#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wvu s ILE 36 N 0.00 4.83 0.20 3.84 1.01 -1.26 -5.02 121.20 124.80 2wvu s ILE 36 Ca 0.00 2.04 -0.32 0.00 0.00 0.00 0.00 60.65 62.38 2wvu s ILE 36 Cb 0.00 -4.31 -0.11 0.00 0.01 0.00 0.00 42.46 38.05 2wvu s ILE 36 CO 0.00 0.12 1.64 -2.84 0.00 0.00 0.00 174.94 173.85 2wvu s PRO 37 N 1.29 4.17 -0.13 2.79 0.02 -1.26 -4.84 135.00 137.05 2wvu s PRO 37 Ca 0.51 2.49 -0.11 0.00 0.02 0.00 0.00 61.00 63.91 2wvu s PRO 37 Cb -0.20 -3.10 0.03 0.00 0.02 0.00 0.00 34.50 31.25 2wvu s PRO 37 CO 0.25 -0.67 0.33 -0.51 -0.33 0.00 0.00 177.00 176.07 2wvu s LEU 38 N 0.96 0.69 -0.15 -5.54 1.43 -1.26 -5.03 118.68 109.79 2wvu s LEU 38 Ca 0.71 0.67 0.14 0.00 -1.03 0.00 0.00 54.13 54.62 2wvu s LEU 38 Cb -0.47 1.13 -0.24 0.00 0.03 0.00 0.00 46.19 46.65 2wvu s LEU 38 CO 0.33 -0.12 0.25 1.17 0.23 0.00 0.00 176.35 178.21 2wvu n LYS 39 N 2.99 0.67 -1.10 1.70 4.81 -1.26 -4.63 118.16 121.34 2wvu n LYS 39 Ca -0.14 0.12 -0.07 0.00 -0.87 0.00 0.00 58.31 57.35 2wvu n LYS 39 Cb 0.57 -1.62 0.15 0.00 0.02 0.00 0.00 35.03 34.15 2wvu n LYS 39 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2wvu n TYR 40 N -2.92 1.17 -2.01 5.64 4.01 -1.26 -5.01 117.16 116.77 2wvu n TYR 40 Ca -0.29 -1.80 0.00 0.00 -0.16 0.00 0.00 57.90 55.65 2wvu n TYR 40 Cb 1.11 -0.37 0.00 0.00 -0.31 0.00 0.00 39.34 39.76 2wvu n TYR 40 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wvu n GLY 41 N -0.99 1.02 3.56 2.72 0.00 -1.26 -4.00 105.19 106.24 2wvu n GLY 41 Ca 0.31 -1.96 -0.45 0.00 0.00 0.00 0.00 46.02 43.92 2wvu n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wvu n ALA 42 N -3.00 -0.67 -0.26 4.61 0.00 -1.26 -4.98 120.51 114.94 2wvu n ALA 42 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2wvu n ALA 42 Cb 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 17.50 2wvu n ALA 42 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2wvu n THR 43 N 0.19 0.00 -1.80 0.00 -1.04 -1.26 -4.97 114.28 105.39 2wvu n THR 43 Ca 0.11 0.37 -0.41 0.00 -2.04 0.00 0.00 64.05 62.08 2wvu n THR 43 Cb 0.31 -1.27 0.00 0.00 -1.82 0.00 0.00 70.33 67.56 2wvu n THR 43 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2wvu s ASN 44 N -2.92 6.23 0.00 8.00 0.01 -1.26 -4.98 114.94 120.01 2wvu s ASN 44 Ca 0.00 3.02 0.00 0.00 -0.71 0.00 0.00 52.86 55.17 2wvu s ASN 44 Cb 0.00 -2.66 0.00 0.00 0.41 0.00 0.00 41.25 39.00 2wvu s ASN 44 CO 0.00 -0.95 0.00 -0.62 -1.51 0.00 0.00 177.10 174.02 2wvu n GLU 45 N 0.29 0.00 -0.08 -0.60 1.02 -1.26 -4.95 120.64 115.07 2wvu n GLU 45 Ca 0.02 0.30 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 2wvu n GLU 45 Cb 0.40 -0.77 0.00 0.00 -0.02 0.00 0.00 31.44 31.05 2wvu n GLU 45 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wvu n GLY 46 N 2.01 -0.04 3.77 0.62 0.00 -1.26 -5.03 105.19 105.25 2wvu n GLY 46 Ca 0.00 -1.76 -0.40 0.00 0.00 0.00 0.00 46.02 43.85 2wvu n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvu s LYS 47 N -0.05 4.47 0.30 1.61 1.02 -1.26 -5.01 119.74 120.82 2wvu s LYS 47 Ca 0.00 2.05 -0.29 0.00 0.02 0.00 0.00 55.97 57.75 2wvu s LYS 47 Cb 0.00 -3.12 -0.11 0.00 -0.52 0.00 0.00 37.83 34.09 2wvu s LYS 47 CO 0.00 -0.03 1.51 1.03 -0.92 0.00 0.00 175.35 176.94 2wvu s ARG 48 N -1.66 4.17 -0.07 1.68 0.52 -1.26 -4.93 118.95 117.41 2wvu s ARG 48 Ca 0.47 2.48 0.10 0.00 -0.52 0.00 0.00 55.73 58.26 2wvu s ARG 48 Cb -0.37 -3.04 0.15 0.00 0.52 0.00 0.00 34.95 32.22 2wvu s ARG 48 CO 0.48 -0.52 1.05 1.04 0.02 0.00 0.00 175.30 177.37 2wvu n GLN 49 N 1.71 1.77 -1.31 3.54 1.13 -1.26 -4.62 117.38 118.33 2wvu n GLN 49 Ca 0.05 -1.97 -0.33 0.00 -1.94 0.00 0.00 57.00 52.82 2wvu n GLN 49 Cb 0.39 -1.20 0.10 0.00 0.11 0.00 0.00 30.24 29.64 2wvu n GLN 49 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2wvu s ASP 50 N -1.92 4.18 0.40 1.08 -4.77 -1.26 -4.76 116.67 109.61 2wvu s ASP 50 Ca 0.16 2.13 0.08 0.00 -3.30 0.00 0.00 52.55 51.63 2wvu s ASP 50 Cb 0.14 -2.56 0.85 0.00 -1.09 0.00 0.00 42.92 40.26 2wvu s ASP 50 CO 0.02 -2.26 2.01 -0.65 0.70 0.00 0.00 175.17 174.99 2wvu h PRO 51 N -0.74 0.58 -0.84 2.11 0.11 -1.99 -1.84 132.00 129.40 2wvu h PRO 51 Ca -0.46 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 2wvu h PRO 51 Cb 1.27 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 2wvu h PRO 51 CO 0.49 0.38 0.43 0.00 -0.21 0.00 0.00 178.00 179.10 2wvu h ALA 52 N 1.69 1.19 -0.13 -0.75 0.00 -1.91 0.17 119.26 119.51 2wvu h ALA 52 Ca 0.22 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 2wvu h ALA 52 Cb 0.15 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.61 2wvu h ALA 52 CO -0.06 0.64 -0.49 1.98 0.00 0.00 0.00 179.25 181.32 2wvu h MET 53 N 1.18 0.56 -0.70 0.00 -1.53 -1.67 -1.52 114.93 111.25 2wvu h MET 53 Ca 0.29 -0.43 0.09 0.00 -3.44 0.00 0.00 59.70 56.21 2wvu h MET 53 Cb 0.07 0.08 -0.04 0.00 -0.55 0.00 0.00 31.60 31.15 2wvu h MET 53 CO -0.04 1.05 0.46 1.96 0.14 0.00 0.00 176.91 180.48 2wvu h GLN 54 N 0.19 0.60 -0.23 0.39 4.20 -1.12 0.15 115.11 119.29 2wvu h GLN 54 Ca -0.02 -0.04 -0.11 0.00 0.06 0.00 0.00 58.65 58.54 2wvu h GLN 54 Cb 1.12 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.76 2wvu h GLN 54 CO 0.10 0.40 -0.28 -0.22 -0.67 0.00 0.00 178.83 178.16 2wvu h LYS 55 N 0.62 0.59 -0.50 1.46 1.63 -0.83 0.24 116.57 119.78 2wvu h LYS 55 Ca 0.31 -0.33 0.09 0.00 -0.85 0.00 0.00 60.65 59.88 2wvu h LYS 55 Cb 0.42 0.02 -0.08 0.00 -0.60 0.00 0.00 32.23 31.99 2wvu h LYS 55 CO -0.11 0.93 0.04 0.35 -3.45 0.00 0.00 179.45 177.22 2wvu h PHE 56 N 0.29 0.04 0.20 1.91 3.57 -0.16 -1.43 116.94 121.36 2wvu h PHE 56 Ca 0.03 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 2wvu h PHE 56 Cb 0.85 0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.65 2wvu h PHE 56 CO 0.08 -0.08 -0.10 -0.09 -2.23 0.00 0.00 178.31 175.90 2wvu h ARG 57 N 0.16 -0.26 0.00 1.11 2.43 -0.68 -3.31 114.38 113.83 2wvu h ARG 57 Ca 0.25 0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.41 2wvu h ARG 57 Cb 0.37 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 2wvu h ARG 57 CO -0.39 0.10 -0.13 -0.44 -1.51 0.00 0.00 179.97 177.60 2wvu h ASP 58 N -0.68 0.00 -0.67 -3.80 3.32 -0.22 -1.73 116.42 112.64 2wvu h ASP 58 Ca -0.03 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.17 2wvu h ASP 58 Cb 0.48 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.92 2wvu h ASP 58 CO 0.05 0.13 0.02 0.78 -1.72 0.00 0.00 179.24 178.50 2wvu h ASN 59 N 0.00 -0.27 0.00 6.45 2.35 -1.35 0.10 115.58 122.87 2wvu h ASN 59 Ca -0.00 0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2wvu h ASN 59 Cb 0.25 0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.91 2wvu h ASN 59 CO 0.02 -0.12 0.00 0.54 -1.65 0.00 0.00 177.43 176.21 2wvu n ARG 60 N -5.29 0.00 -3.93 0.81 5.12 -0.65 -4.61 116.66 108.11 2wvu n ARG 60 Ca 0.11 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.67 2wvu n ARG 60 Cb 0.40 0.00 -0.12 0.00 -1.16 0.00 0.00 32.46 31.58 2wvu n ARG 60 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2wvu s LEU 61 N 0.00 3.44 0.33 0.55 2.96 -1.26 -1.09 118.68 123.61 2wvu s LEU 61 Ca 0.00 -0.15 0.04 0.00 -0.22 0.00 0.00 54.13 53.80 2wvu s LEU 61 Cb 0.00 -1.89 -0.06 0.00 0.50 0.00 0.00 46.19 44.74 2wvu s LEU 61 CO 0.00 0.04 0.07 -0.83 -1.32 0.00 0.00 176.35 174.31 2wvu s GLY 62 N 1.14 2.14 0.16 7.98 0.00 -0.64 -0.22 107.32 117.88 2wvu s GLY 62 Ca 0.04 -1.94 0.08 0.00 0.00 0.00 0.00 44.72 42.89 2wvu s GLY 62 CO 0.03 -1.82 -0.09 0.00 0.00 0.00 0.00 173.10 171.22 2wvu s ALA 63 N -3.29 2.96 -0.06 3.20 0.00 -0.49 -1.37 121.76 122.70 2wvu s ALA 63 Ca 0.35 -1.40 0.02 0.00 0.00 0.00 0.00 51.96 50.92 2wvu s ALA 63 Cb 0.08 -0.80 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 2wvu s ALA 63 CO 0.15 0.51 -0.10 0.12 0.00 0.00 0.00 175.76 176.45 2wvu s PHE 64 N -1.57 2.85 -0.22 0.00 5.99 0.51 -0.79 117.98 124.75 2wvu s PHE 64 Ca 0.24 -0.07 -0.03 0.00 0.00 0.00 0.00 56.93 57.07 2wvu s PHE 64 Cb -0.09 -1.69 0.00 0.00 0.00 0.00 0.00 43.02 41.24 2wvu s PHE 64 CO 0.15 0.26 -0.06 0.42 -0.00 0.00 0.00 175.22 175.99 2wvu s ILE 65 N -0.73 3.17 -0.40 3.12 -1.09 0.62 -0.03 121.20 125.85 2wvu s ILE 65 Ca 0.11 -0.63 -0.08 0.00 -2.23 0.00 0.00 60.65 57.83 2wvu s ILE 65 Cb -0.11 -2.46 0.08 0.00 -1.58 0.00 0.00 42.46 38.39 2wvu s ILE 65 CO 0.01 0.39 0.23 -1.00 -1.23 0.00 0.00 174.94 173.34 2wvu s HIS 66 N 1.44 3.36 -0.03 3.97 3.76 -0.73 -1.81 115.29 125.25 2wvu s HIS 66 Ca 0.05 -1.64 0.00 0.00 -0.15 0.00 0.00 55.06 53.32 2wvu s HIS 66 Cb -0.14 -2.89 0.03 0.00 1.11 0.00 0.00 32.58 30.68 2wvu s HIS 66 CO -0.04 -0.85 0.01 -0.46 -0.85 0.00 0.00 174.74 172.54 2wvu s TRP 67 N 1.38 0.26 0.02 1.40 -0.00 -1.26 -3.74 118.94 117.00 2wvu s TRP 67 Ca 0.03 0.03 -0.09 0.00 -0.00 0.00 0.00 56.10 56.06 2wvu s TRP 67 Cb -0.23 -0.39 0.03 0.00 -0.00 0.00 0.00 33.47 32.89 2wvu s TRP 67 CO 0.01 -0.13 0.44 0.41 -0.00 0.00 0.00 176.95 177.68 2wvu n GLY 68 N 4.19 0.71 0.23 5.86 0.00 -1.26 -4.86 105.19 110.06 2wvu n GLY 68 Ca -0.26 -0.95 0.04 0.00 0.00 0.00 0.00 46.02 44.85 2wvu n GLY 68 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wvu h LEU 69 N 0.00 0.08 -1.85 0.99 3.38 -1.98 -2.16 115.31 113.78 2wvu h LEU 69 Ca -0.09 -0.02 0.19 0.00 0.09 0.00 0.00 57.88 58.06 2wvu h LEU 69 Cb 0.44 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 2wvu h LEU 69 CO 0.12 0.27 0.63 0.10 0.09 0.00 0.00 178.44 179.66 2wvu h TYR 70 N 0.08 0.00 0.00 1.13 -0.00 -1.92 0.35 116.97 116.61 2wvu h TYR 70 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.75 2wvu h TYR 70 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.10 2wvu h TYR 70 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.16 2wvu h ALA 71 N 1.35 1.00 0.32 0.10 0.00 -1.63 -1.48 119.26 118.91 2wvu h ALA 71 Ca 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 2wvu h ALA 71 Cb 1.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2wvu h ALA 71 CO -0.00 0.00 -0.15 0.82 0.00 0.00 0.00 179.25 179.91 2wvu h ILE 72 N 0.00 0.00 -0.21 0.00 2.04 -1.13 -3.34 117.51 114.87 2wvu h ILE 72 Ca 0.00 -0.47 -0.07 0.00 1.00 0.00 0.00 64.86 65.32 2wvu h ILE 72 Cb 0.35 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 2wvu h ILE 72 CO 0.00 0.00 -0.18 1.55 0.00 0.00 0.00 178.15 179.52 2wvu h PRO 73 N -0.90 0.37 -4.31 2.37 0.13 -1.70 -3.48 132.00 124.48 2wvu h PRO 73 Ca -0.04 -0.11 -0.27 0.00 -0.87 0.00 0.00 66.00 64.71 2wvu h PRO 73 Cb 0.33 -0.04 0.10 0.00 0.13 0.00 0.00 31.00 31.52 2wvu h PRO 73 CO 0.07 0.54 -0.47 0.41 -0.23 0.00 0.00 178.00 178.33 2wvu n GLY 74 N -0.63 -0.07 1.64 1.56 0.00 -0.56 -2.88 105.19 104.25 2wvu n GLY 74 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2wvu n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvu n GLY 75 N -1.50 1.42 3.49 -0.02 0.00 -1.26 -1.66 105.19 105.65 2wvu n GLY 75 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2wvu n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wvu s GLU 76 N -0.45 2.95 -0.11 1.61 2.12 -1.14 -0.35 118.70 123.33 2wvu s GLU 76 Ca 0.00 -0.62 -0.05 0.00 0.36 0.00 0.00 54.97 54.66 2wvu s GLU 76 Cb 0.00 -2.58 0.05 0.00 0.26 0.00 0.00 34.13 31.86 2wvu s GLU 76 CO 0.00 0.49 0.24 -0.46 -0.54 0.00 0.00 175.26 174.99 2wvu s TRP 77 N -0.36 -0.33 -1.34 5.30 -0.11 -0.55 -4.70 118.94 116.85 2wvu s TRP 77 Ca 0.04 0.79 -0.14 0.00 1.22 0.00 0.00 56.10 58.02 2wvu s TRP 77 Cb -0.12 0.01 0.01 0.00 -1.50 0.00 0.00 33.47 31.86 2wvu s TRP 77 CO 0.02 -0.25 0.45 0.09 -4.62 0.00 0.00 176.95 172.64 2wvu n ASN 78 N 4.50 -1.97 0.00 5.86 5.03 -1.26 -2.68 115.26 124.73 2wvu n ASN 78 Ca -0.21 -1.16 0.00 0.00 0.87 0.00 0.00 54.58 54.08 2wvu n ASN 78 Cb 0.52 -2.36 0.00 0.00 -1.02 0.00 0.00 39.78 36.92 2wvu n ASN 78 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wvu n GLY 79 N -2.12 2.47 3.73 7.41 0.00 -1.26 -5.02 105.19 110.41 2wvu n GLY 79 Ca -0.22 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 2wvu n GLY 79 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wvu s LYS 80 N 0.00 4.60 -0.27 1.61 2.20 -1.09 -5.03 119.74 121.76 2wvu s LYS 80 Ca 0.00 1.61 -0.17 0.00 -0.36 0.00 0.00 55.97 57.05 2wvu s LYS 80 Cb 0.00 -3.34 -0.03 0.00 -1.51 0.00 0.00 37.83 32.96 2wvu s LYS 80 CO 0.00 0.07 0.50 0.08 -0.36 0.00 0.00 175.35 175.63 2wvu s VAL 81 N 0.12 5.08 -0.05 4.02 1.01 -1.26 -1.49 120.40 127.83 2wvu s VAL 81 Ca 0.50 0.78 -0.18 0.00 0.00 0.00 0.00 61.98 63.08 2wvu s VAL 81 Cb -0.27 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 2wvu s VAL 81 CO 0.32 0.06 0.51 -0.31 0.00 0.00 0.00 175.10 175.68 2wvu s TYR 82 N 2.29 3.63 -0.99 5.22 2.02 0.53 -4.97 117.35 125.08 2wvu s TYR 82 Ca 0.20 1.04 0.29 0.00 -0.37 0.00 0.00 57.07 58.22 2wvu s TYR 82 Cb -0.16 -2.52 1.18 0.00 -0.40 0.00 0.00 41.96 40.06 2wvu s TYR 82 CO 0.10 0.34 1.89 0.41 -1.57 0.00 0.00 175.55 176.72 2wvu n GLY 83 N 2.63 -1.49 3.67 0.71 0.00 -1.26 -4.83 105.19 104.62 2wvu n GLY 83 Ca -0.08 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 2wvu n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wvu s GLY 84 N -3.03 1.62 -0.12 -0.02 0.00 -1.26 -4.90 107.32 99.62 2wvu s GLY 84 Ca 0.14 -0.93 -0.30 0.00 0.00 0.00 0.00 44.72 43.63 2wvu s GLY 84 CO 0.54 -0.10 2.09 0.00 0.00 0.00 0.00 173.10 175.64 2wvu n ALA 85 N -4.49 1.57 -0.40 3.20 0.00 -1.25 -4.83 120.51 114.31 2wvu n ALA 85 Ca 0.13 -0.01 0.32 0.00 0.00 0.00 0.00 53.44 53.88 2wvu n ALA 85 Cb 0.59 -2.76 0.62 0.00 0.00 0.00 0.00 19.45 17.90 2wvu n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvu h ALA 86 N 12.60 2.67 0.00 0.00 0.00 -1.83 0.40 119.26 133.09 2wvu h ALA 86 Ca -0.44 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2wvu h ALA 86 Cb 1.25 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2wvu h ALA 86 CO 0.96 -1.17 0.00 -0.85 0.00 0.00 0.00 179.25 178.18 2wvu n GLU 87 N -4.56 0.01 -0.33 0.00 0.00 -1.26 -2.53 120.64 111.97 2wvu n GLU 87 Ca 0.32 0.12 0.12 0.00 0.00 0.00 0.00 57.16 57.72 2wvu n GLU 87 Cb 1.24 -1.51 0.30 0.00 0.00 0.00 0.00 31.44 31.46 2wvu n GLU 87 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 2wvu n TRP 88 N -1.53 0.86 -0.34 -1.84 7.02 0.14 -4.64 117.44 117.10 2wvu n TRP 88 Ca 0.05 -0.43 0.09 0.00 -1.02 0.00 0.00 57.50 56.19 2wvu n TRP 88 Cb 0.26 0.00 0.28 0.00 -2.42 0.00 0.00 31.31 29.43 2wvu n TRP 88 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 2wvu h LEU 89 N 4.35 0.86 -1.05 -0.99 5.85 -1.55 0.14 115.31 122.92 2wvu h LEU 89 Ca 0.00 0.05 0.22 0.00 0.84 0.00 0.00 57.88 59.00 2wvu h LEU 89 Cb 0.99 -0.12 -0.11 0.00 0.37 0.00 0.00 40.66 41.78 2wvu h LEU 89 CO 0.00 0.43 0.61 0.50 -0.34 0.00 0.00 178.44 179.64 2wvu h LYS 90 N 0.91 0.62 -0.01 1.25 3.64 -1.86 0.21 116.57 121.33 2wvu h LYS 90 Ca 0.50 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.79 2wvu h LYS 90 Cb 0.59 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2wvu h LYS 90 CO -0.27 0.41 -0.17 1.03 -2.27 0.00 0.00 179.45 178.18 2wvu h SER 91 N 0.64 0.17 -0.95 4.20 0.87 -1.07 -2.11 113.55 115.31 2wvu h SER 91 Ca 0.61 -0.74 0.04 0.00 -1.23 0.00 0.00 61.79 60.47 2wvu h SER 91 Cb 1.11 -0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 62.97 2wvu h SER 91 CO -0.42 0.88 0.62 -0.50 -0.53 0.00 0.00 176.83 176.88 2wvu h TRP 92 N -0.53 