#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x0h s GLN 6 N 0.00 1.49 0.69 3.23 -1.52 -1.26 -2.68 119.66 119.61 2x0h s GLN 6 Ca 0.00 -0.28 -0.16 0.00 -1.95 0.00 0.00 55.36 52.96 2x0h s GLN 6 Cb 0.00 -1.43 0.02 0.00 -0.22 0.00 0.00 33.01 31.38 2x0h s GLN 6 CO 0.00 -0.15 1.23 -2.14 -0.25 0.00 0.00 175.29 173.98 2x0h s PRO 7 N 1.27 2.35 0.25 2.91 0.02 -1.26 -4.84 135.00 135.69 2x0h s PRO 7 Ca -0.04 1.85 -0.30 0.00 0.02 0.00 0.00 61.00 62.53 2x0h s PRO 7 Cb -0.14 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.44 2x0h s PRO 7 CO -0.03 -1.70 1.32 -1.25 -0.33 0.00 0.00 177.00 175.01 2x0h s PRO 8 N -3.70 4.37 0.69 5.54 0.04 -1.09 -4.99 135.00 135.86 2x0h s PRO 8 Ca 0.77 2.12 -0.13 0.00 0.04 0.00 0.00 61.00 63.81 2x0h s PRO 8 Cb -0.31 -3.15 0.01 0.00 0.04 0.00 0.00 34.50 31.09 2x0h s PRO 8 CO 0.42 -0.24 1.08 -1.25 0.04 0.00 0.00 177.00 177.05 2x0h s PRO 9 N -0.67 2.79 0.23 0.56 0.04 -1.26 -4.68 135.00 132.01 2x0h s PRO 9 Ca 0.54 1.16 -0.06 0.00 0.04 0.00 0.00 61.00 62.68 2x0h s PRO 9 Cb -0.38 -1.96 0.30 0.00 0.04 0.00 0.00 34.50 32.49 2x0h s PRO 9 CO 0.43 -1.23 1.86 1.96 0.04 0.00 0.00 177.00 180.06 2x0h h GLN 10 N -0.44 0.94 -3.97 4.56 1.08 -1.83 -3.43 115.11 112.03 2x0h h GLN 10 Ca -0.45 -0.06 -0.28 0.00 -1.45 0.00 0.00 58.65 56.41 2x0h h GLN 10 Cb 1.23 -0.21 -0.29 0.00 -0.05 0.00 0.00 27.48 28.15 2x0h h GLN 10 CO 0.55 0.63 -0.74 -1.14 -0.95 0.00 0.00 178.83 177.18 2x0h s GLN 11 N -6.08 0.20 -0.18 1.46 0.74 -0.71 -5.04 119.66 110.06 2x0h s GLN 11 Ca -0.13 -0.07 -0.09 0.00 0.05 0.00 0.00 55.36 55.13 2x0h s GLN 11 Cb 0.18 -0.22 0.07 0.00 1.10 0.00 0.00 33.01 34.14 2x0h s GLN 11 CO 0.79 0.03 0.41 -1.17 -0.55 0.00 0.00 175.29 174.80 2x0h s LEU 12 N 0.05 -0.27 -0.21 3.68 2.96 -1.26 -2.11 118.68 121.52 2x0h s LEU 12 Ca -0.00 0.92 0.01 0.00 -0.22 0.00 0.00 54.13 54.84 2x0h s LEU 12 Cb -0.02 1.34 0.03 0.00 0.50 0.00 0.00 46.19 48.04 2x0h s LEU 12 CO -0.00 -0.21 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.03 2x0h s ILE 13 N 1.78 2.15 -0.16 6.68 1.01 0.00 -5.00 121.20 127.67 2x0h s ILE 13 Ca -0.07 -1.17 -0.05 0.00 0.00 0.00 0.00 60.65 59.36 2x0h s ILE 13 Cb -0.09 -2.04 -0.03 0.00 0.01 0.00 0.00 42.46 40.31 2x0h s ILE 13 CO -0.13 0.33 0.01 -0.69 0.00 0.00 0.00 174.94 174.47 2x0h s VAL 14 N 1.23 4.35 -0.19 2.92 1.01 -1.26 -0.79 120.40 127.67 2x0h s VAL 14 Ca 0.00 -0.20 0.21 0.00 0.00 0.00 0.00 61.98 62.00 2x0h s VAL 14 Cb -0.15 -2.93 -0.07 0.00 0.00 0.00 0.00 36.38 33.22 2x0h s VAL 14 CO -0.10 0.49 0.91 0.00 0.00 0.00 0.00 175.10 176.40 2x0h n GLN 15 N 3.42 0.62 -1.42 2.72 1.13 0.45 -4.99 117.38 119.30 2x0h n GLN 15 Ca -0.17 0.09 -0.01 0.00 -1.94 0.00 0.00 57.00 54.97 2x0h n GLN 15 Cb 0.52 -1.78 -0.00 0.00 0.11 0.00 0.00 30.24 29.09 2x0h n GLN 15 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2x0h n ASN 16 N -2.66 -2.32 -4.34 1.08 3.02 -1.26 -5.04 115.26 103.74 2x0h n ASN 16 Ca -0.03 0.01 -0.21 0.00 -0.03 0.00 0.00 54.58 54.33 2x0h n ASN 16 Cb 0.61 -0.66 -0.11 0.00 -0.61 0.00 0.00 39.78 39.01 2x0h n ASN 16 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2x0h s LYS 17 N -2.87 1.32 0.17 3.52 1.02 -1.26 -5.04 119.74 116.61 2x0h s LYS 17 Ca 0.00 -1.49 0.09 0.00 0.02 0.00 0.00 55.97 54.59 2x0h s LYS 17 Cb 0.00 -1.28 -0.04 0.00 -0.52 0.00 0.00 37.83 35.99 2x0h s LYS 17 CO 0.00 0.24 -0.20 0.99 -0.92 0.00 0.00 175.35 175.46 2x0h s THR 18 N -2.40 1.99 -0.03 2.17 2.01 -1.26 -1.23 115.64 116.90 2x0h s THR 18 Ca 0.19 -1.96 -0.01 0.00 0.31 0.00 0.00 61.69 60.23 2x0h s THR 18 Cb -0.04 -1.93 0.03 0.00 0.01 0.00 0.00 72.50 70.57 2x0h s THR 18 CO 0.07 -0.25 0.05 -0.63 -0.69 0.00 0.00 174.62 173.16 2x0h s ILE 19 N -1.93 -0.07 0.12 1.82 1.01 -0.20 -4.93 121.20 117.01 2x0h s ILE 19 Ca 0.17 0.25 -0.31 0.00 0.00 0.00 0.00 60.65 60.76 2x0h s ILE 19 Cb -0.06 -0.11 -0.08 0.00 0.01 0.00 0.00 42.46 42.22 2x0h s ILE 19 CO 0.08 0.10 1.39 -1.81 0.00 0.00 0.00 174.94 174.70 2x0h s ASP 20 N 1.27 6.82 -0.29 3.58 -0.00 -1.26 0.14 116.67 126.93 2x0h s ASP 20 Ca -0.07 2.33 -0.40 0.00 -0.00 0.00 0.00 52.55 54.41 2x0h s ASP 20 Cb -0.13 -2.59 -0.16 0.00 -0.00 0.00 0.00 42.92 40.05 2x0h s ASP 20 CO -0.03 -0.66 1.78 -0.11 -0.00 0.00 0.00 175.17 176.15 2x0h n LEU 21 N 3.96 2.34 -4.65 1.23 7.94 0.66 -4.77 117.00 123.70 2x0h n LEU 21 Ca 0.12 1.04 -0.42 0.00 -1.11 0.00 0.00 56.01 55.63 2x0h n LEU 21 Cb 0.42 -1.14 -0.03 0.00 0.53 0.00 0.00 43.42 43.21 2x0h n LEU 21 CO 0.59 -0.45 1.58 -2.16 -1.11 0.00 0.00 177.39 175.84 2x0h s PRO 22 N 3.75 4.06 0.56 1.96 0.04 -1.26 -4.85 135.00 139.26 2x0h s PRO 22 Ca 1.00 2.48 0.28 0.00 0.04 0.00 0.00 61.00 64.79 2x0h s PRO 22 Cb -1.08 -4.15 1.65 0.00 0.04 0.00 0.00 34.50 30.97 2x0h s PRO 22 CO 0.65 -1.03 2.19 0.00 0.04 0.00 0.00 177.00 178.85 2x0h h ALA 23 N 10.77 1.49 -3.28 8.56 0.00 -1.99 -3.39 119.26 131.41 2x0h h ALA 23 Ca -0.47 -0.04 -0.52 0.00 0.00 0.00 0.00 54.91 53.88 2x0h h ALA 23 Cb 1.23 -0.01 -0.35 0.00 0.00 0.00 0.00 17.79 18.66 2x0h h ALA 23 CO 0.95 0.05 -0.81 0.08 0.00 0.00 0.00 179.25 179.52 2x0h s VAL 24 N -4.53 1.09 0.05 0.00 1.01 -1.26 -5.13 120.40 111.63 2x0h s VAL 24 Ca -0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 2x0h s VAL 24 Cb 0.15 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 2x0h s VAL 24 CO 0.57 0.37 -0.03 -0.72 0.00 0.00 0.00 175.10 175.29 2x0h s TYR 25 N 1.24 0.47 -0.27 5.22 1.13 -1.26 -1.79 117.35 122.09 2x0h s TYR 25 Ca -0.04 -0.97 0.03 0.00 -1.41 0.00 0.00 57.07 54.69 2x0h s TYR 25 Cb -0.14 -0.35 0.07 0.00 -1.10 0.00 0.00 41.96 40.44 2x0h s TYR 25 CO -0.03 -0.35 -0.08 -1.14 -2.51 0.00 0.00 175.55 171.44 2x0h s GLN 26 N -3.49 2.05 -0.15 -3.49 0.74 0.80 -4.75 119.66 111.37 2x0h s GLN 26 Ca 0.03 -1.37 -0.25 0.00 0.05 0.00 0.00 55.36 53.82 2x0h s GLN 26 Cb 0.05 -2.88 -0.02 0.00 1.10 0.00 0.00 33.01 31.25 2x0h s GLN 26 CO -0.08 -0.62 0.81 -1.17 -0.55 0.00 0.00 175.29 173.67 2x0h s LEU 27 N 1.12 4.20 -0.24 3.68 2.96 -1.26 -1.19 118.68 127.95 2x0h s LEU 27 Ca -0.06 1.17 -0.01 0.00 -0.22 0.00 0.00 54.13 55.02 2x0h s LEU 27 Cb -0.20 -3.21 0.03 0.00 0.50 0.00 0.00 46.19 43.32 2x0h s LEU 27 CO -0.06 -0.35 -0.08 0.21 -1.32 0.00 0.00 176.35 174.75 2x0h s ASN 28 N 1.11 4.18 0.00 3.68 2.47 0.10 -4.68 114.94 121.79 2x0h s ASN 28 Ca 0.38 -0.91 0.00 0.00 0.42 0.00 0.00 52.86 52.76 2x0h s ASN 28 Cb -0.17 -1.63 0.00 0.00 -1.45 0.00 0.00 41.25 38.01 2x0h s ASN 28 CO 0.14 -0.12 0.00 0.61 -3.72 0.00 0.00 177.10 174.01 2x0h n GLY 29 N 4.63 0.69 0.29 1.21 0.00 -1.26 -1.80 105.19 108.96 2x0h n GLY 29 Ca -0.17 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.04 2x0h n GLY 29 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2x0h h GLY 30 N 0.00 0.00 0.81 -0.02 0.00 -1.83 -0.18 103.07 101.85 2x0h h GLY 30 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2x0h h GLY 30 CO 0.00 0.00 -0.52 1.18 0.00 0.00 0.00 176.54 177.20 2x0h n GLU 31 N -2.84 0.09 -0.00 4.80 1.02 -1.26 -4.24 120.64 118.21 2x0h n GLU 31 Ca -0.02 -0.06 0.01 0.00 -0.02 0.00 0.00 57.16 57.07 2x0h n GLU 31 Cb 0.09 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.00 2x0h n GLU 31 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2x0h n GLU 32 N -1.40 0.64 -1.52 3.49 -0.58 -0.74 -5.06 120.64 115.48 2x0h n GLU 32 Ca 0.06 -0.01 -0.30 0.00 -0.42 0.00 0.00 57.16 56.49 2x0h n GLU 32 Cb 0.34 -1.00 0.09 0.00 -0.57 0.00 0.00 31.44 30.30 2x0h n GLU 32 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2x0h s ALA 33 N -2.03 2.23 -0.36 0.62 0.00 -0.16 -4.86 121.76 117.20 2x0h s ALA 33 Ca -0.01 -0.16 -0.37 0.00 0.00 0.00 0.00 51.96 51.43 2x0h s ALA 33 Cb 0.01 -3.12 -0.13 0.00 0.00 0.00 0.00 23.12 19.88 2x0h s ALA 33 CO 0.07 -1.74 2.13 -1.71 0.00 0.00 0.00 175.76 174.52 2x0h n ASN 34 N -3.45 1.99 -0.22 0.00 2.85 -1.26 -4.80 115.26 110.36 2x0h n ASN 34 Ca 0.07 0.52 0.30 0.00 -0.11 0.00 0.00 54.58 55.37 2x0h n ASN 34 Cb 0.56 -1.20 0.73 0.00 1.24 0.00 0.00 39.78 41.11 2x0h n ASN 34 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2x0h h PRO 35 N 11.35 0.01 -0.03 1.20 0.11 -1.92 0.18 132.00 142.90 2x0h h PRO 35 Ca -0.27 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.73 2x0h h PRO 35 Cb 1.33 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.43 2x0h h PRO 35 CO 1.02 0.00 -0.50 0.45 -0.21 0.00 0.00 178.00 178.77 2x0h h HIS 36 N 0.01 0.09 0.19 0.65 3.86 -1.91 -1.37 115.15 116.67 2x0h h HIS 36 Ca 0.47 -0.03 -0.31 0.00 -1.16 0.00 0.00 60.37 59.34 2x0h h HIS 36 Cb 1.87 -0.02 0.02 0.00 1.06 0.00 0.00 27.41 30.34 2x0h h HIS 36 CO -0.00 0.56 -1.38 0.00 0.86 0.00 0.00 177.93 177.96 2x0h h ALA 37 N 1.44 -0.02 -0.54 2.45 0.00 -1.03 -3.21 119.26 118.35 2x0h h ALA 37 Ca -0.00 -0.89 -0.01 0.00 0.00 0.00 0.00 54.91 54.01 2x0h h ALA 37 Cb 0.90 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 2x0h h ALA 37 CO 0.07 0.85 0.30 0.28 0.00 0.00 0.00 179.25 180.75 2x0h h VAL 38 N 0.11 1.18 -0.43 0.00 2.07 -1.11 -1.12 116.25 116.95 2x0h h VAL 38 Ca -0.20 -0.46 0.06 0.00 0.82 0.00 0.00 66.70 66.92 2x0h h VAL 38 Cb 2.07 0.50 -0.05 0.00 -1.52 0.00 0.00 31.29 32.29 2x0h h VAL 38 CO 0.24 0.19 0.13 0.50 0.02 0.00 0.00 177.57 178.65 2x0h h LYS 39 N 0.73 0.28 -0.11 1.57 3.64 -1.37 0.56 116.57 121.86 2x0h h LYS 39 Ca 0.19 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 2x0h h LYS 39 Cb 0.04 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2x0h h LYS 39 CO -0.03 0.18 0.04 0.28 -2.27 0.00 0.00 179.45 177.65 2x0h h VAL 40 N 0.29 0.97 -0.38 2.00 2.07 -1.47 -2.57 116.25 117.16 2x0h h VAL 40 Ca 0.21 -0.03 0.07 0.00 0.82 0.00 0.00 66.70 67.77 2x0h h VAL 40 Cb 0.22 0.87 -0.07 0.00 -1.52 0.00 0.00 31.29 30.80 2x0h h VAL 40 CO -0.23 0.02 -0.07 0.25 0.02 0.00 0.00 177.57 177.55 2x0h h LEU 41 N 0.09 -0.31 -1.49 2.57 5.85 -0.73 -2.35 115.31 118.94 2x0h h LEU 41 Ca 0.05 0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 2x0h h LEU 41 Cb 0.03 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2x0h h LEU 41 CO -0.05 -0.11 -0.24 0.11 -0.34 0.00 0.00 178.44 177.81 2x0h h LYS 42 N 0.02 0.00 -0.30 1.25 1.57 -0.74 -2.00 116.57 116.37 2x0h h LYS 42 Ca 0.18 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.80 2x0h h LYS 42 Cb 0.28 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 2x0h h LYS 42 CO -0.37 0.24 -0.44 1.49 -0.57 0.00 0.00 179.45 179.80 2x0h h GLU 43 N 0.00 0.83 0.00 3.15 4.22 -1.16 -2.91 114.58 118.71 2x0h h GLU 43 Ca -0.00 -0.49 0.00 0.00 0.08 0.00 0.00 59.36 58.95 2x0h h GLU 43 Cb 0.55 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2x0h h GLU 43 CO 0.03 1.13 0.00 1.28 -2.18 0.00 0.00 179.01 179.27 2x0h n LEU 44 N -4.10 0.27 0.00 1.64 4.77 -0.78 -5.13 117.00 113.67 2x0h n LEU 44 Ca -0.04 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 2x0h n LEU 44 Cb 0.57 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2x0h n LEU 44 CO 0.48 -0.44 0.00 0.18 -1.33 0.00 0.00 177.39 176.28 2x0h n LEU 45 N -1.81 0.00 0.00 2.23 4.77 -1.04 -5.11 117.00 116.04 2x0h n LEU 45 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2x0h n LEU 45 Cb 0.16 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2x0h n LEU 45 CO 0.14 -0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.63 2x0h n GLY 54 N 5.00 2.06 3.74 -0.72 0.00 -1.26 -4.97 105.19 109.03 2x0h n GLY 54 Ca 0.00 -2.15 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 2x0h n GLY 54 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2x0h s MET 55 N -1.84 4.18 -0.10 1.61 -2.45 -0.74 -4.22 119.30 115.75 2x0h s MET 55 Ca 0.00 2.47 -0.30 0.00 -1.25 0.00 0.00 55.69 56.61 2x0h s MET 55 Cb 0.00 -3.08 -0.02 0.00 1.25 0.00 0.00 34.83 32.97 2x0h s MET 55 CO 0.00 -0.60 1.20 -1.17 1.05 0.00 0.00 175.02 175.51 2x0h s LEU 56 N 0.19 4.24 -0.16 4.11 2.96 -1.26 -0.14 118.68 128.61 2x0h s LEU 56 Ca 0.66 1.75 0.01 0.00 -0.22 0.00 0.00 54.13 56.33 2x0h s LEU 56 Cb -0.46 -3.55 0.01 0.00 0.50 0.00 0.00 46.19 42.69 2x0h s LEU 56 CO 0.40 -0.64 -0.19 -0.63 -1.32 0.00 0.00 176.35 173.97 2x0h s ILE 57 N 2.64 2.19 -0.21 6.68 1.01 -0.33 -0.55 121.20 132.63 2x0h s ILE 57 Ca 0.55 -0.91 -0.03 0.00 0.00 0.00 0.00 60.65 60.25 2x0h s ILE 57 Cb -0.23 -1.91 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 2x0h s ILE 57 CO 0.19 0.53 -0.06 -0.44 0.00 0.00 0.00 174.94 175.16 2x0h s SER 58 N 1.08 4.23 0.00 3.58 0.01 0.48 -0.72 113.70 122.35 2x0h s SER 58 Ca -0.00 -0.39 0.06 0.00 1.31 0.00 0.00 55.95 56.93 2x0h s SER 58 Cb -0.14 -1.71 -0.02 0.00 0.21 0.00 0.00 66.02 64.36 2x0h s SER 58 CO -0.07 0.01 -0.20 -0.51 0.41 0.00 0.00 173.24 172.88 2x0h s ILE 59 N 1.30 1.57 0.00 1.44 2.07 -0.75 -0.31 121.20 126.53 2x0h s ILE 59 Ca 0.04 -0.95 0.00 0.00 -1.41 0.00 0.00 60.65 58.32 2x0h s ILE 59 Cb -0.14 -1.33 0.00 0.00 0.13 0.00 0.00 42.46 41.12 2x0h s ILE 59 CO -0.03 0.35 0.00 0.61 -1.91 0.00 0.00 174.94 173.97 2x0h n GLY 60 N 2.35 0.60 3.70 1.50 0.00 -0.85 -4.36 105.19 108.14 2x0h n GLY 60 Ca -0.16 -1.06 -0.34 0.00 0.00 0.00 0.00 46.02 44.46 2x0h n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x0h s GLU 61 N -2.00 2.96 -0.24 1.61 8.01 -1.26 -0.23 118.70 127.55 2x0h s GLU 61 Ca 0.00 -0.45 -0.43 0.00 0.01 0.00 0.00 54.97 54.10 2x0h s GLU 61 Cb 0.00 -2.79 -0.20 0.00 -4.31 0.00 0.00 34.13 26.83 2x0h s GLU 61 CO 0.00 0.68 1.33 1.17 0.01 0.00 0.00 175.26 178.45 2x0h n LYS 62 N 1.85 0.02 0.00 1.61 4.81 0.22 0.02 118.16 126.70 2x0h n LYS 62 Ca -0.17 0.01 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 2x0h n LYS 62 Cb 0.53 -1.51 0.00 0.00 0.02 0.00 0.00 35.03 34.07 2x0h n LYS 62 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2x0h n GLY 63 N 2.72 2.02 3.77 3.14 0.00 -1.26 -4.95 105.19 110.62 2x0h n GLY 63 Ca 0.25 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 2x0h n GLY 63 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2x0h s ASP 64 N 0.19 6.47 0.21 1.61 1.01 0.10 -4.94 116.67 121.32 2x0h s ASP 64 Ca 0.00 2.74 -0.12 0.00 0.71 0.00 0.00 52.55 55.87 2x0h s ASP 64 Cb 0.00 -2.65 0.26 0.00 1.01 0.00 0.00 42.92 41.54 2x0h s ASP 64 CO 0.00 -0.75 1.65 0.50 0.21 0.00 0.00 175.17 176.78 2x0h h LYS 65 N 2.97 0.06 -0.90 8.23 3.64 -1.98 -2.72 116.57 125.87 2x0h h LYS 65 Ca -0.50 -0.00 0.21 0.00 -1.27 0.00 0.00 60.65 59.09 2x0h h LYS 65 Cb 1.24 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.98 2x0h h LYS 65 CO 0.64 0.04 0.60 0.66 -2.27 0.00 0.00 179.45 179.12 2x0h h SER 66 N 0.06 0.36 -0.05 4.20 4.64 -1.89 -2.95 113.55 117.93 2x0h h SER 66 Ca 0.30 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 2x0h h SER 66 Cb 0.49 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 2x0h h SER 66 CO -0.56 0.14 0.00 1.33 -0.87 0.00 0.00 176.83 176.87 2x0h n VAL 67 N -4.49 0.66 0.09 0.95 0.24 -1.05 -4.67 118.33 110.06 2x0h n VAL 67 Ca 0.19 -0.83 0.18 0.00 -2.04 0.00 0.00 64.34 61.85 2x0h n VAL 67 Cb 0.73 0.69 0.73 0.00 -1.47 0.00 0.00 33.84 34.51 2x0h n VAL 67 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 2x0h h ARG 68 N 0.42 0.00 0.00 7.34 0.11 -1.31 0.59 114.38 121.54 2x0h h ARG 68 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2x0h h ARG 68 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 2x0h h ARG 68 CO 0.00 0.00 0.00 1.17 0.10 0.00 0.00 179.97 181.24 2x0h n LYS 69 N -4.14 0.16 -0.00 0.08 4.81 -1.26 -2.77 118.16 115.05 2x0h n LYS 69 Ca 0.06 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 2x0h n LYS 69 Cb 0.49 -1.89 0.00 0.00 0.02 0.00 0.00 35.03 33.65 2x0h n LYS 69 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2x0h n TYR 70 N -2.21 0.00 -0.34 5.64 4.01 0.21 -4.81 117.16 119.65 2x0h n TYR 70 Ca 0.01 -0.44 0.19 0.00 -0.16 0.00 0.00 57.90 57.49 2x0h n TYR 70 Cb 0.15 -0.04 0.41 0.00 -0.31 0.00 0.00 39.34 39.55 2x0h n TYR 70 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2x0h h SER 71 N 0.00 0.62 0.66 7.72 4.64 -1.38 0.54 113.55 126.36 2x0h h SER 71 Ca 0.00 0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 61.43 2x0h h SER 71 Cb 0.44 0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2x0h h SER 71 CO 0.00 0.09 -0.08 0.03 -0.87 0.00 0.00 176.83 176.00 2x0h h ARG 72 N 0.54 0.00 0.00 4.77 3.08 -1.87 -3.01 114.38 117.88 2x0h h ARG 72 Ca 0.64 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.69 2x0h h ARG 72 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.35 2x0h h ARG 72 CO -0.44 0.08 -0.17 1.96 -1.07 0.00 0.00 179.97 180.33 2x0h h GLN 73 N 0.00 0.00 -6.01 0.04 1.08 -0.28 -3.46 115.11 106.48 2x0h h GLN 73 Ca -0.00 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.62 2x0h h GLN 73 Cb 0.44 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.80 2x0h h GLN 73 CO 0.01 0.00 0.72 0.42 -0.95 0.00 0.00 178.83 179.03 2x0h s ILE 74 N -3.21 4.72 0.27 2.54 1.01 -1.14 -4.66 121.20 120.72 2x0h s ILE 74 Ca 0.07 1.92 -0.31 0.00 0.00 0.00 0.00 60.65 62.33 2x0h s ILE 74 Cb 0.07 -4.27 -0.12 0.00 0.01 0.00 0.00 42.46 38.16 2x0h s ILE 74 CO 0.68 -0.15 1.59 -2.65 0.00 0.00 0.00 174.94 174.41 2x0h n PRO 75 N 6.23 2.61 -1.89 2.79 -0.02 -1.26 -4.87 135.00 138.58 2x0h n PRO 75 Ca 0.10 0.93 -0.40 0.00 -2.02 0.00 0.00 63.50 62.11 2x0h n PRO 75 Cb 0.46 -2.71 -0.01 0.00 -0.02 0.00 0.00 33.50 31.23 2x0h n PRO 75 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2x0h n ASP 76 N 2.52 7.37 -4.01 2.55 2.03 -1.26 -4.69 116.55 121.06 2x0h n ASP 76 Ca 0.11 -2.99 -0.15 0.00 0.52 0.00 0.00 54.79 52.27 2x0h n ASP 76 Cb 0.35 -1.45 -0.13 0.00 -0.72 0.00 0.00 41.12 39.18 2x0h n ASP 76 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2x0h s HIS 77 N 0.13 0.59 0.12 -0.67 3.76 -1.26 -5.09 115.29 112.87 2x0h s HIS 77 Ca 0.54 -0.25 -0.36 0.00 -0.15 0.00 0.00 55.06 54.84 2x0h s HIS 77 Cb 0.16 -0.36 -0.16 0.00 1.11 0.00 0.00 32.58 33.33 2x0h s HIS 77 CO -0.07 -0.03 1.43 1.63 -0.85 0.00 0.00 174.74 176.85 2x0h n LYS 78 N 2.35 1.54 -1.04 1.40 5.02 -1.26 -1.16 118.16 125.00 2x0h n LYS 78 Ca -0.17 0.55 -0.01 0.00 -2.02 0.00 0.00 58.31 56.66 2x0h n LYS 78 Cb 0.57 -2.24 -0.01 0.00 -0.02 0.00 0.00 35.03 33.33 2x0h n LYS 78 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2x0h n GLU 79 N 2.84 -0.80 -1.63 1.97 1.02 -1.26 -4.47 120.64 118.31 2x0h n GLU 79 Ca 0.18 0.31 -0.30 0.00 -0.02 0.00 0.00 57.16 57.33 2x0h n GLU 79 Cb 0.23 -3.98 0.08 0.00 -0.02 0.00 0.00 31.44 27.75 2x0h n GLU 79 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2x0h s GLY 80 N -2.15 1.62 0.13 0.62 0.00 -0.31 -4.19 107.32 103.04 2x0h s GLY 80 Ca 0.00 -0.26 -0.22 0.00 0.00 0.00 0.00 44.72 44.23 2x0h s GLY 80 CO 0.00 0.16 0.57 -2.52 0.00 0.00 0.00 173.10 171.31 2x0h s TYR 81 N -3.22 -0.49 -0.13 1.90 -0.85 0.00 -0.83 117.35 113.73 2x0h s TYR 81 Ca 0.60 0.33 -0.01 0.00 -0.52 0.00 0.00 57.07 57.48 2x0h s TYR 81 Cb -0.14 0.49 -0.02 0.00 0.38 0.00 0.00 41.96 42.68 2x0h s TYR 81 CO 0.53 -0.80 -0.12 -0.47 -1.52 0.00 0.00 175.55 173.18 2x0h s TYR 82 N -3.49 2.84 -0.06 -3.49 5.04 -0.16 -1.32 117.35 116.72 2x0h s TYR 82 Ca 0.00 -0.59 0.04 0.00 -2.44 0.00 0.00 57.07 54.08 2x0h s TYR 82 Cb -0.00 -1.86 -0.00 0.00 0.35 0.00 0.00 41.96 40.45 2x0h s TYR 82 CO -0.10 -0.18 -0.19 -1.17 -1.34 0.00 0.00 175.55 172.56 2x0h s LEU 83 N 0.33 1.94 -0.02 6.97 0.20 -0.20 -1.11 118.68 126.79 2x0h s LEU 83 Ca -0.10 -0.41 -0.01 0.00 0.69 0.00 0.00 54.13 54.30 2x0h s LEU 83 Cb -0.16 -1.11 0.02 0.00 -0.43 0.00 0.00 46.19 44.51 2x0h s LEU 83 CO 0.05 0.15 0.05 -0.55 -0.29 0.00 0.00 176.35 175.77 2x0h s SER 84 N 0.15 -0.01 -0.09 3.68 0.15 -0.19 -0.02 113.70 117.38 2x0h s SER 84 Ca -0.08 0.10 -0.01 0.00 0.70 0.00 0.00 55.95 56.66 2x0h s SER 84 Cb -0.14 0.03 0.03 0.00 -1.71 0.00 0.00 66.02 64.23 2x0h s SER 84 CO 0.04 -0.08 -0.04 -0.69 1.20 0.00 0.00 173.24 173.67 2x0h s VAL 85 N 0.64 0.68 0.27 4.45 1.01 -0.27 -0.78 120.40 126.38 2x0h s VAL 85 Ca -0.05 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 61.85 2x0h s VAL 85 Cb -0.07 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.52 2x0h s VAL 85 CO -0.02 0.30 0.25 0.54 0.00 0.00 0.00 175.10 176.17 2x0h s ASN 86 N 1.72 0.74 0.46 3.32 2.20 -1.12 -2.19 114.94 120.08 2x0h s ASN 86 Ca 0.03 -1.49 0.22 0.00 -0.94 0.00 0.00 52.86 50.69 2x0h s ASN 86 Cb -0.13 0.49 1.23 0.00 -2.00 0.00 0.00 41.25 40.85 2x0h s ASN 86 CO -0.06 -1.00 1.88 -0.08 -2.94 0.00 0.00 177.10 174.91 2x0h h GLU 87 N 2.36 0.24 0.02 3.55 4.81 -1.99 -3.03 114.58 120.54 2x0h h GLU 87 Ca -0.30 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 58.79 2x0h h GLU 87 Cb 1.24 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 2x0h h GLU 87 CO 0.44 0.16 -0.65 -0.22 -0.73 0.00 0.00 179.01 178.01 2x0h h LYS 88 N 0.25 0.04 -2.55 1.92 3.64 -1.98 -3.49 116.57 114.40 2x0h h LYS 88 Ca 0.43 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.69 2x0h h LYS 88 Cb 1.30 0.03 -0.16 0.00 -0.41 0.00 0.00 32.23 32.99 2x0h h LYS 88 CO -0.11 1.03 0.14 -2.00 -2.27 0.00 0.00 179.45 176.25 2x0h s GLU 89 N -2.31 1.11 -0.16 1.90 2.12 -1.15 -4.10 118.70 116.12 2x0h s GLU 89 Ca -0.22 -0.11 -0.05 0.00 0.36 0.00 0.00 54.97 54.94 2x0h s GLU 89 Cb 0.01 0.51 -0.03 0.00 0.26 0.00 0.00 34.13 34.88 2x0h s GLU 89 CO 0.67 -0.41 0.01 0.42 -0.54 0.00 0.00 175.26 175.41 2x0h s ILE 90 N -2.33 4.32 -0.10 -3.70 1.01 0.29 -2.80 121.20 117.89 2x0h s ILE 90 Ca -0.06 -0.21 0.04 0.00 0.00 0.00 0.00 60.65 60.42 2x0h s ILE 90 Cb -0.01 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.57 2x0h s ILE 90 CO -0.00 0.50 -0.22 -0.69 0.00 0.00 0.00 174.94 174.52 2x0h s VAL 91 N 0.17 1.93 -0.41 2.92 1.01 0.04 -0.39 120.40 125.67 2x0h s VAL 91 Ca 0.01 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.07 2x0h s VAL 91 Cb -0.13 -1.68 0.14 0.00 0.00 0.00 0.00 36.38 34.70 2x0h s VAL 91 CO 0.02 0.53 0.23 -0.76 0.00 0.00 0.00 175.10 175.12 2x0h s LEU 92 N 0.44 2.20 -0.27 3.92 1.43 0.58 -1.02 118.68 125.96 2x0h s LEU 92 Ca -0.17 -2.51 0.02 0.00 -1.03 0.00 0.00 54.13 50.45 2x0h s LEU 92 Cb -0.17 -0.85 0.07 0.00 0.03 0.00 0.00 46.19 45.26 2x0h s LEU 92 CO 0.07 -0.28 -0.05 0.00 0.23 0.00 0.00 176.35 176.32 2x0h s ALA 93 N 0.55 2.36 0.40 4.21 0.00 -0.26 -2.00 121.76 127.01 2x0h s ALA 93 Ca 0.18 -1.75 -0.19 0.00 0.00 0.00 0.00 51.96 50.19 2x0h s ALA 93 Cb -0.24 -1.60 -0.10 0.00 0.00 0.00 0.00 23.12 21.18 2x0h s ALA 93 CO 0.00 -1.31 0.88 0.20 0.00 0.00 0.00 175.76 175.54 2x0h s GLY 94 N 1.20 2.36 0.41 0.00 0.00 0.68 -0.99 107.32 110.97 2x0h s GLY 94 Ca -0.03 0.28 0.27 0.00 0.00 0.00 0.00 44.72 45.24 