#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2du3 s LYS 2 N 0.00 3.17 0.27 3.17 -2.85 -1.26 -4.79 119.74 117.45 2du3 s LYS 2 Ca 0.00 0.57 0.04 0.00 -1.00 0.00 0.00 55.97 55.58 2du3 s LYS 2 Cb 0.00 -2.05 -0.03 0.00 -2.06 0.00 0.00 37.83 33.68 2du3 s LYS 2 CO 0.00 -0.84 0.21 -0.59 0.10 0.00 0.00 175.35 174.23 2du3 s PHE 3 N -3.28 1.50 -0.29 1.78 -0.12 -1.26 -5.03 117.98 111.28 2du3 s PHE 3 Ca 0.57 -1.53 -0.15 0.00 -0.05 0.00 0.00 56.93 55.76 2du3 s PHE 3 Cb -0.11 -0.66 -0.03 0.00 -0.63 0.00 0.00 43.02 41.59 2du3 s PHE 3 CO 0.53 -0.76 0.38 0.34 -0.05 0.00 0.00 175.22 175.66 2du3 s ASP 4 N -3.28 6.24 0.10 1.98 2.15 -1.26 -4.99 116.67 117.60 2du3 s ASP 4 Ca 0.40 0.13 -0.25 0.00 0.43 0.00 0.00 52.55 53.25 2du3 s ASP 4 Cb 0.04 -2.21 -0.12 0.00 -0.30 0.00 0.00 42.92 40.34 2du3 s ASP 4 CO 0.21 -0.25 1.69 -0.65 -0.17 0.00 0.00 175.17 176.00 2du3 h PRO 5 N 8.27 -0.28 -0.57 4.34 0.11 -2.00 -2.51 132.00 139.37 2du3 h PRO 5 Ca -0.31 0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.90 2du3 h PRO 5 Cb 1.15 0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 2du3 h PRO 5 CO 0.67 -0.18 0.22 0.37 -0.21 0.00 0.00 178.00 178.86 2du3 h GLN 6 N -0.29 0.39 0.20 1.05 4.15 -1.99 0.36 115.11 118.98 2du3 h GLN 6 Ca 0.01 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.41 2du3 h GLN 6 Cb 0.28 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.86 2du3 h GLN 6 CO -0.05 0.26 -0.26 -0.22 -1.93 0.00 0.00 178.83 176.63 2du3 h LYS 7 N 0.40 -0.50 -0.90 1.69 1.63 -1.97 -1.11 116.57 115.81 2du3 h LYS 7 Ca 0.28 0.03 0.03 0.00 -0.85 0.00 0.00 60.65 60.14 2du3 h LYS 7 Cb 0.32 0.11 -0.05 0.00 -0.60 0.00 0.00 32.23 32.01 2du3 h LYS 7 CO -0.27 -0.33 0.59 1.88 -3.45 0.00 0.00 179.45 177.86 2du3 h TYR 8 N -0.52 1.10 0.18 1.91 0.05 -0.97 -1.08 116.97 117.64 2du3 h TYR 8 Ca 0.01 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 2du3 h TYR 8 Cb 0.51 -0.37 0.00 0.00 1.01 0.00 0.00 36.73 37.88 2du3 h TYR 8 CO -0.20 0.65 -0.09 0.00 -1.05 0.00 0.00 178.16 177.47 2du3 h ARG 9 N 1.15 -0.23 0.00 4.88 3.08 -0.55 0.64 114.38 123.34 2du3 h ARG 9 Ca 0.35 0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.34 2du3 h ARG 9 Cb -0.02 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2du3 h ARG 9 CO -0.10 -0.14 -0.38 1.05 -1.07 0.00 0.00 179.97 179.34 2du3 h GLU 10 N -0.27 0.00 0.02 0.04 4.11 -0.88 -0.53 114.58 117.07 2du3 h GLU 10 Ca -0.02 0.00 -0.23 0.00 0.07 0.00 0.00 59.36 59.18 2du3 h GLU 10 Cb 0.21 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 2du3 h GLU 10 CO 0.04 0.38 -1.10 1.25 0.07 0.00 0.00 179.01 179.64 2du3 h LEU 11 N 0.00 0.07 -0.33 3.06 5.85 -1.11 -3.30 115.31 119.55 2du3 h LEU 11 Ca -0.00 -0.08 -0.18 0.00 0.84 0.00 0.00 57.88 58.45 2du3 h LEU 11 Cb 0.73 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 2du3 h LEU 11 CO 0.05 1.06 -0.84 0.00 -0.34 0.00 0.00 178.44 178.37 2du3 h ALA 12 N 0.92 0.59 0.00 1.25 0.00 -0.51 -0.33 119.26 121.19 2du3 h ALA 12 Ca -0.06 -0.73 -0.04 0.00 0.00 0.00 0.00 54.91 54.08 2du3 h ALA 12 Cb 1.82 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 2du3 h ALA 12 CO 0.14 0.97 -0.20 1.49 0.00 0.00 0.00 179.25 181.65 2du3 h GLU 13 N 0.05 0.00 0.00 0.00 4.81 -1.19 -3.22 114.58 115.03 2du3 h GLU 13 Ca -0.02 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.93 2du3 h GLU 13 Cb 1.47 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.81 2du3 h GLU 13 CO 0.12 0.20 -1.91 1.63 -0.73 0.00 0.00 179.01 178.32 2du3 n LYS 14 N -3.75 0.54 -3.76 1.92 4.76 -1.18 -4.86 118.16 111.83 2du3 n LYS 14 Ca -0.02 0.23 -0.28 0.00 -2.87 0.00 0.00 58.31 55.37 2du3 n LYS 14 Cb 0.31 -1.42 -0.12 0.00 -1.84 0.00 0.00 35.03 31.96 2du3 n LYS 14 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2du3 s ASP 15 N -6.83 3.79 0.11 4.39 3.68 -0.14 -5.01 116.67 116.66 2du3 s ASP 15 Ca -0.33 -3.27 -0.31 0.00 2.13 0.00 0.00 52.55 50.76 2du3 s ASP 15 Cb 0.10 -1.24 -0.11 0.00 -1.45 0.00 0.00 42.92 40.22 2du3 s ASP 15 CO 0.44 -0.17 1.59 0.15 0.13 0.00 0.00 175.17 177.32 2du3 h PHE 16 N 5.93 -1.15 -0.67 -5.34 3.57 -1.72 -2.70 116.94 114.86 2du3 h PHE 16 Ca 0.10 0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.76 2du3 h PHE 16 Cb 0.85 0.48 -0.10 0.00 2.79 0.00 0.00 35.95 39.97 2du3 h PHE 16 CO 0.53 -0.52 0.13 0.93 -2.23 0.00 0.00 178.31 177.15 2du3 h GLU 17 N -0.68 0.24 -0.54 1.11 4.39 -1.94 0.22 114.58 117.37 2du3 h GLU 17 Ca 0.01 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.75 2du3 h GLU 17 Cb 0.69 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 29.23 2du3 h GLU 17 CO -0.21 0.16 0.27 0.00 -1.16 0.00 0.00 179.01 178.07 2du3 h ALA 18 N 1.55 0.70 -0.06 3.43 0.00 -1.88 0.24 119.26 123.24 2du3 h ALA 18 Ca 0.36 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 2du3 h ALA 18 Cb 0.58 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2du3 h ALA 18 CO -0.47 -0.08 0.01 0.00 0.00 0.00 0.00 179.25 178.71 2du3 h ALA 19 N 1.30 0.07 -0.25 0.00 0.00 -0.92 -1.19 119.26 118.28 2du3 h ALA 19 Ca 0.25 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.09 2du3 h ALA 19 Cb 0.17 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 2du3 h ALA 19 CO -0.18 -0.30 -0.15 2.35 0.00 0.00 0.00 179.25 180.97 2du3 h TRP 20 N -0.13 -0.36 -0.73 0.00 7.01 -0.62 -1.21 115.95 119.91 2du3 h TRP 20 Ca 0.02 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.02 2du3 h TRP 20 Cb 0.24 0.20 -0.03 0.00 -2.10 0.00 0.00 29.16 27.46 2du3 h TRP 20 CO 0.00 -0.22 0.33 -0.22 -2.79 0.00 0.00 178.44 175.55 2du3 h LYS 21 N -0.13 1.05 0.00 2.65 3.64 -0.92 -1.77 116.57 121.09 2du3 h LYS 21 Ca 0.14 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2du3 h LYS 21 Cb 0.33 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2du3 h LYS 21 CO -0.32 0.82 -0.01 0.00 -2.27 0.00 0.00 179.45 177.67 2du3 h ALA 22 N 1.33 1.01 -0.91 5.00 0.00 -0.19 -3.09 119.26 122.40 2du3 h ALA 22 Ca 0.25 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 55.41 2du3 h ALA 22 Cb 0.13 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2du3 h ALA 22 CO -0.03 0.01 0.65 0.78 0.00 0.00 0.00 179.25 180.65 2du3 h GLY 23 N 1.20 0.20 1.40 0.00 0.00 -0.33 -0.95 103.07 104.60 2du3 h GLY 23 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2du3 h GLY 23 CO 0.00 -0.01 0.29 0.50 0.00 0.00 0.00 176.54 177.33 2du3 h LYS 24 N 0.08 0.00 0.00 4.80 1.57 -1.73 -0.97 116.57 120.33 2du3 h LYS 24 Ca 0.45 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.18 2du3 h LYS 24 Cb 1.64 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.94 2du3 h LYS 24 CO -0.05 0.00 -0.21 1.05 -0.57 0.00 0.00 179.45 179.67 2du3 h GLU 25 N 0.00 0.00 -0.00 3.15 4.11 -1.44 -2.79 114.58 117.60 2du3 h GLU 25 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2du3 h GLU 25 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2du3 h GLU 25 CO 0.00 0.21 -0.10 0.44 0.07 0.00 0.00 179.01 179.64 2du3 n ILE 26 N -3.76 0.00 -1.59 -1.06 -5.35 -0.37 -4.74 119.36 102.50 2du3 n ILE 26 Ca -0.02 -0.02 -0.31 0.00 -0.27 0.00 0.00 62.75 62.13 2du3 n ILE 26 Cb 0.32 -0.28 0.05 0.00 -1.74 0.00 0.00 39.64 37.99 2du3 n ILE 26 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2du3 s LEU 27 N -2.72 3.19 -0.08 7.28 1.43 -1.06 -1.54 118.68 125.19 2du3 s LEU 27 Ca 0.22 1.74 -0.12 0.00 -1.03 0.00 0.00 54.13 54.94 2du3 s LEU 27 Cb 0.19 -4.51 -0.05 0.00 0.03 0.00 0.00 46.19 41.85 2du3 s LEU 27 CO 0.52 -1.57 0.29 0.00 0.23 0.00 0.00 176.35 175.82 2du3 s ALA 28 N -2.84 3.74 -0.44 4.21 0.00 -1.26 -4.60 121.76 120.56 2du3 s ALA 28 Ca 0.61 -0.42 -0.22 0.00 0.00 0.00 0.00 51.96 51.93 2du3 s ALA 28 Cb -0.16 -2.24 0.02 0.00 0.00 0.00 0.00 23.12 20.75 2du3 s ALA 28 CO 0.51 0.45 0.72 -1.21 0.00 0.00 0.00 175.76 176.22 2du3 s GLU 29 N -0.73 3.35 0.08 0.00 2.02 -1.26 -5.04 118.70 117.12 2du3 s GLU 29 Ca 0.19 -0.23 -0.19 0.00 0.02 0.00 0.00 54.97 54.76 2du3 s GLU 29 Cb -0.14 -3.94 -0.07 0.00 0.10 0.00 0.00 34.13 30.08 2du3 s GLU 29 CO 0.08 -1.06 0.56 1.03 0.02 0.00 0.00 175.26 175.89 2du3 s ARG 30 N 3.06 4.17 0.73 1.61 1.81 -1.26 -5.09 118.95 123.98 2du3 s ARG 30 Ca 0.26 0.71 -0.12 0.00 -1.72 0.00 0.00 55.73 54.87 2du3 s ARG 30 Cb -0.13 -3.21 0.03 0.00 -0.45 0.00 0.00 34.95 31.19 2du3 s ARG 30 CO 0.21 0.63 1.11 -1.54 -0.68 0.00 0.00 175.30 175.02 2du3 s SER 31 N -1.17 5.25 0.34 0.23 1.04 -1.26 -4.91 113.70 113.22 2du3 s SER 31 Ca 0.30 1.11 0.13 0.00 0.48 0.00 0.00 55.95 57.96 2du3 s SER 31 Cb -0.19 -1.86 1.02 0.00 0.10 0.00 0.00 66.02 65.09 2du3 s SER 31 CO 0.19 -1.46 1.69 1.55 0.98 0.00 0.00 173.24 176.18 2du3 h PRO 32 N -0.74 0.40 -0.10 4.02 0.13 -1.98 0.36 132.00 134.09 2du3 h PRO 32 Ca -0.45 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2du3 h PRO 32 Cb 1.26 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2du3 h PRO 32 CO 0.64 0.26 0.00 0.09 -0.23 0.00 0.00 178.00 178.76 2du3 n ASN 33 N -4.99 0.85 -0.74 1.44 3.02 -1.26 -3.11 115.26 110.47 2du3 n ASN 33 Ca 0.30 -1.65 0.08 0.00 -0.03 0.00 0.00 54.58 53.27 2du3 n ASN 33 Cb 0.91 -0.07 0.14 0.00 -0.61 0.00 0.00 39.78 40.15 2du3 n ASN 33 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2du3 n GLU 34 N -0.19 2.00 -3.80 3.52 1.02 0.11 -4.49 120.64 118.81 2du3 n GLU 34 Ca 0.13 -1.84 -0.36 0.00 -0.02 0.00 0.00 57.16 55.07 2du3 n GLU 34 Cb 0.19 -1.33 -0.06 0.00 -0.02 0.00 0.00 31.44 30.22 2du3 n GLU 34 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2du3 s LEU 35 N -1.12 4.39 0.46 -4.62 1.02 -1.18 -4.72 118.68 112.91 2du3 s LEU 35 Ca 0.25 0.54 -0.25 0.00 0.02 0.00 0.00 54.13 54.69 2du3 s LEU 35 Cb 0.14 -2.36 -0.08 0.00 0.02 0.00 0.00 46.19 43.91 2du3 s LEU 35 CO 0.20 0.34 1.41 0.00 0.02 0.00 0.00 176.35 178.32 2du3 n TYR 36 N 1.60 2.61 0.61 0.29 9.36 -1.26 0.06 117.16 130.43 2du3 n TYR 36 Ca -0.16 0.44 0.04 0.00 3.32 0.00 0.00 57.90 61.54 2du3 n TYR 36 Cb 0.54 -2.44 0.15 0.00 -0.63 0.00 0.00 39.34 36.95 2du3 n TYR 36 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2du3 n PRO 37 N -0.26 2.17 0.25 2.98 -0.04 -1.26 -4.90 135.00 133.93 2du3 n PRO 37 Ca 0.06 -1.16 0.14 0.00 -0.04 0.00 0.00 63.50 62.50 2du3 n PRO 37 Cb 0.42 -1.56 0.54 0.00 -0.04 0.00 0.00 33.50 32.86 2du3 n PRO 37 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2du3 h ARG 38 N 1.63 0.00 -6.38 0.54 3.08 -0.61 -3.37 114.38 109.26 2du3 h ARG 38 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.40 2du3 h ARG 38 Cb 0.79 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.71 2du3 h ARG 38 CO 0.11 0.09 -0.67 0.14 -1.07 0.00 0.00 179.97 178.56 2du3 s VAL 39 N -3.60 3.92 0.29 2.04 -7.23 -1.21 -4.93 120.40 109.67 2du3 s VAL 39 Ca 0.02 -1.03 -0.19 0.00 -1.81 0.00 0.00 61.98 58.96 2du3 s VAL 39 Cb 0.09 -2.86 0.06 0.00 0.56 0.00 0.00 36.38 34.23 2du3 s VAL 39 CO 0.59 0.12 0.89 -0.83 -0.31 0.00 0.00 175.10 175.56 2du3 s GLY 40 N -2.30 0.20 0.16 2.32 0.00 -1.26 -4.71 107.32 101.73 2du3 s GLY 40 Ca 0.25 -0.50 0.11 0.00 0.00 0.00 0.00 44.72 44.58 2du3 s GLY 40 CO 0.18 0.69 -0.25 -1.36 0.00 0.00 0.00 173.10 172.36 2du3 s PHE 41 N -2.46 2.29 0.40 1.90 0.08 -1.26 -5.15 117.98 113.79 2du3 s PHE 41 Ca 0.17 -0.37 0.05 0.00 0.12 0.00 0.00 56.93 56.90 2du3 s PHE 41 Cb -0.04 -1.19 -0.06 0.00 -0.57 0.00 0.00 43.02 41.16 2du3 s PHE 41 CO 0.08 0.42 0.03 -1.54 -0.10 0.00 0.00 175.22 174.12 2du3 s SER 42 N -2.38 3.37 -0.06 1.36 1.04 -1.26 -5.15 113.70 110.62 2du3 s SER 42 Ca 0.17 -1.44 -0.31 0.00 0.48 0.00 0.00 55.95 54.86 2du3 s SER 42 Cb -0.09 -0.10 0.08 0.00 0.10 0.00 0.00 66.02 66.00 2du3 s SER 42 CO 0.08 -0.59 0.71 0.72 0.98 0.00 0.00 173.24 175.13 2du3 s PHE 43 N -2.95 -0.63 0.39 5.02 -0.71 -1.26 -5.16 117.98 112.68 2du3 s PHE 43 Ca 0.30 1.07 -0.20 0.00 -1.04 0.00 0.00 56.93 57.06 2du3 s PHE 43 Cb 0.08 0.42 -0.10 0.00 -1.21 0.00 0.00 43.02 42.20 2du3 s PHE 43 CO 0.15 -0.59 0.90 0.20 -1.34 0.00 0.00 175.22 174.54 2du3 s GLY 44 N -1.22 2.43 0.19 1.99 0.00 -1.26 -5.08 107.32 104.38 2du3 s GLY 44 Ca -0.10 0.34 0.06 0.00 0.00 0.00 0.00 44.72 45.02 2du3 s GLY 44 CO 0.09 0.63 0.12 0.54 0.00 0.00 0.00 173.10 174.48 2du3 s LYS 45 N -2.99 2.81 0.22 2.90 1.02 -1.26 -5.12 119.74 117.33 2du3 s LYS 45 Ca 0.59 -0.96 -0.07 0.00 0.02 0.00 0.00 55.97 55.54 2du3 s LYS 45 Cb -0.10 -2.57 -0.06 0.00 -0.52 0.00 0.00 37.83 34.57 2du3 s LYS 45 CO 0.15 0.46 0.51 -1.21 -0.92 0.00 0.00 175.35 174.34 2du3 s GLU 46 N -3.25 3.72 0.05 1.68 2.02 -1.26 -5.07 118.70 116.58 2du3 s GLU 46 Ca 0.31 0.13 -0.22 0.00 0.02 0.00 0.00 54.97 55.21 2du3 s GLU 46 Cb -0.09 -2.69 -0.06 0.00 0.10 0.00 0.00 34.13 31.38 2du3 s GLU 46 CO 0.23 0.33 0.65 -1.58 0.02 0.00 0.00 175.26 174.91 2du3 s HIS 47 N -1.84 3.75 0.29 1.61 5.65 -1.26 -4.97 115.29 118.52 2du3 s HIS 47 Ca 0.45 1.34 0.04 0.00 0.25 0.00 0.00 55.06 57.13 2du3 s HIS 47 Cb -0.11 -2.65 0.70 0.00 -1.18 0.00 0.00 32.58 29.34 2du3 s HIS 47 CO 0.24 0.41 1.73 -1.00 -0.65 0.00 0.00 174.74 175.48 2du3 h PRO 48 N 5.21 0.54 0.49 2.88 0.13 -1.98 -1.32 132.00 137.94 2du3 h PRO 48 Ca -0.46 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.62 2du3 h PRO 48 Cb 1.21 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 2du3 h PRO 48 CO 0.68 0.35 -0.29 1.25 -0.23 0.00 0.00 178.00 179.76 2du3 h LEU 49 N 0.55 -0.73 -1.44 1.56 6.46 -1.93 -1.59 115.31 118.20 2du3 h LEU 49 Ca 0.55 0.04 -0.06 0.00 -0.12 0.00 0.00 57.88 58.29 2du3 h LEU 49 Cb 0.95 0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.08 2du3 h LEU 49 CO -0.45 -0.46 -0.28 -0.26 -0.62 0.00 0.00 178.44 176.36 2du3 h PHE 50 N -0.74 0.00 -0.02 1.25 -1.00 -1.91 -1.52 116.94 113.00 2du3 h PHE 50 Ca -0.06 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.72 2du3 h PHE 50 Cb 0.60 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.16 2du3 h PHE 50 CO -0.09 0.28 0.01 0.00 -1.61 0.00 0.00 178.31 176.90 2du3 h ALA 51 N 1.72 0.02 -0.65 2.45 0.00 -1.00 -2.19 119.26 119.60 2du3 h ALA 51 Ca -0.00 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.89 2du3 h ALA 51 Cb 0.53 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 2du3 h ALA 51 CO 0.04 -0.42 0.39 1.15 0.00 0.00 0.00 179.25 180.41 2du3 h THR 52 N -0.10 1.03 -0.95 0.00 2.02 -0.89 -2.02 112.91 112.00 2du3 h THR 52 Ca 0.01 -0.25 0.04 0.00 0.77 0.00 0.00 66.41 66.97 2du3 h THR 52 Cb 0.12 0.23 -0.06 0.00 -1.74 0.00 0.00 68.15 66.70 2du3 h THR 52 CO -0.00 0.13 0.62 0.40 0.37 0.00 0.00 175.52 177.04 2du3 h ILE 53 N 0.74 1.15 -0.29 3.11 2.04 -1.09 0.32 117.51 123.48 2du3 h ILE 53 Ca 0.28 -0.41 -0.10 0.00 1.00 0.00 0.00 64.86 65.62 2du3 h ILE 53 Cb 0.10 -0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.02 2du3 h ILE 53 CO -0.14 0.22 -0.26 -0.61 0.00 0.00 0.00 178.15 177.36 2du3 h GLN 54 N 1.20 0.57 -0.36 2.37 5.75 -0.86 -0.09 115.11 123.70 2du3 h GLN 54 Ca 0.38 -0.23 -0.12 0.00 -0.15 0.00 0.00 58.65 58.53 2du3 h GLN 54 Cb 0.02 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 2du3 h GLN 54 CO -0.13 0.78 -0.25 0.00 -2.65 0.00 0.00 178.83 176.58 2du3 h ARG 55 N 0.50 0.80 -0.77 1.69 3.08 -0.73 -1.99 114.38 116.97 2du3 h ARG 55 Ca 0.07 -0.39 -0.02 0.00 0.07 0.00 0.00 59.98 59.72 2du3 h ARG 55 Cb 0.71 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.72 2du3 h ARG 55 CO 0.05 1.02 0.41 -0.07 -1.07 0.00 0.00 179.97 180.31 2du3 h LEU 56 N 0.59 0.96 -0.25 3.04 4.07 -0.65 0.97 115.31 124.05 2du3 h LEU 56 Ca 0.07 -0.09 -0.00 0.00 0.08 0.00 0.00 57.88 57.94 2du3 h LEU 56 Cb 0.82 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.30 2du3 h LEU 56 CO 0.07 0.78 0.15 0.03 -1.08 0.00 0.00 178.44 178.39 2du3 h ARG 57 N 1.08 0.34 -0.75 1.13 3.08 -0.72 -0.76 114.38 117.77 2du3 h ARG 57 Ca 0.27 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.26 2du3 h ARG 57 Cb 0.04 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 2du3 h ARG 57 CO -0.04 0.27 0.33 0.93 -1.07 0.00 0.00 179.97 180.39 2du3 h GLU 58 N 0.31 1.09 -0.18 0.04 5.08 -0.84 -1.86 114.58 118.22 2du3 h GLU 58 Ca 0.09 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2du3 h GLU 58 Cb 0.02 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.07 2du3 h GLU 58 CO -0.02 0.86 -0.08 0.00 -1.00 0.00 0.00 179.01 178.77 2du3 h ALA 59 N 1.29 0.25 -0.76 3.43 0.00 -0.40 -0.61 119.26 122.44 2du3 h ALA 59 Ca 0.26 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2du3 h ALA 59 Cb 0.15 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2du3 h ALA 59 CO -0.03 0.06 0.26 1.88 0.00 0.00 0.00 179.25 181.42 2du3 h TYR 60 N 0.05 1.20 -0.52 0.00 0.05 -1.11 -2.85 116.97 113.78 2du3 h TYR 60 Ca 0.04 -0.11 -0.04 0.00 0.05 0.00 0.00 58.73 58.67 2du3 h TYR 60 Cb 0.56 -0.35 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 2du3 h TYR 60 CO 0.06 0.93 0.17 -0.07 -1.05 0.00 0.00 178.16 178.20 2du3 h LEU 61 N 1.12 0.76 -2.37 3.88 3.38 -1.27 -2.53 115.31 118.28 2du3 h LEU 61 Ca 0.25 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2du3 h LEU 61 Cb 0.27 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2du3 h LEU 61 CO -0.01 0.76 -0.03 0.77 0.09 0.00 0.00 178.44 180.02 2du3 h SER 62 N 0.72 0.00 -0.58 -0.43 4.64 -0.89 -1.67 113.55 115.34 2du3 h SER 62 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2du3 h SER 62 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2du3 h SER 62 CO -0.01 0.03 0.00 2.30 -0.87 0.00 0.00 176.83 178.29 2du3 n ILE 63 N -3.69 2.57 -0.51 0.95 -5.35 -1.01 -4.96 119.36 107.35 2du3 n ILE 63 Ca -0.03 -1.34 0.00 0.00 -0.27 0.00 0.00 62.75 61.11 2du3 n ILE 63 Cb 0.13 -0.21 0.00 0.00 -1.74 0.00 0.00 39.64 37.81 2du3 n ILE 63 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2du3 n GLY 64 N 0.71 0.75 3.84 3.28 0.00 -0.63 -5.08 105.19 108.07 2du3 n GLY 64 Ca 0.27 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 2du3 n GLY 64 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2du3 s PHE 65 N -2.39 3.60 -0.03 1.61 0.40 -0.99 -4.77 117.98 115.41 2du3 s PHE 65 Ca 0.00 1.12 -0.01 0.00 -0.60 0.00 0.00 56.93 57.44 2du3 s PHE 65 Cb 0.00 -2.42 -0.04 0.00 0.51 0.00 0.00 43.02 41.07 2du3 s PHE 65 CO 0.00 0.39 0.08 -1.12 0.70 0.00 0.00 175.22 175.27 2du3 s SER 66 N -1.74 5.69 0.36 1.36 0.01 0.57 -4.25 113.70 115.70 2du3 s SER 66 Ca 0.40 0.18 -0.27 0.00 1.31 0.00 0.00 55.95 57.57 2du3 s SER 66 Cb -0.15 -1.66 -0.09 0.00 0.21 0.00 0.00 66.02 64.33 2du3 s SER 66 CO 0.20 0.30 1.16 -0.70 0.41 0.00 0.00 173.24 174.61 2du3 s GLU 67 N -1.53 4.26 0.08 12.44 2.12 -1.26 -0.85 118.70 133.96 2du3 s GLU 67 Ca 0.21 1.85 -0.09 0.00 0.36 0.00 0.00 54.97 57.30 2du3 s GLU 67 Cb -0.12 -2.85 0.00 0.00 0.26 0.00 0.00 34.13 31.42 2du3 s GLU 67 CO 0.11 -0.15 0.20 0.08 -0.54 0.00 0.00 175.26 174.96 2du3 s VAL 68 N -1.33 0.13 -0.20 3.70 1.01 -0.24 -4.88 120.40 118.60 2du3 s VAL 68 Ca 0.53 -1.10 0.01 0.00 0.00 0.00 0.00 61.98 61.41 2du3 s VAL 68 Cb -0.32 -1.24 0.02 0.00 0.00 0.00 0.00 36.38 34.85 2du3 s VAL 68 CO 0.40 -0.61 -0.17 -0.69 0.00 0.00 0.00 175.10 174.04 2du3 s VAL 69 N -3.57 2.22 0.21 2.92 1.01 -1.26 -4.51 120.40 117.41 2du3 s VAL 69 Ca 0.03 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.03 2du3 s VAL 69 Cb 0.04 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 2du3 s VAL 69 CO -0.09 0.43 0.34 0.20 0.00 0.00 0.00 175.10 175.97 2du3 s ASN 70 N 1.28 6.33 0.40 3.32 0.01 -1.26 -5.06 114.94 119.96 2du3 s ASN 70 Ca 0.03 0.12 -0.26 0.00 -0.71 0.00 0.00 52.86 52.03 2du3 s ASN 70 Cb -0.14 -1.88 -0.10 0.00 0.41 0.00 0.00 41.25 39.53 2du3 s ASN 70 CO -0.11 -0.03 1.36 -2.65 -1.51 0.00 0.00 177.10 174.16 2du3 n PRO 71 N -1.12 2.20 -0.05 -0.60 -0.02 -1.26 -4.92 135.00 129.23 2du3 n PRO 71 Ca -0.08 0.78 -0.08 0.00 -2.02 0.00 0.00 63.50 62.09 2du3 n PRO 71 Cb 0.56 -2.49 -0.05 0.00 -0.02 0.00 0.00 33.50 31.51 2du3 n PRO 71 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2du3 n LEU 72 N 0.29 2.52 -4.64 2.45 0.00 -1.26 -4.47 117.00 111.89 2du3 n LEU 72 Ca 0.05 -0.01 -0.40 0.00 0.00 0.00 0.00 56.01 55.64 2du3 n LEU 72 Cb 0.39 -0.35 -0.07 0.00 0.00 0.00 0.00 43.42 43.39 2du3 n LEU 72 CO 0.61 0.58 0.27 -0.63 0.00 0.00 0.00 177.39 178.22 2du3 s ILE 73 N -2.21 5.07 -0.02 1.96 1.01 -1.26 -1.37 121.20 124.38 2du3 s ILE 73 Ca -0.14 0.96 -0.04 0.00 0.00 0.00 0.00 60.65 61.43 2du3 s ILE 73 Cb 0.04 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.66 2du3 s ILE 73 CO 0.23 0.11 0.09 0.68 0.00 0.00 0.00 174.94 176.05 2du3 s VAL 74 N 2.08 0.04 0.34 2.92 -7.23 0.11 -4.93 120.40 113.74 2du3 s VAL 74 Ca 0.23 -0.36 -0.29 0.00 -1.81 0.00 0.00 61.98 59.75 2du3 s VAL 74 Cb -0.16 -0.25 -0.11 0.00 0.56 0.00 0.00 36.38 36.42 2du3 s VAL 74 CO 0.09 -0.20 1.52 -1.61 -0.31 0.00 0.00 175.10 174.59 2du3 s GLU 75 N -0.63 4.12 0.00 4.82 0.41 -1.26 0.67 118.70 126.82 2du3 s GLU 75 Ca -0.07 2.56 0.10 0.00 -0.41 0.00 0.00 54.97 57.15 2du3 s GLU 75 Cb -0.04 -2.99 0.52 0.00 -1.78 0.00 0.00 34.13 29.83 2du3 s GLU 75 CO 0.00 -0.56 1.12 -0.40 -0.49 0.00 0.00 175.26 174.93 2du3 n ASP 76 N 1.12 0.00 0.23 -0.19 3.85 -0.42 -2.22 116.55 118.91 2du3 n ASP 76 Ca 0.04 -0.04 0.08 0.00 -0.71 0.00 0.00 54.79 54.16 2du3 n ASP 76 Cb 0.39 -0.17 0.55 0.00 -1.35 0.00 0.00 41.12 40.53 2du3 n ASP 76 CO 0.00 0.00 0.00 1.62 -1.01 0.00 0.00 177.20 177.81 2du3 h VAL 77 N 0.00 0.83 -0.28 2.12 3.04 -1.88 -2.57 116.25 117.50 2du3 h VAL 77 Ca 0.00 -0.89 -0.08 0.00 -1.01 0.00 0.00 66.70 64.72 2du3 h VAL 77 Cb 0.05 1.53 -0.02 0.00 -2.01 0.00 0.00 31.29 30.85 2du3 h VAL 77 CO 0.00 0.22 -0.17 0.45 -1.01 0.00 0.00 177.57 177.06 2du3 h HIS 78 N 0.00 0.55 -0.09 3.17 3.86 -1.82 0.17 115.15 120.99 2du3 h HIS 78 Ca -0.00 -0.10 -0.10 0.00 -1.16 0.00 0.00 60.37 59.01 2du3 h HIS 78 Cb 0.51 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.83 2du3 h HIS 78 CO 0.00 0.65 -0.41 0.28 0.86 0.00 0.00 177.93 179.31 2du3 h VAL 79 N 0.46 1.31 -0.09 2.45 2.07 -1.67 -1.73 116.25 119.04 2du3 h VAL 79 Ca 0.08 -1.50 -0.12 0.00 0.82 0.00 0.00 66.70 65.97 2du3 h VAL 79 Cb 0.57 1.70 0.01 0.00 -1.52 0.00 0.00 31.29 32.04 2du3 h VAL 79 CO 0.04 0.45 -0.42 0.11 0.02 0.00 0.00 177.57 177.77 2du3 h LYS 80 N 0.16 0.44 0.00 1.57 1.57 -1.24 0.14 116.57 119.21 2du3 h LYS 80 Ca 0.01 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.43 2du3 h LYS 80 Cb 0.80 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.18 2du3 h LYS 80 CO 0.06 0.99 -0.07 0.87 -0.57 0.00 0.00 179.45 180.73 2du3 h LYS 81 N -0.01 0.00 0.04 3.15 1.57 -0.56 -1.28 116.57 119.48 2du3 h LYS 81 Ca -0.03 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.41 2du3 h LYS 81 Cb 1.06 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.33 2du3 h LYS 81 CO 0.09 0.07 -2.04 1.04 -0.57 0.00 0.00 179.45 178.03 2du3 n GLN 82 N -3.56 0.68 -0.03 3.15 6.02 -0.66 -4.62 117.38 118.37 2du3 n GLN 82 Ca -0.02 0.20 0.04 0.00 -0.01 0.00 0.00 57.00 57.21 2du3 n GLN 82 Cb 0.18 -1.67 -0.12 0.00 1.02 0.00 0.00 30.24 29.64 2du3 n GLN 82 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 2du3 n PHE 83 N -3.15 0.00 -0.59 1.08 3.01 0.48 -3.92 117.46 114.37 2du3 n PHE 83 Ca -0.29 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.17 2du3 n PHE 83 Cb 1.06 -0.48 0.00 0.00 -0.01 0.00 0.00 39.48 40.05 2du3 n PHE 83 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2du3 n GLY 84 N 1.71 0.33 0.21 1.37 0.00 -0.49 -3.58 105.19 104.75 2du3 n GLY 84 Ca -0.09 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 45.07 2du3 n GLY 84 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2du3 h ARG 85 N 0.00 0.52 0.00 1.61 -0.00 -1.96 -2.76 114.38 111.79 2du3 h ARG 85 Ca 0.00 -0.30 0.00 0.00 -0.50 0.00 0.00 59.98 59.18 2du3 h ARG 85 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 29.97 29.99 2du3 h ARG 85 CO 0.00 0.90 0.00 -1.91 0.00 0.00 0.00 179.97 178.96 2du3 n GLU 86 N -3.98 0.10 -0.29 0.04 2.13 -1.23 -3.20 120.64 114.21 2du3 n GLU 86 Ca -0.02 0.56 0.11 0.00 0.66 0.00 0.00 57.16 58.46 2du3 n GLU 86 Cb 0.57 -1.81 0.26 0.00 0.27 0.00 0.00 31.44 30.73 2du3 n GLU 86 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2du3 h ALA 87 N 2.05 1.25 -0.96 4.31 0.00 -1.67 -1.48 119.26 122.77 2du3 h ALA 87 Ca 0.00 0.18 0.11 0.00 0.00 0.00 0.00 54.91 55.20 2du3 h ALA 87 Cb 0.05 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 17.98 2du3 h ALA 87 CO 0.00 -0.37 0.61 -0.07 0.00 0.00 0.00 179.25 179.42 2du3 h LEU 88 N 0.31 0.87 -1.06 0.00 3.38 -1.81 0.51 115.31 117.52 2du3 h LEU 88 Ca 0.51 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.48 2du3 h LEU 88 Cb 0.97 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 2du3 h LEU 88 CO -0.56 0.48 0.15 0.00 0.09 0.00 0.00 178.44 178.60 2du3 h ALA 89 N 1.54 1.24 0.47 1.53 0.00 -1.53 -2.61 119.26 119.90 2du3 h ALA 89 Ca 0.47 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 2du3 h ALA 89 Cb 0.48 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2du3 h ALA 89 CO -0.23 0.53 -0.22 0.28 0.00 0.00 0.00 179.25 179.61 2du3 h VAL 90 N 0.80 0.00 -0.32 0.00 2.07 -0.94 -3.19 116.25 114.67 2du3 h VAL 90 Ca 0.18 -0.40 0.09 0.00 0.82 0.00 0.00 66.70 67.39 2du3 h VAL 90 Cb 0.27 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 2du3 h VAL 90 CO -0.00 0.00 0.59 -0.07 0.02 0.00 0.00 177.57 178.10 2du3 h LEU 91 N -1.02 0.00 -0.10 2.57 3.38 -1.01 0.90 115.31 120.02 2du3 h LEU 91 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2du3 h LEU 91 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2du3 h LEU 91 CO 0.11 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.11 2du3 n ASP 92 N -3.24 0.15 -0.76 -0.43 8.00 -0.99 -2.00 116.55 117.28 2du3 n ASP 92 Ca 0.06 0.53 0.08 0.00 0.71 0.00 0.00 54.79 56.17 2du3 n ASP 92 Cb 0.72 -0.56 0.13 0.00 -0.02 0.00 0.00 41.12 41.39 2du3 n ASP 92 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2du3 n ARG 93 N -1.65 1.86 -3.23 -1.24 1.85 0.31 -4.98 116.66 109.58 2du3 n ARG 93 Ca 0.04 -1.80 -0.18 0.00 -1.00 0.00 0.00 57.85 54.91 2du3 n ARG 93 Cb 0.24 -1.35 -0.01 0.00 -1.05 0.00 0.00 32.46 30.30 2du3 n ARG 93 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2du3 s PHE 95 N -2.39 2.77 0.02 0.00 0.40 -1.26 -4.80 117.98 112.70 2du3 s PHE 95 Ca 0.52 -0.11 0.02 0.00 -0.60 0.00 0.00 56.93 56.76 2du3 s PHE 95 Cb -0.07 -1.63 -0.04 0.00 0.51 0.00 0.00 43.02 41.79 2du3 s PHE 95 CO 0.31 0.25 0.00 0.71 0.70 0.00 0.00 175.22 177.19 2du3 s TYR 96 N -0.80 3.06 -0.24 0.36 1.51 -1.26 -2.63 117.35 117.35 2du3 s TYR 96 Ca 0.13 0.06 -0.24 0.00 -1.01 0.00 0.00 57.07 56.00 2du3 s TYR 96 Cb -0.11 -1.65 -0.01 0.00 -0.11 0.00 0.00 41.96 40.09 2du3 s TYR 96 CO 0.02 0.46 0.81 -0.51 -1.11 0.00 0.00 175.55 175.22 2du3 s LEU 97 N -1.69 4.09 0.24 -1.29 1.02 -0.14 -4.92 118.68 115.99 2du3 s LEU 97 Ca 0.21 1.01 0.08 0.00 0.02 0.00 0.00 54.13 55.45 2du3 s LEU 97 Cb -0.12 -3.16 -0.04 0.00 0.02 0.00 0.00 46.19 42.89 2du3 s LEU 97 CO 0.12 -0.49 0.05 0.00 0.02 0.00 0.00 176.35 176.04 2du3 s ALA 98 N 2.76 3.29 0.06 4.21 0.00 -1.26 -2.25 121.76 128.57 2du3 s ALA 98 Ca 0.34 -1.52 -0.06 0.00 0.00 0.00 0.00 51.96 50.72 2du3 s ALA 98 Cb -0.15 -0.97 -0.01 0.00 0.00 0.00 0.00 23.12 21.98 2du3 s ALA 98 CO 0.08 0.31 0.12 -0.08 0.00 0.00 0.00 175.76 176.19 2du3 s THR 99 N -2.13 0.16 -0.02 0.00 -1.32 -0.88 -4.84 115.64 106.59 2du3 s THR 99 Ca 0.31 -1.29 -0.22 0.00 -1.21 0.00 0.00 61.69 59.28 2du3 s THR 99 Cb -0.07 -1.24 -0.05 0.00 -1.51 0.00 0.00 72.50 69.63 2du3 s THR 99 CO 0.21 -0.71 0.64 -0.76 -2.21 0.00 0.00 174.62 171.79 2du3 s LEU 100 N -2.64 4.39 0.59 9.08 1.43 -1.26 0.24 118.68 130.51 2du3 s LEU 100 Ca 0.02 1.19 -0.08 0.00 -1.03 0.00 0.00 54.13 54.23 2du3 s LEU 100 Cb 0.04 -3.00 -0.02 0.00 0.03 0.00 0.00 46.19 43.24 2du3 s LEU 100 CO -0.09 0.03 0.95 -2.16 0.23 0.00 0.00 176.35 175.31 2du3 s PRO 101 N 0.14 3.29 0.31 1.29 0.04 -1.26 -4.99 135.00 133.82 2du3 s PRO 101 Ca 0.33 0.38 -0.19 0.00 0.04 0.00 0.00 61.00 61.57 2du3 s PRO 101 Cb -0.18 -2.19 -0.09 0.00 0.04 0.00 0.00 34.50 32.08 2du3 s PRO 101 CO 0.18 -0.59 0.79 0.15 0.04 0.00 0.00 177.00 177.57 2du3 s LYS 102 N -5.06 4.18 0.57 4.56 -0.14 -1.26 -4.93 119.74 117.66 2du3 s LYS 102 Ca 0.53 0.87 -0.15 0.00 -1.36 0.00 0.00 55.97 55.86 2du3 s LYS 102 Cb -0.11 -2.57 -0.05 0.00 -1.68 0.00 0.00 37.83 33.42 2du3 s LYS 102 CO 0.49 0.22 1.02 -1.25 -0.76 0.00 0.00 175.35 175.07 2du3 s PRO 103 N -2.60 3.57 -0.31 -1.68 0.04 -1.26 -5.04 135.00 127.73 2du3 s PRO 103 Ca 0.51 1.03 -0.05 0.00 0.04 0.00 0.00 61.00 62.53 2du3 s PRO 103 Cb -0.13 -2.08 0.03 0.00 0.04 0.00 0.00 34.50 32.36 2du3 s PRO 103 CO 0.18 -0.59 0.06 1.21 0.04 0.00 0.00 177.00 177.90 2du3 s ASN 104 N -3.14 5.05 -0.23 6.66 3.04 -1.26 -4.90 114.94 120.16 2du3 s ASN 104 Ca 0.60 -0.98 0.00 0.00 0.04 0.00 0.00 52.86 52.52 2du3 s ASN 104 Cb -0.13 -1.82 0.21 0.00 -1.54 0.00 0.00 41.25 37.98 2du3 s ASN 104 CO 0.38 -0.24 1.74 1.33 -3.04 0.00 0.00 177.10 177.27 2du3 n VAL 105 N 4.78 2.32 -3.73 -5.21 0.24 -1.26 -4.04 118.33 111.44 2du3 n VAL 105 Ca -0.14 -1.16 -0.08 0.00 -2.04 0.00 0.00 64.34 60.92 2du3 n VAL 105 Cb 0.46 -1.13 0.03 0.00 -1.47 0.00 0.00 33.84 31.73 2du3 n VAL 105 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2du3 n GLY 106 N 0.26 1.08 5.72 7.63 0.00 -1.26 -4.74 105.19 113.88 2du3 n GLY 106 Ca 0.24 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 45.02 2du3 n GLY 106 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2du3 n ILE 107 N -0.49 0.00 -0.09 -0.61 5.41 -1.26 -1.73 119.36 120.60 2du3 n ILE 107 Ca -0.08 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.60 2du3 n ILE 107 Cb 0.54 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.47 2du3 n ILE 107 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 2du3 h SER 108 N 0.00 -0.77 -1.72 4.38 0.87 -1.97 -3.10 113.55 111.24 2du3 h SER 108 Ca 0.00 0.15 -0.63 0.00 -1.23 0.00 0.00 61.79 60.09 2du3 h SER 108 Cb 0.00 0.38 -0.39 0.00 -0.44 0.00 0.00 62.40 61.95 2du3 h SER 108 CO 0.00 -0.26 -0.36 0.00 -0.53 0.00 0.00 176.83 175.67 2du3 n ALA 109 N -2.86 5.30 0.00 6.23 0.00 -0.70 -4.60 120.51 123.87 2du3 n ALA 109 Ca 0.01 -4.35 0.00 0.00 0.00 0.00 0.00 53.44 49.10 2du3 n ALA 109 Cb 0.30 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2du3 n ALA 109 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2du3 n GLU 110 N -0.45 1.22 0.06 0.00 2.13 -1.17 -4.19 120.64 118.24 2du3 n GLU 110 Ca 0.41 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 58.17 2du3 n GLU 110 Cb 0.54 -0.50 0.12 0.00 0.27 0.00 0.00 31.44 31.87 2du3 n GLU 110 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2du3 h LYS 111 N 0.00 0.34 -0.44 5.31 3.64 -1.81 -1.31 116.57 122.30 2du3 h LYS 111 Ca 0.00 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2du3 h LYS 111 Cb 0.00 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2du3 h LYS 111 CO 0.00 0.80 0.00 1.51 -2.27 0.00 0.00 179.45 179.49 2du3 n ILE 112 N -3.93 0.64 -0.07 2.00 0.13 -1.26 -4.15 119.36 112.72 2du3 n ILE 112 Ca -0.02 -0.82 -0.07 0.00 -1.10 0.00 0.00 62.75 60.73 2du3 n ILE 112 Cb 0.59 0.84 -0.02 0.00 -0.84 0.00 0.00 39.64 40.21 2du3 n ILE 112 CO 0.00 0.00 0.00 -1.14 2.80 0.00 0.00 176.55 178.21 2du3 n ARG 113 N 1.39 0.44 0.00 9.51 0.63 -0.99 -4.38 116.66 123.26 2du3 n ARG 113 Ca 0.19 0.19 0.02 0.00 -0.92 0.00 0.00 57.85 57.32 2du3 n ARG 113 Cb 0.57 -1.29 0.10 0.00 0.45 0.00 0.00 32.46 32.30 2du3 n ARG 113 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2du3 n GLN 114 N -4.15 0.59 -0.49 -0.14 6.02 -0.53 -1.00 117.38 117.68 2du3 n GLN 114 Ca -0.12 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 56.97 2du3 n GLN 114 Cb 0.43 -1.09 0.31 0.00 1.02 0.00 0.00 30.24 30.91 2du3 n GLN 114 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56 2du3 n ILE 115 N -0.59 1.61 -3.93 5.09 0.00 -1.26 -4.94 119.36 115.34 2du3 n ILE 115 Ca 0.03 -1.20 -0.09 0.00 0.00 0.00 0.00 62.75 61.48 2du3 n ILE 115 Cb 0.01 0.21 -0.06 0.00 0.00 0.00 0.00 39.64 39.81 2du3 n ILE 115 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 2du3 s GLU 116 N -1.66 1.35 -0.53 9.51 2.02 -0.17 -5.04 118.70 124.18 2du3 s GLU 116 Ca 0.46 -1.15 -0.28 0.00 0.02 0.00 0.00 54.97 54.03 2du3 s GLU 116 Cb 0.29 0.44 -0.00 0.00 0.10 0.00 0.00 34.13 34.95 2du3 s GLU 116 CO 0.23 -0.54 1.64 0.00 0.02 0.00 0.00 175.26 176.61 2du3 s ALA 117 N -3.97 2.61 0.00 5.21 0.00 -1.26 -4.95 121.76 119.40 2du3 s ALA 117 Ca 0.18 -0.47 0.00 0.00 0.00 0.00 0.00 51.96 51.67 2du3 s ALA 117 Cb 0.01 -4.15 0.00 0.00 0.00 0.00 0.00 23.12 18.98 2du3 s ALA 117 CO 0.03 -3.18 0.00 -0.89 0.00 0.00 0.00 175.76 171.72 2du3 n ILE 118 N 7.09 0.00 -4.08 0.00 -0.00 -1.26 -4.86 119.36 116.25 2du3 n ILE 118 Ca 0.17 0.01 -0.31 0.00 -0.00 0.00 0.00 62.75 62.63 2du3 n ILE 118 Cb 0.50 -0.82 -0.07 0.00 -0.00 0.00 0.00 39.64 39.24 2du3 n ILE 118 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.55 175.66 2du3 s THR 119 N 0.00 4.39 -0.10 1.39 2.01 -1.26 -5.03 115.64 117.05 2du3 s THR 119 Ca 0.00 -0.81 -0.07 0.00 0.31 0.00 0.00 61.69 61.13 2du3 s THR 119 Cb 0.00 -3.10 -0.05 0.00 0.01 0.00 0.00 72.50 69.36 2du3 s THR 119 CO 0.00 0.14 -0.16 0.29 -0.69 0.00 0.00 174.62 174.20 2du3 n LYS 120 N 0.54 0.25 -1.08 4.92 4.76 -1.26 -4.97 118.16 121.32 2du3 n LYS 120 Ca -0.09 0.11 -0.42 0.00 -2.87 0.00 0.00 58.31 55.04 2du3 n LYS 120 Cb 0.52 -0.92 -0.11 0.00 -1.84 0.00 0.00 35.03 32.68 2du3 n LYS 120 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2du3 n ARG 121 N -3.64 0.00 -1.57 1.97 3.00 -1.26 -4.65 116.66 110.51 2du3 n ARG 121 Ca -0.19 0.00 -0.39 0.00 -0.00 0.00 0.00 57.85 57.26 2du3 n ARG 121 Cb 0.55 -1.20 -0.03 0.00 0.00 0.00 0.00 32.46 31.78 2du3 n ARG 121 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2du3 n GLU 122 N 6.32 1.42 0.00 -0.14 4.07 -1.26 -4.38 120.64 126.67 2du3 n GLU 122 Ca 0.48 0.23 0.00 0.00 -0.06 0.00 0.00 57.16 57.81 2du3 n GLU 122 Cb -0.01 -3.31 0.00 0.00 -0.06 0.00 0.00 31.44 28.06 2du3 n GLU 122 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 2du3 n VAL 123 N 7.88 0.00 0.00 6.31 0.24 -1.26 -5.09 118.33 126.41 2du3 n VAL 123 Ca 0.35 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.65 2du3 n VAL 123 Cb 0.49 0.89 0.00 0.00 -1.47 0.00 0.00 33.84 33.75 2du3 n VAL 123 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2du3 n ASP 124 N 0.00 0.00 -1.26 -1.34 4.64 -1.26 -4.85 116.55 112.48 2du3 n ASP 124 Ca 0.00 0.00 0.08 0.00 -1.38 0.00 0.00 54.79 53.49 2du3 n ASP 124 Cb 0.08 0.00 -0.05 0.00 -1.04 0.00 0.00 41.12 40.11 2du3 n ASP 124 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 2du3 n SER 125 N 0.86 -6.82 -4.72 1.67 7.64 -1.26 -4.89 113.62 106.10 2du3 n SER 125 Ca 0.00 1.39 -0.33 0.00 1.01 0.00 0.00 58.87 60.94 2du3 n SER 125 Cb 0.00 -4.16 0.10 0.00 -1.01 0.00 0.00 64.21 59.14 2du3 n SER 125 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2du3 s LYS 126 N -4.59 2.03 -0.44 1.43 1.02 -1.26 -4.84 119.74 113.08 2du3 s LYS 126 Ca 0.00 1.60 -0.34 0.00 0.02 0.00 0.00 55.97 57.25 2du3 s LYS 126 Cb 0.00 -1.84 -0.12 0.00 -0.52 0.00 0.00 37.83 35.35 2du3 s LYS 126 CO 0.00 -1.89 2.27 -2.30 -0.92 0.00 0.00 175.35 172.52 2du3 n PRO 127 N -3.06 0.91 -0.51 -1.68 -0.02 -1.26 -4.80 135.00 124.58 2du3 n PRO 127 Ca 0.12 0.21 -0.04 0.00 -2.02 0.00 0.00 63.50 61.77 2du3 n PRO 127 Cb 0.51 -2.44 0.14 0.00 -0.02 0.00 0.00 33.50 31.69 2du3 n PRO 127 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 2du3 n LEU 128 N 10.60 4.06 0.24 2.45 -0.00 -1.26 -4.33 117.00 128.75 2du3 n LEU 128 Ca 0.44 -2.10 0.17 0.00 -0.00 0.00 0.00 56.01 54.52 2du3 n LEU 128 Cb 0.24 -0.63 0.77 0.00 -0.00 0.00 0.00 43.42 43.80 2du3 n LEU 128 CO 0.78 0.60 1.15 -0.61 -0.00 0.00 0.00 177.39 179.30 2du3 h GLN 129 N 1.18 0.00 0.05 1.47 5.75 -1.98 -0.03 115.11 121.55 2du3 h GLN 129 Ca 0.16 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.48 2du3 h GLN 129 Cb 1.57 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.11 2du3 h GLN 129 CO 0.39 0.00 -0.89 0.93 -2.65 0.00 0.00 178.83 176.61 2du3 h GLU 130 N 0.00 0.11 0.00 1.69 4.39 -1.99 -2.15 114.58 116.63 2du3 h GLU 130 Ca 0.08 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2du3 h GLU 130 Cb 0.88 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.60 2du3 h GLU 130 CO -0.00 1.09 0.00 -0.89 -1.16 0.00 0.00 179.01 178.05 2du3 n ILE 131 N -4.29 1.38 0.07 3.13 -0.00 -0.17 -0.81 119.36 118.67 2du3 n ILE 131 Ca -0.21 0.35 0.08 0.00 -0.00 0.00 0.00 62.75 62.96 2du3 n ILE 131 Cb 0.71 -1.22 -0.12 0.00 -0.00 0.00 0.00 39.64 39.01 2du3 n ILE 131 CO 0.00 0.00 0.00 0.33 -0.00 0.00 0.00 176.55 176.88 2du3 n PHE 132 N -1.47 0.00 0.11 1.39 -0.00 -0.37 -4.35 117.46 112.77 2du3 n PHE 132 Ca 0.02 0.00 -0.18 0.00 -0.00 0.00 0.00 57.45 57.29 2du3 n PHE 132 Cb 0.08 -0.32 -0.14 0.00 -0.00 0.00 0.00 39.48 39.10 2du3 n PHE 132 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 2du3 h HIS 133 N 0.00 0.59 0.00 -5.13 2.76 -0.27 -3.13 115.15 109.97 2du3 h HIS 133 Ca 0.00 -0.43 0.00 0.00 -2.20 0.00 0.00 60.37 57.74 2du3 h HIS 133 Cb 0.68 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.61 2du3 h HIS 133 CO 0.00 1.37 0.00 0.54 -1.30 0.00 0.00 177.93 178.54 2du3 n ARG 134 N -3.56 0.00 0.03 5.26 5.12 -0.25 0.19 116.66 123.46 2du3 n ARG 134 Ca -0.12 0.35 0.13 0.00 -1.93 0.00 0.00 57.85 56.28 2du3 n ARG 134 Cb 1.05 -1.50 0.40 0.00 -1.16 0.00 0.00 32.46 31.25 2du3 n ARG 134 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2du3 n TYR 135 N -1.35 0.30 