1.15 -0.59 2.24 -0.00 -0.67 -3.04 115.95 114.52 2wvu h TRP 92 Ca -0.02 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.90 2wvu h TRP 92 Cb 0.90 -0.38 0.00 0.00 -0.00 0.00 0.00 29.16 29.67 2wvu h TRP 92 CO 0.17 0.66 0.00 0.00 -0.00 0.00 0.00 178.44 179.28 2wvu n ALA 93 N -2.36 2.32 -1.52 1.49 0.00 0.69 -4.96 120.51 116.17 2wvu n ALA 93 Ca 0.12 -1.26 -0.18 0.00 0.00 0.00 0.00 53.44 52.13 2wvu n ALA 93 Cb 0.09 -0.75 -0.08 0.00 0.00 0.00 0.00 19.45 18.72 2wvu n ALA 93 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wvu n LYS 94 N 1.22 -1.41 -1.85 0.00 4.76 -1.03 -4.93 118.16 114.91 2wvu n LYS 94 Ca 0.20 1.07 -0.42 0.00 -2.87 0.00 0.00 58.31 56.29 2wvu n LYS 94 Cb 0.56 -5.41 -0.03 0.00 -1.84 0.00 0.00 35.03 28.30 2wvu n LYS 94 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wvu s VAL 95 N -2.53 2.92 0.74 -0.18 1.01 -0.82 -4.99 120.40 116.55 2wvu s VAL 95 Ca 0.00 0.34 -0.11 0.00 0.00 0.00 0.00 61.98 62.21 2wvu s VAL 95 Cb 0.00 -3.22 0.04 0.00 0.00 0.00 0.00 36.38 33.20 2wvu s VAL 95 CO 0.00 -0.01 1.08 -2.16 0.00 0.00 0.00 175.10 174.01 2wvu s PRO 96 N 2.91 2.55 0.14 2.72 0.04 -1.26 -4.79 135.00 137.30 2wvu s PRO 96 Ca 0.77 1.06 -0.26 0.00 0.04 0.00 0.00 61.00 62.61 2wvu s PRO 96 Cb -0.41 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.17 2wvu s PRO 96 CO 0.34 -1.41 1.61 0.00 0.04 0.00 0.00 177.00 177.58 2wvu h ALA 97 N -0.95 -0.39 -0.66 8.56 0.00 -1.94 -0.94 119.26 122.95 2wvu h ALA 97 Ca -0.44 0.02 0.13 0.00 0.00 0.00 0.00 54.91 54.63 2wvu h ALA 97 Cb 1.22 0.64 -0.13 0.00 0.00 0.00 0.00 17.79 19.52 2wvu h ALA 97 CO 0.54 -0.81 -0.20 -0.44 0.00 0.00 0.00 179.25 178.34 2wvu h ASP 98 N -0.40 -0.72 0.51 0.00 3.45 -1.94 -0.82 116.42 116.51 2wvu h ASP 98 Ca 0.10 0.21 -0.17 0.00 0.43 0.00 0.00 57.03 57.59 2wvu h ASP 98 Cb 0.56 0.44 -0.01 0.00 -0.56 0.00 0.00 39.33 39.76 2wvu h ASP 98 CO -0.37 -0.24 -0.75 -0.08 -1.57 0.00 0.00 179.24 176.23 2wvu h GLU 99 N -0.03 0.19 0.59 3.56 4.81 -1.81 -3.03 114.58 118.86 2wvu h GLU 99 Ca 0.31 -0.17 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 2wvu h GLU 99 Cb 0.50 0.04 0.01 0.00 0.63 0.00 0.00 28.75 29.93 2wvu h GLU 99 CO -0.69 0.85 -0.28 2.35 -0.73 0.00 0.00 179.01 180.51 2wvu h TRP 100 N 0.12 -0.73 0.00 0.92 2.91 -0.37 -3.09 115.95 115.71 2wvu h TRP 100 Ca -0.02 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.98 2wvu h TRP 100 Cb 1.32 0.24 0.00 0.00 -0.51 0.00 0.00 29.16 30.21 2wvu h TRP 100 CO 0.02 -0.40 0.12 -0.07 -1.03 0.00 0.00 178.44 177.09 2wvu h LEU 101 N -1.07 0.00 -1.53 0.65 3.38 -1.26 0.68 115.31 116.16 2wvu h LEU 101 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2wvu h LEU 101 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2wvu h LEU 101 CO 0.13 0.00 0.00 0.50 0.09 0.00 0.00 178.44 179.16 2wvu h LYS 102 N 0.00 0.00 -0.22 1.13 3.64 -1.44 -1.25 116.57 118.43 2wvu h LYS 102 Ca 0.00 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 2wvu h LYS 102 Cb 0.24 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 2wvu h LYS 102 CO 0.00 0.00 0.19 -0.07 -2.27 0.00 0.00 179.45 177.30 2wvu h LEU 103 N 0.00 0.00 -1.52 5.20 3.38 -1.00 -2.14 115.31 119.22 2wvu h LEU 103 Ca 0.00 0.00 0.29 0.00 0.09 0.00 0.00 57.88 58.26 2wvu h LEU 103 Cb 0.14 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.81 2wvu h LEU 103 CO 0.00 0.00 0.71 0.24 0.09 0.00 0.00 178.44 179.48 2wvu h MET 104 N 0.00 0.28 0.00 1.13 2.86 -1.46 0.17 114.93 117.91 2wvu h MET 104 Ca 0.11 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2wvu h MET 104 Cb 0.49 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.09 2wvu h MET 104 CO -0.00 0.18 0.00 -0.44 1.06 0.00 0.00 176.91 177.71 2wvu h ASP 105 N 0.29 0.00 -0.02 1.22 3.32 -1.61 -1.02 116.42 118.60 2wvu h ASP 105 Ca 0.59 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.64 2wvu h ASP 105 Cb 1.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.25 2wvu h ASP 105 CO -0.23 0.00 -0.16 0.00 -1.72 0.00 0.00 179.24 177.13 2wvu n GLN 106 N -3.04 1.50 -2.14 3.56 6.02 0.59 -4.72 117.38 119.15 2wvu n GLN 106 Ca -0.03 -1.13 -0.36 0.00 -0.01 0.00 0.00 57.00 55.47 2wvu n GLN 106 Cb 0.08 -1.28 -0.04 0.00 1.02 0.00 0.00 30.24 30.02 2wvu n GLN 106 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2wvu s TRP 107 N -1.61 1.83 -0.43 1.08 -0.11 -0.38 -4.79 118.94 114.53 2wvu s TRP 107 Ca 0.16 0.54 0.08 0.00 1.22 0.00 0.00 56.10 58.10 2wvu s TRP 107 Cb 0.13 -4.18 0.27 0.00 -1.50 0.00 0.00 33.47 28.19 2wvu s TRP 107 CO 0.30 -2.11 0.74 -1.71 -4.62 0.00 0.00 176.95 169.55 2wvu n ASN 108 N 12.42 -1.03 -4.12 5.86 5.15 -1.26 -2.90 115.26 129.37 2wvu n ASN 108 Ca 0.24 -3.06 -0.34 0.00 -0.60 0.00 0.00 54.58 50.82 2wvu n ASN 108 Cb 0.50 0.48 -0.07 0.00 -0.53 0.00 0.00 39.78 40.16 2wvu n ASN 108 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2wvu n PRO 109 N 1.20 1.31 -0.32 1.20 -0.04 -1.26 -4.79 135.00 132.31 2wvu n PRO 109 Ca 0.16 -2.05 0.21 0.00 -0.04 0.00 0.00 63.50 61.78 2wvu n PRO 109 Cb 0.60 -3.33 0.42 0.00 -0.04 0.00 0.00 33.50 31.15 2wvu n PRO 109 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2wvu h THR 110 N 5.46 0.16 -0.01 0.52 2.02 -1.81 -1.86 112.91 117.38 2wvu h THR 110 Ca 0.28 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.42 2wvu h THR 110 Cb 0.82 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2wvu h THR 110 CO 1.56 0.03 -0.07 0.29 0.37 0.00 0.00 175.52 177.70 2wvu n LYS 111 N -5.25 1.30 -1.83 6.66 5.02 0.21 -4.94 118.16 119.34 2wvu n LYS 111 Ca 0.29 -0.67 -0.41 0.00 -2.02 0.00 0.00 58.31 55.49 2wvu n LYS 111 Cb 0.94 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 34.45 2wvu n LYS 111 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2wvu s PHE 112 N -2.16 2.80 -0.31 2.13 5.36 -0.70 -4.60 117.98 120.50 2wvu s PHE 112 Ca 0.35 0.84 0.03 0.00 -0.96 0.00 0.00 56.93 57.19 2wvu s PHE 112 Cb 0.21 -4.02 0.17 0.00 -0.34 0.00 0.00 43.02 39.04 2wvu s PHE 112 CO 0.39 -3.40 0.45 0.34 -1.46 0.00 0.00 175.22 171.55 2wvu s ASP 113 N 0.46 0.03 0.26 6.13 -1.08 -1.26 -5.05 116.67 116.15 2wvu s ASP 113 Ca 0.62 -0.48 -0.02 0.00 -0.52 0.00 0.00 52.55 52.15 2wvu s ASP 113 Cb -0.47 1.25 0.54 0.00 -1.46 0.00 0.00 42.92 42.78 2wvu s ASP 113 CO 0.47 -0.32 1.71 0.00 0.52 0.00 0.00 175.17 177.55 2wvu h ALA 114 N 7.91 1.14 -0.96 3.66 0.00 -1.94 0.09 119.26 129.15 2wvu h ALA 114 Ca -0.05 0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.08 2wvu h ALA 114 Cb 1.13 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.99 2wvu h ALA 114 CO 0.23 -0.28 0.61 0.87 0.00 0.00 0.00 179.25 180.68 2wvu h LYS 115 N 0.39 1.04 -0.36 0.00 1.57 -1.92 -0.71 116.57 116.58 2wvu h LYS 115 Ca 0.46 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 59.07 2wvu h LYS 115 Cb 0.77 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 2wvu h LYS 115 CO -0.47 0.69 -0.19 -0.22 -0.57 0.00 0.00 179.45 178.69 2wvu h LYS 116 N 1.07 0.76 -0.55 3.15 3.64 -1.45 -1.02 116.57 122.18 2wvu h LYS 116 Ca 0.43 -0.34 0.06 0.00 -1.27 0.00 0.00 60.65 59.53 2wvu h LYS 116 Cb 0.24 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.99 2wvu h LYS 116 CO -0.20 0.96 0.24 -1.49 -2.27 0.00 0.00 179.45 176.69 2wvu h TRP 117 N 0.55 0.44 -0.42 1.91 4.06 -0.83 -0.04 115.95 121.62 2wvu h TRP 117 Ca 0.08 0.02 -0.11 0.00 2.06 0.00 0.00 58.89 60.94 2wvu h TRP 117 Cb 0.74 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 28.77 2wvu h TRP 117 CO 0.06 0.18 -0.18 0.00 -3.56 0.00 0.00 178.44 174.93 2wvu h ALA 118 N 1.33 0.90 -0.66 1.49 0.00 -0.99 -0.88 119.26 120.46 2wvu h ALA 118 Ca 0.26 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2wvu h ALA 118 Cb 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2wvu h ALA 118 CO -0.22 0.63 0.34 0.87 0.00 0.00 0.00 179.25 180.87 2wvu h LYS 119 N 0.70 0.93 -0.24 0.00 1.79 -0.81 -0.44 116.57 118.51 2wvu h LYS 119 Ca 0.10 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2wvu h LYS 119 Cb 0.69 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 31.15 2wvu h LYS 119 CO 0.05 0.72 0.15 1.98 -1.08 0.00 0.00 179.45 181.27 2wvu h MET 120 N 0.90 0.32 -0.60 3.15 4.05 -0.47 -1.14 114.93 121.14 2wvu h MET 120 Ca 0.23 -0.02 0.01 0.00 -0.28 0.00 0.00 59.70 59.63 2wvu h MET 120 Cb 0.08 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.78 2wvu h MET 120 CO -0.03 0.23 0.40 0.00 0.23 0.00 0.00 176.91 177.73 2wvu h ALA 121 N 1.07 0.77 -0.60 0.39 0.00 -1.02 -2.05 119.26 117.82 2wvu h ALA 121 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2wvu h ALA 121 Cb -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2wvu h ALA 121 CO -0.02 0.19 0.38 -0.22 0.00 0.00 0.00 179.25 179.58 2wvu h LYS 122 N 0.81 0.80 -0.02 0.00 3.64 -0.85 -2.20 116.57 118.75 2wvu h LYS 122 Ca 0.22 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.42 2wvu h LYS 122 Cb -0.09 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.54 2wvu h LYS 122 CO -0.05 0.55 -0.57 0.93 -2.27 0.00 0.00 179.45 178.04 2wvu h GLU 123 N 0.81 0.05 0.00 1.90 5.08 -1.06 -1.26 114.58 120.09 2wvu h GLU 123 Ca 0.22 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2wvu h GLU 123 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2wvu h GLU 123 CO -0.04 0.60 0.00 1.98 -1.00 0.00 0.00 179.01 180.55 2wvu h MET 124 N 0.04 0.00 0.00 2.33 4.05 -1.14 -3.38 114.93 116.83 2wvu h MET 124 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2wvu h MET 124 Cb 1.01 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.81 2wvu h MET 124 CO 0.08 0.00 0.00 0.41 0.23 0.00 0.00 176.91 177.63 2wvu n GLY 125 N -0.05 0.54 3.79 1.39 0.00 -0.48 -2.97 105.19 107.41 2wvu n GLY 125 Ca 0.01 -0.84 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 2wvu n GLY 125 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wvu s THR 126 N -2.00 4.31 -0.74 2.61 -4.23 -0.86 -4.88 115.64 109.86 2wvu s THR 126 Ca 0.00 1.66 0.20 0.00 -1.18 0.00 0.00 61.69 62.37 2wvu s THR 126 Cb 0.00 -3.95 -0.23 0.00 1.34 0.00 0.00 72.50 69.66 2wvu s THR 126 CO 0.00 0.13 0.75 0.29 -0.54 0.00 0.00 174.62 175.25 2wvu n LYS 127 N 0.52 0.54 -3.64 3.99 4.76 0.69 -4.64 118.16 120.38 2wvu n LYS 127 Ca 0.01 -0.04 -0.12 0.00 -2.87 0.00 0.00 58.31 55.30 2wvu n LYS 127 Cb 0.51 -1.44 -0.05 0.00 -1.84 0.00 0.00 35.03 32.20 2wvu n LYS 127 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 2wvu s TYR 128 N -2.97 -0.25 -0.06 2.13 -0.85 -1.23 -2.12 117.35 112.01 2wvu s TYR 128 Ca 0.04 0.08 0.03 0.00 -0.52 0.00 0.00 57.07 56.70 2wvu s TYR 128 Cb 0.14 0.25 0.01 0.00 0.38 0.00 0.00 41.96 42.74 2wvu s TYR 128 CO 0.81 -0.64 -0.12 0.08 -1.52 0.00 0.00 175.55 174.16 2wvu s VAL 129 N -3.11 1.13 -0.18 -3.49 1.01 -0.16 -1.40 120.40 114.19 2wvu s VAL 129 Ca -0.01 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 2wvu s VAL 129 Cb 0.00 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.31 2wvu s VAL 129 CO -0.07 0.35 0.20 -0.54 0.00 0.00 0.00 175.10 175.04 2wvu s LYS 130 N 0.54 4.18 -0.08 2.72 1.02 0.03 -0.96 119.74 127.19 2wvu s LYS 130 Ca -0.12 -0.09 0.03 0.00 0.02 0.00 0.00 55.97 55.81 2wvu s LYS 130 Cb -0.15 -3.41 0.01 0.00 -0.52 0.00 0.00 37.83 33.76 2wvu s LYS 130 CO 0.03 0.30 -0.18 0.42 -0.92 0.00 0.00 175.35 175.00 2wvu s ILE 131 N 0.32 1.60 -0.51 2.17 1.01 -0.17 -0.28 121.20 125.35 2wvu s ILE 131 Ca 0.12 -0.76 -0.26 0.00 0.00 0.00 0.00 60.65 59.75 2wvu s ILE 131 Cb -0.12 -1.41 -0.05 0.00 0.01 0.00 0.00 42.46 40.89 2wvu s ILE 131 CO 0.01 0.46 2.20 0.42 0.00 0.00 0.00 174.94 178.02 2wvu s THR 132 N 0.48 3.14 0.16 2.92 -4.23 -0.75 -0.56 115.64 116.80 2wvu s THR 132 Ca -0.16 0.09 -0.07 0.00 -1.18 0.00 0.00 61.69 60.37 2wvu s THR 132 Cb -0.17 -3.34 -0.08 0.00 1.34 0.00 0.00 72.50 70.25 2wvu s THR 132 CO 0.06 -0.32 1.45 0.71 -0.54 0.00 0.00 174.62 175.98 2wvu h THR 133 N 7.36 1.31 -2.11 3.99 1.35 -1.70 -3.44 112.91 119.67 2wvu h THR 133 Ca -0.26 -1.83 0.02 0.00 -0.55 0.00 0.00 66.41 63.79 2wvu h THR 133 Cb 1.23 1.78 -0.22 0.00 -1.73 0.00 0.00 68.15 69.21 2wvu h THR 133 CO 1.16 0.58 -0.10 -0.75 -0.25 0.00 0.00 175.52 176.15 2wvu s LYS 134 N -3.98 0.59 0.00 4.72 2.20 -1.26 -1.08 119.74 120.94 2wvu s LYS 134 Ca -0.09 1.25 0.00 0.00 -0.36 0.00 0.00 55.97 56.78 2wvu s LYS 134 Cb 0.11 0.41 0.00 0.00 -1.51 0.00 0.00 37.83 36.84 2wvu s LYS 134 CO 0.86 -0.18 0.00 1.58 -0.36 0.00 0.00 175.35 177.26 2wvu n HIS 135 N 4.83 -1.38 -0.25 4.03 -0.00 -1.26 -2.03 115.22 119.16 2wvu n HIS 135 Ca -0.16 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.49 2wvu n HIS 135 Cb 0.54 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.58 2wvu n HIS 135 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2wvu h HIS 136 N -0.15 1.07 -1.34 1.57 -0.00 -1.91 -1.77 115.15 112.62 2wvu h HIS 136 Ca 0.00 -0.09 0.39 0.00 -0.00 0.00 0.00 60.37 60.67 2wvu h HIS 136 Cb 0.00 -0.32 -0.05 0.00 -0.00 0.00 0.00 27.41 27.04 2wvu h HIS 136 CO 0.00 0.84 1.00 1.05 -0.00 0.00 0.00 177.93 180.82 2wvu h GLU 137 N 1.00 0.00 0.00 2.45 4.11 -1.90 0.41 114.58 120.65 2wvu h GLU 137 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.66 2wvu h GLU 137 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2wvu h GLU 137 CO -0.02 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.47 2wvu n GLY 138 N -1.79 0.70 3.68 1.06 0.00 -0.67 -3.59 105.19 104.57 2wvu n GLY 138 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.89 2wvu n GLY 138 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wvu s PHE 139 N -2.54 3.28 -0.13 1.61 5.36 -1.26 -4.83 117.98 119.47 2wvu s PHE 139 Ca 0.00 1.38 -0.11 0.00 -0.96 0.00 0.00 56.93 57.24 2wvu s PHE 139 Cb 0.00 -3.32 -0.05 0.00 -0.34 0.00 0.00 43.02 39.32 2wvu s PHE 139 CO 0.00 -0.79 0.23 0.00 -1.46 0.00 0.00 175.22 173.21 2wvu n LEU 141 N 2.78 0.00 -4.36 0.00 4.77 -0.24 -1.41 117.00 118.53 2wvu n LEU 141 Ca -0.16 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.57 2wvu n LEU 141 Cb 0.53 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.50 2wvu n LEU 141 CO 0.36 0.00 -0.52 -1.66 -1.33 0.00 0.00 177.39 174.24 2wvu s TRP 142 N -2.00 2.05 -1.19 -1.77 -2.14 -1.26 -1.27 118.94 111.36 2wvu s TRP 142 Ca 0.42 -0.41 -0.15 0.00 2.66 0.00 0.00 56.10 58.62 2wvu s TRP 142 Cb 0.19 -1.05 -0.05 0.00 -3.10 0.00 0.00 33.47 29.46 2wvu s TRP 142 CO 0.32 0.36 2.22 -0.35 -2.66 0.00 0.00 176.95 176.85 2wvu n PRO 143 N 0.54 2.44 -1.71 3.25 -0.04 -1.26 -4.34 135.00 133.88 2wvu n PRO 143 Ca -0.15 -2.15 -0.43 0.00 -0.04 0.00 0.00 63.50 60.73 2wvu n PRO 143 Cb 0.55 -2.99 -0.02 0.00 -0.04 0.00 0.00 33.50 31.00 2wvu n PRO 143 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2wvu n SER 144 N 5.93 3.21 -0.31 3.54 2.88 -1.26 -4.85 113.62 122.76 2wvu n SER 144 Ca 0.54 1.15 0.04 0.00 -1.33 0.00 0.00 58.87 59.27 2wvu n SER 144 Cb 0.34 -1.50 0.13 0.00 -0.75 0.00 0.00 64.21 62.43 2wvu n SER 144 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2wvu n LYS 145 N 1.87 1.39 0.00 -1.46 4.81 -1.26 -3.68 118.16 119.82 2wvu n LYS 145 Ca 0.09 -0.60 0.04 0.00 -0.87 0.00 0.00 58.31 56.98 2wvu n LYS 145 Cb 0.34 -1.16 0.03 0.00 0.02 0.00 0.00 35.03 34.26 2wvu n LYS 145 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2wvu n TYR 146 N -0.04 0.00 -3.58 5.64 4.01 -1.26 -5.01 117.16 116.92 2wvu n TYR 146 Ca 0.07 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.65 2wvu n TYR 146 Cb 0.15 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.12 2wvu n TYR 146 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2wvu s THR 147 N -0.66 0.02 -0.95 -0.72 -1.32 -1.24 -5.02 115.64 105.74 2wvu s THR 147 Ca 0.09 -0.14 0.27 0.00 -1.21 0.00 0.00 61.69 60.70 2wvu s THR 147 Cb 0.06 -0.91 0.23 0.00 -1.51 0.00 0.00 72.50 70.38 2wvu s THR 147 CO 0.10 -0.08 1.86 2.29 -2.21 0.00 0.00 174.62 176.58 2wvu n LYS 148 N 0.88 0.04 -2.56 7.08 2.85 -1.26 -4.49 118.16 120.70 2wvu n LYS 148 Ca -0.19 0.06 -0.43 0.00 -1.05 0.00 0.00 58.31 56.70 2wvu n LYS 148 Cb 0.57 -1.55 0.00 0.00 -0.65 0.00 0.00 35.03 33.41 2wvu n LYS 148 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2wvu n TYR 149 N -1.62 3.24 -4.25 5.58 4.01 -1.26 -4.57 117.16 118.29 2wvu n TYR 149 Ca 0.06 -2.89 -0.14 0.00 -0.16 0.00 0.00 57.90 54.78 2wvu n TYR 149 Cb 0.33 -1.88 -0.10 0.00 -0.31 0.00 0.00 39.34 37.38 2wvu n TYR 149 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2wvu s THR 150 N 0.07 0.23 0.57 -0.72 -4.23 -1.26 -1.25 115.64 109.05 2wvu s THR 150 Ca 0.39 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.17 2wvu s THR 150 Cb 0.06 -2.56 0.38 0.00 1.34 0.00 0.00 72.50 71.72 2wvu s THR 150 CO 0.02 0.00 2.01 -0.37 -0.54 0.00 0.00 174.62 175.74 2wvu h VAL 151 N 2.52 0.54 -0.08 2.29 -1.51 -1.43 -1.84 116.25 116.73 2wvu h VAL 151 Ca -0.37 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.07 2wvu h VAL 151 Cb 1.25 0.75 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 2wvu h VAL 151 CO 0.56 0.00 -0.11 0.00 -1.23 0.00 0.00 177.57 176.79 2wvu h ALA 152 N 1.67 1.67 -0.88 5.19 0.00 -1.84 -2.76 119.26 122.31 2wvu h ALA 152 Ca 0.17 -0.15 -0.45 0.00 0.00 0.00 0.00 54.91 54.48 2wvu h ALA 152 Cb 0.84 -0.05 -0.27 0.00 0.00 0.00 0.00 17.79 18.31 2wvu h ALA 152 CO -0.00 0.25 0.58 0.09 0.00 0.00 0.00 179.25 180.16 2wvu n ASN 153 N -4.34 3.69 -4.48 0.00 3.02 -0.69 -4.60 115.26 107.86 2wvu n ASN 153 Ca -0.02 -3.42 -0.24 0.00 -0.03 0.00 0.00 54.58 50.88 2wvu n ASN 153 Cb 0.22 -0.80 -0.10 0.00 -0.61 0.00 0.00 39.78 38.49 2wvu n ASN 153 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2wvu s THR 154 N -2.93 1.94 0.51 3.41 -4.23 -1.05 -4.77 115.64 108.53 2wvu s THR 154 Ca 0.51 -2.17 0.24 0.00 -1.18 0.00 0.00 61.69 59.09 2wvu s THR 154 Cb 0.43 -2.55 0.39 0.00 1.34 0.00 0.00 72.50 72.11 2wvu s THR 154 CO 0.10 -0.25 1.98 -0.65 -0.54 0.00 0.00 174.62 175.26 2wvu h PRO 155 N 2.15 0.07 -0.06 3.99 0.11 -1.75 -2.60 132.00 133.92 2wvu h PRO 155 Ca -0.41 -0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.56 2wvu h PRO 155 Cb 1.24 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2wvu h PRO 155 CO 0.69 0.05 -0.59 -0.92 -0.21 0.00 0.00 178.00 177.01 2wvu h TYR 156 N 0.07 0.25 0.00 0.65 3.20 -1.80 -3.47 116.97 115.88 2wvu h TYR 156 Ca 0.27 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 62.05 2wvu h TYR 156 Cb 0.98 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.21 2wvu h TYR 156 CO -0.00 0.74 0.00 1.63 -1.64 0.00 0.00 178.16 178.89 2wvu n LYS 157 N -3.87 0.00 -1.90 1.82 5.02 -0.98 -4.93 118.16 113.32 2wvu n LYS 157 Ca -0.02 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.94 2wvu n LYS 157 Cb 0.61 -0.30 0.03 0.00 -0.02 0.00 0.00 35.03 35.34 2wvu n LYS 157 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wvu s ARG 158 N 0.00 3.10 -1.20 1.97 0.52 -1.26 -3.78 118.95 118.29 2wvu s ARG 158 Ca 0.00 1.25 -0.20 0.00 -0.52 0.00 0.00 55.73 56.26 2wvu s ARG 158 Cb 0.00 -2.00 0.04 0.00 0.52 0.00 0.00 34.95 33.51 2wvu s ARG 158 CO 0.00 -0.99 1.70 0.34 0.02 0.00 0.00 175.30 176.36 2wvu s ASP 159 N -2.80 6.49 0.19 0.23 2.15 -1.26 -4.69 116.67 116.97 2wvu s ASP 159 Ca 0.64 -2.05 -0.17 0.00 0.43 0.00 0.00 52.55 51.41 2wvu s ASP 159 Cb -0.17 -2.58 0.15 0.00 -0.30 0.00 0.00 42.92 40.02 2wvu s ASP 159 CO 0.40 -1.53 1.63 0.40 -0.17 0.00 0.00 175.17 175.90 2wvu h ILE 160 N 6.01 0.38 -0.02 4.11 1.08 -1.90 -1.41 117.51 125.75 2wvu h ILE 160 Ca 0.35 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.83 2wvu h ILE 160 Cb 0.92 0.38 -0.01 0.00 -3.07 0.00 0.00 36.82 35.04 2wvu h ILE 160 CO 1.42 0.00 -0.02 0.25 -0.69 0.00 0.00 178.15 179.11 2wvu h LEU 161 N -0.08 -0.06 -0.93 1.44 5.85 -1.50 -0.87 115.31 119.16 2wvu h LEU 161 Ca 0.24 0.01 0.03 0.00 0.84 0.00 0.00 57.88 59.01 2wvu h LEU 161 Cb 0.45 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 2wvu h LEU 161 CO -0.56 -0.03 0.60 1.23 -0.34 0.00 0.00 178.44 179.34 2wvu h GLY 162 N -0.02 1.35 1.45 3.75 0.00 -1.74 0.05 103.07 107.90 2wvu h GLY 162 Ca 0.02 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 46.83 2wvu h GLY 162 CO -0.04 0.40 0.05 0.83 0.00 0.00 0.00 176.54 177.79 2wvu h GLU 163 N 1.18 0.68 -0.26 4.80 5.08 -0.76 -2.08 114.58 123.23 2wvu h GLU 163 Ca 0.37 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.49 2wvu h GLU 163 Cb -0.02 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2wvu h GLU 163 CO -0.11 0.66 -0.17 -0.07 -1.00 0.00 0.00 179.01 178.32 2wvu h LEU 164 N 0.65 0.59 -0.19 1.33 3.38 -0.50 -1.22 115.31 119.35 2wvu h LEU 164 Ca 0.14 -0.44 0.05 0.00 0.09 0.00 0.00 57.88 57.73 2wvu h LEU 164 Cb 0.33 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 2wvu h LEU 164 CO 0.01 0.90 -0.19 0.58 0.09 0.00 0.00 178.44 179.82 2wvu h VAL 165 N 0.29 0.49 0.22 1.22 2.07 -0.87 0.50 116.25 120.17 2wvu h VAL 165 Ca 0.05 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.58 2wvu h VAL 165 Cb 0.70 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 2wvu h VAL 165 CO 0.05 0.00 -0.35 0.50 0.02 0.00 0.00 177.57 177.79 2wvu h LYS 166 N -0.21 -0.61 -0.17 1.57 3.64 -1.37 -0.86 116.57 118.55 2wvu h LYS 166 Ca 0.12 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2wvu h LYS 166 Cb 0.39 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 2wvu h LYS 166 CO -0.32 -0.41 0.10 0.00 -2.27 0.00 0.00 179.45 176.55 2wvu h ALA 167 N -0.09 0.22 -0.28 5.00 0.00 -0.98 -0.19 119.26 122.95 2wvu h ALA 167 Ca 0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2wvu h ALA 167 Cb 0.62 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2wvu h ALA 167 CO -0.14 -0.26 0.10 1.88 0.00 0.00 0.00 179.25 180.83 2wvu h TYR 168 N 0.20 0.44 -0.80 0.00 0.05 -0.90 -2.76 116.97 113.19 2wvu h TYR 168 Ca 0.06 -0.04 0.05 0.00 0.05 0.00 0.00 58.73 58.86 2wvu h TYR 168 Cb 0.04 -0.13 -0.05 0.00 1.01 0.00 0.00 36.73 37.60 2wvu h TYR 168 CO -0.05 0.46 0.53 -0.91 -1.05 0.00 0.00 178.16 177.13 2wvu h ASN 169 N 0.29 0.80 0.13 3.88 2.35 -0.97 -0.50 115.58 121.57 2wvu h ASN 169 Ca 0.09 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 2wvu h ASN 169 Cb 0.21 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 2wvu h ASN 169 CO -0.01 0.53 -0.06 0.44 -1.65 0.00 0.00 177.43 176.68 2wvu h ASP 170 N 0.91 0.00 -0.40 5.81 3.32 -0.75 -1.46 116.42 123.85 2wvu h ASP 170 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 2wvu h ASP 170 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 2wvu h ASP 170 CO -0.11 0.06 0.00 -0.62 -1.72 0.00 0.00 179.24 176.84 2wvu n GLU 171 N -3.87 2.06 -1.06 3.56 -0.58 -0.30 -4.92 120.64 115.53 2wvu n GLU 171 Ca -0.03 -1.64 -0.02 0.00 -0.42 0.00 0.00 57.16 55.05 2wvu n GLU 171 Cb 0.15 -1.39 -0.01 0.00 -0.57 0.00 0.00 31.44 29.62 2wvu n GLU 171 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wvu n GLY 172 N 1.26 0.55 3.64 0.62 0.00 -0.55 -5.02 105.19 105.69 2wvu n GLY 172 Ca 0.16 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 2wvu n GLY 172 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvu s ILE 173 N -2.06 5.02 0.52 -0.61 1.01 -0.56 -4.96 121.20 119.56 2wvu s ILE 173 Ca 0.00 0.06 -0.20 0.00 0.00 0.00 0.00 60.65 60.51 2wvu s ILE 173 Cb 0.00 -3.30 -0.07 0.00 0.01 0.00 0.00 42.46 39.10 2wvu s ILE 173 CO 0.00 0.41 1.08 -1.81 0.00 0.00 0.00 174.94 174.62 2wvu s ASP 174 N 0.69 6.04 -0.07 3.58 1.01 -0.90 -3.23 116.67 123.80 2wvu s ASP 174 Ca 0.05 2.03 0.05 0.00 0.71 0.00 0.00 52.55 55.40 2wvu s ASP 174 Cb -0.13 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.22 2wvu s ASP 174 CO 0.01 -0.99 -0.22 -0.69 0.21 0.00 0.00 175.17 173.50 2wvu s VAL 175 N -1.91 2.35 0.08 -1.27 1.01 -1.26 -0.99 120.40 118.40 2wvu s VAL 175 Ca 0.70 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.80 2wvu s VAL 175 Cb -0.20 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 2wvu s VAL 175 CO 0.24 0.57 -0.21 -1.00 0.00 0.00 0.00 175.10 174.70 2wvu s HIS 176 N -0.17 2.48 -0.28 5.22 3.76 -0.13 -1.02 115.29 125.15 2wvu s HIS 176 Ca -0.03 -0.30 -0.07 0.00 -0.15 0.00 0.00 55.06 54.52 2wvu s HIS 176 Cb -0.14 -1.39 -0.00 0.00 1.11 0.00 0.00 32.58 32.16 2wvu s HIS 176 CO 0.04 0.28 0.07 -0.06 -0.85 0.00 0.00 174.74 174.22 2wvu s PHE 177 N -0.99 3.12 0.28 1.40 0.08 0.24 -1.00 117.98 121.11 2wvu s PHE 177 Ca 0.15 -0.86 -0.29 0.00 0.12 0.00 0.00 56.93 56.05 2wvu s PHE 177 Cb -0.10 -2.24 -0.10 0.00 -0.57 0.00 0.00 43.02 40.01 2wvu s PHE 177 CO 0.06 -0.53 1.13 -0.47 -0.10 0.00 0.00 175.22 175.32 2wvu s TYR 178 N 1.52 3.49 -0.15 0.36 5.04 0.28 -0.09 117.35 127.80 2wvu s TYR 178 Ca 0.04 1.65 -0.05 0.00 -2.44 0.00 0.00 57.07 56.26 2wvu s TYR 178 Cb -0.16 -3.35 0.07 0.00 0.35 0.00 0.00 41.96 38.87 2wvu s TYR 178 CO 0.02 -0.77 0.31 0.12 -1.34 0.00 0.00 175.55 173.89 2wvu s PHE 179 N -1.12 -0.53 -0.38 4.97 5.36 -0.73 -1.73 117.98 123.82 2wvu s PHE 179 Ca 0.45 1.12 -0.25 0.00 -0.96 0.00 0.00 56.93 57.29 2wvu s PHE 179 Cb -0.33 0.06 0.02 0.00 -0.34 0.00 0.00 43.02 42.42 2wvu s PHE 179 CO 0.43 -0.40 0.89 0.45 -1.46 0.00 0.00 175.22 175.13 2wvu s SER 180 N 2.48 6.61 0.04 6.13 0.15 -0.86 -1.19 113.70 127.06 2wvu s SER 180 Ca 0.01 0.43 -0.27 0.00 0.70 0.00 0.00 55.95 56.82 2wvu s SER 180 Cb -0.12 -2.44 -0.17 0.00 -1.71 0.00 0.00 66.02 61.57 2wvu s SER 180 CO -0.10 -0.86 1.45 0.58 1.20 0.00 0.00 173.24 175.52 2wvu h VAL 181 N 5.85 0.69 -1.69 4.45 2.07 -1.23 -3.41 116.25 122.99 2wvu h VAL 181 Ca -0.24 -0.33 -0.69 0.00 0.82 0.00 0.00 66.70 66.26 2wvu h VAL 181 Cb 1.08 0.87 0.04 0.00 -1.52 0.00 0.00 31.29 31.76 2wvu h VAL 181 CO 0.97 0.07 0.67 0.80 0.02 0.00 0.00 177.57 180.10 2wvu n MET 182 N -5.21 1.27 -3.66 1.57 0.00 -0.62 -4.97 117.12 105.50 2wvu n MET 182 Ca -0.10 0.46 -0.27 0.00 -0.00 0.00 0.00 57.70 57.79 2wvu n MET 182 Cb 0.24 -2.14 -0.16 0.00 0.00 0.00 0.00 33.22 31.16 2wvu n MET 182 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2wvu s ASP 183 N 1.82 2.81 0.00 6.12 -1.08 -1.26 -4.49 116.67 120.58 2wvu s ASP 183 Ca 0.90 -0.83 0.16 0.00 -0.52 0.00 0.00 52.55 52.26 2wvu s ASP 183 Cb -0.97 -0.44 0.88 0.00 -1.46 0.00 0.00 42.92 40.94 2wvu s ASP 183 CO 0.53 -0.35 1.43 0.79 0.52 0.00 0.00 175.17 178.10 2wvu n TRP 184 N 5.16 0.00 -0.01 -5.34 8.01 0.14 -3.04 117.44 122.36 2wvu n TRP 184 Ca -0.07 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.22 2wvu n TRP 184 Cb 0.47 -0.17 -0.16 0.00 -2.01 0.00 0.00 31.31 29.44 2wvu n TRP 184 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2wvu n SER 185 N -1.17 0.03 -4.42 -0.99 3.41 -1.24 -4.79 113.62 104.46 2wvu n SER 185 Ca 0.10 0.01 -0.39 0.00 -0.26 0.00 0.00 58.87 58.32 2wvu n SER 185 Cb 0.10 1.92 -0.11 0.00 -0.26 0.00 0.00 64.21 65.86 2wvu n SER 185 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2wvu s ASN 186 N -4.57 5.65 0.43 4.04 3.84 -1.17 -4.99 114.94 118.16 2wvu s ASN 186 Ca -0.08 -0.68 0.30 0.00 0.21 0.00 0.00 52.86 52.61 2wvu s ASN 186 Cb 0.14 -2.02 1.42 0.00 -0.55 0.00 0.00 41.25 40.23 2wvu s ASN 186 CO 0.90 -0.26 1.90 1.55 -2.79 0.00 0.00 177.10 178.40 2wvu h PRO 187 N 8.39 0.00 0.00 0.43 0.13 -1.90 -2.26 132.00 136.79 2wvu h PRO 187 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2wvu h PRO 187 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2wvu h PRO 187 CO 0.64 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.16 2wvu n ASP 188 N -2.63 0.00 -4.76 1.44 8.00 -1.26 -4.79 116.55 112.55 2wvu n ASP 188 Ca -0.00 0.15 -0.41 0.00 0.71 0.00 0.00 54.79 55.24 2wvu n ASP 188 Cb 0.17 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.12 40.92 2wvu n ASP 188 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2wvu s TYR 189 N -2.66 3.14 0.07 1.24 5.04 -0.85 -3.71 117.35 119.61 2wvu s TYR 189 Ca 0.13 1.39 0.08 0.00 -2.44 0.00 0.00 57.07 56.23 2wvu s TYR 189 Cb 0.10 -3.63 -0.03 0.00 0.35 0.00 0.00 41.96 38.75 2wvu s TYR 189 CO 0.25 -1.77 -0.20 1.03 -1.34 0.00 0.00 175.55 173.51 2wvu s ARG 190 N -1.42 1.25 0.04 4.97 1.81 -1.26 -4.99 118.95 119.34 2wvu s ARG 190 Ca 0.50 -1.03 0.08 0.00 -1.72 0.00 0.00 55.73 53.57 2wvu s ARG 190 Cb -0.39 -1.43 -0.23 0.00 -0.45 0.00 0.00 34.95 32.46 2wvu s ARG 190 CO 0.49 0.35 0.97 1.88 -0.68 0.00 0.00 175.30 178.31 2wvu h TYR 191 N 4.53 0.05 -3.13 -0.53 -1.99 -1.99 -3.43 116.97 110.47 2wvu h TYR 191 Ca -0.44 -0.04 -0.11 0.00 2.00 0.00 0.00 58.73 60.14 2wvu h TYR 191 Cb 1.17 -0.00 -0.19 0.00 2.00 0.00 0.00 36.73 39.71 2wvu h TYR 191 CO 0.55 1.05 -0.28 0.34 -0.00 0.00 0.00 178.16 179.82 2wvu s ASP 192 N -6.48 -0.16 -0.40 3.88 -1.08 -1.26 -0.63 116.67 110.54 2wvu s ASP 192 Ca -0.03 -0.01 -0.15 0.00 -0.52 0.00 0.00 52.55 51.84 2wvu s ASP 192 Cb 0.09 0.32 0.01 0.00 -1.46 0.00 0.00 42.92 41.88 2wvu s ASP 192 CO 0.83 -0.49 0.32 -0.63 0.52 0.00 0.00 175.17 175.71 2wvu s ILE 193 N -1.68 5.23 -0.20 4.11 -1.09 -1.26 -4.87 121.20 121.43 2wvu s ILE 193 Ca -0.11 -0.52 0.02 0.00 -2.23 0.00 0.00 60.65 57.80 2wvu s ILE 193 Cb -0.04 -3.92 0.01 0.00 -1.58 0.00 0.00 42.46 36.93 2wvu s ILE 193 CO 0.02 -0.29 0.42 0.29 -1.23 0.00 0.00 174.94 174.15 2wvu n LYS 194 N 5.24 1.36 -3.81 2.79 5.02 -1.26 -5.01 118.16 122.49 2wvu n LYS 194 Ca -0.10 -0.44 -0.06 0.00 -2.02 0.00 0.00 58.31 55.69 2wvu n LYS 194 Cb 0.47 -0.90 -0.02 0.00 -0.02 0.00 0.00 35.03 34.56 2wvu n LYS 194 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2wvu s SER 195 N -0.46 -0.23 0.29 4.39 1.04 -1.26 -5.04 113.70 112.44 2wvu s SER 195 Ca 0.02 -0.52 -0.00 0.00 0.48 0.00 0.00 55.95 55.93 2wvu s SER 195 Cb 0.02 0.63 0.44 0.00 0.10 0.00 0.00 66.02 67.20 2wvu s SER 195 CO 0.04 -1.16 1.83 0.50 0.98 0.00 0.00 173.24 175.43 2wvu h LYS 196 N 2.00 0.76 -0.85 4.02 1.63 -1.98 -1.48 116.57 120.67 2wvu h LYS 196 Ca -0.21 -0.16 -0.01 0.00 -0.85 0.00 0.00 60.65 59.42 2wvu h LYS 196 Cb 1.24 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.72 2wvu h LYS 196 CO 0.24 0.71 0.50 1.49 -3.45 0.00 0.00 179.45 178.94 2wvu h GLU 197 N 0.73 1.16 -0.24 1.90 4.22 -1.99 0.64 114.58 121.01 2wvu h GLU 197 Ca 0.16 -0.12 -0.02 0.00 0.08 0.00 0.00 59.36 59.46 2wvu h GLU 197 Cb 0.31 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2wvu h GLU 197 CO 0.00 0.83 0.06 -0.44 -2.18 0.00 0.00 179.01 177.28 2wvu h ASP 198 N 1.17 0.37 -0.67 1.04 3.32 -1.87 -0.32 116.42 119.46 2wvu h ASP 198 Ca 0.30 -0.23 0.11 0.00 0.02 0.00 0.00 57.03 57.23 2wvu h ASP 198 Cb -0.02 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 2wvu h ASP 198 CO -0.05 0.51 0.45 -1.28 -1.72 0.00 0.00 179.24 177.14 2wvu h SER 199 N 0.22 0.41 0.13 6.45 0.87 -0.85 0.24 113.55 121.01 2wvu h SER 199 Ca 0.08 