2x0h s GLY 94 CO -0.07 0.54 1.77 -0.57 0.00 0.00 0.00 173.10 174.77 2x0h h ASN 95 N 1.98 0.00 -5.00 1.64 -1.24 -1.27 0.66 115.58 112.35 2x0h h ASN 95 Ca -0.49 0.00 0.01 0.00 0.71 0.00 0.00 56.30 56.53 2x0h h ASN 95 Cb 1.18 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.22 2x0h h ASN 95 CO 0.62 0.00 0.26 1.51 -1.29 0.00 0.00 177.43 178.53 2x0h s ASP 96 N -5.47 -0.07 0.23 1.15 1.47 -1.26 -4.44 116.67 108.28 2x0h s ASP 96 Ca 0.05 -1.00 -0.05 0.00 1.18 0.00 0.00 52.55 52.74 2x0h s ASP 96 Cb 0.08 0.82 0.22 0.00 -0.34 0.00 0.00 42.92 43.70 2x0h s ASP 96 CO 0.58 -1.59 1.75 -0.33 0.68 0.00 0.00 175.17 176.26 2x0h h GLU 97 N 2.00 1.01 -0.83 2.11 5.08 -1.96 -1.24 114.58 120.76 2x0h h GLU 97 Ca -0.28 -0.24 -0.02 0.00 -1.00 0.00 0.00 59.36 57.81 2x0h h GLU 97 Cb 1.25 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 2x0h h GLU 97 CO 0.36 0.91 0.42 -0.09 -1.00 0.00 0.00 179.01 179.61 2x0h h ARG 98 N 0.96 1.17 -0.90 2.33 2.43 -1.95 -2.44 114.38 115.98 2x0h h ARG 98 Ca 0.20 -0.16 0.11 0.00 -0.81 0.00 0.00 59.98 59.33 2x0h h ARG 98 Cb 0.37 -0.22 -0.08 0.00 -0.42 0.00 0.00 29.97 29.62 2x0h h ARG 98 CO 0.00 0.88 0.53 0.78 -1.51 0.00 0.00 179.97 180.66 2x0h h GLY 99 N 1.16 1.44 1.02 2.80 0.00 -1.41 0.62 103.07 108.71 2x0h h GLY 99 Ca 0.29 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 2x0h h GLY 99 CO -0.04 0.12 0.27 -0.84 0.00 0.00 0.00 176.54 176.05 2x0h h THR 100 N 0.85 1.24 -0.49 4.70 2.02 -0.98 0.12 112.91 120.39 2x0h h THR 100 Ca 0.45 -0.77 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 2x0h h THR 100 Cb 0.45 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2x0h h THR 100 CO -0.27 0.31 0.13 0.22 0.37 0.00 0.00 175.52 176.28 2x0h h TYR 101 N 0.98 0.80 -0.54 3.16 3.20 -0.90 -1.49 116.97 122.18 2x0h h TYR 101 Ca 0.23 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.95 2x0h h TYR 101 Cb 0.21 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 2x0h h TYR 101 CO 0.02 0.71 0.11 1.88 -1.64 0.00 0.00 178.16 179.23 2x0h h TYR 102 N 0.66 0.88 -0.80 -3.82 0.05 -0.36 -0.46 116.97 113.12 2x0h h TYR 102 Ca 0.15 -0.09 0.07 0.00 0.05 0.00 0.00 58.73 58.92 2x0h h TYR 102 Cb 0.30 -0.25 -0.05 0.00 1.01 0.00 0.00 36.73 37.74 2x0h h TYR 102 CO 0.02 0.75 0.52 0.00 -1.05 0.00 0.00 178.16 178.40 2x0h h ALA 103 N 1.31 1.66 -0.11 3.88 0.00 -0.37 -2.17 119.26 123.46 2x0h h ALA 103 Ca 0.17 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 2x0h h ALA 103 Cb 0.33 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2x0h h ALA 103 CO 0.00 0.20 -0.54 -0.07 0.00 0.00 0.00 179.25 178.84 2x0h h LEU 104 N 0.83 0.37 -0.79 0.00 -0.00 -0.08 -0.76 115.31 114.87 2x0h h LEU 104 Ca 0.35 -0.20 -0.11 0.00 -0.00 0.00 0.00 57.88 57.92 2x0h h LEU 104 Cb 0.29 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 40.83 2x0h h LEU 104 CO -0.13 0.84 -0.26 1.56 -0.00 0.00 0.00 178.44 180.46 2x0h h GLN 105 N 0.26 0.62 0.14 1.13 1.08 -0.70 -0.94 115.11 116.71 2x0h h GLN 105 Ca 0.00 -0.25 -0.01 0.00 -1.45 0.00 0.00 58.65 56.95 2x0h h GLN 105 Cb 1.04 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.44 2x0h h GLN 105 CO 0.09 0.82 -0.07 1.15 -0.95 0.00 0.00 178.83 179.87 2x0h h THR 106 N 0.54 1.02 -0.88 -0.54 2.02 -1.28 -3.22 112.91 110.56 2x0h h THR 106 Ca 0.07 -0.99 0.22 0.00 0.77 0.00 0.00 66.41 66.49 2x0h h THR 106 Cb 0.73 1.60 -0.16 0.00 -1.74 0.00 0.00 68.15 68.58 2x0h h THR 106 CO 0.06 0.22 0.05 0.15 0.37 0.00 0.00 175.52 176.36 2x0h h PHE 107 N -0.68 0.01 0.00 3.16 3.57 -0.95 -0.52 116.94 121.52 2x0h h PHE 107 Ca -0.02 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 2x0h h PHE 107 Cb 0.51 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 2x0h h PHE 107 CO 0.07 -0.32 -0.08 0.00 -2.23 0.00 0.00 178.31 175.75 2x0h h ALA 108 N 1.84 1.26 0.00 2.41 0.00 -1.18 -1.88 119.26 121.72 2x0h h ALA 108 Ca 0.51 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.35 2x0h h ALA 108 Cb 1.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2x0h h ALA 108 CO -0.78 0.10 -0.60 1.96 0.00 0.00 0.00 179.25 179.94 2x0h h GLN 109 N 0.00 0.00 0.04 0.00 4.20 -1.15 -3.26 115.11 114.93 2x0h h GLN 109 Ca -0.00 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.49 2x0h h GLN 109 Cb 0.27 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 2x0h h GLN 109 CO 0.01 0.00 -1.00 -0.07 -0.67 0.00 0.00 178.83 177.10 2x0h h LEU 110 N 0.00 0.30 -8.69 1.46 3.38 -1.07 -3.44 115.31 107.25 2x0h h LEU 110 Ca 0.00 -0.28 -0.55 0.00 0.09 0.00 0.00 57.88 57.15 2x0h h LEU 110 Cb 0.93 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 2x0h h LEU 110 CO 0.00 1.13 1.19 -0.22 0.09 0.00 0.00 178.44 180.63 2x0h s LEU 111 N -7.29 3.45 -0.04 1.67 2.96 -1.01 -4.47 118.68 113.94 2x0h s LEU 111 Ca -0.03 0.70 -0.01 0.00 -0.22 0.00 0.00 54.13 54.57 2x0h s LEU 111 Cb 0.09 -3.19 0.03 0.00 0.50 0.00 0.00 46.19 43.62 2x0h s LEU 111 CO 0.85 -1.78 0.04 -0.54 -1.32 0.00 0.00 176.35 173.59 2x0h s LYS 112 N 5.73 0.14 -1.43 1.98 -0.14 -0.45 -4.83 119.74 120.74 2x0h s LYS 112 Ca 0.65 0.26 0.00 0.00 -1.36 0.00 0.00 55.97 55.52 2x0h s LYS 112 Cb -0.15 -0.60 0.00 0.00 -1.68 0.00 0.00 37.83 35.40 2x0h s LYS 112 CO 0.28 -0.29 0.00 -0.25 -0.76 0.00 0.00 175.35 174.34 2x0h n ASP 113 N 5.03 -4.64 0.00 2.83 9.92 -1.26 -1.14 116.55 127.28 2x0h n ASP 113 Ca -0.09 0.33 0.00 0.00 -0.53 0.00 0.00 54.79 54.50 2x0h n ASP 113 Cb 0.50 -3.33 0.00 0.00 -0.64 0.00 0.00 41.12 37.65 2x0h n ASP 113 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2x0h n GLY 114 N -1.30 0.77 3.57 0.44 0.00 -1.26 -5.05 105.19 102.36 2x0h n GLY 114 Ca -0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 2x0h n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x0h s LYS 115 N -0.26 2.09 0.04 1.61 1.02 -0.29 -0.25 119.74 123.70 2x0h s LYS 115 Ca 0.00 -1.13 0.07 0.00 0.02 0.00 0.00 55.97 54.93 2x0h s LYS 115 Cb 0.00 -2.24 -0.02 0.00 -0.52 0.00 0.00 37.83 35.05 2x0h s LYS 115 CO 0.00 0.48 -0.20 -0.51 -0.92 0.00 0.00 175.35 174.20 2x0h s LEU 116 N -2.47 2.16 0.42 3.17 1.43 0.12 -1.33 118.68 122.17 2x0h s LEU 116 Ca 0.23 -0.50 -0.19 0.00 -1.03 0.00 0.00 54.13 52.64 2x0h s LEU 116 Cb -0.10 -0.92 -0.10 0.00 0.03 0.00 0.00 46.19 45.10 2x0h s LEU 116 CO 0.14 0.15 0.91 -2.16 0.23 0.00 0.00 176.35 175.62 2x0h s PRO 117 N -1.11 4.14 -0.41 1.29 0.04 -1.26 -1.03 135.00 136.65 2x0h s PRO 117 Ca 0.07 0.99 -0.29 0.00 0.04 0.00 0.00 61.00 61.81 2x0h s PRO 117 Cb -0.09 -2.23 0.01 0.00 0.04 0.00 0.00 34.50 32.24 2x0h s PRO 117 CO 0.01 -0.03 1.38 -2.00 0.04 0.00 0.00 177.00 176.41 2x0h s GLU 118 N -3.28 3.62 0.00 4.56 2.12 -0.36 -4.78 118.70 120.59 2x0h s GLU 118 Ca 0.60 0.93 -0.09 0.00 0.36 0.00 0.00 54.97 56.77 2x0h s GLU 118 Cb -0.09 -4.00 0.01 0.00 0.26 0.00 0.00 34.13 30.30 2x0h s GLU 118 CO 0.17 -1.51 0.17 0.14 -0.54 0.00 0.00 175.26 173.69 2x0h s VAL 119 N 5.24 0.08 -0.11 3.70 -7.23 -0.93 -0.41 120.40 120.74 2x0h s VAL 119 Ca 0.59 -0.68 0.03 0.00 -1.81 0.00 0.00 61.98 60.11 2x0h s VAL 119 Cb -0.13 -0.52 0.01 0.00 0.56 0.00 0.00 36.38 36.30 2x0h s VAL 119 CO 0.32 -0.37 -0.19 -0.70 -0.31 0.00 0.00 175.10 173.84 2x0h s GLU 120 N -1.50 2.59 -0.04 4.82 2.12 0.03 -1.12 118.70 125.60 2x0h s GLU 120 Ca -0.14 -0.71 0.04 0.00 0.36 0.00 0.00 54.97 54.52 2x0h s GLU 120 Cb -0.07 -2.07 -0.00 0.00 0.26 0.00 0.00 34.13 32.25 2x0h s GLU 120 CO 0.02 0.04 -0.15 0.42 -0.54 0.00 0.00 175.26 175.04 2x0h s ILE 121 N 0.69 1.28 -0.16 -3.70 1.01 0.97 -0.82 121.20 120.47 2x0h s ILE 121 Ca -0.12 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 59.91 2x0h s ILE 121 Cb -0.16 -1.10 0.02 0.00 0.01 0.00 0.00 42.46 41.22 2x0h s ILE 121 CO 0.03 0.37 -0.16 -0.54 0.00 0.00 0.00 174.94 174.64 2x0h s LYS 122 N 0.08 2.54 0.05 2.79 1.02 -0.90 -1.04 119.74 124.28 2x0h s LYS 122 Ca -0.04 -0.66 -0.05 0.00 0.02 0.00 0.00 55.97 55.25 2x0h s LYS 122 Cb -0.11 -2.26 -0.01 0.00 -0.52 0.00 0.00 37.83 34.93 2x0h s LYS 122 CO 0.02 -0.21 0.09 0.34 -0.92 0.00 0.00 175.35 174.66 2x0h s ASP 123 N 1.37 0.22 -0.27 2.83 2.15 -0.43 -1.75 116.67 120.80 2x0h s ASP 123 Ca 0.04 -0.62 -0.36 0.00 0.43 0.00 0.00 52.55 52.03 2x0h s ASP 123 Cb -0.13 0.24 0.16 0.00 -0.30 0.00 0.00 42.92 42.89 2x0h s ASP 123 CO -0.11 -0.55 1.34 -0.72 -0.17 0.00 0.00 175.17 174.96 2x0h s TYR 124 N -2.98 -0.04 0.24 -5.34 -0.85 -1.26 -0.82 117.35 106.29 2x0h s TYR 124 Ca -0.02 0.04 -0.12 0.00 -0.52 0.00 0.00 57.07 56.44 2x0h s TYR 124 Cb 0.01 0.50 -0.08 0.00 0.38 0.00 0.00 41.96 42.78 2x0h s TYR 124 CO -0.06 -0.06 0.61 -1.25 -1.52 0.00 0.00 175.55 173.26 2x0h s PRO 125 N -1.95 3.91 0.32 -3.49 0.04 -1.26 -4.65 135.00 127.91 2x0h s PRO 125 Ca 0.11 0.45 0.20 0.00 0.04 0.00 0.00 61.00 61.79 2x0h s PRO 125 Cb -0.01 -2.66 0.16 0.00 0.04 0.00 0.00 34.50 32.03 2x0h s PRO 125 CO -0.04 0.31 1.39 0.77 0.04 0.00 0.00 177.00 179.48 2x0h h SER 126 N 2.70 0.00 -3.80 6.66 0.02 -1.23 -3.44 113.55 114.45 2x0h h SER 126 Ca -0.47 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 59.79 2x0h h SER 126 Cb 1.18 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 63.43 2x0h h SER 126 CO 0.67 0.21 -0.84 -0.69 -1.14 0.00 0.00 176.83 175.04 2x0h s VAL 127 N -3.13 2.46 0.09 2.27 1.01 -1.10 -4.65 120.40 117.35 2x0h s VAL 127 Ca 0.04 -0.91 -0.14 0.00 0.00 0.00 0.00 61.98 60.96 2x0h s VAL 127 Cb 0.07 -1.95 -0.11 0.00 0.00 0.00 0.00 36.38 34.39 2x0h s VAL 127 CO 0.73 0.56 1.37 -0.09 0.00 0.00 0.00 175.10 177.67 2x0h h ARG 128 N 6.13 0.72 -5.84 2.72 9.65 -1.82 -3.43 114.38 122.50 2x0h h ARG 128 Ca -0.32 -0.45 -0.69 0.00 -1.10 0.00 0.00 59.98 57.43 2x0h h ARG 128 Cb 1.19 0.05 -0.32 0.00 -1.39 0.00 0.00 29.97 29.50 2x0h h ARG 128 CO 0.49 1.07 -0.88 0.71 2.80 0.00 0.00 179.97 184.16 2x0h s TYR 129 N -4.13 2.47 -0.13 2.20 2.02 -1.20 -4.97 117.35 113.62 2x0h s TYR 129 Ca -0.12 -0.81 -0.05 0.00 -0.37 0.00 0.00 57.07 55.72 2x0h s TYR 129 Cb 0.08 -1.63 0.06 0.00 -0.40 0.00 0.00 41.96 40.08 2x0h s TYR 129 CO 0.85 -0.27 0.27 1.03 -1.57 0.00 0.00 175.55 175.86 2x0h s ARG 130 N -0.03 0.18 0.00 -0.62 0.52 -1.26 -1.24 118.95 116.50 2x0h s ARG 130 Ca -0.08 0.69 0.00 0.00 -0.52 0.00 0.00 55.73 55.82 2x0h s ARG 130 Cb -0.15 -0.05 0.00 0.00 0.52 0.00 0.00 34.95 35.27 2x0h s ARG 130 CO 0.05 -0.24 0.00 0.41 0.02 0.00 0.00 175.30 175.54 2x0h n GLY 131 N 4.93 -0.75 3.08 -3.53 0.00 -0.96 -0.84 105.19 107.13 2x0h n GLY 131 Ca -0.13 -0.25 -0.22 0.00 0.00 0.00 0.00 46.02 45.42 2x0h n GLY 131 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x0h s VAL 132 N -4.00 1.04 -0.24 1.61 1.01 -0.74 -0.51 120.40 118.56 2x0h s VAL 132 Ca 0.00 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 2x0h s VAL 132 Cb 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 36.38 35.49 2x0h s VAL 132 CO 0.00 0.30 0.02 0.54 0.00 0.00 0.00 175.10 175.96 2x0h s VAL 133 N -0.14 3.86 -1.02 2.92 0.11 -1.19 -1.07 120.40 123.88 2x0h s VAL 133 Ca 0.02 -0.38 -0.23 0.00 -2.93 0.00 0.00 61.98 58.46 2x0h s VAL 133 Cb -0.07 -2.81 0.03 0.00 -1.53 0.00 0.00 36.38 32.00 2x0h s VAL 133 CO 0.00 0.34 1.59 -0.70 -3.33 0.00 0.00 175.10 173.00 2x0h s GLU 134 N 1.54 3.36 -0.07 1.54 2.12 -0.08 -4.20 118.70 122.92 2x0h s GLU 134 Ca 0.06 -1.00 0.19 0.00 0.36 0.00 0.00 54.97 54.58 2x0h s GLU 134 Cb -0.15 -5.30 0.38 0.00 0.26 0.00 0.00 34.13 29.32 2x0h s GLU 134 CO 0.01 -2.51 1.17 0.41 -0.54 0.00 0.00 175.26 173.80 2x0h n GLY 135 N 6.76 2.40 3.95 -1.50 0.00 -1.26 -0.54 105.19 115.01 2x0h n GLY 135 Ca 0.36 -0.93 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 2x0h n GLY 135 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2x0h s PHE 136 N -1.12 3.19 0.27 1.61 -0.12 -1.26 -4.46 117.98 116.09 2x0h s PHE 136 Ca 0.32 0.21 -0.18 0.00 -0.05 0.00 0.00 56.93 57.24 2x0h s PHE 136 Cb 0.34 -2.35 -0.09 0.00 -0.63 0.00 0.00 43.02 40.30 2x0h s PHE 136 CO -0.12 -0.40 0.73 0.71 -0.05 0.00 0.00 175.22 176.10 2x0h s TYR 137 N -2.57 3.52 -0.10 3.49 2.02 -1.26 -1.78 117.35 120.67 2x0h s TYR 137 Ca 0.49 1.31 0.00 0.00 -0.37 0.00 0.00 57.07 58.50 2x0h s TYR 137 Cb -0.10 -2.58 0.00 0.00 -0.40 0.00 0.00 41.96 38.88 2x0h s TYR 137 CO 0.38 0.22 0.00 0.41 -1.57 0.00 0.00 175.55 174.99 2x0h n GLY 138 N 0.21 0.44 3.65 0.71 0.00 -1.26 -4.71 105.19 104.23 2x0h n GLY 138 Ca 0.00 -2.31 -0.42 0.00 0.00 0.00 0.00 46.02 43.29 2x0h n GLY 138 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x0h s THR 139 N -0.35 3.07 0.77 2.61 2.01 -1.26 -4.50 115.64 117.98 2x0h s THR 139 Ca 0.00 0.08 -0.12 0.00 0.31 0.00 0.00 61.69 61.95 2x0h s THR 139 Cb 0.00 -3.06 0.06 0.00 0.01 0.00 0.00 72.50 69.51 2x0h s THR 139 CO 0.00 -0.02 1.13 -2.84 -0.69 0.00 0.00 174.62 172.21 2x0h s PRO 140 N 4.88 2.07 0.33 4.92 0.02 -1.26 -4.83 135.00 141.14 2x0h s PRO 140 Ca 0.90 1.44 -0.29 0.00 0.02 0.00 0.00 61.00 63.08 2x0h s PRO 140 Cb -0.39 -1.86 -0.12 0.00 0.02 0.00 0.00 34.50 32.15 2x0h s PRO 140 CO 0.39 -1.82 1.33 0.91 -0.33 0.00 0.00 177.00 177.48 2x0h n TRP 141 N -3.25 2.33 -0.80 6.54 8.01 -1.26 -4.96 117.44 124.06 2x0h n TRP 141 Ca 0.11 0.52 -0.31 0.00 -1.31 0.00 0.00 57.50 56.50 2x0h n TRP 141 Cb 0.52 -2.44 0.15 0.00 -2.01 0.00 0.00 31.31 27.54 2x0h n TRP 141 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.69 175.14 2x0h s SER 142 N -0.17 3.17 0.15 -0.99 1.04 -1.26 -4.82 113.70 110.82 2x0h s SER 142 Ca 0.58 2.15 -0.22 0.00 0.48 0.00 0.00 55.95 58.94 2x0h s SER 142 Cb -0.57 -2.56 0.04 0.00 0.10 0.00 0.00 66.02 63.03 2x0h s SER 142 CO 0.60 -2.94 1.63 -0.74 0.98 0.00 0.00 173.24 172.77 2x0h h HIS 143 N -1.72 -0.60 -0.74 5.02 2.76 -2.00 -1.80 115.15 116.07 2x0h h HIS 143 Ca -0.43 0.04 0.11 0.00 -2.20 0.00 0.00 60.37 57.89 2x0h h HIS 143 Cb 1.26 0.31 -0.08 0.00 1.55 0.00 0.00 27.41 30.45 2x0h h HIS 143 CO 0.51 -0.30 0.36 1.96 -1.30 0.00 0.00 177.93 179.15 2x0h h GLN 144 N -0.21 0.56 -0.42 5.26 1.08 -2.00 -1.47 115.11 117.91 2x0h h GLN 144 Ca 0.15 -0.03 -0.08 0.00 -1.45 0.00 0.00 58.65 57.23 2x0h h GLN 144 Cb 0.45 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.73 2x0h h GLN 144 CO -0.41 0.37 -0.08 0.00 -0.95 0.00 0.00 178.83 177.76 2x0h h ALA 145 N 1.47 1.06 -0.38 3.87 0.00 -1.85 -2.08 119.26 121.34 2x0h h ALA 145 Ca 0.38 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2x0h h ALA 145 Cb 0.45 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2x0h h ALA 145 CO -0.31 0.58 -0.09 0.00 0.00 0.00 0.00 179.25 179.43 2x0h h ARG 146 N 0.67 0.74 -0.13 0.00 3.08 -0.74 0.89 114.38 118.88 2x0h h ARG 146 Ca 0.12 -0.28 0.04 0.00 0.07 0.00 0.00 59.98 59.93 2x0h h ARG 146 Cb 0.54 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 2x0h h ARG 146 CO 0.03 0.88 -0.11 -0.07 -1.07 0.00 0.00 179.97 179.63 2x0h h LEU 147 N 0.55 -0.35 -1.34 3.04 3.38 -1.10 -1.57 115.31 117.91 2x0h h LEU 147 Ca 0.10 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 2x0h h LEU 147 Cb 0.61 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 2x0h h LEU 147 CO 0.04 -0.15 0.25 -1.28 0.09 0.00 0.00 178.44 177.39 2x0h h SER 148 N -0.12 0.62 -0.98 -0.43 0.87 -1.28 -1.92 113.55 110.32 2x0h h SER 148 Ca 0.09 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 2x0h h SER 148 Cb 0.25 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 62.01 2x0h h SER 148 CO -0.21 0.53 0.64 1.56 -0.53 0.00 0.00 176.83 178.81 2x0h h GLN 149 N 0.70 1.29 -0.18 2.24 1.08 -0.03 -2.72 115.11 117.49 2x0h h GLN 149 Ca 0.18 -0.09 -0.20 0.00 -1.45 0.00 0.00 58.65 57.10 2x0h h GLN 149 Cb 0.06 -0.29 0.01 0.00 -0.05 0.00 0.00 27.48 27.21 2x0h h GLN 149 CO -0.03 0.86 -0.65 -0.07 -0.95 0.00 0.00 178.83 177.99 2x0h h LEU 150 N 1.33 0.89 -0.83 1.46 3.38 -0.50 -0.21 115.31 120.82 2x0h h LEU 150 Ca 0.36 -0.60 0.06 0.00 0.09 0.00 0.00 57.88 57.79 2x0h h LEU 150 Cb -0.14 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.29 2x0h h LEU 150 CO -0.08 1.34 0.51 0.11 0.09 0.00 0.00 178.44 180.42 2x0h h LYS 151 N 0.48 0.90 -0.22 1.13 1.57 -1.51 -2.71 116.57 116.22 2x0h h LYS 151 Ca -0.03 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.59 2x0h h LYS 151 Cb 1.28 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 2x0h h LYS 151 CO 0.14 0.59 -0.33 0.35 -0.57 0.00 0.00 179.45 179.63 2x0h h PHE 152 N 0.93 0.52 -0.32 -1.35 3.57 -1.10 -2.05 116.94 117.14 2x0h h PHE 152 Ca 0.37 -0.13 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 2x0h h PHE 152 Cb 0.19 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 2x0h h PHE 152 CO -0.04 0.73 0.15 1.88 -2.23 0.00 0.00 178.31 178.80 2x0h h TYR 153 N 0.39 0.46 -0.89 0.41 0.05 -0.92 -2.57 116.97 113.91 2x0h h TYR 153 Ca 0.05 -0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 2x0h h TYR 153 Cb 0.77 -0.14 -0.04 0.00 1.01 0.00 0.00 36.73 38.32 2x0h h TYR 153 CO 0.02 0.42 0.46 0.78 -1.05 0.00 0.00 178.16 178.79 2x0h h GLY 154 N 0.38 1.34 1.97 3.88 0.00 -1.24 0.17 103.07 109.57 2x0h h GLY 154 Ca 0.11 -0.63 -0.04 0.00 0.00 0.00 0.00 47.33 46.77 2x0h h GLY 154 CO -0.01 0.60 -0.18 0.50 0.00 0.00 0.00 176.54 177.45 2x0h h LYS 155 N 1.25 0.04 -0.34 4.80 1.57 -1.29 -2.97 116.57 119.63 2x0h h LYS 155 Ca 0.31 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2x0h h LYS 155 Cb 0.06 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2x0h h LYS 155 CO -0.05 0.22 0.00 0.09 -0.57 0.00 0.00 179.45 179.14 2x0h n ASN 156 N -4.31 3.84 -2.39 0.86 4.13 -0.83 -4.89 115.26 111.68 2x0h n ASN 156 Ca -0.02 -2.69 -0.19 0.00 1.68 0.00 0.00 54.58 53.36 2x0h n ASN 156 Cb 0.25 -0.47 -0.01 0.00 -1.54 0.00 0.00 39.78 38.01 2x0h n ASN 156 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2x0h n LYS 157 N -0.01 -1.82 -2.96 3.52 5.02 -0.41 -4.68 118.16 116.83 2x0h n LYS 157 Ca 0.20 0.91 -0.41 0.00 -2.02 0.00 0.00 58.31 56.99 2x0h n LYS 157 Cb 0.79 -5.56 -0.04 0.00 -0.02 0.00 0.00 35.03 30.20 2x0h n LYS 157 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2x0h s MET 158 N -5.01 4.40 -0.00 1.97 -1.94 0.48 -4.91 119.30 114.28 2x0h s MET 158 Ca 0.00 0.98 0.10 0.00 -1.71 0.00 0.00 55.69 55.06 2x0h s MET 158 Cb 0.00 -3.50 0.29 0.00 2.01 0.00 0.00 34.83 33.64 2x0h s MET 158 CO 0.00 -0.09 1.24 0.27 -0.01 0.00 0.00 175.02 176.43 2x0h n ASN 159 N 4.31 2.88 -3.80 3.03 0.23 -0.02 -4.23 115.26 117.67 2x0h n ASN 159 Ca 0.01 -2.00 -0.21 0.00 -0.53 0.00 0.00 54.58 51.85 2x0h n ASN 159 Cb 0.50 -0.22 -0.17 0.00 -2.08 0.00 0.00 39.78 37.81 2x0h n ASN 159 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2x0h s THR 160 N -1.01 0.35 -0.24 5.53 2.01 -0.65 -0.21 115.64 121.42 2x0h s THR 160 Ca 0.22 0.08 -0.00 0.00 0.31 0.00 0.00 61.69 62.30 2x0h s THR 160 Cb 0.12 -0.47 0.07 0.00 0.01 0.00 0.00 72.50 72.22 2x0h s THR 160 CO 0.15 0.23 -0.01 -0.47 -0.69 0.00 0.00 174.62 173.83 2x0h s TYR 161 N 1.57 2.06 -0.44 4.92 5.04 -0.31 -1.79 117.35 128.41 2x0h s TYR 161 Ca -0.01 -1.61 -0.17 0.00 -2.44 0.00 0.00 57.07 52.83 2x0h s TYR 161 Cb -0.13 -1.54 0.03 0.00 0.35 0.00 0.00 41.96 40.67 2x0h s TYR 161 CO -0.03 -0.76 0.44 0.42 -1.34 0.00 0.00 175.55 174.27 2x0h s ILE 162 N 1.50 5.10 -0.32 3.14 1.01 -0.23 -0.21 121.20 131.20 2x0h s ILE 162 Ca -0.02 -0.50 -0.28 0.00 0.00 0.00 0.00 60.65 59.86 2x0h s ILE 162 Cb -0.18 -4.07 0.01 0.00 0.01 0.00 0.00 42.46 38.24 2x0h s ILE 162 CO -0.09 -0.47 1.03 -0.47 0.00 0.00 0.00 174.94 174.94 2x0h s TYR 163 N 2.07 3.16 -0.38 3.97 5.04 0.65 -0.90 117.35 130.96 2x0h s TYR 163 Ca 0.10 1.13 0.10 0.00 -2.44 0.00 0.00 57.07 55.97 2x0h s TYR 163 Cb -0.18 -3.61 0.39 0.00 0.35 0.00 0.00 41.96 38.91 2x0h s TYR 163 CO 0.12 -0.73 1.43 0.41 -1.34 0.00 0.00 175.55 175.44 2x0h n GLY 164 N 3.92 1.59 3.68 8.97 0.00 0.30 -1.52 105.19 122.13 2x0h n GLY 164 Ca 0.11 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 2x0h n GLY 164 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2x0h s PRO 165 N 0.17 4.17 0.44 1.61 0.02 -0.49 -4.10 135.00 136.83 2x0h s PRO 165 Ca 0.17 2.42 0.21 0.00 0.02 0.00 0.00 61.00 63.82 2x0h s PRO 165 Cb 0.42 -3.78 1.19 0.00 0.02 0.00 0.00 34.50 32.34 2x0h s PRO 165 CO -0.10 -0.82 1.85 0.87 -0.33 0.00 0.00 177.00 178.46 2x0h h LYS 166 N 9.05 0.30 -0.62 5.54 1.79 -1.57 -2.15 116.57 128.92 2x0h h LYS 166 Ca -0.44 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 2x0h h LYS 166 Cb 1.21 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.79 2x0h h LYS 166 CO 0.94 0.20 0.00 -0.25 -1.08 0.00 0.00 179.45 179.26 2x0h n ASP 167 N -4.47 3.63 -4.60 0.86 8.00 -1.26 -4.74 116.55 113.97 2x0h n ASP 167 Ca 0.20 -2.18 -0.43 0.00 0.71 0.00 0.00 54.79 53.10 2x0h n ASP 167 Cb 0.80 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.12 41.41 2x0h n ASP 167 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2x0h s ASP 168 N -0.92 6.54 0.26 -2.24 -1.08 -0.81 -4.91 116.67 113.51 2x0h s ASP 168 Ca 0.42 0.66 0.19 0.00 -0.52 0.00 0.00 52.55 53.30 2x0h s ASP 168 Cb 0.24 -2.55 0.97 0.00 -1.46 0.00 0.00 42.92 40.13 2x0h s ASP 168 CO 0.24 -1.29 1.59 -0.81 0.52 0.00 0.00 175.17 175.42 2x0h n PRO 169 N 7.86 0.13 0.00 4.34 -0.04 -1.26 -1.32 135.00 144.71 2x0h n PRO 169 Ca 0.14 0.55 0.12 0.00 -0.04 0.00 0.00 63.50 64.27 2x0h n PRO 169 Cb 0.48 -1.87 0.18 0.00 -0.04 0.00 0.00 33.50 32.26 2x0h n PRO 169 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2x0h n TYR 170 N -2.14 0.00 -0.02 0.54 4.01 -1.26 -2.35 117.16 115.94 2x0h n TYR 170 Ca -0.00 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.56 2x0h n TYR 170 Cb 0.09 -0.14 -0.14 0.00 -0.31 0.00 0.00 39.34 38.84 2x0h n TYR 170 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 2x0h n HIS 171 N -1.13 1.01 -3.63 -0.72 -0.00 -0.44 -4.16 115.22 106.17 2x0h n HIS 171 Ca 0.07 0.24 0.00 0.00 -0.00 0.00 0.00 57.72 58.03 2x0h n HIS 171 Cb 0.35 -1.14 0.00 0.00 -0.00 0.00 0.00 29.99 29.20 2x0h n HIS 171 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2x0h n SER 172 N -3.35 0.83 -4.49 0.26 2.88 -1.05 -0.78 113.62 107.92 2x0h n SER 172 Ca -0.31 -0.63 -0.50 0.00 -1.33 0.00 0.00 58.87 56.10 2x0h n SER 172 Cb 1.05 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.46 2x0h n SER 172 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2x0h n ALA 173 N -3.00 -2.21 0.89 -1.46 0.00 -1.25 -2.33 120.51 111.16 2x0h n ALA 173 Ca 0.00 0.48 0.10 0.00 0.00 0.00 0.00 53.44 54.02 2x0h n ALA 173 Cb 0.00 -1.80 0.03 0.00 0.00 0.00 0.00 19.45 17.68 2x0h n ALA 173 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2x0h n PRO 174 N 1.27 1.61 -0.94 0.00 -0.04 -1.26 -4.68 135.00 130.96 