#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ae5 s ASN 2 N 0.00 3.49 -0.17 0.00 0.01 -0.31 -3.65 114.94 114.31 2ae5 s ASN 2 Ca 0.00 -0.90 -0.13 0.00 -0.71 0.00 0.00 52.86 51.12 2ae5 s ASN 2 Cb 0.00 -0.28 0.05 0.00 0.41 0.00 0.00 41.25 41.43 2ae5 s ASN 2 CO 0.00 0.10 0.43 -0.94 -1.51 0.00 0.00 177.10 175.18 2ae5 s SER 3 N -2.87 -0.48 -0.02 -1.22 1.04 -0.26 -3.41 113.70 106.49 2ae5 s SER 3 Ca 0.23 0.89 0.01 0.00 0.48 0.00 0.00 55.95 57.56 2ae5 s SER 3 Cb -0.07 0.85 0.01 0.00 0.10 0.00 0.00 66.02 66.91 2ae5 s SER 3 CO 0.11 -0.17 -0.02 0.26 0.98 0.00 0.00 173.24 174.40 2ae5 s TRP 4 N 0.70 0.38 -0.02 5.02 0.51 -1.23 -1.98 118.94 122.33 2ae5 s TRP 4 Ca -0.04 -0.05 0.04 0.00 -2.12 0.00 0.00 56.10 53.93 2ae5 s TRP 4 Cb -0.05 -0.36 -0.01 0.00 -0.81 0.00 0.00 33.47 32.24 2ae5 s TRP 4 CO -0.05 -0.08 -0.14 0.00 -0.51 0.00 0.00 176.95 176.17 2ae5 s ALA 5 N 0.51 1.22 -0.10 0.98 0.00 -0.60 -1.03 121.76 122.75 2ae5 s ALA 5 Ca -0.05 -0.58 0.02 0.00 0.00 0.00 0.00 51.96 51.35 2ae5 s ALA 5 Cb -0.08 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.69 2ae5 s ALA 5 CO -0.01 0.26 -0.16 0.08 0.00 0.00 0.00 175.76 175.93 2ae5 s VAL 6 N -0.15 1.52 0.60 0.00 1.01 -0.11 -1.33 120.40 121.95 2ae5 s VAL 6 Ca 0.02 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.15 2ae5 s VAL 6 Cb -0.08 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 2ae5 s VAL 6 CO 0.00 0.44 1.11 0.00 0.00 0.00 0.00 175.10 176.66 2ae5 s ALA 7 N 0.76 2.60 0.31 5.51 0.00 -0.06 -1.96 121.76 128.92 2ae5 s ALA 7 Ca -0.11 0.65 0.07 0.00 0.00 0.00 0.00 51.96 52.57 2ae5 s ALA 7 Cb -0.16 -3.33 0.84 0.00 0.00 0.00 0.00 23.12 20.48 2ae5 s ALA 7 CO 0.02 -1.00 1.69 -1.35 0.00 0.00 0.00 175.76 175.12 2ae5 h PRO 8 N 0.60 0.38 0.00 0.00 0.11 -1.81 -2.17 132.00 129.11 2ae5 h PRO 8 Ca -0.48 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 2ae5 h PRO 8 Cb 1.25 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 2ae5 h PRO 8 CO 0.56 0.25 -0.02 0.78 -0.21 0.00 0.00 178.00 179.36 2ae5 h GLY 9 N 0.39 0.00 -0.90 -0.55 0.00 -1.93 -1.43 103.07 98.65 2ae5 h GLY 9 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.95 2ae5 h GLY 9 CO -0.55 0.00 -0.02 1.17 0.00 0.00 0.00 176.54 177.14 2ae5 n LYS 10 N -3.49 1.83 -4.25 4.80 4.81 -0.82 -4.78 118.16 116.25 2ae5 n LYS 10 Ca -0.03 -1.25 -0.23 0.00 -0.87 0.00 0.00 58.31 55.94 2ae5 n LYS 10 Cb 0.12 -1.47 -0.07 0.00 0.02 0.00 0.00 35.03 33.62 2ae5 n LYS 10 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2ae5 s THR 11 N -2.03 3.27 0.04 3.15 -4.23 -0.54 -1.48 115.64 113.82 2ae5 s THR 11 Ca 0.34 -1.86 -0.17 0.00 -1.18 0.00 0.00 61.69 58.82 2ae5 s THR 11 Cb 0.21 -2.88 -0.26 0.00 1.34 0.00 0.00 72.50 70.91 2ae5 s THR 11 CO 0.34 -0.31 1.11 0.00 -0.54 0.00 0.00 174.62 175.22 2ae5 h ALA 12 N 1.79 0.05 0.00 3.99 0.00 -1.35 -3.35 119.26 120.39 2ae5 h ALA 12 Ca -0.44 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 53.79 2ae5 h ALA 12 Cb 1.25 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2ae5 h ALA 12 CO 0.62 0.56 -0.75 -0.91 0.00 0.00 0.00 179.25 178.76 2ae5 h ASN 13 N 0.15 0.00 0.00 0.00 2.35 -1.89 -3.49 115.58 112.70 2ae5 h ASN 13 Ca -0.13 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 2ae5 h ASN 13 Cb 1.64 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.01 2ae5 h ASN 13 CO 0.18 0.03 0.00 0.61 -1.65 0.00 0.00 177.43 176.61 2ae5 n GLY 14 N 1.22 1.02 3.19 2.83 0.00 -1.26 -5.08 105.19 107.11 2ae5 n GLY 14 Ca 0.02 -0.46 -0.26 0.00 0.00 0.00 0.00 46.02 45.31 2ae5 n GLY 14 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ae5 s ASN 15 N -2.48 2.25 0.72 1.61 0.02 -1.26 -4.72 114.94 111.08 2ae5 s ASN 15 Ca 0.00 -0.35 -0.15 0.00 -1.02 0.00 0.00 52.86 51.34 2ae5 s ASN 15 Cb 0.00 -0.32 0.03 0.00 0.02 0.00 0.00 41.25 40.98 2ae5 s ASN 15 CO 0.00 0.22 1.18 0.00 0.02 0.00 0.00 177.10 178.52 2ae5 s ALA 16 N -0.37 2.19 0.06 0.60 0.00 -1.26 -4.60 121.76 118.38 2ae5 s ALA 16 Ca 0.05 0.77 0.08 0.00 0.00 0.00 0.00 51.96 52.87 2ae5 s ALA 16 Cb -0.08 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 2ae5 s ALA 16 CO -0.00 -1.74 -0.22 -0.51 0.00 0.00 0.00 175.76 173.29 2ae5 s LEU 17 N -5.13 2.21 -0.01 0.00 1.43 -0.83 -1.31 118.68 115.04 2ae5 s LEU 17 Ca 0.72 -0.58 0.01 0.00 -1.03 0.00 0.00 54.13 53.25 2ae5 s LEU 17 Cb -0.26 -1.00 0.00 0.00 0.03 0.00 0.00 46.19 44.96 2ae5 s LEU 17 CO 0.45 0.15 -0.04 -0.22 0.23 0.00 0.00 176.35 176.92 2ae5 s LEU 18 N -1.40 1.87 -0.17 1.79 2.96 0.03 -0.93 118.68 122.84 2ae5 s LEU 18 Ca 0.08 -0.08 -0.01 0.00 -0.22 0.00 0.00 54.13 53.91 2ae5 s LEU 18 Cb -0.09 -0.24 -0.00 0.00 0.50 0.00 0.00 46.19 46.35 2ae5 s LEU 18 CO 0.03 0.03 -0.12 -0.22 -1.32 0.00 0.00 176.35 174.74 2ae5 s LEU 19 N 0.08 2.61 -0.20 -0.68 2.96 -0.20 -0.85 118.68 122.40 2ae5 s LEU 19 Ca -0.00 -0.43 -0.07 0.00 -0.22 0.00 0.00 54.13 53.41 2ae5 s LEU 19 Cb -0.04 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 45.00 2ae5 s LEU 19 CO -0.00 0.07 0.06 -1.10 -1.32 0.00 0.00 176.35 174.06 2ae5 s GLN 20 N 0.90 3.84 -0.42 1.98 -0.21 -0.02 -3.49 119.66 122.25 2ae5 s GLN 20 Ca -0.03 -0.41 0.08 0.00 0.02 0.00 0.00 55.36 55.02 2ae5 s GLN 20 Cb -0.15 -3.23 0.35 0.00 1.00 0.00 0.00 33.01 30.98 2ae5 s GLN 20 CO -0.01 0.11 1.27 -1.71 -2.12 0.00 0.00 175.29 172.83 2ae5 n ASN 21 N 4.02 -2.02 -4.77 5.90 4.05 -1.22 -1.32 115.26 119.91 2ae5 n ASN 21 Ca -0.16 -2.84 -0.39 0.00 0.45 0.00 0.00 54.58 51.64 2ae5 n ASN 21 Cb 0.52 1.33 -0.01 0.00 1.23 0.00 0.00 39.78 42.85 2ae5 n ASN 21 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2ae5 s PRO 22 N 0.21 4.01 -0.23 1.20 0.04 -1.24 -1.16 135.00 137.83 2ae5 s PRO 22 Ca 0.21 1.96 -0.01 0.00 0.04 0.00 0.00 61.00 63.21 2ae5 s PRO 22 Cb 0.35 -2.71 0.02 0.00 0.04 0.00 0.00 34.50 32.20 2ae5 s PRO 22 CO -0.08 -0.39 -0.09 -1.01 0.04 0.00 0.00 177.00 175.47 2ae5 s HIS 23 N -1.35 2.98 0.26 0.56 3.76 -1.26 -3.65 115.29 116.59 2ae5 s HIS 23 Ca 0.57 -1.49 -0.04 0.00 -0.15 0.00 0.00 55.06 53.95 2ae5 s HIS 23 Cb -0.34 -2.03 -0.02 0.00 1.11 0.00 0.00 32.58 31.31 2ae5 s HIS 23 CO 0.43 -0.72 0.33 -0.51 -0.85 0.00 0.00 174.74 173.42 2ae5 s LEU 24 N 1.34 0.93 0.38 0.89 1.43 -1.24 -4.47 118.68 117.95 2ae5 s LEU 24 Ca 0.02 -1.31 -0.27 0.00 -1.03 0.00 0.00 54.13 51.54 2ae5 s LEU 24 Cb -0.15 1.08 -0.11 0.00 0.03 0.00 0.00 46.19 47.03 2ae5 s LEU 24 CO -0.06 -1.06 1.33 -0.24 0.23 0.00 0.00 176.35 176.55 2ae5 n SER 25 N -0.71 2.94 0.07 2.29 2.88 -1.26 -3.05 113.62 116.78 2ae5 n SER 25 Ca 0.01 1.17 0.12 0.00 -1.33 0.00 0.00 58.87 58.85 2ae5 n SER 25 Cb 0.63 -1.53 0.47 0.00 -0.75 0.00 0.00 64.21 63.03 2ae5 n SER 25 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 2ae5 n TRP 26 N 0.13 0.59 -0.02 0.66 7.02 -0.49 -4.34 117.44 120.99 2ae5 n TRP 26 Ca 0.05 0.19 -0.02 0.00 -1.02 0.00 0.00 57.50 56.69 2ae5 n TRP 26 Cb 0.38 -0.80 -0.02 0.00 -2.42 0.00 0.00 31.31 28.45 2ae5 n TRP 26 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2ae5 n THR 27 N -1.99 0.22 -1.67 -0.99 -2.24 -1.26 -5.01 114.28 101.33 2ae5 n THR 27 Ca 0.05 -0.11 -0.51 0.00 -2.27 0.00 0.00 64.05 61.21 2ae5 n THR 27 Cb 0.34 -0.77 -0.06 0.00 -2.10 0.00 0.00 70.33 67.74 2ae5 n THR 27 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2ae5 n THR 28 N -2.38 0.48 -0.15 4.28 -1.04 -1.26 -4.86 114.28 109.34 2ae5 n THR 28 Ca -0.06 -0.11 -0.05 0.00 -2.04 0.00 0.00 64.05 61.79 2ae5 n THR 28 Cb 0.59 -1.70 0.04 0.00 -1.82 0.00 0.00 70.33 67.44 2ae5 n THR 28 CO 0.00 0.00 0.00 -2.24 -0.64 0.00 0.00 175.07 172.19 2ae5 h ASP 29 N 9.03 0.35 0.78 8.00 3.04 -1.95 -1.97 116.42 133.70 2ae5 h ASP 29 Ca -0.46 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 2ae5 h ASP 29 Cb 1.29 -0.04 0.00 0.00 -1.04 0.00 0.00 39.33 39.54 2ae5 h ASP 29 CO 0.96 0.25 0.00 0.00 -2.04 0.00 0.00 179.24 178.40 2ae5 n TYR 30 N -4.89 0.12 0.86 4.15 0.18 -1.26 -2.01 117.16 114.30 2ae5 n TYR 30 Ca 0.03 0.04 0.12 0.00 1.88 0.00 0.00 57.90 59.97 2ae5 n TYR 30 Cb 0.12 -0.57 0.28 0.00 -0.38 0.00 0.00 39.34 38.79 2ae5 n TYR 30 CO 0.00 0.00 0.00 1.19 -2.08 0.00 0.00 176.86 175.97 2ae5 n PHE 31 N -1.60 0.26 -2.36 -3.48 0.99 -0.75 -4.58 117.46 105.94 2ae5 n PHE 31 Ca 0.05 -0.13 -0.42 0.00 -0.00 0.00 0.00 57.45 56.95 2ae5 n PHE 31 Cb 0.26 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 38.71 2ae5 n PHE 31 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 2ae5 s THR 32 N -1.74 3.88 0.21 4.37 2.01 -0.85 -4.81 115.64 118.71 2ae5 s THR 32 Ca 0.35 1.34 -0.06 0.00 0.31 0.00 0.00 61.69 63.62 2ae5 s THR 32 Cb 0.20 -3.86 -0.06 0.00 0.01 0.00 0.00 72.50 68.80 2ae5 s THR 32 CO 0.30 0.09 0.48 -0.31 -0.69 0.00 0.00 174.62 174.48 2ae5 s TYR 33 N 1.25 3.46 -0.02 4.92 1.51 -1.26 -1.19 117.35 126.01 2ae5 s TYR 33 Ca 0.60 0.67 0.01 0.00 -1.01 0.00 0.00 57.07 57.33 2ae5 s TYR 33 Cb -0.31 -2.10 0.02 0.00 -0.11 0.00 0.00 41.96 39.46 2ae5 s TYR 33 CO 0.29 0.31 -0.02 -0.47 -1.11 0.00 0.00 175.55 174.55 2ae5 s TYR 34 N -1.82 0.43 -0.13 2.71 5.04 -0.22 -4.89 117.35 118.47 2ae5 s TYR 34 Ca 0.44 -0.07 -0.07 0.00 -2.44 0.00 0.00 57.07 54.92 2ae5 s TYR 34 Cb -0.11 -0.42 -0.04 0.00 0.35 0.00 0.00 41.96 41.74 2ae5 s TYR 34 CO 0.25 -0.10 0.14 -2.00 -1.34 0.00 0.00 175.55 172.49 2ae5 s GLU 35 N 0.65 3.57 0.24 4.97 2.12 -1.26 -1.75 118.70 127.24 2ae5 s GLU 35 Ca -0.07 -0.15 -0.22 0.00 0.36 0.00 0.00 54.97 54.89 2ae5 s GLU 35 Cb -0.10 -3.22 0.03 0.00 0.26 0.00 0.00 34.13 31.10 2ae5 s GLU 35 CO -0.01 0.69 0.76 0.00 -0.54 0.00 0.00 175.26 176.17 2ae5 s ALA 36 N -0.78 -1.35 -0.04 6.30 0.00 -0.35 -5.00 121.76 120.54 2ae5 s ALA 36 Ca 0.14 -0.14 -0.02 0.00 0.00 0.00 0.00 51.96 51.94 2ae5 s ALA 36 Cb -0.12 0.80 0.03 0.00 0.00 0.00 0.00 23.12 23.83 2ae5 s ALA 36 CO 0.03 -1.02 0.05 -1.58 0.00 0.00 0.00 175.76 173.24 2ae5 s HIS 37 N -3.76 0.14 -0.10 0.00 2.46 -1.26 -1.36 115.29 111.40 2ae5 s HIS 37 Ca 0.10 0.19 0.01 0.00 0.47 0.00 0.00 55.06 55.84 2ae5 s HIS 37 Cb -0.05 -0.49 -0.02 0.00 -0.13 0.00 0.00 32.58 31.89 2ae5 s HIS 37 CO 0.04 -0.20 -0.14 -0.51 -2.47 0.00 0.00 174.74 171.47 2ae5 s LEU 38 N 2.02 2.71 -0.06 8.88 1.02 -0.07 -5.01 118.68 128.17 2ae5 s LEU 38 Ca 0.03 -0.28 -0.01 0.00 0.02 0.00 0.00 54.13 53.89 2ae5 s LEU 38 Cb -0.12 -1.59 0.03 0.00 0.02 0.00 0.00 46.19 44.53 2ae5 s LEU 38 CO -0.03 0.23 0.01 -0.69 0.02 0.00 0.00 176.35 175.88 2ae5 s VAL 39 N -0.03 0.28 0.46 -1.59 1.01 -1.26 -1.67 120.40 117.60 2ae5 s VAL 39 Ca -0.03 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.13 2ae5 s VAL 39 Cb -0.14 -0.44 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 2ae5 s VAL 39 CO 0.04 0.23 0.05 0.42 0.00 0.00 0.00 175.10 175.84 2ae5 s THR 40 N 1.81 1.06 0.57 3.92 -4.23 -0.69 -5.03 115.64 113.05 2ae5 s THR 40 Ca 0.02 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.78 2ae5 s THR 40 Cb -0.13 -2.34 0.33 0.00 1.34 0.00 0.00 72.50 71.71 2ae5 s THR 40 CO -0.04 0.00 2.17 -0.65 -0.54 0.00 0.00 174.62 175.56 2ae5 h PRO 41 N 1.58 0.00 0.00 3.99 0.11 -2.06 -3.26 132.00 132.36 2ae5 h PRO 41 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2ae5 h PRO 41 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2ae5 h PRO 41 CO 0.69 0.00 -1.10 -0.25 -0.21 0.00 0.00 178.00 177.13 2ae5 n ASP 42 N -4.08 1.00 -3.74 -2.05 8.00 -1.26 -5.04 116.55 109.38 2ae5 n ASP 42 Ca -0.01 -0.52 -0.10 0.00 0.71 0.00 0.00 54.79 54.87 2ae5 n ASP 42 Cb 0.17 1.28 -0.05 0.00 -0.02 0.00 0.00 41.12 42.50 2ae5 n ASP 42 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2ae5 s PHE 43 N -2.68 -0.06 -0.10 1.24 -0.12 -1.23 -5.16 117.98 109.87 2ae5 s PHE 43 Ca 0.01 -0.28 -0.05 0.00 -0.05 0.00 0.00 56.93 56.56 2ae5 s PHE 43 Cb 0.11 0.25 0.04 0.00 -0.63 0.00 0.00 43.02 42.79 2ae5 s PHE 43 CO 0.63 -0.78 0.23 -2.00 -0.05 0.00 0.00 175.22 173.25 2ae5 s GLU 44 N -3.86 0.20 -0.01 1.99 2.12 -1.26 -1.71 118.70 116.17 2ae5 s GLU 44 Ca 0.08 0.49 0.00 0.00 0.36 0.00 0.00 54.97 55.90 2ae5 s GLU 44 Cb 0.01 -0.11 0.01 0.00 0.26 0.00 0.00 34.13 34.30 2ae5 s GLU 44 CO -0.06 -0.15 -0.01 0.96 -0.54 0.00 0.00 175.26 175.46 2ae5 s ILE 45 N 1.14 0.12 -0.02 -3.70 -4.36 -0.67 -4.66 121.20 109.05 2ae5 s ILE 45 Ca -0.08 -0.01 0.05 0.00 -0.26 0.00 0.00 60.65 60.34 2ae5 s ILE 45 Cb -0.10 -0.14 -0.01 0.00 1.25 0.00 0.00 42.46 43.47 2ae5 s ILE 45 CO -0.07 0.06 -0.17 -0.47 0.24 0.00 0.00 174.94 174.53 2ae5 s TYR 46 N 0.25 1.60 -5.00 1.37 5.04 -0.18 -0.89 117.35 119.53 2ae5 s TYR 46 Ca -0.02 -0.36 0.00 0.00 -2.44 0.00 0.00 57.07 54.25 2ae5 s TYR 46 Cb -0.04 -1.05 0.00 0.00 0.35 0.00 0.00 41.96 41.22 2ae5 s TYR 46 CO -0.01 -0.08 0.00 0.41 -1.34 0.00 0.00 175.55 174.54 2ae5 n GLY 47 N 2.84 0.19 3.53 8.97 0.00 -0.47 -1.07 105.19 119.18 2ae5 n GLY 47 Ca -0.16 -1.45 -0.26 0.00 0.00 0.00 0.00 46.02 44.14 2ae5 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ae5 s ALA 48 N -1.00 2.84 0.06 4.61 0.00 -0.76 -1.21 121.76 126.30 2ae5 s ALA 48 Ca 0.00 -1.55 -0.26 0.00 0.00 0.00 0.00 51.96 50.14 2ae5 s ALA 48 Cb 0.00 -0.60 0.08 0.00 0.00 0.00 0.00 23.12 22.60 2ae5 s ALA 48 CO 0.00 0.43 0.70 -0.08 0.00 0.00 0.00 175.76 176.82 2ae5 s THR 49 N -1.78 0.00 0.32 0.00 -1.32 -0.71 -1.43 115.64 110.71 2ae5 s THR 49 Ca 0.24 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.44 2ae5 s THR 49 Cb -0.08 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.81 2ae5 s THR 49 CO 0.14 0.00 1.32 -1.10 -2.21 0.00 0.00 174.62 172.77 2ae5 s GLN 50 N -2.87 4.35 0.35 7.08 1.11 -1.26 -1.06 119.66 127.36 2ae5 s GLN 50 Ca -0.01 2.22 -0.28 0.00 0.01 0.00 0.00 55.36 57.30 2ae5 s GLN 50 Cb -0.01 -3.08 -0.12 0.00 -1.01 0.00 0.00 33.01 28.79 2ae5 s GLN 50 CO -0.06 -0.21 1.29 0.44 0.01 0.00 0.00 175.29 176.76 2ae5 n ILE 51 N 0.99 2.04 0.00 1.08 -5.35 -0.34 -1.83 119.36 115.95 2ae5 n ILE 51 Ca 0.01 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.99 2ae5 n ILE 51 Cb 0.42 -1.58 0.00 0.00 -1.74 0.00 0.00 39.64 36.73 2ae5 n ILE 51 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ae5 n GLY 52 N 0.76 2.86 3.72 3.28 0.00 -1.26 -4.96 105.19 109.58 2ae5 n GLY 52 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2ae5 n GLY 52 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ae5 s LEU 53 N 0.00 4.41 0.00 0.99 1.43 -0.76 -4.97 118.68 119.78 2ae5 s LEU 53 Ca 0.00 1.70 0.20 0.00 -1.03 0.00 0.00 54.13 54.99 2ae5 s LEU 53 Cb 0.00 -3.57 0.85 0.00 0.03 0.00 0.00 46.19 43.51 2ae5 s LEU 53 CO 0.00 -0.19 1.59 -0.81 0.23 0.00 0.00 176.35 177.17 2ae5 n PRO 54 N 3.54 1.49 -4.13 1.29 -0.04 -1.26 -4.84 135.00 131.04 2ae5 n PRO 54 Ca 0.05 -0.73 -0.16 0.00 -0.04 0.00 0.00 63.50 62.61 2ae5 n PRO 54 Cb 0.50 -1.36 -0.12 0.00 -0.04 0.00 0.00 33.50 32.49 2ae5 n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2ae5 s VAL 55 N -1.86 0.91 -0.35 0.52 -7.23 -1.26 -5.11 120.40 106.02 2ae5 s VAL 55 Ca 0.30 -1.22 -0.24 0.00 -1.81 0.00 0.00 61.98 59.01 2ae5 s VAL 55 Cb 0.16 -0.90 0.01 0.00 0.56 0.00 0.00 36.38 36.20 2ae5 s VAL 55 CO 0.24 -0.28 0.85 -0.63 -0.31 0.00 0.00 175.10 174.97 2ae5 s ILE 56 N -1.31 4.69 0.09 -0.62 1.01 -1.26 -4.85 121.20 118.94 2ae5 s ILE 56 Ca -0.05 1.12 -0.02 0.00 0.00 0.00 0.00 60.65 61.70 2ae5 s ILE 56 Cb -0.10 -4.24 -0.27 0.00 0.01 0.00 0.00 42.46 37.86 2ae5 s ILE 56 CO 0.02 -0.42 1.18 0.03 0.00 0.00 0.00 174.94 175.74 2ae5 h ARG 57 N 8.35 0.23 -3.51 2.79 3.08 -1.93 -3.37 114.38 120.03 2ae5 h ARG 57 Ca -0.24 -0.39 -0.76 0.00 0.07 0.00 0.00 59.98 58.66 2ae5 h ARG 57 Cb 1.09 0.14 -0.31 0.00 0.08 0.00 0.00 29.97 30.97 2ae5 h ARG 57 CO 0.93 1.18 0.20 -0.06 -1.07 0.00 0.00 179.97 181.15 2ae5 s PHE 58 N -2.70 4.07 0.15 3.04 0.40 -0.51 -4.63 117.98 117.80 2ae5 s PHE 58 Ca -0.03 -2.75 0.09 0.00 -0.60 0.00 0.00 56.93 53.64 2ae5 s PHE 58 Cb 0.08 -3.61 -0.04 0.00 0.51 0.00 0.00 43.02 39.95 2ae5 s PHE 58 CO 0.87 -0.88 -0.14 0.00 0.70 0.00 0.00 175.22 175.78 2ae5 s ALA 59 N -1.12 2.82 0.21 5.36 0.00 -1.22 -1.82 121.76 125.99 2ae5 s ALA 59 Ca 0.28 -1.43 -0.13 0.00 0.00 0.00 0.00 51.96 50.68 2ae5 s ALA 59 Cb -0.09 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.35 2ae5 s ALA 59 CO -0.09 0.52 0.45 -0.59 0.00 0.00 0.00 175.76 176.04 2ae5 s PHE 60 N -1.47 0.22 0.00 0.00 -0.12 -0.24 -0.67 117.98 115.70 2ae5 s PHE 60 Ca 0.22 -0.58 0.00 0.00 -0.05 0.00 0.00 56.93 56.52 2ae5 s PHE 60 Cb -0.10 0.20 0.00 0.00 -0.63 0.00 0.00 43.02 42.49 2ae5 s PHE 60 CO 0.13 -0.90 0.00 0.27 -0.05 0.00 0.00 175.22 174.66 2ae5 n ASN 61 N -0.33 0.00 0.27 1.98 0.23 -0.16 -1.02 115.26 116.24 2ae5 n ASN 61 Ca -0.06 0.00 0.16 0.00 -0.53 0.00 0.00 54.58 54.15 2ae5 n ASN 61 Cb 0.62 0.00 0.69 0.00 -2.08 0.00 0.00 39.78 39.01 2ae5 n ASN 61 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2ae5 h GLN 62 N 0.00 0.00 0.00 -3.83 1.08 -1.98 -3.34 115.11 107.04 2ae5 h GLN 62 Ca 0.00 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.87 2ae5 h GLN 62 Cb 0.00 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.37 2ae5 h GLN 62 CO 0.00 0.05 -2.24 -2.13 -0.95 0.00 0.00 178.83 173.56 2ae5 n ARG 63 N -3.19 0.60 -3.93 1.46 0.63 -1.26 -4.76 116.66 106.22 2ae5 n ARG 63 Ca 0.00 0.11 -0.09 0.00 -0.92 0.00 0.00 57.85 56.96 2ae5 n ARG 63 Cb 0.31 -1.44 -0.03 0.00 0.45 0.00 0.00 32.46 31.75 2ae5 n ARG 63 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2ae5 s MET 64 N -2.44 1.80 0.08 -0.14 0.23 -1.26 -0.68 119.30 116.90 2ae5 s MET 64 Ca -0.28 -1.26 -0.26 0.00 -1.03 0.00 0.00 55.69 52.87 2ae5 s MET 64 Cb 0.07 0.54 0.07 0.00 -1.53 0.00 0.00 34.83 33.99 2ae5 s MET 64 CO 0.52 -0.80 0.64 0.20 -2.03 0.00 0.00 175.02 173.56 2ae5 s GLY 65 N -3.02 -0.60 0.22 3.16 0.00 -0.23 -0.99 107.32 105.86 2ae5 s GLY 65 Ca 0.18 0.81 0.04 0.00 0.00 0.00 0.00 44.72 45.75 2ae5 s GLY 65 CO 0.10 0.44 -0.04 -0.26 0.00 0.00 0.00 173.10 173.34 2ae5 s ILE 66 N -2.84 1.20 0.17 0.90 -4.36 0.15 -1.76 121.20 114.65 2ae5 s ILE 66 Ca -0.03 -2.06 -0.04 0.00 -0.26 0.00 0.00 60.65 58.25 2ae5 s ILE 66 Cb -0.01 -2.23 -0.03 0.00 1.25 0.00 0.00 42.46 41.44 2ae5 s ILE 66 CO -0.05 -0.43 0.18 0.28 0.24 0.00 0.00 174.94 175.16 2ae5 s THR 67 N -3.31 0.06 0.07 8.37 -1.32 -0.57 -3.44 115.64 115.50 2ae5 s THR 67 Ca 0.26 -1.73 0.06 0.00 -1.21 0.00 0.00 61.69 59.06 2ae5 s THR 67 Cb 0.04 -2.10 -0.03 0.00 -1.51 0.00 0.00 72.50 68.90 2ae5 s THR 67 CO 0.07 -0.27 -0.16 0.20 -2.21 0.00 0.00 174.62 172.26 2ae5 s ASN 68 N -3.05 1.86 0.09 8.08 0.01 -1.26 -1.07 114.94 119.60 