0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.48 2wvu h SER 199 Cb 0.28 -0.07 0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2wvu h SER 199 CO 0.00 0.23 -0.76 0.40 -0.53 0.00 0.00 176.83 176.17 2wvu h ILE 200 N 0.45 1.52 0.25 2.23 1.08 -0.75 -2.67 117.51 119.61 2wvu h ILE 200 Ca 0.32 -2.51 -0.00 0.00 -0.39 0.00 0.00 64.86 62.27 2wvu h ILE 200 Cb 0.63 3.20 -0.01 0.00 -3.07 0.00 0.00 36.82 37.57 2wvu h ILE 200 CO -0.10 0.71 -0.20 0.00 -0.69 0.00 0.00 178.15 177.87 2wvu h ALA 201 N 0.07 -0.44 -0.33 1.87 0.00 -0.65 -2.24 119.26 117.54 2wvu h ALA 201 Ca -0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2wvu h ALA 201 Cb 1.58 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.63 2wvu h ALA 201 CO 0.13 -0.77 0.14 0.35 0.00 0.00 0.00 179.25 179.10 2wvu h PHE 202 N -0.46 0.45 -0.84 0.00 3.57 -0.61 0.62 116.94 119.66 2wvu h PHE 202 Ca -0.01 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.49 2wvu h PHE 202 Cb 0.41 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 2wvu h PHE 202 CO -0.13 0.35 0.56 1.03 -2.23 0.00 0.00 178.31 177.89 2wvu h SER 203 N 0.46 0.96 0.61 0.41 0.87 -1.08 0.60 113.55 116.38 2wvu h SER 203 Ca 0.12 -0.02 -0.16 0.00 -1.23 0.00 0.00 61.79 60.49 2wvu h SER 203 Cb 0.08 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 2wvu h SER 203 CO -0.01 0.69 -0.73 0.03 -0.53 0.00 0.00 176.83 176.28 2wvu h ARG 204 N 1.12 0.09 -0.21 2.24 3.08 -0.39 -2.00 114.38 118.32 2wvu h ARG 204 Ca 0.31 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 60.19 2wvu h ARG 204 Cb -0.10 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 2wvu h ARG 204 CO -0.07 0.78 -0.26 0.35 -1.07 0.00 0.00 179.97 179.69 2wvu h PHE 205 N 0.06 0.45 0.00 3.04 3.57 -0.07 -2.37 116.94 121.62 2wvu h PHE 205 Ca -0.02 -0.09 -0.12 0.00 3.53 0.00 0.00 57.97 61.27 2wvu h PHE 205 Cb 1.28 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.89 2wvu h PHE 205 CO 0.01 0.63 -0.56 -0.07 -2.23 0.00 0.00 178.31 176.09 2wvu h LEU 206 N 0.36 0.00 -0.21 0.59 3.38 -0.72 -0.79 115.31 117.92 2wvu h LEU 206 Ca 0.05 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 2wvu h LEU 206 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2wvu h LEU 206 CO 0.05 0.56 -0.37 -0.08 0.09 0.00 0.00 178.44 178.69 2wvu h GLU 207 N 0.00 0.62 -0.28 1.13 4.81 -1.34 -0.53 114.58 118.99 2wvu h GLU 207 Ca -0.01 -0.39 0.05 0.00 -0.13 0.00 0.00 59.36 58.89 2wvu h GLU 207 Cb 1.28 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.66 2wvu h GLU 207 CO 0.07 1.00 -0.00 0.35 -0.73 0.00 0.00 179.01 179.70 2wvu h PHE 208 N 0.30 -0.02 0.23 0.92 3.57 -1.33 0.11 116.94 120.74 2wvu h PHE 208 Ca 0.01 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 2wvu h PHE 208 Cb 0.96 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 2wvu h PHE 208 CO 0.09 -0.05 -0.17 1.15 -2.23 0.00 0.00 178.31 177.10 2wvu h THR 209 N 0.08 0.63 -0.87 4.41 2.02 -1.16 -1.35 112.91 116.67 2wvu h THR 209 Ca 0.13 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.54 2wvu h THR 209 Cb 0.17 0.63 -0.14 0.00 -1.74 0.00 0.00 68.15 67.08 2wvu h THR 209 CO -0.23 0.00 0.22 0.44 0.37 0.00 0.00 175.52 176.33 2wvu h ASP 210 N -0.41 -0.02 -0.23 4.18 5.19 -0.73 0.40 116.42 124.81 2wvu h ASP 210 Ca -0.02 0.20 -0.02 0.00 -0.62 0.00 0.00 57.03 56.57 2wvu h ASP 210 Cb 0.36 0.27 -0.01 0.00 0.18 0.00 0.00 39.33 40.13 2wvu h ASP 210 CO -0.00 -0.16 0.04 0.78 -3.12 0.00 0.00 179.24 176.79 2wvu h ASN 211 N 0.20 0.35 -0.43 6.45 2.35 -0.02 0.12 115.58 124.60 2wvu h ASN 211 Ca 0.54 -0.25 -0.07 0.00 -0.55 0.00 0.00 56.30 55.97 2wvu h ASN 211 Cb 1.09 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.35 2wvu h ASN 211 CO -0.66 0.51 -0.02 1.56 -1.65 0.00 0.00 177.43 177.17 2wvu h GLN 212 N 0.18 0.78 -0.45 0.81 4.20 -0.75 -0.41 115.11 119.46 2wvu h GLN 212 Ca 0.07 -0.26 0.03 0.00 0.06 0.00 0.00 58.65 58.55 2wvu h GLN 212 Cb 0.30 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 2wvu h GLN 212 CO 0.00 0.86 0.24 -0.07 -0.67 0.00 0.00 178.83 179.19 2wvu h LEU 213 N 0.61 0.37 -0.65 1.46 3.38 -0.72 0.14 115.31 119.90 2wvu h LEU 213 Ca 0.12 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 2wvu h LEU 213 Cb 0.52 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2wvu h LEU 213 CO 0.03 0.26 0.14 0.11 0.09 0.00 0.00 178.44 179.07 2wvu h LYS 214 N 0.48 1.06 -0.29 1.13 1.57 -0.90 -0.97 116.57 118.65 2wvu h LYS 214 Ca 0.19 -0.26 0.06 0.00 -1.87 0.00 0.00 60.65 58.77 2wvu h LYS 214 Cb 0.07 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.19 2wvu h LYS 214 CO -0.12 0.96 -0.09 1.49 -0.57 0.00 0.00 179.45 181.12 2wvu h GLU 215 N 0.98 -0.02 -0.50 3.15 4.81 -0.51 -0.66 114.58 121.82 2wvu h GLU 215 Ca 0.20 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 2wvu h GLU 215 Cb 0.38 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 2wvu h GLU 215 CO 0.01 -0.01 0.25 -0.07 -0.73 0.00 0.00 179.01 178.45 2wvu h LEU 216 N -0.02 0.64 -1.55 1.64 3.38 -0.50 -0.92 115.31 117.98 2wvu h LEU 216 Ca 0.14 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2wvu h LEU 216 Cb 0.24 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2wvu h LEU 216 CO -0.31 0.58 -0.23 0.00 0.09 0.00 0.00 178.44 178.57 2wvu h ALA 217 N 1.09 1.59 0.07 1.53 0.00 -0.94 -1.89 119.26 120.70 2wvu h ALA 217 Ca 0.17 -0.21 -0.37 0.00 0.00 0.00 0.00 54.91 54.51 2wvu h ALA 217 Cb 0.10 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2wvu h ALA 217 CO -0.02 0.29 -2.14 0.25 0.00 0.00 0.00 179.25 177.63 2wvu n THR 218 N -4.22 1.65 -0.11 0.00 -2.24 -0.28 -3.49 114.28 105.59 2wvu n THR 218 Ca -0.02 -0.66 -0.08 0.00 -2.27 0.00 0.00 64.05 61.02 2wvu n THR 218 Cb 0.29 -1.48 0.08 0.00 -2.10 0.00 0.00 70.33 67.12 2wvu n THR 218 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2wvu h ARG 219 N 0.04 0.83 -2.15 -0.78 3.08 -1.23 -3.37 114.38 110.80 2wvu h ARG 219 Ca -0.46 -0.31 -0.59 0.00 0.07 0.00 0.00 59.98 58.68 2wvu h ARG 219 Cb 2.01 -0.05 -0.41 0.00 0.08 0.00 0.00 29.97 31.59 2wvu h ARG 219 CO 0.03 0.94 -0.72 0.66 -1.07 0.00 0.00 179.97 179.81 2wvu n TYR 220 N -4.13 2.75 0.35 3.04 4.01 -0.71 -4.96 117.16 117.52 2wvu n TYR 220 Ca 0.01 -4.01 0.04 0.00 -0.16 0.00 0.00 57.90 53.78 2wvu n TYR 220 Cb 0.41 -0.51 0.20 0.00 -0.31 0.00 0.00 39.34 39.13 2wvu n TYR 220 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2wvu n PRO 221 N 0.86 0.08 0.00 -0.72 -0.04 -1.23 -1.89 135.00 132.05 2wvu n PRO 221 Ca 0.28 0.26 0.14 0.00 -0.04 0.00 0.00 63.50 64.15 2wvu n PRO 221 Cb 0.44 -1.50 0.67 0.00 -0.04 0.00 0.00 33.50 33.07 2wvu n PRO 221 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2wvu n THR 222 N -1.36 0.00 -1.67 0.52 -2.24 -1.26 -4.91 114.28 103.35 2wvu n THR 222 Ca 0.03 -0.03 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 2wvu n THR 222 Cb 0.08 -0.27 -0.01 0.00 -2.10 0.00 0.00 70.33 68.03 2wvu n THR 222 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2wvu n VAL 223 N -1.12 1.92 0.48 2.28 3.14 -0.79 -4.61 118.33 119.62 2wvu n VAL 223 Ca 0.14 -0.48 0.05 0.00 -2.96 0.00 0.00 64.34 61.09 2wvu n VAL 223 Cb 0.26 -1.45 -0.03 0.00 -1.06 0.00 0.00 33.84 31.56 2wvu n VAL 223 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2wvu n LYS 224 N 0.70 2.93 -3.64 1.45 4.76 -0.19 -4.88 118.16 119.29 2wvu n LYS 224 Ca 0.06 -0.28 -0.09 0.00 -2.87 0.00 0.00 58.31 55.13 2wvu n LYS 224 Cb 0.35 -1.03 -0.07 0.00 -1.84 0.00 0.00 35.03 32.44 2wvu n LYS 224 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wvu s ASP 225 N -1.71 -0.54 -0.16 4.39 2.15 -1.26 -1.12 116.67 118.42 2wvu s ASP 225 Ca 0.06 1.01 -0.01 0.00 0.43 0.00 0.00 52.55 54.04 2wvu s ASP 225 Cb 0.08 1.06 -0.01 0.00 -0.30 0.00 0.00 42.92 43.76 2wvu s ASP 225 CO 0.35 -0.17 -0.12 -0.36 -0.17 0.00 0.00 175.17 174.70 2wvu s PHE 226 N 0.51 2.84 -0.46 -5.34 0.40 -0.28 -0.59 117.98 115.05 2wvu s PHE 226 Ca 0.00 -0.90 0.01 0.00 -0.60 0.00 0.00 56.93 55.44 2wvu s PHE 226 Cb -0.05 -1.93 0.12 0.00 0.51 0.00 0.00 43.02 41.68 2wvu s PHE 226 CO -0.07 -0.41 0.22 -0.46 0.70 0.00 0.00 175.22 175.20 2wvu s TRP 227 N 0.83 3.49 0.32 0.36 -0.00 0.87 -2.83 118.94 121.98 2wvu s TRP 227 Ca -0.04 -2.86 -0.27 0.00 -0.00 0.00 0.00 56.10 52.93 2wvu s TRP 227 Cb -0.15 -3.03 -0.09 0.00 -0.00 0.00 0.00 33.47 30.20 2wvu s TRP 227 CO 0.00 -0.88 1.00 -0.06 -0.00 0.00 0.00 176.95 177.02 2wvu s PHE 228 N 0.43 3.63 0.17 5.86 0.08 -1.26 -1.77 117.98 125.11 2wvu s PHE 228 Ca 0.13 1.76 -0.02 0.00 0.12 0.00 0.00 56.93 58.93 2wvu s PHE 228 Cb -0.22 -3.05 -0.04 0.00 -0.57 0.00 0.00 43.02 39.14 2wvu s PHE 228 CO -0.04 -0.09 0.11 0.34 -0.10 0.00 0.00 175.22 175.44 2wvu s ASP 229 N -1.37 0.21 -1.22 1.36 2.15 -0.34 -4.46 116.67 113.00 2wvu s ASP 229 Ca 0.49 -1.28 -0.00 0.00 0.43 0.00 0.00 52.55 52.19 2wvu s ASP 229 Cb -0.23 0.35 0.00 0.00 -0.30 0.00 0.00 42.92 42.74 2wvu s ASP 229 CO 0.30 -0.80 0.94 0.61 -0.17 0.00 0.00 175.17 176.05 2wvu n GLY 230 N -0.19 -0.35 0.16 2.66 0.00 -1.26 -1.09 105.19 105.12 2wvu n GLY 230 Ca -0.02 0.11 0.05 0.00 0.00 0.00 0.00 46.02 46.16 2wvu n GLY 230 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wvu n THR 231 N -4.17 1.06 0.71 2.61 -2.24 -1.26 -1.59 114.28 109.40 2wvu n THR 231 Ca -0.29 -1.23 0.11 0.00 -2.27 0.00 0.00 64.05 60.37 2wvu n THR 231 Cb 0.67 0.21 0.03 0.00 -2.10 0.00 0.00 70.33 69.14 2wvu n THR 231 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 2wvu n TRP 232 N -0.76 0.16 -1.14 4.78 2.14 -1.26 -4.66 117.44 116.70 2wvu n TRP 232 Ca 0.07 0.05 -0.31 0.00 2.07 0.00 0.00 57.50 59.38 2wvu n TRP 232 Cb 0.57 -0.32 0.11 0.00 -0.81 0.00 0.00 31.31 30.86 2wvu n TRP 232 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2wvu s ASP 233 N -3.60 4.11 0.39 -0.67 1.01 -1.26 -4.77 116.67 111.87 2wvu s ASP 233 Ca 0.05 1.95 0.08 0.00 0.71 0.00 0.00 52.55 55.34 2wvu s ASP 233 Cb 0.15 -2.54 0.84 0.00 1.01 0.00 0.00 42.92 42.38 2wvu s ASP 233 CO 0.80 -2.31 1.98 0.00 0.21 0.00 0.00 175.17 175.85 2wvu h ALA 234 N -1.24 1.79 -0.70 5.23 0.00 -1.83 -0.93 119.26 121.58 2wvu h ALA 234 Ca -0.44 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 2wvu h ALA 234 Cb 1.24 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2wvu h ALA 234 CO 0.49 0.10 0.42 0.66 0.00 0.00 0.00 179.25 180.92 2wvu h SER 235 N 0.63 0.84 -0.17 0.00 4.64 -1.15 0.61 113.55 118.96 2wvu h SER 235 Ca 0.28 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 61.48 2wvu h SER 235 Cb 0.30 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2wvu h SER 235 CO -0.09 0.65 -0.14 0.58 -0.87 0.00 0.00 176.83 176.97 2wvu h VAL 236 N 0.95 1.33 -0.75 0.95 2.07 -1.63 -2.88 116.25 116.29 2wvu h VAL 236 Ca 0.25 -1.27 0.11 0.00 0.82 0.00 0.00 66.70 66.62 2wvu h VAL 236 Cb -0.03 1.80 -0.08 0.00 -1.52 0.00 0.00 31.29 31.45 2wvu h VAL 236 CO -0.05 0.38 0.36 0.11 0.02 0.00 0.00 177.57 178.39 2wvu h LYS 237 N 0.04 0.56 0.00 1.57 1.57 -0.66 -0.44 116.57 119.22 2wvu h LYS 237 Ca 0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wvu h LYS 237 Cb 0.66 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2wvu h LYS 237 CO 0.04 0.37 0.00 1.63 -0.57 0.00 0.00 179.45 180.92 2wvu n LYS 238 N -4.89 0.05 -2.40 3.15 5.02 0.21 -3.54 118.16 115.75 2wvu n LYS 238 Ca 0.13 0.28 -0.21 0.00 -2.02 0.00 0.00 58.31 56.49 2wvu n LYS 238 Cb 0.34 -1.59 0.02 0.00 -0.02 0.00 0.00 35.03 33.78 2wvu n LYS 238 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2wvu n ASN 239 N -1.68 3.99 -0.12 4.39 4.13 -0.18 -4.86 115.26 120.94 2wvu n ASN 239 Ca 0.03 -3.41 0.11 0.00 1.68 0.00 0.00 54.58 52.99 2wvu n ASN 239 Cb 0.20 -0.44 0.46 0.00 -1.54 0.00 0.00 39.78 38.46 2wvu n ASN 239 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 2wvu h GLY 240 N 2.52 0.70 -0.36 7.41 0.00 -1.59 0.21 103.07 111.96 2wvu h GLY 240 Ca 0.22 -0.21 0.25 0.00 0.00 0.00 0.00 47.33 47.59 2wvu h GLY 240 CO 0.71 0.13 0.40 0.11 0.00 0.00 0.00 176.54 177.88 2wvu h TRP 241 N 0.50 0.64 -0.12 5.60 5.08 -1.88 -1.54 115.95 124.24 2wvu h TRP 241 Ca 0.30 0.04 -0.03 0.00 1.08 0.00 0.00 58.89 60.28 2wvu h TRP 241 Cb 0.50 -0.14 -0.00 0.00 -3.00 0.00 0.00 29.16 26.52 2wvu h TRP 241 CO -0.00 -0.13 -0.05 2.35 -1.28 0.00 0.00 178.44 179.33 2wvu h TRP 242 N 0.33 0.28 -0.68 0.12 7.01 -0.95 0.95 115.95 123.01 2wvu h TRP 242 Ca 0.61 -0.07 0.11 0.00 2.11 0.00 0.00 58.89 61.65 2wvu h TRP 242 Cb 1.24 -0.07 -0.08 0.00 -2.10 0.00 0.00 29.16 28.15 2wvu h TRP 242 CO -0.14 0.58 0.26 1.79 -2.79 0.00 0.00 178.44 178.14 2wvu h THR 243 N -0.09 0.72 -0.45 2.65 1.35 -1.35 0.32 112.91 116.07 2wvu h THR 243 Ca 0.03 -0.15 -0.05 0.00 -0.55 0.00 0.00 66.41 65.69 2wvu h THR 243 Cb 0.50 0.25 -0.02 0.00 -1.73 0.00 0.00 68.15 67.15 2wvu h THR 243 CO 0.02 0.08 0.09 0.00 -0.25 0.00 0.00 175.52 175.45 2wvu h ALA 244 N 1.48 0.59 -0.57 6.62 0.00 -1.09 -2.09 119.26 124.21 2wvu h ALA 244 Ca 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2wvu h ALA 244 Cb 0.48 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2wvu h ALA 244 CO -0.35 0.30 0.31 1.25 0.00 0.00 0.00 179.25 180.76 2wvu h HIS 245 N 0.60 0.78 -0.44 0.00 -0.00 0.39 -1.91 115.15 114.57 2wvu h HIS 245 Ca 0.14 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.49 2wvu h HIS 245 Cb 0.36 -0.25 -0.02 0.00 -0.00 0.00 0.00 27.41 27.50 2wvu h HIS 245 CO 0.02 0.57 0.27 0.00 -0.00 0.00 0.00 177.93 178.80 2wvu h ALA 246 N 1.14 0.56 0.01 5.26 0.00 -0.30 0.13 119.26 126.05 2wvu h ALA 246 Ca 0.20 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.09 2wvu h ALA 246 Cb 0.05 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 2wvu h ALA 246 CO -0.03 0.04 -0.33 1.49 0.00 0.00 0.00 179.25 180.42 2wvu h GLU 247 N 0.59 -0.47 -0.80 0.00 4.81 -1.24 -1.14 114.58 116.33 2wvu h GLU 247 Ca 0.16 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 2wvu h GLU 247 Cb -0.02 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 2wvu h GLU 247 CO -0.03 -0.31 0.37 0.37 -0.73 0.00 0.00 179.01 178.68 2wvu h GLN 248 N -0.49 1.17 -0.70 1.92 5.75 -1.02 -0.82 115.11 120.92 2wvu h GLN 248 Ca 0.06 -0.18 -0.02 0.00 -0.15 0.00 0.00 58.65 58.35 2wvu h GLN 248 Cb 0.57 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 2wvu h GLN 248 CO -0.27 0.91 0.35 1.98 -2.65 0.00 0.00 178.83 179.16 2wvu h MET 249 N 1.14 0.99 -0.04 1.69 4.05 -0.58 0.04 114.93 122.23 2wvu h MET 249 Ca 0.27 -0.14 -0.20 0.00 -0.28 0.00 0.00 59.70 59.35 2wvu h MET 249 Cb 0.14 -0.18 -0.00 0.00 -0.80 0.00 0.00 31.60 30.76 2wvu h MET 249 CO -0.03 0.77 -0.83 -0.07 0.23 0.00 0.00 176.91 176.98 2wvu h LEU 250 N 0.96 0.49 -1.06 3.39 3.38 -0.94 -1.18 115.31 120.35 2wvu h LEU 250 Ca 0.24 -0.36 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 2wvu h LEU 250 Cb 0.09 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2wvu h LEU 250 CO -0.03 1.13 -0.28 0.11 0.09 0.00 0.00 178.44 179.45 2wvu h LYS 251 N 0.25 0.32 -0.20 1.13 1.57 -0.90 0.41 116.57 119.14 2wvu h LYS 251 Ca -0.05 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.54 2wvu h LYS 251 Cb 1.43 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.72 2wvu h LYS 251 CO 0.14 0.58 -0.13 0.93 -0.57 0.00 0.00 179.45 180.40 2wvu h GLU 252 N 0.28 0.45 -0.00 3.15 5.08 -0.90 -3.30 114.58 119.33 2wvu