#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wu1 s ARG 2 N 0.00 2.90 -0.11 2.12 0.52 -0.61 -5.03 118.95 118.74 2wu1 s ARG 2 Ca 0.00 -0.48 0.02 0.00 -0.52 0.00 0.00 55.73 54.75 2wu1 s ARG 2 Cb 0.00 -2.74 0.01 0.00 0.52 0.00 0.00 34.95 32.74 2wu1 s ARG 2 CO 0.00 0.68 -0.18 -1.17 0.02 0.00 0.00 175.30 174.65 2wu1 s LEU 3 N -1.08 1.86 -0.44 2.53 0.20 -1.26 -0.37 118.68 120.12 2wu1 s LEU 3 Ca 0.15 -0.47 -0.09 0.00 0.69 0.00 0.00 54.13 54.41 2wu1 s LEU 3 Cb -0.11 -1.19 0.10 0.00 -0.43 0.00 0.00 46.19 44.55 2wu1 s LEU 3 CO 0.05 0.06 0.30 -0.63 -0.29 0.00 0.00 176.35 175.84 2wu1 s ILE 4 N 0.78 4.19 -0.62 6.68 -1.09 0.95 -4.84 121.20 127.24 2wu1 s ILE 4 Ca -0.10 -1.61 -0.22 0.00 -2.23 0.00 0.00 60.65 56.49 2wu1 s ILE 4 Cb -0.16 -3.67 0.07 0.00 -1.58 0.00 0.00 42.46 37.13 2wu1 s ILE 4 CO 0.01 -0.64 0.88 -2.16 -1.23 0.00 0.00 174.94 171.80 2wu1 s PRO 5 N 1.39 3.12 0.28 2.79 0.04 -1.26 -1.07 135.00 140.29 2wu1 s PRO 5 Ca 0.04 -0.87 0.04 0.00 0.04 0.00 0.00 61.00 60.25 2wu1 s PRO 5 Cb -0.25 -4.20 0.04 0.00 0.04 0.00 0.00 34.50 30.13 2wu1 s PRO 5 CO 0.00 -1.67 0.30 1.28 0.04 0.00 0.00 177.00 176.95 2wu1 n LEU 6 N 7.26 0.00 -0.13 -3.56 4.77 0.61 -4.99 117.00 120.96 2wu1 n LEU 6 Ca -0.05 -1.37 -0.27 0.00 -0.03 0.00 0.00 56.01 54.30 2wu1 n LEU 6 Cb 0.45 -0.11 -0.09 0.00 -2.33 0.00 0.00 43.42 41.34 2wu1 n LEU 6 CO 0.62 -0.51 -1.34 0.41 -1.33 0.00 0.00 177.39 175.24 2wu1 n THR 7 N -1.37 1.49 -4.51 -5.08 -1.04 -1.26 -2.47 114.28 100.03 2wu1 n THR 7 Ca 0.03 -0.32 -0.25 0.00 -2.04 0.00 0.00 64.05 61.47 2wu1 n THR 7 Cb 0.31 -1.92 -0.10 0.00 -1.82 0.00 0.00 70.33 66.79 2wu1 n THR 7 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2wu1 s THR 8 N -2.54 2.33 0.53 12.58 -4.23 -1.26 -2.07 115.64 120.98 2wu1 s THR 8 Ca -0.37 -2.29 0.20 0.00 -1.18 0.00 0.00 61.69 58.05 2wu1 s THR 8 Cb 0.13 -2.51 0.31 0.00 1.34 0.00 0.00 72.50 71.78 2wu1 s THR 8 CO 0.47 -0.28 2.11 0.00 -0.54 0.00 0.00 174.62 176.37 2wu1 h ALA 9 N 2.12 2.13 -0.15 3.99 0.00 -1.97 -1.61 119.26 123.78 2wu1 h ALA 9 Ca -0.41 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 2wu1 h ALA 9 Cb 1.25 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2wu1 h ALA 9 CO 0.66 -0.20 -0.01 1.49 0.00 0.00 0.00 179.25 181.19 2wu1 h GLU 10 N 0.00 0.27 -0.44 0.00 4.57 -1.96 -0.92 114.58 116.09 2wu1 h GLU 10 Ca 0.08 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2wu1 h GLU 10 Cb 0.31 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.86 2wu1 h GLU 10 CO -0.00 0.51 0.29 1.96 -1.18 0.00 0.00 179.01 180.59 2wu1 h GLN 11 N -0.01 0.59 -0.49 1.92 4.20 -1.79 -1.37 115.11 118.16 2wu1 h GLN 11 Ca 0.04 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.76 2wu1 h GLN 11 Cb 0.40 -0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.00 2wu1 h GLN 11 CO 0.01 0.40 0.22 0.28 -0.67 0.00 0.00 178.83 179.07 2wu1 h VAL 12 N 0.60 0.91 -0.32 -0.54 2.07 -1.21 0.17 116.25 117.93 2wu1 h VAL 12 Ca 0.16 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 2wu1 h VAL 12 Cb -0.06 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 2wu1 h VAL 12 CO -0.03 0.08 0.18 1.23 0.02 0.00 0.00 177.57 179.05 2wu1 h GLY 13 N 0.43 0.47 1.18 2.17 0.00 -0.84 -0.94 103.07 105.55 2wu1 h GLY 13 Ca 0.22 -0.20 -0.09 0.00 0.00 0.00 0.00 47.33 47.26 2wu1 h GLY 13 CO -0.18 0.20 -0.01 1.70 0.00 0.00 0.00 176.54 178.24 2wu1 h LYS 14 N 0.40 0.98 -0.12 4.80 3.64 -0.84 -1.11 116.57 124.31 2wu1 h LYS 14 Ca 0.11 -0.30 -0.00 0.00 -1.27 0.00 0.00 60.65 59.19 2wu1 h LYS 14 Cb 0.04 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2wu1 h LYS 14 CO -0.02 0.97 0.06 2.35 -2.27 0.00 0.00 179.45 180.54 2wu1 h TRP 15 N 0.90 0.17 -0.38 1.91 7.01 -0.35 -1.09 115.95 124.12 2wu1 h TRP 15 Ca 0.16 -0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.11 2wu1 h TRP 15 Cb 0.54 -0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.53 2wu1 h TRP 15 CO 0.03 0.21 0.05 0.00 -2.79 0.00 0.00 178.44 175.95 2wu1 h ALA 16 N 0.95 0.50 -0.24 2.65 0.00 -1.14 -0.92 119.26 121.06 2wu1 h ALA 16 Ca 0.04 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.77 2wu1 h ALA 16 Cb 0.10 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2wu1 h ALA 16 CO -0.01 0.22 0.07 0.00 0.00 0.00 0.00 179.25 179.53 2wu1 h ALA 17 N 0.91 0.26 -0.78 0.00 0.00 -1.16 -1.23 119.26 117.27 2wu1 h ALA 17 Ca 0.11 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2wu1 h ALA 17 Cb 0.38 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2wu1 h ALA 17 CO 0.01 -0.35 0.51 -0.09 0.00 0.00 0.00 179.25 179.33 2wu1 h ARG 18 N 0.17 1.00 -0.51 0.00 2.43 -1.07 -1.46 114.38 114.94 2wu1 h ARG 18 Ca 0.11 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.15 2wu1 h ARG 18 Cb 0.09 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 2wu1 h ARG 18 CO -0.13 0.66 0.04 1.25 -1.51 0.00 0.00 179.97 180.29 2wu1 h HIS 19 N 1.03 0.95 -0.51 2.20 2.76 -0.62 -1.72 115.15 119.24 2wu1 h HIS 19 Ca 0.29 -0.15 -0.08 0.00 -2.20 0.00 0.00 60.37 58.23 2wu1 h HIS 19 Cb -0.09 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 28.60 2wu1 h HIS 19 CO -0.00 0.87 0.01 0.82 -1.30 0.00 0.00 177.93 178.33 2wu1 h ILE 20 N 0.75 1.26 -0.35 6.26 2.04 -0.89 -1.83 117.51 124.76 2wu1 h ILE 20 Ca 0.15 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 2wu1 h ILE 20 Cb 0.46 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 2wu1 h ILE 20 CO 0.02 0.38 0.18 0.58 0.00 0.00 0.00 178.15 179.30 2wu1 h VAL 21 N 0.75 1.15 -0.53 1.67 2.07 -1.16 -1.27 116.25 118.93 2wu1 h VAL 21 Ca 0.14 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 2wu1 h VAL 21 Cb 0.51 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2wu1 h VAL 21 CO 0.02 0.16 0.06 0.78 0.02 0.00 0.00 177.57 178.62 2wu1 h ASN 22 N 0.43 0.82 -0.43 0.57 -0.26 -1.20 -0.66 115.58 114.84 2wu1 h ASN 22 Ca 0.12 -0.18 -0.01 0.00 -0.56 0.00 0.00 56.30 55.67 2wu1 h ASN 22 Cb 0.10 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.12 2wu1 h ASN 22 CO -0.02 0.84 0.21 0.03 -1.06 0.00 0.00 177.43 177.44 2wu1 h ARG 23 N 0.81 0.62 -0.10 0.81 2.47 -1.12 -1.40 114.38 116.48 2wu1 h ARG 23 Ca 0.17 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 58.79 2wu1 h ARG 23 Cb 0.39 -0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 28.60 2wu1 h ARG 23 CO 0.01 0.53 0.03 0.82 0.56 0.00 0.00 179.97 181.92 2wu1 h ILE 24 N 0.55 1.17 -0.37 2.04 2.04 -0.78 -2.20 117.51 119.97 2wu1 h ILE 24 Ca 0.15 -0.52 -0.10 0.00 1.00 0.00 0.00 64.86 65.39 2wu1 h ILE 24 Cb 0.11 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 2wu1 h ILE 24 CO -0.02 0.15 -0.18 0.78 0.00 0.00 0.00 178.15 178.88 2wu1 h ASN 25 N -0.03 0.69 0.43 1.72 2.35 -1.10 -1.85 115.58 117.79 2wu1 h ASN 25 Ca 0.03 -0.23 -0.09 0.00 -0.55 0.00 0.00 56.30 55.47 2wu1 h ASN 25 Cb 0.21 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2wu1 h ASN 25 CO -0.00 0.88 -0.42 0.00 -1.65 0.00 0.00 177.43 176.23 2wu1 h ALA 26 N 1.18 1.30 -0.08 -0.83 0.00 -1.26 -3.15 119.26 116.43 2wu1 h ALA 26 Ca 0.10 -0.38 -0.20 0.00 0.00 0.00 0.00 54.91 54.42 2wu1 h ALA 26 Cb 0.65 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2wu1 h ALA 26 CO 0.05 0.53 -0.77 0.35 0.00 0.00 0.00 179.25 179.40 2wu1 h PHE 27 N 0.00 0.64 -5.47 0.00 3.57 -0.72 -3.49 116.94 111.47 2wu1 h PHE 27 Ca -0.00 -0.29 -0.15 0.00 3.53 0.00 0.00 57.97 61.06 2wu1 h PHE 27 Cb 0.75 -0.09 0.10 0.00 2.79 0.00 0.00 35.95 39.50 2wu1 h PHE 27 CO 0.00 1.07 -0.48 1.63 -2.23 0.00 0.00 178.31 178.30 2wu1 n LYS 28 N -3.84 -1.78 -2.55 1.11 5.02 -0.76 -4.95 118.16 110.42 2wu1 n LYS 28 Ca -0.05 1.14 -0.35 0.00 -2.02 0.00 0.00 58.31 57.03 2wu1 n LYS 28 Cb 0.73 -5.68 -0.04 0.00 -0.02 0.00 0.00 35.03 30.03 2wu1 n LYS 28 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2wu1 s PRO 29 N -3.83 3.90 0.43 1.97 0.04 -1.26 -5.04 135.00 131.21 2wu1 s PRO 29 Ca 0.24 1.39 0.03 0.00 0.04 0.00 0.00 61.00 62.71 2wu1 s PRO 29 Cb -0.04 -2.20 -0.02 0.00 0.04 0.00 0.00 34.50 32.28 2wu1 s PRO 29 CO 0.75 -0.35 0.10 0.95 0.04 0.00 0.00 177.00 178.49 2wu1 s THR 30 N -1.91 0.74 0.40 1.26 -4.23 -0.21 -4.89 115.64 106.80 2wu1 s THR 30 Ca 0.65 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.23 2wu1 s THR 30 Cb -0.18 -2.31 0.27 0.00 1.34 0.00 0.00 72.50 71.63 2wu1 s THR 30 CO 0.22 0.00 2.03 0.00 -0.54 0.00 0.00 174.62 176.33 2wu1 h ALA 31 N 1.69 1.70 0.00 3.99 0.00 -1.95 -1.41 119.26 123.27 2wu1 h ALA 31 Ca -0.37 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 2wu1 h ALA 31 Cb 1.28 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2wu1 h ALA 31 CO 0.61 0.25 -0.43 -0.44 0.00 0.00 0.00 179.25 179.24 2wu1 h ASP 32 N 0.62 0.00 -2.23 0.00 3.32 -1.99 -3.40 116.42 112.74 2wu1 h ASP 32 Ca 0.19 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.67 2wu1 h ASP 32 Cb 0.02 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.18 2wu1 h ASP 32 CO -0.05 0.09 -1.00 -1.14 -1.72 0.00 0.00 179.24 175.42 2wu1 n ARG 33 N -2.98 0.57 -1.77 3.56 0.63 -0.59 -5.12 116.66 110.96 2wu1 n ARG 33 Ca 0.02 -3.31 -0.32 0.00 -0.92 0.00 0.00 57.85 53.33 2wu1 n ARG 33 Cb 0.58 -1.52 0.03 0.00 0.45 0.00 0.00 32.46 32.00 2wu1 n ARG 33 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2wu1 s PRO 34 