2x0h n PRO 174 Ca 0.17 -1.25 -0.05 0.00 -0.04 0.00 0.00 63.50 62.33 2x0h n PRO 174 Cb 0.22 -1.41 0.29 0.00 -0.04 0.00 0.00 33.50 32.56 2x0h n PRO 174 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2x0h n ASN 175 N 0.42 4.67 0.17 3.54 3.02 -0.99 -4.44 115.26 121.64 2x0h n ASN 175 Ca 0.10 -3.09 0.17 0.00 -0.03 0.00 0.00 54.58 51.73 2x0h n ASN 175 Cb 0.46 -0.73 0.79 0.00 -0.61 0.00 0.00 39.78 39.70 2x0h n ASN 175 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 2x0h h TRP 176 N 2.55 0.00 0.00 3.10 5.08 -1.38 -1.43 115.95 123.87 2x0h h TRP 176 Ca 0.23 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.20 2x0h h TRP 176 Cb 2.19 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 28.35 2x0h h TRP 176 CO 1.18 0.00 0.00 0.00 -1.28 0.00 0.00 178.44 178.34 2x0h h ARG 177 N 0.00 0.00 -5.84 0.12 3.08 -1.86 -3.46 114.38 106.42 2x0h h ARG 177 Ca 0.11 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.53 2x0h h ARG 177 Cb 0.59 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.58 2x0h h ARG 177 CO -0.00 0.00 -0.40 -0.51 -1.07 0.00 0.00 179.97 177.99 2x0h s LEU 178 N -5.05 4.39 0.70 3.04 1.43 -0.54 -4.84 118.68 117.81 2x0h s LEU 178 Ca 0.03 0.56 -0.16 0.00 -1.03 0.00 0.00 54.13 53.54 2x0h s LEU 178 Cb 0.09 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.82 2x0h s LEU 178 CO 0.45 0.30 1.20 -2.16 0.23 0.00 0.00 176.35 176.38 2x0h s PRO 179 N -1.52 2.37 0.49 1.29 0.04 -1.26 -4.95 135.00 131.45 2x0h s PRO 179 Ca 0.24 1.76 -0.23 0.00 0.04 0.00 0.00 61.00 62.80 2x0h s PRO 179 Cb -0.13 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.48 2x0h s PRO 179 CO 0.13 -1.66 1.34 0.71 0.04 0.00 0.00 177.00 177.56 2x0h s TYR 180 N -1.91 2.48 1.01 0.56 2.02 -1.26 -4.99 117.35 115.26 2x0h s TYR 180 Ca 0.75 1.37 -0.11 0.00 -0.37 0.00 0.00 57.07 58.71 2x0h s TYR 180 Cb -0.29 -3.76 0.20 0.00 -0.40 0.00 0.00 41.96 37.71 2x0h s TYR 180 CO 0.42 -2.62 1.07 -2.30 -1.57 0.00 0.00 175.55 170.55 2x0h n PRO 181 N -0.59 -1.19 -0.19 -1.71 -0.02 -1.26 -4.62 135.00 125.41 2x0h n PRO 181 Ca 0.08 -0.29 -0.01 0.00 -2.02 0.00 0.00 63.50 61.25 2x0h n PRO 181 Cb 0.44 -2.28 0.06 0.00 -0.02 0.00 0.00 33.50 31.71 2x0h n PRO 181 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2x0h h ASP 182 N -2.18 -0.45 -0.01 2.55 3.32 -1.99 -0.89 116.42 116.77 2x0h h ASP 182 Ca -0.50 0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.72 2x0h h ASP 182 Cb 1.29 0.33 -0.00 0.00 0.22 0.00 0.00 39.33 41.17 2x0h h ASP 182 CO 0.44 -0.17 0.00 0.50 -1.72 0.00 0.00 179.24 178.29 2x0h h LYS 183 N 0.03 0.02 -0.56 3.56 3.64 -1.99 0.13 116.57 121.40 2x0h h LYS 183 Ca 0.29 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.63 2x0h h LYS 183 Cb 0.45 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 2x0h h LYS 183 CO -0.57 0.20 0.22 0.93 -2.27 0.00 0.00 179.45 177.97 2x0h h GLU 184 N -0.16 0.81 -0.40 1.90 3.07 -1.87 -1.98 114.58 115.94 2x0h h GLU 184 Ca 0.00 -0.12 -0.11 0.00 -0.50 0.00 0.00 59.36 58.63 2x0h h GLU 184 Cb 0.19 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 2x0h h GLU 184 CO -0.00 0.67 -0.18 0.00 -1.40 0.00 0.00 179.01 178.10 2x0h h ALA 185 N 1.44 0.57 -0.62 3.43 0.00 -0.71 -1.16 119.26 122.21 2x0h h ALA 185 Ca 0.19 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2x0h h ALA 185 Cb 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2x0h h ALA 185 CO -0.02 0.51 0.40 0.00 0.00 0.00 0.00 179.25 180.14 2x0h h ALA 186 N 0.82 1.54 -0.21 0.00 0.00 -0.78 -1.33 119.26 119.29 2x0h h ALA 186 Ca 0.09 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2x0h h ALA 186 Cb 0.73 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2x0h h ALA 186 CO 0.06 0.42 -0.09 1.96 0.00 0.00 0.00 179.25 181.60 2x0h h GLN 187 N 0.84 0.44 -0.55 0.00 4.20 -0.91 -2.30 115.11 116.83 2x0h h GLN 187 Ca 0.23 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2x0h h GLN 187 Cb -0.08 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 2x0h h GLN 187 CO -0.05 0.71 0.27 -0.07 -0.67 0.00 0.00 178.83 179.02 2x0h h LEU 188 N 0.15 0.72 -0.66 1.46 3.38 -1.14 -0.09 115.31 119.12 2x0h h LEU 188 Ca 0.05 -0.13 0.09 0.00 0.09 0.00 0.00 57.88 57.98 2x0h h LEU 188 Cb 0.57 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.07 2x0h h LEU 188 CO 0.03 0.64 0.31 -0.61 0.09 0.00 0.00 178.44 178.90 2x0h h GLN 189 N 0.74 0.52 -0.62 1.13 4.15 -1.22 0.10 115.11 119.92 2x0h h GLN 189 Ca 0.19 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.52 2x0h h GLN 189 Cb 0.11 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 2x0h h GLN 189 CO -0.02 0.34 0.16 1.49 -1.93 0.00 0.00 178.83 178.87 2x0h h GLU 190 N 0.54 0.98 -0.90 1.69 4.81 -0.92 -1.71 114.58 119.06 2x0h h GLU 190 Ca 0.33 -0.23 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2x0h h GLU 190 Cb 0.35 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.56 2x0h h GLU 190 CO -0.27 0.89 0.60 -0.07 -0.73 0.00 0.00 179.01 179.43 2x0h h LEU 191 N 0.90 1.04 -0.22 1.64 3.38 0.20 0.48 115.31 122.72 2x0h h LEU 191 Ca 0.19 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.07 2x0h h LEU 191 Cb 0.34 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2x0h h LEU 191 CO 0.00 0.75 -0.12 0.58 0.09 0.00 0.00 178.44 179.75 2x0h h VAL 192 N 1.23 1.31 -0.23 1.22 2.07 -0.58 0.11 116.25 121.38 2x0h h VAL 192 Ca 0.33 -1.20 0.04 0.00 0.82 0.00 0.00 66.70 66.69 2x0h h VAL 192 Cb -0.14 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 2x0h h VAL 192 CO -0.07 0.37 0.01 0.00 0.02 0.00 0.00 177.57 177.89 2x0h h ALA 193 N 0.70 0.20 -0.71 1.67 0.00 -0.77 -1.32 119.26 119.04 2x0h h ALA 193 Ca 0.05 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2x0h h ALA 193 Cb 0.62 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2x0h h ALA 193 CO 0.03 -0.42 0.18 0.28 0.00 0.00 0.00 179.25 179.33 2x0h h VAL 194 N 0.08 1.26 -0.33 0.00 2.07 -0.72 -1.83 116.25 116.78 2x0h h VAL 194 Ca 0.11 -0.95 0.05 0.00 0.82 0.00 0.00 66.70 66.72 2x0h h VAL 194 Cb 0.13 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 2x0h h VAL 194 CO -0.17 0.37 0.07 0.00 0.02 0.00 0.00 177.57 177.85 2x0h h ALA 195 N 1.12 0.35 -0.62 1.67 0.00 -0.42 -2.66 119.26 118.70 2x0h h ALA 195 Ca 0.22 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.26 2x0h h ALA 195 Cb 0.36 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 2x0h h ALA 195 CO 0.00 -0.34 0.31 -0.91 0.00 0.00 0.00 179.25 178.31 2x0h h ASN 196 N 0.18 0.44 -0.14 0.00 2.35 -0.71 0.10 115.58 117.81 2x0h h ASN 196 Ca 0.16 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.99 2x0h h ASN 196 Cb 0.17 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 2x0h h ASN 196 CO -0.20 0.28 0.17 -0.33 -1.65 0.00 0.00 177.43 175.69 2x0h h GLU 197 N 0.58 0.00 -0.25 0.81 5.08 -1.03 -2.55 114.58 117.22 2x0h h GLU 197 Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2x0h h GLU 197 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2x0h h GLU 197 CO -0.20 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 177.90 2x0h n ASN 198 N -3.75 3.24 -3.21 1.42 3.02 -0.59 -4.91 115.26 110.48 2x0h n ASN 198 Ca 0.01 -2.56 -0.23 0.00 -0.03 0.00 0.00 54.58 51.77 2x0h n ASN 198 Cb 0.28 -0.37 0.05 0.00 -0.61 0.00 0.00 39.78 39.13 2x0h n ASN 198 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2x0h n GLU 199 N -0.21 -6.06 -4.39 3.52 -0.58 -0.80 -4.04 120.64 108.08 2x0h n GLU 199 Ca 0.15 0.87 -0.34 0.00 -0.42 0.00 0.00 57.16 57.43 2x0h n GLU 199 Cb 0.64 -5.79 -0.12 0.00 -0.57 0.00 0.00 31.44 25.61 2x0h n GLU 199 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2x0h s VAL 200 N -3.23 3.88 -0.32 2.62 1.01 0.25 -4.54 120.40 120.07 2x0h s VAL 200 Ca 0.41 -0.36 -0.29 0.00 0.00 0.00 0.00 61.98 61.74 2x0h s VAL 200 Cb -0.18 -2.70 -0.00 0.00 0.00 0.00 0.00 36.38 33.50 2x0h s VAL 200 CO 0.51 0.49 1.44 -1.81 0.00 0.00 0.00 175.10 175.73 2x0h s ASP 201 N 0.39 6.45 -0.38 3.32 1.01 0.71 -3.95 116.67 124.22 2x0h s ASP 201 Ca -0.04 1.19 -0.29 0.00 0.71 0.00 0.00 52.55 54.12 2x0h s ASP 201 Cb -0.14 -2.54 0.02 0.00 1.01 0.00 0.00 42.92 41.27 2x0h s ASP 201 CO 0.03 -1.27 1.16 0.12 0.21 0.00 0.00 175.17 175.42 2x0h s PHE 202 N 5.06 2.90 -0.36 4.23 5.36 -1.26 -1.16 117.98 132.75 2x0h s PHE 202 Ca 0.63 0.94 -0.08 0.00 -0.96 0.00 0.00 56.93 57.45 2x0h s PHE 202 Cb -0.18 -4.03 0.04 0.00 -0.34 0.00 0.00 43.02 38.51 2x0h s PHE 202 CO 0.28 -1.20 0.15 0.08 -1.46 0.00 0.00 175.22 173.08 2x0h s VAL 203 N 4.18 4.05 -0.16 3.12 1.01 0.70 -3.50 120.40 129.81 2x0h s VAL 203 Ca 0.49 -1.10 -0.25 0.00 0.00 0.00 0.00 61.98 61.13 2x0h s VAL 203 Cb -0.11 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2x0h s VAL 203 CO 0.24 -0.24 0.79 0.86 0.00 0.00 0.00 175.10 176.74 2x0h s TRP 204 N 1.44 3.44 0.19 5.22 -0.00 -0.73 -0.26 118.94 128.24 2x0h s TRP 204 Ca 0.00 1.22 0.05 0.00 -0.00 0.00 0.00 56.10 57.36 2x0h s TRP 204 Cb -0.20 -2.96 -0.04 0.00 -0.00 0.00 0.00 33.47 30.27 2x0h s TRP 204 CO 0.04 -0.19 0.22 0.00 -0.00 0.00 0.00 176.95 177.02 2x0h s ALA 205 N 1.94 3.74 0.08 5.86 0.00 -0.57 -1.50 121.76 131.30 2x0h s ALA 205 Ca 0.37 -1.20 0.05 0.00 0.00 0.00 0.00 51.96 51.17 2x0h s ALA 205 Cb -0.17 -1.52 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 2x0h s ALA 205 CO 0.13 0.43 -0.12 -1.50 0.00 0.00 0.00 175.76 174.70 2x0h s ILE 206 N -1.85 1.03 -0.41 0.00 2.07 -0.17 -4.81 121.20 117.06 2x0h s ILE 206 Ca 0.33 -1.40 0.06 0.00 -1.41 0.00 0.00 60.65 58.23 2x0h s ILE 206 Cb -0.10 -1.13 0.21 0.00 0.13 0.00 0.00 42.46 41.57 2x0h s ILE 206 CO 0.26 -0.34 0.43 1.57 -1.91 0.00 0.00 174.94 174.95 2x0h n HIS 207 N 1.06 -0.49 1.10 3.50 -0.00 0.04 0.10 115.22 120.52 2x0h n HIS 207 Ca -0.20 -3.46 0.12 0.00 -0.00 0.00 0.00 57.72 54.18 2x0h n HIS 207 Cb 0.55 -0.04 0.14 0.00 -0.00 0.00 0.00 29.99 30.65 2x0h n HIS 207 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2x0h n PRO 208 N 2.15 1.25 0.16 1.57 -0.04 -1.26 -3.82 135.00 135.02 2x0h n PRO 208 Ca 0.26 -0.95 0.02 0.00 -0.04 0.00 0.00 63.50 62.79 2x0h n PRO 208 Cb 0.50 -1.48 0.26 0.00 -0.04 0.00 0.00 33.50 32.74 2x0h n PRO 208 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2x0h h GLY 209 N 4.86 0.00 2.00 0.55 0.00 -1.92 -1.87 103.07 106.69 2x0h h GLY 209 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2x0h h GLY 209 CO 0.00 0.00 -0.07 -1.61 0.00 0.00 0.00 176.54 174.86 2x0h h GLN 210 N 0.00 0.00 0.00 4.80 5.75 -1.84 -3.25 115.11 120.56 2x0h h GLN 210 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2x0h h GLN 210 Cb 0.97 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.52 2x0h h GLN 210 CO 0.06 0.07 -0.13 -0.40 -2.65 0.00 0.00 178.83 175.79 2x0h n ASP 211 N -3.74 0.00 -4.77 -0.69 5.75 -1.18 -4.87 116.55 107.04 2x0h n ASP 211 Ca -0.02 -1.25 -0.40 0.00 -0.01 0.00 0.00 54.79 53.11 2x0h n ASP 211 Cb 0.17 -0.05 0.01 0.00 -1.03 0.00 0.00 41.12 40.21 2x0h n ASP 211 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 2x0h s ILE 212 N 0.00 2.28 -0.09 2.12 2.07 -0.71 -5.02 121.20 121.85 2x0h s ILE 212 Ca 0.00 0.25 -0.05 0.00 -1.41 0.00 0.00 60.65 59.45 2x0h s ILE 212 Cb 0.00 -3.15 -0.04 0.00 0.13 0.00 0.00 42.46 39.40 2x0h s ILE 212 CO 0.00 0.04 0.11 -0.54 -1.91 0.00 0.00 174.94 172.64 2x0h s LYS 213 N -2.31 3.29 -1.48 3.50 -0.14 -1.26 -4.61 119.74 116.73 2x0h s LYS 213 Ca 0.58 -0.25 -0.11 0.00 -1.36 0.00 0.00 55.97 54.83 2x0h s LYS 213 Cb -0.42 -3.05 0.02 0.00 -1.68 0.00 0.00 37.83 32.70 2x0h s LYS 213 CO 0.54 0.74 2.45 0.91 -0.76 0.00 0.00 175.35 179.23 2x0h n TRP 214 N 1.83 3.02 -4.40 3.18 7.02 -1.26 -4.58 117.44 122.25 2x0h n TRP 214 Ca -0.18 -2.98 -0.22 0.00 -1.02 0.00 0.00 57.50 53.10 2x0h n TRP 214 Cb 0.54 -2.41 -0.08 0.00 -2.42 0.00 0.00 31.31 26.94 2x0h n TRP 214 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2x0h s ASN 215 N 2.35 2.12 0.07 -0.99 2.20 -1.26 -5.08 114.94 114.36 2x0h s ASN 215 Ca 0.54 -1.66 -0.22 0.00 -0.94 0.00 0.00 52.86 50.58 2x0h s ASN 215 Cb 0.15 0.48 -0.13 0.00 -2.00 0.00 0.00 41.25 39.75 2x0h s ASN 215 CO -0.07 -0.95 1.59 0.50 -2.94 0.00 0.00 177.10 175.23 2x0h h LYS 216 N 2.01 0.14 -0.46 3.55 3.64 -1.98 -1.93 116.57 121.53 2x0h h LYS 216 Ca -0.32 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.12 2x0h h LYS 216 Cb 1.26 -0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.97 2x0h h LYS 216 CO 0.50 0.27 -0.10 1.49 -2.27 0.00 0.00 179.45 179.34 2x0h h GLU 217 N -0.03 0.01 -0.04 1.90 4.81 -1.98 0.31 114.58 119.57 2x0h h GLU 217 Ca 0.03 -0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.02 2x0h h GLU 217 Cb 0.19 -0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.57 2x0h h GLU 217 CO -0.00 0.01 -0.93 -0.44 -0.73 0.00 0.00 179.01 176.92 2x0h h ASP 218 N 0.01 0.76 0.00 1.04 3.32 -1.81 -1.27 116.42 118.48 2x0h h ASP 218 Ca 0.22 -0.57 0.03 0.00 0.02 0.00 0.00 57.03 56.73 2x0h h ASP 218 Cb 0.34 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.61 2x0h h ASP 218 CO -0.47 1.37 -0.34 -0.09 -1.72 0.00 0.00 179.24 177.99 2x0h h ARG 219 N 0.37 -0.48 -0.87 3.56 2.43 -1.00 -0.93 114.38 117.45 2x0h h ARG 219 Ca -0.09 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2x0h h ARG 219 Cb 1.56 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 31.18 2x0h h ARG 219 CO 0.18 -0.32 0.55 -0.44 -1.51 0.00 0.00 179.97 178.42 2x0h h ASP 220 N -0.50 1.03 -0.35 -3.80 3.32 -0.38 -1.96 116.42 113.78 2x0h h ASP 220 Ca 0.06 -0.05 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 2x0h h ASP 220 Cb 0.59 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2x0h h ASP 220 CO -0.28 0.77 -0.07 -0.07 -1.72 0.00 0.00 179.24 177.88 2x0h h LEU 221 N 1.19 0.74 -0.58 1.55 3.38 -1.00 0.82 115.31 121.42 2x0h h LEU 221 Ca 0.32 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2x0h h LEU 221 Cb -0.09 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2x0h h LEU 221 CO -0.06 0.85 0.21 0.25 0.09 0.00 0.00 178.44 179.77 2x0h h LEU 222 N 0.70 0.82 -0.55 1.67 6.46 -0.81 -1.15 115.31 122.45 2x0h h LEU 222 Ca 0.13 -0.19 -0.13 0.00 -0.12 0.00 0.00 57.88 57.57 2x0h h LEU 222 Cb 0.52 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.23 2x0h h LEU 222 CO 0.03 0.79 -0.19 -0.07 -0.62 0.00 0.00 178.44 178.38 2x0h h LEU 223 N 0.81 0.99 -1.11 2.25 -0.00 -0.82 -1.76 115.31 115.66 2x0h h LEU 223 Ca 0.19 -0.36 -0.00 0.00 -0.00 0.00 0.00 57.88 57.71 2x0h h LEU 223 Cb 0.25 -0.27 -0.04 0.00 -0.00 0.00 0.00 40.66 40.59 2x0h h LEU 223 CO -0.01 1.14 0.51 0.00 -0.00 0.00 0.00 178.44 180.08 2x0h h ALA 224 N 0.93 1.34 -0.29 1.53 0.00 -0.70 0.41 119.26 122.48 2x0h h ALA 224 Ca 0.12 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2x0h h ALA 224 Cb 0.76 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2x0h h ALA 224 CO 0.06 0.58 -0.01 -0.22 0.00 0.00 0.00 179.25 179.65 2x0h h LYS 225 N 1.13 0.53 -0.89 0.00 1.63 -0.95 -1.57 116.57 116.45 2x0h h LYS 225 Ca 0.30 -0.17 -0.00 0.00 -0.85 0.00 0.00 60.65 59.92 2x0h h LYS 225 Cb -0.07 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.48 2x0h h LYS 225 CO -0.06 0.68 0.54 0.74 -3.45 0.00 0.00 179.45 177.91 2x0h h PHE 226 N 0.31 1.18 -0.74 1.91 -1.00 -0.80 -0.65 116.94 117.15 2x0h h PHE 226 Ca 0.08 -0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.87 2x0h h PHE 226 Cb 0.46 -0.39 -0.04 0.00 3.61 0.00 0.00 35.95 39.59 2x0h h PHE 226 CO 0.04 0.78 0.49 1.49 -1.61 0.00 0.00 178.31 179.50 2x0h h GLU 227 N 1.23 0.97 -0.51 1.51 4.57 -0.75 0.11 114.58 121.71 2x0h h GLU 227 Ca 0.32 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.46 2x0h h GLU 227 Cb -0.05 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.29 2x0h h GLU 227 CO -0.06 0.64 0.32 0.87 -1.18 0.00 0.00 179.01 179.60 2x0h h LYS 228 N 1.00 0.63 -0.44 1.92 1.79 -0.72 -0.31 116.57 120.44 2x0h h LYS 228 Ca 0.27 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.70 2x0h h LYS 228 Cb -0.11 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.38 2x0h h LYS 228 CO -0.06 0.42 0.25 0.52 -1.08 0.00 0.00 179.45 179.49 2x0h h MET 229 N 0.65 0.62 -0.78 3.15 2.86 -0.72 -2.45 114.93 118.27 2x0h h MET 229 Ca 0.20 -0.07 0.12 0.00 -2.06 0.00 0.00 59.70 57.89 2x0h h MET 229 Cb -0.03 -0.12 -0.08 0.00 0.06 0.00 0.00 31.60 31.42 2x0h h MET 229 CO -0.07 0.49 0.39 -0.92 1.06 0.00 0.00 176.91 177.86 2x0h h TYR 230 N 0.58 0.68 0.00 -0.22 3.20 -0.28 -0.78 116.97 120.15 2x0h h TYR 230 Ca 0.16 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 2x0h h TYR 230 Cb 0.05 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.13 2x0h h TYR 230 CO -0.02 0.19 -0.06 1.96 -1.64 0.00 0.00 178.16 178.59 2x0h h GLN 231 N 0.60 0.00 0.00 1.82 4.20 -0.62 -0.51 115.11 120.60 2x0h h GLN 231 Ca 0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.12 2x0h h GLN 231 Cb 0.52 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.30 2x0h h GLN 231 CO -0.33 0.06 0.00 1.28 -0.67 0.00 0.00 178.83 179.17 2x0h n LEU 232 N -4.38 0.00 0.00 1.46 4.77 -0.34 -4.92 117.00 113.59 2x0h n LEU 232 Ca -0.03 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 2x0h n LEU 232 Cb 0.14 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 2x0h n LEU 232 CO 0.34 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 2x0h n GLY 233 N 0.78 0.77 3.72 -0.72 0.00 -0.20 -4.44 105.19 105.10 2x0h n GLY 233 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2x0h n GLY 233 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x0h s VAL 234 N -2.00 3.46 0.00 1.61 1.01 -0.94 -4.91 120.40 118.62 2x0h s VAL 234 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.08 2x0h s VAL 234 Cb 0.00 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.68 2x0h s VAL 234 CO 0.00 0.11 0.63 0.54 0.00 0.00 0.00 175.10 176.38 2x0h n ARG 235 N 3.46 0.88 -4.04 2.72 5.12 -1.26 -4.27 116.66 119.28 2x0h n ARG 235 Ca 0.09 -0.82 -0.12 0.00 -1.93 0.00 0.00 57.85 55.07 2x0h n ARG 235 Cb 0.43 -0.84 -0.12 0.00 -1.16 0.00 0.00 32.46 30.78 2x0h n ARG 235 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2x0h s SER 236 N -0.39 0.61 0.02 0.55 0.01 -1.23 -0.62 113.70 112.66 2x0h s SER 236 Ca 0.00 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.79 2x0h s SER 236 Cb 0.00 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.25 2x0h s SER 236 CO 0.00 -0.20 -0.03 -0.36 0.41 0.00 0.00 173.24 173.06 2x0h s PHE 237 N -1.23 0.29 0.03 2.43 0.08 -0.43 -1.77 117.98 117.38 2x0h s PHE 237 Ca -0.10 -0.51 0.00 0.00 0.12 0.00 0.00 56.93 56.44 2x0h s PHE 237 Cb -0.09 -0.20 -0.02 0.00 -0.57 0.00 0.00 43.02 42.13 2x0h s PHE 237 CO -0.00 -0.18 -0.04 0.00 -0.10 0.00 0.00 175.22 174.90 2x0h s ALA 238 N -1.42 0.29 -0.12 5.36 0.00 -0.56 -1.26 121.76 124.05 2x0h s ALA 238 Ca -0.15 -0.74 -0.00 0.00 0.00 0.00 0.00 51.96 51.06 2x0h s ALA 238 Cb -0.10 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.20 2x0h s ALA 238 CO -0.01 -0.17 -0.07 0.08 0.00 0.00 0.00 175.76 175.58 2x0h s VAL 239 N -1.91 1.02 -0.18 0.00 1.01 -0.38 -0.99 120.40 118.97 2x0h s VAL 239 Ca -0.10 -0.30 -0.07 0.00 0.00 0.00 0.00 61.98 61.50 2x0h s VAL 239 Cb -0.07 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 2x0h s VAL 239 CO -0.02 0.35 0.07 -0.36 0.00 0.00 0.00 175.10 175.14 2x0h s PHE 240 N 1.71 3.27 -0.21 5.22 0.08 0.11 -1.20 117.98 126.97 2x0h s PHE 240 Ca 0.05 0.11 0.12 0.00 0.12 0.00 0.00 56.93 57.32 2x0h s PHE 240 Cb -0.13 -2.07 0.42 0.00 -0.57 0.00 0.00 43.02 40.67 2x0h s PHE 240 CO -0.08 0.20 1.24 1.19 -0.10 0.00 0.00 175.22 177.66 2x0h n PHE 241 N 3.42 0.11 -3.51 0.36 3.72 -0.12 -4.11 117.46 117.34 2x0h n PHE 241 Ca -0.17 -1.45 -0.35 0.00 -0.05 0.00 0.00 57.45 55.44 2x0h n PHE 241 Cb 0.52 -0.26 -0.05 0.00 -0.94 0.00 0.00 39.48 38.75 2x0h n PHE 241 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2x0h s ASP 242 N -3.12 6.69 -0.59 4.37 -4.77 -1.26 -3.45 116.67 114.54 2x0h s ASP 242 Ca 0.38 0.87 -0.03 0.00 -3.30 0.00 0.00 52.55 50.47 2x0h s ASP 242 Cb 0.36 -2.21 0.00 0.00 -1.09 0.00 0.00 42.92 39.99 2x0h s ASP 242 CO -0.05 0.14 0.51 0.47 0.70 0.00 0.00 175.17 176.94 2x0h n ASP 243 N 0.82 -3.60 -4.15 2.11 8.00 -1.26 -5.04 116.55 113.43 2x0h n ASP 243 Ca -0.07 -0.24 -0.11 0.00 0.71 0.00 0.00 54.79 55.08 2x0h n ASP 243 Cb 0.52 -2.51 -0.10 0.00 -0.02 0.00 0.00 41.12 39.01 2x0h n ASP 243 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2x0h s ILE 244 N -3.14 0.64 0.26 0.53 -4.36 -1.26 -5.01 121.20 108.85 2x0h s ILE 244 Ca 0.21 -1.79 0.06 0.00 -0.26 0.00 0.00 60.65 58.88 2x0h s ILE 244 Cb -0.09 -1.50 -0.05 0.00 1.25 0.00 0.00 42.46 42.06 2x0h s ILE 244 CO 0.32 -0.80 -0.06 -0.94 0.24 0.00 0.00 174.94 173.70 2x0h s SER 245 N -2.80 2.58 0.00 4.36 1.04 -1.26 -4.91 113.70 112.72 2x0h s SER 245 Ca 0.08 -1.17 0.00 0.00 0.48 0.00 0.00 55.95 55.34 2x0h s SER 245 Cb 0.03 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.01 2x0h s SER 245 CO -0.04 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 174.44 2x0h n GLY 246 N -0.53 -1.77 0.46 7.32 0.00 -1.26 -4.52 105.19 104.89 2x0h n GLY 246 Ca -0.06 -1.92 0.27 0.00 0.00 0.00 0.00 46.02 44.32 2x0h n GLY 246 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2x0h h GLU 247 N 0.00 0.14 0.00 1.61 4.39 -1.92 -2.19 114.58 116.62 2x0h h GLU 247 Ca 0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2x0h h GLU 247 Cb 0.00 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2x0h h GLU 247 CO 0.00 0.10 0.18 0.78 -1.16 0.00 0.00 179.01 178.90 2x0h h GLY 248 N 0.15 0.00 -1.14 -3.84 0.00 -1.79 -2.07 103.07 94.38 2x0h h GLY 248 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 2x0h h GLY 248 CO -0.09 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.15 2x0h n THR 249 N -2.18 0.27 -2.40 4.70 -2.24 -0.82 -4.87 114.28 106.72 2x0h n THR 249 Ca -0.01 -0.43 -0.43 0.00 -2.27 0.00 0.00 64.05 60.91 2x0h n THR 249 Cb 0.21 0.51 -0.02 0.00 -2.10 0.00 0.00 70.33 68.92 2x0h n THR 249 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2x0h s ASN 250 N -1.55 6.62 0.15 3.42 3.84 -0.78 -4.95 114.94 121.69 2x0h s ASN 250 Ca 0.33 1.18 -0.15 0.00 0.21 0.00 0.00 52.86 54.43 2x0h s ASN 250 Cb 0.18 -2.54 0.02 0.00 -0.55 0.00 0.00 41.25 38.36 2x0h s ASN 250 CO 0.27 -1.13 1.73 1.55 -2.79 0.00 0.00 177.10 176.73 2x0h h PRO 251 N 9.51 0.63 -0.83 0.43 0.13 -1.91 -1.36 132.00 138.60 2x0h h PRO 251 Ca -0.27 -0.09 0.08 0.00 -0.87 0.00 0.00 66.00 64.86 2x0h h PRO 251 Cb 1.10 -0.12 -0.07 0.00 0.13 0.00 0.00 31.00 32.05 2x0h h PRO 251 