2ae5 s ASN 68 Ca 0.25 -0.61 0.02 0.00 -0.71 0.00 0.00 52.86 51.81 2ae5 s ASN 68 Cb 0.05 -0.08 -0.04 0.00 0.41 0.00 0.00 41.25 41.60 2ae5 s ASN 68 CO 0.04 -0.03 -0.06 0.42 -1.51 0.00 0.00 177.10 175.95 2ae5 s THR 69 N -1.20 0.62 0.02 1.60 -4.23 -0.69 -4.64 115.64 107.12 2ae5 s THR 69 Ca 0.00 -1.79 -0.30 0.00 -1.18 0.00 0.00 61.69 58.42 2ae5 s THR 69 Cb -0.10 -1.50 -0.06 0.00 1.34 0.00 0.00 72.50 72.18 2ae5 s THR 69 CO 0.03 -0.81 1.36 -0.69 -0.54 0.00 0.00 174.62 173.97 2ae5 s VAL 70 N -3.31 3.74 -0.55 2.29 1.01 -1.26 -1.05 120.40 121.26 2ae5 s VAL 70 Ca 0.08 1.15 0.07 0.00 0.00 0.00 0.00 61.98 63.28 2ae5 s VAL 70 Cb 0.03 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 2ae5 s VAL 70 CO -0.04 0.02 0.45 -0.46 0.00 0.00 0.00 175.10 175.07 2ae5 n ASN 71 N 5.03 0.81 -1.82 3.32 6.94 -1.26 -4.49 115.26 123.79 2ae5 n ASN 71 Ca 0.12 -0.90 -0.19 0.00 -0.02 0.00 0.00 54.58 53.59 2ae5 n ASN 71 Cb 0.44 0.62 -0.04 0.00 -2.36 0.00 0.00 39.78 38.44 2ae5 n ASN 71 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2ae5 n GLY 72 N 0.88 0.59 3.61 4.83 0.00 -1.26 -4.90 105.19 108.94 2ae5 n GLY 72 Ca 0.02 -0.11 -0.61 0.00 0.00 0.00 0.00 46.02 45.33 2ae5 n GLY 72 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2ae5 n MET 73 N -2.65 0.27 -2.77 1.61 0.00 -1.26 -4.79 117.12 107.53 2ae5 n MET 73 Ca -0.21 0.10 -0.43 0.00 0.00 0.00 0.00 57.70 57.16 2ae5 n MET 73 Cb 0.64 -1.64 -0.01 0.00 0.00 0.00 0.00 33.22 32.22 2ae5 n MET 73 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 2ae5 s VAL 74 N 1.32 4.51 -2.62 1.12 1.01 -1.26 -4.75 120.40 119.74 2ae5 s VAL 74 Ca 0.95 -1.87 0.24 0.00 0.00 0.00 0.00 61.98 61.30 2ae5 s VAL 74 Cb -1.28 -4.99 0.37 0.00 0.00 0.00 0.00 36.38 30.48 2ae5 s VAL 74 CO 0.64 -1.77 1.42 0.61 0.00 0.00 0.00 175.10 176.00 2ae5 n GLY 75 N 5.27 1.10 3.14 4.51 0.00 -1.26 -4.55 105.19 113.39 2ae5 n GLY 75 Ca 0.37 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 2ae5 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ae5 s ALA 76 N -1.75 0.82 -0.05 4.61 0.00 -1.26 -0.96 121.76 123.17 2ae5 s ALA 76 Ca 0.34 -1.23 0.04 0.00 0.00 0.00 0.00 51.96 51.11 2ae5 s ALA 76 Cb 0.21 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.49 2ae5 s ALA 76 CO 0.31 -0.23 -0.15 0.99 0.00 0.00 0.00 175.76 176.68 2ae5 s THR 77 N -3.31 1.31 -0.23 0.00 2.01 -0.33 -4.94 115.64 110.15 2ae5 s THR 77 Ca 0.07 -0.63 -0.08 0.00 0.31 0.00 0.00 61.69 61.36 2ae5 s THR 77 Cb 0.03 -1.14 -0.04 0.00 0.01 0.00 0.00 72.50 71.36 2ae5 s THR 77 CO -0.05 0.38 0.10 0.20 -0.69 0.00 0.00 174.62 174.56 2ae5 s ASN 78 N 0.19 5.59 -0.13 3.53 -0.87 -1.26 -1.34 114.94 120.65 2ae5 s ASN 78 Ca -0.06 -0.02 -0.02 0.00 -1.57 0.00 0.00 52.86 51.18 2ae5 s ASN 78 Cb -0.12 -1.99 -0.02 0.00 -0.02 0.00 0.00 41.25 39.09 2ae5 s ASN 78 CO 0.02 0.06 -0.07 -0.31 -2.57 0.00 0.00 177.10 174.24 2ae5 s TYR 79 N 1.08 2.96 -0.31 2.20 1.51 -0.27 -1.44 117.35 123.08 2ae5 s TYR 79 Ca 0.05 -0.33 -0.29 0.00 -1.01 0.00 0.00 57.07 55.50 2ae5 s TYR 79 Cb -0.14 -1.89 0.01 0.00 -0.11 0.00 0.00 41.96 39.84 2ae5 s TYR 79 CO 0.04 -0.01 1.10 0.50 -1.11 0.00 0.00 175.55 176.06 2ae5 s ARG 80 N 0.16 4.07 0.29 -0.62 3.52 -0.53 -1.53 118.95 124.31 2ae5 s ARG 80 Ca -0.03 1.13 -0.21 0.00 -0.13 0.00 0.00 55.73 56.48 2ae5 s ARG 80 Cb -0.14 -3.74 -0.09 0.00 -1.56 0.00 0.00 34.95 29.41 2ae5 s ARG 80 CO 0.03 -0.90 0.82 -0.51 -0.81 0.00 0.00 175.30 173.94 2ae5 s LEU 81 N 3.68 4.27 -0.40 -0.88 1.43 -0.32 -0.45 118.68 126.01 2ae5 s LEU 81 Ca 0.47 1.58 -0.15 0.00 -1.03 0.00 0.00 54.13 54.99 2ae5 s LEU 81 Cb -0.13 -3.88 0.01 0.00 0.03 0.00 0.00 46.19 42.22 2ae5 s LEU 81 CO 0.15 -0.07 0.29 -0.89 0.23 0.00 0.00 176.35 176.07 2ae5 s THR 82 N -1.67 5.26 0.24 5.49 2.01 -1.26 -4.62 115.64 121.08 2ae5 s THR 82 Ca 0.49 -0.59 -0.30 0.00 0.31 0.00 0.00 61.69 61.60 2ae5 s THR 82 Cb -0.16 -3.90 -0.09 0.00 0.01 0.00 0.00 72.50 68.36 2ae5 s THR 82 CO 0.21 -0.27 0.93 -0.76 -0.69 0.00 0.00 174.62 174.04 2ae5 s LEU 83 N 1.69 4.64 -0.29 4.42 1.43 -1.26 -0.81 118.68 128.50 2ae5 s LEU 83 Ca 0.05 1.93 -0.12 0.00 -1.03 0.00 0.00 54.13 54.96 2ae5 s LEU 83 Cb -0.19 -3.61 0.13 0.00 0.03 0.00 0.00 46.19 42.55 2ae5 s LEU 83 CO 0.10 0.15 0.73 -1.58 0.23 0.00 0.00 176.35 175.99 2ae5 s GLN 84 N -1.21 0.55 -1.40 1.70 0.74 -0.96 -4.86 119.66 114.23 2ae5 s GLN 84 Ca 0.41 1.24 -0.09 0.00 0.05 0.00 0.00 55.36 56.98 2ae5 s GLN 84 Cb -0.26 0.59 0.04 0.00 1.10 0.00 0.00 33.01 34.48 2ae5 s GLN 84 CO 0.31 -0.17 1.03 -0.25 -0.55 0.00 0.00 175.29 175.67 2ae5 n ASP 85 N 5.01 -4.62 0.00 6.67 8.00 -1.26 -1.47 116.55 128.88 2ae5 n ASP 85 Ca -0.14 -0.68 0.00 0.00 0.71 0.00 0.00 54.79 54.69 2ae5 n ASP 85 Cb 0.52 -4.49 0.00 0.00 -0.02 0.00 0.00 41.12 37.14 2ae5 n ASP 85 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ae5 n GLY 86 N -1.74 0.69 0.00 0.44 0.00 -1.26 -4.94 105.19 98.38 2ae5 n GLY 86 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2ae5 n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ae5 n GLY 87 N -2.00 5.10 2.98 -0.02 0.00 -0.54 -4.62 105.19 106.09 2ae5 n GLY 87 Ca 0.00 -1.73 -0.11 0.00 0.00 0.00 0.00 46.02 44.18 2ae5 n GLY 87 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ae5 s TYR 88 N 2.15 0.10 0.09 1.61 1.13 -0.40 -2.25 117.35 119.77 2ae5 s TYR 88 Ca 0.00 -0.19 -0.30 0.00 -1.41 0.00 0.00 57.07 55.16 2ae5 s TYR 88 Cb 0.00 -0.08 -0.06 0.00 -1.10 0.00 0.00 41.96 40.72 2ae5 s TYR 88 CO 0.00 -0.14 1.03 -1.17 -2.51 0.00 0.00 175.55 172.76 2ae5 s LEU 89 N -0.86 4.45 -0.27 -3.49 2.96 0.01 -1.64 118.68 119.84 2ae5 s LEU 89 Ca -0.09 1.86 -0.07 0.00 -0.22 0.00 0.00 54.13 55.61 2ae5 s LEU 89 Cb -0.06 -3.59 0.13 0.00 0.50 0.00 0.00 46.19 43.17 2ae5 s LEU 89 CO -0.00 -0.21 0.55 -0.47 -1.32 0.00 0.00 176.35 174.90 2ae5 s TYR 90 N 0.34 -1.19 -1.39 5.38 5.04 -0.15 -4.22 117.35 121.17 2ae5 s TYR 90 Ca 0.50 1.90 -0.01 0.00 -2.44 0.00 0.00 57.07 57.02 2ae5 s TYR 90 Cb -0.25 0.57 0.01 0.00 0.35 0.00 0.00 41.96 42.63 2ae5 s TYR 90 CO 0.30 -0.65 0.52 -0.25 -1.34 0.00 0.00 175.55 174.14 2ae5 n ASP 91 N 5.42 -0.74 0.00 4.32 10.43 -0.74 -2.34 116.55 132.90 2ae5 n ASP 91 Ca -0.09 -0.95 0.00 0.00 2.57 0.00 0.00 54.79 56.33 2ae5 n ASP 91 Cb 0.49 -3.36 0.00 0.00 1.84 0.00 0.00 41.12 40.10 2ae5 n ASP 91 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2ae5 n GLY 92 N -1.84 0.51 3.24 0.44 0.00 -1.26 -4.99 105.19 101.29 2ae5 n GLY 92 Ca -0.29 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.52 2ae5 n GLY 92 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ae5 s GLN 93 N -0.52 1.01 0.15 1.61 -0.21 -0.99 -5.13 119.66 115.58 2ae5 s GLN 93 Ca 0.00 -1.10 -0.30 0.00 0.02 0.00 0.00 55.36 53.98 2ae5 s GLN 93 Cb 0.00 -1.15 -0.07 0.00 1.00 0.00 0.00 33.01 32.79 2ae5 s GLN 93 CO 0.00 0.26 1.00 0.08 -2.12 0.00 0.00 175.29 174.51 2ae5 s VAL 94 N -1.29 4.27 -0.06 1.09 1.01 -1.26 -0.98 120.40 123.19 2ae5 s VAL 94 Ca 0.04 1.95 0.02 0.00 0.00 0.00 0.00 61.98 63.99 2ae5 s VAL 94 Cb -0.10 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 32.05 2ae5 s VAL 94 CO 0.04 0.33 -0.11 -0.60 0.00 0.00 0.00 175.10 174.75 2ae5 s ARG 95 N -0.26 1.53 0.54 2.72 3.52 -0.65 -4.95 118.95 121.40 2ae5 s ARG 95 Ca 0.47 -0.38 -0.17 0.00 -0.13 0.00 0.00 55.73 55.51 2ae5 s ARG 95 Cb -0.25 -1.30 -0.06 0.00 -1.56 0.00 0.00 34.95 31.78 2ae5 s ARG 95 CO 0.31 0.04 1.03 -1.25 -0.81 0.00 0.00 175.30 174.63 2ae5 s PRO 96 N 0.58 3.62 0.42 5.12 0.04 -1.26 -1.28 135.00 142.25 2ae5 s PRO 96 Ca -0.12 1.19 -0.23 0.00 0.04 0.00 0.00 61.00 61.88 2ae5 s PRO 96 Cb -0.15 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.23 2ae5 s PRO 96 CO 0.03 -0.56 1.05 -0.06 0.04 0.00 0.00 177.00 177.49 2ae5 s PHE 97 N -2.35 3.19 0.26 0.56 0.40 -1.26 -4.91 117.98 113.87 2ae5 s PHE 97 Ca 0.63 1.62 -0.30 0.00 -0.60 0.00 0.00 56.93 58.29 2ae5 s PHE 97 Cb -0.14 -3.11 -0.10 0.00 0.51 0.00 0.00 43.02 40.18 2ae5 s PHE 97 CO 0.30 -0.68 1.38 -1.21 0.70 0.00 0.00 175.22 175.70 2ae5 s GLU 98 N -2.71 4.31 -0.01 0.44 2.02 -0.38 -4.91 118.70 117.47 2ae5 s GLU 98 Ca 0.60 2.23 -0.01 0.00 0.02 0.00 0.00 54.97 57.82 2ae5 s GLU 98 Cb -0.20 -3.12 0.00 0.00 0.10 0.00 0.00 34.13 30.91 2ae5 s GLU 98 CO 0.25 -0.32 0.02 -0.98 0.02 0.00 0.00 175.26 174.25 2ae5 s ARG 99 N -0.72 0.02 -0.02 1.61 1.70 -1.26 -0.89 118.95 119.40 2ae5 s ARG 99 Ca 0.56 0.04 0.03 0.00 -0.47 0.00 0.00 55.73 55.89 2ae5 s ARG 99 Cb -0.40 -0.00 -0.00 0.00 -0.57 0.00 0.00 34.95 33.97 2ae5 s ARG 99 CO 0.45 -0.01 -0.12 0.50 -1.08 0.00 0.00 175.30 175.04 2ae5 s ARG 100 N 0.06 1.07 -0.43 3.89 3.52 -0.37 -5.00 118.95 121.69 2ae5 s ARG 100 Ca -0.00 -0.41 -0.18 0.00 -0.13 0.00 0.00 55.73 55.01 2ae5 s ARG 100 Cb -0.01 -1.01 0.03 0.00 -1.56 0.00 0.00 34.95 32.40 2ae5 s ARG 100 CO -0.00 0.21 0.48 -0.65 -0.81 0.00 0.00 175.30 174.53 2ae5 s GLN 101 N -0.08 3.12 0.50 5.12 -1.52 -1.26 -1.40 119.66 124.13 2ae5 s GLN 101 Ca 0.01 -0.74 0.04 0.00 -1.95 0.00 0.00 55.36 52.71 2ae5 s GLN 101 Cb -0.07 -3.99 0.04 0.00 -0.22 0.00 0.00 33.01 28.77 2ae5 s GLN 101 CO 0.00 -0.92 0.31 0.00 -0.25 0.00 0.00 175.29 174.43 2ae5 n ALA 102 N 5.74 0.71 -3.52 6.09 0.00 -0.37 -5.00 120.51 124.15 2ae5 n ALA 102 Ca -0.07 -2.05 -0.10 0.00 0.00 0.00 0.00 53.44 51.22 2ae5 n ALA 102 Cb 0.47 0.90 -0.02 0.00 0.00 0.00 0.00 19.45 20.80 2ae5 n ALA 102 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2ae5 s SER 103 N -3.90 -0.47 0.09 0.00 1.04 -1.26 -1.63 113.70 107.57 2ae5 s SER 103 Ca 0.23 -0.12 -0.06 0.00 0.48 0.00 0.00 55.95 56.49 2ae5 s SER 103 Cb -0.02 0.59 -0.02 0.00 0.10 0.00 0.00 66.02 66.67 2ae5 s SER 103 CO 0.15 -0.98 0.13 -0.72 0.98 0.00 0.00 173.24 172.79 2ae5 s TYR 104 N -3.67 0.36 0.01 5.02 -0.85 -0.71 -4.94 117.35 112.56 2ae5 s TYR 104 Ca 0.04 -0.81 -0.15 0.00 -0.52 0.00 0.00 57.07 55.63 2ae5 s TYR 104 Cb -0.02 -0.19 -0.06 0.00 0.38 0.00 0.00 41.96 42.07 2ae5 s TYR 104 CO -0.08 -0.52 0.42 1.03 -1.52 0.00 0.00 175.55 174.88 2ae5 s ARG 105 N -3.91 3.94 -0.21 -3.49 3.00 -1.26 -0.60 118.95 116.43 2ae5 s ARG 105 Ca 0.09 0.44 0.01 0.00 0.00 0.00 0.00 55.73 56.28 2ae5 s ARG 105 Cb 0.06 -3.22 0.03 0.00 0.00 0.00 0.00 34.95 31.81 2ae5 s ARG 105 CO -0.08 0.69 -0.16 -1.17 0.00 0.00 0.00 175.30 174.58 2ae5 s LEU 106 N -1.08 2.58 0.21 2.53 2.96 -0.65 -4.95 118.68 120.29 2ae5 s LEU 106 Ca 0.24 -0.85 -0.31 0.00 -0.22 0.00 0.00 54.13 52.99 2ae5 s LEU 106 Cb -0.17 -1.52 -0.11 0.00 0.50 0.00 0.00 46.19 44.89 2ae5 s LEU 106 CO 0.14 -0.06 1.62 -0.60 -1.32 0.00 0.00 176.35 176.13 2ae5 s ARG 107 N 1.25 4.17 0.35 1.98 3.52 -1.26 -2.21 118.95 126.75 2ae5 s ARG 107 Ca 0.01 2.49 0.01 0.00 -0.13 0.00 0.00 55.73 58.11 2ae5 s ARG 107 Cb -0.15 -3.09 -0.03 0.00 -1.56 0.00 0.00 34.95 30.12 2ae5 s ARG 107 CO -0.10 -0.65 0.54 -0.65 -0.81 0.00 0.00 175.30 173.63 2ae5 s GLN 108 N 0.67 3.42 0.59 5.12 -1.52 0.35 -4.97 119.66 123.31 2ae5 s GLN 108 Ca 0.69 -0.42 0.29 0.00 -1.95 0.00 0.00 55.36 53.97 2ae5 s GLN 108 Cb -0.47 -2.68 1.50 0.00 -0.22 0.00 0.00 33.01 31.15 2ae5 s GLN 108 CO 0.36 0.13 1.93 0.00 -0.25 0.00 0.00 175.29 177.46 2ae5 h ALA 109 N 0.77 2.11 -0.52 6.09 0.00 -1.95 -1.39 119.26 124.37 2ae5 h ALA 109 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2ae5 h ALA 109 Cb 1.22 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2ae5 h ALA 109 CO 0.61 -0.65 0.00 -0.40 0.00 0.00 0.00 179.25 178.81 2ae5 n ASP 110 N -3.72 3.77 0.00 0.00 5.68 -1.26 -4.96 116.55 116.06 2ae5 n ASP 110 Ca 0.07 -2.32 0.00 0.00 -0.50 0.00 0.00 54.79 52.04 2ae5 n ASP 110 Cb 0.61 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 2ae5 n ASP 110 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ae5 n GLY 111 N 1.00 2.53 3.94 6.12 0.00 -0.52 -5.05 105.19 113.20 2ae5 n GLY 111 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 2ae5 n GLY 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ae5 s THR 112 N -2.24 2.03 0.16 2.61 -4.23 -1.26 -4.81 115.64 107.90 2ae5 s THR 112 Ca 0.00 -0.10 0.09 0.00 -1.18 0.00 0.00 61.69 60.49 2ae5 s THR 112 Cb 0.00 -2.93 -0.04 0.00 1.34 0.00 0.00 72.50 70.87 2ae5 s THR 112 CO 0.00 0.00 -0.19 0.42 -0.54 0.00 0.00 174.62 174.31 2ae5 s THR 113 N -3.72 1.83 0.12 3.99 -4.23 -1.26 -0.50 115.64 111.86 2ae5 s THR 113 Ca 0.71 -1.91 0.08 0.00 -1.18 0.00 0.00 61.69 59.39 2ae5 s THR 113 Cb -0.05 -1.84 -0.04 0.00 1.34 0.00 0.00 72.50 71.91 2ae5 s THR 113 CO 0.51 -0.30 -0.11 0.68 -0.54 0.00 0.00 174.62 174.86 2ae5 s VAL 114 N -2.00 3.27 -0.16 2.29 -7.23 -0.94 -4.93 120.40 110.70 2ae5 s VAL 114 Ca 0.16 -1.35 -0.28 0.00 -1.81 0.00 0.00 61.98 58.69 2ae5 s VAL 114 Cb -0.06 -2.54 -0.01 0.00 0.56 0.00 0.00 36.38 34.34 2ae5 s VAL 114 CO 0.07 0.08 0.97 -1.81 -0.31 0.00 0.00 175.10 174.09 2ae5 s ASP 115 N -2.28 7.12 -0.15 4.85 1.01 -1.26 -1.63 116.67 124.33 2ae5 s ASP 115 Ca 0.21 1.38 -0.00 0.00 0.71 0.00 0.00 52.55 54.85 2ae5 s ASP 115 Cb -0.11 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.29 2ae5 s ASP 115 CO 0.13 -0.50 -0.14 -0.54 0.21 0.00 0.00 175.17 174.34 2ae5 s LYS 116 N 2.41 3.29 0.54 8.23 1.02 0.24 -4.99 119.74 130.47 2ae5 s LYS 116 Ca 0.44 -0.72 -0.19 0.00 0.02 0.00 0.00 55.97 55.53 2ae5 s LYS 116 Cb -0.17 -2.66 -0.06 0.00 -0.52 0.00 0.00 37.83 34.42 2ae5 s LYS 116 CO 0.13 0.07 1.09 -1.25 -0.92 0.00 0.00 175.35 174.47 2ae5 s PRO 117 N 0.70 3.44 -0.24 -1.68 0.04 -1.26 -1.74 135.00 134.26 2ae5 s PRO 117 Ca -0.06 1.47 -0.03 0.00 0.04 0.00 0.00 61.00 62.42 2ae5 s PRO 117 Cb -0.15 -2.03 0.12 0.00 0.04 0.00 0.00 34.50 32.47 2ae5 s PRO 117 CO 0.02 -0.75 0.30 -1.17 0.04 0.00 0.00 177.00 175.44 2ae5 s LEU 118 N -3.87 -0.36 0.03 -3.56 2.96 -0.65 -4.89 118.68 108.36 2ae5 s LEU 118 Ca 0.70 -0.15 -0.30 0.00 -0.22 0.00 0.00 54.13 54.16 2ae5 s LEU 118 Cb -0.20 0.71 -0.04 0.00 0.50 0.00 0.00 46.19 47.16 2ae5 s LEU 118 CO 0.27 -0.33 1.03 -0.70 -1.32 0.00 0.00 176.35 175.30 2ae5 s GLU 119 N 2.42 4.55 -0.33 1.98 2.12 -1.26 -1.24 118.70 126.94 2ae5 s GLU 119 Ca 0.10 1.51 -0.04 0.00 0.36 0.00 0.00 54.97 56.90 2ae5 s GLU 119 Cb -0.15 -3.42 0.05 0.00 0.26 0.00 0.00 34.13 30.88 2ae5 s GLU 119 CO -0.18 -0.06 0.07 0.42 -0.54 0.00 0.00 175.26 174.97 2ae5 s ILE 120 N 0.84 3.35 -0.04 -3.70 1.01 -0.49 -4.96 121.20 117.20 2ae5 s ILE 120 Ca 0.53 -1.37 -0.03 0.00 0.00 0.00 0.00 60.65 59.78 2ae5 s ILE 120 Cb -0.24 -2.96 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 2ae5 s ILE 120 CO 0.29 -0.21 0.13 -0.13 0.00 0.00 0.00 174.94 175.02 2ae5 s ARG 121 N 1.30 3.30 0.01 2.79 0.52 -1.26 -1.23 118.95 124.38 2ae5 s ARG 121 Ca -0.02 -0.33 0.02 0.00 -0.52 0.00 0.00 55.73 54.88 2ae5 s ARG 121 Cb -0.20 -3.03 -0.01 0.00 0.52 0.00 0.00 34.95 32.23 2ae5 s ARG 121 CO 0.00 0.69 -0.06 -1.12 0.02 0.00 0.00 175.30 174.83 2ae5 s SER 122 N -1.59 0.70 0.59 0.23 0.01 -0.07 -0.48 113.70 113.09 2ae5 s SER 122 Ca 0.22 -0.27 0.09 0.00 1.31 0.00 0.00 55.95 57.30 2ae5 s SER 122 Cb -0.12 -0.03 0.09 0.00 0.21 0.00 0.00 66.02 66.17 2ae5 s SER 122 CO 0.13 -0.04 0.76 -0.94 0.41 0.00 0.00 173.24 173.56 2ae5 s SER 123 N -0.69 4.96 0.56 2.44 1.04 -0.62 -1.24 113.70 120.15 2ae5 s SER 123 Ca -0.03 -0.97 0.24 0.00 0.48 0.00 0.00 55.95 55.67 2ae5 s SER 123 Cb -0.05 0.45 1.57 0.00 0.10 0.00 0.00 66.02 68.10 2ae5 s SER 123 CO 0.00 -1.39 2.20 1.62 0.98 0.00 0.00 173.24 176.65 2ae5 h VAL 124 N 0.20 0.72 -0.26 5.02 3.04 -1.99 -2.45 116.25 120.54 2ae5 h VAL 124 Ca -0.29 -0.06 -0.10 0.00 -1.01 0.00 0.00 66.70 65.24 2ae5 h VAL 124 Cb 1.29 1.03 -0.00 0.00 -2.01 0.00 0.00 31.29 31.60 2ae5 h VAL 124 CO 0.43 0.02 -0.22 0.45 -1.01 0.00 0.00 177.57 177.23 2ae5 h HIS 125 N 0.00 0.71 0.00 3.17 3.86 -1.94 -3.50 115.15 117.45 2ae5 h HIS 125 Ca -0.00 -0.20 0.00 0.00 -1.16 0.00 0.00 60.37 59.01 2ae5 h HIS 125 Cb 0.03 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.35 2ae5 h HIS 125 CO 0.00 0.90 0.00 0.41 0.86 0.00 0.00 177.93 180.10 2ae5 n GLY 126 N 0.12 -1.00 3.67 2.45 0.00 -0.92 -4.32 105.19 105.19 2ae5 n GLY 126 Ca -0.04 -1.31 -0.41 0.00 0.00 0.00 0.00 46.02 44.26 2ae5 n GLY 126 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ae5 n PRO 127 N 0.00 1.73 -4.40 1.61 -0.02 -1.24 -1.58 135.00 131.10 2ae5 n PRO 127 Ca 0.00 0.62 -0.34 0.00 -2.02 0.00 0.00 63.50 61.76 2ae5 n PRO 127 Cb 0.00 -2.27 -0.12 0.00 -0.02 0.00 0.00 33.50 31.09 2ae5 n PRO 127 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ae5 s VAL 128 N -1.22 3.92 0.11 -1.45 1.01 0.37 -1.65 120.40 121.49 2ae5 s VAL 128 Ca 0.62 -0.35 0.10 0.00 0.00 0.00 0.00 61.98 62.35 2ae5 s VAL 128 Cb -0.52 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 2ae5 s VAL 128 CO 0.57 0.50 -0.27 -0.36 0.00 0.00 0.00 175.10 175.55 2ae5 s PHE 129 N 0.27 2.28 -0.25 5.22 0.40 0.49 -4.66 117.98 121.72 2ae5 s PHE 129 Ca -0.03 -0.39 -0.08 0.00 -0.60 0.00 0.00 56.93 55.83 2ae5 s PHE 129 Cb -0.14 -1.27 -0.03 0.00 0.51 0.00 0.00 43.02 42.09 2ae5 s PHE 129 CO 0.03 0.28 0.10 -2.00 0.70 0.00 0.00 175.22 174.33 2ae5 s GLU 130 N -1.86 3.73 0.84 0.44 2.12 -1.26 -0.57 118.70 122.13 2ae5 s GLU 130 Ca 0.13 -0.44 -0.11 0.00 0.36 0.00 0.00 54.97 54.91 2ae5 s GLU 130 Cb -0.10 -3.40 0.10 0.00 0.26 0.00 0.00 34.13 30.99 2ae5 s GLU 130 CO 0.05 -0.18 1.09 1.03 -0.54 0.00 0.00 175.26 176.71 2ae5 s ARG 131 N 1.62 1.71 0.38 4.30 0.52 -0.53 -4.93 118.95 122.01 2ae5 s ARG 131 Ca 0.06 0.89 0.10 0.00 -0.52 0.00 0.00 55.73 56.26 2ae5 s ARG 131 Cb -0.15 -1.86 0.85 0.00 0.52 0.00 0.00 34.95 34.32 2ae5 s ARG 131 CO 0.05 -1.94 1.91 0.00 0.02 0.00 0.00 175.30 175.34 2ae5 h ALA 132 N -1.34 1.86 -0.09 2.13 0.00 -1.99 -1.47 119.26 118.36 2ae5 h ALA 132 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2ae5 h ALA 132 Cb 1.26 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2ae5 h ALA 132 CO 0.54 -0.06 0.00 -0.40 0.00 0.00 0.00 179.25 179.34 2ae5 n ASP 133 N -4.52 0.84 0.00 0.00 5.68 -1.26 -4.92 116.55 112.38 2ae5 n ASP 133 Ca 0.15 -1.60 0.00 0.00 -0.50 0.00 0.00 54.79 52.84 2ae5 n ASP 133 Cb 0.41 -0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.33 2ae5 n ASP 133 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ae5 n GLY 134 N 0.95 0.54 3.70 6.12 0.00 -0.55 -5.05 105.19 110.89 2ae5 n GLY 134 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2ae5 n GLY 134 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ae5 s THR 135 N -2.21 2.91 -0.24 2.61 2.01 -1.26 -4.75 115.64 114.72 2ae5 s THR 135 Ca 0.00 0.48 -0.18 0.00 0.31 0.00 0.00 61.69 62.29 2ae5 s THR 135 Cb 0.00 -3.