#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wdm s LEU 3 N 0.00 4.05 0.46 2.46 1.43 -1.26 -5.06 118.68 120.76 1wdm s LEU 3 Ca 0.00 0.27 -0.22 0.00 -1.03 0.00 0.00 54.13 53.14 1wdm s LEU 3 Cb 0.00 -2.38 -0.08 0.00 0.03 0.00 0.00 46.19 43.76 1wdm s LEU 3 CO 0.00 -0.15 1.10 0.20 0.23 0.00 0.00 176.35 177.73 1wdm s ASN 4 N 1.57 6.31 0.56 2.29 0.02 -1.26 -4.90 114.94 119.53 1wdm s ASN 4 Ca 0.14 2.13 0.31 0.00 -1.02 0.00 0.00 52.86 54.43 1wdm s ASN 4 Cb -0.16 -2.59 1.46 0.00 0.02 0.00 0.00 41.25 39.99 1wdm s ASN 4 CO 0.10 -0.81 1.84 -0.65 0.02 0.00 0.00 177.10 177.60 1wdm h PRO 5 N 1.96 0.00 -0.49 -0.60 0.11 -1.97 -0.85 132.00 130.17 1wdm h PRO 5 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1wdm h PRO 5 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1wdm h PRO 5 CO 0.60 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.93 1wdm n ARG 6 N -4.00 2.50 -2.06 1.05 5.12 -1.26 -2.20 116.66 115.80 1wdm n ARG 6 Ca 0.17 -2.28 -0.36 0.00 -1.93 0.00 0.00 57.85 53.45 1wdm n ARG 6 Cb 0.96 -1.52 0.03 0.00 -1.16 0.00 0.00 32.46 30.77 1wdm n ARG 6 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1wdm s ASP 7 N -1.32 5.33 -0.38 0.55 1.01 -0.32 -4.01 116.67 117.53 1wdm s ASP 7 Ca 0.41 2.36 -0.22 0.00 0.71 0.00 0.00 52.55 55.81 1wdm s ASP 7 Cb 0.23 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.57 1wdm s ASP 7 CO 0.31 -1.50 0.71 -0.69 0.21 0.00 0.00 175.17 174.21 1wdm s VAL 8 N -1.61 4.80 -0.10 -1.27 1.01 -1.26 -0.44 120.40 121.52 1wdm s VAL 8 Ca 0.76 0.62 -0.01 0.00 0.00 0.00 0.00 61.98 63.35 1wdm s VAL 8 Cb -0.29 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 31.89 1wdm s VAL 8 CO 0.32 -0.44 -0.06 -0.69 0.00 0.00 0.00 175.10 174.23 1wdm s VAL 9 N 2.93 3.72 -0.17 2.92 1.01 -0.01 -2.24 120.40 128.56 1wdm s VAL 9 Ca 0.27 -0.45 -0.17 0.00 0.00 0.00 0.00 61.98 61.63 1wdm s VAL 9 Cb -0.14 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 1wdm s VAL 9 CO 0.17 0.56 0.46 -0.63 0.00 0.00 0.00 175.10 175.66 1wdm s ILE 10 N -0.35 5.17 -0.06 2.22 1.09 -0.92 -1.55 121.20 126.81 1wdm s ILE 10 Ca 0.05 0.86 0.05 0.00 -1.10 0.00 0.00 60.65 60.51 1wdm s ILE 10 Cb -0.12 -3.79 -0.24 0.00 -1.06 0.00 0.00 42.46 37.24 1wdm s ILE 10 CO 0.02 0.26 0.62 0.58 -0.10 0.00 0.00 174.94 176.32 1wdm h VAL 11 N 4.94 0.84 -2.11 2.92 2.07 -1.15 0.14 116.25 123.90 1wdm h VAL 11 Ca -0.37 -2.63 0.18 0.00 0.82 0.00 0.00 66.70 64.71 1wdm h VAL 11 Cb 1.16 2.50 -0.12 0.00 -1.52 0.00 0.00 31.29 33.31 1wdm h VAL 11 CO 0.74 0.66 0.57 -0.62 0.02 0.00 0.00 177.57 178.94 1wdm s ASP 12 N -6.49 -0.22 -0.08 0.57 3.68 -1.23 -4.50 116.67 108.40 1wdm s ASP 12 Ca -0.10 -0.19 -0.04 0.00 2.13 0.00 0.00 52.55 54.34 1wdm s ASP 12 Cb 0.07 0.37 0.04 0.00 -1.45 0.00 0.00 42.92 41.96 1wdm s ASP 12 CO 0.81 -0.66 0.18 0.12 0.13 0.00 0.00 175.17 175.76 1wdm s PHE 13 N -3.02 -0.22 -0.04 -5.34 5.36 -1.26 -2.78 117.98 110.67 1wdm s PHE 13 Ca 0.10 0.58 -0.02 0.00 -0.96 0.00 0.00 56.93 56.63 1wdm s PHE 13 Cb -0.00 -0.03 0.02 0.00 -0.34 0.00 0.00 43.02 42.67 1wdm s PHE 13 CO -0.03 -0.18 0.10 0.20 -1.46 0.00 0.00 175.22 173.85 1wdm s GLY 14 N 1.11 -0.02 0.15 13.12 0.00 -0.81 -4.63 107.32 116.24 1wdm s GLY 14 Ca -0.08 0.43 0.06 0.00 0.00 0.00 0.00 44.72 45.13 1wdm s GLY 14 CO -0.06 0.60 -0.14 1.09 0.00 0.00 0.00 173.10 174.59 1wdm s ARG 15 N 0.66 1.12 0.45 2.90 1.70 -0.39 -0.61 118.95 124.78 1wdm s ARG 15 Ca -0.05 -1.37 -0.10 0.00 -0.47 0.00 0.00 55.73 53.74 1wdm s ARG 15 Cb -0.07 -0.94 -0.06 0.00 -0.57 0.00 0.00 34.95 33.31 1wdm s ARG 15 CO -0.03 0.17 0.82 0.95 -1.08 0.00 0.00 175.30 176.13 1wdm s THR 16 N -2.53 4.78 -0.48 4.99 -4.23 -0.51 -1.16 115.64 116.51 1wdm s THR 16 Ca 0.14 0.61 -0.27 0.00 -1.18 0.00 0.00 61.69 60.99 1wdm s THR 16 Cb -0.03 -3.77 -0.03 0.00 1.34 0.00 0.00 72.50 70.01 1wdm s THR 16 CO 0.04 -0.66 1.98 -2.84 -0.54 0.00 0.00 174.62 172.60 1wdm s PRO 17 N -4.16 2.76 -0.09 3.99 0.02 -1.26 -4.72 135.00 131.54 1wdm s PRO 17 Ca 0.51 1.11 -0.40 0.00 0.02 0.00 0.00 61.00 62.25 1wdm s PRO 17 Cb -0.10 -4.37 -0.18 0.00 0.02 0.00 0.00 34.50 29.87 1wdm s PRO 17 CO 0.36 -2.54 1.36 -1.33 -0.33 0.00 0.00 177.00 174.52 1wdm n MET 18 N 8.89 0.61 -4.46 5.54 2.81 -1.26 -4.82 117.12 124.44 1wdm n MET 18 Ca 0.25 0.22 -0.23 0.00 -1.81 0.00 0.00 57.70 56.13 1wdm n MET 18 Cb 0.51 -1.81 -0.10 0.00 -0.71 0.00 0.00 33.22 31.11 1wdm n MET 18 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1wdm s GLY 19 N 1.20 1.88 -0.10 3.03 0.00 -1.08 -2.34 107.32 109.89 1wdm s GLY 19 Ca 0.92 -1.90 -0.30 0.00 0.00 0.00 0.00 44.72 43.44 1wdm s GLY 19 CO 0.58 -1.93 1.14 0.50 0.00 0.00 0.00 173.10 173.39 1wdm s ARG 20 N -3.59 4.34 0.37 2.90 0.52 -1.26 -2.13 118.95 120.10 1wdm s ARG 20 Ca 0.29 1.56 0.05 0.00 -0.52 0.00 0.00 55.73 57.11 1wdm s ARG 20 Cb -0.01 -3.59 0.71 0.00 0.52 0.00 0.00 34.95 32.58 1wdm s ARG 20 CO 0.13 -0.47 1.98 0.77 0.02 0.00 0.00 175.30 177.73 1wdm h SER 21 N 7.48 0.54 -1.11 0.23 0.02 -1.89 0.75 113.55 