0.00 0.00 58.89 60.06 2aqh h TRP 222 Cb 0.47 0.07 -0.04 0.00 -0.51 0.00 0.00 29.16 29.16 2aqh h TRP 222 CO 0.01 -0.13 0.40 0.22 -1.03 0.00 0.00 178.44 177.91 2aqh h ASP 223 N -0.22 1.05 -0.18 2.65 -0.00 -1.32 0.41 116.42 118.81 2aqh h ASP 223 Ca -0.02 -0.12 -0.01 0.00 -0.00 0.00 0.00 57.03 56.88 2aqh h ASP 223 Cb 0.18 -0.27 -0.01 0.00 -0.00 0.00 0.00 39.33 39.23 2aqh h ASP 223 CO 0.03 0.88 0.09 1.56 -0.00 0.00 0.00 179.24 181.80 2aqh h GLN 224 N 1.16 0.25 -0.38 0.28 4.20 -1.03 -3.18 115.11 116.41 2aqh h GLN 224 Ca 0.28 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.82 2aqh h GLN 224 Cb 0.11 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2aqh h GLN 224 CO -0.04 0.28 -0.30 0.00 -0.67 0.00 0.00 178.83 178.11 2aqh h ARG 225 N 0.17 0.83 -6.07 1.46 3.08 -0.30 -3.44 114.38 110.11 2aqh h ARG 225 Ca 0.06 -0.38 -0.61 0.00 0.07 0.00 0.00 59.98 59.12 2aqh h ARG 225 Cb 0.11 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2aqh h ARG 225 CO -0.01 1.01 1.37 0.00 -1.07 0.00 0.00 179.97 181.28 2aqh n ALA 226 N -2.52 1.39 0.19 0.04 0.00 0.11 -4.61 120.51 115.12 2aqh n ALA 226 Ca -0.01 -0.05 0.17 0.00 0.00 0.00 0.00 53.44 53.55 2aqh n ALA 226 Cb 0.48 -2.71 0.80 0.00 0.00 0.00 0.00 19.45 18.03 2aqh n ALA 226 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2aqh h PRO 227 N 12.79 0.00 -0.36 0.00 0.11 -1.75 0.79 132.00 143.58 2aqh h PRO 227 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2aqh h PRO 227 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2aqh h PRO 227 CO 0.97 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 179.20 2aqh n ILE 228 N -3.92 1.14 0.00 4.15 -5.35 -1.21 -5.09 119.36 109.08 2aqh n ILE 228 Ca 0.02 -1.09 0.00 0.00 -0.27 0.00 0.00 62.75 61.41 2aqh n ILE 228 Cb 0.32 0.42 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 2aqh n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2aqh n GLY 229 N 0.48 -1.74 2.89 3.28 0.00 0.27 -4.97 105.19 105.40 2aqh n GLY 229 Ca 0.13 -1.53 -0.15 0.00 0.00 0.00 0.00 46.02 44.47 2aqh n GLY 229 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2aqh s TRP 230 N -2.11 -0.24 -0.47 1.61 -0.11 -1.26 -4.43 118.94 111.93 2aqh s TRP 230 Ca 0.00 0.68 -0.08 0.00 1.22 0.00 0.00 56.10 57.92 2aqh s TRP 230 Cb 0.00 -0.18 0.12 0.00 -1.50 0.00 0.00 33.47 31.91 2aqh s TRP 230 CO 0.00 -0.27 0.33 1.21 -4.62 0.00 0.00 176.95 173.60 2aqh s ASN 231 N 2.12 5.65 0.22 5.86 3.84 -1.26 -4.54 114.94 126.82 2aqh s ASN 231 Ca 0.00 -1.95 0.21 0.00 0.21 0.00 0.00 52.86 51.33 2aqh s ASN 231 Cb -0.12 -1.99 0.91 0.00 -0.55 0.00 0.00 41.25 39.50 2aqh s ASN 231 CO -0.06 -0.67 1.63 1.15 -2.79 0.00 0.00 177.10 176.35 2aqh n MET 232 N 4.85 0.15 -0.03 0.43 0.00 -1.26 -1.41 117.12 119.84 2aqh n MET 232 Ca -0.07 0.44 0.13 0.00 0.00 0.00 0.00 57.70 58.20 2aqh n MET 232 Cb 0.41 -1.81 0.41 0.00 0.00 0.00 0.00 33.22 32.22 2aqh n MET 232 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2aqh n LYS 233 N -2.09 1.83 -3.93 3.17 5.02 -1.26 0.28 118.16 121.19 2aqh n LYS 233 Ca 0.02 -1.22 -0.31 0.00 -2.02 0.00 0.00 58.31 54.78 2aqh n LYS 233 Cb 0.18 -1.46 -0.15 0.00 -0.02 0.00 0.00 35.03 33.58 2aqh n LYS 233 