#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aqb s ARG 3 N 0.00 3.06 -0.12 1.97 0.52 -1.26 -4.40 118.95 118.71 2aqb s ARG 3 Ca 0.00 -0.42 0.02 0.00 -0.52 0.00 0.00 55.73 54.82 2aqb s ARG 3 Cb 0.00 -2.86 -0.00 0.00 0.52 0.00 0.00 34.95 32.61 2aqb s ARG 3 CO 0.00 0.68 -0.20 0.00 0.02 0.00 0.00 175.30 175.80 2aqb s ALA 4 N -1.05 2.32 0.28 2.13 0.00 -1.26 -1.30 121.76 122.89 2aqb s ALA 4 Ca 0.18 -0.98 0.11 0.00 0.00 0.00 0.00 51.96 51.27 2aqb s ALA 4 Cb -0.12 -0.98 -0.05 0.00 0.00 0.00 0.00 23.12 21.97 2aqb s ALA 4 CO 0.08 0.19 -0.17 0.14 0.00 0.00 0.00 175.76 175.99 2aqb s VAL 5 N 0.48 2.34 -0.27 0.00 -7.23 0.26 -0.75 120.40 115.23 2aqb s VAL 5 Ca -0.14 -2.35 -0.10 0.00 -1.81 0.00 0.00 61.98 57.59 2aqb s VAL 5 Cb -0.17 -2.33 -0.04 0.00 0.56 0.00 0.00 36.38 34.40 2aqb s VAL 5 CO 0.05 -0.39 0.15 -0.63 -0.31 0.00 0.00 175.10 173.98 2aqb s ILE 6 N -2.59 4.98 -0.43 -0.62 -1.09 -0.15 -0.79 121.20 120.51 2aqb s ILE 6 Ca 0.30 0.06 0.05 0.00 -2.23 0.00 0.00 60.65 58.82 2aqb s ILE 6 Cb -0.03 -3.36 -0.01 0.00 -1.58 0.00 0.00 42.46 37.48 2aqb s ILE 6 CO 0.14 0.28 0.41 0.35 -1.23 0.00 0.00 174.94 174.89 2aqb n THR 7 N 5.00 0.00 -3.51 2.92 -2.24 -0.75 -0.86 114.28 114.84 2aqb n THR 7 Ca -0.15 -0.43 -0.17 0.00 -2.27 0.00 0.00 64.05 61.03 2aqb n THR 7 Cb 0.52 1.05 -0.05 0.00 -2.10 0.00 0.00 70.33 69.74 2aqb n THR 7 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2aqb s GLY 8 N -1.04 -0.57 0.05 3.38 0.00 -1.26 -3.85 107.32 104.04 2aqb s GLY 8 Ca 0.04 1.11 -0.05 0.00 0.00 0.00 0.00 44.72 45.81 2aqb s GLY 8 CO 0.15 0.76 0.10 0.48 0.00 0.00 0.00 173.10 174.58 2aqb s LEU 9 N -1.51 1.83 -0.08 0.66 0.05 -1.26 -0.66 118.68 117.71 2aqb s LEU 9 Ca -0.09 -0.64 -0.17 0.00 0.05 0.00 0.00 54.13 53.29 2aqb s LEU 9 Cb -0.00 0.63 0.04 0.00 -2.05 0.00 0.00 46.19 44.81 2aqb s LEU 9 CO 0.05 -0.58 0.40 -0.83 -0.55 0.00 0.00 176.35 174.85 2aqb s GLY 10 N -2.43 -0.27 -0.20 -3.48 0.00 0.19 -3.30 107.32 97.82 2aqb s GLY 10 Ca -0.01 0.82 -0.17 0.00 0.00 0.00 0.00 44.72 45.36 2aqb s GLY 10 CO -0.07 0.62 0.53 -1.50 0.00 0.00 0.00 173.10 172.67 2aqb s ILE 11 N -0.62 -0.00 -0.28 0.90 2.07 -1.26 -1.20 121.20 120.80 2aqb s ILE 11 Ca -0.07 0.01 0.00 0.00 -1.41 0.00 0.00 60.65 59.18 2aqb s ILE 11 Cb -0.04 -0.74 0.08 0.00 0.13 0.00 0.00 42.46 41.90 2aqb s ILE 11 CO 0.03 0.00 0.04 -0.69 -1.91 0.00 0.00 174.94 172.42 2aqb s VAL 12 N 0.46 1.24 0.31 4.00 1.01 -0.61 -3.39 120.40 123.42 2aqb s VAL 12 Ca -0.01 -1.40 0.03 0.00 0.00 0.00 0.00 61.98 60.59 2aqb s VAL 12 Cb -0.04 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2aqb s VAL 12 CO -0.02 -0.45 0.12 -0.94 0.00 0.00 0.00 175.10 173.81 2aqb s SER 13 N 1.47 1.80 0.62 3.32 1.04 0.08 -0.83 113.70 121.20 2aqb s SER 13 Ca 0.04 -1.49 0.36 0.00 0.48 0.00 0.00 55.95 55.35 2aqb s SER 13 Cb -0.18 0.25 2.05 0.00 0.10 0.00 0.00 66.02 68.24 2aqb s SER 13 CO -0.15 -0.79 2.29 0.77 0.98 0.00 0.00 173.24 176.33 2aqb h SER 14 N 2.17 0.00 -0.33 7.02 4.64 -1.75 -2.56 113.55 122.74 2aqb h SER 14 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2aqb h SER 14 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2aqb h SER 14 CO 0.59 0.01 0.00 2.30 -0.87 0.00 0.00 176.83 178.86 2aqb n ILE 15 N -3.47 0.75 0.00 0.95 -5.35 -1.26 -4.43 119.36 106.55 2aqb n ILE 15 Ca -0.03 -0.87 0.00 0.00 -0.27 0.00 0.00 62.75 61.58 2aqb n ILE 15 Cb 0.10 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 38.70 2aqb n ILE 15 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2aqb n GLY 16 N 0.78 3.26 0.98 3.28 0.00 -0.97 -3.93 105.19 108.59 2aqb n GLY 16 Ca 0.13 -0.30 0.11 0.00 0.00 0.00 0.00 46.02 45.96 2aqb n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2aqb n ASN 17 N 0.00 2.92 -3.40 1.61 3.02 -1.26 -0.74 115.26 117.41 2aqb n ASN 17 Ca 0.00 -1.92 -0.08 0.00 -0.03 0.00 0.00 54.58 52.55 2aqb n ASN 17 Cb 0.00 -0.22 -0.00 0.00 -0.61 0.00 0.00 39.78 38.95 2aqb n ASN 17 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2aqb s ASN 18 N -1.46 -0.05 0.47 6.41 2.20 -1.22 -4.64 114.94 116.65 2aqb s ASN 18 Ca 0.37 -0.94 0.17 0.00 -0.94 0.00 0.00 52.86 51.51 2aqb s ASN 18 Cb 0.21 0.77 1.11 0.00 -2.00 0.00 0.00 41.25 41.35 2aqb s ASN 18 CO 0.30 -1.49 2.03 0.06 -2.94 0.00 0.00 177.10 175.05 2aqb h GLN 19 N 2.03 0.00 -0.15 3.55 3.07 -1.92 -2.03 115.11 119.66 2aqb h GLN 19 Ca -0.26 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.41 2aqb h GLN 19 Cb 1.25 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.81 2aqb h GLN 19 CO 0.33 0.15 -0.16 1.96 0.09 0.00 0.00 178.83 181.21 2aqb h GLN 20 N 0.00 0.38 -0.48 0.06 7.50 -1.99 -0.19 115.11 120.40 2aqb h GLN 20 Ca -0.00 -0.20 -0.09 0.00 0.50 0.00 0.00 58.65 58.86 2aqb h GLN 20 Cb 0.28 0.01 -0.02 0.00 0.05 0.00 0.00 27.48 27.80 2aqb h GLN 20 CO 0.02 0.76 -0.07 0.93 -1.50 0.00 0.00 178.83 178.97 2aqb h GLU 21 N 0.01 0.84 -0.23 1.46 5.08 -1.86 -2.57 114.58 117.31 2aqb h GLU 21 Ca 0.02 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2aqb h GLU 21 Cb 0.69 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 2aqb h GLU 21 CO 0.04 0.88 0.07 0.28 -1.00 0.00 0.00 179.01 179.28 2aqb h VAL 22 N 0.77 1.19 -0.40 3.13 2.07 -1.38 -2.00 116.25 119.63 2aqb h VAL 22 Ca 0.14 -0.62 0.08 0.00 0.82 0.00 0.00 66.70 67.12 2aqb h VAL 22 Cb 0.56 1.17 -0.09 0.00 -1.52 0.00 0.00 31.29 31.40 2aqb h VAL 22 CO 0.03 0.20 -0.28 0.25 0.02 0.00 0.00 177.57 177.79 2aqb h LEU 23 N 0.20 -0.94 -0.34 2.57 6.46 -0.92 -0.31 115.31 122.03 2aqb h LEU 23 Ca 0.07 0.18 0.00 0.00 -0.12 0.00 0.00 57.88 58.01 2aqb h LEU 23 Cb 0.24 0.46 -0.02 0.00 -0.73 0.00 0.00 40.66 40.61 2aqb h LEU 23 CO -0.00 -0.29 0.21 0.00 -0.62 0.00 0.00 178.44 177.74 2aqb h ALA 24 N 0.90 0.43 -0.74 1.25 0.00 -1.39 -0.82 119.26 118.89 2aqb h ALA 24 Ca 0.18 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2aqb h ALA 24 Cb 0.51 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 2aqb h ALA 24 CO -0.52 -0.09 0.45 0.77 0.00 0.00 0.00 179.25 179.85 2aqb h SER 25 N 0.44 0.70 0.00 0.00 0.02 -0.96 -1.69 113.55 112.08 2aqb h SER 25 Ca 0.12 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2aqb h SER 25 Cb -0.02 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.39 2aqb h SER 25 CO -0.02 0.47 -0.00 -0.07 -1.14 0.00 0.00 176.83 176.06 2aqb h LEU 26 N 0.84 -0.00 -2.41 5.07 3.38 -0.70 -0.32 115.31 121.16 2aqb h LEU 26 Ca 0.31 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2aqb h LEU 26 Cb 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2aqb h LEU 26 CO -0.15 0.33 -0.00 0.03 0.09 0.00 0.00 178.44 178.74 2aqb h ARG 27 N -0.34 0.00 -0.01 1.13 3.08 -1.03 -2.75 114.38 114.46 2aqb h ARG 27 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2aqb h ARG 27 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 2aqb h ARG 27 CO 0.00 0.00 -0.55 0.39 -1.07 0.00 0.00 179.97 178.75 2aqb n GLU 28 N -3.93 0.74 -2.96 0.04 1.02 -0.65 -4.76 120.64 110.14 2aqb n GLU 28 Ca -0.03 -0.56 -0.18 0.00 -0.02 0.00 0.00 57.16 56.37 2aqb n GLU 28 Cb 0.08 -1.49 0.04 0.00 -0.02 0.00 0.00 31.44 30.05 2aqb n GLU 28 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2aqb n GLY 29 N 1.43 -0.24 3.68 0.62 0.00 -0.58 -4.96 105.19 105.15 2aqb n GLY 29 Ca 0.08 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 2aqb n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2aqb s ARG 30 N -5.56 4.32 0.24 1.61 3.52 -0.24 -4.99 118.95 117.85 2aqb s ARG 30 Ca 0.28 0.85 -0.30 0.00 -0.13 0.00 0.00 55.73 56.44 2aqb s ARG 30 Cb -0.13 -3.53 -0.09 0.00 -1.56 0.00 0.00 34.95 29.65 2aqb s ARG 30 CO 0.35 -0.16 1.19 0.45 -0.81 0.00 0.00 175.30 176.32 2aqb s SER 31 N 1.04 7.08 -0.04 -2.12 0.15 -1.26 -4.80 113.70 113.74 2aqb s SER 31 Ca 0.35 2.32 0.21 0.00 0.70 0.00 0.00 55.95 59.53 2aqb s SER 31 Cb -0.17 -2.62 0.67 0.00 -1.71 0.00 0.00 66.02 62.19 2aqb s SER 31 CO 0.14 -0.33 1.57 0.61 1.20 0.00 0.00 173.24 176.42 2aqb n GLY 32 N 1.68 2.62 3.75 9.45 0.00 -0.04 -4.96 105.19 117.70 2aqb n GLY 32 Ca 0.02 -0.81 -0.38 0.00 0.00 0.00 0.00 46.02 44.86 2aqb n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2aqb s ILE 33 N -1.34 5.16 0.30 -0.61 -1.09 -1.26 -3.88 121.20 118.49 2aqb s ILE 33 Ca 0.49 0.87 0.04 0.00 -2.23 0.00 0.00 60.65 59.82 2aqb s ILE 33 Cb 0.28 -3.77 -0.06 0.00 -1.58 0.00 0.00 42.46 37.33 2aqb s ILE 33 CO 0.29 0.39 0.04 0.42 -1.23 0.00 0.00 174.94 174.86 2aqb s THR 34 N 0.22 1.15 0.23 2.92 -4.23 -0.32 -4.26 115.64 111.34 2aqb s THR 34 Ca 0.24 -2.02 -0.30 0.00 -1.18 0.00 0.00 61.69 58.43 2aqb s THR 34 Cb -0.15 -2.67 -0.09 0.00 1.34 0.00 0.00 72.50 70.94 2aqb s THR 34 CO 0.10 -0.09 1.11 0.12 -0.54 0.00 0.00 174.62 175.32 2aqb s PHE 35 N -3.33 3.57 -0.28 3.99 2.19 -1.26 -1.46 117.98 121.40 2aqb s PHE 35 Ca 0.35 1.63 0.01 0.00 0.33 0.00 0.00 56.93 59.24 2aqb s PHE 35 Cb 0.08 -3.30 0.05 0.00 -1.31 0.00 0.00 43.02 38.54 2aqb s PHE 35 CO 0.14 -0.65 -0.06 0.45 1.83 0.00 0.00 175.22 176.93 2aqb s SER 36 N -0.46 4.61 0.26 6.13 0.15 0.73 -4.89 113.70 120.22 2aqb s SER 36 Ca 0.47 -1.30 -0.02 0.00 0.70 0.00 0.00 55.95 55.81 2aqb s SER 36 Cb -0.31 -1.63 0.33 0.00 -1.71 0.00 0.00 66.02 62.70 2aqb s SER 36 CO 0.38 -0.21 1.75 -0.61 1.20 0.00 0.00 173.24 175.74 2aqb h GLN 37 N 7.89 0.77 -0.40 5.44 5.75 -1.97 -2.63 115.11 129.96 2aqb h GLN 37 Ca -0.21 -0.22 0.05 0.00 -0.15 0.00 0.00 58.65 58.12 2aqb h GLN 37 Cb 1.06 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 29.48 2aqb h GLN 37 CO 0.50 0.80 0.13 1.49 -2.65 0.00 0.00 178.83 179.10 2aqb h GLU 38 N 0.71 0.27 -0.40 1.69 4.81 -1.96 0.41 114.58 120.12 2aqb h GLU 38 Ca 0.13 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.30 2aqb h GLU 38 Cb 0.49 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 2aqb h GLU 38 CO 0.02 0.18 0.06 -0.07 -0.73 0.00 0.00 179.01 178.48 2aqb h LEU 39 N 0.28 0.64 -0.15 1.64 3.38 -1.87 -2.52 115.31 116.71 2aqb h LEU 39 Ca 0.19 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.90 2aqb h LEU 39 Cb 0.18 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2aqb h LEU 39 CO -0.20 0.74 0.07 0.50 0.09 0.00 0.00 178.44 179.64 2aqb h LYS 40 N 0.52 0.16 -0.01 1.13 3.64 -1.17 -2.75 116.57 118.08 2aqb h LYS 40 Ca 0.12 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2aqb h LYS 40 Cb 0.38 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2aqb h LYS 40 CO 0.01 0.10 0.01 -0.44 -2.27 0.00 0.00 179.45 176.86 2aqb h ASP 41 N 0.16 0.00 0.92 4.20 3.32 -0.15 -2.55 116.42 122.32 2aqb h ASP 41 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2aqb h ASP 41 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2aqb h ASP 41 CO -0.04 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.94 2aqb n SER 42 N -4.06 0.15 0.00 6.45 3.41 -0.95 -4.89 113.62 113.72 2aqb n SER 42 Ca -0.03 0.52 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 2aqb n SER 42 Cb 0.09 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 2aqb n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2aqb n GLY 43 N 1.01 0.82 3.79 5.00 0.00 -0.96 -5.09 105.19 109.76 2aqb n GLY 43 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 2aqb n GLY 43 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2aqb s MET 44 N -0.84 2.31 -0.05 1.61 -1.94 -1.15 -5.00 119.30 114.24 2aqb s MET 44 Ca 0.00 0.93 0.18 0.00 -1.71 0.00 0.00 55.69 55.09 2aqb s MET 44 Cb 0.00 -1.92 -0.22 0.00 2.01 0.00 0.00 34.83 34.70 2aqb s MET 44 CO 0.00 -1.54 0.51 0.54 -0.01 0.00 0.00 175.02 174.52 2aqb n ARG 45 N -3.42 0.65 -3.17 2.03 1.74 -1.26 -4.74 116.66 108.49 2aqb n ARG 45 Ca 0.08 0.07 -0.40 0.00 -0.77 0.00 0.00 57.85 56.83 2aqb n ARG 45 Cb 0.54 -1.66 -0.07 0.00 -1.02 0.00 0.00 32.46 30.26 2aqb n ARG 45 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2aqb s SER 46 N -5.45 6.56 -0.17 0.55 0.15 -1.26 -4.68 113.70 109.40 2aqb s SER 46 Ca -0.06 0.68 0.15 0.00 0.70 0.00 0.00 55.95 57.42 2aqb s SER 46 Cb 0.09 -2.32 0.35 0.00 -1.71 0.00 0.00 66.02 62.43 2aqb s SER 46 CO 0.84 -0.29 1.19 1.41 1.20 0.00 0.00 173.24 177.58 2aqb n HIS 47 N 5.36 0.01 -4.49 3.44 8.25 -1.26 -4.51 115.22 122.02 2aqb n HIS 47 Ca -0.02 -1.23 -0.26 0.00 -0.26 0.00 0.00 57.72 55.95 2aqb n HIS 47 Cb 0.50 -0.20 -0.13 0.00 1.12 0.00 0.00 29.99 31.27 2aqb n HIS 47 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2aqb s VAL 48 N -3.05 1.84 0.15 1.59 -7.23 -1.26 -0.20 120.40 112.25 2aqb s VAL 48 Ca 0.35 -1.45 -0.19 0.00 -1.81 0.00 0.00 61.98 58.88 2aqb s VAL 48 Cb 0.32 -1.63 0.05 0.00 0.56 0.00 0.00 36.38 35.68 2aqb s VAL 48 CO -0.02 0.10 0.49 -1.66 -0.31 0.00 0.00 175.10 173.71 2aqb s TRP 49 N -0.98 -0.32 -0.92 2.82 -2.14 -0.53 -4.40 118.94 112.47 2aqb s TRP 49 Ca 0.09 0.04 -0.13 0.00 2.66 0.00 0.00 56.10 58.76 2aqb s TRP 49 Cb -0.10 0.39 0.23 0.00 -3.10 0.00 0.00 33.47 30.90 2aqb s TRP 49 CO 0.03 -0.79 0.88 0.20 -2.66 0.00 0.00 176.95 174.62 2aqb s GLY 50 N -2.79 2.82 0.18 3.67 0.00 0.26 -1.18 107.32 110.27 2aqb s GLY 50 Ca 0.03 -3.47 -0.13 0.00 0.00 0.00 0.00 44.72 41.15 2aqb s GLY 50 CO -0.11 1.30 0.57 0.54 0.00 0.00 0.00 173.10 175.41 2aqb s ASN 51 N 1.95 6.79 -0.15 1.64 4.22 -1.25 -1.79 114.94 126.35 2aqb s ASN 51 Ca 0.22 1.07 -0.29 0.00 -2.14 0.00 0.00 52.86 51.72 2aqb s ASN 51 Cb -0.10 -2.29 -0.03 0.00 1.28 0.00 0.00 41.25 40.12 2aqb s ASN 51 CO -0.09 0.03 1.46 -0.69 -2.04 0.00 0.00 177.10 175.77 2aqb s VAL 52 N -1.59 3.94 -1.27 3.54 1.01 -1.26 -4.17 120.40 120.59 2aqb s VAL 52 Ca 0.42 1.12 -0.10 0.00 0.00 0.00 0.00 61.98 63.42 2aqb s VAL 52 Cb -0.14 -3.78 0.17 0.00 0.00 0.00 0.00 36.38 32.64 2aqb s VAL 52 CO 0.20 -0.16 1.83 0.29 0.00 0.00 0.00 175.10 177.25 2aqb n LYS 53 N 7.01 3.62 -3.64 2.72 4.76 -1.26 -4.86 118.16 126.51 2aqb n LYS 53 Ca 0.16 -3.58 -0.06 0.00 -2.87 0.00 0.00 58.31 51.96 2aqb