119.57 1wdm h SER 21 Ca -0.30 -0.04 -0.59 0.00 -0.84 0.00 0.00 61.79 60.01 1wdm h SER 21 Cb 1.14 -0.14 -0.10 0.00 0.14 0.00 0.00 62.40 63.44 1wdm h SER 21 CO 0.90 0.47 1.48 -0.75 -1.14 0.00 0.00 176.83 177.79 1wdm s LYS 22 N -5.36 3.57 -1.31 3.45 2.20 -1.26 -4.09 119.74 116.93 1wdm s LYS 22 Ca -0.08 -1.10 -0.05 0.00 -0.36 0.00 0.00 55.97 54.38 1wdm s LYS 22 Cb 0.17 -5.35 0.01 0.00 -1.51 0.00 0.00 37.83 31.15 1wdm s LYS 22 CO 0.75 -2.23 1.04 0.41 -0.36 0.00 0.00 175.35 174.96 1wdm n GLY 23 N 6.88 -0.44 0.00 5.54 0.00 -1.26 -5.01 105.19 110.90 1wdm n GLY 23 Ca 0.33 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.53 1wdm n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdm n GLY 24 N -1.59 1.09 0.15 -0.02 0.00 0.26 -4.88 105.19 100.19 1wdm n GLY 24 Ca -0.14 -1.92 0.13 0.00 0.00 0.00 0.00 46.02 44.09 1wdm n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdm h MET 25 N 0.00 0.00 -0.34 1.61 -0.00 -1.74 -3.04 114.93 111.42 1wdm h MET 25 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1wdm h MET 25 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 1wdm h MET 25 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.91 177.63 1wdm n HIS 26 N -2.40 0.45 0.12 -0.10 8.25 -1.26 -2.70 115.22 117.57 1wdm n HIS 26 Ca 0.03 -0.41 0.19 0.00 -0.26 0.00 0.00 57.72 57.26 1wdm n HIS 26 Cb 0.31 -0.02 0.76 0.00 1.12 0.00 0.00 29.99 32.17 1wdm n HIS 26 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1wdm h ARG 27 N 2.40 0.00 -0.29 -0.41 0.11 -1.83 -0.90 114.38 113.46 1wdm h ARG 27 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1wdm h ARG 27 Cb 0.73 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.81 1wdm h ARG 27 CO 0.00 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.16 1wdm n ASN 28 N -3.95 2.79 -4.52 0.08 3.02 -1.26 -4.96 115.26 106.46 1wdm n ASN 28 Ca 0.05 -1.86 -0.34 0.00 -0.03 0.00 0.00 54.58 52.40 1wdm n ASN 28 Cb 0.48 -0.19 -0.12 0.00 -0.61 0.00 0.00 39.78 39.34 1wdm n ASN 28 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1wdm s THR 29 N -1.04 4.19 0.70 3.41 2.01 -0.35 -5.10 115.64 119.46 1wdm s THR 29 Ca 0.24 -0.24 -0.13 0.00 0.31 0.00 0.00 61.69 61.87 1wdm s THR 29 Cb 0.13 -2.87 0.02 0.00 0.01 0.00 0.00 72.50 69.79 1wdm s THR 29 CO 0.18 0.46 1.09 -0.13 -0.69 0.00 0.00 174.62 175.53 1wdm s ARG 30 N 0.56 2.70 0.20 4.92 0.52 -1.26 -4.92 118.95 121.68 1wdm s ARG 30 Ca -0.00 1.20 -0.07 0.00 -0.52 0.00 0.00 55.73 56.33 1wdm s ARG 30 Cb -0.14 -1.95 0.13 0.00 0.52 0.00 0.00 34.95 33.52 1wdm s ARG 30 CO 0.02 -1.30 1.69 0.00 0.02 0.00 0.00 175.30 175.73 1wdm h ALA 31 N -0.47 0.92 0.09 2.13 0.00 -1.95 -1.68 119.26 118.30 1wdm h ALA 31 Ca -0.45 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.17 1wdm h ALA 31 Cb 1.23 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1wdm h ALA 31 CO 0.54 0.66 -0.04 0.93 0.00 0.00 0.00 179.25 181.34 1wdm h GLU 32 N 0.98 -0.11 0.00 0.00 5.08 -1.93 -1.31 114.58 117.29 1wdm h GLU 32 Ca 0.19 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1wdm h GLU 32 Cb 0.48 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1wdm h GLU 32 CO 0.02 0.28 -0.04 -0.44 -1.00 0.00 0.00 179.01 177.83 1wdm h ASP 33 N -0.53 0.00 0.04 1.42 3.32 -1.95 0.52 116.42 119.24 1wdm h ASP 33 Ca -0.01 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.88 1wdm h ASP 33 Cb 0.45 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.01 1wdm h ASP 33 CO 0.02 0.04 -0.66 -0.03 -1.72 0.00 0.00 179.24 176.89 1wdm h MET 34 N 0.00 0.37 0.04 3.56 4.05 -1.12 -2.61 114.93 119.23 1wdm h MET 34 Ca -0.00 -0.46 -0.00 0.00 -0.28 0.00 0.00 59.70 58.96 1wdm h MET 34 Cb 0.23 0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.17 1wdm h MET 34 CO 0.01 1.14 -0.02 0.77 0.23 0.00 0.00 176.91 179.04 1wdm h SER 35 N -0.19 -0.04 -0.80 1.39 0.02 -0.38 -1.84 113.55 111.71 1wdm h SER 35 Ca -0.09 -0.51 0.12 0.00 -0.84 0.00 0.00 61.79 60.46 1wdm h SER 35 Cb 1.41 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.90 1wdm h SER 35 CO 0.13 0.50 0.52 0.00 -1.14 0.00 0.00 176.83 176.84 1wdm h ALA 36 N 0.30 1.86 0.41 3.77 0.00 -0.13 -1.49 119.26 123.99 1wdm h ALA 36 Ca -0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1wdm h ALA 36 Cb 0.55 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1wdm h ALA 36 CO 0.01 -0.05 -0.20 1.25 0.00 0.00 0.00 179.25 180.26 1wdm h HIS 37 N 0.64 -0.51 -0.90 0.00 2.76 -1.44 -2.26 115.15 113.43 1wdm h HIS 37 Ca 0.38 -0.01 0.22 0.00 -2.20 0.00 0.00 60.37 58.76 1wdm h HIS 37 Cb 0.59 0.17 -0.17 0.00 1.55 0.00 0.00 27.41 29.56 1wdm h HIS 37 CO -0.00 -0.32 -0.05 1.25 -1.30 0.00 0.00 177.93 177.51 1wdm h LEU 38 N -0.88 -0.55 -0.61 0.26 5.85 -1.07 0.32 115.31 118.62 1wdm h LEU 38 Ca -0.06 0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 1wdm h LEU 38 Cb 0.43 0.47 -0.03 0.00 0.37 0.00 0.00 40.66 41.90 1wdm h LEU 38 CO 0.09 -0.29 0.31 0.40 -0.34 0.00 0.00 178.44 178.62 1wdm h ILE 39 N 0.04 1.21 -0.28 4.05 2.04 -1.33 -1.51 117.51 121.73 1wdm h ILE 39 Ca 0.50 -0.56 0.01 0.00 1.00 0.00 0.00 64.86 65.81 1wdm h ILE 39 Cb 0.92 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1wdm h ILE 39 CO -0.86 0.23 0.16 -1.28 0.00 0.00 0.00 178.15 176.41 1wdm h SER 40 N 0.84 0.25 -0.47 1.72 0.87 0.21 -2.15 113.55 114.83 1wdm h SER 40 Ca 0.21 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.72 1wdm h SER 40 Cb 0.09 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 1wdm h SER 40 CO -0.03 0.19 0.07 0.11 -0.53 0.00 0.00 176.83 176.64 1wdm h LYS 41 N 0.33 0.78 -0.96 2.24 1.79 -1.04 -1.83 116.57 117.87 1wdm h LYS 41 Ca 0.11 -0.21 0.05 0.00 -2.18 0.00 0.00 60.65 58.42 1wdm h LYS 41 Cb 0.00 -0.09 -0.06 0.00 -1.58 0.00 0.00 32.23 30.50 1wdm h LYS 41 CO -0.05 0.79 0.62 0.28 -1.08 0.00 0.00 179.45 180.01 1wdm h VAL 42 N 0.65 1.12 -0.46 0.50 2.07 -1.12 -1.91 116.25 117.09 1wdm h VAL 42 Ca 0.14 -0.40 -0.12 0.00 0.82 0.00 0.00 66.70 67.14 1wdm h VAL 42 Cb 0.40 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 1wdm h VAL 42 CO 0.01 0.21 -0.20 -0.07 0.02 0.00 0.00 177.57 177.54 1wdm h LEU 43 N 1.17 0.95 -1.99 2.57 3.38 -1.20 -2.85 115.31 117.35 1wdm h LEU 43 Ca 0.40 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1wdm h LEU 43 Cb 0.08 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1wdm h LEU 43 CO -0.15 1.12 -0.10 -0.33 0.09 0.00 0.00 178.44 179.07 1wdm h GLU 44 N 0.81 0.00 -0.24 1.13 5.08 -0.56 -2.44 114.58 118.35 1wdm h GLU 44 Ca 0.11 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.28 1wdm h GLU 44 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1wdm h GLU 44 CO 0.06 0.10 -0.59 0.00 -1.00 0.00 0.00 179.01 177.58 1wdm h ARG 45 N 0.00 0.79 -3.40 2.33 3.08 -1.19 -3.35 114.38 112.65 1wdm h ARG 45 Ca -0.00 -0.53 -0.73 0.00 0.07 0.00 0.00 59.98 58.79 1wdm h ARG 45 Cb 0.24 0.07 -0.33 0.00 0.08 0.00 0.00 29.97 30.03 1wdm h ARG 45 CO 0.01 1.15 0.05 -0.80 -1.07 0.00 0.00 179.97 179.32 1wdm s ASN 46 N -6.98 6.35 0.55 7.04 0.01 -0.92 -4.89 114.94 116.10 1wdm s ASN 46 Ca -0.10 -3.65 0.34 0.00 -0.71 0.00 0.00 52.86 48.74 1wdm s ASN 46 Cb 0.10 -1.99 1.47 0.00 0.41 0.00 0.00 41.25 41.24 1wdm s ASN 46 CO 0.88 -0.22 2.01 0.77 -1.51 0.00 0.00 177.10 179.04 1wdm h SER 47 N 6.24 0.00 0.63 -1.22 4.64 -1.70 -2.97 113.55 119.17 1wdm h SER 47 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1wdm h SER 47 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1wdm h SER 47 CO 0.89 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.96 1wdm h LYS 48 N 0.00 0.00 -5.06 4.77 1.57 -1.90 -3.40 116.57 112.55 1wdm h LYS 48 Ca 0.00 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.15 1wdm h LYS 48 Cb 0.45 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.61 1wdm h LYS 48 CO 0.00 0.00 -0.40 0.14 -0.57 0.00 0.00 179.45 178.62 1wdm s VAL 49 N -3.49 5.27 -0.35 0.50 -7.23 -1.12 -5.01 120.40 108.96 1wdm s VAL 49 Ca 0.02 0.35 -0.29 0.00 -1.81 0.00 0.00 61.98 60.25 1wdm s VAL 49 Cb 0.09 -3.60 0.02 0.00 0.56 0.00 0.00 36.38 33.45 1wdm s VAL 49 CO 0.40 0.24 1.14 -0.62 -0.31 0.00 0.00 175.10 175.94 1wdm s ASP 50 N 1.54 6.82 0.60 4.85 2.15 -1.26 -4.90 116.67 126.47 1wdm s ASP 50 Ca 0.11 0.97 0.28 0.00 0.43 0.00 0.00 52.55 54.34 1wdm s ASP 50 Cb -0.15 -2.54 1.45 0.00 -0.30 0.00 0.00 42.92 41.37 1wdm s ASP 50 CO 0.09 -0.99 1.85 -0.65 -0.17 0.00 0.00 175.17 175.30 1wdm h PRO 51 N 8.56 0.00 0.00 4.34 0.11 -1.94 0.40 132.00 143.48 1wdm h PRO 51 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1wdm h PRO 51 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1wdm h PRO 51 CO 1.05 0.00 0.00 0.78 -0.21 0.00 0.00 178.00 179.62 1wdm h GLY 52 N 0.00 0.00 0.45 -0.55 0.00 -1.90 -2.33 103.07 98.73 1wdm h GLY 52 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1wdm h GLY 52 CO -0.00 0.00 -0.23 1.18 0.00 0.00 0.00 176.54 177.48 1wdm n GLU 53 N -2.66 0.75 -1.60 4.80 1.02 0.14 -4.82 120.64 118.27 1wdm n GLU 53 Ca -0.00 -0.40 -0.20 0.00 -0.02 0.00 0.00 57.16 56.54 1wdm n GLU 53 Cb 0.18 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.04 1wdm n GLU 53 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1wdm s VAL 54 N -2.53 3.04 0.34 2.62 1.01 -0.88 -4.18 120.40 119.82 1wdm s VAL 54 Ca 0.24 -0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.27 1wdm s VAL 54 Cb 0.19 -3.08 0.31 0.00 0.00 0.00 0.00 36.38 33.80 1wdm s VAL 54 CO 0.52 -0.08 1.88 -0.33 0.00 0.00 0.00 175.10 177.09 1wdm h GLU 55 N 14.28 0.77 -1.85 2.72 4.39 -1.15 -3.38 114.58 130.35 1wdm h GLU 55 Ca -0.05 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.63 1wdm h GLU 55 Cb 1.07 -0.17 -0.23 0.00 -0.10 0.00 0.00 28.75 29.31 1wdm h GLU 55 CO 1.05 0.51 0.18 0.34 -1.16 0.00 0.00 179.01 179.94 1wdm s ASP 56 N -5.85 -0.74 -0.60 1.42 2.15 -1.26 -2.97 116.67 108.82 1wdm s ASP 56 Ca -0.10 1.27 -0.17 0.00 0.43 0.00 0.00 52.55 53.97 1wdm s ASP 56 Cb 0.21 1.30 0.12 0.00 -0.30 0.00 0.00 42.92 44.26 1wdm s ASP 56 CO 0.79 -0.21 0.65 -0.69 -0.17 