N -0.64 3.13 -0.05 -0.14 0.04 -0.85 -1.05 135.00 135.44 2wu1 s PRO 34 Ca 0.34 1.03 -0.21 0.00 0.04 0.00 0.00 61.00 62.19 2wu1 s PRO 34 Cb 0.10 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 2wu1 s PRO 34 CO -0.15 -0.95 0.62 0.12 0.04 0.00 0.00 177.00 176.68 2wu1 s PHE 35 N -2.84 3.61 -0.32 0.56 5.36 -0.67 -4.90 117.98 118.77 2wu1 s PHE 35 Ca 0.60 1.17 -0.09 0.00 -0.96 0.00 0.00 56.93 57.65 2wu1 s PHE 35 Cb -0.14 -2.69 0.01 0.00 -0.34 0.00 0.00 43.02 39.86 2wu1 s PHE 35 CO 0.48 0.20 0.13 0.08 -1.46 0.00 0.00 175.22 174.66 2wu1 s VAL 36 N 0.38 4.28 -0.17 3.12 1.01 -1.26 -0.51 120.40 127.25 2wu1 s VAL 36 Ca 0.33 -0.68 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 2wu1 s VAL 36 Cb -0.17 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2wu1 s VAL 36 CO 0.16 -0.01 -0.07 -0.22 0.00 0.00 0.00 175.10 174.96 2wu1 s LEU 37 N 1.54 2.93 -0.14 3.92 0.20 0.29 -0.72 118.68 126.70 2wu1 s LEU 37 Ca 0.03 -0.29 -0.10 0.00 0.69 0.00 0.00 54.13 54.45 2wu1 s LEU 37 Cb -0.18 -1.71 -0.05 0.00 -0.43 0.00 0.00 46.19 43.83 2wu1 s LEU 37 CO 0.05 0.10 0.19 -0.83 -0.29 0.00 0.00 176.35 175.57 2wu1 s GLY 38 N 0.76 2.16 0.05 7.98 0.00 0.25 -1.35 107.32 117.17 2wu1 s GLY 38 Ca -0.03 -0.58 0.06 0.00 0.00 0.00 0.00 44.72 44.17 2wu1 s GLY 38 CO 0.02 -0.02 -0.17 1.08 0.00 0.00 0.00 173.10 174.01 2wu1 s LEU 39 N -0.32 2.19 0.44 0.66 1.43 0.26 -0.77 118.68 122.57 2wu1 s LEU 39 Ca 0.14 -0.52 0.07 0.00 -1.03 0.00 0.00 54.13 52.79 2wu1 s LEU 39 Cb -0.12 -0.76 -0.02 0.00 0.03 0.00 0.00 46.19 45.32 2wu1 s LEU 39 CO 0.03 0.07 0.34 -2.16 0.23 0.00 0.00 176.35 174.86 2wu1 s PRO 40 N -1.28 2.41 0.45 1.29 0.04 -1.23 -1.76 135.00 134.92 2wu1 s PRO 40 Ca 0.04 -1.69 0.04 0.00 0.04 0.00 0.00 61.00 59.43 2wu1 s PRO 40 Cb -0.09 -2.24 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 2wu1 s PRO 40 CO 0.02 -0.25 0.02 0.95 0.04 0.00 0.00 177.00 177.78 2wu1 s THR 41 N -2.55 1.40 -0.07 1.26 -4.23 -1.26 -4.95 115.64 105.24 2wu1 s THR 41 Ca 0.44 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 2wu1 s THR 41 Cb -0.01 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.30 2wu1 s THR 41 CO 0.26 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.95 2wu1 n GLY 42 N -1.07 0.38 0.21 3.99 0.00 -1.26 -4.76 105.19 102.68 2wu1 n GLY 42 Ca -0.11 -2.31 -0.08 0.00 0.00 0.00 0.00 46.02 43.51 2wu1 n GLY 42 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wu1 h GLY 43 N 0.00 0.72 0.10 -0.02 0.00 -2.03 -3.36 103.07 98.48 2wu1 h GLY 43 Ca 0.00 -0.37 0.07 0.00 0.00 0.00 0.00 47.33 47.03 2wu1 h GLY 43 CO 0.00 0.35 -0.25 -0.84 0.00 0.00 0.00 176.54 175.80 2wu1 h THR 44 N 0.60 0.37 0.00 4.70 2.02 -1.97 -2.49 112.91 116.15 2wu1 h THR 44 Ca 0.16 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.34 2wu1 h THR 44 Cb 0.15 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 2wu1 h THR 44 CO -0.02 0.00 0.00 -0.81 0.37 0.00 0.00 175.52 175.06 2wu1 n PRO 45 N -5.38 0.90 -0.04 6.66 -0.04 -1.26 -4.32 135.00 131.52 2wu1 n PRO 45 Ca -0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 2wu1 n PRO 45 Cb 0.30 -1.40 -0.02 0.00 -0.04 0.00 0.00 33.50 32.34 2wu1 n PRO 45 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 2wu1 h MET 46 N 0.00 -0.17 0.00 0.54 2.86 -1.62 0.11 114.93 116.64 2wu1 h MET 46 Ca 0.00 0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 2wu1 h MET 46 Cb 0.00 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 2wu1 h MET 46 CO 0.00 -0.11 -0.15 1.79 1.06 0.00 0.00 176.91 179.50 2wu1 h THR 47 N -0.18 0.60 -0.08 2.22 1.35 -1.83 -0.75 112.91 114.24 2wu1 h THR 47 Ca 0.13 -0.66 -0.07 0.00 -0.55 0.00 0.00 66.41 65.26 2wu1 h THR 47 Cb 0.37 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 2wu1 h THR 47 CO -0.32 0.14 -0.22 0.74 -0.25 0.00 0.00 175.52 175.61 2wu1 h THR 48 N 0.00 1.42 -0.22 6.82 2.02 -1.36 -2.16 112.91 119.42 2wu1 h THR 48 Ca -0.00 -1.58 0.00 0.00 0.77 0.00 0.00 66.41 65.60 2wu1 h THR 48 Cb 0.41 2.23 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 2wu1 h THR 48 CO 0.02 0.45 0.14 1.88 0.37 0.00 0.00 175.52 178.38 2wu1 h TYR 49 N -0.19 0.29 -0.41 3.16 0.05 -0.44 0.17 116.97 119.59 2wu1 h TYR 49 Ca -0.01 0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.86 2wu1 h TYR 49 Cb 0.84 -0.10 -0.09 0.00 1.01 0.00 0.00 36.73 38.39 2wu1 h TYR 49 CO 0.12 0.21 -0.29 0.87 -1.05 0.00 0.00 178.16 178.02 2wu1 h LYS 50 N 0.29 -0.20 -0.44 4.88 6.56 -1.21 -1.23 116.57 125.21 2wu1 h LYS 50 Ca 0.08 0.01 -0.08 0.00 -1.06 0.00 0.00 60.65 59.60 2wu1 h LYS 50 Cb -0.00 0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 31.69 2wu1 h LYS 50 CO -0.02 -0.14 -0.07 0.00 -2.06 0.00 0.00 179.45 177.17 2wu1 h ALA 51 N 0.90 1.05 -0.22 3.86 0.00 -1.12 -1.76 119.26 121.96 2wu1 h ALA 51 Ca 0.19 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2wu1 h ALA 51 Cb 0.51 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2wu1 h ALA 51 CO -0.53 0.58 0.14 -0.07 0.00 0.00 0.00 179.25 179.37 2wu1 h LEU 52 N 0.70 0.26 -0.56 0.00 3.38 -0.35 -1.88 115.31 116.86 2wu1 h LEU 52 Ca 0.13 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2wu1 h LEU 52 Cb 0.54 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2wu1 h LEU 52 CO 0.03 0.20 0.34 0.58 0.09 0.00 0.00 178.44 179.68 2wu1 h VAL 53 N 0.29 1.17 0.00 1.22 2.07 -1.01 -1.53 116.25 118.46 2wu1 h VAL 53 Ca 0.08 -0.39 0.03 0.00 0.82 0.00 0.00 66.70 67.24 2wu1 h VAL 53 Cb -0.02 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.12 2wu1 h VAL 53 CO -0.02 0.18 -0.27 -0.33 0.02 0.00 0.00 177.57 177.15 2wu1 h GLU 54 N 0.76 -0.40 -0.45 1.57 5.08 -1.17 -0.29 114.58 119.68 2wu1 h GLU 54 Ca 0.20 0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2wu1 h GLU 54 Cb -0.01 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2wu1 h GLU 54 CO -0.04 -0.27 0.27 0.52 -1.00 0.00 0.00 179.01 178.49 2wu1 h MET 55 N -0.42 0.60 -0.04 2.33 2.86 -1.11 0.63 114.93 119.78 2wu1 h MET 55 Ca 0.06 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2wu1 h MET 55 Cb 0.50 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.03 2wu1 h MET 55 CO -0.24 0.42 -0.01 1.25 1.06 0.00 0.00 176.91 179.40 2wu1 h HIS 56 N 0.61 0.09 -0.87 -0.22 -0.00 -0.86 0.48 115.15 114.38 2wu1 h HIS 56 Ca 0.16 -0.02 0.12 0.00 -0.00 0.00 0.00 60.37 60.63 2wu1 h HIS 56 Cb -0.02 -0.02 -0.06 0.00 -0.00 0.00 0.00 27.41 27.30 2wu1 h HIS 56 CO 0.00 0.41 0.56 0.87 -0.00 0.00 0.00 177.93 179.77 2wu1 h LYS 57 N -0.26 0.75 0.00 5.26 1.57 -0.45 0.34 116.57 123.78 2wu1 h LYS 57 Ca 0.01 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2wu1 h LYS 57 Cb 0.38 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2wu1 h LYS 57 CO 0.00 0.49 0.00 0.00 -0.57 0.00 0.00 179.45 179.38 2wu1 n ALA 58 N -2.43 2.32 -1.59 3.86 0.00 0.16 -4.89 120.51 117.95 2wu1 n ALA 58 Ca 0.16 -0.14 -0.02 0.00 0.00 0.00 0.00 53.44 53.44 2wu1 n ALA 58 Cb 0.38 -1.40 -0.00 0.00 0.00 0.00 0.00 19.45 18.43 2wu1 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wu1 n GLY 59 N 0.64 0.40 0.11 0.00 0.00 0.12 -4.96 105.19 101.50 2wu1 n GLY 59 Ca 0.15 -0.89 0.12 0.00 0.00 0.00 0.00 46.02 45.40 2wu1 n GLY 59 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2wu1 h GLN 60 N 0.00 0.00 -3.52 1.61 4.20 -1.08 -3.47 115.11 112.85 2wu1 h GLN 60 Ca -0.05 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.48 2wu1 h GLN 60 Cb 0.62 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 28.15 2wu1 h GLN 60 CO 0.06 0.00 -0.58 0.08 -0.67 0.00 0.00 178.83 177.72 2wu1 s VAL 61 N -3.32 0.03 -0.05 -0.54 1.01 -1.25 -4.98 120.40 111.30 2wu1 s VAL 61 Ca 0.01 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 61.81 2wu1 s VAL 61 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 36.38 36.23 2wu1 s VAL 61 CO 0.77 -0.13 -0.19 -0.55 0.00 0.00 0.00 175.10 175.01 2wu1 s SER 62 N -0.39 3.64 -0.08 3.32 0.15 -1.26 -4.55 113.70 114.53 2wu1 s SER 62 Ca -0.05 -0.32 0.19 0.00 0.70 0.00 0.00 55.95 56.48 2wu1 s SER 62 Cb -0.03 -0.74 0.68 0.00 -1.71 0.00 0.00 66.02 64.22 2wu1 s SER 62 CO 0.00 0.32 1.59 0.49 1.20 0.00 0.00 173.24 176.84 2wu1 n PHE 63 N 2.49 1.30 -0.31 3.44 3.72 -1.26 -4.56 117.46 122.27 2wu1 n PHE 63 Ca -0.17 -0.59 0.14 0.00 -0.05 0.00 0.00 57.45 56.79 2wu1 n PHE 63 Cb 0.52 -0.18 0.38 0.00 -0.94 0.00 0.00 39.48 39.26 2wu1 n PHE 63 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2wu1 h LYS 64 N 3.99 0.65 -0.44 -1.08 1.63 -1.96 -2.10 116.57 117.27 2wu1 h LYS 64 Ca 0.00 -0.04 -0.29 0.00 -0.85 0.00 0.00 60.65 59.47 2wu1 h LYS 64 Cb 1.31 -0.15 -0.20 0.00 -0.60 0.00 0.00 32.23 32.59 2wu1 h LYS 64 CO 0.16 0.43 -0.36 0.72 -3.45 0.00 0.00 179.45 176.96 2wu1 n HIS 65 N -4.65 1.50 -4.46 1.91 8.25 -1.26 -4.62 115.22 111.89 2wu1 n HIS 65 Ca 0.21 -1.89 -0.34 0.00 -0.26 0.00 0.00 57.72 55.44 2wu1 n HIS 65 Cb 0.58 -0.46 -0.12 0.00 1.12 0.00 0.00 29.99 31.11 2wu1 n HIS 65 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2wu1 s VAL 66 N -3.81 3.75 -0.16 1.59 1.01 -0.79 -1.66 120.40 120.33 2wu1 s VAL 66 Ca 0.47 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.98 2wu1 s VAL 66 Cb 0.41 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 2wu1 s VAL 66 CO -0.01 0.50 0.03 -0.69 0.00 0.00 0.00 