n LYS 53 Cb 0.44 -2.93 -0.07 0.00 -1.84 0.00 0.00 35.03 30.64 2aqb n LYS 53 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2aqb s LEU 54 N -0.03 -0.97 -0.41 -0.35 2.96 -1.26 -4.98 118.68 113.64 2aqb s LEU 54 Ca 0.40 1.52 -0.25 0.00 -0.22 0.00 0.00 54.13 55.58 2aqb s LEU 54 Cb 0.08 2.37 0.02 0.00 0.50 0.00 0.00 46.19 49.16 2aqb s LEU 54 CO 0.01 -0.24 0.91 -0.62 -1.32 0.00 0.00 176.35 175.09 2aqb s ASP 55 N 1.82 6.59 0.00 3.68 3.68 -1.26 -4.93 116.67 126.25 2aqb s ASP 55 Ca -0.09 0.37 0.29 0.00 2.13 0.00 0.00 52.55 55.25 2aqb s ASP 55 Cb -0.06 -2.45 1.29 0.00 -1.45 0.00 0.00 42.92 40.25 2aqb s ASP 55 CO -0.20 -0.93 1.88 0.35 0.13 0.00 0.00 175.17 176.41 2aqb n THR 56 N 6.14 0.00 -1.67 1.71 -2.24 -1.26 -4.91 114.28 112.05 2aqb n THR 56 Ca 0.06 -0.15 -0.48 0.00 -2.27 0.00 0.00 64.05 61.21 2aqb n THR 56 Cb 0.48 0.15 -0.05 0.00 -2.10 0.00 0.00 70.33 68.82 2aqb n THR 56 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2aqb n THR 57 N -0.32 0.30 -0.84 4.28 -1.04 -1.26 -2.52 114.28 112.87 2aqb n THR 57 Ca 0.20 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 2aqb n THR 57 Cb 0.28 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.17 2aqb n THR 57 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2aqb n GLY 58 N 3.87 0.98 0.12 3.41 0.00 -1.26 -4.88 105.19 107.44 2aqb n GLY 58 Ca 0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.35 2aqb n GLY 58 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2aqb h LEU 59 N 0.00 0.00 -8.36 0.99 3.38 -1.85 -3.44 115.31 106.04 2aqb h LEU 59 Ca 0.00 -0.03 -0.61 0.00 0.09 0.00 0.00 57.88 57.32 2aqb h LEU 59 Cb 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 40.44 2aqb h LEU 59 CO 0.00 0.02 -0.86 -0.63 0.09 0.00 0.00 178.44 177.06 2aqb s ILE 60 N -3.14 1.68 -0.03 1.22 1.01 -1.26 -5.09 121.20 115.58 2aqb s ILE 60 Ca 0.09 -0.87 -0.40 0.00 0.00 0.00 0.00 60.65 59.47 2aqb s ILE 60 Cb 0.11 -1.42 -0.20 0.00 0.01 0.00 0.00 42.46 40.96 2aqb s ILE 60 CO 0.64 0.47 1.15 -0.67 0.00 0.00 0.00 174.94 176.53 2aqb n ASP 61 N 2.94 0.32 -0.25 3.58 4.64 -1.26 -4.64 116.55 121.88 2aqb n ASP 61 Ca -0.17 1.16 0.02 0.00 -1.38 0.00 0.00 54.79 54.41 2aqb n ASP 61 Cb 0.53 -0.96 0.10 0.00 -1.04 0.00 0.00 41.12 39.75 2aqb n ASP 61 CO 0.00 0.00 0.00 -0.09 -0.82 0.00 0.00 177.20 176.29 2aqb h ARG 62 N 3.39 0.03 0.00 -0.67 2.43 -1.98 0.12 114.38 117.71 2aqb h ARG 62 Ca -0.50 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2aqb h ARG 62 Cb 1.41 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.96 2aqb h ARG 62 CO 0.69 0.02 0.00 1.63 -1.51 0.00 0.00 179.97 180.80 2aqb n LYS 63 N -5.44 0.10 -0.14 0.20 5.02 -1.26 -2.01 118.16 114.64 2aqb n LYS 63 Ca 0.10 0.37 -0.26 0.00 -2.02 0.00 0.00 58.31 56.50 2aqb n LYS 63 Cb 0.39 -1.70 -0.11 0.00 -0.02 0.00 0.00 35.03 33.59 2aqb n LYS 63 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2aqb n VAL 64 N -1.89 1.50 0.40 -0.18 0.31 0.04 -4.50 118.33 114.02 2aqb n VAL 64 Ca 0.02 -0.45 0.13 0.00 -0.01 0.00 0.00 64.34 64.04 2aqb n VAL 64 Cb 0.18 -1.72 0.51 0.00 -0.91 0.00 0.00 33.84 31.90 2aqb n VAL 64 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 2aqb h VAL 65 N -0.65 0.00 0.00 2.52 3.04 -0.82 -3.10 116.25 117.24 2aqb h VAL 65 Ca -0.66 -0.33 -0.02 0.00 -1.01 0.00 0.00 66.70 64.68 2aqb h VAL 65 Cb 1.71 1.16 -0.00 0.00 -2.01 0.00 0.00 31.29 32.14 2aqb h VAL 65 CO -0.31 0.00 -0.11 0.08 -1.01 0.00 0.00 177.57 176.23 2aqb h ARG 66 N 0.00 0.00 -0.00 4.17 0.11 -1.63 -1.53 114.38 115.50 2aqb h ARG 66 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2aqb h ARG 66 Cb 0.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 2aqb h ARG 66 CO 0.00 0.11 -0.23 1.19 0.10 0.00 0.00 179.97 181.14 2aqb n PHE 67 N -3.95 0.00 -4.08 4.08 3.72 -1.17 -4.85 117.46 111.21 2aqb n PHE 67 Ca -0.02 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.02 2aqb n PHE 67 Cb 0.20 -0.28 -0.07 0.00 -0.94 0.00 0.00 39.48 38.38 2aqb n PHE 67 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 2aqb s MET 68 N -2.79 3.23 0.69 -1.08 -1.94 -0.58 -2.97 119.30 113.87 2aqb s MET 68 Ca 0.19 -0.28 0.00 0.00 -1.71 0.00 0.00 55.69 53.89 2aqb s MET 68 Cb 0.19 -3.01 0.11 0.00 2.01 0.00 0.00 34.83 34.13 2aqb s MET 68 CO 0.57 0.73 0.95 -1.54 -0.01 0.00 0.00 175.02 175.73 2aqb s SER 69 N -1.10 4.52 0.23 3.03 1.04 -1.26 -4.92 113.70 115.23 2aqb s SER 69 Ca 0.16 -0.35 -0.07 0.00 0.48 0.00 0.00 55.95 56.17 2aqb s SER 69 Cb -0.12 -0.11 0.29 0.00 0.10 0.00 0.00 66.02 66.18 2aqb s SER 69 CO 0.05 -1.73 1.85 0.44 0.98 0.00 0.00 173.24 174.82 2aqb h ASP 70 N -0.40 0.78 -0.63 7.02 3.45 -1.94 -0.99 116.42 123.70 2aqb h ASP 70 Ca -0.37 0.01 0.10 0.00 0.43 0.00 0.00 57.03 57.21 2aqb h ASP 70 Cb 1.27 -0.15 -0.08 0.00 -0.56 0.00 0.00 39.33 39.82 2aqb h ASP 70 CO 0.42 0.51 0.22 0.00 -1.57 0.00 0.00 179.24 178.82 2aqb h ALA 71 N 1.37 0.81 -0.43 3.45 0.00 -1.87 0.05 119.26 122.64 2aqb h ALA 71 Ca 0.34 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 55.21 2aqb h ALA 71 Cb 0.13 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2aqb h ALA 71 CO -0.16 -0.22 -0.28 0.77 0.00 0.00 0.00 179.25 179.36 2aqb h SER 72 N 0.39 0.98 0.01 0.00 0.02 -1.76 -2.29 113.55 110.90 2aqb h SER 72 Ca 0.32 -0.40 0.01 0.00 -0.84 0.00 0.00 61.79 60.89 2aqb h SER 72 Cb 0.43 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 2aqb h SER 72 CO -0.34 1.19 -0.08 0.40 -1.14 0.00 0.00 176.83 176.86 2aqb h ILE 73 N 0.80 0.80 -0.49 3.27 2.04 -0.42 0.12 117.51 123.63 2aqb h ILE 73 Ca 0.09 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.95 2aqb h ILE 73 Cb 0.86 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.72 2aqb h ILE 73 CO 0.08 0.00 0.30 1.88 0.00 0.00 0.00 178.15 180.41 2aqb h TYR 74 N -0.14 0.64 -0.55 1.37 0.05 -1.02 -1.37 116.97 115.94 2aqb h TYR 74 Ca 0.03 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.78 2aqb h TYR 74 Cb 0.18 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.68 2aqb h TYR 74 CO -0.14 0.44 0.23 0.00 -1.05 0.00 0.00 178.16 177.63 2aqb h ALA 75 N 1.15 0.72 -0.05 3.88 0.00 -1.31 -1.47 119.26 122.18 2aqb h ALA 75 Ca 0.18 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2aqb h ALA 75 Cb -0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2aqb h ALA 75 CO -0.03 0.33 -0.01 0.35 0.00 0.00 0.00 179.25 179.88 2aqb h PHE 76 N 0.75 -0.03 -0.67 0.00 3.04 -0.74 0.16 116.94 119.46 2aqb h PHE 76 Ca 0.19 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.12 2aqb h PHE 76 Cb 0.19 0.02 -0.03 0.00 2.56 0.00 0.00 35.95 38.69 2aqb h PHE 76 CO 0.01 -0.02 0.33 -0.07 -2.02 0.00 0.00 178.31 176.53 2aqb h LEU 77 N 0.00 0.88 -0.92 0.59 3.38 -1.23 -0.91 115.31 117.10 2aqb h LEU 77 Ca 0.03 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 57.90 2aqb h LEU 77 Cb 0.04 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 2aqb h LEU 77 CO -0.05 0.76 0.60 0.28 0.09 0.00 0.00 178.44 180.11 2aqb h SER 78 N 0.93 0.99 -0.49 -0.43 0.02 -1.03 -2.82 113.55 110.73 2aqb h SER 78 Ca 0.23 -0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 61.06 2aqb h SER 78 Cb 0.11 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 2aqb h SER 78 CO -0.03 0.68 -0.14 -0.03 -1.14 0.00 0.00 176.83 176.17 2aqb h MET 79 N 1.15 0.98 -0.58 3.45 1.85 0.11 -1.80 114.93 120.10 2aqb h MET 79 Ca 0.37 -0.37 0.07 0.00 -0.61 0.00 0.00 59.70 59.15 2aqb h MET 79 Cb 0.01 -0.06 -0.06 0.00 0.43 0.00 0.00 31.60 31.93 2aqb h MET 79 CO -0.12 1.05 0.27 0.93 -0.40 0.00 0.00 176.91 178.64 2aqb h GLU 80 N 0.87 0.50 -0.65 0.39 5.08 -1.05 -0.39 114.58 119.32 2aqb h GLU 80 Ca 0.13 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 2aqb h GLU 80 Cb 0.70 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 2aqb h GLU 80 CO 0.05 0.33 0.24 1.96 -1.00 0.00 0.00 179.01 180.59 2aqb h GLN 81 N 0.51 0.99 -0.36 2.33 4.20 -1.29 -2.45 115.11 119.04 2aqb h GLN 81 Ca 0.27 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2aqb h GLN 81 Cb 0.23 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2aqb h GLN 81 CO -0.22 0.84 0.07 0.00 -0.67 0.00 0.00 178.83 178.86 2aqb h ALA 82 N 1.10 0.48 -0.18 3.87 0.00 -0.88 0.20 119.26 123.85 2aqb h ALA 82 Ca 0.22 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2aqb h ALA 82 Cb 0.24 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2aqb h ALA 82 CO -0.01 0.18 -0.08 0.82 0.00 0.00 0.00 179.25 180.15 2aqb h ILE 83 N 0.44 0.74 -0.47 0.00 2.04 -1.04 0.14 117.51 119.36 2aqb h ILE 83 Ca 0.11 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.94 2aqb h ILE 83 Cb 0.34 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2aqb h ILE 83 CO 0.01 0.00 0.15 0.00 0.00 0.00 0.00 178.15 178.31 2aqb h ALA 84 N 1.10 0.61 -0.55 1.87 0.00 -1.36 -1.62 119.26 119.31 2aqb h ALA 84 Ca 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2aqb h ALA 84 Cb 0.20 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2aqb h ALA 84 CO -0.22 0.25 0.25 0.22 0.00 0.00 0.00 179.25 179.76 2aqb h ASP 85 N 0.62 0.70 1.06 0.00 3.58 -0.36 -2.06 116.42 119.96 2aqb h ASP 85 Ca 0.15 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.53 2aqb h ASP 85 Cb 0.25 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.13 2aqb h ASP 85 CO -0.01 0.60 0.00 0.00 -2.88 0.00 0.00 179.24 176.96 2aqb n ALA 86 N -2.45 2.17 -2.78 -0.78 0.00 0.46 -4.75 120.51 112.39 2aqb n ALA 86 Ca 0.05 -0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2aqb n ALA 86 Cb 0.13 -1.43 0.03 0.00 0.00 0.00 0.00 19.45 18.18 2aqb n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aqb n GLY 87 N 1.12 -0.03 3.60 0.00 0.00 -0.77 -4.82 105.19 104.29 2aqb n GLY 87 Ca 0.06 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 2aqb n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aqb s LEU 88 N -4.29 4.05 0.72 0.99 1.43 -0.67 -5.04 118.68 115.87 2aqb s LEU 88 Ca 0.21 0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 53.44 2aqb s LEU 88 Cb -0.09 -2.40 0.02 0.00 0.03 0.00 0.00 46.19 43.75 2aqb s LEU 88 CO 0.25 -0.18 1.07 -0.94 0.23 0.00 0.00 176.35 176.78 2aqb s SER 89 N 1.65 5.09 0.31 2.29 1.04 -1.26 -4.71 113.70 118.12 2aqb s SER 89 Ca 0.14 1.63 0.05 0.00 0.48 0.00 0.00 55.95 58.26 2aqb s SER 89 Cb -0.16 -2.46 0.69 0.00 0.10 0.00 0.00 66.02 64.20 2aqb s SER 89 CO 0.10 -1.63 1.83 -0.65 0.98 0.00 0.00 173.24 173.87 2aqb h PRO 90 N -0.85 0.81 0.00 4.02 0.11 -1.98 -1.95 132.00 132.15 2aqb h PRO 90 Ca -0.44 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2aqb h PRO 90 Cb 1.22 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2aqb h PRO 90 CO 0.56 0.53 -0.20 1.05 -0.21 0.00 0.00 178.00 179.73 2aqb h GLU 91 N 0.83 0.00 -0.26 1.05 9.09 -1.93 0.18 114.58 123.54 2aqb h GLU 91 Ca 0.51 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.80 2aqb h GLU 91 Cb 0.69 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.79 2aqb h GLU 91 CO -0.28 0.20 -0.28 0.00 0.05 0.00 0.00 179.01 178.70 2aqb h ALA 92 N 1.80 0.39 0.00 1.06 0.00 -1.72 -3.40 119.26 117.38 2aqb h ALA 92 Ca -0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2aqb h ALA 92 Cb 0.47 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2aqb h ALA 92 CO 0.03 0.40 -1.28 2.48 0.00 0.00 0.00 179.25 180.87 2aqb n TYR 93 N -4.29 0.00 -2.89 0.00 0.18 -1.09 -4.96 117.16 104.12 2aqb n TYR 93 Ca -0.04 0.00 -0.31 0.00 1.88 0.00 0.00 57.90 59.42 2aqb n TYR 93 Cb 0.46 -0.15 -0.04 0.00 -0.38 0.00 0.00 39.34 39.23 2aqb n TYR 93 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 2aqb s GLN 94 N -2.39 3.91 -1.60 -3.48 -0.21 0.61 -4.13 119.66 112.36 2aqb s GLN 94 Ca -0.02 0.65 -0.15 0.00 0.02 0.00 0.00 55.36 55.86 2aqb s GLN 94 Cb 0.04 -2.35 0.11 0.00 1.00 0.00 0.00 33.01 31.80 2aqb s GLN 94 CO 0.25 -0.00 0.83 0.09 -2.12 0.00 0.00 175.29 174.33 2aqb n ASN 95 N -0.97 -3.54 -3.84 5.90 3.02 -0.12 -4.83 115.26 110.88 2aqb n ASN 95 Ca 0.04 -0.92 -0.29 0.00 -0.03 0.00 0.00 54.58 53.37 2aqb n ASN 95 Cb 0.54 -3.24 -0.16 0.00 -0.61 0.00 0.00 39.78 36.31 2aqb n ASN 95 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2aqb s ASN 96 N -3.43 3.58 0.65 6.41 3.84 -1.26 -4.96 114.94 119.77 2aqb s ASN 96 Ca 0.63 -1.16 0.33 0.00 0.21 0.00 0.00 52.86 52.86 2aqb s ASN 96 Cb -0.33 -0.94 1.81 0.00 -0.55 0.00 0.00 41.25 41.25 2aqb s ASN 96 CO 0.89 -0.30 2.06 -0.65 -2.79 0.00 0.00 177.10 176.31 2aqb h PRO 97 N 8.07 0.00 -0.15 0.43 0.11 -1.92 -1.16 132.00 137.37 2aqb h PRO 97 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 2aqb h PRO 97 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2aqb h PRO 97 CO 0.40 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.73 2aqb n ARG 98 N -3.19 1.78 -4.53 1.05 5.12 -1.26 -3.94 116.66 111.70 2aqb n ARG 98 Ca -0.01 -1.17 -0.33 0.00 -1.93 0.00 0.00 57.85 54.42 2aqb n ARG 98 Cb 0.32 -1.42 -0.16 0.00 -1.16 0.00 0.00 32.46 30.04 2aqb n ARG 98 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2aqb s VAL 99 N -1.82 2.37 0.30 1.55 1.01 -0.44 -0.30 120.40 123.07 2aqb s VAL 99 Ca 0.34 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.48 2aqb s VAL 99 Cb 0.19 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 2aqb s VAL 99 CO 0.28 0.53 0.09 0.61 0.00 0.00 0.00 175.10 176.61 2aqb n GLY 100 N 4.15 3.51 3.05 4.51 0.00 0.39 0.05 105.19 120.85 2aqb n GLY 100 Ca -0.20 -2.08 -0.13 0.00 0.00 0.00 0.00 46.02 43.61 2aqb n GLY 100 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2aqb s LEU 101 N 0.00 -0.22 -0.27 0.99 1.98 0.55 -0.97 118.68 120.74 2aqb s LEU 101 Ca 0.13 0.64 -0.00 0.00 -2.89 0.00 0.00 54.13 52.01 2aqb s LEU 101 Cb 0.01 0.80 0.08 0.00 0.66 0.00 0.00 46.19 47.74 2aqb s LEU 101 CO 0.09 -0.23 0.04 -0.63 -1.89 0.00 0.00 176.35 173.74 2aqb s ILE 102 N 2.21 1.17 -0.14 6.68 1.01 -0.02 -2.63 