0.00 0.00 175.17 175.54 1wdm s VAL 57 N 1.07 5.02 -0.39 1.11 1.01 -0.87 -2.82 120.40 124.53 1wdm s VAL 57 Ca -0.06 -1.32 -0.17 0.00 0.00 0.00 0.00 61.98 60.43 1wdm s VAL 57 Cb -0.05 -4.44 0.01 0.00 0.00 0.00 0.00 36.38 31.90 1wdm s VAL 57 CO -0.12 -1.04 0.46 -0.63 0.00 0.00 0.00 175.10 173.78 1wdm s ILE 58 N 2.09 5.05 0.06 2.22 1.01 -0.76 -1.40 121.20 129.47 1wdm s ILE 58 Ca 0.10 -0.05 0.07 0.00 0.00 0.00 0.00 60.65 60.77 1wdm s ILE 58 Cb -0.25 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 1wdm s ILE 58 CO 0.03 -0.33 -0.18 0.86 0.00 0.00 0.00 174.94 175.33 1wdm s TRP 59 N 2.26 2.56 -0.15 3.97 -0.11 -0.29 -2.12 118.94 125.06 1wdm s TRP 59 Ca 0.15 -0.25 -0.06 0.00 1.22 0.00 0.00 56.10 57.16 1wdm s TRP 59 Cb -0.16 -1.44 -0.04 0.00 -1.50 0.00 0.00 33.47 30.33 1wdm s TRP 59 CO 0.14 0.28 0.05 0.20 -4.62 0.00 0.00 176.95 173.00 1wdm s GLY 60 N -1.59 1.90 -0.26 5.86 0.00 -0.43 -0.17 107.32 112.64 1wdm s GLY 60 Ca 0.15 -0.75 -0.20 0.00 0.00 0.00 0.00 44.72 43.92 1wdm s GLY 60 CO 0.06 -0.16 0.66 0.00 0.00 0.00 0.00 173.10 173.67 1wdm n VAL 62 N 3.46 0.00 -1.76 0.00 0.31 -1.26 -4.47 118.33 114.60 1wdm n VAL 62 Ca -0.17 0.38 -0.39 0.00 -0.01 0.00 0.00 64.34 64.15 1wdm n VAL 62 Cb 0.57 -1.25 -0.04 0.00 -0.91 0.00 0.00 33.84 32.21 1wdm n VAL 62 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1wdm n ASN 63 N -1.92 3.35 -3.26 4.52 2.85 -1.26 -4.82 115.26 114.71 1wdm n ASN 63 Ca 0.00 -2.76 -0.30 0.00 -0.11 0.00 0.00 54.58 51.41 1wdm n ASN 63 Cb 0.00 -1.50 -0.02 0.00 1.24 0.00 0.00 39.78 39.50 1wdm n ASN 63 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1wdm n GLN 64 N 7.44 2.74 -4.30 1.20 6.02 -1.26 -4.56 117.38 124.67 1wdm n GLN 64 Ca 0.49 -1.80 -0.16 0.00 -0.01 0.00 0.00 57.00 55.52 1wdm n GLN 64 Cb 0.43 -2.63 -0.10 0.00 1.02 0.00 0.00 30.24 28.96 1wdm n GLN 64 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1wdm s THR 65 N 2.95 0.85 0.00 5.09 -1.32 -1.24 -3.88 115.64 118.10 1wdm s THR 65 Ca 0.53 -2.01 0.00 0.00 -1.21 0.00 0.00 61.69 58.99 1wdm s THR 65 Cb 0.14 -2.30 0.00 0.00 -1.51 0.00 0.00 72.50 68.82 1wdm s THR 65 CO -0.04 -0.34 0.00 0.18 -2.21 0.00 0.00 174.62 172.21 1wdm n LEU 66 N -0.36 0.00 -0.31 9.08 4.77 -1.26 -1.08 117.00 127.84 1wdm n LEU 66 Ca -0.05 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.06 1wdm n LEU 66 Cb 0.64 0.00 0.35 0.00 -2.33 0.00 0.00 43.42 42.08 1wdm n LEU 66 CO 0.36 0.00 1.22 -0.33 -1.33 0.00 0.00 177.39 177.30 1wdm h GLU 67 N 0.00 0.71 -0.64 3.23 5.08 -1.94 -1.02 114.58 119.99 1wdm h GLU 67 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1wdm h GLU 67 Cb 0.00 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.09 1wdm h GLU 67 CO 0.00 0.47 0.00 1.04 -1.00 0.00 0.00 179.01 179.52 1wdm n GLN 68 N -4.64 3.00 -2.92 2.33 6.02 -0.24 -4.66 117.38 116.27 1wdm n GLN 68 Ca 0.20 -1.89 -0.19 0.00 -0.01 0.00 0.00 57.00 55.10 1wdm n GLN 68 Cb 0.53 -1.77 0.02 0.00 1.02 0.00 0.00 30.24 30.03 1wdm n GLN 68 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1wdm s GLY 69 N -0.67 1.82 -1.14 1.08 0.00 -0.39 -3.61 107.32 104.40 1wdm s GLY 69 Ca 0.34 -1.44 -0.01 0.00 0.00 0.00 0.00 44.72 43.60 1wdm s GLY 69 CO 0.14 -1.24 0.96 0.79 0.00 0.00 0.00 173.10 173.75 1wdm n TRP 70 N -2.04 -2.21 -3.22 1.90 7.02 -1.26 -3.97 117.44 113.67 1wdm n TRP 70 Ca 0.06 0.90 -0.09 0.00 -1.02 0.00 0.00 57.50 57.35 1wdm n TRP 70 Cb 0.59 -4.81 0.00 0.00 -2.42 0.00 0.00 31.31 24.68 1wdm n TRP 70 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1wdm n ASN 71 N -3.11 -7.03 0.25 -0.99 5.15 -1.26 -4.78 115.26 103.49 1wdm n ASN 71 Ca -0.23 -0.17 0.17 0.00 -0.60 0.00 0.00 54.58 53.74 1wdm n ASN 71 Cb 0.65 -4.29 0.91 0.00 -0.53 0.00 0.00 39.78 36.52 1wdm n ASN 71 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1wdm h ILE 72 N 0.66 0.00 -0.68 -1.44 2.10 -1.79 -2.25 117.51 114.10 1wdm h ILE 72 Ca -0.18 -0.00 0.02 0.00 1.08 0.00 0.00 64.86 65.78 1wdm h ILE 72 Cb 1.12 0.74 -0.04 0.00 -1.09 0.00 0.00 36.82 37.55 1wdm h ILE 72 CO 0.29 0.00 0.44 0.00 -1.08 0.00 0.00 178.15 177.80 1wdm h ALA 73 N 2.00 0.88 0.05 0.18 0.00 -1.87 -1.67 119.26 118.83 1wdm h ALA 73 Ca 0.00 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.63 1wdm h ALA 73 Cb 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.56 1wdm h ALA 73 CO 0.00 0.23 -1.06 -0.09 0.00 0.00 0.00 179.25 178.34 1wdm h ARG 74 N 0.87 0.43 -0.65 0.00 9.65 -1.67 -2.21 114.38 120.81 1wdm h ARG 74 Ca 0.27 -0.52 0.05 0.00 -1.10 0.00 0.00 59.98 58.67 1wdm h ARG 74 Cb -0.03 0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.68 1wdm h ARG 74 CO -0.09 1.18 0.43 0.52 2.80 0.00 0.00 179.97 184.81 1wdm h MET 75 N 0.21 0.69 0.01 0.20 2.86 -1.45 -0.77 114.93 116.67 1wdm h MET 75 Ca -0.11 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.47 1wdm h MET 75 Cb 1.72 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 33.22 1wdm h MET 75 CO 0.19 0.45 -0.07 0.00 1.06 0.00 0.00 176.91 178.54 1wdm h ALA 76 