CO 1.04 0.54 0.49 0.37 -0.23 0.00 0.00 178.00 180.21 2x0h h GLN 252 N 0.57 0.83 -0.12 0.86 5.75 -1.92 -0.35 115.11 120.73 2x0h h GLN 252 Ca 0.15 -0.05 -0.22 0.00 -0.15 0.00 0.00 58.65 58.38 2x0h h GLN 252 Cb 0.11 -0.19 0.01 0.00 1.07 0.00 0.00 27.48 28.48 2x0h h GLN 252 CO -0.02 0.55 -0.80 0.87 -2.65 0.00 0.00 178.83 176.78 2x0h h LYS 253 N 0.85 0.72 -0.01 1.69 1.79 -1.88 0.51 116.57 120.24 2x0h h LYS 253 Ca 0.39 -0.60 0.03 0.00 -2.18 0.00 0.00 60.65 58.28 2x0h h LYS 253 Cb 0.29 0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 31.04 2x0h h LYS 253 CO -0.22 1.21 -0.17 1.96 -1.08 0.00 0.00 179.45 181.15 2x0h h GLN 254 N 0.48 -0.27 -0.12 3.15 4.20 -0.97 -0.18 115.11 121.40 2x0h h GLN 254 Ca -0.06 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 2x0h h GLN 254 Cb 1.42 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.26 2x0h h GLN 254 CO 0.16 -0.18 0.07 0.00 -0.67 0.00 0.00 178.83 178.21 2x0h h ALA 255 N 0.65 0.15 -0.63 3.87 0.00 -0.95 -1.07 119.26 121.28 2x0h h ALA 255 Ca 0.06 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.03 2x0h h ALA 255 Cb 0.35 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.02 2x0h h ALA 255 CO -0.17 -0.33 0.22 0.93 0.00 0.00 0.00 179.25 179.90 2x0h h GLU 256 N 0.11 0.38 -0.27 0.00 5.08 -0.79 0.36 114.58 119.45 2x0h h GLU 256 Ca 0.04 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2x0h h GLU 256 Cb 0.05 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2x0h h GLU 256 CO -0.01 0.25 0.13 1.25 -1.00 0.00 0.00 179.01 179.63 2x0h h LEU 257 N 0.39 0.36 -0.75 1.33 5.85 -0.68 -1.33 115.31 120.48 2x0h h LEU 257 Ca 0.32 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2x0h h LEU 257 Cb 0.43 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2x0h h LEU 257 CO -0.34 0.39 0.38 -0.07 -0.34 0.00 0.00 178.44 178.46 2x0h h LEU 258 N 0.30 0.97 -1.04 2.25 -0.00 -0.65 0.20 115.31 117.34 2x0h h LEU 258 Ca 0.09 -0.12 -0.08 0.00 -0.00 0.00 0.00 57.88 57.77 2x0h h LEU 258 Cb 0.13 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 40.53 2x0h h LEU 258 CO -0.01 0.82 -0.21 0.78 -0.00 0.00 0.00 178.44 179.81 2x0h h ASN 259 N 1.05 0.43 -0.16 -0.43 2.35 -0.85 0.98 115.58 118.95 2x0h h ASN 259 Ca 0.26 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 55.82 2x0h h ASN 259 Cb 0.09 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 2x0h h ASN 259 CO -0.04 0.65 -0.12 0.22 -1.65 0.00 0.00 177.43 176.49 2x0h h TYR 260 N 0.39 0.43 -0.48 1.19 3.20 -0.69 -0.71 116.97 120.29 2x0h h TYR 260 Ca 0.06 -0.12 0.04 0.00 3.14 0.00 0.00 58.73 61.85 2x0h h TYR 260 Cb 0.59 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.73 2x0h h TYR 260 CO 0.02 0.72 0.25 0.82 -1.64 0.00 0.00 178.16 178.33 2x0h h ILE 261 N 0.01 0.98 -0.18 1.81 2.04 -0.66 0.42 117.51 121.92 2x0h h ILE 261 Ca 0.03 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.76 2x0h h ILE 261 Cb 0.63 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 2x0h h ILE 261 CO 0.03 0.09 -0.09 -0.78 0.00 0.00 0.00 178.15 177.40 2x0h h ASP 262 N 0.50 -0.30 0.66 1.72 3.58 -0.72 0.21 116.42 122.06 2x0h h ASP 262 Ca 0.21 0.07 -0.27 0.00 0.42 0.00 0.00 57.03 57.46 2x0h h ASP 262 Cb 0.10 0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.31 2x0h h ASP 262 CO -0.14 -0.12 -1.28 -0.33 -2.88 0.00 0.00 179.24 174.49 2x0h h GLU 263 N -0.07 0.20 -0.00 0.28 5.08 -0.73 0.38 114.58 119.72 2x0h h GLU 263 Ca 0.10 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 2x0h h GLU 263 Cb 0.22 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2x0h h GLU 263 CO -0.23 1.12 -0.59 1.63 -1.00 0.00 0.00 179.01 179.94 2x0h n LYS 264 N -3.46 0.15 0.04 2.33 4.01 0.10 -4.45 118.16 116.88 2x0h n LYS 264 Ca -0.09 -0.10 0.00 0.00 -0.51 0.00 0.00 58.31 57.61 2x0h n LYS 264 Cb 1.01 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 34.04 2x0h n LYS 264 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2x0h n PHE 265 N -1.34 -0.75 -0.14 2.13 7.35 -0.09 -4.65 117.46 119.97 2x0h n PHE 265 Ca 0.06 0.13 0.07 0.00 -0.76 0.00 0.00 57.45 56.95 2x0h n PHE 265 Cb 0.34 0.48 0.39 0.00 0.35 0.00 0.00 39.48 41.04 2x0h n PHE 265 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2x0h h ALA 266 N 0.00 1.75 -0.01 3.13 0.00 -0.86 -1.24 119.26 122.04 2x0h h ALA 266 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2x0h h ALA 266 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2x0h h ALA 266 CO 0.00 0.14 -0.38 1.04 0.00 0.00 0.00 179.25 180.06 2x0h n GLN 267 N -4.48 1.07 -0.07 0.00 1.13 0.13 -4.39 117.38 110.77 2x0h n GLN 267 Ca 0.09 -0.79 -0.20 0.00 -1.94 0.00 0.00 57.00 54.16 2x0h n GLN 267 Cb 0.22 -1.48 -0.13 0.00 0.11 0.00 0.00 30.24 28.97 2x0h n GLN 267 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2x0h n VAL 268 N -0.27 1.62 -1.78 5.09 0.31 -0.63 -4.89 118.33 117.77 2x0h n VAL 268 Ca 0.11 -0.56 -0.38 0.00 -0.01 0.00 0.00 64.34 63.49 2x0h n VAL 268 Cb 0.42 -1.62 0.04 0.00 -0.91 0.00 0.00 33.84 31.77 2x0h n VAL 268 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2x0h s LYS 269 N -2.53 3.17 0.55 5.55 -0.14 -0.56 -4.93 119.74 120.85 2x0h s LYS 269 Ca -0.30 2.25 0.34 0.00 -1.36 0.00 0.00 55.97 56.90 2x0h s LYS 269 Cb 0.08 -2.28 1.39 0.00 -1.68 0.00 0.00 37.83 35.34 2x0h s LYS 269 CO 0.66 -1.17 1.99 -1.00 -0.76 0.00 0.00 175.35 175.07 2x0h h PRO 270 N 1.51 0.00 -0.06 -1.68 0.13 -1.90 -3.38 132.00 126.61 2x0h h PRO 270 Ca -0.51 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.44 2x0h h PRO 270 Cb 1.30 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 32.07 2x0h h PRO 270 CO 0.57 0.00 -0.94 -0.40 -0.23 0.00 0.00 178.00 177.00 2x0h n ASP 271 N -3.09 0.78 -4.75 1.44 5.75 -1.26 -5.08 116.55 110.34 2x0h n ASP 271 Ca 0.01 -2.01 -0.40 0.00 -0.01 0.00 0.00 54.79 52.38 2x0h n ASP 271 Cb 0.30 -0.23 -0.05 0.00 -1.03 0.00 0.00 41.12 40.11 2x0h n ASP 271 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2x0h s ILE 272 N -0.56 4.64 0.00 2.12 1.01 -1.26 -4.87 121.20 122.28 2x0h s ILE 272 Ca 0.28 1.68 0.00 0.00 0.00 0.00 0.00 60.65 62.62 2x0h s ILE 272 Cb 0.33 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.66 2x0h s ILE 272 CO -0.13 0.39 0.00 0.59 0.00 0.00 0.00 174.94 175.79 2x0h n ASN 273 N 2.57 0.00 -4.81 3.58 5.03 0.21 -5.02 115.26 116.82 2x0h n ASN 273 Ca -0.03 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.05 2x0h n ASN 273 Cb 0.50 0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 39.20 2x0h n ASN 273 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2x0h s GLN 274 N 0.00 3.98 -0.13 3.52 -0.21 -1.26 -5.02 119.66 120.54 2x0h s GLN 274 Ca 0.00 0.37 0.01 0.00 0.02 0.00 0.00 55.36 55.76 2x0h s GLN 274 Cb 0.00 -3.26 0.02 0.00 1.00 0.00 0.00 33.01 30.77 2x0h s GLN 274 CO 0.00 0.59 -0.15 -1.17 -2.12 0.00 0.00 175.29 172.45 2x0h s LEU 275 N -0.74 1.70 -0.01 2.90 2.96 -1.26 -1.31 118.68 122.92 2x0h s LEU 275 Ca 0.23 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.71 2x0h s LEU 275 Cb -0.16 -1.13 -0.00 0.00 0.50 0.00 0.00 46.19 45.39 2x0h s LEU 275 CO 0.12 -0.02 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.36 2x0h s VAL 276 N 1.23 0.65 0.04 1.68 1.01 -0.39 -1.79 120.40 122.83 2x0h s VAL 276 Ca -0.01 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 61.68 2x0h s VAL 276 Cb -0.14 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 2x0h s VAL 276 CO -0.06 0.19 -0.15 0.00 0.00 0.00 0.00 175.10 175.08 2x0h s MET 277 N -0.14 0.99 -0.29 2.72 0.23 0.29 -1.25 119.30 121.85 2x0h s MET 277 Ca 0.02 -0.80 -0.09 0.00 -1.03 0.00 0.00 55.69 53.80 2x0h s MET 277 Cb -0.04 -1.02 -0.01 0.00 -1.53 0.00 0.00 34.83 32.24 2x0h s MET 277 CO -0.00 0.25 0.13 0.00 -2.03 0.00 0.00 175.02 173.36 2x0h s PRO 279 N 1.60 2.25 0.14 0.00 0.04 -1.26 -0.94 135.00 136.83 2x0h s PRO 279 Ca 0.05 1.20 -0.13 0.00 0.04 0.00 0.00 61.00 62.16 2x0h s PRO 279 Cb -0.17 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 2x0h s PRO 279 CO 0.05 -1.65 1.55 1.15 0.04 0.00 0.00 177.00 178.14 2x0h h THR 280 N -1.06 1.27 -3.01 1.26 2.02 -1.92 -3.35 112.91 108.12 2x0h h THR 280 Ca -0.44 -1.21 -0.73 0.00 0.77 0.00 0.00 66.41 64.80 2x0h h THR 280 Cb 1.23 1.15 -0.21 0.00 -1.74 0.00 0.00 68.15 68.58 2x0h h THR 280 CO 0.51 0.41 0.51 -1.61 0.37 0.00 0.00 175.52 175.71 2x0h s GLU 281 N -4.81 3.59 0.00 6.66 2.02 -1.26 -4.66 118.70 120.24 2x0h s GLU 281 Ca -0.12 -2.05 0.12 0.00 0.02 0.00 0.00 54.97 52.94 2x0h s GLU 281 Cb 0.11 -4.70 0.25 0.00 0.10 0.00 0.00 34.13 29.89 2x0h s GLU 281 CO 0.83 -1.57 1.14 2.48 0.02 0.00 0.00 175.26 178.16 2x0h n TYR 282 N 5.46 0.33 -3.69 1.61 0.18 -1.26 -4.94 117.16 114.86 2x0h n TYR 282 Ca 0.19 -0.32 -0.10 0.00 1.88 0.00 0.00 57.90 59.55 2x0h n TYR 282 Cb 0.48 -0.02 -0.05 0.00 -0.38 0.00 0.00 39.34 39.37 2x0h n TYR 282 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2x0h s ASN 283 N -1.01 -0.16 0.21 9.48 2.20 -1.26 -0.99 114.94 123.41 2x0h s ASN 283 Ca 0.22 -0.37 -0.10 0.00 -0.94 0.00 0.00 52.86 51.67 2x0h s ASN 283 Cb 0.12 0.44 0.16 0.00 -2.00 0.00 0.00 41.25 39.97 2x0h s ASN 283 CO 0.17 -0.81 1.85 0.50 -2.94 0.00 0.00 177.10 175.87 2x0h h LYS 284 N 2.51 1.05 -0.17 3.55 3.64 -0.94 -2.90 116.57 123.32 2x0h h LYS 284 Ca -0.34 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 58.91 2x0h h LYS 284 Cb 1.24 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 2x0h h LYS 284 CO 0.49 0.74 -0.08 0.66 -2.27 0.00 0.00 179.45 178.99 2x0h h SER 285 N 1.06 0.24 -0.26 4.20 4.64 -1.54 -1.70 113.55 120.19 2x0h h SER 285 Ca 0.28 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2x0h h SER 285 Cb -0.04 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 2x0h h SER 285 CO -0.05 0.36 0.00 0.79 -0.87 0.00 0.00 176.83 177.06 2x0h n TRP 286 N -4.31 0.35 -3.81 4.77 7.02 -1.10 -4.84 117.44 115.52 2x0h n TRP 286 Ca -0.00 -0.17 -0.36 0.00 -1.02 0.00 0.00 57.50 55.94 2x0h n TRP 286 Cb 0.24 0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.01 2x0h n TRP 286 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2x0h s SER 287 N -1.12 5.55 0.32 -0.99 0.15 -0.64 -4.78 113.70 112.19 2x0h s SER 287 Ca 0.22 -0.04 -0.29 0.00 0.70 0.00 0.00 55.95 56.54 2x0h s SER 287 Cb 0.12 -1.99 -0.10 0.00 -1.71 0.00 0.00 66.02 62.34 2x0h s SER 287 CO 0.16 0.04 1.27 0.21 1.20 0.00 0.00 173.24 176.12 2x0h s ASN 288 N 1.16 6.88 -1.22 5.45 2.47 -1.26 -5.03 114.94 123.38 2x0h s ASN 288 Ca 0.05 2.59 -0.12 0.00 0.42 0.00 0.00 52.86 55.80 2x0h s ASN 288 Cb -0.14 -2.64 0.18 0.00 -1.45 0.00 0.00 41.25 37.19 2x0h s ASN 288 CO 0.04 -0.46 1.53 -0.81 -3.72 0.00 0.00 177.10 173.69 2x0h n PRO 289 N 0.96 3.46 -2.40 0.43 -0.04 -1.26 -4.83 135.00 131.33 2x0h n PRO 289 Ca 0.00 -3.82 -0.08 0.00 -0.04 0.00 0.00 63.50 59.56 2x0h n PRO 289 Cb 0.42 -2.98 0.04 0.00 -0.04 0.00 0.00 33.50 30.95 2x0h n PRO 289 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2x0h n ASN 292 N 4.97 2.75 -0.24 3.54 0.23 -1.26 -5.16 115.26 120.09 2x0h n ASN 292 Ca 0.37 -2.70 -0.01 0.00 -0.53 0.00 0.00 54.58 51.70 2x0h n ASN 292 Cb 0.41 -0.42 0.11 0.00 -2.08 0.00 0.00 39.78 37.79 2x0h n ASN 292 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 2x0h h TYR 293 N 2.32 0.73 0.13 -2.53 3.20 -2.00 -2.81 116.97 116.00 2x0h h TYR 293 Ca 0.04 0.03 -0.28 0.00 3.14 0.00 0.00 58.73 61.66 2x0h h TYR 293 Cb 1.39 -0.22 0.02 0.00 1.54 0.00 0.00 36.73 39.45 2x0h h TYR 293 CO 0.62 0.35 -1.23 -0.07 -1.64 0.00 0.00 178.16 176.18 2x0h h LEU 294 N 0.72 0.62 -0.83 2.82 3.38 -1.94 -2.71 115.31 117.37 2x0h h LEU 294 Ca 0.32 -0.61 -0.12 0.00 0.09 0.00 0.00 57.88 57.56 2x0h h LEU 294 Cb 0.20 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2x0h h LEU 294 CO -0.19 1.45 -0.57 0.71 0.09 0.00 0.00 178.44 179.93 2x0h h THR 295 N 0.16 1.38 -0.05 0.22 1.35 -1.73 0.00 112.91 114.25 2x0h h THR 295 Ca -0.16 -1.98 0.00 0.00 -0.55 0.00 0.00 66.41 63.72 2x0h h THR 295 Cb 1.92 2.08 -0.00 0.00 -1.73 0.00 0.00 68.15 70.41 2x0h h THR 295 CO 0.22 0.56 0.03 0.74 -0.25 0.00 0.00 175.52 176.82 2x0h h THR 296 N 0.00 1.02 0.11 6.82 2.02 -1.53 -0.95 112.91 120.40 2x0h h THR 296 Ca -0.01 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 2x0h h THR 296 Cb 1.03 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 2x0h h THR 296 CO 0.07 0.02 -0.05 -0.07 0.37 0.00 0.00 175.52 175.86 2x0h h LEU 297 N 0.07 -0.13 -0.71 2.58 3.38 -1.22 -0.38 115.31 118.90 2x0h h LEU 297 Ca 0.02 -0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.10 2x0h h LEU 297 Cb -0.00 0.03 -0.09 0.00 0.09 0.00 0.00 40.66 40.69 2x0h h LEU 297 CO -0.00 -0.06 0.25 1.23 0.09 0.00 0.00 178.44 179.94 2x0h h GLY 298 N -0.18 1.03 1.54 0.83 0.00 -0.90 -1.33 103.07 104.06 2x0h h GLY 298 Ca -0.02 -0.11 -0.25 0.00 0.00 0.00 0.00 47.33 46.96 2x0h h GLY 298 CO 0.03 -0.10 -1.07 -0.55 0.00 0.00 0.00 176.54 174.84 2x0h h ASP 299 N 0.39 0.53 0.30 0.19 3.32 -1.00 -3.39 116.42 116.75 2x0h h ASP 299 Ca 0.38 -0.48 -0.33 0.00 0.02 0.00 0.00 57.03 56.63 2x0h h ASP 299 Cb 0.58 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.92 2x0h h ASP 299 CO -0.41 1.31 -1.90 0.29 -1.72 0.00 0.00 179.24 176.81 2x0h n LYS 300 N -3.68 0.69 -2.21 3.56 4.76 -0.17 -4.93 118.16 116.17 2x0h n LYS 300 Ca -0.08 0.26 -0.42 0.00 -2.87 0.00 0.00 58.31 55.20 2x0h n LYS 300 Cb 0.91 -1.73 -0.03 0.00 -1.84 0.00 0.00 35.03 32.34 2x0h n LYS 300 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2x0h s LEU 301 N -6.44 4.37 0.19 -0.35 2.96 -0.52 -4.92 118.68 113.97 2x0h s LEU 301 Ca -0.13 2.27 -0.32 0.00 -0.22 0.00 0.00 54.13 55.73 2x0h s LEU 301 Cb 0.07 -3.58 -0.16 0.00 0.50 0.00 0.00 46.19 43.02 2x0h s LEU 301 CO 0.79 -0.63 1.12 0.59 -1.32 0.00 0.00 176.35 176.91 2x0h n ASN 302 N 4.00 1.26 0.28 3.68 3.02 -1.26 -4.82 115.26 121.42 2x0h n ASN 302 Ca 0.11 1.15 0.12 0.00 -0.03 0.00 0.00 54.58 55.93 2x0h n ASN 302 Cb 0.43 -1.22 0.80 0.00 -0.61 0.00 0.00 39.78 39.18 2x0h n ASN 302 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2x0h h PRO 303 N 3.12 0.00 0.00 3.52 0.13 -1.93 -1.82 132.00 135.02 2x0h h PRO 303 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2x0h h PRO 303 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2x0h h PRO 303 CO 0.68 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.33 2x0h n SER 304 N -4.13 0.43 -4.72 1.44 3.41 -1.26 -4.76 113.62 104.03 2x0h n SER 304 Ca -0.03 0.59 -0.42 0.00 -0.26 0.00 0.00 58.87 58.75 2x0h n SER 304 Cb 0.09 -0.69 -0.03 0.00 -0.26 0.00 0.00 64.21 63.32 2x0h n SER 304 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2x0h s ILE 305 N -3.16 3.94 0.25 -1.33 1.01 -0.69 -4.75 121.20 116.46 2x0h s ILE 305 Ca 0.07 1.46 -0.23 0.00 0.00 0.00 0.00 60.65 61.94 2x0h s ILE 305 Cb 0.11 -3.93 -0.09 0.00 0.01 0.00 0.00 42.46 38.55 2x0h s ILE 305 CO 0.39 0.15 0.82 -1.10 0.00 0.00 0.00 174.94 175.20 2x0h s GLN 306 N 0.66 4.44 -0.15 2.79 -1.52 -0.74 -4.96 119.66 120.19 2x0h s GLN 306 Ca 0.57 1.10 0.02 0.00 -1.95 0.00 0.00 55.36 55.09 2x0h s GLN 306 Cb -0.30 -2.94 0.01 0.00 -0.22 0.00 0.00 33.01 29.56 2x0h s GLN 306 CO 0.31 0.39 -0.20 0.42 -0.25 0.00 0.00 175.29 175.97 2x0h s ILE 307 N -1.47 2.25 0.54 1.08 1.01 -1.26 -0.55 121.20 122.80 2x0h s ILE 307 Ca 0.44 -0.91 -0.08 0.00 0.00 0.00 0.00 60.65 60.10 2x0h s ILE 307 Cb -0.19 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 2x0h s ILE 307 CO 0.23 0.54 0.90 -0.04 0.00 0.00 0.00 174.94 176.57 2x0h s MET 308 N 0.88 3.59 -0.28 2.79 -1.94 -0.55 -1.57 119.30 122.22 2x0h s MET 308 Ca -0.05 0.48 -0.20 0.00 -1.71 0.00 0.00 55.69 54.21 2x0h s MET 308 Cb -0.15 -2.23 0.09 0.00 2.01 0.00 0.00 34.83 34.55 2x0h s MET 308 CO -0.03 -0.37 0.78 -0.46 -0.01 0.00 0.00 175.02 174.94 2x0h s TRP 309 N -2.93 -0.83 -1.85 -0.03 -0.11 -0.94 -4.36 118.94 107.88 2x0h s TRP 309 Ca 0.51 1.81 0.19 0.00 1.22 0.00 0.00 56.10 59.83 2x0h s TRP 309 Cb -0.11 0.45 0.03 0.00 -1.50 0.00 0.00 33.47 32.34 2x0h s TRP 309 CO 0.48 -0.41 0.98 0.25 -4.62 0.00 0.00 176.95 173.63 2x0h n THR 310 N 3.45 0.00 0.00 5.86 -2.24 -0.17 -0.63 114.28 120.55 2x0h n THR 310 Ca -0.17 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 2x0h n THR 310 Cb 0.57 1.26 0.00 0.00 -2.10 0.00 0.00 70.33 70.06 2x0h n THR 310 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x0h n GLY 311 N 1.22 0.19 0.23 3.38 0.00 -1.26 -4.08 105.19 104.87 2x0h n GLY 311 Ca 0.08 -2.05 0.09 0.00 0.00 0.00 0.00 46.02 44.15 2x0h n GLY 311 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2x0h h ASP 312 N 0.00 0.00 -5.52 1.61 3.32 -1.92 -0.31 116.42 113.60 2x0h h ASP 312 Ca 0.00 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 2x0h h ASP 312 Cb 0.00 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.42 2x0h h ASP 312 CO 0.00 0.23 -0.47 -0.13 -1.72 0.00 0.00 179.24 177.15 2x0h s ARG 313 N -3.91 1.35 0.18 3.56 0.52 -1.26 -1.49 118.95 117.90 2x0h s ARG 313 Ca -0.01 -1.57 -0.14 0.00 -0.52 0.00 0.00 55.73 53.49 2x0h s ARG 313 Cb 0.12 0.33 0.17 0.00 0.52 0.00 0.00 34.95 36.09 2x0h s ARG 313 CO 0.64 -0.49 1.68 0.28 0.02 0.00 0.00 175.30 177.43 2x0h h VAL 314 N 2.48 0.61 -3.68 3.52 2.07 -1.88 -3.28 116.25 116.09 2x0h h VAL 314 Ca -0.33 -0.03 -0.69 0.00 0.82 0.00 0.00 66.70 66.47 2x0h h VAL 314 Cb 1.25 0.51 -0.31 0.00 -1.52 0.00 0.00 31.29 31.22 2x0h h VAL 314 CO 0.47 0.02 -0.63 -0.63 0.02 0.00 0.00 177.57 176.82 2x0h s ILE 315 N -6.18 3.46 0.19 4.57 -1.09 -1.26 -4.62 121.20 116.27 2x0h s ILE 315 Ca -0.14 -1.32 -0.16 0.00 -2.23 0.00 0.00 60.65 56.80 2x0h s ILE 315 Cb 0.16 -3.01 0.02 0.00 -1.58 0.00 0.00 42.46 38.05 2x0h s ILE 315 CO 0.72 -0.21 0.48 -0.94 -1.23 0.00 0.00 174.94 173.76 2x0h s SER 316 N 1.42 -0.20 0.09 3.58 1.04 -1.24 -4.90 113.70 113.49 2x0h s SER 316 Ca -0.02 -0.55 -0.04 0.00 0.48 0.00 0.00 55.95 55.82 2x0h s SER 316 Cb -0.20 0.55 -0.05 0.00 0.10 0.00 0.00 66.02 66.42 2x0h s SER 316 CO 0.01 -1.02 0.31 -1.81 0.98 0.00 0.00 173.24 171.71 2x0h s ASP 317 N -2.89 6.46 -0.10 7.02 1.01 -1.26 -4.63 116.67 122.27 2x0h s ASP 317 Ca 0.10 0.50 -0.21 0.00 0.71 0.00 0.00 52.55 53.66 2x0h s ASP 317 Cb -0.00 -2.06 -0.04 0.00 1.01 0.00 0.00 42.92 41.83 2x0h s ASP 317 CO -0.02 0.12 0.58 -0.63 0.21 0.00 0.00 175.17 175.43 2x0h s ILE 318 N -1.55 5.12 0.37 0.77 -1.09 -1.26 -4.73 121.20 118.83 2x0h s ILE 318 Ca 0.37 1.18 0.08 0.00 -2.23 0.00 0.00 60.65 60.05 2x0h s ILE 318 Cb -0.13 -3.92 -0.06 0.00 -1.58 0.00 0.00 42.46 36.77 2x0h s ILE 318 CO 0.24 0.28 -0.00 0.42 -1.23 0.00 0.00 174.94 174.64 2x0h s THR 319 N 0.80 2.29 0.10 2.92 -4.23 -1.26 -1.17 115.64 115.08 2x0h s THR 319 Ca 0.31 -2.02 -0.18 0.00 -1.18 0.00 0.00 61.69 58.62 2x0h s THR 319 Cb -0.16 -2.83 -0.06 0.00 1.34 0.00 0.00 72.50 70.79 2x0h s THR 319 CO 0.14 -0.12 1.58 -0.09 -0.54 0.00 0.00 174.62 175.58 2x0h h ARG 320 N 1.82 0.47 -0.44 3.99 2.43 -1.96 -0.66 114.38 120.03 2x0h h ARG 320 Ca -0.43 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 58.61 2x0h h ARG 320 Cb 1.25 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.72 2x0h h ARG 320 CO 0.72 0.58 0.26 -0.44 -1.51 0.00 0.00 179.97 179.57 2x0h h ASP 321 N 0.29 0.54 -0.44 -3.80 3.32 -1.99 -1.33 116.42 113.02 2x0h h ASP 321 Ca 0.09 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 2x0h h ASP 321 Cb 0.33 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 2x0h h ASP 321 CO 0.00 0.45 0.14 1.23 -1.72 0.00 0.00 179.24 179.34 2x0h h GLY 322 N 0.58 0.73 1.66 2.75 0.00 -1.94 -1.32 103.07 105.54 2x0h h GLY 322 Ca 0.16 -0.43 -0.13 0.00 0.00 0.00 0.00 47.33 46.92 2x0h h GLY 322 CO -0.03 0.40 -0.49 1.19 0.00 0.00 0.00 176.54 177.61 2x0h h ILE 323 N 0.56 1.33 -0.29 2.60 2.10 -1.06 -2.75 117.51 120.00 2x0h h ILE 323 Ca 0.14 -1.72 -0.09 0.00 1.08 0.00 0.00 64.86 64.27 2x0h h ILE 323 Cb 0.26 1.77 -0.01 0.00 -1.09 0.00 0.00 36.82 37.75 2x0h h ILE 323 CO -0.00 0.52 -0.20 0.28 -1.08 0.00 0.00 178.15 177.67 2x0h h SER 324 N 0.29 0.53 0.07 2.19 0.02 -1.01 -1.68 113.55 113.96 2x0h h SER 324 Ca 0.01 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.79 2x0h h SER 324 Cb 0.97 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.37 2x0h h SER 324 CO 0.08 0.74 -0.03 -0.25 -1.14 0.00 0.00 176.83 176.23 2x0h h TRP 325 N 0.48 -0.09 0.42 3.45 7.01 -1.06 -2.79 115.95 123.37 2x0h h TRP 325 Ca 0.08 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.05 2x0h h TRP 325 Cb 0.62 0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.71 2x0h h TRP 325 CO 0.02 -0.04 -0.20 0.97 -2.79 0.00 0.00 178.44 176.40 2x0h h ILE 326 N -0.11 0.58 -1.01 2.65 6.09 -1.40 -3.25 117.51 121.06 2x0h h ILE 326 Ca -0.01 -0.23 0.24 0.00 -1.37 0.00 0.00 64.86 63.49 2x0h h ILE 326 Cb 0.09 0.69 -0.12 0.00 0.47 0.00 0.00 36.82 37.95 2x0h h ILE 326 CO 0.02 0.04 0.60 0.78 -3.07 0.00 0.00 178.15 176.52 2x0h h ASN 327 N -0.70 0.67 -0.13 2.19 4.21 -1.34 -0.17 115.58 120.31 2x0h h ASN 327 Ca -0.06 0.13 -0.09 0.00 1.21 0.00 0.00 56.30 57.49 2x0h h ASN 327 Cb 0.50 0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.71 2x0h h ASN 327 CO 0.09 0.11 -0.19 -0.33 -1.29 0.00 0.00 177.43 175.82 2x0h h GLU 328 N 0.58 0.54 0.07 0.81 5.08 -1.53 0.77 114.58 120.90 2x0h h GLU 328 Ca 0.64 -0.18 -0.25 0.00 -1.00 0.00 0.00 59.36 58.57 2x0h h GLU 328 Cb 1.23 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 30.46 2x0h h GLU 328 CO -0.46 0.70 -1.01 0.00 -1.00 0.00 0.00 179.01 177.25 2x0h h ARG 329 N 0.48 0.56 0.00 2.33 3.08 -1.14 -3.36 114.38 116.33 2x0h h ARG 329 Ca 0.08 -0.70 0.00 0.00 0.07 0.00 0.00 59.98 59.43 2x0h h ARG 329 Cb 0.61 0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.88 2x0h h ARG 329 CO 0.04 1.29 -0.56 0.44 -1.07 0.00 0.00 179.97 180.11 2x0h n ILE 330 N -3.94 0.13 -1.71 2.04 -5.35 -0.41 -4.12 119.36 106.01 2x0h n ILE 330 Ca -0.12 -0.11 -0.14 0.00 -0.27 0.00 0.00 62.75 62.10 2x0h n ILE 330 Cb 0.87 0.09 -0.04 0.00 -1.74 0.00 0.00 39.64 38.82 2x0h n ILE 330 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2x0h n LYS 331 N -1.74 -1.05 -3.97 6.28 4.76 0.25 -4.34 118.16 118.36 2x0h n LYS 331 Ca 0.05 0.90 -0.09 0.00 -2.87 0.00 0.00 58.31 56.30 2x0h n LYS 331 Cb 0.38 -5.07 -0.05 0.00 -1.84 0.00 0.00 35.03 28.45 2x0h n LYS 331 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2x0h s ARG 332 N -3.72 1.60 0.03 1.97 1.70 -1.25 -5.09 118.95 114.19 2x0h s ARG 332 Ca 0.00 -1.19 -0.30 0.00 -0.47 0.00 0.00 55.73 53.76 2x0h s ARG 332 Cb 0.00 0.50 -0.04 0.00 -0.57 0.00 0.00 34.95 