121.20 129.48 2aqb s ILE 102 Ca -0.01 -1.31 -0.11 0.00 0.00 0.00 0.00 60.65 59.22 2aqb s ILE 102 Cb -0.12 -1.71 0.04 0.00 0.01 0.00 0.00 42.46 40.69 2aqb s ILE 102 CO -0.09 -0.41 0.37 0.00 0.00 0.00 0.00 174.94 174.80 2aqb s ALA 103 N 1.51 -0.91 0.34 9.38 0.00 -1.07 -2.37 121.76 128.64 2aqb s ALA 103 Ca 0.03 1.18 0.07 0.00 0.00 0.00 0.00 51.96 53.25 2aqb s ALA 103 Cb -0.18 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.21 2aqb s ALA 103 CO -0.14 -0.20 0.27 0.41 0.00 0.00 0.00 175.76 176.09 2aqb n GLY 104 N 3.46 2.95 3.22 0.00 0.00 -1.02 -3.20 105.19 110.59 2aqb n GLY 104 Ca -0.18 -1.92 -0.13 0.00 0.00 0.00 0.00 46.02 43.79 2aqb n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2aqb s SER 105 N -3.36 1.54 0.14 1.61 1.04 -1.26 -2.02 113.70 111.39 2aqb s SER 105 Ca 0.38 -0.99 -0.07 0.00 0.48 0.00 0.00 55.95 55.74 2aqb s SER 105 Cb 0.02 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 2aqb s SER 105 CO 0.27 -0.37 1.39 1.23 0.98 0.00 0.00 173.24 176.73 2aqb h GLY 106 N 2.91 0.71 -0.13 7.32 0.00 -1.80 -3.40 103.07 108.68 2aqb h GLY 106 Ca -0.36 -0.96 0.00 0.00 0.00 0.00 0.00 47.33 46.01 2aqb h GLY 106 CO 0.63 0.85 -0.06 0.61 0.00 0.00 0.00 176.54 178.58 2aqb n GLY 107 N 0.56 -0.31 7.00 4.60 0.00 -1.26 -4.68 105.19 111.10 2aqb n GLY 107 Ca -0.05 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2aqb n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aqb n GLY 108 N 0.57 2.85 2.45 -0.02 0.00 -1.26 -3.92 105.19 105.85 2aqb n GLY 108 Ca 0.01 -0.19 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 2aqb n GLY 108 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2aqb s SER 109 N -4.00 2.25 0.34 1.61 0.15 -1.23 -4.69 113.70 108.12 2aqb s SER 109 Ca 0.00 -2.48 0.08 0.00 0.70 0.00 0.00 55.95 54.25 2aqb s SER 109 Cb 0.00 -0.34 0.80 0.00 -1.71 0.00 0.00 66.02 64.77 2aqb s SER 109 CO 0.00 -0.25 1.83 -0.65 1.20 0.00 0.00 173.24 175.37 2aqb h PRO 110 N 6.48 0.69 -0.24 5.44 0.11 -1.90 -1.33 132.00 141.26 2aqb h PRO 110 Ca 0.14 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 66.26 2aqb h PRO 110 Cb 0.95 -0.16 -0.06 0.00 0.11 0.00 0.00 31.00 31.85 2aqb h PRO 110 CO 0.30 0.46 -0.14 -0.09 -0.21 0.00 0.00 178.00 178.32 2aqb h ARG 111 N 0.71 -0.11 0.00 1.05 2.43 -1.95 -0.98 114.38 115.54 2aqb h ARG 111 Ca 0.50 0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.60 2aqb h ARG 111 Cb 0.83 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.39 2aqb h ARG 111 CO -0.27 -0.08 -0.37 0.74 -1.51 0.00 0.00 179.97 178.49 2aqb h PHE 112 N -0.12 0.00 -0.21 2.20 -1.00 -1.81 0.39 116.94 116.38 2aqb h PHE 112 Ca 0.13 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.91 2aqb h PHE 112 Cb 0.31 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.86 2aqb h PHE 112 CO -0.31 0.37 0.14 1.96 -1.61 0.00 0.00 178.31 178.86 2aqb h GLN 113 N 0.00 0.28 -0.31 1.51 4.20 -1.02 -1.90 115.11 117.87 2aqb h GLN 113 Ca -0.00 -0.02 -0.18 0.00 0.06 0.00 0.00 58.65 58.51 2aqb h GLN 113 Cb 1.23 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.94 2aqb h GLN 113 CO 0.05 0.19 -0.52 0.28 -0.67 0.00 0.00 178.83 178.16 2aqb h VAL 114 N 0.29 1.27 -0.21 -0.54 2.07 -0.98 -2.77 116.25 115.39 2aqb h VAL 114 Ca 0.08 -1.70 0.02 0.00 0.82 0.00 0.00 66.70 65.91 2aqb h VAL 114 Cb -0.03 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 2aqb h VAL 114 CO -0.02 0.56 0.09 0.15 0.02 0.00 0.00 177.57 178.37 2aqb h PHE 115 N 0.69 0.17 -0.38 1.57 3.57 -0.91 0.56 116.94 122.20 2aqb h PHE 115 Ca 0.02 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.60 2aqb h PHE 115 Cb 1.13 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.77 2aqb h PHE 115 CO 0.07 0.09 0.01 0.78 -2.23 0.00 0.00 178.31 177.04 2aqb h GLY 116 N 0.20 0.39 1.19 2.40 0.00 -1.33 0.10 103.07 106.03 2aqb h GLY 116 Ca 0.09 0.03 -0.11 0.00 0.00 0.00 0.00 47.33 47.34 2aqb h GLY 116 CO -0.07 -0.08 -0.13 0.00 0.00 0.00 0.00 176.54 176.25 2aqb h ALA 117 N 1.33 0.82 -0.51 3.60 0.00 -1.26 -1.63 119.26 121.61 2aqb h ALA 117 Ca 0.19 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2aqb h ALA 117 Cb 0.26 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2aqb h ALA 117 CO -0.30 0.65 0.05 -0.44 0.00 0.00 0.00 179.25 179.21 2aqb h ASP 118 N 0.84 0.84 -0.55 0.00 3.45 -0.58 -2.88 116.42 117.53 2aqb h ASP 118 Ca 0.13 -0.28 -0.05 0.00 0.43 0.00 0.00 57.03 57.26 2aqb h ASP 118 Cb 0.68 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 39.20 2aqb h ASP 118 CO 0.05 0.91 0.17 0.00 -1.57 0.00 0.00 179.24 178.79 2aqb h ALA 119 N 0.96 0.72 -0.10 3.45 0.00 -0.73 -2.98 119.26 120.58 2aqb h ALA 119 Ca 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2aqb h ALA 119 Cb 0.45 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2aqb h ALA 119 CO 0.02 0.39 -0.10 1.98 0.00 0.00 0.00 179.25 181.54 2aqb h MET 120 N 0.76 0.14 -0.00 0.00 1.85 -1.26 -2.36 114.93 114.07 2aqb h MET 120 Ca 0.18 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 59.24 2aqb h MET 120 Cb 0.29 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.30 2aqb h MET 120 CO -0.00 0.25 -0.21 0.54 -0.40 0.00 0.00 176.91 177.08 2aqb n ARG 121 N -4.35 0.49 -0.62 0.39 1.74 -1.09 -4.29 116.66 108.93 2aqb n ARG 121 Ca -0.01 -0.22 -0.05 0.00 -0.77 0.00 0.00 57.85 56.79 2aqb n ARG 121 Cb 0.22 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.19 2aqb n ARG 121 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2aqb n GLY 122 N 1.37 -0.47 0.08 -0.13 0.00 -0.89 -4.97 105.19 100.18 2aqb n GLY 122 Ca 0.11 -1.79 0.12 0.00 0.00 0.00 0.00 46.02 44.46 2aqb n GLY 122 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2aqb n PRO 123 N -1.50 0.15 -0.00 1.61 -0.04 -1.26 -3.16 135.00 130.80 2aqb n PRO 123 Ca 0.03 0.26 0.08 0.00 -0.04 0.00 0.00 63.50 63.83 2aqb n PRO 123 Cb 0.12 -1.73 -0.11 0.00 -0.04 0.00 0.00 33.50 31.74 2aqb n PRO 123 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2aqb n ARG 124 N -2.01 1.17 0.00 0.54 1.74 -1.26 -5.05 116.66 111.78 2aqb n ARG 124 Ca 0.04 -0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 2aqb n ARG 124 Cb 0.31 -1.33 0.00 0.00 -1.02 0.00 0.00 32.46 30.41 2aqb n ARG 124 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2aqb n GLY 125 N 1.42 2.87 0.36 -0.13 0.00 -1.19 -2.51 105.19 106.02 2aqb n GLY 125 Ca 0.02 0.15 0.09 0.00 0.00 0.00 0.00 46.02 46.28 2aqb n GLY 125 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2aqb h LEU 126 N 0.00 0.85 -1.77 0.99 3.38 -1.85 -1.67 115.31 115.24 2aqb h LEU 126 Ca 0.00 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2aqb h LEU 126 Cb 0.00 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2aqb h LEU 126 CO 0.00 0.43 -0.14 0.11 0.09 0.00 0.00 178.44 178.93 2aqb h LYS 127 N 0.90 0.00 0.06 1.13 1.57 -1.88 -2.09 116.57 116.26 2aqb h LYS 127 Ca 0.49 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 59.03 2aqb h LYS 127 Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 2aqb h LYS 127 CO -0.26 0.14 -1.17 0.00 -0.57 0.00 0.00 179.45 177.60 2aqb h ALA 128 N 1.86 0.25 -0.22 3.86 0.00 -1.42 -3.34 119.26 120.24 2aqb h ALA 128 Ca -0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 54.91 53.96 2aqb h ALA 128 Cb 0.41 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2aqb h ALA 128 CO 0.02 1.13 0.08 0.28 0.00 0.00 0.00 179.25 180.76 2aqb h VAL 129 N 0.04 1.18 -0.54 0.00 2.07 -1.19 -3.48 116.25 114.32 2aqb h VAL 129 Ca -0.09 -0.57 0.06 0.00 0.82 0.00 0.00 66.70 66.93 2aqb h VAL 129 Cb 1.88 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.77 2aqb h VAL 129 CO 0.16 0.18 -0.13 0.61 0.02 0.00 0.00 177.57 178.42 2aqb n GLY 130 N -0.65 -1.82 0.58 2.17 0.00 -0.99 -4.62 105.19 99.86 2aqb n GLY 130 Ca -0.04 -1.45 0.07 0.00 0.00 0.00 0.00 46.02 44.61 2aqb n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2aqb n PRO 131 N -2.36 1.74 0.00 1.61 -0.04 -1.26 -4.33 135.00 130.36 2aqb n PRO 131 Ca -0.00 -1.13 0.05 0.00 -0.04 0.00 0.00 63.50 62.38 2aqb n PRO 131 Cb 0.11 -1.31 -0.00 0.00 -0.04 0.00 0.00 33.50 32.26 2aqb n PRO 131 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2aqb n TYR 132 N 0.39 0.00 -0.01 0.54 4.01 -1.26 -4.69 117.16 116.14 2aqb n TYR 132 Ca 0.13 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.83 2aqb n TYR 132 Cb 0.29 0.00 0.19 0.00 -0.31 0.00 0.00 39.34 39.52 2aqb n TYR 132 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2aqb h VAL 133 N 1.14 1.26 0.44 -0.72 2.07 -1.82 -2.97 116.25 115.65 2aqb h VAL 133 Ca 0.00 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.29 2aqb h VAL 133 Cb 0.35 1.26 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 2aqb h VAL 133 CO 0.00 0.39 -0.27 0.58 0.02 0.00 0.00 177.57 178.30 2aqb h VAL 134 N 0.48 0.45 0.00 2.57 2.07 -1.92 0.29 116.25 120.19 2aqb h VAL 134 Ca 0.08 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 2aqb h VAL 134 Cb 0.63 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2aqb h VAL 134 CO 0.04 0.00 -0.17 0.71 0.02 0.00 0.00 177.57 178.18 2aqb h THR 135 N -0.67 0.78 0.00 2.57 1.35 -1.81 0.63 112.91 115.75 2aqb h THR 135 Ca -0.05 -0.67 -0.11 0.00 -0.55 0.00 0.00 66.41 65.03 2aqb h THR 135 Cb 0.55 1.40 0.01 0.00 -1.73 0.00 0.00 68.15 68.38 2aqb h THR 135 CO 0.06 0.17 -0.43 0.11 -0.25 0.00 0.00 175.52 175.17 2aqb h LYS 136 N 0.00 0.29 0.00 4.72 1.57 -1.31 -3.40 116.57 118.44 2aqb h LYS 136 Ca -0.00 -0.31 -0.21 0.00 -1.87 0.00 0.00 60.65 58.26 2aqb h LYS 136 Cb 0.39 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.75 2aqb h LYS 136 CO 0.02 1.02 -1.54 0.00 -0.57 0.00 0.00 179.45 178.38 2aqb n ALA 137 N -2.57 1.82 -1.73 3.86 0.00 0.98 -4.10 120.51 118.78 2aqb n ALA 137 Ca -0.10 -0.63 -0.39 0.00 0.00 0.00 0.00 53.44 52.31 2aqb n ALA 137 Cb 0.59 -0.89 0.03 0.00 0.00 0.00 0.00 19.45 19.18 2aqb n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aqb n MET 138 N -2.91 1.81 0.23 0.00 0.00 0.19 -3.51 117.12 112.93 2aqb n MET 138 Ca -0.12 0.65 0.15 0.00 0.00 0.00 0.00 57.70 58.38 2aqb n MET 138 Cb 0.90 -2.51 0.80 0.00 0.00 0.00 0.00 33.22 32.42 2aqb n MET 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2aqb h ALA 139 N 1.70 1.82 -0.55 3.17 0.00 -1.92 -0.99 119.26 122.49 2aqb h ALA 139 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2aqb h ALA 139 Cb 1.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2aqb h ALA 139 CO 0.58 -0.17 0.00 -1.13 0.00 0.00 0.00 179.25 178.53 2aqb n SER 140 N -4.03 3.49 -0.26 0.00 3.41 -1.26 -4.52 113.62 110.46 2aqb n SER 140 Ca -0.00 -2.17 0.07 0.00 -0.26 0.00 0.00 58.87 56.50 2aqb n SER 140 Cb 0.22 -0.45 0.20 0.00 -0.26 0.00 0.00 64.21 63.92 2aqb n SER 140 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2aqb h GLY 141 N 4.62 1.06 0.71 5.00 0.00 -1.38 -1.01 103.07 112.06 2aqb h GLY 141 Ca 0.00 -0.02 0.05 0.00 0.00 0.00 0.00 47.33 47.36 2aqb h GLY 141 CO 0.09 -0.23 0.38 -2.08 0.00 0.00 0.00 176.54 174.70 2aqb h VAL 142 N 0.25 0.99 0.04 4.60 2.07 -1.83 -0.10 116.25 122.26 2aqb h VAL 142 Ca 0.44 -0.24 -0.12 0.00 0.82 0.00 0.00 66.70 67.60 2aqb h VAL 142 Cb 0.77 0.22 0.01 0.00 -1.52 0.00 0.00 31.29 30.77 2aqb h VAL 142 CO -0.55 0.13 -0.48 0.77 0.02 0.00 0.00 177.57 177.47 2aqb h SER 143 N 0.71 0.35 -0.64 0.57 4.64 -1.37 -3.24 113.55 114.57 2aqb h SER 143 Ca 0.30 -0.85 0.06 0.00 -0.47 0.00 0.00 61.79 60.83 2aqb h SER 143 Cb 0.16 -0.11 -0.05 0.00 -0.31 0.00 0.00 62.40 62.09 2aqb h SER 143 CO -0.17 1.16 0.34 0.00 -0.87 0.00 0.00 176.83 177.30 2aqb h ALA 144 N 0.20 0.85 0.00 5.18 0.00 -1.13 0.36 119.26 124.71 2aqb h ALA 144 Ca -0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2aqb h ALA 144 Cb 1.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2aqb h ALA 144 CO 0.09 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.35 2aqb n LEU 146 N -1.77 2.90 -0.30 0.00 4.77 -0.96 -4.48 117.00 117.16 2aqb n LEU 146 Ca 0.05 -0.07 0.04 0.00 -0.03 0.00 0.00 56.01 56.00 2aqb n LEU 146 Cb 0.28 -0.57 0.19 0.00 -2.33 0.00 0.00 43.42 40.99 2aqb n LEU 146 CO 0.22 0.75 1.14 0.00 -1.33 0.00 0.00 177.39 178.17 2aqb h ALA 147 N -0.03 1.23 0.44 -1.18 0.00 -1.00 -2.20 119.26 116.52 2aqb h ALA 147 Ca -0.37 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2aqb h ALA 147 Cb 1.55 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2aqb h ALA 147 CO -0.07 0.07 -0.21 1.15 0.00 0.00 0.00 179.25 180.19 2aqb h THR 148 N 0.77 0.00 0.00 0.00 2.02 -1.80 0.15 112.91 114.06 2aqb h THR 148 Ca 0.42 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 67.34 2aqb h THR 148 Cb 0.44 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 2aqb h THR 148 CO -0.27 0.00 -0.19 1.55 0.37 0.00 0.00 175.52 176.98 2aqb h PRO 149 N -0.82 0.00 -0.07 6.66 0.13 -1.78 -1.50 132.00 134.63 2aqb h PRO 149 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2aqb h PRO 149 Cb 0.45 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.58 2aqb h PRO 149 CO 0.10 0.19 0.00 1.19 -0.23 0.00 0.00 178.00 179.25 2aqb n PHE 150 N -4.15 0.09 -3.62 1.56 3.72 -0.83 -4.92 117.46 109.31 2aqb n PHE 150 Ca -0.02 -0.04 -0.25 0.00 -0.05 0.00 0.00 57.45 57.08 2aqb n PHE 150 Cb 0.26 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.87 2aqb n PHE 150 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2aqb n LYS 151 N -0.34 -7.38 -2.50 -1.08 4.01 -0.56 -4.62 118.16 105.69 2aqb n LYS 151 Ca 0.14 0.79 -0.42 0.00 -0.51 0.00 0.00 58.31 58.31 2aqb n LYS 151 Cb 0.16 -5.81 -0.03 0.00 -0.51 0.00 0.00 35.03 28.84 2aqb n LYS 151 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2aqb s ILE 152 N -3.31 4.18 -0.03 -0.18 1.01 0.01 -0.95 121.20 121.95 2aqb s ILE 152 Ca 0.59 1.62 0.10 0.00 0.00 0.00 0.00 60.65 62.96 2aqb s ILE 152 Cb -0.27 -4.04 -0.16 0.00 0.01 0.00 0.00 42.46 38.01 2aqb s