N 1.64 -0.00 -0.38 6.32 0.00 -1.31 -3.29 119.26 122.24 1wdm h ALA 76 Ca 0.27 -0.48 0.11 0.00 0.00 0.00 0.00 54.91 54.81 1wdm h ALA 76 Cb 0.17 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1wdm h ALA 76 CO -0.08 -0.00 0.36 1.03 0.00 0.00 0.00 179.25 180.56 1wdm h SER 77 N -0.86 0.00 1.13 0.00 0.87 -1.00 -0.03 113.55 113.66 1wdm h SER 77 Ca -0.01 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.45 1wdm h SER 77 Cb 0.97 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.92 1wdm h SER 77 CO 0.01 0.00 -0.48 -0.07 -0.53 0.00 0.00 176.83 175.76 1wdm h LEU 78 N 0.00 0.00 -3.59 2.23 3.38 -1.22 -3.09 115.31 113.01 1wdm h LEU 78 Ca 0.18 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 1wdm h LEU 78 Cb 0.89 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.59 1wdm h LEU 78 CO -0.00 0.48 0.11 0.23 0.09 0.00 0.00 178.44 179.35 1wdm n MET 79 N -3.38 4.39 -3.87 1.13 2.81 -0.03 -4.93 117.12 113.24 1wdm n MET 79 Ca 0.01 -3.07 -0.23 0.00 -1.81 0.00 0.00 57.70 52.60 1wdm n MET 79 Cb 0.64 -2.24 -0.05 0.00 -0.71 0.00 0.00 33.22 30.86 1wdm n MET 79 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1wdm n THR 80 N 0.31 0.00 1.78 2.03 -1.04 -1.16 -4.83 114.28 111.37 1wdm n THR 80 Ca 0.33 -1.67 0.11 0.00 -2.04 0.00 0.00 64.05 60.77 1wdm n THR 80 Cb 1.27 0.34 0.58 0.00 -1.82 0.00 0.00 70.33 70.69 1wdm n THR 80 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wdm n GLN 81 N -0.88 1.22 -2.23 -2.82 0.00 -1.26 -4.79 117.38 106.62 1wdm n GLN 81 Ca -0.15 -0.33 -0.43 0.00 0.00 0.00 0.00 57.00 56.10 1wdm n GLN 81 Cb 0.45 -1.37 -0.02 0.00 0.00 0.00 0.00 30.24 29.30 1wdm n GLN 81 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1wdm s ILE 82 N -1.95 3.87 0.96 -0.39 -1.09 -1.26 -4.70 121.20 116.64 1wdm s ILE 82 Ca 0.33 0.99 -0.13 0.00 -2.23 0.00 0.00 60.65 59.61 1wdm s ILE 82 Cb 0.16 -3.86 0.05 0.00 -1.58 0.00 0.00 42.46 37.23 1wdm s ILE 82 CO 0.26 -0.34 0.41 -2.65 -1.23 0.00 0.00 174.94 171.40 1wdm n PRO 83 N 7.47 -0.38 0.24 2.79 -0.02 -1.26 -4.68 135.00 139.15 1wdm n PRO 83 Ca 0.17 -0.07 0.16 0.00 -2.02 0.00 0.00 63.50 61.74 1wdm n PRO 83 Cb 0.46 -1.87 0.57 0.00 -0.02 0.00 0.00 33.50 32.64 1wdm n PRO 83 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1wdm h HIS 84 N -1.61 0.00 0.00 6.00 3.86 -1.93 -2.83 115.15 118.63 1wdm h HIS 84 Ca -0.44 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 58.74 1wdm h HIS 84 Cb 1.29 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.75 1wdm h HIS 84 CO 0.38 0.00 -0.14 1.79 0.86 0.00 0.00 177.93 180.82 1wdm h THR 85 N 0.00 0.74 -4.34 2.45 1.35 -1.96 -3.43 112.91 107.71 1wdm h THR 85 Ca 0.00 -0.56 -0.51 0.00 -0.55 0.00 0.00 66.41 64.79 1wdm h THR 85 Cb 0.57 1.34 0.09 0.00 -1.73 0.00 0.00 68.15 68.42 1wdm h THR 85 CO 0.00 0.14 0.37 -0.44 -0.25 0.00 0.00 175.52 175.34 1wdm s SER 86 N -6.41 5.39 0.05 5.36 0.01 -1.07 -5.08 113.70 111.95 1wdm s SER 86 Ca -0.03 1.53 0.01 0.00 1.31 0.00 0.00 55.95 58.77 1wdm s SER 86 Cb 0.14 -2.42 0.01 0.00 0.21 0.00 0.00 66.02 63.96 1wdm s SER 86 CO 0.62 -1.42 0.07 0.00 0.41 0.00 0.00 173.24 172.91 1wdm n ALA 87 N -3.11 0.10 -3.65 1.44 0.00 -1.16 -4.99 120.51 109.15 1wdm n ALA 87 Ca 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 53.44 53.32 1wdm n ALA 87 Cb 0.54 0.05 -0.07 0.00 0.00 0.00 0.00 19.45 19.97 1wdm n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wdm s ALA 88 N -2.06 -2.38 -0.05 0.00 0.00 -1.26 -2.05 121.76 113.96 1wdm s ALA 88 Ca 0.05 1.81 -0.08 0.00 0.00 0.00 0.00 51.96 53.74 1wdm s ALA 88 Cb -0.00 -1.84 0.02 0.00 0.00 0.00 0.00 23.12 21.29 1wdm s ALA 88 CO 0.03 -0.19 0.21 1.14 0.00 0.00 0.00 175.76 176.95 1wdm s GLN 89 N 0.44 0.36 -0.30 0.00 -2.07 -0.49 -4.64 119.66 112.96 1wdm s GLN 89 Ca 0.01 0.05 -0.09 0.00 -1.82 0.00 0.00 55.36 53.51 1wdm s GLN 89 Cb -0.04 0.16 -0.01 0.00 -1.09 0.00 0.00 33.01 32.04 1wdm s GLN 89 CO -0.13 -0.07 0.14 0.99 -1.32 0.00 0.00 175.29 174.90 1wdm s THR 90 N -0.46 4.54 -0.07 3.63 2.01 -1.26 -1.14 115.64 122.89 1wdm s THR 90 Ca -0.06 -0.40 -0.15 0.00 0.31 0.00 0.00 61.69 61.39 1wdm s THR 90 Cb -0.04 -3.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.13 1wdm s THR 90 CO 0.01 0.10 0.38 -0.69 -0.69 0.00 0.00 174.62 173.73 1wdm s VAL 91 N 1.61 5.16 -0.14 3.82 1.01 0.76 -4.91 120.40 127.71 1wdm s VAL 91 Ca 0.05 0.76 -0.01 0.00 0.00 0.00 0.00 61.98 62.78 1wdm s VAL 91 Cb -0.17 -3.70 0.03 0.00 0.00 0.00 0.00 36.38 32.55 1wdm s VAL 91 CO 0.06 0.48 -0.06 -0.55 0.00 0.00 0.00 175.10 175.03 1wdm s SER 92 N -0.34 2.47 -0.27 3.32 0.15 -1.26 -2.75 113.70 115.02 1wdm s SER 92 Ca 0.22 -0.47 0.22 0.00 0.70 0.00 0.00 55.95 56.62 1wdm s SER 92 Cb -0.15 -0.85 0.50 0.00 -1.71 0.00 0.00 66.02 63.81 1wdm s SER 92 CO 0.10 -0.16 1.10 -1.14 1.20 0.00 0.00 173.24 174.34 1wdm n ARG 93 N 4.93 1.77 0.00 5.44 0.63 -1.26 -4.93 116.66 123.23 1wdm n ARG 93 Ca -0.12 -3.52 0.00 0.00 -0.92 0.00 0.00 57.85 53.29 1wdm n ARG 93 Cb 0.49 -1.61 0.00 0.00 0.45 0.00 