#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wdl s LEU 3 N 0.00 3.60 0.25 2.46 1.43 -1.26 -5.07 118.68 120.08 1wdl s LEU 3 Ca 0.00 1.04 -0.10 0.00 -1.03 0.00 0.00 54.13 54.04 1wdl s LEU 3 Cb 0.00 -4.00 -0.07 0.00 0.03 0.00 0.00 46.19 42.15 1wdl s LEU 3 CO 0.00 -0.60 0.58 0.20 0.23 0.00 0.00 176.35 176.76 1wdl s ASN 4 N -3.97 6.62 0.17 2.29 0.02 -1.26 -5.01 114.94 113.80 1wdl s ASN 4 Ca 0.49 0.95 -0.25 0.00 -1.02 0.00 0.00 52.86 53.03 1wdl s ASN 4 Cb -0.10 -2.24 0.04 0.00 0.02 0.00 0.00 41.25 38.97 1wdl s ASN 4 CO 0.44 -0.11 1.57 -0.65 0.02 0.00 0.00 177.10 178.37 1wdl h PRO 5 N 2.38 -0.24 -1.21 -0.60 0.11 -1.98 -2.28 132.00 128.19 1wdl h PRO 5 Ca -0.47 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 1wdl h PRO 5 Cb 1.17 0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 1wdl h PRO 5 CO 0.68 -0.16 0.17 0.54 -0.21 0.00 0.00 178.00 179.02 1wdl n ARG 6 N -5.41 1.32 -3.10 1.05 5.12 -1.26 -1.98 116.66 112.39 1wdl n ARG 6 Ca 0.01 -0.72 -0.39 0.00 -1.93 0.00 0.00 57.85 54.82 1wdl n ARG 6 Cb 0.35 -1.28 -0.05 0.00 -1.16 0.00 0.00 32.46 30.32 1wdl n ARG 6 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1wdl s ASP 7 N 0.64 6.96 0.00 0.55 1.01 -0.86 -4.12 116.67 120.85 1wdl s ASP 7 Ca 0.14 1.15 -0.30 0.00 0.71 0.00 0.00 52.55 54.25 1wdl s ASP 7 Cb 0.11 -2.39 -0.06 0.00 1.01 0.00 0.00 42.92 41.60 1wdl s ASP 7 CO 0.02 -0.06 1.40 -0.69 0.21 0.00 0.00 175.17 176.05 1wdl s VAL 8 N 0.55 3.70 -0.10 -1.27 1.01 -1.26 -0.46 120.40 122.58 1wdl s VAL 8 Ca 0.35 1.09 0.02 0.00 0.00 0.00 0.00 61.98 63.44 1wdl s VAL 8 Cb -0.18 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.52 1wdl s VAL 8 CO 0.17 -0.00 -0.15 -0.69 0.00 0.00 0.00 175.10 174.43 1wdl s VAL 9 N 2.37 1.44 -0.44 2.92 1.01 0.62 -2.12 120.40 126.20 1wdl s VAL 9 Ca 0.64 -0.62 -0.24 0.00 0.00 0.00 0.00 61.98 61.76 1wdl s VAL 9 Cb -0.32 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.78 1wdl s VAL 9 CO 0.27 0.43 0.83 -0.63 0.00 0.00 0.00 175.10 176.00 1wdl s ILE 10 N 0.86 4.60 -0.08 2.22 1.09 -0.84 -1.69 121.20 127.35 1wdl s ILE 10 Ca -0.10 0.62 -0.26 0.00 -1.10 0.00 0.00 60.65 59.82 1wdl s ILE 10 Cb -0.15 -4.34 -0.22 0.00 -1.06 0.00 0.00 42.46 36.69 1wdl s ILE 10 CO 0.01 -0.71 0.93 0.58 -0.10 0.00 0.00 174.94 175.65 1wdl h VAL 11 N 5.97 1.45 -3.98 2.92 2.07 -1.59 -1.07 116.25 122.03 1wdl h VAL 11 Ca -0.24 -1.70 -0.12 0.00 0.82 0.00 0.00 66.70 65.45 1wdl h VAL 11 Cb 1.08 2.56 -0.12 0.00 -1.52 0.00 0.00 31.29 33.29 1wdl h VAL 11 CO 0.97 0.42 -0.33 -0.62 0.02 0.00 0.00 177.57 178.03 1wdl s ASP 12 N -5.90 0.03 -0.09 0.57 3.68 -1.23 -4.09 116.67 109.64 1wdl s ASP 12 Ca -0.16 -1.01 -0.05 0.00 2.13 0.00 0.00 52.55 53.46 1wdl s ASP 12 Cb -0.01 0.47 0.04 0.00 -1.45 0.00 0.00 42.92 41.97 1wdl s ASP 12 CO 0.63 -0.95 0.21 0.12 0.13 0.00 0.00 175.17 175.31 1wdl s PHE 13 N -4.03 -0.27 -0.09 -5.34 5.36 -1.26 -2.63 117.98 109.72 1wdl s PHE 13 Ca 0.24 0.68 -0.04 0.00 -0.96 0.00 0.00 56.93 56.84 1wdl s PHE 13 Cb 0.03 0.02 0.04 0.00 -0.34 0.00 0.00 43.02 42.77 1wdl s PHE 13 CO 0.05 -0.20 0.20 0.20 -1.46 0.00 0.00 175.22 174.02 1wdl s GLY 14 N 1.10 -0.10 0.31 13.12 0.00 -1.06 -4.57 107.32 116.13 1wdl s GLY 14 Ca -0.08 0.83 0.07 0.00 0.00 0.00 0.00 44.72 45.54 1wdl s GLY 14 CO -0.07 1.08 -0.05 1.09 0.00 0.00 0.00 173.10 175.15 1wdl s ARG 15 N 1.11 1.66 0.44 2.90 1.70 0.41 0.10 118.95 127.26 1wdl s ARG 15 Ca -0.08 -1.86 -0.01 0.00 -0.47 0.00 0.00 55.73 53.31 1wdl s ARG 15 Cb -0.10 -1.28 -0.01 0.00 -0.57 0.00 0.00 34.95 32.99 1wdl s ARG 15 CO -0.07 0.03 0.67 0.95 -1.08 0.00 0.00 175.30 175.79 1wdl s THR 16 N -2.93 4.37 0.08 4.99 -4.23 -0.45 -0.58 115.64 116.90 1wdl s THR 16 Ca 0.31 -0.38 -0.31 0.00 -1.18 0.00 0.00 61.69 60.14 1wdl s THR 16 Cb 0.05 -3.62 -0.08 0.00 1.34 0.00 0.00 72.50 70.19 1wdl s THR 16 CO 0.14 -0.46 1.48 -2.84 -0.54 0.00 0.00 174.62 172.40 1wdl s PRO 17 N -4.54 4.27 -0.41 3.99 0.02 -1.26 -4.80 135.00 132.27 1wdl s PRO 17 Ca 0.46 2.15 -0.29 0.00 0.02 0.00 0.00 61.00 63.35 1wdl s PRO 17 Cb -0.10 -3.40 0.00 0.00 0.02 0.00 0.00 34.50 31.02 1wdl s PRO 17 CO 0.39 -0.57 1.51 -1.64 -0.33 0.00 0.00 177.00 176.36 1wdl s MET 18 N 1.80 3.48 0.11 5.54 -1.94 -1.26 -4.88 119.30 122.15 1wdl s MET 18 Ca 0.67 1.02 0.06 0.00 -1.71 0.00 0.00 55.69 55.73 1wdl s MET 18 Cb -0.37 -4.08 -0.04 0.00 2.01 0.00 0.00 34.83 32.35 1wdl s MET 18 CO 0.30 -1.68 -0.03 0.20 -0.01 0.00 0.00 175.02 173.80 1wdl s GLY 19 N 4.56 1.86 0.78 -0.03 0.00 -1.22 -1.56 107.32 111.71 1wdl s GLY 19 Ca 0.65 -1.19 -0.14 0.00 0.00 0.00 0.00 44.72 44.04 1wdl s GLY 19 CO 0.32 -1.17 1.22 0.50 0.00 0.00 0.00 173.10 173.97 1wdl s ARG 20 N -2.37 1.78 -0.11 2.90 0.52 -1.26 -2.39 118.95 118.02 1wdl s ARG 20 Ca 0.25 1.80 0.01 0.00 -0.52 0.00 0.00 55.73 57.27 1wdl s ARG 20 Cb -0.11 -1.79 -0.24 0.00 0.52 0.00 0.00 34.95 33.33 1wdl s ARG 20 CO 0.17 -2.12 0.40 0.43 0.02 0.00 0.00 175.30 174.20 1wdl n SER 21 N -3.08 1.64 -3.62 0.23 7.64 -1.16 -2.52 113.62 112.75 1wdl n SER 21 Ca 0.14 0.24 -0.42 0.00 1.01 0.00 0.00 58.87 59.83 1wdl n SER 21 Cb 0.50 -0.51 -0.04 0.00 -1.01 0.00 0.00 64.21 63.15 1wdl n SER 21 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1wdl n LYS 22 N -3.30 1.86 -1.35 1.43 4.01 -1.26 -3.75 118.16 115.80 1wdl n LYS 22 Ca -0.28 -2.00 0.00 0.00 -0.51 0.00 0.00 58.31 55.51 1wdl n LYS 22 Cb 1.05 -2.98 0.00 0.00 -0.51 0.00 0.00 35.03 32.59 1wdl n LYS 22 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1wdl n GLY 23 N 4.38 0.59 0.00 0.72 0.00 -1.26 -5.06 105.19 104.56 1wdl n GLY 23 Ca 0.50 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1wdl n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdl n GLY 24 N -1.67 -2.26 0.21 -0.02 0.00 -1.05 -4.86 105.19 95.53 1wdl n GLY 24 Ca 0.00 -1.43 0.15 0.00 0.00 0.00 0.00 46.02 44.73 1wdl n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdl h MET 25 N 0.00 0.00 -0.57 1.61 -0.00 -1.74 -3.02 114.93 111.20 1wdl h MET 25 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1wdl h MET 25 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 1wdl h MET 25 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.91 177.63 1wdl n HIS 26 N -2.70 0.81 0.29 -0.10 8.25 -1.26 -2.54 115.22 117.96 1wdl n HIS 26 Ca 0.02 -0.51 0.15 0.00 -0.26 0.00 0.00 57.72 57.12 1wdl n HIS 26 Cb 0.29 -0.03 0.82 0.00 1.12 0.00 0.00 29.99 32.19 1wdl n HIS 26 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1wdl h ARG 27 N 3.36 0.00 0.00 -0.41 0.11 -1.83 -1.39 114.38 114.21 1wdl h ARG 27 Ca 0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 1wdl h ARG 27 Cb 0.92 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.00 1wdl h ARG 27 CO 0.02 0.00 -0.20 0.09 0.10 0.00 0.00 179.97 179.98 1wdl n ASN 28 N -2.74 2.06 -3.99 0.08 3.02 -1.26 -5.00 115.26 107.43 1wdl n ASN 28 Ca -0.02 -3.33 -0.26 0.00 -0.03 0.00 0.00 54.58 50.94 1wdl n ASN 28 Cb 0.26 -0.46 -0.17 0.00 -0.61 0.00 0.00 39.78 38.81 1wdl n ASN 28 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1wdl s THR 29 N -2.89 1.18 0.66 3.41 2.01 -0.53 -5.11 115.64 114.37 1wdl s THR 29 Ca 0.33 -0.44 -0.16 0.00 0.31 0.00 0.00 61.69 61.73 1wdl s THR 29 Cb 0.30 -1.12 -0.00 0.00 0.01 0.00 0.00 72.50 71.70 1wdl s THR 29 CO -0.01 0.38 1.14 -0.13 -0.69 0.00 0.00 174.62 175.31 1wdl s ARG 30 N 1.14 2.73 0.25 4.92 0.52 -1.26 -4.89 118.95 122.36 1wdl s ARG 30 Ca -0.05 1.53 -0.03 0.00 -0.52 0.00 0.00 55.73 56.66 1wdl s ARG 30 Cb -0.14 -1.93 0.30 0.00 0.52 0.00 0.00 34.95 33.69 1wdl s ARG 30 CO -0.02 -1.33 1.73 0.00 0.02 0.00 0.00 175.30 175.70 1wdl h ALA 31 N 0.17 1.06 0.31 2.13 0.00 -1.95 -1.37 119.26 119.61 1wdl h ALA 31 Ca -0.48 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.14 1wdl h ALA 31 Cb 1.26 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1wdl h ALA 31 CO 0.53 0.59 -0.16 0.93 0.00 0.00 0.00 179.25 181.14 1wdl h GLU 32 N 0.75 -0.42 -0.57 0.00 5.08 -1.92 -1.16 114.58 116.34 1wdl h GLU 32 Ca 0.14 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1wdl h GLU 32 Cb 0.49 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 1wdl h GLU 32 CO 0.02 -0.28 0.27 -0.44 -1.00 0.00 0.00 179.01 177.59 1wdl h ASP 33 N -0.43 0.74 -0.95 1.42 3.32 -1.93 0.16 116.42 118.76 1wdl h ASP 33 Ca -0.04 -0.13 0.09 0.00 0.02 0.00 0.00 57.03 56.97 1wdl h ASP 33 Cb 0.34 -0.19 -0.07 0.00 0.22 0.00 0.00 39.33 39.62 1wdl h ASP 33 CO 0.06 0.66 0.59 -0.03 -1.72 0.00 0.00 179.24 178.81 1wdl h MET 34 N 0.77 0.99 -0.01 3.56 4.05 -1.10 0.25 114.93 123.44 1wdl h MET 34 Ca 0.20 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.54 1wdl h MET 34 Cb 0.12 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 30.70 1wdl h MET 34 CO -0.02 0.65 -0.04 0.77 0.23 0.00 0.00 176.91 178.50 1wdl h SER 35 N 1.02 0.05 -0.70 1.39 0.02 -0.74 -2.67 113.55 111.91 1wdl h SER 35 Ca 0.44 -0.69 0.09 0.00 -0.84 0.00 0.00 61.79 60.78 1wdl h SER 35 Cb 0.30 -0.01 -0.07 0.00 0.14 0.00 0.00 62.40 62.76 1wdl h SER 35 CO -0.21 0.73 0.35 0.00 -1.14 0.00 0.00 176.83 176.55 1wdl h ALA 36 N 0.32 0.96 -0.46 3.77 0.00 -0.27 -0.35 119.26 123.23 1wdl h ALA 36 Ca -0.00 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1wdl h ALA 36 Cb 0.73 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1wdl h ALA 36 CO 0.01 -0.05 0.12 1.25 0.00 0.00 0.00 179.25 180.58 1wdl h HIS 37 N 0.60 0.76 0.34 0.00 6.17 -0.59 -1.14 115.15 121.28 1wdl h HIS 37 Ca 0.34 -0.09 -0.02 0.00 0.71 0.00 0.00 60.37 61.32 1wdl h HIS 37 Cb 0.35 -0.21 0.00 0.00 2.52 0.00 0.00 27.41 30.07 1wdl h HIS 37 CO -0.11 0.69 -0.16 1.25 0.71 0.00 0.00 177.93 180.31 1wdl h LEU 38 N 0.60 -0.39 -0.97 0.26 5.85 -1.00 0.32 115.31 119.99 1wdl h LEU 38 Ca 0.14 0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.94 1wdl h LEU 38 Cb 0.31 0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.37 1wdl h LEU 38 CO 0.00 -0.27 0.62 0.40 -0.34 0.00 0.00 178.44 178.85 1wdl h ILE 39 N -0.47 1.07 0.02 4.05 2.04 -1.05 -0.42 117.51 122.75 1wdl h ILE 39 Ca -0.05 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 1wdl h ILE 39 Cb 0.36 -0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.29 1wdl h ILE 39 CO 0.08 0.20 -0.01 -1.28 0.00 0.00 0.00 178.15 177.14 1wdl h SER 40 N 1.11 -0.02 -0.74 1.72 0.87 -0.89 -2.40 113.55 113.20 1wdl h SER 40 Ca 0.42 -0.21 -0.05 0.00 -1.23 0.00 0.00 61.79 60.72 1wdl h SER 40 Cb 0.18 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.12 1wdl h SER 40 CO -0.18 0.20 0.27 0.11 -0.53 0.00 0.00 176.83 176.70 1wdl h LYS 41 N -0.24 1.12 -0.77 2.24 6.56 -0.57 -2.72 116.57 122.19 1wdl h LYS 41 Ca -0.00 -0.22 -0.05 0.00 -1.06 0.00 0.00 60.65 59.32 1wdl h LYS 41 Cb 0.23 -0.17 -0.03 0.00 -0.57 0.00 0.00 32.23 31.68 1wdl h LYS 41 CO 0.00 0.93 0.27 0.28 -2.06 0.00 0.00 179.45 178.88 1wdl h VAL 42 N 1.07 1.26 0.00 0.50 2.07 -1.07 -1.94 116.25 118.14 1wdl h VAL 42 Ca 0.24 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1wdl h VAL 42 Cb 0.24 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1wdl h VAL 42 CO -0.02 0.35 -0.12 -0.07 0.02 0.00 0.00 177.57 177.74 1wdl h LEU 43 N 1.14 0.00 0.02 2.57 3.38 -1.24 -3.03 115.31 118.16 1wdl h LEU 43 Ca 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 1wdl h LEU 43 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1wdl h LEU 43 CO -0.01 0.12 -0.01 -0.33 0.09 0.00 0.00 178.44 178.29 1wdl h GLU 44 N 0.00 -0.03 -0.22 1.13 5.08 -1.04 -2.97 114.58 116.52 1wdl h GLU 44 Ca -0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1wdl h GLU 44 Cb 0.43 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1wdl h GLU 44 CO 0.02 0.41 0.28 0.00 -1.00 0.00 0.00 179.01 178.71 1wdl h ARG 45 N -0.48 0.00 -3.14 2.33 3.08 -1.41 -3.07 114.38 111.69 1wdl h ARG 45 Ca -0.00 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.37 1wdl h ARG 45 Cb 0.45 0.00 -0.37 0.00 0.08 0.00 0.00 29.97 30.13 1wdl h ARG 45 CO 0.01 0.00 -0.21 0.09 -1.07 0.00 0.00 179.97 178.79 1wdl n ASN 46 N -3.65 3.99 0.00 7.04 3.02 -1.12 -4.90 115.26 119.64 1wdl n ASN 46 Ca 0.03 -3.19 0.09 0.00 -0.03 0.00 0.00 54.58 51.47 1wdl n ASN 46 Cb 0.41 -0.96 0.48 0.00 -0.61 0.00 0.00 39.78 39.10 1wdl n ASN 46 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1wdl n SER 47 N 2.04 0.00 -0.53 6.41 3.41 -1.16 -3.07 113.62 120.71 1wdl n SER 47 Ca 0.22 -0.07 0.12 0.00 -0.26 0.00 0.00 58.87 58.88 1wdl n SER 47 Cb 0.37 -0.24 0.22 0.00 -0.26 0.00 0.00 64.21 64.29 1wdl n SER 47 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wdl n LYS 48 N -1.24 1.44 -3.55 4.33 5.02 -1.26 -4.74 118.16 118.17 1wdl n LYS 48 Ca 0.10 -1.06 -0.41 0.00 -2.02 0.00 0.00 58.31 54.91 1wdl n LYS 48 Cb 0.13 -1.48 -0.08 0.00 -0.02 0.00 0.00 35.03 33.58 1wdl n LYS 48 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1wdl s VAL 49 N -2.29 4.25 -0.07 -0.18 -7.23 -1.18 -5.02 120.40 108.69 1wdl s VAL 49 Ca 0.26 -1.75 -0.29 0.00 -1.81 0.00 0.00 61.98 58.38 1wdl s VAL 49 Cb 0.19 -3.79 -0.07 0.00 0.56 0.00 0.00 36.38 33.27 1wdl s VAL 49 CO 0.45 -0.77 2.06 -0.62 -0.31 0.00 0.00 175.10 175.92 1wdl s ASP 50 N 2.68 6.04 0.57 4.85 2.15 -1.26 -4.85 116.67 126.86 1wdl s ASP 50 Ca 0.05 2.34 0.29 0.00 0.43 0.00 0.00 52.55 55.67 1wdl s ASP 50 Cb -0.26 -2.52 1.46 0.00 -0.30 0.00 0.00 42.92 41.30 1wdl s ASP 50 CO -0.00 -1.43 1.89 -0.65 -0.17 0.00 0.00 175.17 174.81 1wdl h PRO 51 N 12.41 0.00 0.00 4.34 0.11 -1.96 0.18 132.00 147.08 1wdl h PRO 51 Ca -0.46 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1wdl h PRO 51 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1wdl h PRO 51 CO 0.95 0.00 -0.11 0.78 -0.21 0.00 0.00 178.00 179.41 1wdl h GLY 52 N 0.00 0.00 2.00 -0.55 0.00 -1.88 -2.57 103.07 100.07 1wdl h GLY 52 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1wdl h GLY 52 CO -0.00 0.00 0.00 0.83 0.00 0.00 0.00 176.54 177.37 1wdl h GLU 53 N 0.00 0.00 -5.71 4.80 5.08 -1.02 -3.44 114.58 114.29 1wdl h GLU 53 Ca -0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 1wdl h GLU 53 Cb 0.48 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.73 1wdl h GLU 53 CO 0.01 0.00 1.60 0.08 -1.00 0.00 0.00 179.01 179.70 1wdl s VAL 54 N -3.14 3.01 0.44 3.13 1.01 -0.97 -4.07 120.40 119.82 1wdl s VAL 54 Ca 0.09 0.01 0.13 0.00 0.00 0.00 0.00 61.98 62.21 1wdl s VAL 54 Cb 0.11 -3.03 0.20 0.00 0.00 0.00 0.00 36.38 33.66 1wdl s VAL 54 CO 0.59 -0.03 2.01 -0.08 0.00 0.00 0.00 175.10 177.59 1wdl h GLU 55 N 18.47 0.10 -1.57 2.72 4.22 -1.20 -3.41 114.58 133.91 1wdl h GLU 55 Ca -0.28 -0.02 0.08 0.00 0.08 0.00 0.00 59.36 59.22 1wdl h GLU 55 Cb 1.26 -0.02 -0.23 0.00 0.50 0.00 0.00 28.75 30.26 1wdl h GLU 55 CO 1.11 0.21 0.54 0.34 -2.18 0.00 0.00 179.01 179.04 1wdl s ASP 56 N -6.96 -0.37 -0.32 1.04 2.15 -1.26 -3.35 116.67 107.61 1wdl s ASP 56 Ca -0.05 0.40 -0.03 0.00 0.43 0.00 0.00 52.55 53.30 1wdl s ASP 56 Cb 0.16 0.30 0.05 0.00 -0.30 0.00 0.00 42.92 43.13 1wdl s ASP 56 CO 0.70 -0.35 0.04 -0.69 -0.17 0.00 0.00 175.17 174.71 1wdl s VAL 57 N -1.14 3.28 -0.46 1.11 1.01 0.33 -2.87 120.40 121.66 1wdl s VAL 57 Ca -0.02 -1.32 -0.16 0.00 0.00 0.00 0.00 61.98 60.48 1wdl s VAL 57 Cb -0.00 -2.89 0.06 0.00 0.00 0.00 0.00 36.38 33.55 1wdl s VAL 57 CO 0.02 -0.16 0.38 -0.63 0.00 0.00 0.00 175.10 174.71 1wdl s ILE 58 N 1.30 5.22 -0.08 2.22 1.01 -1.05 -1.62 121.20 128.21 1wdl s ILE 58 Ca -0.03 -0.93 -0.00 0.00 0.00 0.00 0.00 60.65 59.68 1wdl s ILE 58 Cb -0.20 -4.09 -0.03 0.00 0.01 0.00 0.00 42.46 38.16 1wdl s ILE 58 CO 0.00 -0.52 -0.05 0.86 0.00 0.00 0.00 174.94 175.23 1wdl s TRP 59 N 1.70 3.00 -0.14 3.97 -0.11 -0.63 -2.09 118.94 124.63 1wdl s TRP 59 Ca 0.05 0.05 -0.08 0.00 1.22 0.00 0.00 56.10 57.34 1wdl s TRP 59 Cb -0.23 -1.74 -0.04 0.00 -1.50 0.00 0.00 33.47 29.96 1wdl s TRP 59 CO 0.08 0.35 0.15 0.20 -4.62 0.00 0.00 176.95 173.10 1wdl s GLY 60 N -0.77 2.13 -0.17 5.86 0.00 0.53 -0.75 107.32 114.15 1wdl s GLY 60 Ca 0.12 -0.64 -0.28 0.00 0.00 0.00 0.00 44.72 43.92 1wdl s GLY 60 CO 0.02 -0.19 0.73 0.00 0.00 0.00 0.00 173.10 173.66 1wdl n VAL 62 N 1.82 0.00 -1.88 0.00 0.31 -1.26 -4.24 118.33 113.07 1wdl n VAL 62 Ca -0.16 0.21 -0.35 0.00 -0.01 0.00 0.00 64.34 64.02 1wdl n VAL 62 Cb 0.56 -1.19 -0.05 0.00 -0.91 0.00 0.00 33.84 32.25 1wdl n VAL 62 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1wdl n ASN 63 N -1.89 3.27 -4.54 4.52 2.85 -1.26 -4.86 115.26 113.35 1wdl n ASN 63 Ca 0.00 -2.74 -0.43 0.00 -0.11 0.00 0.00 54.58 51.30 1wdl n ASN 63 Cb 0.00 -1.57 -0.00 0.00 1.24 0.00 0.00 39.78 39.45 1wdl n ASN 63 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1wdl n GLN 64 N 7.82 3.16 -3.73 1.20 6.02 -1.26 -4.61 117.38 125.99 1wdl n GLN 64 Ca 0.47 -3.24 -0.10 0.00 -0.01 0.00 0.00 57.00 54.13 1wdl n GLN 64 Cb 0.44 -3.49 -0.05 0.00 1.02 0.00 0.00 30.24 28.16 1wdl n GLN 64 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1wdl s THR 65 N 4.26 0.06 0.00 5.09 -1.32 -1.25 -4.21 115.64 118.27 1wdl s THR 65 Ca 0.54 -0.78 0.00 0.00 -1.21 0.00 0.00 61.69 60.23 1wdl s THR 65 Cb 0.04 -1.42 0.00 0.00 -1.51 0.00 0.00 72.50 69.62 1wdl s THR 65 CO 0.07 -0.25 0.00 0.18 -2.21 0.00 0.00 174.62 172.41 1wdl n LEU 66 N -0.26 0.00 -0.34 9.08 4.77 -1.26 -1.67 117.00 127.32 1wdl n LEU 66 Ca -0.13 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.82 1wdl n LEU 66 Cb 0.63 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.81 1wdl n LEU 66 CO 0.18 0.00 1.19 -0.33 -1.33 0.00 0.00 177.39 177.10 1wdl h GLU 67 N 0.00 1.27 -0.34 3.23 5.08 -1.94 -2.93 114.58 118.96 1wdl h GLU 67 Ca 0.00 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1wdl h GLU 67 Cb 0.00 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.00 1wdl h GLU 67 CO 0.00 0.92 0.00 1.04 -1.00 0.00 0.00 179.01 179.97 1wdl n GLN 68 N -4.34 1.93 -2.71 2.33 6.02 -0.67 -4.62 117.38 115.31 1wdl n GLN 68 Ca 0.10 -1.42 -0.23 0.00 -0.01 0.00 0.00 57.00 55.43 1wdl n GLN 68 Cb 0.09 -1.36 0.03 0.00 1.02 0.00 0.00 30.24 30.02 1wdl n GLN 68 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1wdl s GLY 69 N -1.21 1.66 -0.76 1.08 0.00 -1.11 -3.89 107.32 103.09 1wdl s GLY 69 Ca 0.30 -1.06 -0.02 0.00 0.00 0.00 0.00 44.72 43.94 1wdl s GLY 69 CO 0.22 -0.82 0.65 0.79 0.00 0.00 0.00 173.10 173.94 1wdl n TRP 70 N -2.32 -1.58 -3.30 1.90 7.02 -1.26 -4.23 117.44 113.68 1wdl n TRP 70 Ca 0.04 0.61 -0.14 0.00 -1.02 0.00 0.00 57.50 57.00 1wdl n TRP 70 Cb 0.58 -3.85 0.01 0.00 -2.42 0.00 0.00 31.31 25.63 1wdl n TRP 70 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1wdl n ASN 71 N -2.56 -6.67 0.32 -0.99 5.15 -1.26 -4.71 115.26 104.54 1wdl n ASN 71 Ca -0.12 -0.24 0.21 0.00 -0.60 0.00 0.00 54.58 53.82 1wdl n ASN 71 Cb 0.60 -3.80 1.10 0.00 -0.53 0.00 0.00 39.78 37.15 1wdl n ASN 71 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1wdl h ILE 72 N 0.71 0.00 -0.39 -1.44 2.10 -1.76 -2.25 117.51 114.48 1wdl h ILE 72 Ca -0.26 0.00 0.02 0.00 1.08 0.00 0.00 64.86 65.70 1wdl h ILE 72 Cb 1.17 0.90 -0.03 0.00 -1.09 0.00 0.00 36.82 37.77 1wdl h ILE 72 CO 0.29 0.00 0.22 0.00 -1.08 0.00 0.00 178.15 177.59 1wdl h ALA 73 N 1.89 0.49 0.14 0.18 0.00 -1.87 0.14 119.26 120.22 1wdl h ALA 73 Ca 0.00 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.61 1wdl h ALA 73 Cb 0.11 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 17.83 1wdl h ALA 73 CO 0.00 -0.12 -1.27 -0.09 0.00 0.00 0.00 179.25 177.77 1wdl h ARG 74 N 0.45 0.58 -0.94 0.00 9.65 -1.65 -2.01 114.38 120.47 1wdl h ARG 74 Ca 0.16 -0.81 0.06 0.00 -1.10 0.00 0.00 59.98 58.29 1wdl h ARG 74 Cb 0.03 0.27 -0.06 0.00 -1.39 0.00 0.00 29.97 28.82 1wdl h ARG 74 CO -0.09 1.37 0.61 0.52 2.80 0.00 0.00 179.97 185.18 1wdl h MET 75 N 0.24 1.08 0.00 0.20 2.86 -1.32 0.14 114.93 118.13 1wdl h MET 75 Ca -0.19 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.27 1wdl h MET 75 Cb 1.95 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 33.34 1wdl h MET 75 CO 0.24 0.71 -0.86 0.00 1.06 0.00 0.00 176.91 178.06 1wdl h ALA 76 N 1.48 0.67 -0.01 6.32 0.00 -1.04 -3.32 119.26 123.36 1wdl h ALA 76 Ca 0.39 -0.54 -0.18 0.00 0.00 0.00 0.00 54.91 54.58 1wdl h ALA 76 Cb 0.13 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1wdl h ALA 76 CO -0.14 0.65 -0.81 1.03 0.00 0.00 0.00 179.25 179.97 1wdl h SER 77 N 0.00 0.21 0.61 0.00 0.87 -0.50 -3.24 113.55 111.50 1wdl h SER 77 Ca -0.06 -0.16 -0.05 0.00 -1.23 0.00 0.00 61.79 60.29 1wdl h SER 77 Cb 1.41 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 63.29 1wdl h SER 77 CO 0.05 0.93 -0.23 -0.07 -0.53 0.00 0.00 176.83 176.99 1wdl h LEU 78 N 0.10 0.00 -2.05 2.23 3.38 -0.88 -2.36 115.31 115.73 1wdl h LEU 78 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1wdl h LEU 78 Cb 1.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 1wdl h LEU 78 CO 0.12 0.23 0.00 0.23 0.09 0.00 0.00 178.44 179.11 1wdl n MET 79 N -3.60 2.58 -3.76 1.13 2.81 -1.22 -4.89 117.12 110.17 1wdl n MET 79 Ca -0.01 -1.82 -0.22 0.00 -1.81 0.00 0.00 57.70 53.84 1wdl n MET 79 Cb 0.36 -1.58 -0.04 0.00 -0.71 0.00 0.00 33.22 31.25 1wdl n MET 79 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1wdl s THR 80 N -1.62 2.50 -1.39 2.03 2.01 -0.89 -4.89 115.64 113.38 1wdl s THR 80 Ca 0.33 -1.46 0.14 0.00 0.31 0.00 0.00 61.69 61.01 1wdl s THR 80 Cb 0.20 -2.96 0.24 0.00 0.01 0.00 0.00 72.50 69.99 1wdl s THR 80 CO 0.18 0.00 1.40 0.00 -0.69 0.00 0.00 174.62 175.51 1wdl n GLN 81 N -1.46 0.19 -1.83 4.92 0.00 -1.26 -4.72 117.38 113.21 1wdl n GLN 81 Ca 0.02 0.16 -0.42 0.00 0.00 0.00 0.00 57.00 56.76 1wdl n GLN 81 Cb 0.63 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 29.34 1wdl n GLN 81 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1wdl s ILE 82 N -2.61 2.58 0.95 -0.39 -1.09 -1.26 -4.84 121.20 114.55 1wdl s ILE 82 Ca 0.13 0.26 -0.10 0.00 -2.23 0.00 0.00 60.65 58.71 1wdl s ILE 82 Cb 0.10 -3.17 0.17 0.00 -1.58 0.00 0.00 42.46 37.97 1wdl s ILE 82 CO 0.22 0.01 1.13 -2.84 -1.23 0.00 0.00 174.94 172.23 1wdl s PRO 83 N 1.95 0.72 0.01 2.79 0.02 -1.26 -4.80 135.00 134.42 1wdl s PRO 83 Ca 0.75 1.45 0.21 0.00 0.02 0.00 0.00 61.00 63.43 1wdl s PRO 83 Cb -0.45 -1.70 0.90 0.00 0.02 0.00 0.00 34.50 33.27 1wdl s PRO 83 CO 0.33 -2.81 1.68 0.72 -0.33 0.00 0.00 177.00 176.59 1wdl n HIS 84 N -4.34 0.04 0.89 6.54 8.25 -1.26 -2.75 115.22 122.58 1wdl n HIS 84 Ca 0.11 0.01 0.12 0.00 -0.26 0.00 0.00 57.72 57.70 1wdl n HIS 84 Cb 0.52 -0.52 0.55 0.00 1.12 0.00 0.00 29.99 31.66 1wdl n HIS 84 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1wdl n THR 85 N -1.54 0.25 -2.40 1.59 -2.24 -1.26 -4.83 114.28 103.86 1wdl n THR 85 Ca 0.05 0.06 -0.24 0.00 -2.27 0.00 0.00 64.05 61.65 1wdl n THR 85 Cb 0.25 -0.63 0.05 0.00 -2.10 0.00 0.00 70.33 67.90 1wdl n THR 85 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1wdl s SER 86 N -2.98 5.10 0.42 3.42 0.01 -1.11 -5.06 113.70 113.51 1wdl s SER 86 Ca 0.13 0.34 0.07 0.00 1.31 0.00 0.00 55.95 57.79 1wdl s SER 86 Cb 0.17 -1.13 -0.06 0.00 0.21 0.00 0.00 66.02 65.20 1wdl s SER 86 CO 0.46 -1.35 0.09 0.00 0.41 0.00 0.00 173.24 172.85 1wdl s ALA 87 N -3.03 3.46 -0.24 1.44 0.00 -1.21 -5.02 121.76 117.16 1wdl s ALA 87 Ca 0.58 -2.02 -0.26 0.00 0.00 0.00 0.00 51.96 50.26 1wdl s ALA 87 Cb -0.11 -0.09 0.07 0.00 0.00 0.00 0.00 23.12 22.99 1wdl s ALA 87 CO 0.43 -0.14 0.72 0.00 0.00 0.00 0.00 175.76 176.76 1wdl s ALA 88 N -2.68 -1.78 -0.01 0.00 0.00 -1.26 -0.51 121.76 115.52 1wdl s ALA 88 Ca 0.35 1.93 -0.05 0.00 0.00 0.00 0.00 51.96 54.19 1wdl s ALA 88 Cb 0.06 -1.02 -0.00 0.00 0.00 0.00 0.00 23.12 22.16 1wdl s ALA 88 CO 0.19 -0.34 0.10 1.14 0.00 0.00 0.00 175.76 176.84 1wdl s GLN 89 N 0.17 0.35 -0.24 0.00 -2.07 -0.64 -4.55 119.66 112.69 1wdl s GLN 89 Ca -0.01 -0.29 -0.08 0.00 -1.82 0.00 0.00 55.36 53.16 1wdl s GLN 89 Cb -0.04 0.14 -0.04 0.00 -1.09 0.00 0.00 33.01 31.98 1wdl s GLN 89 CO 0.02 -0.07 0.09 0.99 -1.32 0.00 0.00 175.29 175.00 1wdl s THR 90 N -1.00 4.63 -0.25 3.63 2.01 -1.26 -1.60 115.64 121.80 1wdl s THR 90 Ca -0.11 -0.07 -0.08 0.00 0.31 0.00 0.00 61.69 61.74 1wdl s THR 90 Cb -0.06 -3.15 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 1wdl s THR 90 CO 0.01 0.35 0.09 -0.69 -0.69 0.00 0.00 174.62 173.68 1wdl s VAL 91 N 1.33 4.50 -0.16 3.82 1.01 0.07 -4.95 120.40 126.02 1wdl s VAL 91 Ca 0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 1wdl s VAL 91 Cb -0.15 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 1wdl s VAL 91 CO 0.04 0.34 -0.09 -0.55 0.00 0.00 0.00 175.10 174.84 1wdl s SER 92 N 1.52 4.23 -0.31 3.32 0.15 -1.26 -3.30 113.70 118.06 1wdl s SER 92 Ca 0.06 -0.31 0.17 0.00 0.70 0.00 0.00 55.95 56.58 1wdl s SER 92 Cb -0.15 -1.68 0.45 0.00 -1.71 0.00 0.00 66.02 62.94 1wdl s SER 92 CO 0.05 0.12 1.26 -1.14 1.20 0.00 0.00 173.24 174.72 1wdl n ARG 93 N 3.86 1.45 0.00 5.44 0.63 -1.26 -4.96 116.66 121.82 1wdl n ARG 93 Ca -0.18 -2.51 0.00 0.00 -0.92 0.00 0.00 57.85 54.24 1wdl n ARG 93 Cb 0.52 -0.69 0.00 0.00 0.45 0.00 0.00 32.46 32.74 1wdl n ARG 93 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1wdl n LEU 94 N -0.82 0.00 -0.01 6.15 4.77 -1.26 -2.21 117.00 123.62 1wdl n LEU 94 Ca -0.02 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.83 1wdl n LEU 94 Cb 0.84 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.83 1wdl n LEU 94 CO 0.01 0.00 0.68 0.00 -1.33 0.00 0.00 177.39 176.75 1wdl n GLY 96 N -0.04 1.01 0.44 0.00 0.00 -0.94 -4.07 105.19 101.59 1wdl n GLY 96 Ca -0.08 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.79 1wdl n GLY 96 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1wdl h SER 97 N 0.11 -1.43 -0.97 1.61 0.02 -1.63 -1.05 113.55 110.21 1wdl h SER 97 Ca 0.00 0.14 0.18 0.00 -0.84 0.00 0.00 61.79 61.27 1wdl h SER 97 Cb 0.38 0.52 -0.10 0.00 0.14 0.00 0.00 62.40 63.33 1wdl h SER 97 CO 0.00 -0.52 0.57 0.28 -1.14 0.00 0.00 176.83 176.02 1wdl h SER 98 N -0.72 0.73 -0.33 3.07 0.02 -1.76 -1.52 113.55 113.04 1wdl h SER 98 Ca -0.01 0.09 -0.12 0.00 -0.84 0.00 0.00 61.79 60.91 1wdl h SER 98 Cb 0.71 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 1wdl h SER 98 CO -0.23 0.28 -0.24 -0.03 -1.14 0.00 0.00 176.83 175.46 1wdl h MET 99 N 0.75 0.75 -0.60 3.45 -1.53 -1.66 -2.59 114.93 113.50 1wdl h MET 99 Ca 0.55 -0.36 0.07 0.00 -3.44 0.00 0.00 59.70 56.51 1wdl h MET 99 Cb 0.81 -0.00 -0.04 0.00 -0.55 0.00 0.00 31.60 31.83 1wdl h MET 99 CO -0.37 0.98 0.40 0.77 0.14 0.00 0.00 176.91 178.83 1wdl h SER 100 N 0.52 0.48 -0.29 1.39 0.02 -0.26 0.01 113.55 115.43 1wdl h SER 100 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1wdl h SER 100 Cb 0.81 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 1wdl h SER 100 CO 0.07 0.31 0.19 0.00 -1.14 0.00 0.00 176.83 176.25 1wdl h ALA 101 N 1.68 0.37 -1.01 3.77 0.00 -0.94 0.38 119.26 123.51 1wdl h ALA 101 Ca 0.26 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.19 