h GLU 252 Ca 0.04 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.07 2wvu h GLU 252 Cb 0.65 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 2wvu h GLU 252 CO 0.05 0.76 -0.58 -0.07 -1.00 0.00 0.00 179.01 178.16 2wvu h LEU 253 N 0.13 0.02 -7.19 1.33 3.38 -0.93 -3.40 115.31 108.65 2wvu h LEU 253 Ca 0.04 -0.01 -0.60 0.00 0.09 0.00 0.00 57.88 57.40 2wvu h LEU 253 Cb 0.64 -0.01 -0.40 0.00 0.09 0.00 0.00 40.66 40.99 2wvu h LEU 253 CO 0.04 0.60 -0.75 -0.69 0.09 0.00 0.00 178.44 177.73 2wvu s VAL 254 N -3.70 1.23 0.04 1.22 1.01 0.14 -4.95 120.40 115.39 2wvu s VAL 254 Ca -0.02 -1.84 -0.36 0.00 0.00 0.00 0.00 61.98 59.76 2wvu s VAL 254 Cb 0.13 -1.91 -0.15 0.00 0.00 0.00 0.00 36.38 34.45 2wvu s VAL 254 CO 0.76 -0.72 1.50 -2.65 0.00 0.00 0.00 175.10 173.99 2wvu n PRO 255 N 4.42 1.50 -0.94 2.72 -0.02 -1.25 -1.76 135.00 139.67 2wvu n PRO 255 Ca 0.02 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2wvu n PRO 255 Cb 0.40 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 2wvu n PRO 255 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wvu n GLY 256 N 3.14 0.61 3.70 -1.23 0.00 -1.26 -5.01 105.19 105.14 2wvu n GLY 256 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2wvu n GLY 256 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2wvu n VAL 257 N -2.33 3.49 -3.85 1.61 3.14 -0.72 -4.61 118.33 115.05 2wvu n VAL 257 Ca 0.00 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.55 2wvu n VAL 257 Cb 0.05 -1.49 -0.05 0.00 -1.06 0.00 0.00 33.84 31.29 2wvu n VAL 257 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2wvu s ALA 258 N -1.32 3.92 -0.05 1.55 0.00 -0.27 -4.93 121.76 120.65 2wvu s ALA 258 Ca 0.70 -0.70 0.02 0.00 0.00 0.00 0.00 51.96 51.98 2wvu s ALA 258 Cb -0.44 -1.95 0.02 0.00 0.00 0.00 0.00 23.12 20.75 2wvu s ALA 258 CO 0.51 0.72 -0.08 0.42 0.00 0.00 0.00 175.76 177.33 2wvu s ILE 259 N -1.34 0.78 0.56 0.00 -1.09 -1.26 -1.13 121.20 117.72 2wvu s ILE 259 Ca 0.28 -0.29 -0.13 0.00 -2.23 0.00 0.00 60.65 58.29 2wvu s ILE 259 Cb -0.13 -0.75 -0.06 0.00 -1.58 0.00 0.00 42.46 39.95 2wvu s ILE 259 CO 0.19 0.27 0.99 0.54 -1.23 0.00 0.00 174.94 175.69 2wvu s ASN 260 N 0.70 6.41 0.39 3.58 4.22 -1.13 -0.42 114.94 128.69 2wvu s ASN 260 Ca -0.12 1.44 0.09 0.00 -2.14 0.00 0.00 52.86 52.13 2wvu s ASN 260 Cb -0.14 -2.47 0.78 0.00 1.28 0.00 0.00 41.25 40.70 2wvu s ASN 260 CO 0.02 -0.71 1.93 0.77 -2.04 0.00 0.00 177.10 177.07 2wvu h SER 261 N 0.31 0.29 -0.05 3.54 4.64 -1.20 -3.00 113.55 118.08 2wvu h SER 261 Ca -0.45 -0.05 0.02 0.00 -0.47 0.00 0.00 61.79 60.83 2wvu h SER 261 Cb 1.19 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2wvu h SER 261 CO 0.62 0.39 0.13 -0.09 -0.87 0.00 0.00 176.83 177.01 2wvu h ARG 262 N 0.31 0.00 -0.53 4.77 2.43 -1.85 -1.13 114.38 118.38 2wvu h ARG 262 Ca 0.07 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.15 2wvu h ARG 262 Cb 0.30 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 2wvu h ARG 262 CO 0.01 0.00 -0.03 1.25 -1.51 0.00 0.00 179.97 179.69 2wvu h LEU 263 N 0.00 0.94 -9.63 3.80 5.85 -1.74 -3.44 115.31 111.09 2wvu h LEU 263 Ca 0.02 -0.32 -0.53 0.00 0.84 0.00 0.00 57.88 57.89 2wvu h LEU 263 Cb 0.27 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2wvu h LEU 263 CO -0.00 1.03 0.19 -0.13 -0.34 0.00 0.00 178.44 179.19 2wvu s ARG 264 N -4.97 4.55 -0.01 1.25 1.81 -0.43 -4.84 118.95 116.31 2wvu s ARG 264 Ca -0.12 1.14 0.02 0.00 -1.72 0.00 0.00 55.73 55.05 2wvu s ARG 264 Cb 0.12 -3.32 -0.00 0.00 -0.45 0.00 0.00 34.95 31.30 2wvu s ARG 264 CO 0.84 0.41 -0.07 0.00 -0.68 0.00 0.00 175.30 175.80 2wvu s ALA 265 N -0.56 0.65 0.71 2.13 0.00 -1.26 -2.27 121.76 121.16 2wvu s ALA 265 Ca 0.38 -0.30 -0.02 0.00 0.00 0.00 0.00 51.96 52.01 2wvu s ALA 265 Cb -0.22 -0.20 0.12 0.00 0.00 0.00 0.00 23.12 22.82 2wvu s ALA 265 CO 0.25 0.14 0.78 -0.40 0.00 0.00 0.00 175.76 176.53 2wvu n ASP 266 N 3.03 0.81 -0.29 0.00 5.68 -0.04 -4.35 116.55 121.38 2wvu n ASP 266 Ca -0.15 -1.74 0.23 0.00 -0.50 0.00 0.00 54.79 52.64 2wvu n ASP 266 Cb 0.56 -0.52 0.54 0.00 -1.14 0.00 0.00 41.12 40.56 2wvu n ASP 266 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2wvu h ASP 267 N -0.60 0.38 -0.19 -1.12 3.45 -1.90 0.17 116.42 116.62 2wvu h ASP 267 Ca -0.26 0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.26 2wvu h ASP 267 Cb 0.89 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.65 2wvu h ASP 267 CO 0.25 0.10 0.00 0.29 -1.57 0.00 0.00 179.24 178.31 2wvu n LYS 268 N -4.54 1.60 -1.71 3.56 4.76 -1.26 -4.87 118.16 115.70 2wvu n LYS 268 Ca 0.23 -0.91 -0.09 0.00 -2.87 0.00 0.00 58.31 54.68 2wvu n LYS 268 Cb 0.86 -1.31 -0.02 0.00 -1.84 0.00 0.00 35.03 32.72 2wvu n LYS 268 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wvu n GLY 269 N 1.01 0.54 3.72 0.72 0.00 0.61 -5.01 105.19 106.78 2wvu n GLY 269 Ca 0.13 -0.58 -0.38 0.00 0.00 0.00 0.00 46.02 45.19 2wvu n GLY 269 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wvu s LYS 270 N -3.59 4.35 0.20 1.61 2.47 -1.25 -4.80 119.74 118.73 2wvu s LYS 270 Ca 0.00 0.52 0.07 0.00 -1.56 0.00 0.00 55.97 54.99 2wvu s LYS 270 Cb 0.00 -3.43 -0.04 0.00 -1.46 0.00 0.00 37.83 32.90 2wvu s LYS 270 CO 0.00 0.16 0.10 1.03 0.16 0.00 0.00 175.35 176.80 2wvu s ARG 271 N 0.59 2.71 0.00 4.03 0.52 -1.26 -0.86 118.95 124.67 2wvu s ARG 271 Ca 0.28 -1.04 0.00 0.00 -0.52 0.00 0.00 55.73 54.44 2wvu s ARG 271 Cb -0.16 -2.49 0.00 0.00 0.52 0.00 0.00 34.95 32.82 2wvu s ARG 271 CO 0.12 0.44 0.00 0.72 0.02 0.00 0.00 175.30 176.60 2wvu n HIS 272 N -0.56 0.00 -4.39 -0.53 8.25 -0.96 -4.66 115.22 112.37 2wvu n HIS 272 Ca -0.08 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.04 2wvu n HIS 272 Cb 0.56 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.55 2wvu n HIS 272 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2wvu s PHE 273 N 0.00 3.04 1.05 4.41 0.40 -1.26 0.14 117.98 125.76 2wvu s PHE 273 Ca 0.00 -0.24 -0.13 0.00 -0.60 0.00 0.00 56.93 55.96 2wvu s PHE 273 Cb 0.00 -1.95 0.22 0.00 0.51 0.00 0.00 43.02 41.80 2wvu s PHE 273 CO 0.00 0.01 1.08 0.16 0.70 0.00 0.00 175.22 177.18 2wvu s ASP 274 N 0.25 2.13 0.59 1.36 1.47 0.52 -4.78 116.67 118.21 2wvu s ASP 274 Ca -0.02 1.15 0.29 0.00 1.18 0.00 0.00 52.55 55.15 2wvu s ASP 274 Cb -0.14 -1.79 1.79 0.00 -0.34 0.00 0.00 42.92 42.44 2wvu s ASP 274 CO 0.03 -3.44 2.23 0.28 0.68 0.00 0.00 175.17 174.95 2wvu h SER 275 N -2.10 0.00 -0.33 2.11 0.02 -1.88 0.62 113.55 111.99 2wvu h SER 275 Ca -0.55 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.28 2wvu h SER 275 Cb 1.33 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.80 2wvu h SER 275 CO 0.55 0.00 0.15 0.59 -1.14 0.00 0.00 176.83 176.98 2wvu n ASN 276 N -3.84 3.13 -1.23 3.07 5.03 -1.26 -4.90 115.26 115.26 2wvu n ASN 276 Ca -0.02 -2.52 -0.16 0.00 0.87 0.00 0.00 54.58 52.74 2wvu n ASN 276 Cb 0.13 -0.61 -0.07 0.00 -1.02 0.00 0.00 39.78 38.21 2wvu n ASN 276 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wvu n GLY 277 N 0.02 1.55 3.75 7.41 0.00 0.22 -4.99 105.19 113.15 2wvu n GLY 277 Ca 0.18 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2wvu n GLY 277 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wvu s ARG 278 N -3.33 3.46 0.14 1.61 0.52 -1.21 -4.80 118.95 115.34 2wvu s ARG 278 Ca 0.00 -0.27 -0.31 0.00 -0.52 0.00 0.00 55.73 54.62 2wvu s ARG 278 Cb 0.00 -3.08 -0.10 0.00 0.52 0.00 0.00 34.95 32.29 2wvu s ARG 278 CO 0.00 0.61 1.69 -1.17 0.02 0.00 0.00 175.30 176.45 2wvu s LEU 279 N -0.59 4.38 0.12 2.53 2.96 -1.26 -0.35 118.68 126.46 2wvu s LEU 279 Ca 0.11 2.68 0.02 0.00 -0.22 0.00 0.00 54.13 56.72 2wvu s LEU 279 Cb -0.12 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 2wvu s LEU 279 CO 0.02 -0.92 0.25 -0.04 -1.32 0.00 0.00 176.35 174.35 2wvu s MET 280 N 1.88 3.42 1.78 1.98 -1.94 0.12 -4.49 119.30 122.06 2wvu s MET 280 Ca 0.75 -0.54 0.00 0.00 -1.71 0.00 0.00 55.69 54.18 2wvu s MET 280 Cb -0.45 -2.99 0.00 0.00 2.01 0.00 0.00 34.83 33.41 2wvu s MET 280 CO 0.33 0.55 0.00 0.41 -0.01 0.00 0.00 175.02 176.30 2wvu n GLY 281 N -0.22 -1.39 0.00 -0.03 0.00 -1.26 -3.80 105.19 98.50 2wvu n GLY 281 Ca -0.06 -1.27 0.09 0.00 0.00 0.00 0.00 46.02 44.78 2wvu n GLY 281 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wvu n ASP 282 N -0.23 0.79 -3.48 1.61 8.00 0.43 -4.70 116.55 118.97 2wvu n ASP 282 Ca 0.00 -0.51 -0.13 0.00 0.71 0.00 0.00 54.79 54.86 2wvu n ASP 282 Cb 0.00 1.39 -0.03 0.00 -0.02 0.00 0.00 41.12 42.45 2wvu n ASP 282 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2wvu s TYR 283 N -2.99 -0.52 -0.19 1.24 -0.85 -1.25 -4.54 117.35 108.25 2wvu s TYR 283 Ca 0.01 0.55 -0.21 0.00 -0.52 0.00 0.00 57.07 56.89 2wvu s TYR 283 Cb 0.13 0.50 -0.02 0.00 0.38 0.00 0.00 41.96 42.95 2wvu s TYR 283 CO 0.76 -0.68 0.66 -2.00 -1.52 0.00 0.00 175.55 172.77 2wvu s GLU 284 N -2.68 4.23 -0.18 -3.49 2.12 -0.34 -1.08 118.70 117.28 2wvu s GLU 284 Ca -0.02 0.68 -0.01 0.00 0.36 0.00 0.00 54.97 55.98 2wvu s GLU 284 Cb -0.01 -3.57 -0.00 0.00 0.26 0.00 0.00 34.13 30.81 2wvu s GLU 284 CO -0.05 -0.24 -0.12 -1.54 -0.54 0.00 0.00 175.26 172.77 2wvu s SER 285 N 1.17 3.81 0.00 -1.70 1.04 -1.26 -1.26 113.70 115.50 2wvu s SER 285 Ca 0.30 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.27 2wvu s SER 285 Cb -0.16 -1.61 0.00 0.00 0.10 0.00 0.00 66.02 64.35 2wvu s SER 285 CO 0.11 0.04 0.00 0.61 0.98 0.00 0.00 173.24 174.98 2wvu n GLY 286 N 4.38 -1.80 3.86 7.32 0.00 -1.26 -4.32 105.19 113.36 2wvu n GLY 286 Ca -0.19 0.64 -0.38 0.00 0.00 0.00 0.00 46.02 46.09 2wvu n GLY 286 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wvu n TYR 287 N 0.00 -1.68 -2.66 1.61 4.02 -1.26 -3.47 117.16 113.72 2wvu n TYR 287 Ca 0.00 0.28 -0.42 0.00 -0.01 0.00 0.00 57.90 57.76 2wvu n TYR 287 Cb 0.00 -3.14 -0.04 0.00 -0.02 0.00 0.00 39.34 36.14 2wvu n TYR 287 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2wvu s GLU 288 N -6.61 4.59 0.00 -0.72 8.01 -1.26 -4.02 118.70 118.68 2wvu s GLU 288 Ca 0.48 1.50 0.00 0.00 0.01 0.00 0.00 54.97 56.97 2wvu s GLU 288 Cb -0.21 -3.40 0.00 0.00 -4.31 0.00 0.00 34.13 26.20 2wvu s GLU 288 CO 0.91 0.02 0.00 0.54 0.01 0.00 0.00 175.26 176.74 2wvu n ARG 289 N 3.42 -1.20 -3.36 1.61 1.74 -1.26 -4.88 116.66 112.73 2wvu n ARG 289 Ca 0.05 0.29 -0.11 0.00 -0.77 0.00 0.00 57.85 57.31 2wvu n ARG 289 Cb 0.49 -4.73 -0.08 0.00 -1.02 0.00 0.00 32.46 27.13 2wvu n ARG 289 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2wvu s ARG 290 N -1.56 0.35 0.62 5.56 1.70 -1.26 -5.17 118.95 119.20 2wvu s ARG 290 Ca 0.00 0.31 -0.17 0.00 -0.47 0.00 0.00 55.73 55.40 2wvu s ARG 290 Cb 0.00 -0.52 -0.02 0.00 -0.57 0.00 0.00 34.95 33.84 2wvu s ARG 290 CO 0.00 -0.80 1.13 -0.51 -1.08 0.00 0.00 175.30 174.04 2wvu s LEU 291 N 2.50 3.53 0.23 -1.89 1.43 -1.26 -4.68 118.68 118.54 2wvu s LEU 291 Ca 0.11 2.13 -0.31 0.00 -1.03 0.00 0.00 54.13 55.03 2wvu s LEU 291 Cb -0.14 -4.57 -0.14 0.00 0.03 0.00 0.00 46.19 41.37 2wvu s LEU 291 CO -0.22 -1.55 1.34 -2.65 0.23 0.00 0.00 176.35 173.50 2wvu n PRO 292 N -1.99 1.83 -2.13 1.29 -0.02 -1.26 -4.93 135.00 127.79 2wvu n PRO 292 Ca 0.11 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.82 2wvu n PRO 292 Cb 0.51 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.70 2wvu n PRO 292 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2wvu s ASP 293 N 0.17 6.77 0.02 2.55 2.15 -1.26 -4.91 116.67 122.17 2wvu s ASP 293 Ca 0.68 2.29 0.12 0.00 0.43 0.00 0.00 52.55 56.07 2wvu s ASP 293 Cb -0.69 -2.57 0.52 0.00 -0.30 0.00 0.00 42.92 39.88 2wvu s ASP 293 CO 0.51 -0.74 1.38 -2.65 -0.17 0.00 0.00 175.17 173.50 2wvu n PRO 294 N 4.92 0.02 -0.11 4.34 -0.02 -1.26 -1.49 135.00 141.39 2wvu n PRO 294 Ca 0.13 0.32 -0.23 0.00 -2.02 0.00 0.00 63.50 61.71 2wvu n PRO 294 Cb 0.42 -1.53 -0.08 0.00 -0.02 0.00 0.00 33.50 32.29 2wvu n PRO 294 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wvu n VAL 295 N -1.56 1.23 0.09 -1.45 0.31 -1.26 -4.62 118.33 111.06 2wvu n VAL 295 Ca 0.03 -0.34 0.11 0.00 -0.01 0.00 0.00 64.34 64.13 2wvu n VAL 295 Cb 0.13 -1.70 -0.04 0.00 -0.91 0.00 0.00 33.84 31.32 2wvu n VAL 295 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2wvu n LYS 296 N -3.85 0.61 -1.50 5.55 5.02 -1.19 -4.39 118.16 118.42 2wvu n LYS 296 Ca -0.43 0.05 -0.22 0.00 -2.02 0.00 0.00 58.31 55.69 2wvu n LYS 296 Cb 0.83 -1.76 0.09 0.00 -0.02 0.00 0.00 35.03 34.17 2wvu n LYS 296 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2wvu n ASP 297 N -2.58 4.99 0.09 4.39 8.00 -0.56 -4.75 116.55 126.12 2wvu n ASP 297 Ca -0.01 -3.77 0.10 0.00 0.71 0.00 0.00 54.79 51.82 2wvu n ASP 297 Cb 0.55 -0.60 0.43 0.00 -0.02 0.00 0.00 41.12 41.48 2wvu n ASP 297 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2wvu n LEU 298 N -0.88 0.44 -0.27 0.64 4.77 -1.26 -2.50 117.00 117.94 2wvu n LEU 298 Ca 0.46 0.61 0.26 0.00 -0.03 0.00 0.00 56.01 57.31 2wvu n LEU 298 Cb 0.91 -0.55 0.61 0.00 -2.33 0.00 0.00 43.42 42.06 2wvu n LEU 298 CO 0.45 -0.47 1.25 0.07 -1.33 0.00 0.00 177.39 177.37 2wvu h LYS 299 N 0.00 0.21 0.00 3.23 2.10 -1.96 -1.44 116.57 118.71 2wvu h LYS 299 Ca 0.00 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 2wvu h LYS 299 Cb 0.32 -0.05 -0.00 0.00 -0.90 0.00 0.00 32.23 31.60 2wvu h LYS 299 CO 0.00 0.14 -0.04 -0.39 -2.00 0.00 0.00 179.45 177.16 2wvu h VAL 300 N 0.22 0.54 0.00 0.07 -1.51 -1.84 -1.15 116.25 112.58 2wvu h VAL 300 Ca 0.52 -0.18 0.00 0.00 -1.23 0.00 0.00 66.70 65.81 2wvu h VAL 300 Cb 1.63 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 31.91 2wvu h VAL 300 CO -0.14 0.04 0.00 0.35 -1.23 0.00 0.00 177.57 176.59 2wvu n THR 301 N -3.77 1.51 0.49 7.19 -2.24 -0.54 -2.25 114.28 114.67 2wvu n THR 301 Ca -0.03 0.38 0.12 0.00 -2.27 0.00 0.00 64.05 62.26 2wvu n THR 301 Cb 0.13 -1.26 0.22 0.00 -2.10 0.00 0.00 70.33 67.32 2wvu n THR 301 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2wvu h GLN 302 N 0.00 0.00 -5.08 -0.78 4.20 -1.40 -3.47 115.11 108.59 2wvu h GLN 302 Ca 0.00 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.36 2wvu h GLN 302 Cb 0.12 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.76 2wvu h GLN 302 CO 0.00 0.00 -0.69 1.67 -0.67 0.00 0.00 178.83 179.14 2wvu s TRP 303 N -3.17 1.40 0.51 2.96 -2.14 -0.95 -4.64 118.94 112.89 2wvu s TRP 303 Ca 0.07 -0.83 -0.22 0.00 2.66 0.00 0.00 56.10 57.77 2wvu s TRP 303 Cb 0.12 -0.76 -0.06 0.00 -3.10 0.00 0.00 33.47 29.67 2wvu s TRP 303 CO 0.69 0.02 1.23 -0.51 -2.66 0.00 0.00 176.95 175.72 2wvu s ASP 304 N -3.23 5.75 0.21 -2.66 1.01 -1.26 -4.92 116.67 111.57 2wvu s ASP 304 Ca 0.22 2.46 -0.21 0.00 0.71 0.00 0.00 52.55 55.73 2wvu s ASP 304 Cb 0.04 -2.61 0.04 0.00 1.01 0.00 0.00 42.92 41.40 2wvu s ASP 304 CO 0.04 -1.22 0.62 -1.66 0.21 0.00 0.00 175.17 173.16 2wvu s TRP 305 N -1.48 -0.29 -0.20 4.23 1.48 -1.26 -1.19 118.94 120.22 2wvu s TRP 305 Ca 0.68 -0.05 -0.10 0.00 -1.06 0.00 0.00 56.10 55.57 2wvu s TRP 305 Cb -0.32 0.57 0.07 0.00 -1.16 0.00 0.00 33.47 32.63 2wvu s TRP 305 CO 0.38 -1.01 0.48 -2.00 -4.06 0.00 0.00 176.95 170.74 2wvu s GLU 306 N -3.85 0.45 -0.05 3.25 2.12 -0.39 -1.38 118.70 118.85 2wvu s GLU 306 Ca 0.07 0.96 -0.00 0.00 0.36 0.00 0.00 54.97 56.36 2wvu s GLU 306 Cb -0.03 0.13 -0.03 0.00 0.26 0.00 0.00 