175.10 174.93 2wu1 s VAL 67 N 0.37 4.50 0.04 2.92 1.01 0.33 -4.85 120.40 124.72 2wu1 s VAL 67 Ca -0.05 -0.14 0.05 0.00 0.00 0.00 0.00 61.98 61.83 2wu1 s VAL 67 Cb -0.14 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 2wu1 s VAL 67 CO 0.03 0.50 -0.07 0.42 0.00 0.00 0.00 175.10 175.98 2wu1 s THR 68 N 0.13 3.61 -0.05 3.92 -4.23 -0.46 -0.55 115.64 118.01 2wu1 s THR 68 Ca 0.03 -0.94 0.03 0.00 -1.18 0.00 0.00 61.69 59.63 2wu1 s THR 68 Cb -0.13 -2.62 0.01 0.00 1.34 0.00 0.00 72.50 71.10 2wu1 s THR 68 CO 0.01 0.28 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.88 2wu1 s PHE 69 N -1.10 1.47 0.33 3.99 0.08 -0.46 -1.20 117.98 121.09 2wu1 s PHE 69 Ca 0.19 -0.47 -0.10 0.00 0.12 0.00 0.00 56.93 56.67 2wu1 s PHE 69 Cb -0.11 -1.04 -0.07 0.00 -0.57 0.00 0.00 43.02 41.23 2wu1 s PHE 69 CO 0.11 -0.21 0.67 -0.80 -0.10 0.00 0.00 175.22 174.89 2wu1 s ASN 70 N 0.36 6.58 0.16 1.36 -0.87 -0.96 -0.57 114.94 121.00 2wu1 s ASN 70 Ca -0.09 1.03 -0.10 0.00 -1.57 0.00 0.00 52.86 52.12 2wu1 s ASN 70 Cb -0.13 -2.27 0.03 0.00 -0.02 0.00 0.00 41.25 38.85 2wu1 s ASN 70 CO 0.03 -0.25 1.59 0.24 -2.57 0.00 0.00 177.10 176.14 2wu1 h MET 71 N 1.81 0.99 -2.99 -0.60 2.86 -1.72 -3.45 114.93 111.83 2wu1 h MET 71 Ca -0.47 -0.36 0.02 0.00 -2.06 0.00 0.00 59.70 56.83 2wu1 h MET 71 Cb 1.18 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 2wu1 h MET 71 CO 0.66 1.03 0.26 0.16 1.06 0.00 0.00 176.91 180.08 2wu1 s ASP 72 N -6.57 -0.09 -0.21 1.22 1.47 -1.26 -0.83 116.67 110.40 2wu1 s ASP 72 Ca -0.12 -0.94 -0.28 0.00 1.18 0.00 0.00 52.55 52.40 2wu1 s ASP 72 Cb 0.12 0.80 0.11 0.00 -0.34 0.00 0.00 42.92 43.62 2wu1 s ASP 72 CO 0.85 -1.55 0.93 -0.70 0.68 0.00 0.00 175.17 175.38 2wu1 s GLU 73 N -2.91 0.65 0.32 2.11 2.56 -0.76 -4.78 118.70 115.90 2wu1 s GLU 73 Ca 0.14 0.45 -0.29 0.00 0.00 0.00 0.00 54.97 55.27 2wu1 s GLU 73 Cb -0.05 0.31 -0.10 0.00 2.00 0.00 0.00 34.13 36.29 2wu1 s GLU 73 CO 0.10 -0.15 1.29 0.71 -0.56 0.00 0.00 175.26 176.65 2wu1 s TYR 74 N -0.41 3.11 0.13 5.30 2.02 -1.26 -0.59 117.35 125.65 2wu1 s TYR 74 Ca -0.01 1.42 -0.30 0.00 -0.37 0.00 0.00 57.07 57.81 2wu1 s TYR 74 Cb -0.03 -3.64 -0.06 0.00 -0.40 0.00 0.00 41.96 37.83 2wu1 s TYR 74 CO -0.00 -1.75 0.97 0.08 -1.57 0.00 0.00 175.55 173.27 2wu1 s VAL 75 N -1.05 4.40 0.00 0.71 1.01 -0.32 -4.14 120.40 121.01 2wu1 s VAL 75 Ca 0.49 2.04 0.00 0.00 0.00 0.00 0.00 61.98 64.52 2wu1 s VAL 75 Cb -0.39 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 31.69 2wu1 s VAL 75 CO 0.51 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.56 2wu1 n GLY 76 N 2.14 0.52 3.71 4.51 0.00 -0.18 -4.73 105.19 111.15 2wu1 n GLY 76 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2wu1 n GLY 76 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wu1 s LEU 77 N 0.00 4.25 0.29 0.99 0.20 -1.26 -5.03 118.68 118.12 2wu1 s LEU 77 Ca 0.00 0.83 -0.30 0.00 0.69 0.00 0.00 54.13 55.36 2wu1 s LEU 77 Cb 0.00 -2.75 -0.13 0.00 -0.43 0.00 0.00 46.19 42.88 2wu1 s LEU 77 CO 0.00 -0.06 1.39 -2.65 -0.29 0.00 0.00 176.35 174.74 2wu1 n PRO 78 N 3.97 2.19 -0.21 0.98 -0.02 -1.26 -4.79 135.00 135.86 2wu1 n PRO 78 Ca -0.06 0.78 0.20 0.00 -2.02 0.00 0.00 63.50 62.40 2wu1 n PRO 78 Cb 0.51 -2.43 0.56 0.00 -0.02 0.00 0.00 33.50 32.13 2wu1 n PRO 78 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wu1 h LYS 79 N 3.63 0.30 0.00 -0.52 3.64 -1.99 -1.49 116.57 120.15 2wu1 h LYS 79 Ca -0.46 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 58.83 2wu1 h LYS 79 Cb 1.27 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 2wu1 h LYS 79 CO 0.71 0.20 -0.33 1.05 -2.27 0.00 0.00 179.45 178.81 2wu1 h GLU 80 N 0.31 0.00 -6.47 1.90 9.09 -2.00 -3.38 114.58 114.04 2wu1 h GLU 80 Ca 0.44 0.00 -0.60 0.00 0.05 0.00 0.00 59.36 59.24 2wu1 h GLU 80 Cb 1.21 0.00 0.06 0.00 -1.65 0.00 0.00 28.75 28.37 2wu1 h GLU 80 CO -0.13 0.33 0.68 1.58 0.05 0.00 0.00 179.01 181.52 2wu1 n HIS 81 N -3.40 2.08 0.30 2.06 -0.00 -0.56 -4.84 115.22 110.86 2wu1 n HIS 81 Ca 0.00 0.38 0.19 0.00 0.46 0.00 0.00 57.72 58.75 2wu1 n HIS 81 Cb 0.52 -2.48 0.95 0.00 -0.12 0.00 0.00 29.99 28.86 2wu1 n HIS 81 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2wu1 h PRO 82 N 5.28 0.00 -0.04 1.57 0.13 -1.88 -2.06 132.00 135.00 2wu1 h PRO 82 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2wu1 h PRO 82 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2wu1 h PRO 82 CO 0.84 0.02 0.00 0.39 -0.23 0.00 0.00 178.00 179.02 2wu1 n GLU 83 N -3.23 2.07 -1.13 0.86 -0.58 -1.26 -4.27 120.64 113.10 2wu1 n GLU 83 Ca -0.02 -1.56 -0.31 0.00 -0.42 0.00 0.00 57.16 54.85 2wu1 n GLU 83 Cb 0.18 -1.47 0.11 0.00 -0.57 0.00 0.00 31.44 29.69 2wu1 n GLU 83 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2wu1 s SER 84 N -1.97 4.04 0.27 1.62 1.04 -0.78 -4.88 113.70 113.04 2wu1 s SER 84 Ca 0.32 1.99 0.15 0.00 0.48 0.00 0.00 55.95 58.88 2wu1 s SER 84 Cb 0.20 -2.54 0.12 0.00 0.10 0.00 0.00 66.02 63.90 2wu1 s SER 84 CO 0.31 -2.35 1.47 1.88 0.98 0.00 0.00 173.24 175.53 2wu1 h TYR 85 N -1.22 0.00 0.16 5.02 0.05 -1.90 -2.11 116.97 116.97 2wu1 h TYR 85 Ca -0.44 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.36 2wu1 h TYR 85 Cb 1.25 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.95 2wu1 h TYR 85 CO 0.55 0.55 -0.35 -0.92 -1.05 0.00 0.00 178.16 176.93 2wu1 h TYR 86 N 0.00 -0.97 -0.73 4.88 5.03 -1.92 -1.87 116.97 121.40 2wu1 h TYR 86 Ca -0.01 0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.34 2wu1 h TYR 86 Cb 1.36 0.41 -0.04 0.00 1.55 0.00 0.00 36.73 40.01 2wu1 h TYR 86 CO 0.00 -0.46 0.47 0.77 -1.32 0.00 0.00 178.16 177.62 2wu1 h SER 87 N -0.61 0.80 -0.35 -2.11 0.02 -1.70 -2.77 113.55 106.84 2wu1 h SER 87 Ca 0.02 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2wu1 h SER 87 Cb 0.62 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 2wu1 h SER 87 CO -0.18 0.57 0.15 0.15 -1.14 0.00 0.00 176.83 176.37 2wu1 h PHE 88 N 0.95 0.27 -0.53 3.45 3.04 -1.25 -1.38 116.94 121.48 2wu1 h PHE 88 Ca 0.28 0.02 -0.11 0.00 3.98 0.00 0.00 57.97 62.14 2wu1 h PHE 88 Cb -0.05 -0.07 -0.02 0.00 2.56 0.00 0.00 35.95 38.37 2wu1 h PHE 88 CO -0.03 0.13 -0.09 0.52 -2.02 0.00 0.00 178.31 176.82 2wu1 h MET 89 N 0.31 0.99 -0.02 1.11 2.86 -1.09 -1.10 114.93 118.00 2wu1 h MET 89 Ca 0.15 -0.35 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 2wu1 h MET 89 Cb 0.10 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 2wu1 h MET 89 CO -0.13 1.03 -0.02 0.45 1.06 0.00 0.00 176.91 179.29 2wu1 h HIS 90 N 0.89 0.05 -0.92 -0.22 3.86 -1.36 -0.67 115.15 116.77 2wu1 h HIS 90 Ca 0.14 -0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.38 2wu1 h HIS 90 Cb 0.64 -0.01 -0.05 0.00 1.06 0.00 0.00 27.41 29.05 2wu1 h HIS 90 CO 0.04 0.52 0.60 -0.09 0.86 0.00 0.00 177.93 179.87 2wu1 h ARG 91 N -0.44 1.09 -0.01 2.45 2.43 -1.22 -1.10 114.38 117.58 2wu1 h ARG 91 Ca 0.00 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2wu1 h ARG 91 Cb 0.52 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2wu1 h ARG 91 CO 0.00 0.72 -0.56 0.09 -1.51 0.00 0.00 179.97 178.72 2wu1 n ASN 92 N -4.45 1.65 0.13 -3.80 3.02 -0.42 -4.82 115.26 106.57 2wu1 n ASN 92 Ca 0.13 -1.33 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 2wu1 n ASN 92 Cb 0.12 0.61 0.00 0.00 -0.61 0.00 0.00 39.78 39.91 2wu1 n ASN 92 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2wu1 n PHE 93 N -0.41 -2.84 -0.25 3.10 7.35 -0.41 -4.75 117.46 119.25 2wu1 n PHE 93 Ca 0.07 0.70 0.01 0.00 -0.76 0.00 0.00 57.45 57.47 2wu1 n PHE 93 Cb 0.40 1.70 0.24 0.00 0.35 0.00 0.00 39.48 42.16 2wu1 n PHE 93 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2wu1 h PHE 94 N 0.00 0.99 0.00 -5.13 0.04 -1.17 -1.45 116.94 110.22 2wu1 h PHE 94 Ca 0.00 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 2wu1 h PHE 94 Cb 0.00 -0.33 -0.00 0.00 2.20 0.00 0.00 35.95 37.82 2wu1 h PHE 94 CO 0.00 0.60 -0.02 -0.44 -0.60 0.00 0.00 178.31 177.85 2wu1 h ASP 95 N 1.04 0.00 -0.09 2.17 3.32 -1.44 -3.02 116.42 118.40 2wu1 h ASP 95 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2wu1 h ASP 95 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 2wu1 h ASP 95 CO -0.08 0.02 0.00 1.41 -1.72 0.00 0.00 179.24 178.87 2wu1 n HIS 96 N -3.39 0.10 -4.33 4.55 8.25 -0.55 -5.01 115.22 114.84 2wu1 n HIS 96 Ca -0.02 -0.08 -0.17 0.00 -0.26 0.00 0.00 57.72 57.18 2wu1 n HIS 96 Cb 0.12 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.13 2wu1 n HIS 96 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2wu1 s VAL 97 N -1.21 0.90 -0.24 1.59 -7.23 -1.14 -4.90 120.40 108.16 2wu1 s VAL 97 Ca 0.20 -2.02 0.01 0.00 -1.81 0.00 0.00 61.98 58.36 2wu1 s VAL 97 Cb 0.13 -2.44 0.26 0.00 0.56 0.00 0.00 36.38 34.89 2wu1 s VAL 97 CO 0.19 -0.23 1.68 -0.90 -0.31 0.00 0.00 175.10 175.53 2wu1 n ASP 98 N -0.44 4.68 -4.69 4.85 5.75 -1.26 -4.90 116.55 120.53 2wu1 n ASP 98 Ca -0.04 -2.85 -0.40 0.00 -0.01 0.00 0.00 54.79 51.49 2wu1 n ASP 98 Cb 0.65 -0.83 -0.05 0.00 -1.03 0.00 0.00 41.12 39.86 2wu1 n ASP 98 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 2wu1 s ILE 99 N -1.77 4.98 0.37 2.12 2.07 -1.26 -3.57 121.20 124.14 2wu1 s ILE 99 Ca 0.27 1.51 -0.27 0.00 -1.41 0.00 0.00 60.65 60.74 2wu1 s ILE 99 Cb 