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2aqh s ASP 234 N -1.85 4.42 0.00 4.39 2.15 -0.50 -4.95 116.67 120.33 2aqh s ASP 234 Ca 0.35 -1.85 0.30 0.00 0.43 0.00 0.00 52.55 51.78 2aqh s ASP 234 Cb 0.20 -1.34 1.41 0.00 -0.30 0.00 0.00 42.92 42.89 2aqh s ASP 234 CO 0.31 -0.36 2.00 0.00 -0.17 0.00 0.00 175.17 176.94 2aqh n ALA 235 N 4.49 2.50 -0.17 3.66 0.00 -1.26 -4.31 120.51 125.42 2aqh n ALA 235 Ca -0.01 -0.15 -0.05 0.00 0.00 0.00 0.00 53.44 53.23 2aqh n ALA 235 Cb 0.42 -1.46 0.04 0.00 0.00 0.00 0.00 19.45 18.45 2aqh n ALA 235 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2aqh h THR 236 N 0.05 1.03 -0.29 0.00 2.02 -1.95 -0.30 112.91 113.47 2aqh h THR 236 Ca 0.00 -0.20 0.03 0.00 0.77 0.00 0.00 66.41 67.01 2aqh h THR 236 Cb 0.34 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2aqh h THR 236 CO 0.00 0.11 0.20 -0.65 0.37 0.00 0.00 175.52 175.54 2aqh h PRO 237 N 0.58 0.26 0.09 6.66 0.11 -1.98 0.45 132.00 138.17 2aqh h PRO 237 Ca 0.21 -0.02 -0.28 0.00 0.11 0.00 0.00 66.00 66.02 2aqh h PRO 237 Cb 0.04 -0.06 0.02 0.00 0.11 0.00 0.00 31.00 31.11 2aqh h PRO 237 CO -0.10 0.17 -1.17 -0.39 -0.21 0.00 0.00 178.00 176.30 2aqh h VAL 238 N 0.27 1.35 -0.92 3.15 -1.51 -1.60 -2.62 116.25 114.37 2aqh h VAL 238 Ca 0.12 -2.55 -0.00 0.00 -1.23 0.00 0.00 66.70 63.04 2aqh h VAL 238 Cb 0.16 2.66 -0.04 0.00 -2.13 0.00 0.00 31.29 31.94 2aqh h VAL 238 CO -0.02 0.77 0.57 0.00 -1.23 0.00 0.00 177.57 177.65 2aqh h ALA 239 N 0.45 1.17 -0.71 5.19 0.00 -0.52 -0.73 119.26 124.11 2aqh h ALA 239 Ca -0.15 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2aqh h ALA 239 Cb 1.84 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 2aqh h ALA 239 CO 0.21 0.61 0.24 0.87 0.00 0.00 0.00 179.25 181.18 2aqh h LYS 240 N 1.26 1.08 -0.32 0.00 1.57 -0.95 -0.86 116.57 118.35 2aqh h LYS 240 Ca 0.33 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.81 2aqh h LYS 240 Cb -0.08 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 2aqh h LYS 240 CO -0.06 0.91 -0.13 1.15 -0.57 0.00 0.00 179.45 180.75 2aqh h THR 241 N 1.04 1.29 -0.36 -0.16 2.02 -0.96 0.24 112.91 116.02 2aqh h THR 241 Ca 0.23 -1.21 0.06 0.00 0.77 0.00 0.00 66.41 66.26 2aqh h THR 241 Cb 0.27 1.41 -0.05 0.00 -1.74 0.00 0.00 68.15 68.03 2aqh h THR 241 CO -0.01 0.39 0.04 0.58 0.37 0.00 0.00 175.52 176.89 2aqh h VAL 242 N 0.41 0.78 -0.82 3.16 2.07 -0.97 -0.87 116.25 120.00 2aqh h VAL 242 Ca 0.07 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.60 2aqh h VAL 242 Cb 0.64 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 2aqh h VAL 242 CO 0.04 0.03 0.54 0.00 0.02 0.00 0.00 177.57 178.20 2aqh h ALA 244 N 1.55 1.02 -0.04 0.00 0.00 0.87 -1.12 119.26 121.54 2aqh h ALA 244 Ca 0.35 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.11 2aqh h ALA 244 Cb 0.19 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2aqh h ALA 244 CO -0.12 0.15 -0.65 -0.07 0.00 0.00 0.00 179.25 178.56 2aqh h LEU 245 N 0.81 0.20 -1.50 0.00 3.38 -0.65 -2.79 115.31 114.76 2aqh h LEU 245 Ca 0.33 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2aqh h LEU 245 Cb 0.18 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2aqh h LEU 245 CO -0.18 0.79 -0.04 -0.07 0.09 0.00 0.00 178.44 179.03 2aqh h LEU 246 N 0.12 0.00-10.83 1.67 3.38 -0.40 -3.46 115.31 105.79 2aqh h LEU 246 Ca -0.01 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.51 2aqh h LEU 246 Cb 1.17 0.00 0.16 0.00 0.09 0.00 0.00 40.66 42.07 2aqh h LEU 246 CO 0.10 0.04 0.37 -0.94 0.09 0.00 0.00 178.44 178.10 2aqh s SER 247 N -5.76 3.17 0.00 -0.43 1.04 -0.48 -4.78 113.70 106.46 2aqh s SER 247 Ca 0.01 0.10 0.10 0.00 0.48 0.00 0.00 55.95 56.63 2aqh s SER 247 Cb 0.09 -0.14 0.34 0.00 0.10 0.00 0.00 66.02 66.41 2aqh s SER 247 CO 0.55 -2.68 1.26 0.47 0.98 0.00 0.00 173.24 173.82 2aqh n ASP 248 N -3.66 1.20 -0.46 7.02 8.00 -1.26 -4.24 116.55 123.15 2aqh n ASP 248 Ca 0.16 -1.92 0.12 0.00 0.71 0.00 0.00 54.79 53.86 2aqh n ASP 248 Cb 0.59 -0.14 0.17 0.00 -0.02 0.00 0.00 41.12 41.72 2aqh n ASP 248 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2aqh n TRP 249 N 0.13 0.00 -3.04 1.24 7.02 -1.26 -4.01 117.44 117.52 2aqh n TRP 249 Ca 0.09 0.00 -0.24 0.00 -1.02 0.00 0.00 57.50 56.33 2aqh n TRP 249 Cb 0.20 -0.04 -0.04 0.00 -2.42 0.00 0.00 31.31 29.02 2aqh n TRP 249 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2aqh n LEU 250 N -0.08 3.22 0.00 -0.99 7.99 -1.26 -4.94 117.00 120.94 2aqh n LEU 250 Ca 0.11 -5.45 0.14 0.00 -0.01 0.00 0.00 56.01 50.80 2aqh n LEU 250 Cb 0.44 -0.13 0.55 0.00 -0.11 0.00 0.00 43.42 44.17 2aqh n LEU 250 CO 0.25 2.33 0.86 -0.81 -1.51 0.00 0.00 177.39 178.51 2aqh n PRO 251 N -0.03 0.00 -0.36 3.23 -0.04 -1.26 -3.09 135.00 133.46 2aqh n PRO 251 Ca 0.29 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.84 2aqh n PRO 251 Cb 0.48 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.67 2aqh n PRO 251 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2aqh n ALA 252 N -1.50 2.82 -3.83 0.55 0.00 -1.26 -4.95 120.51 112.34 2aqh n ALA 252 Ca 0.07 -2.30 -0.34 0.00 0.00 0.00 0.00 53.44 50.87 2aqh n ALA 252 Cb 0.34 -0.64 -0.15 0.00 0.00 0.00 0.00 19.45 19.00 2aqh n ALA 252 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2aqh s THR 253 N -2.73 2.67 0.21 0.00 -1.32 -1.18 -5.09 115.64 108.20 2aqh s THR 253 Ca 0.39 -0.80 -0.10 0.00 -1.21 0.00 0.00 61.69 59.97 2aqh s THR 253 Cb 0.32 -2.21 -0.01 0.00 -1.51 0.00 0.00 72.50 69.09 2aqh s THR 253 CO 0.08 0.44 0.37 0.42 -2.21 0.00 0.00 174.62 173.71 2aqh s THR 254 N 1.36 0.02 -1.94 5.08 -4.23 -1.26 -4.63 115.64 110.05 2aqh s THR 254 Ca 0.04 -1.45 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2aqh s THR 254 Cb -0.14 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.60 2aqh s THR 254 CO -0.08 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.51 2aqh n GLY 255 N -0.31 1.32 3.73 3.99 0.00 0.12 -4.95 105.19 109.10 2aqh n GLY 255 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2aqh n GLY 255 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aqh s ASP 256 N -2.49 4.16 -0.09 1.61 -1.08 -1.21 -4.46 116.67 113.11 2aqh s ASP 256 Ca 0.00 -1.43 0.02 0.00 -0.52 0.00 0.00 52.55 50.62 2aqh s ASP 256 Cb 0.00 0.06 0.02 0.00 -1.46 0.00 0.00 42.92 41.54 2aqh s ASP 256 CO 0.00 -0.71 -0.12 -0.63 0.52 0.00 0.00 175.17 174.23 2aqh s ILE 257 N -2.77 1.22 -0.15 4.11 1.01 -1.26 -0.51 121.20 122.85 2aqh s ILE 257 Ca 0.24 -0.49 -0.06 0.00 0.00 0.00 0.00 60.65 60.34 2aqh s ILE 257 Cb 0.04 -1.14 -0.04 0.00 0.01 0.00 0.00 42.46 41.34 2aqh s ILE 257 CO 0.13 0.38 0.06 -0.63 0.00 0.00 0.00 174.94 174.88 2aqh s ILE 258 N 0.96 4.76 -0.45 2.92 -1.09 0.64 -4.94 121.20 124.00 2aqh s ILE 258 Ca -0.08 -0.06 -0.15 0.00 -2.23 0.00 0.00 60.65 58.13 2aqh s ILE 258 Cb -0.15 -3.10 0.05 0.00 -1.58 0.00 0.00 42.46 37.68 2aqh s ILE 258 CO -0.00 0.51 0.36 -0.31 -1.23 0.00 0.00 174.94 174.27 2aqh s TYR 259 N -0.09 3.24 -1.07 3.97 1.51 -1.26 -0.11 117.35 123.54 2aqh s TYR 259 Ca 0.06 -0.80 -0.05 0.00 -1.01 0.00 0.00 57.07 55.27 2aqh s TYR 259 Cb -0.12 -2.95 0.29 0.00 -0.11 0.00 0.00 41.96 39.07 2aqh s TYR 259 CO 0.01 -0.72 1.26 0.00 -1.11 0.00 0.00 175.55 174.99 2aqh n ALA 260 N 5.19 4.66 -1.66 3.71 0.00 0.95 -4.71 120.51 128.66 2aqh n ALA 260 Ca -0.12 -4.74 0.01 0.00 0.00 0.00 0.00 53.44 48.60 2aqh n ALA 260 Cb 0.45 -2.29 0.02 0.00 0.00 0.00 0.00 19.45 17.63 2aqh n ALA 260 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2aqh n ASP 261 N 1.92 0.34 -0.09 0.00 5.75 -1.26 -1.52 116.55 121.70 2aqh n ASP 261 Ca 0.25 -1.96 -0.01 0.00 -0.01 0.00 0.00 54.79 53.06 2aqh n ASP 261 Cb 0.36 -0.19 -0.00 0.00 -1.03 0.00 0.00 41.12 40.26 2aqh n ASP 261 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2aqh n GLY 262 N -0.19 0.45 2.40 6.12 0.00 -1.26 -2.14 105.19 110.58 2aqh n GLY 262 Ca 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2aqh n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aqh n GLY 263 N -1.97 0.55 0.39 -0.02 0.00 -1.26 -2.66 105.19 100.22 2aqh n GLY 263 Ca -0.01 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.17 2aqh n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqh h ALA 264 N 0.00 2.03 0.00 4.61 0.00 -1.68 -1.61 119.26 122.61 2aqh h ALA 264 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2aqh h ALA 264 Cb 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2aqh h ALA 264 CO 0.00 -0.31 0.00 -2.39 0.00 0.00 0.00 179.25 176.55 2aqh n HIS 265 N -4.56 0.20 0.74 0.00 1.44 -1.26 -2.30 115.22 109.48 2aqh n HIS 265 Ca 0.19 0.07 0.11 0.00 -2.01 0.00 0.00 57.72 56.08 2aqh n HIS 265 Cb 0.61 -0.61 0.27 0.00 0.12 0.00 0.00 29.99 30.38 2aqh n HIS 265 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 2aqh n THR 266 N -1.67 0.34 -4.58 0.61 -2.24 -0.61 -4.90 114.28 101.23 2aqh n THR 266 Ca 0.05 -0.57 -0.22 0.00 -2.27 0.00 0.00 64.05 61.04 2aqh n THR 266 Cb 0.27 0.79 -0.15 0.00 -2.10 0.00 0.00 70.33 69.13 2aqh n THR 266 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2aqh s GLN 267 N -1.66 1.23 -0.14 -0.78 -1.52 -0.97 -5.05 119.66 110.76 2aqh s GLN 267 Ca 0.35 -0.44 -0.22 0.00 -1.95 0.00 0.00 55.36 53.10 2aqh s GLN 267 Cb 0.20 -1.13 -0.25 0.00 -0.22 0.00 0.00 33.01 31.62 2aqh s GLN 267 CO 0.30 0.20 0.55 1.25 -0.25 0.00 0.00 175.29 177.34 2aqh h LEU 268 N 6.17 0.15 0.00 2.90 5.85 -1.90 -3.49 115.31 124.99 2aqh h LEU 268 Ca -0.33 -0.80 0.00 0.00 0.84 0.00 0.00 57.88 57.58 2aqh h LEU 268 Cb 1.17 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.15 2aqh h LEU 268 CO 0.48 1.37 0.00 -0.11 -0.34 0.00 0.00 178.44 179.84