34.13 34.46 2wvu s GLU 306 CO -0.03 -0.18 -0.01 0.00 -0.54 0.00 0.00 175.26 174.50 2wvu s ALA 307 N 1.78 3.22 -0.03 6.30 0.00 -0.71 -4.19 121.76 128.13 2wvu s ALA 307 Ca -0.08 -0.87 0.07 0.00 0.00 0.00 0.00 51.96 51.08 2wvu s ALA 307 Cb -0.09 -1.38 -0.02 0.00 0.00 0.00 0.00 23.12 21.63 2wvu s ALA 307 CO -0.14 0.60 -0.24 0.00 0.00 0.00 0.00 175.76 175.98 2wvu s MET 309 N -0.46 0.70 0.26 0.00 0.23 0.24 -4.36 119.30 115.92 2wvu s MET 309 Ca 0.06 -0.95 0.01 0.00 -1.03 0.00 0.00 55.69 53.79 2wvu s MET 309 Cb -0.10 -0.48 -0.04 0.00 -1.53 0.00 0.00 34.83 32.68 2wvu s MET 309 CO 0.00 0.09 0.44 0.95 -2.03 0.00 0.00 175.02 174.47 2wvu s THR 310 N -1.77 5.18 -0.15 3.16 -4.23 -1.26 -1.27 115.64 115.29 2wvu s THR 310 Ca -0.03 -0.53 -0.25 0.00 -1.18 0.00 0.00 61.69 59.70 2wvu s THR 310 Cb -0.07 -3.81 -0.24 0.00 1.34 0.00 0.00 72.50 69.72 2wvu s THR 310 CO 0.00 -0.35 0.57 0.40 -0.54 0.00 0.00 174.62 174.70 2wvu h ILE 311 N 1.17 1.41 -2.82 2.99 2.04 -1.80 -3.45 117.51 117.04 2wvu h ILE 311 Ca -0.50 -2.31 -0.22 0.00 1.00 0.00 0.00 64.86 62.84 2wvu h ILE 311 Cb 1.21 2.92 0.09 0.00 -0.74 0.00 0.00 36.82 40.30 2wvu h ILE 311 CO 0.64 0.52 0.18 -0.81 0.00 0.00 0.00 178.15 178.68 2wvu n PRO 312 N -4.46 -1.05 0.00 2.37 -0.05 -1.26 -0.96 135.00 129.59 2wvu n PRO 312 Ca -0.19 -1.02 -0.11 0.00 -0.05 0.00 0.00 63.50 62.13 2wvu n PRO 312 Cb 0.61 -0.74 -0.05 0.00 -0.05 0.00 0.00 33.50 33.26 2wvu n PRO 312 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 175.50 176.94 2wvu h GLU 313 N 0.00 0.12 -0.28 0.54 4.81 -1.71 -3.40 114.58 114.65 2wvu h GLU 313 Ca -0.22 -0.01 -0.26 0.00 -0.13 0.00 0.00 59.36 58.74 2wvu h GLU 313 Cb 0.62 -0.03 -0.21 0.00 0.63 0.00 0.00 28.75 29.76 2wvu h GLU 313 CO 0.15 0.09 -0.57 -1.71 -0.73 0.00 0.00 179.01 176.24 2wvu n ASN 314 N -5.02 -1.16 -4.10 1.04 5.15 -1.26 -4.84 115.26 105.08 2wvu n ASN 314 Ca -0.05 -2.67 -0.33 0.00 -0.60 0.00 0.00 54.58 50.93 2wvu n ASN 314 Cb 0.03 0.74 -0.15 0.00 -0.53 0.00 0.00 39.78 39.86 2wvu n ASN 314 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2wvu s GLN 315 N -0.58 2.62 -0.18 1.20 -1.52 -1.26 -3.79 119.66 116.14 2wvu s GLN 315 Ca 0.24 -1.09 -0.15 0.00 -1.95 0.00 0.00 55.36 52.40 2wvu s GLN 315 Cb 0.40 -2.74 -0.07 0.00 -0.22 0.00 0.00 33.01 30.38 2wvu s GLN 315 CO -0.06 -0.39 -0.27 0.91 -0.25 0.00 0.00 175.29 175.23 2wvu n TRP 316 N 4.53 0.32 -1.42 0.91 7.02 -1.26 -4.57 117.44 122.98 2wvu n TRP 316 Ca -0.17 0.14 -0.30 0.00 -1.02 0.00 0.00 57.50 56.15 2wvu n TRP 316 Cb 0.46 -0.67 0.11 0.00 -2.42 0.00 0.00 31.31 28.79 2wvu n TRP 316 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2wvu s GLY 317 N -4.78 1.62 -0.04 6.99 0.00 -1.26 -3.87 107.32 105.97 2wvu s GLY 317 Ca -0.26 -0.15 -0.34 0.00 0.00 0.00 0.00 44.72 43.97 2wvu s GLY 317 CO 0.39 0.30 1.84 2.98 0.00 0.00 0.00 173.10 178.60 2wvu n TYR 318 N -3.61 2.34 -4.86 1.90 9.36 -1.26 -4.66 117.16 116.38 2wvu n TYR 318 Ca 0.07 0.01 -0.33 0.00 3.32 0.00 0.00 57.90 60.98 2wvu n TYR 318 Cb 0.56 -2.66 -0.16 0.00 -0.63 0.00 0.00 39.34 36.46 2wvu n TYR 318 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2wvu s HIS 319 N 3.56 2.70 0.46 2.98 5.65 -1.26 -4.29 115.29 125.10 2wvu s HIS 319 Ca 0.90 -0.95 0.28 0.00 0.25 0.00 0.00 55.06 55.54 2wvu s HIS 319 Cb -0.67 -1.81 1.54 0.00 -1.18 0.00 0.00 32.58 30.46 2wvu s HIS 319 CO 0.49 -0.39 2.12 1.57 -0.65 0.00 0.00 174.74 177.88 2wvu h LYS 320 N 6.92 0.00 -4.33 2.88 2.10 -1.65 -3.39 116.57 119.09 2wvu h LYS 320 Ca -0.26 0.00 -0.65 0.00 -2.00 0.00 0.00 60.65 57.75 2wvu h LYS 320 Cb 1.21 0.00 -0.40 0.00 -0.90 0.00 0.00 32.23 32.14 2wvu h LYS 320 CO 0.53 0.09 -0.71 0.34 -2.00 0.00 0.00 179.45 177.70 2wvu s ASP 321 N -6.18 4.59 0.19 7.07 -1.08 -1.26 -4.95 116.67 115.05 2wvu s ASP 321 Ca -0.03 -2.24 0.25 0.00 -0.52 0.00 0.00 52.55 50.01 2wvu s ASP 321 Cb 0.14 -1.53 0.62 0.00 -1.46 0.00 0.00 42.92 40.69 2wvu s ASP 321 CO 0.58 -0.36 1.61 -0.50 0.52 0.00 0.00 175.17 177.02 2wvu h TRP 322 N 7.48 0.00 0.00 -5.34 4.06 -1.96 -3.28 115.95 116.92 2wvu h TRP 322 Ca -0.06 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.89 2wvu h TRP 322 Cb 1.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.16 2wvu h TRP 322 CO 0.46 0.00 0.00 -1.13 -3.56 0.00 0.00 178.44 174.21 2wvu n SER 323 N -2.27 0.00 0.06 -3.49 3.41 -1.26 -3.27 113.62 106.79 2wvu n SER 323 Ca 0.05 0.01 0.11 0.00 -0.26 0.00 0.00 58.87 58.78 2wvu n SER 323 Cb 0.44 -0.27 0.44 0.00 -0.26 0.00 0.00 64.21 64.56 2wvu n SER 323 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wvu n LEU 324 N -1.27 0.32 -3.88 1.04 4.77 -1.24 -4.88 117.00 111.86 2wvu n LEU 324 Ca 0.08 0.56 -0.10 0.00 -0.03 0.00 0.00 56.01 56.53 2wvu n LEU 324 Cb 0.13 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 2wvu n LEU 324 CO 0.13 -0.29 0.43 -0.94 -1.33 0.00 0.00 177.39 175.39 2wvu s SER 325 N -3.61 0.18 0.04 -1.43 1.04 -1.20 -5.10 113.70 103.62 2wvu s SER 325 Ca 0.08 -1.17 -0.30 0.00 0.48 0.00 0.00 55.95 55.04 2wvu s SER 325 Cb 0.12 0.79 -0.05 0.00 0.10 0.00 0.00 66.02 66.98 2wvu s SER 325 CO 0.40 -1.56 1.18 -0.47 0.98 0.00 0.00 173.24 173.76 2wvu s TYR 326 N -2.65 3.43 -0.27 5.02 5.04 -1.26 -4.81 117.35 121.84 2wvu s TYR 326 Ca 0.18 1.33 -0.09 0.00 -2.44 0.00 0.00 57.07 56.05 2wvu s TYR 326 Cb -0.04 -3.39 -0.04 0.00 0.35 0.00 0.00 41.96 38.84 2wvu s TYR 326 CO 0.13 -1.15 0.14 0.08 -1.34 0.00 0.00 175.55 173.40 2wvu s VAL 327 N 1.21 4.89 0.47 3.14 1.01 -1.26 -1.98 120.40 127.88 2wvu s VAL 327 Ca 0.58 0.03 -0.24 0.00 0.00 0.00 0.00 61.98 62.35 2wvu s VAL 327 Cb -0.28 -3.31 -0.07 0.00 0.00 0.00 0.00 36.38 32.72 2wvu s VAL 327 CO 0.28 0.29 1.28 -0.54 0.00 0.00 0.00 175.10 176.42 2wvu s LYS 328 N 1.67 3.64 0.62 2.72 1.02 -0.14 -4.98 119.74 124.28 2wvu s LYS 328 Ca 0.07 2.07 -0.08 0.00 0.02 0.00 0.00 55.97 58.05 2wvu s LYS 328 Cb -0.16 -2.49 0.00 0.00 -0.52 0.00 0.00 37.83 34.67 2wvu s LYS 328 CO 0.08 -0.74 0.96 0.95 -0.92 0.00 0.00 175.35 175.68 2wvu s THR 329 N -1.36 3.85 0.22 2.17 -4.23 -1.26 -4.93 115.64 110.10 2wvu s THR 329 Ca 0.64 0.27 -0.08 0.00 -1.18 0.00 0.00 61.69 61.33 2wvu s THR 329 Cb -0.36 -3.55 0.17 0.00 1.34 0.00 0.00 72.50 70.10 2wvu s THR 329 CO 0.44 -0.63 1.84 -0.65 -0.54 0.00 0.00 174.62 175.08 2wvu h PRO 330 N -0.30 0.83 -0.79 3.99 0.11 -1.96 -1.56 132.00 132.32 2wvu h PRO 330 Ca -0.45 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 2wvu h PRO 330 Cb 1.24 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 2wvu h PRO 330 CO 0.62 0.55 0.39 0.82 -0.21 0.00 0.00 178.00 180.16 2wvu h ILE 331 N 0.85 1.24 -0.46 4.15 2.04 -1.98 0.14 117.51 123.49 2wvu h ILE 331 Ca 0.33 -0.67 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 2wvu h ILE 331 Cb 0.14 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 2wvu h ILE 331 CO -0.16 0.29 0.12 -0.33 0.00 0.00 0.00 178.15 178.07 2wvu h GLU 332 N 1.12 0.69 -0.18 2.37 5.08 -1.78 0.35 114.58 122.22 2wvu h GLU 332 Ca 0.27 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.41 2wvu h GLU 332 Cb 0.10 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2wvu h GLU 332 CO -0.04 0.62 -0.27 0.28 -1.00 0.00 0.00 179.01 178.60 2wvu h VAL 333 N 0.67 1.34 -0.94 3.13 2.07 -0.57 -2.87 116.25 119.07 2wvu h VAL 333 Ca 0.15 -1.49 0.03 0.00 0.82 0.00 0.00 66.70 66.21 2wvu h VAL 333 Cb 0.24 1.87 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 2wvu h VAL 333 CO -0.00 0.45 0.62 0.40 0.02 0.00 0.00 177.57 179.05 2wvu h ILE 334 N 0.15 1.19 -0.48 4.57 2.04 -0.28 -0.19 117.51 124.52 2wvu h ILE 334 Ca 0.02 -0.42 0.07 0.00 1.00 0.00 0.00 64.86 65.53 2wvu h ILE 334 Cb 0.85 -0.14 -0.06 0.00 -0.74 0.00 0.00 36.82 36.73 2wvu h ILE 334 CO 0.06 0.22 0.13 -0.78 0.00 0.00 0.00 178.15 177.78 2wvu h ASP 335 N 1.22 0.08 -0.61 1.72 3.58 -0.37 -0.27 116.42 121.77 2wvu h ASP 335 Ca 0.36 0.07 -0.08 0.00 0.42 0.00 0.00 57.03 57.80 2wvu h ASP 335 Cb -0.05 0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 2wvu h ASP 335 CO -0.10 0.07 0.06 0.03 -2.88 0.00 0.00 179.24 176.42 2wvu h ARG 336 N 0.28 1.06 0.17 0.28 3.08 -1.08 -0.25 114.38 117.91 2wvu h ARG 336 Ca 0.24 -0.30 0.01 0.00 0.07 0.00 0.00 59.98 59.99 2wvu h ARG 336 Cb 0.28 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 2wvu h ARG 336 CO -0.28 0.99 -0.21 0.82 -1.07 0.00 0.00 179.97 180.23 2wvu h ILE 337 N 0.98 0.54 -0.33 2.04 2.04 -0.61 -1.69 117.51 120.48 2wvu h ILE 337 Ca 0.19 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.02 2wvu h ILE 337 Cb 0.48 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 2wvu h ILE 337 CO 0.02 0.00 0.09 0.58 0.00 0.00 0.00 178.15 178.84 2wvu h VAL 338 N -0.43 1.21 -0.77 1.67 2.07 -0.93 -2.76 116.25 116.32 2wvu h VAL 338 Ca 0.01 -0.70 0.14 0.00 0.82 0.00 0.00 66.70 66.97 2wvu h VAL 338 Cb 0.42 1.04 -0.14 0.00 -1.52 0.00 0.00 31.29 31.09 2wvu h VAL 338 CO -0.07 0.24 -0.28 -0.74 0.02 0.00 0.00 177.57 176.74 2wvu h HIS 339 N 0.38 -0.71 0.07 1.57 6.17 -0.94 0.85 115.15 122.55 2wvu h HIS 339 Ca 0.11 0.08 -0.00 0.00 0.71 0.00 0.00 60.37 61.26 2wvu h HIS 339 Cb 0.27 0.43 0.00 0.00 2.52 0.00 0.00 27.41 30.63 2wvu h HIS 339 CO 0.01 -0.37 -0.03 0.00 0.71 0.00 0.00 177.93 178.25 2wvu h ALA 340 N 1.46 -0.09 -0.94 5.26 0.00 -1.10 -2.70 119.26 121.15 2wvu h ALA 340 Ca 0.33 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2wvu h ALA 340 Cb 0.58 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2wvu h ALA 340 CO -0.81 -0.52 0.60 0.28 0.00 0.00 0.00 179.25 178.81 2wvu h VAL 341 N -0.16 1.25 0.00 0.00 2.07 -1.19 0.28 116.25 118.50 2wvu h VAL 341 Ca -0.01 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2wvu h VAL 341 Cb 0.14 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 29.79 2wvu h VAL 341 CO 0.02 0.25 0.00 0.77 0.02 0.00 0.00 177.57 178.62 2wvu h SER 342 N 1.28 0.00 -0.14 0.57 4.64 -0.52 -0.20 113.55 119.18 2wvu h SER 342 Ca 0.34 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.66 2wvu h SER 342 Cb -0.11 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.98 2wvu h SER 342 CO -0.07 0.00 -0.00 0.23 -0.87 0.00 0.00 176.83 176.12 2wvu n MET 343 N -2.93 2.15 -1.23 4.77 2.81 -0.71 -3.95 117.12 118.02 2wvu n MET 343 Ca -0.02 -2.73 -0.01 0.00 -1.81 0.00 0.00 57.70 53.12 2wvu n MET 343 Cb 0.09 -1.69 -0.00 0.00 -0.71 0.00 0.00 33.22 30.91 2wvu n MET 343 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wvu n GLY 344 N -0.95 0.43 3.64 3.03 0.00 -0.09 -4.11 105.19 107.14 2wvu n GLY 344 Ca 0.19 -1.01 -0.24 0.00 0.00 0.00 0.00 46.02 44.96 2wvu n GLY 344 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wvu s GLY 345 N -2.98 2.04 0.45 -0.02 0.00 0.92 -4.33 107.32 103.40 2wvu s GLY 345 Ca 0.00 -1.94 -0.04 0.00 0.00 0.00 0.00 44.72 42.74 2wvu s GLY 345 CO 0.00 -1.88 0.73 -1.31 0.00 0.00 0.00 173.10 170.64 2wvu s ASN 346 N -3.72 6.23 -0.04 1.64 -0.87 -0.48 -2.62 114.94 115.08 2wvu s ASN 346 Ca 0.35 0.79 0.02 0.00 -1.57 0.00 0.00 52.86 52.45 2wvu s ASN 346 Cb -0.01 -2.15 0.01 0.00 -0.02 0.00 0.00 41.25 39.08 2wvu s ASN 346 CO 0.20 -0.54 -0.08 -0.32 -2.57 0.00 0.00 177.10 173.78 2wvu s MET 347 N -4.65 1.05 -0.14 -0.60 -2.45 -0.25 -1.74 119.30 110.51 2wvu s MET 347 Ca 0.46 -0.28 0.01 0.00 -1.25 0.00 0.00 55.69 54.63 2wvu s MET 347 Cb -0.10 -0.96 0.02 0.00 1.25 0.00 0.00 34.83 35.03 2wvu s MET 347 CO 0.43 0.06 -0.16 0.08 1.05 0.00 0.00 175.02 176.47 2wvu s VAL 348 N 0.43 1.68 -0.30 10.11 1.01 0.33 -1.62 120.40 132.04 2wvu s VAL 348 Ca -0.07 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.04 2wvu s VAL 348 Cb -0.11 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 2wvu s VAL 348 CO 0.01 0.48 0.38 -0.69 0.00 0.00 0.00 175.10 175.27 2wvu s VAL 349 N 1.22 5.16 0.24 2.92 1.01 -0.47 -0.59 120.40 129.89 2wvu s VAL 349 Ca -0.00 0.39 -0.29 0.00 0.00 0.00 0.00 61.98 62.08 2wvu s VAL 349 Cb -0.14 -3.75 -0.09 0.00 0.00 0.00 0.00 36.38 32.40 2wvu s VAL 349 CO -0.07 0.06 0.91 0.21 0.00 0.00 0.00 175.10 176.21 2wvu s ASN 350 N 1.68 7.57 -0.02 3.32 2.47 -0.40 -0.36 114.94 129.21 2wvu s ASN 350 Ca 0.14 1.88 0.06 0.00 0.42 0.00 0.00 52.86 55.37 2wvu s ASN 350 Cb -0.16 -2.59 -0.02 0.00 -1.45 0.00 0.00 41.25 37.04 2wvu s ASN 350 CO 0.11 0.15 -0.21 -0.36 -3.72 0.00 0.00 177.10 173.07 2wvu s PHE 351 N -1.22 1.85 -0.66 0.43 0.08 0.96 -4.46 117.98 114.96 2wvu s PHE 351 Ca 0.41 -0.36 0.00 0.00 0.12 0.00 0.00 56.93 57.10 2wvu s PHE 351 Cb -0.25 -1.19 0.17 0.00 -0.57 0.00 0.00 43.02 41.17 2wvu s PHE 351 CO 0.30 -0.04 0.47 0.20 -0.10 0.00 0.00 175.22 176.05 2wvu s GLY 352 N -0.45 2.67 0.64 4.36 0.00 -1.25 -1.77 107.32 111.52 2wvu s GLY 352 Ca 0.07 -3.47 -0.18 0.00 0.00 0.00 0.00 44.72 41.15 2wvu s GLY 352 CO -0.01 1.09 1.19 -1.05 0.00 0.00 0.00 173.10 174.33 2wvu n PRO 353 N 2.95 1.02 -0.95 2.90 -0.02 -1.25 -4.09 135.00 135.57 2wvu n PRO 353 Ca 0.11 0.40 -0.30 0.00 -2.02 0.00 0.00 63.50 61.70 2wvu n PRO 353 Cb 0.36 -2.42 0.17 0.00 -0.02 0.00 0.00 33.50 31.58 2wvu n PRO 353 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2wvu s GLN 354 N -3.22 0.71 0.48 -0.52 -0.21 0.58 -4.45 119.66 113.04 2wvu s GLN 354 Ca 0.81 0.98 0.16 0.00 0.02 0.00 0.00 55.36 57.33 2wvu s GLN 354 Cb -0.39 -1.73 1.17 0.00 1.00 0.00 0.00 33.01 33.06 2wvu s GLN 354 CO 0.42 -2.66 2.07 0.00 -2.12 0.00 0.00 175.29 173.00 2wvu h ALA 355 N -1.86 1.77 -0.00 6.09 0.00 -1.86 -2.48 119.26 120.92 2wvu h ALA 355 Ca -0.51 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2wvu h ALA 355 Cb 1.29 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2wvu h ALA 355 CO 0.51 0.13 -0.07 -0.40 0.00 0.00 0.00 179.25 179.41 2wvu n ASP 356 N -4.34 0.30 0.00 0.00 5.68 -1.26 -3.97 116.55 112.96 2wvu n ASP 356 Ca -0.03 -0.44 0.00 0.00 -0.50 0.00 0.00 54.79 53.82 2wvu n ASP 356 Cb 0.18 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.02 2wvu n ASP 356 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wvu n GLY 357 N 1.27 0.69 3.93 6.12 0.00 -0.93 0.65 105.19 116.93 2wvu n GLY 357 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 2wvu n GLY 357 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wvu s ASP 358 N -2.67 5.16 -0.11 1.61 2.15 -1.26 -3.96 116.67 117.59 2wvu s ASP 358 Ca 0.00 -0.73 -0.03 0.00 0.43 0.00 0.00 52.55 52.22 2wvu s ASP 358 Cb 0.00 -0.37 -0.03 0.00 -0.30 0.00 0.00 42.92 42.22 2wvu s ASP 358 CO 0.00 -0.82 -0.00 -0.36 -0.17 0.00 0.00 175.17 173.82 2wvu s PHE 359 N -2.50 3.13 0.67 -5.34 0.08 -1.26 -0.31 117.98 112.45 2wvu s PHE 359 Ca 0.50 0.06 -0.17 0.00 0.12 0.00 0.00 56.93 57.44 2wvu s PHE 359 Cb -0.05 -1.86 -0.02 0.00 -0.57 0.00 0.00 43.02 40.52 2wvu s PHE 359 CO 0.30 0.30 0.97 2.89 -0.10 0.00 0.00 175.22 179.58 2wvu n ARG 360 N 2.66 0.70 -0.29 0.44 1.85 -1.26 -4.77 116.66 115.98 2wvu n ARG 360 Ca -0.18 0.29 0.12 0.00 -1.00 0.00 0.00 57.85 57.08 2wvu n ARG 360 Cb 0.53 -2.20 0.37 0.00 -1.05 0.00 0.00 32.46 30.11 2wvu n ARG 360 CO 0.00 0.00 0.00 -1.35 -0.01 0.00 0.00 177.63 176.27 2wvu h PRO 361 N 0.10 0.69 -0.19 2.89 0.11 -2.00 -1.83 132.00 131.76 2wvu h PRO 361 Ca -0.48 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.49 2wvu h PRO 361 Cb 1.35 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2wvu h PRO 361 CO 0.49 0.46 -0.30 0.93 -0.21 