0.22 -4.07 -0.10 0.00 0.13 0.00 0.00 42.46 38.64 2wu1 s ILE 99 CO 0.03 0.16 1.34 -2.84 -1.91 0.00 0.00 174.94 171.71 2wu1 s PRO 100 N 1.38 4.13 0.55 3.50 0.02 -1.26 -4.92 135.00 138.40 2wu1 s PRO 100 Ca 0.37 2.26 0.27 0.00 0.02 0.00 0.00 61.00 63.93 2wu1 s PRO 100 Cb -0.17 -2.91 1.61 0.00 0.02 0.00 0.00 34.50 33.05 2wu1 s PRO 100 CO 0.16 -0.40 2.17 0.00 -0.33 0.00 0.00 177.00 178.60 2wu1 h ALA 101 N 2.98 1.45 0.00 -1.55 0.00 -1.97 0.05 119.26 120.22 2wu1 h ALA 101 Ca -0.50 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2wu1 h ALA 101 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2wu1 h ALA 101 CO 0.64 0.07 0.00 1.05 0.00 0.00 0.00 179.25 181.01 2wu1 h GLU 102 N 0.00 0.00 -0.02 0.00 9.09 -2.01 -2.97 114.58 118.67 2wu1 h GLU 102 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2wu1 h GLU 102 Cb 0.15 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.25 2wu1 h GLU 102 CO 0.01 0.00 -0.02 0.09 0.05 0.00 0.00 179.01 179.14 2wu1 n ASN 103 N -2.33 1.64 -4.64 3.06 4.13 0.00 -4.87 115.26 112.26 2wu1 n ASN 103 Ca 0.02 -1.52 -0.37 0.00 1.68 0.00 0.00 54.58 54.40 2wu1 n ASN 103 Cb 0.27 0.01 -0.10 0.00 -1.54 0.00 0.00 39.78 38.42 2wu1 n ASN 103 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2wu1 s ILE 104 N -2.04 5.33 -0.13 2.41 1.01 -1.13 -1.35 121.20 125.31 2wu1 s ILE 104 Ca 0.36 0.22 0.02 0.00 0.00 0.00 0.00 60.65 61.25 2wu1 s ILE 104 Cb 0.21 -3.53 0.01 0.00 0.01 0.00 0.00 42.46 39.16 2wu1 s ILE 104 CO 0.34 0.31 -0.20 0.20 0.00 0.00 0.00 174.94 175.59 2wu1 s ASN 105 N 1.26 2.93 0.03 3.58 0.01 -0.34 -4.99 114.94 117.42 2wu1 s ASN 105 Ca 0.08 -0.56 0.01 0.00 -0.71 0.00 0.00 52.86 51.69 2wu1 s ASN 105 Cb -0.14 -1.35 -0.02 0.00 0.41 0.00 0.00 41.25 40.15 2wu1 s ASN 105 CO 0.07 0.06 -0.05 -0.76 -1.51 0.00 0.00 177.10 174.90 2wu1 s LEU 106 N 0.88 2.25 0.28 0.60 1.43 -1.26 -2.27 118.68 120.59 2wu1 s LEU 106 Ca -0.07 -0.53 -0.29 0.00 -1.03 0.00 0.00 54.13 52.21 2wu1 s LEU 106 Cb -0.15 -0.03 -0.09 0.00 0.03 0.00 0.00 46.19 45.94 2wu1 s LEU 106 CO -0.02 -0.25 1.08 -0.76 0.23 0.00 0.00 176.35 176.63 2wu1 s LEU 107 N -1.53 4.55 -0.64 1.79 1.43 -1.26 -5.00 118.68 118.02 2wu1 s LEU 107 Ca -0.13 2.23 -0.21 0.00 -1.03 0.00 0.00 54.13 55.00 2wu1 s LEU 107 Cb -0.10 -3.65 0.09 0.00 0.03 0.00 0.00 46.19 42.56 2wu1 s LEU 107 CO -0.00 -0.13 0.84 0.21 0.23 0.00 0.00 176.35 177.50 2wu1 s ASN 108 N -0.94 6.19 0.00 2.29 2.47 -1.26 -4.88 114.94 118.82 2wu1 s ASN 108 Ca 0.45 -1.25 0.13 0.00 0.42 0.00 0.00 52.86 52.61 2wu1 s ASN 108 Cb -0.31 -2.36 0.65 0.00 -1.45 0.00 0.00 41.25 37.78 2wu1 s ASN 108 CO 0.40 -1.27 1.37 0.61 -3.72 0.00 0.00 177.10 174.49 2wu1 n GLY 109 N 5.30 -0.79 0.50 1.21 0.00 -1.26 -2.03 105.19 108.12 2wu1 n GLY 109 Ca -0.06 -0.06 0.07 0.00 0.00 0.00 0.00 46.02 45.97 2wu1 n GLY 109 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wu1 n ASN 110 N -1.34 3.01 -4.70 1.61 3.02 -1.26 -1.01 115.26 114.59 2wu1 n ASN 110 Ca 0.06 -2.65 -0.43 0.00 -0.03 0.00 0.00 54.58 51.52 2wu1 n ASN 110 Cb 0.12 -0.36 -0.02 0.00 -0.61 0.00 0.00 39.78 38.91 2wu1 n ASN 110 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wu1 n ALA 111 N -0.50 1.49 0.16 5.41 0.00 -0.86 -4.89 120.51 121.32 2wu1 n ALA 111 Ca 0.15 0.38 0.01 0.00 0.00 0.00 0.00 53.44 53.98 2wu1 n ALA 111 Cb 0.63 -2.31 0.28 0.00 0.00 0.00 0.00 19.45 18.05 2wu1 n ALA 111 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2wu1 h PRO 112 N 3.65 0.00 -4.43 0.00 0.13 -1.96 -3.38 132.00 126.02 2wu1 h PRO 112 Ca -0.46 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.02 2wu1 h PRO 112 Cb 1.27 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.00 2wu1 h PRO 112 CO 0.71 0.48 -0.72 0.34 -0.23 0.00 0.00 178.00 178.59 2wu1 s ASP 113 N -6.84 4.63 0.06 1.44 -1.08 -1.26 -5.00 116.67 108.63 2wu1 s ASP 113 Ca -0.02 -2.18 -0.20 0.00 -0.52 0.00 0.00 52.55 49.62 2wu1 s ASP 113 Cb 0.13 -1.54 -0.12 0.00 -1.46 0.00 0.00 42.92 39.94 2wu1 s ASP 113 CO 0.74 -0.37 1.48 0.40 0.52 0.00 0.00 175.17 177.94 2wu1 h ILE 114 N 6.48 1.26 -0.76 4.11 2.04 -1.97 -1.52 117.51 127.15 2wu1 h ILE 114 Ca -0.05 -0.88 0.10 0.00 1.00 0.00 0.00 64.86 65.02 2wu1 h ILE 114 Cb 1.01 1.51 -0.07 0.00 -0.74 0.00 0.00 36.82 38.52 2wu1 h ILE 114 CO 0.53 0.26 0.40 0.44 0.00 0.00 0.00 178.15 179.78 2wu1 h ASP 115 N 0.05 0.54 0.16 1.72 3.32 -1.97 -0.85 116.42 119.39 2wu1 h ASP 115 Ca 0.05 0.06 -0.13 0.00 0.02 0.00 0.00 57.03 57.02 2wu1 h ASP 115 Cb 0.40 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 2wu1 h ASP 115 CO 0.01 0.30 -0.49 0.00 -1.72 0.00 0.00 179.24 177.35 2wu1 h ALA 116 N 1.44 0.90 -0.17 3.45 0.00 -1.92 -1.17 119.26 121.79 2wu1 h ALA 116 Ca 0.37 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2wu1 h ALA 116 Cb 0.38 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2wu1 h ALA 116 CO -0.27 0.66 -0.00 1.49 0.00 0.00 0.00 179.25 181.13 2wu1 h GLU 117 N 0.30 0.30 -0.54 0.00 4.57 -0.72 -1.58 114.58 116.92 2wu1 h GLU 117 Ca 0.02 -0.10 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 2wu1 h GLU 117 Cb 0.97 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.50 2wu1 h GLU 117 CO 0.08 0.53 0.29 0.00 -1.18 0.00 0.00 179.01 178.73 2wu1 h ARG 119 N 0.72 0.64 -0.41 0.00 2.43 -1.15 -2.65 114.38 113.96 2wu1 h ARG 119 Ca 0.19 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 2wu1 h ARG 119 Cb 0.06 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 2wu1 h ARG 119 CO -0.03 0.49 0.12 1.96 -1.51 0.00 0.00 179.97 181.01 2wu1 h GLN 120 N 0.61 0.59 -0.76 0.20 4.20 -1.13 -0.96 115.11 117.86 2wu1 h GLN 120 Ca 0.16 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 2wu1 h GLN 120 Cb 0.03 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2wu1 h GLN 120 CO -0.03 0.52 0.36 -0.92 -0.67 0.00 0.00 178.83 178.10 2wu1 h TYR 121 N 0.58 1.09 -0.46 2.96 3.20 -1.06 0.11 116.97 123.40 2wu1 h TYR 121 Ca 0.14 -0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.86 2wu1 h TYR 121 Cb 0.18 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 2wu1 h TYR 121 CO 0.01 0.80 -0.07 0.93 -1.64 0.00 0.00 178.16 178.19 2wu1 h GLU 122 N 1.07 0.86 -0.78 1.82 4.39 -1.08 -1.98 114.58 118.88 2wu1 h GLU 122 Ca 0.26 -0.31 0.03 0.00 0.34 0.00 0.00 59.36 59.68 2wu1 h GLU 122 Cb 0.12 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.67 2wu1 h GLU 122 CO -0.03 0.95 0.49 0.93 -1.16 0.00 0.00 179.01 180.19 2wu1 h GLU 123 N 0.70 0.94 -0.51 2.33 5.08 -0.84 -1.18 114.58 121.09 2wu1 h GLU 123 Ca 0.12 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2wu1 h GLU 123 Cb 0.61 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2wu1 h GLU 123 CO 0.04 0.62 0.31 -0.22 -1.00 0.00 0.00 179.01 178.76 2wu1 h LYS 124 N 0.96 0.69 -0.27 2.33 3.11 -0.57 -0.55 116.57 122.28 2wu1 h LYS 124 Ca 0.31 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 58.09 2wu1 h LYS 124 Cb 0.01 -0.15 -0.01 0.00 -1.00 0.00 0.00 32.23 31.08 2wu1 h LYS 124 CO -0.11 0.50 0.17 0.82 -2.81 0.00 0.00 179.45 178.03 2wu1 h ILE 125 N 0.69 1.09 -0.24 2.00 2.04 -1.00 -2.76 117.51 119.33 2wu1 h ILE 125 Ca 0.18 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2wu1 h ILE 125 Cb -0.02 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2wu1 h ILE 125 CO -0.03 0.09 0.09 -0.09 0.00 0.00 0.00 178.15 178.20 2wu1 h ARG 126 N 0.36 0.32 0.00 2.37 2.43 -0.77 -1.75 114.38 117.34 2wu1 h ARG 126 Ca 0.10 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 2wu1 h ARG 126 Cb -0.01 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2wu1 h ARG 126 CO -0.02 0.28 -0.26 0.66 -1.51 0.00 0.00 179.97 179.12 2wu1 h SER 127 N 0.33 0.00 1.08 -3.80 4.64 -0.81 -0.92 113.55 114.06 2wu1 h SER 127 Ca 0.08 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.21 2wu1 h SER 127 Cb 0.08 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 2wu1 h SER 127 CO -0.01 0.26 -0.93 1.88 -0.87 0.00 0.00 176.83 177.17 2wu1 h TYR 128 N 0.00 0.00 0.00 4.77 0.05 -1.28 -3.49 116.97 117.02 2wu1 h TYR 128 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2wu1 h TYR 128 Cb 0.52 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.26 2wu1 h TYR 128 CO 0.00 0.91 0.00 0.41 -1.05 0.00 0.00 178.16 178.43 2wu1 n GLY 129 N 1.33 2.34 3.23 3.88 0.00 -0.35 -5.02 105.19 110.60 2wu1 n GLY 129 Ca -0.00 -0.74 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 2wu1 n GLY 129 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wu1 s LYS 130 N 0.00 0.81 -0.14 1.61 -2.85 -1.26 -4.66 119.74 113.25 2wu1 s LYS 130 Ca 0.00 -0.63 -0.27 0.00 -1.00 0.00 0.00 55.97 54.07 2wu1 s LYS 130 Cb 0.00 0.35 -0.01 0.00 -2.06 0.00 0.00 37.83 36.10 2wu1 s LYS 130 CO 0.00 -0.26 0.89 0.42 0.10 0.00 0.00 175.35 176.50 2wu1 s ILE 131 N -2.91 4.85 0.06 3.79 1.01 -1.26 -4.67 121.20 122.08 2wu1 s ILE 131 Ca -0.02 1.77 -0.13 0.00 0.00 0.00 0.00 60.65 62.27 2wu1 s ILE 131 Cb 0.00 -4.20 -0.29 0.00 0.01 0.00 0.00 42.46 37.99 2wu1 s ILE 131 CO -0.06 0.03 1.12 0.45 0.00 0.00 0.00 174.94 176.48 2wu1 h HIS 132 N 7.22 0.93 -2.95 3.97 3.86 -1.28 0.11 115.15 127.01 2wu1 h HIS 132 Ca -0.30 -0.60 -0.28 0.00 -1.16 0.00 0.00 60.37 58.03 2wu1 h HIS 132 Cb 1.14 -0.07 -0.35 0.00 1.06 0.00 0.00 27.41 29.19 2wu1 h HIS 132 CO 0.71 