0.40 -1.55 4.19 -1.18 -2.08 117.16 115.88 2du3 n TYR 135 Ca 0.00 0.09 0.11 0.00 3.31 0.00 0.00 57.90 61.41 2du3 n TYR 135 Cb 0.00 -0.56 -0.07 0.00 0.49 0.00 0.00 39.34 39.20 2du3 n TYR 135 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 2du3 n LYS 136 N -1.77 0.40 0.00 2.98 4.76 0.13 -4.75 118.16 119.91 2du3 n LYS 136 Ca 0.06 -0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2du3 n LYS 136 Cb 0.38 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 2du3 n LYS 136 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2du3 n LYS 137 N -2.06 0.00 -3.96 1.97 3.00 -1.01 -5.02 118.16 111.08 2du3 n LYS 137 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.02 2du3 n LYS 137 Cb 0.48 0.00 -0.16 0.00 0.00 0.00 0.00 35.03 35.34 2du3 n LYS 137 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2du3 s GLY 138 N 0.00 1.11 0.08 3.14 0.00 -0.88 -5.08 107.32 105.68 2du3 s GLY 138 Ca 0.00 -0.98 0.02 0.00 0.00 0.00 0.00 44.72 43.76 2du3 s GLY 138 CO 0.00 0.74 0.06 1.18 0.00 0.00 0.00 173.10 175.09 2du3 n GLU 139 N 4.78 0.18 0.00 2.90 -0.58 -1.26 -4.82 120.64 121.84 2du3 n GLU 139 Ca -0.14 -0.76 0.00 0.00 -0.42 0.00 0.00 57.16 55.84 2du3 n GLU 139 Cb 0.48 0.60 0.00 0.00 -0.57 0.00 0.00 31.44 31.95 2du3 n GLU 139 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 2du3 n ILE 140 N -0.15 0.00 -0.08 -3.67 -5.35 -1.26 -5.08 119.36 103.76 2du3 n ILE 140 Ca 0.01 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.38 2du3 n ILE 140 Cb 0.14 0.00 -0.04 0.00 -1.74 0.00 0.00 39.64 38.00 2du3 n ILE 140 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2du3 n ASP 141 N 0.00 1.84 0.00 7.28 5.75 -1.26 -4.44 116.55 125.72 2du3 n ASP 141 Ca 0.00 0.31 0.01 0.00 -0.01 0.00 0.00 54.79 55.10 2du3 n ASP 141 Cb 0.00 -0.71 0.06 0.00 -1.03 0.00 0.00 41.12 39.44 2du3 n ASP 141 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2du3 n GLY 142 N 1.62 -0.28 0.00 6.12 0.00 -1.26 -2.68 105.19 108.71 2du3 n GLY 142 Ca -0.19 -0.01 0.08 0.00 0.00 0.00 0.00 46.02 45.89 2du3 n GLY 142 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2du3 n ASP 143 N -0.61 0.00 0.08 1.61 3.85 -1.26 -2.94 116.55 117.28 2du3 n ASP 143 Ca 0.01 -1.26 -0.09 0.00 -0.71 0.00 0.00 54.79 52.75 2du3 n ASP 143 Cb 0.01 0.00 -0.04 0.00 -1.35 0.00 0.00 41.12 39.73 2du3 n ASP 143 CO 0.00 0.00 0.00 -0.78 -1.01 0.00 0.00 177.20 175.41 2du3 h ASP 144 N 0.00 0.18 0.00 -1.12 3.58 -1.84 -3.07 116.42 114.15 2du3 h ASP 144 Ca 0.00 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.29 2du3 h ASP 144 Cb 0.00 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 40.99 2du3 h ASP 144 CO 0.00 1.02 0.00 0.18 -2.88 0.00 0.00 179.24 177.56 2du3 n LEU 145 N -3.57 3.67 0.00 2.28 7.99 -1.15 -3.94 117.00 122.28 2du3 n LEU 145 Ca -0.03 -1.72 0.00 0.00 -0.01 0.00 0.00 56.01 54.25 2du3 n LEU 145 Cb 0.86 -0.72 0.00 0.00 -0.11 0.00 0.00 43.42 43.45 2du3 n LEU 145 CO 0.48 0.67 0.00 -0.24 -1.51 0.00 0.00 177.39 176.78 2du3 n SER 146 N 1.08 0.00 -1.97 -1.43 2.88 -1.16 -4.56 113.62 108.46 2du3 n SER 146 Ca 0.00 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.53 2du3 n SER 146 Cb 0.44 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.88 2du3 n SER 146 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2du3 n TYR 147 N -1.50 0.00 0.23 0.66 0.18 -1.25 -1.70 117.16 113.78 2du3 n TYR 147 Ca 0.00 -0.34 0.00 0.00 1.88 0.00 0.00 57.90 59.44 2du3 n TYR 147 Cb 0.00 -0.43 0.00 0.00 -0.38 0.00 0.00 39.34 38.53 2du3 n TYR 147 CO 0.00 0.00 0.00 -0.11 -2.08 0.00 0.00 176.86 174.67 2du3 n LEU 148 N 2.08 -4.17 0.24 -3.48 -0.00 -1.26 -4.65 117.00 105.77 2du3 n LEU 148 Ca 0.03 0.93 0.09 0.00 -0.00 0.00 0.00 56.01 57.06 2du3 n LEU 148 Cb 0.18 3.88 0.63 0.00 -0.00 0.00 0.00 43.42 48.11 2du3 n LEU 148 CO 0.05 0.32 0.93 -0.29 -0.00 0.00 0.00 177.39 178.41 2du3 h ILE 149 N 0.00 0.81 -1.56 1.96 2.10 -1.52 -2.99 117.51 116.30 2du3 h ILE 149 Ca 0.00 -0.61 -0.49 0.00 1.08 0.00 0.00 64.86 64.85 2du3 h ILE 149 Cb 0.00 1.36 -0.41 0.00 -1.09 0.00 0.00 36.82 36.68 2du3 h ILE 149 CO 0.00 0.15 -0.98 0.00 -1.08 0.00 0.00 178.15 176.24 2du3 n ALA 150 N -2.37 3.79 -1.99 0.18 0.00 -0.69 -4.70 120.51 114.73 2du3 n ALA 150 Ca -0.02 -3.77 0.00 0.00 0.00 0.00 0.00 53.44 49.65 2du3 n ALA 150 Cb 0.25 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.91 2du3 n ALA 150 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2du3 n GLU 151 N -0.14 0.00 -0.78 0.00 4.07 -1.14 -4.77 120.64 117.88 2du3 n GLU 151 Ca 0.24 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 57.24 2du3 n GLU 151 Cb 0.67 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 32.06 2du3 n GLU 151 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 2du3 n VAL 152 N 0.00 2.51 -2.23 6.31 0.24 -1.24 -4.96 118.33 118.96 2du3 n VAL 152 Ca 0.00 -1.26 0.06 0.00 -2.04 0.00 0.00 64.34 61.10 2du3 n VAL 152 Cb 0.00 -1.46 -0.01 0.00 -1.47 0.00 0.00 33.84 30.89 2du3 n VAL 152 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2du3 n LEU 153 N 0.99 0.00 -1.31 1.34 4.32 -1.14 -4.98 117.00 116.23 2du3 n LEU 153 Ca 0.20 0.45 0.00 0.00 -0.02 0.00 0.00 56.01 56.64 2du3 n LEU 153 Cb 0.57 -1.35 0.00 0.00 -1.62 0.00 0.00 43.42 41.01 2du3 n LEU 153 CO 0.21 -1.38 0.00 0.47 -1.22 0.00 0.00 177.39 175.47 2du3 n ASP 154 N -3.80 -1.90 -4.58 -1.43 10.43 -1.26 -4.31 116.55 109.70 2du3 n ASP 154 Ca 0.00 0.00 -0.35 0.00 2.57 0.00 0.00 54.79 57.01 2du3 n ASP 154 Cb 0.19 -0.95 0.09 0.00 1.84 0.00 0.00 41.12 42.30 2du3 n ASP 154 CO 0.00 0.00 0.00 1.33 -1.07 0.00 0.00 177.20 177.46 2du3 n VAL 155 N 0.08 2.24 0.00 2.53 0.24 -1.26 -3.35 118.33 118.80 2du3 n VAL 155 Ca 0.00 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 2du3 n VAL 155 Cb 0.00 -1.01 0.00 0.00 -1.47 0.00 0.00 33.84 31.36 2du3 n VAL 155 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2du3 n ASP 156 N -1.65 0.00 -2.32 -1.34 5.75 -1.26 -3.04 116.55 112.68 2du3 n ASP 156 Ca 0.12 0.00 -0.22 0.00 -0.01 0.00 0.00 54.79 54.68 2du3 n ASP 156 Cb 0.50 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.50 2du3 n ASP 156 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2du3 n ASP 157 N -2.51 6.09 0.07 -1.12 8.00 -1.26 -4.30 116.55 121.52 2du3 n ASP 157 Ca 0.00 -2.98 -0.21 0.00 0.71 0.00 0.00 54.79 52.31 2du3 n ASP 157 Cb 0.00 -1.28 -0.14 0.00 -0.02 0.00 0.00 41.12 39.68 2du3 n ASP 157 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 2du3 h ILE 158 N 1.96 1.42 0.00 0.53 3.07 -1.84 -3.37 117.51 119.28 2du3 h ILE 158 Ca 0.33 -2.49 0.00 0.00 1.55 0.00 0.00 64.86 64.24 2du3 h ILE 158 Cb 0.97 3.01 0.00 0.00 -0.27 0.00 0.00 36.82 40.53 2du3 h ILE 158 CO 0.67 0.72 0.00 0.35 -1.05 0.00 0.00 178.15 178.85 2du3 n THR 159 N -4.01 0.00 -0.05 0.16 -2.24 -1.26 -4.70 114.28 102.17 2du3 n THR 159 Ca -0.14 -0.38 -0.14 0.00 -2.27 0.00 0.00 64.05 61.12 2du3 n THR 159 Cb 0.88 1.23 -0.07 0.00 -2.10 0.00 0.00 70.33 70.27 2du3 n THR 159 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2du3 h ALA 160 N 0.00 0.23 -0.24 6.98 0.00 -1.75 -0.17 119.26 124.31 2du3 h ALA 160 Ca 0.00 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 2du3 h ALA 160 Cb 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2du3 h ALA 160 CO 0.00 0.17 0.00 -0.39 0.00 0.00 0.00 179.25 179.04 2du3 h VAL 161 N 0.03 1.25 0.00 0.00 -1.51 -1.85 -3.24 116.25 110.94 2du3 h VAL 161 Ca 0.02 -0.89 -0.18 0.00 -1.23 0.00 0.00 66.70 64.41 2du3 h VAL 161 Cb 0.77 1.36 -0.03 0.00 -2.13 0.00 0.00 31.29 31.27 2du3 h VAL 161 CO 0.05 0.28 -0.86 0.07 -1.23 0.00 0.00 177.57 175.88 2du3 h LYS 162 N 0.21 0.00 0.00 5.19 2.10 -1.84 -3.16 116.57 119.06 2du3 h LYS 162 Ca 0.07 -0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.70 2du3 h LYS 162 Cb 0.41 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.74 2du3 h LYS 162 CO 0.01 0.86 -0.08 0.97 -2.00 0.00 0.00 179.45 179.22 2du3 h ILE 163 N 0.00 0.81 0.35 0.07 2.10 -1.07 -2.74 117.51 117.03 2du3 h ILE 163 Ca -0.01 -0.28 -0.02 0.00 1.08 0.00 0.00 64.86 65.63 2du3 h ILE 163 Cb 1.53 1.16 0.00 0.00 -1.09 0.00 0.00 36.82 38.42 2du3 h ILE 163 CO 0.11 0.07 -0.17 -0.07 -1.08 0.00 0.00 178.15 177.02 2du3 h LEU 164 N 0.00 -0.40 0.17 2.19 3.38 -1.58 -3.19 115.31 115.88 2du3 h LEU 164 Ca -0.00 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.83 2du3 h LEU 164 Cb 0.16 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 2du3 h LEU 164 CO 0.01 0.02 -0.33 0.44 0.09 0.00 0.00 178.44 178.67 2du3 h ASP 165 N -0.91 -0.95 -0.24 -0.43 5.19 -1.56 -1.03 116.42 116.49 2du3 h ASP 165 Ca -0.05 0.10 -0.06 0.00 -0.62 0.00 0.00 57.03 56.41 2du3 h ASP 165 Cb 0.53 0.35 -0.03 0.00 0.18 0.00 0.00 39.33 40.36 2du3 h ASP 165 CO 0.08 -0.43 0.07 -1.84 -3.12 0.00 0.00 179.24 174.00 2du3 n GLU 166 N -5.43 2.04 0.00 3.56 0.28 -1.06 -3.99 120.64 116.05 2du3 n GLU 166 Ca -0.07 -1.06 0.00 0.00 -0.16 0.00 0.00 57.16 55.86 2du3 n GLU 166 Cb 0.34 -1.65 0.00 0.00 1.43 0.00 0.00 31.44 31.56 2du3 n GLU 166 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2du3 n VAL 167 N 0.12 0.00 -3.52 3.84 0.31 -1.15 -5.02 118.33 112.92 2du3 n VAL 167 Ca 0.13 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.17 2du3 n VAL 167 Cb 0.68 -0.04 -0.12 0.00 -0.91 0.00 0.00 33.84 33.45 2du3 n VAL 167 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2du3 s PHE 168 N -1.05 1.18 -2.00 3.52 0.40 -0.40 -4.94 117.98 114.69 2du3 s PHE 168 Ca 0.00 -2.01 0.02 0.00 -0.60 0.00 0.00 56.93 54.34 2du3 s PHE 168 Cb 0.00 -1.19 0.14 0.00 0.51 0.00 0.00 43.02 42.47 2du3 s PHE 168 CO 0.00 -0.81 0.68 -2.30 0.70 0.00 0.00 175.22 173.49 2du3 n PRO 169 N 3.60 0.57 0.08 0.24 -0.02 -1.26 -3.35 135.00 134.85 2du3 n PRO 169 Ca 0.15 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.62 2du3 n PRO 169 Cb 0.39 -1.06 0.25 0.00 -0.02 0.00 0.00 33.50 33.05 2du3 n PRO 169 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2du3 h GLU 170 N 0.00 0.30 -0.13 -0.52 4.57 -1.92 -3.03 114.58 113.86 2du3 h GLU 170 Ca 0.00 -0.12 -0.14 0.00 -1.18 0.00 0.00 59.36 57.92 2du3 h GLU 170 Cb 0.00 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 2du3 h GLU 170 CO 0.00 0.59 -0.51 0.74 -1.18 0.00 0.00 179.01 178.65 2du3 h PHE 171 N 0.27 0.44 0.00 0.92 0.05 -1.94 -3.04 116.94 113.63 2du3 h PHE 171 Ca 0.04 -0.15 0.00 0.00 3.82 0.00 0.00 57.97 61.68 2du3 h PHE 171 Cb 0.70 -0.09 0.00 0.00 2.00 0.00 0.00 35.95 38.56 2du3 h PHE 171 CO 0.01 0.80 0.00 1.63 -0.18 0.00 0.00 178.31 180.57 2du3 n LYS 172 N -3.95 0.44 -0.11 1.51 4.76 -1.14 -3.25 118.16 116.41 2du3 n LYS 172 Ca -0.02 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.17 2du3 n LYS 172 Cb 0.56 -1.42 -0.11 0.00 -1.84 0.00 0.00 35.03 32.22 2du3 n LYS 172 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2du3 n GLU 173 N -0.92 0.61 -0.11 1.97 4.07 -1.15 -5.04 120.64 120.07 2du3 n GLU 173 Ca 0.09 0.38 -0.04 0.00 -0.06 0.00 0.00 57.16 57.52 2du3 n GLU 173 Cb 0.04 -1.62 -0.00 0.00 -0.06 0.00 0.00 31.44 29.79 2du3 n GLU 173 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2du3 n LEU 174 N -4.12 -0.05 -3.90 4.31 4.77 -1.20 -5.02 117.00 111.80 2du3 n LEU 174 Ca -0.42 0.08 -0.17 0.00 -0.03 0.00 0.00 56.01 55.47 2du3 n LEU 174 Cb 0.84 -0.07 -0.15 0.00 -2.33 0.00 0.00 43.42 41.71 2du3 n LEU 174 CO 0.17 -0.18 -0.40 -0.54 -1.33 0.00 0.00 177.39 175.11 2du3 s LYS 175 N -0.04 0.50 0.49 3.23 1.02 -1.26 -5.07 119.74 118.61 2du3 s LYS 175 Ca 0.06 -0.10 -0.23 0.00 0.02 0.00 0.00 55.97 55.72 2du3 s LYS 175 Cb -0.08 -0.54 -0.07 0.00 -0.52 0.00 0.00 37.83 36.62 2du3 s LYS 175 CO 0.04 -0.00 1.23 -0.35 -0.92 0.00 0.00 175.35 175.35 2du3 n PRO 176 N 3.54 1.65 -4.05 -1.68 -0.04 -1.26 -4.51 135.00 128.65 2du3 n PRO 176 Ca -0.20 0.60 -0.33 0.00 -0.04 0.00 0.00 63.50 63.53 2du3 n PRO 176 Cb 0.54 -2.39 -0.15 0.00 -0.04 0.00 0.00 33.50 31.46 2du3 n PRO 176 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2du3 s ILE 177 N -1.28 2.39 1.08 0.52 1.01 0.14 -4.83 121.20 120.23 2du3 s ILE 177 Ca 0.67 -1.08 -0.14 0.00 0.00 0.00 0.00 60.65 60.10 2du3 s ILE 177 Cb -0.47 -2.16 0.18 0.00 0.01 0.00 0.00 42.46 40.03 2du3 s ILE 177 CO 0.53 0.32 0.72 -1.20 0.00 0.00 0.00 174.94 175.31 2du3 n SER 178 N 4.61 -1.53 -1.01 3.58 7.64 -1.26 -2.08 113.62 123.56 2du3 n SER 178 Ca -0.18 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.73 2du3 n SER 178 Cb 0.48 -1.22 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 2du3 n SER 178 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2du3 n SER 179 N -3.55 0.25 -0.67 6.43 3.41 -0.96 -4.84 113.62 113.70 2du3 n SER 179 Ca 0.05 -0.90 0.11 0.00 -0.26 0.00 0.00 58.87 57.87 2du3 n SER 179 Cb 0.55 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.54 2du3 n SER 179 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2du3 n THR 180 N 0.00 0.00 -2.41 6.66 -2.24 -1.26 -4.71 114.28 110.32 2du3 n THR 180 Ca 0.00 -0.36 -0.41 0.00 -2.27 0.00 0.00 64.05 61.01 2du3 n THR 180 Cb 0.00 1.35 -0.04 0.00 -2.10 0.00 0.00 70.33 69.54 2du3 n THR 180 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2du3 s LEU 181 N -2.25 4.48 0.25 3.22 1.43 -1.26 -1.31 118.68 123.24 2du3 s LEU 181 Ca 0.22 2.24 0.04 0.00 -1.03 0.00 0.00 54.13 55.60 2du3 s LEU 181 Cb 0.18 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.74 2du3 s LEU 181 CO 0.46 -0.30 -0.00 0.42 0.23 0.00 0.00 176.35 177.15 2du3 s THR 182 N -0.41 1.16 -0.23 5.49 -4.23 0.21 -0.96 115.64 116.66 2du3 s THR 182 Ca 0.50 -2.05 -0.10 0.00 -1.18 0.00 0.00 61.69 58.86 2du3 s THR 182 Cb -0.32 -2.42 -0.05 0.00 1.34 0.00 0.00 72.50 71.04 2du3 s THR 182 CO 0.38 -0.27 0.14 -0.76 -0.54 0.00 0.00 174.62 173.57 2du3 s LEU 183 N -3.35 4.07 0.24 4.79 1.43 -1.08 0.08 118.68 124.86 2du3 s LEU 183 Ca 0.30 0.11 -0.30 0.00 -1.03 0.00 0.00 54.13 53.21 2du3 s LEU 183 Cb 0.06 -2.08 -0.15 0.00 0.03 0.00 0.00 46.19 44.05 2du3 s LEU 183 CO 0.10 0.09 1.07 -2.11 0.23 0.00 0.00 176.35 175.73 2du3 n ARG 184 N 4.13 1.26 0.00 1.70 1.85 -0.47 -4.62 116.66 120.51 2du3 n ARG 184 Ca -0.15 0.44 0.12 0.00 -1.00 0.00 0.00 57.85 57.26 2du3 n ARG 184 Cb 0.52 -1.87 0.13 0.00 -1.05 0.00 0.00 32.46 30.19 2du3 n ARG 184 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2du3 n SER 185 N 1.62 1.45 -3.53 2.89 3.41 -1.24 -1.15 113.62 117.07 2du3 n SER 185 Ca 0.12 -1.15 -0.10 0.00 -0.26 0.00 0.00 58.87 57.48 2du3 n SER 185 Cb 0.29 0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 64.62 2du3 n SER 185 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 2du3 s HIS 186 N -2.59 -0.39 0.47 7.33 0.00 -1.26 -4.59 115.29 114.26 2du3 s HIS 186 Ca 0.18 0.44 0.21 0.00 -3.00 0.00 0.00 55.06 52.90 2du3 s HIS 186 Cb 0.18 0.50 1.22 0.00 -4.00 0.00 0.00 32.58 30.48 2du3 s HIS 186 CO 0.60 -0.49 1.92 1.98 -1.00 0.00 0.00 174.74 177.76 2du3 h MET 187 N 2.28 0.23 -0.62 -0.38 4.05 -1.93 -2.97 114.93 115.59 2du3 h MET 187 Ca -0.21 -0.01 0.13 0.00 -0.28 0.00 0.00 59.70 59.32 2du3 h MET 187 Cb 1.21 -0.05 -0.11 0.00 -0.80 0.00 0.00 31.60 31.85 2du3 h MET 187 CO 0.32 0.15 -0.01 1.15 0.23 0.00 0.00 176.91 178.75 2du3 h THR 188 N 0.23 0.47 -1.03 -0.77 2.02 -1.99 -0.32 112.91 111.53 2du3 h THR 188 Ca 0.37 -0.04 0.27 0.00 0.77 0.00 0.00 66.41 67.79 2du3 h THR 188 Cb 1.10 0.36 -0.12 0.00 -1.74 0.00 0.00 68.15 67.74 2du3 h THR 188 CO -0.08 0.02 0.62 0.74 0.37 0.00 0.00 175.52 177.19 2du3 h THR 189 N 0.10 0.47 0.00 3.16 2.02 -1.93 -0.46 112.91 116.27 2du3 h THR 189 Ca 0.33 -0.16 -0.10 0.00 0.77 0.00 0.00 66.41 67.25 2du3 h THR 189 Cb 0.53 -0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 2du3 h THR 189 CO -0.55 0.09 -1.00 1.23 0.37 0.00 0.00 175.52 175.66 2du3 h GLY 190 N 0.47 0.00 1.00 2.16 0.00 -1.29 -3.38 103.07 102.02 2du3 h GLY 190 Ca 0.66 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.99 2du3 h GLY 190 CO -0.46 0.00 0.04 1.49 0.00 0.00 0.00 176.54 177.61 2du3 h TRP 191 N 0.00 0.08 -0.55 5.60 -0.00 -0.05 -2.58 115.95 118.45 2du3 h TRP 191 Ca -0.07 0.00 0.11 0.00 -0.00 0.00 0.00 58.89 58.93 2du3 h TRP 191 Cb 1.34 -0.03 -0.11 0.00 -0.00 0.00 0.00 29.16 30.36 2du3 h TRP 191 CO 0.00 0.06 -0.24 0.74 -0.00 0.00 0.00 178.44 179.00 2du3 h PHE 192 N 0.09 -0.60 0.32 0.49 -1.00 -1.72 0.38 116.94 114.90 2du3 h PHE 192 Ca 0.02 0.06 0.00 0.00 2.81 0.00 0.00 57.97 60.86 2du3 h PHE 192 Cb -0.01 0.35 -0.02 0.00 3.61 0.00 0.00 35.95 39.88 2du3 h PHE 192 CO -0.07 -0.32 -0.35 0.82 -1.61 0.00 0.00 178.31 176.78 2du3 h ILE 193 N -0.10 0.28 -0.62 -0.55 2.04 -1.73 0.29 117.51 117.12 2du3 h ILE 193 Ca 0.25 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.21 2du3 h ILE 193 Cb 0.50 0.28 -0.07 0.00 -0.74 0.00 0.00 36.82 36.78 2du3 h ILE 193 CO -0.62 0.00 0.23 0.74 0.00 0.00 0.00 178.15 178.50 2du3 h THR 194 N -0.71 0.76 0.00 -0.27 2.02 -0.90 -1.98 112.91 111.83 2du3 h THR 194 Ca -0.02 -0.14 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 2du3 h THR 194 Cb 0.65 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 2du3 h THR 194 CO -0.08 0.07 -0.28 -0.07 0.37 0.00 0.00 175.52 175.54 2du3 h LEU 195 N 0.41 0.00 -2.37 2.58 3.38 0.10 -2.90 115.31 116.51 2du3 h LEU 195 Ca 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.28 2du3 h LEU 195 Cb 0.39 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 2du3 h LEU 195 CO -0.31 0.28 -0.01 0.77 0.09 0.00 0.00 178.44 179.25 2du3 h SER 196 N 0.00 0.00 0.32 -0.43 4.64 -0.14 -0.87 113.55 117.07 2du3 h SER 196 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2du3 h SER 196 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 2du3 h SER 196 CO 0.04 0.01 -0.47 1.41 -0.87 0.00 0.00 176.83 176.95 2du3 n HIS 197 N -3.16 0.00 -0.14 4.77 8.25 -1.09 -4.66 115.22 119.19 2du3 n HIS 197 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2du3 n HIS 197 Cb 0.17 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2du3 n HIS 197 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2du3 n ILE 198 N -1.10 0.00 0.14 1.59 -5.35 -0.89 -4.83 119.36 108.92 2du3 n ILE 198 Ca 0.08 0.00 0.19 0.00 -0.27 0.00 0.00 62.75 62.75 2du3 n ILE 198 Cb 0.35 0.71 0.70 0.00 -1.74 0.00 0.00 39.64 39.66 2du3 n ILE 198 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2du3 h ALA 199 N 0.00 1.99 -0.09 -1.28 0.00 -1.44 -1.47 119.26 116.96 2du3 h ALA 199 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2du3 h ALA 199 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2du3 h ALA 199 CO 0.00 -0.70 0.00 -0.40 0.00 0.00 0.00 179.25 178.15 2du3 n ASP 200 N -3.38 1.98 -0.24 0.00 5.68 -1.26 -4.60 116.55 114.72 2du3 n ASP 200 Ca 0.06 -1.56 0.03 0.00 -0.50 0.00 0.00 54.79 52.81 2du3 n ASP 200 Cb 0.67 -0.06 0.04 0.00 -1.14 0.00 0.00 41.12 40.63 2du3 n ASP 200 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2du3 n LYS 201 N 0.31 0.84 -4.39 0.11 5.02 -0.57 -5.02 118.16 114.47 2du3 n LYS 201 Ca 0.05 -1.14 -0.29 0.00 -2.02 0.00 0.00 58.31 54.92 2du3 n LYS 201 Cb 0.25 -1.11 -0.13 0.00 -0.02 0.00 0.00 35.03 34.02 2du3 n LYS 201 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2du3 s LEU 202 N -0.63 2.32 0.17 -0.35 1.43 -1.12 -5.10 118.68 115.40 2du3 s LEU 202 Ca 0.08 -0.74 -0.32 0.00 -1.03 0.00 0.00 54.13 52.12 2du3 s LEU 202 Cb 0.05 -1.19 -0.11 0.00 0.03 0.00 0.00 46.19 44.97 2du3 s LEU 202 CO 0.07 0.17 1.67 -2.84 0.23 0.00 0.00 176.35 175.65 2du3 s PRO 203 N -2.03 4.17 0.31 1.29 0.02 -1.26 -4.93 135.00 132.56 2du3 s PRO 203 Ca 0.13 2.49 -0.26 0.00 0.02 0.00 0.00 61.00 63.38 2du3 s PRO 203 Cb -0.10 -3.23 -0.10 0.00 0.02 0.00 0.00 34.50 31.10 2du3 s PRO 203 CO 0.06 -0.71 0.93 -0.51 -0.33 0.00 0.00 177.00 176.44 2du3 s LEU 204 N 1.52 4.36 0.42 -5.54 1.02 -1.26 -4.02 118.68 115.18 2du3 s LEU 204 Ca 0.74 1.82 -0.14 0.00 0.02 0.00 0.00 54.13 56.57 2du3 s LEU 204 Cb -0.46 -3.96 -0.08 0.00 0.02 0.00 0.00 46.19 41.71 2du3 s LEU 204 CO 0.32 -0.04 0.83 -2.16 0.02 0.00 0.00 176.35 175.31 2du3 s PRO 205 N -1.99 3.90 -0.25 1.29 0.04 -1.26 -5.09 135.00 131.64 2du3 s PRO 205 Ca 0.49 0.67 -0.09 0.00 0.04 0.00 0.00 61.00 62.11 2du3 s PRO 205 Cb -0.19 -2.