0.00 32.46 31.79 1wdm n ARG 93 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1wdm n LEU 94 N -0.56 0.00 -0.34 6.15 4.77 -1.26 -2.39 117.00 123.37 1wdm n LEU 94 Ca 0.09 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.22 1wdm n LEU 94 Cb 0.81 0.00 0.34 0.00 -2.33 0.00 0.00 43.42 42.24 1wdm n LEU 94 CO 0.10 0.00 1.15 0.00 -1.33 0.00 0.00 177.39 177.31 1wdm n GLY 96 N -1.32 -0.62 0.44 0.00 0.00 -1.00 -3.94 105.19 98.74 1wdm n GLY 96 Ca 0.24 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 1wdm n GLY 96 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1wdm h SER 97 N 0.53 -1.75 -1.01 1.61 0.02 -1.23 -1.42 113.55 110.30 1wdm h SER 97 Ca 0.00 0.24 0.22 0.00 -0.84 0.00 0.00 61.79 61.41 1wdm h SER 97 Cb 0.12 0.73 -0.12 0.00 0.14 0.00 0.00 62.40 63.27 1wdm h SER 97 CO 0.00 -0.39 0.60 -1.28 -1.14 0.00 0.00 176.83 174.62 1wdm h SER 98 N -0.37 0.71 0.68 3.07 0.87 -1.76 -0.82 113.55 115.94 1wdm h SER 98 Ca 0.09 0.12 -0.21 0.00 -1.23 0.00 0.00 61.79 60.57 1wdm h SER 98 Cb 0.59 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 1wdm h SER 98 CO -0.60 0.17 -0.93 -0.03 -0.53 0.00 0.00 176.83 174.91 1wdm h MET 99 N 0.65 0.15 -0.16 2.24 -1.53 -1.55 -3.13 114.93 111.59 1wdm h MET 99 Ca 0.62 -0.19 -0.09 0.00 -3.44 0.00 0.00 59.70 56.61 1wdm h MET 99 Cb 1.11 0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 32.21 1wdm h MET 99 CO -0.43 0.98 -0.28 0.77 0.14 0.00 0.00 176.91 178.09 1wdm h SER 100 N 0.07 0.30 0.21 1.39 0.02 -0.15 -2.30 113.55 113.09 1wdm h SER 100 Ca -0.05 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1wdm h SER 100 Cb 1.60 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 64.05 1wdm h SER 100 CO 0.14 0.58 -0.16 0.00 -1.14 0.00 0.00 176.83 176.25 1wdm h ALA 101 N 1.45 -0.36 -0.73 3.77 0.00 -1.27 0.19 119.26 122.32 1wdm h ALA 101 Ca 0.04 -0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.04 1wdm h ALA 101 Cb 0.63 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.53 1wdm h ALA 101 CO 0.05 -0.71 0.22 1.25 0.00 0.00 0.00 179.25 180.05 1wdm h LEU 102 N -0.38 0.11 0.46 0.00 5.85 -1.43 -1.27 115.31 118.65 1wdm h LEU 102 Ca -0.01 0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 1wdm h LEU 102 Cb 0.33 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.52 1wdm h LEU 102 CO -0.00 0.01 -0.22 0.45 -0.34 0.00 0.00 178.44 178.34 1wdm h HIS 103 N 0.33 -0.57 -0.65 1.25 3.86 -0.84 -1.48 115.15 117.04 1wdm h HIS 103 Ca 0.41 -0.01 0.13 0.00 -1.16 0.00 0.00 60.37 59.73 1wdm h HIS 103 Cb 0.66 0.19 -0.12 0.00 1.06 0.00 0.00 27.41 29.20 1wdm h HIS 103 CO -0.22 -0.29 -0.15 1.15 0.86 0.00 0.00 177.93 179.27 1wdm h THR 104 N -0.75 0.36 0.42 2.45 2.02 0.09 0.11 112.91 117.60 1wdm h THR 104 Ca -0.06 -0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1wdm h THR 104 Cb 0.54 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1wdm h THR 104 CO 0.10 0.00 -0.20 0.00 0.37 0.00 0.00 175.52 175.79 1wdm h ALA 105 N 1.65 -0.56 -0.47 6.16 0.00 -1.20 -1.71 119.26 123.12 1wdm h ALA 105 Ca 0.32 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.15 1wdm h ALA 105 Cb 0.48 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.40 1wdm h ALA 105 CO -0.66 -0.79 -0.54 0.00 0.00 0.00 0.00 179.25 177.26 1wdm h ALA 106 N -0.05 -0.69 -1.05 0.00 0.00 -0.21 0.67 119.26 117.94 1wdm h ALA 106 Ca -0.06 0.03 0.27 0.00 0.00 0.00 0.00 54.91 55.15 1wdm h ALA 106 Cb 0.46 1.11 -0.11 0.00 0.00 0.00 0.00 17.79 19.26 1wdm h ALA 106 CO 0.09 -1.01 0.66 1.96 0.00 0.00 0.00 179.25 180.95 1wdm h GLN 107 N -0.34 0.41 0.15 0.00 4.20 -0.71 0.17 115.11 118.99 1wdm h GLN 107 Ca 0.10 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1wdm h GLN 107 Cb 0.58 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1wdm h GLN 107 CO -0.63 0.27 -0.07 0.00 -0.67 0.00 0.00 178.83 177.73 1wdm h ALA 108 N 1.65 -0.20 -0.67 3.87 0.00 0.12 -1.70 119.26 122.34 1wdm h ALA 108 Ca 0.63 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.48 1wdm h ALA 108 Cb 1.50 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 19.30 1wdm h ALA 108 CO -0.36 -0.48 0.30 0.82 0.00 0.00 0.00 179.25 179.53 1wdm h ILE 109 N -0.46 0.80 -0.55 0.00 2.04 0.20 -1.98 117.51 117.57 1wdm h ILE 109 Ca -0.02 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1wdm h ILE 109 Cb 0.36 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1wdm h ILE 109 CO 0.03 0.09 0.23 0.24 0.00 0.00 0.00 178.15 178.74 1wdm h MET 110 N 0.51 0.81 0.00 2.37 2.86 -0.84 -2.64 114.93 117.99 1wdm h MET 110 Ca 0.34 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1wdm h MET 110 Cb 0.39 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1wdm h MET 110 CO -0.29 0.70 0.00 0.25 1.06 0.00 0.00 176.91 178.62 1wdm n THR 111 N -4.53 0.16 -1.59 2.22 -2.24 -0.65 -4.88 114.28 102.79 1wdm n THR 111 Ca 0.03 0.04 -0.00 0.00 -2.27 0.00 0.00 64.05 61.84 1wdm n THR 111 Cb 0.15 -0.67 -0.00 0.00 -2.10 0.00 0.00 70.33 67.71 1wdm