0.00 0.00 178.00 179.37 2wvu h GLU 362 N 0.71 0.38 -0.14 1.05 3.07 -2.00 -2.08 114.58 115.57 2wvu h GLU 362 Ca 0.48 -0.15 -0.20 0.00 -0.50 0.00 0.00 59.36 58.99 2wvu h GLU 362 Cb 0.77 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 28.67 2wvu h GLU 362 CO -0.24 0.64 -0.69 0.93 -1.40 0.00 0.00 179.01 178.25 2wvu h GLU 363 N 0.33 0.72 -0.53 2.33 5.08 -1.70 -1.05 114.58 119.76 2wvu h GLU 363 Ca 0.05 -0.58 -0.00 0.00 -1.00 0.00 0.00 59.36 57.82 2wvu h GLU 363 Cb 0.69 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.04 2wvu h GLU 363 CO 0.05 1.20 0.32 0.87 -1.00 0.00 0.00 179.01 180.45 2wvu h LYS 364 N 0.41 0.72 -0.50 2.33 1.57 -1.38 -0.65 116.57 119.07 2wvu h LYS 364 Ca -0.05 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 2wvu h LYS 364 Cb 1.33 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 2wvu h LYS 364 CO 0.14 0.53 0.26 0.00 -0.57 0.00 0.00 179.45 179.81 2wvu h ALA 365 N 1.16 0.64 -0.14 3.86 0.00 -1.35 -1.92 119.26 121.52 2wvu h ALA 365 Ca 0.19 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2wvu h ALA 365 Cb -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2wvu h ALA 365 CO -0.04 0.19 0.07 1.98 0.00 0.00 0.00 179.25 181.45 2wvu h MET 366 N 0.67 0.14 -0.35 0.00 1.85 -1.00 0.12 114.93 116.36 2wvu h MET 366 Ca 0.17 -0.01 -0.00 0.00 -0.61 0.00 0.00 59.70 59.25 2wvu h MET 366 Cb 0.09 -0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.07 2wvu h MET 366 CO -0.02 0.09 0.20 0.00 -0.40 0.00 0.00 176.91 176.78 2wvu h ALA 367 N 1.07 0.45 -0.67 0.39 0.00 -1.01 -1.06 119.26 118.43 2wvu h ALA 367 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wvu h ALA 367 Cb 0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2wvu h ALA 367 CO -0.04 -0.04 0.43 1.15 0.00 0.00 0.00 179.25 180.75 2wvu h THR 368 N 0.45 1.18 -0.23 0.00 2.02 -1.24 -0.13 112.91 114.96 2wvu h THR 368 Ca 0.12 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 66.92 2wvu h THR 368 Cb 0.03 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 2wvu h THR 368 CO -0.02 0.18 0.05 0.00 0.37 0.00 0.00 175.52 176.10 2wvu h ALA 369 N 1.23 0.30 -0.57 6.16 0.00 -0.60 -1.39 119.26 124.39 2wvu h ALA 369 Ca 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2wvu h ALA 369 Cb -0.07 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2wvu h ALA 369 CO -0.05 -0.04 0.27 0.82 0.00 0.00 0.00 179.25 180.26 2wvu h ILE 370 N 0.18 1.21 -0.96 0.00 2.04 -1.11 -2.65 117.51 116.22 2wvu h ILE 370 Ca 0.07 -0.58 0.06 0.00 1.00 0.00 0.00 64.86 65.41 2wvu h ILE 370 Cb 0.30 0.54 -0.06 0.00 -0.74 0.00 0.00 36.82 36.85 2wvu h ILE 370 CO 0.00 0.23 0.62 1.23 0.00 0.00 0.00 178.15 180.24 2wvu h GLY 371 N 0.78 1.43 1.04 5.37 0.00 -0.80 0.77 103.07 111.66 2wvu h GLY 371 Ca 0.20 -0.45 -0.14 0.00 0.00 0.00 0.00 47.33 46.93 2wvu h GLY 371 CO -0.02 0.33 -0.38 0.50 0.00 0.00 0.00 176.54 176.97 2wvu h LYS 372 N 1.12 0.79 -0.43 4.80 1.57 -1.06 -1.34 116.57 122.01 2wvu h LYS 372 Ca 0.41 -0.45 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 2wvu h LYS 372 Cb 0.17 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2wvu h LYS 372 CO -0.16 1.08 -0.20 2.35 -0.57 0.00 0.00 179.45 181.94 2wvu h TRP 373 N 0.56 1.04 -0.13 -1.35 7.01 -1.11 -3.04 115.95 118.92 2wvu h TRP 373 Ca 0.04 -0.26 -0.08 0.00 2.11 0.00 0.00 58.89 60.70 2wvu h TRP 373 Cb 0.97 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.77 2wvu h TRP 373 CO 0.07 1.05 -0.28 0.52 -2.79 0.00 0.00 178.44 177.01 2wvu h MET 374 N 0.73 0.25 -0.38 2.65 2.86 -0.75 0.27 114.93 120.55 2wvu h MET 374 Ca 0.10 -0.09 -0.08 0.00 -2.06 0.00 0.00 59.70 57.57 2wvu h MET 374 Cb 0.77 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 2wvu h MET 374 CO 0.06 0.52 -0.10 -0.97 1.06 0.00 0.00 176.91 177.47 2wvu h ASN 375 N 0.22 0.65 0.15 1.22 -1.24 -1.17 0.49 115.58 115.90 2wvu h ASN 375 Ca 0.03 -0.18 -0.31 0.00 0.71 0.00 0.00 56.30 56.55 2wvu h ASN 375 Cb 0.62 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 39.50 2wvu h ASN 375 CO 0.04 0.78 -1.55 -0.09 -1.29 0.00 0.00 177.43 175.32 2wvu h ARG 376 N 0.61 0.32 -0.05 6.67 2.43 -1.33 -3.41 114.38 119.62 2wvu h ARG 376 Ca 0.11 -0.55 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 2wvu h ARG 376 Cb 0.53 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2wvu h ARG 376 CO 0.03 1.26 0.00 0.66 -1.51 0.00 0.00 179.97 180.41 2wvu n TYR 377 N -3.77 0.05 0.14 2.20 4.01 0.91 -4.75 117.16 115.94 2wvu n TYR 377 Ca -0.24 -0.07 0.08 0.00 -0.16 0.00 0.00 57.90 57.50 2wvu n TYR 377 Cb 0.98 -0.00 0.42 0.00 -0.31 0.00 0.00 39.34 40.43 2wvu n TYR 377 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wvu n GLY 378 N 0.43 -0.71 0.27 2.72 0.00 0.17 -1.71 105.19 106.36 2wvu n GLY 378 Ca 0.05 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.34 2wvu n GLY 378 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2wvu h LYS 379 N 0.00 0.00 -0.09 1.61 3.64 -1.85 -0.66 116.57 119.21 2wvu h LYS 379 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2wvu h LYS 379 Cb 0.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 2wvu h LYS 379 CO 0.00 0.07 0.00 0.00 -2.27 0.00 0.00 179.45 177.25 2wvu n ALA 380 N -2.34 2.56 0.02 5.00 0.00 -0.69 -4.52 120.51 120.53 2wvu n ALA 380 Ca -0.02 -0.43 -0.01 0.00 0.00 0.00 0.00 53.44 52.98 2wvu n ALA 380 Cb 0.17 -1.16 -0.00 0.00 0.00 0.00 0.00 19.45 18.45 2wvu n ALA 380 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wvu n VAL 381 N 0.06 0.77 -1.85 0.00 0.31 -0.39 -4.79 118.33 112.44 2wvu n VAL 381 Ca 0.17 0.25 -0.42 0.00 -0.01 0.00 0.00 64.34 64.34 2wvu n VAL 381 Cb 0.29 -1.44 -0.02 0.00 -0.91 0.00 0.00 33.84 31.76 2wvu n VAL 381 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2wvu s TYR 382 N -1.68 2.89 -1.97 3.52 2.02 -0.42 -1.94 117.35 119.77 2wvu s TYR 382 Ca -0.02 0.73 0.00 0.00 -0.37 0.00 0.00 57.07 57.41 2wvu s TYR 382 Cb 0.00 -4.00 0.00 0.00 -0.40 0.00 0.00 41.96 37.56 2wvu s TYR 382 CO 0.03 -3.48 0.00 0.00 -1.57 0.00 0.00 175.55 170.53 2wvu n ALA 383 N 2.83 -0.40 -2.03 3.71 0.00 0.36 -4.86 120.51 120.12 2wvu n ALA 383 Ca 0.10 0.27 -0.17 0.00 0.00 0.00 0.00 53.44 53.64 2wvu n ALA 383 Cb 0.38 -2.00 0.01 0.00 0.00 0.00 0.00 19.45 17.84 2wvu n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvu s ASP 385 N -4.33 0.21 0.22 0.00 -1.08 -0.19 -4.90 116.67 106.60 2wvu s ASP 385 Ca 0.54 -1.16 -0.32 0.00 -0.52 0.00 0.00 52.55 51.10 2wvu s ASP 385 Cb -0.09 0.76 -0.14 0.00 -1.46 0.00 0.00 42.92 41.99 2wvu s ASP 385 CO 0.33 -1.50 1.44 0.00 0.52 0.00 0.00 175.17 175.96 2wvu n TYR 386 N -0.52 2.17 0.97 -5.34 9.36 -1.22 -0.08 117.16 122.49 2wvu n TYR 386 Ca -0.05 0.40 0.10 0.00 3.32 0.00 0.00 57.90 61.68 2wvu n TYR 386 Cb 0.60 -2.47 -0.05 0.00 -0.63 0.00 0.00 39.34 36.79 2wvu n TYR 386 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2wvu n ALA 387 N 2.24 4.48 -1.10 2.98 0.00 -1.26 -4.64 120.51 123.21 2wvu n ALA 387 Ca 0.13 -0.55 -0.03 0.00 0.00 0.00 0.00 53.44 52.98 2wvu n ALA 387 Cb 0.31 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 18.91 2wvu n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wvu n GLY 388 N 1.49 0.64 3.83 0.00 0.00 -1.26 -5.00 105.19 104.88 2wvu n GLY 388 Ca 0.04 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 2wvu n GLY 388 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wvu s PHE 389 N -2.05 3.35 0.23 1.61 0.40 -1.26 -4.70 117.98 115.56 2wvu s PHE 389 Ca 0.00 0.21 -0.31 0.00 -0.60 0.00 0.00 56.93 56.23 2wvu s PHE 389 Cb 0.00 -1.73 -0.11 0.00 0.51 0.00 0.00 43.02 41.69 2wvu s PHE 389 CO 0.00 0.57 1.65 -2.00 0.70 0.00 0.00 175.22 176.14 2wvu s GLU 390 N -2.08 4.14 0.21 0.44 2.12 -1.26 -4.92 118.70 117.34 2wvu s GLU 390 Ca 0.27 2.56 -0.32 0.00 0.36 0.00 0.00 54.97 57.84 2wvu s GLU 390 Cb -0.12 -3.07 -0.13 0.00 0.26 0.00 0.00 34.13 31.07 2wvu s GLU 390 CO 0.19 -0.69 1.53 1.17 -0.54 0.00 0.00 175.26 176.93 2wvu n LYS 391 N 3.36 2.22 -4.36 4.30 3.00 -1.26 -4.82 118.16 120.60 2wvu n LYS 391 Ca 0.13 0.80 -0.25 0.00 -0.00 0.00 0.00 58.31 58.99 2wvu n LYS 391 Cb 0.36 -2.53 -0.09 0.00 0.00 0.00 0.00 35.03 32.77 2wvu n LYS 391 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 2wvu s GLN 392 N 0.28 1.94 0.54 1.64 -1.52 -1.26 -5.06 119.66 116.22 2wvu s GLN 392 Ca 0.73 -1.49 0.30 0.00 -1.95 0.00 0.00 55.36 52.94 2wvu s GLN 392 Cb -0.63 -2.00 1.55 0.00 -0.22 0.00 0.00 33.01 31.71 2wvu s GLN 392 CO 0.43 0.38 2.10 -0.44 -0.25 0.00 0.00 175.29 177.51 2wvu h ASP 393 N 2.47 0.00 1.17 5.90 3.32 -1.95 -3.17 116.42 124.16 2wvu h ASP 393 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2wvu h ASP 393 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2wvu h ASP 393 CO 0.57 0.09 0.00 4.11 -1.72 0.00 0.00 179.24 182.29 2wvu h TRP 394 N 0.00 0.00 0.00 4.55 5.08 -1.95 -3.42 115.95 120.20 2wvu h TRP 394 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2wvu h TRP 394 Cb 0.30 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.46 2wvu h TRP 394 CO 0.00 0.00 0.00 0.41 -1.28 0.00 0.00 178.44 177.57 2wvu n GLY 395 N 0.53 -0.42 3.15 11.11 0.00 -1.20 -0.28 105.19 118.08 2wvu n GLY 395 Ca 0.03 -0.38 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 2wvu n GLY 395 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvu s TYR 396 N -2.29 1.07 -0.09 1.61 2.02 -0.29 -4.44 117.35 114.95 2wvu s TYR 396 Ca 0.00 -0.49 -0.09 0.00 -0.37 0.00 0.00 57.07 56.12 2wvu s TYR 396 Cb 0.00 -0.61 -0.04 0.00 -0.40 0.00 0.00 41.96 40.91 2wvu s TYR 396 CO 0.00 0.02 0.21 0.71 -1.57 0.00 0.00 175.55 174.92 2wvu s TYR 397 N -1.43 3.63 0.20 2.71 2.02 -1.26 0.05 117.35 123.27 2wvu s TYR 397 Ca -0.03 0.65 0.08 0.00 -0.37 0.00 0.00 57.07 57.40 2wvu s TYR 397 Cb -0.09 -2.03 -0.05 0.00 -0.40 0.00 0.00 41.96 39.39 2wvu s TYR 397 CO 0.02 0.71 -0.16 0.95 -1.57 0.00 0.00 175.55 175.50 2wvu s THR 398 N -1.05 1.80 -0.12 -0.71 -4.23 -0.48 -4.44 115.64 106.40 2wvu s THR 398 Ca 0.17 -2.15 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 2wvu s THR 398 Cb -0.13 -2.00 0.00 0.00 1.34 0.00 0.00 72.50 71.71 2wvu s THR 398 CO 0.07 -0.52 -0.23 -0.60 -0.54 0.00 0.00 174.62 172.80 2wvu s ARG 399 N -3.43 3.04 0.81 3.99 3.52 0.88 -0.21 118.95 127.55 2wvu s ARG 399 Ca 0.21 -0.86 -0.10 0.00 -0.13 0.00 0.00 55.73 54.85 2wvu s ARG 399 Cb -0.02 -2.37 0.12 0.00 -1.56 0.00 0.00 34.95 31.11 2wvu s ARG 399 CO 0.07 0.08 1.14 0.20 -0.81 0.00 0.00 175.30 175.98 2wvu s GLY 400 N 0.58 1.71 0.43 8.12 0.00 0.09 -1.02 107.32 117.24 2wvu s GLY 400 Ca -0.13 -1.07 0.20 0.00 0.00 0.00 0.00 44.72 43.73 2wvu s GLY 400 CO 0.03 -0.51 1.88 0.50 0.00 0.00 0.00 173.10 175.00 2wvu h LYS 401 N -1.00 0.00 -0.76 2.90 1.79 -1.89 -2.23 116.57 115.38 2wvu h LYS 401 Ca -0.44 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.01 2wvu h LYS 401 Cb 1.29 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.92 2wvu h LYS 401 CO 0.52 0.27 0.03 0.09 -1.08 0.00 0.00 179.45 179.28 2wvu n ASN 402 N -3.71 3.95 -1.33 0.86 4.13 -1.26 -4.89 115.26 113.01 2wvu n ASN 402 Ca -0.01 -2.62 -0.16 0.00 1.68 0.00 0.00 54.58 53.46 2wvu n ASN 402 Cb 0.38 -0.63 -0.06 0.00 -1.54 0.00 0.00 39.78 37.93 2wvu n ASN 402 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2wvu n ASP 403 N 0.32 -4.95 -4.76 6.41 9.92 -0.84 -5.00 116.55 117.64 2wvu n ASP 403 Ca 0.19 0.35 -0.39 0.00 -0.53 0.00 0.00 54.79 54.41 2wvu n ASP 403 Cb 0.88 -3.91 0.02 0.00 -0.64 0.00 0.00 41.12 37.47 2wvu n ASP 403 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2wvu s GLU 404 N -3.57 3.53 -0.23 -1.24 8.01 -1.26 -4.66 118.70 119.29 2wvu s GLU 404 Ca 0.00 2.37 0.01 0.00 0.01 0.00 0.00 54.97 57.37 2wvu s GLU 404 Cb 0.00 -2.54 0.04 0.00 -4.31 0.00 0.00 34.13 27.31 2wvu s GLU 404 CO 0.00 -0.93 -0.14 0.08 0.01 0.00 0.00 175.26 174.29 2wvu s VAL 405 N -1.23 2.26 -0.10 2.63 1.01 -1.09 -0.73 120.40 123.14 2wvu s VAL 405 Ca 0.64 -1.26 -0.14 0.00 0.00 0.00 0.00 61.98 61.21 2wvu s VAL 405 Cb -0.43 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 2wvu s VAL 405 CO 0.54 0.23 0.35 -0.31 0.00 0.00 0.00 175.10 175.91 2wvu s TYR 406 N 1.21 3.56 -0.26 5.22 2.02 0.71 0.23 117.35 130.03 2wvu s TYR 406 Ca -0.02 0.76 -0.13 0.00 -0.37 0.00 0.00 57.07 57.31 2wvu s TYR 406 Cb -0.17 -2.34 -0.04 0.00 -0.40 0.00 0.00 41.96 39.01 2wvu s TYR 406 CO -0.08 0.37 0.27 -1.64 -1.57 0.00 0.00 175.55 172.90 2wvu s MET 407 N -0.04 4.01 -0.31 -0.62 -1.94 0.27 -1.39 119.30 119.29 2wvu s MET 407 Ca 0.20 -0.14 -0.04 0.00 -1.71 0.00 0.00 55.69 54.00 2wvu s MET 407 Cb -0.14 -3.63 0.04 0.00 2.01 0.00 0.00 34.83 33.11 2wvu s MET 407 CO 0.08 -0.17 0.04 0.08 -0.01 0.00 0.00 175.02 175.04 2wvu s VAL 408 N 1.72 3.36 -0.31 -6.03 1.01 0.11 -0.71 120.40 119.54 2wvu s VAL 408 Ca 0.11 -1.18 -0.10 0.00 0.00 0.00 0.00 61.98 60.81 2wvu s VAL 408 Cb -0.15 -2.87 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 2wvu s VAL 408 CO 0.09 -0.07 0.17 -0.69 0.00 0.00 0.00 175.10 174.60 2wvu s VAL 409 N 1.34 4.82 -0.07 2.92 1.01 -0.03 -1.14 120.40 129.25 2wvu s VAL 409 Ca -0.03 -0.31 0.16 0.00 0.00 0.00 0.00 61.98 61.80 2wvu s VAL 409 Cb -0.19 -3.44 -0.23 0.00 0.00 0.00 0.00 36.38 32.52 2wvu s VAL 409 CO 0.00 0.08 0.24 0.49 0.00 0.00 0.00 175.10 175.91 2wvu n PHE 410 N 5.02 0.00 -3.81 5.22 3.72 0.61 -2.46 117.46 125.76 2wvu n PHE 410 Ca -0.14 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 56.96 2wvu n PHE 410 Cb 0.50 -0.53 -0.15 0.00 -0.94 0.00 0.00 39.48 38.36 2wvu n PHE 410 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2wvu s ASN 411 N -4.30 4.11 -0.25 4.37 0.01 -0.06 -4.89 114.94 113.93 2wvu s ASN 411 Ca -0.07 -1.66 -0.29 0.00 -0.71 0.00 0.00 52.86 50.13 2wvu s ASN 411 Cb 0.08 -1.03 0.01 0.00 0.41 0.00 0.00 41.25 40.72 2wvu s ASN 411 CO 0.67 -0.39 1.14 -1.58 -1.51 0.00 0.00 177.10 175.43 2wvu s GLN 412 N 1.47 4.15 0.09 -0.60 2.00 -1.26 -4.42 119.66 121.09 2wvu s GLN 412 Ca 0.08 1.32 -0.31 0.00 -2.00 0.00 0.00 55.36 54.46 2wvu s GLN 412 Cb -0.18 -3.73 -0.07 0.00 0.80 0.00 0.00 33.01 29.83 2wvu s GLN 412 CO -0.20 -0.80 1.31 -1.25 -0.50 0.00 0.00 175.29 173.85 2wvu s PRO 413 N 3.54 4.37 0.54 1.67 0.04 -1.26 -4.91 135.00 138.98 2wvu s PRO 413 Ca 0.48 1.95 0.23 0.00 0.04 0.00 0.00 61.00 63.70 2wvu s PRO 413 Cb -0.16 -3.29 1.41 0.00 0.04 0.00 0.00 34.50 32.50 2wvu s PRO 413 CO 0.13 -0.36 2.07 1.88 0.04 0.00 0.00 177.00 180.77 2wvu h TYR 414 N 6.79 0.00 0.00 0.56 0.05 -1.94 -1.15 116.97 121.28 2wvu h TYR 414 Ca -0.42 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.36 2wvu h TYR 414 Cb 1.