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.98 2du3 s PRO 205 CO 0.24 -0.05 0.13 0.42 0.04 0.00 0.00 177.00 177.78 2du3 s ILE 206 N -2.34 4.98 -0.28 0.56 1.01 0.04 -4.92 121.20 120.25 2du3 s ILE 206 Ca 0.54 0.05 0.03 0.00 0.00 0.00 0.00 60.65 61.27 2du3 s ILE 206 Cb -0.10 -3.33 0.07 0.00 0.01 0.00 0.00 42.46 39.11 2du3 s ILE 206 CO 0.27 0.33 -0.05 -0.54 0.00 0.00 0.00 174.94 174.95 2du3 s LYS 207 N 1.31 1.89 0.11 2.79 1.02 -1.26 -0.51 119.74 125.09 2du3 s LYS 207 Ca 0.06 -1.45 0.08 0.00 0.02 0.00 0.00 55.97 54.68 2du3 s LYS 207 Cb -0.15 -2.92 -0.04 0.00 -0.52 0.00 0.00 37.83 34.21 2du3 s LYS 207 CO 0.06 -0.70 -0.21 -0.51 -0.92 0.00 0.00 175.35 173.07 2du3 s LEU 208 N 1.09 2.31 0.11 3.17 1.43 -0.85 -0.31 118.68 125.64 2du3 s LEU 208 Ca -0.02 -0.71 -0.02 0.00 -1.03 0.00 0.00 54.13 52.36 2du3 s LEU 208 Cb -0.19 -0.90 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 2du3 s LEU 208 CO -0.07 0.06 0.05 0.72 0.23 0.00 0.00 176.35 177.34 2du3 s PHE 209 N -1.23 0.74 -0.28 0.29 -0.12 -0.03 -1.21 117.98 116.15 2du3 s PHE 209 Ca 0.08 -1.16 -0.17 0.00 -0.05 0.00 0.00 56.93 55.63 2du3 s PHE 209 Cb -0.10 -0.43 0.09 0.00 -0.63 0.00 0.00 43.02 41.96 2du3 s PHE 209 CO 0.05 -0.50 0.73 0.45 -0.05 0.00 0.00 175.22 175.90 2du3 s SER 210 N -3.01 -0.87 -0.31 1.98 0.15 0.06 -1.07 113.70 110.62 2du3 s SER 210 Ca 0.19 1.42 -0.02 0.00 0.70 0.00 0.00 55.95 58.24 2du3 s SER 210 Cb 0.07 1.37 0.06 0.00 -1.71 0.00 0.00 66.02 65.81 2du3 s SER 210 CO -0.01 -0.23 0.02 -0.63 1.20 0.00 0.00 173.24 173.60 2du3 s ILE 211 N 1.44 3.00 0.35 6.45 1.01 -1.26 -0.70 121.20 131.50 2du3 s ILE 211 Ca -0.09 -1.50 -0.10 0.00 0.00 0.00 0.00 60.65 58.97 2du3 s ILE 211 Cb -0.05 -2.78 0.03 0.00 0.01 0.00 0.00 42.46 39.67 2du3 s ILE 211 CO -0.17 -0.19 0.62 -0.62 0.00 0.00 0.00 174.94 174.58 2du3 s ASP 212 N 1.31 0.40 0.41 3.58 -1.08 -1.00 -4.96 116.67 115.32 2du3 s ASP 212 Ca -0.03 -1.26 -0.23 0.00 -0.52 0.00 0.00 52.55 50.51 2du3 s ASP 212 Cb -0.20 0.74 -0.10 0.00 -1.46 0.00 0.00 42.92 41.90 2du3 s ASP 212 CO -0.02 -1.46 0.99 -0.13 0.52 0.00 0.00 175.17 175.08 2du3 s ARG 213 N -2.85 4.22 0.16 4.34 0.52 -1.26 -1.62 118.95 122.46 2du3 s ARG 213 Ca 0.23 1.32 0.00 0.00 -0.52 0.00 0.00 55.73 56.76 2du3 s ARG 213 Cb -0.03 -2.41 -0.04 0.00 0.52 0.00 0.00 34.95 32.99 2du3 s ARG 213 CO 0.15 -0.06 0.05 0.00 0.02 0.00 0.00 175.30 175.46 2du3 s PHE 215 N -3.91 0.81 -0.30 0.00 0.40 -0.30 -1.85 117.98 112.82 2du3 s PHE 215 Ca 0.26 -0.37 -0.09 0.00 -0.60 0.00 0.00 56.93 56.12 2du3 s PHE 215 Cb 0.07 -0.49 0.18 0.00 0.51 0.00 0.00 43.02 43.29 2du3 s PHE 215 CO 0.04 -0.03 0.89 0.50 0.70 0.00 0.00 175.22 177.32 2du3 s ARG 216 N -1.17 0.33 0.58 0.44 3.52 -0.09 -3.65 118.95 118.90 2du3 s ARG 216 Ca -0.04 0.61 -0.19 0.00 -0.13 0.00 0.00 55.73 55.98 2du3 s ARG 216 Cb -0.08 0.34 -0.04 0.00 -1.56 0.00 0.00 34.95 33.61 2du3 s ARG 216 CO 0.01 -0.33 1.19 -0.98 -0.81 0.00 0.00 175.30 174.38 2du3 s ARG 217 N 2.88 3.05 -0.31 5.12 1.70 -0.49 -4.52 118.95 126.38 2du3 s ARG 217 Ca 0.06 1.77 0.02 0.00 -0.47 0.00 0.00 55.73 57.12 2du3 s ARG 217 Cb -0.11 -1.95 0.16 0.00 -0.57 0.00 0.00 34.95 32.48 2du3 s ARG 217 CO -0.15 -1.13 0.41 -1.21 -1.08 0.00 0.00 175.30 172.14 2du3 s GLU 218 N -3.34 0.47 0.00 3.89 0.41 -1.26 -4.85 118.70 114.02 2du3 s GLU 218 Ca 0.76 -0.07 0.00 0.00 -0.41 0.00 0.00 54.97 55.25 2du3 s GLU 218 Cb -0.29 -0.37 0.00 0.00 -1.78 0.00 0.00 34.13 31.69 2du3 s GLU 218 CO 0.32 -1.07 0.00 1.04 -0.49 0.00 0.00 175.26 175.06 2du3 n GLN 219 N 5.11 -0.89 -3.17 1.61 1.13 -1.26 -2.45 117.38 117.46 2du3 n GLN 219 Ca 0.03 0.21 -0.14 0.00 -1.94 0.00 0.00 57.00 55.15 2du3 n GLN 219 Cb 0.49 -4.49 0.07 0.00 0.11 0.00 0.00 30.24 26.43 2du3 n GLN 219 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2du3 n GLY 220 N -0.57 -0.57 3.38 1.08 0.00 -1.26 -5.02 105.19 102.22 2du3 n GLY 220 Ca 0.00 0.24 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 2du3 n GLY 220 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2du3 s GLU 221 N -4.77 1.35 -0.06 1.61 2.02 -1.03 -5.07 118.70 112.76 2du3 s GLU 221 Ca 0.18 -1.44 0.01 0.00 0.02 0.00 0.00 54.97 53.75 2du3 s GLU 221 Cb -0.02 0.36 -0.04 0.00 0.10 0.00 0.00 34.13 34.53 2du3 s GLU 221 CO 0.65 -0.50 -0.04 -3.47 0.02 0.00 0.00 175.26 171.92 2du3 n ASP 222 N -0.32 3.58 0.00 -0.19 4.64 -1.22 -4.14 116.55 118.92 2du3 n ASP 222 Ca -0.00 -0.03 0.11 0.00 -1.38 0.00 0.00 54.79 53.49 2du3 n ASP 222 Cb 0.64 0.03 0.56 0.00 -1.04 0.00 0.00 41.12 41.31 2du3 n ASP 222 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2du3 n ALA 223 N -2.59 2.15 0.10 -1.67 0.00 -1.26 -2.62 120.51 114.63 2du3 n ALA 223 Ca -0.10 -0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.27 2du3 n ALA 223 Cb 0.62 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 18.65 2du3 n ALA 223 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2du3 n THR 224 N -1.29 0.00 0.00 0.00 -1.04 -1.26 -5.08 114.28 105.60 2du3 n THR 224 Ca 0.10 -0.22 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2du3 n THR 224 Cb 0.18 0.51 0.00 0.00 -1.82 0.00 0.00 70.33 69.21 2du3 n THR 224 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2du3 n ARG 225 N -1.60 0.00 -4.18 -2.82 3.00 -1.08 -5.07 116.66 104.92 2du3 n ARG 225 Ca -0.01 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.54 2du3 n ARG 225 Cb 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 32.56 2du3 n ARG 225 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2du3 s LEU 226 N 0.00 3.41 0.28 6.15 1.43 -1.26 -3.37 118.68 125.32 2du3 s LEU 226 Ca 0.00 -0.17 0.11 0.00 -1.03 0.00 0.00 54.13 53.04 2du3 s LEU 226 Cb 0.00 -2.11 0.39 0.00 0.03 0.00 0.00 46.19 44.50 2du3 s LEU 226 CO 0.00 0.20 1.63 1.88 0.23 0.00 0.00 176.35 180.28 2du3 h TYR 227 N 3.64 0.00 -3.78 0.29 0.99 -1.85 -3.44 116.97 112.82 2du3 h TYR 227 Ca -0.48 0.00 -0.55 0.00 2.00 0.00 0.00 58.73 59.70 2du3 h TYR 227 Cb 1.17 0.00 -0.21 0.00 1.00 0.00 0.00 36.73 38.69 2du3 h TYR 227 CO 0.60 0.59 -0.82 0.99 -0.00 0.00 0.00 178.16 179.53 2du3 s THR 228 N -3.61 1.73 0.30 -2.88 2.01 -1.26 -0.92 115.64 111.01 2du3 s THR 228 Ca -0.01 -1.63 -0.17 0.00 0.31 0.00 0.00 61.69 60.19 2du3 s THR 228 Cb 0.13 -1.62 0.02 0.00 0.01 0.00 0.00 72.50 71.04 2du3 s THR 228 CO 0.75 -0.12 0.68 -0.72 -0.69 0.00 0.00 174.62 174.52 2du3 s TYR 229 N -1.37 0.06 -0.09 4.92 -0.85 -0.77 -4.99 117.35 114.25 2du3 s TYR 229 Ca 0.08 -0.54 0.01 0.00 -0.52 0.00 0.00 57.07 56.10 2du3 s TYR 229 Cb -0.09 0.60 -0.03 0.00 0.38 0.00 0.00 41.96 42.82 2du3 s TYR 229 CO 0.05 -1.27 -0.09 -0.06 -1.52 0.00 0.00 175.55 172.66 2du3 s PHE 230 N -3.51 2.88 -0.14 -3.49 0.40 -1.26 -1.07 117.98 111.79 2du3 s PHE 230 Ca 0.15 -0.16 0.01 0.00 -0.60 0.00 0.00 56.93 56.33 2du3 s PHE 230 Cb -0.04 -1.75 -0.00 0.00 0.51 0.00 0.00 43.02 41.74 2du3 s PHE 230 CO 0.09 0.17 -0.17 0.45 0.70 0.00 0.00 175.22 176.46 2du3 s SER 231 N -0.45 3.59 -0.70 1.36 0.15 -0.64 -2.16 113.70 114.85 2du3 s SER 231 Ca 0.06 -0.47 -0.18 0.00 0.70 0.00 0.00 55.95 56.07 2du3 s SER 231 Cb -0.12 -1.54 0.14 0.00 -1.71 0.00 0.00 66.02 62.79 2du3 s SER 231 CO 0.02 0.11 0.78 0.00 1.20 0.00 0.00 173.24 175.35 2du3 s ALA 232 N 0.68 3.57 0.28 5.45 0.00 0.14 -2.38 121.76 129.49 2du3 s ALA 232 Ca -0.08 -2.60 0.10 0.00 0.00 0.00 0.00 51.96 49.38 2du3 s ALA 232 Cb -0.16 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.32 2du3 s ALA 232 CO 0.02 -2.43 -0.01 0.45 0.00 0.00 0.00 175.76 173.79 2du3 s SER 233 N 3.30 4.41 0.15 0.00 0.15 0.13 -1.79 113.70 120.04 2du3 s SER 233 Ca 0.16 -0.73 -0.17 0.00 0.70 0.00 0.00 55.95 55.91 2du3 s SER 233 Cb -0.18 -0.74 0.04 0.00 -1.71 0.00 0.00 66.02 63.42 2du3 s SER 233 CO -0.00 -0.04 0.45 0.00 1.20 0.00 0.00 173.24 174.84 2du3 s VAL 235 N -3.82 0.18 -0.10 0.00 -7.23 -0.35 -2.40 120.40 106.68 2du3 s VAL 235 Ca 0.05 -0.49 0.02 0.00 -1.81 0.00 0.00 61.98 59.75 2du3 s VAL 235 Cb 0.01 -0.24 0.01 0.00 0.56 0.00 0.00 36.38 36.73 2du3 s VAL 235 CO -0.10 -0.20 -0.16 -0.22 -0.31 0.00 0.00 175.10 174.12 2du3 s LEU 236 N -0.72 1.75 -0.15 1.32 0.20 0.06 -2.00 118.68 119.14 2du3 s LEU 236 Ca -0.06 -0.42 0.02 0.00 0.69 0.00 0.00 54.13 54.35 2du3 s LEU 236 Cb -0.05 -1.09 0.01 0.00 -0.43 0.00 0.00 46.19 44.63 2du3 s LEU 236 CO -0.00 0.03 -0.19 -0.69 -0.29 0.00 0.00 176.35 175.20 2du3 s VAL 237 N 0.90 2.29 0.31 1.68 1.01 0.33 -0.97 120.40 125.95 2du3 s VAL 237 Ca -0.08 -0.90 -0.16 0.00 0.00 0.00 0.00 61.98 60.83 2du3 s VAL 237 Cb -0.15 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 34.31 2du3 s VAL 237 CO -0.00 0.54 0.67 -0.62 0.00 0.00 0.00 175.10 175.69 2du3 s ASP 238 N 0.82 -0.06 0.01 3.32 3.68 -1.16 -0.78 116.67 122.50 2du3 s ASP 238 Ca -0.06 -0.89 -0.19 0.00 2.13 0.00 0.00 52.55 53.54 2du3 s ASP 238 Cb -0.15 0.73 -0.24 0.00 -1.45 0.00 0.00 42.92 41.81 2du3 s ASP 238 CO -0.01 -1.40 1.10 -0.33 0.13 0.00 0.00 175.17 174.66 2du3 h GLU 239 N 2.06 0.43 -4.93 4.34 5.08 -1.98 -3.25 114.58 116.33 2du3 h GLU 239 Ca -0.25 -0.47 -0.66 0.00 -1.00 0.00 0.00 59.36 56.98 2du3 h GLU 239 Cb 1.25 0.13 -0.28 0.00 0.50 0.00 0.00 28.75 30.35 2du3 h GLU 239 CO 0.31 1.13 -0.70 -1.21 -1.00 0.00 0.00 179.01 177.54 2du3 s GLU 240 N -3.20 3.21 0.00 2.33 0.41 -1.26 -4.60 118.70 115.60 2du3 s GLU 240 Ca -0.13 -0.74 -0.03 0.00 -0.41 0.00 0.00 54.97 53.66 2du3 s GLU 240 Cb 0.04 -3.09 -0.01 0.00 -1.78 0.00 0.00 34.13 29.29 2du3 s GLU 240 CO 0.83 -0.29 0.05 -0.51 -0.49 0.00 0.00 175.26 174.85 2du3 s LEU 241 N 1.46 1.89 0.24 1.80 1.43 -1.26 -5.10 118.68 119.13 2du3 s LEU 241 Ca 0.04 -0.27 -0.10 0.00 -1.03 0.00 0.00 54.13 52.78 2du3 s LEU 241 Cb -0.15 0.34 -0.01 0.00 0.03 0.00 0.00 46.19 46.40 2du3 s LEU 241 CO -0.02 -0.27 0.40 -0.94 0.23 0.00 0.00 176.35 175.75 2du3 s SER 242 N -1.14 -0.00 0.65 2.29 1.04 -1.26 -5.01 113.70 110.26 2du3 s SER 242 Ca -0.12 -1.05 0.27 0.00 0.48 0.00 0.00 55.95 55.52 2du3 s SER 242 Cb -0.07 0.54 1.43 0.00 0.10 0.00 0.00 66.02 68.02 2du3 s SER 242 CO 0.00 -1.08 1.81 0.58 0.98 0.00 0.00 173.24 175.54 2du3 h VAL 243 N 2.33 0.08 0.00 5.02 2.07 -1.97 0.11 116.25 123.89 2du3 h VAL 243 Ca -0.28 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 2du3 h VAL 243 Cb 1.25 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 2du3 h VAL 243 CO 0.39 0.00 -0.22 0.44 0.02 0.00 0.00 177.57 178.20 2du3 h ASP 244 N 0.00 0.00 0.88 0.57 5.19 -1.99 -1.69 116.42 119.38 2du3 h ASP 244 Ca 0.05 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.35 2du3 h ASP 244 Cb 0.94 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.43 2du3 h ASP 244 CO -0.00 0.22 -0.55 0.44 -3.12 0.00 0.00 179.24 176.24 2du3 h ASP 245 N 0.00 0.00 -0.16 6.45 5.19 -1.18 -0.60 116.42 126.12 2du3 h ASP 245 Ca -0.00 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.20 2du3 h ASP 245 Cb 0.49 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.01 2du3 h ASP 245 CO 0.03 0.55 -0.73 1.23 -3.12 0.00 0.00 179.24 177.20 2du3 h GLY 246 N 2.31 0.85 0.77 2.75 0.00 -1.44 -2.36 103.07 105.95 2du3 h GLY 246 Ca -0.01 -1.18 -0.02 0.00 0.00 0.00 0.00 47.33 46.12 2du3 h GLY 246 CO 0.07 1.05 -0.01 0.50 0.00 0.00 0.00 176.54 178.16 2du3 h LYS 247 N 0.49 0.24 -0.62 4.80 1.57 -1.18 -0.57 116.57 121.30 2du3 h LYS 247 Ca -0.05 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.66 2du3 h LYS 247 Cb 1.36 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.62 2du3 h LYS 247 CO 0.15 0.49 0.41 0.00 -0.57 0.00 0.00 179.45 179.93 2du3 h ALA 248 N 0.74 1.56 -0.14 3.86 0.00 -1.15 -0.88 119.26 123.25 2du3 h ALA 248 Ca 0.04 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 2du3 h ALA 248 Cb 0.38 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2du3 h ALA 248 CO 0.01 0.40 -0.33 0.28 0.00 0.00 0.00 179.25 179.61 2du3 h VAL 249 N 0.84 1.36 -0.73 0.00 2.07 -1.27 -1.99 116.25 116.52 2du3 h VAL 249 Ca 0.23 -1.61 0.04 0.00 0.82 0.00 0.00 66.70 66.19 2du3 h VAL 249 Cb -0.09 2.03 -0.05 0.00 -1.52 0.00 0.00 31.29 31.66 2du3 h VAL 249 CO -0.05 0.48 0.45 0.00 0.02 0.00 0.00 177.57 178.47 2du3 h ALA 250 N 0.54 0.97 -0.13 1.67 0.00 -0.59 -1.14 119.26 120.58 2du3 h ALA 250 Ca -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2du3 h ALA 250 Cb 0.94 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2du3 h ALA 250 CO 0.07 0.20 -0.05 1.49 0.00 0.00 0.00 179.25 180.96 2du3 h GLU 251 N 0.86 0.26 -0.03 0.00 4.81 -1.18 0.04 114.58 119.34 2du3 h GLU 251 Ca 0.31 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2du3 h GLU 251 Cb 0.08 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.45 2du3 h GLU 251 CO -0.14 0.59 -0.05 0.00 -0.73 0.00 0.00 179.01 178.69 2du3 h ALA 252 N 0.67 1.86 0.00 2.92 0.00 -1.11 0.79 119.26 124.38 2du3 h ALA 252 Ca 0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2du3 h ALA 252 Cb 0.51 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2du3 h ALA 252 CO 0.02 0.11 -0.05 1.25 0.00 0.00 0.00 179.25 180.57 2du3 h LEU 253 N 0.05 0.00 -1.52 0.00 5.85 -1.15 -3.37 115.31 115.17 2du3 h LEU 253 Ca 0.01 -0.35 -0.02 0.00 0.84 0.00 0.00 57.88 58.36 2du3 h LEU 253 Cb 0.12 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2du3 h LEU 253 CO 0.01 0.70 0.06 -0.07 -0.34 0.00 0.00 178.44 178.80 2du3 h LEU 254 N -1.00 0.34 -2.46 2.25 -0.00 -0.87 -2.38 115.31 111.18 2du3 h LEU 254 Ca -0.01 -0.04 -0.00 0.00 -0.00 0.00 0.00 57.88 57.83 2du3 h LEU 254 Cb 0.39 -0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 40.97 2du3 h LEU 254 CO -0.01 0.35 -0.02 0.03 -0.00 0.00 0.00 178.44 178.80 2du3 h ARG 255 N 0.37 0.00 0.00 1.13 2.47 -1.01 -0.72 114.38 116.62 2du3 h ARG 255 Ca 0.09 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.81 2du3 h ARG 255 Cb 0.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2du3 h ARG 255 CO -0.00 0.02 0.00 1.04 0.56 0.00 0.00 179.97 181.58 2du3 n GLN 256 N -3.70 0.44 -0.34 0.04 6.02 -0.89 -3.02 117.38 115.93 2du3 n GLN 256 Ca -0.03 0.01 0.09 0.00 -0.01 0.00 0.00 57.00 57.06 2du3 n GLN 256 Cb 0.10 -1.50 0.23 0.00 1.02 0.00 0.00 30.24 30.09 2du3 n GLN 256 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 2du3 n PHE 257 N -1.27 0.67 -0.47 1.08 3.72 -0.29 -4.98 117.46 115.93 2du3 n PHE 257 Ca 0.14 -0.92 0.00 0.00 -0.05 0.00 0.00 57.45 56.63 2du3 n PHE 257 Cb 0.23 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.50 2du3 n PHE 257 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2du3 n GLY 258 N -0.78 0.95 3.80 1.37 0.00 -1.17 -5.04 105.19 104.32 2du3 n GLY 258 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 2du3 n GLY 258 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2du3 s PHE 259 N -3.03 3.06 0.00 1.61 0.40 -1.17 -4.55 117.98 114.30 2du3 s PHE 259 Ca 0.00 1.57 0.00 0.00 -0.60 0.00 0.00 56.93 57.90 2du3 s PHE 259 Cb 0.00 -3.02 0.00 0.00 0.51 0.00 0.00 43.02 40.51 2du3 s PHE 259 CO 0.00 -0.73 0.15 0.39 0.70 0.00 0.00 175.22 175.73 2du3 n GLU 260 N -1.06 1.44 -3.72 0.44 1.02 -0.49 -4.38 120.64 113.89 2du3 n GLU 260 Ca 0.09 -0.15 -0.14 0.00 -0.02 0.00 0.00 57.16 56.94 2du3 n GLU 260 Cb 0.53 -0.55 -0.09 0.00 -0.02 0.00 0.00 31.44 31.31 2du3 n GLU 260 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2du3 s ASN 261 N -0.25 -0.35 0.05 1.62 3.04 -1.25 -4.99 114.94 112.80 2du3 s ASN 261 Ca 0.00 0.49 0.03 0.00 0.04 0.00 0.00 52.86 53.42 2du3 s ASN 261 Cb 0.00 0.58 -0.02 0.00 -1.54 0.00 0.00 41.25 40.27 2du3 s ASN 261 CO 0.00 -0.32 -0.10 -0.36 -3.04 0.00 0.00 177.10 173.28 2du3 s PHE 262 N -0.60 0.83 0.01 0.43 0.08 -1.26 -1.07 117.98 116.39 2du3 s PHE 262 Ca -0.07 -0.45 0.01 0.00 0.12 0.00 0.00 56.93 56.53 2du3 s PHE 262 Cb -0.04 -0.49 -0.01 0.00 -0.57 0.00 0.00 43.02 41.92 2du3 s PHE 262 CO 0.03 -0.04 -0.03 1.03 -0.10 0.00 0.00 175.22 176.12 2du3 s ARG 263 N -1.49 0.21 -0.04 0.44 1.81 0.10 -5.01 118.95 114.97 2du3 s ARG 263 Ca -0.06 -0.27 0.03 0.00 -1.72 0.00 0.00 55.73 53.71 2du3 s ARG 263 Cb -0.09 -0.08 0.00 0.00 -0.45 0.00 0.00 34.95 34.33 2du3 s ARG 263 CO 0.01 0.01 -0.14 -0.06 -0.68 0.00 0.00 175.30 174.45 2du3 s PHE 264 N -0.53 1.40 0.19 -0.53 0.40 -1.26 -0.42 117.98 117.23 2du3 s PHE 264 Ca -0.05 -0.40 0.08 0.00 -0.60 0.00 0.00 56.93 55.97 2du3 s PHE 264 Cb -0.04 -0.97 -0.04 0.00 0.51 0.00 0.00 43.02 42.48 2du3 s PHE 264 CO -0.00 -0.15 -0.17 -0.98 0.70 0.00 0.00 175.22 174.62 2du3 s ARG 265 N 0.16 1.33 0.20 0.44 1.70 -0.89 -4.95 118.95 116.94 2du3 s ARG 265 Ca -0.05 -1.51 -0.30 0.00 -0.47 0.00 0.00 55.73 53.40 2du3 s ARG 265 Cb -0.11 -1.28 -0.08 0.00 -0.57 0.00 0.00 34.95 32.92 2du3 s ARG 265 CO 0.02 0.24 1.07 0.15 -1.08 0.00 0.00 175.30 175.69 2du3 s LYS 266 N -3.20 4.64 -0.19 3.89 -0.14 -1.26 -0.09 119.74 123.40 2du3 s LYS 266 Ca 0.20 1.68 -0.26 0.00 -1.36 0.00 0.00 55.97 56.23 2du3 s LYS 266 Cb -0.04 -3.27 -0.01 0.00 -1.68 0.00 0.00 37.83 32.84 2du3 s LYS 266 CO 0.07 0.16 0.89 0.34 -0.76 0.00 0.00 175.35 176.06 2du3 s ASP 267 N -0.36 7.00 0.61 2.83 3.68 -0.30 -4.82 116.67 125.31 2du3 s ASP 267 Ca 0.47 1.23 0.30 0.00 2.13 0.00 0.00 52.55 56.68 2du3 s ASP 267 Cb -0.29 -2.48 1.62 0.00 -1.45 0.00 0.00 42.92 40.32 2du3 s ASP 267 CO 0.35 -0.48 2.00 -0.33 0.13 0.00 0.00 175.17 176.84 2du3 h GLU 268 N 7.39 0.00 -0.17 4.34 5.08 -1.95 -2.44 114.58 126.83 2du3 h GLU 268 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2du3 h GLU 268 Cb 1.