n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wdm n GLY 112 N 0.57 0.38 2.41 3.38 0.00 -0.96 -4.95 105.19 106.02 1wdm n GLY 112 Ca 0.14 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.88 1wdm n GLY 112 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1wdm n ASN 113 N 1.95 6.11 0.00 1.61 3.02 -0.80 -5.00 115.26 122.15 1wdm n ASN 113 Ca -0.00 -3.77 0.00 0.00 -0.03 0.00 0.00 54.58 50.78 1wdm n ASN 113 Cb 0.30 -0.68 0.00 0.00 -0.61 0.00 0.00 39.78 38.78 1wdm n ASN 113 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdm n GLY 114 N -0.66 2.48 0.00 7.41 0.00 -1.26 -4.74 105.19 108.42 1wdm n GLY 114 Ca 0.49 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1wdm n GLY 114 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wdm n ASP 115 N 0.00 0.57 -3.63 1.61 8.00 -1.26 -4.60 116.55 117.23 1wdm n ASP 115 Ca 0.00 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.26 1wdm n ASP 115 Cb 0.00 0.05 -0.17 0.00 -0.02 0.00 0.00 41.12 40.97 1wdm n ASP 115 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1wdm s VAL 116 N -1.12 -0.06 0.29 2.53 1.01 -1.26 -1.72 120.40 120.07 1wdm s VAL 116 Ca 0.00 -0.02 0.10 0.00 0.00 0.00 0.00 61.98 62.06 1wdm s VAL 116 Cb 0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 1wdm s VAL 116 CO 0.00 -0.15 -0.09 -0.36 0.00 0.00 0.00 175.10 174.50 1wdm s PHE 117 N 2.13 2.48 -0.21 5.22 0.40 0.48 -0.56 117.98 127.92 1wdm s PHE 117 Ca 0.03 -0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.04 1wdm s PHE 117 Cb -0.15 -1.18 0.05 0.00 0.51 0.00 0.00 43.02 42.25 1wdm s PHE 117 CO -0.07 0.63 -0.07 0.08 0.70 0.00 0.00 175.22 176.49 1wdm s VAL 118 N -2.46 1.49 -0.02 -0.44 1.01 -1.13 -1.06 120.40 117.80 1wdm s VAL 118 Ca 0.32 -1.02 0.06 0.00 0.00 0.00 0.00 61.98 61.33 1wdm s VAL 118 Cb -0.04 -1.67 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 1wdm s VAL 118 CO 0.18 0.05 -0.20 0.68 0.00 0.00 0.00 175.10 175.80 1wdm s VAL 119 N 1.44 2.56 0.00 2.92 -7.23 -0.14 -1.83 120.40 118.12 1wdm s VAL 119 Ca -0.03 -0.96 0.00 0.00 -1.81 0.00 0.00 61.98 59.18 1wdm s VAL 119 Cb -0.17 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.80 1wdm s VAL 119 CO -0.07 0.55 0.00 0.61 -0.31 0.00 0.00 175.10 175.88 1wdm n GLY 120 N 2.27 2.92 3.62 2.32 0.00 -0.90 0.55 105.19 115.97 1wdm n GLY 120 Ca -0.17 -0.65 -0.06 0.00 0.00 0.00 0.00 46.02 45.14 1wdm n GLY 120 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wdm s GLY 121 N -0.06 -0.02 0.13 -0.02 0.00 -0.06 -1.31 107.32 105.98 1wdm s GLY 121 Ca 0.00 2.70 0.02 0.00 0.00 0.00 0.00 44.72 47.44 1wdm s GLY 121 CO 0.00 1.43 -0.04 0.54 0.00 0.00 0.00 173.10 175.03 1wdm s VAL 122 N -0.53 0.73 -0.30 1.40 0.11 -0.20 -0.19 120.40 121.42 1wdm s VAL 122 Ca 0.04 -1.96 -0.07 0.00 -2.93 0.00 0.00 61.98 57.05 1wdm s VAL 122 Cb -0.03 -1.85 0.19 0.00 -1.53 0.00 0.00 36.38 33.16 1wdm s VAL 122 CO -0.06 -0.72 0.93 -0.70 -3.33 0.00 0.00 175.10 171.22 1wdm s GLU 123 N -3.86 0.26 -0.95 1.54 2.56 -0.96 -3.69 118.70 113.61 1wdm s GLU 123 Ca 0.17 0.29 -0.12 0.00 0.00 0.00 0.00 54.97 55.30 1wdm s GLU 123 Cb 0.05 0.14 0.24 0.00 2.00 0.00 0.00 34.13 36.56 1wdm s GLU 123 CO -0.01 -0.44 0.92 -1.58 -0.56 0.00 0.00 175.26 173.59 1wdm s HIS 124 N 2.93 3.95 -0.98 5.30 5.65 -1.26 -2.82 115.29 128.05 1wdm s HIS 124 Ca 0.19 -2.26 0.15 0.00 0.25 0.00 0.00 55.06 53.39 1wdm s HIS 124 Cb -0.05 -3.85 0.65 0.00 -1.18 0.00 0.00 32.58 28.15 1wdm s HIS 124 CO -0.22 -0.99 1.48 -1.33 -0.65 0.00 0.00 174.74 173.04 1wdm n MET 125 N 3.55 0.01 0.09 2.88 0.00 -1.26 -1.18 117.12 121.20 1wdm n MET 125 Ca 0.18 0.25 -0.19 0.00 0.00 0.00 0.00 57.70 57.94 1wdm n MET 125 Cb 0.44 -1.51 -0.11 0.00 0.00 0.00 0.00 33.22 32.04 1wdm n MET 125 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 1wdm h GLY 126 N 2.56 0.60 0.89 3.03 0.00 -1.89 -3.15 103.07 105.11 1wdm h GLY 126 Ca 0.00 -1.23 -0.13 0.00 0.00 0.00 0.00 47.33 45.97 1wdm h GLY 126 CO 0.00 1.08 -1.39 1.42 0.00 0.00 0.00 176.54 177.66 1wdm n HIS 127 N -3.75 0.89 -3.40 5.60 8.25 -1.01 -4.57 115.22 117.24 1wdm n HIS 127 Ca -0.11 0.29 -0.26 0.00 -0.26 0.00 0.00 57.72 57.37 1wdm n HIS 127 Cb 0.95 -1.02 -0.09 0.00 1.12 0.00 0.00 29.99 30.95 1wdm n HIS 127 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1wdm n VAL 128 N -2.80 0.20 -1.36 1.59 0.31 -0.32 -4.99 118.33 110.96 1wdm n VAL 128 Ca -0.08 -4.26 -0.42 0.00 -0.01 0.00 0.00 64.34 59.57 1wdm n VAL 128 Cb 0.77 -1.95 -0.00 0.00 -0.91 0.00 0.00 33.84 31.75 1wdm n VAL 128 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1wdm n SER 129 N 1.73 -2.09 0.05 4.52 3.41 -1.19 -4.49 113.62 115.56 1wdm n SER 129 Ca 0.25 0.88 0.06 0.00 -0.26 0.00 0.00 58.87 59.80 1wdm n SER 129 Cb 0.46 -0.96 0.28 0.00 -0.26 0.00 0.00 64.21 63.73 1wdm n SER 129 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 1wdm n MET 130 N 1.07 0.06 -0.22 4.33 3.85 -1.26 -1.16 117.12 123.79 1wdm n MET 130 Ca 0.12 0.45 0.06 0.00 -1.00 0.00 0.00 57.70 57.33 1wdm n MET 130 Cb 0.38 -1.65 0.16 