ILE 152 CO 0.73 0.16 0.23 1.41 0.00 0.00 0.00 174.94 177.47 2aqb n HIS 153 N 3.62 0.00 0.00 3.97 8.25 -1.23 -4.86 115.22 124.97 2aqb n HIS 153 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 2aqb n HIS 153 Cb 0.47 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 31.35 2aqb n HIS 153 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2aqb n GLY 154 N 1.89 0.72 3.77 -1.41 0.00 0.11 -4.63 105.19 105.64 2aqb n GLY 154 Ca -0.02 -0.97 -0.36 0.00 0.00 0.00 0.00 46.02 44.67 2aqb n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2aqb s VAL 155 N 0.00 2.93 -0.33 1.61 -7.23 -1.26 -4.87 120.40 111.25 2aqb s VAL 155 Ca 0.00 0.61 0.04 0.00 -1.81 0.00 0.00 61.98 60.82 2aqb s VAL 155 Cb 0.00 -3.27 0.16 0.00 0.56 0.00 0.00 36.38 33.84 2aqb s VAL 155 CO 0.00 -0.09 0.45 0.21 -0.31 0.00 0.00 175.10 175.35 2aqb s ASN 156 N -1.58 0.19 0.22 4.85 2.47 -1.24 -0.33 114.94 119.51 2aqb s ASN 156 Ca 0.72 -0.78 -0.22 0.00 0.42 0.00 0.00 52.86 53.00 2aqb s ASN 156 Cb -0.28 1.14 0.05 0.00 -1.45 0.00 0.00 41.25 40.72 2aqb s ASN 156 CO 0.32 -0.29 0.89 -0.72 -3.72 0.00 0.00 177.10 173.58 2aqb s TYR 157 N 2.11 -0.08 -0.09 0.43 -0.85 -1.08 -4.99 117.35 112.81 2aqb s TYR 157 Ca 0.13 -0.33 0.01 0.00 -0.52 0.00 0.00 57.07 56.36 2aqb s TYR 157 Cb -0.12 0.69 -0.02 0.00 0.38 0.00 0.00 41.96 42.89 2aqb s TYR 157 CO -0.18 -1.04 -0.11 -1.12 -1.52 0.00 0.00 175.55 171.58 2aqb s SER 158 N -3.03 4.24 0.00 -0.18 0.01 -1.26 -2.59 113.70 110.90 2aqb s SER 158 Ca 0.14 -0.19 -0.12 0.00 1.31 0.00 0.00 55.95 57.09 2aqb s SER 158 Cb -0.03 -1.24 -0.05 0.00 0.21 0.00 0.00 66.02 64.91 2aqb s SER 158 CO 0.05 0.28 0.36 -0.63 0.41 0.00 0.00 173.24 173.71 2aqb s ILE 159 N -0.32 5.13 -0.04 1.44 -1.09 -1.26 -4.95 121.20 120.10 2aqb s ILE 159 Ca 0.04 0.63 0.01 0.00 -2.23 0.00 0.00 60.65 59.09 2aqb s ILE 159 Cb -0.13 -3.64 0.02 0.00 -1.58 0.00 0.00 42.46 37.13 2aqb s ILE 159 CO 0.02 0.51 -0.04 -0.55 -1.23 0.00 0.00 174.94 173.65 2aqb s SER 160 N -1.26 0.89 -0.39 3.58 0.15 -1.26 -4.17 113.70 111.24 2aqb s SER 160 Ca 0.25 -0.12 0.09 0.00 0.70 0.00 0.00 55.95 56.86 2aqb s SER 160 Cb -0.15 -0.42 0.37 0.00 -1.71 0.00 0.00 66.02 64.10 2aqb s SER 160 CO 0.13 -0.05 1.35 -1.54 1.20 0.00 0.00 173.24 174.33 2aqb n SER 161 N 3.97 -1.81 0.00 5.45 3.41 -1.26 -4.93 113.62 118.44 2aqb n SER 161 Ca -0.25 -2.38 0.00 0.00 -0.26 0.00 0.00 58.87 55.98 2aqb n SER 161 Cb 0.51 0.99 0.00 0.00 -0.26 0.00 0.00 64.21 65.45 2aqb n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2aqb n ALA 162 N -0.66 0.00 0.44 7.33 0.00 -1.26 -1.67 120.51 124.69 2aqb n ALA 162 Ca -0.06 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.48 2aqb n ALA 162 Cb 0.84 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.71 2aqb n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aqb n ALA 164 N -1.67 3.62 -0.20 0.00 0.00 -0.67 -4.33 120.51 117.26 2aqb n ALA 164 Ca 0.03 -0.55 -0.05 0.00 0.00 0.00 0.00 53.44 52.86 2aqb n ALA 164 Cb 0.21 -0.90 -0.05 0.00 0.00 0.00 0.00 19.45 18.71 2aqb n ALA 164 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2aqb n THR 165 N -0.51 -0.32 0.38 0.00 -1.04 -0.92 -1.51 114.28 110.36 2aqb n THR 165 Ca 0.09 1.76 0.13 0.00 -2.04 0.00 0.00 64.05 63.99 2aqb n THR 165 Cb 0.41 -2.24 0.31 0.00 -1.82 0.00 0.00 70.33 66.99 2aqb n THR 165 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2aqb h SER 166 N 0.00 0.00 -0.19 8.00 4.64 -1.74 -2.11 113.55 122.15 2aqb h SER 166 Ca 0.07 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.36 2aqb h SER 166 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 2aqb h SER 166 CO -0.44 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 175.51 2aqb h ALA 167 N 2.20 0.26 0.00 5.18 0.00 -1.53 -2.44 119.26 122.93 2aqb h ALA 167 Ca 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 2aqb h ALA 167 Cb 0.84 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2aqb h ALA 167 CO 0.00 -0.01 -0.24 0.45 0.00 0.00 0.00 179.25 179.45 2aqb h HIS 168 N 0.10 0.00 -0.37 0.00 -0.00 -0.92 -1.62 115.15 112.34 2aqb h HIS 168 Ca 0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.40 2aqb h HIS 168 Cb 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.80 2aqb h HIS 168 CO 0.04 0.24 0.13 0.00 -0.00 0.00 0.00 177.93 178.34 2aqb h ILE 170 N 0.44 1.22 -0.59 0.00 2.04 -1.10 -1.66 117.51 117.86 2aqb h ILE 170 Ca 0.12 -0.69 -0.08 0.00 1.00 0.00 0.00 64.86 65.21 2aqb h ILE 170 Cb 0.22 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2aqb h ILE 170 CO -0.01 0.25 0.06 1.23 0.00 0.00 0.00 178.15 179.69 2aqb h GLY 171 N 0.62 1.06 1.22 5.37 0.00 -1.16 -1.32 103.07 108.86 2aqb h GLY 171 Ca 0.16 -0.71 -0.13 0.00 0.00 0.00 0.00 47.33 46.65 2aqb h GLY 171 CO -0.01 0.65 -0.27 -0.57 0.00 0.00 0.00 176.54 176.35 2aqb h ASN 172 N 0.92 0.91 -0.69 0.19 -0.73 -0.87 -2.10 115.58 113.20 2aqb h ASN 172 Ca 0.18 -0.36 0.09 0.00 1.87 0.00 0.00 56.30 58.08 2aqb h ASN 172 Cb 0.45 -0.25 -0.07 0.00 0.27 0.00 0.00 38.32 38.72 2aqb h ASN 172 CO 0.02 1.12 0.33 0.00 -0.37 0.00 0.00 177.43 178.53 2aqb h ALA 173 N 0.94 0.94 -0.51 1.57 0.00 -1.02 -1.61 119.26 119.56 2aqb h ALA 173 Ca 0.09 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2aqb h ALA 173 Cb 0.82 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2aqb h ALA 173 CO 0.07 -0.07 0.33 0.28 0.00 0.00 0.00 179.25 179.86 2aqb h VAL 174 N 0.57 1.14 -0.81 0.00 2.07 -0.94 -2.49 116.25 115.79 2aqb h VAL 174 Ca 0.34 -0.29 0.06 0.00 0.82 0.00 0.00 66.70 67.63 2aqb h VAL 174 Cb 0.36 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.49 2aqb h VAL 174 CO -0.27 0.14 0.53 -0.33 0.02 0.00 0.00 177.57 177.66 2aqb h GLU 175 N 0.69 0.88 -0.69 1.57 5.08 -1.02 0.99 114.58 122.08 2aqb h GLU 175 Ca 0.19 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.43 2aqb h GLU 175 Cb -0.05 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 28.97 2aqb h GLU 175 CO -0.04 0.58 0.16 1.96 -1.00 0.00 0.00 179.01 180.68 2aqb h GLN 176 N 0.91 1.09 -0.19 2.33 1.08 -0.89 -0.84 115.11 118.61 2aqb h GLN 176 Ca 0.35 -0.26 -0.04 0.00 -1.45 0.00 0.00 58.65 57.25 2aqb h GLN 176 Cb 0.20 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 2aqb h GLN 176 CO -0.12 0.97 -0.05 0.82 -0.95 0.00 0.00 178.83 179.50 2aqb h ILE 177 N 1.04 1.29 -0.55 2.54 5.03 -0.96 -1.84 117.51 124.05 2aqb h ILE 177 Ca 0.22 -1.02 -0.01 0.00 -0.12 0.00 0.00 64.86 63.92 2aqb h ILE 177 Cb 0.37 1.58 -0.03 0.00 -3.03 0.00 0.00 36.82 35.71 2aqb h ILE 177 CO 0.00 0.31 0.29 1.56 -0.68 0.00 0.00 178.15 179.63 2aqb h GLN 178 N 0.08 0.76 0.00 2.37 4.20 -0.64 -1.02 115.11 120.86 2aqb h GLN 178 Ca 0.05 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2aqb h GLN 178 Cb 0.49 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.11 2aqb h GLN 178 CO 0.02 0.57 0.00 1.28 -0.67 0.00 0.00 178.83 180.03 2aqb n LEU 179 N -4.39 0.00 -0.11 1.46 4.77 -0.34 -4.35 117.00 114.04 2aqb n LEU 179 Ca 0.05 0.20 -0.01 0.00 -0.03 0.00 0.00 56.01 56.22 2aqb n LEU 179 Cb 0.11 -0.20 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 2aqb n LEU 179 CO 0.37 -0.01 -0.01 0.61 -1.33 0.00 0.00 177.39 177.02 2aqb n GLY 180 N 1.10 0.43 0.11 -0.72 0.00 -0.39 -4.92 105.19 100.81 2aqb n GLY 180 Ca 0.16 -0.12 -0.01 0.00 0.00 0.00 0.00 46.02 46.05 2aqb n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2aqb h LYS 181 N 0.51 0.00 -4.37 1.61 1.57 -1.57 -3.46 116.57 110.85 2aqb h LYS 181 Ca -0.03 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.49 2aqb h LYS 181 Cb 0.41 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 32.49 2aqb h LYS 181 CO 0.04 0.70 -0.73 -0.65 -0.57 0.00 0.00 179.45 178.24 2aqb s GLN 182 N -2.95 0.44 -0.11 3.15 -1.52 -1.08 -4.76 119.66 112.83 2aqb s GLN 182 Ca 0.02 -0.61 0.04 0.00 -1.95 0.00 0.00 55.36 52.86 2aqb s GLN 182 Cb 0.09 -0.21 -0.24 0.00 -0.22 0.00 0.00 33.01 32.43 2aqb s GLN 182 CO 0.77 0.04 0.41 -0.25 -0.25 0.00 0.00 175.29 176.01 2aqb n ASP 183 N 1.78 1.46 -3.89 5.90 8.00 0.59 -4.24 116.55 126.15 2aqb n ASP 183 Ca -0.21 0.25 -0.18 0.00 0.71 0.00 0.00 54.79 55.36 2aqb n ASP 183 Cb 0.55 -0.37 -0.16 0.00 -0.02 0.00 0.00 41.12 41.13 2aqb n ASP 183 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2aqb s ILE 184 N -2.57 0.38 -0.10 0.53 1.01 -1.02 -0.78 121.20 118.66 2aqb s ILE 184 Ca -0.15 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.42 2aqb s ILE 184 Cb 0.07 -0.41 0.02 0.00 0.01 0.00 0.00 42.46 42.16 2aqb s ILE 184 CO 0.78 0.17 -0.08 -0.69 0.00 0.00 0.00 174.94 175.12 2aqb s VAL 185 N 0.66 1.01 -0.18 2.92 1.01 0.66 -0.46 120.40 126.03 2aqb s VAL 185 Ca -0.08 -0.31 -0.29 0.00 0.00 0.00 0.00 61.98 61.30 2aqb s VAL 185 Cb -0.11 -1.01 -0.00 0.00 0.00 0.00 0.00 36.38 35.25 2aqb s VAL 185 CO -0.00 0.36 1.10 -0.36 0.00 0.00 0.00 175.10 176.19 2aqb s PHE 186 N 1.48 3.24 -0.03 5.22 0.40 -0.14 -0.87 117.98 127.28 2aqb s PHE 186 Ca 0.01 1.36 0.04 0.00 -0.60 0.00 0.00 56.93 57.74 2aqb s PHE 186 Cb -0.13 -3.32 -0.01 0.00 0.51 0.00 0.00 43.02 40.07 2aqb s PHE 186 CO -0.06 -0.80 -0.16 0.00 0.70 0.00 0.00 175.22 174.91 2aqb s ALA 187 N 2.97 1.42 0.00 5.36 0.00 -0.48 -0.84 121.76 130.19 2aqb s ALA 187 Ca 0.48 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.78 2aqb s ALA 187 Cb -0.18 -0.45 0.00 0.00 0.00 0.00 0.00 23.12 22.49 2aqb s ALA 187 CO 0.12 0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.57 2aqb n GLY 188 N 3.03 -0.70 0.00 0.00 0.00 -1.00 -0.50 105.19 106.02 2aqb n GLY 188 Ca -0.17 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2aqb n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aqb n GLY 189 N 0.00 -0.40 3.22 -0.02 0.00 -0.80 -2.45 105.19 104.74 2aqb n GLY 189 Ca 0.00 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 2aqb n GLY 189 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2aqb s GLY 190 N 0.00 0.31 -0.12 -0.02 0.00 -0.86 -1.20 107.32 105.43 2aqb s GLY 190 Ca 0.00 -0.83 -0.07 0.00 0.00 0.00 0.00 44.72 43.82 2aqb s GLY 190 CO 0.00 -0.93 0.30 1.85 0.00 0.00 0.00 173.10 174.32 2aqb s GLU 191 N -3.91 0.28 0.76 2.90 2.56 0.21 -4.14 118.70 117.36 2aqb s GLU 191 Ca 0.10 0.58 -0.11 0.00 0.00 0.00 0.00 54.97 55.54 2aqb s GLU 191 Cb 0.05 -0.05 0.05 0.00 2.00 0.00 0.00 34.13 36.18 2aqb s GLU 191 CO -0.07 -0.14 1.08 -1.83 -0.56 0.00 0.00 175.26 173.74 2aqb s GLU 192 N 1.14 2.36 -0.15 4.30 -1.05 -1.26 -1.76 118.70 122.28 2aqb s GLU 192 Ca -0.08 0.80 0.00 0.00 -0.15 0.00 0.00 54.97 55.54 2aqb s GLU 192 Cb -0.09 -1.94 0.03 0.00 -0.44 0.00 0.00 34.13 31.69 2aqb s GLU 192 CO -0.08 -1.47 -0.12 -1.17 0.95 0.00 0.00 175.26 173.37 2aqb s LEU 193 N -5.73 1.66 -0.13 1.83 2.96 -1.26 -4.66 118.68 113.35 2aqb s LEU 193 Ca 0.60 -0.51 -0.30 0.00 -0.22 0.00 0.00 54.13 53.69 2aqb s LEU 193 Cb -0.15 -1.10 0.11 0.00 0.50 0.00 0.00 46.19 45.55 2aqb s LEU 193 CO 0.55 -0.09 0.89 0.00 -1.32 0.00 0.00 176.35 176.38 2aqb h TRP 195 N 2.78 0.35 -0.57 0.00 5.08 -1.97 -1.63 115.95 119.98 2aqb h TRP 195 Ca -0.21 -0.00 0.11 0.00 1.08 0.00 0.00 58.89 59.86 2aqb h TRP 195 Cb 1.16 -0.11 -0.09 0.00 -3.00 0.00 0.00 29.16 27.11 2aqb h TRP 195 CO 0.32 0.28 0.06 0.93 -1.28 0.00 0.00 178.44 178.74 2aqb h GLU 196 N 0.36 0.17 0.11 0.12 3.07 -1.96 0.20 114.58 116.65 2aqb h GLU 196 Ca 0.09 -0.01 -0.23 0.00 -0.50 0.00 0.00 59.36 58.71 2aqb h GLU 196 Cb 0.07 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 2aqb h GLU 196 CO -0.01 0.11 -1.12 1.98 -1.40 0.00 0.00 179.01 178.58 2aqb h MET 197 N 0.18 0.23 -0.91 2.33 4.05 -1.90 -3.38 114.93 115.53 2aqb h MET 197 Ca 0.30 -0.40 0.11 0.00 -0.28 0.00 0.00 59.70 59.44 2aqb h MET 197 Cb 0.46 0.15 -0.07 0.00 -0.80 0.00 0.00 31.60 31.33 2aqb h MET 197 CO -0.44 1.19 0.58 0.00 0.23 0.00 0.00 176.91 178.47 2aqb h ALA 198 N -0.03 1.68 0.00 0.39 0.00 -1.00 -1.67 119.26 118.63 2aqb h ALA 198 Ca -0.23 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2aqb h ALA 198 Cb 1.65 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 2aqb h ALA 198 CO 0.07 0.11 -0.15 0.00 0.00 0.00 0.00 179.25 179.28 2aqb h GLU 200 N 0.00 0.73 -0.54 0.00 5.08 -1.49 0.25 114.58 118.61 2aqb h GLU 200 Ca -0.00 -0.33 -0.12 0.00 -1.00 0.00 0.00 59.36 57.92 2aqb h GLU 200 Cb 0.40 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 2aqb h GLU 200 CO 0.02 0.94 -0.12 0.74 -1.00 0.00 0.00 179.01 179.59 2aqb h PHE 201 N 0.51 1.14 -0.85 4.33 -1.00 -1.49 -3.01 116.94 116.57 2aqb h PHE 201 Ca 0.08 -0.24 -0.03 0.00 2.81 0.00 0.00 57.97 60.58 2aqb h PHE 201 Cb 0.72 -0.28 -0.04 0.00 3.61 0.00 0.00 35.95 39.96 2aqb h PHE 201 CO 0.06 1.06 0.40 0.22 -1.61 0.00 0.00 178.31 178.44 2aqb h ASP 202 N 0.90 1.12 0.81 2.17 1.82 -1.22 -1.31 116.42 120.72 2aqb h ASP 202 Ca 0.14 -0.14 -0.02 0.00 -0.39 0.00 0.00 57.03 56.62 2aqb h ASP 202 Cb 0.69 -0.29 -0.00 0.00 0.68 0.00 0.00 39.33 40.41 2aqb h ASP 202 CO 0.05 0.94 -0.08 0.00 -1.61 0.00 0.00 179.24 178.54 2aqb h ALA 203 N 1.22 1.05 -0.24 -0.78 0.00 -0.87 -0.89 119.26 118.75 2aqb h ALA 203 Ca 0.29 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2aqb h ALA 203 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2aqb h ALA 203 CO -0.03 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.32 2aqb n MET 204 N -3.26 2.21 -1.43 0.00 0.00 -1.11 -4.97 117.12 108.55 2aqb n MET 204 Ca -0.00 -1.81 -0.05 0.00 0.00 0.00 0.00 57.70 55.84 2aqb n MET 204 Cb 0.31 -1.47 -0.02 0.00 0.00 0.00 0.00 33.22 32.05 2aqb n MET 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2aqb n GLY 205 N 1.35 0.57 0.10 3.17 0.00 -0.34 -4.94 105.19 105.11 2aqb n GLY 205 Ca 0.18 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.52 2aqb n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqb h ALA 206 N 0.07 0.73 -2.78 4.61 0.00 -1.45 -3.47 119.26 116.96 2aqb h ALA 206 Ca -0.10 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.18 2aqb h ALA 206 Cb 0.55 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 2aqb h ALA 206 CO 0.14 0.00 -0.45 -0.51 0.00 0.00 0.00 179.25 178.44 2aqb s LEU 207 N -4.77 4.36 0.22 0.00 1.43 -1.25 -1.26 118.68 117.41 2aqb s LEU 207 Ca 0.06 0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 53.28 2aqb s LEU 207 Cb 0.11 -2.72 -0.10 0.00 0.03 0.00 0.00 46.19 43.52 2aqb s LEU 207 CO 0.70 0.23 1.44 -0.55 0.23 0.00 0.00 176.35 178.40 2aqb s SER 208 N -1.96 6.69 0.00 2.29 0.15 -0.35 -4.64 113.70 115.88 2aqb s SER 208 Ca 0.29 2.59 0.00 0.00 0.70 0.00 0.00 55.95 59.53 2aqb s SER 208 Cb -0.13 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.57 2aqb s SER 208 CO 0.19 -0.69 0.00 0.35 1.20 0.00 0.00 173.24 174.29 2aqb n THR 209 N 2.77 0.00 1.21 6.45 -2.24 -1.26 -4.31 114.28 116.90 2aqb n THR 209 Ca 0.08 -0.15 0.14 0.00 -2.27 0.00 0.00 64.05 61.85 2aqb n THR 209 Cb 0.40 0.71 0.53 0.00 -2.10 0.00 0.00 70.33 69.87 2aqb n THR 209 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2aqb n LYS 210 N -0.59 0.36 -0.52 -0.78 4.76 -1.26 -4.26 118.16 115.87 2aqb n LYS 210 Ca 0.00 -0.13 0.06 0.00 -2.87 0.00 0.00 58.31 55.38 2aqb n LYS 210 Cb 0.00 -1.50 0.14 0.00 -1.84 0.00 0.00 35.03 31.83 2aqb n LYS 210 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2aqb n TYR 211 N -1.21 0.00 0.17 2.13 4.02 -1.26 -4.80 117.16 116.20 2aqb n TYR 211 Ca 0.10 -1.04 0.08 0.00 -0.01 0.00 0.00 57.90 57.04 2aqb n TYR 211 Cb 0.31 -0.18 0.59 0.00 -0.02 0.00 0.00 39.34 40.04 2aqb n TYR 211 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2aqb h ASN 212 N 0.55 0.12 0.96 7.72 2.35 -1.93 -1.30 115.58 124.05 2aqb h ASN 212 Ca -0.03 -0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.64 2aqb h ASN 212 Cb 1.16 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 39.49 2aqb h ASN 212 CO 0.01 0.08 -0.36 0.44 -1.65 0.00 0.00 177.43 175.96 2aqb h ASP 213 N 0.14 0.00 -2.39 5.81 3.32 -1.94 -3.35 116.42 118.00 2aqb h ASP 213 Ca 0.07 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.52 2aqb h ASP 213 Cb 0.10 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.23 2aqb h ASP 213 CO -0.01 0.36 -0.69 0.35 -1.72 0.00 0.00 179.24 177.53 2aqb n THR 214 N -3.46 1.51 -0.34 0.35 -2.24 -0.50 -4.99 114.28 104.61 2aqb n THR 214 Ca 0.00 -4.84 0.17 0.00 -2.27 0.00 0.00 64.05 57.11 2aqb n THR 214 Cb 0.52 -2.07 0.39 0.00 -2.10 0.00 0.00 70.33 67.07 2aqb n THR 214 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2aqb h PRO 215 N 4.54 0.60 0.00 -0.78 0.11 -1.68 -0.43 132.00 134.37 2aqb h PRO 215 Ca 0.17 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2aqb h PRO 215 Cb 0.73 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.71 2aqb h PRO 215 CO 0.72 0.40 0.00 0.39 -0.21 0.00 0.00 178.00 179.30 2aqb n GLU 216 N -4.76 0.07 0.00 1.05 1.02 -1.26 -2.51 120.64 114.25 2aqb n GLU 216 Ca 0.25 0.24 0.10 0.00 -0.02 0.00 0.00 57.16 57.72 2aqb n GLU 216 Cb 0.69 -1.62 0.02 0.00 -0.02 0.00 0.00 31.44 30.51 2aqb n GLU 216 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2aqb n LYS 217 N -1.75 1.57 -0.10 3.49 4.76 -0.18 -4.62 118.16 121.33 2aqb n LYS 217 Ca 0.04 -1.14 -0.11 0.00 -2.87 0.00 0.00 58.31 54.24 2aqb n LYS 217 Cb 0.24 -1.38 -0.03 0.00 -1.84 0.00 0.00 35.03 32.02 2aqb n LYS 217 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2aqb h ALA 218 N 3.53 0.41 -2.27 7.82 0.00 -1.45 -3.40 119.26 123.91 2aqb h ALA 218 Ca 0.00 -0.21 -0.61 0.00 0.00 0.00 0.00 54.91 54.09 2aqb h ALA 218 Cb 0.71 -0.11 -0.11 0.00 0.00 0.00 0.00 17.79 18.28 2aqb h ALA 218 CO 0.00 0.12 0.34 0.45 0.00 0.00 0.00 179.25 180.16 2aqb s SER 219 N -5.96 6.60 -0.42 0.00 0.15 -1.26 -4.76 113.70 108.04 2aqb s SER 219 Ca -0.13 0.54 0.08 0.00 0.70 0.00 0.00 55.95 57.14 2aqb s SER 219 Cb 0.08 -2.39 0.34 0.00 -1.71 0.00 0.00 66.02 62.35 2aqb s SER 219 CO 0.76 -0.61 1.01 -2.11 1.20 0.00 0.00 173.24 173.49 2aqb n ARG 220 N 6.17 1.02 -1.66 5.44 1.85 -1.26 -4.62 116.66 123.60 2aqb n ARG 220 Ca 0.02 -2.41 -0.46 0.00 -1.00 0.00 0.00 57.85 54.00 2aqb n ARG 220 Cb 0.48 -1.18 -0.04 0.00 -1.05 0.00 0.00 32.46 30.67 2aqb n ARG 220 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2aqb n THR 221 N 0.26 0.21 -0.55 8.89 -1.04 -1.26 -1.52 114.28 119.28 2aqb n THR 221 Ca 0.11 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2aqb n THR 221 Cb 0.70 -1.45 0.00 0.00 -1.82 0.00 0.00 70.33 67.76 2aqb n THR 221 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2aqb n TYR 222 N 2.98 0.00 -2.63 -1.42 0.53 -1.26 -4.73 117.16 110.63 2aqb n TYR 222 Ca 0.16 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.64 2aqb n TYR 222 Cb 0.28 0.00 -0.05 0.00 -1.03 0.00 0.00 39.34 38.54 2aqb n TYR 222 CO 0.00 0.00 0.00 0.34 -1.02 0.00 0.00 176.86 176.18 2aqb s ASP 223 N -3.45 7.48 0.62 7.72 2.15 -0.57 -1.42 116.67 129.20 2aqb s ASP 223 Ca 0.00 2.08 0.34 0.00 0.43 0.00 0.00 52.55 55.40 2aqb s ASP 223 Cb 0.00 -2.62 1.94 0.00 -0.30 0.00 0.00 42.92 41.94 2aqb s ASP 223 CO 0.00 0.02 2.20 0.00 -0.17 0.00 0.00 175.17 177.22 2aqb h ALA 224 N 4.08 1.43 -0.30 3.66 0.00 -0.04 -2.47 119.26 125.63 2aqb h ALA 224 Ca -0.46 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 2aqb h ALA 224 Cb 1.21 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 2aqb h ALA 224 CO 0.68 -0.14 -0.02 0.72 0.00 0.00 0.00 179.25 180.49 2aqb n HIS 225 N -3.48 0.99 -1.76 0.00 8.25 -1.26 -5.01 115.22 112.95 2aqb n HIS 225 Ca -0.01 -1.20 -0.40 0.00 -0.26 0.00 0.00 57.72 55.85 2aqb n HIS 225 Cb 0.20 -0.39 0.02 0.00 1.12 0.00 0.00 29.99 30.94 2aqb n HIS 225 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 2aqb n ARG 226 N -0.83 2.18 -1.49 -0.41 1.85 -0.93 -4.97 116.66 112.05 2aqb n ARG 226 Ca 0.27 0.78 0.04 0.00 -1.00 0.00 0.00 57.85 57.93 2aqb n ARG 226 Cb 0.95 -2.62 0.04 0.00 -1.05 0.00 0.00 32.46 29.79 2aqb n ARG 226 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 2aqb n ASP 227 N -0.26 1.11 0.00 2.89 5.75 -1.25 -4.61 116.55 120.18 2aqb n ASP 227 Ca 0.06 -2.17 0.00 0.00 -0.01 0.00 0.00 54.79 52.67 2aqb n ASP 227 Cb 0.42 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 2aqb n ASP 227 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2aqb n GLY 228 N 0.30 2.91 3.89 6.12 0.00 -0.54 -3.74 105.19 114.13 2aqb n GLY 228 Ca 0.07 -2.06 -0.29 0.00 0.00 0.00 0.00 46.02 43.74 2aqb n GLY 228 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2aqb s PHE 229 N -2.48 3.37 -0.26 1.61 -0.12 -0.39 -3.63 117.98 116.07 2aqb s PHE 229 Ca 0.00 1.00 -0.06 0.00 -0.05 0.00 0.00 56.93 57.82 2aqb s PHE 229 Cb 0.00 -2.92 -0.01 0.00 -0.63 0.00 0.00 43.02 39.46 2aqb s PHE 229 CO 0.00 -1.00 0.05 0.08 -0.05 0.00 0.00 175.22 174.30 2aqb s VAL 230 N -3.24 3.94 0.46 -2.49 1.01 -1.26 -1.22 120.40 117.61 2aqb s VAL 230 Ca 0.56 -0.48 -0.24 0.00 0.00 0.00 0.00 61.98 61.83 2aqb s VAL 230 Cb -0.11 -2.92 -0.07 0.00 0.00 0.00 0.00 36.38 33.28 2aqb s VAL 230 CO 0.51 0.24 1.29 -0.51 0.00 0.00 0.00 175.10 176.63 2aqb s ILE 231 N 1.53 2.56 0.19 2.22 1.10 -1.26 0.08 121.20 127.61 2aqb s ILE 231 Ca 0.05 0.45 -0.04 0.00 -0.51 0.00 0.00 60.65 60.59 2aqb s ILE 231 Cb -0.16 -3.25 -0.03 0.00 0.15 0.00 0.00 42.46 39.17 2aqb s ILE 231 CO 0.02 0.03 0.20 0.00 -2.11 0.00 0.00 174.94 173.08 2aqb s ALA 232 N -1.34 0.65 0.30 1.50 0.00 -0.33 -0.58 121.76 121.96 2aqb s ALA 232 Ca 0.63 -1.36 0.03 0.00 0.00 0.00 0.00 51.96 51.25 2aqb s ALA 232 Cb -0.37 1.13 -0.05 0.00 0.00 0.00 0.00 23.12 23.83 2aqb s ALA 232 CO 0.45 -0.62 0.09 0.20 0.00 0.00 0.00 175.76 175.88 2aqb s GLY 233 N -3.08 1.97 0.00 0.00 0.00 -0.74 -4.26 107.32 101.22 2aqb s GLY 233 Ca 0.29 -1.87 0.00 0.00 0.00 0.00 0.00 44.72 43.14 2aqb s GLY 233 CO 0.07 -1.70 0.00 0.61 0.00 0.00 0.00 173.10 172.08 2aqb n GLY 234 N -0.60 0.34 3.42 0.20 0.00 -0.72 -4.31 105.19 103.53 2aqb n GLY 234 Ca -0.01 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.23 2aqb n GLY 234 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2aqb s GLY 235 N 0.00 0.06 0.09 -0.02 0.00 -0.01 -0.62 107.32 106.83 2aqb s GLY 235 Ca 0.00 -0.41 -0.18 0.00 0.00 0.00 0.00 44.72 44.12 2aqb s GLY 235 CO 0.00 -0.47 0.44 -0.32 0.00 0.00 0.00 173.10 172.75 2aqb s GLY 236 N -2.89 -0.32 -0.22 0.20 0.00 -0.34 -1.57 107.32 102.17 2aqb s GLY 236 Ca 0.10 0.20 -0.18 0.00 0.00 0.00 0.00 44.72 44.84 2aqb s GLY 236 CO -0.04 -0.07 0.58 -0.29 0.00 0.00 0.00 173.10 173.28 2aqb s MET 237 N -3.18 0.64 0.14 2.90 1.75 -0.34 -1.90 119.30 119.31 2aqb s MET 237 Ca -0.01 0.90 0.10 0.00 -1.25 0.00 0.00 55.69 55.42 2aqb s MET 237 Cb 0.00 0.23 -0.04 0.00 2.84 0.00 0.00 34.83 37.87 2aqb s MET 237 CO -0.08 -0.11 -0.23 0.14 -0.65 0.00 0.00 175.02 174.10 2aqb s VAL 238 N 0.77 2.04 -0.41 10.11 -7.23 0.34 -0.64 120.40 125.38 2aqb s VAL 238 Ca -0.04 -1.78 -0.19 0.00 -1.81 0.00 0.00 61.98 58.16 2aqb s VAL 238 Cb -0.05 -1.87 0.02 0.00 0.56 0.00 0.00 36.38 35.04 2aqb s VAL 238 CO -0.06 -0.07 0.55 -0.69 -0.31 0.00 0.00 175.10 174.52 2aqb s VAL 239 N -1.40 4.95 -0.20 1.32 1.01 0.16 -1.39 120.40 124.86 2aqb s VAL 239 Ca 0.13 0.02 -0.16 0.00 0.00 0.00 0.00 61.98 61.98 2aqb s VAL 239 Cb -0.09 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 2aqb s VAL 239 CO 0.06 -0.45 0.42 -0.69 0.00 0.00 0.00 175.10 174.44 2aqb s VAL 240 N 2.50 5.18 -0.00 2.92 1.01 -0.05 -1.81 120.40 130.16 2aqb s VAL 240 Ca 0.18 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.92 2aqb s VAL 240 Cb -0.15 -3.75 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 2aqb s VAL 240 CO 0.16 0.23 -0.02 -0.70 0.00 0.00 0.00 175.10 174.78 2aqb s GLU 241 N 1.40 0.13 0.29 2.72 2.12 0.03 -0.25 118.70 125.15 2aqb s GLU 241 Ca 0.20 -0.06 -0.29 0.00 0.36 0.00 0.00 54.97 55.18 2aqb s GLU 241 Cb -0.15 -0.13 -0.10 0.00 0.26 0.00 0.00 34.13 34.01 2aqb s GLU 241 CO 0.08 0.03 1.39 -2.00 -0.54 0.00 0.00 175.26 174.23 2aqb s GLU 242 N -0.03 4.29 0.13 4.30 -6.30 0.04 -0.57 118.70 120.56 2aqb s GLU 242 Ca 0.01 2.29 -0.22 0.00 -2.50 0.00 0.00 54.97 54.55 2aqb s GLU 242 Cb -0.01 -3.08 -0.02 0.00 0.00 0.00 0.00 34.13 31.02 2aqb s GLU 242 CO -0.00 -0.34 1.67 1.25 0.02 0.00 0.00 175.26 177.86 2aqb h LEU 243 N 4.19 -0.44 -0.83 2.70 5.85 -1.55 -1.96 115.31 123.26 2aqb h LEU 243 Ca -0.48 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 2aqb h LEU 243 Cb 1.22 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.43 2aqb h LEU 243 CO 0.71 -0.19 0.40 -0.33 -0.34 0.00 0.00 178.44 178.69 2aqb h GLU 244 N -0.17 1.20 -0.65 1.25 4.39 -1.92 -0.79 114.58 117.88 2aqb h GLU 244 Ca 0.09 -0.18 0.07 0.00 0.34 0.00 0.00 59.36 59.68 2aqb h GLU 244 Cb 0.31 -0.21 -0.06 0.00 -0.10 0.00 0.00 28.75 28.69 2aqb h GLU 244 CO -0.23 0.92 0.34 1.25 -1.16 0.00 0.00 179.01 180.13 2aqb h HIS 245 N 1.18 0.62 -0.25 4.33 2.76 -1.89 -0.54 115.15 121.36 2aqb h HIS 245 Ca 0.28 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.43 2aqb h HIS 245 Cb 0.12 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.89 2aqb h HIS 245 CO 0.01 0.28 -0.04 0.00 -1.30 0.00 0.00 177.93 176.89 2aqb h ALA 246 N 1.36 0.35 -0.43 5.26 0.00 -0.57 -3.07 119.26 122.15 2aqb h ALA 246 Ca 0.30 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2aqb h ALA 246 Cb 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2aqb h ALA 246 CO -0.20 0.12 0.24 -0.07 0.00 0.00 0.00 179.25 179.34 2aqb h LEU 247 N 0.23 0.54 -0.71 0.00 3.38 -1.01 -0.74 115.31 117.00 2aqb h LEU 247 Ca 0.07 -0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.04 2aqb h LEU 247 Cb 0.49 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 41.02 2aqb h LEU 247 CO 0.02 0.48 0.34 0.00 0.09 0.00 0.00 178.44 179.37 2aqb h ALA 248 N 1.09 0.98 -0.04 1.53 0.00 -1.09 -2.28 119.26 119.44 2aqb h ALA 248 Ca 0.15 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2aqb h ALA 248 Cb 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2aqb h ALA 248 CO -0.02 -0.07 0.00 2.89 0.00 0.00 0.00 179.25 182.05 2aqb n ARG 249 N -4.88 1.74 -2.08 0.00 1.85 -1.16 -4.95 116.66 107.18 2aqb n ARG 249 Ca 0.11 -1.08 -0.05 0.00 -1.00 0.00 0.00 57.85 55.83 2aqb n ARG 249 Cb 0.29 -1.47 -0.00 0.00 -1.05 0.00 0.00 32.46 30.22 2aqb n ARG 249 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2aqb n GLY 250 N 1.19 0.17 3.75 2.89 0.00 -0.86 -5.01 105.19 107.32 2aqb n GLY 250 Ca 0.18 -0.67 -0.38 0.00 0.00 0.00 0.00 46.02 45.15 2aqb n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqb s ALA 251 N -2.26 2.80 -0.13 4.61 0.00 -0.33 -4.98 121.76 121.48 2aqb s ALA 251 Ca 0.00 1.35 -0.29 0.00 0.00 0.00 0.00 51.96 53.01 2aqb s ALA 251 Cb 0.00 -3.57 -0.01 0.00 0.00 0.00 0.00 23.12 19.54 2aqb s ALA 251 CO 0.00 -1.41 1.02 -1.58 0.00 0.00 0.00 175.76 173.79 2aqb s HIS 252 N -1.30 3.46 -0.20 0.00 5.65 -1.26 -4.83 115.29 116.81 2aqb s HIS 252 Ca 0.72 1.55 -0.07 0.00 0.25 0.00 0.00 55.06 57.51 2aqb s HIS 252 Cb -0.41 -3.22 -0.04 0.00 -1.18 0.00 0.00 32.58 27.74 2aqb s HIS 252 CO 0.48 -0.33 0.06 0.42 -0.65 0.00 0.00 174.74 174.73 2aqb s ILE 253 N 2.26 4.65 -0.09 0.89 1.09 -1.26 -4.37 121.20 124.37 2aqb s ILE 253 Ca 0.48 -0.08 -0.23 0.00 -1.10 0.00 0.00 60.65 59.72 2aqb s ILE 253 Cb -0.18 -3.11 -0.19 0.00 -1.06 0.00 0.00 42.46 37.92 2aqb s ILE 253 CO 0.16 0.43 0.81 1.88 -0.10 0.00 0.00 174.94 178.12 2aqb h TYR 254 N 7.06 -0.06 -2.54 3.97 0.05 -1.34 -3.47 116.97 120.64 2aqb h TYR 254 Ca -0.36 -0.00 0.10 0.00 0.05 0.00 0.00 58.73 58.51 2aqb h TYR 254 Cb 1.17 0.02 -0.11 0.00 1.01 0.00 0.00 36.73 38.82 2aqb h TYR 254 CO 0.59 0.58 0.40 0.00 -1.05 0.00 0.00 178.16 178.68 2aqb s ALA 255 N -3.05 -1.65 0.01 3.88 0.00 -1.25 -4.59 121.76 115.11 2aqb s ALA 255 Ca -0.15 0.48 -0.13 0.00 0.00 0.00 0.00 51.96 52.16 2aqb s ALA 255 Cb -0.01 