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.18 2ae5 s THR 135 CO 0.00 0.01 0.53 0.00 -0.69 0.00 0.00 174.62 174.47 2ae5 s ALA 136 N 2.17 3.58 -0.10 7.40 0.00 -1.26 -1.46 121.76 132.09 2ae5 s ALA 136 Ca 0.73 -0.51 0.01 0.00 0.00 0.00 0.00 51.96 52.19 2ae5 s ALA 136 Cb -0.41 -2.88 0.02 0.00 0.00 0.00 0.00 23.12 19.85 2ae5 s ALA 136 CO 0.32 -0.63 -0.11 0.08 0.00 0.00 0.00 175.76 175.41 2ae5 s VAL 137 N 2.08 1.20 -0.17 0.00 1.01 0.26 -1.18 120.40 123.60 2ae5 s VAL 137 Ca 0.23 -0.46 -0.08 0.00 0.00 0.00 0.00 61.98 61.68 2ae5 s VAL 137 Cb -0.16 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2ae5 s VAL 137 CO 0.09 0.38 0.09 0.00 0.00 0.00 0.00 175.10 175.66 2ae5 s ALA 138 N 1.15 3.54 -0.16 5.51 0.00 -0.58 -0.38 121.76 130.84 2ae5 s ALA 138 Ca -0.05 -0.72 -0.06 0.00 0.00 0.00 0.00 51.96 51.13 2ae5 s ALA 138 Cb -0.14 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 20.98 2ae5 s ALA 138 CO -0.03 0.27 0.04 0.54 0.00 0.00 0.00 175.76 176.58 2ae5 s VAL 139 N 0.06 4.56 -0.23 0.00 0.11 -0.66 -1.12 120.40 123.13 2ae5 s VAL 139 Ca 0.07 -0.12 0.02 0.00 -2.93 0.00 0.00 61.98 59.02 2ae5 s VAL 139 Cb -0.12 -3.03 0.05 0.00 -1.53 0.00 0.00 36.38 31.75 2ae5 s VAL 139 CO 0.00 0.49 -0.12 -0.60 -3.33 0.00 0.00 175.10 171.54 2ae5 s ARG 140 N 0.18 2.25 -0.17 1.54 3.52 -0.45 -3.62 118.95 122.21 2ae5 s ARG 140 Ca 0.03 -1.10 -0.04 0.00 -0.13 0.00 0.00 55.73 54.49 2ae5 s ARG 140 Cb -0.13 -2.69 -0.02 0.00 -1.56 0.00 0.00 34.95 30.55 2ae5 s ARG 140 CO 0.01 -0.48 -0.04 0.08 -0.81 0.00 0.00 175.30 174.06 2ae5 s VAL 141 N 1.23 3.71 0.58 7.11 1.01 -1.26 -1.19 120.40 131.59 2ae5 s VAL 141 Ca -0.04 -0.41 -0.14 0.00 0.00 0.00 0.00 61.98 61.38 2ae5 s VAL 141 Cb -0.18 -2.64 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 2ae5 s VAL 141 CO -0.07 0.47 1.02 0.00 0.00 0.00 0.00 175.10 176.52 2ae5 s ALA 142 N 0.70 2.98 -0.39 5.51 0.00 -0.14 -4.21 121.76 126.21 2ae5 s ALA 142 Ca -0.02 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.07 2ae5 s ALA 142 Cb -0.15 -3.13 0.00 0.00 0.00 0.00 0.00 23.12 19.84 2ae5 s ALA 142 CO 0.02 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.62 2ae5 n GLY 143 N -1.86 0.66 0.08 0.00 0.00 -1.26 -4.89 105.19 97.91 2ae5 n GLY 143 Ca 0.07 -0.86 0.08 0.00 0.00 0.00 0.00 46.02 45.31 2ae5 n GLY 143 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ae5 n LEU 144 N -0.42 0.34 -1.71 0.99 4.77 -1.26 -2.61 117.00 117.10 2ae5 n LEU 144 Ca -0.04 0.61 -0.13 0.00 -0.03 0.00 0.00 56.01 56.41 2ae5 n LEU 144 Cb 0.12 -0.59 0.20 0.00 -2.33 0.00 0.00 43.42 40.83 2ae5 n LEU 144 CO 0.06 -0.53 0.99 -0.90 -1.33 0.00 0.00 177.39 175.68 2ae5 n ASP 145 N -1.90 3.22 -3.61 -1.43 5.75 -1.26 -4.78 116.55 112.54 2ae5 n ASP 145 Ca 0.02 -3.66 -0.27 0.00 -0.01 0.00 0.00 54.79 50.86 2ae5 n ASP 145 Cb 0.14 -0.74 -0.10 0.00 -1.03 0.00 0.00 41.12 39.39 2ae5 n ASP 145 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2ae5 n ARG 146 N -1.07 2.01 0.00 0.11 5.12 -1.07 -4.94 116.66 116.81 2ae5 n ARG 146 Ca 0.46 -4.44 0.09 0.00 -1.93 0.00 0.00 57.85 52.03 2ae5 n ARG 146 Cb 1.36 -2.18 0.39 0.00 -1.16 0.00 0.00 32.46 30.87 2ae5 n ARG 146 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2ae5 n PRO 147 N 1.46 0.07 -0.82 5.56 -0.04 -1.26 -3.98 135.00 135.98 2ae5 n PRO 147 Ca 0.25 0.18 -0.06 0.00 -0.04 0.00 0.00 63.50 63.83 2ae5 n PRO 147 Cb 0.39 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.59 2ae5 n PRO 147 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ae5 n GLY 148 N 0.28 3.25 0.37 0.55 0.00 -1.26 -4.63 105.19 103.75 2ae5 n GLY 148 Ca 0.05 -0.78 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 2ae5 n GLY 148 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2ae5 h MET 149 N 2.07 -0.57 -0.59 1.61 4.05 -1.69 0.84 114.93 120.65 2ae5 h MET 149 Ca 0.23 0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.64 2ae5 h MET 149 Cb 2.03 0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 32.94 2ae5 h MET 149 CO 0.61 -0.38 0.18 -0.07 0.23 0.00 0.00 176.91 177.47 2ae5 h LEU 150 N -0.59 0.86 -0.96 3.39 3.38 -1.89 -2.25 115.31 117.26 2ae5 h LEU 150 Ca 0.03 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 2ae5 h LEU 150 Cb 0.62 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2ae5 h LEU 150 CO -0.20 0.85 -0.22 -0.08 0.09 0.00 0.00 178.44 178.87 2ae5 h GLU 151 N 0.84 0.50 -0.07 1.13 4.81 -1.85 -1.42 114.58 118.52 2ae5 h GLU 151 Ca 0.19 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2ae5 h GLU 151 Cb 0.30 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 2ae5 h GLU 151 CO -0.00 0.69 0.03 0.37 -0.73 0.00 0.00 179.01 179.37 2ae5 h GLN 152 N 0.45 0.10 -0.67 1.92 4.15 -0.39 0.13 115.11 120.80 2ae5 h GLN 152 Ca 0.07 -0.02 0.09 0.00 0.77 0.00 0.00 58.65 59.56 2ae5 h GLN 152 Cb 0.63 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 28.24 2ae5 h GLN 152 CO 0.05 0.21 0.32 1.88 -1.93 0.00 0.00 178.83 179.36 2ae5 h TYR 153 N -0.03 0.57 -0.77 3.99 -1.99 -1.20 0.99 116.97 118.52 2ae5 h TYR 153 Ca 0.02 0.03 -0.03 0.00 2.00 0.00 0.00 58.73 60.75 2ae5 h TYR 153 Cb 0.15 -0.15 -0.04 0.00 2.00 0.00 0.00 36.73 38.69 2ae5 h TYR 153 CO -0.02 0.20 0.36 0.35 -0.00 0.00 0.00 178.16 179.04 2ae5 h PHE 154 N 0.55 1.13 -0.11 4.88 3.57 -0.68 -0.67 116.94 125.61 2ae5 h PHE 154 Ca 0.33 -0.06 -0.18 0.00 3.53 0.00 0.00 57.97 61.59 2ae5 h PHE 154 Cb 0.35 -0.35 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 2ae5 h PHE 154 CO -0.12 0.83 -0.70 -0.44 -2.23 0.00 0.00 178.31 175.65 2ae5 h ASP 155 N 1.10 0.56 -0.28 0.41 3.32 -0.43 -2.52 116.42 118.59 2ae5 h ASP 155 Ca 0.26 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2ae5 h ASP 155 Cb 0.14 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2ae5 h ASP 155 CO -0.03 1.09 0.18 0.24 -1.72 0.00 0.00 179.24 179.00 2ae5 h MET 156 N 0.34 0.35 0.00 3.56 2.86 -0.43 -2.05 114.93 119.56 2ae5 h MET 156 Ca -0.03 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2ae5 h MET 156 Cb 1.27 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.85 2ae5 h MET 156 CO 0.12 0.23 -0.01 -0.84 1.06 0.00 0.00 176.91 177.48 2ae5 h ILE 157 N 0.36 0.00 -0.53 -1.22 3.07 -1.10 -2.85 117.51 115.25 2ae5 h ILE 157 Ca 0.10 -0.63 0.00 0.00 1.55 0.00 0.00 64.86 65.88 2ae5 h ILE 157 Cb -0.03 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 38.14 2ae5 h ILE 157 CO -0.03 0.00 0.00 0.35 -1.05 0.00 0.00 178.15 177.42 2ae5 n THR 158 N -2.51 1.02 -1.64 0.16 -2.24 -0.95 -4.90 114.28 103.22 2ae5 n THR 158 Ca 0.05 -1.01 -0.47 0.00 -2.27 0.00 0.00 64.05 60.35 2ae5 n THR 158 Cb 0.46 0.49 -0.04 0.00 -2.10 0.00 0.00 70.33 69.14 2ae5 n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ae5 n ALA 159 N 1.03 0.58 0.49 6.98 0.00 -0.77 -4.88 120.51 123.93 2ae5 n ALA 159 Ca 0.18 0.45 0.13 0.00 0.00 0.00 0.00 53.44 54.20 2ae5 n ALA 159 Cb 0.53 -2.23 0.41 0.00 0.00 0.00 0.00 19.45 18.15 2ae5 n ALA 159 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2ae5 h ASP 160 N 4.75 0.00 -5.02 0.00 3.32 -1.92 -3.47 116.42 114.08 2ae5 h ASP 160 Ca -0.45 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.63 2ae5 h ASP 160 Cb 1.29 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.76 2ae5 h ASP 160 CO 0.80 0.00 0.19 -0.94 -1.72 0.00 0.00 179.24 177.56 2ae5 s SER 161 N -4.82 -0.35 0.24 6.45 1.04 -1.26 -5.02 113.70 109.99 2ae5 s SER 161 Ca 0.08 -0.42 -0.07 0.00 0.48 0.00 0.00 55.95 56.02 2ae5 s SER 161 Cb 0.10 0.67 0.23 0.00 0.10 0.00 0.00 66.02 67.12 2ae5 s SER 161 CO 0.56 -1.19 1.90 0.15 0.98 0.00 0.00 173.24 175.64 2ae5 h PHE 162 N 2.04 1.22 -0.51 5.02 3.57 -1.99 -1.37 116.94 124.92 2ae5 h PHE 162 Ca -0.25 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.30 2ae5 h PHE 162 Cb 1.27 -0.41 -0.04 0.00 2.79 0.00 0.00 35.95 39.56 2ae5 h PHE 162 CO 0.36 0.80 0.28 -0.44 -2.23 0.00 0.00 178.31 177.07 2ae5 h ASP 163 N 1.29 0.41 -0.77 0.41 3.32 -1.99 0.18 116.42 119.28 2ae5 h ASP 163 Ca 0.34 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.38 2ae5 h ASP 163 Cb -0.09 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 2ae5 h ASP 163 CO -0.07 0.29 0.38 0.44 -1.72 0.00 0.00 179.24 178.56 2ae5 h ASP 164 N 0.54 1.02 -0.06 6.45 3.32 -1.85 -2.06 116.42 123.77 2ae5 h ASP 164 Ca 0.22 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2ae5 h ASP 164 Cb 0.10 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 2ae5 h ASP 164 CO -0.14 0.86 0.03 0.22 -1.72 0.00 0.00 179.24 178.50 2ae5 h TYR 165 N 1.11 0.08 -0.36 4.55 3.20 -0.54 -2.28 116.97 122.74 2ae5 h TYR 165 Ca 0.27 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.06 2ae5 h TYR 165 Cb 0.11 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2ae5 h TYR 165 CO 0.01 0.12 -0.11 0.93 -1.64 0.00 0.00 178.16 177.48 2ae5 h GLU 166 N 0.02 0.62 -0.40 1.82 5.08 -0.87 -0.78 114.58 120.06 2ae5 h GLU 166 Ca 0.02 -0.19 -0.10 0.00 -1.00 0.00 0.00 59.36 58.09 2ae5 h GLU 166 Cb 0.07 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2ae5 h GLU 166 CO -0.00 0.72 -0.15 0.00 -1.00 0.00 0.00 179.01 178.58 2ae5 h ALA 167 N 1.31 0.99 -0.09 3.43 0.00 -1.27 -0.40 119.26 123.23 2ae5 h ALA 167 Ca 0.10 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2ae5 h ALA 167 Cb 0.53 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2ae5 h ALA 167 CO 0.03 0.60 0.02 0.00 0.00 0.00 0.00 179.25 179.90 2ae5 h ALA 168 N 1.17 0.12 -0.69 0.00 0.00 -0.92 -3.02 119.26 115.92 2ae5 h ALA 168 Ca 0.11 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2ae5 h ALA 168 Cb 0.62 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2ae5 h ALA 168 CO 0.04 -0.24 0.45 1.25 0.00 0.00 0.00 179.25 180.76 2ae5 h LEU 169 N -0.08 0.65 -1.04 0.00 5.85 -0.97 -2.23 115.31 117.48 2ae5 h LEU 169 Ca 0.03 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2ae5 h LEU 169 Cb 0.27 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.16 2ae5 h LEU 169 CO 0.00 0.43 0.00 0.00 -0.34 0.00 0.00 178.44 178.53 2ae5 h ALA 170 N 1.62 1.00 0.00 1.25 0.00 -0.94 -2.76 119.26 119.43 2ae5 h ALA 170 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2ae5 h ALA 170 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2ae5 h ALA 170 CO -0.09 0.00 0.01 0.00 0.00 0.00 0.00 179.25 179.17 2ae5 h ARG 171 N 0.00 0.00 -6.10 0.00 3.08 -1.39 -3.42 114.38 106.55 2ae5 h ARG 171 Ca 0.00 0.00 -0.43 0.00 0.07 0.00 0.00 59.98 59.62 2ae5 h ARG 171 Cb 0.36 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.45 2ae5 h ARG 171 CO 0.00 0.00 -0.76 -1.33 -1.07 0.00 0.00 179.97 176.81 2ae5 n MET 172 N -3.02 -5.96 0.00 0.04 2.81 -1.04 -4.91 117.12 105.04 2ae5 n MET 172 Ca -0.03 0.67 0.11 0.00 -1.81 0.00 0.00 57.70 56.64 2ae5 n MET 172 Cb 0.07 -5.52 -0.00 0.00 -0.71 0.00 0.00 33.22 27.06 2ae5 n MET 172 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2ae5 n GLN 173 N -4.60 0.07 -3.51 0.03 1.13 -1.26 -4.81 117.38 104.43 2ae5 n GLN 173 Ca -0.08 -0.05 -0.42 0.00 -1.94 0.00 0.00 57.00 54.51 2ae5 n GLN 173 Cb 0.58 -1.50 -0.10 0.00 0.11 0.00 0.00 30.24 29.33 2ae5 n GLN 173 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2ae5 s VAL 174 N -2.97 5.11 -1.81 5.09 1.01 -1.26 -3.82 120.40 121.75 2ae5 s VAL 174 Ca 0.10 -0.60 0.31 0.00 0.00 0.00 0.00 61.98 61.79 2ae5 s VAL 174 Cb 0.17 -3.79 0.73 0.00 0.00 0.00 0.00 36.38 33.49 2ae5 s VAL 174 CO 0.80 -0.22 2.12 -0.81 0.00 0.00 0.00 175.10 176.99 2ae5 n PRO 175 N 5.11 0.82 -1.35 2.72 -0.04 -1.26 -4.05 135.00 136.96 2ae5 n PRO 175 Ca -0.12 -0.06 -0.01 0.00 -0.04 0.00 0.00 63.50 63.27 2ae5 n PRO 175 Cb 0.47 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 2ae5 n PRO 175 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 2ae5 n THR 176 N -1.04 0.00 0.00 0.52 5.66 -1.26 -1.97 114.28 116.20 2ae5 n THR 176 Ca 0.20 -0.11 0.00 0.00 -3.05 0.00 0.00 64.05 61.09 2ae5 n THR 176 Cb 0.18 0.10 0.00 0.00 -1.55 0.00 0.00 70.33 69.06 2ae5 n THR 176 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 2ae5 n PHE 177 N -0.05 0.00 -2.54 1.09 3.01 -1.22 -4.35 117.46 113.40 2ae5 n PHE 177 Ca -0.01 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.07 2ae5 n PHE 177 Cb 0.06 -0.94 -0.04 0.00 -0.01 0.00 0.00 39.48 38.55 2ae5 n PHE 177 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 2ae5 s ASN 178 N -1.94 7.04 -0.04 4.37 0.01 -0.21 -1.61 114.94 122.55 2ae5 s ASN 178 Ca 0.00 2.12 -0.00 0.00 -0.71 0.00 0.00 52.86 54.27 2ae5 s ASN 178 Cb 0.00 -2.60 0.03 0.00 0.41 0.00 0.00 41.25 39.08 2ae5 s ASN 178 CO 0.00 -0.30 0.01 -0.63 -1.51 0.00 0.00 177.10 174.67 2ae5 s ILE 179 N -1.42 0.17 0.02 0.60 1.01 -0.15 -1.71 121.20 119.72 2ae5 s ILE 179 Ca 0.51 0.14 0.06 0.00 0.00 0.00 0.00 60.65 61.36 2ae5 s ILE 179 Cb -0.26 -0.30 -0.03 0.00 0.01 0.00 0.00 42.46 41.87 2ae5 s ILE 179 CO 0.33 0.17 -0.16 -0.69 0.00 0.00 0.00 174.94 174.59 2ae5 s VAL 180 N 1.36 2.91 0.02 2.92 1.01 -0.23 -1.09 120.40 127.30 2ae5 s VAL 180 Ca -0.05 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 60.91 2ae5 s VAL 180 Cb -0.13 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 2ae5 s VAL 180 CO -0.02 0.41 -0.06 -0.47 0.00 0.00 0.00 175.10 174.95 2ae5 s TYR 181 N -0.88 0.55 0.04 5.22 5.04 -0.08 -1.51 117.35 125.73 2ae5 s TYR 181 Ca 0.14 -0.30 -0.10 0.00 -2.44 0.00 0.00 57.07 54.37 2ae5 s TYR 181 Cb -0.11 -0.34 0.01 0.00 0.35 0.00 0.00 41.96 41.87 2ae5 s TYR 181 CO 0.04 -0.05 0.21 0.00 -1.34 0.00 0.00 175.55 174.42 2ae5 s ALA 182 N -0.77 -0.41 0.25 3.97 0.00 -0.72 -1.68 121.76 122.40 2ae5 s ALA 182 Ca -0.04 -0.23 -0.07 0.00 0.00 0.00 0.00 51.96 51.61 2ae5 s ALA 182 Cb -0.06 0.28 -0.01 0.00 0.00 0.00 0.00 23.12 23.33 2ae5 s ALA 182 CO 0.00 -0.37 0.38 0.16 0.00 0.00 0.00 175.76 175.93 2ae5 s ASP 183 N -2.07 0.19 0.38 0.00 1.47 -0.91 -1.07 116.67 114.66 2ae5 s ASP 183 Ca -0.05 -1.18 0.28 0.00 1.18 0.00 0.00 52.55 52.78 2ae5 s ASP 183 Cb -0.01 0.54 1.12 0.00 -0.34 0.00 0.00 42.92 44.23 2ae5 s ASP 183 CO -0.04 -1.08 1.82 0.08 0.68 0.00 0.00 175.17 176.63 2ae5 h ARG 184 N 2.33 0.00 0.00 2.11 0.11 -1.15 -2.51 114.38 115.27 2ae5 h ARG 184 Ca -0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.79 2ae5 h ARG 184 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 2ae5 h ARG 184 CO 0.41 0.00 -0.04 -0.85 0.10 0.00 0.00 179.97 179.60 2ae5 n GLU 185 N -2.61 0.07 0.00 0.08 0.00 -1.26 -4.90 120.64 112.01 2ae5 n GLU 185 Ca 0.02 0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.23 2ae5 n GLU 185 Cb 0.28 -1.57 0.00 0.00 0.00 0.00 0.00 31.44 30.14 2ae5 n GLU 185 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2ae5 n GLY 186 N 1.45 0.76 3.75 -1.84 0.00 -0.94 -5.09 105.19 103.28 2ae5 n GLY 186 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 2ae5 n GLY 186 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ae5 s THR 187 N -2.00 3.94 0.09 2.61 2.01 -1.26 -4.50 115.64 116.53 2ae5 s THR 187 Ca 0.00 1.93 0.05 0.00 0.31 0.00 0.00 61.69 63.98 2ae5 s THR 187 Cb 0.00 -4.23 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 2ae5 s THR 187 CO 0.00 0.45 -0.13 0.27 -0.69 0.00 0.00 174.62 174.52 2ae5 s ILE 188 N -1.10 1.11 -0.17 1.82 -4.36 -1.26 -2.13 121.20 115.11 2ae5 s ILE 188 Ca 0.42 -1.44 -0.18 0.00 -0.26 0.00 0.00 60.65 59.19 2ae5 s ILE 188 Cb -0.27 -1.20 0.05 0.00 1.25 0.00 0.00 42.46 42.28 2ae5 s ILE 188 CO 0.34 -0.33 0.50 0.21 0.24 0.00 0.00 174.94 175.91 2ae5 s ASN 189 N -2.01 -0.51 -0.07 4.36 3.84 -0.68 -1.83 114.94 118.05 2ae5 s ASN 189 Ca 0.01 0.92 0.05 0.00 0.21 0.00 0.00 52.86 54.06 2ae5 s ASN 189 Cb -0.08 0.94 -0.01 0.00 -0.55 0.00 0.00 41.25 41.56 2ae5 s ASN 189 CO 0.02 -0.23 -0.25 -0.47 -2.79 0.00 0.00 177.10 173.39 2ae5 s TYR 190 N 0.04 2.48 -0.05 0.43 5.04 -0.01 -0.90 117.35 124.38 2ae5 s TYR 190 Ca -0.02 -0.83 0.01 0.00 -2.44 0.00 0.00 57.07 53.79 2ae5 s TYR 190 Cb -0.03 -1.64 0.02 0.00 0.35 0.00 0.00 41.96 40.66 2ae5 s TYR 190 CO 0.02 -0.28 -0.05 -1.12 -1.34 0.00 0.00 175.55 172.77 2ae5 s SER 191 N -0.00 1.15 -1.00 4.32 0.01 -0.25 -1.03 113.70 116.90 2ae5 s SER 191 Ca -0.08 -0.15 -0.23 0.00 1.31 0.00 0.00 55.95 56.79 2ae5 s SER 191 Cb -0.15 -0.51 0.05 0.00 0.21 0.00 0.00 66.02 65.62 2ae5 s SER 191 CO 0.05 -0.06 1.44 0.12 0.41 0.00 0.00 173.24 175.21 2ae5 s PHE 192 N 1.00 2.51 0.26 2.43 5.36 -0.38 -0.98 117.98 128.17 2ae5 s PHE 192 Ca -0.10 -0.77 -0.05 0.00 -0.96 0.00 0.00 56.93 55.05 2ae5 s PHE 192 Cb -0.14 -4.69 -0.05 0.00 -0.34 0.00 0.00 43.02 37.79 2ae5 s PHE 192 CO -0.00 -1.95 0.51 1.21 -1.46 0.00 0.00 175.22 173.53 2ae5 s ASN 193 N 4.91 6.46 0.00 6.13 2.47 -0.63 -4.54 114.94 129.74 2ae5 s ASN 193 Ca 0.45 0.67 0.00 0.00 0.42 0.00 0.00 52.86 54.41 2ae5 s ASN 193 Cb -0.01 -2.13 0.00 0.00 -1.45 0.00 0.00 41.25 37.67 2ae5 s ASN 193 CO -0.08 -0.14 0.00 0.61 -3.72 0.00 0.00 177.10 173.77 2ae5 n GLY 194 N -0.72 -0.07 3.33 1.21 0.00 -1.26 -3.39 105.19 104.30 2ae5 n GLY 194 Ca -0.02 -1.