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2du3 h GLU 268 CO 0.87 0.00 0.11 0.87 -1.00 0.00 0.00 179.01 179.86 2du3 h LYS 269 N 0.00 0.22 -6.12 2.33 1.57 -1.96 -3.47 116.57 109.15 2du3 h LYS 269 Ca 0.11 -0.01 -0.42 0.00 -1.87 0.00 0.00 60.65 58.46 2du3 h LYS 269 Cb 0.75 -0.05 0.06 0.00 0.08 0.00 0.00 32.23 33.07 2du3 h LYS 269 CO -0.00 0.16 -0.87 0.54 -0.57 0.00 0.00 179.45 178.71 2du3 n ARG 270 N -4.97 -3.57 -1.66 3.15 1.74 -0.92 -4.87 116.66 105.57 2du3 n ARG 270 Ca -0.04 0.57 -0.40 0.00 -0.77 0.00 0.00 57.85 57.22 2du3 n ARG 270 Cb 0.03 -4.90 0.03 0.00 -1.02 0.00 0.00 32.46 26.60 2du3 n ARG 270 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2du3 n SER 271 N -2.97 1.79 0.28 0.55 7.64 -1.26 -4.92 113.62 114.72 2du3 n SER 271 Ca -0.23 0.99 0.13 0.00 1.01 0.00 0.00 58.87 60.77 2du3 n SER 271 Cb 0.65 -1.45 0.79 0.00 -1.01 0.00 0.00 64.21 63.20 2du3 n SER 271 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2du3 h LYS 272 N 1.43 0.00 -0.02 1.43 1.79 -1.89 -2.65 116.57 116.66 2du3 h LYS 272 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 2du3 h LYS 272 Cb 1.32 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.97 2du3 h LYS 272 CO 0.56 0.07 0.00 2.48 -1.08 0.00 0.00 179.45 181.48 2du3 n TYR 273 N -3.80 0.02 -4.99 -1.35 4.11 -1.25 -4.73 117.16 105.17 2du3 n TYR 273 Ca -0.02 -0.01 -0.31 0.00 -0.00 0.00 0.00 57.90 57.55 2du3 n TYR 273 Cb 0.17 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.36 2du3 n TYR 273 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 2du3 s TYR 274 N -1.98 2.46 0.20 -3.48 2.02 -1.00 0.08 117.35 115.65 2du3 s TYR 274 Ca 0.38 -0.33 -0.32 0.00 -0.37 0.00 0.00 57.07 56.42 2du3 s TYR 274 Cb 0.18 -1.50 -0.13 0.00 -0.40 0.00 0.00 41.96 40.11 2du3 s TYR 274 CO 0.29 0.11 1.56 -0.89 -1.57 0.00 0.00 175.55 175.06 2du3 n ILE 275 N 2.07 0.35 -1.54 2.71 5.41 0.94 -4.59 119.36 124.72 2du3 n ILE 275 Ca -0.16 -0.09 -0.49 0.00 1.00 0.00 0.00 62.75 63.01 2du3 n ILE 275 Cb 0.52 -1.65 -0.04 0.00 -0.71 0.00 0.00 39.64 37.76 2du3 n ILE 275 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2du3 n PRO 276 N 3.03 0.86 -1.19 0.38 -0.02 -1.26 -1.31 135.00 135.48 2du3 n PRO 276 Ca 0.15 0.30 -0.07 0.00 -2.02 0.00 0.00 63.50 61.86 2du3 n PRO 276 Cb 0.31 -1.68 -0.03 0.00 -0.02 0.00 0.00 33.50 32.08 2du3 n PRO 276 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2du3 n ASP 277 N 1.81 -4.67 -0.02 2.55 2.03 -1.26 -4.85 116.55 112.14 2du3 n ASP 277 Ca 0.15 0.17 0.04 0.00 0.52 0.00 0.00 54.79 55.67 2du3 n ASP 277 Cb 0.24 -2.76 -0.12 0.00 -0.72 0.00 0.00 41.12 37.76 2du3 n ASP 277 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2du3 n THR 278 N -2.52 0.24 -1.93 5.18 -2.24 -0.43 -4.89 114.28 107.70 2du3 n THR 278 Ca -0.07 -0.42 -0.39 0.00 -2.27 0.00 0.00 64.05 60.90 2du3 n THR 278 Cb 0.36 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.52 2du3 n THR 278 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2du3 s GLN 279 N -2.91 2.72 0.03 -0.78 0.74 -1.26 -4.28 119.66 113.91 2du3 s GLN 279 Ca -0.06 1.01 0.03 0.00 0.05 0.00 0.00 55.36 56.38 2du3 s GLN 279 Cb 0.09 -4.38 -0.04 0.00 1.10 0.00 0.00 33.01 29.78 2du3 s GLN 279 CO 0.64 -2.60 0.00 0.99 -0.55 0.00 0.00 175.29 173.77 2du3 s THR 280 N 9.11 4.13 -0.12 -0.34 2.01 -0.06 -1.15 115.64 129.23 2du3 s THR 280 Ca 0.77 -0.73 -0.05 0.00 0.31 0.00 0.00 61.69 61.99 2du3 s THR 280 Cb -0.16 -2.89 -0.04 0.00 0.01 0.00 0.00 72.50 69.42 2du3 s THR 280 CO 0.25 0.29 0.06 -1.61 -0.69 0.00 0.00 174.62 172.92 2du3 s GLU 281 N -1.83 3.40 -0.18 4.92 2.02 0.88 -1.62 118.70 126.29 2du3 s GLU 281 Ca 0.22 -0.30 -0.03 0.00 0.02 0.00 0.00 54.97 54.88 2du3 s GLU 281 Cb -0.12 -3.03 -0.02 0.00 0.10 0.00 0.00 34.13 31.06 2du3 s GLU 281 CO 0.13 0.61 -0.06 0.54 0.02 0.00 0.00 175.26 176.51 2du3 s VAL 282 N -0.59 3.52 -0.14 2.63 0.11 0.00 -2.09 120.40 123.84 2du3 s VAL 282 Ca 0.11 -0.47 -0.03 0.00 -2.93 0.00 0.00 61.98 58.66 2du3 s VAL 282 Cb -0.12 -2.55 -0.03 0.00 -1.53 0.00 0.00 36.38 32.15 2du3 s VAL 282 CO 0.02 0.47 -0.05 -0.36 -3.33 0.00 0.00 175.10 171.86 2du3 s PHE 283 N 0.80 3.01 0.12 1.54 0.08 0.43 -1.52 117.98 122.44 2du3 s PHE 283 Ca -0.02 -0.24 0.06 0.00 0.12 0.00 0.00 56.93 56.85 2du3 s PHE 283 Cb -0.15 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.36 2du3 s PHE 283 CO 0.02 0.04 -0.15 0.00 -0.10 0.00 0.00 175.22 175.03 2du3 s ALA 284 N 0.11 1.53 -0.22 5.36 0.00 -0.19 -0.72 121.76 127.62 2du3 s ALA 284 Ca -0.01 -1.29 -0.06 0.00 0.00 0.00 0.00 51.96 50.59 2du3 s ALA 284 Cb -0.14 -0.09 -0.03 0.00 0.00 0.00 0.00 23.12 22.86 2du3 s ALA 284 CO 0.03 0.12 0.04 0.12 0.00 0.00 0.00 175.76 176.08 2du3 s PHE 285 N -2.06 3.10 -0.09 0.00 2.19 -0.23 -1.28 117.98 119.60 2du3 s PHE 285 Ca 0.09 -0.34 0.03 0.00 0.33 0.00 0.00 56.93 57.04 2du3 s PHE 285 Cb -0.05 -2.15 0.01 0.00 -1.31 0.00 0.00 43.02 39.51 2du3 s PHE 285 CO 0.03 -0.22 -0.18 -1.58 1.83 0.00 0.00 175.22 175.10 2du3 s HIS 286 N 1.17 2.05 0.13 10.12 2.46 0.75 -1.39 115.29 130.58 2du3 s HIS 286 Ca 0.04 -0.84 -0.26 0.00 0.47 0.00 0.00 55.06 54.47 2du3 s HIS 286 Cb -0.14 -1.42 -0.03 0.00 -0.13 0.00 0.00 32.58 30.86 2du3 s HIS 286 CO 0.03 -0.38 1.61 -1.35 -2.47 0.00 0.00 174.74 172.18 2du3 h PRO 287 N 6.92 -0.38 -0.40 2.88 0.11 -1.85 -1.40 132.00 137.87 2du3 h PRO 287 Ca -0.26 0.03 0.12 0.00 0.11 0.00 0.00 66.00 66.00 2du3 h PRO 287 Cb 1.21 0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.39 2du3 h PRO 287 CO 0.48 -0.26 0.90 0.87 -0.21 0.00 0.00 178.00 179.78 2du3 h LYS 288 N -0.40 0.00 0.00 1.05 1.57 -1.96 0.38 116.57 117.22 2du3 h LYS 288 Ca 0.09 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 2du3 h LYS 288 Cb 0.54 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 2du3 h LYS 288 CO -0.33 0.00 -0.96 -0.07 -0.57 0.00 0.00 179.45 177.52 2du3 h LEU 289 N 0.00 0.00 -9.78 2.94 3.38 -1.57 -3.44 115.31 106.84 2du3 h LEU 289 Ca 0.19 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.64 2du3 h LEU 289 Cb 1.99 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.79 2du3 h LEU 289 CO -0.00 0.05 0.63 0.68 0.09 0.00 0.00 178.44 179.89 2du3 s VAL 290 N -3.32 3.01 0.00 1.22 -7.23 0.13 -1.85 120.40 112.36 2du3 s VAL 290 Ca -0.00 0.92 0.00 0.00 -1.81 0.00 0.00 61.98 61.09 2du3 s VAL 290 Cb 0.09 -3.59 0.00 0.00 0.56 0.00 0.00 36.38 33.44 2du3 s VAL 290 CO 0.78 0.19 0.00 0.61 -0.31 0.00 0.00 175.10 176.37 2du3 n GLY 291 N 1.54 0.97 3.77 2.32 0.00 -0.17 -4.96 105.19 108.66 2du3 n GLY 291 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 2du3 n GLY 291 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2du3 s SER 292 N -2.90 5.46 0.27 1.61 0.15 -0.77 -4.92 113.70 112.61 2du3 s SER 292 Ca 0.00 2.22 0.25 0.00 0.70 0.00 0.00 55.95 59.13 2du3 s SER 292 Cb 0.00 -2.58 0.89 0.00 -1.71 0.00 0.00 66.02 62.62 2du3 s SER 292 CO 0.00 -1.40 1.76 -1.28 1.20 0.00 0.00 173.24 173.52 2du3 h SER 293 N 0.94 0.00 -1.95 5.45 0.87 -1.94 -3.37 113.55 113.55 2du3 h SER 293 Ca -0.50 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 59.88 2du3 h SER 293 Cb 1.27 0.00 0.11 0.00 -0.44 0.00 0.00 62.40 63.34 2du3 h SER 293 CO 0.56 0.00 -0.09 1.07 -0.53 0.00 0.00 176.83 177.84 2du3 n THR 294 N -2.38 0.00 1.80 2.23 5.66 -1.26 -4.85 114.28 115.48 2du3 n THR 294 Ca 0.04 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.17 2du3 n THR 294 Cb 0.34 -0.51 0.69 0.00 -1.55 0.00 0.00 70.33 69.30 2du3 n THR 294 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 2du3 n LYS 295 N -3.70 1.22 -2.03 1.09 3.00 -1.26 -3.66 118.16 112.82 2du3 n LYS 295 Ca 0.07 -0.33 -0.30 0.00 -0.00 0.00 0.00 58.31 57.75 2du3 n LYS 295 Cb 0.31 -1.43 0.03 0.00 0.00 0.00 0.00 35.03 33.94 2du3 n LYS 295 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2du3 n TYR 296 N -0.54 3.09 -0.34 5.64 4.02 -1.26 -4.81 117.16 122.95 2du3 n TYR 296 Ca 0.19 -2.67 0.13 0.00 -0.01 0.00 0.00 57.90 55.54 2du3 n TYR 296 Cb 0.17 -0.60 0.32 0.00 -0.02 0.00 0.00 39.34 39.21 2du3 n TYR 296 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 2du3 h SER 297 N 2.42 0.74 0.00 7.72 0.02 -1.73 0.96 113.55 123.67 2du3 h SER 297 Ca 0.42 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 2du3 h SER 297 Cb 0.96 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.47 2du3 h SER 297 CO 1.05 0.25 0.00 -0.90 -1.14 0.00 0.00 176.83 176.09 2du3 n ASP 298 N -4.80 0.00 0.00 3.07 3.85 -1.26 -1.00 116.55 116.41 2du3 n ASP 298 Ca 0.23 -1.01 0.00 0.00 -0.71 0.00 0.00 54.79 53.30 2du3 n ASP 298 Cb 0.58 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.35 2du3 n ASP 298 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2du3 n GLY 299 N 0.80 0.68 3.72 6.12 0.00 0.33 -4.75 105.19 112.10 2du3 n GLY 299 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 2du3 n GLY 299 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2du3 s TRP 300 N -2.52 3.26 -0.05 1.61 0.52 -1.26 -0.18 118.94 120.33 2du3 s TRP 300 Ca 0.00 0.26 -0.20 0.00 0.02 0.00 0.00 56.10 56.18 2du3 s TRP 300 Cb 0.00 -1.84 0.04 0.00 -1.15 0.00 0.00 33.47 30.52 2du3 s TRP 300 CO 0.00 0.51 0.45 -1.50 0.02 0.00 0.00 176.95 176.43 2du3 s ILE 301 N -0.85 0.03 -0.34 2.03 2.07 -0.41 -4.74 121.20 118.99 2du3 s ILE 301 Ca 0.13 -0.26 -0.29 0.00 -1.41 0.00 0.00 60.65 58.82 2du3 s ILE 301 Cb -0.12 -0.75 0.02 0.00 0.13 0.00 0.00 42.46 41.74 2du3 s ILE 301 CO 0.03 -0.14 1.14 -0.70 -1.91 0.00 0.00 174.94 173.36 2du3 s GLU 302 N -1.09 3.97 -0.01 3.50 2.12 -1.26 -1.02 118.70 124.90 2du3 s GLU 302 Ca -0.11 1.02 0.09 0.00 0.36 0.00 0.00 54.97 56.33 2du3 s GLU 302 Cb -0.03 -3.80 -0.12 0.00 0.26 0.00 0.00 34.13 30.43 2du3 s GLU 302 CO 0.06 -1.05 0.27 1.51 -0.54 0.00 0.00 175.26 175.52 2du3 n ILE 303 N 6.14 0.00 -3.83 -3.70 0.13 -0.57 -4.99 119.36 112.54 2du3 n ILE 303 Ca 0.13 -0.24 -0.07 0.00 -1.10 0.00 0.00 62.75 61.46 2du3 n ILE 303 Cb 0.47 0.61 0.01 0.00 -0.84 0.00 0.00 39.64 39.89 2du3 n ILE 303 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2du3 s ALA 304 N -2.27 -1.04 -0.01 1.51 0.00 -1.20 -4.00 121.76 114.75 2du3 s ALA 304 Ca -0.00 -0.54 -0.15 0.00 0.00 0.00 0.00 51.96 51.27 2du3 s ALA 304 Cb 0.06 0.72 0.02 0.00 0.00 0.00 0.00 23.12 23.92 2du3 s ALA 304 CO 0.37 -1.01 0.31 0.95 0.00 0.00 0.00 175.76 176.37 2du3 s THR 305 N -2.63 0.06 0.32 0.00 -4.23 -0.84 -0.82 115.64 107.50 2du3 s THR 305 Ca 0.16 -0.49 -0.11 0.00 -1.18 0.00 0.00 61.69 60.06 2du3 s THR 305 Cb -0.05 -0.63 0.02 0.00 1.34 0.00 0.00 72.50 73.18 2du3 s THR 305 CO 0.09 -0.27 0.59 0.72 -0.54 0.00 0.00 174.62 175.21 2du3 s PHE 306 N -1.41 0.47 -0.03 3.99 -0.12 -0.64 -1.05 117.98 119.18 2du3 s PHE 306 Ca -0.13 -0.89 -0.14 0.00 -0.05 0.00 0.00 56.93 55.72 2du3 s PHE 306 Cb -0.05 0.33 0.05 0.00 -0.63 0.00 0.00 43.02 42.72 2du3 s PHE 306 CO 0.04 -1.23 0.64 0.41 -0.05 0.00 0.00 175.22 175.03 2du3 n GLY 307 N -0.49 0.33 3.09 1.99 0.00 -0.52 -0.88 105.19 108.70 2du3 n GLY 307 Ca -0.03 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 2du3 n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2du3 s ILE 308 N -2.04 1.87 0.19 -0.61 1.01 -1.26 -1.07 121.20 119.29 2du3 s ILE 308 Ca 0.15 -0.83 -0.32 0.00 0.00 0.00 0.00 60.65 59.65 2du3 s ILE 308 Cb -0.00 -1.70 -0.15 0.00 0.01 0.00 0.00 42.46 40.62 2du3 s ILE 308 CO -0.01 0.51 1.24 -1.22 0.00 0.00 0.00 174.94 175.46 2du3 n TYR 309 N 4.55 1.56 -2.05 3.97 0.53 -0.67 -0.04 117.16 125.01 2du3 n TYR 309 Ca -0.19 0.60 -0.42 0.00 -1.02 0.00 0.00 57.90 56.87 2du3 n TYR 309 Cb 0.50 -2.34 -0.03 0.00 -1.03 0.00 0.00 39.34 36.45 2du3 n TYR 309 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 2du3 s SER 310 N 0.10 6.71 0.65 7.72 0.15 0.11 -4.43 113.70 124.70 2du3 s SER 310 Ca 0.72 2.35 0.30 0.00 0.70 0.00 0.00 55.95 60.02 2du3 s SER 310 Cb -0.79 -2.57 1.64 0.00 -1.71 0.00 0.00 66.02 62.59 2du3 s SER 310 CO 0.51 -0.80 1.94 1.55 1.20 0.00 0.00 173.24 177.64 2du3 h PRO 311 N 7.89 0.00 -0.53 5.44 0.13 -1.90 0.71 132.00 143.73 2du3 h PRO 311 Ca -0.41 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.69 2du3 h PRO 311 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2du3 h PRO 311 CO 0.91 0.00 0.21 1.15 -0.23 0.00 0.00 178.00 180.04 2du3 h THR 312 N 0.00 1.22 0.04 1.56 2.02 -1.95 -1.52 112.91 114.28 2du3 h THR 312 Ca 0.03 -0.69 -0.27 0.00 0.77 0.00 0.00 66.41 66.25 2du3 h THR 312 Cb 0.71 0.68 0.02 0.00 -1.74 0.00 0.00 68.15 67.82 2du3 h THR 312 CO -0.00 0.26 -1.09 0.00 0.37 0.00 0.00 175.52 175.07 2du3 h ALA 313 N 1.05 0.08 -0.81 6.16 0.00 0.09 -3.26 119.26 122.57 2du3 h ALA 313 Ca 0.18 -0.72 0.04 0.00 0.00 0.00 0.00 54.91 54.41 2du3 h ALA 313 Cb 0.21 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 2du3 h ALA 313 CO -0.01 0.66 0.53 -0.07 0.00 0.00 0.00 179.25 180.36 2du3 h LEU 314 N 0.32 0.85 -1.20 0.00 -0.00 -1.10 -2.17 115.31 112.01 2du3 h LEU 314 Ca -0.15 -0.01 0.01 0.00 -0.00 0.00 0.00 57.88 57.73 2du3 h LEU 314 Cb 1.75 -0.19 -0.04 0.00 -0.00 0.00 0.00 40.66 42.18 2du3 h LEU 314 CO 0.21 0.58 0.52 0.00 -0.00 0.00 0.00 178.44 179.75 2du3 h ALA 315 N 1.53 1.42 0.00 1.53 0.00 -1.32 0.76 119.26 123.17 2du3 h ALA 315 Ca 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2du3 h ALA 315 Cb 0.07 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2du3 h ALA 315 CO -0.10 0.54 0.04 0.39 0.00 0.00 0.00 179.25 180.11 2du3 n GLU 316 N -4.41 0.02 -0.02 0.00 -0.58 -0.82 -0.32 120.64 114.52 2du3 n GLU 316 Ca 0.09 0.49 0.00 0.00 -0.42 0.00 0.00 57.16 57.32 2du3 n GLU 316 Cb 0.03 -1.60 0.01 0.00 -0.57 0.00 0.00 31.44 29.31 2du3 n GLU 316 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2du3 n TYR 317 N -1.57 0.00 -2.98 -0.32 4.02 -0.70 -5.01 117.16 110.60 2du3 n TYR 317 Ca -0.00 -0.28 -0.20 0.00 -0.01 0.00 0.00 57.90 57.40 2du3 n TYR 317 Cb 0.04 -0.03 0.04 0.00 -0.02 0.00 0.00 39.34 39.37 2du3 n TYR 317 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2du3 n ASP 318 N -0.30 -5.76 -4.61 7.72 4.64 0.57 -4.66 116.55 114.16 2du3 n ASP 318 Ca 0.01 -0.28 -0.40 0.00 -1.38 0.00 0.00 54.79 52.74 2du3 n ASP 318 Cb 0.39 -4.57 -0.08 0.00 -1.04 0.00 0.00 41.12 35.82 2du3 n ASP 318 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2du3 s ILE 319 N -3.14 5.10 -1.91 5.18 1.01 0.18 -4.96 121.20 122.66 2du3 s ILE 319 Ca 0.29 0.72 0.28 0.00 0.00 0.00 0.00 60.65 61.94 2du3 s ILE 319 Cb -0.13 -3.80 0.45 0.00 0.01 0.00 0.00 42.46 38.99 2du3 s ILE 319 CO 0.36 0.07 1.76 -0.81 0.00 0.00 0.00 174.94 176.32 2du3 n PRO 320 N 5.50 1.00 -4.38 2.79 -0.04 -1.26 -4.15 135.00 134.45 2du3 n PRO 320 Ca -0.06 -0.48 -0.28 0.00 -0.04 0.00 0.00 63.50 62.65 2du3 n PRO 320 Cb 0.50 -1.49 -0.12 0.00 -0.04 0.00 0.00 33.50 32.35 2du3 n PRO 320 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2du3 s TYR 321 N -2.34 2.38 0.52 0.54 1.51 -1.26 -5.11 117.35 113.59 2du3 s TYR 321 Ca 0.31 -0.33 -0.19 0.00 -1.01 0.00 0.00 57.07 55.84 2du3 s TYR 321 Cb 0.20 -1.22 -0.07 0.00 -0.11 0.00 0.00 41.96 40.77 2du3 s TYR 321 CO 0.45 0.44 1.07 -1.25 -1.11 0.00 0.00 175.55 175.15 2du3 s PRO 322 N -2.46 3.59 -0.01 -1.71 0.04 -1.23 -4.93 135.00 128.30 2du3 s PRO 322 Ca 0.19 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.65 2du3 s PRO 322 Cb -0.09 -2.06 0.01 0.00 0.04 0.00 0.00 34.50 32.40 2du3 s PRO 322 CO 0.10 -0.61 -0.01 0.54 0.04 0.00 0.00 177.00 177.05 2du3 s VAL 323 N -1.99 0.13 -0.16 -0.36 0.11 -1.26 -2.97 120.40 113.89 2du3 s VAL 323 Ca 0.68 -0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 59.64 2du3 s VAL 323 Cb -0.18 -0.15 -0.05 0.00 -1.53 0.00 0.00 36.38 34.46 2du3 s VAL 323 CO 0.24 0.07 0.15 -0.32 -3.33 0.00 0.00 175.10 171.91 2du3 s MET 324 N 0.33 3.87 -0.11 1.54 1.75 -0.14 -1.67 119.30 124.87 2du3 s MET 324 Ca -0.03 -0.16 0.00 0.00 -1.25 0.00 0.00 55.69 54.26 2du3 s MET 324 Cb -0.05 -3.32 0.02 0.00 2.84 0.00 0.00 34.83 34.32 2du3 s MET 324 CO -0.01 0.51 -0.11 1.21 -0.65 0.00 0.00 175.02 175.97 2du3 s ASN 325 N -0.25 2.24 -0.08 1.11 3.84 -0.24 -0.76 114.94 120.81 2du3 s ASN 325 Ca 0.12 -0.35 0.05 0.00 0.21 0.00 0.00 52.86 52.88 2du3 s ASN 325 Cb -0.12 -0.94 -0.00 0.00 -0.55 0.00 0.00 41.25 39.65 2du3 s ASN 325 CO 0.01 -0.06 -0.23 -0.22 -2.79 0.00 0.00 177.10 173.81 2du3 s LEU 326 N 1.39 2.03 -0.01 3.21 1.98 -1.01 -1.44 118.68 124.84 2du3 s LEU 326 Ca 0.00 -0.50 0.05 0.00 -2.89 0.00 0.00 54.13 50.79 2du3 s LEU 326 Cb -0.13 -1.30 -0.01 0.00 0.66 0.00 0.00 46.19 45.40 2du3 s LEU 326 CO -0.06 0.18 -0.17 -0.83 -1.89 0.00 0.00 176.35 173.59 2du3 s GLY 327 N 0.15 0.83 -0.08 7.98 0.00 -0.22 -1.76 107.32 114.22 2du3 s GLY 327 Ca -0.11 -0.75 0.02 0.00 0.00 0.00 0.00 44.72 43.88 2du3 s GLY 327 CO 0.06 -0.64 -0.14 -2.27 0.00 0.00 0.00 173.10 170.12 2du3 s LEU 328 N -0.49 1.68 -0.34 0.66 1.98 -0.74 -1.99 118.68 119.43 2du3 s LEU 328 Ca 0.06 -0.34 -0.29 0.00 -2.89 0.00 0.00 54.13 50.67 2du3 s LEU 328 Cb -0.07 -0.92 0.02 0.00 0.66 0.00 0.00 46.19 45.88 2du3 s LEU 328 CO -0.00 0.04 1.12 -0.83 -1.89 0.00 0.00 176.35 174.78 2du3 s GLY 329 N 0.71 1.50 0.11 7.98 0.00 -1.26 -0.69 107.32 115.67 2du3 s GLY 329 Ca -0.13 -0.09 -0.19 0.00 0.00 0.00 0.00 44.72 44.31 2du3 s GLY 329 CO 0.03 2.34 1.68 -2.08 0.00 0.00 0.00 173.10 175.07 2du3 h VAL 330 N 5.83 1.14 -0.58 1.40 2.07 -1.81 -3.22 116.25 121.08 2du3 h VAL 330 Ca -0.22 -0.40 0.12 0.00 0.82 0.00 0.00 66.70 67.02 2du3 h VAL 330 Cb 1.07 0.96 -0.11 0.00 -1.52 0.00 0.00 31.29 31.69 2du3 h VAL 330 CO 1.05 0.14 -0.17 -0.33 0.02 0.00 0.00 177.57 178.28 2du3 h GLU 331 N 0.26 -0.02 -0.75 1.57 3.07 -1.92 -0.74 114.58 116.05 2du3 h GLU 331 Ca 0.08 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.94 2du3 h GLU 331 Cb 0.12 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.00 2du3 h GLU 331 CO -0.01 -0.01 0.43 -0.09 -1.40 0.00 0.00 179.01 177.92 2du3 h ARG 332 N -0.02 1.03 -0.76 2.33 2.43 -1.97 -1.81 114.38 115.61 2du3 h ARG 332 Ca 0.28 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 2du3 h ARG 332 Cb 0.45 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 2du3 h ARG 332 CO -0.61 0.75 0.31 1.25 -1.51 0.00 0.00 179.97 180.16 2du3 h LEU 333 N 1.03 1.03 -0.69 3.80 6.46 -1.30 -2.58 115.31 123.06 2du3 h LEU 333 Ca 0.27 -0.15 -0.05 0.00 -0.12 0.00 0.00 57.88 57.83 2du3 h LEU 333 Cb 0.00 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 39.63 2du3 h LEU 333 CO -0.05 0.91 0.25 0.00 -0.62 0.00 0.00 178.44 178.93 2du3 h ALA 334 N 1.24 0.90 -0.81 1.25 0.00 -0.74 -1.14 119.26 119.95 2du3 h ALA 334 Ca 0.25 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2du3 h ALA 334 Cb 0.20 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 2du3 h ALA 334 