34.84 2x0h s ARG 332 CO 0.00 -0.68 1.11 -2.14 -1.08 0.00 0.00 175.30 172.51 2x0h s PRO 333 N -4.00 4.47 0.46 3.89 0.02 -1.26 -4.49 135.00 134.09 2x0h s PRO 333 Ca 0.20 1.63 -0.25 0.00 0.02 0.00 0.00 61.00 62.60 2x0h s PRO 333 Cb -0.02 -3.40 -0.08 0.00 0.02 0.00 0.00 34.50 31.02 2x0h s PRO 333 CO 0.09 -0.19 1.43 0.00 -0.33 0.00 0.00 177.00 178.00 2x0h s ALA 334 N 1.12 3.21 -0.58 -1.55 0.00 -1.22 -3.57 121.76 119.17 2x0h s ALA 334 Ca 0.56 1.47 -0.18 0.00 0.00 0.00 0.00 51.96 53.81 2x0h s ALA 334 Cb -0.26 -3.60 0.10 0.00 0.00 0.00 0.00 23.12 19.37 2x0h s ALA 334 CO 0.28 -1.24 0.66 -0.47 0.00 0.00 0.00 175.76 175.00 2x0h s TYR 335 N -1.20 3.04 0.05 0.00 5.04 -0.61 -1.25 117.35 122.43 2x0h s TYR 335 Ca 0.62 -0.98 -0.31 0.00 -2.44 0.00 0.00 57.07 53.97 2x0h s TYR 335 Cb -0.44 -3.93 -0.06 0.00 0.35 0.00 0.00 41.96 37.88 2x0h s TYR 335 CO 0.56 -1.23 1.33 0.42 -1.34 0.00 0.00 175.55 175.29 2x0h s ILE 336 N 2.51 3.70 -0.44 3.14 -1.09 -0.14 -2.22 121.20 126.66 2x0h s ILE 336 Ca 0.10 1.18 -0.10 0.00 -2.23 0.00 0.00 60.65 59.60 2x0h s ILE 336 Cb -0.25 -3.75 0.09 0.00 -1.58 0.00 0.00 42.46 36.97 2x0h s ILE 336 CO 0.06 0.06 0.30 0.86 -1.23 0.00 0.00 174.94 174.99 2x0h s TRP 337 N 1.56 3.35 -0.34 3.97 -0.11 0.20 -0.67 118.94 126.89 2x0h s TRP 337 Ca 0.62 -1.54 -0.18 0.00 1.22 0.00 0.00 56.10 56.22 2x0h s TRP 337 Cb -0.32 -3.12 -0.01 0.00 -1.50 0.00 0.00 33.47 28.52 2x0h s TRP 337 CO 0.28 -0.88 0.50 -0.46 -4.62 0.00 0.00 176.95 171.77 2x0h s TRP 338 N 1.44 3.19 -1.46 5.86 -0.00 -0.12 -3.90 118.94 123.96 2x0h s TRP 338 Ca 0.04 0.23 -0.11 0.00 -0.00 0.00 0.00 56.10 56.25 2x0h s TRP 338 Cb -0.24 -2.88 0.04 0.00 -0.00 0.00 0.00 33.47 30.39 2x0h s TRP 338 CO 0.02 -0.49 2.38 0.09 -0.00 0.00 0.00 176.95 178.95 2x0h n ASN 339 N 5.69 5.88 -3.64 5.86 3.02 -1.26 -1.74 115.26 129.06 2x0h n ASN 339 Ca -0.05 -2.85 -0.10 0.00 -0.03 0.00 0.00 54.58 51.56 2x0h n ASN 339 Cb 0.49 -1.57 -0.07 0.00 -0.61 0.00 0.00 39.78 38.02 2x0h n ASN 339 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2x0h s PHE 340 N 1.94 -0.82 -0.42 3.10 5.36 -1.20 -4.48 117.98 121.46 2x0h s PHE 340 Ca 0.53 1.80 0.07 0.00 -0.96 0.00 0.00 56.93 58.36 2x0h s PHE 340 Cb 0.15 0.42 0.50 0.00 -0.34 0.00 0.00 43.02 43.75 2x0h s PHE 340 CO -0.06 -0.40 1.44 -0.35 -1.46 0.00 0.00 175.22 174.38 2x0h n PRO 341 N 3.30 2.87 -1.46 10.12 -0.04 -0.96 -4.10 135.00 144.73 2x0h n PRO 341 Ca -0.16 -2.04 -0.53 0.00 -0.04 0.00 0.00 63.50 60.73 2x0h n PRO 341 Cb 0.57 -1.91 -0.05 0.00 -0.04 0.00 0.00 33.50 32.06 2x0h n PRO 341 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2x0h n VAL 342 N 0.01 1.04 -1.78 0.52 3.14 0.23 -4.02 118.33 117.48 2x0h n VAL 342 Ca 0.27 -0.26 0.04 0.00 -2.96 0.00 0.00 64.34 61.43 2x0h n VAL 342 Cb 1.04 -0.06 0.05 0.00 -1.06 0.00 0.00 33.84 33.81 2x0h n VAL 342 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2x0h n SER 343 N 1.77 0.89 0.00 6.55 3.41 -1.26 -4.85 113.62 120.13 2x0h n SER 343 Ca 0.19 -2.43 0.10 0.00 -0.26 0.00 0.00 58.87 56.47 2x0h n SER 343 Cb 0.17 -0.30 0.56 0.00 -0.26 0.00 0.00 64.21 64.39 2x0h n SER 343 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2x0h n ASP 344 N -0.41 0.00 -0.36 4.04 5.68 -1.26 -0.94 116.55 123.29 2x0h n ASP 344 Ca 0.06 -0.34 0.06 0.00 -0.50 0.00 0.00 54.79 54.07 2x0h n ASP 344 Cb 0.74 -0.13 0.02 0.00 -1.14 0.00 0.00 41.12 40.61 2x0h n ASP 344 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2x0h n TYR 345 N -1.13 0.00 -3.11 2.11 4.11 -1.26 -4.63 117.16 113.25 2x0h n TYR 345 Ca 0.13 0.00 -0.17 0.00 -0.00 0.00 0.00 57.90 57.85 2x0h n TYR 345 Cb 0.11 0.00 -0.02 0.00 -0.00 0.00 0.00 39.34 39.43 2x0h n TYR 345 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 2x0h n VAL 346 N 0.19 0.12 0.39 -3.48 0.24 -0.12 -4.95 118.33 110.72 2x0h n VAL 346 Ca 0.06 -4.45 0.06 0.00 -2.04 0.00 0.00 64.34 57.97 2x0h n VAL 346 Cb 0.27 -0.20 0.25 0.00 -1.47 0.00 0.00 33.84 32.68 2x0h n VAL 346 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2x0h n ARG 347 N 0.21 0.01 0.00 7.34 1.74 -0.97 -1.37 116.66 123.62 2x0h n ARG 347 Ca 0.23 0.31 0.14 0.00 -0.77 0.00 0.00 57.85 57.76 2x0h n ARG 347 Cb 0.67 -1.51 0.48 0.00 -1.02 0.00 0.00 32.46 31.08 2x0h n ARG 347 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2x0h n ASP 348 N -1.52 0.91 -4.50 0.55 5.68 -1.13 -4.86 116.55 111.67 2x0h n ASP 348 Ca 0.03 -0.90 -0.31 0.00 -0.50 0.00 0.00 54.79 53.11 2x0h n ASP 348 Cb 0.13 0.05 -0.12 0.00 -1.14 0.00 0.00 41.12 40.05 2x0h n ASP 348 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2x0h s HIS 349 N -2.40 2.65 0.02 2.11 3.76 -0.47 -0.59 115.29 120.36 2x0h s HIS 349 Ca 0.28 -0.20 -0.04 0.00 -0.15 0.00 0.00 55.06 54.95 2x0h s HIS 349 Cb 0.20 -1.48 -0.04 0.00 1.11 0.00 0.00 32.58 32.37 2x0h s HIS 349 CO 0.47 0.31 0.24 -0.51 -0.85 0.00 0.00 174.74 174.41 2x0h s LEU 350 N -1.61 4.36 -0.61 0.89 1.43 -1.26 -4.96 118.68 116.92 2x0h s LEU 350 Ca 0.16 0.45 0.02 0.00 -1.03 0.00 0.00 54.13 53.74 2x0h s LEU 350 Cb -0.11 -2.74 0.15 0.00 0.03 0.00 0.00 46.19 43.53 2x0h s LEU 350 CO 0.07 0.23 0.39 -0.76 0.23 0.00 0.00 176.35 176.51 2x0h s LEU 351 N -1.98 4.73 -0.04 1.79 1.43 -1.26 -4.14 118.68 119.21 2x0h s LEU 351 Ca 0.29 -3.18 0.10 0.00 -1.03 0.00 0.00 54.13 50.31 2x0h s LEU 351 Cb -0.13 -1.71 0.29 0.00 0.03 0.00 0.00 46.19 44.67 2x0h s LEU 351 CO 0.19 -0.23 1.23 0.18 0.23 0.00 0.00 176.35 177.95 2x0h n LEU 352 N 2.93 2.91 0.00 1.79 4.77 -0.07 -4.88 117.00 124.45 2x0h n LEU 352 Ca 0.10 -2.26 0.00 0.00 -0.03 0.00 0.00 56.01 53.82 2x0h n LEU 352 Cb 0.34 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2x0h n LEU 352 CO 0.33 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.68 2x0h n GLY 353 N 0.02 -2.04 3.93 -0.72 0.00 -1.26 -4.76 105.19 100.36 2x0h n GLY 353 Ca 0.12 -1.47 -0.25 0.00 0.00 0.00 0.00 46.02 44.41 2x0h n GLY 353 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2x0h s PRO 354 N -1.58 3.50 -0.24 1.61 0.04 -1.26 -4.69 135.00 132.38 2x0h s PRO 354 Ca 0.00 -0.09 -0.17 0.00 0.04 0.00 0.00 61.00 60.77 2x0h s PRO 354 Cb 0.00 -2.53 -0.03 0.00 0.04 0.00 0.00 34.50 31.98 2x0h s PRO 354 CO 0.00 -0.02 0.49 0.08 0.04 0.00 0.00 177.00 177.59 2x0h s VAL 355 N -2.52 5.10 0.24 -0.36 1.01 -1.26 -5.03 120.40 117.59 2x0h s VAL 355 Ca 0.43 0.85 -0.17 0.00 0.00 0.00 0.00 61.98 63.09 2x0h s VAL 355 Cb -0.10 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.49 2x0h s VAL 355 CO 0.40 0.14 0.57 -0.72 0.00 0.00 0.00 175.10 175.49 2x0h s TYR 356 N 2.00 0.04 0.00 5.22 -0.85 -1.26 -4.69 117.35 117.81 2x0h s TYR 356 Ca 0.21 -0.43 0.00 0.00 -0.52 0.00 0.00 57.07 56.33 2x0h s TYR 356 Cb -0.15 0.42 0.00 0.00 0.38 0.00 0.00 41.96 42.60 2x0h s TYR 356 CO 0.09 -1.05 0.00 0.41 -1.52 0.00 0.00 175.55 173.48 2x0h n GLY 357 N -0.40 2.77 3.75 5.49 0.00 -1.26 -4.98 105.19 110.56 2x0h n GLY 357 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 2x0h n GLY 357 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2x0h s ASN 358 N -1.43 7.16 0.41 1.61 0.01 -1.26 -4.34 114.94 117.09 2x0h s ASN 358 Ca 0.00 1.38 -0.26 0.00 -0.71 0.00 0.00 52.86 53.27 2x0h s ASN 358 Cb 0.00 -2.44 -0.09 0.00 0.41 0.00 0.00 41.25 39.13 2x0h s ASN 358 CO 0.00 0.05 1.35 -0.62 -1.51 0.00 0.00 177.10 176.37 2x0h s ASP 359 N -0.17 6.24 0.00 -1.22 -1.08 -0.32 -4.92 116.67 115.19 2x0h s ASP 359 Ca 0.36 2.76 0.20 0.00 -0.52 0.00 0.00 52.55 55.36 2x0h s ASP 359 Cb -0.20 -2.65 0.46 0.00 -1.46 0.00 0.00 42.92 39.08 2x0h s ASP 359 CO 0.22 -0.91 1.39 0.35 0.52 0.00 0.00 175.17 176.74 2x0h n THR 360 N 0.13 0.72 0.09 1.71 -2.24 -1.26 -4.37 114.28 109.05 2x0h n THR 360 Ca 0.03 -0.86 0.03 0.00 -2.27 0.00 0.00 64.05 60.99 2x0h n THR 360 Cb 0.43 0.76 0.05 0.00 -2.10 0.00 0.00 70.33 69.47 2x0h n THR 360 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2x0h n THR 361 N 1.35 0.47 -1.04 4.28 -2.24 -1.26 -3.57 114.28 112.28 2x0h n THR 361 Ca 0.19 -0.74 0.03 0.00 -2.27 0.00 0.00 64.05 61.27 2x0h n THR 361 Cb 0.57 0.83 0.30 0.00 -2.10 0.00 0.00 70.33 69.92 2x0h n THR 361 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2x0h n ILE 362 N 0.20 2.59 -0.34 2.28 -5.35 -1.26 -4.67 119.36 112.81 2x0h n ILE 362 Ca 0.05 -1.81 0.13 0.00 -0.27 0.00 0.00 62.75 60.85 2x0h n ILE 362 Cb 0.24 -0.29 0.34 0.00 -1.74 0.00 0.00 39.64 38.18 2x0h n ILE 362 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2x0h h ALA 363 N 2.42 1.73 0.00 -1.28 0.00 -1.89 -1.26 119.26 118.98 2x0h h ALA 363 Ca 0.09 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2x0h h ALA 363 Cb 1.82 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 2x0h h ALA 363 CO 0.43 -0.08 -0.12 0.87 0.00 0.00 0.00 179.25 180.35 2x0h h LYS 364 N 0.74 0.00 -0.00 0.00 1.57 -1.83 -2.71 116.57 114.34 2x0h h LYS 364 Ca 0.56 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.34 2x0h h LYS 364 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.21 2x0h h LYS 364 CO -0.35 0.12 -0.04 0.39 -0.57 0.00 0.00 179.45 179.00 2x0h n GLU 365 N -3.31 0.99 -4.73 3.15 -0.58 -0.48 -4.84 120.64 110.84 2x0h n GLU 365 Ca -0.00 -0.30 -0.25 0.00 -0.42 0.00 0.00 57.16 56.19 2x0h n GLU 365 Cb 0.35 -1.49 -0.16 0.00 -0.57 0.00 0.00 31.44 29.56 2x0h n GLU 365 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2x0h s MET 366 N -2.22 1.62 0.15 3.49 0.23 -1.02 -3.44 119.30 118.11 2x0h s MET 366 Ca 0.37 -0.54 0.05 0.00 -1.03 0.00 0.00 55.69 54.55 2x0h s MET 366 Cb 0.21 -1.42 -0.08 0.00 -1.53 0.00 0.00 34.83 32.02 2x0h s MET 366 CO 0.41 0.20 1.34 0.77 -2.03 0.00 0.00 175.02 175.71 2x0h h SER 367 N 6.33 0.11 -5.08 -1.18 0.02 -1.23 -3.42 113.55 109.11 2x0h h SER 367 Ca -0.32 -0.11 0.02 0.00 -0.84 0.00 0.00 61.79 60.53 2x0h h SER 367 Cb 1.17 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.63 2x0h h SER 367 CO 0.48 0.98 0.14 -0.83 -1.14 0.00 0.00 176.83 176.46 2x0h s GLY 368 N -4.61 0.18 -0.20 -3.77 0.00 -1.25 -3.21 107.32 94.47 2x0h s GLY 368 Ca -0.01 -0.55 -0.05 0.00 0.00 0.00 0.00 44.72 44.11 2x0h s GLY 368 CO 0.82 -0.28 0.35 -0.12 0.00 0.00 0.00 173.10 173.87 2x0h s PHE 369 N -3.68 -0.66 0.18 1.90 5.36 -0.37 -0.97 117.98 119.73 2x0h s PHE 369 Ca 0.15 1.03 0.09 0.00 -0.96 0.00 0.00 56.93 57.24 2x0h s PHE 369 Cb -0.04 0.06 -0.04 0.00 -0.34 0.00 0.00 43.02 42.65 2x0h s PHE 369 CO 0.09 -0.54 -0.18 0.14 -1.46 0.00 0.00 175.22 173.26 2x0h s VAL 370 N 2.52 1.89 -0.18 3.12 -7.23 0.15 -2.26 120.40 118.41 2x0h s VAL 370 Ca 0.05 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 2x0h s VAL 370 Cb -0.14 -1.91 0.01 0.00 0.56 0.00 0.00 36.38 34.91 2x0h s VAL 370 CO -0.13 -0.33 -0.17 0.28 -0.31 0.00 0.00 175.10 174.44 2x0h s THR 371 N -2.12 2.30 -0.28 5.32 -1.32 0.33 -0.94 115.64 118.93 2x0h s THR 371 Ca 0.17 -0.86 -0.29 0.00 -1.21 0.00 0.00 61.69 59.50 2x0h s THR 371 Cb -0.05 -1.98 0.00 0.00 -1.51 0.00 0.00 72.50 68.96 2x0h s THR 371 CO 0.07 0.52 1.21 0.21 -2.21 0.00 0.00 174.62 174.42 2x0h s ASN 372 N 1.28 6.82 0.55 8.08 2.47 -0.71 -3.14 114.94 130.28 2x0h s ASN 372 Ca 0.04 1.25 0.09 0.00 0.42 0.00 0.00 52.86 54.65 2x0h s ASN 372 Cb -0.13 -2.54 0.09 0.00 -1.45 0.00 0.00 41.25 37.21 2x0h s ASN 372 CO -0.10 -0.95 0.71 -0.81 -3.72 0.00 0.00 177.10 172.24 2x0h n PRO 373 N 7.01 0.64 -1.73 0.43 -0.04 -1.26 -0.60 135.00 139.45 2x0h n PRO 373 Ca 0.14 -3.01 -0.30 0.00 -0.04 0.00 0.00 63.50 60.28 2x0h n PRO 373 Cb 0.46 -0.15 0.05 0.00 -0.04 0.00 0.00 33.50 33.83 2x0h n PRO 373 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2x0h s MET 374 N -4.45 2.79 0.50 0.54 -1.94 -1.26 -3.77 119.30 111.71 2x0h s MET 374 Ca 0.54 0.66 0.34 0.00 -1.71 0.00 0.00 55.69 55.52 2x0h s MET 374 Cb -0.04 -2.00 1.81 0.00 2.01 0.00 0.00 34.83 36.61 2x0h s MET 374 CO 0.34 -1.13 2.04 1.05 -0.01 0.00 0.00 175.02 177.31 2x0h h GLU 375 N -0.73 0.00 -5.74 2.03 4.11 -1.91 -3.37 114.58 108.98 2x0h h GLU 375 Ca -0.45 0.00 -0.61 0.00 0.07 0.00 0.00 59.36 58.37 2x0h h GLU 375 Cb 1.24 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.36 2x0h h GLU 375 CO 0.61 0.00 0.64 -1.01 0.07 0.00 0.00 179.01 179.32 2x0h s HIS 376 N -3.85 2.64 -0.01 2.06 3.76 -1.26 -4.72 115.29 113.92 2x0h s HIS 376 Ca -0.03 -0.30 -0.25 0.00 -0.15 0.00 0.00 55.06 54.33 2x0h s HIS 376 Cb 0.10 -4.29 -0.19 0.00 1.11 0.00 0.00 32.58 29.31 2x0h s HIS 376 CO 0.33 -1.64 1.32 0.00 -0.85 0.00 0.00 174.74 173.90 2x0h h ALA 377 N 9.57 -0.04 -0.28 -1.40 0.00 -1.98 -2.38 119.26 122.76 2x0h h ALA 377 Ca -0.28 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 2x0h h ALA 377 Cb 1.07 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2x0h h ALA 377 CO 1.17 -0.31 0.06 0.93 0.00 0.00 0.00 179.25 181.09 2x0h h GLU 378 N -0.45 0.46 -0.83 0.00 4.39 -1.92 -2.92 114.58 113.31 2x0h h GLU 378 Ca -0.00 -0.12 0.16 0.00 0.34 0.00 0.00 59.36 59.74 2x0h h GLU 378 Cb 0.42 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.96 2x0h h GLU 378 CO 0.01 0.55 0.54 0.77 -1.16 0.00 0.00 179.01 179.73 2x0h h SER 379 N 0.28 0.48 0.47 1.42 0.02 -1.89 0.43 113.55 114.77 2x0h h SER 379 Ca 0.09 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2x0h h SER 379 Cb 0.31 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2x0h h SER 379 CO 0.00 0.24 0.00 0.28 -1.14 0.00 0.00 176.83 176.21 2x0h h SER 380 N 0.51 0.00 0.21 3.07 0.02 -1.22 -3.23 113.55 112.91 2x0h h SER 380 Ca 0.41 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.35 2x0h h SER 380 Cb 0.86 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.40 2x0h h SER 380 CO -0.16 0.00 -0.09 0.11 -1.14 0.00 0.00 176.83 175.55 2x0h h LYS 381 N 0.00 0.00 0.31 3.45 1.57 -0.91 -0.84 116.57 120.15 2x0h h LYS 381 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2x0h h LYS 381 Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 2x0h h LYS 381 CO 0.00 0.09 -0.19 0.82 -0.57 0.00 0.00 179.45 179.60 2x0h h ILE 382 N 0.00 0.60 -0.52 1.86 2.04 -1.76 -0.29 117.51 119.46 2x0h h ILE 382 Ca -0.00 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 2x0h h ILE 382 Cb 0.22 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 2x0h h ILE 382 CO 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 178.15 178.09 2x0h h ALA 383 N 0.19 0.89 -0.02 1.87 0.00 -1.67 -2.79 119.26 117.73 2x0h h ALA 383 Ca -0.03 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 2x0h h ALA 383 Cb 0.40 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2x0h h ALA 383 CO 0.04 0.64 0.01 0.82 0.00 0.00 0.00 179.25 180.75 2x0h h ILE 384 N 0.84 1.18 -0.96 0.00 2.04 -1.06 0.46 117.51 120.01 2x0h h ILE 384 Ca 0.14 -0.54 0.03 0.00 1.00 0.00 0.00 64.86 65.49 2x0h h ILE 384 Cb 0.60 1.51 -0.05 0.00 -0.74 0.00 0.00 36.82 38.14 2x0h h ILE 384 CO 0.04 0.14 0.63 0.22 0.00 0.00 0.00 178.15 179.18 2x0h h TYR 385 N -0.18 1.18 -0.31 1.37 3.20 -1.11 -0.68 116.97 120.43 2x0h h TYR 385 Ca 0.01 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.84 2x0h h TYR 385 Cb 0.23 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 2x0h h TYR 385 CO 0.00 0.70 -0.06 0.77 -1.64 0.00 0.00 178.16 177.93 2x0h h SER 386 N 1.23 0.59 -0.85 -2.11 0.02 -1.08 -2.68 113.55 108.68 2x0h h SER 386 Ca 0.37 -0.35 0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2x0h h SER 386 Cb -0.03 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.30 2x0h h SER 386 CO -0.11 0.81 0.55 0.58 -1.14 0.00 0.00 176.83 177.52 2x0h h VAL 387 N 0.37 1.15 -0.99 2.27 2.07 0.33 0.24 116.25 121.68 2x0h h VAL 387 Ca 0.08 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.28 2x0h h VAL 387 Cb 0.54 -0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.23 2x0h h VAL 387 CO 0.03 0.20 0.65 0.00 0.02 0.00 0.00 177.57 178.46 2x0h h ALA 388 N 1.35 1.38 -0.09 1.67 0.00 -1.08 0.76 119.26 123.25 2x0h h ALA 388 Ca 0.33 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 2x0h h ALA 388 Cb -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.44 2x0h h ALA 388 CO -0.11 0.51 -0.22 1.03 0.00 0.00 0.00 179.25 180.46 2x0h h SER 389 N 1.22 0.34 -0.30 0.00 0.87 -1.05 -2.42 113.55 112.21 2x0h h SER 389 Ca 0.41 -0.59 0.02 0.00 -1.23 0.00 0.00 61.79 60.40 2x0h h SER 389 Cb 0.07 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 2x0h h SER 389 CO -0.14 0.87 0.14 0.22 -0.53 0.00 0.00 176.83 177.40 2x0h h TYR 390 N -0.17 0.26 0.00 2.24 3.20 -0.49 -1.77 116.97 120.24 2x0h h TYR 390 Ca -0.00 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.76 2x0h h TYR 390 Cb 0.83 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.01 2x0h h TYR 390 CO 0.12 0.14 -0.55 0.00 -1.64 0.00 0.00 178.16 176.23 2x0h h ALA 391 N 1.16 0.79 0.00 1.82 0.00 -0.86 -0.52 119.26 121.65 2x0h h ALA 391 Ca 0.12 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.46 2x0h h ALA 391 Cb 0.05 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.75 2x0h h ALA 391 CO -0.09 0.69 -0.27 2.35 0.00 0.00 0.00 179.25 181.93 2x0h h TRP 392 N 0.00 0.27 -2.11 0.00 2.91 -1.36 -2.93 115.95 112.73 2x0h h TRP 392 Ca -0.01 -0.15 -0.57 0.00 1.13 0.00 0.00 58.89 59.29 2x0h h TRP 392 Cb 1.21 -0.03 -0.40 0.00 -0.51 0.00 0.00 29.16 29.44 2x0h h TRP 392 CO 0.00 0.96 -0.96 -1.71 -1.03 0.00 0.00 178.44 175.70 2x0h n ASN 393 N -4.48 1.04 0.02 2.65 2.85 -0.67 -1.09 115.26 115.57 2x0h n ASN 393 Ca -0.10 -2.85 0.06 0.00 -0.11 0.00 0.00 54.58 51.58 2x0h n ASN 393 Cb 0.52 -0.64 0.48 0.00 1.24 0.00 0.00 39.78 41.38 2x0h n ASN 393 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2x0h h PRO 394 N 4.23 0.42 0.00 1.20 0.13 -1.29 -2.29 132.00 134.41 2x0h h PRO 394 Ca 0.12 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 2x0h h PRO 394 Cb 0.83 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.86 2x0h h PRO 394 CO 0.55 0.28 -0.05 0.00 -0.23 0.00 0.00 178.00 178.55 2x0h h ALA 395 N 1.77 1.67 -0.39 -0.56 0.00 -1.86 -1.99 119.26 117.91 2x0h h ALA 395 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2x0h h ALA 395 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2x0h h ALA 395 CO -0.04 0.06 0.00 1.63 0.00 0.00 0.00 179.25 180.90 2x0h n LYS 396 N -4.12 2.89 -1.83 0.00 4.76 -0.89 -5.02 118.16 113.95 2x0h n LYS 396 Ca -0.03 -2.21 -0.42 0.00 -2.87 0.00 0.00 58.31 52.78 2x0h n LYS 396 Cb 0.13 -1.37 -0.03 0.00 -1.84 0.00 0.00 35.03 31.92 2x0h n LYS 396 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 2x0h s TYR 397 N -1.19 2.11 -0.32 2.13 5.04 -0.75 -4.96 117.35 119.41 2x0h s TYR 397 Ca 0.28 0.08 0.02 0.00 -2.44 0.00 0.00 57.07 55.02 2x0h s TYR 397 Cb 0.16 -4.07 0.08 0.00 0.35 0.00 0.00 41.96 38.49 2x0h s TYR 397 CO 0.17 -4.42 0.02 0.34 -1.34 0.00 0.00 175.55 170.32 2x0h s ASP 398 N 2.92 4.77 0.13 4.32 -1.08 -1.26 -5.02 116.67 121.45 2x0h s ASP 398 Ca 0.78 -1.82 -0.28 0.00 -0.52 0.00 0.00 52.55 50.72 2x0h s ASP 398 Cb -0.41 -1.65 -0.05 0.00 -1.46 0.00 0.00 42.92 39.35 2x0h s ASP 398 CO 0.35 -0.34 1.60 0.74 0.52 0.00 0.00 175.17 178.04 2x0h h THR 399 N 6.60 0.23 -0.11 1.71 2.02 -1.93 -2.40 112.91 119.04 2x0h h THR 399 Ca -0.12 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.00 2x0h h THR 399 Cb 1.03 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2x0h h THR 399 CO 0.53 0.00 -0.20 -0.50 0.37 0.00 0.00 175.52 175.72 2x0h h TRP 400 N -0.47 0.40 -0.81 3.16 4.06 -1.95 -2.32 115.95 118.02 2x0h h TRP 400 Ca 0.07 -0.14 -0.02 0.00 2.06 0.00 0.00 58.89 60.85 2x0h h TRP 400 Cb 0.59 -0.08 -0.04 0.00 -1.00 0.00 0.00 29.16 28.64 2x0h h TRP 400 CO -0.41 0.81 0.40 0.37 -3.56 0.00 0.00 178.44 176.05 2x0h h GLN 401 N -0.11 1.14 -0.33 0.49 5.75 -1.99 -1.75 115.11 118.31 2x0h h GLN 401 Ca 0.01 -0.15 -0.13 0.00 -0.15 0.00 0.00 58.65 58.22 2x0h h GLN 401 Cb 0.78 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 29.11 2x0h h GLN 401 CO 0.04 0.87 -0.32 1.15 -2.65 0.00 0.00 178.83 177.92 2x0h h THR 402 N 1.14 1.28 -0.23 2.39 2.02 -1.42 0.18 112.91 118.27 2x0h h THR 402 Ca 0.28 -1.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.00 2x0h h THR 402 Cb 0.09 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 2x0h h THR 402 CO -0.04 0.47 0.12 -0.25 0.37 0.00 0.00 175.52 176.20 2x0h h TRP 403 N 0.60 0.32 -0.31 3.16 7.01 -1.14 0.19 115.95 125.77 2x0h h TRP 403 Ca 0.07 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.05 2x0h h TRP 403 Cb 0.83 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.78 2x0h h TRP 403 CO 0.04 0.29 0.18 0.87 -2.79 0.00 0.00 178.44 177.03 2x0h h LYS 404 N 0.26 0.43 -0.90 2.65 1.57 -1.15 -1.90 116.57 117.53 2x0h h LYS 404 Ca 0.08 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2x0h h LYS 404 Cb 0.08 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.26 2x0h h LYS 404 CO -0.01 0.35 0.49 -0.44 -0.57 0.00 0.00 179.45 179.26 2x0h h ASP 405 N 0.39 1.13 0.12 0.86 3.32 -0.50 -1.70 116.42 120.04 2x0h h ASP 405 Ca 0.11 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2x0h h ASP 405 Cb 0.04 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 2x0h h ASP 405 CO -0.02 0.91 -0.12 0.00 -1.72 0.00 0.00 179.24 178.29 2x0h h ALA 406 N 1.27 -0.24 -0.72 3.45 0.00 -0.41 -0.98 119.26 121.63 2x0h h ALA 406 Ca 0.32 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.21 2x0h h ALA 406 Cb 0.04 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2x0h h ALA 406 CO -0.05 -0.65 0.46 0.82 0.00 0.00 0.00 179.25 179.83 2x0h h ILE 407 N -0.27 1.14 0.00 0.00 2.04 -1.19 0.70 117.51 119.94 2x0h h ILE 407 Ca 0.01 -0.32 -0.06 0.00 1.00 0.00 0.00 64.86 65.49 2x0h h ILE 407 Cb 0.26 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 2x0h h ILE 407 CO -0.03 0.17 -0.28 -0.09 0.00 0.00 0.00 178.15 177.92 2x0h h ARG 408 N 0.93 0.00 0.17 2.37 2.43 -1.18 0.11 114.38 119.22 2x0h h ARG 408 Ca 0.28 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 59.14 2x0h h ARG 408 Cb -0.05 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.53 2x0h h ARG 408 CO -0.08 0.28 -1.33 1.15 -1.51 0.00 0.00 179.97 178.48 2x0h h THR 409 N 0.00 1.34 -0.14 0.20 2.02 -0.15 -3.04 112.91 113.14 2x0h h THR 409 Ca -0.00 -2.70 -0.19 0.00 0.77 0.00 0.00 66.41 64.28 2x0h h THR 409 Cb 0.66 2.88 0.00 0.00 -1.74 0.00 0.00 68.15 69.96 2x0h h THR 409 CO 0.04 0.81 -0.70 0.40 0.37 0.00 0.00 175.52 176.44 2x0h h ILE 410 N 0.17 1.33 -1.85 3.11 2.04 -0.60 -3.39 117.51 118.32 2x0h h ILE 410 Ca -0.20 -1.99 -0.52 0.00 1.00 0.00 0.00 64.86 63.15 2x0h h ILE 410 Cb 2.02 1.97 -0.37 0.00 -0.74 0.00 0.00 36.82 39.69 2x0h h ILE 410 CO 0.24 0.62 -1.08 -0.11 0.00 0.00 0.00 178.15 177.82 2x0h n LEU 411 N -3.90 0.09 0.13 1.44 7.94 0.37 -4.85 117.00 118.22 2x0h n LEU 411 Ca -0.05 -4.66 0.12 0.00 -1.11 0.00 0.00 56.01 50.31 2x0h n LEU 411 Cb 0.69 0.67 0.63 0.00 0.53 0.00 0.00 43.42 45.95 2x0h n LEU 411 CO 0.50 2.11 1.12 -0.65 -1.11 0.00 0.00 177.39 179.36 2x0h h PRO 412 N 3.78 0.06 0.00 1.96 0.11 -1.74 -0.65 132.00 135.52 2x0h h PRO 412 Ca 0.06 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 2x0h h PRO 412 Cb 0.91 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 2x0h h PRO 412 CO 0.46 0.04 -0.05 0.66 -0.21 0.00 0.00 178.00 178.90 2x0h h SER 413 N 0.06 0.00 -0.58 -2.05 4.64 -1.93 -3.31 113.55 110.38 2x0h h SER 413 Ca 0.11 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.15 2x0h h SER 413 Cb 0.38 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.14 2x0h h SER 413 CO -0.01 0.05 -0.92 0.00 -0.87 0.00 0.00 176.83 175.08 2x0h n ALA 414 N -2.12 2.73 -0.05 5.18 0.00 -0.35 -4.96 120.51 120.94 2x0h n ALA 414 Ca 0.01 -2.47 -0.11 0.00 0.00 0.00 0.00 53.44 50.88 2x0h n ALA 414 Cb 0.39 -0.