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.06 2ae5 n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ae5 s VAL 195 N -1.70 4.77 -0.21 1.61 1.01 -0.83 -4.84 120.40 120.20 2ae5 s VAL 195 Ca 0.00 -1.23 -0.04 0.00 0.00 0.00 0.00 61.98 60.71 2ae5 s VAL 195 Cb 0.00 -3.88 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 2ae5 s VAL 195 CO 0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 175.10 174.51 2ae5 s ALA 196 N 1.54 2.86 0.25 5.51 0.00 -1.26 -4.36 121.76 126.30 2ae5 s ALA 196 Ca 0.04 -1.13 -0.31 0.00 0.00 0.00 0.00 51.96 50.56 2ae5 s ALA 196 Cb -0.24 -1.71 -0.13 0.00 0.00 0.00 0.00 23.12 21.04 2ae5 s ALA 196 CO 0.04 -0.36 1.51 -2.30 0.00 0.00 0.00 175.76 174.65 2ae5 n PRO 197 N 4.66 2.35 -2.20 0.00 -0.02 -1.26 -1.18 135.00 137.35 2ae5 n PRO 197 Ca -0.18 0.84 -0.42 0.00 -2.02 0.00 0.00 63.50 61.71 2ae5 n PRO 197 Cb 0.51 -2.56 -0.03 0.00 -0.02 0.00 0.00 33.50 31.40 2ae5 n PRO 197 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2ae5 s LYS 198 N -0.29 4.22 0.23 -0.52 1.02 -0.11 -4.81 119.74 119.47 2ae5 s LYS 198 Ca 0.67 1.95 0.10 0.00 0.02 0.00 0.00 55.97 58.72 2ae5 s LYS 198 Cb -0.58 -3.82 -0.05 0.00 -0.52 0.00 0.00 37.83 32.86 2ae5 s LYS 198 CO 0.48 -0.74 -0.18 1.03 -0.92 0.00 0.00 175.35 175.01 2ae5 s ARG 199 N 3.50 1.48 0.01 1.68 3.00 -1.26 -4.65 118.95 122.71 2ae5 s ARG 199 Ca 0.65 -1.62 0.21 0.00 0.00 0.00 0.00 55.73 54.96 2ae5 s ARG 199 Cb -0.29 -1.49 -0.22 0.00 0.00 0.00 0.00 34.95 32.95 2ae5 s ARG 199 CO 0.23 0.28 0.60 0.00 0.00 0.00 0.00 175.30 176.41 2ae5 n ALA 200 N -0.29 2.46 -2.75 2.13 0.00 -1.26 -5.00 120.51 115.80 2ae5 n ALA 200 Ca -0.08 -0.56 -0.10 0.00 0.00 0.00 0.00 53.44 52.70 2ae5 n ALA 200 Cb 0.59 -0.79 -0.07 0.00 0.00 0.00 0.00 19.45 19.18 2ae5 n ALA 200 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2ae5 s GLU 201 N -3.27 1.34 0.00 0.00 -1.05 -1.26 -5.15 118.70 109.31 2ae5 s GLU 201 Ca -0.06 -1.35 0.00 0.00 -0.15 0.00 0.00 54.97 53.41 2ae5 s GLU 201 Cb 0.11 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 34.19 2ae5 s GLU 201 CO 0.86 -0.51 0.00 0.41 0.95 0.00 0.00 175.26 176.97 2ae5 n GLY 202 N -0.30 -0.07 3.84 -3.83 0.00 -1.26 -5.04 105.19 98.53 2ae5 n GLY 202 Ca -0.02 -1.32 -0.26 0.00 0.00 0.00 0.00 46.02 44.43 2ae5 n GLY 202 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ae5 n ASP 203 N -0.29 0.79 -0.34 1.61 3.85 -1.26 -4.24 116.55 116.66 2ae5 n ASP 203 Ca 0.00 -1.84 -0.03 0.00 -0.71 0.00 0.00 54.79 52.21 2ae5 n ASP 203 Cb 0.00 -0.81 0.11 0.00 -1.35 0.00 0.00 41.12 39.07 2ae5 n ASP 203 CO 0.00 0.00 0.00 -0.29 -1.01 0.00 0.00 177.20 175.90 2ae5 h ILE 204 N -1.13 1.26 -0.75 2.12 2.10 -1.70 -2.74 117.51 116.67 2ae5 h ILE 204 Ca -0.37 -0.56 -0.05 0.00 1.08 0.00 0.00 64.86 64.96 2ae5 h ILE 204 Cb 1.20 -0.06 -0.03 0.00 -1.09 0.00 0.00 36.82 36.84 2ae5 h ILE 204 CO 0.33 0.27 0.28 0.00 -1.08 0.00 0.00 178.15 177.95 2ae5 h ALA 205 N 1.33 1.09 -0.37 0.18 0.00 -1.93 0.32 119.26 119.88 2ae5 h ALA 205 Ca 0.33 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2ae5 h ALA 205 Cb -0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2ae5 h ALA 205 CO -0.06 0.64 0.23 0.35 0.00 0.00 0.00 179.25 180.41 2ae5 h PHE 206 N 1.09 0.48 0.00 0.00 3.57 -1.87 -2.43 116.94 117.78 2ae5 h PHE 206 Ca 0.25 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.75 2ae5 h PHE 206 Cb 0.23 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.81 2ae5 h PHE 206 CO 0.02 0.33 0.00 0.91 -2.23 0.00 0.00 178.31 177.34 2ae5 n TRP 207 N -4.81 0.94 0.17 0.41 7.02 -0.92 -2.61 117.44 117.64 2ae5 n TRP 207 Ca -0.00 0.31 0.10 0.00 -1.02 0.00 0.00 57.50 56.88 2ae5 n TRP 207 Cb 0.04 -1.00 0.09 0.00 -2.42 0.00 0.00 31.31 28.02 2ae5 n TRP 207 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 2ae5 h GLN 208 N 0.00 0.00 0.00 -0.99 4.20 -0.75 -3.44 115.11 114.13 2ae5 h GLN 208 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 2ae5 h GLN 208 Cb 0.61 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.40 2ae5 h GLN 208 CO 0.00 0.09 0.03 0.41 -0.67 0.00 0.00 178.83 178.69 2ae5 n GLY 209 N 1.16 0.23 3.59 3.46 0.00 -0.93 -4.93 105.19 107.77 2ae5 n GLY 209 Ca 0.02 -1.89 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 2ae5 n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ae5 s LEU 210 N 0.00 3.53 0.22 0.99 1.43 -1.26 -4.49 118.68 119.11 2ae5 s LEU 210 Ca 0.09 0.78 -0.28 0.00 -1.03 0.00 0.00 54.13 53.69 2ae5 s LEU 210 Cb -0.00 -3.42 -0.09 0.00 0.03 0.00 0.00 46.19 42.71 2ae5 s LEU 210 CO 0.06 -1.55 0.88 -0.69 0.23 0.00 0.00 176.35 175.28 2ae5 s VAL 211 N 5.86 4.20 0.25 -1.59 1.01 -0.52 -4.70 120.40 124.90 2ae5 s VAL 211 Ca 0.62 1.91 -0.31 0.00 0.00 0.00 0.00 61.98 64.20 2ae5 s VAL 211 Cb -0.14 -4.22 -0.12 0.00 0.00 0.00 0.00 36.38 31.89 2ae5 s VAL 211 CO 0.31 0.47 1.58 -2.65 0.00 0.00 0.00 175.10 174.80 2ae5 n PRO 212 N 1.42 2.49 -0.81 2.72 -0.02 -1.26 -1.45 135.00 138.09 2ae5 n PRO 212 Ca -0.03 0.89 0.07 0.00 -2.02 0.00 0.00 63.50 62.41 2ae5 n PRO 212 Cb 0.48 -2.65 0.38 0.00 -0.02 0.00 0.00 33.50 31.68 2ae5 n PRO 212 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ae5 n GLY 213 N 2.69 3.20 0.78 -1.23 0.00 0.40 -4.45 105.19 106.58 2ae5 n GLY 213 Ca 0.12 -0.95 0.07 0.00 0.00 0.00 0.00 46.02 45.26 2ae5 n GLY 213 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ae5 n ASP 214 N 0.41 3.39 -3.64 1.61 3.85 -1.26 -4.70 116.55 116.21 2ae5 n ASP 214 Ca 0.27 -3.15 -0.09 0.00 -0.71 0.00 0.00 54.79 51.11 2ae5 n ASP 214 Cb 1.14 -0.54 -0.07 0.00 -1.35 0.00 0.00 41.12 40.31 2ae5 n ASP 214 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 2ae5 s SER 215 N -2.20 -0.65 0.20 -1.12 0.15 -1.26 -1.79 113.70 107.03 2ae5 s SER 215 Ca 0.41 1.15 0.19 0.00 0.70 0.00 0.00 55.95 58.39 2ae5 s SER 215 Cb 0.34 1.21 0.86 0.00 -1.71 0.00 0.00 66.02 66.72 2ae5 s SER 215 CO 0.06 -0.19 1.57 -1.54 1.20 0.00 0.00 173.24 174.35 2ae5 n SER 216 N 3.08 0.45 -0.30 5.45 3.41 -1.26 -2.76 113.62 121.69 2ae5 n SER 216 Ca -0.16 0.65 0.12 0.00 -0.26 0.00 0.00 58.87 59.22 2ae5 n SER 216 Cb 0.57 -0.73 0.28 0.00 -0.26 0.00 0.00 64.21 64.07 2ae5 n SER 216 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2ae5 h ARG 217 N 0.00 0.37 -0.45 4.33 2.43 -1.97 -2.58 114.38 116.50 2ae5 h ARG 217 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2ae5 h ARG 217 Cb 0.20 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2ae5 h ARG 217 CO 0.00 0.25 0.00 0.66 -1.51 0.00 0.00 179.97 179.37 2ae5 n TYR 218 N -5.06 0.59 -2.88 2.20 4.02 -1.11 -4.84 117.16 110.08 2ae5 n TYR 218 Ca 0.21 -0.34 -0.43 0.00 -0.01 0.00 0.00 57.90 57.32 2ae5 n TYR 218 Cb 0.62 -0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.90 2ae5 n TYR 218 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2ae5 s LEU 219 N -1.23 4.81 0.61 7.72 2.96 -0.97 -5.03 118.68 127.55 2ae5 s LEU 219 Ca 0.37 -1.87 -0.16 0.00 -0.22 0.00 0.00 54.13 52.25 2ae5 s LEU 219 Cb 0.21 -2.42 -0.03 0.00 0.50 0.00 0.00 46.19 44.45 2ae5 s LEU 219 CO 0.28 -1.15 1.08 -1.66 -1.32 0.00 0.00 176.35 173.58 2ae5 s TRP 220 N 3.09 2.82 0.00 5.38 1.48 -1.26 -4.99 118.94 125.46 2ae5 s TRP 220 Ca 0.33 1.53 0.00 0.00 -1.06 0.00 0.00 56.10 56.90 2ae5 s TRP 220 Cb -0.05 -3.09 0.00 0.00 -1.16 0.00 0.00 33.47 29.16 2ae5 s TRP 220 CO -0.08 -1.36 0.00 0.25 -4.06 0.00 0.00 176.95 171.70 2ae5 n THR 221 N -2.09 0.00 -4.35 0.66 -2.24 -1.26 -5.09 114.28 99.90 2ae5 n THR 221 Ca 0.10 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.62 2ae5 n THR 221 Cb 0.52 0.12 -0.09 0.00 -2.10 0.00 0.00 70.33 68.79 2ae5 n THR 221 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2ae5 s GLU 222 N -0.59 2.08 0.17 -0.78 0.41 -1.26 -5.05 118.70 113.69 2ae5 s GLU 222 Ca 0.00 -1.85 0.02 0.00 -0.41 0.00 0.00 54.97 52.73 2ae5 s GLU 222 Cb 0.00 -1.88 -0.05 0.00 -1.78 0.00 0.00 34.13 30.43 2ae5 s GLU 222 CO 0.00 0.04 0.01 0.95 -0.49 0.00 0.00 175.26 175.77 2ae5 s THR 223 N -2.58 0.65 0.20 3.63 -4.23 -1.26 -0.94 115.64 111.11 2ae5 s THR 223 Ca 0.36 -1.98 -0.29 0.00 -1.18 0.00 0.00 61.69 58.60 2ae5 s THR 223 Cb 0.03 -2.12 -0.08 0.00 1.34 0.00 0.00 72.50 71.66 2ae5 s THR 223 CO 0.20 -0.47 0.92 -1.00 -0.54 0.00 0.00 174.62 173.73 2ae5 s HIS 224 N -3.67 3.93 0.86 3.99 3.76 -0.33 -4.75 115.29 119.08 2ae5 s HIS 224 Ca 0.24 1.85 -0.12 0.00 -0.15 0.00 0.00 55.06 56.88 2ae5 s HIS 224 Cb 0.06 -2.97 0.11 0.00 1.11 0.00 0.00 32.58 30.89 2ae5 s HIS 224 CO 0.04 0.40 1.17 -1.25 -0.85 0.00 0.00 174.74 174.24 2ae5 s PRO 225 N -0.86 1.55 0.32 8.40 0.04 -1.26 -4.69 135.00 138.50 2ae5 s PRO 225 Ca 0.42 0.17 0.03 0.00 0.04 0.00 0.00 61.00 61.66 2ae5 s PRO 225 Cb -0.25 -1.90 0.62 0.00 0.04 0.00 0.00 34.50 33.01 2ae5 s PRO 225 CO 0.31 -1.90 1.91 1.25 0.04 0.00 0.00 177.00 178.61 2ae5 h LEU 226 N -1.28 0.82 0.00 -3.56 5.85 -1.93 -2.18 115.31 113.03 2ae5 h LEU 226 Ca -0.48 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2ae5 h LEU 226 Cb 1.33 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2ae5 h LEU 226 CO 0.63 0.51 0.00 0.47 -0.34 0.00 0.00 178.44 179.71 2ae5 n ASP 227 N -4.50 0.00 -0.09 1.25 8.00 -1.26 -1.86 116.55 118.09 2ae5 n ASP 227 Ca 0.14 -0.79 0.14 0.00 0.71 0.00 0.00 54.79 54.99 2ae5 n ASP 227 Cb 0.25 -0.05 0.57 0.00 -0.02 0.00 0.00 41.12 41.86 2ae5 n ASP 227 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2ae5 n ASP 228 N -1.05 0.42 -4.76 -2.24 9.92 -0.82 -4.96 116.55 113.06 2ae5 n ASP 228 Ca 0.21 -0.41 -0.31 0.00 -0.53 0.00 0.00 54.79 53.75 2ae5 n ASP 228 Cb 0.13 -0.09 -0.07 0.00 -0.64 0.00 0.00 41.12 40.45 2ae5 n ASP 228 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2ae5 s LEU 229 N -2.60 3.78 -0.04 0.64 1.43 -0.78 -4.93 118.68 116.19 2ae5 s LEU 229 Ca 0.25 0.02 -0.35 0.00 -1.03 0.00 0.00 54.13 53.02 2ae5 s LEU 229 Cb 0.20 -2.37 -0.14 0.00 0.03 0.00 0.00 46.19 43.91 2ae5 s LEU 229 CO 0.51 0.21 1.72 -2.65 0.23 0.00 0.00 176.35 176.36 2ae5 n PRO 230 N 0.73 1.88 -3.89 1.29 -0.02 -1.26 -4.86 135.00 128.87 2ae5 n PRO 230 Ca -0.10 0.68 -0.10 0.00 -2.02 0.00 0.00 63.50 61.96 2ae5 n PRO 230 Cb 0.52 -2.46 -0.10 0.00 -0.02 0.00 0.00 33.50 31.44 2ae5 n PRO 230 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2ae5 s ARG 231 N 2.74 0.51 -0.02 -0.52 0.52 -1.26 -1.25 118.95 119.67 2ae5 s ARG 231 Ca 0.89 -0.53 0.00 0.00 -0.52 0.00 0.00 55.73 55.58 2ae5 s ARG 231 Cb -0.78 0.21 0.03 0.00 0.52 0.00 0.00 34.95 34.92 2ae5 s ARG 231 CO 0.50 -0.12 0.02 0.08 0.02 0.00 0.00 175.30 175.79 2ae5 s VAL 232 N -1.78 0.01 -0.06 3.52 1.01 -0.20 -4.99 120.40 117.90 2ae5 s VAL 232 Ca -0.12 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.04 2ae5 s VAL 232 Cb -0.06 -0.12 0.02 0.00 0.00 0.00 0.00 36.38 36.22 2ae5 s VAL 232 CO -0.01 0.09 -0.08 -0.89 0.00 0.00 0.00 175.10 174.21 2ae5 s THR 233 N 0.94 0.87 -1.13 3.92 2.01 -1.26 -0.83 115.64 120.16 2ae5 s THR 233 Ca -0.08 -0.31 -0.33 0.00 0.31 0.00 0.00 61.69 61.28 2ae5 s THR 233 Cb -0.12 -0.83 0.05 0.00 0.01 0.00 0.00 72.50 71.60 2ae5 s THR 233 CO -0.02 0.30 0.63 0.59 -0.69 0.00 0.00 174.62 175.43 2ae5 n ASN 234 N 4.01 -3.80 -4.78 3.53 3.02 -0.76 -4.90 115.26 111.58 2ae5 n ASN 234 Ca -0.23 -1.22 -0.31 0.00 -0.03 0.00 0.00 54.58 52.79 2ae5 n ASN 234 Cb 0.51 -1.47 0.09 0.00 -0.61 0.00 0.00 39.78 38.30 2ae5 n ASN 234 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2ae5 s PRO 235 N -7.33 2.20 0.38 3.52 0.04 -1.26 -4.92 135.00 127.62 2ae5 s PRO 235 Ca 0.46 0.95 0.11 0.00 0.04 0.00 0.00 61.00 62.56 2ae5 s PRO 235 Cb -0.26 -1.91 0.88 0.00 0.04 0.00 0.00 34.50 33.26 2ae5 s PRO 235 CO 0.91 -1.62 1.89 -1.35 0.04 0.00 0.00 177.00 176.87 2ae5 h PRO 236 N -1.10 0.60 0.00 0.56 0.11 -1.90 -1.99 132.00 128.28 2ae5 h PRO 236 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2ae5 h PRO 236 Cb 1.24 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2ae5 h PRO 236 CO 0.55 0.40 0.00 0.78 -0.21 0.00 0.00 178.00 179.51 2ae5 h GLY 237 N 0.62 0.00 0.00 -0.55 0.00 -1.84 -3.47 103.07 97.83 2ae5 h GLY 237 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.74 2ae5 h GLY 237 CO -0.17 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.98 2ae5 n GLY 238 N -0.19 0.42 3.44 4.60 0.00 -0.75 -4.94 105.19 107.77 2ae5 n GLY 238 Ca 0.01 -0.77 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 2ae5 n GLY 238 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ae5 s PHE 239 N -2.00 -0.39 0.18 1.61 -0.71 -1.26 -0.88 117.98 114.53 2ae5 s PHE 239 Ca 0.00 0.12 0.06 0.00 -1.04 0.00 0.00 56.93 56.07 2ae5 s PHE 239 Cb 0.00 0.48 -0.05 0.00 -1.21 0.00 0.00 43.02 42.24 2ae5 s PHE 239 CO 0.00 -0.85 -0.13 0.14 -1.34 0.00 0.00 175.22 173.04 2ae5 s VAL 240 N -3.79 1.51 0.06 -2.49 -7.23 -0.44 -4.59 120.40 103.43 2ae5 s VAL 240 Ca 0.03 -2.13 -0.25 0.00 -1.81 0.00 0.00 61.98 57.82 2ae5 s VAL 240 Cb -0.01 -1.95 0.06 0.00 0.56 0.00 0.00 36.38 35.05 2ae5 s VAL 240 CO -0.10 -0.64 0.58 0.00 -0.31 0.00 0.00 175.10 174.62 2ae5 s GLN 241 N -3.64 1.11 -0.20 4.82 1.03 0.09 -1.55 119.66 121.32 2ae5 s GLN 241 Ca 0.20 -0.19 -0.12 0.00 0.04 0.00 0.00 55.36 55.29 2ae5 s GLN 241 Cb 0.00 0.51 0.06 0.00 0.03 0.00 0.00 33.01 33.62 2ae5 s GLN 241 CO 0.04 -0.42 0.50 1.21 -2.54 0.00 0.00 175.29 174.09 2ae5 s ASN 242 N -2.01 -0.63 -0.40 12.60 3.84 -0.84 -4.41 114.94 123.09 2ae5 s ASN 242 Ca -0.05 1.08 0.09 0.00 0.21 0.00 0.00 52.86 54.19 2ae5 s ASN 242 Cb -0.01 0.98 0.43 0.00 -0.55 0.00 0.00 41.25 42.11 2ae5 s ASN 242 CO -0.02 -0.20 1.07 -1.20 -2.79 0.00 0.00 177.10 173.96 2ae5 n SER 243 N 4.05 3.83 0.00 -4.21 7.64 -1.26 -1.10 113.62 122.57 2ae5 n SER 243 Ca -0.21 -3.43 0.00 0.00 1.01 0.00 0.00 58.87 56.24 2ae5 n SER 243 Cb 0.56 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2ae5 n SER 243 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2ae5 n ASN 244 N -0.39 -0.61 -4.75 6.43 5.03 -1.24 -4.64 115.26 115.09 2ae5 n ASN 244 Ca 0.31 0.00 -0.35 0.00 0.87 0.00 0.00 54.58 55.41 2ae5 n ASN 244 Cb 0.72 -1.71 0.05 0.00 -1.02 0.00 0.00 39.78 37.82 2ae5 n ASN 244 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.26 176.94 2ae5 s ASP 245 N -2.31 4.95 0.67 6.41 -4.77 -1.26 -4.96 116.67 115.40 2ae5 s ASP 245 Ca 0.00 2.37 -0.17 0.00 -3.30 0.00 0.00 52.55 51.45 2ae5 s ASP 245 Cb 0.00 -2.59 -0.06 0.00 -1.09 0.00 0.00 42.92 39.17 2ae5 s ASP 245 CO 0.00 -1.75 0.45 -2.65 0.70 0.00 0.00 175.17 171.92 2ae5 n PRO 246 N -1.90 0.35 0.00 2.11 -0.02 -1.26 -4.80 135.00 129.48 2ae5 n PRO 246 Ca 0.13 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2ae5 n PRO 246 Cb 0.50 -1.72 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 2ae5 n PRO 246 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2ae5 n PRO 247 N -0.29 0.86 0.00 0.52 -0.04 -1.26 -4.23 135.00 130.57 2ae5 n PRO 247 Ca 0.10 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.67 2ae5 n PRO 247 Cb 0.49 -1.15 0.14 0.00 -0.04 0.00 0.00 33.50 32.94 2ae5 n PRO 247 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2ae5 n TRP 248 N 0.46 0.02 -3.09 0.54 5.03 -1.26 -4.21 117.44 114.94 2ae5 n TRP 248 Ca 0.00 0.01 -0.21 0.00 3.03 0.00 0.00 57.50 60.33 2ae5 n TRP 248 Cb 0.38 -0.20 -0.03 0.00 -1.03 0.00 0.00 31.31 30.43 2ae5 n TRP 248 CO 0.00 0.00 0.00 0.25 -0.03 0.00 0.00 177.69 177.91 2ae5 n THR 249 N -1.53 1.03 0.61 -0.99 -2.24 -1.26 -4.90 114.28 105.00 2ae5 n THR 249 Ca 0.05 -4.93 0.12 0.00 -2.27 0.00 0.00 64.05 57.02 2ae5 n THR 249 Cb 0.34 -0.66 0.46 0.00 -2.10 0.00 0.00 70.33 68.36 2ae5 n THR 249 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2ae5 n PRO 250 N 0.08 0.14 -3.87 -0.78 -0.04 -1.26 -4.84 135.00 124.42 2ae5 n PRO 250 Ca 0.27 0.24 -0.09 0.00 -0.04 0.00 0.00 63.50 63.88 2ae5 n PRO 250 Cb 0.57 -1.71 -0.00 0.00 -0.04 0.00 0.00 33.50 32.32 2ae5 n PRO 250 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2ae5 s THR 251 N -3.13 0.00 -0.21 0.52 -1.32 -1.26 -0.73 115.64 109.51 2ae5 s THR 251 Ca 0.09 -1.11 -0.05 0.00 -1.21 0.00 0.00 61.69 59.41 2ae5 s THR 251 Cb 0.12 -2.54 0.11 0.00 -1.51 0.00 0.00 72.50 68.68 2ae5 s THR 251 CO 0.46 0.00 0.40 0.86 -2.21 0.00 0.00 174.62 174.13 2ae5 s TRP 252 N -3.01 -0.81 0.67 9.09 -0.11 -1.26 -3.62 118.94 119.88 2ae5 s TRP 252 Ca 0.17 1.25 -0.15 0.00 1.22 0.00 0.00 56.10 58.59 2ae5 s TRP 252 Cb -0.04 0.19 0.01 0.00 -1.50 0.00 0.00 33.47 32.12 2ae5 s TRP 252 CO 0.11 -0.57 1.11 -1.25 -4.62 0.00 0.00 176.95 171.73 2ae5 s PRO 253 N 2.59 2.73 0.84 5.86 0.04 -1.26 -4.07 135.00 141.73 2ae5 s PRO 253 Ca 0.04 1.39 -0.10 0.00 0.04 0.00 0.00 61.00 62.37 2ae5 s PRO 253 Cb -0.13 -1.94 0.10 0.00 0.04 0.00 0.00 34.50 32.57 2ae5 s PRO 253 CO -0.14 -1.30 1.12 0.14 0.04 0.00 0.00 177.00 176.86 2ae5 s VAL 254 N -2.37 2.70 -0.38 -0.36 -7.23 -1.24 -4.68 120.40 106.84 2ae5 s VAL 254 Ca 0.67 0.23 0.04 0.00 -1.81 0.00 0.00 61.98 61.10 2ae5 s VAL 254 Cb -0.21 -2.48 0.01 0.00 0.56 0.00 0.00 36.38 34.27 2ae5 s VAL 254 CO 0.43 -0.29 0.51 0.35 -0.31 0.00 0.00 175.10 175.78 2ae5 n THR 255 N -3.88 0.00 -3.83 5.32 -2.24 -1.26 -5.06 114.28 103.33 2ae5 n THR 255 Ca 0.10 -0.48 -0.08 0.00 -2.27 0.00 0.00 64.05 61.32 2ae5 n THR 255 Cb 0.53 1.06 0.01 0.00 -2.10 0.00 0.00 70.33 69.82 2ae5 n THR 255 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2ae5 s TYR 256 N -0.53 -0.01 0.22 4.78 -0.85 -1.26 -5.16 117.35 114.55 2ae5 s TYR 256 Ca 0.04 -0.58 0.01 0.00 -0.52 0.00 0.00 57.07 56.02 2ae5 s TYR 256 Cb 0.03 0.79 -0.05 0.00 0.38 0.00 0.00 41.96 43.11 2ae5 s TYR 256 CO 0.06 -1.43 0.06 0.95 -1.52 0.00 0.00 175.55 173.67 2ae5 s THR 257 N -2.97 0.61 0.50 -3.49 -4.23 -1.26 -5.00 115.64 99.80 2ae5 s THR 257 Ca 0.14 -1.99 0.24 0.00 -1.18 0.00 0.00 61.69 58.89 2ae5 s THR 257 Cb -0.05 -2.42 0.40 0.00 1.34 0.00 0.00 72.50 71.77 2ae5 s THR 257 CO 0.10 -0.20 1.95 -0.65 -0.54 0.00 0.00 174.62 175.28 2ae5 h PRO 258 N 2.51 0.12 0.00 3.99 0.11 -1.94 -2.16 132.00 134.63 2ae5 h PRO 258 Ca -0.38 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 2ae5 h PRO 258 Cb 1.23 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2ae5 h PRO 258 CO 0.61 0.08 -0.05 1.57 -0.21 0.00 0.00 178.00 180.00 2ae5 h LYS 259 N 0.12 0.00 0.00 1.05 2.10 -1.98 -2.82 116.57 115.04 2ae5 h LYS 259 Ca 0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.97 2ae5 h LYS 259 Cb 1.