1.44 -0.61 -1.17 0.86 0.00 0.00 177.93 179.16 2wu1 s LEU 133 N -7.76 -0.13 -0.26 2.43 2.96 -1.11 -2.00 118.68 112.81 2wu1 s LEU 133 Ca -0.08 0.30 -0.08 0.00 -0.22 0.00 0.00 54.13 54.04 2wu1 s LEU 133 Cb 0.06 0.39 -0.03 0.00 0.50 0.00 0.00 46.19 47.10 2wu1 s LEU 133 CO 0.93 -0.26 0.10 0.12 -1.32 0.00 0.00 176.35 175.92 2wu1 s PHE 134 N 2.33 3.12 -0.12 5.38 2.19 0.68 -0.59 117.98 130.97 2wu1 s PHE 134 Ca 0.03 -0.30 -0.06 0.00 0.33 0.00 0.00 56.93 56.93 2wu1 s PHE 134 Cb -0.13 -2.28 -0.04 0.00 -1.31 0.00 0.00 43.02 39.27 2wu1 s PHE 134 CO -0.07 -0.31 0.11 1.41 1.83 0.00 0.00 175.22 178.18 2wu1 s MET 135 N 1.65 3.39 0.35 10.12 -2.45 0.05 -0.39 119.30 132.02 2wu1 s MET 135 Ca 0.06 -0.21 -0.06 0.00 -1.25 0.00 0.00 55.69 54.24 2wu1 s MET 135 Cb -0.15 -3.11 0.02 0.00 1.25 0.00 0.00 34.83 32.84 2wu1 s MET 135 CO 0.05 0.72 0.56 0.41 1.05 0.00 0.00 175.02 177.82 2wu1 n GLY 136 N 2.15 1.78 0.00 2.11 0.00 -0.17 -3.48 105.19 107.58 2wu1 n GLY 136 Ca -0.19 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2wu1 n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wu1 n GLY 137 N -0.54 4.16 3.01 -0.02 0.00 -1.26 -0.77 105.19 109.77 2wu1 n GLY 137 Ca -0.02 -2.16 -0.14 0.00 0.00 0.00 0.00 46.02 43.69 2wu1 n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wu1 s VAL 138 N -0.24 0.44 0.67 1.61 0.11 -1.26 -4.57 120.40 117.16 2wu1 s VAL 138 Ca 0.00 -0.69 -0.11 0.00 -2.93 0.00 0.00 61.98 58.25 2wu1 s VAL 138 Cb 0.00 -0.46 -0.01 0.00 -1.53 0.00 0.00 36.38 34.38 2wu1 s VAL 138 CO 0.00 -0.17 1.06 -0.83 -3.33 0.00 0.00 175.10 171.83 2wu1 s GLY 139 N -0.93 1.65 0.32 6.54 0.00 -0.19 -4.91 107.32 109.80 2wu1 s GLY 139 Ca -0.05 -0.19 0.06 0.00 0.00 0.00 0.00 44.72 44.54 2wu1 s GLY 139 CO 0.00 0.13 1.83 3.43 0.00 0.00 0.00 173.10 178.48 2wu1 h ASN 140 N -0.50 0.77 -0.17 1.64 2.35 -1.91 0.65 115.58 118.41 2wu1 h ASN 140 Ca -0.44 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 2wu1 h ASN 140 Cb 1.22 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.50 2wu1 h ASN 140 CO 0.62 0.35 0.00 -0.90 -1.65 0.00 0.00 177.43 175.86 2wu1 n ASP 141 N -4.64 1.24 0.00 5.81 5.68 -1.26 -4.42 116.55 118.96 2wu1 n ASP 141 Ca 0.20 -1.76 0.00 0.00 -0.50 0.00 0.00 54.79 52.73 2wu1 n ASP 141 Cb 0.48 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.36 2wu1 n ASP 141 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wu1 n GLY 142 N 0.98 0.73 3.77 6.12 0.00 0.22 -4.57 105.19 112.43 2wu1 n GLY 142 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 2wu1 n GLY 142 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2wu1 s HIS 143 N -2.09 3.14 -0.12 1.61 -3.43 -1.26 -0.96 115.29 112.19 2wu1 s HIS 143 Ca 0.00 1.57 -0.01 0.00 -0.80 0.00 0.00 55.06 55.82 2wu1 s HIS 143 Cb 0.00 -3.37 -0.03 0.00 -1.43 0.00 0.00 32.58 27.76 2wu1 s HIS 143 CO 0.00 -1.19 -0.07 -1.50 -2.00 0.00 0.00 174.74 169.99 2wu1 s ILE 144 N -1.40 3.66 0.00 -5.38 2.07 -1.25 -1.03 121.20 117.87 2wu1 s ILE 144 Ca 0.55 -0.46 0.00 0.00 -1.41 0.00 0.00 60.65 59.33 2wu1 s ILE 144 Cb -0.30 -2.55 0.00 0.00 0.13 0.00 0.00 42.46 39.73 2wu1 s ILE 144 CO 0.38 0.54 0.00 0.00 -1.91 0.00 0.00 174.94 173.95 2wu1 n ALA 145 N 3.06 0.00 -1.32 1.50 0.00 -1.26 -1.32 120.51 121.17 2wu1 n ALA 145 Ca -0.18 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.06 2wu1 n ALA 145 Cb 0.53 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.15 2wu1 n ALA 145 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2wu1 n PHE 146 N 14.00 2.63 -2.28 0.00 3.72 -1.26 -4.83 117.46 129.44 2wu1 n PHE 146 Ca 0.00 -1.94 -0.38 0.00 -0.05 0.00 0.00 57.45 55.08 2wu1 n PHE 146 Cb 0.00 -0.89 -0.02 0.00 -0.94 0.00 0.00 39.48 37.63 2wu1 n PHE 146 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2wu1 n ASN 147 N -1.11 4.15 -4.61 4.37 3.02 -0.43 -4.89 115.26 115.76 2wu1 n ASN 147 Ca 0.54 -2.83 -0.30 0.00 -0.03 0.00 0.00 54.58 51.96 2wu1 n ASN 147 Cb 1.40 -1.71 0.19 0.00 -0.61 0.00 0.00 39.78 39.06 2wu1 n ASN 147 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2wu1 s GLU 148 N 4.88 0.33 0.20 3.52 0.41 -1.26 -3.93 118.70 122.84 2wu1 s GLU 148 Ca 0.58 1.20 -0.31 0.00 -0.41 0.00 0.00 54.97 56.02 2wu1 s GLU 148 Cb 0.04 -1.67 -0.16 0.00 -1.78 0.00 0.00 34.13 30.56 2wu1 s GLU 148 CO 0.09 -2.99 1.06 -2.30 -0.49 0.00 0.00 175.26 170.62 2wu1 n PRO 149 N -4.45 1.06 -2.08 0.39 -0.02 -1.26 -1.50 135.00 127.15 2wu1 n PRO 149 Ca 0.08 0.38 -0.07 0.00 -2.02 0.00 0.00 63.50 61.87 2wu1 n PRO 149 Cb 0.53 -1.79 -0.00 0.00 -0.02 0.00 0.00 33.50 32.21 2wu1 n PRO 149 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wu1 n ALA 150 N 1.03 -0.19 -2.44 3.55 0.00 0.38 -4.95 120.51 117.88 2wu1 n ALA 150 Ca 0.14 0.06 -0.37 0.00 0.00 0.00 0.00 53.44 53.27 2wu1 n ALA 150 Cb 0.26 -1.05 -0.06 0.00 0.00 0.00 0.00 19.45 18.60 2wu1 n ALA 150 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2wu1 s SER 151 N -2.71 6.82 0.36 0.00 0.01 -0.56 -5.04 113.70 112.58 2wu1 s SER 151 Ca 0.00 1.01 -0.28 0.00 1.31 0.00 0.00 55.95 57.98 2wu1 s SER 151 Cb 0.00 -2.26 -0.11 0.00 0.21 0.00 0.00 66.02 63.85 2wu1 s SER 151 CO 0.00 0.22 1.48 -0.24 0.41 0.00 0.00 173.24 175.12 2wu1 n SER 152 N 1.32 3.68 0.00 2.44 2.88 -1.26 -4.76 113.62 117.92 2wu1 n SER 152 Ca -0.10 1.21 0.11 0.00 -1.33 0.00 0.00 58.87 58.76 2wu1 n SER 152 Cb 0.52 -1.60 0.58 0.00 -0.75 0.00 0.00 64.21 62.96 2wu1 n SER 152 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2wu1 n LEU 153 N 0.82 0.00 -0.47 2.46 4.77 -1.26 -2.67 117.00 120.64 2wu1 n LEU 153 Ca 0.03 0.25 0.08 0.00 -0.03 0.00 0.00 56.01 56.34 2wu1 n LEU 153 Cb 0.38 -0.25 0.19 0.00 -2.33 0.00 0.00 43.42 41.42 2wu1 n LEU 153 CO 0.64 -0.06 0.62 0.00 -1.33 0.00 0.00 177.39 177.25 2wu1 n ALA 154 N -1.25 2.75 -1.61 -1.18 0.00 -1.26 -3.75 120.51 114.22 2wu1 n ALA 154 Ca 0.12 -2.59 -0.34 0.00 0.00 0.00 0.00 53.44 50.62 2wu1 n ALA 154 Cb 0.16 -0.52 0.03 0.00 0.00 0.00 0.00 19.45 19.12 2wu1 n ALA 154 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2wu1 s SER 155 N -2.54 5.33 0.28 0.00 1.04 -1.09 -4.46 113.70 112.26 2wu1 s SER 155 Ca 0.37 2.06 0.03 0.00 0.48 0.00 0.00 55.95 58.89 2wu1 s SER 155 Cb 0.32 -2.56 0.03 0.00 0.10 0.00 0.00 66.02 63.90 2wu1 s SER 155 CO 0.04 -1.48 0.22 0.54 0.98 0.00 0.00 173.24 173.54 2wu1 n ARG 156 N -2.02 1.05 -1.98 4.02 5.12 -1.26 -1.11 116.66 120.49 2wu1 n ARG 156 Ca 0.11 -1.75 -0.42 0.00 -1.93 0.00 0.00 57.85 53.86 2wu1 n ARG 156 Cb 0.52 0.17 -0.03 0.00 -1.16 0.00 0.00 32.46 31.96 2wu1 n ARG 156 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2wu1 s THR 157 N -1.35 2.67 0.17 0.55 2.01 -1.26 -3.20 115.64 115.23 2wu1 s THR 157 Ca 0.17 0.51 -0.23 0.00 0.31 0.00 0.00 61.69 62.45 2wu1 s THR 157 Cb -0.01 -3.33 0.08 0.00 0.01 0.00 0.00 72.50 69.24 2wu1 s THR 157 CO 0.11 0.06 1.03 0.00 -0.69 0.00 0.00 174.62 175.13 2wu1 s ARG 158 N 0.52 1.24 0.17 4.92 1.70 -0.64 -4.70 118.95 122.15 2wu1 s ARG 158 Ca 0.65 -0.76 -0.23 0.00 -0.47 0.00 0.00 55.73 54.92 2wu1 s ARG 158 Cb -0.43 0.37 -0.08 0.00 -0.57 0.00 0.00 34.95 34.24 2wu1 s ARG 158 CO 0.36 -0.58 0.74 -1.50 -1.08 0.00 0.00 175.30 173.25 2wu1 s ILE 159 N -2.49 4.46 0.05 4.99 2.07 -1.26 -1.02 121.20 127.99 2wu1 s ILE 159 Ca 0.19 1.54 0.03 0.00 -1.41 0.00 0.00 60.65 61.00 2wu1 s ILE 159 Cb -0.02 -4.04 -0.02 0.00 0.13 0.00 0.00 42.46 38.51 2wu1 s ILE 159 CO 0.04 0.44 -0.10 -0.54 -1.91 0.00 0.00 174.94 172.87 2wu1 s LYS 160 N -1.36 0.64 -0.22 3.50 -0.14 -0.01 -4.96 119.74 117.19 2wu1 s LYS 160 Ca 0.37 -0.78 -0.16 0.00 -1.36 0.00 0.00 55.97 54.04 2wu1 s LYS 160 Cb -0.21 -0.52 -0.04 0.00 -1.68 0.00 0.00 37.83 35.38 2wu1 s LYS 160 CO 0.24 0.11 0.40 0.99 -0.76 0.00 0.00 175.35 176.33 2wu1 s THR 161 N -1.22 5.19 0.22 2.17 2.01 -1.26 -1.66 115.64 121.08 2wu1 s THR 161 Ca -0.06 0.70 -0.30 0.00 0.31 0.00 0.00 61.69 62.34 2wu1 s THR 161 Cb -0.09 -3.73 -0.09 0.00 0.01 0.00 0.00 72.50 68.60 2wu1 s THR 161 CO 0.01 0.23 1.24 -0.76 -0.69 0.00 0.00 174.62 174.64 2wu1 s LEU 162 N 1.49 4.45 0.60 4.42 1.43 0.28 -4.94 118.68 126.42 2wu1 s LEU 162 Ca 0.19 2.35 -0.19 0.00 -1.03 0.00 0.00 54.13 55.44 2wu1 s LEU 162 Cb -0.15 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.42 2wu1 s LEU 162 CO 0.08 -0.42 1.24 0.41 0.23 0.00 0.00 176.35 177.90 2wu1 n THR 163 N 2.21 4.31 -0.29 5.49 -1.04 -1.26 -4.88 114.28 118.83 2wu1 n THR 163 Ca 0.04 -0.50 0.04 0.00 -2.04 0.00 0.00 64.05 61.58 2wu1 n THR 163 Cb 0.44 -1.47 0.24 0.00 -1.82 0.00 0.00 70.33 67.72 2wu1 n THR 163 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 2wu1 h HIS 164 N 0.82 1.02 -0.72 -1.42 2.76 -2.00 -1.96 115.15 113.66 2wu1 h HIS 164 Ca -0.50 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 57.68 2wu1 h HIS 164 Cb 1.33 -0.34 -0.03 0.00 1.55 0.00 0.00 27.41 29.92 2wu1 h HIS 164 CO 0.42 0.55 0.40 -0.44 -1.30 0.00 0.00 177.93 177.56 2wu1 h ASP 165 N 1.02 0.90 -0.55 3.26 3.32 -2.00 -1.55 116.42 120.82 2wu1 h ASP 165 Ca 0.37 -0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.27 2wu1 h ASP 165 Cb 0.16 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 2wu1 h ASP 165 CO -0.13 0.73 0.11 0.74 -1.72 0.00 0.00 179.24 178.97 2wu1 h THR 166 N 0.99 1.24 -0.21 0.35 2.02 -1.76 -1.37 112.91 114.18 2wu1 