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.86 2x0h n ALA 414 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x0h h ALA 415 N 2.53 0.25 -0.88 0.00 0.00 -1.38 -1.81 119.26 117.97 2x0h h ALA 415 Ca -0.18 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.67 2x0h h ALA 415 Cb 1.23 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 2x0h h ALA 415 CO 0.25 -0.16 0.56 0.93 0.00 0.00 0.00 179.25 180.83 2x0h h GLU 416 N 0.16 1.04 -0.67 0.00 4.39 -1.91 -0.40 114.58 117.18 2x0h h GLU 416 Ca 0.06 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2x0h h GLU 416 Cb 0.17 -0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 28.56 2x0h h GLU 416 CO -0.01 0.69 0.28 0.93 -1.16 0.00 0.00 179.01 179.74 2x0h h GLU 417 N 1.07 0.99 -0.73 2.33 3.07 -1.88 -1.38 114.58 118.04 2x0h h GLU 417 Ca 0.36 -0.17 -0.06 0.00 -0.50 0.00 0.00 59.36 58.99 2x0h h GLU 417 Cb 0.06 -0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 27.77 2x0h h GLU 417 CO -0.14 0.81 0.22 1.25 -1.40 0.00 0.00 179.01 179.76 2x0h h LEU 418 N 0.94 1.07 -0.57 1.33 5.85 -0.79 -1.07 115.31 122.07 2x0h h LEU 418 Ca 0.22 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 2x0h h LEU 418 Cb 0.18 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2x0h h LEU 418 CO -0.02 1.00 0.35 -0.33 -0.34 0.00 0.00 178.44 179.10 2x0h h GLU 419 N 1.09 0.77 -0.01 1.25 5.08 -0.94 0.18 114.58 121.98 2x0h h GLU 419 Ca 0.24 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2x0h h GLU 419 Cb 0.31 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2x0h h GLU 419 CO -0.01 0.54 -0.01 0.00 -1.00 0.00 0.00 179.01 178.54 2x0h h PHE 421 N -0.00 0.40 -0.53 0.00 3.57 -0.99 -3.15 116.94 116.23 2x0h h PHE 421 Ca 0.01 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.40 2x0h h PHE 421 Cb 0.01 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 2x0h h PHE 421 CO -0.09 0.28 -0.09 0.00 -2.23 0.00 0.00 178.31 176.18 2x0h h ALA 422 N 1.08 0.83 -0.89 2.41 0.00 -0.48 -2.66 119.26 119.55 2x0h h ALA 422 Ca 0.11 -0.34 0.22 0.00 0.00 0.00 0.00 54.91 54.91 2x0h h ALA 422 Cb -0.00 -0.20 -0.16 0.00 0.00 0.00 0.00 17.79 17.43 2x0h h ALA 422 CO -0.02 0.66 0.02 0.52 0.00 0.00 0.00 179.25 180.42 2x0h h MET 423 N 0.88 0.06 -0.50 0.00 2.86 -0.86 -2.02 114.93 115.34 2x0h h MET 423 Ca 0.14 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 2x0h h MET 423 Cb 0.64 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.29 2x0h h MET 423 CO 0.04 0.04 0.00 0.72 1.06 0.00 0.00 176.91 178.77 2x0h n HIS 424 N -5.42 1.31 -3.15 -0.22 8.25 -1.07 -2.84 115.22 112.07 2x0h n HIS 424 Ca 0.19 -0.68 -0.20 0.00 -0.26 0.00 0.00 57.72 56.77 2x0h n HIS 424 Cb 0.62 -0.27 -0.04 0.00 1.12 0.00 0.00 29.99 31.42 2x0h n HIS 424 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2x0h n ASN 425 N 0.57 1.42 0.00 0.41 3.02 -0.76 -1.50 115.26 118.42 2x0h n ASN 425 Ca 0.23 -3.10 0.00 0.00 -0.03 0.00 0.00 54.58 51.68 2x0h n ASN 425 Cb 0.88 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 2x0h n ASN 425 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2x0h n SER 426 N 0.29 3.23 -4.81 6.41 3.41 -1.25 -0.89 113.62 120.00 2x0h n SER 426 Ca 0.26 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.53 2x0h n SER 426 Cb 0.60 0.52 -0.07 0.00 -0.26 0.00 0.00 64.21 65.01 2x0h n SER 426 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2x0h s ASP 427 N -1.67 7.00 0.26 4.04 2.15 -1.26 -4.59 116.67 122.60 2x0h s ASP 427 Ca 0.00 1.68 0.25 0.00 0.43 0.00 0.00 52.55 54.91 2x0h s ASP 427 Cb 0.00 -2.53 0.52 0.00 -0.30 0.00 0.00 42.92 40.60 2x0h s ASP 427 CO 0.00 -0.29 1.58 -0.07 -0.17 0.00 0.00 175.17 176.22 2x0h h LEU 428 N 2.19 0.00 -0.13 -1.34 4.07 -1.85 -3.46 115.31 114.79 2x0h h LEU 428 Ca -0.48 -0.04 0.13 0.00 0.08 0.00 0.00 57.88 57.57 2x0h h LEU 428 Cb 1.18 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.88 2x0h h LEU 428 CO 0.62 0.02 -0.25 0.61 -1.08 0.00 0.00 178.44 178.36 2x0h n GLY 429 N 1.24 -1.88 3.70 0.83 0.00 -1.26 -4.86 105.19 102.97 2x0h n GLY 429 Ca 0.04 -1.38 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 2x0h n GLY 429 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2x0h n PRO 430 N -2.68 1.67 -3.51 1.61 -0.02 -1.26 -4.91 135.00 125.91 2x0h n PRO 430 Ca -0.01 0.61 -0.10 0.00 -2.02 0.00 0.00 63.50 61.98 2x0h n PRO 430 Cb 0.23 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.29 2x0h n PRO 430 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2x0h s ASN 431 N -0.77 -0.46 0.51 2.55 2.20 -1.26 -5.05 114.94 112.65 2x0h s ASN 431 Ca 0.67 -0.09 0.25 0.00 -0.94 0.00 0.00 52.86 52.75 2x0h s ASN 431 Cb -0.46 0.55 1.36 0.00 -2.00 0.00 0.00 41.25 40.69 2x0h s ASN 431 CO 0.53 -0.91 2.05 1.23 -2.94 0.00 0.00 177.10 177.07 2x0h h GLY 432 N 2.00 0.00 1.76 0.45 0.00 -1.94 0.05 103.07 105.40 2x0h h GLY 432 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2x0h h GLY 432 CO 0.34 0.00 -0.10 1.42 0.00 0.00 0.00 176.54 178.20 2x0h n HIS 433 N -3.74 0.00 -1.53 5.60 8.25 -1.26 -4.94 115.22 117.60 2x0h n HIS 433 Ca -0.02 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.28 2x0h n HIS 433 Cb 0.25 -0.44 -0.07 0.00 1.12 0.00 0.00 29.99 30.85 2x0h n HIS 433 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x0h n GLY 434 N 1.49 1.54 3.63 -1.41 0.00 0.00 -4.92 105.19 105.53 2x0h n GLY 434 Ca 0.07 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 2x0h n GLY 434 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2x0h s TYR 435 N -2.63 3.28 0.23 1.61 5.04 -1.26 -5.00 117.35 118.62 2x0h s TYR 435 Ca 0.00 0.17 0.09 0.00 -2.44 0.00 0.00 57.07 54.89 2x0h s TYR 435 Cb 0.00 -2.29 -0.05 0.00 0.35 0.00 0.00 41.96 39.97 2x0h s TYR 435 CO 0.00 -0.00 -0.16 1.03 -1.34 0.00 0.00 175.55 175.08 2x0h s ARG 436 N 1.22 1.44 0.07 4.97 1.81 -1.26 -4.63 118.95 122.58 2x0h s ARG 436 Ca 0.07 -1.64 0.04 0.00 -1.72 0.00 0.00 55.73 52.48 2x0h s ARG 436 Cb -0.14 -1.34 -0.03 0.00 -0.45 0.00 0.00 34.95 32.99 2x0h s ARG 436 CO 0.06 0.24 -0.11 1.03 -0.68 0.00 0.00 175.30 175.83 2x0h s ARG 437 N -3.56 0.77 0.61 3.54 1.81 -1.26 -4.97 118.95 115.89 2x0h s ARG 437 Ca 0.25 -0.99 -0.18 0.00 -1.72 0.00 0.00 55.73 53.09 2x0h s ARG 437 Cb -0.02 -0.61 -0.03 0.00 -0.45 0.00 0.00 34.95 33.84 2x0h s ARG 437 CO 0.09 0.12 1.22 -1.21 -0.68 0.00 0.00 175.30 174.84 2x0h s GLU 438 N -2.08 2.86 -0.20 3.54 2.02 -1.26 -4.30 118.70 119.28 2x0h s GLU 438 Ca -0.01 1.85 -0.18 0.00 0.02 0.00 0.00 54.97 56.65 2x0h s GLU 438 Cb -0.08 -1.91 0.05 0.00 0.10 0.00 0.00 34.13 32.30 2x0h s GLU 438 CO 0.01 -1.30 0.54 -2.00 0.02 0.00 0.00 175.26 172.53 2x0h s GLU 439 N -3.38 0.62 -1.46 1.61 2.12 -1.26 -4.28 118.70 112.67 2x0h s GLU 439 Ca 0.78 0.77 -0.08 0.00 0.36 0.00 0.00 54.97 56.80 2x0h s GLU 439 Cb -0.31 0.29 0.02 0.00 0.26 0.00 0.00 34.13 34.39 2x0h s GLU 439 CO 0.35 -0.08 0.89 0.43 -0.54 0.00 0.00 175.26 176.30 2x0h n SER 440 N 2.88 -6.01 0.04 -1.70 7.64 -1.13 -4.75 113.62 110.60 2x0h n SER 440 Ca -0.14 -0.45 -0.06 0.00 1.01 0.00 0.00 58.87 59.24 2x0h n SER 440 Cb 0.56 -4.80 0.13 0.00 -1.01 0.00 0.00 64.21 59.10 2x0h n SER 440 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2x0h h MET 441 N -2.00 0.40 -0.88 1.43 2.86 -1.93 -2.35 114.93 112.45 2x0h h MET 441 Ca -0.55 -0.22 0.01 0.00 -2.06 0.00 0.00 59.70 56.88 2x0h h MET 441 Cb 1.37 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 33.00 2x0h h MET 441 CO 0.57 0.79 0.58 -0.44 1.06 0.00 0.00 176.91 179.48 2x0h h ASP 442 N 0.32 1.02 0.26 1.22 3.32 -1.99 -3.04 116.42 117.53 2x0h h ASP 442 Ca 0.02 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2x0h h ASP 442 Cb 0.96 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.26 2x0h h ASP 442 CO 0.08 0.74 -1.03 2.30 -1.72 0.00 0.00 179.24 179.61 2x0h n ILE 443 N -4.46 0.08 -0.31 0.35 -5.35 -1.16 -4.32 119.36 104.18 2x0h n ILE 443 Ca 0.10 -0.15 0.13 0.00 -0.27 0.00 0.00 62.75 62.56 2x0h n ILE 443 Cb 0.02 0.45 0.31 0.00 -1.74 0.00 0.00 39.64 38.68 2x0h n ILE 443 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 2x0h h GLN 444 N 0.00 0.46 -0.33 6.28 4.15 -1.30 0.19 115.11 124.56 2x0h h GLN 444 Ca 0.00 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 2x0h h GLN 444 Cb 0.65 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.22 2x0h h GLN 444 CO 0.00 0.30 0.14 -1.35 -1.93 0.00 0.00 178.83 176.00 2x0h h PRO 445 N 0.47 0.49 -0.39 -2.39 0.11 -1.75 0.21 132.00 128.75 2x0h h PRO 445 Ca 0.57 -0.08 -0.04 0.00 0.11 0.00 0.00 66.00 66.56 2x0h h PRO 445 Cb 1.04 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 2x0h h PRO 445 CO -0.49 0.47 0.08 0.00 -0.21 0.00 0.00 178.00 177.85 2x0h h ALA 446 N 0.99 1.42 0.79 -0.75 0.00 -1.66 -2.17 119.26 117.87 2x0h h ALA 446 Ca 0.11 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2x0h h ALA 446 Cb 0.16 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2x0h h ALA 446 CO -0.01 0.42 -0.38 0.00 0.00 0.00 0.00 179.25 179.28 2x0h h ALA 447 N 1.53 -1.10 0.00 0.00 0.00 -0.57 -1.88 119.26 117.24 2x0h h ALA 447 Ca 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2x0h h ALA 447 Cb 0.24 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2x0h h ALA 447 CO -0.00 -1.02 -0.05 1.49 0.00 0.00 0.00 179.25 179.67 2x0h h GLU 448 N -1.24 0.00 0.02 0.00 4.81 -0.91 -1.58 114.58 115.68 2x0h h GLU 448 Ca -0.11 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 58.91 2x0h h GLU 448 Cb 0.82 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.18 2x0h h GLU 448 CO 0.18 0.05 -1.01 0.00 -0.73 0.00 0.00 179.01 177.50 2x0h h ARG 449 N 0.00 0.07 -0.38 1.92 3.08 -1.43 -2.84 114.38 114.79 2x0h h ARG 449 Ca -0.00 -0.11 -0.13 0.00 0.07 0.00 0.00 59.98 59.82 2x0h h ARG 449 Cb 0.09 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2x0h h ARG 449 CO 0.01 1.01 -0.26 0.35 -1.07 0.00 0.00 179.97 180.01 2x0h h PHE 450 N 0.02 0.98 0.22 3.04 3.57 -0.44 -2.78 116.94 121.56 2x0h h PHE 450 Ca -0.04 -0.27 -0.01 0.00 3.53 0.00 0.00 57.97 61.19 2x0h h PHE 450 Cb 1.74 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 40.26 2x0h h PHE 450 CO 0.01 1.05 -0.11 1.25 -2.23 0.00 0.00 178.31 178.29 2x0h h LEU 451 N 0.64 -0.25 -0.71 0.59 5.85 -1.49 -2.45 115.31 117.49 2x0h h LEU 451 Ca 0.07 -0.28 0.13 0.00 0.84 0.00 0.00 57.88 58.65 2x0h h LEU 451 Cb 0.83 0.07 -0.13 0.00 0.37 0.00 0.00 40.66 41.79 2x0h h LEU 451 CO 0.07 0.23 -0.30 0.50 -0.34 0.00 0.00 178.44 178.60 2x0h h LYS 452 N -0.83 -0.08 -0.94 1.25 1.63 -1.58 0.42 116.57 116.44 2x0h h LYS 452 Ca -0.03 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2x0h h LYS 452 Cb 0.51 0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.12 2x0h h LYS 452 CO 0.05 -0.06 0.60 0.00 -3.45 0.00 0.00 179.45 176.59 2x0h h ALA 453 N 1.29 1.20 0.21 5.00 0.00 -1.56 -3.11 119.26 122.28 2x0h h ALA 453 Ca 0.29 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2x0h h ALA 453 Cb 0.56 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2x0h h ALA 453 CO -0.77 0.62 -0.10 0.35 0.00 0.00 0.00 179.25 179.35 2x0h h PHE 454 N 1.29 -0.26 0.00 0.00 3.57 -0.13 -3.44 116.94 117.97 2x0h h PHE 454 Ca 0.34 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.84 2x0h h PHE 454 Cb -0.11 0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.72 2x0h h PHE 454 CO -0.00 0.03 0.00 1.63 -2.23 0.00 0.00 178.31 177.73 2x0h n LYS 455 N -5.10 0.23 -3.59 1.11 5.02 0.12 -5.09 118.16 110.85 2x0h n LYS 455 Ca -0.09 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.13 2x0h n LYS 455 Cb 0.22 -1.27 -0.04 0.00 -0.02 0.00 0.00 35.03 33.91 2x0h n LYS 455 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2x0h s TYR 460 N -2.00 -0.25 0.20 2.13 -0.85 -1.26 -5.09 117.35 110.23 2x0h s TYR 460 Ca 0.06 0.37 -0.31 0.00 -0.52 0.00 0.00 57.07 56.68 2x0h s TYR 460 Cb 0.03 0.48 -0.09 0.00 0.38 0.00 0.00 41.96 42.75 2x0h s TYR 460 CO 0.05 -0.26 1.43 -0.51 -1.52 0.00 0.00 175.55 174.74 2x0h s ASP 461 N -1.33 6.71 0.30 -0.18 -0.00 -1.26 -4.94 116.67 115.97 2x0h s ASP 461 Ca 0.03 2.55 0.05 0.00 -0.00 0.00 0.00 52.55 55.18 2x0h s ASP 461 Cb -0.01 -2.61 0.69 0.00 -0.00 0.00 0.00 42.92 40.99 2x0h s ASP 461 CO -0.03 -0.68 1.80 0.50 -0.00 0.00 0.00 175.17 176.76 2x0h h LYS 462 N 5.73 0.81 -0.69 8.23 3.64 -2.04 -2.10 116.57 130.15 2x0h h LYS 462 Ca -0.44 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.86 2x0h h LYS 462 Cb 1.21 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.82 2x0h h LYS 462 CO 0.82 0.54 0.33 0.00 -2.27 0.00 0.00 179.45 178.86 2x0h h ALA 463 N 1.61 1.28 -0.36 5.00 0.00 -1.98 -0.22 119.26 124.59 2x0h h ALA 463 Ca 0.54 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 55.19 2x0h h ALA 463 Cb 0.76 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2x0h h ALA 463 CO -0.33 0.56 -0.28 -0.44 0.00 0.00 0.00 179.25 178.76 2x0h h ASP 464 N 0.98 0.77 -0.09 0.00 3.32 -1.73 0.66 116.42 120.32 2x0h h ASP 464 Ca 0.24 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2x0h h ASP 464 Cb 0.11 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.44 2x0h h ASP 464 CO -0.03 1.00 0.01 0.15 -1.72 0.00 0.00 179.24 178.66 2x0h h PHE 465 N 0.64 0.17 -0.19 4.55 3.57 -1.22 -1.54 116.94 122.92 2x0h h PHE 465 Ca 0.08 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.50 2x0h h PHE 465 Cb 0.79 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 2x0h h PHE 465 CO 0.04 0.37 -0.15 0.93 -2.23 0.00 0.00 178.31 177.27 2x0h h GLU 466 N -0.08 0.30 -0.22 1.11 5.08 -0.94 -1.33 114.58 118.50 2x0h h GLU 466 Ca 0.03 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2x0h h GLU 466 Cb 0.29 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2x0h h GLU 466 CO 0.00 0.46 0.12 1.15 -1.00 0.00 0.00 179.01 179.74 2x0h h THR 467 N 0.29 1.11 -0.49 1.13 2.02 -0.57 0.34 112.91 116.74 2x0h h THR 467 Ca 0.05 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 66.91 2x0h h THR 467 Cb 0.44 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2x0h h THR 467 CO 0.03 0.10 0.12 -0.07 0.37 0.00 0.00 175.52 176.07 2x0h h LEU 468 N 0.25 0.73 -0.17 2.58 3.38 -1.01 0.01 115.31 121.09 2x0h h LEU 468 Ca 0.08 -0.23 0.03 0.00 0.09 0.00 0.00 57.88 57.84 2x0h h LEU 468 Cb 0.06 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2x0h h LEU 468 CO -0.01 0.77 0.00 -0.61 0.09 0.00 0.00 178.44 178.68 2x0h h GLN 469 N 0.66 0.06 -0.46 1.13 4.15 -1.12 -0.48 115.11 119.05 2x0h h GLN 469 Ca 0.15 -0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.64 2x0h h GLN 469 Cb 0.32 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 27.94 2x0h h GLN 469 CO 0.00 0.04 0.13 -0.92 -1.93 0.00 0.00 178.83 176.15 2x0h h TYR 470 N 0.06 0.22 -0.34 3.99 3.20 -0.09 -1.86 116.97 122.15 2x0h h TYR 470 Ca 0.08 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.99 2x0h h TYR 470 Cb 0.09 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 2x0h h TYR 470 CO -0.15 0.05 0.19 1.15 -1.64 0.00 0.00 178.16 177.75 2x0h h THR 471 N 0.28 1.02 -0.75 1.81 2.02 -0.52 -0.90 112.91 115.86 2x0h h THR 471 Ca 0.22 -0.13 -0.05 0.00 0.77 0.00 0.00 66.41 67.22 2x0h h THR 471 Cb 0.26 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 2x0h h THR 471 CO -0.26 0.07 0.28 -0.26 0.37 0.00 0.00 175.52 175.71 2x0h h PHE 472 N 0.38 1.17 -0.14 3.16 0.04 -0.90 0.24 116.94 120.89 2x0h h PHE 472 Ca 0.14 -0.10 0.01 0.00 2.80 0.00 0.00 57.97 60.82 2x0h h PHE 472 Cb 0.02 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 37.81 2x0h h PHE 472 CO -0.08 0.90 0.05 1.49 -0.60 0.00 0.00 178.31 180.07 2x0h h GLU 473 N 1.10 0.11 -0.79 1.51 4.81 -0.96 -2.16 114.58 118.20 2x0h h GLU 473 Ca 0.25 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.44 2x0h h GLU 473 Cb 0.25 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.57 2x0h h GLU 473 CO -0.02 0.08 0.39 -0.09 -0.73 0.00 0.00 179.01 178.64 2x0h h ARG 474 N 0.12 1.14 -0.91 1.92 9.65 -0.79 -1.88 114.38 123.62 2x0h h ARG 474 Ca 0.06 -0.16 0.05 0.00 -1.10 0.00 0.00 59.98 58.82 2x0h h ARG 474 Cb 0.03 -0.21 -0.06 0.00 -1.39 0.00 0.00 29.97 28.35 2x0h h ARG 474 CO -0.06 0.88 0.58 0.52 2.80 0.00 0.00 179.97 184.69 2x0h h MET 475 N 1.12 1.07 -0.30 0.20 2.86 -0.53 -0.27 114.93 119.09 2x0h h MET 475 Ca 0.27 -0.06 -0.15 0.00 -2.06 0.00 0.00 59.70 57.70 2x0h h MET 475 Cb 0.11 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.52 2x0h h MET 475 CO -0.04 0.71 -0.39 0.87 1.06 0.00 0.00 176.91 179.13 2x0h h LYS 476 N 1.10 0.79 -0.48 1.72 1.57 -0.75 0.92 116.57 121.44 2x0h h LYS 476 Ca 0.38 -0.45 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2x0h h LYS 476 Cb 0.07 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 2x0h h LYS 476 CO -0.14 1.08 0.30 0.93 -0.57 0.00 0.00 179.45 181.05 2x0h h GLU 477 N 0.55 0.59 -0.23 3.15 5.08 -1.08 -1.75 114.58 120.90 2x0h h GLU 477 Ca 0.04 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2x0h h GLU 477 Cb 0.98 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 2x0h h GLU 477 CO 0.09 0.39 0.05 0.77 -1.00 0.00 0.00 179.01 179.32 2x0h h SER 478 N 0.61 0.34 -0.31 1.42 0.02 -0.81 -2.04 113.55 112.79 2x0h h SER 478 Ca 0.18 -0.23 0.06 0.00 -0.84 0.00 0.00 61.79 60.97 2x0h h SER 478 Cb -0.03 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 62.36 2x0h h SER 478 CO -0.06 0.49 -0.07 0.00 -1.14 0.00 0.00 176.83 176.04 2x0h h ALA 479 N 0.87 0.21 -0.20 3.77 0.00 -0.68 0.10 119.26 123.34 2x0h h ALA 479 Ca 0.07 0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 2x0h h ALA 479 Cb 0.28 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2x0h h ALA 479 CO 0.00 -0.46 -0.64 -0.44 0.00 0.00 0.00 179.25 177.71 2x0h h ASP 480 N 0.01 0.82 -0.14 0.00 3.32 -1.24 -1.83 116.42 117.35 2x0h h ASP 480 Ca 0.15 -0.48 -0.04 0.00 0.02 0.00 0.00 57.03 56.68 2x0h h ASP 480 Cb 0.23 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 2x0h h ASP 480 CO -0.32 1.25 -0.08 0.40 -1.72 0.00 0.00 179.24 178.78 2x0h h ILE 481 N 0.52 1.32 -0.39 0.35 2.04 -1.31 -3.15 117.51 116.89 2x0h h ILE 481 Ca -0.01 -1.13 0.07 0.00 1.00 0.00 0.00 64.86 64.79 2x0h h ILE 481 Cb 1.24 1.77 -0.07 0.00 -0.74 0.00 0.00 36.82 39.02 2x0h h ILE 481 CO 0.13 0.33 -0.02 -0.07 0.00 0.00 0.00 178.15 178.52 2x0h h LEU 482 N -0.04 -0.20 -1.22 1.44 3.38 -0.76 -2.31 115.31 115.60 2x0h h LEU 482 Ca 0.03 0.10 0.13 0.00 0.09 0.00 0.00 57.88 58.23 2x0h h LEU 482 Cb 0.55 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.41 2x0h h LEU 482 CO 0.02 -0.06 0.58 -0.07 0.09 0.00 0.00 178.44 179.01 2x0h h LEU 483 N 0.09 0.72 -1.54 1.67 3.38 -1.36 -1.88 115.31 116.39 2x0h h LEU 483 Ca 0.19 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2x0h h LEU 483 Cb 0.28 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2x0h h LEU 483 CO -0.34 0.38 0.00 0.23 0.09 0.00 0.00 178.44 178.80 2x0h n MET 484 N -4.57 2.02 -2.48 1.13 2.81 -0.99 -4.96 117.12 110.08 2x0h n MET 484 Ca 0.17 -1.52 -0.42 0.00 -1.81 0.00 0.00 57.70 54.13 2x0h n MET 484 Cb 0.42 -1.45 -0.03 0.00 -0.71 0.00 0.00 33.22 31.45 2x0h n MET 484 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 2x0h s ASN 485 N -1.65 7.18 0.00 7.83 3.84 -0.71 -4.94 114.94 126.49 2x0h s ASN 485 Ca 0.34 2.02 0.12 0.00 0.21 0.00 0.00 52.86 55.56 2x0h s ASN 485 Cb 0.20 -2.59 0.11 0.00 -0.55 0.00 0.00 41.25 38.42 2x0h s ASN 485 CO 0.29 -0.35 0.92 0.35 -2.79 0.00 0.00 177.10 175.52 2x0h n THR 486 N 3.26 0.06 0.02 -5.21 -2.24 -1.26 -4.57 114.28 104.34 2x0h n THR 486 Ca 0.06 -0.53 -0.16 0.00 -2.27 0.00 0.00 64.05 61.15 2x0h n THR 486 Cb 0.47 1.21 -0.05 0.00 -2.10 0.00 0.00 70.33 69.85 2x0h n THR 486 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2x0h h GLU 487 N 2.42 0.64 -2.49 -0.78 4.81 -1.99 -3.37 114.58 113.81 2x0h h GLU 487 Ca 0.00 -0.58 -0.59 0.00 -0.13 0.00 0.00 59.36 58.06 2x0h h GLU 487 Cb 0.53 0.14 -0.40 0.00 0.63 0.00 0.00 28.75 29.65 2x0h h GLU 487 CO 0.00 1.19 -0.85 -1.71 -0.73 0.00 0.00 179.01 176.92 2x0h n ASN 488 N -3.87 1.03 -0.31 1.04 2.85 -1.26 -4.97 115.26 109.77 2x0h n ASN 488 Ca -0.07 -2.77 -0.03 0.00 -0.11 0.00 0.00 54.58 51.60 2x0h n ASN 488 Cb 0.78 -0.64 0.12 0.00 1.24 0.00 0.00 39.78 41.29 2x0h n ASN 488 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 2x0h h LYS 489 N 5.16 1.21 -0.40 1.20 1.57 -1.81 -2.40 116.57 121.10 2x0h h LYS 489 Ca 0.20 -0.12 -0.08 0.00 -1.87 0.00 0.00 60.65 58.77 2x0h h LYS 489 Cb 0.84 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 2x0h h LYS 489 CO 0.53 0.86 -0.10 -1.35 -0.57 0.00 0.00 179.45 178.83 2x0h h PRO 490 N 1.22 0.69 -0.08 3.15 0.11 -1.96 -0.47 132.00 134.66 2x0h h PRO 490 Ca 0.31 -0.21 0.02 0.00 0.11 0.00 0.00 66.00 66.23 2x0h h PRO 490 Cb -0.01 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.01 2x0h h PRO 490 CO -0.05 0.77 -0.06 1.25 -0.21 0.00 0.00 178.00 179.70 2x0h h LEU 491 N 0.63 -0.18 -0.58 2.35 5.85 -1.88 -2.35 115.31 119.15 2x0h h LEU 491 Ca 0.11 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 2x0h h LEU 491 Cb 0.54 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2x0h h LEU 491 CO 0.03 -0.08 0.28 0.40 -0.34 0.00 0.00 178.44 178.73 2x0h h ILE 492 N -0.06 1.21 -0.72 4.05 1.08 -0.96 -1.49 117.51 120.61 2x0h h ILE 492 Ca 0.05 -0.58 0.10 0.00 -0.39 0.00 0.00 64.86 64.04 2x0h h ILE 492 Cb 0.14 0.52 -0.08 0.00 -3.07 0.00 0.00 36.82 34.34 2x0h h ILE 492 CO -0.12 0.24 0.35 0.58 -0.69 0.00 0.00 178.15 178.50 2x0h h VAL 493 N 0.79 0.81 -0.06 1.67 2.07 -0.99 -1.17 116.25 119.37 2x0h h VAL 493 Ca 0.20 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2x0h h VAL 493 Cb 0.12 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.07 2x0h h VAL 493 CO -0.03 0.11 0.04 -0.33 0.02 0.00 0.00 177.57 177.38 2x0h h GLU 494 N 0.58 0.08 0.00 1.57 5.08 -0.73 -3.21 114.58 117.94 2x0h h GLU 494 Ca 0.37 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 2x0h h GLU 494 Cb 0.43 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2x0h h GLU 494 CO -0.30 0.05 -0.32 0.44 -1.00 0.00 0.00 179.01 177.89 2x0h n ILE 495 N -5.05 0.01 -0.20 3.13 -5.35 -0.87 -4.56 119.36 106.48 2x0h n ILE 495 Ca -0.06 -0.01 0.01 0.00 -0.27 0.00 0.00 62.75 62.42 2x0h n ILE 495 Cb 0.03 -0.03 0.10 0.00 -1.74 0.00 0.00 39.64 37.99 2x0h n ILE 495 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2x0h h THR 496 N 0.00 0.53 -0.89 7.28 2.02 -1.22 -0.04 112.91 120.59 2x0h h THR 496 Ca 0.00 -0.05 0.04 0.00 0.77 0.00 0.00 66.41 67.17 2x0h h THR 496 Cb 0.51 0.37 -0.05 0.00 -1.74 0.00 0.00 68.15 67.24 2x0h h THR 496 CO 0.00 0.03 0.58 -0.65 0.37 0.00 0.00 175.52 175.84 2x0h h PRO 497 N 0.14 1.08 -0.25 6.66 0.11 -1.83 -0.00 132.00 137.92 2x0h h PRO 497 Ca 0.32 -0.07 -0.12 0.00 0.11 0.00 0.00 66.00 66.24 2x0h h PRO 497 Cb 0.50 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2x0h h PRO 497 CO -0.49 0.72 -0.37 -1.49 -0.21 0.00 0.00 178.00 176.16 2x0h h TRP 498 N 1.12 0.65 -0.50 0.65 6.55 -1.52 -2.18 115.95 120.72 2x0h h TRP 498 Ca 0.36 -0.18 -0.03 0.00 0.95 0.00 0.00 58.89 59.99 2x0h h TRP 498 Cb 0.01 -0.14 -0.02 0.00 -0.86 0.00 0.00 29.16 28.15 2x0h h TRP 498 CO -0.02 0.84 0.20 0.28 -1.05 0.00 0.00 178.44 178.70 2x0h h VAL 499 N 0.46 1.21 -0.58 1.49 2.07 -0.15 0.35 116.25 121.11 2x0h h VAL 499 Ca 0.05 -0.65 0.03 0.00 0.82 0.00 0.00 66.70 66.95 2x0h h VAL 499 Cb 0.85 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.29 2x0h h VAL 499 CO 0.07 0.25 0.34 0.45 0.02 0.00 0.00 177.57 178.70 2x0h h HIS 500 N 0.66 0.63 -0.42 1.57 3.86 -0.94 -0.17 115.15 120.34 2x0h h HIS 500 Ca 0.17 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.32 2x0h h HIS 500 Cb 0.19 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 2x0h h HIS 500 CO 0.00 0.34 -0.04 0.37 0.86 0.00 0.00 177.93 179.46 2x0h h GLN 501 N 0.66 0.77 -0.51 2.45 5.75 -1.10 -1.48 115.11 121.67 2x0h h GLN 501 Ca 0.24 -0.27 0.07 0.00 -0.15 0.00 0.00 58.65 58.54 2x0h h GLN 501 Cb 0.06 -0.06 -0.06 0.00 1.07 0.00 0.00 27.48 28.49 2x0h h GLN 501 CO -0.12 0.87 0.16 0.35 -2.65 0.00 0.00 178.83 177.45 2x0h h PHE 502 N 0.60 0.28 -0.52 3.99 3.57 -0.17 -0.61 116.94 124.08 2x0h h PHE 502 Ca 0.11 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 2x0h h PHE 502 Cb 0.55 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 2x0h h PHE 502 CO 0.04 0.07 0.25 -0.22 -2.23 0.00 0.00 178.31 176.22 2x0h h LYS 503 N 0.33 0.75 -0.85 1.11 3.64 -0.77 -2.45 116.57 118.32 2x0h h LYS 503 Ca 0.25 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 2x0h h LYS 503 Cb 0.29 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.93 2x0h h LYS 503 CO -0.27 0.63 0.56 -0.07 -2.27 0.00 0.00 179.45 178.03 2x0h h LEU 504 N 0.70 0.99 -0.48 5.20 3.38 -0.91 -0.91 115.31 123.27 2x0h h LEU 504 Ca 0.18 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.14 2x0h h LEU 504 Cb 0.13 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2x0h h LEU 504 CO -0.02 0.72 0.28 0.74 0.09 0.00 0.00 178.44 180.25 2x0h h THR 505 N 1.16 1.04 -0.47 0.22 2.02 -0.95 0.33 112.91 116.25 2x0h h THR 505 Ca 0.31 -0.19 -0.13 0.00 0.77 0.00 0.00 66.41 67.17 2x0h h THR 505 Cb -0.13 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 2x0h h THR 505 CO -0.07 0.10 -0.20 0.00 0.37 0.00 0.00 175.52 175.73 2x0h h ALA 506 N 1.22 0.75 -0.54 6.16 0.00 -0.92 -0.59 119.26 125.35 2x0h h ALA 506 Ca 0.20 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2x0h h ALA 506 Cb 0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2x0h h ALA 506 CO -0.09 0.67 0.33 0.93 0.00 0.00 0.00 179.25 181.08 2x0h h GLU 507 N 0.83 0.73 -0.65 0.00 5.08 -0.89 -0.63 114.58 119.04 2x0h h GLU 507 Ca 0.11 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 2x0h h GLU 507 Cb 0.76 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 2x0h h GLU 507 CO 0.06 0.52 0.29 1.98 -1.00 0.00 0.00 179.01 180.86 2x0h h MET 508 N 0.73 0.93 -0.08 2.33 4.05 -0.67 -1.90 114.93 120.32 2x0h h MET 508 Ca 0.19 -0.13 -0.00 0.00 -0.28 0.00 0.00 59.70 59.48 2x0h h MET 508 Cb -0.03 -0.17 -0.00 0.00 -0.80 0.00 0.00 31.60 30.60 2x0h h MET 508 CO -0.04 0.74 0.04 0.78 0.23 0.00 0.00 176.91 178.66 2x0h h GLY 509 N 1.01 0.12 0.81 1.39 0.00 -0.73 0.08 103.07 105.75 2x0h h GLY 509 Ca 0.22 -0.06 0.04 0.00 0.00 0.00 0.00 47.33 47.54 2x0h h GLY 509 CO -0.03 0.06 0.50 0.83 0.00 0.00 0.00 176.54 177.90 2x0h h GLU 510 N 0.02 0.93 -0.33 4.80 5.08 -0.87 -1.63 114.58 122.58 2x0h h GLU 510 Ca 0.03 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.18 2x0h h GLU 510 Cb 0.10 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2x0h h GLU 510 CO -0.00 0.61 -0.41 0.93 -1.00 0.00 0.00 179.01 179.14 2x0h h GLU 511 N 0.95 0.81 -0.54 2.33 4.39 -1.10 -2.19 114.58 119.24 2x0h h GLU 511 Ca 0.33 -0.43 -0.03 0.00 0.34 0.00 0.00 59.36 59.57 2x0h h GLU 511 Cb 0.08 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 2x0h h GLU 511 CO -0.14 1.06 0.21 0.28 -1.16 0.00 0.00 179.01 179.27 2x0h h VAL 512 N 0.66 1.22 -0.95 3.13 2.07 -0.80 -1.76 116.25 119.82 2x0h h VAL 512 Ca 0.05 -0.70 0.03 0.00 0.82 0.00 0.00 66.70 66.91 2x0h h VAL 512 Cb 0.97 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 31.36 2x0h h VAL 512 CO 0.09 0.27 0.62 -0.07 0.02 0.00 0.00 177.57 178.50 2x0h h LEU 513 N 0.73 1.03 -1.36 2.57 3.38 -1.20 -1.59 115.31 118.87 2x0h h LEU 513 Ca 0.18 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 2x0h h LEU 513 Cb 0.21 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2x0h h LEU 513 CO -0.01 0.71 0.03 0.11 0.09 0.00 0.00 178.44 179.36 2x0h h LYS 514 N 1.20 0.45 -0.33 1.13 1.57 -1.04 -1.46 116.57 118.09 2x0h h LYS 514 Ca 0.37 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 59.01 2x0h h LYS 514 Cb 0.00 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 2x0h h LYS 514 CO -0.11 0.46 -0.08 0.52 -0.57 0.00 0.00 179.45 179.67 2x0h h MET 515 N 0.44 0.56 -0.32 3.15 2.86 -0.42 -3.03 114.93 118.16 2x0h h MET 515 Ca 0.10 -0.15 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 2x0h h MET 515 Cb 0.25 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 2x0h h MET 515 CO 0.00 0.64 0.01 0.28 1.06 0.00 0.00 176.91 178.91 2x0h h VAL 516 N 0.52 1.25 0.00 -2.22 2.07 -0.63 -3.46 116.25 113.79 2x0h h VAL 516 Ca 0.10 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2x0h h VAL 516 Cb 0.46 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 2x0h h VAL 516 CO 0.02 0.30 0.00 -0.62 0.02 0.00 0.00 177.57 177.30 2x0h n GLU 517 N -4.56 0.00 0.09 1.57 1.02 -0.64 -5.12 120.64 113.02 2x0h n GLU 517 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2x0h n GLU 517 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.67 2x0h n GLU 517 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2x0h n ARG 519 N 0.00 0.00 -4.14 3.49 1.85 -1.26 -5.11 116.66 111.49 2x0h n ARG 519 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.73 2x0h n ARG 519 Cb 0.00 -0.24 -0.11 0.00 -1.05 0.00 0.00 32.46 31.07 2x0h n ARG 519 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2x0h s ASN 520 N -5.45 1.13 0.22 2.89 2.20 -1.26 -5.06 114.94 109.61 2x0h s ASN 520 Ca 0.00 -0.83 -0.08 0.00 -0.94 0.00 0.00 52.86 51.00 2x0h s ASN 520 Cb 0.00 0.06 0.35 0.00 -2.00 0.00 0.00 41.25 39.66 2x0h s ASN 520 CO 0.00 -0.35 1.68 -0.08 -2.94 0.00 0.00 177.10 175.42 2x0h h GLU 521 N 3.54 0.20 -0.54 3.55 4.81 -2.04 -1.59 114.58 122.52 2x0h h GLU 521 Ca -0.36 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 58.81 2x0h h GLU 521 Cb 1.18 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 2x0h h GLU 521 CO 0.55 0.14 0.15 1.03 -0.73 0.00 0.00 179.01 180.14 2x0h h SER 522 N 0.21 0.81 -0.08 1.04 0.87 -2.00 -2.25 113.55 112.15 2x0h h SER 522 Ca 0.35 -0.22 -0.11 0.00 -1.23 0.00 0.00 61.79 60.58 2x0h h SER 522 Cb 0.57 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 2x0h h SER 522 CO -0.49 0.82 -0.28 0.22 -0.53 0.00 0.00 176.83 176.57 2x0h h TYR 523 N 0.76 0.61 -0.57 2.24 3.20 -1.82 -2.49 116.97 118.89 2x0h h TYR 523 Ca 0.17 -0.14 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 2x0h h TYR 523 Cb 0.32 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 2x0h h TYR 523 CO 0.02 0.76 0.17 0.35 -1.64 0.00 0.00 178.16 177.82 2x0h h PHE 524 N 0.46 0.94 -0.46 -3.82 3.57 -0.96 -2.10 116.94 114.57 2x0h h PHE 524 Ca 0.06 -0.10 -0.11 0.00 3.53 0.00 0.00 57.97 61.36 2x0h h PHE 524 Cb 0.73 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 2x0h h PHE 524 CO 0.03 0.79 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.68 2x0h h LEU 525 N 0.81 0.86 -0.43 0.59 3.38 -1.26 0.24 115.31 119.51 2x0h h LEU 525 Ca 0.18 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.92 2x0h h LEU 525 Cb 0.30 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 2x0h h LEU 525 CO -0.00 1.01 0.15 0.03 0.09 0.00 0.00 178.44 179.72 2x0h h ARG 526 N 0.77 0.31 -0.22 1.13 3.08 -1.33 0.23 114.38 118.35 2x0h h ARG 526 Ca 0.12 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 2x0h h ARG 526 Cb 0.67 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2x0h h ARG 526 CO 0.05 0.20 -0.05 0.87 -1.07 0.00 0.00 179.97 179.97 2x0h h LYS 527 N 0.32 0.42 -0.08 0.04 1.79 -0.93 -1.78 116.57 116.36 2x0h h LYS 527 Ca 0.20 -0.16 0.04 0.00 -2.18 0.00 0.00 60.65 58.55 2x0h h LYS 527 Cb 0.19 -0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 30.76 2x0h h LYS 527 CO -0.20 0.66 -0.38 -0.92 -1.08 0.00 0.00 179.45 177.52 2x0h h TYR 528 N 0.15 -1.08 -0.79 -1.35 3.20 -0.39 0.72 116.97 117.43 2x0h h TYR 528 Ca 0.05 0.04 0.04 0.00 3.14 0.00 0.00 58.73 62.00 2x0h h TYR 528 Cb 0.50 0.49 -0.05 0.00 1.54 0.00 0.00 36.73 39.21 2x0h h TYR 528 CO 0.05 -0.46 0.52 -0.91 -1.64 0.00 0.00 178.16 175.73 2x0h h ASN 529 N -0.49 0.83 -0.01 -2.11 -0.26 -0.94 -1.38 115.58 111.21 2x0h h ASN 529 Ca 0.07 -0.01 -0.12 0.00 -0.56 0.00 0.00 56.30 55.69 2x0h h ASN 529 Cb 0.61 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.67 2x0h h ASN 529 CO -0.35 0.57 -0.35 -0.74 -1.06 0.00 0.00 177.43 175.50 2x0h h HIS 530 N 0.96 0.57 0.23 1.19 2.76 -0.72 -2.55 115.15 117.60 2x0h h HIS 530 Ca 0.32 -0.15 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 2x0h h HIS 530 Cb 0.07 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 28.90 2x0h h HIS 530 CO -0.00 0.78 -0.11 0.28 -1.30 0.00 0.00 177.93 177.58 2x0h h VAL 531 N 0.42 0.79 -0.87 5.26 2.07 0.13 -1.59 116.25 122.46 2x0h h VAL 531 Ca 0.05 -0.11 0.12 0.00 0.82 0.00 0.00 66.70 67.58 2x0h h VAL 531 Cb 0.81 0.86 -0.07 0.00 -1.52 0.00 0.00 31.29 31.37 2x0h h VAL 531 CO 0.07 0.02 0.56 0.11 0.02 0.00 0.00 177.57 178.35 2x0h h LYS 532 N -0.37 0.71 -0.43 1.57 1.79 -1.26 0.13 116.57 118.72 2x0h h LYS 532 Ca -0.03 -0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 58.32 2x0h h LYS 532 Cb 0.28 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2x0h h LYS 532 CO 0.05 0.47 -0.05 0.00 -1.08 0.00 0.00 179.45 178.85 2x0h h ALA 533 N 1.59 0.58 -0.50 3.86 0.00 -1.36 -1.83 119.26 121.60 2x0h h ALA 533 Ca 0.42 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2x0h h ALA 533 Cb 0.60 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2x0h h ALA 533 CO -0.19 0.41 0.13 -0.07 0.00 0.00 0.00 179.25 179.53 2x0h h LEU 534 N 0.61 0.70 -0.66 0.00 3.38 -0.18 -0.92 115.31 118.25 2x0h h LEU 534 Ca 0.11 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2x0h h LEU 534 Cb 0.56 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2x0h h LEU 534 CO 0.03 0.69 0.33 1.56 0.09 0.00 0.00 178.44 181.13 2x0h h GLN 535 N 0.73 0.94 -0.51 1.13 4.20 -0.60 -2.03 115.11 118.98 2x0h h GLN 535 Ca 0.17 -0.13 -0.11 0.00 0.06 0.00 0.00 58.65 58.64 2x0h h GLN 535 Cb 0.26 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 2x0h h GLN 535 CO -0.00 0.74 -0.11 1.96 -0.67 0.00 0.00 178.83 180.74 2x0h h GLN 536 N 0.90 0.95 -0.78 1.46 4.20 -0.88 -2.03 115.11 118.93 2x0h h GLN 536 Ca 0.23 -0.34 0.04 0.00 0.06 0.00 0.00 58.65 58.64 2x0h h GLN 536 Cb 0.10 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.76 2x0h h GLN 536 CO -0.03 1.00 0.49 1.96 -0.67 0.00 0.00 178.83 181.58 2x0h h GLN 537 N 0.84 0.90 -0.43 1.46 4.20 -1.00 -0.47 115.11 120.61 2x0h h GLN 537 Ca 0.13 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.68 2x0h h GLN 537 Cb 0.65 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 2x0h h GLN 537 CO 0.05 0.60 -0.18 0.52 -0.67 0.00 0.00 178.83 179.15 2x0h h MET 538 N 0.93 0.84 -0.02 1.46 2.86 -0.99 -1.46 114.93 118.54 2x0h h MET 538 Ca 0.32 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2x0h h MET 538 Cb 0.07 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 2x0h h MET 538 CO -0.13 0.95 0.02 0.35 1.06 0.00 0.00 176.91 179.15 2x0h h PHE 539 N 0.74 0.03 -0.57 -0.22 3.57 -1.14 -0.77 116.94 118.58 2x0h h PHE 539 Ca 0.11 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.70 2x0h h PHE 539 Cb 0.69 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.35 2x0h h PHE 539 CO 0.04 0.02 0.17 -0.92 -2.23 0.00 0.00 178.31 175.40 2x0h h TYR 540 N 0.03 0.30 -0.67 0.41 3.20 -0.60 -0.58 116.97 119.06 2x0h h TYR 540 Ca 0.01 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 2x0h h TYR 540 Cb 0.00 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 2x0h h TYR 540 CO -0.08 0.05 0.20 0.82 -1.64 0.00 0.00 178.16 177.52 2x0h h ILE 541 N 0.33 1.25 0.00 1.81 2.04 -1.06 -2.08 117.51 119.80 2x0h h ILE 541 Ca 0.29 -0.86 -0.03 0.00 1.00 0.00 0.00 64.86 65.26 2x0h h ILE 541 Cb 0.37 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2x0h h ILE 541 CO -0.32 0.33 -0.15 -0.78 0.00 0.00 0.00 178.15 177.24 2x0h h ASP 542 N 0.99 0.00 0.14 1.72 3.58 0.00 -1.27 116.42 121.58 2x0h h ASP 542 Ca 0.22 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.67 2x0h h ASP 542 Cb 0.29 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.34 2x0h h ASP 542 CO -0.01 0.15 -1.06 0.00 -2.88 0.00 0.00 179.24 175.44 2x0h n GLN 543 N -3.49 0.13 -0.00 0.28 1.13 -0.34 -3.73 117.38 111.37 2x0h n GLN 543 Ca -0.01 -0.03 0.02 0.00 -1.94 0.00 0.00 57.00 55.04 2x0h n GLN 543 Cb 0.30 -1.52 -0.03 0.00 0.11 0.00 0.00 30.24 29.11 2x0h n GLN 543 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2x0h n THR 544 N -1.67 0.00 -4.07 5.09 -2.24 -0.84 -4.93 114.28 105.63 2x0h n THR 544 Ca 0.03 -0.13 -0.34 0.00 -2.27 0.00 0.00 64.05 61.34 2x0h n THR 544 Cb 0.38 0.49 -0.07 0.00 -2.10 0.00 0.00 70.33 69.03 2x0h n THR 544 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2x0h s SER 545 N -2.30 5.87 -1.33 3.42 0.01 -0.50 -4.67 113.70 114.21 2x0h s SER 545 Ca -0.01 0.25 -0.04 0.00 1.31 0.00 0.00 55.95 57.46 2x0h s SER 545 Cb 0.02 -1.76 0.02 0.00 0.21 0.00 0.00 66.02 64.51 2x0h s SER 545 CO 0.15 0.32 0.91 -3.20 0.41 0.00 0.00 173.24 171.83 2x0h n ASN 546 N 1.52 -2.90 -3.63 2.44 5.15 -1.26 -3.23 115.26 113.35 2x0h n ASN 546 Ca -0.15 -0.72 -0.41 0.00 -0.60 0.00 0.00 54.58 52.70 2x0h n ASN 546 Cb 0.53 -4.45 -0.01 0.00 -0.53 0.00 0.00 39.78 35.33 2x0h n ASN 546 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2x0h n GLN 547 N -4.43 3.37 -2.45 1.20 1.13 -1.26 -1.68 117.38 113.25 2x0h n GLN 547 Ca -0.18 -2.76 -0.26 0.00 -1.94 0.00 0.00 57.00 51.85 2x0h n GLN 547 Cb 0.63 -3.04 0.03 0.00 0.11 0.00 0.00 30.24 27.97 2x0h n GLN 547 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2x0h s ASN 548 N 2.24 5.63 0.02 1.08 2.20 -1.26 -4.99 114.94 119.86 2x0h s ASN 548 Ca 0.52 0.68 0.14 0.00 -0.94 0.00 0.00 52.86 53.26 2x0h s ASN 548 Cb 0.15 -1.70 0.60 0.00 -2.00 0.00 0.00 41.25 38.29 2x0h s ASN 548 CO -0.06 -1.02 1.45 -2.65 -2.94 0.00 0.00 177.10 171.87 2x0h n PRO 549 N -2.53 0.02 -0.02 3.55 -0.02 -1.26 -3.69 135.00 131.05 2x0h n PRO 549 Ca 0.04 0.29 -0.06 0.00 -2.02 0.00 0.00 63.50 61.75 2x0h n PRO 549 Cb 0.57 -1.53 -0.02 0.00 -0.02 0.00 0.00 33.50 32.50 2x0h n PRO 549 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2x0h n TYR 550 N -1.56 0.00 -3.44 6.00 4.01 -1.26 -4.87 117.16 116.04 2x0h n TYR 550 Ca 0.03 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.51 2x0h n TYR 550 Cb 0.16 -0.24 -0.09 0.00 -0.31 0.00 0.00 39.34 38.85 2x0h n TYR 550 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2x0h n GLN 551 N -3.67 0.96 -1.18 -0.72 3.00 -1.26 -5.02 117.38 109.49 2x0h n GLN 551 Ca -0.11 -3.64 -0.31 0.00 -0.01 0.00 0.00 57.00 52.93 2x0h n GLN 551 Cb 0.37 -1.74 0.11 0.00 0.00 0.00 0.00 30.24 28.97 2x0h n GLN 551 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2x0h s PRO 552 N -0.92 1.98 0.01 -1.09 0.04 -1.24 -2.84 135.00 130.94 2x0h s PRO 552 Ca 0.33 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.71 2x0h s PRO 552 Cb 0.08 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.76 2x0h s PRO 552 CO -0.14 -1.87 0.00 0.41 0.04 0.00 0.00 177.00 175.43 2x0h n GLY 553 N -0.64 -1.71 2.72 0.56 0.00 -0.68 -4.77 105.19 100.68 2x0h n GLY 553 Ca 0.10 -2.04 -0.19 0.00 0.00 0.00 0.00 46.02 43.88 2x0h n GLY 553 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x0h s VAL 554 N 0.00 -0.30 0.08 1.61 1.01 -1.26 -4.43 120.40 117.11 2x0h s VAL 554 Ca 0.00 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 61.82 2x0h s VAL 554 Cb 0.00 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 2x0h s VAL 554 CO 0.00 -0.28 -0.03 -0.54 0.00 0.00 0.00 175.10 174.25 2x0h s LYS 555 N 2.30 2.48 0.01 2.72 -0.14 0.24 -4.78 119.74 122.58 2x0h s LYS 555 Ca 0.07 -0.85 -0.22 0.00 -1.36 0.00 0.00 55.97 53.61 2x0h s LYS 555 Cb -0.16 -2.50 0.05 0.00 -1.68 0.00 0.00 37.83 33.54 2x0h s LYS 555 CO -0.16 0.55 0.49 -0.08 -0.76 0.00 0.00 175.35 175.38 2x0h s THR 556 N -1.24 0.03 -1.49 2.17 -1.32 -1.26 -4.54 115.64 107.99 2x0h s THR 556 Ca 0.23 -0.28 -0.06 0.00 -1.21 0.00 0.00 61.69 60.37 2x0h s THR 556 Cb -0.11 -0.90 0.05 0.00 -1.51 0.00 0.00 72.50 70.03 2x0h s THR 556 CO 0.16 -0.16 0.59 0.00 -2.21 0.00 0.00 174.62 173.00 2x0h n ALA 557 N 0.73 -1.74 0.09 11.08 0.00 -0.57 -4.75 120.51 125.36 2x0h n ALA 557 Ca -0.19 -0.15 0.07 0.00 0.00 0.00 0.00 53.44 53.17 2x0h n ALA 557 Cb 0.58 -2.35 -0.02 0.00 0.00 0.00 0.00 19.45 17.67 2x0h n ALA 557 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2x0h h THR 558 N -1.78 0.22 0.22 0.00 1.35 -1.92 0.01 112.91 111.01 2x0h h THR 558 Ca -0.61 -1.41 -0.30 0.00 -0.55 0.00 0.00 66.41 63.54 2x0h h THR 558 Cb 1.38 1.77 0.03 0.00 -1.73 0.00 0.00 68.15 69.60 2x0h h THR 558 CO 0.67 0.12 -1.32 -0.09 -0.25 0.00 0.00 175.52 174.65 2x0h h ARG 559 N 0.00 0.47 0.00 4.72 2.43 -1.91 -3.41 114.38 116.68 2x0h h ARG 559 Ca -0.06 -0.81 0.00 0.00 -0.81 0.00 0.00 59.98 58.30 2x0h h ARG 559 Cb 1.22 0.30 0.00 0.00 -0.42 0.00 0.00 29.97 31.07 2x0h h ARG 559 CO 0.02 1.39 -0.85 0.28 -1.51 0.00 0.00 179.97 179.30 2x0h n VAL 560 N -3.82 0.00 0.05 0.20 0.31 -1.26 -4.81 118.33 109.00 2x0h n VAL 560 Ca -0.17 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.05 2x0h n VAL 560 Cb 1.03 -1.31 -0.08 0.00 -0.91 0.00 0.00 33.84 32.57 2x0h n VAL 560 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2x0h h ILE 561 N 0.00 0.93 -0.31 2.52 2.04 -1.83 -2.30 117.51 118.56 2x0h h ILE 561 Ca 0.00 -1.12 0.02 0.00 1.00 0.00 0.00 64.86 64.76 2x0h h ILE 561 Cb 0.85 1.54 -0.03 0.00 -0.74 0.00 0.00 36.82 38.44 2x0h h ILE 561 CO 0.00 0.23 0.14 0.50 0.00 0.00 0.00 178.15 179.03 2x0h h LYS 562 N -0.81 0.30 -0.87 2.37 1.63 -1.26 -1.45 116.57 116.47 2x0h h LYS 562 Ca -0.02 -0.02 0.08 0.00 -0.85 0.00 0.00 60.65 59.85 2x0h h LYS 562 Cb 0.53 -0.07 -0.07 0.00 -0.60 0.00 0.00 32.23 32.03 2x0h h LYS 562 CO 0.03 0.20 0.53 -1.35 -3.45 0.00 0.00 179.45 175.40 2x0h h PRO 563 N 0.30 0.88 -0.22 1.90 0.11 -1.79 0.13 132.00 133.32 2x0h h PRO 563 Ca 0.13 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.18 2x0h h PRO 563 Cb 0.06 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 30.96 2x0h h PRO 563 CO -0.10 0.58 0.11 1.25 -0.21 0.00 0.00 178.00 179.63 2x0h h LEU 564 N 0.91 0.28 0.10 2.35 5.85 -0.95 -1.09 115.31 122.75 2x0h h LEU 564 Ca 0.40 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 59.01 2x0h h LEU 564 Cb 0.30 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.26 2x0h h LEU 564 CO -0.22 0.31 -0.05 0.40 -0.34 0.00 0.00 178.44 178.54 2x0h h ILE 565 N 0.23 0.97 -0.54 4.05 2.04 -0.70 0.13 117.51 123.69 2x0h h ILE 565 Ca 0.07 -0.24 0.04 0.00 1.00 0.00 0.00 64.86 65.74 2x0h h ILE 565 Cb 0.10 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 2x0h h ILE 565 CO -0.01 0.06 0.29 0.44 0.00 0.00 0.00 178.15 178.93 2x0h h ASP 566 N -0.24 0.44 -0.03 1.72 3.32 -0.76 0.16 116.42 121.03 2x0h h ASP 566 Ca -0.01 0.02 -0.22 0.00 0.02 0.00 0.00 57.03 56.84 2x0h h ASP 566 Cb 0.20 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.69 2x0h h ASP 566 CO 0.02 0.30 -0.78 0.03 -1.72 0.00 0.00 179.24 177.09 2x0h h ARG 567 N 0.57 0.69 -0.67 3.56 3.08 -1.00 0.15 114.38 120.76 2x0h h ARG 567 Ca 0.23 -0.57 -0.01 0.00 0.07 0.00 0.00 59.98 59.70 2x0h h ARG 567 Cb 0.11 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2x0h h ARG 567 CO -0.14 1.19 0.38 1.15 -1.07 0.00 0.00 179.97 181.47 2x0h h THR 568 N 0.47 1.20 -0.49 2.04 2.02 -0.59 -1.09 112.91 116.46 2x0h h THR 568 Ca -0.05 -0.50 -0.02 0.00 0.77 0.00 0.00 66.41 66.62 2x0h h THR 568 Cb 1.40 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 2x0h h THR 568 CO 0.15 0.22 0.25 0.15 0.37 0.00 0.00 175.52 176.66 2x0h h PHE 569 N 0.91 0.70 -0.81 3.16 3.57 -0.50 -0.10 116.94 123.87 2x0h h PHE 569 Ca 0.24 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 2x0h h PHE 569 Cb 0.02 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.50 2x0h h PHE 569 CO -0.01 0.55 0.48 0.00 -2.23 0.00 0.00 178.31 177.10 2x0h h ALA 570 N 1.09 1.03 -0.02 2.41 0.00 -0.39 -2.57 119.26 120.81 2x0h h ALA 570 Ca 0.17 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2x0h h ALA 570 Cb 0.10 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2x0h h ALA 570 CO -0.02 0.49 -0.01 1.15 0.00 0.00 0.00 179.25 180.86 2x0h h THR 571 N 1.10 1.34 0.00 0.00 2.02 -0.87 -1.45 112.91 115.06 2x0h h THR 571 Ca 0.29 -1.03 -0.09 0.00 0.77 0.00 0.00 66.41 66.34 2x0h h THR 571 Cb -0.04 2.