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 2ae5 h LYS 259 CO -0.04 0.05 0.00 -0.25 -2.00 0.00 0.00 179.45 177.21 2ae5 n ASP 260 N -3.30 0.00 -4.10 7.07 8.00 -0.81 -4.80 116.55 118.60 2ae5 n ASP 260 Ca -0.01 -0.02 -0.12 0.00 0.71 0.00 0.00 54.79 55.34 2ae5 n ASP 260 Cb 0.22 -0.27 -0.11 0.00 -0.02 0.00 0.00 41.12 40.94 2ae5 n ASP 260 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ae5 s PHE 261 N -2.54 0.75 0.45 1.24 0.40 -1.07 -5.06 117.98 112.16 2ae5 s PHE 261 Ca 0.19 -0.68 -0.25 0.00 -0.60 0.00 0.00 56.93 55.59 2ae5 s PHE 261 Cb 0.13 -0.45 -0.08 0.00 0.51 0.00 0.00 43.02 43.13 2ae5 s PHE 261 CO 0.29 -0.12 1.36 -0.35 0.70 0.00 0.00 175.22 177.10 2ae5 n PRO 262 N 0.83 2.05 0.00 0.24 -0.04 -1.26 -4.88 135.00 131.93 2ae5 n PRO 262 Ca -0.18 0.73 0.10 0.00 -0.04 0.00 0.00 63.50 64.11 2ae5 n PRO 262 Cb 0.57 -2.52 0.51 0.00 -0.04 0.00 0.00 33.50 32.01 2ae5 n PRO 262 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2ae5 n SER 263 N -0.14 0.00 -0.27 3.54 3.41 -1.26 -2.89 113.62 116.01 2ae5 n SER 263 Ca 0.06 -0.05 0.12 0.00 -0.26 0.00 0.00 58.87 58.74 2ae5 n SER 263 Cb 0.41 -0.26 0.27 0.00 -0.26 0.00 0.00 64.21 64.37 2ae5 n SER 263 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ae5 n TYR 264 N -1.26 0.00 -0.08 7.33 0.18 -1.26 -2.39 117.16 119.68 2ae5 n TYR 264 Ca 0.10 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.74 2ae5 n TYR 264 Cb 0.15 -0.10 -0.03 0.00 -0.38 0.00 0.00 39.34 38.98 2ae5 n TYR 264 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 2ae5 h LEU 265 N 1.33 0.96 -7.02 -3.48 3.38 -1.92 -3.40 115.31 105.16 2ae5 h LEU 265 Ca 0.00 -0.51 -0.06 0.00 0.09 0.00 0.00 57.88 57.40 2ae5 h LEU 265 Cb 0.56 -0.28 -0.19 0.00 0.09 0.00 0.00 40.66 40.85 2ae5 h LEU 265 CO 0.00 1.30 0.17 0.00 0.09 0.00 0.00 178.44 180.00 2ae5 s ALA 266 N -4.15 -1.71 0.82 1.53 0.00 -1.26 -4.66 121.76 112.32 2ae5 s ALA 266 Ca -0.10 1.22 -0.11 0.00 0.00 0.00 0.00 51.96 52.96 2ae5 s ALA 266 Cb 0.10 0.06 0.08 0.00 0.00 0.00 0.00 23.12 23.37 2ae5 s ALA 266 CO 0.89 -0.39 1.09 -1.25 0.00 0.00 0.00 175.76 176.10 2ae5 s PRO 267 N -1.38 1.90 -0.50 0.00 0.04 -1.26 -4.89 135.00 128.92 2ae5 s PRO 267 Ca -0.10 0.99 0.04 0.00 0.04 0.00 0.00 61.00 61.97 2ae5 s PRO 267 Cb -0.00 -1.87 0.41 0.00 0.04 0.00 0.00 34.50 33.08 2ae5 s PRO 267 CO 0.08 -1.84 1.27 1.04 0.04 0.00 0.00 177.00 177.59 2ae5 n GLN 268 N -3.63 3.33 -3.67 4.56 6.02 -1.26 -4.78 117.38 117.94 2ae5 n GLN 268 Ca 0.08 -4.33 -0.22 0.00 -0.01 0.00 0.00 57.00 52.53 2ae5 n GLN 268 Cb 0.54 -2.26 -0.01 0.00 1.02 0.00 0.00 30.24 29.53 2ae5 n GLN 268 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2ae5 s THR 269 N -5.41 5.02 0.24 5.09 -4.23 -1.26 -5.04 115.64 110.05 2ae5 s THR 269 Ca 0.49 -0.79 -0.31 0.00 -1.18 0.00 0.00 61.69 59.90 2ae5 s THR 269 Cb 0.41 -3.80 -0.14 0.00 1.34 0.00 0.00 72.50 70.31 2ae5 s THR 269 CO -0.21 -0.39 1.30 -2.65 -0.54 0.00 0.00 174.62 172.13 2ae5 n PRO 270 N -1.59 1.78 -2.69 3.99 -0.02 -1.26 -4.87 135.00 130.34 2ae5 n PRO 270 Ca -0.06 0.63 -0.38 0.00 -2.02 0.00 0.00 63.50 61.67 2ae5 n PRO 270 Cb 0.57 -2.22 -0.06 0.00 -0.02 0.00 0.00 33.50 31.77 2ae5 n PRO 270 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2ae5 s HIS 271 N -0.28 3.67 0.74 6.00 3.76 -1.26 -4.98 115.29 122.93 2ae5 s HIS 271 Ca 0.67 1.78 -0.11 0.00 -0.15 0.00 0.00 55.06 57.25 2ae5 s HIS 271 Cb -0.69 -3.02 0.04 0.00 1.11 0.00 0.00 32.58 30.02 2ae5 s HIS 271 CO 0.52 0.02 1.09 -1.54 -0.85 0.00 0.00 174.74 173.99 2ae5 s SER 272 N -1.41 4.72 0.37 1.40 1.04 -1.26 -4.78 113.70 113.77 2ae5 s SER 272 Ca 0.49 1.84 0.08 0.00 0.48 0.00 0.00 55.95 58.84 2ae5 s SER 272 Cb -0.23 -2.52 0.73 0.00 0.10 0.00 0.00 66.02 64.10 2ae5 s SER 272 CO 0.29 -1.89 1.89 -0.07 0.98 0.00 0.00 173.24 174.44 2ae5 h LEU 273 N -0.85 0.27 -0.55 2.42 3.38 -1.77 -0.86 115.31 117.34 2ae5 h LEU 273 Ca -0.44 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.46 2ae5 h LEU 273 Cb 1.23 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 2ae5 h LEU 273 CO 0.52 0.43 0.31 -0.09 0.09 0.00 0.00 178.44 179.70 2ae5 h ARG 274 N 0.27 0.76 -0.31 1.13 2.43 -1.71 -0.96 114.38 115.99 2ae5 h ARG 274 Ca 0.05 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 2ae5 h ARG 274 Cb 0.40 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2ae5 h ARG 274 CO 0.02 0.58 -0.09 0.00 -1.51 0.00 0.00 179.97 178.97 2ae5 h ALA 275 N 1.14 1.27 -0.50 2.80 0.00 -1.50 -0.43 119.26 122.04 2ae5 h ALA 275 Ca 0.19 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2ae5 h ALA 275 Cb 0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2ae5 h ALA 275 CO -0.03 0.48 -0.00 1.96 0.00 0.00 0.00 179.25 181.66 2ae5 h GLN 276 N 0.48 0.89 -0.54 0.00 4.20 -0.96 -2.61 115.11 116.57 2ae5 h GLN 276 Ca 0.09 -0.29 -0.04 0.00 0.06 0.00 0.00 58.65 58.47 2ae5 h GLN 276 Cb 0.45 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 2ae5 h GLN 276 CO 0.02 0.92 0.16 1.96 -0.67 0.00 0.00 178.83 181.23 2ae5 h GLN 277 N 0.76 0.80 -0.35 1.46 1.08 -0.70 -2.34 115.11 115.82 2ae5 h GLN 277 Ca 0.14 -0.15 0.03 0.00 -1.45 0.00 0.00 58.65 57.23 2ae5 h GLN 277 Cb 0.52 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.79 2ae5 h GLN 277 CO 0.03 0.70 0.16 1.03 -0.95 0.00 0.00 178.83 179.80 2ae5 h SER 278 N 0.78 0.21 -0.68 1.46 0.87 -0.75 0.90 113.55 116.35 2ae5 h SER 278 Ca 0.18 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.70 2ae5 h SER 278 Cb 0.24 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 2ae5 h SER 278 CO -0.01 0.16 0.19 0.58 -0.53 0.00 0.00 176.83 177.23 2ae5 h VAL 279 N 0.33 1.26 -0.37 2.23 2.07 -1.30 -2.88 116.25 117.58 2ae5 h VAL 279 Ca 0.15 -0.91 -0.09 0.00 0.82 0.00 0.00 66.70 66.68 2ae5 h VAL 279 Cb 0.09 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2ae5 h VAL 279 CO -0.12 0.35 -0.10 0.03 0.02 0.00 0.00 177.57 177.74 2ae5 h ARG 280 N 1.00 0.73 -0.52 1.57 3.08 -0.98 -0.77 114.38 118.48 2ae5 h ARG 280 Ca 0.22 -0.28 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 2ae5 h ARG 280 Cb 0.33 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 2ae5 h ARG 280 CO -0.00 0.88 0.04 -0.07 -1.07 0.00 0.00 179.97 179.74 2ae5 h LEU 281 N 0.53 0.82 0.10 3.04 3.38 -0.77 -1.11 115.31 121.29 2ae5 h LEU 281 Ca 0.09 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2ae5 h LEU 281 Cb 0.62 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2ae5 h LEU 281 CO 0.04 0.87 -0.05 0.24 0.09 0.00 0.00 178.44 179.63 2ae5 h MET 282 N 0.81 -0.12 -0.60 1.13 2.86 -1.48 -3.32 114.93 114.21 2ae5 h MET 282 Ca 0.16 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.77 2ae5 h MET 282 Cb 0.43 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 2ae5 h MET 282 CO 0.02 0.36 0.23 0.66 1.06 0.00 0.00 176.91 179.23 2ae5 h SER 283 N -0.92 0.80 0.98 1.22 4.64 -1.08 -2.80 113.55 116.40 2ae5 h SER 283 Ca -0.01 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 2ae5 h SER 283 Cb 0.54 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2ae5 h SER 283 CO 0.02 0.73 -0.08 -0.62 -0.87 0.00 0.00 176.83 176.00 2ae5 n GLU 284 N -4.31 0.04 -4.75 4.77 1.02 -0.43 -4.80 120.64 112.18 2ae5 n GLU 284 Ca 0.05 0.03 -0.33 0.00 -0.02 0.00 0.00 57.16 56.88 2ae5 n GLU 284 Cb 0.17 -1.54 -0.13 0.00 -0.02 0.00 0.00 31.44 29.93 2ae5 n GLU 284 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2ae5 s ASN 285 N -3.20 4.30 0.21 1.62 0.01 -1.06 -5.09 114.94 111.74 2ae5 s ASN 285 Ca 0.13 -0.14 0.05 0.00 -0.71 0.00 0.00 52.86 52.18 2ae5 s ASN 285 Cb 0.18 -1.13 -0.05 0.00 0.41 0.00 0.00 41.25 40.66 2ae5 s ASN 285 CO 0.56 0.32 -0.05 -0.62 -1.51 0.00 0.00 177.10 175.80 2ae5 s ASP 286 N -0.54 1.99 -1.41 -1.22 2.15 -1.26 -4.83 116.67 111.54 2ae5 s ASP 286 Ca 0.08 -1.13 -0.10 0.00 0.43 0.00 0.00 52.55 51.82 2ae5 s ASP 286 Cb -0.12 -0.03 0.04 0.00 -0.30 0.00 0.00 42.92 42.51 2ae5 s ASP 286 CO 0.02 -0.41 1.09 -0.67 -0.17 0.00 0.00 175.17 175.03 2ae5 n ASP 287 N -0.36 -5.48 -4.76 -0.34 4.64 -0.55 -4.90 116.55 104.81 2ae5 n ASP 287 Ca -0.07 -0.64 -0.41 0.00 -1.38 0.00 0.00 54.79 52.29 2ae5 n ASP 287 Cb 0.62 -4.60 -0.02 0.00 -1.04 0.00 0.00 41.12 36.08 2ae5 n ASP 287 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 2ae5 s LEU 288 N -7.25 4.42 0.31 -2.67 1.43 -0.59 -3.97 118.68 110.37 2ae5 s LEU 288 Ca 0.57 2.61 0.07 0.00 -1.03 0.00 0.00 54.13 56.35 2ae5 s LEU 288 Cb -0.27 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.29 2ae5 s LEU 288 CO 0.77 -0.55 0.29 0.42 0.23 0.00 0.00 176.35 177.51 2ae5 s THR 289 N -0.64 3.91 0.21 5.49 -4.23 -1.26 -1.37 115.64 117.75 2ae5 s THR 289 Ca 0.53 -1.32 -0.09 0.00 -1.18 0.00 0.00 61.69 59.63 2ae5 s THR 289 Cb -0.39 -3.30 0.15 0.00 1.34 0.00 0.00 72.50 70.30 2ae5 s THR 289 CO 0.47 -0.22 1.79 0.25 -0.54 0.00 0.00 174.62 176.36 2ae5 h LEU 290 N 1.26 0.46 -0.64 4.79 5.85 -1.98 -0.89 115.31 124.16 2ae5 h LEU 290 Ca -0.46 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.33 2ae5 h LEU 290 Cb 1.25 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 2ae5 h LEU 290 CO 0.58 0.28 0.40 -0.33 -0.34 0.00 0.00 178.44 179.04 2ae5 h GLU 291 N 0.60 0.77 -0.34 1.25 3.07 -1.99 0.46 114.58 118.40 2ae5 h GLU 291 Ca 0.31 -0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 59.04 2ae5 h GLU 291 Cb 0.28 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 2ae5 h GLU 291 CO -0.23 0.51 -0.12 -0.09 -1.40 0.00 0.00 179.01 177.68 2ae5 h ARG 292 N 0.79 0.67 -0.38 2.33 9.65 -1.89 -1.47 114.38 124.08 2ae5 h ARG 292 Ca 0.26 -0.27 0.07 0.00 -1.10 0.00 0.00 59.98 58.93 2ae5 h ARG 292 Cb 0.01 -0.03 -0.06 0.00 -1.39 0.00 0.00 29.97 28.49 2ae5 h ARG 292 CO -0.10 0.86 -0.02 0.35 2.80 0.00 0.00 179.97 183.86 2ae5 h PHE 293 N 0.45 -0.06 -0.80 2.20 3.57 -0.84 0.16 116.94 121.62 2ae5 h PHE 293 Ca 0.08 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 2ae5 h PHE 293 Cb 0.63 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.42 2ae5 h PHE 293 CO 0.05 -0.10 0.32 0.52 -2.23 0.00 0.00 178.31 176.88 2ae5 h MET 294 N 0.08 1.19 -0.58 1.11 2.86 -0.79 -2.30 114.93 116.49 2ae5 h MET 294 Ca 0.19 -0.22 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 2ae5 h MET 294 Cb 0.27 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 2ae5 h MET 294 CO -0.33 0.96 0.21 0.00 1.06 0.00 0.00 176.91 178.81 2ae5 h ALA 295 N 1.17 0.76 -0.33 6.32 0.00 -0.52 -2.75 119.26 123.90 2ae5 h ALA 295 Ca 0.27 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2ae5 h ALA 295 Cb 0.22 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2ae5 h ALA 295 CO -0.02 0.40 0.01 -0.07 0.00 0.00 0.00 179.25 179.57 2ae5 h LEU 296 N 0.81 0.48 -2.09 0.00 3.38 -0.83 -2.31 115.31 114.75 2ae5 h LEU 296 Ca 0.19 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2ae5 h LEU 296 Cb 0.24 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2ae5 h LEU 296 CO -0.01 0.54 -0.05 -0.61 0.09 0.00 0.00 178.44 178.39 2ae5 h GLN 297 N 0.49 0.00 0.00 1.13 -0.00 -1.11 -2.35 115.11 113.28 2ae5 h GLN 297 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.76 2ae5 h GLN 297 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.78 2ae5 h GLN 297 CO 0.01 0.05 0.00 1.28 0.00 0.00 0.00 178.83 180.17 2ae5 n LEU 298 N -4.09 0.00 -4.67 -2.39 4.77 -0.87 -3.86 117.00 105.89 2ae5 n LEU 298 Ca -0.03 0.00 -0.46 0.00 -0.03 0.00 0.00 56.01 55.49 2ae5 n LEU 298 Cb 0.14 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2ae5 n LEU 298 CO 0.31 0.00 1.19 -1.20 -1.33 0.00 0.00 177.39 176.36 2ae5 n SER 299 N -0.86 3.09 -2.74 -1.43 7.64 -0.89 -4.69 113.62 113.74 2ae5 n SER 299 Ca 0.14 1.09 -0.04 0.00 1.01 0.00 0.00 58.87 61.06 2ae5 n SER 299 Cb 0.06 -1.43 0.04 0.00 -1.01 0.00 0.00 64.21 61.88 2ae5 n SER 299 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ae5 n HIS 300 N 3.34 1.34 -2.38 1.43 1.44 -1.26 -1.53 115.22 117.60 2ae5 n HIS 300 Ca 0.17 -2.35 -0.41 0.00 -2.01 0.00 0.00 57.72 53.12 2ae5 n HIS 300 Cb 0.29 -0.28 -0.04 0.00 0.12 0.00 0.00 29.99 30.09 2ae5 n HIS 300 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 2ae5 s ARG 301 N -3.60 4.52 -1.33 -1.40 6.06 -1.26 -1.58 118.95 120.37 2ae5 s ARG 301 Ca 0.28 1.89 -0.13 0.00 -2.50 0.00 0.00 55.73 55.27 2ae5 s ARG 301 Cb 0.37 -3.21 0.11 0.00 0.06 0.00 0.00 34.95 32.28 2ae5 s ARG 301 CO -0.02 -0.01 1.87 0.00 -2.50 0.00 0.00 175.30 174.65 2ae5 n ALA 302 N 1.94 4.75 -0.17 6.12 0.00 -0.05 -2.50 120.51 130.60 2ae5 n ALA 302 Ca 0.02 -4.07 0.04 0.00 0.00 0.00 0.00 53.44 49.43 2ae5 n ALA 302 Cb 0.44 -3.30 0.32 0.00 0.00 0.00 0.00 19.45 16.92 2ae5 n ALA 302 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ae5 h VAL 303 N 4.38 1.09 -0.37 0.00 2.07 -1.49 -0.28 116.25 121.65 2ae5 h VAL 303 Ca 0.45 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.69 2ae5 h VAL 303 Cb 0.73 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 2ae5 h VAL 303 CO 1.60 0.15 0.25 -0.03 0.02 0.00 0.00 177.57 179.56 2ae5 h MET 304 N 0.82 0.49 -0.49 1.57 1.85 -1.62 -0.13 114.93 117.42 2ae5 h MET 304 Ca 0.28 -0.03 -0.10 0.00 -0.61 0.00 0.00 59.70 59.24 2ae5 h MET 304 Cb 0.08 -0.11 -0.02 0.00 0.43 0.00 0.00 31.60 31.98 2ae5 h MET 304 CO -0.08 0.32 -0.08 0.00 -0.40 0.00 0.00 176.91 176.68 2ae5 h ALA 305 N 1.77 0.94 -0.20 0.39 0.00 -1.31 -2.27 119.26 118.58 2ae5 h ALA 305 Ca 0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2ae5 h ALA 305 Cb -0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2ae5 h ALA 305 CO -0.03 0.62 0.08 -0.44 0.00 0.00 0.00 179.25 179.49 2ae5 h ASP 306 N 0.79 0.24 1.42 0.00 3.32 -0.89 0.31 116.42 121.60 2ae5 h ASP 306 Ca 0.14 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2ae5 h ASP 306 Cb 0.58 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2ae5 h ASP 306 CO 0.04 0.22 -0.54 0.03 -1.72 0.00 0.00 179.24 177.27 2ae5 h ARG 307 N 0.27 0.00 0.00 3.56 2.47 -1.14 -3.42 114.38 116.13 2ae5 h ARG 307 Ca 0.07 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.79 2ae5 h ARG 307 Cb 0.05 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.37 2ae5 h ARG 307 CO -0.01 0.00 -1.00 0.25 0.56 0.00 0.00 179.97 179.77 2ae5 n THR 308 N -2.81 0.00 -0.03 2.04 -2.24 -0.88 -1.03 114.28 109.34 2ae5 n THR 308 Ca 0.02 -0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.82 2ae5 n THR 308 Cb 0.53 -0.77 0.36 0.00 -2.10 0.00 0.00 70.33 68.35 2ae5 n THR 308 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2ae5 h LEU 309 N 0.00 0.53 -1.14 3.22 3.38 -1.17 -0.70 115.31 119.43 2ae5 h LEU 309 Ca -0.00 -0.04 0.13 0.00 0.09 0.00 0.00 57.88 58.06 2ae5 h LEU 309 Cb 1.00 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.54 2ae5 h LEU 309 CO -0.00 0.45 0.60 -0.65 0.09 0.00 0.00 178.44 178.94 2ae5 h PRO 310 N 0.60 0.82 0.08 1.13 0.11 -1.82 -1.05 132.00 131.87 2ae5 h PRO 310 Ca 0.15 -0.05 -0.31 0.00 0.11 0.00 0.00 66.00 65.90 2ae5 h PRO 310 Cb 0.06 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 30.96 2ae5 h PRO 310 CO -0.02 0.54 -1.67 -0.44 -0.21 0.00 0.00 178.00 176.21 2ae5 h ASP 311 N 0.85 0.28 -0.21 -2.05 3.32 -1.80 -3.40 116.42 113.40 2ae5 h ASP 311 Ca 0.48 -0.47 -0.07 0.00 0.02 0.00 0.00 57.03 56.99 2ae5 h ASP 311 Cb 0.61 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.07 2ae5 h ASP 311 CO -0.24 1.41 -0.13 0.25 -1.72 0.00 0.00 179.24 178.81 2ae5 h LEU 312 N 0.05 0.48 0.68 1.55 5.85 -0.80 -3.16 115.31 119.96 2ae5 h LEU 312 Ca -0.29 -0.43 -0.03 0.00 0.84 0.00 0.00 57.88 57.97 2ae5 h LEU 312 Cb 2.01 -0.13 0.01 0.00 0.37 0.00 0.00 40.66 42.91 2ae5 h LEU 312 CO 0.12 0.80 -0.33 0.40 -0.34 0.00 0.00 178.44 179.09 2ae5 h ILE 313 N 0.15 0.32 -0.81 4.05 1.08 -1.41 -0.62 117.51 120.26 2ae5 h ILE 313 Ca 0.04 -0.04 0.09 0.00 -0.39 0.00 0.00 64.86 64.56 2ae5 h ILE 313 Cb 0.63 0.33 -0.07 0.00 -3.07 0.00 0.00 36.82 34.64 2ae5 h ILE 313 CO 0.04 0.01 0.47 1.55 -0.69 0.00 0.00 178.15 179.52 2ae5 h PRO 314 N -0.95 0.77 -0.82 2.37 0.13 -1.78 -1.34 132.00 130.39 2ae5 h PRO 314 Ca -0.09 -0.05 0.05 0.00 -0.87 0.00 0.00 66.00 65.04 2ae5 h PRO 314 Cb 0.71 -0.17 -0.06 0.00 0.13 0.00 0.00 31.00 31.61 2ae5 h PRO 314 CO 0.15 0.51 0.50 0.00 -0.23 0.00 0.00 178.00 178.94 2ae5 h ALA 315 N 1.44 1.10 -0.02 -0.56 0.00 -1.47 -2.80 119.26 116.95 2ae5 h ALA 315 Ca 0.38 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.14 2ae5 h ALA 315 Cb 0.32 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2ae5 h ALA 315 CO -0.23 0.26 -0.66 0.00 0.00 0.00 0.00 179.25 178.61 2ae5 h ALA 316 N 1.38 0.85 0.00 0.00 0.00 -0.41 -2.97 119.26 118.10 2ae5 h ALA 316 Ca 0.35 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2ae5 h ALA 316 Cb 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2ae5 h ALA 316 CO -0.16 0.80 0.00 -0.07 0.00 0.00 0.00 179.25 179.82 2ae5 h LEU 317 N 0.07 0.00 -1.30 0.00 3.38 -1.02 -2.42 115.31 114.02 2ae5 h LEU 317 Ca -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2ae5 h LEU 317 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2ae5 h LEU 317 CO 0.09 0.00 -0.25 0.40 0.09 0.00 0.00 178.44 178.77 2ae5 h ILE 318 N 0.00 0.71 -3.65 1.22 2.04 -1.34 -3.46 117.51 113.03 2ae5 h ILE 318 Ca 0.00 -1.08 -0.52 0.00 1.00 0.00 0.00 64.86 64.26 2ae5 h ILE 318 Cb 0.57 1.68 0.04 0.00 -0.74 0.00 0.00 36.82 38.37 2ae5 h ILE 318 CO 0.00 0.25 0.61 -0.62 0.00 0.00 0.00 178.15 178.38 2ae5 s ASP 319 N -6.32 6.94 0.47 1.72 2.15 -0.91 -4.96 116.67 115.77 2ae5 s ASP 319 Ca -0.01 2.46 0.27 0.00 0.43 0.00 0.00 52.55 55.70 2ae5 s ASP 319 Cb 0.12 -2.63 0.92 0.00 -0.30 0.00 0.00 42.92 41.03 2ae5 s ASP 319 CO 0.64 -0.44 1.82 1.55 -0.17 0.00 0.00 175.17 178.57 2ae5 h PRO 320 N 4.36 0.00 -6.26 4.34 0.13 -1.88 -3.44 132.00 129.25 2ae5 h PRO 320 Ca -0.47 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.11 2ae5 h PRO 320 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2ae5 h PRO 320 CO 0.71 0.12 1.15 0.34 -0.23 0.00 0.00 178.00 180.08 2ae5 s ASP 321 N -6.03 6.46 0.52 1.44 -1.08 -1.26 -4.90 116.67 111.83 2ae5 s ASP 321 Ca 0.02 2.07 0.28 0.00 -0.52 0.00 0.00 52.55 54.40 2ae5 s ASP 321 Cb 0.09 -2.53 1.45 0.00 -1.46 0.00 0.00 42.92 40.46 2ae5 s ASP 321 CO 0.62 -1.12 2.06 -0.65 0.52 0.00 0.00 175.17 176.60 2ae5 h PRO 322 N 10.43 0.00 -0.20 4.34 0.11 -2.00 -2.22 132.00 142.46 2ae5 h PRO 322 Ca -0.39 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.55 2ae5 h PRO 322 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2ae5 h PRO 322 CO 0.97 0.12 -0.59 1.49 -0.21 0.00 0.00 178.00 179.78 2ae5 h GLU 323 N 0.00 0.66 -0.62 1.05 4.81 -1.97 -1.69 114.58 116.82 2ae5 h GLU 323 Ca -0.00 -0.44 -0.06 0.00 -0.13 0.00 0.00 59.36 58.72 2ae5 h GLU 323 Cb 0.35 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 2ae5 h GLU 323 CO 0.02 1.06 0.13 0.28 -0.73 0.00 0.00 179.01 179.77 2ae5 h VAL 324 N 0.50 1.26 -0.48 0.32 2.07 -1.79 -0.76 116.25 117.37 2ae5 h VAL 324 Ca 0.00 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.54 2ae5 h VAL 324 Cb 1.16 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 2ae5 h VAL 324 CO 0.12 0.36 0.19 1.56 0.02 0.00 0.00 177.57 179.81 2ae5 h GLN 325 N 0.92 0.72 -0.46 1.57 4.20 -1.41 -0.72 115.11 119.93 2ae5 h GLN 325 Ca 0.19 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.69 2ae5 h GLN 325 Cb 0.38 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 2ae5 h GLN 325 CO 0.01 0.65 -0.04 0.00 -0.67 0.00 0.00 178.83 178.78 2ae5 h ALA 326 N 1.03 1.07 -0.33 3.87 0.00 -1.20 -1.87 119.26 121.84 2ae5 h ALA 326 Ca 0.16 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ae5 h ALA 326 Cb 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2ae5 h ALA 326 CO -0.01 0.58 0.20 0.00 0.00 0.00 0.00 179.25 180.02 2ae5 h ALA 327 N 1.24 0.42 -0.76 0.00 0.00 -0.89 -1.45 119.26 117.81 2ae5 h ALA 327 Ca 0.13 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.07 2ae5 h ALA 327 Cb 0.50 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2ae5 