1wdl h ALA 101 Cb 0.33 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 1wdl h ALA 101 CO -0.08 -0.16 0.66 1.25 0.00 0.00 0.00 179.25 180.92 1wdl h LEU 102 N 0.39 1.10 -0.14 0.00 5.85 -0.75 -2.36 115.31 119.39 1wdl h LEU 102 Ca 0.11 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1wdl h LEU 102 Cb -0.04 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.74 1wdl h LEU 102 CO -0.02 0.75 -0.01 0.45 -0.34 0.00 0.00 178.44 179.27 1wdl h HIS 103 N 1.27 0.27 -0.32 1.25 3.86 -0.60 -1.14 115.15 119.74 1wdl h HIS 103 Ca 0.40 -0.05 0.07 0.00 -1.16 0.00 0.00 60.37 59.63 1wdl h HIS 103 Cb 0.01 -0.07 -0.06 0.00 1.06 0.00 0.00 27.41 28.35 1wdl h HIS 103 CO -0.00 0.48 -0.09 1.15 0.86 0.00 0.00 177.93 180.33 1wdl h THR 104 N -0.03 0.65 -0.50 2.45 2.02 -0.61 0.66 112.91 117.56 1wdl h THR 104 Ca 0.04 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 1wdl h THR 104 Cb 0.38 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1wdl h THR 104 CO 0.01 0.00 0.19 0.00 0.37 0.00 0.00 175.52 176.09 1wdl h ALA 105 N 1.29 0.65 -0.01 6.16 0.00 -1.44 -1.52 119.26 124.39 1wdl h ALA 105 Ca 0.16 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1wdl h ALA 105 Cb 0.26 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1wdl h ALA 105 CO -0.34 0.26 -0.36 0.00 0.00 0.00 0.00 179.25 178.81 1wdl h ALA 106 N 1.04 -0.54 -0.64 0.00 0.00 -0.20 0.10 119.26 119.03 1wdl h ALA 106 Ca 0.16 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1wdl h ALA 106 Cb 0.21 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1wdl h ALA 106 CO -0.01 -0.88 0.42 1.96 0.00 0.00 0.00 179.25 180.74 1wdl h GLN 107 N -0.51 0.84 0.39 0.00 4.20 -0.81 -1.21 115.11 118.01 1wdl h GLN 107 Ca 0.06 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1wdl h GLN 107 Cb 0.60 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.19 1wdl h GLN 107 CO -0.29 0.56 -0.19 0.00 -0.67 0.00 0.00 178.83 178.24 1wdl h ALA 108 N 1.59 -0.52 -0.43 3.87 0.00 -0.25 -1.11 119.26 122.42 1wdl h ALA 108 Ca 0.23 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.09 1wdl h ALA 108 Cb -0.09 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.83 1wdl h ALA 108 CO -0.05 -0.77 -0.01 0.82 0.00 0.00 0.00 179.25 179.25 1wdl h ILE 109 N -0.57 0.67 -0.87 0.00 2.04 -0.43 -1.28 117.51 117.07 1wdl h ILE 109 Ca -0.05 -0.03 0.04 0.00 1.00 0.00 0.00 64.86 65.81 1wdl h ILE 109 Cb 0.43 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 1wdl h ILE 109 CO 0.09 0.02 0.57 0.24 0.00 0.00 0.00 178.15 179.07 1wdl h MET 110 N 0.10 1.04 -0.11 2.37 2.86 -1.04 -2.18 114.93 117.97 1wdl h MET 110 Ca 0.21 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1wdl h MET 110 Cb 0.31 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1wdl h MET 110 CO -0.36 0.69 0.00 0.25 1.06 0.00 0.00 176.91 178.55 1wdl n THR 111 N -4.45 0.14 -2.26 2.22 -2.24 -0.44 -4.90 114.28 102.35 1wdl n THR 111 Ca 0.12 -0.22 -0.05 0.00 -2.27 0.00 0.00 64.05 61.62 1wdl n THR 111 Cb 0.12 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1wdl n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wdl n GLY 112 N 1.00 0.25 2.87 3.38 0.00 -0.82 -4.97 105.19 106.90 1wdl n GLY 112 Ca 0.15 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 1wdl n GLY 112 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1wdl n ASN 113 N 0.85 5.01 0.00 1.61 3.02 -0.56 -5.01 115.26 120.18 1wdl n ASN 113 Ca -0.05 -3.69 0.00 0.00 -0.03 0.00 0.00 54.58 50.81 1wdl n ASN 113 Cb 0.54 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 1wdl n ASN 113 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdl n GLY 114 N -0.24 3.66 0.00 7.41 0.00 -1.26 -4.57 105.19 110.19 1wdl n GLY 114 Ca 0.34 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1wdl n GLY 114 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wdl n ASP 115 N 0.00 3.79 -4.18 1.61 8.00 -1.26 -4.43 116.55 120.08 1wdl n ASP 115 Ca 0.00 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.20 1wdl n ASP 115 Cb 0.00 0.06 -0.17 0.00 -0.02 0.00 0.00 41.12 40.99 1wdl n ASP 115 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1wdl s VAL 116 N -1.92 1.83 0.18 2.53 1.01 -1.26 -2.45 120.40 120.32 1wdl s VAL 116 Ca 0.00 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.12 1wdl s VAL 116 Cb 0.00 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1wdl s VAL 116 CO 0.00 0.51 -0.07 -0.36 0.00 0.00 0.00 175.10 175.18 1wdl s PHE 117 N 0.29 1.38 -0.37 5.22 0.40 0.22 -0.68 117.98 124.44 1wdl s PHE 117 Ca -0.14 -0.80 0.00 0.00 -0.60 0.00 0.00 56.93 55.39 1wdl s PHE 117 Cb -0.16 -0.73 0.12 0.00 0.51 0.00 0.00 43.02 42.76 1wdl s PHE 117 CO 0.07 0.06 0.17 0.08 0.70 0.00 0.00 175.22 176.30 1wdl s VAL 118 N -3.34 0.95 0.41 -0.44 1.01 -1.14 -0.91 120.40 116.95 1wdl s VAL 118 Ca 0.21 -1.89 0.06 0.00 0.00 0.00 0.00 61.98 60.36 1wdl s VAL 118 Cb 0.03 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.72 1wdl s VAL 118 CO 0.03 -0.81 0.58 0.68 0.00 0.00 0.00 175.10 175.58 1wdl s VAL 119 N 1.05 3.37 -5.00 2.92 -7.23 0.22 -2.52 120.40 113.21 1wdl s VAL 119 Ca 0.14 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.40 1wdl s VAL 119 Cb -0.21 -3.17 0.00 0.00 0.56 0.00 0.00 36.38 33.56 1wdl s VAL 119 CO -0.11 -0.08 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 1wdl n GLY 120 N -1.87 -0.64 3.61 2.32 0.00 -0.89 -0.42 105.19 107.29 1wdl n GLY 120 Ca 0.05 -1.29 -0.07 0.00 0.00 0.00 0.00 46.02 44.71 1wdl n GLY 120 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wdl s GLY 121 N 0.00 -0.38 0.06 -0.02 0.00 -0.56 -0.35 107.32 106.08 1wdl s GLY 121 Ca 0.00 0.47 -0.11 0.00 0.00 0.00 0.00 44.72 45.08 1wdl s GLY 121 CO 0.00 0.15 0.25 0.54 0.00 0.00 0.00 173.10 174.04 1wdl s VAL 122 N -3.40 0.11 -0.30 1.40 0.11 0.41 -1.31 120.40 117.42 1wdl s VAL 122 Ca 0.07 -0.87 -0.02 0.00 -2.93 0.00 0.00 61.98 58.23 1wdl s VAL 122 Cb -0.02 -1.06 0.19 0.00 -1.53 0.00 0.00 36.38 33.96 1wdl s VAL 122 CO -0.04 -0.48 0.69 -0.70 -3.33 0.00 0.00 175.10 171.24 1wdl s GLU 123 N -3.03 0.49 -1.04 1.54 2.56 -0.98 -3.95 118.70 114.28 1wdl s GLU 123 Ca -0.02 0.76 -0.06 0.00 0.00 0.00 0.00 54.97 55.65 1wdl s GLU 123 Cb 0.01 0.41 0.27 0.00 2.00 0.00 0.00 34.13 36.81 1wdl s GLU 123 CO -0.06 -0.63 1.07 1.58 -0.56 0.00 0.00 175.26 176.66 1wdl n HIS 124 N 5.42 4.52 0.58 5.30 -0.00 -1.26 -2.46 115.22 127.32 1wdl n HIS 124 Ca -0.00 -3.79 0.05 0.00 -0.00 0.00 0.00 57.72 53.97 1wdl n HIS 124 Cb 0.52 -1.45 0.28 0.00 -0.00 0.00 0.00 29.99 29.34 1wdl n HIS 124 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 1wdl n MET 125 N 2.32 0.28 -0.03 1.57 0.00 -1.26 -1.20 117.12 118.80 1wdl n MET 125 Ca 0.24 0.02 -0.20 0.00 0.00 0.00 0.00 57.70 57.76 1wdl n MET 125 Cb 0.38 -1.50 -0.13 0.00 0.00 0.00 0.00 33.22 31.97 1wdl n MET 125 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 1wdl h GLY 126 N 1.50 0.17 1.59 3.03 0.00 -1.89 -3.12 103.07 104.35 1wdl h GLY 126 Ca 0.00 -0.42 -0.21 0.00 0.00 0.00 0.00 47.33 46.69 1wdl h GLY 126 CO 0.00 0.37 -1.18 0.45 0.00 0.00 0.00 176.54 176.19 1wdl h HIS 127 N -0.58 0.00 -2.50 5.60 3.86 -1.83 -3.39 115.15 116.31 1wdl h HIS 127 Ca -0.28 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.34 1wdl h HIS 127 Cb 1.54 0.00 -0.40 0.00 1.06 0.00 0.00 27.41 29.61 1wdl h HIS 127 CO 0.14 0.88 -0.82 0.28 0.86 0.00 0.00 177.93 179.27 1wdl n VAL 128 N -3.19 0.26 -0.68 2.45 0.31 -0.34 -4.99 118.33 112.16 1wdl n VAL 128 Ca -0.06 -4.22 -0.32 0.00 -0.01 0.00 0.00 64.34 59.73 1wdl n VAL 128 Cb 0.93 -1.93 0.17 0.00 -0.91 0.00 0.00 33.84 32.10 1wdl n VAL 128 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1wdl n SER 129 N 2.04 -1.63 -0.04 4.52 3.41 -1.18 -4.27 113.62 116.47 1wdl n SER 129 Ca 0.25 0.13 -0.14 0.00 -0.26 0.00 0.00 58.87 58.85 1wdl n SER 129 Cb 0.44 -1.20 -0.08 0.00 -0.26 0.00 0.00 64.21 63.10 1wdl n SER 129 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wdl h MET 130 N -1.99 0.37 0.00 4.33 -0.00 -1.97 -3.11 114.93 112.57 1wdl h MET 130 Ca -0.50 -0.26 0.00 0.00 -0.00 0.00 0.00 59.70 58.94 1wdl h MET 130 Cb 1.31 0.04 0.00 0.00 -0.00 0.00 0.00 31.60 32.95 1wdl h MET 130 CO 0.39 0.88 0.00 -1.33 -0.00 0.00 0.00 176.91 176.85 1wdl n MET 131 N -4.44 0.31 -2.19 -0.10 2.81 -1.26 -4.77 117.12 107.48 1wdl n MET 131 Ca -0.07 0.10 -0.42 0.00 -1.81 0.00 0.00 57.70 55.49 1wdl n MET 131 Cb 0.47 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.45 1wdl n MET 131 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1wdl s HIS 132 N -2.45 2.98 -1.04 2.03 5.04 -1.18 -3.83 115.29 116.84 1wdl s HIS 132 Ca 0.19 0.85 -0.08 0.00 -1.54 0.00 0.00 55.06 54.48 1wdl s HIS 132 Cb 0.12 -3.68 -0.05 0.00 0.04 0.00 0.00 32.58 29.01 1wdl s HIS 132 CO 0.25 -2.47 0.87 0.41 -2.34 0.00 0.00 174.74 171.47 1wdl n GLY 133 N 3.60 -1.15 3.31 1.59 0.00 -1.26 -4.97 105.19 106.32 1wdl n GLY 133 Ca 0.13 0.55 -0.32 0.00 0.00 0.00 0.00 46.02 46.38 1wdl n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wdl s VAL 134 N -3.37 2.56 -0.50 1.61 1.01 -1.25 -5.08 120.40 115.38 1wdl s VAL 134 Ca 0.42 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.58 1wdl s VAL 134 Cb -0.08 -2.02 0.15 0.00 0.00 0.00 0.00 36.38 34.44 1wdl s VAL 134 CO 0.77 0.55 0.31 -0.62 0.00 0.00 0.00 175.10 176.11 1wdl s ASP 135 N 0.15 3.65 -0.18 3.32 -1.08 -1.26 -5.09 116.67 116.17 1wdl s ASP 135 Ca -0.10 -3.01 -0.33 0.00 -0.52 0.00 0.00 52.55 48.59 1wdl s ASP 135 Cb -0.16 -1.14 -0.10 0.00 -1.46 0.00 0.00 42.92 40.06 1wdl s ASP 135 CO 0.06 -0.21 2.03 -2.65 0.52 0.00 0.00 175.17 174.92 1wdl n PRO 136 N 3.04 1.88 -2.43 4.34 -0.02 -1.26 -4.91 135.00 135.63 1wdl n PRO 136 Ca 0.14 0.63 -0.43 0.00 -2.02 0.00 0.00 63.50 61.81 1wdl n PRO 136 Cb 0.36 -2.72 -0.02 0.00 -0.02 0.00 0.00 33.50 31.10 1wdl n PRO 136 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1wdl s ASN 137 N 5.74 6.55 0.33 2.55 2.47 -1.26 -4.90 114.94 126.42 1wdl s ASN 137 Ca 0.98 0.94 0.08 0.00 0.42 0.00 0.00 52.86 55.29 1wdl s ASN 137 Cb -0.66 -2.54 0.78 0.00 -1.45 0.00 0.00 41.25 37.38 1wdl s ASN 137 CO 0.48 -1.23 1.83 -0.65 -3.72 0.00 0.00 177.10 173.81 1wdl h PRO 138 N 9.75 0.71 -0.09 0.43 0.11 -2.04 -1.21 132.00 139.67 1wdl h PRO 138 Ca -0.26 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.83 1wdl h PRO 138 Cb 1.09 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 1wdl h PRO 138 CO 1.07 0.47 0.15 0.45 -0.21 0.00 0.00 178.00 179.93 1wdl h HIS 139 N 0.74 0.00 -0.09 0.65 3.86 -2.01 -1.47 115.15 116.82 1wdl h HIS 139 Ca 0.51 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.70 1wdl h HIS 139 Cb 0.81 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.27 1wdl h HIS 139 CO -0.00 0.00 -0.03 1.98 0.86 0.00 0.00 177.93 180.74 1wdl h MET 140 N 0.00 0.12 0.00 2.45 -1.53 -1.55 -0.76 114.93 113.66 1wdl h MET 140 Ca 0.04 -0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.29 1wdl h MET 140 Cb 0.35 -0.02 0.00 0.00 -0.55 0.00 0.00 31.60 31.37 1wdl h MET 140 CO -0.00 0.17 0.00 0.43 0.14 0.00 0.00 176.91 177.65 1wdl n SER 141 N -4.43 0.00 0.07 1.39 7.64 -0.55 -0.50 113.62 117.23 1wdl n SER 141 Ca -0.02 0.23 0.12 0.00 1.01 0.00 0.00 58.87 60.21 1wdl n SER 141 Cb 0.16 -0.36 0.17 0.00 -1.01 0.00 0.00 64.21 63.16 1wdl n SER 141 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1wdl h LEU 142 N 0.00 0.00 0.00 -3.43 5.85 -1.30 -3.38 115.31 113.05 1wdl h LEU 142 Ca 0.00 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.53 1wdl h LEU 142 Cb 0.