0.64 -0.06 0.00 0.00 0.00 0.00 23.12 23.69 2aqb s ALA 255 CO 0.55 -0.85 0.39 -2.00 0.00 0.00 0.00 175.76 173.85 2aqb s GLU 256 N -3.41 3.85 -0.67 0.00 2.12 0.20 -0.98 118.70 119.82 2aqb s GLU 256 Ca 0.07 0.32 -0.27 0.00 0.36 0.00 0.00 54.97 55.45 2aqb s GLU 256 Cb -0.02 -3.17 0.02 0.00 0.26 0.00 0.00 34.13 31.23 2aqb s GLU 256 CO -0.05 0.67 1.31 0.42 -0.54 0.00 0.00 175.26 177.07 2aqb s ILE 257 N -1.14 3.79 -0.79 -3.70 -1.09 0.07 -1.02 121.20 117.30 2aqb s ILE 257 Ca 0.25 0.57 0.23 0.00 -2.23 0.00 0.00 60.65 59.46 2aqb s ILE 257 Cb -0.16 -4.75 -0.15 0.00 -1.58 0.00 0.00 42.46 35.83 2aqb s ILE 257 CO 0.14 -1.57 1.02 1.33 -1.23 0.00 0.00 174.94 174.63 2aqb n VAL 258 N 6.57 0.06 -3.72 2.92 0.24 -0.45 -4.59 118.33 119.37 2aqb n VAL 258 Ca 0.07 -0.12 -0.13 0.00 -2.04 0.00 0.00 64.34 62.12 2aqb n VAL 258 Cb 0.49 0.49 -0.10 0.00 -1.47 0.00 0.00 33.84 33.26 2aqb n VAL 258 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2aqb s GLY 259 N -3.34 -0.34 -0.14 7.63 0.00 -1.12 -4.84 107.32 105.18 2aqb s GLY 259 Ca 0.06 1.28 -0.04 0.00 0.00 0.00 0.00 44.72 46.02 2aqb s GLY 259 CO 0.81 1.11 0.15 -0.47 0.00 0.00 0.00 173.10 174.70 2aqb s TYR 260 N 0.28 -0.06 -0.12 1.90 5.04 -1.26 -1.08 117.35 122.05 2aqb s TYR 260 Ca -0.00 0.16 -0.05 0.00 -2.44 0.00 0.00 57.07 54.73 2aqb s TYR 260 Cb -0.03 -0.45 -0.04 0.00 0.35 0.00 0.00 41.96 41.78 2aqb s TYR 260 CO 0.00 -0.44 0.08 0.20 -1.34 0.00 0.00 175.55 174.05 2aqb s GLY 261 N 2.24 2.03 -0.17 8.97 0.00 -0.07 -4.37 107.32 115.94 2aqb s GLY 261 Ca 0.04 -0.71 -0.04 0.00 0.00 0.00 0.00 44.72 44.01 2aqb s GLY 261 CO -0.08 -0.39 0.18 0.00 0.00 0.00 0.00 173.10 172.81 2aqb s ALA 262 N -0.80 -0.09 0.39 3.20 0.00 -1.26 -1.48 121.76 121.72 2aqb s ALA 262 Ca 0.13 0.21 0.05 0.00 0.00 0.00 0.00 51.96 52.35 2aqb s ALA 262 Cb -0.12 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.85 2aqb s ALA 262 CO 0.03 -1.04 0.20 0.25 0.00 0.00 0.00 175.76 175.19 2aqb n THR 263 N 5.31 0.00 -4.22 0.00 -2.24 -0.71 -4.98 114.28 107.44 2aqb n THR 263 Ca -0.06 -2.46 -0.17 0.00 -2.27 0.00 0.00 64.05 59.10 2aqb n THR 263 Cb 0.49 1.00 -0.14 0.00 -2.10 0.00 0.00 70.33 69.58 2aqb n THR 263 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2aqb s SER 264 N -3.51 0.75 0.04 3.42 0.15 -1.26 -1.71 113.70 111.58 2aqb s SER 264 Ca 0.28 -0.13 -0.18 0.00 0.70 0.00 0.00 55.95 56.62 2aqb s SER 264 Cb 0.01 -0.08 -0.19 0.00 -1.71 0.00 0.00 66.02 64.06 2aqb s SER 264 CO 0.20 0.07 1.22 0.44 1.20 0.00 0.00 173.24 176.36 2aqb h ASP 265 N 5.94 0.61 -6.28 5.45 5.19 -0.89 -3.44 116.42 123.00 2aqb h ASP 265 Ca -0.29 -0.65 -0.47 0.00 -0.62 0.00 0.00 57.03 55.00 2aqb h ASP 265 Cb 1.19 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 40.49 2aqb h ASP 265 CO 0.50 1.17 -0.77 0.61 -3.12 0.00 0.00 179.24 177.63 2aqb n GLY 266 N 0.75 -0.47 0.00 2.75 0.00 -1.26 -4.87 105.19 102.08 2aqb n GLY 266 Ca -0.08 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2aqb n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aqb n ALA 267 N -4.65 1.53 -2.41 4.61 0.00 -1.26 -5.14 120.51 113.19 2aqb n ALA 267 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 2aqb n ALA 267 Cb 0.54 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.87 2aqb n ALA 267 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2aqb s ASP 268 N 1.00 3.43 0.14 0.00 1.01 -1.26 -5.07 116.67 115.92 2aqb s ASP 268 Ca 0.00 -0.77 -0.10 0.00 0.71 0.00 0.00 52.55 52.38 2aqb s ASP 268 Cb 0.00 -0.27 -0.05 0.00 1.01 0.00 0.00 42.92 43.61 2aqb s ASP 268 CO 0.00 0.16 1.44 0.24 0.21 0.00 0.00 175.17 177.22 2aqb h MET 269 N 3.60 0.88 0.00 8.23 2.86 -2.00 -3.37 114.93 125.12 2aqb h MET 269 Ca -0.49 -0.52 0.00 0.00 -2.06 0.00 0.00 59.70 56.63 2aqb h MET 269 Cb 1.18 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.89 2aqb h MET 269 CO 0.43 1.16 0.00 1.33 1.06 0.00 0.00 176.91 180.89 2aqb n VAL 270 N -4.02 0.00 -5.21 -2.22 0.24 -1.26 -0.09 118.33 105.76 2aqb n VAL 270 Ca -0.04 -0.28 -0.31 0.00 -2.04 0.00 0.00 64.34 61.67 2aqb n VAL 270 Cb 0.60 1.38 -0.15 0.00 -1.47 0.00 0.00 33.84 34.20 2aqb n VAL 270 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2aqb s ALA 271 N -0.07 2.27 0.48 2.33 0.00 -1.26 -4.98 121.76 120.53 2aqb s ALA 271 Ca 0.00 -1.08 -0.19 0.00 0.00 0.00 0.00 51.96 50.69 2aqb s ALA 271 Cb 0.00 -0.66 -0.09 0.00 0.00 0.00 0.00 23.12 22.37 2aqb s ALA 271 CO 0.00 0.52 0.99 -1.25 0.00 0.00 0.00 175.76 176.02 2aqb s PRO 272 N -0.56 3.97 0.07 0.00 0.04 -1.26 -4.36 135.00 132.89 2aqb s PRO 272 Ca 0.08 1.15 0.18 0.00 0.04 0.00 0.00 61.00 62.45 2aqb s PRO 272 Cb -0.11 -2.13 -0.13 0.00 0.04 0.00 0.00 34.50 32.17 2aqb s PRO 272 CO -0.00 -0.26 0.82 -1.13 0.04 0.00 0.00 177.00 176.47 2aqb n SER 273 N -1.07 0.81 0.00 6.66 3.41 -1.26 -4.99 113.62 117.19 2aqb n SER 273 Ca 0.08 0.35 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 2aqb n SER 273 Cb 0.54 0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.75 2aqb n SER 273 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2aqb n GLY 274 N 1.37 2.11 0.26 5.00 0.00 -1.26 -4.77 105.19 107.91 2aqb n GLY 274 Ca -0.09 -0.33 0.04 0.00 0.00 0.00 0.00 46.02 45.64 2aqb n GLY 274 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2aqb h GLU 275 N 0.00 0.15 -0.36 1.61 4.22 -1.94 -1.13 114.58 117.13 2aqb h GLU 275 Ca 0.00 -0.01 -0.11 0.00 0.08 0.00 0.00 59.36 59.32 2aqb h GLU 275 Cb 0.00 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2aqb h GLU 275 CO 0.00 0.10 -0.23 0.78 -2.18 0.00 0.00 179.01 177.48 2aqb h GLY 276 N 0.16 0.78 1.18 1.92 0.00 -1.86 -2.77 103.07 102.49 2aqb h GLY 276 Ca 0.38 -0.66 -0.12 0.00 0.00 0.00 0.00 47.33 46.93 2aqb h GLY 276 CO -0.57 0.60 -0.15 0.00 0.00 0.00 0.00 176.54 176.43 2aqb h ALA 277 N 1.12 0.80 -0.00 3.60 0.00 -1.80 -0.79 119.26 122.19 2aqb h ALA 277 Ca 0.09 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.67 2aqb h ALA 277 Cb 0.72 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 2aqb h ALA 277 CO 0.06 0.66 -0.22 0.28 0.00 0.00 0.00 179.25 180.03 2aqb h VAL 278 N 0.84 0.49 -0.64 0.00 2.07 -1.13 -1.25 116.25 116.62 2aqb h VAL 278 Ca 0.12 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 2aqb h VAL 278 Cb 0.70 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 2aqb h VAL 278 CO 0.05 0.00 0.36 0.03 0.02 0.00 0.00 177.57 178.03 2aqb h ARG 279 N -0.35 0.88 -0.18 1.57 3.08 -1.38 -1.19 114.38 116.82 2aqb h ARG 279 Ca 0.06 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2aqb h ARG 279 Cb 0.42 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 2aqb h ARG 279 CO -0.20 0.64 0.06 0.00 -1.07 0.00 0.00 179.97 179.40 2aqb h MET 281 N 0.12 0.50 -0.84 0.00 2.86 -1.10 -1.86 114.93 114.61 2aqb h MET 281 Ca 0.06 -0.19 0.10 0.00 -2.06 0.00 0.00 59.70 57.61 2aqb h MET 281 Cb 0.23 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 31.79 2aqb h MET 281 CO -0.00 0.71 0.49 0.87 1.06 0.00 0.00 176.91 180.04 2aqb h LYS 282 N 0.26 0.79 -0.77 1.72 1.57 -1.23 -1.34 116.57 117.57 2aqb h LYS 282 Ca 0.07 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 2aqb h LYS 282 Cb 0.52 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 2aqb h LYS 282 CO 0.02 0.52 0.27 1.98 -0.57 0.00 0.00 179.45 181.68 2aqb h MET 283 N 0.81 1.17 0.00 3.15 4.05 -0.96 -2.31 114.93 120.84 2aqb h MET 283 Ca 0.41 -0.23 -0.02 0.00 -0.28 0.00 0.00 59.70 59.58 2aqb h MET 283 Cb 0.38 -0.18 -0.00 0.00 -0.80 0.00 0.00 31.60 31.00 2aqb h MET 283 CO -0.25 0.97 -0.09 0.00 0.23 0.00 0.00 176.91 177.76 2aqb h ALA 284 N 1.17 1.04 -0.01 0.39 0.00 -0.81 -3.08 119.26 117.95 2aqb h ALA 284 Ca 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2aqb h ALA 284 Cb 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2aqb h ALA 284 CO -0.01 0.11 -0.37 -1.33 0.00 0.00 0.00 179.25 177.65 2aqb n MET 285 N -3.25 0.79 -1.71 0.00 2.00 -0.55 -4.15 117.12 110.24 2aqb n MET 285 Ca 0.00 -0.52 -0.42 0.00 0.00 0.00 0.00 57.70 56.76 2aqb n MET 285 Cb 0.33 -1.49 -0.03 0.00 0.00 0.00 0.00 33.22 32.03 2aqb n MET 285 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 2aqb s HIS 286 N -2.57 2.14 0.00 2.03 3.76 -1.03 -1.38 115.29 118.24 2aqb s HIS 286 Ca 0.21 -0.03 0.00 0.00 -0.15 0.00 0.00 55.06 55.09 2aqb s HIS 286 Cb 0.19 -4.18 0.00 0.00 1.11 0.00 0.00 32.58 29.69 2aqb s HIS 286 CO 0.57 -4.88 0.00 0.41 -0.85 0.00 0.00 174.74 169.99 2aqb n GLY 287 N 4.24 0.90 3.44 -2.22 0.00 -1.26 -4.95 105.19 105.33 2aqb n GLY 287 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 2aqb n GLY 287 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aqb s VAL 288 N -3.15 4.96 -1.91 1.61 1.01 -0.48 -4.92 120.40 117.52 2aqb s VAL 288 Ca 0.00 -0.60 0.19 0.00 0.00 0.00 0.00 61.98 61.58 2aqb s VAL 288 Cb 0.00 -4.25 0.42 0.00 0.00 0.00 0.00 36.38 32.55 2aqb s VAL 288 CO 0.00 -0.74 1.35 0.47 0.00 0.00 0.00 175.10 176.18 2aqb n ASP 289 N 5.95 3.32 -4.89 3.32 8.00 -1.26 -4.90 116.55 126.08 2aqb n ASP 289 Ca -0.08 -1.94 -0.31 0.00 0.71 0.00 0.00 54.79 53.18 2aqb n ASP 289 Cb 0.45 -0.28 -0.04 0.00 -0.02 0.00 0.00 41.12 41.23 2aqb n ASP 289 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2aqb s THR 290 N -1.21 5.07 0.56 -3.53 -4.23 -1.26 -5.09 115.64 105.95 2aqb s THR 290 Ca 0.35 0.13 -0.17 0.00 -1.18 0.00 0.00 61.69 60.82 2aqb s THR 290 Cb 0.20 -3.66 -0.05 0.00 1.34 0.00 0.00 72.50 70.33 2aqb s THR 290 CO 0.27 -0.09 1.05 -2.16 -0.54 0.00 0.00 174.62 173.14 2aqb s PRO 291 N -2.96 3.47 -0.30 3.99 0.04 -1.26 -4.99 135.00 132.99 2aqb s PRO 291 Ca 0.43 1.22 -0.29 0.00 0.04 0.00 0.00 61.00 62.40 2aqb s PRO 291 Cb -0.11 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.38 2aqb s PRO 291 CO 0.25 -0.69 1.20 0.42 0.04 0.00 0.00 177.00 178.23 2aqb s ILE 292 N -2.36 4.30 -0.02 0.56 -1.09 -1.26 -4.44 121.20 116.89 2aqb s ILE 292 Ca 0.64 1.49 0.12 0.00 -2.23 0.00 0.00 60.65 60.67 2aqb s ILE 292 Cb -0.16 -4.26 -0.14 0.00 -1.58 0.00 0.00 42.46 36.32 2aqb s ILE 292 CO 0.33 -0.47 1.08 0.44 -1.23 0.00 0.00 174.94 175.09 2aqb h ASP 293 N 8.72 0.00 -3.63 3.58 3.32 -1.30 -3.41 116.42 123.70 2aqb h ASP 293 Ca -0.24 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.70 2aqb h ASP 293 Cb 1.08 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.38 2aqb h ASP 293 CO 1.03 0.82 -0.25 -0.47 -1.72 0.00 0.00 179.24 178.65 2aqb s TYR 294 N -2.77 -0.52 -0.23 4.55 5.04 -1.21 -3.69 117.35 118.52 2aqb s TYR 294 Ca -0.00 1.19 0.01 0.00 -2.44 0.00 0.00 57.07 55.83 2aqb s TYR 294 Cb 0.09 0.20 0.04 0.00 0.35 0.00 0.00 41.96 42.64 2aqb s TYR 294 CO 0.80 -0.27 -0.13 -1.17 -1.34 0.00 0.00 175.55 173.45 2aqb s LEU 295 N 0.68 2.92 -0.54 6.97 0.20 0.25 -0.80 118.68 128.35 2aqb s LEU 295 Ca -0.04 -0.98 -0.25 0.00 0.69 0.00 0.00 54.13 53.55 2aqb s LEU 295 Cb -0.05 -1.56 0.04 0.00 -0.43 0.00 0.00 46.19 44.19 2aqb s LEU 295 CO -0.05 -0.11 0.99 0.21 -0.29 0.00 0.00 176.35 177.10 2aqb s ASN 296 N 1.23 6.38 0.65 3.68 3.84 0.96 -2.63 114.94 129.05 2aqb s ASN 296 Ca -0.01 -0.20 -0.11 0.00 0.21 0.00 0.00 52.86 52.74 2aqb s ASN 296 Cb -0.17 -2.46 -0.02 0.00 -0.55 0.00 0.00 41.25 38.05 2aqb s ASN 296 CO -0.08 -1.25 1.04 -0.94 -2.79 0.00 0.00 177.10 173.08 2aqb s SER 297 N 2.79 5.90 0.10 -4.21 1.04 -1.06 -1.82 113.70 116.44 2aqb s SER 297 Ca 0.34 1.48 -0.20 0.00 0.48 0.00 0.00 55.95 58.06 2aqb s SER 297 Cb -0.11 -2.47 -0.08 0.00 0.10 0.00 0.00 66.02 63.47 2aqb s SER 297 CO 0.21 -1.09 1.66 -0.74 0.98 0.00 0.00 173.24 174.26 2aqb h HIS 298 N -0.48 0.32 -2.25 5.02 2.76 -1.91 -3.44 115.15 115.17 2aqb h HIS 298 Ca -0.44 -0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 57.69 2aqb h HIS 298 Cb 1.20 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 30.06 2aqb h HIS 298 CO 0.64 0.33 -0.08 0.41 -1.30 0.00 0.00 177.93 177.93 2aqb n GLY 299 N -0.80 0.01 0.00 5.26 0.00 -1.26 -4.85 105.19 103.56 2aqb n GLY 299 Ca -0.03 0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2aqb n GLY 299 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2aqb n THR 300 N 0.01 0.03 -1.13 2.61 -2.24 -1.26 -4.54 114.28 107.76 2aqb n THR 300 Ca -0.01 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2aqb n THR 300 Cb 0.04 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 2aqb n THR 300 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2aqb n SER 301 N -1.55 -0.57 -4.83 3.42 2.88 -1.26 -3.88 113.62 107.83 2aqb n SER 301 Ca 0.05 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.23 2aqb n SER 301 Cb 0.34 -0.28 -0.07 0.00 -0.75 0.00 0.00 64.21 63.45 2aqb n SER 301 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2aqb s THR 302 N -2.00 5.21 0.13 2.46 -4.23 -1.26 -1.46 115.64 114.48 2aqb s THR 302 Ca 0.00 0.09 -0.32 0.00 -1.18 0.00 0.00 61.69 60.28 2aqb s THR 302 Cb 0.00 -3.25 -0.10 0.00 1.34 0.00 0.00 72.50 70.49 2aqb s THR 302 CO 0.00 0.61 1.55 -0.65 -0.54 0.00 0.00 174.62 175.60 2aqb h PRO 303 N 5.05 -0.41 -0.03 3.99 0.11 -1.94 -2.40 132.00 136.37 2aqb h PRO 303 Ca -0.54 0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2aqb h PRO 303 Cb 1.22 0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 2aqb h PRO 303 CO 0.57 -0.28 -0.04 0.28 -0.21 0.00 0.00 178.00 178.33 2aqb h VAL 304 N -0.43 1.40 -0.36 3.15 2.07 -1.98 -3.37 116.25 116.72 2aqb h VAL 304 Ca 0.07 -1.23 0.01 0.00 0.82 0.00 0.00 66.70 66.37 2aqb h VAL 304 Cb 0.61 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.52 2aqb h VAL 304 CO -0.56 0.33 0.23 1.23 0.02 0.00 0.00 177.57 178.82 2aqb h GLY 305 N -0.41 0.51 0.43 2.17 0.00 -1.96 -2.56 103.07 101.25 2aqb h GLY 305 Ca 0.00 -0.18 0.06 0.00 0.00 0.00 0.00 47.33 47.21 2aqb h GLY 305 CO 0.01 0.17 -0.08 -0.55 0.00 0.00 0.00 176.54 176.09 2aqb h ASP 306 N 0.47 -0.28 1.59 0.19 5.19 -1.59 -2.38 116.42 119.62 