h ALA 327 CO 0.03 -0.08 0.43 0.00 0.00 0.00 0.00 179.25 179.63 2ae5 h ALA 328 N 1.08 1.05 -0.02 0.00 0.00 -0.76 -1.07 119.26 119.54 2ae5 h ALA 328 Ca 0.12 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 2ae5 h ALA 328 Cb 0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2ae5 h ALA 328 CO -0.02 0.09 -0.69 0.00 0.00 0.00 0.00 179.25 178.63 2ae5 h ARG 329 N 0.76 0.12 -0.31 0.00 3.08 -1.19 -0.76 114.38 116.09 2ae5 h ARG 329 Ca 0.35 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.26 2ae5 h ARG 329 Cb 0.27 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2ae5 h ARG 329 CO -0.22 0.77 0.02 1.25 -1.07 0.00 0.00 179.97 180.72 2ae5 h LEU 330 N 0.08 0.52 -0.97 3.04 5.85 -0.83 -2.39 115.31 120.61 2ae5 h LEU 330 Ca -0.01 -0.29 -0.07 0.00 0.84 0.00 0.00 57.88 58.34 2ae5 h LEU 330 Cb 1.23 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 2ae5 h LEU 330 CO 0.10 0.68 -0.05 -0.07 -0.34 0.00 0.00 178.44 178.76 2ae5 h LEU 331 N 0.34 0.66 -0.86 2.25 3.38 -1.14 -3.12 115.31 116.83 2ae5 h LEU 331 Ca 0.09 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 2ae5 h LEU 331 Cb 0.41 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2ae5 h LEU 331 CO 0.01 0.77 -0.46 0.00 0.09 0.00 0.00 178.44 178.85 2ae5 h ALA 332 N 1.30 1.03 0.00 1.53 0.00 -1.00 -2.79 119.26 119.33 2ae5 h ALA 332 Ca 0.12 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2ae5 h ALA 332 Cb 0.48 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2ae5 h ALA 332 CO 0.02 0.63 -0.10 0.00 0.00 0.00 0.00 179.25 179.80 2ae5 n ALA 333 N -2.47 2.46 -1.88 0.00 0.00 -0.91 -4.88 120.51 112.82 2ae5 n ALA 333 Ca -0.02 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 52.92 2ae5 n ALA 333 Cb 0.52 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 2ae5 n ALA 333 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2ae5 s TRP 334 N -3.07 3.23 -2.00 0.00 -0.00 -1.06 -4.92 118.94 111.13 2ae5 s TRP 334 Ca 0.11 1.36 0.26 0.00 -0.00 0.00 0.00 56.10 57.83 2ae5 s TRP 334 Cb 0.15 -3.58 1.54 0.00 -0.00 0.00 0.00 33.47 31.57 2ae5 s TRP 334 CO 0.59 -1.68 1.94 -0.40 -0.00 0.00 0.00 176.95 177.41 2ae5 n ASP 335 N 1.77 0.00 -1.57 5.86 5.68 -1.26 -4.89 116.55 122.14 2ae5 n ASP 335 Ca 0.03 -1.02 -0.14 0.00 -0.50 0.00 0.00 54.79 53.16 2ae5 n ASP 335 Cb 0.43 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.39 2ae5 n ASP 335 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2ae5 n ARG 336 N -0.94 -1.13 -4.60 0.11 1.74 -1.26 -4.99 116.66 105.59 2ae5 n ARG 336 Ca 0.19 0.73 -0.33 0.00 -0.77 0.00 0.00 57.85 57.67 2ae5 n ARG 336 Cb 0.09 -5.01 -0.11 0.00 -1.02 0.00 0.00 32.46 26.41 2ae5 n ARG 336 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2ae5 s GLU 337 N -4.53 2.67 -1.48 5.56 0.41 -1.26 -0.87 118.70 119.20 2ae5 s GLU 337 Ca 0.00 -0.61 -0.13 0.00 -0.41 0.00 0.00 54.97 53.82 2ae5 s GLU 337 Cb 0.00 -2.55 0.02 0.00 -1.78 0.00 0.00 34.13 29.83 2ae5 s GLU 337 CO 0.00 0.64 2.36 1.19 -0.49 0.00 0.00 175.26 178.96 2ae5 n PHE 338 N 2.03 3.25 -2.96 1.61 3.01 -0.62 -4.84 117.46 118.93 2ae5 n PHE 338 Ca -0.17 -2.99 -0.24 0.00 1.01 0.00 0.00 57.45 55.06 2ae5 n PHE 338 Cb 0.53 -2.49 0.00 0.00 -0.01 0.00 0.00 39.48 37.51 2ae5 n PHE 338 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2ae5 s THR 339 N 2.69 4.45 0.40 4.37 -4.23 -1.26 -0.95 115.64 121.11 2ae5 s THR 339 Ca 0.51 -0.30 0.13 0.00 -1.18 0.00 0.00 61.69 60.85 2ae5 s THR 339 Cb 0.15 -3.66 0.34 0.00 1.34 0.00 0.00 72.50 70.67 2ae5 s THR 339 CO -0.08 -0.51 1.90 0.28 -0.54 0.00 0.00 174.62 175.66 2ae5 h SER 340 N 0.40 0.51 -0.13 3.99 0.02 -1.94 -2.85 113.55 113.55 2ae5 h SER 340 Ca -0.47 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2ae5 h SER 340 Cb 1.23 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2ae5 h SER 340 CO 0.60 0.26 0.00 -0.90 -1.14 0.00 0.00 176.83 175.64 2ae5 n ASP 341 N -4.51 1.86 -4.69 3.07 5.68 -1.26 -0.29 116.55 116.41 2ae5 n ASP 341 Ca 0.16 -1.69 -0.42 0.00 -0.50 0.00 0.00 54.79 52.34 2ae5 n ASP 341 Cb 0.51 -0.08 -0.03 0.00 -1.14 0.00 0.00 41.12 40.38 2ae5 n ASP 341 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 2ae5 s SER 342 N -1.73 6.79 0.16 -1.12 0.15 -1.08 -4.70 113.70 112.17 2ae5 s SER 342 Ca 0.34 2.20 0.23 0.00 0.70 0.00 0.00 55.95 59.42 2ae5 s SER 342 Cb 0.19 -2.56 0.21 0.00 -1.71 0.00 0.00 66.02 62.15 2ae5 s SER 342 CO 0.29 -0.77 1.22 0.03 1.20 0.00 0.00 173.24 175.21 2ae5 h ARG 343 N 8.05 0.00 0.00 5.44 3.08 -1.85 -0.77 114.38 128.33 2ae5 h ARG 343 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.66 2ae5 h ARG 343 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 2ae5 h ARG 343 CO 0.91 0.00 -1.47 0.00 -1.07 0.00 0.00 179.97 178.35 2ae5 n ALA 344 N -1.96 3.56 -0.21 0.04 0.00 -1.26 -4.09 120.51 116.59 2ae5 n ALA 344 Ca 0.02 -0.51 -0.07 0.00 0.00 0.00 0.00 53.44 52.88 2ae5 n ALA 344 Cb 0.48 -0.70 0.03 0.00 0.00 0.00 0.00 19.45 19.26 2ae5 n ALA 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ae5 h ALA 345 N 2.25 0.76 -0.18 0.00 0.00 -1.91 -0.66 119.26 119.53 2ae5 h ALA 345 Ca 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2ae5 h ALA 345 Cb 0.71 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2ae5 h ALA 345 CO 0.00 0.35 0.06 -0.07 0.00 0.00 0.00 179.25 179.59 2ae5 h LEU 346 N 0.81 0.25 -0.73 0.00 3.38 -1.85 -0.63 115.31 116.54 2ae5 h LEU 346 Ca 0.20 -0.20 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2ae5 h LEU 346 Cb 0.16 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 2ae5 h LEU 346 CO -0.02 0.38 0.43 0.25 0.09 0.00 0.00 178.44 179.57 2ae5 h LEU 347 N 0.11 0.66 -0.63 1.67 5.85 -1.76 -1.86 115.31 119.34 2ae5 h LEU 347 Ca 0.06 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2ae5 h LEU 347 Cb 0.22 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 2ae5 h LEU 347 CO -0.00 0.43 0.32 0.15 -0.34 0.00 0.00 178.44 178.99 2ae5 h PHE 348 N 0.79 0.90 -0.64 1.25 3.57 -0.61 -2.10 116.94 120.09 2ae5 h PHE 348 Ca 0.32 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.83 2ae5 h PHE 348 Cb 0.17 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 2ae5 h PHE 348 CO -0.06 0.67 0.36 0.93 -2.23 0.00 0.00 178.31 177.98 2ae5 h GLU 349 N 0.87 0.67 -0.15 1.11 5.08 -0.51 -0.88 114.58 120.77 2ae5 h GLU 349 Ca 0.22 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.46 2ae5 h GLU 349 Cb 0.09 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2ae5 h GLU 349 CO -0.03 0.44 -0.27 0.93 -1.00 0.00 0.00 179.01 179.08 2ae5 h GLU 350 N 0.69 0.27 -0.30 2.33 4.39 -0.94 0.67 114.58 121.68 2ae5 h GLU 350 Ca 0.28 -0.10 -0.08 0.00 0.34 0.00 0.00 59.36 59.81 2ae5 h GLU 350 Cb 0.14 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2ae5 h GLU 350 CO -0.16 0.53 -0.10 2.35 -1.16 0.00 0.00 179.01 180.47 2ae5 h TRP 351 N 0.24 0.69 -0.10 4.33 7.01 -0.90 -3.19 115.95 124.03 2ae5 h TRP 351 Ca 0.04 -0.16 -0.07 0.00 2.11 0.00 0.00 58.89 60.81 2ae5 h TRP 351 Cb 0.61 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.50 2ae5 h TRP 351 CO 0.01 0.81 -0.25 0.00 -2.79 0.00 0.00 178.44 176.22 2ae5 h ALA 352 N 0.78 1.41 -0.59 2.65 0.00 -0.31 -0.66 119.26 122.53 2ae5 h ALA 352 Ca 0.07 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.76 2ae5 h ALA 352 Cb 0.61 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2ae5 h ALA 352 CO 0.04 0.42 0.39 0.00 0.00 0.00 0.00 179.25 180.10 2ae5 h ARG 353 N 0.15 0.57 0.09 0.00 3.08 -0.89 0.14 114.38 117.53 2ae5 h ARG 353 Ca 0.02 -0.03 -0.21 0.00 0.07 0.00 0.00 59.98 59.83 2ae5 h ARG 353 Cb 0.53 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2ae5 h ARG 353 CO 0.04 0.38 -1.04 -0.07 -1.07 0.00 0.00 179.97 178.21 2ae5 h LEU 354 N 0.59 0.31 -0.82 3.04 3.38 -1.40 -2.26 115.31 118.15 2ae5 h LEU 354 Ca 0.25 -0.86 -0.11 0.00 0.09 0.00 0.00 57.88 57.25 2ae5 h LEU 354 Cb 0.25 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2ae5 h LEU 354 CO -0.07 1.46 -0.32 0.15 0.09 0.00 0.00 178.44 179.74 2ae5 h PHE 355 N -0.49 0.59 0.00 1.13 3.57 -0.95 -3.31 116.94 117.47 2ae5 h PHE 355 Ca -0.22 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.13 2ae5 h PHE 355 Cb 1.58 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 40.18 2ae5 h PHE 355 CO 0.16 0.77 -0.13 0.00 -2.23 0.00 0.00 178.31 176.89 2ae5 n ALA 356 N -2.49 2.06 0.00 2.41 0.00 0.46 -4.37 120.51 118.58 2ae5 n ALA 356 Ca -0.01 -1.81 0.00 0.00 0.00 0.00 0.00 53.44 51.62 2ae5 n ALA 356 Cb 0.46 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2ae5 n ALA 356 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ae5 n GLY 357 N -0.83 -1.82 0.24 0.00 0.00 -0.86 -0.92 105.19 101.01 2ae5 n GLY 357 Ca 0.08 -1.52 0.10 0.00 0.00 0.00 0.00 46.02 44.68 2ae5 n GLY 357 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2ae5 h GLN 358 N 0.00 0.00 -0.01 1.61 1.08 -1.86 -1.58 115.11 114.35 2ae5 h GLN 358 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2ae5 h GLN 358 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2ae5 h GLN 358 CO 0.00 0.19 -0.22 0.27 -0.95 0.00 0.00 178.83 178.12 2ae5 n ASN 359 N -3.74 1.39 -1.08 1.46 6.94 -1.26 -4.96 115.26 114.01 2ae5 n ASN 359 Ca -0.02 -1.18 -0.14 0.00 -0.02 0.00 0.00 54.58 53.23 2ae5 n ASN 359 Cb 0.30 0.15 -0.06 0.00 -2.36 0.00 0.00 39.78 37.82 2ae5 n ASN 359 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2ae5 n PHE 360 N -0.27 0.00 0.79 -2.53 3.01 -0.59 -4.78 117.46 113.08 2ae5 n PHE 360 Ca 0.13 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.68 2ae5 n PHE 360 Cb 0.38 -2.53 -0.03 0.00 -0.01 0.00 0.00 39.48 37.29 2ae5 n PHE 360 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ae5 n ALA 361 N 1.26 3.58 -1.76 4.37 0.00 -0.87 -4.76 120.51 122.33 2ae5 n ALA 361 Ca -0.14 -0.53 -0.39 0.00 0.00 0.00 0.00 53.44 52.37 2ae5 n ALA 361 Cb 0.47 -0.62 0.02 0.00 0.00 0.00 0.00 19.45 19.32 2ae5 n ALA 361 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ae5 s GLY 362 N -2.22 2.91 -0.00 0.00 0.00 -0.09 -4.96 107.32 102.96 2ae5 s GLY 362 Ca 0.12 1.43 0.05 0.00 0.00 0.00 0.00 44.72 46.32 2ae5 s GLY 362 CO 0.53 2.02 0.20 -1.06 0.00 0.00 0.00 173.10 174.78 2ae5 n GLN 363 N -0.34 3.93 0.25 2.90 1.13 -1.26 -4.72 117.38 119.27 2ae5 n GLN 363 Ca 0.06 -0.01 0.13 0.00 -1.94 0.00 0.00 57.00 55.24 2ae5 n GLN 363 Cb 0.43 -0.85 0.57 0.00 0.11 0.00 0.00 30.24 30.49 2ae5 n GLN 363 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2ae5 h ALA 364 N 0.68 1.04 0.00 -1.58 0.00 -1.92 -2.92 119.26 114.55 2ae5 h ALA 364 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ae5 h ALA 364 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ae5 h ALA 364 CO 0.00 0.17 0.00 0.78 0.00 0.00 0.00 179.25 180.20 2ae5 h GLY 365 N 1.96 0.00 -2.61 0.00 0.00 -1.85 -3.47 103.07 97.10 2ae5 h GLY 365 Ca -0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 2ae5 h GLY 365 CO 0.02 0.00 0.17 -1.36 0.00 0.00 0.00 176.54 175.37 2ae5 s PHE 366 N -3.34 3.36 -0.05 5.60 0.40 -1.11 -1.06 117.98 121.79 2ae5 s PHE 366 Ca 0.05 1.32 -0.23 0.00 -0.60 0.00 0.00 56.93 57.47 2ae5 s PHE 366 Cb 0.09 -2.62 -0.27 0.00 0.51 0.00 0.00 43.02 40.73 2ae5 s PHE 366 CO 0.52 0.01 0.97 0.00 0.70 0.00 0.00 175.22 177.42 2ae5 h ALA 367 N 2.06 -0.01 -2.99 5.36 0.00 -0.77 -3.38 119.26 119.53 2ae5 h ALA 367 Ca -0.48 -0.58 -0.66 0.00 0.00 0.00 0.00 54.91 53.19 2ae5 h ALA 367 Cb 1.18 0.05 -0.27 0.00 0.00 0.00 0.00 17.79 18.75 2ae5 h ALA 367 CO 0.64 0.25 -0.70 0.99 0.00 0.00 0.00 179.25 180.43 2ae5 s THR 368 N -2.78 3.57 0.79 0.00 2.01 0.61 -4.91 115.64 114.93 2ae5 s THR 368 Ca -0.15 -0.42 -0.11 0.00 0.31 0.00 0.00 61.69 61.32 2ae5 s THR 368 Cb 0.01 -2.64 0.07 0.00 0.01 0.00 0.00 72.50 69.95 2ae5 s THR 368 CO 0.79 0.41 1.09 -2.16 -0.69 0.00 0.00 174.62 174.05 2ae5 s PRO 369 N 1.49 2.13 0.43 4.92 0.04 -1.26 -1.60 135.00 141.15 2ae5 s PRO 369 Ca 0.06 0.84 -0.25 0.00 0.04 0.00 0.00 61.00 61.68 2ae5 s PRO 369 Cb -0.14 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 2ae5 s PRO 369 CO -0.02 -1.64 1.35 -0.46 0.04 0.00 0.00 177.00 176.28 2ae5 s TRP 370 N -3.04 2.64 -0.05 0.56 -0.00 -1.26 -4.57 118.94 113.22 2ae5 s TRP 370 Ca 0.61 1.35 -0.04 0.00 -0.00 0.00 0.00 56.10 58.01 2ae5 s TRP 370 Cb -0.16 -3.78 0.02 0.00 -0.00 0.00 0.00 33.47 29.56 2ae5 s TRP 370 CO 0.55 -2.47 0.13 0.45 -0.00 0.00 0.00 176.95 175.61 2ae5 s SER 371 N -0.66 -0.13 0.55 5.86 0.15 -1.26 -4.96 113.70 113.24 2ae5 s SER 371 Ca 0.59 0.26 0.33 0.00 0.70 0.00 0.00 55.95 57.84 2ae5 s SER 371 Cb -0.40 0.24 1.44 0.00 -1.71 0.00 0.00 66.02 65.59 2ae5 s SER 371 CO 0.52 -0.06 2.01 0.25 1.20 0.00 0.00 173.24 177.16 2ae5 h LEU 372 N 6.17 0.00 -1.28 3.45 5.85 -1.96 -1.80 115.31 125.75 2ae5 h LEU 372 Ca -0.28 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 2ae5 h LEU 372 Cb 1.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 2ae5 h LEU 372 CO 0.43 0.03 -0.17 0.44 -0.34 0.00 0.00 178.44 178.84 2ae5 h ASP 373 N 0.00 0.00 -2.09 1.25 3.32 -2.02 -3.28 116.42 113.61 2ae5 h ASP 373 Ca -0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 2ae5 h ASP 373 Cb 0.47 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.62 2ae5 h ASP 373 CO 0.00 0.17 -0.95 0.29 -1.72 0.00 0.00 179.24 177.03 2ae5 n LYS 374 N -3.35 1.57 0.24 3.56 5.02 -0.70 -4.99 118.16 119.50 2ae5 n LYS 374 Ca 0.00 -3.83 0.16 0.00 -2.02 0.00 0.00 58.31 52.62 2ae5 n LYS 374 Cb 0.38 -1.73 0.63 0.00 -0.02 0.00 0.00 35.03 34.30 2ae5 n LYS 374 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2ae5 h PRO 375 N 3.62 0.00 -0.14 1.97 0.13 -1.57 -2.81 132.00 133.20 2ae5 h PRO 375 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2ae5 h PRO 375 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2ae5 h PRO 375 CO 0.61 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.71 2ae5 n VAL 376 N -2.86 1.32 -0.92 1.56 0.24 -1.26 -4.65 118.33 111.76 2ae5 n VAL 376 Ca 0.01 -1.33 0.00 0.00 -2.04 0.00 0.00 64.34 60.99 2ae5 n VAL 376 Cb 0.29 0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.94 2ae5 n VAL 376 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2ae5 n SER 377 N -0.35 0.13 -4.39 -1.34 3.41 -1.13 -4.93 113.62 105.02 2ae5 n SER 377 Ca 0.09 -1.05 -0.20 0.00 -0.26 0.00 0.00 58.87 57.45 2ae5 n SER 377 Cb 0.45 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.30 2ae5 n SER 377 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2ae5 s THR 378 N -0.05 1.82 0.93 6.66 -4.23 -1.07 -4.62 115.64 115.08 2ae5 s THR 378 Ca 0.00 -2.21 -0.13 0.00 -1.18 0.00 0.00 61.69 58.16 2ae5 s THR 378 Cb 0.00 -2.20 0.15 0.00 1.34 0.00 0.00 72.50 71.79 2ae5 s THR 378 CO 0.00 -0.48 1.16 -2.16 -0.54 0.00 0.00 174.62 172.60 2ae5 s PRO 379 N -3.65 1.00 -0.04 3.99 0.04 -1.26 -4.82 135.00 130.27 2ae5 s PRO 379 Ca 0.26 0.15 -0.18 0.00 0.04 0.00 0.00 61.00 61.26 2ae5 s PRO 379 Cb 0.00 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.74 2ae5 s PRO 379 CO 0.09 -2.26 0.40 -0.47 0.04 0.00 0.00 177.00 174.80 2ae5 s TYR 380 N -3.37 -0.31 0.00 0.56 6.14 -0.62 -4.94 117.35 114.80 2ae5 s TYR 380 Ca 0.65 0.54 0.00 0.00 0.64 0.00 0.00 57.07 58.90 2ae5 s TYR 380 Cb -0.12 0.17 0.00 0.00 0.42 0.00 0.00 41.96 42.42 2ae5 s TYR 380 CO 0.53 -0.42 0.00 0.41 0.64 0.00 0.00 175.55 176.71 2ae5 n GLY 381 N 1.35 -0.93 3.37 8.97 0.00 -0.19 -0.29 105.19 117.47 2ae5 n GLY 381 Ca -0.20 -1.63 -0.38 0.00 0.00 0.00 0.00 46.02 43.81 2ae5 n GLY 381 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ae5 s VAL 382 N -2.62 4.18 0.14 1.61 1.01 -1.26 -1.87 120.40 121.58 2ae5 s VAL 382 Ca 0.00 -0.67 -0.18 0.00 0.00 0.00 0.00 61.98 61.13 2ae5 s VAL 382 Cb 0.00 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 2ae5 s VAL 382 CO 0.00 0.03 1.79 -0.09 0.00 0.00 0.00 175.10 176.83 2ae5 h ARG 383 N 8.28 0.37 -2.91 2.72 2.43 -1.28 -3.38 114.38 120.62 2ae5 h ARG 383 Ca -0.30 -0.02 -0.61 0.00 -0.81 0.00 0.00 59.98 58.23 2ae5 h ARG 383 Cb 1.13 -0.08 -0.40 0.00 -0.42 0.00 0.00 29.97 30.19 2ae5 h ARG 383 CO 0.61 0.25 -0.74 0.34 -1.51 0.00 0.00 179.97 178.92 2ae5 s ASP 384 N -5.45 3.52 0.33 -3.80 -1.08 -1.26 -4.93 116.67 104.00 2ae5 s ASP 384 Ca -0.13 -3.01 0.01 0.00 -0.52 0.00 0.00 52.55 48.90 2ae5 s ASP 384 Cb 0.10 -1.08 0.56 0.00 -1.46 0.00 0.00 42.92 41.04 2ae5 s ASP 384 CO 0.71 -0.20 1.97 -0.65 0.52 0.00 0.00 175.17 177.51 2ae5 h PRO 385 N 6.20 0.87 -0.35 4.34 0.11 -1.94 -1.33 132.00 139.91 2ae5 h PRO 385 Ca 0.08 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2ae5 h PRO 385 Cb 0.88 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.79 2ae5 h PRO 385 CO 0.52 0.62 0.22 0.87 -0.21 0.00 0.00 178.00 180.02 2ae5 h LYS 386 N 0.89 0.46 -0.96 1.05 1.57 -1.94 -0.31 116.57 117.32 2ae5 h LYS 386 Ca 0.23 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2ae5 h LYS 386 Cb -0.03 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.14 2ae5 h LYS 386 CO -0.04 0.32 0.58 0.00 -0.57 0.00 0.00 179.45 179.74 2ae5 h ALA 387 N 1.11 1.22 -0.53 3.86 0.00 -1.92 -2.31 119.26 120.69 2ae5 h ALA 387 Ca 0.13 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2ae5 h ALA 387 Cb -0.03 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 2ae5 h ALA 387 CO -0.03 0.67 0.12 0.00 0.00 0.00 0.00 179.25 180.01 2ae5 h ALA 388 N 1.32 1.20 -0.47 0.00 0.00 -0.54 -0.86 119.26 119.91 2ae5 h ALA 388 Ca 0.34 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2ae5 h ALA 388 Cb -0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2ae5 h ALA 388 CO -0.07 0.54 -0.10 0.28 0.00 0.00 0.00 179.25 179.91 2ae5 h VAL 389 N 0.79 1.26 -0.78 0.00 2.07 -0.79 -0.48 116.25 118.32 2ae5 h VAL 389 Ca 0.17 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 2ae5 h VAL 389 Cb 0.31 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2ae5 h VAL 389 CO 0.00 0.41 0.45 0.44 0.02 0.00 0.00 177.57 178.89 2ae5 h ASP 390 N 0.77 0.96 -0.98 0.57 3.45 -0.85 -0.64 116.42 119.70 2ae5 h ASP 390 Ca 0.13 -0.08 0.03 0.00 0.43 0.00 0.00 57.03 57.53 2ae5 h ASP 390 Cb 0.61 -0.24 -0.05 0.00 -0.56 0.00 0.00 39.33 39.08 2ae5 h ASP 390 CO 0.04 0.77 0.65 1.56 -1.57 0.00 0.00 179.24 180.68 2ae5 h GLN 391 N 1.08 1.24 -0.69 3.56 4.20 -0.73 -2.24 115.11 121.52 2ae5 h GLN 391 Ca 0.28 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.86 2ae5 h GLN 391 Cb 0.00 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 27.47 2ae5 h GLN 391 CO -0.05 0.82 0.23 1.25 -0.67 0.00 0.00 178.83 180.41 2ae5 h LEU 392 N 1.27 0.97 0.02 1.46 5.85 -0.24 -0.06 115.31 124.58 2ae5 h LEU 392 Ca 0.38 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.95 2ae5 h LEU 392 Cb -0.05 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 2ae5 h LEU 392 CO -0.11 0.89 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.71 2ae5 h ARG 393 N 1.01 -0.14 -0.70 1.25 2.43 -0.61 -0.26 114.38 117.36 2ae5 h ARG 393 Ca 0.23 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 2ae5 h ARG 393 Cb 0.26 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 2ae5 h ARG 393 CO -0.01 -0.09 0.45 1.15 -1.51 0.00 0.00 179.97 179.96 2ae5 h THR 394 N -0.15 1.19 0.00 0.20 2.02 -1.25 -2.88 112.91 112.03 2ae5 h THR 394 Ca 0.03 -0.36 -0.05 0.00 0.77 0.00 0.00 66.41 66.79 2ae5 h THR 394 Cb 0.18 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 2ae5 h THR 394 CO -0.07 0.18 -0.26 0.00 0.37 0.00 0.00 175.52 175.74 2ae5 h ALA 395 N 1.25 1.48 -0.06 6.16 0.00 -0.55 -0.06 119.26 127.48 2ae5 h ALA 395 Ca 0.26 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2ae5 h ALA 395 Cb -0.09 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2ae5 h ALA 395 CO -0.05 0.32 0.01 0.82 0.00 0.00 0.00 179.25 180.35 2ae5 h ILE 396 N 0.00 1.21 -0.68 0.00 2.04 -0.84 0.04 117.51 119.29 2ae5 h ILE 396 Ca -0.00 -0.64 0.01 0.00 1.00 0.00 0.00 64.86 65.23 2ae5 h ILE 396 Cb 0.49 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 2ae5 h ILE 396 CO 0.03 0.18 0.44 0.00 0.00 0.00 0.00 178.15 178.80 2ae5 h ALA 397 N 0.77 0.86 -0.67 1.87 0.00 -1.34 -1.90 119.26 118.85 2ae5 h ALA 397 Ca 0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2ae5 h ALA 397 Cb 0.27 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2ae5 h ALA 397 CO 0.00 0.26 0.31 -0.91 0.00 0.00 0.00 179.25 178.91 2ae5 h ASN 398 N 0.89 0.86 -0.27 0.00 2.35 -0.85 -0.74 115.58 117.82 2ae5 h ASN 398 Ca 0.25 -0.09 -0.14 0.00 -0.55 0.00 0.00 56.30 55.77 2ae5 h ASN 398 Cb -0.07 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.07 2ae5 h ASN 398 CO -0.07 0.74 -0.38 0.74 -1.65 0.00 0.00 177.43 176.81 2ae5 h THR 399 N 0.95 1.30 -0.39 2.81 2.02 -0.68 -0.91 112.91 118.01 2ae5 h THR 399 Ca 0.23 -1.57 -0.10 0.00 0.77 0.00 0.00 66.41 65.75 2ae5 h THR 399 Cb 0.11 1.