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1wdl h LEU 142 CO 0.00 0.10 -0.78 -1.22 -0.34 0.00 0.00 178.44 176.19 1wdl n TYR 143 N -2.16 0.00 -3.63 1.25 4.02 -0.82 -5.09 117.16 110.74 1wdl n TYR 143 Ca 0.03 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.78 1wdl n TYR 143 Cb 0.45 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.70 1wdl n TYR 143 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wdl s ALA 144 N -1.59 -1.21 0.24 -0.72 0.00 0.34 -5.14 121.76 113.68 1wdl s ALA 144 Ca 0.00 0.58 -0.30 0.00 0.00 0.00 0.00 51.96 52.24 1wdl s ALA 144 Cb 0.00 0.26 -0.10 0.00 0.00 0.00 0.00 23.12 23.28 1wdl s ALA 144 CO 0.00 -0.43 1.42 0.00 0.00 0.00 0.00 175.76 176.76 1wdl s ALA 145 N -2.07 3.61 0.25 0.00 0.00 -1.26 -3.40 121.76 118.90 1wdl s ALA 145 Ca -0.08 1.30 -0.04 0.00 0.00 0.00 0.00 51.96 53.14 1wdl s ALA 145 Cb -0.01 -3.55 0.30 0.00 0.00 0.00 0.00 23.12 19.86 1wdl s ALA 145 CO 0.01 -0.72 1.83 -0.22 0.00 0.00 0.00 175.76 176.67 1wdl h LYS 146 N 5.09 1.05 -0.43 0.00 3.64 -1.91 -2.46 116.57 121.55 1wdl h LYS 146 Ca -0.46 -0.17 0.13 0.00 -1.27 0.00 0.00 60.65 58.88 1wdl h LYS 146 Cb 1.22 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 1wdl h LYS 146 CO 0.78 0.85 0.37 0.00 -2.27 0.00 0.00 179.45 179.17 1wdl h ALA 147 N 1.29 2.26 0.00 5.00 0.00 -1.97 0.19 119.26 126.04 1wdl h ALA 147 Ca 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1wdl h ALA 147 Cb 0.18 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1wdl h ALA 147 CO -0.02 -0.60 0.00 0.43 0.00 0.00 0.00 179.25 179.06 1wdl n SER 148 N -4.07 0.41 0.23 0.00 7.64 -0.92 -0.94 113.62 115.96 1wdl n SER 148 Ca 0.08 0.65 0.13 0.00 1.01 0.00 0.00 58.87 60.73 1wdl n SER 148 Cb 0.56 -0.72 0.24 0.00 -1.01 0.00 0.00 64.21 63.29 1wdl n SER 148 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1wdl h GLY 149 N 1.04 0.00 -7.54 0.23 0.00 -0.78 -3.40 103.07 92.62 1wdl h GLY 149 Ca 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 47.33 46.61 1wdl h GLY 149 CO 0.00 0.00 0.61 1.06 0.00 0.00 0.00 176.54 178.21 1wdl s MET 150 N -3.27 3.58 0.26 4.80 -1.94 -0.12 -4.91 119.30 117.70 1wdl s MET 150 Ca 0.06 -1.92 0.07 0.00 -1.71 0.00 0.00 55.69 52.19 1wdl s MET 150 Cb 0.06 -4.75 0.77 0.00 2.01 0.00 0.00 34.83 32.91 1wdl s MET 150 CO 0.65 -1.64 1.21 -1.33 -0.01 0.00 0.00 175.02 173.91 1wdl n MET 151 N 5.86 -0.06 0.02 2.03 2.81 -1.26 -0.34 117.12 126.18 1wdl n MET 151 Ca 0.20 1.12 -0.10 0.00 -1.81 0.00 0.00 57.70 57.11 1wdl n MET 151 Cb 0.48 -1.87 -0.04 0.00 -0.71 0.00 0.00 33.22 31.09 1wdl n MET 151 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1wdl h GLY 152 N 0.00 -0.10 1.88 3.03 0.00 -1.93 -1.96 103.07 104.00 1wdl h GLY 152 Ca 0.54 0.17 0.00 0.00 0.00 0.00 0.00 47.33 48.04 1wdl h GLY 152 CO -0.67 -0.14 0.07 1.41 0.00 0.00 0.00 176.54 177.21 1wdl h LEU 153 N -0.19 0.14 -0.54 3.11 3.38 -0.98 -1.09 115.31 119.14 1wdl h LEU 153 Ca 0.08 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 1wdl h LEU 153 Cb 0.30 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1wdl h LEU 153 CO -0.20 0.10 -0.30 0.71 0.09 0.00 0.00 178.44 178.84 1wdl h THR 154 N 0.16 1.28 -0.93 0.22 1.35 -1.25 -1.35 112.91 112.40 1wdl h THR 154 Ca 0.04 -1.46 -0.01 0.00 -0.55 0.00 0.00 66.41 64.43 1wdl h THR 154 Cb -0.01 1.30 -0.04 0.00 -1.73 0.00 0.00 68.15 67.66 1wdl h THR 154 CO -0.01 0.49 0.54 0.00 -0.25 0.00 0.00 175.52 176.29 1wdl h ALA 155 N 0.93 1.19 0.07 6.62 0.00 -0.51 0.77 119.26 128.33 1wdl h ALA 155 Ca 0.08 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1wdl h ALA 155 Cb 0.86 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1wdl h ALA 155 CO 0.08 0.66 -0.03 0.93 0.00 0.00 0.00 179.25 180.89 1wdl h GLU 156 N 1.29 -0.09 0.28 0.00 4.39 -0.97 -0.34 114.58 119.14 1wdl h GLU 156 Ca 0.33 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.02 1wdl h GLU 156 Cb -0.02 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1wdl h GLU 156 CO -0.06 0.01 -0.13 1.98 -1.16 0.00 0.00 179.01 179.65 1wdl h MET 157 N -0.17 -0.36 -1.00 2.33 4.05 -0.79 -0.29 114.93 118.71 1wdl h MET 157 Ca -0.01 0.02 0.07 0.00 -0.28 0.00 0.00 59.70 59.51 1wdl h MET 157 Cb 0.14 0.08 -0.07 0.00 -0.80 0.00 0.00 31.60 30.95 1wdl h MET 157 CO 0.02 -0.21 0.64 1.25 0.23 0.00 0.00 176.91 178.84 1wdl h LEU 158 N -0.41 1.02 0.00 3.39 5.85 -0.87 -2.14 115.31 122.15 1wdl h LEU 158 Ca -0.04 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 1wdl h LEU 158 Cb 0.32 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1wdl h LEU 158 CO 0.06 0.64 -0.00 1.23 -0.34 0.00 0.00 178.44 180.03 1wdl h GLY 159 N 1.15 -0.01 0.31 3.75 0.00 -0.69 -2.73 103.07 104.85 1wdl h GLY 159 Ca 0.44 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.86 1wdl h GLY 159 CO -0.18 -0.00 0.12 0.50 0.00 0.00 0.00 176.54 176.98 1wdl h LYS 160 N -0.12 0.26 0.22 4.80 1.79 -0.60 0.12 116.57 123.04 1wdl h LYS 160 Ca -0.00 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1wdl h LYS 160 Cb 0.12 -0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.67 1wdl h LYS 160 CO 0.00 0.17 -0.44 0.52 -1.08 0.00 0.00 179.45 178.62 1wdl h MET 161 N 0.27 -0.72 0.00 3.15 2.86 -1.25 -2.63 114.93 116.61 1wdl h MET 161 Ca 0.28 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 1wdl h MET 161 Cb 0.38 0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.20 1wdl h MET 161 CO -0.35 -0.48 0.00 0.72 1.06 0.00 0.00 176.91 177.87 1wdl n HIS 162 N -5.49 0.11 -2.23 -0.22 8.25 -1.04 -4.98 115.22 109.62 1wdl n HIS 162 Ca -0.09 0.03 -0.02 0.00 -0.26 0.00 0.00 57.72 57.39 1wdl n HIS 162 Cb 0.40 -0.55 0.00 0.00 1.12 0.00 0.00 29.99 30.96 1wdl n HIS 162 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wdl n GLY 163 N 1.27 -0.86 3.18 -1.41 0.00 0.40 -5.05 105.19 102.73 1wdl n GLY 163 Ca 0.06 0.31 -0.34 0.00 0.00 0.00 0.00 46.02 46.05 1wdl n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wdl s ILE 164 N -2.51 2.76 0.71 -0.61 1.09 -1.15 -5.05 121.20 116.43 1wdl s ILE 164 Ca 0.05 -1.05 -0.13 0.00 -1.10 0.00 0.00 60.65 58.42 1wdl s ILE 164 Cb -0.01 -2.40 0.02 0.00 -1.06 0.00 0.00 42.46 39.01 1wdl s ILE 164 CO 0.38 0.21 1.10 -0.94 -0.10 0.00 0.00 174.94 175.59 1wdl s SER 165 N 1.31 4.90 0.29 3.58 1.04 -1.26 -4.86 113.70 118.69 1wdl s SER 165 Ca -0.00 1.90 0.03 0.00 0.48 0.00 0.00 55.95 58.36 1wdl s SER 165 Cb -0.17 -2.53 0.65 0.00 0.10 0.00 0.00 66.02 64.07 1wdl s SER 165 CO -0.05 -1.77 1.79 -0.09 0.98 0.00 0.00 173.24 174.09 1wdl h ARG 166 N -0.48 0.78 -0.51 4.02 9.65 -1.94 -0.03 114.38 125.87 1wdl h ARG 166 Ca -0.45 -0.05 -0.10 0.00 -1.10 0.00 0.00 59.98 58.28 1wdl h ARG 166 Cb 1.24 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 29.62 1wdl h ARG 166 CO 0.53 0.51 -0.07 1.49 2.80 0.00 0.00 179.97 185.24 1wdl h GLU 167 N 0.80 0.94 -0.72 0.20 4.22 -1.97 -1.32 114.58 116.73 1wdl h GLU 167 Ca 0.54 -0.33 0.04 0.00 0.08 0.00 0.00 59.36 59.68 1wdl h GLU 167 Cb 0.75 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.89 1wdl h GLU 167 CO -0.35 0.99 0.48 1.96 -2.18 0.00 0.00 179.01 179.91 1wdl h GLN 168 N 0.80 0.84 0.02 1.92 4.20 -1.38 0.60 115.11 122.11 1wdl h GLN 168 Ca 0.14 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1wdl h GLN 168 Cb 0.61 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1wdl h GLN 168 CO 0.04 0.55 -0.01 1.96 -0.67 0.00 0.00 178.83 180.71 1wdl h GLN 169 N 0.86 -0.02 -0.98 1.46 4.20 -1.17 -2.97 115.11 116.48 1wdl h GLN 169 Ca 0.29 0.00 0.08 0.00 0.06 0.00 0.00 58.65 59.08 1wdl h GLN 169 Cb 0.08 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.80 1wdl h GLN 169 CO -0.08 0.74 0.63 -0.44 -0.67 0.00 0.00 178.83 179.01 1wdl h ASP 170 N -0.88 0.98 -0.34 1.46 3.32 -1.11 0.22 116.42 120.08 1wdl h ASP 170 Ca -0.00 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1wdl h ASP 170 Cb 0.77 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 1wdl h ASP 170 CO 0.00 0.61 0.15 0.00 -1.72 0.00 0.00 179.24 178.28 1wdl h ALA 171 N 1.49 1.54 -0.22 3.45 0.00 -0.96 -1.75 119.26 122.81 1wdl h ALA 171 Ca 0.44 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 1wdl h ALA 171 Cb 0.25 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1wdl h ALA 171 CO -0.19 0.36 -0.02 0.35 0.00 0.00 0.00 179.25 179.75 1wdl h PHE 172 N 0.55 0.44 -0.94 0.00 3.57 -0.81 -2.28 116.94 117.46 1wdl h PHE 172 Ca 0.14 -0.08 0.04 0.00 3.53 0.00 0.00 57.97 61.59 1wdl h PHE 172 Cb 0.12 -0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.69 1wdl h PHE 172 CO 0.01 0.60 0.61 0.00 -2.23 0.00 0.00 178.31 177.30 1wdl h ALA 173 N 0.77 1.41 -0.39 2.41 0.00 -0.79 -0.98 119.26 121.70 1wdl h ALA 173 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1wdl h ALA 173 Cb 0.44 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1wdl h ALA 173 CO 0.02 0.49 0.16 0.28 0.00 0.00 0.00 179.25 180.19 1wdl h VAL 174 N 1.16 1.19 -0.39 0.00 2.07 -1.18 -1.06 116.25 118.05 1wdl h VAL 174 Ca 0.38 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1wdl h VAL 174 Cb 0.03 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1wdl h VAL 174 CO -0.12 0.21 0.17 -0.09 0.02 0.00 0.00 177.57 177.76 1wdl h ARG 175 N 0.48 0.54 -0.05 1.57 1.12 -0.77 0.36 114.38 117.62 1wdl h ARG 175 Ca 0.13 -0.06 -0.02 0.00 -1.11 0.00 0.00 59.98 58.91 1wdl h ARG 175 Cb 0.18 -0.11 -0.00 0.00 -0.01 0.00 0.00 29.97 30.04 1wdl h ARG 175 CO -0.01 0.43 -0.06 1.03 -3.11 0.00 0.00 179.97 178.25 1wdl h SER 176 N 0.54 0.15 0.05 -3.80 0.87 -0.73 -1.76 113.55 108.88 1wdl h SER 176 Ca 0.14 -0.51 -0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1wdl h SER 176 Cb 0.09 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 1wdl h SER 176 CO -0.02 0.62 -0.03 0.45 -0.53 0.00 0.00 176.83 177.33 1wdl h HIS 177 N -0.32 -0.06 -0.06 2.24 3.86 -0.96 -1.07 115.15 118.78 1wdl h HIS 177 Ca 0.01 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.25 1wdl h HIS 177 Cb 0.59 0.02 -0.04 0.00 1.06 0.00 0.00 27.41 29.03 1wdl h HIS 177 CO 0.10 0.12 -0.19 1.96 0.86 0.00 0.00 177.93 180.78 1wdl h GLN 178 N -0.24 -0.26 -0.20 2.45 4.20 -1.00 -0.65 115.11 119.41 1wdl h GLN 178 Ca -0.01 0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 1wdl h GLN 178 Cb 0.22 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1wdl h GLN 178 CO 0.01 -0.17 -0.04 -0.07 -0.67 0.00 0.00 178.83 177.88 1wdl h LEU 179 N -0.27 0.27 -0.16 1.46 3.38 -1.31 -0.88 115.31 117.80 1wdl h LEU 179 Ca 0.08 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1wdl h LEU 179 Cb 0.38 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1wdl h LEU 179 CO -0.22 0.37 -0.06 0.00 0.09 0.00 0.00 178.44 178.62 1wdl h ALA 180 N 1.67 0.23 -0.52 1.53 0.00 -0.61 -1.83 119.26 119.72 1wdl h ALA 180 Ca 0.06 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1wdl h ALA 180 Cb 0.27 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1wdl h ALA 180 CO 0.01 0.01 0.32 1.25 0.00 0.00 0.00 179.25 180.84 1wdl h HIS 181 N 0.01 0.68 0.38 0.00 -0.00 -0.82 -1.28 115.15 114.12 1wdl h HIS 181 Ca 0.04 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.41 1wdl h HIS 181 Cb 0.51 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.68 1wdl h HIS 181 CO 0.06 0.46 -0.37 -0.22 -0.00 0.00 0.00 177.93 177.86 1wdl h LYS 182 N 0.70 -0.74 -0.83 5.26 3.64 -1.10 0.13 116.57 123.63 1wdl h LYS 182 Ca 0.19 0.05 0.12 0.00 -1.27 0.00 0.00 60.65 59.74 1wdl h LYS 182 Cb -0.02 0.17 -0.06 0.00 -0.41 0.00 0.00 32.23 31.90 1wdl h LYS 182 CO -0.04 -0.49 0.54 0.00 -2.27 0.00 0.00 179.45 177.19 1wdl h ALA 183 N -0.34 1.82 0.57 5.00 0.00 -1.20 0.07 119.26 125.18 1wdl h ALA 183 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1wdl h ALA 183 Cb 0.69 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1wdl h ALA 183 CO -0.06 -0.02 -0.27 1.15 0.00 0.00 0.00 179.25 180.05 1wdl h THR 184 N 0.69 0.25 -0.70 0.00 2.02 -0.50 0.43 112.91 115.10 1wdl h THR 184 Ca 0.40 -0.38 0.06 0.00 0.77 0.00 0.00 66.41 67.26 1wdl h THR 184 Cb 0.59 0.35 -0.06 0.00 -1.74 0.00 0.00 68.15 67.29 1wdl h THR 184 CO -0.16 0.04 0.40 0.58 0.37 0.00 0.00 175.52 176.75 1wdl h VAL 185 N -1.06 0.98 0.00 3.16 2.07 -0.38 -1.14 116.25 119.88 1wdl h VAL 185 Ca -0.08 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1wdl h VAL 185 Cb 0.65 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1wdl h VAL 185 CO 0.13 0.13 0.00 -0.62 0.02 0.00 0.00 177.57 177.23 1wdl n GLU 186 N -4.76 0.44 -1.21 1.57 1.02 -0.02 -4.88 120.64 112.79 1wdl n GLU 186 Ca 0.09 0.05 -0.02 0.00 -0.02 0.00 0.00 57.16 57.26 1wdl n GLU 186 Cb 0.17 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.09 1wdl n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wdl n GLY 187 N 0.55 0.51 0.00 0.62 0.00 -0.43 -4.90 105.19 101.54 1wdl n GLY 187 Ca 0.13 -0.95 0.11 0.00 0.00 0.00 0.00 46.02 45.30 1wdl n GLY 187 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wdl n LYS 188 N -2.67 0.75 0.00 1.61 4.76 0.15 -2.43 118.16 120.32 1wdl n LYS 188 Ca -0.02 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.44 1wdl n LYS 188 Cb 0.14 -1.44 -0.02 0.00 -1.84 0.00 0.00 35.03 31.87 1wdl n LYS 188 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1wdl n PHE 189 N -0.94 0.00 -0.22 2.13 0.99 -1.23 -4.72 117.46 113.47 1wdl n PHE 189 Ca 0.16 0.00 0.17 0.00 -0.00 0.00 0.00 57.45 57.77 1wdl n PHE 189 Cb 0.07 0.00 0.48 0.00 -1.00 0.00 0.00 39.48 39.04 1wdl n PHE 189 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1wdl h LYS 190 N 0.01 0.45 -0.03 -1.08 3.64 -1.81 -0.65 116.57 117.11 1wdl h LYS 190 Ca 0.00 -0.03 -0.22 0.00 -1.27 0.00 0.00 60.65 59.13 1wdl h LYS 190 Cb 0.10 -0.10 0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1wdl h LYS 190 CO 0.00 0.30 -0.84 -0.44 -2.27 0.00 0.00 179.45 176.20 1wdl h ASP 191 N 0.47 0.79 0.38 4.20 3.32 -1.84 -3.37 116.42 120.36 1wdl h ASP 191 Ca 0.44 -0.72 -0.32 0.00 0.02 0.00 0.00 57.03 56.44 1wdl h ASP 191 Cb 0.98 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1wdl h ASP 191 CO -0.17 1.40 -1.55 1.05 -1.72 0.00 0.00 179.24 178.25 1wdl h GLU 192 N 0.25 0.33 -6.17 3.56 4.11 -1.72 -3.46 114.58 111.47 1wdl h GLU 192 Ca -0.10 -0.56 -0.56 0.00 0.07 0.00 0.00 59.36 58.21 1wdl h GLU 192 Cb 1.50 0.21 -0.04 0.00 0.50 0.00 0.00 28.75 30.93 1wdl h GLU 192 CO 0.17 1.22 0.91 0.42 0.07 0.00 0.00 179.01 181.80 1wdl s ILE 193 N -2.61 4.20 -0.36 -1.06 1.01 -0.28 -0.44 121.20 121.65 1wdl s ILE 193 Ca -0.10 1.46 -0.16 0.00 0.00 0.00 0.00 60.65 61.85 1wdl s ILE 193 Cb 0.06 -3.94 -0.00 0.00 0.01 0.00 0.00 42.46 38.59 1wdl s ILE 193 CO 0.87 -0.12 0.40 -0.63 0.00 0.00 0.00 174.94 175.46 1wdl s ILE 194 N 3.46 5.13 0.18 2.92 -1.09 0.26 -4.86 121.20 127.21 1wdl s ILE 194 Ca 0.57 -0.03 -0.31 0.00 -2.23 0.00 0.00 60.65 58.64 1wdl s ILE 194 Cb -0.23 -3.89 -0.16 0.00 -1.58 0.00 0.00 42.46 36.59 1wdl s ILE 194 CO 0.17 -0.19 0.94 -2.65 -1.23 0.00 0.00 174.94 171.97 1wdl n PRO 195 N 5.47 0.73 -3.83 2.79 -0.02 -1.26 -4.42 135.00 134.46 1wdl n PRO 195 Ca -0.08 0.26 -0.12 0.00 -2.02 0.00 0.00 63.50 61.54 1wdl n PRO 195 Cb 0.49 -1.59 -0.13 0.00 -0.02 0.00 0.00 33.50 32.25 1wdl n PRO 195 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1wdl s MET 196 N -0.76 0.15 0.53 -0.52 1.75 -0.93 -4.99 119.30 114.53 1wdl s MET 196 Ca 0.70 0.14 -0.21 0.00 -1.25 0.00 0.00 55.69 55.06 1wdl s MET 196 Cb -0.89 0.07 -0.05 0.00 2.84 0.00 0.00 34.83 36.80 1wdl s MET 196 CO 0.56 -0.02 1.27 -0.65 -0.65 0.00 0.00 175.02 175.53 1wdl s GLN 197 N -0.01 3.28 0.11 4.11 -0.21 -1.26 -1.47 119.66 124.21 1wdl s GLN 197 Ca -0.01 2.02 -0.07 0.00 0.02 0.00 0.00 55.36 57.33 1wdl s GLN 197 Cb -0.01 -2.24 0.03 0.00 1.00 0.00 0.00 33.01 31.79 1wdl s GLN 197 CO 0.00 -1.01 0.34 0.41 -2.12 0.00 0.00 175.29 172.91 1wdl n GLY 198 N 0.61 1.33 3.09 3.09 0.00 0.10 -4.85 105.19 108.56 1wdl n GLY 198 Ca 0.10 -1.06 -0.26 0.00 0.00 0.00 0.00 46.02 44.81 1wdl n GLY 198 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wdl s TYR 199 N -5.51 1.67 0.99 1.61 1.51 -1.05 -1.40 117.35 115.16 1wdl s TYR 199 Ca 0.07 -0.57 -0.16 0.00 -1.01 0.00 0.00 57.07 55.40 1wdl s TYR 199 Cb -0.01 -1.16 0.21 0.00 -0.11 0.00 0.00 41.96 40.88 1wdl s TYR 199 CO 0.03 -0.25 1.28 0.16 -1.11 0.00 0.00 175.55 175.66 1wdl s ASP 200 N 0.39 2.84 0.00 2.29 -4.77 -0.73 -4.25 116.67 112.43 1wdl s ASP 200 Ca -0.11 0.37 0.00 0.00 -3.30 0.00 0.00 52.55 49.51 1wdl s ASP 200 Cb -0.14 -0.48 0.00 0.00 -1.09 0.00 0.00 42.92 41.21 1wdl s ASP 200 CO 0.04 -2.91 0.81 -1.84 0.70 0.00 0.00 175.17 171.96 1wdl n GLU 201 N -3.91 0.00 -0.30 2.11 0.28 -1.26 -1.01 120.64 116.55 1wdl n GLU 201 Ca 0.14 0.32 0.07 0.00 -0.16 0.00 0.00 57.16 57.54 1wdl n GLU 201 Cb 0.59 -1.59 0.22 0.00 1.43 0.00 0.00 31.44 32.10 1wdl n GLU 201 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1wdl n ASN 202 N -1.31 3.45 0.00 -1.84 3.02 -1.26 -4.94 115.26 112.38 1wdl n ASN 202 Ca 0.00 -2.25 0.00 0.00 -0.03 0.00 0.00 54.58 52.30 1wdl n ASN 202 Cb 0.09 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.90 1wdl n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdl n GLY 203 N 0.52 0.60 3.80 7.41 0.00 -0.18 -4.99 105.19 112.34 1wdl n GLY 203 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1wdl n GLY 203 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wdl s PHE 204 N -2.67 3.21 -0.11 1.61 0.08 -1.26 -4.81 117.98 114.04 1wdl s PHE 204 Ca 0.00 1.62 -0.20 0.00 0.12 0.00 0.00 56.93 58.47 1wdl s PHE 204 Cb 0.00 -3.03 -0.04 0.00 -0.57 0.00 0.00 43.02 39.38 1wdl s PHE 204 CO 0.00 -0.53 0.58 -1.17 -0.10 0.00 0.00 175.22 174.00 1wdl s LEU 205 N -3.01 4.28 0.03 -0.37 2.96 -1.26 -1.78 118.68 119.53 1wdl s LEU 205 Ca 0.62 0.96 -0.27 0.00 -0.22 0.00 0.00 54.13 55.21 1wdl s LEU 205 Cb -0.17 -2.86 0.09 0.00 0.50 0.00 0.00 46.19 43.75 1wdl s LEU 205 CO 0.21 -0.07 0.78 -1.59 -1.32 0.00 0.00 176.35 174.36 1wdl s LYS 206 N 0.81 0.98 -0.15 1.98 -2.85 -0.49 -4.98 119.74 115.04 1wdl s LYS 206 Ca 0.31 -0.23 -0.17 0.00 -1.00 0.00 0.00 55.97 54.87 1wdl s LYS 206 Cb -0.16 0.45 -0.04 0.00 -2.06 0.00 0.00 37.83 36.02 1wdl s LYS 206 CO 0.13 -0.40 0.43 0.42 0.10 0.00 0.00 175.35 176.03 1wdl s ILE 207 N -2.85 5.21 -0.06 3.79 1.01 -1.26 -0.72 121.20 126.32 1wdl s ILE 207 Ca 0.01 0.82 -0.04 0.00 0.00 0.00 0.00 60.65 61.44 1wdl s ILE 207 Cb -0.01 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1wdl s ILE 207 CO -0.07 0.32 0.14 -0.36 0.00 0.00 0.00 174.94 174.97 1wdl s PHE 208 N 0.75 3.51 -0.02 3.97 0.40 -0.54 -4.91 117.98 121.13 1wdl s PHE 208 Ca 0.23 0.39 0.04 0.00 -0.60 0.00 0.00 56.93 56.99 1wdl s PHE 208 Cb -0.15 -1.86 0.05 0.00 0.51 0.00 0.00 43.02 41.58 1wdl s PHE 208 CO 0.08 0.66 0.89 -0.40 0.70 0.00 0.00 175.22 177.15 1wdl n ASP 209 N 1.48 0.69 -3.06 1.36 5.68 -1.26 -2.20 116.55 119.24 1wdl n ASP 209 Ca -0.15 -1.93 -0.17 0.00 -0.50 0.00 0.00 54.79 52.03 1wdl n ASP 209 Cb 0.54 -0.16 -0.05 0.00 -1.14 0.00 0.00 41.12 40.30 1wdl n ASP 209 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1wdl n TYR 210 N -0.33 -0.05 -3.75 2.11 0.18 -1.26 -4.97 117.16 109.09 1wdl n TYR 210 Ca 0.03 -1.90 -0.38 0.00 1.88 0.00 0.00 57.90 57.53 1wdl n TYR 210 Cb 0.58 0.04 -0.12 0.00 -0.38 0.00 0.00 39.34 39.46 1wdl n TYR 210 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1wdl s ASP 211 N -2.77 5.31 0.30 9.48 1.01 -1.26 -4.06 116.67 124.67 1wdl s ASP 211 Ca 0.18 -1.45 0.04 0.00 0.71 0.00 0.00 52.55 52.04 1wdl s ASP 211 Cb 0.01 -1.86 0.69 0.00 1.01 0.00 0.00 42.92 42.77 1wdl s ASP 211 CO 0.13 -0.41 1.79 -0.33 0.21 0.00 0.00 175.17 176.55 1wdl h GLU 212 N 8.19 0.78 -1.08 8.23 5.08 -1.65 -2.33 114.58 131.80 1wdl h GLU 212 Ca -0.21 -0.05 0.29 0.00 -1.00 0.00 0.00 59.36 58.40 1wdl h GLU 212 Cb 1.07 -0.18 -0.10 0.00 0.50 0.00 0.00 28.75 30.05 1wdl h GLU 212 CO 0.65 0.51 0.70 1.79 -1.00 0.00 0.00 179.01 181.66 1wdl h THR 213 N 0.80 0.46 -3.36 1.13 1.35 -1.78 -3.43 112.91 108.09 1wdl h THR 213 Ca 0.56 -0.11 -0.53 0.00 -0.55 0.00 0.00 66.41 65.77 1wdl h THR 213 Cb 0.80 0.10 0.08 0.00 -1.73 0.00 0.00 68.15 67.40 1wdl h THR 213 CO -0.36 0.06 0.85 -0.63 -0.25 0.00 0.00 175.52 175.19 1wdl s ILE 214 N -5.44 2.23 -0.40 6.82 1.01 -0.70 -4.82 121.20 119.90 1wdl s ILE 214 Ca -0.08 0.20 0.01 0.00 0.00 0.00 0.00 60.65 60.77 1wdl s ILE 214 Cb 0.26 -3.12 0.13 0.00 0.01 0.00 0.00 42.46 39.73 1wdl s ILE 214 CO 0.80 0.03 0.21 -0.13 0.00 0.00 0.00 174.94 175.85 1wdl s ARG 215 N -0.50 1.09 0.55 2.79 0.52 -1.26 -5.00 118.95 117.14 1wdl s ARG 215 Ca 0.62 -1.74 0.24 0.00 -0.52 0.00 0.00 55.73 54.33 1wdl s ARG 215 Cb -0.46 -2.15 1.48 0.00 0.52 0.00 0.00 34.95 34.35 1wdl s ARG 215 CO 0.47 -1.13 2.09 -1.35 0.02 0.00 0.00 175.30 175.40 1wdl h PRO 216 N 7.03 0.00 0.00 3.54 0.11 -1.94 -1.92 132.00 138.82 1wdl h PRO 216 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1wdl h PRO 216 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1wdl h PRO 216 CO 0.45 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.84 1wdl n ASP 217 N -4.18 0.00 -4.57 -2.05 5.75 -1.26 -4.76 116.55 105.48 1wdl n ASP 217 Ca 0.02 -0.20 -0.39 0.00 -0.01 0.00 0.00 54.79 54.21 1wdl n ASP 217 Cb 0.33 -0.21 -0.03 0.00 -1.03 0.00 0.00 41.12 40.18 1wdl n ASP 217 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1wdl s THR 218 N -2.41 3.12 0.30 2.12 2.01 -0.72 -4.88 115.64 115.17 1wdl s THR 218 Ca 0.23 0.10 0.10 0.00 0.31 0.00 0.00 61.69 62.43 1wdl s THR 218 Cb 0.14 -3.23 -0.05 0.00 0.01 0.00 0.00 72.50 69.37 1wdl s THR 218 CO 0.30 -0.20 -0.07 0.42 -0.69 0.00 0.00 174.62 174.39 1wdl s THR 219 N 9.90 2.79 0.46 -0.82 -4.23 -1.26 -4.77 115.64 117.71 1wdl s THR 219 Ca 0.92 -2.11 0.16 0.00 -1.18 0.00 0.00 61.69 59.48 1wdl s THR 219 Cb -0.22 -2.65 0.34 0.00 1.34 0.00 0.00 72.50 71.31 1wdl s THR 219 CO 0.29 -0.31 2.00 -0.07 -0.54 0.00 0.00 174.62 175.99 1wdl h LEU 220 N 1.99 0.25 -0.34 4.79 3.38 -1.92 0.29 115.31 123.75 1wdl h LEU 220 Ca -0.42 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.41 1wdl h LEU 220 Cb 1.25 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1wdl h LEU 220 CO 0.63 0.15 -0.35 -0.33 0.09 0.00 0.00 178.44 178.64 1wdl h GLU 221 N 0.28 0.83 0.00 1.13 3.07 -1.97 -1.23 114.58 116.69 1wdl h GLU 221 Ca 0.24 -0.44 -0.08 0.00 -0.50 0.00 0.00 59.36 58.58 1wdl h GLU 221 Cb 0.59 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.51 1wdl h GLU 221 CO -0.05 1.08 -0.38 0.66 -1.40 0.00 0.00 179.01 178.91 1wdl h SER 222 N 0.61 0.00 0.87 1.42 4.64 -1.49 -3.15 113.55 116.45 1wdl h SER 222 Ca 0.05 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.17 1wdl h SER 222 Cb 0.93 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.99 1wdl h SER 222 CO 0.09 0.38 -1.21 -0.07 -0.87 0.00 0.00 176.83 175.14 1wdl h LEU 223 N 0.00 0.00 0.00 5.97 3.38 -0.94 -3.28 115.31 120.44 1wdl h LEU 223 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wdl h LEU 223 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1wdl h LEU 223 CO 0.05 0.79 0.00 0.00 0.09 0.00 0.00 178.44 179.37 1wdl n ALA 224 N -2.40 2.46 0.01 1.53 0.00 -0.47 -2.81 120.51 118.84 1wdl n ALA 224 Ca -0.07 -0.16 0.01 0.00 0.00 0.00 0.00 53.44 53.22 1wdl n ALA 224 Cb 0.91 -1.43 -0.10 0.00 0.00 0.00 0.00 19.45 18.82 1wdl n ALA 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wdl n ALA 225 N -1.04 2.06 -1.55 0.00 0.00 -1.23 -4.94 120.51 113.81 1wdl n ALA 225 Ca 0.19 -0.65 -0.34 0.00 0.00 0.00 0.00 53.44 52.64 1wdl n ALA 225 Cb 0.11 -0.80 0.05 0.00 0.00 0.00 0.00 19.45 18.81 1wdl n ALA 225 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wdl s LEU 226 N -5.48 3.47 0.17 0.00 1.43 -1.12 -5.04 118.68 112.10 1wdl s LEU 226 Ca -0.05 2.18 0.04 0.00 -1.03 0.00 0.00 54.13 55.28 1wdl s LEU 226 Cb 0.09 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.70 1wdl s LEU 226 CO 0.83 -1.73 0.22 -1.59 0.23 0.00 0.00 176.35 174.30 1wdl s LYS 227 N -3.80 3.16 0.11 1.70 0.00 -1.26 -5.04 119.74 114.60 1wdl s LYS 227 Ca 0.71 -0.77 -0.35 0.00 0.00 0.00 0.00 55.97 55.57 1wdl s LYS 227 Cb -0.25 -2.79 -0.15 0.00 0.00 0.00 0.00 37.83 34.65 1wdl s LYS 227 CO 0.39 0.49 1.53 -2.30 0.00 0.00 0.00 175.35 175.46 1wdl n PRO 228 N -0.56 1.82 0.01 1.78 -0.02 -1.26 -4.56 135.00 132.21 1wdl n PRO 228 Ca -0.08 0.66 -0.11 0.00 -2.02 0.00 0.00 63.50 61.95 1wdl n PRO 228 Cb 0.55 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.50 1wdl n PRO 228 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wdl h ALA 229 N 5.73 0.57 -0.06 3.55 0.00 -1.72 -3.38 119.26 123.96 1wdl h ALA 229 Ca -0.46 -1.30 0.00 0.00 0.00 0.00 0.00 54.91 53.15 1wdl h ALA 229 Cb 1.28 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1wdl h ALA 229 CO 0.86 1.42 0.00 1.19 0.00 0.00 0.00 179.25 182.72 1wdl n PHE 230 N -3.22 0.06 -2.83 0.00 3.01 -1.25 -4.85 117.46 108.37 1wdl n PHE 230 Ca -0.16 -0.07 -0.02 0.00 1.01 0.00 0.00 57.45 58.21 1wdl n PHE 230 Cb 1.03 -0.00 0.01 0.00 -0.01 0.00 0.00 39.48 40.51 1wdl n PHE 230 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1wdl s ASN 231 N -0.89 -1.06 0.19 4.37 3.84 -1.26 -4.81 114.94 115.32 1wdl s ASN 231 Ca 0.14 -1.03 -0.15 0.00 0.21 0.00 0.00 52.86 52.02 1wdl s ASN 231 Cb 0.09 1.38 0.17 0.00 -0.55 0.00 0.00 41.25 42.35 1wdl s ASN 231 CO 0.13 -0.06 1.65 -0.65 -2.79 0.00 0.00 177.10 175.38 1wdl h PRO 232 N 5.27 0.01 -4.41 0.43 0.11 -1.89 -2.46 132.00 129.06 1wdl h PRO 232 Ca 0.03 -0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.43 1wdl h PRO 232 Cb 1.15 -0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.20 1wdl h PRO 232 CO -0.01 0.01 2.83 1.63 -0.21 0.00 0.00 178.00 182.24 1wdl n LYS 233 N -5.36 2.99 -0.17 1.05 5.02 -1.26 -4.28 118.16 116.15 1wdl n LYS 233 Ca 0.05 -2.84 0.00 0.00 -2.02 0.00 0.00 58.31 53.51 1wdl n LYS 233 Cb 0.28 -3.31 0.00 0.00 -0.02 0.00 0.00 35.03 31.98 1wdl n LYS 233 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wdl n GLY 234 N 4.32 0.82 3.29 0.72 0.00 -1.23 -5.14 105.19 107.97 1wdl n GLY 234 Ca 0.50 -0.73 -0.16 0.00 0.00 0.00 0.00 46.02 45.64 1wdl n GLY 234 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wdl s GLY 235 N -2.07 1.35 0.00 -0.02 0.00 -0.93 -4.96 107.32 100.70 1wdl s GLY 235 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 44.72 43.07 1wdl s GLY 235 CO 0.00 -1.63 0.00 -1.30 0.00 0.00 0.00 173.10 170.17 1wdl n THR 236 N -0.32 0.00 -2.10 0.90 -2.24 -1.26 -4.72 114.28 104.54 1wdl n THR 236 Ca -0.07 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.29 1wdl n THR 236 Cb 0.63 -0.72 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1wdl n THR 236 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1wdl s VAL 237 N -1.76 3.54 0.37 2.28 1.01 -1.26 -4.91 120.40 119.67 1wdl s VAL 237 Ca 0.00 0.50 0.08 0.00 0.00 0.00 0.00 61.98 62.56 1wdl s VAL 237 Cb 0.00 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1wdl s VAL 237 CO 0.00 -0.66 0.19 0.42 0.00 0.00 0.00 175.10 175.05 1wdl s THR 238 N 7.15 2.76 0.57 3.92 -4.23 -1.26 -1.89 115.64 122.65 1wdl s THR 238 Ca 0.71 -1.64 0.26 0.00 -1.18 0.00 0.00 61.69 59.84 1wdl s THR 238 Cb -0.17 -2.99 0.35 0.00 1.34 0.00 0.00 72.50 71.03 1wdl s THR 238 CO 0.29 -0.10 2.09 0.00 -0.54 0.00 0.00 174.62 176.37 1wdl h ALA 239 N 1.44 1.96 -0.02 3.99 0.00 -1.93 -0.81 119.26 123.89 1wdl h ALA 239 Ca -0.43 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.34 1wdl h ALA 239 Cb 1.25 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1wdl h ALA 239 CO 0.64 -0.31 -0.62 0.78 0.00 0.00 0.00 179.25 179.74 1wdl h GLY 240 N 0.00 0.08 -2.02 0.00 0.00 -1.94 -3.09 103.07 96.10 1wdl h GLY 240 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wdl h GLY 240 CO -0.00 0.09 0.00 -1.30 0.00 0.00 0.00 176.54 175.33 1wdl n THR 241 N -3.82 0.39 -4.02 4.70 -2.24 -0.36 -4.83 114.28 104.10 1wdl n THR 241 Ca -0.02 -0.65 -0.25 0.00 -2.27 0.00 0.00 64.05 60.86 1wdl n THR 241 Cb 0.62 0.95 -0.04 0.00 -2.10 0.00 0.00 70.33 69.76 1wdl n THR 241 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1wdl s SER 242 N -1.57 5.90 0.77 3.42 0.01 -0.88 -1.42 113.70 119.94 1wdl s SER 242 Ca 0.37 -0.01 -0.13 0.00 1.31 0.00 0.00 55.95 57.49 1wdl s SER 242 Cb 0.22 -1.65 0.06 0.00 0.21 0.00 0.00 66.02 64.86 1wdl s SER 242 CO 0.31 0.04 1.16 -0.94 0.41 0.00 0.00 173.24 174.22 1wdl s SER 243 N -3.30 4.06 0.14 2.44 1.04 -0.27 -4.62 113.70 113.19 1wdl s SER 243 Ca 0.33 2.18 -0.09 0.00 0.48 0.00 0.00 55.95 58.85 1wdl s SER 243 Cb -0.10 -2.57 -0.06 0.00 0.10 0.00 0.00 66.02 63.39 1wdl s SER 243 CO 0.26 -2.35 0.44 -1.10 0.98 0.00 0.00 173.24 171.47 1wdl s GLN 244 N -4.27 3.74 -0.46 4.02 -0.21 -0.96 -4.87 