2aqb h ASP 306 Ca 0.14 0.09 -0.05 0.00 -0.62 0.00 0.00 57.03 56.58 2aqb h ASP 306 Cb -0.04 0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.65 2aqb h ASP 306 CO -0.04 -0.10 -0.42 -0.37 -3.12 0.00 0.00 179.24 175.19 2aqb h VAL 307 N -0.01 0.36 -0.49 -1.35 -1.51 -1.72 -2.50 116.25 109.04 2aqb h VAL 307 Ca 0.14 -1.53 -0.07 0.00 -1.23 0.00 0.00 66.70 64.00 2aqb h VAL 307 Cb 0.22 2.10 -0.02 0.00 -2.13 0.00 0.00 31.29 31.46 2aqb h VAL 307 CO -0.29 0.21 0.03 0.50 -1.23 0.00 0.00 177.57 176.78 2aqb h LYS 308 N 0.00 0.84 -0.33 5.19 1.63 -1.24 -0.90 116.57 121.76 2aqb h LYS 308 Ca -0.02 -0.26 -0.13 0.00 -0.85 0.00 0.00 60.65 59.40 2aqb h LYS 308 Cb 1.19 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.73 2aqb h LYS 308 CO 0.03 0.87 -0.31 1.49 -3.45 0.00 0.00 179.45 178.08 2aqb h GLU 309 N 0.71 0.72 -0.78 1.90 4.81 -1.41 -2.31 114.58 118.21 2aqb h GLU 309 Ca 0.14 -0.33 -0.04 0.00 -0.13 0.00 0.00 59.36 59.00 2aqb h GLU 309 Cb 0.47 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 2aqb h GLU 309 CO 0.02 0.94 0.33 -0.07 -0.73 0.00 0.00 179.01 179.50 2aqb h LEU 310 N 0.61 1.05 -0.75 1.64 3.38 -1.25 -0.60 115.31 119.39 2aqb h LEU 310 Ca 0.07 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2aqb h LEU 310 Cb 0.83 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2aqb h LEU 310 CO 0.07 0.92 0.38 0.00 0.09 0.00 0.00 178.44 179.90 2aqb h ALA 311 N 1.17 0.96 -0.58 1.53 0.00 -1.10 -1.40 119.26 119.85 2aqb h ALA 311 Ca 0.26 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2aqb h ALA 311 Cb 0.18 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2aqb h ALA 311 CO -0.03 0.51 0.05 0.00 0.00 0.00 0.00 179.25 179.78 2aqb h ALA 312 N 1.19 1.00 -0.14 0.00 0.00 -0.92 -2.02 119.26 118.37 2aqb h ALA 312 Ca 0.26 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2aqb h ALA 312 Cb 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2aqb h ALA 312 CO -0.04 0.62 0.09 0.82 0.00 0.00 0.00 179.25 180.74 2aqb h ILE 313 N 0.89 1.07 -0.48 0.00 5.03 -0.79 -1.81 117.51 121.42 2aqb h ILE 313 Ca 0.17 -0.18 0.07 0.00 -0.12 0.00 0.00 64.86 64.81 2aqb h ILE 313 Cb 0.45 0.93 -0.06 0.00 -3.03 0.00 0.00 36.82 35.11 2aqb h ILE 313 CO 0.02 0.07 0.14 0.03 -0.68 0.00 0.00 178.15 177.72 2aqb h ARG 314 N 0.16 0.29 -0.64 2.37 3.08 -1.06 0.10 114.38 118.68 2aqb h ARG 314 Ca 0.05 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 2aqb h ARG 314 Cb 0.03 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 2aqb h ARG 314 CO -0.01 0.19 0.22 1.49 -1.07 0.00 0.00 179.97 180.79 2aqb h GLU 315 N 0.30 0.99 -0.23 0.04 4.57 -1.22 1.09 114.58 120.11 2aqb h GLU 315 Ca 0.23 -0.20 -0.09 0.00 -1.18 0.00 0.00 59.36 58.11 2aqb h GLU 315 Cb 0.27 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.71 2aqb h GLU 315 CO -0.27 0.86 -0.23 0.28 -1.18 0.00 0.00 179.01 178.47 2aqb h VAL 316 N 0.92 1.32 0.00 0.32 2.07 -1.03 -3.37 116.25 116.48 2aqb h VAL 316 Ca 0.21 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 66.34 2aqb h VAL 316 Cb 0.27 1.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2aqb h VAL 316 CO -0.01 0.43 -1.83 0.49 0.02 0.00 0.00 177.57 176.67 2aqb n PHE 317 N -4.39 0.00 0.00 1.57 3.01 0.32 -5.05 117.46 112.93 2aqb n PHE 317 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.41 2aqb n PHE 317 Cb 0.43 -0.42 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 2aqb n PHE 317 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2aqb n GLY 318 N 1.42 4.05 1.12 1.37 0.00 0.37 -1.16 105.19 112.36 2aqb n GLY 318 Ca -0.03 0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.19 2aqb n GLY 318 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2aqb n ASP 319 N 7.50 3.25 -1.69 1.61 10.43 -1.26 -3.88 116.55 132.50 2aqb n ASP 319 Ca 0.00 -2.05 -0.16 0.00 2.57 0.00 0.00 54.79 55.15 2aqb n ASP 319 Cb 0.00 -0.41 0.14 0.00 1.84 0.00 0.00 41.12 42.70 2aqb n ASP 319 CO 0.00 0.00 0.00 2.29 -1.07 0.00 0.00 177.20 178.42 2aqb n LYS 320 N 1.18 2.35 -2.11 -1.24 2.85 -0.31 -5.06 118.16 115.81 2aqb n LYS 320 Ca 0.20 -3.35 -0.41 0.00 -1.05 0.00 0.00 58.31 53.70 2aqb n LYS 320 Cb 0.53 -2.04 -0.02 0.00 -0.65 0.00 0.00 35.03 32.85 2aqb n LYS 320 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2aqb s SER 321 N -2.40 6.77 0.82 -5.58 1.04 -1.25 -4.93 113.70 108.17 2aqb s SER 321 Ca 0.51 2.64 -0.11 0.00 0.48 0.00 0.00 55.95 59.47 2aqb s SER 321 Cb 0.44 -2.64 0.12 0.00 0.10 0.00 0.00 66.02 64.04 2aqb s SER 321 CO 0.02 -0.56 1.17 -2.16 0.98 0.00 0.00 173.24 172.69 2aqb s PRO 322 N -1.29 1.59 0.29 4.02 0.04 -1.26 -4.83 135.00 133.57 2aqb s PRO 322 Ca 0.52 -0.25 -0.30 0.00 0.04 0.00 0.00 61.00 61.01 2aqb s PRO 322 Cb -0.40 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 32.02 2aqb s PRO 322 CO 0.49 -1.74 1.58 0.00 0.04 0.00 0.00 177.00 177.36 2aqb s ALA 323 N -3.55 3.73 -0.03 8.56 0.00 -1.24 -4.45 121.76 124.78 2aqb s ALA 323 Ca 0.66 1.55 0.05 0.00 0.00 0.00 0.00 51.96 54.21 2aqb s ALA 323 Cb -0.08 -3.64 -0.01 0.00 0.00 0.00 0.00 23.12 19.39 2aqb s ALA 323 CO 0.49 -0.97 -0.16 0.42 0.00 0.00 0.00 175.76 175.53 2aqb s ILE 324 N -0.07 1.33 -0.01 0.00 1.01 0.51 -0.59 121.20 123.39 2aqb s ILE 324 Ca 0.62 -0.69 -0.05 0.00 0.00 0.00 0.00 60.65 60.53 2aqb s ILE 324 Cb -0.47 -1.12 0.00 0.00 0.01 0.00 0.00 42.46 40.87 2aqb s ILE 324 CO 0.48 0.38 0.11 -0.94 0.00 0.00 0.00 174.94 174.97 2aqb s SER 325 N -0.19 0.02 -0.52 3.58 1.04 -1.08 -0.61 113.70 115.94 2aqb s SER 325 Ca 0.02 -0.12 -0.12 0.00 0.48 0.00 0.00 55.95 56.20 2aqb s SER 325 Cb -0.09 0.20 0.13 0.00 0.10 0.00 0.00 66.02 66.37 2aqb s SER 325 CO 0.00 -0.26 0.44 0.00 0.98 0.00 0.00 173.24 174.40 2aqb s ALA 326 N -0.98 3.54 -0.13 5.32 0.00 -1.26 -2.56 121.76 125.69 2aqb s ALA 326 Ca -0.11 -2.59 0.29 0.00 0.00 0.00 0.00 51.96 49.55 2aqb s ALA 326 Cb -0.06 -3.05 1.29 0.00 0.00 0.00 0.00 23.12 21.30 2aqb s ALA 326 CO 0.01 -1.98 1.86 1.79 0.00 0.00 0.00 175.76 177.44 2aqb h THR 327 N 5.94 0.00 -0.02 0.00 1.35 -1.85 -2.32 112.91 116.01 2aqb h THR 327 Ca -0.23 -0.26 0.01 0.00 -0.55 0.00 0.00 66.41 65.37 2aqb h THR 327 Cb 1.08 1.07 -0.00 0.00 -1.73 0.00 0.00 68.15 68.57 2aqb h THR 327 CO 0.93 0.00 0.06 0.11 -0.25 0.00 0.00 175.52 176.37 2aqb h LYS 328 N 0.00 0.00 0.00 4.72 1.57 -1.81 0.08 116.57 121.13 2aqb h LYS 328 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2aqb h LYS 328 Cb 0.32 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 2aqb h LYS 328 CO 0.00 0.00 -0.16 0.00 -0.57 0.00 0.00 179.45 178.72 2aqb h ALA 329 N 1.91 1.50 0.06 3.86 0.00 -1.67 -1.01 119.26 123.90 2aqb h ALA 329 Ca 0.01 -0.14 -0.28 0.00 0.00 0.00 0.00 54.91 54.49 2aqb h ALA 329 Cb 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2aqb h ALA 329 CO -0.00 0.20 -1.54 0.52 0.00 0.00 0.00 179.25 178.42 2aqb h MET 330 N 0.00 0.12 0.00 0.00 2.86 -1.26 -3.42 114.93 113.22 2aqb h MET 330 Ca -0.00 -0.20 -0.08 0.00 -2.06 0.00 0.00 59.70 57.36 2aqb h MET 330 Cb 0.33 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 2aqb h MET 330 CO 0.02 1.10 -1.50 0.25 1.06 0.00 0.00 176.91 177.84 2aqb n THR 331 N -4.05 0.70 -1.62 2.22 -2.24 -0.40 -0.86 114.28 108.03 2aqb n THR 331 Ca -0.32 -0.61 0.01 0.00 -2.27 0.00 0.00 64.05 60.87 2aqb n THR 331 Cb 0.83 -0.39 -0.00 0.00 -2.10 0.00 0.00 70.33 68.68 2aqb n THR 331 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2aqb n GLY 332 N 1.31 -2.15 3.17 3.38 0.00 -0.39 -4.59 105.19 105.93 2aqb n GLY 332 Ca -0.07 -1.46 -0.37 0.00 0.00 0.00 0.00 46.02 44.12 2aqb n GLY 332 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2aqb s HIS 333 N -0.69 3.43 -1.32 1.61 2.46 0.11 -4.60 115.29 116.29 2aqb s HIS 333 Ca 0.00 -2.02 0.08 0.00 0.47 0.00 0.00 55.06 53.59 2aqb s HIS 333 Cb 0.00 -2.77 0.33 0.00 -0.13 0.00 0.00 32.58 30.01 2aqb s HIS 333 CO 0.00 -0.88 1.15 -1.13 -2.47 0.00 0.00 174.74 171.41 2aqb n SER 334 N 4.67 2.48 0.00 9.88 3.41 -1.26 -1.18 113.62 131.62 2aqb n SER 334 Ca -0.08 -2.21 0.00 0.00 -0.26 0.00 0.00 58.87 56.32 2aqb n SER 334 Cb 0.42 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 2aqb n SER 334 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2aqb n LEU 335 N 0.38 0.00 0.30 1.04 4.77 -1.26 -1.86 117.00 120.36 2aqb n LEU 335 Ca 0.12 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.26 2aqb n LEU 335 Cb 0.48 0.00 0.93 0.00 -2.33 0.00 0.00 43.42 42.50 2aqb n LEU 335 CO 0.11 0.00 1.11 1.23 -1.33 0.00 0.00 177.39 178.51 2aqb h GLY 336 N 0.00 0.00 1.15 -0.72 0.00 -1.85 -2.08 103.07 99.57 2aqb h GLY 336 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2aqb h GLY 336 CO 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 176.54 176.07 2aqb n ALA 337 N -2.28 3.29 -0.22 3.60 0.00 -0.78 -2.56 120.51 121.57 2aqb n ALA 337 Ca -0.03 -0.30 -0.07 0.00 0.00 0.00 0.00 53.44 53.05 2aqb n ALA 337 Cb 0.11 -1.17 0.04 0.00 0.00 0.00 0.00 19.45 18.43 2aqb n ALA 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aqb h ALA 338 N 2.91 0.79 -0.03 0.00 0.00 -1.49 -2.17 119.26 119.27 2aqb h ALA 338 Ca 0.00 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2aqb h ALA 338 Cb 0.55 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2aqb h ALA 338 CO 0.00 0.31 -0.11 0.78 0.00 0.00 0.00 179.25 180.23 2aqb h GLY 339 N 0.83 -0.10 1.30 0.00 0.00 -1.76 -0.06 103.07 103.29 2aqb h GLY 339 Ca 0.22 0.13 -0.20 0.00 0.00 0.00 0.00 47.33 47.47 2aqb h GLY 339 CO -0.03 -0.11 -0.68 -0.24 0.00 0.00 0.00 176.54 175.48 2aqb h VAL 340 N -0.17 1.30 -0.84 4.60 3.04 -1.74 -1.92 116.25 120.53 2aqb h VAL 340 Ca 0.05 -1.92 -0.03 0.00 -1.01 0.00 0.00 66.70 63.79 2aqb h VAL 340 Cb 0.23 1.88 -0.04 0.00 -2.01 0.00 0.00 31.29 31.36 2aqb h VAL 340 CO -0.13 0.60 0.39 1.56 -1.01 0.00 0.00 177.57 178.99 2aqb h GLN 341 N 0.51 1.21 0.00 4.17 4.20 -1.26 -0.69 115.11 123.25 2aqb h GLN 341 Ca -0.02 -0.19 -0.19 0.00 0.06 0.00 0.00 58.65 58.31 2aqb h GLN 341 Cb 1.28 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 28.82 2aqb h GLN 341 CO 0.14 0.94 -0.91 0.93 -0.67 0.00 0.00 178.83 179.26 2aqb h GLU 342 N 1.20 0.00 -0.59 1.46 5.08 -1.01 -0.02 114.58 120.70 2aqb h GLU 342 Ca 0.29 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.64 2aqb h GLU 342 Cb 0.14 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 2aqb h GLU 342 CO -0.03 0.91 0.34 0.00 -1.00 0.00 0.00 179.01 179.22 2aqb h ALA 343 N 1.09 0.75 -0.08 3.43 0.00 -1.23 -1.32 119.26 121.90 2aqb h ALA 343 Ca -0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2aqb h ALA 343 Cb 1.64 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 2aqb h ALA 343 CO 0.12 0.25 0.05 0.82 0.00 0.00 0.00 179.25 180.48 2aqb h ILE 344 N 0.80 1.05 -0.46 0.00 2.04 -0.80 0.19 117.51 120.32 2aqb h ILE 344 Ca 0.21 -0.12 0.08 0.00 1.00 0.00 0.00 64.86 66.03 2aqb h ILE 344 Cb 0.01 0.99 -0.07 0.00 -0.74 0.00 0.00 36.82 37.01 2aqb h ILE 344 CO -0.04 0.04 0.06 1.88 0.00 0.00 0.00 178.15 180.09 2aqb h TYR 345 N 0.07 0.08 -0.45 1.37 0.05 -0.97 0.17 116.97 117.29 2aqb h TYR 345 Ca 0.03 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.84 2aqb h TYR 345 Cb 0.03 0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.78 2aqb h TYR 345 CO -0.06 -0.04 0.30 0.77 -1.05 0.00 0.00 178.16 178.08 2aqb h SER 346 N 0.18 0.51 -0.81 3.88 0.02 -0.96 -0.91 113.55 115.47 2aqb h SER 346 Ca 0.23 -0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.21 2aqb h SER 346 Cb 0.32 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 62.68 2aqb h SER 346 CO -0.33 0.37 0.51 -0.07 -1.14 0.00 0.00 176.83 176.17 2aqb h LEU 347 N 0.61 0.84 -0.66 5.07 4.07 -0.15 -0.78 115.31 124.30 2aqb h LEU 347 Ca 0.17 -0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.09 2aqb h LEU 347 Cb -0.06 -0.18 -0.03 0.00 1.08 0.00 0.00 40.66 41.46 2aqb h LEU 347 CO -0.04 0.57 0.28 -0.07 -1.08 0.00 0.00 178.44 178.11 2aqb h LEU 348 N 0.99 0.90 -0.86 1.67 3.38 -0.28 0.50 115.31 121.61 2aqb h LEU 348 Ca 0.33 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 2aqb h LEU 348 Cb 0.04 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 2aqb h LEU 348 CO -0.12 0.82 0.33 0.24 0.09 0.00 0.00 178.44 179.79 2aqb h MET 349 N 0.93 1.17 -0.02 1.13 2.86 -0.92 -1.15 114.93 118.93 2aqb h MET 349 Ca 0.22 -0.20 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2aqb h MET 349 Cb 0.18 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 2aqb h MET 349 CO -0.02 0.93 0.01 1.25 1.06 0.00 0.00 176.91 180.14 2aqb h LEU 350 N 1.14 0.03 -0.84 1.22 6.46 -0.88 -0.39 115.31 122.05 2aqb h LEU 350 Ca 0.27 -0.13 -0.06 0.00 -0.12 0.00 0.00 57.88 57.84 2aqb h LEU 350 Cb 0.19 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 2aqb h LEU 350 CO -0.02 0.15 0.21 -0.08 -0.62 0.00 0.00 178.44 178.07 2aqb h GLU 351 N -0.10 1.06 -0.18 1.25 4.57 -0.76 -3.29 114.58 117.12 2aqb h GLU 351 Ca 0.01 -0.22 0.00 0.00 -1.18 0.00 0.00 59.36 57.96 2aqb h GLU 351 Cb 0.13 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.56 2aqb h GLU 351 CO -0.00 0.91 0.00 0.72 -1.18 0.00 0.00 179.01 179.46 2aqb n HIS 352 N -4.26 0.23 -3.23 0.92 8.25 -0.45 -5.02 115.22 111.66 2aqb n HIS 352 Ca 0.05 -0.18 -0.15 0.00 -0.26 0.00 0.00 57.72 57.19 2aqb n HIS 352 Cb 0.23 -0.01 0.07 0.00 1.12 0.00 0.00 29.99 31.41 2aqb n HIS 352 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2aqb n GLY 353 N 0.90 -0.78 3.28 -1.41 0.00 -0.19 -4.95 105.19 102.05 2aqb n GLY 353 Ca 0.12 0.36 -0.09 0.00 0.00 0.00 0.00 46.02 46.41 2aqb n GLY 353 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2aqb s PHE 354 N -3.36 0.09 -0.20 1.61 -0.12 -1.02 -1.54 117.98 113.44 2aqb s PHE 354 Ca 0.27 -0.47 -0.03 0.00 -0.05 0.00 0.00 56.93 56.66 2aqb s PHE 354 Cb -0.04 0.06 -0.01 0.00 -0.63 0.00 0.00 43.02 42.41 2aqb s PHE 354 