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 2ae5 h THR 399 CO -0.03 0.50 -0.14 0.11 0.37 0.00 0.00 175.52 176.33 2ae5 h LYS 400 N 0.48 0.78 -0.31 6.66 1.57 -1.21 -0.21 116.57 124.34 2ae5 h LYS 400 Ca 0.03 -0.32 0.05 0.00 -1.87 0.00 0.00 60.65 58.54 2ae5 h LYS 400 Cb 0.97 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.20 2ae5 h LYS 400 CO 0.09 0.93 0.05 -0.09 -0.57 0.00 0.00 179.45 179.86 2ae5 h ARG 401 N 0.58 0.15 -0.03 3.15 2.43 -1.05 -0.59 114.38 119.02 2ae5 h ARG 401 Ca 0.09 -0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 59.04 2ae5 h ARG 401 Cb 0.68 -0.03 0.02 0.00 -0.42 0.00 0.00 29.97 30.21 2ae5 h ARG 401 CO 0.05 0.10 -0.80 0.87 -1.51 0.00 0.00 179.97 178.68 2ae5 h LYS 402 N 0.16 0.60 -0.00 0.20 1.57 -1.02 -3.39 116.57 114.68 2ae5 h LYS 402 Ca 0.14 -0.60 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2ae5 h LYS 402 Cb 0.16 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2ae5 h LYS 402 CO -0.20 1.21 -0.12 0.66 -0.57 0.00 0.00 179.45 180.44 2ae5 n TYR 403 N -4.03 0.00 0.00 -1.35 4.02 -0.10 -3.90 117.16 111.80 2ae5 n TYR 403 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.79 2ae5 n TYR 403 Cb 0.76 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.08 2ae5 n TYR 403 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2ae5 n GLY 404 N 1.00 1.29 3.54 2.72 0.00 -0.23 -4.84 105.19 108.66 2ae5 n GLY 404 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 2ae5 n GLY 404 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ae5 s ALA 405 N -2.30 -1.91 -1.46 4.61 0.00 -1.26 -4.92 121.76 114.53 2ae5 s ALA 405 Ca 0.00 1.23 0.29 0.00 0.00 0.00 0.00 51.96 53.48 2ae5 s ALA 405 Cb 0.00 0.22 1.49 0.00 0.00 0.00 0.00 23.12 24.83 2ae5 s ALA 405 CO 0.00 -0.65 2.02 0.44 0.00 0.00 0.00 175.76 177.57 2ae5 n ILE 406 N -0.18 0.04 -2.30 0.00 -5.35 -1.26 -4.18 119.36 106.13 2ae5 n ILE 406 Ca -0.06 0.01 0.04 0.00 -0.27 0.00 0.00 62.75 62.48 2ae5 n ILE 406 Cb 0.60 -0.53 0.05 0.00 -1.74 0.00 0.00 39.64 38.03 2ae5 n ILE 406 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2ae5 n ASP 407 N -1.27 1.08 -4.73 7.28 5.75 -1.26 -4.55 116.55 118.85 2ae5 n ASP 407 Ca 0.14 -2.34 -0.42 0.00 -0.01 0.00 0.00 54.79 52.17 2ae5 n ASP 407 Cb 0.23 -0.33 -0.03 0.00 -1.03 0.00 0.00 41.12 39.95 2ae5 n ASP 407 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 2ae5 s ARG 408 N -0.59 4.31 0.23 0.11 3.52 -1.26 -4.73 118.95 120.54 2ae5 s ARG 408 Ca 0.33 2.19 -0.31 0.00 -0.13 0.00 0.00 55.73 57.80 2ae5 s ARG 408 Cb 0.36 -3.17 -0.14 0.00 -1.56 0.00 0.00 34.95 30.44 2ae5 s ARG 408 CO -0.14 -0.40 1.38 -2.30 -0.81 0.00 0.00 175.30 173.03 2ae5 n PRO 409 N 3.01 1.93 -0.16 5.12 -0.02 -1.26 -4.61 135.00 139.00 2ae5 n PRO 409 Ca 0.09 0.69 -0.03 0.00 -2.02 0.00 0.00 63.50 62.22 2ae5 n PRO 409 Cb 0.41 -2.33 0.06 0.00 -0.02 0.00 0.00 33.50 31.63 2ae5 n PRO 409 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2ae5 h PHE 410 N 4.14 0.37 0.00 6.00 3.57 -1.02 -0.82 116.94 129.17 2ae5 h PHE 410 Ca -0.45 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.08 2ae5 h PHE 410 Cb 1.28 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.93 2ae5 h PHE 410 CO 0.56 0.14 0.00 0.41 -2.23 0.00 0.00 178.31 177.20 2ae5 n GLY 411 N -1.26 -0.97 0.11 2.40 0.00 0.60 -0.63 105.19 105.44 2ae5 n GLY 411 Ca 0.05 -0.12 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 2ae5 n GLY 411 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2ae5 h ASP 412 N 0.00 0.24 0.23 1.61 1.82 -1.35 -3.35 116.42 115.61 2ae5 h ASP 412 Ca 0.00 -0.49 -0.31 0.00 -0.39 0.00 0.00 57.03 55.83 2ae5 h ASP 412 Cb 0.16 -0.08 0.03 0.00 0.68 0.00 0.00 39.33 40.12 2ae5 h ASP 412 CO 0.00 1.44 -1.40 0.00 -1.61 0.00 0.00 179.24 177.67 2ae5 h ALA 413 N 0.52 -0.12 -2.07 -0.78 0.00 -1.43 -3.45 119.26 111.93 2ae5 h ALA 413 Ca -0.34 -0.86 -0.66 0.00 0.00 0.00 0.00 54.91 53.05 2ae5 h ALA 413 Cb 2.02 0.20 -0.16 0.00 0.00 0.00 0.00 17.79 19.85 2ae5 h ALA 413 CO 0.09 0.67 0.18 -1.12 0.00 0.00 0.00 179.25 179.08 2ae5 s SER 414 N -7.46 6.29 0.13 0.00 0.01 0.19 -0.77 113.70 112.09 2ae5 s SER 414 Ca -0.11 -0.58 0.09 0.00 1.31 0.00 0.00 55.95 56.66 2ae5 s SER 414 Cb 0.04 -2.33 -0.04 0.00 0.21 0.00 0.00 66.02 63.90 2ae5 s SER 414 CO 0.92 -0.92 -0.21 -0.13 0.41 0.00 0.00 173.24 173.31 2ae5 s ARG 415 N 2.96 1.21 -0.27 12.44 1.81 -0.14 -0.42 118.95 136.54 2ae5 s ARG 415 Ca 0.21 -1.26 -0.04 0.00 -1.72 0.00 0.00 55.73 52.92 2ae5 s ARG 415 Cb -0.16 -1.44 0.02 0.00 -0.45 0.00 0.00 34.95 32.92 2ae5 s ARG 415 CO 0.16 0.32 -0.00 -1.64 -0.68 0.00 0.00 175.30 173.46 2ae5 s MET 416 N -2.21 2.92 -0.21 3.54 -1.94 -0.55 -4.02 119.30 116.83 2ae5 s MET 416 Ca 0.10 -0.94 0.00 0.00 -1.71 0.00 0.00 55.69 53.14 2ae5 s MET 416 Cb -0.09 -3.15 0.05 0.00 2.01 0.00 0.00 34.83 33.66 2ae5 s MET 416 CO 0.05 -0.43 -0.05 0.42 -0.01 0.00 0.00 175.02 175.01 2ae5 s ILE 417 N 1.39 1.33 -0.06 2.53 1.01 -1.26 -1.52 121.20 124.61 2ae5 s ILE 417 Ca 0.01 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 59.72 2ae5 s ILE 417 Cb -0.17 -1.56 0.02 0.00 0.01 0.00 0.00 42.46 40.76 2ae5 s ILE 417 CO -0.02 -0.00 -0.09 -0.76 0.00 0.00 0.00 174.94 174.07 2ae5 s LEU 418 N 1.51 1.49 0.00 2.97 1.43 -0.82 -5.01 118.68 120.25 2ae5 s LEU 418 Ca -0.03 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 2ae5 s LEU 418 Cb -0.17 -0.71 0.00 0.00 0.03 0.00 0.00 46.19 45.33 2ae5 s LEU 418 CO -0.07 -0.01 0.00 0.59 0.23 0.00 0.00 176.35 177.09 2ae5 n ASN 419 N 4.03 0.00 -1.49 2.29 3.02 -1.26 -1.47 115.26 120.38 2ae5 n ASN 419 Ca -0.22 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.41 2ae5 n ASN 419 Cb 0.51 0.00 0.34 0.00 -0.61 0.00 0.00 39.78 40.02 2ae5 n ASN 419 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2ae5 n ASP 420 N 3.33 4.78 -4.74 6.41 5.75 -1.26 -4.89 116.55 125.93 2ae5 n ASP 420 Ca 0.00 -2.66 -0.35 0.00 -0.01 0.00 0.00 54.79 51.77 2ae5 n ASP 420 Cb 0.00 -0.58 -0.08 0.00 -1.03 0.00 0.00 41.12 39.43 2ae5 n ASP 420 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2ae5 s VAL 421 N -2.23 5.41 -0.24 2.12 1.01 -0.54 -5.07 120.40 120.87 2ae5 s VAL 421 Ca 0.49 0.20 -0.04 0.00 0.00 0.00 0.00 61.98 62.63 2ae5 s VAL 421 Cb 0.34 -3.47 0.09 0.00 0.00 0.00 0.00 36.38 33.34 2ae5 s VAL 421 CO 0.19 0.45 0.15 0.21 0.00 0.00 0.00 175.10 176.09 2ae5 s ASN 422 N 0.28 2.62 0.17 3.32 3.84 -1.26 -1.95 114.94 121.96 2ae5 s ASN 422 Ca 0.09 -0.85 0.07 0.00 0.21 0.00 0.00 52.86 52.38 2ae5 s ASN 422 Cb -0.11 -0.12 -0.04 0.00 -0.55 0.00 0.00 41.25 40.43 2ae5 s ASN 422 CO -0.01 -0.39 -0.15 0.68 -2.79 0.00 0.00 177.10 174.44 2ae5 s VAL 423 N 2.17 1.59 0.27 -5.21 -7.23 -0.58 -4.97 120.40 106.45 2ae5 s VAL 423 Ca 0.06 -1.98 -0.29 0.00 -1.81 0.00 0.00 61.98 57.96 2ae5 s VAL 423 Cb -0.16 -1.83 -0.10 0.00 0.56 0.00 0.00 36.38 34.86 2ae5 s VAL 423 CO -0.23 -0.48 1.27 -2.16 -0.31 0.00 0.00 175.10 173.18 2ae5 s PRO 424 N -3.15 4.42 0.39 4.82 0.04 -1.26 -1.49 135.00 138.77 2ae5 s PRO 424 Ca 0.16 2.08 -0.07 0.00 0.04 0.00 0.00 61.00 63.21 2ae5 s PRO 424 Cb -0.03 -3.14 -0.05 0.00 0.04 0.00 0.00 34.50 31.32 2ae5 s PRO 424 CO 0.05 -0.14 0.71 0.20 0.04 0.00 0.00 177.00 177.86 2ae5 s GLY 425 N -0.25 1.79 0.21 0.56 0.00 0.44 -4.77 107.32 105.29 2ae5 s GLY 425 Ca 0.51 -0.39 -0.13 0.00 0.00 0.00 0.00 44.72 44.70 2ae5 s GLY 425 CO 0.45 -0.23 0.44 0.00 0.00 0.00 0.00 173.10 173.76 2ae5 s ALA 426 N -2.38 -0.40 0.32 3.20 0.00 -1.26 -3.90 121.76 117.33 2ae5 s ALA 426 Ca 0.48 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.77 2ae5 s ALA 426 Cb -0.10 0.94 0.00 0.00 0.00 0.00 0.00 23.12 23.95 2ae5 s ALA 426 CO 0.34 -0.78 0.00 0.00 0.00 0.00 0.00 175.76 175.32 2ae5 n ALA 427 N -0.32 -3.04 -2.70 0.00 0.00 -0.13 -4.83 120.51 109.50 2ae5 n ALA 427 Ca -0.06 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2ae5 n ALA 427 Cb 0.62 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.98 2ae5 n ALA 427 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ae5 n GLY 428 N -3.75 1.81 3.69 0.00 0.00 -1.25 -4.66 105.19 101.02 2ae5 n GLY 428 Ca -0.01 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2ae5 n GLY 428 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ae5 s TYR 429 N 0.55 3.14 0.24 1.61 1.51 -1.25 -1.79 117.35 121.37 2ae5 s TYR 429 Ca 0.00 1.18 -0.04 0.00 -1.01 0.00 0.00 57.07 57.20 2ae5 s TYR 429 Cb 0.00 -3.44 0.44 0.00 -0.11 0.00 0.00 41.96 38.85 2ae5 s TYR 429 CO 0.00 -1.41 1.75 0.78 -1.11 0.00 0.00 175.55 175.57 2ae5 h GLY 430 N 8.33 1.19 2.00 0.71 0.00 -1.89 -1.61 103.07 111.80 2ae5 h GLY 430 Ca -0.34 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.79 2ae5 h GLY 430 CO 0.89 -0.03 0.00 0.70 0.00 0.00 0.00 176.54 178.10 2ae5 n ASN 431 N -4.92 0.29 -0.11 0.19 3.02 -1.26 -0.84 115.26 111.62 2ae5 n ASN 431 Ca 0.14 0.58 0.12 0.00 -0.03 0.00 0.00 54.58 55.40 2ae5 n ASN 431 Cb 0.38 -0.64 0.31 0.00 -0.61 0.00 0.00 39.78 39.22 2ae5 n ASN 431 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2ae5 n LEU 432 N -1.83 0.72 0.00 3.41 4.77 -0.61 -4.43 117.00 119.03 2ae5 n LEU 432 Ca 0.02 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 2ae5 n LEU 432 Cb 0.16 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2ae5 n LEU 432 CO 0.14 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 2ae5 n GLY 433 N 1.43 1.01 3.69 -0.72 0.00 -0.02 -1.39 105.19 109.18 2ae5 n GLY 433 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2ae5 n GLY 433 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ae5 s SER 434 N -1.60 6.66 -0.12 1.61 0.15 -1.04 -4.35 113.70 115.01 2ae5 s SER 434 Ca 0.00 2.40 -0.22 0.00 0.70 0.00 0.00 55.95 58.83 2ae5 s SER 434 Cb 0.00 -2.56 -0.19 0.00 -1.71 0.00 0.00 66.02 61.55 2ae5 s SER 434 CO 0.00 -0.85 0.64 0.15 1.20 0.00 0.00 173.24 174.39 2ae5 h PHE 435 N 8.18 -0.02 -2.89 3.44 3.57 -1.63 -3.36 116.94 124.23 2ae5 h PHE 435 Ca -0.41 -0.00 -0.54 0.00 3.53 0.00 0.00 57.97 60.55 2ae5 h PHE 435 Cb 1.20 0.01 0.01 0.00 2.79 0.00 0.00 35.95 39.96 2ae5 h PHE 435 CO 0.77 0.69 0.83 0.50 -2.23 0.00 0.00 178.31 178.87 2ae5 s ARG 436 N -2.29 4.28 -0.14 1.11 3.52 -0.58 -4.95 118.95 119.89 2ae5 s ARG 436 Ca -0.14 2.09 0.00 0.00 -0.13 0.00 0.00 55.73 57.55 2ae5 s ARG 436 Cb -0.02 -3.45 -0.01 0.00 -1.56 0.00 0.00 34.95 29.92 2ae5 s ARG 436 CO 0.52 -0.56 -0.14 0.08 -0.81 0.00 0.00 175.30 174.39 2ae5 s VAL 437 N 1.94 2.86 -0.26 7.11 1.01 -1.26 -3.75 120.40 128.05 2ae5 s VAL 437 Ca 0.66 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 2ae5 s VAL 437 Cb -0.36 -2.20 0.08 0.00 0.00 0.00 0.00 36.38 33.91 2ae5 s VAL 437 CO 0.29 0.52 0.06 -0.36 0.00 0.00 0.00 175.10 175.61 2ae5 s PHE 438 N 0.53 1.45 -0.96 5.22 0.40 -0.74 -0.88 117.98 123.01 2ae5 s PHE 438 Ca -0.09 -1.37 -0.24 0.00 -0.60 0.00 0.00 56.93 54.63 2ae5 s PHE 438 Cb -0.16 -1.41 0.03 0.00 0.51 0.00 0.00 43.02 42.00 2ae5 s PHE 438 CO 0.04 -0.77 1.49 0.99 0.70 0.00 0.00 175.22 177.67 2ae5 s THR 439 N 1.71 3.82 0.30 0.64 2.01 -0.30 -3.83 115.64 120.00 2ae5 s THR 439 Ca 0.04 -0.52 -0.29 0.00 0.31 0.00 0.00 61.69 61.23 2ae5 s THR 439 Cb -0.17 -4.90 -0.10 0.00 0.01 0.00 0.00 72.50 67.34 2ae5 s THR 439 CO -0.18 -1.79 1.33 0.26 -0.69 0.00 0.00 174.62 173.56 2ae5 s TRP 440 N 5.76 3.06 0.98 4.92 0.52 -1.26 -1.53 118.94 131.39 2ae5 s TRP 440 Ca 0.48 1.32 -0.12 0.00 0.02 0.00 0.00 56.10 57.80 2ae5 s TRP 440 Cb -0.02 -3.70 0.18 0.00 -1.15 0.00 0.00 33.47 28.78 2ae5 s TRP 440 CO -0.05 -2.03 1.08 -1.54 0.02 0.00 0.00 176.95 174.44 2ae5 s SER 441 N -0.24 2.58 0.53 2.95 1.04 0.28 -4.82 113.70 116.02 2ae5 s SER 441 Ca 0.52 1.61 -0.22 0.00 0.48 0.00 0.00 55.95 58.33 2ae5 s SER 441 Cb -0.40 -2.26 -0.06 0.00 0.10 0.00 0.00 66.02 63.40 2ae5 s SER 441 CO 0.50 -3.22 1.31 0.47 0.98 0.00 0.00 173.24 173.28 2ae5 n ASP 442 N -4.27 2.51 -4.79 7.02 8.00 -1.26 -4.65 116.55 119.11 2ae5 n ASP 442 Ca 0.07 0.99 -0.34 0.00 0.71 0.00 0.00 54.79 56.22 2ae5 n ASP 442 Cb 0.54 -1.55 -0.02 0.00 -0.02 0.00 0.00 41.12 40.08 2ae5 n ASP 442 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2ae5 s PRO 443 N -2.74 3.59 0.16 -0.24 0.04 -1.26 -4.72 135.00 129.83 2ae5 s PRO 443 Ca 0.70 1.39 -0.03 0.00 0.04 0.00 0.00 61.00 63.10 2ae5 s PRO 443 Cb -0.43 -2.06 0.04 0.00 0.04 0.00 0.00 34.50 32.08 2ae5 s PRO 443 CO 0.51 -0.61 0.19 -0.40 0.04 0.00 0.00 177.00 176.73 2ae5 n ASP 444 N -1.26 -0.32 0.26 6.66 3.85 -0.25 -4.87 116.55 120.63 2ae5 n ASP 444 Ca 0.10 -0.94 0.17 0.00 -0.71 0.00 0.00 54.79 53.40 2ae5 n ASP 444 Cb 0.52 -0.16 0.66 0.00 -1.35 0.00 0.00 41.12 40.80 2ae5 n ASP 444 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 2ae5 h GLU 445 N 0.00 0.00 -0.61 0.11 4.11 -1.93 -1.40 114.58 114.86 2ae5 h GLU 445 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.36 2ae5 h GLU 445 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2ae5 h GLU 445 CO 0.05 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.22 2ae5 n ASN 446 N -3.00 3.53 -0.08 3.06 3.02 -1.26 -4.95 115.26 115.58 2ae5 n ASN 446 Ca 0.01 -2.16 -0.01 0.00 -0.03 0.00 0.00 54.58 52.39 2ae5 n ASN 446 Cb 0.30 -0.45 -0.00 0.00 -0.61 0.00 0.00 39.78 39.01 2ae5 n ASN 446 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ae5 n GLY 447 N 1.25 0.46 3.74 7.41 0.00 -0.53 -4.99 105.19 112.54 2ae5 n GLY 447 Ca 0.20 -0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 2ae5 n GLY 447 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ae5 s VAL 448 N -1.84 5.13 0.13 1.61 1.01 -1.26 -4.60 120.40 120.58 2ae5 s VAL 448 Ca 0.00 0.97 0.05 0.00 0.00 0.00 0.00 61.98 63.00 2ae5 s VAL 448 Cb 0.00 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 2ae5 s VAL 448 CO 0.00 0.37 -0.11 0.00 0.00 0.00 0.00 175.10 175.36 2ae5 s ARG 449 N 0.27 1.01 0.18 2.72 1.70 0.05 -1.09 118.95 123.80 2ae5 s ARG 449 Ca 0.26 -1.34 0.01 0.00 -0.47 0.00 0.00 55.73 54.19 2ae5 s ARG 449 Cb -0.16 -0.68 -0.05 0.00 -0.57 0.00 0.00 34.95 33.50 2ae5 s ARG 449 CO 0.12 0.10 0.03 0.95 -1.08 0.00 0.00 175.30 175.41 2ae5 s THR 450 N -2.85 0.55 0.07 4.99 -4.23 -1.26 -0.97 115.64 111.95 2ae5 s THR 450 Ca 0.12 -1.97 -0.31 0.00 -1.18 0.00 0.00 61.69 58.36 2ae5 s THR 450 Cb -0.00 -2.18 -0.07 0.00 1.34 0.00 0.00 72.50 71.59 2ae5 s THR 450 CO 0.01 -0.41 1.40 -2.84 -0.54 0.00 0.00 174.62 172.24 2ae5 s PRO 451 N -3.96 4.31 0.14 3.99 0.02 -1.26 -0.56 135.00 137.68 2ae5 s PRO 451 Ca 0.26 2.03 0.24 0.00 0.02 0.00 0.00 61.00 63.54 2ae5 s PRO 451 Cb 0.07 -3.40 0.21 0.00 0.02 0.00 0.00 34.50 31.40 2ae5 s PRO 451 CO 0.05 -0.49 1.21 -0.39 -0.33 0.00 0.00 177.00 177.04 2ae5 h VAL 452 N 4.55 0.00 -1.60 3.83 -1.51 -1.59 -3.45 116.25 116.48 2ae5 h VAL 452 Ca -0.41 -0.63 0.12 0.00 -1.23 0.00 0.00 66.70 64.55 2ae5 h VAL 452 Cb 1.20 1.16 -0.22 0.00 -2.13 0.00 0.00 31.29 31.30 2ae5 h VAL 452 CO 0.88 0.00 0.60 -2.28 -1.23 0.00 0.00 177.57 175.54 2ae5 s HIS 453 N -3.23 -0.31 -2.28 5.19 5.65 -1.25 -1.39 115.29 117.66 2ae5 s HIS 453 Ca 0.04 0.47 0.00 0.00 0.25 0.00 0.00 55.06 55.82 2ae5 s HIS 453 Cb 0.12 0.47 0.00 0.00 -1.18 0.00 0.00 32.58 31.99 2ae5 s HIS 453 CO 0.75 -0.33 0.00 0.41 -0.65 0.00 0.00 174.74 174.92 2ae5 n GLY 454 N 0.51 0.58 3.64 1.59 0.00 -1.17 -1.16 105.19 109.18 2ae5 n GLY 454 Ca -0.08 -1.42 -0.49 0.00 0.00 0.00 0.00 46.02 44.02 2ae5 n GLY 454 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ae5 n GLU 455 N 0.00 1.69 0.00 1.61 -0.58 -0.06 -3.62 120.64 119.68 2ae5 n GLU 455 Ca 0.00 0.61 0.00 0.00 -0.42 0.00 0.00 57.16 57.35 2ae5 n GLU 455 Cb 0.00 -2.33 0.00 0.00 -0.57 0.00 0.00 31.44 28.54 2ae5 n GLU 455 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2ae5 n THR 456 N 3.22 0.00 -3.06 2.62 -2.24 -1.24 -4.65 114.28 108.93 2ae5 n THR 456 Ca 0.18 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.56 2ae5 n THR 456 Cb 0.24 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.42 2ae5 n THR 456 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2ae5 s TRP 457 N 0.24 3.46 -0.16 4.78 -0.11 -1.26 -1.73 118.94 124.17 2ae5 s TRP 457 Ca 0.00 1.11 -0.02 0.00 1.22 0.00 