h THR 166 Ca 0.26 -0.93 -0.05 0.00 0.77 0.00 0.00 66.41 66.46 2wu1 h THR 166 Cb 0.02 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2wu1 h THR 166 CO -0.04 0.35 -0.07 0.03 0.37 0.00 0.00 175.52 176.16 2wu1 h ARG 167 N 0.89 0.41 -0.52 6.66 3.08 -0.98 -0.99 114.38 122.93 2wu1 h ARG 167 Ca 0.19 -0.16 0.07 0.00 0.07 0.00 0.00 59.98 60.14 2wu1 h ARG 167 Cb 0.37 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 2wu1 h ARG 167 CO 0.01 0.67 0.20 0.28 -1.07 0.00 0.00 179.97 180.05 2wu1 h VAL 168 N 0.12 0.84 -0.59 2.04 2.07 -1.22 -0.56 116.25 118.95 2wu1 h VAL 168 Ca 0.05 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 2wu1 h VAL 168 Cb 0.53 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 2wu1 h VAL 168 CO 0.02 0.07 0.30 0.00 0.02 0.00 0.00 177.57 177.98 2wu1 h ALA 169 N 1.34 1.42 -0.00 1.67 0.00 -1.05 -2.61 119.26 120.03 2wu1 h ALA 169 Ca 0.25 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2wu1 h ALA 169 Cb 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2wu1 h ALA 169 CO -0.24 0.47 -0.35 0.09 0.00 0.00 0.00 179.25 179.21 2wu1 n ASN 170 N -4.37 0.44 0.22 0.00 4.13 -0.39 -4.03 115.26 111.24 2wu1 n ASN 170 Ca 0.05 -0.17 0.15 0.00 1.68 0.00 0.00 54.58 56.29 2wu1 n ASN 170 Cb 0.12 0.07 0.73 0.00 -1.54 0.00 0.00 39.78 39.16 2wu1 n ASN 170 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 2wu1 h SER 171 N 0.13 0.00 0.15 6.41 4.64 -0.71 -1.24 113.55 122.93 2wu1 h SER 171 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wu1 h SER 171 Cb 0.49 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2wu1 h SER 171 CO 0.00 0.00 -0.01 0.08 -0.87 0.00 0.00 176.83 176.03 2wu1 h ARG 172 N 0.00 0.00 0.00 4.77 0.11 -1.75 0.40 114.38 117.91 2wu1 h ARG 172 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2wu1 h ARG 172 Cb 0.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.25 2wu1 h ARG 172 CO 0.00 0.01 -0.88 1.19 0.10 0.00 0.00 179.97 180.39 2wu1 n PHE 173 N -3.23 0.15 -2.30 4.08 3.72 -0.47 -4.28 117.46 115.13 2wu1 n PHE 173 Ca -0.02 0.04 -0.30 0.00 -0.05 0.00 0.00 57.45 57.11 2wu1 n PHE 173 Cb 0.11 -0.31 0.01 0.00 -0.94 0.00 0.00 39.48 38.35 2wu1 n PHE 173 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2wu1 n PHE 174 N -1.76 3.28 -3.91 1.38 3.01 -0.24 -4.91 117.46 114.31 2wu1 n PHE 174 Ca 0.03 -2.88 -0.27 0.00 1.01 0.00 0.00 57.45 55.34 2wu1 n PHE 174 Cb 0.39 -0.40 0.01 0.00 -0.01 0.00 0.00 39.48 39.47 2wu1 n PHE 174 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2wu1 n ASP 175 N -0.51 -2.42 -2.46 4.37 8.00 -1.18 -1.71 116.55 120.64 2wu1 n ASP 175 Ca 0.43 -0.88 -0.12 0.00 0.71 0.00 0.00 54.79 54.93 2wu1 n ASP 175 Cb 0.55 -3.56 -0.01 0.00 -0.02 0.00 0.00 41.12 38.09 2wu1 n ASP 175 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2wu1 n ASN 176 N -2.91 -3.78 -4.10 -2.24 4.13 0.13 -4.93 115.26 101.56 2wu1 n ASN 176 Ca -0.14 0.20 -0.34 0.00 1.68 0.00 0.00 54.58 55.98 2wu1 n ASN 176 Cb 0.60 -3.21 -0.14 0.00 -1.54 0.00 0.00 39.78 35.49 2wu1 n ASN 176 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2wu1 s ASP 177 N -2.04 4.88 0.37 6.41 2.15 -0.69 -4.96 116.67 122.78 2wu1 s ASP 177 Ca 0.01 -1.73 0.11 0.00 0.43 0.00 0.00 52.55 51.36 2wu1 s ASP 177 Cb -0.00 -1.69 0.88 0.00 -0.30 0.00 0.00 42.92 41.80 2wu1 s ASP 177 CO 0.01 -0.35 1.87 0.58 -0.17 0.00 0.00 175.17 177.11 2wu1 h VAL 178 N 6.53 0.81 0.00 1.11 2.07 -1.88 -1.58 116.25 123.32 2wu1 h VAL 178 Ca -0.14 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2wu1 h VAL 178 Cb 1.04 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2wu1 h VAL 178 CO 0.56 0.11 -0.10 0.78 0.02 0.00 0.00 177.57 178.95 2wu1 h ASN 179 N 0.63 0.00 1.64 0.57 2.35 -1.95 -1.96 115.58 116.86 2wu1 h ASN 179 Ca 0.44 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.13 2wu1 h ASN 179 Cb 0.78 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.14 2wu1 h ASN 179 CO -0.19 0.10 -0.28 1.56 -1.65 0.00 0.00 177.43 176.96 2wu1 h GLN 180 N 0.00 0.00 -6.46 0.81 1.08 -1.60 -3.46 115.11 105.48 2wu1 h GLN 180 Ca -0.00 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.66 2wu1 h GLN 180 Cb 0.31 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.74 2wu1 h GLN 180 CO 0.01 0.28 0.58 0.08 -0.95 0.00 0.00 178.83 178.83 2wu1 s VAL 181 N -3.12 4.08 0.55 -0.54 1.01 -0.74 -4.99 120.40 116.65 2wu1 s VAL 181 Ca 0.05 1.48 -0.21 0.00 0.00 0.00 0.00 61.98 63.30 2wu1 s VAL 181 Cb 0.07 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 2wu1 s VAL 181 CO 0.70 0.10 1.25 -2.65 0.00 0.00 0.00 175.10 174.50 2wu1 n PRO 182 N 4.10 1.49 0.10 2.72 -0.02 -1.26 -4.92 135.00 137.21 2wu1 n PRO 182 Ca 0.09 0.55 -0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2wu1 n PRO 182 Cb 0.46 -2.44 -0.03 0.00 -0.02 0.00 0.00 33.50 31.47 2wu1 n PRO 182 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2wu1 h LYS 183 N 1.23 0.00 -6.04 -0.52 1.57 -1.94 -3.46 116.57 107.41 2wu1 h LYS 183 Ca -0.50 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 57.74 2wu1 h LYS 183 Cb 1.32 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.45 2wu1 h LYS 183 CO 0.56 0.57 -0.79 0.71 -0.57 0.00 0.00 179.45 179.93 2wu1 s TYR 184 N -2.89 1.90 0.02 -1.35 2.02 -1.26 -0.55 117.35 115.24 2wu1 s TYR 184 Ca 0.02 -0.45 -0.01 0.00 -0.37 0.00 0.00 57.07 56.26 2wu1 s TYR 184 Cb 0.08 -0.94 -0.02 0.00 -0.40 0.00 0.00 41.96 40.68 2wu1 s TYR 184 CO 0.77 0.37 0.00 0.00 -1.57 0.00 0.00 175.55 175.12 2wu1 s ALA 185 N -2.01 0.08 -0.04 3.71 0.00 -0.67 -1.17 121.76 121.66 2wu1 s ALA 185 Ca 0.17 -0.58 -0.20 0.00 0.00 0.00 0.00 51.96 51.35 2wu1 s ALA 185 Cb -0.06 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.17 2wu1 s ALA 185 CO 0.07 -0.20 0.58 -0.51 0.00 0.00 0.00 175.76 175.71 2wu1 s LEU 186 N -1.62 4.37 -0.04 0.00 1.02 0.24 -0.83 118.68 121.80 2wu1 s LEU 186 Ca -0.13 1.07 -0.04 0.00 0.02 0.00 0.00 54.13 55.05 2wu1 s LEU 186 Cb -0.07 -2.88 0.01 0.00 0.02 0.00 0.00 46.19 43.26 2wu1 s LEU 186 CO -0.02 0.05 0.11 0.28 0.02 0.00 0.00 176.35 176.79 2wu1 s THR 187 N 0.15 -0.00 0.79 5.49 -1.32 -0.19 -1.83 115.64 118.74 2wu1 s THR 187 Ca 0.31 0.00 -0.14 0.00 -1.21 0.00 0.00 61.69 60.65 2wu1 s THR 187 Cb -0.17 -0.17 0.07 0.00 -1.51 0.00 0.00 72.50 70.72 2wu1 s THR 187 CO 0.16 0.00 1.19 1.33 -2.21 0.00 0.00 174.62 175.08 2wu1 n VAL 188 N 3.03 2.28 -2.38 5.08 0.24 -0.01 -1.63 118.33 124.95 2wu1 n VAL 188 Ca -0.12 -0.24 -0.25 0.00 -2.04 0.00 0.00 64.34 61.69 2wu1 n VAL 188 Cb 0.59 -1.21 0.05 0.00 -1.47 0.00 0.00 33.84 31.80 2wu1 n VAL 188 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2wu1 s GLY 189 N -2.04 1.69 0.19 7.63 0.00 -1.19 -4.73 107.32 108.87 2wu1 s GLY 189 Ca 0.74 -0.97 -0.12 0.00 0.00 0.00 0.00 44.72 44.37 2wu1 s GLY 189 CO 0.50 -0.63 1.85 -2.08 0.00 0.00 0.00 173.10 172.74 2wu1 h VAL 190 N -0.31 1.17 -0.91 1.40 2.07 -1.76 -1.77 116.25 116.14 2wu1 h VAL 190 Ca -0.44 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 66.78 2wu1 h VAL 190 Cb 1.30 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2wu1 h VAL 190 CO 0.58 0.16 0.60 1.23 0.02 0.00 0.00 177.57 180.16 2wu1 h GLY 191 N 0.85 1.31 0.99 2.17 0.00 -1.20 0.39 103.07 107.57 2wu1 h GLY 191 Ca 0.23 -0.46 0.01 0.00 0.00 0.00 0.00 47.33 47.10 2wu1 h GLY 191 CO -0.05 0.42 0.23 -0.84 0.00 0.00 0.00 176.54 176.30 2wu1 h THR 192 N 1.18 1.08 -0.52 4.70 2.02 -1.42 -1.73 112.91 118.22 2wu1 h THR 192 Ca 0.35 -0.16 -0.10 0.00 0.77 0.00 0.00 66.41 67.27 2wu1 h THR 192 Cb -0.06 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 2wu1 h THR 192 CO -0.10 0.09 -0.08 -0.07 0.37 0.00 0.00 175.52 175.73 2wu1 h LEU 193 N 0.47 0.93 -1.81 2.58 3.38 -0.97 -2.66 115.31 117.24 2wu1 h LEU 193 Ca 0.13 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 2wu1 h LEU 193 Cb -0.04 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 2wu1 h LEU 193 CO -0.04 1.03 -0.11 -0.07 0.09 0.00 0.00 178.44 179.34 2wu1 h LEU 194 N 0.85 0.00 -0.19 1.67 3.38 -0.50 -1.87 115.31 118.65 2wu1 h LEU 194 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2wu1 h LEU 194 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2wu1 h LEU 194 CO 0.04 0.11 0.00 0.47 0.09 0.00 0.00 178.44 179.15 2wu1 n ASP 195 N -3.48 0.39 -4.77 -0.43 8.00 -0.69 -4.82 116.55 110.76 2wu1 n ASP 195 Ca -0.01 0.56 -0.35 0.00 0.71 0.00 0.00 54.79 55.70 2wu1 n ASP 195 Cb 0.27 -0.66 0.02 0.00 -0.02 0.00 0.00 41.12 40.72 2wu1 n ASP 195 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wu1 s ALA 196 N -3.11 2.63 0.19 2.24 0.00 -0.71 -4.64 121.76 118.36 2wu1 s ALA 196 Ca 0.09 0.86 -0.05 0.00 0.00 0.00 0.00 51.96 52.86 2wu1 s ALA 196 Cb 0.12 -3.39 0.12 0.00 0.00 0.00 0.00 23.12 19.97 2wu1 s ALA 196 CO 0.45 -0.94 1.55 1.49 0.00 0.00 0.00 175.76 178.31 2wu1 h GLU 197 N 1.00 0.72 -3.50 0.00 4.81 -0.90 -3.45 114.58 113.26 2wu1 h GLU 197 Ca -0.50 -0.37 -0.22 0.00 -0.13 0.00 0.00 59.36 58.14 2wu1 h GLU 197 Cb 1.27 0.01 -0.29 0.00 0.63 0.00 0.00 28.75 30.37 2wu1 h GLU 197 CO 0.56 0.98 -0.64 -2.00 -0.73 0.00 0.00 179.01 177.19 2wu1 s GLU 198 N -4.32 0.08 -0.12 1.92 2.12 -0.85 -4.55 118.70 112.98 2wu1 s GLU 198 Ca -0.09 0.16 0.03 0.00 0.36 0.00 0.00 54.97 55.43 2wu1 s GLU 198 Cb 0.12 -0.02 0.00 0.00 