CO -0.02 0.55 0.52 0.52 0.00 0.00 0.00 179.25 180.82 2du3 h MET 335 N 1.00 1.00 0.25 0.00 2.86 -1.00 0.02 114.93 119.06 2du3 h MET 335 Ca 0.23 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 2du3 h MET 335 Cb 0.25 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.69 2du3 h MET 335 CO -0.01 0.66 -0.12 0.82 1.06 0.00 0.00 176.91 179.32 2du3 h ILE 336 N 1.03 0.81 -0.87 -1.22 2.04 -1.16 0.41 117.51 118.55 2du3 h ILE 336 Ca 0.32 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.61 2du3 h ILE 336 Cb -0.03 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 2du3 h ILE 336 CO -0.10 0.12 0.57 -0.07 0.00 0.00 0.00 178.15 178.67 2du3 h LEU 337 N -0.65 0.96 -3.17 1.44 3.38 -1.01 -3.01 115.31 113.25 2du3 h LEU 337 Ca -0.03 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2du3 h LEU 337 Cb 0.46 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2du3 h LEU 337 CO 0.06 0.68 0.00 -1.22 0.09 0.00 0.00 178.44 178.04 2du3 n TYR 338 N -4.51 1.11 -3.13 1.13 4.02 -0.03 -5.03 117.16 110.72 2du3 n TYR 338 Ca 0.10 -0.70 -0.03 0.00 -0.01 0.00 0.00 57.90 57.27 2du3 n TYR 338 Cb 0.05 -0.25 0.00 0.00 -0.02 0.00 0.00 39.34 39.13 2du3 n TYR 338 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2du3 n GLY 339 N 0.33 -1.25 3.23 2.72 0.00 0.31 -5.00 105.19 105.53 2du3 n GLY 339 Ca 0.21 0.48 -0.20 0.00 0.00 0.00 0.00 46.02 46.51 2du3 n GLY 339 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2du3 s TYR 340 N -3.01 1.47 -0.11 1.61 1.51 0.12 -5.02 117.35 113.92 2du3 s TYR 340 Ca 0.01 -0.46 0.11 0.00 -1.01 0.00 0.00 57.07 55.72 2du3 s TYR 340 Cb -0.00 -0.80 -0.16 0.00 -0.11 0.00 0.00 41.96 40.89 2du3 s TYR 340 CO 0.76 0.13 0.07 -0.25 -1.11 0.00 0.00 175.55 175.16 2du3 n ASP 341 N 1.07 2.00 -4.18 2.29 10.43 -1.26 -4.61 116.55 122.29 2du3 n ASP 341 Ca -0.20 0.00 -0.34 0.00 2.57 0.00 0.00 54.79 56.83 2du3 n ASP 341 Cb 0.54 0.89 -0.15 0.00 1.84 0.00 0.00 41.12 44.24 2du3 n ASP 341 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2du3 s ASP 342 N -4.38 3.64 0.19 -2.24 3.68 -1.26 -5.01 116.67 111.29 2du3 s ASP 342 Ca -0.06 -0.63 -0.20 0.00 2.13 0.00 0.00 52.55 53.79 2du3 s ASP 342 Cb 0.04 -1.58 0.14 0.00 -1.45 0.00 0.00 42.92 40.07 2du3 s ASP 342 CO 0.50 -0.03 1.59 0.58 0.13 0.00 0.00 175.17 177.95 2du3 h VAL 343 N 5.93 0.20 -0.72 1.11 2.07 -1.97 -1.42 116.25 121.45 2du3 h VAL 343 Ca -0.42 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.20 2du3 h VAL 343 Cb 1.14 0.20 -0.08 0.00 -1.52 0.00 0.00 31.29 31.04 2du3 h VAL 343 CO 0.62 0.00 0.35 0.03 0.02 0.00 0.00 177.57 178.59 2du3 h ARG 344 N -0.15 0.57 -0.09 1.57 3.08 -1.95 -1.24 114.38 116.17 2du3 h ARG 344 Ca 0.24 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 60.13 2du3 h ARG 344 Cb 0.54 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 2du3 h ARG 344 CO -0.66 0.37 -0.49 0.87 -1.07 0.00 0.00 179.97 178.99 2du3 h LYS 345 N 0.58 0.23 -0.12 0.04 1.57 -1.64 0.11 116.57 117.34 2du3 h LYS 345 Ca 0.36 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 2du3 h LYS 345 Cb 0.42 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 2du3 h LYS 345 CO -0.29 0.67 0.01 1.98 -0.57 0.00 0.00 179.45 181.25 2du3 h MET 346 N 0.18 0.21 0.00 3.15 4.05 -0.25 -2.90 114.93 119.37 2du3 h MET 346 Ca 0.01 -0.06 -0.13 0.00 -0.28 0.00 0.00 59.70 59.23 2du3 h MET 346 Cb 0.93 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.68 2du3 h MET 346 CO 0.07 0.43 -1.63 1.55 0.23 0.00 0.00 176.91 177.56 2du3 n VAL 347 N -4.81 0.86 -2.58 -5.77 3.14 -0.58 -4.53 118.33 104.07 2du3 n VAL 347 Ca -0.06 -0.65 -0.24 0.00 -2.96 0.00 0.00 64.34 60.43 2du3 n VAL 347 Cb 0.19 -0.46 -0.00 0.00 -1.06 0.00 0.00 33.84 32.51 2du3 n VAL 347 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 2du3 n TYR 348 N -2.69 3.07 -0.24 1.45 4.01 0.02 -4.92 117.16 117.86 2du3 n TYR 348 Ca -0.10 -3.19 0.03 0.00 -0.16 0.00 0.00 57.90 54.48 2du3 n TYR 348 Cb 0.78 -0.18 0.16 0.00 -0.31 0.00 0.00 39.34 39.79 2du3 n TYR 348 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2du3 h PRO 349 N 2.70 0.43 -0.15 -0.72 0.13 -1.66 -1.75 132.00 130.98 2du3 h PRO 349 Ca 0.22 -0.03 0.01 0.00 -0.87 0.00 0.00 66.00 65.33 2du3 h PRO 349 Cb 0.91 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 2du3 h PRO 349 CO 0.79 0.28 0.06 1.96 -0.23 0.00 0.00 178.00 180.86 2du3 h GLN 350 N 0.44 0.13 -0.05 0.86 7.50 -1.90 0.32 115.11 122.42 2du3 h GLN 350 Ca 0.38 -0.01 -0.08 0.00 0.50 0.00 0.00 58.65 59.44 2du3 h GLN 350 Cb 0.53 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.02 2du3 h GLN 350 CO -0.37 0.09 -0.33 0.82 -1.50 0.00 0.00 178.83 177.54 2du3 h ILE 351 N 0.14 1.25 -0.54 2.54 2.04 -1.87 -3.02 117.51 118.05 2du3 h ILE 351 Ca 0.06 -1.20 -0.08 0.00 1.00 0.00 0.00 64.86 64.64 2du3 h ILE 351 Cb 0.02 1.58 -0.05 0.00 -0.74 0.00 0.00 36.82 37.64 2du3 h ILE 351 CO -0.05 0.35 0.10 1.41 0.00 0.00 0.00 178.15 179.96 2du3 n HIS 352 N -4.13 1.87 -1.13 1.37 8.25 -0.69 -4.92 115.22 115.84 2du3 n HIS 352 Ca -0.02 -0.79 -0.05 0.00 -0.26 0.00 0.00 57.72 56.61 2du3 n HIS 352 Cb 0.39 -0.51 -0.02 0.00 1.12 0.00 0.00 29.99 30.96 2du3 n HIS 352 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2du3 n GLY 353 N 0.26 0.65 2.59 -1.41 0.00 -1.05 -4.94 105.19 101.29 2du3 n GLY 353 Ca 0.28 -0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 2du3 n GLY 353 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2du3 n GLU 354 N -1.60 4.55 -4.07 1.61 -0.58 0.07 -4.95 120.64 115.66 2du3 n GLU 354 Ca -0.05 -3.70 -0.28 0.00 -0.42 0.00 0.00 57.16 52.71 2du3 n GLU 354 Cb 0.31 -2.65 -0.06 0.00 -0.57 0.00 0.00 31.44 28.47 2du3 n GLU 354 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 2du3 s ILE 355 N -1.43 4.46 -0.13 -3.67 -4.36 -1.26 -4.64 121.20 110.17 2du3 s ILE 355 Ca 0.48 -0.96 -0.22 0.00 -0.26 0.00 0.00 60.65 59.70 2du3 s ILE 355 Cb 0.16 -3.21 0.05 0.00 1.25 0.00 0.00 42.46 40.71 2du3 s ILE 355 CO -0.07 -0.00 0.55 -0.75 0.24 0.00 0.00 174.94 174.90 2du3 s LYS 356 N -2.76 0.78 0.10 0.37 2.47 -1.26 -5.08 119.74 114.35 2du3 s LYS 356 Ca 0.30 0.44 0.10 0.00 -1.56 0.00 0.00 55.97 55.25 2du3 s LYS 356 Cb -0.11 0.37 -0.04 0.00 -1.46 0.00 0.00 37.83 36.59 2du3 s LYS 356 CO 0.22 -0.17 -0.26 -0.51 0.16 0.00 0.00 175.35 174.80 2du3 s LEU 357 N -0.45 2.28 0.56 5.43 1.43 -1.26 -5.14 118.68 121.53 2du3 s LEU 357 Ca -0.06 -0.70 -0.03 0.00 -1.03 0.00 0.00 54.13 52.31 2du3 s LEU 357 Cb -0.03 -1.17 0.01 0.00 0.03 0.00 0.00 46.19 45.03 2du3 s LEU 357 CO 0.04 0.18 0.83 -0.94 0.23 0.00 0.00 176.35 176.69 2du3 s SER 358 N -1.83 5.52 0.24 2.29 1.04 -1.26 -4.92 113.70 114.79 2du3 s SER 358 Ca 0.12 0.47 -0.05 0.00 0.48 0.00 0.00 55.95 56.97 2du3 s SER 358 Cb -0.10 -1.48 0.36 0.00 0.10 0.00 0.00 66.02 64.90 2du3 s SER 358 CO 0.05 -1.04 1.83 0.44 0.98 0.00 0.00 173.24 175.50 2du3 h ASP 359 N -0.04 0.73 -0.69 7.02 3.45 -2.00 -0.52 116.42 124.39 2du3 h ASP 359 Ca -0.45 0.03 0.07 0.00 0.43 0.00 0.00 57.03 57.11 2du3 h ASP 359 Cb 1.27 -0.11 -0.06 0.00 -0.56 0.00 0.00 39.33 39.86 2du3 h ASP 359 CO 0.59 0.45 0.38 0.25 -1.57 0.00 0.00 179.24 179.33 2du3 h LEU 360 N 0.86 0.55 -0.53 1.55 5.85 -1.92 0.06 115.31 121.73 2du3 h LEU 360 Ca 0.38 0.03 0.02 0.00 0.84 0.00 0.00 57.88 59.15 2du3 h LEU 360 Cb 0.27 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 2du3 h LEU 360 CO -0.21 0.35 0.32 0.44 -0.34 0.00 0.00 178.44 179.01 2du3 h ASP 361 N 0.69 0.53 -0.16 1.25 3.32 -1.48 -1.61 116.42 118.96 2du3 h ASP 361 Ca 0.31 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 2du3 h ASP 361 Cb 0.22 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2du3 h ASP 361 CO -0.20 0.38 0.05 0.40 -1.72 0.00 0.00 179.24 178.14 2du3 h ILE 362 N 0.65 1.19 -0.61 0.35 2.04 -0.65 -2.64 117.51 117.82 2du3 h ILE 362 Ca 0.21 -0.59 0.11 0.00 1.00 0.00 0.00 64.86 65.60 2du3 h ILE 362 Cb 0.01 1.28 -0.09 0.00 -0.74 0.00 0.00 36.82 37.29 2du3 h ILE 362 CO -0.09 0.18 0.15 0.00 0.00 0.00 0.00 178.15 178.39 2du3 h ALA 363 N 0.86 0.75 -0.55 1.87 0.00 -0.80 0.26 119.26 121.65 2du3 h ALA 363 Ca 0.05 0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.17 2du3 h ALA 363 Cb 0.23 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2du3 h ALA 363 CO -0.00 -0.29 0.37 -0.09 0.00 0.00 0.00 179.25 179.24 2du3 h ARG 364 N 0.29 0.37 0.00 0.00 2.43 -1.05 -2.08 114.38 114.34 2du3 h ARG 364 Ca 0.32 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2du3 h ARG 364 Cb 0.47 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2du3 h ARG 364 CO -0.39 0.25 0.00 0.39 -1.51 0.00 0.00 179.97 178.70 2du3 n GLU 365 N -4.47 0.28 -2.96 0.20 -0.58 0.89 -4.56 120.64 109.43 2du3 n GLU 365 Ca 0.09 0.01 -0.43 0.00 -0.42 0.00 0.00 57.16 56.41 2du3 n GLU 365 Cb 0.34 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.66 2du3 n GLU 365 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2du3 s ILE 366 N -2.71 4.59 0.38 -3.67 1.01 -0.78 -4.37 121.20 115.64 2du3 s ILE 366 Ca 0.23 0.05 0.08 0.00 0.00 0.00 0.00 60.65 61.00 2du3 s ILE 366 Cb 0.19 -4.42 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 2du3 s ILE 366 CO 0.46 -0.95 0.27 -0.54 0.00 0.00 0.00 174.94 174.18 2du3 s LYS 367 N 3.41 2.50 -0.23 2.79 3.01 -0.39 -4.94 119.74 125.89 2du3 s LYS 367 Ca 0.25 -1.52 -0.16 0.00 -1.01 0.00 0.00 55.97 53.53 2du3 s LYS 367 Cb -0.15 -2.29 -0.04 0.00 -1.01 0.00 0.00 37.83 34.34 2du3 s LYS 367 CO 0.17 -0.03 0.41 0.08 0.51 0.00 0.00 175.35 176.49 2du3 s VAL 368 N -2.44 5.18 -0.00 3.17 1.01 -1.26 -1.07 120.40 124.98 2du3 s VAL 368 Ca 0.43 0.70 -0.09 0.00 0.00 0.00 0.00 61.98 63.01 2du3 s VAL 368 Cb -0.03 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 2du3 s VAL 368 CO 0.25 0.21 0.76 0.50 0.00 0.00 0.00 175.10 176.82 2du3 h LYS 369 N 7.65 -0.32 -5.51 2.72 1.63 -0.67 -3.44 116.57 118.62 2du3 h LYS 369 Ca -0.34 0.02 -0.60 0.00 -0.85 0.00 0.00 60.65 58.88 2du3 h LYS 369 Cb 1.16 0.07 -0.11 0.00 -0.60 0.00 0.00 32.23 32.76 2du3 h LYS 369 CO 0.70 -0.22 -0.06 -1.21 -3.45 0.00 0.00 179.45 175.21 2du3 s GLU 370 N -3.06 4.18 -0.03 1.90 0.41 -1.26 -5.06 118.70 115.78 2du3 s GLU 370 Ca -0.05 0.38 0.01 0.00 -0.41 0.00 0.00 54.97 54.89 2du3 s GLU 370 Cb 0.00 -3.56 0.02 0.00 -1.78 0.00 0.00 34.13 28.82 2du3 s GLU 370 CO 0.15 -0.14 -0.02 0.08 -0.49 0.00 0.00 175.26 174.84 2du3 s VAL 371 N 1.60 0.30 0.12 2.63 1.01 -1.26 -4.08 120.40 120.72 2du3 s VAL 371 Ca 0.23 0.01 -0.36 0.00 0.00 0.00 0.00 61.98 61.86 2du3 s VAL 371 Cb -0.15 -0.37 -0.16 0.00 0.00 0.00 0.00 36.38 35.70 2du3 s VAL 371 CO 0.09 0.17 1.41 -2.65 0.00 0.00 0.00 175.10 174.12 2du3 n PRO 372 N 4.06 1.48 0.00 2.72 -0.02 -1.26 -4.88 135.00 137.10 2du3 n PRO 372 Ca -0.26 0.53 0.14 0.00 -2.02 0.00 0.00 63.50 61.89 2du3 n PRO 372 Cb 0.51 -2.21 0.48 0.00 -0.02 0.00 0.00 33.50 32.25 2du3 n PRO 372 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2du3 n GLN 373 N 2.75 1.67 -4.34 -0.52 -0.06 -1.26 -4.80 117.38 110.82 2du3 n GLN 373 Ca 0.18 -1.02 -0.30 0.00 -2.00 0.00 0.00 57.00 53.86 2du3 n GLN 373 Cb 0.23 -1.48 -0.11 0.00 -4.06 0.00 0.00 30.24 24.81 2du3 n GLN 373 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 2du3 s THR 374 N -2.03 2.96 0.41 1.69 2.01 -1.26 -5.02 115.64 114.40 2du3 s THR 374 Ca 0.36 -1.39 0.14 0.00 0.31 0.00 0.00 61.69 61.11 2du3 s THR 374 Cb 0.21 -2.35 0.15 0.00 0.01 0.00 0.00 72.50 70.51 2du3 s THR 374 CO 0.34 0.14 1.92 0.00 -0.69 0.00 0.00 174.62 176.34 2du3 h ALA 375 N 3.84 1.54 0.11 7.40 0.00 -2.00 -2.08 119.26 128.07 2du3 h ALA 375 Ca -0.49 -0.24 -0.28 0.00 0.00 0.00 0.00 54.91 53.90 2du3 h ALA 375 Cb 1.17 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.93 2du3 h ALA 375 CO 0.48 0.33 -1.20 0.28 0.00 0.00 0.00 179.25 179.14 2du3 h VAL 376 N 0.00 1.37 -0.85 0.00 2.07 -1.95 -2.90 116.25 113.98 2du3 h VAL 376 Ca -0.00 -2.63 0.07 0.00 0.82 0.00 0.00 66.70 64.95 2du3 h VAL 376 Cb 0.48 2.72 -0.06 0.00 -1.52 0.00 0.00 31.29 32.91 2du3 h VAL 376 CO 0.03 0.79 0.52 1.23 0.02 0.00 0.00 177.57 180.17 2du3 h GLY 377 N 0.84 1.29 1.00 2.17 0.00 -1.78 0.56 103.07 107.16 2du3 h GLY 377 Ca -0.16 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 46.77 2du3 h GLY 377 CO 0.22 0.25 0.30 1.41 0.00 0.00 0.00 176.54 178.71 2du3 h LEU 378 N 0.95 0.84 -0.62 3.11 3.38 -1.41 -0.33 115.31 121.22 2du3 h LEU 378 Ca 0.38 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2du3 h LEU 378 Cb 0.20 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2du3 h LEU 378 CO -0.18 0.74 0.40 0.11 0.09 0.00 0.00 178.44 179.60 2du3 h LYS 379 N 0.88 0.82 -0.60 1.13 1.57 -0.78 -0.03 116.57 119.55 2du3 h LYS 379 Ca 0.22 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 59.00 2du3 h LYS 379 Cb 0.13 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 32.20 2du3 h LYS 379 CO -0.03 0.56 0.32 0.82 -0.57 0.00 0.00 179.45 180.55 2du3 h ILE 380 N 0.84 0.95 -0.18 1.86 2.04 0.82 -0.42 117.51 123.42 2du3 h ILE 380 Ca 0.23 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 2du3 h ILE 380 Cb -0.08 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 2du3 h ILE 380 CO -0.05 0.11 0.05 0.00 0.00 0.00 0.00 178.15 178.27 2du3 h ALA 381 N 1.32 0.24 -0.67 1.87 0.00 -0.49 -1.63 119.26 119.90 2du3 h ALA 381 Ca 0.27 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.13 2du3 h ALA 381 Cb 0.17 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2du3 h ALA 381 CO -0.18 -0.14 0.31 0.37 0.00 0.00 0.00 179.25 179.62 2du3 h GLN 382 N 0.11 0.53 -0.27 0.00 4.15 -0.58 -1.52 115.11 117.54 2du3 h GLN 382 Ca 0.06 -0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.36 2du3 h GLN 382 Cb 0.24 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.79 2du3 h GLN 382 CO -0.00 0.35 -0.22 0.66 -1.93 0.00 0.00 178.83 177.68 2du3 h SER 383 N 0.54 0.50 0.04 -0.69 4.64 -0.87 -0.69 113.55 117.02 2du3 h SER 383 Ca 0.33 -0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2du3 h SER 383 Cb 0.36 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2du3 h SER 383 CO -0.27 0.72 -0.02 0.40 -0.87 0.00 0.00 176.83 176.79 2du3 h ILE 384 N 0.45 1.01 -0.75 0.95 2.04 -0.31 0.13 117.51 121.03 2du3 h ILE 384 Ca 0.07 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 2du3 h ILE 384 Cb 0.63 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 2du3 h ILE 384 CO 0.05 0.04 0.45 0.58 0.00 0.00 0.00 178.15 179.26 2du3 h VAL 385 N -0.13 1.21 0.40 1.67 2.07 -1.26 0.78 116.25 121.00 2du3 h VAL 385 Ca -0.01 -0.47 -0.00 0.00 0.82 0.00 0.00 66.70 67.04 2du3 h VAL 385 Cb 0.11 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.04 2du3 h VAL 385 CO 0.01 0.22 -0.43 -0.08 0.02 0.00 0.00 177.57 177.32 2du3 h GLU 386 N 1.02 -0.82 0.00 1.57 4.57 -0.64 0.12 114.58 120.40 2du3 h GLU 386 Ca 0.27 0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 58.42 2du3 h GLU 386 Cb -0.03 0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 2du3 h GLU 386 CO -0.05 -0.55 -0.39 1.79 -1.18 0.00 0.00 179.01 178.64 2du3 h THR 387 N -0.85 1.27 -0.08 0.32 1.35 -0.61 -1.76 112.91 112.56 2du3 h THR 387 Ca -0.03 -1.34 -0.07 0.00 -0.55 0.00 0.00 66.41 64.41 2du3 h THR 387 Cb 0.76 1.72 -0.01 0.00 -1.73 0.00 0.00 68.15 68.89 2du3 h THR 387 CO -0.08 0.38 -0.28 0.00 -0.25 0.00 0.00 175.52 175.29 2du3 h ALA 388 N 1.61 1.38 0.04 6.62 0.00 -0.43 -1.19 119.26 127.30 2du3 h ALA 388 Ca -0.00 -0.30 -0.23 0.00 0.00 0.00 0.00 54.91 54.38 2du3 h ALA 388 Cb 0.69 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2du3 h ALA 388 CO 0.05 0.44 -1.03 0.93 0.00 0.00 0.00 179.25 179.64 2du3 h GLU 389 N 0.13 0.18 -0.04 0.00 5.08 -0.05 -3.11 114.58 116.76 2du3 h GLU 389 Ca 0.02 -0.25 -0.09 0.00 -1.00 0.00 0.00 59.36 58.04 2du3 h GLU 389 Cb 0.57 0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.91 2du3 h GLU 389 CO 0.04 1.06 -0.32 0.87 -1.00 0.00 0.00 179.01 179.65 2du3 h LYS 390 N 0.07 0.30 -1.64 2.33 1.57 -0.94 -3.37 116.57 114.89 2du3 h LYS 390 Ca -0.07 -0.26 -0.62 0.00 -1.87 0.00 0.00 60.65 57.83 2du3 h LYS 390 Cb 1.73 0.06 -0.39 0.00 0.08 0.00 0.00 32.23 33.70 2du3 h LYS 390 CO 0.16 0.92 -0.38 0.72 -0.57 0.00 0.00 179.45 180.30 2du3 n HIS 391 N -4.43 3.35 1.00 -1.35 8.25 -0.49 -4.77 115.22 116.79 2du3 n HIS 391 Ca -0.09 -3.00 0.14 0.00 -0.26 0.00 0.00 57.72 54.51 2du3 n HIS 391 Cb 0.51 -0.31 0.57 0.00 1.12 0.00 0.00 29.99 31.89 2du3 n HIS 391 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2du3 n ALA 392 N -0.48 2.49 0.66 -1.41 0.00 -1.18 -3.70 120.51 116.90 2du3 n ALA 392 Ca 0.42 -0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.79 2du3 n ALA 392 Cb 0.57 -1.42 -0.06 0.00 0.00 0.00 0.00 19.45 18.54 2du3 n ALA 392 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2du3 n SER 393 N -1.50 0.89 -4.63 0.00 7.64 -1.26 -3.30 113.62 111.46 2du3 n SER 393 Ca 0.07 -0.94 -0.52 0.00 1.01 0.00 0.00 58.87 58.48 2du3 n SER 393 Cb 0.34 0.86 -0.06 0.00 -1.01 0.00 0.00 64.21 64.34 2du3 n SER 393 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2du3 n GLU 394 N -1.02 1.30 -2.12 1.43 -0.58 -1.24 -4.69 120.64 113.71 2du3 n GLU 394 Ca 0.04 0.47 -0.38 0.00 -0.42 0.00 0.00 57.16 56.87 2du3 n GLU 394 Cb 0.24 -2.15 0.00 0.00 -0.57 0.00 0.00 31.44 28.97 2du3 n GLU 394 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 2du3 s PRO 395 N 1.39 3.71 0.28 3.49 0.02 -1.26 -1.42 135.00 141.21 2du3 s PRO 395 Ca 0.87 1.95 -0.29 0.00 0.02 0.00 0.00 61.00 63.56 2du3 s PRO 395 Cb -0.94 -2.48 -0.09 0.00 0.02 0.00 0.00 34.50 31.01 2du3 s PRO 395 CO 0.50 -0.64 0.98 -1.12 -0.33 0.00 0.00 177.00 176.39 2du3 s SER 396 N -1.12 7.44 0.72 2.53 0.01 0.25 -4.23 113.70 119.29 2du3 s SER 396 Ca 0.63 1.99 -0.09 0.00 1.31 0.00 0.00 55.95 59.80 2du3 s SER 396 Cb -0.33 -2.60 0.05 0.00 0.21 0.00 0.00 66.02 63.35 2du3 s SER 396 CO 0.41 0.00 1.05 -2.84 0.41 0.00 0.00 173.24 172.28 2du3 s PRO 397 N -1.52 2.30 0.01 12.44 0.02 -1.26 -3.84 135.00 143.14 2du3 s PRO 397 Ca 0.45 -0.04 -0.30 0.00 0.02 0.00 0.00 61.00 61.13 2du3 s PRO 397 Cb -0.25 -2.11 0.11 0.00 0.02 0.00 0.00 34.50 32.27 2du3 s PRO 397 CO 0.32 -1.24 1.18 0.00 -0.33 0.00 0.00 177.00 176.92 2du3 s SER 399 N -2.86 -0.67 -0.06 0.00 0.15 -1.26 -3.18 113.70 105.82 2du3 s SER 399 Ca 0.13 0.93 -0.04 0.00 0.70 0.00 0.00 55.95 57.66 2du3 s SER 399 Cb 0.02 0.82 0.02 0.00 -1.71 0.00 0.00 66.02 65.17 2du3 s SER 399 CO -0.03 -0.48 0.14 -0.36 1.20 0.00 0.00 173.24 173.72 2du3 s PHE 400 N -0.69 -0.16 -0.28 3.44 0.08 -0.91 -5.01 117.98 114.45 2du3 s PHE 400 Ca -0.07 0.42 -0.29 0.00 0.12 0.00 0.00 56.93 57.11 2du3 s PHE 400 Cb -0.02 0.01 -0.00 0.00 -0.57 0.00 0.00 43.02 42.44 2du3 s PHE 400 CO 0.07 -0.11 1.28 -1.17 -0.10 0.00 0.00 175.22 175.19 2du3 