0.00 56.10 58.41 2ae5 s TRP 457 Cb 0.00 -2.83 0.05 0.00 -1.50 0.00 0.00 33.47 29.19 2ae5 s TRP 457 CO 0.00 -0.07 0.00 0.08 -4.62 0.00 0.00 176.95 172.34 2ae5 s VAL 458 N 1.49 0.64 0.04 5.86 1.01 -0.41 -3.69 120.40 125.32 2ae5 s VAL 458 Ca 0.34 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2ae5 s VAL 458 Cb -0.17 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.22 2ae5 s VAL 458 CO 0.13 -0.01 -0.07 0.00 0.00 0.00 0.00 175.10 175.15 2ae5 s ALA 459 N 1.83 0.55 -0.06 5.51 0.00 -0.44 -1.03 121.76 128.13 2ae5 s ALA 459 Ca 0.01 -0.70 -0.00 0.00 0.00 0.00 0.00 51.96 51.26 2ae5 s ALA 459 Cb -0.15 0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.02 2ae5 s ALA 459 CO -0.07 -0.01 -0.02 -1.64 0.00 0.00 0.00 175.76 174.02 2ae5 s MET 460 N -1.42 0.68 -0.07 0.00 -1.94 0.04 -0.84 119.30 115.77 2ae5 s MET 460 Ca -0.09 0.02 0.03 0.00 -1.71 0.00 0.00 55.69 53.94 2ae5 s MET 460 Cb -0.09 -0.90 0.01 0.00 2.01 0.00 0.00 34.83 35.86 2ae5 s MET 460 CO 0.00 -0.21 -0.14 0.42 -0.01 0.00 0.00 175.02 175.09 2ae5 s ILE 461 N 1.50 1.25 -0.18 2.53 1.09 -0.03 -1.43 121.20 125.93 2ae5 s ILE 461 Ca -0.02 -0.55 -0.06 0.00 -1.10 0.00 0.00 60.65 58.91 2ae5 s ILE 461 Cb -0.13 -1.13 -0.04 0.00 -1.06 0.00 0.00 42.46 40.10 2ae5 s ILE 461 CO -0.03 0.38 0.03 -0.70 -0.10 0.00 0.00 174.94 174.52 2ae5 s GLU 462 N 0.59 3.86 -0.50 2.79 2.12 0.03 -0.79 118.70 126.79 2ae5 s GLU 462 Ca -0.14 -0.41 -0.04 0.00 0.36 0.00 0.00 54.97 54.74 2ae5 s GLU 462 Cb -0.16 -3.13 0.07 0.00 0.26 0.00 0.00 34.13 31.17 2ae5 s GLU 462 CO 0.04 0.22 2.74 1.19 -0.54 0.00 0.00 175.26 178.92 2ae5 n PHE 463 N 3.65 1.66 -1.03 5.30 3.01 -0.43 -1.95 117.46 127.68 2ae5 n PHE 463 Ca -0.17 -1.99 -0.27 0.00 1.01 0.00 0.00 57.45 56.03 2ae5 n PHE 463 Cb 0.52 -1.40 0.23 0.00 -0.01 0.00 0.00 39.48 38.82 2ae5 n PHE 463 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2ae5 n SER 464 N 0.90 -1.92 -3.89 4.37 3.41 -1.26 -4.57 113.62 110.65 2ae5 n SER 464 Ca 0.50 -1.12 -0.30 0.00 -0.26 0.00 0.00 58.87 57.68 2ae5 n SER 464 Cb 0.53 -0.91 -0.15 0.00 -0.26 0.00 0.00 64.21 63.42 2ae5 n SER 464 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2ae5 s THR 465 N -2.83 1.48 0.96 6.66 2.01 -1.26 -2.19 115.64 120.47 2ae5 s THR 465 Ca 0.65 -1.51 -0.12 0.00 0.31 0.00 0.00 61.69 61.02 2ae5 s THR 465 Cb -0.06 -1.94 0.17 0.00 0.01 0.00 0.00 72.50 70.68 2ae5 s THR 465 CO 0.49 -0.38 1.11 -2.16 -0.69 0.00 0.00 174.62 172.99 2ae5 s PRO 466 N 1.36 0.72 0.68 4.92 0.04 -1.26 -5.11 135.00 136.34 2ae5 s PRO 466 Ca 0.03 0.47 -0.14 0.00 0.04 0.00 0.00 61.00 61.39 2ae5 s PRO 466 Cb -0.18 -1.77 0.01 0.00 0.04 0.00 0.00 34.50 32.59 2ae5 s PRO 466 CO -0.12 -2.52 1.11 0.14 0.04 0.00 0.00 177.00 175.65 2ae5 s VAL 467 N -3.06 3.18 -0.07 -0.36 -7.23 -0.93 -4.97 120.40 106.96 2ae5 s VAL 467 Ca 0.65 0.53 0.02 0.00 -1.81 0.00 0.00 61.98 61.36 2ae5 s VAL 467 Cb -0.17 -3.04 0.01 0.00 0.56 0.00 0.00 36.38 33.74 2ae5 s VAL 467 CO 0.56 -0.36 -0.12 -0.60 -0.31 0.00 0.00 175.10 174.27 2ae5 s ARG 468 N -4.19 1.76 0.00 4.82 3.52 -0.82 -4.93 118.95 119.10 2ae5 s ARG 468 Ca 0.67 -0.42 -0.02 0.00 -0.13 0.00 0.00 55.73 55.82 2ae5 s ARG 468 Cb -0.21 -1.49 -0.01 0.00 -1.56 0.00 0.00 34.95 31.69 2ae5 s ARG 468 CO 0.44 -0.01 0.04 0.00 -0.81 0.00 0.00 175.30 174.96 2ae5 s ALA 469 N 0.79 -0.07 0.08 6.12 0.00 -1.26 -0.79 121.76 126.63 2ae5 s ALA 469 Ca -0.12 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 51.67 2ae5 s ALA 469 Cb -0.15 0.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.99 2ae5 s ALA 469 CO 0.02 -0.12 -0.12 0.71 0.00 0.00 0.00 175.76 176.25 2ae5 s TYR 470 N -0.91 1.09 0.16 0.00 1.51 -0.51 -1.38 117.35 117.31 2ae5 s TYR 470 Ca -0.10 -0.52 -0.24 0.00 -1.01 0.00 0.00 57.07 55.20 2ae5 s TYR 470 Cb -0.06 -0.61 0.06 0.00 -0.11 0.00 0.00 41.96 41.24 2ae5 s TYR 470 CO -0.00 0.02 0.80 0.20 -1.11 0.00 0.00 175.55 175.47 2ae5 s GLY 471 N -1.92 -0.32 0.03 0.71 0.00 -0.34 -0.78 107.32 104.70 2ae5 s GLY 471 Ca -0.01 0.26 -0.07 0.00 0.00 0.00 0.00 44.72 44.90 2ae5 s GLY 471 CO 0.01 0.08 0.14 1.08 0.00 0.00 0.00 173.10 174.41 2ae5 s LEU 472 N -2.80 1.62 -0.22 0.66 1.43 -0.20 -1.65 118.68 117.52 2ae5 s LEU 472 Ca 0.08 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.78 2ae5 s LEU 472 Cb -0.02 0.73 0.04 0.00 0.03 0.00 0.00 46.19 46.97 2ae5 s LEU 472 CO -0.02 -0.50 -0.14 -0.32 0.23 0.00 0.00 176.35 175.60 2ae5 s MET 473 N -2.35 2.45 0.21 1.70 -2.45 -1.26 -1.29 119.30 116.31 2ae5 s MET 473 Ca -0.07 -1.04 -0.10 0.00 -1.25 0.00 0.00 55.69 53.23 2ae5 s MET 473 Cb -0.02 -2.66 0.30 0.00 1.25 0.00 0.00 34.83 33.70 2ae5 s MET 473 CO -0.03 -0.41 1.71 0.77 1.05 0.00 0.00 175.02 178.11 2ae5 h SER 474 N 7.88 0.04 -0.55 1.11 0.02 -1.60 -2.51 113.55 117.94 2ae5 h SER 474 Ca -0.31 0.11 -0.17 0.00 -0.84 0.00 0.00 61.79 60.58 2ae5 h SER 474 Cb 1.09 0.14 -0.10 0.00 0.14 0.00 0.00 62.40 63.67 2ae5 h SER 474 CO 0.53 0.03 0.15 0.00 -1.14 0.00 0.00 176.83 176.39 2ae5 n TYR 475 N -5.11 1.81 -0.98 3.45 0.18 -1.26 -3.88 117.16 111.37 2ae5 n TYR 475 Ca 0.09 -1.24 0.06 0.00 1.88 0.00 0.00 57.90 58.69 2ae5 n TYR 475 Cb 0.32 -0.56 -0.02 0.00 -0.38 0.00 0.00 39.34 38.70 2ae5 n TYR 475 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2ae5 n GLY 476 N -0.51 -2.08 1.13 -7.48 0.00 -0.95 -4.53 105.19 90.78 2ae5 n GLY 476 Ca 0.35 -1.39 0.12 0.00 0.00 0.00 0.00 46.02 45.10 2ae5 n GLY 476 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ae5 n ASN 477 N -1.97 3.38 -3.70 1.61 5.15 -0.44 -4.94 115.26 114.35 2ae5 n ASN 477 Ca 0.00 -1.98 -0.14 0.00 -0.60 0.00 0.00 54.58 51.86 2ae5 n ASN 477 Cb 0.21 -0.27 -0.08 0.00 -0.53 0.00 0.00 39.78 39.11 2ae5 n ASN 477 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2ae5 s SER 478 N -1.44 -0.37 0.00 1.20 0.15 -0.65 -4.84 113.70 107.74 2ae5 s SER 478 Ca 0.39 0.47 0.00 0.00 0.70 0.00 0.00 55.95 57.52 2ae5 s SER 478 Cb 0.23 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 65.09 2ae5 s SER 478 CO 0.31 -0.39 0.77 -1.14 1.20 0.00 0.00 173.24 174.00 2ae5 n ARG 479 N 1.69 1.61 -2.22 5.44 0.63 -1.26 -3.48 116.66 119.08 2ae5 n ARG 479 Ca -0.18 -1.07 -0.41 0.00 -0.92 0.00 0.00 57.85 55.27 2ae5 n ARG 479 Cb 0.56 -0.89 -0.03 0.00 0.45 0.00 0.00 32.46 32.56 2ae5 n ARG 479 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2ae5 s GLN 480 N -0.60 4.43 -0.08 -0.14 -1.52 -1.26 -4.90 119.66 115.59 2ae5 s GLN 480 Ca 0.00 2.09 -0.39 0.00 -1.95 0.00 0.00 55.36 55.11 2ae5 s GLN 480 Cb 0.00 -3.12 -0.17 0.00 -0.22 0.00 0.00 33.01 29.50 2ae5 s GLN 480 CO 0.00 -0.10 1.46 -2.30 -0.25 0.00 0.00 175.29 174.10 2ae5 n PRO 481 N 1.18 0.94 -0.71 2.91 -0.02 -1.26 -1.68 135.00 136.37 2ae5 n PRO 481 Ca 0.01 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2ae5 n PRO 481 Cb 0.43 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2ae5 n PRO 481 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ae5 n GLY 482 N 3.04 0.78 3.77 -1.23 0.00 -1.26 -5.03 105.19 105.26 2ae5 n GLY 482 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 2ae5 n GLY 482 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ae5 s THR 483 N -2.93 3.14 -2.12 2.61 -1.32 -0.67 -4.91 115.64 109.44 2ae5 s THR 483 Ca 0.00 0.84 0.15 0.00 -1.21 0.00 0.00 61.69 61.47 2ae5 s THR 483 Cb 0.00 -3.41 0.37 0.00 -1.51 0.00 0.00 72.50 67.95 2ae5 s THR 483 CO 0.00 -0.03 1.40 0.35 -2.21 0.00 0.00 174.62 174.13 2ae5 n THR 484 N -0.58 0.29 -1.66 5.08 -2.24 -1.26 -4.34 114.28 109.57 2ae5 n THR 484 Ca 0.08 -0.35 -0.07 0.00 -2.27 0.00 0.00 64.05 61.44 2ae5 n THR 484 Cb 0.48 0.24 0.15 0.00 -2.10 0.00 0.00 70.33 69.10 2ae5 n THR 484 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2ae5 n HIS 485 N 0.26 1.20 -0.11 4.78 8.25 -1.26 -4.30 115.22 124.04 2ae5 n HIS 485 Ca 0.13 -1.80 -0.23 0.00 -0.26 0.00 0.00 57.72 55.56 2ae5 n HIS 485 Cb 0.27 -0.41 -0.08 0.00 1.12 0.00 0.00 29.99 30.90 2ae5 n HIS 485 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 2ae5 n TYR 486 N -1.01 0.00 0.37 4.41 9.36 -1.23 -1.33 117.16 127.74 2ae5 n TYR 486 Ca 0.32 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.66 2ae5 n TYR 486 Cb 0.87 -0.80 0.24 0.00 -0.63 0.00 0.00 39.34 39.02 2ae5 n TYR 486 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 2ae5 n SER 487 N -4.16 3.27 -0.28 2.98 3.41 -1.26 -2.93 113.62 114.65 2ae5 n SER 487 Ca -0.42 -1.96 0.12 0.00 -0.26 0.00 0.00 58.87 56.35 2ae5 n SER 487 Cb 0.77 -0.26 0.57 0.00 -0.26 0.00 0.00 64.21 65.04 2ae5 n SER 487 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2ae5 n ASP 488 N 1.35 0.85 -0.00 4.04 5.75 -1.26 -3.74 116.55 123.53 2ae5 n ASP 488 Ca 0.19 -1.44 0.02 0.00 -0.01 0.00 0.00 54.79 53.55 2ae5 n ASP 488 Cb 0.57 -0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.61 2ae5 n ASP 488 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ae5 n GLN 489 N -0.27 2.24 0.13 0.11 6.02 -1.26 -4.79 117.38 119.55 2ae5 n GLN 489 Ca 0.18 -0.02 0.02 0.00 -0.01 0.00 0.00 57.00 57.17 2ae5 n GLN 489 Cb 0.22 -0.92 0.38 0.00 1.02 0.00 0.00 30.24 30.94 2ae5 n GLN 489 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.06 177.02 2ae5 h ILE 490 N 0.00 1.20 -0.41 5.09 6.09 -1.67 -1.42 117.51 126.39 2ae5 h ILE 490 Ca 0.00 -0.92 -0.04 0.00 -1.37 0.00 0.00 64.86 62.54 2ae5 h ILE 490 Cb 0.12 1.34 -0.02 0.00 0.47 0.00 0.00 36.82 38.73 2ae5 h ILE 490 CO 0.00 0.28 0.12 -0.08 -3.07 0.00 0.00 178.15 175.39 2ae5 h GLU 491 N 0.18 0.65 -0.93 2.19 4.22 -1.87 -1.14 114.58 117.88 2ae5 h GLU 491 Ca 0.03 -0.15 0.03 0.00 0.08 0.00 0.00 59.36 59.36 2ae5 h GLU 491 Cb 0.46 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.56 2ae5 h GLU 491 CO 0.03 0.65 0.61 0.00 -2.18 0.00 0.00 179.01 178.12 2ae5 h ARG 492 N 0.52 1.13 -0.69 1.92 3.08 -1.70 -1.92 114.38 116.73 2ae5 h ARG 492 Ca 0.13 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 60.12 2ae5 h ARG 492 Cb 0.28 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 2ae5 h ARG 492 CO -0.00 0.75 0.45 0.28 -1.07 0.00 0.00 179.97 180.38 2ae5 h VAL 493 N 1.17 1.17 0.00 2.04 2.07 -0.77 -0.09 116.25 121.84 2ae5 h VAL 493 Ca 0.37 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 2ae5 h VAL 493 Cb 0.01 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 2ae5 h VAL 493 CO -0.11 0.17 -0.03 0.77 0.02 0.00 0.00 177.57 178.39 2ae5 h SER 494 N 0.93 0.00 -0.31 0.57 4.64 -0.42 -1.37 113.55 117.59 2ae5 h SER 494 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 2ae5 h SER 494 Cb -0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 2ae5 h SER 494 CO -0.06 0.03 0.00 0.54 -0.87 0.00 0.00 176.83 176.47 2ae5 n ARG 495 N -3.41 2.21 -3.99 4.77 1.74 -0.88 -4.95 116.66 112.16 2ae5 n ARG 495 Ca -0.02 -1.95 -0.29 0.00 -0.77 0.00 0.00 57.85 54.82 2ae5 n ARG 495 Cb 0.15 -1.34 -0.00 0.00 -1.02 0.00 0.00 32.46 30.24 2ae5 n ARG 495 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ae5 n ALA 496 N 0.88 -1.62 -3.35 7.54 0.00 -0.52 -4.93 120.51 118.51 2ae5 n ALA 496 Ca 0.13 -0.07 -0.46 0.00 0.00 0.00 0.00 53.44 53.04 2ae5 n ALA 496 Cb 0.45 -2.84 -0.03 0.00 0.00 0.00 0.00 19.45 17.04 2ae5 n ALA 496 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ae5 s ASP 497 N -3.81 6.64 0.35 0.00 3.68 -0.15 -5.02 116.67 118.35 2ae5 s ASP 497 Ca 0.37 -2.63 -0.25 0.00 2.13 0.00 0.00 52.55 52.17 2ae5 s ASP 497 Cb -0.20 -2.19 -0.10 0.00 -1.45 0.00 0.00 42.92 38.99 2ae5 s ASP 497 CO 0.88 -0.58 0.96 -0.36 0.13 0.00 0.00 175.17 176.20 2ae5 s PHE 498 N 0.26 3.58 0.31 -5.34 0.40 -1.26 -4.69 117.98 111.23 2ae5 s PHE 498 Ca 0.17 1.74 -0.28 0.00 -0.60 0.00 0.00 56.93 57.96 2ae5 s PHE 498 Cb -0.12 -2.95 -0.09 0.00 0.51 0.00 0.00 43.02 40.37 2ae5 s PHE 498 CO -0.08 0.04 1.03 1.03 0.70 0.00 0.00 175.22 177.94 2ae5 s ARG 499 N -2.25 4.56 0.00 0.44 0.52 -0.66 -4.82 118.95 116.75 2ae5 s ARG 499 Ca 0.53 1.60 -0.30 0.00 -0.52 0.00 0.00 55.73 57.03 2ae5 s ARG 499 Cb -0.18 -3.00 -0.05 0.00 0.52 0.00 0.00 34.95 32.24 2ae5 s ARG 499 CO 0.23 0.20 1.35 -2.00 0.02 0.00 0.00 175.30 175.11 2ae5 s GLU 500 N -1.73 4.31 0.00 3.54 2.12 -1.26 -1.20 118.70 124.47 2ae5 s GLU 500 Ca 0.48 1.91 -0.28 0.00 0.36 0.00 0.00 54.97 57.44 2ae5 s GLU 500 Cb -0.26 -3.53 -0.04 0.00 0.26 0.00 0.00 34.13 30.56 2ae5 s GLU 500 CO 0.33 -0.52 0.87 -0.51 -0.54 0.00 0.00 175.26 174.90 2ae5 s LEU 501 N 2.18 4.38 -0.39 2.70 1.43 -0.48 -4.92 118.68 123.59 2ae5 s LEU 501 Ca 0.62 1.52 -0.09 0.00 -1.03 0.00 0.00 54.13 55.15 2ae5 s LEU 501 Cb -0.31 -3.40 0.05 0.00 0.03 0.00 0.00 46.19 42.57 2ae5 s LEU 501 CO 0.26 -0.16 0.21 -0.76 0.23 0.00 0.00 176.35 176.12 2ae5 s LEU 502 N 0.70 4.82 -0.13 1.79 1.43 -1.26 -4.62 118.68 121.41 2ae5 s LEU 502 Ca 0.46 -1.27 0.13 0.00 -1.03 0.00 0.00 54.13 52.41 2ae5 s LEU 502 Cb -0.20 -1.97 -0.18 0.00 0.03 0.00 0.00 46.19 43.87 2ae5 s LEU 502 CO 0.25 -0.44 0.07 0.18 0.23 0.00 0.00 176.35 176.64 2ae5 n LEU 503 N 4.91 0.00 -4.75 1.79 4.32 -1.26 -4.79 117.00 117.22 2ae5 n LEU 503 Ca -0.11 0.00 -0.40 0.00 -0.02 0.00 0.00 56.01 55.48 2ae5 n LEU 503 Cb 0.44 0.32 -0.05 0.00 -1.62 0.00 0.00 43.42 42.51 2ae5 n LEU 503 CO 0.36 0.32 0.61 -0.13 -1.22 0.00 0.00 177.39 177.34 2ae5 s ARG 504 N -2.39 4.74 0.23 3.23 0.52 -1.26 -4.93 118.95 119.08 2ae5 s ARG 504 Ca -0.07 1.39 -0.09 0.00 -0.52 0.00 0.00 55.73 56.44 2ae5 s ARG 504 Cb 0.05 -3.31 0.35 0.00 0.52 0.00 0.00 34.95 32.56 2ae5 s ARG 504 CO 0.57 0.42 1.65 -0.09 0.02 0.00 0.00 175.30 177.87 2ae5 h ARG 505 N 4.72 0.11 -0.72 3.54 9.65 -1.99 -0.66 114.38 129.03 2ae5 h ARG 505 Ca -0.45 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.43 2ae5 h ARG 505 Cb 1.20 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.72 2ae5 h ARG 505 CO 0.69 0.07 0.46 1.05 2.80 0.00 0.00 179.97 185.04 2ae5 h GLU 506 N 0.12 0.95 -0.32 0.20 4.11 -1.99 0.36 114.58 118.01 2ae5 h GLU 506 Ca 0.36 -0.07 -0.13 0.00 0.07 0.00 0.00 59.36 59.59 2ae5 h GLU 506 Cb 0.60 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2ae5 h GLU 506 CO -0.58 0.65 -0.30 1.96 0.07 0.00 0.00 179.01 180.80 2ae5 h GLN 507 N 0.98 0.77 -0.68 1.06 4.20 -1.55 -2.59 115.11 117.29 2ae5 h GLN 507 Ca 0.26 -0.40 -0.04 0.00 0.06 0.00 0.00 58.65 58.53 2ae5 h GLN 507 Cb -0.08 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2ae5 h GLN 507 CO -0.05 1.03 0.29 0.28 -0.67 0.00 0.00 178.83 179.70 2ae5 h VAL 508 N 0.54 1.24 -0.04 -0.54 2.07 -0.35 -2.52 116.25 116.65 2ae5 h VAL 508 Ca 0.05 -0.73 -0.05 0.00 0.82 0.00 0.00 66.70 66.79 2ae5 h VAL 508 Cb 0.88 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 2ae5 h VAL 508 CO 0.08 0.29 -0.20 -0.33 0.02 0.00 0.00 177.57 177.43 2ae5 h GLU 509 N 0.97 0.06 0.00 1.57 5.08 -0.90 -1.56 114.58 119.79 2ae5 h GLU 509 Ca 0.23 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.42 2ae5 h GLU 509 Cb 0.19 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2ae5 h GLU 509 CO -0.02 0.26 -0.76 0.00 -1.00 0.00 0.00 179.01 177.49 2ae5 h ALA 510 N 1.74 0.64 -0.01 3.43 0.00 -1.20 -3.31 119.26 120.56 2ae5 h ALA 510 Ca 0.01 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2ae5 h ALA 510 Cb 0.39 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2ae5 h ALA 510 CO 0.03 0.95 -0.38 0.00 0.00 0.00 0.00 179.25 179.85 2ae5 n ALA 511 N -2.35 3.35 -1.93 0.00 0.00 -0.85 -4.97 120.51 113.76 2ae5 n ALA 511 Ca -0.00 -0.50 -0.42 0.00 0.00 0.00 0.00 53.44 52.52 2ae5 n ALA 511 Cb 0.77 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 19.21 2ae5 n ALA 511 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ae5 s VAL 512 N -2.53 2.65 -0.13 0.00 0.11 -0.65 -4.89 120.40 114.97 2ae5 s VAL 512 Ca 0.21 0.48 0.02 0.00 -2.93 0.00 0.00 61.98 59.76 2ae5 s VAL 512 Cb 0.19 -3.31 -0.02 0.00 -1.53 0.00 0.00 36.38 31.71 2ae5 s VAL 512 CO 0.56 0.05 0.16 0.00 -3.33 0.00 0.00 175.10 172.54 2ae5 n GLN 513 N 3.60 5.30 -3.66 1.54 1.13 -1.26 -5.04 117.38 118.99 2ae5 n GLN 513 Ca 0.12 -0.09 -0.13 0.00 -1.94 0.00 0.00 57.00 54.96 2ae5 n GLN 513 Cb 0.39 -0.67 -0.08 0.00 0.11 0.00 0.00 30.24 29.99 2ae5 n GLN 513 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 2ae5 s GLU 514 N -1.07 0.71 -0.13 -1.09 2.12 -1.26 -5.15 118.70 112.84 2ae5 s GLU 514 Ca 0.01 0.90 0.00 0.00 0.36 0.00 0.00 54.97 56.24 2ae5 s GLU 514 Cb 0.02 0.32 0.02 0.00 0.26 0.00 0.00 34.13 34.75 2ae5 s GLU 514 CO 0.08 -0.10 -0.12 0.50 -0.54 0.00 0.00 175.26 175.08 2ae5 s ARG 515 N 0.50 2.02 -0.43 4.30 3.52 -1.26 -5.10 118.95 122.50 2ae5 s ARG 515 Ca -0.01 -0.46 -0.01 0.00 -0.13 0.00 0.00 55.73 55.12 2ae5 s ARG 515 Cb -0.05 -1.87 0.12 0.00 -1.56 0.00 0.00 34.95 31.59 2ae5 s ARG 515 CO -0.02 -0.20 0.20 0.99 -0.81 0.00 0.00 175.30 175.47 2ae5 s THR 516 N 1.40 3.03 0.48 4.11 2.01 -1.26 -5.09 115.64 120.32 2ae5 s THR 516 Ca 0.02 -2.36 -0.23 0.00 0.31 0.00 0.00 61.69 59.42 2ae5 s THR 516 Cb -0.13 -3.10 -0.07 0.00 0.01 0.00 0.00 72.50 69.21 2ae5 s THR 516 CO -0.07 -0.70 1.23 -2.16 -0.69 0.00 0.00 174.62 172.22 2ae5 s PRO 517 N 0.79 3.61 0.17 4.92 0.04 -1.26 -5.03 135.00 138.24 2ae5 s PRO 517 Ca 0.11 1.93 -0.04 0.00 0.04 0.00 0.00 61.00 63.04 2ae5 s PRO 517 Cb -0.22 -2.39 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 2ae5 s PRO 517 CO -0.05 -0.72 0.17 -0.59 0.04 0.00 0.00 177.00 175.85 2ae5 s PHE 518 N -1.46 0.82 -0.15 0.56 -0.12 -1.26 -5.17 117.98 111.21 2ae5 s PHE 518 Ca 0.65 -1.14 -0.12 0.00 -0.05 0.00 0.00 56.93 56.28 2ae5 s PHE 518 Cb -0.32 -0.35 0.04 0.00 -0.63 0.00 0.00 43.02 41.76 2ae5 s PHE 518 CO 0.39 -0.65 0.39 0.54 -0.05 0.00 0.00 175.22 175.84 2ae5 s ASN 519 N -3.07 -0.43 -0.15 1.98 4.22 -1.26 -5.15 114.94 111.09 2ae5 s ASN 519 Ca 0.28 0.80 -0.03 0.00 -2.14 0.00 0.00 52.86 51.76 2ae5 s ASN 519 Cb 0.06 0.76 -0.03 0.00 1.28 0.00 0.00 41.25 43.32 2ae5 s ASN 519 CO 0.06 -0.15 -0.04 0.12 -2.04 0.00 0.00 177.10 175.05 2ae5 s PHE 520 N 0.59 3.02 -0.26 1.54 5.99 -1.26 -5.08 117.98 122.52 2ae5 s PHE 520 Ca -0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 56.93 56.62 2ae5 s PHE 520 Cb -0.05 -1.93 0.09 0.00 0.00 0.00 0.00 43.02 41.13 2ae5 s PHE 520 CO -0.04 0.02 0.09 0.21 -0.00 0.00 0.00 175.22 175.50 2ae5 s LYS 521 N 0.22 0.48 0.00 10.12 2.47 -1.26 -5.39 119.74 126.38 2ae5 s LYS 521 Ca -0.02 -0.66 0.00 0.00 -1.56 0.00 0.00 55.97 53.72 2ae5 s LYS 521 Cb -0.14 -1.73 0.00 0.00 -1.46 0.00 0.00 37.83 34.50 2ae5 s LYS 521 CO 0.03 -0.89 0.25 -2.30 0.16 0.00 0.00 175.35 172.60