0.26 0.00 0.00 34.13 34.49 2wu1 s GLU 198 CO 0.85 -0.05 -0.23 0.08 -0.54 0.00 0.00 175.26 175.37 2wu1 s VAL 199 N 0.33 2.01 -0.20 3.70 1.01 -0.77 -0.23 120.40 126.26 2wu1 s VAL 199 Ca -0.02 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 60.99 2wu1 s VAL 199 Cb -0.04 -1.76 0.04 0.00 0.00 0.00 0.00 36.38 34.62 2wu1 s VAL 199 CO -0.01 0.55 -0.13 -0.32 0.00 0.00 0.00 175.10 175.18 2wu1 s MET 200 N 0.57 2.30 -0.18 2.72 0.00 0.48 -0.56 119.30 124.62 2wu1 s MET 200 Ca -0.14 -0.87 -0.07 0.00 0.00 0.00 0.00 55.69 54.61 2wu1 s MET 200 Cb -0.17 -2.47 -0.04 0.00 0.00 0.00 0.00 34.83 32.15 2wu1 s MET 200 CO 0.04 -0.38 0.05 0.42 0.00 0.00 0.00 175.02 175.15 2wu1 s ILE 201 N 1.34 4.68 -0.18 10.11 -1.09 0.36 -1.00 121.20 135.42 2wu1 s ILE 201 Ca -0.00 -0.08 -0.14 0.00 -2.23 0.00 0.00 60.65 58.20 2wu1 s ILE 201 Cb -0.16 -3.10 -0.04 0.00 -1.58 0.00 0.00 42.46 37.58 2wu1 s ILE 201 CO -0.09 0.47 0.33 -0.76 -1.23 0.00 0.00 174.94 173.66 2wu1 s LEU 202 N 0.31 4.20 -0.23 2.97 1.02 0.05 -0.60 118.68 126.41 2wu1 s LEU 202 Ca 0.02 0.49 0.01 0.00 0.02 0.00 0.00 54.13 54.68 2wu1 s LEU 202 Cb -0.13 -2.41 0.05 0.00 0.02 0.00 0.00 46.19 43.73 2wu1 s LEU 202 CO 0.00 0.03 -0.09 -0.69 0.02 0.00 0.00 176.35 175.63 2wu1 s VAL 203 N 0.83 1.76 -0.10 -1.59 1.01 0.32 -4.07 120.40 118.56 2wu1 s VAL 203 Ca 0.17 -1.29 0.03 0.00 0.00 0.00 0.00 61.98 60.89 2wu1 s VAL 203 Cb -0.14 -1.92 0.01 0.00 0.00 0.00 0.00 36.38 34.33 2wu1 s VAL 203 CO 0.06 -0.00 -0.19 -0.76 0.00 0.00 0.00 175.10 174.20 2wu1 s LEU 204 N 1.30 1.92 0.00 3.92 1.43 -1.26 -1.96 118.68 124.03 2wu1 s LEU 204 Ca -0.05 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.56 2wu1 s LEU 204 Cb -0.18 -1.22 0.00 0.00 0.03 0.00 0.00 46.19 44.81 2wu1 s LEU 204 CO -0.06 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.21 2wu1 n GLY 205 N 3.82 1.47 0.27 -3.19 0.00 -1.26 -4.48 105.19 101.82 2wu1 n GLY 205 Ca -0.20 -1.75 0.17 0.00 0.00 0.00 0.00 46.02 44.25 2wu1 n GLY 205 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wu1 h SER 206 N 0.00 0.00 0.40 1.61 4.64 -1.94 -1.81 113.55 116.45 2wu1 h SER 206 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2wu1 h SER 206 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2wu1 h SER 206 CO 0.00 0.00 -0.06 -0.61 -0.87 0.00 0.00 176.83 175.29 2wu1 h GLN 207 N 0.00 0.00 -0.25 4.77 5.75 -1.90 -2.46 115.11 121.02 2wu1 h GLN 207 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2wu1 h GLN 207 Cb 0.48 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.03 2wu1 h GLN 207 CO 0.00 0.06 0.00 1.63 -2.65 0.00 0.00 178.83 177.87 2wu1 n LYS 208 N -3.38 2.42 -0.28 1.69 4.76 -0.68 -4.62 118.16 118.07 2wu1 n LYS 208 Ca -0.02 -2.11 -0.06 0.00 -2.87 0.00 0.00 58.31 53.25 2wu1 n LYS 208 Cb 0.20 -1.49 0.06 0.00 -1.84 0.00 0.00 35.03 31.96 2wu1 n LYS 208 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wu1 h ALA 209 N 4.58 0.99 -0.61 7.82 0.00 -1.52 -0.01 119.26 130.51 2wu1 h ALA 209 Ca 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 2wu1 h ALA 209 Cb 0.97 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2wu1 h ALA 209 CO 0.00 0.60 0.10 -0.07 0.00 0.00 0.00 179.25 179.88 2wu1 h LEU 210 N 1.10 0.97 -0.61 0.00 3.38 -1.82 -1.51 115.31 116.83 2wu1 h LEU 210 Ca 0.26 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2wu1 h LEU 210 Cb 0.20 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2wu1 h LEU 210 CO -0.02 0.98 0.26 0.00 0.09 0.00 0.00 178.44 179.76 2wu1 h ALA 211 N 1.02 0.79 -0.80 1.53 0.00 -1.64 -0.71 119.26 119.45 2wu1 h ALA 211 Ca 0.19 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2wu1 h ALA 211 Cb 0.43 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2wu1 h ALA 211 CO 0.01 0.38 0.34 1.25 0.00 0.00 0.00 179.25 181.24 2wu1 h LEU 212 N 0.84 1.08 -0.53 0.00 5.85 -0.85 -0.53 115.31 121.16 2wu1 h LEU 212 Ca 0.21 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2wu1 h LEU 212 Cb 0.17 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 2wu1 h LEU 212 CO -0.02 0.94 0.24 -0.61 -0.34 0.00 0.00 178.44 178.65 2wu1 h GLN 213 N 1.15 0.78 -0.75 1.25 4.15 -0.92 -0.77 115.11 120.00 2wu1 h GLN 213 Ca 0.27 -0.13 -0.00 0.00 0.77 0.00 0.00 58.65 59.56 2wu1 h GLN 213 Cb 0.18 -0.13 -0.04 0.00 0.21 0.00 0.00 27.48 27.70 2wu1 h GLN 213 CO -0.03 0.66 0.46 0.00 -1.93 0.00 0.00 178.83 178.00 2wu1 h ALA 214 N 1.08 0.95 -0.67 3.38 0.00 -0.78 0.17 119.26 123.40 2wu1 h ALA 214 Ca 0.18 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2wu1 h ALA 214 Cb 0.15 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2wu1 h ALA 214 CO -0.02 0.40 0.12 0.00 0.00 0.00 0.00 179.25 179.75 2wu1 h ALA 215 N 1.25 0.94 0.02 0.00 0.00 -0.73 -2.75 119.26 117.99 2wu1 h ALA 215 Ca 0.27 -0.27 -0.40 0.00 0.00 0.00 0.00 54.91 54.52 2wu1 h ALA 215 Cb -0.06 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.42 2wu1 h ALA 215 CO -0.05 0.66 -2.37 0.28 0.00 0.00 0.00 179.25 177.77 2wu1 n VAL 216 N -4.22 1.54 0.55 0.00 0.31 -0.33 -4.61 118.33 111.58 2wu1 n VAL 216 Ca 0.05 -0.52 0.06 0.00 -0.01 0.00 0.00 64.34 63.91 2wu1 n VAL 216 Cb 0.28 -1.59 -0.07 0.00 -0.91 0.00 0.00 33.84 31.56 2wu1 n VAL 216 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wu1 n GLU 217 N -3.56 3.09 -1.88 5.55 1.02 0.55 -5.02 120.64 120.39 2wu1 n GLU 217 Ca -0.45 -0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.49 2wu1 n GLU 217 Cb 0.96 -1.06 0.12 0.00 -0.02 0.00 0.00 31.44 31.44 2wu1 n GLU 217 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wu1 n GLY 218 N 1.28 -0.12 3.96 0.62 0.00 -0.83 -4.98 105.19 105.13 2wu1 n GLY 218 Ca 0.02 -1.90 -0.22 0.00 0.00 0.00 0.00 46.02 43.92 2wu1 n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wu1 s VAL 220 N -2.25 3.36 -0.02 0.00 1.01 -1.26 -4.89 120.40 116.35 2wu1 s VAL 220 Ca 0.41 0.83 -0.28 0.00 0.00 0.00 0.00 61.98 62.94 2wu1 s VAL 220 Cb -0.09 -3.54 0.10 0.00 0.00 0.00 0.00 36.38 32.85 2wu1 s VAL 220 CO 0.34 0.01 0.83 0.54 0.00 0.00 0.00 175.10 176.81 2wu1 s ASN 221 N 1.89 -0.45 0.00 3.32 2.20 -1.26 -5.05 114.94 115.58 2wu1 s ASN 221 Ca 0.68 0.22 0.28 0.00 -0.94 0.00 0.00 52.86 53.09 2wu1 s ASN 221 Cb -0.36 0.43 1.10 0.00 -2.00 0.00 0.00 41.25 40.42 2wu1 s ASN 221 CO 0.29 -0.62 1.77 0.00 -2.94 0.00 0.00 177.10 175.61 2wu1 n HIS 222 N 0.15 0.00 0.00 1.54 1.44 -1.26 -3.63 115.22 113.46 2wu1 n HIS 222 Ca -0.12 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.41 2wu1 n HIS 222 Cb 0.61 -0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.64 2wu1 n HIS 222 CO 0.00 0.00 0.00 0.52 -2.81 0.00 0.00 176.34 174.05 2wu1 h MET 223 N 2.16 0.73 -3.36 -1.40 2.86 -1.92 0.11 114.93 114.11 2wu1 h MET 223 Ca 0.00 -0.64 -0.68 0.00 -2.06 0.00 0.00 59.70 56.32 2wu1 h MET 223 Cb 0.47 0.15 -0.37 0.00 0.06 0.00 0.00 31.60 31.91 2wu1 h MET 223 CO 0.00 1.24 -0.30 -1.58 1.06 0.00 0.00 176.91 177.33 2wu1 s TRP 224 N -3.62 3.63 0.58 -0.22 0.52 -1.24 -4.17 118.94 114.43 2wu1 s TRP 224 Ca -0.10 -3.00 0.35 0.00 0.02 0.00 0.00 56.10 53.38 2wu1 s TRP 224 Cb 0.08 -3.11 1.98 0.00 -1.15 0.00 0.00 33.47 31.28 2wu1 s TRP 224 CO 0.90 -0.74 2.27 1.79 0.02 0.00 0.00 176.95 181.20 2wu1 h THR 225 N 4.61 0.34 -0.13 2.01 1.35 -1.68 0.38 112.91 119.80 2wu1 h THR 225 Ca 0.08 -0.08 0.04 0.00 -0.55 0.00 0.00 66.41 65.90 2wu1 h THR 225 Cb 0.85 1.05 -0.01 0.00 -1.73 0.00 0.00 68.15 68.32 2wu1 h THR 225 CO 0.77 0.01 0.36 -0.29 -0.25 0.00 0.00 175.52 176.13 2wu1 h ILE 226 N 0.00 0.12 0.00 6.82 6.09 -1.34 -1.29 117.51 127.92 2wu1 h ILE 226 Ca -0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2wu1 h ILE 226 Cb 0.05 0.66 0.00 0.00 0.47 0.00 0.00 36.82 38.01 2wu1 h ILE 226 CO 0.00 0.00 0.00 -1.54 -3.07 0.00 0.00 178.15 173.54 2wu1 n SER 227 N -3.16 0.32 0.31 2.19 3.41 0.12 -2.20 113.62 114.62 2wu1 n SER 227 Ca 0.01 0.58 0.19 0.00 -0.26 0.00 0.00 58.87 59.39 2wu1 n SER 227 Cb 0.45 -0.65 1.04 0.00 -0.26 0.00 0.00 64.21 64.79 2wu1 n SER 227 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wu1 h LEU 229 N 0.00 0.00 -2.42 0.00 3.38 -1.68 0.62 115.31 115.21 2wu1 h LEU 229 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wu1 h LEU 229 Cb 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2wu1 h LEU 229 CO 0.00 0.03 -0.02 1.56 0.09 0.00 0.00 178.44 180.11 2wu1 h GLN 230 N 0.00 0.00 -0.01 1.13 4.20 -1.66 -1.53 115.11 117.24 2wu1 h GLN 230 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wu1 h GLN 230 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2wu1 h GLN 230 CO 0.00 0.02 -0.33 1.28 -0.67 0.00 0.00 178.83 179.13 2wu1 n LEU 231 N -3.24 1.38 -4.83 1.46 4.77 0.21 -4.94 117.00 111.80 2wu1 n LEU 231 Ca -0.02 -0.44 -0.38 0.00 -0.03 0.00 0.00 56.01 55.15 2wu1 n LEU 231 Cb 0.15 -0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 2wu1 n LEU 231 CO 0.24 0.26 0.10 -2.28 -1.33 0.00 0.00 177.39 174.37 2wu1 s HIS 232 N -2.49 3.70 0.27 -1.77 2.46 -0.58 -4.98 115.29 111.91 2wu1 s HIS 232 Ca 0.23 0.96 0.24 0.00 0.47 0.00 0.00 55.06 56.95 2wu1 s HIS 232 Cb 0.19 -2.30 1.10 0.00 -0.13 0.00 0.00 32.58 31.44 2wu1 s HIS 232 CO 0.54 0.60 1.92 -1.35 -2.47 0.00 0.00 174.74 173.97 2wu1 h PRO 233 N 4.92 0.00 -1.81 2.88 0.11 -1.92 -3.38 132.00 132.81 2wu1 h