119.66 116.65 1wdl s GLN 244 Ca 0.69 0.14 -0.28 0.00 0.02 0.00 0.00 55.36 55.93 1wdl s GLN 244 Cb -0.24 -2.86 0.01 0.00 1.00 0.00 0.00 33.01 30.91 1wdl s GLN 244 CO 0.49 0.47 1.46 0.42 -2.12 0.00 0.00 175.29 176.02 1wdl s ILE 245 N -1.58 3.81 0.01 1.08 1.01 -1.26 -0.95 121.20 123.31 1wdl s ILE 245 Ca 0.39 0.78 0.04 0.00 0.00 0.00 0.00 60.65 61.86 1wdl s ILE 245 Cb -0.13 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 38.11 1wdl s ILE 245 CO 0.21 -0.86 -0.13 -0.89 0.00 0.00 0.00 174.94 173.27 1wdl s THR 246 N 5.91 1.04 -0.21 2.92 2.01 -1.26 -3.00 115.64 123.04 1wdl s THR 246 Ca 0.60 -0.71 -0.15 0.00 0.31 0.00 0.00 61.69 61.75 1wdl s THR 246 Cb -0.13 -0.89 -0.04 0.00 0.01 0.00 0.00 72.50 71.44 1wdl s THR 246 CO 0.30 0.18 0.34 -1.81 -0.69 0.00 0.00 174.62 172.94 1wdl s ASP 247 N -0.61 6.37 -0.24 3.53 1.01 -1.00 -4.08 116.67 121.64 1wdl s ASP 247 Ca 0.04 0.43 -0.36 0.00 0.71 0.00 0.00 52.55 53.36 1wdl s ASP 247 Cb -0.06 -2.20 0.15 0.00 1.01 0.00 0.00 42.92 41.82 1wdl s ASP 247 CO 0.00 -0.04 1.30 -0.83 0.21 0.00 0.00 175.17 175.81 1wdl s GLY 248 N 1.02 -0.22 0.09 0.21 0.00 -1.03 -3.41 107.32 103.97 1wdl s GLY 248 Ca 0.16 1.83 0.04 0.00 0.00 0.00 0.00 44.72 46.76 1wdl s GLY 248 CO 0.07 0.62 -0.12 0.00 0.00 0.00 0.00 173.10 173.68 1wdl s ALA 249 N -2.14 1.13 -0.01 3.20 0.00 -1.26 -2.33 121.76 120.35 1wdl s ALA 249 Ca 0.10 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.99 1wdl s ALA 249 Cb -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 1wdl s ALA 249 CO -0.04 0.05 -0.07 -1.54 0.00 0.00 0.00 175.76 174.17 1wdl s SER 250 N -2.13 0.86 0.33 0.00 1.04 -0.43 -1.34 113.70 112.04 1wdl s SER 250 Ca 0.02 -0.13 0.09 0.00 0.48 0.00 0.00 55.95 56.41 1wdl s SER 250 Cb -0.06 -0.16 -0.06 0.00 0.10 0.00 0.00 66.02 65.84 1wdl s SER 250 CO 0.01 0.07 -0.09 0.00 0.98 0.00 0.00 173.24 174.21 1wdl s MET 252 N -3.64 0.35 -0.10 0.00 1.75 0.44 -2.55 119.30 115.56 1wdl s MET 252 Ca 0.32 0.89 -0.22 0.00 -1.25 0.00 0.00 55.69 55.43 1wdl s MET 252 Cb 0.03 0.53 -0.03 0.00 2.84 0.00 0.00 34.83 38.20 1wdl s MET 252 CO 0.15 -0.12 0.65 0.42 -0.65 0.00 0.00 175.02 175.47 1wdl s ILE 253 N 2.54 5.06 0.04 10.11 1.01 -1.08 -0.61 121.20 138.28 1wdl s ILE 253 Ca -0.03 1.31 0.05 0.00 0.00 0.00 0.00 60.65 61.98 1wdl s ILE 253 Cb -0.07 -3.98 -0.02 0.00 0.01 0.00 0.00 42.46 38.39 1wdl s ILE 253 CO -0.18 0.23 -0.14 -0.69 0.00 0.00 0.00 174.94 174.17 1wdl s VAL 254 N 1.01 1.08 0.25 2.92 1.01 -0.09 -1.55 120.40 125.03 1wdl s VAL 254 Ca 0.34 -1.03 -0.22 0.00 0.00 0.00 0.00 61.98 61.07 1wdl s VAL 254 Cb -0.17 -0.99 0.04 0.00 0.00 0.00 0.00 36.38 35.26 1wdl s VAL 254 CO 0.15 -0.04 0.82 0.00 0.00 0.00 0.00 175.10 176.03 1wdl s MET 255 N -1.22 1.62 0.57 2.72 0.23 -0.68 0.70 119.30 123.24 1wdl s MET 255 Ca 0.01 -0.92 -0.17 0.00 -1.03 0.00 0.00 55.69 53.57 1wdl s MET 255 Cb -0.08 0.54 -0.05 0.00 -1.53 0.00 0.00 34.83 33.71 1wdl s MET 255 CO 0.01 -0.75 1.07 -1.54 -2.03 0.00 0.00 175.02 171.78 1wdl s SER 256 N -2.97 5.85 0.41 -1.18 1.04 -1.02 -0.28 113.70 115.56 1wdl s SER 256 Ca 0.12 1.91 0.11 0.00 0.48 0.00 0.00 55.95 58.58 1wdl s SER 256 Cb -0.04 -2.55 0.88 0.00 0.10 0.00 0.00 66.02 64.41 1wdl s SER 256 CO 0.06 -1.12 1.95 0.00 0.98 0.00 0.00 173.24 175.11 1wdl h ALA 257 N 0.78 1.60 0.56 5.32 0.00 -0.66 -1.28 119.26 125.59 1wdl h ALA 257 Ca -0.48 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.22 1wdl h ALA 257 Cb 1.23 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.96 1wdl h ALA 257 CO 0.57 0.30 -0.27 0.37 0.00 0.00 0.00 179.25 180.22 1wdl h GLN 258 N 0.14 -0.73 0.00 0.00 5.75 -1.63 0.74 115.11 119.37 1wdl h GLN 258 Ca 0.03 0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 1wdl h GLN 258 Cb 0.34 0.17 0.00 0.00 1.07 0.00 0.00 27.48 29.05 1wdl h GLN 258 CO 0.02 -0.49 0.00 -0.09 -2.65 0.00 0.00 178.83 175.62 1wdl h ARG 259 N -0.82 0.00 0.01 1.69 9.65 -1.83 -1.42 114.38 121.66 1wdl h ARG 259 Ca -0.08 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.78 1wdl h ARG 259 Cb 0.58 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.16 1wdl h ARG 259 CO 0.13 0.00 -0.12 0.00 2.80 0.00 0.00 179.97 182.78 1wdl h ALA 260 N 2.01 0.01 -0.32 2.80 0.00 -0.81 -3.13 119.26 119.83 1wdl h ALA 260 Ca 0.00 -0.55 0.02 0.00 0.00 0.00 0.00 54.91 54.38 1wdl h ALA 260 Cb 0.04 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1wdl h ALA 260 CO 0.00 0.06 0.21 -0.22 0.00 0.00 0.00 179.25 179.31 1wdl h LYS 261 N -0.97 0.33 -0.40 0.00 3.64 0.13 -1.21 116.57 118.09 1wdl h LYS 261 Ca -0.03 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.25 1wdl h LYS 261 Cb 1.05 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1wdl h LYS 261 CO -0.01 0.22 -0.10 -0.44 -2.27 0.00 0.00 179.45 176.85 1wdl h ASP 262 N 0.34 0.68 0.07 4.20 3.32 -1.37 -2.29 116.42 121.37 1wdl h ASP 262 Ca 0.13 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1wdl h ASP 262 Cb 0.09 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.46 1wdl h ASP 262 CO -0.03 0.82 -0.02 0.18 -1.72 0.00 0.00 179.24 178.47 1wdl n LEU 263 N -4.18 0.49 -2.27 1.55 4.77 -0.50 -4.92 117.00 111.95 1wdl n LEU 263 Ca 0.01 -0.13 -0.17 0.00 -0.03 0.00 0.00 56.01 55.69 1wdl n LEU 263 Cb 0.35 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 1wdl n LEU 263 CO 0.42 0.08 -0.21 0.61 -1.33 0.00 0.00 177.39 176.97 1wdl n GLY 264 N 1.10 -0.16 3.61 -0.72 0.00 -0.86 -4.96 105.19 103.19 1wdl n GLY 264 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 1wdl n GLY 264 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1wdl s LEU 265 N -5.59 3.87 0.09 0.99 2.34 -1.23 -5.06 118.68 114.11 1wdl s LEU 265 Ca 0.00 0.03 -0.31 0.00 0.06 0.00 0.00 54.13 53.91 1wdl s LEU 265 Cb 0.00 -2.02 -0.09 0.00 -0.56 0.00 0.00 46.19 43.52 1wdl s LEU 265 CO 0.00 0.08 1.67 -0.70 -1.06 0.00 0.00 176.35 176.33 1wdl s GLU 266 N 0.96 4.19 0.77 1.48 2.56 -1.26 -4.78 118.70 122.62 1wdl s GLU 266 Ca 0.06 2.38 -0.14 0.00 0.00 0.00 0.00 54.97 57.27 1wdl s GLU 266 Cb -0.14 -3.52 0.06 0.00 2.00 0.00 0.00 34.13 32.54 1wdl s GLU 266 CO 0.03 -0.73 1.18 -2.14 -0.56 0.00 0.00 175.26 173.04 1wdl s PRO 267 N 2.39 1.92 -0.15 4.30 0.02 -1.26 -4.97 135.00 137.25 1wdl s PRO 267 Ca 0.74 1.65 0.11 0.00 0.02 0.00 0.00 61.00 63.52 1wdl s PRO 267 Cb -0.41 -1.82 -0.23 0.00 0.02 0.00 0.00 34.50 32.05 1wdl s PRO 267 CO 0.33 -1.98 0.24 -0.11 -0.33 0.00 0.00 177.00 175.15 1wdl n LEU 268 N -3.11 1.07 -3.83 -5.54 7.94 -0.41 -4.95 117.00 108.16 1wdl n LEU 268 Ca 0.13 0.13 -0.01 0.00 -1.11 0.00 0.00 56.01 55.15 1wdl n LEU 268 Cb 0.51 -0.03 0.01 0.00 0.53 0.00 0.00 43.42 44.44 1wdl n LEU 268 CO 0.48 0.58 0.92 0.00 -1.11 0.00 0.00 177.39 178.26 1wdl s ALA 269 N -2.54 -1.95 -0.04 1.96 0.00 -1.16 -4.83 121.76 113.20 1wdl s ALA 269 Ca -0.14 0.04 -0.01 0.00 0.00 0.00 0.00 51.96 51.85 1wdl s ALA 269 Cb 0.07 0.69 0.03 0.00 0.00 0.00 0.00 23.12 23.92 1wdl s ALA 269 CO 0.78 -1.08 0.08 0.08 0.00 0.00 0.00 175.76 175.63 1wdl s VAL 270 N -2.36 -0.06 0.03 0.00 1.01 0.58 -1.99 120.40 117.61 1wdl s VAL 270 Ca 0.21 0.20 -0.30 0.00 0.00 0.00 0.00 61.98 62.09 1wdl s VAL 270 Cb -0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 36.38 36.18 1wdl s VAL 270 CO 0.01 0.08 1.17 -0.63 0.00 0.00 0.00 175.10 175.74 1wdl s ILE 271 N 1.13 4.18 -0.11 2.22 1.01 -0.90 -0.21 121.20 128.52 1wdl s ILE 271 Ca -0.09 1.56 0.06 0.00 0.00 0.00 0.00 60.65 62.18 1wdl s ILE 271 Cb -0.12 -4.00 -0.12 0.00 0.01 0.00 0.00 42.46 38.23 1wdl s ILE 271 CO -0.04 0.10 -0.02 -1.14 0.00 0.00 0.00 174.94 173.84 1wdl n ARG 272 N 4.13 1.63 -3.68 2.79 0.63 -0.50 -4.60 116.66 117.07 1wdl n ARG 272 Ca 0.09 0.02 -0.15 0.00 -0.92 0.00 0.00 57.85 56.89 1wdl n ARG 272 Cb 0.47 -1.27 -0.08 0.00 0.45 0.00 0.00 32.46 32.03 1wdl n ARG 272 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 1wdl s SER 273 N -4.63 -0.37 0.02 6.15 1.04 -1.21 -4.72 113.70 109.97 1wdl s SER 273 Ca -0.10 0.38 0.03 0.00 0.48 0.00 0.00 55.95 56.74 1wdl s SER 273 Cb 0.04 0.45 -0.01 0.00 0.10 0.00 0.00 66.02 66.59 1wdl s SER 273 CO 0.39 -0.47 -0.10 -0.04 0.98 0.00 0.00 173.24 174.00 1wdl s MET 274 N -1.12 0.72 -0.14 4.02 -1.94 -1.26 -1.95 119.30 117.61 1wdl s MET 274 Ca -0.11 -0.53 -0.22 0.00 -1.71 0.00 0.00 55.69 53.12 1wdl s MET 274 Cb -0.03 -0.66 0.05 0.00 2.01 0.00 0.00 34.83 36.20 1wdl s MET 274 CO 0.06 0.17 0.56 0.00 -0.01 0.00 0.00 175.02 175.79 1wdl s ALA 275 N -0.63 -1.40 -0.00 3.03 0.00 -0.40 -4.77 121.76 117.60 1wdl s ALA 275 Ca 0.00 1.34 0.02 0.00 0.00 0.00 0.00 51.96 53.32 1wdl s ALA 275 Cb -0.06 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 1wdl s ALA 275 CO 0.00 -0.29 -0.07 0.14 0.00 0.00 0.00 175.76 175.54 1wdl s VAL 276 N -0.31 0.56 0.19 0.00 -7.23 -1.26 0.20 120.40 112.55 1wdl s VAL 276 Ca -0.05 -0.31 -0.03 0.00 -1.81 0.00 0.00 61.98 59.78 1wdl s VAL 276 Cb -0.03 -0.47 -0.03 0.00 0.56 0.00 0.00 36.38 36.40 1wdl s VAL 276 CO 0.04 0.15 0.17 0.00 -0.31 0.00 0.00 175.10 175.15 1wdl s ALA 277 N -0.18 0.81 0.12 1.32 0.00 -0.34 -4.88 121.76 118.62 1wdl s ALA 277 Ca 0.03 -1.47 0.09 0.00 0.00 0.00 0.00 51.96 50.61 1wdl s ALA 277 Cb -0.03 1.19 -0.04 0.00 0.00 0.00 0.00 23.12 24.24 1wdl s ALA 277 CO -0.00 -0.61 -0.22 0.20 0.00 0.00 0.00 175.76 175.14 1wdl s GLY 278 N -3.10 1.35 0.31 0.00 0.00 -1.26 -0.18 107.32 104.44 1wdl s GLY 278 Ca 0.32 -1.36 0.06 0.00 0.00 0.00 0.00 44.72 43.74 1wdl s GLY 278 CO 0.08 -1.37 0.25 -1.34 0.00 0.00 0.00 173.10 170.73 1wdl s VAL 279 N -1.35 0.01 0.20 1.40 -7.23 -0.85 -4.93 120.40 107.65 1wdl s VAL 279 Ca 0.10 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.97 1wdl s VAL 279 Cb -0.09 -2.50 -0.08 0.00 0.56 0.00 0.00 36.38 34.27 1wdl s VAL 279 CO 0.05 0.00 1.12 -1.81 -0.31 0.00 0.00 175.10 174.16 1wdl s ASP 280 N -3.34 7.22 0.36 4.85 1.01 -1.26 -4.37 116.67 121.13 1wdl s ASP 280 Ca 0.40 2.16 0.12 0.00 0.71 0.00 0.00 52.55 55.95 1wdl s ASP 280 Cb 0.03 -2.61 0.94 0.00 1.01 0.00 0.00 42.92 42.29 1wdl s ASP 280 CO 0.25 -0.24 1.78 -0.65 0.21 0.00 0.00 175.17 176.53 1wdl h PRO 281 N 4.89 0.54 -0.91 8.23 0.11 -1.86 -1.69 132.00 141.32 1wdl h PRO 281 Ca -0.45 -0.03 0.16 0.00 0.11 0.00 0.00 66.00 65.79 1wdl h PRO 281 Cb 1.21 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 32.13 1wdl h PRO 281 CO 0.72 0.36 0.58 0.00 -0.21 0.00 0.00 178.00 179.45 1wdl h ALA 282 N 1.64 1.87 -0.97 -0.75 0.00 -1.92 -2.66 119.26 116.46 1wdl h ALA 282 Ca 0.57 0.02 -0.48 0.00 0.00 0.00 0.00 54.91 55.03 1wdl h ALA 282 Cb 1.18 -0.11 -0.42 0.00 0.00 0.00 0.00 17.79 18.44 1wdl h ALA 282 CO -0.33 -0.13 -0.90 0.44 0.00 0.00 0.00 179.25 178.33 1wdl n ILE 283 N -4.57 2.02 -0.21 0.00 -5.35 -0.68 -4.26 119.36 106.30 1wdl n ILE 283 Ca 0.18 -4.03 0.31 0.00 -0.27 0.00 0.00 62.75 58.94 1wdl n ILE 283 Cb 0.51 -0.47 0.72 0.00 -1.74 0.00 0.00 39.64 38.67 1wdl n ILE 283 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wdl h MET 284 N 2.51 0.00 0.00 6.28 -0.00 -1.08 0.52 114.93 123.17 1wdl h MET 284 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.88 1wdl h MET 284 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.84 1wdl h MET 284 CO 0.65 0.00 0.07 0.78 -0.00 0.00 0.00 176.91 178.41 1wdl h GLY 285 N 0.00 0.00 -0.20 -3.00 0.00 -1.88 0.10 103.07 98.09 1wdl h GLY 285 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 1wdl h GLY 285 CO -0.00 0.00 0.00 2.98 0.00 0.00 0.00 176.54 179.52 1wdl n TYR 286 N -2.33 0.11 -0.33 5.60 9.36 0.17 -4.32 117.16 125.42 1wdl n TYR 286 Ca -0.02 -0.05 0.07 0.00 3.32 0.00 0.00 57.90 61.22 1wdl n TYR 286 Cb 0.11 0.00 0.27 0.00 -0.63 0.00 0.00 39.34 39.08 1wdl n TYR 286 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1wdl h GLY 287 N 5.15 1.49 0.30 2.98 0.00 -0.92 -3.20 103.07 108.87 1wdl h GLY 287 Ca 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 47.33 47.01 1wdl h GLY 287 CO 0.00 0.18 0.02 -2.55 0.00 0.00 0.00 176.54 174.19 1wdl h PRO 288 N 0.95 0.13 -0.35 4.80 0.11 -1.76 -2.83 132.00 133.05 1wdl h PRO 288 Ca 0.47 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.63 1wdl h PRO 288 Cb 0.47 -0.03 -0.05 0.00 0.11 0.00 0.00 31.00 31.50 1wdl h PRO 288 CO -0.23 0.09 0.03 -0.24 -0.21 0.00 0.00 178.00 177.44 1wdl h VAL 289 N 0.13 0.77 -0.39 3.15 3.04 -1.88 0.49 116.25 121.56 1wdl h VAL 289 Ca 0.23 -0.05 -0.04 0.00 -1.01 0.00 0.00 66.70 65.83 1wdl h VAL 289 Cb 0.32 0.62 -0.02 0.00 -2.01 0.00 0.00 31.29 30.21 1wdl h VAL 289 CO -0.36 0.02 0.08 -0.65 -1.01 0.00 0.00 177.57 175.66 1wdl h PRO 290 N 0.14 0.63 -0.65 4.17 0.11 -1.70 -1.24 132.00 133.45 1wdl h PRO 290 Ca 0.17 -0.16 -0.06 0.00 0.11 0.00 0.00 66.00 66.07 1wdl h PRO 290 Cb 0.22 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.22 1wdl h PRO 290 CO -0.26 0.66 0.18 0.00 -0.21 0.00 0.00 178.00 178.38 1wdl h ALA 291 N 0.93 1.09 0.09 -0.75 0.00 -1.23 -2.47 119.26 116.94 1wdl h ALA 291 Ca 0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1wdl h ALA 291 Cb 0.33 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1wdl h ALA 291 CO 0.00 0.61 -0.04 1.15 0.00 0.00 0.00 179.25 180.97 1wdl h THR 292 N 0.97 1.12 -0.93 0.00 2.02 0.11 -2.34 112.91 113.86 1wdl h THR 292 Ca 0.21 -0.82 0.15 0.00 0.77 0.00 0.00 66.41 66.73 1wdl h THR 292 Cb 0.30 1.64 -0.08 0.00 -1.74 0.00 0.00 68.15 68.27 1wdl h THR 292 CO -0.00 0.20 0.59 1.56 0.37 0.00 0.00 175.52 178.24 1wdl h GLN 293 N -0.50 