CO 0.70 -0.65 -0.07 0.42 -0.05 0.00 0.00 175.22 175.56 2aqb s ILE 355 N -3.87 3.20 0.41 -4.49 1.01 0.14 -4.59 121.20 113.02 2aqb s ILE 355 Ca 0.07 -0.56 -0.24 0.00 0.00 0.00 0.00 60.65 59.92 2aqb s ILE 355 Cb 0.03 -2.43 -0.08 0.00 0.01 0.00 0.00 42.46 39.99 2aqb s ILE 355 CO -0.09 0.46 1.12 0.00 0.00 0.00 0.00 174.94 176.43 2aqb s ALA 356 N 1.21 3.08 0.40 9.38 0.00 -1.26 -2.16 121.76 132.41 2aqb s ALA 356 Ca 0.02 0.85 -0.23 0.00 0.00 0.00 0.00 51.96 52.61 2aqb s ALA 356 Cb -0.14 -3.34 -0.10 0.00 0.00 0.00 0.00 23.12 19.54 2aqb s ALA 356 CO -0.02 -0.44 0.98 -1.25 0.00 0.00 0.00 175.76 175.03 2aqb s PRO 357 N -2.47 4.26 -0.62 0.00 0.04 -1.26 -4.75 135.00 130.19 2aqb s PRO 357 Ca 0.59 1.30 -0.23 0.00 0.04 0.00 0.00 61.00 62.69 2aqb s PRO 357 Cb -0.27 -2.42 0.06 0.00 0.04 0.00 0.00 34.50 31.91 2aqb s PRO 357 CO 0.33 -0.02 0.96 0.45 0.04 0.00 0.00 177.00 178.76 2aqb s SER 358 N -1.86 6.23 0.55 6.66 0.15 0.52 -4.74 113.70 121.20 2aqb s SER 358 Ca 0.59 -0.75 -0.01 0.00 0.70 0.00 0.00 55.95 56.47 2aqb s SER 358 Cb -0.15 -2.43 0.02 0.00 -1.71 0.00 0.00 66.02 61.75 2aqb s SER 358 CO 0.20 -1.37 0.79 0.27 1.20 0.00 0.00 173.24 174.34 2aqb s ILE 359 N 4.05 3.15 -1.21 6.45 -4.36 -1.26 -4.46 121.20 123.55 2aqb s ILE 359 Ca 0.25 -0.47 0.00 0.00 -0.26 0.00 0.00 60.65 60.17 2aqb s ILE 359 Cb -0.15 -3.21 0.00 0.00 1.25 0.00 0.00 42.46 40.35 2aqb s ILE 359 CO 0.13 -0.17 0.00 0.59 0.24 0.00 0.00 174.94 175.74 2aqb n ASN 360 N -2.38 -4.32 -4.44 4.36 3.02 -1.26 -4.46 115.26 105.78 2aqb n ASN 360 Ca 0.06 0.25 -0.44 0.00 -0.03 0.00 0.00 54.58 54.42 2aqb n ASN 360 Cb 0.59 -2.95 -0.03 0.00 -0.61 0.00 0.00 39.78 36.78 2aqb n ASN 360 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2aqb s ILE 361 N -2.45 4.62 -0.01 2.41 1.01 -1.26 -4.71 121.20 120.80 2aqb s ILE 361 Ca 0.00 -1.16 0.08 0.00 0.00 0.00 0.00 60.65 59.57 2aqb s ILE 361 Cb 0.00 -4.72 -0.23 0.00 0.01 0.00 0.00 42.46 37.51 2aqb s ILE 361 CO 0.00 -1.46 0.79 -0.33 0.00 0.00 0.00 174.94 173.95 2aqb h GLU 362 N 9.08 0.05 -2.96 2.79 5.08 -1.94 -3.43 114.58 123.25 2aqb h GLU 362 Ca -0.02 -0.08 -0.47 0.00 -1.00 0.00 0.00 59.36 57.79 2aqb h GLU 362 Cb 1.04 0.03 -0.40 0.00 0.50 0.00 0.00 28.75 29.92 2aqb h GLU 362 CO 1.13 0.72 -0.75 -2.00 -1.00 0.00 0.00 179.01 177.11 2aqb s GLU 363 N -2.62 0.10 0.16 2.33 2.12 -1.26 -5.05 118.70 114.48 2aqb s GLU 363 Ca -0.05 -0.17 -0.32 0.00 0.36 0.00 0.00 54.97 54.80 2aqb s GLU 363 Cb 0.08 -1.64 -0.10 0.00 0.26 0.00 0.00 34.13 32.73 2aqb s GLU 363 CO 0.82 -0.75 1.61 -1.17 -0.54 0.00 0.00 175.26 175.23 2aqb s LEU 364 N 2.14 4.37 0.25 2.70 1.98 -1.26 0.68 118.68 129.54 2aqb s LEU 364 Ca 0.04 2.64 -0.31 0.00 -2.89 0.00 0.00 54.13 53.61 2aqb s LEU 364 Cb -0.16 -3.59 -0.12 0.00 0.66 0.00 0.00 46.19 42.98 2aqb s LEU 364 CO -0.16 -0.86 1.57 -0.67 -1.89 0.00 0.00 176.35 174.34 2aqb n ASP 365 N 4.19 3.49 0.30 3.68 2.03 -0.51 -4.72 116.55 125.02 2aqb n ASP 365 Ca 0.14 1.12 0.16 0.00 0.52 0.00 0.00 54.79 56.74 2aqb n ASP 365 Cb 0.38 -1.52 0.93 0.00 -0.72 0.00 0.00 41.12 40.19 2aqb n ASP 365 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2aqb h GLU 366 N 5.12 0.00 0.00 -0.67 4.11 -1.92 0.31 114.58 121.54 2aqb h GLU 366 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 2aqb h GLU 366 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2aqb h GLU 366 CO 0.82 0.03 0.00 1.96 0.07 0.00 0.00 179.01 181.90 2aqb h GLN 367 N 0.00 0.00 -0.34 1.06 4.20 -1.98 -2.90 115.11 115.14 2aqb h GLN 367 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2aqb h GLN 367 Cb 0.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 2aqb h GLN 367 CO 0.00 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.16 2aqb n ALA 368 N -1.99 2.46 -1.77 3.87 0.00 0.10 -4.95 120.51 118.23 2aqb n ALA 368 Ca 0.01 -0.74 -0.40 0.00 0.00 0.00 0.00 53.44 52.31 2aqb n ALA 368 Cb 0.30 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 2aqb n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aqb s ALA 369 N -1.55 3.44 0.00 0.00 0.00 -1.10 -3.05 121.76 119.50 2aqb s ALA 369 Ca 0.33 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.60 2aqb s ALA 369 Cb 0.18 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.79 2aqb s ALA 369 CO 0.25 -0.77 0.00 0.41 0.00 0.00 0.00 175.76 175.65 2aqb n GLY 370 N 0.70 2.76 3.71 0.00 0.00 -1.26 -5.04 105.19 106.06 2aqb n GLY 370 Ca 0.01 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 2aqb n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aqb s LEU 371 N 0.00 2.92 -1.14 0.99 1.43 -1.17 -4.94 118.68 116.77 2aqb s LEU 371 Ca 0.00 2.05 -0.06 0.00 -1.03 0.00 0.00 54.13 55.10 2aqb s LEU 371 Cb 0.00 -4.55 0.27 0.00 0.03 0.00 0.00 46.19 41.94 2aqb s LEU 371 CO 0.00 -2.70 1.59 -3.20 0.23 0.00 0.00 176.35 172.27 2aqb n ASN 372 N -3.96 6.04 -4.56 2.29 4.05 -1.26 -4.97 115.26 112.87 2aqb n ASN 372 Ca 0.11 -3.32 -0.43 0.00 0.45 0.00 0.00 54.58 51.39 2aqb n ASN 372 Cb 0.52 -1.33 -0.05 0.00 1.23 0.00 0.00 39.78 40.15 2aqb n ASN 372 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2aqb s ILE 373 N -1.85 4.58 -0.19 -1.44 1.01 -1.26 -0.36 121.20 121.68 2aqb s ILE 373 Ca 0.33 0.68 -0.25 0.00 0.00 0.00 0.00 60.65 61.41 2aqb s ILE 373 Cb 0.06 -4.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.16 2aqb s ILE 373 CO 0.08 -0.72 0.83 0.54 0.00 0.00 0.00 174.94 175.67 2aqb s VAL 374 N 3.48 4.86 -1.24 2.92 0.11 0.22 -4.91 120.40 125.84 2aqb s VAL 374 Ca 0.34 1.62 0.12 0.00 -2.93 0.00 0.00 61.98 61.12 2aqb s VAL 374 Cb -0.11 -4.13 0.21 0.00 -1.53 0.00 0.00 36.38 30.82 2aqb s VAL 374 CO 0.23 -0.01 1.08 0.35 -3.33 0.00 0.00 175.10 173.42 2aqb n THR 375 N 4.91 0.50 -3.91 5.04 -2.24 -1.26 -0.35 114.28 116.97 2aqb n THR 375 Ca 0.05 -0.75 -0.13 0.00 -2.27 0.00 0.00 64.05 60.94 2aqb n THR 375 Cb 0.48 0.87 -0.14 0.00 -2.10 0.00 0.00 70.33 69.44 2aqb n THR 375 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2aqb s GLU 376 N -0.99 0.08 -0.00 -0.78 2.56 -1.26 -4.59 118.70 113.71 2aqb s GLU 376 Ca 0.19 -0.00 -0.34 0.00 0.00 0.00 0.00 54.97 54.81 2aqb s GLU 376 Cb 0.11 -0.12 -0.13 0.00 2.00 0.00 0.00 34.13 36.00 2aqb s GLU 376 CO 0.16 -0.01 1.75 2.41 -0.56 0.00 0.00 175.26 179.01 2aqb n THR 377 N 3.24 0.34 -3.88 -1.70 -1.04 -1.26 -4.62 114.28 105.36 2aqb n THR 377 Ca -0.15 -0.06 -0.27 0.00 -2.04 0.00 0.00 64.05 61.54 2aqb n THR 377 Cb 0.58 -1.68 -0.17 0.00 -1.82 0.00 0.00 70.33 67.24 2aqb n THR 377 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2aqb s THR 378 N 2.78 0.95 0.04 12.58 2.01 -0.92 -4.97 115.64 128.10 2aqb s THR 378 Ca 0.88 -0.30 -0.30 0.00 0.31 0.00 0.00 61.69 62.27 2aqb s THR 378 Cb -0.72 -1.03 -0.06 0.00 0.01 0.00 0.00 72.50 70.71 2aqb s THR 378 CO 0.47 0.30 1.31 -1.81 -0.69 0.00 0.00 174.62 174.21 2aqb s ASP 379 N 1.73 6.94 -0.26 3.53 1.01 -1.26 0.26 116.67 128.62 2aqb s ASP 379 Ca 0.04 2.09 -0.22 0.00 0.71 0.00 0.00 52.55 55.17 2aqb s ASP 379 Cb -0.13 -2.57 0.07 0.00 1.01 0.00 0.00 42.92 41.30 2aqb s ASP 379 CO -0.08 -0.62 0.67 -0.60 0.21 0.00 0.00 175.17 174.76 2aqb s ARG 380 N 1.71 0.77 -0.43 8.23 3.52 -0.59 -4.93 118.95 127.23 2aqb s ARG 380 Ca 0.61 0.98 -0.28 0.00 -0.13 0.00 0.00 55.73 56.91 2aqb s ARG 380 Cb -0.31 0.34 0.00 0.00 -1.56 0.00 0.00 34.95 33.42 2aqb s ARG 380 CO 0.27 -0.10 1.51 -2.00 -0.81 0.00 0.00 175.30 174.17 2aqb s GLU 381 N 0.58 3.44 0.08 5.12 2.56 -1.26 -3.24 118.70 125.97 2aqb s GLU 381 Ca -0.02 0.94 0.01 0.00 0.00 0.00 0.00 54.97 55.90 2aqb s GLU 381 Cb -0.05 -4.09 -0.04 0.00 2.00 0.00 0.00 34.13 31.95 2aqb s GLU 381 CO -0.03 -1.73 0.20 -0.51 -0.56 0.00 0.00 175.26 172.63 2aqb s LEU 382 N 5.97 4.25 0.00 2.70 1.43 -1.26 -5.02 118.68 126.76 2aqb s LEU 382 Ca 0.64 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.93 2aqb s LEU 382 Cb -0.15 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 43.21 2aqb s LEU 382 CO 0.31 0.15 0.00 0.41 0.23 0.00 0.00 176.35 177.45 2aqb n THR 383 N 0.17 0.00 -4.47 5.49 -1.04 -1.26 -4.90 114.28 108.27 2aqb n THR 383 Ca -0.06 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.71 2aqb n THR 383 Cb 0.52 -0.71 -0.17 0.00 -1.82 0.00 0.00 70.33 68.15 2aqb n THR 383 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2aqb s THR 384 N -1.87 1.02 0.07 12.58 2.01 -1.26 -0.61 115.64 127.57 2aqb s THR 384 Ca 0.00 -0.40 0.06 0.00 0.31 0.00 0.00 61.69 61.66 2aqb s THR 384 Cb 0.00 -0.95 -0.03 0.00 0.01 0.00 0.00 72.50 71.53 2aqb s THR 384 CO 0.00 0.33 -0.16 0.68 -0.69 0.00 0.00 174.62 174.78 2aqb s VAL 385 N 0.76 1.32 0.02 3.82 -7.23 0.66 -0.71 120.40 119.04 2aqb s VAL 385 Ca -0.13 -1.28 0.07 0.00 -1.81 0.00 0.00 61.98 58.83 2aqb s VAL 385 Cb -0.15 -1.21 -0.02 0.00 0.56 0.00 0.00 36.38 35.55 2aqb s VAL 385 CO 0.02 -0.09 -0.22 -0.32 -0.31 0.00 0.00 175.10 174.18 2aqb s MET 386 N -1.58 1.63 -0.05 4.82 -2.45 0.02 -0.36 119.30 121.32 2aqb s MET 386 Ca 0.02 -0.91 -0.01 0.00 -1.25 0.00 0.00 55.69 53.54 2aqb s MET 386 Cb -0.09 -1.68 0.03 0.00 1.25 0.00 0.00 34.83 34.33 2aqb s MET 386 CO 0.02 0.44 0.01 0.45 1.05 0.00 0.00 175.02 177.00 2aqb s SER 387 N -0.91 1.11 -0.11 1.11 0.15 -0.18 -0.03 113.70 114.84 2aqb s SER 387 Ca 0.09 -0.03 -0.05 0.00 0.70 0.00 0.00 55.95 56.65 2aqb s SER 387 Cb -0.09 -0.31 -0.04 0.00 -1.71 0.00 0.00 66.02 63.87 2aqb s SER 387 CO 0.01 -0.17 0.10 0.20 1.20 0.00 0.00 173.24 174.58 2aqb s ASN 388 N 1.67 6.06 -0.11 5.45 0.01 -0.75 -1.47 114.94 125.79 2aqb s ASN 388 Ca -0.00 0.38 -0.03 0.00 -0.71 0.00 0.00 52.86 52.49 2aqb s ASN 388 Cb -0.13 -1.90 0.04 0.00 0.41 0.00 0.00 41.25 39.68 2aqb s ASN 388 CO -0.03 0.40 0.05 -0.44 -1.51 0.00 0.00 177.10 175.56 2aqb s SER 389 N -1.00 1.84 -0.11 -1.22 0.01 0.29 -3.19 113.70 110.32 2aqb s SER 389 Ca 0.15 -0.28 0.02 0.00 1.31 0.00 0.00 55.95 57.15 2aqb s SER 389 Cb -0.12 -0.32 0.01 0.00 0.21 0.00 0.00 66.02 65.81 2aqb s SER 389 CO 0.04 -0.27 -0.18 -0.36 0.41 0.00 0.00 173.24 172.88 2aqb s PHE 390 N 2.06 2.15 0.41 2.43 0.08 -1.26 -0.06 117.98 123.78 2aqb s PHE 390 Ca 0.03 -0.97 0.07 0.00 0.12 0.00 0.00 56.93 56.19 2aqb s PHE 390 Cb -0.14 -1.50 -0.04 0.00 -0.57 0.00 0.00 43.02 40.76 2aqb s PHE 390 CO -0.06 -0.46 0.23 0.20 -0.10 0.00 0.00 175.22 175.03 2aqb s GLY 391 N 0.77 2.28 0.63 4.36 0.00 0.34 -4.51 107.32 111.18 2aqb s GLY 391 Ca -0.11 -2.05 -0.19 0.00 0.00 0.00 0.00 44.72 42.38 2aqb s GLY 391 CO 0.01 -1.86 1.28 0.69 0.00 0.00 0.00 173.10 173.22 2aqb n PHE 392 N -1.31 1.90 -0.46 1.90 3.72 -1.26 -3.02 117.46 118.93 2aqb n PHE 392 Ca -0.00 0.42 0.00 0.00 -0.05 0.00 0.00 57.45 57.82 2aqb n PHE 392 Cb 0.64 -2.27 0.00 0.00 -0.94 0.00 0.00 39.48 36.90 2aqb n PHE 392 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2aqb n GLY 393 N 0.93 0.76 2.42 1.37 0.00 0.87 -4.28 105.19 107.25 2aqb n GLY 393 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 2aqb n GLY 393 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aqb n GLY 394 N -2.35 0.04 3.62 -0.02 0.00 -1.17 -4.76 105.19 100.55 2aqb n GLY 394 Ca 0.00 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 2aqb n GLY 394 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2aqb s THR 395 N -2.87 5.00 -0.04 2.61 -1.32 -1.19 -0.22 115.64 117.61 2aqb s THR 395 Ca 0.16 0.05 0.05 0.00 -1.21 0.00 0.00 61.69 60.75 2aqb s THR 395 Cb -0.07 -3.31 -0.01 0.00 -1.51 0.00 0.00 72.50 67.61 2aqb s THR 395 CO 0.20 0.39 -0.21 0.20 -2.21 0.00 0.00 174.62 172.99 2aqb s ASN 396 N 0.88 2.55 -0.00 8.08 0.01 -0.69 -0.51 114.94 125.26 2aqb s ASN 396 Ca 0.06 -0.42 0.02 0.00 -0.71 0.00 0.00 52.86 51.81 2aqb s ASN 396 Cb -0.13 -0.62 -0.01 0.00 0.41 0.00 0.00 41.25 40.90 2aqb s ASN 396 CO 0.03 0.21 -0.06 0.00 -1.51 0.00 0.00 177.10 175.77 2aqb s ALA 397 N -0.14 0.45 -0.03 0.60 0.00 0.91 -1.73 121.76 121.82 2aqb s ALA 397 Ca -0.01 -0.27 0.01 0.00 0.00 0.00 0.00 51.96 51.69 2aqb s ALA 397 Cb -0.12 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 22.91 2aqb s ALA 397 CO 0.02 0.10 -0.05 0.99 0.00 0.00 0.00 175.76 176.82 2aqb s THR 398 N -0.22 0.50 -0.09 0.00 2.01 -0.55 -0.55 115.64 116.74 2aqb s THR 398 Ca 0.01 -0.16 0.03 0.00 0.31 0.00 0.00 61.69 61.87 2aqb s THR 398 Cb -0.03 -0.49 -0.02 0.00 0.01 0.00 0.00 72.50 71.98 2aqb s THR 398 CO -0.00 0.19 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.19 2aqb s LEU 399 N 0.51 2.58 -0.15 4.42 1.43 -0.54 -0.90 118.68 126.02 2aqb s LEU 399 Ca -0.06 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.73 2aqb s LEU 399 Cb -0.10 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.59 2aqb s LEU 399 CO -0.00 0.25 -0.19 -0.69 0.23 0.00 0.00 176.35 175.95 2aqb s VAL 400 N -0.15 2.30 -0.05 -1.59 1.01 -0.25 -1.01 120.40 120.66 2aqb s VAL 400 Ca -0.01 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.14 2aqb s VAL 400 Cb -0.14 -1.95 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 2aqb s VAL 400 CO 0.03 0.53 -0.23 -0.04 0.00 0.00 0.00 175.10 175.40 2aqb s MET 401 N 0.91 2.24 -0.04 2.72 -1.94 0.51 -1.34 119.30 122.36 2aqb s MET 401 Ca -0.04 -0.82 0.02 0.00 -1.71 0.00 0.00 55.69 53.14 2aqb s MET 401 Cb -0.15 -1.95 0.01 0.00 2.01 0.00 0.00 34.83 34.75 2aqb s MET 401 CO -0.03 0.37 -0.10 0.50 -0.01 0.00 0.00 175.02 175.75 2aqb s ARG 402 N -0.18 1.19 0.33 2.03 3.52 -0.19 -0.25 118.95 125.40 2aqb s ARG 402 Ca -0.01 -0.31 -0.28 0.00 -0.13 0.00 0.00 55.73 54.99 2aqb s ARG 402 Cb -0.12 -1.07 -0.13 0.00 -1.56 0.00 0.00 34.95 32.07 2aqb s ARG 402 CO 0.02 0.06 1.23 1.63 -0.81 0.00 0.00 175.30 177.44 2aqb n LYS 403 N 3.57 1.95 0.00 5.12 5.02 0.22 -0.63 118.16 133.41 2aqb n LYS 403 Ca -0.21 0.69 0.13 0.00 -2.02 0.00 0.00 58.31 56.89 2aqb n LYS 403 Cb 0.53 -2.22 0.28 0.00 -0.02 0.00 0.00 35.03 33.59 2aqb n LYS 403 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16