s LEU 401 N 0.44 3.93 -0.17 -0.37 2.96 -1.26 -1.95 118.68 122.26 2du3 s LEU 401 Ca -0.03 1.28 -0.13 0.00 -0.22 0.00 0.00 54.13 55.02 2du3 s LEU 401 Cb -0.04 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.88 2du3 s LEU 401 CO -0.02 -1.02 0.25 0.00 -1.32 0.00 0.00 176.35 174.24 2du3 n ALA 402 N 7.43 0.87 -3.13 5.97 0.00 0.11 -4.97 120.51 126.78 2du3 n ALA 402 Ca 0.14 -0.58 -0.13 0.00 0.00 0.00 0.00 53.44 52.88 2du3 n ALA 402 Cb 0.46 -0.58 -0.12 0.00 0.00 0.00 0.00 19.45 19.22 2du3 n ALA 402 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2du3 s PHE 403 N -2.47 -0.26 -0.10 0.00 2.19 -1.04 -4.79 117.98 111.51 2du3 s PHE 403 Ca -0.26 0.63 -0.01 0.00 0.33 0.00 0.00 56.93 57.62 2du3 s PHE 403 Cb 0.07 0.09 0.03 0.00 -1.31 0.00 0.00 43.02 41.89 2du3 s PHE 403 CO 0.68 -0.12 -0.06 -2.00 1.83 0.00 0.00 175.22 175.55 2du3 s GLU 404 N 0.15 1.28 0.00 10.12 2.56 -1.26 -0.68 118.70 130.88 2du3 s GLU 404 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.97 54.81 2du3 s GLU 404 Cb -0.02 -1.42 0.00 0.00 2.00 0.00 0.00 34.13 34.69 2du3 s GLU 404 CO 0.00 -0.27 0.00 0.41 -0.56 0.00 0.00 175.26 174.84 2du3 n GLY 405 N 4.99 -1.40 3.87 -1.50 0.00 -0.04 -5.00 105.19 106.11 2du3 n GLY 405 Ca -0.11 -1.06 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 2du3 n GLY 405 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2du3 s GLU 406 N -1.98 3.63 -0.22 1.61 2.12 -1.26 0.84 118.70 123.44 2du3 s GLU 406 Ca 0.00 0.03 -0.04 0.00 0.36 0.00 0.00 54.97 55.33 2du3 s GLU 406 Cb 0.00 -3.14 0.11 0.00 0.26 0.00 0.00 34.13 31.37 2du3 s GLU 406 CO 0.00 0.69 0.32 1.41 -0.54 0.00 0.00 175.26 177.14 2du3 s MET 407 N -1.42 0.28 -0.88 4.30 -2.45 -1.20 -4.85 119.30 113.07 2du3 s MET 407 Ca 0.24 0.49 0.00 0.00 -1.25 0.00 0.00 55.69 55.17 2du3 s MET 407 Cb -0.14 -0.60 0.00 0.00 1.25 0.00 0.00 34.83 35.35 2du3 s MET 407 CO 0.12 -0.58 0.00 -1.33 1.05 0.00 0.00 175.02 174.28 2du3 n MET 408 N 5.35 -0.59 -2.32 4.11 2.81 -1.26 -2.73 117.12 122.49 2du3 n MET 408 Ca -0.05 0.77 -0.06 0.00 -1.81 0.00 0.00 57.70 56.55 2du3 n MET 408 Cb 0.50 -4.63 0.00 0.00 -0.71 0.00 0.00 33.22 28.38 2du3 n MET 408 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2du3 n GLY 409 N -1.88 0.24 2.68 3.03 0.00 -1.26 -5.01 105.19 102.98 2du3 n GLY 409 Ca -0.09 -0.57 -0.21 0.00 0.00 0.00 0.00 46.02 45.15 2du3 n GLY 409 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2du3 s ARG 410 N -4.62 0.27 0.32 1.61 0.52 -1.10 -5.11 118.95 110.84 2du3 s ARG 410 Ca 0.05 -0.24 -0.25 0.00 -0.52 0.00 0.00 55.73 54.77 2du3 s ARG 410 Cb -0.02 -0.87 -0.15 0.00 0.52 0.00 0.00 34.95 34.42 2du3 s ARG 410 CO 0.06 -1.00 0.42 0.09 0.02 0.00 0.00 175.30 174.89 2du3 n ASN 411 N 5.29 -1.51 -3.89 0.23 3.02 -1.26 -3.27 115.26 113.87 2du3 n ASN 411 Ca -0.04 0.98 -0.11 0.00 -0.03 0.00 0.00 54.58 55.38 2du3 n ASN 411 Cb 0.45 -0.99 -0.12 0.00 -0.61 0.00 0.00 39.78 38.51 2du3 n ASN 411 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2du3 s VAL 412 N -1.33 0.05 -0.06 2.41 1.01 0.25 -1.59 120.40 121.13 2du3 s VAL 412 Ca 0.62 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 2du3 s VAL 412 Cb -0.75 -0.21 0.03 0.00 0.00 0.00 0.00 36.38 35.46 2du3 s VAL 412 CO 0.59 -0.21 0.01 0.00 0.00 0.00 0.00 175.10 175.48 2du3 s ARG 413 N -0.65 0.50 -0.10 2.72 1.70 -0.91 -0.86 118.95 121.34 2du3 s ARG 413 Ca -0.07 0.12 -0.00 0.00 -0.47 0.00 0.00 55.73 55.31 2du3 s ARG 413 Cb -0.04 -0.84 -0.03 0.00 -0.57 0.00 0.00 34.95 33.47 2du3 s ARG 413 CO 0.00 -0.27 -0.08 0.08 -1.08 0.00 0.00 175.30 173.96 2du3 s VAL 414 N 1.80 3.61 0.05 4.99 1.01 0.15 -0.85 120.40 131.16 2du3 s VAL 414 Ca 0.02 -0.49 0.07 0.00 0.00 0.00 0.00 61.98 61.58 2du3 s VAL 414 Cb -0.13 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 2du3 s VAL 414 CO -0.04 0.56 -0.20 -0.31 0.00 0.00 0.00 175.10 175.11 2du3 s TYR 415 N -0.34 1.76 -0.18 5.22 2.02 0.56 0.04 117.35 126.42 2du3 s TYR 415 Ca 0.05 -0.38 -0.09 0.00 -0.37 0.00 0.00 57.07 56.28 2du3 s TYR 415 Cb -0.12 -1.04 -0.05 0.00 -0.40 0.00 0.00 41.96 40.35 2du3 s TYR 415 CO 0.02 0.10 0.13 0.08 -1.57 0.00 0.00 175.55 174.31 2du3 s VAL 416 N -0.85 5.41 0.27 0.71 1.01 -0.82 0.66 120.40 126.79 2du3 s VAL 416 Ca 0.07 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.20 2du3 s VAL 416 Cb -0.09 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 2du3 s VAL 416 CO 0.02 0.48 0.35 0.68 0.00 0.00 0.00 175.10 176.63 2du3 s VAL 417 N 0.05 0.00 -0.26 2.92 -7.23 0.01 -2.13 120.40 113.76 2du3 s VAL 417 Ca 0.09 -1.72 -0.02 0.00 -1.81 0.00 0.00 61.98 58.52 2du3 s VAL 417 Cb -0.11 -2.46 0.12 0.00 0.56 0.00 0.00 36.38 34.48 2du3 s VAL 417 CO -0.01 0.00 0.26 -0.70 -0.31 0.00 0.00 175.10 174.34 2du3 s GLU 418 N -3.70 0.27 0.01 4.82 2.56 -1.19 -3.05 118.70 118.42 2du3 s GLU 418 Ca 0.32 -0.03 -0.18 0.00 0.00 0.00 0.00 54.97 55.08 2du3 s GLU 418 Cb 0.02 -0.89 -0.10 0.00 2.00 0.00 0.00 34.13 35.16 2du3 s GLU 418 CO 0.16 -0.88 1.00 0.93 -0.56 0.00 0.00 175.26 175.90 2du3 h GLU 419 N 8.29 -0.63 -6.79 4.30 4.39 -1.96 -3.28 114.58 118.90 2du3 h GLU 419 Ca -0.16 0.04 -0.54 0.00 0.34 0.00 0.00 59.36 59.05 2du3 h GLU 419 Cb 1.10 0.14 0.20 0.00 -0.10 0.00 0.00 28.75 30.10 2du3 h GLU 419 CO 0.32 -0.42 -0.44 0.39 -1.16 0.00 0.00 179.01 177.71 2du3 n GLU 420 N -4.24 -0.09 -3.97 2.33 1.02 -1.26 -4.64 120.64 109.79 2du3 n GLU 420 Ca -0.08 0.02 -0.23 0.00 -0.02 0.00 0.00 57.16 56.85 2du3 n GLU 420 Cb 0.26 -1.91 -0.06 0.00 -0.02 0.00 0.00 31.44 29.71 2du3 n GLU 420 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2du3 s GLU 421 N -3.46 2.37 -0.50 3.49 2.02 -1.26 -4.26 118.70 117.11 2du3 s GLU 421 Ca 0.61 -1.64 -0.02 0.00 0.02 0.00 0.00 54.97 53.94 2du3 s GLU 421 Cb -0.26 -2.17 0.00 0.00 0.10 0.00 0.00 34.13 31.81 2du3 s GLU 421 CO 0.63 -0.04 0.25 -1.71 0.02 0.00 0.00 175.26 174.41 2du3 n ASN 422 N -1.29 -3.15 -0.09 -0.19 4.05 -1.25 -4.98 115.26 108.36 2du3 n ASN 422 Ca -0.01 -0.11 0.00 0.00 0.45 0.00 0.00 54.58 54.91 2du3 n ASN 422 Cb 0.62 -1.99 0.00 0.00 1.23 0.00 0.00 39.78 39.65 2du3 n ASN 422 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 177.26 175.28 2du3 n THR 423 N -3.58 0.00 -4.54 -0.44 5.66 -1.26 -4.98 114.28 105.14 2du3 n THR 423 Ca -0.03 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.72 2du3 n THR 423 Cb 0.54 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.22 2du3 n THR 423 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2du3 s LYS 424 N 0.74 1.83 0.14 1.09 1.02 -1.26 0.85 119.74 124.15 2du3 s LYS 424 Ca 0.00 -2.06 -0.28 0.00 0.02 0.00 0.00 55.97 53.65 2du3 s LYS 424 Cb 0.00 -1.11 -0.04 0.00 -0.52 0.00 0.00 37.83 36.16 2du3 s LYS 424 CO 0.00 -0.21 1.58 1.25 -0.92 0.00 0.00 175.35 177.05 2du3 h LEU 425 N 1.89 -1.33 -9.46 3.17 5.85 -1.38 -3.42 115.31 110.63 2du3 h LEU 425 Ca -0.41 0.18 -0.66 0.00 0.84 0.00 0.00 57.88 57.83 2du3 h LEU 425 Cb 1.26 0.55 -0.12 0.00 0.37 0.00 0.00 40.66 42.72 2du3 h LEU 425 CO 0.71 -0.40 -0.61 0.00 -0.34 0.00 0.00 178.44 177.80 2du3 s GLY 427 N -1.66 1.60 0.45 0.00 0.00 -0.01 -4.91 107.32 102.79 2du3 s GLY 427 Ca 0.21 -0.07 0.22 0.00 0.00 0.00 0.00 44.72 45.08 2du3 s GLY 427 CO 0.12 0.48 1.93 -0.56 0.00 0.00 0.00 173.10 175.08 2du3 h PRO 428 N -1.87 0.00 -0.63 2.90 0.13 -1.80 -3.04 132.00 127.69 2du3 h PRO 428 Ca -0.52 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2du3 h PRO 428 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2du3 h PRO 428 CO 0.53 0.23 0.00 0.00 -0.23 0.00 0.00 178.00 178.53 2du3 n ALA 429 N -2.33 2.92 0.27 -0.56 0.00 -0.97 -4.50 120.51 115.35 2du3 n ALA 429 Ca -0.01 -1.27 0.10 0.00 0.00 0.00 0.00 53.44 52.26 2du3 n ALA 429 Cb 0.34 -1.02 0.71 0.00 0.00 0.00 0.00 19.45 19.49 2du3 n ALA 429 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2du3 h TYR 430 N 3.42 0.00 -0.65 0.00 -0.00 -1.70 -2.00 116.97 116.04 2du3 h TYR 430 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 2du3 h TYR 430 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.92 2du3 h TYR 430 CO 0.61 0.02 0.00 0.00 -0.00 0.00 0.00 178.16 178.79 2du3 n ALA 431 N -2.46 2.62 -1.78 0.10 0.00 -1.26 -1.66 120.51 116.07 2du3 n ALA 431 Ca -0.03 -1.28 -0.41 0.00 0.00 0.00 0.00 53.44 51.72 2du3 n ALA 431 Cb 0.11 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 2du3 n ALA 431 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2du3 s ASN 432 N -0.95 6.39 -0.01 0.00 -0.87 -0.75 -4.77 114.94 113.98 2du3 s ASN 432 Ca 0.46 2.99 0.02 0.00 -1.57 0.00 0.00 52.86 54.76 2du3 s ASN 432 Cb 0.26 -2.66 -0.03 0.00 -0.02 0.00 0.00 41.25 38.80 2du3 s ASN 432 CO 0.28 -0.85 -0.04 -0.70 -2.57 0.00 0.00 177.10 173.22 2du3 s GLU 433 N -1.61 2.69 -0.17 -0.60 2.12 0.28 -0.87 118.70 120.54 2du3 s GLU 433 Ca 0.55 -0.65 -0.25 0.00 0.36 0.00 0.00 54.97 54.99 2du3 s GLU 433 Cb -0.46 -2.59 -0.01 0.00 0.26 0.00 0.00 34.13 31.32 2du3 s GLU 433 CO 0.58 0.62 0.82 0.08 -0.54 0.00 0.00 175.26 176.82 2du3 s VAL 434 N -1.01 4.89 0.02 3.70 1.01 -0.22 -1.64 120.40 127.14 2du3 s VAL 434 Ca 0.17 1.60 0.02 0.00 0.00 0.00 0.00 61.98 63.78 2du3 s VAL 434 Cb -0.11 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.13 2du3 s VAL 434 CO 0.08 0.03 -0.06 0.68 0.00 0.00 0.00 175.10 175.82 2du3 s VAL 435 N 2.16 0.47 -0.22 2.92 -7.23 -0.01 -1.22 120.40 117.27 2du3 s VAL 435 Ca 0.38 -0.58 -0.11 0.00 -1.81 0.00 0.00 61.98 59.86 2du3 s VAL 435 Cb -0.16 -0.46 -0.05 0.00 0.56 0.00 0.00 36.38 36.27 2du3 s VAL 435 CO 0.12 -0.09 0.17 -0.69 -0.31 0.00 0.00 175.10 174.30 2du3 s VAL 436 N -0.64 5.36 -0.09 1.32 1.01 -0.70 -0.71 120.40 125.95 2du3 s VAL 436 Ca -0.03 0.23 -0.04 0.00 0.00 0.00 0.00 61.98 62.14 2du3 s VAL 436 Cb -0.05 -3.51 0.05 0.00 0.00 0.00 0.00 36.38 32.86 2du3 s VAL 436 CO 0.00 0.37 0.18 -0.47 0.00 0.00 0.00 175.10 175.19 2du3 s TYR 437 N 0.82 -0.24 -1.42 5.22 6.14 -0.06 -0.65 117.35 127.17 2du3 s TYR 437 Ca 0.09 0.66 -0.01 0.00 0.64 0.00 0.00 57.07 58.45 2du3 s TYR 437 Cb -0.13 -0.14 0.00 0.00 0.42 0.00 0.00 41.96 42.11 2du3 s TYR 437 CO 0.03 -0.25 0.35 1.63 0.64 0.00 0.00 175.55 177.94 2du3 n LYS 438 N 4.91 -2.72 -0.46 4.97 5.02 -1.26 -1.19 118.16 127.42 2du3 n LYS 438 Ca -0.13 0.34 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2du3 n LYS 438 Cb 0.51 -4.30 0.00 0.00 -0.02 0.00 0.00 35.03 31.22 2du3 n LYS 438 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2du3 n GLY 439 N -2.09 2.06 3.69 0.72 0.00 -1.26 -5.02 105.19 103.30 2du3 n GLY 439 Ca -0.31 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 2du3 n GLY 439 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2du3 s ASP 440 N -3.53 4.91 -0.24 1.61 1.01 -0.33 -4.42 116.67 115.69 2du3 s ASP 440 Ca 0.00 -0.38 -0.05 0.00 0.71 0.00 0.00 52.55 52.83 2du3 s ASP 440 Cb 0.00 -1.09 -0.01 0.00 1.01 0.00 0.00 42.92 42.83 2du3 s ASP 440 CO 0.00 0.06 -0.00 -0.63 0.21 0.00 0.00 175.17 174.81 2du3 s ILE 441 N -1.86 3.67 0.01 0.77 1.01 -0.75 -0.88 121.20 123.17 2du3 s ILE 441 Ca 0.29 -0.45 0.06 0.00 0.00 0.00 0.00 60.65 60.56 2du3 s ILE 441 Cb -0.09 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.64 2du3 s ILE 441 CO 0.20 0.36 -0.18 -0.31 0.00 0.00 0.00 174.94 175.01 2du3 s TYR 442 N 1.51 2.56 -0.59 3.97 2.02 0.11 -0.95 117.35 125.99 2du3 s TYR 442 Ca 0.05 -0.26 -0.06 0.00 -0.37 0.00 0.00 57.07 56.43 2du3 s TYR 442 Cb -0.15 -1.51 0.15 0.00 -0.40 0.00 0.00 41.96 40.05 2du3 s TYR 442 CO -0.01 0.19 0.44 0.20 -1.57 0.00 0.00 175.55 174.80 2du3 s GLY 443 N -1.13 2.34 0.20 0.71 0.00 0.16 -0.83 107.32 108.77 2du3 s GLY 443 Ca 0.13 -2.98 0.02 0.00 0.00 0.00 0.00 44.72 41.89 2du3 s GLY 443 CO 0.03 1.12 0.03 -0.26 0.00 0.00 0.00 173.10 174.02 2du3 s ILE 444 N 0.52 0.65 0.03 0.90 -4.36 -0.65 -4.49 121.20 113.80 2du3 s ILE 444 Ca 0.13 -1.99 -0.02 0.00 -0.26 0.00 0.00 60.65 58.51 2du3 s ILE 444 Cb -0.21 -2.26 -0.04 0.00 1.25 0.00 0.00 42.46 41.20 2du3 s ILE 444 CO -0.04 -0.34 0.21 -2.16 0.24 0.00 0.00 174.94 172.85 2du3 s PRO 445 N -3.95 3.46 -0.75 0.37 0.04 -1.26 0.10 135.00 133.01 2du3 s PRO 445 Ca 0.28 -0.35 -0.26 0.00 0.04 0.00 0.00 61.00 60.71 2du3 s PRO 445 Cb 0.06 -3.05 -0.03 0.00 0.04 0.00 0.00 34.50 31.53 2du3 s PRO 445 CO 0.07 0.63 1.85 0.15 0.04 0.00 0.00 177.00 179.73 2du3 s LYS 446 N -2.25 2.67 -0.01 4.56 1.02 -1.26 -4.73 119.74 119.74 2du3 s LYS 446 Ca 0.32 0.15 0.02 0.00 0.02 0.00 0.00 55.97 56.48 2du3 s LYS 446 Cb -0.13 -4.68 -0.00 0.00 -0.52 0.00 0.00 37.83 32.51 2du3 s LYS 446 CO 0.23 -2.93 -0.08 0.99 -0.92 0.00 0.00 175.35 172.65 2du3 s THR 447 N 9.12 0.64 0.55 2.17 2.01 -1.26 -4.99 115.64 123.89 2du3 s THR 447 Ca 0.66 -0.31 0.28 0.00 0.31 0.00 0.00 61.69 62.62 2du3 s THR 447 Cb -0.10 -0.56 0.41 0.00 0.01 0.00 0.00 72.50 72.27 2du3 s THR 447 CO 0.11 0.20 1.24 0.29 -0.69 0.00 0.00 174.62 175.76 2du3 n LYS 448 N 3.11 0.01 0.05 4.92 4.01 -1.26 0.30 118.16 129.30 2du3 n LYS 448 Ca -0.16 0.95 0.00 0.00 -0.51 0.00 0.00 58.31 58.60 2du3 n LYS 448 Cb 0.56 -2.34 0.32 0.00 -0.51 0.00 0.00 35.03 33.06 2du3 n LYS 448 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 2du3 h LYS 449 N 0.00 0.41 -0.33 1.97 3.64 -1.94 -3.15 116.57 117.17 2du3 h LYS 449 Ca 0.52 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.74 2du3 h LYS 449 Cb 2.84 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 34.57 2du3 h LYS 449 CO -0.01 0.50 0.02 0.91 -2.27 0.00 0.00 179.45 178.60 2du3 n TRP 450 N -4.26 1.14 -0.08 1.91 7.02 0.87 -4.73 117.44 119.31 2du3 n TRP 450 Ca 0.00 -1.06 -0.07 0.00 -1.02 0.00 0.00 57.50 55.35 2du3 n TRP 450 Cb 0.27 -0.39 -0.00 0.00 -2.42 0.00 0.00 31.31 28.77 2du3 n TRP 450 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2du3 h ARG 451 N 1.72 -0.15 -0.90 -0.99 3.08 -1.50 -1.81 114.38 113.84 2du3 h ARG 451 Ca 0.08 0.01 0.22 0.00 0.07 0.00 0.00 59.98 60.35 2du3 h ARG 451 Cb 1.59 0.03 -0.16 0.00 0.08 0.00 0.00 29.97 31.51 2du3 h ARG 451 CO 0.31 -0.10 -0.04 0.66 -1.07 0.00 0.00 179.97 179.74 2du3 h SER 452 N -0.15 -0.53 0.03 7.04 4.64 -1.86 0.26 113.55 122.98 2du3 h SER 452 Ca 0.16 0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2du3 h SER 452 Cb 0.41 0.46 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2du3 h SER 452 CO -0.41 -0.28 -0.02 -0.26 -0.87 0.00 0.00 176.83 174.99 2du3 h PHE 453 N 0.04 -0.04 0.00 4.77 -1.00 -1.70 0.23 116.94 119.24 2du3 h PHE 453 Ca 0.50 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.27 2du3 h PHE 453 Cb 0.93 0.01 -0.00 0.00 3.61 0.00 0.00 35.95 40.51 2du3 h PHE 453 CO -0.53 0.21 -0.05 0.74 -1.61 0.00 0.00 178.31 177.08 2du3 h PHE 454 N -0.29 0.00 0.02 -0.55 -1.00 -0.97 0.15 116.94 114.30 2du3 h PHE 454 Ca -0.00 0.00 -0.32 0.00 2.81 0.00 0.00 57.97 60.45 2du3 h PHE 454 Cb 0.27 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 39.78 2du3 h PHE 454 CO 0.01 0.05 -1.92 0.39 -1.61 0.00 0.00 178.31 175.23 2du3 n GLU 455 N -3.18 0.67 0.00 1.51 1.02 0.79 -4.48 120.64 116.97 2du3 n GLU 455 Ca 0.00 0.23 0.05 0.00 -0.02 0.00 0.00 57.16 57.42 2du3 n GLU 455 Cb 0.30 -1.72 -0.03 0.00 -0.02 0.00 0.00 31.44 29.97 2du3 n GLU 455 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2du3 n GLU 456 N -3.08 3.24 0.00 3.49 1.02 0.79 -5.01 120.64 121.09 2du3 n GLU 456 Ca -0.24 -0.22 0.00 0.00 -0.02 0.00 0.00 57.16 56.69 2du3 n GLU 456 Cb 1.07 -0.99 0.00 0.00 -0.02 0.00 0.00 31.44 31.50 2du3 n GLU 456 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2du3 n GLY 457 N 1.10 2.59 2.88 0.62 0.00 0.52 -4.89 105.19 108.01 2du3 n GLY 457 Ca 0.03 -2.04 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 2du3 n GLY 457 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2du3 s VAL 458 N 1.89 1.13 0.23 1.61 -7.23 0.18 -4.91 120.40 113.30 2du3 s VAL 458 Ca 0.00 -0.81 -0.30 0.00 -1.81 0.00 0.00 61.98 59.06 2du3 s VAL 458 Cb 0.00 -1.40 -0.09 0.00 0.56 0.00 0.00 36.38 35.45 2du3 s VAL 458 CO 0.00 -0.02 1.23 -2.84 -0.31 0.00 0.00 175.10 173.17 2du3 s PRO 459 N 1.60 4.47 0.35 4.82 0.02 -1.26 -1.72 135.00 143.27 2du3 s PRO 459 Ca -0.02 1.97 0.25 0.00 0.02 0.00 0.00 61.00 63.22 2du3 s PRO 459 Cb -0.17 -3.19 0.59 0.00 0.02 0.00 0.00 34.50 31.75 2du3 s PRO 459 CO -0.07 -0.10 1.70 0.00 -0.33 0.00 0.00 177.00 178.19 2du3 h THR 460 N 3.53 0.00 0.00 0.99 1.03 -1.55 -3.47 112.91 113.44 2du3 h THR 460 Ca -0.46 -0.74 0.00 0.00 -0.01 0.00 0.00 66.41 65.20 2du3 h THR 460 Cb 1.22 1.74 0.00 0.00 -1.07 0.00 0.00 68.15 70.03 2du3 h THR 460 CO 0.73 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.85 2du3 n GLY 461 N 1.11 0.48 3.20 2.99 0.00 -1.26 -4.73 105.19 106.97 2du3 n GLY 461 Ca 0.04 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 2du3 n GLY 461 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2du3 s ILE 462 N -2.00 1.99 0.31 -0.61 1.01 -1.26 -5.04 121.20 115.60 2du3 s ILE 462 Ca 0.00 -0.97 0.08 0.00 0.00 0.00 0.00 60.65 59.76 2du3 s ILE 462 Cb 0.00 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 2du3 s ILE 462 CO 0.00 0.54 0.17 -0.13 0.00 0.00 0.00 174.94 175.52 2du3 s ARG 463 N 0.44 2.54 0.19 2.79 0.52 -1.26 -1.06 118.95 123.12 2du3 s ARG 463 Ca -0.17 -1.38 -0.16 0.00 -0.52 0.00 0.00 55.73 53.50 2du3 s ARG 463 Cb -0.17 -2.31 0.18 0.00 0.52 0.00 0.00 34.95 33.16 2du3 s ARG 463 CO 0.07 0.20 1.62 1.88 0.02 0.00 0.00 175.30 179.09 2du3 h TYR 464 N 1.52 -0.47 -0.37 -0.53 -1.99 -1.08 -0.68 116.97 113.37 2du3 h TYR 464 Ca -0.45 0.06 -0.05 0.00 2.00 0.00 0.00 58.73 60.29 2du3 h TYR 464 Cb 1.25 0.29 -0.02 0.00 2.00 0.00 0.00 36.73 40.26 2du3 h TYR 464 CO 0.60 -0.29 0.03 -0.84 -0.00 0.00 0.00 178.16 177.66 2du3 h ILE 465 N -0.06 1.20 -0.01 -2.88 -0.00 -1.61 -0.68 117.51 113.46 2du3 h ILE 465 Ca 0.26 -0.76 0.00 0.00 -0.00 0.00 0.00 64.86 64.36 2du3 h ILE 465 Cb 0.47 0.89 -0.00 0.00 -0.00 0.00 0.00 36.82 38.17 2du3 h ILE 465 CO -0.60 0.27 0.01 0.44 -0.00 0.00 0.00 178.15 178.26 2du3 h ASP 466 N 0.54 0.01 -0.59 2.16 3.32 -1.46 0.50 116.42 120.90 2du3 h ASP 466 Ca 0.12 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 2du3 h ASP 466 Cb 0.31 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 2du3 h ASP 466 CO 0.01 0.02 0.19 1.23 -1.72 0.00 0.00 179.24 178.96 2du3 h GLY 467 N 0.00 0.99 0.79 2.75 0.00 -0.92 -2.59 103.07 104.09 2du3 h GLY 467 Ca 0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.73 2du3 h GLY 467 CO -0.00 0.54 0.01 -2.75 0.00 0.00 0.00 176.54 174.34 2du3 h PHE 468 N 0.84 0.27 -0.83 5.60 3.04 -0.93 -2.80 116.94 122.12 2du3 h PHE 468 Ca 0.19 -0.04 0.15 0.00 3.98 0.00 0.00 57.97 62.25 2du3 h PHE 468 Cb 0.28 -0.07 -0.10 0.00 2.56 0.00 0.00 35.95 38.63 2du3 h PHE 468 CO 0.02 0.46 0.41 0.00 -2.02 0.00 0.00 178.31 177.18 2du3 h ALA 469 N 0.77 1.25 -0.27 2.41 