0.71 -0.16 6.66 4.20 -1.17 0.13 115.11 124.97 1wdl h GLN 293 Ca -0.01 -0.04 -0.14 0.00 0.06 0.00 0.00 58.65 58.51 1wdl h GLN 293 Cb 0.42 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1wdl h GLN 293 CO 0.02 0.47 -0.51 -0.22 -0.67 0.00 0.00 178.83 177.92 1wdl h LYS 294 N 0.73 0.44 -0.22 1.46 3.64 -1.38 -2.57 116.57 118.67 1wdl h LYS 294 Ca 0.48 -0.26 -0.14 0.00 -1.27 0.00 0.00 60.65 59.45 1wdl h LYS 294 Cb 0.75 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1wdl h LYS 294 CO -0.24 0.85 -0.43 0.00 -2.27 0.00 0.00 179.45 177.37 1wdl h ALA 295 N 1.10 0.35 -0.73 5.00 0.00 -0.42 -2.62 119.26 121.93 1wdl h ALA 295 Ca 0.01 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1wdl h ALA 295 Cb 1.02 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1wdl h ALA 295 CO 0.09 0.47 0.36 -0.07 0.00 0.00 0.00 179.25 180.10 1wdl h LEU 296 N 0.38 0.94 -0.36 0.00 3.38 -0.82 0.70 115.31 119.53 1wdl h LEU 296 Ca 0.01 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1wdl h LEU 296 Cb 1.03 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1wdl h LEU 296 CO 0.10 0.79 -0.16 0.50 0.09 0.00 0.00 178.44 179.76 1wdl h LYS 297 N 1.04 0.75 0.00 1.13 3.64 -1.44 0.21 116.57 121.89 1wdl h LYS 297 Ca 0.25 -0.32 -0.08 0.00 -1.27 0.00 0.00 60.65 59.24 1wdl h LYS 297 Cb 0.10 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1wdl h LYS 297 CO -0.03 0.93 -0.36 0.00 -2.27 0.00 0.00 179.45 177.72 1wdl h ARG 298 N 0.54 0.00 -0.01 1.90 3.08 -1.13 -1.84 114.38 116.91 1wdl h ARG 298 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1wdl h ARG 298 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1wdl h ARG 298 CO 0.05 0.36 -0.14 0.00 -1.07 0.00 0.00 179.97 179.17 1wdl n ALA 299 N -2.37 2.85 -3.67 0.04 0.00 0.21 -4.89 120.51 112.67 1wdl n ALA 299 Ca -0.01 -0.41 -0.22 0.00 0.00 0.00 0.00 53.44 52.79 1wdl n ALA 299 Cb 0.44 -1.16 0.05 0.00 0.00 0.00 0.00 19.45 18.77 1wdl n ALA 299 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wdl n GLY 300 N 1.27 -0.37 3.13 0.00 0.00 0.04 -4.99 105.19 104.26 1wdl n GLY 300 Ca 0.15 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.19 1wdl n GLY 300 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wdl s LEU 301 N -6.80 2.38 0.17 0.99 1.43 0.52 -5.03 118.68 112.34 1wdl s LEU 301 Ca 0.20 -0.77 -0.01 0.00 -1.03 0.00 0.00 54.13 52.52 1wdl s LEU 301 Cb -0.09 -0.17 -0.04 0.00 0.03 0.00 0.00 46.19 45.91 1wdl s LEU 301 CO 0.79 -0.31 0.35 0.20 0.23 0.00 0.00 176.35 177.62 1wdl s ASN 302 N -2.28 6.39 0.56 2.29 0.01 -1.26 -4.39 114.94 116.25 1wdl s ASN 302 Ca 0.01 0.38 0.28 0.00 -0.71 0.00 0.00 52.86 52.82 1wdl s ASN 302 Cb -0.03 -2.00 1.46 0.00 0.41 0.00 0.00 41.25 41.09 1wdl s ASN 302 CO -0.01 0.01 1.96 -0.03 -1.51 0.00 0.00 177.10 177.51 1wdl h MET 303 N 2.26 0.00 0.00 -0.60 1.85 -1.96 0.10 114.93 116.59 1wdl h MET 303 Ca -0.47 0.00 -0.07 0.00 -0.61 0.00 0.00 59.70 58.55 1wdl h MET 303 Cb 1.18 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.20 1wdl h MET 303 CO 0.70 0.00 -0.33 0.00 -0.40 0.00 0.00 176.91 176.87 1wdl h ALA 304 N 1.62 0.99 0.00 0.39 0.00 -1.94 -3.03 119.26 117.30 1wdl h ALA 304 Ca 0.26 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1wdl h ALA 304 Cb 1.14 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1wdl h ALA 304 CO -0.00 0.42 0.00 -0.25 0.00 0.00 0.00 179.25 179.41 1wdl n ASP 305 N -3.48 0.50 -4.65 0.00 8.00 0.36 -4.69 116.55 112.59 1wdl n ASP 305 Ca -0.00 0.61 -0.42 0.00 0.71 0.00 0.00 54.79 55.69 1wdl n ASP 305 Cb 0.49 -0.72 -0.03 0.00 -0.02 0.00 0.00 41.12 40.84 1wdl n ASP 305 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1wdl s ILE 306 N -3.21 4.79 -0.02 0.53 1.01 -1.15 -4.54 121.20 118.61 1wdl s ILE 306 Ca 0.06 1.76 -0.22 0.00 0.00 0.00 0.00 60.65 62.25 1wdl s ILE 306 Cb 0.10 -4.20 -0.23 0.00 0.01 0.00 0.00 42.46 38.14 1wdl s ILE 306 CO 0.39 -0.09 1.07 0.44 0.00 0.00 0.00 174.94 176.75 1wdl h ASP 307 N 7.52 0.41 -4.30 3.58 3.32 -1.11 -3.47 116.42 122.37 1wdl h ASP 307 Ca -0.23 -0.77 -0.46 0.00 0.02 0.00 0.00 57.03 55.60 1wdl h ASP 307 Cb 1.09 -0.12 -0.25 0.00 0.22 0.00 0.00 39.33 40.26 1wdl h ASP 307 CO 0.90 1.12 -0.80 -0.36 -1.72 0.00 0.00 179.24 178.38 1wdl s PHE 308 N -3.18 1.25 -0.04 4.55 0.40 -1.16 -4.71 117.98 115.08 1wdl s PHE 308 Ca -0.14 -0.33 0.04 0.00 -0.60 0.00 0.00 56.93 55.90 1wdl s PHE 308 Cb 0.02 -0.75 -0.00 0.00 0.51 0.00 0.00 43.02 42.80 1wdl s PHE 308 CO 0.79 0.03 -0.17 0.42 0.70 0.00 0.00 175.22 176.98 1wdl s ILE 309 N -0.76 1.46 -0.34 0.64 1.01 0.51 -1.41 121.20 122.31 1wdl s ILE 309 Ca 0.02 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 59.98 1wdl s ILE 309 Cb -0.07 -1.25 0.10 0.00 0.01 0.00 0.00 42.46 41.25 1wdl s ILE 309 CO 0.01 0.42 0.07 -1.61 0.00 0.00 0.00 174.94 173.83 1wdl s GLU 310 N 0.03 1.39 -0.38 2.79 0.41 0.51 -0.37 118.70 123.09 1wdl s GLU 310 Ca -0.04 -1.80 -0.09 0.00 -0.41 0.00 0.00 54.97 52.63 1wdl s GLU 310 Cb -0.12 -3.03 0.05 0.00 -1.78 0.00 0.00 34.13 29.25 1wdl s GLU 310 CO 0.02 -0.96 0.19 -1.17 -0.49 0.00 0.00 175.26 172.86 1wdl s LEU 311 N 0.94 4.75 -0.15 1.80 2.96 -1.26 -1.67 118.68 126.05 1wdl s LEU 311 Ca 0.11 -1.20 -0.35 0.00 -0.22 0.00 0.00 54.13 52.48 1wdl s LEU 311 Cb -0.19 -1.97 -0.12 0.00 0.50 0.00 0.00 46.19 44.41 1wdl s LEU 311 CO -0.10 -0.42 1.92 -3.20 -1.32 0.00 0.00 176.35 173.24 1wdl n ASN 312 N 4.92 3.20 -4.56 3.68 5.15 -1.01 -4.85 115.26 121.79 1wdl n ASN 312 Ca -0.11 0.88 -0.38 0.00 -0.60 0.00 0.00 54.58 54.36 1wdl n ASN 312 Cb 0.45 -1.35 -0.03 0.00 -0.53 0.00 0.00 39.78 38.32 1wdl n ASN 312 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1wdl s GLU 313 N 4.42 3.35 -0.10 1.20 2.02 -1.26 -4.72 118.70 123.62 1wdl s GLU 313 Ca 0.96 -0.87 -0.27 0.00 0.02 0.00 0.00 54.97 54.80 1wdl s GLU 313 Cb -0.73 -5.20 -0.23 0.00 0.10 0.00 0.00 34.13 28.06 1wdl s GLU 313 CO 0.52 -2.43 0.93 0.00 0.02 0.00 0.00 175.26 174.30 1wdl h ALA 314 N 10.18 -0.01 -2.64 5.21 0.00 -1.91 -3.34 119.26 126.76 1wdl h ALA 314 Ca 0.14 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1wdl h ALA 314 Cb 1.01 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.58 1wdl h ALA 314 CO 1.37 -0.10 -0.24 -0.06 0.00 0.00 0.00 179.25 180.23 1wdl s PHE 315 N -2.95 -0.34 0.51 0.00 0.08 -1.26 -1.12 117.98 112.90 1wdl s PHE 315 Ca -0.17 0.73 0.21 0.00 0.12 0.00 0.00 56.93 57.82 1wdl s PHE 315 Cb -0.01 0.14 1.38 0.00 -0.57 0.00 0.00 43.02 43.96 1wdl s PHE 315 CO 0.67 -0.30 2.13 0.00 -0.10 0.00 0.00 175.22 177.61 1wdl h ALA 316 N 4.72 1.69 0.00 5.36 0.00 -1.56 -0.06 119.26 129.41 1wdl h ALA 316 Ca -0.28 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1wdl h ALA 316 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1wdl h ALA 316 CO 0.32 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.65 1wdl h ALA 317 N 1.94 1.00 0.00 0.00 0.00 -1.89 -2.90 119.26 117.41 1wdl h ALA 317 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 1wdl h ALA 317 Cb 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1wdl h ALA 317 CO 0.01 0.00 -1.82 0.00 0.00 0.00 0.00 179.25 177.43 1wdl n GLN 318 N -2.94 1.07 -0.08 0.00 -0.00 -0.23 -3.97 117.38 111.23 1wdl n GLN 318 Ca 0.00 0.05 -0.10 0.00 -0.00 0.00 0.00 57.00 56.95 1wdl n GLN 318 Cb 0.26 -1.30 -0.03 0.00 -0.00 0.00 0.00 30.24 29.18 1wdl n GLN 318 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wdl h ALA 319 N 0.23 0.35 -0.06 2.61 0.00 -1.13 -2.59 119.26 118.67 1wdl h ALA 319 Ca -0.32 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1wdl h ALA 319 Cb 1.59 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 1wdl h ALA 319 CO -0.02 -0.09 -0.03 -0.07 0.00 0.00 0.00 179.25 179.03 1wdl h LEU 320 N 0.31 -0.11 -0.76 0.00 3.38 -1.75 -1.53 115.31 114.86 1wdl h LEU 320 Ca 0.09 0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1wdl h LEU 320 Cb 0.11 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 1wdl h LEU 320 CO -0.01 -0.05 0.48 -0.65 0.09 0.00 0.00 178.44 178.30 1wdl h PRO 321 N -0.03 0.90 -0.80 1.13 0.11 -1.76 -0.10 132.00 131.46 1wdl h PRO 321 Ca 0.04 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.11 1wdl h PRO 321 Cb 0.08 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 30.94 1wdl h PRO 321 CO -0.08 0.60 0.52 0.28 -0.21 0.00 0.00 178.00 179.10 1wdl h VAL 322 N 0.93 1.15 -0.08 3.15 2.07 -1.20 -1.24 116.25 121.04 1wdl h VAL 322 Ca 0.31 -0.35 -0.12 0.00 0.82 0.00 0.00 66.70 67.35 1wdl h VAL 322 Cb 0.02 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.82 1wdl h VAL 322 CO -0.12 0.19 -0.49 -0.07 0.02 0.00 0.00 177.57 177.10 1wdl h LEU 323 N 1.02 0.21 -0.05 2.57 3.38 -0.61 -1.86 115.31 119.97 1wdl h LEU 323 Ca 0.31 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 1wdl h LEU 323 Cb -0.04 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1wdl h LEU 323 CO -0.09 0.67 -0.05 0.50 0.09 0.00 0.00 178.44 179.56 1wdl h LYS 324 N 0.16 0.13 0.00 1.13 3.64 -0.34 -1.61 116.57 119.68 1wdl h LYS 324 Ca 0.01 -0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 1wdl h LYS 324 Cb 0.93 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 1wdl h LYS 324 CO 0.07 0.57 -0.29 -0.44 -2.27 0.00 0.00 179.45 177.09 1wdl h ASP 325 N -0.31 0.00 0.15 4.20 5.19 -1.26 -0.42 116.42 123.96 1wdl h ASP 325 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1wdl h ASP 325 Cb 0.54 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.05 1wdl h ASP 325 CO 0.01 0.29 0.00 0.18 -3.12 0.00 0.00 179.24 176.60 1wdl n LEU 326 N -3.71 0.00 -3.52 1.55 4.77 -0.70 -4.91 117.00 110.48 1wdl n LEU 326 Ca -0.01 0.08 -0.20 0.00 -0.03 0.00 0.00 56.01 55.85 1wdl n LEU 326 Cb 0.40 -0.08 0.06 0.00 -2.33 0.00 0.00 43.42 41.47 1wdl n LEU 326 CO 0.35 -0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.70 1wdl n LYS 327 N -1.08 -4.27 -0.21 3.23 4.76 -0.17 -4.91 118.16 115.51 1wdl n LYS 327 Ca 0.20 0.72 0.00 0.00 -2.87 0.00 0.00 58.31 56.36 1wdl n LYS 327 Cb 0.14 -5.38 0.00 0.00 -1.84 0.00 0.00 35.03 27.95 1wdl n LYS 327 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1wdl n VAL 328 N -3.98 0.00 -0.10 -0.18 0.24 -0.63 -4.89 118.33 108.80 1wdl n VAL 328 Ca -0.22 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.06 1wdl n VAL 328 Cb 0.65 0.54 0.21 0.00 -1.47 0.00 0.00 33.84 33.76 1wdl n VAL 328 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1wdl h LEU 329 N 0.00 0.71 0.00 1.34 6.46 -1.81 -0.97 115.31 121.04 1wdl h LEU 329 Ca 0.00 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.62 1wdl h LEU 329 Cb 1.12 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 40.86 1wdl h LEU 329 CO 0.00 0.73 0.00 -0.90 -0.62 0.00 0.00 178.44 177.65 1wdl n ASP 330 N -4.26 0.00 0.00 1.25 5.75 -1.26 -2.37 116.55 115.65 1wdl n ASP 330 Ca 0.03 -1.01 0.00 0.00 -0.01 0.00 0.00 54.79 53.80 1wdl n ASP 330 Cb 0.25 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 1wdl n ASP 330 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1wdl n LYS 331 N -0.87 1.10 0.00 0.11 4.76 -0.40 -4.89 118.16 117.97 1wdl n LYS 331 Ca 0.14 -1.01 0.00 0.00 -2.87 0.00 0.00 58.31 54.57 1wdl n LYS 331 Cb 0.07 -0.99 0.00 0.00 -1.84 0.00 0.00 35.03 32.27 1wdl n LYS 331 CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 1wdl n MET 332 N -0.26 0.00 0.03 1.97 1.56 -1.00 -1.13 117.12 118.29 1wdl n MET 332 Ca 0.00 0.70 0.01 0.00 -0.27 0.00 0.00 57.70 58.14 1wdl n MET 332 Cb 0.14 -1.27 0.08 0.00 2.15 0.00 0.00 33.22 34.31 1wdl n MET 332 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 1wdl n ASN 333 N -1.98 0.07 -0.02 6.12 3.02 -1.26 -0.59 115.26 120.62 1wdl n ASN 333 Ca 0.00 0.43 -0.01 0.00 -0.03 0.00 0.00 54.58 54.97 1wdl n ASN 333 Cb 0.00 -0.43 -0.13 0.00 -0.61 0.00 0.00 39.78 38.61 1wdl n ASN 333 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1wdl n GLU 334 N -1.51 0.65 -1.29 3.52 2.13 -0.28 -4.80 120.64 119.06 1wdl n GLU 334 Ca -0.00 0.04 -0.05 0.00 0.66 0.00 0.00 57.16 57.81 1wdl n GLU 334 Cb 0.13 -1.64 -0.02 0.00 0.27 0.00 0.00 31.44 30.17 1wdl n GLU 334 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1wdl n LYS 335 N -2.69 0.27 -3.80 5.31 2.85 -0.47 -5.03 118.16 114.60 1wdl n LYS 335 Ca -0.16 -0.91 -0.28 0.00 -1.05 0.00 0.00 58.31 55.92 1wdl n LYS 335 Cb 0.88 0.47 -0.16 0.00 -0.65 0.00 0.00 35.03 35.57 1wdl n LYS 335 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1wdl s VAL 336 N 0.03 0.79 -0.94 0.58 1.01 0.24 -0.36 120.40 121.75 1wdl s VAL 336 Ca 0.02 -0.61 -0.10 0.00 0.00 0.00 0.00 61.98 61.29 1wdl s VAL 336 Cb 0.09 -1.15 0.00 0.00 0.00 0.00 0.00 36.38 35.31 1wdl s VAL 336 CO -0.03 -0.07 0.69 0.59 0.00 0.00 0.00 175.10 176.28 1wdl n ASN 337 N 4.96 -5.57 0.00 3.32 3.02 0.51 -4.74 115.26 116.75 1wdl n ASN 337 Ca -0.10 -0.82 0.09 0.00 -0.03 0.00 0.00 54.58 53.72 1wdl n ASN 337 Cb 0.47 -2.95 0.46 0.00 -0.61 0.00 0.00 39.78 37.15 1wdl n ASN 337 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1wdl n LEU 338 N -3.13 0.00 -0.18 3.41 4.77 -1.26 -2.79 117.00 117.81 1wdl n LEU 338 Ca -0.16 0.34 0.04 0.00 -0.03 0.00 0.00 56.01 56.19 1wdl n LEU 338 Cb 0.61 -0.34 0.07 0.00 -2.33 0.00 0.00 43.42 41.43 1wdl n LEU 338 CO 0.63 -0.12 0.55 1.41 -1.33 0.00 0.00 177.39 178.53 1wdl n HIS 339 N -1.34 0.14 0.00 -1.77 8.25 -1.26 -4.79 115.22 114.45 1wdl n HIS 339 Ca 0.08 -0.62 0.00 0.00 -0.26 0.00 0.00 57.72 56.92 1wdl n HIS 339 Cb 