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 2x0h h THR 571 CO -0.05 0.27 -0.45 1.62 0.37 0.00 0.00 175.52 177.28 2x0h h VAL 572 N -0.38 1.23 -0.13 3.16 3.04 -1.02 -1.72 116.25 120.43 2x0h h VAL 572 Ca 0.00 -1.60 -0.03 0.00 -1.01 0.00 0.00 66.70 64.07 2x0h h VAL 572 Cb 0.45 1.88 -0.00 0.00 -2.01 0.00 0.00 31.29 31.61 2x0h h VAL 572 CO 0.00 0.44 -0.04 0.58 -1.01 0.00 0.00 177.57 177.55 2x0h h VAL 573 N 0.00 1.30 -0.54 1.51 2.07 -1.45 -1.91 116.25 117.23 2x0h h VAL 573 Ca -0.00 -1.01 0.10 0.00 0.82 0.00 0.00 66.70 66.60 2x0h h VAL 573 Cb 0.85 1.70 -0.08 0.00 -1.52 0.00 0.00 31.29 32.24 2x0h h VAL 573 CO 0.06 0.29 0.11 0.50 0.02 0.00 0.00 177.57 178.55 2x0h h LYS 574 N -0.07 0.24 -0.19 1.57 3.64 -0.89 0.19 116.57 121.06 2x0h h LYS 574 Ca 0.03 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.33 2x0h h LYS 574 Cb 0.47 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 2x0h h LYS 574 CO 0.01 0.16 -0.20 0.74 -2.27 0.00 0.00 179.45 177.90 2x0h h PHE 575 N 0.25 0.35 -0.26 1.91 0.04 -1.27 -1.52 116.94 116.44 2x0h h PHE 575 Ca 0.28 -0.06 -0.08 0.00 2.80 0.00 0.00 57.97 60.91 2x0h h PHE 575 Cb 0.39 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.44 2x0h h PHE 575 CO -0.24 0.51 -0.17 0.35 -0.60 0.00 0.00 178.31 178.16 2x0h h PHE 576 N 0.30 0.66 -0.69 -0.55 3.57 -0.46 -0.84 116.94 118.93 2x0h h PHE 576 Ca 0.05 -0.18 -0.04 0.00 3.53 0.00 0.00 57.97 61.33 2x0h h PHE 576 Cb 0.52 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 2x0h h PHE 576 CO 0.01 0.85 0.27 -0.91 -2.23 0.00 0.00 178.31 176.29 2x0h h ASN 577 N 0.29 0.94 -0.25 0.41 2.35 -0.77 0.35 115.58 118.91 2x0h h ASN 577 Ca 0.05 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 55.60 2x0h h ASN 577 Cb 0.69 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 2x0h h ASN 577 CO 0.05 0.85 -0.08 1.56 -1.65 0.00 0.00 177.43 178.16 2x0h h GLN 578 N 1.00 0.49 -0.19 0.81 4.20 -1.18 -0.48 115.11 119.76 2x0h h GLN 578 Ca 0.23 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 2x0h h GLN 578 Cb 0.21 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 2x0h h GLN 578 CO -0.02 0.72 -0.04 -0.22 -0.67 0.00 0.00 178.83 178.61 2x0h h LYS 579 N 0.22 0.35 -0.30 1.46 3.64 -1.04 -3.33 116.57 117.57 2x0h h LYS 579 Ca 0.06 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2x0h h LYS 579 Cb 0.55 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2x0h h LYS 579 CO 0.03 0.60 0.00 1.19 -2.27 0.00 0.00 179.45 179.00 2x0h n PHE 580 N -4.66 0.39 -3.60 1.91 3.72 0.10 -4.96 117.46 110.36 2x0h n PHE 580 Ca -0.05 -0.27 -0.27 0.00 -0.05 0.00 0.00 57.45 56.81 2x0h n PHE 580 Cb 0.26 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 38.83 2x0h n PHE 580 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2x0h n ASN 581 N 1.03 -5.09 -4.91 4.37 2.85 -0.22 -4.98 115.26 108.30 2x0h n ASN 581 Ca 0.14 -0.58 -0.21 0.00 -0.11 0.00 0.00 54.58 53.83 2x0h n ASN 581 Cb 0.48 -4.08 0.06 0.00 1.24 0.00 0.00 39.78 37.48 2x0h n ASN 581 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2x0h s ALA 582 N -3.21 4.17 -0.33 5.20 0.00 -1.01 -5.04 121.76 121.55 2x0h s ALA 582 Ca 0.54 -1.73 0.16 0.00 0.00 0.00 0.00 51.96 50.93 2x0h s ALA 582 Cb -0.26 -1.81 0.46 0.00 0.00 0.00 0.00 23.12 21.51 2x0h s ALA 582 CO 0.67 -0.91 1.04 0.72 0.00 0.00 0.00 175.76 177.28 2x0h n HIS 583 N -2.38 1.78 -2.17 0.00 8.25 -1.26 -4.62 115.22 114.82 2x0h n HIS 583 Ca 0.12 -2.65 -0.40 0.00 -0.26 0.00 0.00 57.72 54.53 2x0h n HIS 583 Cb 0.60 -0.28 -0.02 0.00 1.12 0.00 0.00 29.99 31.41 2x0h n HIS 583 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2x0h s LEU 584 N -3.41 4.43 0.14 2.41 1.43 -1.26 -4.99 118.68 117.43 2x0h s LEU 584 Ca 0.33 2.62 -0.31 0.00 -1.03 0.00 0.00 54.13 55.74 2x0h s LEU 584 Cb 0.41 -3.67 -0.08 0.00 0.03 0.00 0.00 46.19 42.88 2x0h s LEU 584 CO -0.02 -0.49 1.42 -0.62 0.23 0.00 0.00 176.35 176.86 2x0h s ASP 585 N -0.57 6.78 0.00 2.29 2.15 -1.26 -4.95 116.67 121.11 2x0h s ASP 585 Ca 0.49 2.40 0.22 0.00 0.43 0.00 0.00 52.55 56.08 2x0h s ASP 585 Cb -0.38 -2.59 0.11 0.00 -0.30 0.00 0.00 42.92 39.76 2x0h s ASP 585 CO 0.51 -0.68 1.14 0.00 -0.17 0.00 0.00 175.17 175.97 2x0h n ALA 586 N 3.78 2.82 -1.67 3.66 0.00 -1.26 -5.00 120.51 122.84 2x0h n ALA 586 Ca 0.11 -0.66 -0.43 0.00 0.00 0.00 0.00 53.44 52.46 2x0h n ALA 586 Cb 0.42 -0.75 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 2x0h n ALA 586 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2x0h n THR 587 N 0.79 1.89 -0.06 0.00 -1.04 -1.26 -4.45 114.28 110.15 2x0h n THR 587 Ca 0.11 -0.47 -0.01 0.00 -2.04 0.00 0.00 64.05 61.64 2x0h n THR 587 Cb 0.52 -1.45 -0.16 0.00 -1.82 0.00 0.00 70.33 67.41 2x0h n THR 587 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2x0h n THR 588 N 0.47 0.77 -4.94 12.58 -2.24 -1.26 -4.90 114.28 114.76 2x0h n THR 588 Ca 0.06 -0.70 -0.33 0.00 -2.27 0.00 0.00 64.05 60.82 2x0h n THR 588 Cb 0.35 -0.26 -0.15 0.00 -2.10 0.00 0.00 70.33 68.17 2x0h n THR 588 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2x0h s ASP 589 N -5.05 3.69 0.35 3.42 1.01 -1.26 -4.95 116.67 113.88 2x0h s ASP 589 Ca -0.09 -0.40 -0.28 0.00 0.71 0.00 0.00 52.55 52.49 2x0h s ASP 589 Cb 0.10 -1.49 -0.10 0.00 1.01 0.00 0.00 42.92 42.44 2x0h s ASP 589 CO 0.86 0.17 1.28 -0.47 0.21 0.00 0.00 175.17 177.23 2x0h s TYR 590 N 0.28 3.04 -0.28 4.23 5.04 -1.26 -5.02 117.35 123.39 2x0h s TYR 590 Ca -0.12 1.44 0.01 0.00 -2.44 0.00 0.00 57.07 55.96 2x0h s TYR 590 Cb -0.16 -3.64 0.17 0.00 0.35 0.00 0.00 41.96 38.68 2x0h s TYR 590 CO 0.06 -1.78 0.47 1.41 -1.34 0.00 0.00 175.55 174.37 2x0h s MET 591 N -1.89 0.45 0.44 4.97 -2.45 -1.26 -4.93 119.30 114.63 2x0h s MET 591 Ca 0.51 0.49 0.30 0.00 -1.25 0.00 0.00 55.69 55.74 2x0h s MET 591 Cb -0.38 -0.08 1.25 0.00 1.25 0.00 0.00 34.83 36.87 2x0h s MET 591 CO 0.50 -0.85 1.89 -1.00 1.05 0.00 0.00 175.02 176.61 2x0h h PRO 592 N 8.11 0.00 -6.28 4.11 0.13 -1.99 -3.43 132.00 132.65 2x0h h PRO 592 Ca -0.13 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.55 2x0h h PRO 592 Cb 1.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 2x0h h PRO 592 CO 0.24 0.00 -0.38 -1.01 -0.23 0.00 0.00 178.00 176.63 2x0h s HIS 593 N -3.54 3.20 0.16 1.56 3.76 -1.26 -4.22 115.29 114.94 2x0h s HIS 593 Ca 0.02 -0.16 0.06 0.00 -0.15 0.00 0.00 55.06 54.83 2x0h s HIS 593 Cb 0.09 -1.85 -0.04 0.00 1.11 0.00 0.00 32.58 31.89 2x0h s HIS 593 CO 0.47 0.14 -0.14 0.15 -0.85 0.00 0.00 174.74 174.51 2x0h s LYS 594 N -4.10 1.15 0.00 1.40 1.02 0.34 -5.00 119.74 114.55 2x0h s LYS 594 Ca 0.41 -1.41 0.00 0.00 0.02 0.00 0.00 55.97 55.00 2x0h s LYS 594 Cb -0.09 -0.95 0.00 0.00 -0.52 0.00 0.00 37.83 36.26 2x0h s LYS 594 CO 0.30 0.17 0.00 -0.12 -0.92 0.00 0.00 175.35 174.78 2x0h n MET 595 N 0.08 0.00 -2.12 1.68 1.56 -1.26 -0.63 117.12 116.43 2x0h n MET 595 Ca -0.12 0.00 -0.00 0.00 -0.27 0.00 0.00 57.70 57.31 2x0h n MET 595 Cb 0.59 0.00 -0.00 0.00 2.15 0.00 0.00 33.22 35.96 2x0h n MET 595 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 2x0h n LEU 605 N 0.00 -1.98 -4.77 -0.89 4.77 -1.26 -4.95 117.00 107.92 2x0h n LEU 605 Ca 0.00 1.54 -0.38 0.00 -0.03 0.00 0.00 56.01 57.13 2x0h n LEU 605 Cb 0.00 -2.01 -0.01 0.00 -2.33 0.00 0.00 43.42 39.07 2x0h n LEU 605 CO 0.00 -1.95 0.90 -2.84 -1.33 0.00 0.00 177.39 172.17 2x0h s PRO 606 N -0.17 3.88 0.38 3.23 0.02 -1.26 -4.77 135.00 136.31 2x0h s PRO 606 Ca -0.00 1.98 -0.26 0.00 0.02 0.00 0.00 61.00 62.74 2x0h s PRO 606 Cb 0.00 -2.62 -0.09 0.00 0.02 0.00 0.00 34.50 31.81 2x0h s PRO 606 CO 0.00 -0.51 1.17 -0.51 -0.33 0.00 0.00 177.00 176.83 2x0h s LEU 607 N -2.66 4.26 0.26 -5.54 1.43 -1.26 -2.05 118.68 113.12 2x0h s LEU 607 Ca 0.59 2.35 0.12 0.00 -1.03 0.00 0.00 54.13 56.17 2x0h s LEU 607 Cb -0.34 -3.95 -0.05 0.00 0.03 0.00 0.00 46.19 41.89 2x0h s LEU 607 CO 0.42 -0.59 -0.19 -1.10 0.23 0.00 0.00 176.35 175.13 2x0h s GLN 608 N -2.15 1.71 -0.18 1.70 -0.21 0.48 -4.91 119.66 116.09 2x0h s GLN 608 Ca 0.55 -1.70 -0.00 0.00 0.02 0.00 0.00 55.36 54.23 2x0h s GLN 608 Cb -0.31 -1.82 0.05 0.00 1.00 0.00 0.00 33.01 31.92 2x0h s GLN 608 CO 0.40 0.35 -0.06 0.08 -2.12 0.00 0.00 175.29 173.93 2x0h s VAL 609 N -2.35 1.26 -0.21 1.09 1.01 -1.26 -1.69 120.40 118.25 2x0h s VAL 609 Ca 0.29 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.48 2x0h s VAL 609 Cb -0.06 -1.44 0.05 0.00 0.00 0.00 0.00 36.38 34.94 2x0h s VAL 609 CO 0.15 0.09 -0.05 -0.54 0.00 0.00 0.00 175.10 174.74 2x0h s LYS 610 N 1.56 1.55 3.54 2.72 -0.14 -0.55 -4.99 119.74 123.44 2x0h s LYS 610 Ca -0.01 -0.81 0.00 0.00 -1.36 0.00 0.00 55.97 53.79 2x0h s LYS 610 Cb -0.16 -2.40 0.00 0.00 -1.68 0.00 0.00 37.83 33.59 2x0h s LYS 610 CO -0.08 -0.54 0.00 0.00 -0.76 0.00 0.00 175.35 173.97 2x0h n ALA 611 N 4.75 0.00 -0.70 5.17 0.00 -1.26 -0.03 120.51 128.44 2x0h n ALA 611 Ca -0.12 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.20 2x0h n ALA 611 Cb 0.45 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.10 2x0h n ALA 611 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2x0h n ASN 612 N 3.68 3.97 -4.72 0.00 6.94 -1.26 -4.89 115.26 118.98 2x0h n ASN 612 Ca 0.00 -3.12 -0.35 0.00 -0.02 0.00 0.00 54.58 51.09 2x0h n ASN 612 Cb 0.00 -0.73 -0.09 0.00 -2.36 0.00 0.00 39.78 36.60 2x0h n ASN 612 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2x0h s ARG 613 N -2.57 3.06 -0.16 -3.83 0.52 0.96 -1.12 118.95 115.80 2x0h s ARG 613 Ca 0.45 -0.37 0.01 0.00 -0.52 0.00 0.00 55.73 55.30 2x0h s ARG 613 Cb 0.37 -2.86 0.02 0.00 0.52 0.00 0.00 34.95 33.00 2x0h s ARG 613 CO 0.10 0.71 -0.18 0.08 0.02 0.00 0.00 175.30 176.04 2x0h s VAL 614 N -0.93 1.85 0.04 3.52 1.01 0.19 -1.48 120.40 124.61 2x0h s VAL 614 Ca 0.14 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2x0h s VAL 614 Cb -0.11 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 2x0h s VAL 614 CO 0.03 0.51 -0.07 -1.48 0.00 0.00 0.00 175.10 174.09 2x0h s LEU 615 N 1.35 2.27 -0.21 3.92 0.05 -0.68 0.31 118.68 125.68 2x0h s LEU 615 Ca 0.04 -0.57 -0.20 0.00 0.05 0.00 0.00 54.13 53.45 2x0h s LEU 615 Cb -0.13 -0.13 -0.02 0.00 -2.05 0.00 0.00 46.19 43.85 2x0h s LEU 615 CO -0.12 -0.23 0.61 -0.63 -0.55 0.00 0.00 176.35 175.44 2x0h s ILE 616 N -1.50 5.03 -0.05 1.48 1.01 -0.68 -0.39 121.20 126.10 2x0h s ILE 616 Ca -0.10 1.13 -0.39 0.00 0.00 0.00 0.00 60.65 61.30 2x0h s ILE 616 Cb -0.09 -3.92 -0.17 0.00 0.01 0.00 0.00 42.46 38.28 2x0h s ILE 616 CO -0.00 0.10 1.39 -1.20 0.00 0.00 0.00 174.94 175.23 2x0h n SER 617 N 5.15 1.43 -4.57 3.58 7.64 -0.87 -4.38 113.62 121.59 2x0h n SER 617 Ca -0.02 1.12 -0.24 0.00 1.01 0.00 0.00 58.87 60.75 2x0h n SER 617 Cb 0.50 -1.10 -0.07 0.00 -1.01 0.00 0.00 64.21 62.52 2x0h n SER 617 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2x0h s PRO 618 N 1.20 2.15 -0.19 1.43 0.02 -1.26 -4.86 135.00 133.48 2x0h s PRO 618 Ca 0.90 -0.74 -0.32 0.00 0.02 0.00 0.00 61.00 60.86 2x0h s PRO 618 Cb -1.08 -5.12 -0.14 0.00 0.02 0.00 0.00 34.50 28.17 2x0h s PRO 618 CO 0.55 -4.26 0.98 -1.91 -0.33 0.00 0.00 177.00 172.03 2x0h n GLU 632 N 8.39 0.00 -4.12 5.54 2.13 -1.26 -5.10 120.64 126.22 2x0h n GLU 632 Ca 0.43 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.91 2x0h n GLU 632 Cb 0.46 -1.08 -0.10 0.00 0.27 0.00 0.00 31.44 30.99 2x0h n GLU 632 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2x0h s ILE 633 N 1.14 4.57 -0.17 6.31 1.01 0.10 -4.22 121.20 129.95 2x0h s ILE 633 Ca 0.71 -0.12 -0.01 0.00 0.00 0.00 0.00 60.65 61.24 2x0h s ILE 633 Cb -1.01 -3.04 -0.00 0.00 0.01 0.00 0.00 42.46 38.43 2x0h s ILE 633 CO 0.51 0.48 -0.13 -0.70 0.00 0.00 0.00 174.94 175.10 2x0h s GLU 634 N 0.23 3.24 0.61 2.79 2.12 0.20 -0.24 118.70 127.65 2x0h s GLU 634 Ca 0.02 -0.72 -0.06 0.00 0.36 0.00 0.00 54.97 54.57 2x0h s GLU 634 Cb -0.13 -2.71 0.02 0.00 0.26 0.00 0.00 34.13 31.57 2x0h s GLU 634 CO 0.01 -0.05 0.92 -0.51 -0.54 0.00 0.00 175.26 175.09 2x0h s LEU 635 N 0.99 3.17 0.00 2.70 1.43 0.81 -0.50 118.68 127.27 2x0h s LEU 635 Ca -0.02 0.67 0.26 0.00 -1.03 0.00 0.00 54.13 54.02 2x0h s LEU 635 Cb -0.15 -3.48 1.16 0.00 0.03 0.00 0.00 46.19 43.75 2x0h s LEU 635 CO -0.02 -1.14 1.85 -0.90 0.23 0.00 0.00 176.35 176.36 2x0h n ASP 636 N -2.63 0.00 -3.12 2.29 5.75 -1.26 -4.87 116.55 112.70 2x0h n ASP 636 Ca 0.05 0.38 -0.07 0.00 -0.01 0.00 0.00 54.79 55.14 2x0h n ASP 636 Cb 0.58 -0.46 0.02 0.00 -1.03 0.00 0.00 41.12 40.23 2x0h n ASP 636 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2x0h s ALA 637 N -2.91 -1.03 -0.15 2.12 0.00 -1.26 -5.10 121.76 113.42 2x0h s ALA 637 Ca 0.15 -0.59 -0.18 0.00 0.00 0.00 0.00 51.96 51.34 2x0h s ALA 637 Cb 0.17 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.96 2x0h s ALA 637 CO 0.46 -1.01 0.48 0.42 0.00 0.00 0.00 175.76 176.11 2x0h s ILE 638 N -2.38 5.17 0.18 0.00 1.01 -1.26 -4.49 121.20 119.42 2x0h s ILE 638 Ca 0.17 0.93 0.09 0.00 0.00 0.00 0.00 60.65 61.84 2x0h s ILE 638 Cb -0.04 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 2x0h s ILE 638 CO 0.09 0.28 -0.18 -0.31 0.00 0.00 0.00 174.94 174.81 2x0h s TYR 639 N 0.98 1.86 0.09 3.97 2.02 -0.21 -4.90 117.35 121.16 2x0h s TYR 639 Ca 0.25 -0.47 -0.31 0.00 -0.37 0.00 0.00 57.07 56.17 2x0h s TYR 639 Cb -0.15 -0.91 -0.08 0.00 -0.40 0.00 0.00 41.96 40.41 2x0h s TYR 639 CO 0.10 0.36 1.49 -2.14 -1.57 0.00 0.00 175.55 173.78 2x0h s PRO 640 N -2.90 4.26 0.51 -1.71 0.02 -1.26 -0.15 135.00 133.78 2x0h s PRO 640 Ca 0.17 2.17 -0.14 0.00 0.02 0.00 0.00 61.00 63.22 2x0h s PRO 640 Cb -0.05 -3.37 -0.07 0.00 0.02 0.00 0.00 34.50 31.02 2x0h s PRO 640 CO 0.07 -0.57 0.95 0.20 -0.33 0.00 0.00 177.00 177.33 2x0h s GLY 641 N 1.56 1.95 0.04 0.52 0.00 0.81 -0.36 107.32 111.84 2x0h s GLY 641 Ca 0.68 0.04 -0.02 0.00 0.00 0.00 0.00 44.72 45.42 2x0h s GLY 641 CO 0.30 0.30 -0.04 -2.21 0.00 0.00 0.00 173.10 171.45 2x0h n GLU 642 N -1.78 0.06 -3.45 2.90 4.07 0.75 -1.57 120.64 121.62 2x0h n GLU 642 Ca 0.06 0.02 -0.11 0.00 -0.06 0.00 0.00 57.16 57.07 2x0h n GLU 642 Cb 0.54 -0.60 -0.02 0.00 -0.06 0.00 0.00 31.44 31.30 2x0h n GLU 642 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2x0h s ASN 643 N -5.80 -0.51 -0.20 4.31 2.20 -1.07 -1.54 114.94 112.33 2x0h s ASN 643 Ca -0.03 -0.02 -0.00 0.00 -0.94 0.00 0.00 52.86 51.87 2x0h s ASN 643 Cb 0.01 0.55 0.05 0.00 -2.00 0.00 0.00 41.25 39.86 2x0h s ASN 643 CO 0.05 -0.90 -0.05 -0.63 -2.94 0.00 0.00 177.10 172.63 2x0h s ILE 644 N -3.61 1.28 -0.15 0.54 1.01 -0.19 -1.59 121.20 118.50 2x0h s ILE 644 Ca 0.02 -0.92 -0.07 0.00 0.00 0.00 0.00 60.65 59.68 2x0h s ILE 644 Cb -0.01 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 2x0h s ILE 644 CO -0.12 -0.01 0.10 -1.10 0.00 0.00 0.00 174.94 173.81 2x0h s GLN 645 N 1.53 3.72 -0.01 2.79 -0.21 -0.53 -2.13 119.66 124.82 2x0h s GLN 645 Ca -0.03 -0.25 0.00 0.00 0.02 0.00 0.00 55.36 55.11 2x0h s GLN 645 Cb -0.17 -3.20 0.01 0.00 1.00 0.00 0.00 33.01 30.65 2x0h s GLN 645 CO -0.07 0.51 -0.00 0.42 -2.12 0.00 0.00 175.29 174.03 2x0h s ILE 646 N -0.28 0.06 -0.05 1.08 1.01 -1.02 -1.23 121.20 120.77 2x0h s ILE 646 Ca 0.10 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.78 2x0h s ILE 646 Cb -0.12 -0.11 0.02 0.00 0.01 0.00 0.00 42.46 42.27 2x0h s ILE 646 CO 0.01 0.05 -0.04 0.21 0.00 0.00 0.00 174.94 175.18 2x0h s ASN 647 N 0.36 1.12 -0.03 3.58 3.84 -0.26 -2.88 114.94 120.67 2x0h s ASN 647 Ca -0.03 -0.12 0.13 0.00 0.21 0.00 0.00 52.86 53.04 2x0h s ASN 647 Cb -0.05 -0.46 -0.20 0.00 -0.55 0.00 0.00 41.25 39.99 2x0h s ASN 647 CO -0.01 -0.09 0.26 0.49 -2.79 0.00 0.00 177.10 174.96 2x0h n PHE 648 N 4.31 0.00 0.00 0.43 3.72 -1.26 -3.02 117.46 121.64 2x0h n PHE 648 Ca -0.21 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.19 2x0h n PHE 648 Cb 0.51 -0.35 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 2x0h n PHE 648 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2x0h n LEU 680 N -2.03 0.00 -3.56 4.37 4.32 -1.14 -5.14 117.00 113.82 2x0h n LEU 680 Ca -0.05 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 55.88 2x0h n LEU 680 Cb 0.43 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.20 2x0h n LEU 680 CO 0.28 0.00 0.88 -0.94 -1.22 0.00 0.00 177.39 176.39 2x0h s SER 681 N 0.00 -0.23 -0.03 -1.43 1.04 -1.26 -2.42 113.70 109.37 2x0h s SER 681 Ca 0.00 0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.47 2x0h s SER 681 Cb 0.00 0.24 0.02 0.00 0.10 0.00 0.00 66.02 66.38 2x0h s SER 681 CO 0.00 -0.37 -0.03 0.00 0.98 0.00 0.00 173.24 173.81 2x0h s ALA 682 N -2.54 0.51 0.38 5.32 0.00 -0.91 -5.00 121.76 119.52 2x0h s ALA 682 Ca 0.07 -0.01 -0.25 0.00 0.00 0.00 0.00 51.96 51.77 2x0h s ALA 682 Cb -0.01 -0.32 -0.09 0.00 0.00 0.00 0.00 23.12 22.70 2x0h s ALA 682 CO -0.06 -0.00 1.06 0.20 0.00 0.00 0.00 175.76 176.96 2x0h s GLY 683 N 0.74 2.81 -0.01 0.00 0.00 -1.26 -1.02 107.32 108.57 2x0h s GLY 683 Ca -0.09 0.75 0.10 0.00 0.00 0.00 0.00 44.72 45.49 2x0h s GLY 683 CO -0.00 1.22 0.28 1.04 0.00 0.00 0.00 173.10 175.64 2x0h n LEU 684 N 0.18 0.12 -3.70 0.66 4.77 -0.59 -4.93 117.00 113.52 2x0h n LEU 684 Ca 0.04 -0.13 -0.24 0.00 -0.03 0.00 0.00 56.01 55.66 2x0h n LEU 684 Cb 0.48 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.62 2x0h n LEU 684 CO 0.47 0.03 0.07 0.00 -1.33 0.00 0.00 177.39 176.63 2x0h n GLN 685 N -1.71 -5.97 -1.10 3.23 6.02 -1.25 -2.35 117.38 114.24 2x0h n GLN 685 Ca -0.01 0.69 -0.04 0.00 -0.01 0.00 0.00 57.00 57.64 2x0h n GLN 685 Cb 0.24 -5.52 -0.02 0.00 1.02 0.00 0.00 30.24 25.97 2x0h n GLN 685 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2x0h n LYS 686 N -4.51 -1.27 -1.76 -1.09 4.76 -0.61 -4.96 118.16 108.72 2x0h n LYS 686 Ca -0.14 0.51 -0.41 0.00 -2.87 0.00 0.00 58.31 55.39 2x0h n LYS 686 Cb 0.61 -4.55 -0.01 0.00 -1.84 0.00 0.00 35.03 29.24 2x0h n LYS 686 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2x0h n ALA 687 N 1.07 2.47 -1.81 7.82 0.00 -0.99 -4.15 120.51 124.92 2x0h n ALA 687 Ca -0.04 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.35 2x0h n ALA 687 Cb 0.37 -2.44 -0.02 0.00 0.00 0.00 0.00 19.45 17.36 2x0h n ALA 687 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2x0h s PRO 688 N -1.15 4.20 -0.05 0.00 0.02 -1.26 -0.14 135.00 136.62 2x0h s PRO 688 Ca 0.60 2.43 -0.03 0.00 0.02 0.00 0.00 61.00 64.02 2x0h s PRO 688 Cb -0.49 -3.05 0.03 0.00 0.02 0.00 0.00 34.50 31.01 2x0h s PRO 688 CO 0.55 -0.48 0.12 0.54 -0.33 0.00 0.00 177.00 177.40 2x0h s VAL 689 N -0.35 -0.04 0.00 3.83 0.11 0.79 -4.85 120.40 119.90 2x0h s VAL 689 Ca 0.58 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.77 2x0h s VAL 689 Cb -0.44 -0.20 0.00 0.00 -1.53 0.00 0.00 36.38 34.20 2x0h s VAL 689 CO 0.50 0.06 0.00 1.17 -3.33 0.00 0.00 175.10 173.49 2x0h n LYS 690 N 3.89 0.00 -4.43 1.54 4.81 -1.26 -1.04 118.16 121.67 2x0h n LYS 690 Ca -0.23 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 56.87 2x0h n LYS 690 Cb 0.53 -0.76 -0.12 0.00 0.02 0.00 0.00 35.03 34.71 2x0h n LYS 690 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 2x0h s PHE 691 N -1.82 3.03 -0.17 5.64 0.08 -1.26 -0.14 117.98 123.34 2x0h s PHE 691 Ca 0.00 -0.21 0.01 0.00 0.12 0.00 0.00 56.93 56.85 2x0h s PHE 691 Cb 0.00 -1.91 0.01 0.00 -0.57 0.00 0.00 43.02 40.55 2x0h s PHE 691 CO 0.00 0.06 -0.20 0.08 -0.10 0.00 0.00 175.22 175.06 2x0h s VAL 692 N 0.10 2.13 0.05 -0.44 1.01 0.67 -4.99 120.40 118.92 2x0h s VAL 692 Ca -0.01 -0.93 0.06 0.00 0.00 0.00 0.00 61.98 61.10 2x0h s VAL 692 Cb -0.14 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 2x0h s VAL 692 CO 0.03 0.54 -0.17 -0.60 0.00 0.00 0.00 175.10 174.89 2x0h s ARG 693 N 1.11 1.12 0.00 2.72 3.52 -1.26 0.03 118.95 126.20 2x0h s ARG 693 Ca 0.00 -0.89 0.00 0.00 -0.13 0.00 0.00 55.73 54.72 2x0h s ARG 693 Cb -0.14 -1.20 0.00 0.00 -1.56 0.00 0.00 34.95 32.05 2x0h s ARG 693 CO -0.08 0.30 0.00 0.34 -0.81 0.00 0.00 175.30 175.05 2x0h n PHE 694 N 1.75 0.00 0.00 5.12 7.35 -1.26 -5.01 117.46 125.41 2x0h n PHE 694 Ca -0.18 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.51 2x0h n PHE 694 Cb 0.54 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.37 2x0h n PHE 694 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2x0h n GLN 708 N 0.00 0.00 -3.31 -4.13 10.64 -1.17 -4.82 117.38 114.59 2x0h n GLN 708 Ca 0.00 0.00 -0.11 0.00 -1.83 0.00 0.00 57.00 55.06 2x0h n GLN 708 Cb 0.00 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.32 2x0h n GLN 708 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.06 175.35 2x0h s PHE 709 N 0.00 -0.78 -0.10 2.61 5.36 -1.25 -1.10 117.98 122.73 2x0h s PHE 709 Ca 0.00 -0.40 0.02 0.00 -0.96 0.00 0.00 56.93 55.58 2x0h s PHE 709 Cb 0.00 -0.18 0.01 0.00 -0.34 0.00 0.00 43.02 42.52 2x0h s PHE 709 CO 0.00 -1.03 -0.15 0.08 -1.46 0.00 0.00 175.22 172.66 2x0h s VAL 710 N 1.66 1.43 -0.23 3.12 1.01 -0.37 -1.69 120.40 125.33 2x0h s VAL 710 Ca 0.16 -0.61 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 2x0h s VAL 710 Cb -0.12 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 2x0h s VAL 710 CO -0.07 0.43 0.28 -0.22 0.00 0.00 0.00 175.10 175.51 2x0h s LEU 711 N 0.92 4.12 -0.23 3.92 2.96 0.15 -1.45 118.68 129.07 2x0h s LEU 711 Ca -0.08 0.28 -0.08 0.00 -0.22 0.00 0.00 54.13 54.03 2x0h s LEU 711 Cb -0.15 -2.30 -0.04 0.00 0.50 0.00 0.00 46.19 44.21 2x0h s LEU 711 CO -0.00 -0.02 0.08 -0.89 -1.32 0.00 0.00 176.35 174.19 2x0h s THR 712 N 1.31 4.58 0.35 3.68 2.01 -0.62 0.54 115.64 127.49 2x0h s THR 712 Ca 0.13 -0.09 0.08 0.00 0.31 0.00 0.00 61.69 62.12 2x0h s THR 712 Cb -0.14 -3.12 -0.05 0.00 0.01 0.00 0.00 72.50 69.20 2x0h s THR 712 CO 0.07 0.38 0.11 0.27 -0.69 0.00 0.00 174.62 174.75 2x0h s ILE 713 N 1.15 2.82 -0.28 1.82 -4.36 -0.27 -0.18 121.20 121.90 2x0h s ILE 713 Ca 0.05 -1.78 -0.29 0.00 -0.26 0.00 0.00 60.65 58.37 2x0h s ILE 713 Cb -0.14 -2.92 0.01 0.00 1.25 0.00 0.00 42.46 40.66 2x0h s ILE 713 CO 0.04 -0.17 1.04 -0.70 0.24 0.00 0.00 174.94 175.38 2x0h s GLU 714 N -3.81 4.14 0.00 0.37 2.12 0.51 -4.78 118.70 117.24 2x0h s GLU 714 Ca 0.37 1.15 0.00 0.00 0.36 0.00 0.00 54.97 56.85 2x0h s GLU 714 Cb -0.01 -3.70 0.00 0.00 0.26 0.00 0.00 34.13 30.68 2x0h s GLU 714 CO 0.22 -0.77 0.00 1.17 -0.54 0.00 0.00 175.26 175.33