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.95 2wvu h TYR 414 CO 0.66 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 176.64 2wvu n SER 415 N -4.32 0.48 -1.23 3.88 3.41 -1.26 -4.83 113.62 109.75 2wvu n SER 415 Ca 0.03 0.70 -0.16 0.00 -0.26 0.00 0.00 58.87 59.19 2wvu n SER 415 Cb 0.36 -0.77 -0.06 0.00 -0.26 0.00 0.00 64.21 63.48 2wvu n SER 415 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wvu n GLU 416 N -2.12 -1.09 -4.00 4.33 1.02 -0.44 -4.97 120.64 113.37 2wvu n GLU 416 Ca -0.01 1.04 -0.20 0.00 -0.02 0.00 0.00 57.16 57.97 2wvu n GLU 416 Cb 0.06 -5.21 -0.17 0.00 -0.02 0.00 0.00 31.44 26.10 2wvu n GLU 416 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2wvu s ARG 417 N -3.39 0.68 -0.36 3.49 0.52 -1.26 -2.30 118.95 116.32 2wvu s ARG 417 Ca 0.00 -0.01 -0.14 0.00 -0.52 0.00 0.00 55.73 55.06 2wvu s ARG 417 Cb 0.00 -0.83 -0.01 0.00 0.52 0.00 0.00 34.95 34.64 2wvu s ARG 417 CO 0.00 -0.16 0.28 -0.51 0.02 0.00 0.00 175.30 174.93 2wvu s LEU 418 N 1.27 4.65 0.11 2.53 1.43 0.19 -4.80 118.68 124.06 2wvu s LEU 418 Ca -0.06 -0.51 -0.31 0.00 -1.03 0.00 0.00 54.13 52.23 2wvu s LEU 418 Cb -0.14 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.84 2wvu s LEU 418 CO -0.02 -0.31 1.26 -0.63 0.23 0.00 0.00 176.35 176.88 2wvu s ILE 419 N 1.77 3.70 -0.22 -0.59 1.01 -1.26 -0.61 121.20 125.00 2wvu s ILE 419 Ca 0.07 1.27 -0.00 0.00 0.00 0.00 0.00 60.65 61.98 2wvu s ILE 419 Cb -0.18 -3.81 0.06 0.00 0.01 0.00 0.00 42.46 38.54 2wvu s ILE 419 CO 0.11 0.12 -0.03 -0.69 0.00 0.00 0.00 174.94 174.46 2wvu s VAL 420 N 0.79 1.18 -0.30 2.92 1.01 0.57 -4.90 120.40 121.67 2wvu s VAL 420 Ca 0.59 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 61.49 2wvu s VAL 420 Cb -0.32 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2wvu s VAL 420 CO 0.31 -0.12 0.21 -1.59 0.00 0.00 0.00 175.10 173.92 2wvu s LYS 421 N 1.56 3.81 0.17 2.72 -2.85 -1.26 -0.50 119.74 123.39 2wvu s LYS 421 Ca -0.04 -0.41 -0.06 0.00 -1.00 0.00 0.00 55.97 54.46 2wvu s LYS 421 Cb -0.18 -3.71 -0.06 0.00 -2.06 0.00 0.00 37.83 31.82 2wvu s LYS 421 CO -0.07 -0.27 0.44 0.95 0.10 0.00 0.00 175.35 176.50 2wvu s THR 422 N 1.76 5.09 0.80 3.79 -4.23 -0.32 -4.23 115.64 118.29 2wvu s THR 422 Ca 0.07 0.18 -0.14 0.00 -1.18 0.00 0.00 61.69 60.62 2wvu s THR 422 Cb -0.16 -3.62 0.07 0.00 1.34 0.00 0.00 72.50 70.12 2wvu s THR 422 CO 0.11 -0.00 1.15 -2.65 -0.54 0.00 0.00 174.62 172.69 2wvu n PRO 423 N -0.00 0.22 -1.64 3.99 -0.02 -1.26 -4.86 135.00 131.43 2wvu n PRO 423 Ca -0.01 0.15 -0.48 0.00 -2.02 0.00 0.00 63.50 61.14 2wvu n PRO 423 Cb 0.52 -2.39 -0.04 0.00 -0.02 0.00 0.00 33.50 31.56 2wvu n PRO 423 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2wvu n LYS 424 N -3.03 1.82 0.00 -0.52 0.00 -1.26 -1.64 118.16 113.54 2wvu n LYS 424 Ca 0.13 0.66 0.00 0.00 -0.00 0.00 0.00 58.31 59.10 2wvu n LYS 424 Cb 0.50 -2.37 0.00 0.00 -0.00 0.00 0.00 35.03 33.17 2wvu n LYS 424 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wvu n GLY 425 N 2.98 1.09 3.71 2.58 0.00 -1.26 -5.06 105.19 109.24 2wvu n GLY 425 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2wvu n GLY 425 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvu s ILE 426 N -2.33 4.84 0.14 -0.61 -1.09 -0.65 -4.34 121.20 117.17 2wvu s ILE 426 Ca 0.00 -0.03 0.11 0.00 -2.23 0.00 0.00 60.65 58.50 2wvu s ILE 426 Cb 0.00 -3.12 -0.04 0.00 -1.58 0.00 0.00 42.46 37.71 2wvu s ILE 426 CO 0.00 0.54 -0.25 0.42 -1.23 0.00 0.00 174.94 174.42 2wvu s THR 427 N -0.32 2.39 -0.26 2.92 -4.23 -0.44 -4.76 115.64 110.94 2wvu s THR 427 Ca 0.09 -1.79 -0.16 0.00 -1.18 0.00 0.00 61.69 58.65 2wvu s THR 427 Cb -0.12 -2.09 -0.03 0.00 1.34 0.00 0.00 72.50 71.60 2wvu s THR 427 CO 0.02 0.04 0.42 -0.69 -0.54 0.00 0.00 174.62 173.87 2wvu s VAL 428 N -1.23 5.14 -0.13 2.29 1.01 -1.26 -1.26 120.40 124.95 2wvu s VAL 428 Ca 0.16 0.69 0.18 0.00 0.00 0.00 0.00 61.98 63.02 2wvu s VAL 428 Cb -0.10 -3.75 -0.25 0.00 0.00 0.00 0.00 36.38 32.29 2wvu s VAL 428 CO 0.08 0.15 0.36 -0.62 0.00 0.00 0.00 175.10 175.06 2wvu n GLU 429 N 5.29 0.67 -3.53 2.72 -0.58 0.56 -5.00 120.64 120.77 2wvu n GLU 429 Ca -0.07 0.01 -0.14 0.00 -0.42 0.00 0.00 57.16 56.54 2wvu n GLU 429 Cb 0.50 -1.59 -0.05 0.00 -0.57 0.00 0.00 31.44 29.73 2wvu n GLU 429 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2wvu s LYS 430 N -2.84 0.88 -0.04 3.49 2.20 -1.18 -4.97 119.74 117.27 2wvu s LYS 430 Ca -0.08 0.09 0.02 0.00 -0.36 0.00 0.00 55.97 55.64 2wvu s LYS 430 Cb 0.09 0.41 0.01 0.00 -1.51 0.00 0.00 37.83 36.83 2wvu s LYS 430 CO 0.85 -0.30 -0.08 0.00 -0.36 0.00 0.00 175.35 175.46 2wvu s ALA 431 N -1.60 0.82 -0.02 3.13 0.00 -1.26 -1.01 121.76 121.82 2wvu s ALA 431 Ca -0.05 -0.23 0.01 0.00 0.00 0.00 0.00 51.96 51.69 2wvu s ALA 431 Cb -0.00 -0.37 0.01 0.00 0.00 0.00 0.00 23.12 22.76 2wvu s ALA 431 CO 0.03 0.08 -0.03 0.99 0.00 0.00 0.00 175.76 176.83 2wvu s THR 432 N 0.48 0.34 -0.13 0.00 2.01 0.07 -0.85 115.64 117.56 2wvu s THR 432 Ca -0.07 -0.10 -0.29 0.00 0.31 0.00 0.00 61.69 61.54 2wvu s THR 432 Cb -0.11 -0.35 -0.03 0.00 0.01 0.00 0.00 72.50 72.02 2wvu s THR 432 CO 0.01 0.14 1.41 -0.22 -0.69 0.00 0.00 174.62 175.27 2wvu s LEU 433 N 0.45 4.22 0.20 4.42 2.96 -0.57 0.32 118.68 130.68 2wvu s LEU 433 Ca -0.05 1.87 -0.11 0.00 -0.22 0.00 0.00 54.13 55.62 2wvu s LEU 433 Cb -0.08 -3.54 0.25 0.00 0.50 0.00 0.00 46.19 43.32 2wvu s LEU 433 CO -0.01 -0.84 1.71 0.25 -1.32 0.00 0.00 176.35 176.15 2wvu h LEU 434 N 9.99 0.02 -1.04 -0.68 5.85 -1.70 0.79 115.31 128.55 2wvu h LEU 434 Ca -0.31 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.41 2wvu h LEU 434 Cb 1.13 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2wvu h LEU 434 CO 0.97 0.03 -0.48 0.71 -0.34 0.00 0.00 178.44 179.33 2wvu h THR 435 N 0.26 1.34 0.00 1.05 1.35 -1.89 -3.34 112.91 111.68 2wvu h THR 435 Ca 0.28 -1.65 -0.02 0.00 -0.55 0.00 0.00 66.41 64.48 2wvu h THR 435 Cb 0.40 1.89 -0.00 0.00 -1.73 0.00 0.00 68.15 68.71 2wvu h THR 435 CO -0.36 0.47 -1.21 0.35 -0.25 0.00 0.00 175.52 174.52 2wvu n THR 436 N -3.96 0.07 -0.89 6.82 -2.24 -1.14 -5.01 114.28 107.93 2wvu n THR 436 Ca -0.02 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2wvu n THR 436 Cb 0.50 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 2wvu n THR 436 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wvu n GLY 437 N 2.39 0.92 3.77 3.38 0.00 0.26 -5.02 105.19 110.89 2wvu n GLY 437 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2wvu n GLY 437 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wvu s GLU 438 N -0.11 4.18 0.32 1.61 -1.05 -1.25 -4.67 118.70 117.73 2wvu s GLU 438 Ca 0.00 2.40 -0.27 0.00 -0.15 0.00 0.00 54.97 56.95 2wvu s GLU 438 Cb 0.00 -2.98 -0.09 0.00 -0.44 0.00 0.00 34.13 30.61 2wvu s GLU 438 CO 0.00 -0.41 1.08 0.34 0.95 0.00 0.00 175.26 177.22 2wvu s ASP 439 N -0.33 7.09 -0.11 0.83 2.15 -1.26 -1.51 116.67 123.53 2wvu s ASP 439 Ca 0.52 2.18 0.04 0.00 0.43 0.00 0.00 52.55 55.71 2wvu s ASP 439 Cb -0.43 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 39.58 2wvu s ASP 439 CO 0.58 -0.26 -0.23 -0.63 -0.17 0.00 0.00 175.17 174.45 2wvu s ILE 440 N -1.34 2.02 0.22 4.11 -1.09 -0.03 -4.88 121.20 120.21 2wvu s ILE 440 Ca 0.49 -0.99 -0.30 0.00 -2.23 0.00 0.00 60.65 57.62 2wvu s ILE 440 Cb -0.28 -1.76 -0.10 0.00 -1.58 0.00 0.00 42.46 38.74 2wvu s ILE 440 CO 0.36 0.55 1.45 -0.89 -1.23 0.00 0.00 174.94 175.18 2wvu s THR 441 N 0.45 2.72 -0.14 2.92 2.01 -1.26 -4.20 115.64 118.15 2wvu s THR 441 Ca -0.16 0.58 0.02 0.00 0.31 0.00 0.00 61.69 62.44 2wvu s THR 441 Cb -0.17 -3.37 0.01 0.00 0.01 0.00 0.00 72.50 68.98 2wvu s THR 441 CO 0.07 0.08 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.19 2wvu s VAL 442 N 0.25 1.90 -0.16 3.82 1.01 -1.26 -1.43 120.40 124.53 2wvu s VAL 442 Ca 0.61 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.72 2wvu s VAL 442 Cb -0.42 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.27 2wvu s VAL 442 CO 0.40 0.52 -0.17 -0.69 0.00 0.00 0.00 175.10 175.16 2wvu s VAL 443 N 0.96 2.43 -0.09 2.92 1.01 -0.02 -4.98 120.40 122.62 2wvu s VAL 443 Ca -0.05 -0.84 -0.30 0.00 0.00 0.00 0.00 61.98 60.80 2wvu s VAL 443 Cb -0.15 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 2wvu s VAL 443 CO -0.04 0.52 1.24 -0.70 0.00 0.00 0.00 175.10 176.13 2wvu s GLU 444 N 0.97 4.30 -0.14 2.72 2.12 -1.26 -0.16 118.70 127.25 2wvu s GLU 444 Ca -0.03 1.69 0.16 0.00 0.36 0.00 0.00 54.97 57.16 2wvu s GLU 444 Cb -0.15 -3.64 -0.23 0.00 0.26 0.00 0.00 34.13 30.37 2wvu s GLU 444 CO -0.04 -0.56 0.14 0.25 -0.54 0.00 0.00 175.26 174.51 2wvu n THR 445 N 4.92 0.91 -3.85 -1.70 -2.24 -0.49 -4.93 114.28 106.90 2wvu n THR 445 Ca 0.12 -0.66 -0.06 0.00 -2.27 0.00 0.00 64.05 61.18 2wvu n THR 445 Cb 0.45 -0.40 0.03 0.00 -2.10 0.00 0.00 70.33 68.31 2wvu n THR 445 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2wvu s THR 446 N -2.61 0.00 0.25 4.28 -1.32 -1.19 -5.03 115.64 110.02 2wvu s THR 446 Ca -0.08 -0.81 -0.31 0.00 -1.21 0.00 0.00 61.69 59.28 2wvu s THR 446 Cb 0.07 -2.99 -0.12 0.00 -1.51 0.00 0.00 72.50 67.94 2wvu s THR 446 CO 0.72 0.00 1.67 0.54 -2.21 0.00 0.00 174.62 175.33 2wvu n ARG 447 N -0.63 2.75 -1.72 7.08 5.12 -1.26 -2.36 116.66 125.64 2wvu n ARG 447 Ca -0.06 0.99 -0.20 0.00 -1.93 0.00 0.00 57.85 56.64 2wvu n ARG 447 Cb 0.60 -2.80 -0.08 0.00 -1.16 0.00 0.00 32.46 29.02 2wvu n ARG 447 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2wvu n ASN 448 N 3.09 -5.47 -3.87 0.55 5.03 -1.26 -4.98 115.26 108.36 2wvu n ASN 448 Ca 0.12 0.43 -0.14 0.00 0.87 0.00 0.00 54.58 55.86 2wvu n ASN 448 Cb 0.36 -4.79 -0.15 0.00 -1.02 0.00 0.00 39.78 34.18 2wvu n ASN 448 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2wvu s GLU 449 N -3.95 0.13 0.06 3.52 2.12 -0.99 -1.18 118.70 118.41 2wvu s GLU 449 Ca 0.00 -0.00 0.03 0.00 0.36 0.00 0.00 54.97 55.36 2wvu s GLU 449 Cb 0.00 -0.19 -0.03 0.00 0.26 0.00 0.00 34.13 34.17 2wvu s GLU 449 CO 0.00 -0.02 -0.10 0.71 -0.54 0.00 0.00 175.26 175.31 2wvu s TYR 450 N 0.27 0.86 -0.34 5.30 2.02 0.35 -1.40 117.35 124.41 2wvu s TYR 450 Ca -0.02 -0.53 -0.17 0.00 -0.37 0.00 0.00 57.07 55.98 2wvu s TYR 450 Cb -0.04 -0.50 -0.01 0.00 -0.40 0.00 0.00 41.96 41.01 2wvu s TYR 450 CO -0.01 -0.04 0.46 -0.80 -1.57 0.00 0.00 175.55 173.59 2wvu s ASN 451 N -1.79 6.27 -0.22 2.29 0.01 0.77 -0.31 114.94 121.95 2wvu s ASN 451 Ca -0.05 -0.06 -0.17 0.00 -0.71 0.00 0.00 52.86 51.87 2wvu s ASN 451 Cb -0.08 -2.24 -0.03 0.00 0.41 0.00 0.00 41.25 39.30 2wvu s ASN 451 CO 0.01 -0.41 0.44 -0.69 -1.51 0.00 0.00 177.10 174.93 2wvu s VAL 452 N 2.25 5.15 0.57 1.60 1.01 0.22 -0.84 120.40 130.36 2wvu s VAL 452 Ca 0.16 0.77 -0.19 0.00 0.00 0.00 0.00 61.98 62.72 2wvu s VAL 452 Cb -0.16 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 2wvu s VAL 452 CO 0.12 0.19 1.18 -0.44 0.00 0.00 0.00 175.10 176.15 2wvu s SER 453 N 1.25 5.44 0.70 3.32 0.01 -0.51 0.54 113.70 124.45 2wvu s SER 453 Ca 0.20 2.32 -0.12 0.00 1.31 0.00 0.00 55.95 59.65 2wvu s SER 453 Cb -0.15 -2.59 0.02 0.00 0.21 0.00 0.00 66.02 63.50 2wvu s SER 453 CO 0.09 -1.42 1.09 0.68 0.41 0.00 0.00 173.24 174.09 2wvu s VAL 454 N -1.65 3.50 0.79 3.43 -7.23 -0.97 -4.78 120.40 113.48 2wvu s VAL 454 Ca 0.75 0.57 -0.14 0.00 -1.81 0.00 0.00 61.98 61.35 2wvu s VAL 454 Cb -0.28 -3.12 0.07 0.00 0.56 0.00 0.00 36.38 33.61 2wvu s VAL 454 CO 0.31 -0.56 1.22 -2.65 -0.31 0.00 0.00 175.10 173.12 2wvu n PRO 455 N -2.96 0.32 -0.22 4.82 -0.02 -1.26 -4.93 135.00 130.75 2wvu n PRO 455 Ca 0.09 0.18 0.01 0.00 -2.02 0.00 0.00 63.50 61.77 2wvu n PRO 455 Cb 0.53 -2.46 0.12 0.00 -0.02 0.00 0.00 33.50 31.67 2wvu n PRO 455 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wvu h LYS 456 N -0.70 0.40 -5.64 -0.52 3.64 -1.95 -3.39 116.57 108.41 2wvu h LYS 456 Ca -0.47 -0.02 -0.65 0.00 -1.27 0.00 0.00 60.65 58.23 2wvu h LYS 456 Cb 1.30 -0.09 -0.15 0.00 -0.41 0.00 0.00 32.23 32.88 2wvu h LYS 456 CO 0.47 0.27 -0.60 0.15 -2.27 0.00 0.00 179.45 177.47 2wvu s LYS 457 N -6.08 3.41 0.06 1.90 1.02 -1.26 -5.06 119.74 113.73 2wvu s LYS 457 Ca -0.13 -0.38 -0.31 0.00 0.02 0.00 0.00 55.97 55.18 2wvu s LYS 457 Cb 0.18 -2.97 -0.08 0.00 -0.52 0.00 0.00 37.83 34.44 2wvu s LYS 457 CO 0.75 0.52 1.70 1.21 -0.92 0.00 0.00 175.35 178.61 2wvu s ASN 458 N -0.36 6.58 0.58 2.83 3.84 -1.26 -4.86 114.94 122.28 2wvu s ASN 458 Ca 0.08 2.50 0.38 0.00 0.21 0.00 0.00 52.86 56.03 2wvu s ASN 458 Cb -0.12 -2.56 1.99 0.00 -0.55 0.00 0.00 41.25 40.01 2wvu s ASN 458 CO 0.02 -0.92 2.17 -0.65 -2.79 0.00 0.00 177.10 174.93 2wvu h PRO 459 N 8.71 0.00 -0.07 0.43 0.11 -1.97 -3.46 132.00 135.75 2wvu h PRO 459 Ca -0.43 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 2wvu h PRO 459 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2wvu h PRO 459 CO 0.94 0.00 -0.03 0.41 -0.21 0.00 0.00 178.00 179.11 2wvu n GLY 460 N -0.86 0.42 3.65 -0.55 0.00 -1.26 -4.95 105.19 101.63 2wvu n GLY 460 Ca -0.02 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 2wvu n GLY 460 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wvu s GLU 461 N -1.16 1.54 0.22 1.61 -1.05 -1.26 -5.12 118.70 113.48 2wvu s GLU 461 Ca 0.00 -0.85 -0.32 0.00 -0.15 0.00 0.00 54.97 53.65 2wvu s GLU 461 Cb 0.00 0.57 -0.13 0.00 -0.44 0.00 0.00 34.13 34.13 2wvu s GLU 461 CO 0.00 -0.68 1.53 -2.30 0.95 0.00 0.00 175.26 174.76 2wvu n PRO 462 N -0.40 2.25 -4.29 -4.83 -0.02 -1.26 -4.97 135.00 121.48 2wvu n PRO 462 Ca -0.09 0.81 -0.15 0.00 -2.02 0.00 0.00 63.50 62.05 2wvu n PRO 462 Cb 0.62 -2.54 -0.10 0.00 -0.02 0.00 0.00 33.50 31.45 2wvu n PRO 462 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2wvu s TYR 463 N 0.43 1.42 -0.08 6.00 1.13 -1.03 -4.93 117.35 120.29 2wvu s TYR 463 Ca 0.72 -1.10 0.05 0.00 -1.41 0.00 0.00 57.07 55.32 2wvu s TYR 463 Cb -0.62 -0.82 -0.00 0.00 -1.10 0.00 0.00 41.96 39.41 2wvu s TYR 463 CO 0.43 -0.27 -0.24 0.08 -2.51 0.00 0.00 175.55 173.04 2wvu s VAL 464 N -3.70 2.03 -0.16 -3.49 1.01 -1.26 -0.85 120.40 113.99 2wvu s VAL 464 Ca 0.32 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 2wvu s VAL 464 Cb 0.07 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.70 2wvu s VAL 464 CO 0.10 0.56 -0.12 -0.63 0.00 0.00 0.00 175.10 175.00 2wvu s ILE 465 N 0.14 2.94 -0.18 2.22 1.01 0.11 -1.79 121.20 125.65 2wvu s ILE 465 Ca -0.13 -0.68 -0.13 0.00 0.00 0.00 0.00 60.65 59.71 2wvu s ILE 465 Cb -0.16 -2.26 -0.05 0.00 0.01 0.00 0.00 42.46 40.00 2wvu s ILE 465 CO 0.07 0.50 0.27 -1.58 0.00 0.00 0.00 174.94 174.20 2wvu s GLN 466 N 0.74 4.22 -0.09 2.79 0.74 0.15 0.97 119.66 129.19 2wvu s GLN 466 Ca -0.05 0.02 -0.04 0.00 0.05 0.00 0.00 55.36 55.34 2wvu s GLN 466 Cb -0.15 -3.45 -0.04 0.00 1.10 0.00 0.00 33.01 30.47 2wvu s GLN 466 CO 0.01 0.19 0.07 -0.51 -0.55 0.00 0.00 175.29 174.51 2wvu s LEU 467 N 0.62 3.95 -0.24 3.68 1.43 0.14 -0.75 118.68 127.51 2wvu s LEU 467 Ca 0.15 0.28 -0.15 0.00 -1.03 0.00 0.00 54.13 53.37 2wvu s LEU 467 Cb -0.13 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 2wvu s LEU 467 CO 0.03 0.37 0.39 -0.75 0.23 0.00 0.00 176.35 176.63 2wvu s LYS 468 N -1.08 4.09 0.33 1.70 2.20 -0.18 -2.68 119.74 124.13 2wvu s LYS 468 Ca 0.16 0.13 0.09 0.00 -0.36 0.00 0.00 55.97 55.99 2wvu s LYS 468 Cb -0.12 -3.60 -0.06 0.00 -1.51 0.00 0.00 37.83 32.55 2wvu s LYS 468 CO 0.05 -0.17 -0.05 0.14 -0.36 0.00 0.00 175.35 174.96 2wvu s VAL 469 N 1.73 2.50 0.03 4.02 -7.23 -1.26 -0.32 120.40 119.86 2wvu s VAL 469 Ca 0.17 -2.10 -0.11 0.00 -1.81 0.00 0.00 61.98 58.13 2wvu s VAL 469 Cb -0.15 -2.69 0.01 0.00 0.56 0.00 0.00 36.38 34.10 2wvu s VAL 469 CO 0.09 -0.23 0.24 -0.13 -0.31 0.00 0.00 175.10 174.76 2wvu s ARG 470 N -3.65 0.71 0.00 4.82 0.52 -0.39 -4.87 118.95 116.08 2wvu s ARG 470 Ca 0.33 -0.50 0.00 0.00 -0.52 0.00 0.00 55.73 55.04 2wvu s ARG 470 Cb 0.00 0.30 0.00 0.00 0.52 0.00 0.00 34.95 35.77 2wvu s ARG 470 CO 0.18 -0.21 0.00 0.00 0.02 0.00 0.00 175.30 175.29