0.17 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1wdl n HIS 339 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wdl n GLY 340 N -0.51 0.38 0.00 -1.41 0.00 -1.12 -3.39 105.19 99.14 1wdl n GLY 340 Ca 0.07 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1wdl n GLY 340 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdl n GLY 341 N 0.57 4.38 0.22 -0.02 0.00 -1.26 -4.89 105.19 104.19 1wdl n GLY 341 Ca 0.00 -1.88 0.12 0.00 0.00 0.00 0.00 46.02 44.26 1wdl n GLY 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdl h ALA 342 N 1.00 1.14 -0.10 4.61 0.00 -1.76 0.30 119.26 124.46 1wdl h ALA 342 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1wdl h ALA 342 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1wdl h ALA 342 CO 0.00 -0.14 -0.55 0.82 0.00 0.00 0.00 179.25 179.38 1wdl h ILE 343 N 0.00 1.36 0.00 0.00 2.04 -1.82 -0.69 117.51 118.40 1wdl h ILE 343 Ca 0.00 -1.85 -0.09 0.00 1.00 0.00 0.00 64.86 63.93 1wdl h ILE 343 Cb 0.37 1.89 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 1wdl h ILE 343 CO 0.00 0.55 -1.56 0.00 0.00 0.00 0.00 178.15 177.14 1wdl n ALA 344 N -2.48 2.08 0.47 1.87 0.00 -0.20 -4.50 120.51 117.75 1wdl n ALA 344 Ca -0.02 -0.43 0.11 0.00 0.00 0.00 0.00 53.44 53.09 1wdl n ALA 344 Cb 0.58 -0.16 0.16 0.00 0.00 0.00 0.00 19.45 20.03 1wdl n ALA 344 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wdl n LEU 345 N -2.10 3.10 -0.47 0.00 4.77 0.89 -1.73 117.00 121.46 1wdl n LEU 345 Ca -0.09 -1.34 0.06 0.00 -0.03 0.00 0.00 56.01 54.62 1wdl n LEU 345 Cb 0.53 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 1wdl n LEU 345 CO 0.21 0.63 -0.19 0.61 -1.33 0.00 0.00 177.39 177.32 1wdl n GLY 346 N 1.27 -2.60 2.58 -0.72 0.00 -0.31 -4.84 105.19 100.57 1wdl n GLY 346 Ca 0.16 -1.34 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 1wdl n GLY 346 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1wdl s HIS 347 N -3.03 1.54 -0.68 1.61 2.46 -0.13 -4.34 115.29 112.73 1wdl s HIS 347 Ca 0.00 -2.26 -0.27 0.00 0.47 0.00 0.00 55.06 53.00 1wdl s HIS 347 Cb 0.00 -1.43 0.02 0.00 -0.13 0.00 0.00 32.58 31.03 1wdl s HIS 347 CO 0.00 -0.78 1.43 -2.14 -2.47 0.00 0.00 174.74 170.78 1wdl s PRO 348 N 0.31 3.09 0.00 2.88 0.02 -1.26 -4.50 135.00 135.54 1wdl s PRO 348 Ca 0.22 0.08 0.00 0.00 0.02 0.00 0.00 61.00 61.33 1wdl s PRO 348 Cb -0.15 -4.21 0.00 0.00 0.02 0.00 0.00 34.50 30.16 1wdl s PRO 348 CO -0.06 -2.23 0.16 1.19 -0.33 0.00 0.00 177.00 175.72 1wdl n PHE 349 N 10.14 0.00 0.59 6.54 0.99 -1.26 0.15 117.46 134.62 1wdl n PHE 349 Ca 0.09 0.00 0.05 0.00 -0.00 0.00 0.00 57.45 57.59 1wdl n PHE 349 Cb 0.50 -0.04 0.28 0.00 -1.00 0.00 0.00 39.48 39.22 1wdl n PHE 349 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1wdl n GLY 350 N -0.76 -0.33 0.38 1.37 0.00 -1.25 -3.62 105.19 100.97 1wdl n GLY 350 Ca 0.00 -0.06 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 1wdl n GLY 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdl h SER 352 N -0.36 0.07 -0.08 0.00 0.02 -1.04 -2.67 113.55 109.49 1wdl h SER 352 Ca -0.36 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 60.67 1wdl h SER 352 Cb 1.39 0.05 -0.06 0.00 0.14 0.00 0.00 62.40 63.92 1wdl h SER 352 CO -0.17 -0.08 -0.46 1.23 -1.14 0.00 0.00 176.83 176.21 1wdl h GLY 353 N 0.01 -0.84 1.97 -3.77 0.00 -1.78 -1.56 103.07 97.10 1wdl h GLY 353 Ca 0.89 0.56 -0.15 0.00 0.00 0.00 0.00 47.33 48.64 1wdl h GLY 353 CO -0.16 -0.23 -0.73 0.00 0.00 0.00 0.00 176.54 175.42 1wdl h ALA 354 N -0.06 0.54 0.05 3.60 0.00 -1.66 -3.25 119.26 118.48 1wdl h ALA 354 Ca 0.05 -0.66 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 1wdl h ALA 354 Cb 0.66 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1wdl h ALA 354 CO -0.38 0.89 -0.02 -0.09 0.00 0.00 0.00 179.25 179.65 1wdl h ARG 355 N 0.00 -0.06 -0.48 0.00 1.12 -1.36 0.61 114.38 114.21 1wdl h ARG 355 Ca -0.01 0.00 -0.06 0.00 -1.11 0.00 0.00 59.98 58.80 1wdl h ARG 355 Cb 1.55 0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 31.50 1wdl h ARG 355 CO 0.09 0.05 0.04 -0.84 -3.11 0.00 0.00 179.97 176.20 1wdl h ILE 356 N -0.16 1.23 -0.24 1.20 3.07 -1.41 -0.25 117.51 120.96 1wdl h ILE 356 Ca -0.01 -0.93 -0.10 0.00 1.55 0.00 0.00 64.86 65.37 1wdl h ILE 356 Cb 0.14 0.83 -0.00 0.00 -0.27 0.00 0.00 36.82 37.51 1wdl h ILE 356 CO 0.01 0.33 -0.24 0.28 -1.05 0.00 0.00 178.15 177.48 1wdl h SER 357 N 0.74 0.62 -0.21 2.16 0.02 -1.54 -0.71 113.55 114.62 1wdl h SER 357 Ca 0.15 -0.48 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1wdl h SER 357 Cb 0.40 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 1wdl h SER 357 CO 0.01 0.97 0.13 1.23 -1.14 0.00 0.00 176.83 178.04 1wdl h GLY 358 N 0.28 0.29 1.95 -3.77 0.00 0.52 -1.45 103.07 100.90 1wdl h GLY 358 Ca 0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 1wdl h GLY 358 CO 0.06 0.10 -0.15 -0.84 0.00 0.00 0.00 176.54 175.71 1wdl h THR 359 N 0.28 1.13 -0.83 4.70 2.02 -1.02 -2.05 112.91 117.13 1wdl h THR 359 Ca 0.08 -0.60 -0.00 0.00 0.77 0.00 0.00 66.41 66.65 1wdl h THR 359 Cb -0.03 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.61 1wdl h THR 359 CO -0.02 0.18 0.51 0.25 0.37 0.00 0.00 175.52 176.80 1wdl h LEU 360 N 0.06 0.99 -0.50 2.58 5.85 -0.08 -2.05 115.31 122.16 1wdl h LEU 360 Ca 0.01 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 1wdl h LEU 360 Cb 0.30 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1wdl h LEU 360 CO 0.02 0.76 0.07 -0.07 -0.34 0.00 0.00 178.44 178.88 1wdl h LEU 361 N 1.14 0.80 -1.33 2.25 3.38 -0.76 -2.16 115.31 118.62 1wdl h LEU 361 Ca 0.30 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1wdl h LEU 361 Cb -0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1wdl h LEU 361 CO -0.06 0.86 0.22 0.78 0.09 0.00 0.00 178.44 180.33 1wdl h ASN 362 N 0.70 0.60 -0.14 -0.43 2.35 -1.27 0.97 115.58 118.37 1wdl h ASN 362 Ca 0.15 -0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 1wdl h ASN 362 Cb 0.41 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.62 1wdl h ASN 362 CO 0.01 0.53 -0.03 0.58 -1.65 0.00 0.00 177.43 176.87 1wdl h VAL 363 N 0.67 1.28 0.46 2.81 2.07 -1.11 -1.01 116.25 121.42 1wdl h VAL 363 Ca 0.17 -0.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 1wdl h VAL 363 Cb 0.09 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1wdl h VAL 363 CO -0.02 0.28 -0.22 0.24 0.02 0.00 0.00 177.57 177.87 1wdl h MET 364 N -0.04 -0.60 -0.62 1.57 2.86 -0.90 0.21 114.93 117.42 1wdl h MET 364 Ca 0.04 0.04 0.10 0.00 -2.06 0.00 0.00 59.70 57.82 1wdl h MET 364 Cb 0.45 0.14 -0.08 0.00 0.06 0.00 0.00 31.60 32.17 1wdl h MET 364 CO 0.01 -0.39 0.22 -0.22 1.06 0.00 0.00 176.91 177.59 1wdl h LYS 365 N -0.64 0.37 0.00 1.72 3.64 -0.85 0.15 116.57 120.96 1wdl h LYS 365 Ca -0.06 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.20 1wdl h LYS 365 Cb 0.48 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1wdl h LYS 365 CO 0.10 0.25 -0.46 1.96 -2.27 0.00 0.00 179.45 179.03 1wdl h GLN 366 N 0.38 0.00 -0.29 1.90 4.20 -1.00 -3.23 115.11 117.08 1wdl h GLN 366 Ca 0.32 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.89 1wdl h GLN 366 Cb 0.42 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.11 1wdl h GLN 366 CO -0.33 0.46 -0.14 0.09 -0.67 0.00 0.00 178.83 178.24 1wdl n ASN 367 N -3.97 2.42 -4.08 1.46 3.02 0.05 -4.98 115.26 109.18 1wdl n ASN 367 Ca -0.02 -3.74 -0.31 0.00 -0.03 0.00 0.00 54.58 50.48 1wdl n ASN 367 Cb 0.48 -0.61 -0.02 0.00 -0.61 0.00 0.00 39.78 39.02 1wdl n ASN 367 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdl n GLY 368 N -1.10 -0.35 3.90 7.41 0.00 -0.08 -4.96 105.19 110.03 1wdl n GLY 368 Ca 0.30 0.15 -0.28 0.00 0.00 0.00 0.00 46.02 46.19 1wdl n GLY 368 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wdl s GLY 369 N -3.79 1.53 -0.05 -0.02 0.00 0.31 -5.03 107.32 100.28 1wdl s GLY 369 Ca 0.40 -0.48 -0.09 0.00 0.00 0.00 0.00 44.72 44.55 1wdl s GLY 369 CO 0.90 -0.31 -0.17 2.41 0.00 0.00 0.00 173.10 175.93 1wdl n THR 370 N -2.20 1.30 -4.21 0.90 -1.04 -1.26 -4.63 114.28 103.13 1wdl n THR 370 Ca 0.01 0.23 -0.35 0.00 -2.04 0.00 0.00 64.05 61.90 1wdl n THR 370 Cb 0.55 -1.94 -0.10 0.00 -1.82 0.00 0.00 70.33 67.02 1wdl n THR 370 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1wdl s PHE 371 N -2.43 3.19 0.16 -1.42 0.40 -1.26 -0.64 117.98 115.98 1wdl s PHE 371 Ca -0.15 0.06 0.06 0.00 -0.60 0.00 0.00 56.93 56.30 1wdl s PHE 371 Cb 0.03 -1.94 -0.04 0.00 0.51 0.00 0.00 43.02 41.57 1wdl s PHE 371 CO 0.22 0.26 -0.13 0.20 0.70 0.00 0.00 175.22 176.47 1wdl s GLY 372 N -0.16 1.21 -0.03 4.36 0.00 -1.10 -0.57 107.32 111.04 1wdl s GLY 372 Ca 0.06 -1.51 0.00 0.00 0.00 0.00 0.00 44.72 43.28 1wdl s GLY 372 CO 0.02 -1.59 -0.00 -2.27 0.00 0.00 0.00 173.10 169.25 1wdl s LEU 373 N -3.03 1.27 -0.14 0.66 2.96 -0.50 -1.70 118.68 118.20 1wdl s LEU 373 Ca 0.17 -0.03 -0.00 0.00 -0.22 0.00 0.00 54.13 54.05 1wdl s LEU 373 Cb -0.01 -0.21 0.03 0.00 0.50 0.00 0.00 46.19 46.50 1wdl s LEU 373 CO 0.04 -0.09 -0.11 -0.94 -1.32 0.00 0.00 176.35 173.94 1wdl s SER 374 N 0.89 2.52 0.07 3.68 1.04 -0.68 -0.36 113.70 120.86 1wdl s SER 374 Ca -0.09 -0.44 -0.02 0.00 0.48 0.00 0.00 55.95 55.87 1wdl s SER 374 Cb -0.12 -1.02 -0.03 0.00 0.10 0.00 0.00 66.02 64.94 1wdl s SER 374 CO -0.02 -0.10 0.02 0.28 0.98 0.00 0.00 173.24 174.40 1wdl s THR 375 N 1.59 0.19 -0.04 2.02 -1.32 -0.67 -1.39 115.64 116.02 1wdl s THR 375 Ca 0.04 -1.72 -0.30 0.00 -1.21 0.00 0.00 61.69 58.50 1wdl s THR 375 Cb -0.13 -1.55 0.07 0.00 -1.51 0.00 0.00 72.50 69.38 1wdl s THR 375 CO -0.09 -0.89 0.66 0.00 -2.21 0.00 0.00 174.62 172.09 1wdl s MET 376 N -3.92 1.06 0.34 7.08 0.23 -1.01 -2.40 119.30 120.68 1wdl s MET 376 Ca 0.09 0.20 -0.15 0.00 -1.03 0.00 0.00 55.69 54.80 1wdl s MET 376 Cb 0.07 0.50 -0.09 0.00 -1.53 0.00 0.00 34.83 33.78 1wdl s MET 376 CO -0.09 -0.34 0.77 0.00 -2.03 0.00 0.00 175.02 173.33 1wdl s ILE 378 N -2.04 2.14 0.83 0.00 1.01 -0.29 -4.68 121.20 118.17 1wdl s ILE 378 Ca 0.55 -1.89 -0.12 0.00 0.00 0.00 0.00 60.65 59.20 1wdl s ILE 378 Cb -0.10 -1.96 0.10 0.00 0.01 0.00 0.00 42.46 40.50 1wdl s ILE 378 CO 0.18 -0.10 1.17 -0.83 0.00 0.00 0.00 174.94 175.35 1wdl s GLY 379 N -2.43 1.95 -1.75 6.18 0.00 -1.26 -2.69 107.32 107.32 1wdl s GLY 379 Ca 0.16 0.69 0.00 0.00 0.00 0.00 0.00 44.72 45.57 1wdl s GLY 379 CO 0.08 1.10 0.00 1.04 0.00 0.00 0.00 173.10 175.31 1wdl n LEU 380 N -3.60 -1.73 -1.67 0.66 7.99 -1.26 -4.01 117.00 113.38 1wdl n LEU 380 Ca 0.12 0.12 -0.00 0.00 -0.01 0.00 0.00 56.01 56.24 1wdl n LEU 380 Cb 0.51 -2.79 0.00 0.00 -0.11 0.00 0.00 43.42 41.04 1wdl n LEU 380 CO 0.49 -0.37 0.03 0.61 -1.51 0.00 0.00 177.39 176.64 1wdl n GLY 381 N -0.85 -0.18 3.36 -0.72 0.00 -1.21 -4.24 105.19 101.35 1wdl n GLY 381 Ca -0.22 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.55 1wdl n GLY 381 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wdl s GLN 382 N -3.03 1.31 0.09 1.61 -0.21 -1.09 -2.00 119.66 116.34 1wdl s GLN 382 Ca 0.01 -1.42 -0.17 0.00 0.02 0.00 0.00 55.36 53.80 1wdl s GLN 382 Cb -0.00 0.36 0.04 0.00 1.00 0.00 0.00 33.01 34.40 1wdl s GLN 382 CO 0.08 -0.48 0.42 0.20 -2.12 0.00 0.00 175.29 173.39 1wdl s GLY 383 N -3.07 -0.30 -0.18 3.09 0.00 0.75 -1.14 107.32 106.47 1wdl s GLY 383 Ca 0.29 0.14 -0.17 0.00 0.00 0.00 0.00 44.72 44.98 1wdl s GLY 383 CO 0.09 -0.13 0.49 -1.50 0.00 0.00 0.00 173.10 172.05 1wdl s ILE 384 N -3.26 0.00 0.02 0.90 2.07 -1.14 -1.20 121.20 118.59 1wdl s ILE 384 Ca -0.00 -0.01 -0.02 0.00 -1.41 0.00 0.00 60.65 59.20 1wdl s ILE 384 Cb 0.01 -0.69 -0.02 0.00 0.13 0.00 0.00 42.46 41.89 1wdl s ILE 384 CO -0.08 -0.01 0.02 0.00 -1.91 0.00 0.00 174.94 172.97 1wdl s ALA 385 N 0.21 0.02 -0.04 1.50 0.00 0.13 -2.39 121.76 121.18 1wdl s ALA 385 Ca -0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.42 1wdl s ALA 385 Cb -0.03 0.16 0.03 0.00 0.00 0.00 0.00 23.12 23.27 1wdl s ALA 385 CO 0.01 -0.20 0.09 0.99 0.00 0.00 0.00 175.76 176.64 1wdl s THR 386 N -1.73 -0.04 -0.35 0.00 2.01 -0.49 -1.27 115.64 113.78 1wdl s THR 386 Ca -0.13 0.13 -0.03 0.00 0.31 0.00 0.00 61.69 61.97 1wdl s THR 386 Cb -0.07 -0.15 0.07 0.00 0.01 0.00 0.00 72.50 72.36 1wdl s THR 386 CO -0.01 0.05 0.10 -0.69 -0.69 0.00 0.00 174.62 173.38 1wdl s VAL 387 N 0.76 3.19 0.78 3.82 1.01 -0.82 -1.68 120.40 127.46 1wdl s VAL 387 Ca -0.06 -1.65 -0.07 0.00 0.00 0.00 0.00 61.98 60.20 1wdl s VAL 387 Cb -0.08 -2.99 0.13 0.00 0.00 0.00 0.00 36.38 33.43 1wdl s VAL 387 CO -0.03 -0.37 1.09 -0.36 0.00 0.00 0.00 175.10 175.43 1wdl s PHE 388 N 1.22 1.97 -0.17 5.22 0.40 -0.69 -1.40 117.98 124.52 1wdl s PHE 388 Ca 0.01 0.10 -0.11 0.00 -0.60 0.00 0.00 56.93 56.33 1wdl s PHE 388 Cb -0.21 -3.38 0.06 0.00 0.51 0.00 0.00 43.02 40.00 1wdl s PHE 388 CO -0.02 -1.89 0.42 -2.00 0.70 0.00 0.00 175.22 172.43 1wdl s GLU 389 N -5.38 0.42 -0.23 0.44 2.12 0.71 -2.72 118.70 114.05 1wdl s GLU 389 Ca 0.67 0.76 -0.15 0.00 0.36 0.00 0.00 54.97 56.61 1wdl s GLU 389 Cb -0.06 0.03 -0.04 0.00 0.26 0.00 0.00 34.13 34.32 1wdl s GLU 389 CO 0.47 -0.14 0.34 1.03 -0.54 0.00 0.00 175.26 176.43 1wdl s ARG 390 N 1.17 4.10 0.00 4.30 1.81 0.18 -0.30 118.95 130.21 1wdl s ARG 390 Ca -0.08 0.06 0.00 0.00 -1.72 0.00 0.00 55.73 53.99 1wdl s ARG 390 Cb -0.07 -3.58 0.00 0.00 -0.45 0.00 0.00 34.95 30.85 1wdl s ARG 390 CO -0.10 -0.10 0.23 1.55 -0.68 0.00 0.00 175.30 176.20