PRO 233 Ca -0.51 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.11 2wu1 h PRO 233 Cb 1.22 0.00 -0.33 0.00 0.11 0.00 0.00 31.00 31.99 2wu1 h PRO 233 CO 0.63 0.21 -0.93 1.17 -0.21 0.00 0.00 178.00 178.87 2wu1 n LYS 234 N -3.55 0.50 -4.41 1.05 4.81 -1.26 -4.91 118.16 110.40 2wu1 n LYS 234 Ca -0.01 -2.91 -0.35 0.00 -0.87 0.00 0.00 58.31 54.18 2wu1 n LYS 234 Cb 0.36 -1.44 -0.10 0.00 0.02 0.00 0.00 35.03 33.87 2wu1 n LYS 234 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2wu1 s ALA 235 N -0.28 3.24 -0.04 3.14 0.00 -1.26 -1.84 121.76 124.72 2wu1 s ALA 235 Ca 0.33 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.50 2wu1 s ALA 235 Cb 0.11 -1.44 0.01 0.00 0.00 0.00 0.00 23.12 21.80 2wu1 s ALA 235 CO -0.15 0.59 -0.10 0.42 0.00 0.00 0.00 175.76 176.52 2wu1 s ILE 236 N -0.88 0.90 -0.12 0.00 1.01 0.27 -1.58 121.20 120.80 2wu1 s ILE 236 Ca 0.13 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.40 2wu1 s ILE 236 Cb -0.11 -0.81 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 2wu1 s ILE 236 CO 0.02 0.29 -0.14 -0.04 0.00 0.00 0.00 174.94 175.07 2wu1 s MET 237 N 0.40 3.26 -0.23 2.79 -1.94 0.50 -0.49 119.30 123.59 2wu1 s MET 237 Ca -0.07 -0.70 -0.02 0.00 -1.71 0.00 0.00 55.69 53.18 2wu1 s MET 237 Cb -0.12 -2.58 0.01 0.00 2.01 0.00 0.00 34.83 34.16 2wu1 s MET 237 CO 0.01 0.26 -0.07 0.08 -0.01 0.00 0.00 175.02 175.29 2wu1 s VAL 238 N 0.22 2.95 0.05 -6.03 1.01 0.23 -0.04 120.40 118.79 2wu1 s VAL 238 Ca -0.09 -0.81 0.07 0.00 0.00 0.00 0.00 61.98 61.15 2wu1 s VAL 238 Cb -0.15 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 2wu1 s VAL 238 CO 0.05 0.33 -0.21 0.00 0.00 0.00 0.00 175.10 175.27 2wu1 s ASP 240 N -1.23 4.24 -0.02 0.00 -4.77 -0.83 -0.28 116.67 113.78 2wu1 s ASP 240 Ca 0.08 -0.36 -0.25 0.00 -3.30 0.00 0.00 52.55 48.71 2wu1 s ASP 240 Cb -0.09 0.02 -0.20 0.00 -1.09 0.00 0.00 42.92 41.56 2wu1 s ASP 240 CO 0.02 -1.94 1.27 -0.08 0.70 0.00 0.00 175.17 175.14 2wu1 h GLU 241 N -0.61 0.04 0.00 2.11 4.81 -1.09 -3.18 114.58 116.66 2wu1 h GLU 241 Ca -0.36 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.83 2wu1 h GLU 241 Cb 1.26 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.64 2wu1 h GLU 241 CO 0.39 0.52 -0.07 -1.35 -0.73 0.00 0.00 179.01 177.78 2wu1 h PRO 242 N -0.44 0.00 0.00 0.92 0.11 -1.90 -1.22 132.00 129.48 2wu1 h PRO 242 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2wu1 h PRO 242 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 2wu1 h PRO 242 CO 0.00 0.07 0.00 -1.13 -0.21 0.00 0.00 178.00 176.73 2wu1 n SER 243 N -3.58 0.66 -0.70 -2.05 3.41 -1.20 -3.04 113.62 107.12 2wu1 n SER 243 Ca -0.02 0.67 0.13 0.00 -0.26 0.00 0.00 58.87 59.39 2wu1 n SER 243 Cb 0.19 -0.81 0.35 0.00 -0.26 0.00 0.00 64.21 63.68 2wu1 n SER 243 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2wu1 n THR 244 N -2.24 0.09 0.29 6.66 -2.24 -0.46 -4.15 114.28 112.24 2wu1 n THR 244 Ca 0.02 -0.39 0.14 0.00 -2.27 0.00 0.00 64.05 61.56 2wu1 n THR 244 Cb 0.21 0.80 0.89 0.00 -2.10 0.00 0.00 70.33 70.14 2wu1 n THR 244 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 2wu1 h MET 245 N 3.20 0.00 -0.01 -0.78 2.86 -1.67 -2.64 114.93 115.90 2wu1 h MET 245 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2wu1 h MET 245 Cb 0.69 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.35 2wu1 h MET 245 CO 0.00 0.01 -0.21 0.39 1.06 0.00 0.00 176.91 178.16 2wu1 n GLU 246 N -3.87 1.36 -1.96 1.72 -0.58 -1.26 -4.94 120.64 111.11 2wu1 n GLU 246 Ca -0.03 -0.96 -0.32 0.00 -0.42 0.00 0.00 57.16 55.43 2wu1 n GLU 246 Cb 0.10 -1.48 0.01 0.00 -0.57 0.00 0.00 31.44 29.49 2wu1 n GLU 246 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2wu1 s LEU 247 N -2.30 3.36 0.48 -4.62 1.43 -1.00 -4.92 118.68 111.11 2wu1 s LEU 247 Ca 0.27 1.58 -0.22 0.00 -1.03 0.00 0.00 54.13 54.73 2wu1 s LEU 247 Cb 0.19 -4.50 -0.07 0.00 0.03 0.00 0.00 46.19 41.84 2wu1 s LEU 247 CO 0.46 -1.00 1.12 -0.54 0.23 0.00 0.00 176.35 176.62 2wu1 s LYS 248 N -4.65 3.70 0.27 1.70 1.02 -1.26 -4.92 119.74 115.60 2wu1 s LYS 248 Ca 0.58 1.63 0.00 0.00 0.02 0.00 0.00 55.97 58.21 2wu1 s LYS 248 Cb -0.12 -2.27 0.60 0.00 -0.52 0.00 0.00 37.83 35.52 2wu1 s LYS 248 CO 0.45 -0.56 1.73 0.28 -0.92 0.00 0.00 175.35 176.33 2wu1 h VAL 249 N 1.68 0.61 -0.03 3.17 2.07 -1.97 -1.23 116.25 120.55 2wu1 h VAL 249 Ca -0.49 -0.17 -0.10 0.00 0.82 0.00 0.00 66.70 66.75 2wu1 h VAL 249 Cb 1.24 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2wu1 h VAL 249 CO 0.59 0.09 -0.46 0.07 0.02 0.00 0.00 177.57 177.89 2wu1 h LYS 250 N 0.50 0.06 0.06 1.57 2.10 -1.98 0.66 116.57 119.54 2wu1 h LYS 250 Ca 0.50 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 59.11 2wu1 h LYS 250 Cb 0.82 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.15 2wu1 h LYS 250 CO -0.44 0.51 -0.03 1.15 -2.00 0.00 0.00 179.45 178.64 2wu1 h THR 251 N 0.05 1.20 -0.69 0.07 2.02 -1.62 -2.17 112.91 111.77 2wu1 h THR 251 Ca 0.00 -0.92 -0.03 0.00 0.77 0.00 0.00 66.41 66.23 2wu1 h THR 251 Cb 0.83 1.80 -0.03 0.00 -1.74 0.00 0.00 68.15 69.01 2wu1 h THR 251 CO 0.06 0.23 0.32 0.25 0.37 0.00 0.00 175.52 176.75 2wu1 h LEU 252 N -0.50 0.92 -0.83 2.58 5.85 -1.33 -2.60 115.31 119.40 2wu1 h LEU 252 Ca -0.01 -0.14 0.10 0.00 0.84 0.00 0.00 57.88 58.67 2wu1 h LEU 252 Cb 0.44 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 41.15 2wu1 h LEU 252 CO 0.01 0.81 0.47 -0.09 -0.34 0.00 0.00 178.44 179.30 2wu1 h ARG 253 N 0.97 0.75 -0.22 1.25 2.43 -0.81 -0.81 114.38 117.94 2wu1 h ARG 253 Ca 0.24 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 2wu1 h ARG 253 Cb 0.14 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 2wu1 h ARG 253 CO -0.03 0.49 0.09 -0.92 -1.51 0.00 0.00 179.97 178.09 2wu1 h TYR 254 N 0.77 0.34 -0.00 2.20 3.20 -1.02 -2.10 116.97 120.36 2wu1 h TYR 254 Ca 0.41 -0.03 -0.12 0.00 3.14 0.00 0.00 58.73 62.13 2wu1 h TYR 254 Cb 0.40 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 2wu1 h TYR 254 CO -0.06 0.38 -0.58 0.74 -1.64 0.00 0.00 178.16 177.00 2wu1 h PHE 255 N 0.20 0.02 -0.46 -3.82 0.04 -1.14 -1.63 116.94 110.15 2wu1 h PHE 255 Ca 0.07 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 2wu1 h PHE 255 Cb 0.18 -0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 2wu1 h PHE 255 CO -0.01 0.59 0.19 -0.91 -0.60 0.00 0.00 178.31 177.57 2wu1 h ASN 256 N 0.01 0.63 -0.50 2.17 2.35 -1.02 -1.90 115.58 117.32 2wu1 h ASN 256 Ca -0.01 -0.16 0.01 0.00 -0.55 0.00 0.00 56.30 55.59 2wu1 h ASN 256 Cb 1.02 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 39.20 2wu1 h ASN 256 CO 0.08 0.62 0.32 -0.33 -1.65 0.00 0.00 177.43 176.47 2wu1 h GLU 257 N 0.60 0.64 -0.90 0.81 5.08 -1.13 -2.31 114.58 117.37 2wu1 h GLU 257 Ca 0.15 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2wu1 h GLU 257 Cb 0.18 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 2wu1 h GLU 257 CO -0.01 0.42 0.53 1.25 -1.00 0.00 0.00 179.01 180.20 2wu1 h LEU 258 N 0.66 1.08 -2.23 1.33 5.85 -1.09 -3.25 115.31 117.66 2wu1 h LEU 258 Ca 0.18 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2wu1 h LEU 258 Cb -0.06 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.69 2wu1 h LEU 258 CO -0.05 0.84 0.00 -0.62 -0.34 0.00 0.00 178.44 178.27 2wu1 n GLU 259 N -4.36 1.77 -0.31 1.25 -0.58 -0.73 -4.67 120.64 113.01 2wu1 n GLU 259 Ca 0.10 -1.58 0.14 0.00 -0.42 0.00 0.00 57.16 55.40 2wu1 n GLU 259 Cb 0.07 -1.21 0.32 0.00 -0.57 0.00 0.00 31.44 30.05 2wu1 n GLU 259 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wu1 h ALA 260 N 1.79 1.50 0.00 0.62 0.00 -1.45 0.52 119.26 122.24 2wu1 h ALA 260 Ca 0.00 0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 2wu1 h ALA 260 Cb 0.57 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2wu1 h ALA 260 CO 0.00 -0.34 -0.79 0.93 0.00 0.00 0.00 179.25 179.05 2wu1 h GLU 261 N 0.42 0.00 -0.00 0.00 4.39 -1.86 -1.70 114.58 115.82 2wu1 h GLU 261 Ca 0.58 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.28 2wu1 h GLU 261 Cb 1.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 2wu1 h GLU 261 CO -0.53 0.79 -0.09 0.09 -1.16 0.00 0.00 179.01 178.12 2wu1 n ASN 262 N -3.43 0.44 0.00 1.42 3.02 0.12 -3.39 115.26 113.44 2wu1 n ASN 262 Ca 0.00 -0.61 0.00 0.00 -0.03 0.00 0.00 54.58 53.94 2wu1 n ASN 262 Cb 0.81 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.90 2wu1 n ASN 262 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2wu1 n ILE 263 N -0.94 0.00 -2.54 2.41 -5.35 -0.88 -4.83 119.36 107.23 2wu1 n ILE 263 Ca 0.15 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.32 2wu1 n ILE 263 Cb 0.26 -0.25 -0.00 0.00 -1.74 0.00 0.00 39.64 37.92 2wu1 n ILE 263 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2wu1 n LYS 264 N -1.68 3.57 0.00 6.28 5.02 -0.64 -2.27 118.16 128.43 2wu1 n LYS 264 Ca 0.00 -4.46 0.00 0.00 -2.02 0.00 0.00 58.31 51.83 2wu1 n LYS 264 Cb 0.24 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 32.97 2wu1 n LYS 264 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wu1 n GLY 265 N -0.36 2.73 0.00 0.72 0.00 -1.22 -4.77 105.19 102.30 2wu1 n GLY 265 Ca 0.41 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2wu1 n GLY 265 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36