0.00 0.12 0.22 119.26 123.76 2du3 h ALA 469 Ca 0.04 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2du3 h ALA 469 Cb 0.35 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2du3 h ALA 469 CO 0.01 -0.13 -0.13 1.88 0.00 0.00 0.00 179.25 180.88 2du3 h TYR 470 N 0.58 0.49 0.29 0.00 0.05 -1.38 -1.53 116.97 115.47 2du3 h TYR 470 Ca 0.46 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 59.15 2du3 h TYR 470 Cb 0.67 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 38.28 2du3 h TYR 470 CO -0.11 0.57 -0.14 -0.92 -1.05 0.00 0.00 178.16 176.52 2du3 h TYR 471 N 0.42 -0.36 0.32 4.88 -0.00 -0.42 -2.88 116.97 118.93 2du3 h TYR 471 Ca 0.08 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.73 58.80 2du3 h TYR 471 Cb 0.48 0.12 -0.03 0.00 -0.00 0.00 0.00 36.73 37.30 2du3 h TYR 471 CO 0.01 -0.08 -0.52 0.00 -0.00 0.00 0.00 178.16 177.57 2du3 h ALA 472 N 0.02 -1.08 -0.92 1.82 0.00 -0.61 -1.31 119.26 117.17 2du3 h ALA 472 Ca -0.04 -0.15 0.21 0.00 0.00 0.00 0.00 54.91 54.93 2du3 h ALA 472 Cb 0.44 0.82 -0.12 0.00 0.00 0.00 0.00 17.79 18.93 2du3 h ALA 472 CO 0.07 -1.16 0.47 0.00 0.00 0.00 0.00 179.25 178.62 2du3 h ALA 473 N -0.74 1.51 -0.41 0.00 0.00 -1.36 0.58 119.26 118.84 2du3 h ALA 473 Ca -0.04 0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2du3 h ALA 473 Cb 0.82 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2du3 h ALA 473 CO -0.17 -0.26 -0.06 -0.09 0.00 0.00 0.00 179.25 178.67 2du3 h ARG 474 N 0.51 0.69 0.52 0.00 9.65 -1.24 -0.11 114.38 124.40 2du3 h ARG 474 Ca 0.57 -0.19 -0.03 0.00 -1.10 0.00 0.00 59.98 59.23 2du3 h ARG 474 Cb 1.02 -0.08 0.01 0.00 -1.39 0.00 0.00 29.97 29.53 2du3 h ARG 474 CO -0.48 0.74 -0.25 0.87 2.80 0.00 0.00 179.97 183.66 2du3 h LYS 475 N 0.64 -0.67 -0.81 0.20 1.79 0.13 0.16 116.57 118.01 2du3 h LYS 475 Ca 0.12 0.05 0.02 0.00 -2.18 0.00 0.00 60.65 58.65 2du3 h LYS 475 Cb 0.48 0.15 -0.04 0.00 -1.58 0.00 0.00 32.23 31.24 2du3 h LYS 475 CO 0.03 -0.40 0.53 -0.39 -1.08 0.00 0.00 179.45 178.14 2du3 h VAL 476 N -0.81 1.19 -0.74 0.50 -1.51 -1.14 0.92 116.25 114.65 2du3 h VAL 476 Ca -0.07 -0.37 0.01 0.00 -1.23 0.00 0.00 66.70 65.05 2du3 h VAL 476 Cb 0.58 0.02 -0.04 0.00 -2.13 0.00 0.00 31.29 29.73 2du3 h VAL 476 CO 0.12 0.20 0.49 -0.08 -1.23 0.00 0.00 177.57 177.06 2du3 h GLU 477 N 1.07 0.96 -0.10 5.19 4.81 -0.73 0.68 114.58 126.46 2du3 h GLU 477 Ca 0.30 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.44 2du3 h GLU 477 Cb -0.08 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.08 2du3 h GLU 477 CO -0.07 0.64 -0.09 0.93 -0.73 0.00 0.00 179.01 179.68 2du3 h GLU 478 N 0.99 0.23 -0.94 1.92 5.08 0.16 -3.17 114.58 118.85 2du3 h GLU 478 Ca 0.28 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.57 2du3 h GLU 478 Cb -0.08 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.11 2du3 h GLU 478 CO -0.06 0.64 0.60 0.00 -1.00 0.00 0.00 179.01 179.19 2du3 h ALA 479 N 0.58 1.27 0.00 3.43 0.00 -0.60 0.11 119.26 124.05 2du3 h ALA 479 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2du3 h ALA 479 Cb 0.60 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2du3 h ALA 479 CO 0.02 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.69 2du3 n ALA 480 N -2.36 1.57 -0.03 0.00 0.00 0.18 -1.18 120.51 118.70 2du3 n ALA 480 Ca 0.13 -0.01 -0.04 0.00 0.00 0.00 0.00 53.44 53.52 2du3 n ALA 480 Cb 0.14 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 2du3 n ALA 480 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2du3 n MET 481 N -0.95 0.90 0.00 0.00 2.00 0.32 -4.48 117.12 114.91 2du3 n MET 481 Ca 0.01 0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.74 2du3 n MET 481 Cb 0.01 -1.14 0.00 0.00 0.00 0.00 0.00 33.22 32.09 2du3 n MET 481 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2du3 n ARG 482 N -2.57 0.66 -2.54 0.03 1.74 -0.32 -4.77 116.66 108.89 2du3 n ARG 482 Ca -0.11 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.78 2du3 n ARG 482 Cb 0.64 -1.12 -0.00 0.00 -1.02 0.00 0.00 32.46 30.96 2du3 n ARG 482 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2du3 n GLU 483 N -0.27 -2.35 -1.87 5.56 4.07 -1.05 -4.96 120.64 119.77 2du3 n GLU 483 Ca 0.00 0.86 -0.29 0.00 -0.06 0.00 0.00 57.16 57.67 2du3 n GLU 483 Cb 0.06 -5.54 0.20 0.00 -0.06 0.00 0.00 31.44 26.10 2du3 n GLU 483 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 2du3 n GLN 484 N -3.13 -1.31 0.00 5.31 7.27 -0.77 -5.05 117.38 119.71 2du3 n GLN 484 Ca -0.19 -2.03 0.00 0.00 0.07 0.00 0.00 57.00 54.84 2du3 n GLN 484 Cb 0.65 -1.36 0.00 0.00 2.41 0.00 0.00 30.24 31.94 2du3 n GLN 484 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 2du3 n GLU 485 N -3.81 3.27 -3.85 3.69 -0.00 -1.26 -4.77 120.64 113.92 2du3 n GLU 485 Ca 0.16 0.00 -0.19 0.00 -0.00 0.00 0.00 57.16 57.14 2du3 n GLU 485 Cb 0.57 -0.59 -0.17 0.00 -0.00 0.00 0.00 31.44 31.26 2du3 n GLU 485 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.13 175.13 2du3 s GLU 486 N -0.68 0.32 -0.03 3.44 2.12 -1.26 0.06 118.70 122.68 2du3 s GLU 486 Ca 0.00 0.13 0.03 0.00 0.36 0.00 0.00 54.97 55.50 2du3 s GLU 486 Cb 0.00 -0.61 -0.00 0.00 0.26 0.00 0.00 34.13 33.78 2du3 s GLU 486 CO 0.00 -0.21 -0.13 0.08 -0.54 0.00 0.00 175.26 174.47 2du3 s VAL 487 N 1.44 1.06 -0.06 3.70 1.01 -0.41 -4.99 120.40 122.15 2du3 s VAL 487 Ca -0.04 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 2du3 s VAL 487 Cb -0.13 -0.92 0.04 0.00 0.00 0.00 0.00 36.38 35.37 2du3 s VAL 487 CO -0.03 0.31 0.12 -0.54 0.00 0.00 0.00 175.10 174.97 2du3 s LYS 488 N 0.01 0.03 -0.03 2.72 1.02 -1.26 0.23 119.74 122.47 2du3 s LYS 488 Ca -0.01 0.41 0.02 0.00 0.02 0.00 0.00 55.97 56.40 2du3 s LYS 488 Cb -0.09 -0.26 0.01 0.00 -0.52 0.00 0.00 37.83 36.97 2du3 s LYS 488 CO 0.01 -0.23 -0.06 0.54 -0.92 0.00 0.00 175.35 174.68 2du3 s VAL 489 N 1.63 0.60 0.11 3.17 0.11 -0.59 -5.02 120.40 120.42 2du3 s VAL 489 Ca -0.04 -0.24 0.04 0.00 -2.93 0.00 0.00 61.98 58.81 2du3 s VAL 489 Cb -0.12 -0.56 -0.04 0.00 -1.53 0.00 0.00 36.38 34.13 2du3 s VAL 489 CO -0.05 0.21 -0.10 -1.59 -3.33 0.00 0.00 175.10 170.24 2du3 s LYS 490 N 0.36 0.92 -0.08 1.54 -2.85 -1.26 -1.66 119.74 116.71 2du3 s LYS 490 Ca -0.05 -1.29 0.03 0.00 -1.00 0.00 0.00 55.97 53.67 2du3 s LYS 490 Cb -0.09 -0.53 0.01 0.00 -2.06 0.00 0.00 37.83 35.16 2du3 s LYS 490 CO 0.00 0.07 -0.18 0.00 0.10 0.00 0.00 175.35 175.33 2du3 s ALA 491 N -2.91 1.73 0.00 0.59 0.00 -0.34 -5.00 121.76 115.84 2du3 s ALA 491 Ca 0.10 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.35 2du3 s ALA 491 Cb 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.44 2du3 s ALA 491 CO -0.00 0.22 0.00 0.54 0.00 0.00 0.00 175.76 176.51 2du3 n ARG 492 N 3.61 0.00 -3.75 0.00 1.74 -1.26 -1.56 116.66 115.44 2du3 n ARG 492 Ca -0.21 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.50 2du3 n ARG 492 Cb 0.52 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.90 2du3 n ARG 492 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2du3 s ILE 493 N 0.79 5.34 -0.25 0.55 -5.25 -1.26 -0.90 121.20 120.22 2du3 s ILE 493 Ca 0.00 0.41 -0.10 0.00 -0.99 0.00 0.00 60.65 59.97 2du3 s ILE 493 Cb 0.00 -3.51 -0.05 0.00 2.95 0.00 0.00 42.46 41.85 2du3 s ILE 493 CO 0.00 0.59 0.14 -0.69 -1.79 0.00 0.00 174.94 173.19 2du3 s VAL 494 N -1.06 5.09 -0.19 8.37 1.01 0.13 -4.89 120.40 128.85 2du3 s VAL 494 Ca 0.19 0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.30 2du3 s VAL 494 Cb -0.14 -3.38 -0.15 0.00 0.00 0.00 0.00 36.38 32.72 2du3 s VAL 494 CO 0.08 0.33 -0.13 -0.62 0.00 0.00 0.00 175.10 174.76 2du3 n GLU 495 N 4.53 0.72 -3.97 2.72 -0.58 -1.26 -2.18 120.64 120.62 2du3 n GLU 495 Ca -0.15 0.09 -0.13 0.00 -0.42 0.00 0.00 57.16 56.55 2du3 n GLU 495 Cb 0.52 -1.41 -0.01 0.00 -0.57 0.00 0.00 31.44 29.97 2du3 n GLU 495 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2du3 s ASN 496 N -5.73 0.64 0.40 1.62 6.03 -1.13 -4.49 114.94 112.28 2du3 s ASN 496 Ca -0.23 -1.41 0.13 0.00 -1.03 0.00 0.00 52.86 50.33 2du3 s ASN 496 Cb 0.06 0.76 0.97 0.00 -3.03 0.00 0.00 41.25 40.02 2du3 s ASN 496 CO 0.51 -1.50 1.91 -0.07 -2.03 0.00 0.00 177.10 175.92 2du3 h LEU 497 N 2.04 0.47 -0.74 3.54 3.38 -1.84 -1.01 115.31 121.16 2du3 h LEU 497 Ca -0.30 0.03 0.08 0.00 0.09 0.00 0.00 57.88 57.77 2du3 h LEU 497 Cb 1.24 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.86 2du3 h LEU 497 CO 0.40 0.25 0.40 -1.28 0.09 0.00 0.00 178.44 178.30 2du3 h SER 498 N 0.51 0.58 0.00 -0.43 0.87 -1.95 0.38 113.55 113.51 2du3 h SER 498 Ca 0.38 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.99 2du3 h SER 498 Cb 0.77 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.66 2du3 h SER 498 CO -0.14 0.35 0.00 0.47 -0.53 0.00 0.00 176.83 176.98 2du3 n ASP 499 N -4.79 0.00 0.00 6.23 8.00 -0.38 -1.74 116.55 123.88 2du3 n ASP 499 Ca 0.11 -0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.12 2du3 n ASP 499 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 2du3 n ASP 499 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2du3 n ILE 500 N -0.96 0.58 -2.02 0.53 0.13 0.01 -4.95 119.36 112.69 2du3 n ILE 500 Ca 0.10 -0.72 -0.10 0.00 -1.10 0.00 0.00 62.75 60.93 2du3 n ILE 500 Cb 0.05 0.76 -0.01 0.00 -0.84 0.00 0.00 39.64 39.59 2du3 n ILE 500 CO 0.00 0.00 0.00 -3.20 2.80 0.00 0.00 176.55 176.15 2du3 n ASN 501 N -0.29 -3.60 -4.51 9.51 5.15 -0.71 -3.67 115.26 117.14 2du3 n ASN 501 Ca 0.00 0.04 -0.29 0.00 -0.60 0.00 0.00 54.58 53.74 2du3 n ASN 501 Cb 0.20 -2.69 -0.11 0.00 -0.53 0.00 0.00 39.78 36.66 2du3 n ASN 501 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2du3 s LEU 502 N -2.85 2.76 0.24 1.20 1.02 -0.50 0.08 118.68 120.63 2du3 s LEU 502 Ca 0.00 -0.57 -0.15 0.00 0.02 0.00 0.00 54.13 53.43 2du3 s LEU 502 Cb 0.00 -1.57 0.01 0.00 0.02 0.00 0.00 46.19 44.65 2du3 s LEU 502 CO 0.00 0.16 0.53 -0.72 0.02 0.00 0.00 176.35 176.34 2du3 s TYR 503 N -1.28 0.14 0.01 0.29 1.13 -0.24 -3.31 117.35 114.08 2du3 s TYR 503 Ca 0.20 -0.51 0.01 0.00 -1.41 0.00 0.00 57.07 55.35 2du3 s TYR 503 Cb -0.10 0.33 -0.01 0.00 -1.10 0.00 0.00 41.96 41.08 2du3 s TYR 503 CO 0.11 -1.01 -0.03 0.96 -2.51 0.00 0.00 175.55 173.07 2du3 s ILE 504 N -3.96 0.22 0.59 -3.49 -4.36 -1.26 -1.26 121.20 107.68 2du3 s ILE 504 Ca 0.17 -0.44 -0.20 0.00 -0.26 0.00 0.00 60.65 59.92 2du3 s ILE 504 Cb -0.02 -0.25 -0.04 0.00 1.25 0.00 0.00 42.46 43.40 2du3 s ILE 504 CO 0.05 -0.14 1.24 1.57 0.24 0.00 0.00 174.94 177.90 2du3 n HIS 505 N 2.46 1.80 -0.15 1.37 -0.00 -1.26 -4.76 115.22 114.68 2du3 n HIS 505 Ca -0.17 0.43 0.20 0.00 -0.00 0.00 0.00 57.72 58.18 2du3 n HIS 505 Cb 0.58 -2.27 0.59 0.00 -0.00 0.00 0.00 29.99 28.88 2du3 n HIS 505 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.34 177.39 2du3 h GLU 506 N 0.88 0.24 -0.54 1.57 4.11 -2.00 -1.38 114.58 117.46 2du3 h GLU 506 Ca -0.50 -0.01 -0.10 0.00 0.07 0.00 0.00 59.36 58.82 2du3 h GLU 506 Cb 1.33 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.51 2du3 h GLU 506 CO 0.54 0.16 -0.04 -0.91 0.07 0.00 0.00 179.01 178.82 2du3 h ASN 507 N 0.24 0.97 -0.59 3.06 2.35 -2.00 -2.26 115.58 117.36 2du3 h ASN 507 Ca 0.38 -0.33 -0.09 0.00 -0.55 0.00 0.00 56.30 55.71 2du3 h ASN 507 Cb 1.12 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 39.20 2du3 h ASN 507 CO -0.09 1.07 0.01 -0.37 -1.65 0.00 0.00 177.43 176.40 2du3 h VAL 508 N 0.86 1.26 -0.08 2.81 -1.51 -1.61 0.16 116.25 118.13 2du3 h VAL 508 Ca 0.15 -1.12 0.02 0.00 -1.23 0.00 0.00 66.70 64.52 2du3 h VAL 508 Cb 0.60 0.78 -0.02 0.00 -2.13 0.00 0.00 31.29 30.51 2du3 h VAL 508 CO 0.04 0.41 -0.06 -0.09 -1.23 0.00 0.00 177.57 176.63 2du3 h ARG 509 N 0.96 -0.07 -0.39 5.19 2.43 -1.33 -1.34 114.38 119.82 2du3 h ARG 509 Ca 0.17 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.37 2du3 h ARG 509 Cb 0.53 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 2du3 h ARG 509 CO 0.03 -0.05 0.21 0.00 -1.51 0.00 0.00 179.97 178.65 2du3 h ARG 510 N -0.07 0.42 -0.48 0.20 3.08 -1.00 -1.41 114.38 115.12 2du3 h ARG 510 Ca 0.05 -0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.18 2du3 h ARG 510 Cb 0.15 -0.09 -0.10 0.00 0.08 0.00 0.00 29.97 30.01 2du3 h ARG 510 CO -0.13 0.28 -0.21 -0.92 -1.07 0.00 0.00 179.97 177.92 2du3 h TYR 511 N 0.43 -0.54 -0.75 3.04 3.20 -0.56 0.49 116.97 122.29 2du3 h TYR 511 Ca 0.16 0.05 0.03 0.00 3.14 0.00 0.00 58.73 62.12 2du3 h TYR 511 Cb 0.04 0.31 -0.05 0.00 1.54 0.00 0.00 36.73 38.58 2du3 h TYR 511 CO -0.09 -0.30 0.47 0.82 -1.64 0.00 0.00 178.16 177.43 2du3 h ILE 512 N -0.11 1.10 0.16 1.81 2.04 -0.77 0.68 117.51 122.42 2du3 h ILE 512 Ca 0.22 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 2du3 h ILE 512 Cb 0.46 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2du3 h ILE 512 CO -0.55 0.17 -0.08 -0.07 0.00 0.00 0.00 178.15 177.62 2du3 h LEU 513 N 0.91 -0.19 -1.52 1.44 4.07 -0.07 0.77 115.31 120.73 2du3 h LEU 513 Ca 0.30 -0.12 0.16 0.00 0.08 0.00 0.00 57.88 58.30 2du3 h LEU 513 Cb 0.03 0.05 -0.06 0.00 1.08 0.00 0.00 40.66 41.76 2du3 h LEU 513 CO -0.12 0.01 0.54 -0.25 -1.08 0.00 0.00 178.44 177.54 2du3 h TRP 514 N -0.37 0.55 -0.30 1.13 2.91 0.33 0.21 115.95 120.40 2du3 h TRP 514 Ca -0.02 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.01 2du3 h TRP 514 Cb 0.29 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 28.77 2du3 h TRP 514 CO -0.02 0.19 0.00 1.63 -1.03 0.00 0.00 178.44 179.21 2du3 n LYS 515 N -4.50 1.71 -3.59 2.65 4.76 0.19 -4.90 118.16 114.49 2du3 n LYS 515 Ca 0.16 -1.11 -0.26 0.00 -2.87 0.00 0.00 58.31 54.24 2du3 n LYS 515 Cb 0.56 -1.25 0.05 0.00 -1.84 0.00 0.00 35.03 32.55 2du3 n LYS 515 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2du3 n LYS 516 N 0.39 -6.64 -2.97 1.97 5.02 0.74 -4.98 118.16 111.69 2du3 n LYS 516 Ca 0.11 0.76 -0.18 0.00 -2.02 0.00 0.00 58.31 56.98 2du3 n LYS 516 Cb 0.27 -5.73 0.02 0.00 -0.02 0.00 0.00 35.03 29.57 2du3 n LYS 516 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2du3 s GLY 517 N -3.19 1.91 0.23 0.72 0.00 0.23 -5.03 107.32 102.17 2du3 s GLY 517 Ca 0.56 -1.70 0.03 0.00 0.00 0.00 0.00 44.72 43.62 2du3 s GLY 517 CO 0.69 -1.46 -0.01 -1.59 0.00 0.00 0.00 173.10 170.73 2du3 s LYS 518 N -4.44 1.32 -0.27 2.90 -2.85 -1.26 -4.59 119.74 110.54 2du3 s LYS 518 Ca 0.56 -1.66 0.01 0.00 -1.00 0.00 0.00 55.97 53.88 2du3 s LYS 518 Cb -0.09 -0.60 0.07 0.00 -2.06 0.00 0.00 37.83 35.15 2du3 s LYS 518 CO 0.34 -0.09 -0.01 0.42 0.10 0.00 0.00 175.35 176.11 2du3 s ILE 519 N -3.43 1.54 -0.66 3.79 1.01 -1.26 -1.81 121.20 120.37 2du3 s ILE 519 Ca 0.28 -1.44 0.00 0.00 0.00 0.00 0.00 60.65 59.49 2du3 s ILE 519 Cb 0.06 -1.92 0.16 0.00 0.01 0.00 0.00 42.46 40.77 2du3 s ILE 519 CO 0.08 -0.29 0.46 -0.62 0.00 0.00 0.00 174.94 174.58 2du3 s ASP 520 N 1.35 5.05 -0.51 3.58 2.15 -0.12 -4.99 116.67 123.17 2du3 s ASP 520 Ca -0.00 -3.22 0.03 0.00 0.43 0.00 0.00 52.55 49.80 2du3 s ASP 520 Cb -0.19 -1.77 0.14 0.00 -0.30 0.00 0.00 42.92 40.80 2du3 s ASP 520 CO -0.10 -0.25 0.29 -0.69 -0.17 0.00 0.00 175.17 174.25 2du3 s VAL 521 N -0.58 2.13 0.35 1.11 1.01 -1.26 -0.66 120.40 122.49 2du3 s VAL 521 Ca 0.20 -3.16 0.03 0.00 0.00 0.00 0.00 61.98 59.05 2du3 s VAL 521 Cb -0.17 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 2du3 s VAL 521 CO -0.06 -0.88 0.11 -0.13 0.00 0.00 0.00 175.10 174.14 2du3 s ARG 522 N -0.22 1.73 0.00 2.72 0.52 -1.26 -2.83 118.95 119.61 2du3 s ARG 522 Ca 0.19 -2.00 0.00 0.00 -0.52 0.00 0.00 55.73 53.39 2du3 s ARG 522 Cb -0.21 -0.57 0.00 0.00 0.52 0.00 0.00 34.95 34.69 2du3 s ARG 522 CO -0.03 -0.36 0.00 0.41 0.02 0.00 0.00 175.30 175.34 2du3 n GLY 523 N -0.74 4.11 3.51 -3.53 0.00 -0.92 -4.91 105.19 102.71 2du3 n GLY 523 Ca -0.03 -1.61 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 2du3 n GLY 523 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2du3 s PRO 524 N -3.07 3.16 -0.10 1.61 0.04 -1.26 0.21 135.00 135.58 2du3 s PRO 524 Ca 0.00 -0.54 -0.12 0.00 0.04 0.00 0.00 61.00 60.38 2du3 s PRO 524 Cb 0.00 -4.23 -0.10 0.00 0.04 0.00 0.00 34.50 30.21 2du3 s PRO 524 CO 0.00 -2.00 0.38 1.25 0.04 0.00 0.00 177.00 176.67 2du3 h LEU 525 N 12.25 -0.05 -3.57 -3.56 6.46 -1.40 -2.56 115.31 122.88 2du3 h LEU 525 Ca -0.27 -0.34 -0.44 0.00 -0.12 0.00 0.00 57.88 56.71 2du3 h LEU 525 Cb 1.06 0.01 0.01 0.00 -0.73 0.00 0.00 40.66 41.01 2du3 h LEU 525 CO 1.24 0.60 -1.08 0.49 -0.62 0.00 0.00 178.44 179.07 2du3 n PHE 526 N -4.77 -2.08 -4.33 1.25 3.01 -0.08 -0.83 117.46 109.63 2du3 n PHE 526 Ca -0.04 0.86 -0.18 0.00 1.01 0.00 0.00 57.45 59.10 2du3 n PHE 526 Cb 0.19 -2.27 -0.15 0.00 -0.01 0.00 0.00 39.48 37.24 2du3 n PHE 526 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2du3 s VAL 527 N -2.44 0.66 0.04 -4.37 0.11 -0.60 -2.23 120.40 111.57 2du3 s VAL 527 Ca 0.11 -0.34 0.06 0.00 -2.93 0.00 0.00 61.98 58.88 2du3 s VAL 527 Cb -0.01 -0.56 -0.02 0.00 -1.53 0.00 0.00 36.38 34.25 2du3 s VAL 527 CO 0.84 0.19 -0.17 -0.89 -3.33 0.00 0.00 175.10 171.74 2du3 s THR 528 N -0.10 1.36 -0.05 5.04 2.01 -1.17 -1.20 115.64 121.53 2du3 s THR 528 Ca 0.02 -1.10 0.00 0.00 0.31 0.00 0.00 61.69 60.92 2du3 s THR 528 Cb -0.04 -1.20 0.02 0.00 0.01 0.00 0.00 72.50 71.29 2du3 s THR 528 CO -0.00 0.08 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.29 2du3 s VAL 529 N -0.84 0.45 -0.00 3.82 1.01 -0.66 -0.81 120.40 123.36 2du3 s VAL 529 Ca 0.04 -0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.06 2du3 s VAL 529 Cb -0.08 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 2du3 s VAL 529 CO 0.02 0.22 -0.26 -0.54 0.00 0.00 0.00 175.10 174.54 2du3 s LYS 530 N 1.13 1.99 0.05 2.72 1.02 0.21 -1.54 119.74 125.32 2du3 s LYS 530 Ca -0.08 -0.97 0.04 0.00 0.02 0.00 0.00 55.97 54.98 2du3 s LYS 530 Cb -0.14 -2.00 -0.02 0.00 -0.52 0.00 0.00 37.83 35.15 2du3 s LYS 530 CO -0.01 0.54 -0.12 0.00 -0.92 0.00 0.00 175.35 174.84 2du3 s ALA 531 N -0.66 0.94 -0.25 5.17 0.00 0.14 0.21 121.76 127.30 2du3 s ALA 531 Ca 0.10 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.25 2du3 s ALA 531 Cb -0.10 -0.08 0.07 0.00 0.00 0.00 0.00 23.12 23.00 2du3 s ALA 531 CO -0.00 0.12 -0.03 -1.21 0.00 0.00 0.00 175.76 174.64 2du3 s GLU 532 N -1.38 1.48 -0.20 0.00 0.41 -0.03 -1.29 118.70 117.70 2du3 s GLU 532 Ca -0.03 -1.02 -0.03 0.00 -0.41 0.00 0.00 54.97 53.47 2du3 s GLU 532 Cb -0.09 -2.56 -0.01 0.00 -1.78 0.00 0.00 34.13 29.70 2du3 s GLU 532 CO 0.01 -0.66 -0.06 0.96 -0.49 0.00 0.00 175.26 175.03 2du3 s ILE 533 N 1.41 3.38 -2.98 -1.63 -4.36 0.11 -2.15 121.20 114.97 2du3 s ILE 533 Ca -0.03 -0.50 0.24 0.00 -0.26 0.00 0.00 60.65 60.09 2du3 s ILE 533 Cb -0.19 -2.51 0.19 0.00 1.25 0.00 0.00 42.46 41.20 2du3 s ILE 533 CO -0.08 0.45 1.26 -0.62 0.24 0.00 0.00 174.94 176.18