0.00 -1.05 0.00 0.00 33.22 31.07 1wdm n MET 130 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 175.97 174.64 1wdm n MET 131 N -1.76 2.82 -2.75 3.17 2.81 -1.26 -5.00 117.12 115.15 1wdm n MET 131 Ca 0.01 -2.22 -0.42 0.00 -1.81 0.00 0.00 57.70 53.26 1wdm n MET 131 Cb 0.09 -1.40 -0.03 0.00 -0.71 0.00 0.00 33.22 31.17 1wdm n MET 131 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1wdm s HIS 132 N -1.59 3.56 -0.86 2.03 5.04 -0.30 -4.15 115.29 119.01 1wdm s HIS 132 Ca 0.26 1.56 -0.05 0.00 -1.54 0.00 0.00 55.06 55.29 1wdm s HIS 132 Cb 0.17 -3.11 -0.05 0.00 0.04 0.00 0.00 32.58 29.63 1wdm s HIS 132 CO 0.11 -0.12 0.76 0.41 -2.34 0.00 0.00 174.74 173.56 1wdm n GLY 133 N 3.07 -0.89 3.09 1.59 0.00 -1.26 -4.96 105.19 105.83 1wdm n GLY 133 Ca 0.06 0.45 -0.32 0.00 0.00 0.00 0.00 46.02 46.21 1wdm n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wdm s VAL 134 N -3.29 2.00 -0.50 1.61 1.01 -1.26 -5.07 120.40 114.89 1wdm s VAL 134 Ca 0.35 -1.05 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1wdm s VAL 134 Cb -0.05 -1.89 0.13 0.00 0.00 0.00 0.00 36.38 34.58 1wdm s VAL 134 CO 0.63 0.39 0.31 -0.62 0.00 0.00 0.00 175.10 175.82 1wdm s ASP 135 N 1.28 5.30 0.15 3.32 2.15 -1.26 -5.07 116.67 122.54 1wdm s ASP 135 Ca 0.02 -2.36 -0.31 0.00 0.43 0.00 0.00 52.55 50.33 1wdm s ASP 135 Cb -0.15 -1.86 -0.11 0.00 -0.30 0.00 0.00 42.92 40.51 1wdm s ASP 135 CO -0.11 -0.49 1.75 -2.84 -0.17 0.00 0.00 175.17 173.31 1wdm s PRO 136 N 0.67 4.15 -0.34 4.34 0.02 -1.26 -4.95 135.00 137.63 1wdm s PRO 136 Ca 0.12 2.54 -0.23 0.00 0.02 0.00 0.00 61.00 63.45 1wdm s PRO 136 Cb -0.22 -3.38 0.01 0.00 0.02 0.00 0.00 34.50 30.93 1wdm s PRO 136 CO -0.04 -0.77 0.77 1.21 -0.33 0.00 0.00 177.00 177.84 1wdm s ASN 137 N 2.00 6.58 0.41 2.53 2.47 -1.26 -4.94 114.94 122.73 1wdm s ASN 137 Ca 0.77 0.46 0.12 0.00 0.42 0.00 0.00 52.86 54.63 1wdm s ASN 137 Cb -0.46 -2.39 0.95 0.00 -1.45 0.00 0.00 41.25 37.89 1wdm s ASN 137 CO 0.34 -0.68 1.95 -0.65 -3.72 0.00 0.00 177.10 174.34 1wdm h PRO 138 N 8.34 0.50 0.00 0.43 0.11 -2.04 -1.02 132.00 138.33 1wdm h PRO 138 Ca -0.25 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1wdm h PRO 138 Cb 1.10 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1wdm h PRO 138 CO 0.89 0.33 0.00 0.72 -0.21 0.00 0.00 178.00 179.74 1wdm n HIS 139 N -4.48 0.00 -0.03 0.65 8.25 -1.26 -2.08 115.22 116.27 1wdm n HIS 139 Ca 0.12 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.42 1wdm n HIS 139 Cb 0.38 -0.44 -0.09 0.00 1.12 0.00 0.00 29.99 30.97 1wdm n HIS 139 CO 0.00 0.00 0.00 1.98 0.64 0.00 0.00 176.34 178.96 1wdm h MET 140 N 0.00 0.53 0.00 -0.41 -1.53 -1.55 -3.02 114.93 108.95 1wdm h MET 140 Ca 0.00 -0.44 0.00 0.00 -3.44 0.00 0.00 59.70 55.82 1wdm h MET 140 Cb 0.10 0.09 0.00 0.00 -0.55 0.00 0.00 31.60 31.24 1wdm h MET 140 CO 0.00 1.07 0.12 0.43 0.14 0.00 0.00 176.91 178.67 1wdm n SER 141 N -4.21 0.31 0.11 1.39 7.64 -0.88 -0.39 113.62 117.59 1wdm n SER 141 Ca -0.08 0.59 -0.19 0.00 1.01 0.00 0.00 58.87 60.20 1wdm n SER 141 Cb 0.61 -0.60 -0.15 0.00 -1.01 0.00 0.00 64.21 63.07 1wdm n SER 141 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1wdm h LEU 142 N 0.00 0.54 0.00 -3.43 5.85 -1.67 -3.37 115.31 113.22 1wdm h LEU 142 Ca 0.00 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 58.12 1wdm h LEU 142 Cb 0.24 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.09 1wdm h LEU 142 CO 0.00 1.48 -1.57 -1.22 -0.34 0.00 0.00 178.44 176.79 1wdm n TYR 143 N -3.57 0.00 -3.79 1.25 4.02 -0.33 -5.06 117.16 109.69 1wdm n TYR 143 Ca -0.12 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.73 1wdm n TYR 143 Cb 1.05 -0.30 -0.01 0.00 -0.02 0.00 0.00 39.34 40.06 1wdm n TYR 143 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wdm n ALA 144 N -1.94 -0.03 -2.62 -0.72 0.00 0.47 -5.14 120.51 110.53 1wdm n ALA 144 Ca -0.02 -0.44 -0.38 0.00 0.00 0.00 0.00 53.44 52.60 1wdm n ALA 144 Cb 0.37 0.36 -0.10 0.00 0.00 0.00 0.00 19.45 20.08 1wdm n ALA 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wdm s ALA 145 N -2.00 3.57 0.54 0.00 0.00 -1.26 -3.92 121.76 118.68 1wdm s ALA 145 Ca 0.08 -0.90 0.22 0.00 0.00 0.00 0.00 51.96 51.36 1wdm s ALA 145 Cb -0.00 -2.50 1.39 0.00 0.00 0.00 0.00 23.12 22.01 1wdm s ALA 145 CO 0.06 -0.43 2.07 -0.22 0.00 0.00 0.00 175.76 177.24 1wdm h LYS 146 N 7.94 0.00 0.00 0.00 3.64 -1.89 0.22 116.57 126.48 1wdm h LYS 146 Ca -0.35 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 58.98 1wdm h LYS 146 Cb 1.17 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 1wdm h LYS 146 CO 0.62 0.00 -0.22 0.00 -2.27 0.00 0.00 179.45 177.58 1wdm h ALA 147 N 1.84 1.09 0.00 5.00 0.00 -1.98 -2.83 119.26 122.38 1wdm h ALA 147 Ca 0.13 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1wdm h ALA 147 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1wdm h ALA 147 CO -0.00 0.27 0.00 0.43 0.00 0.00 0.00 179.25 179.95 1wdm n SER 148 N -3.48 0.00 -0.05 0.00 7.64 0.07 -2.30 113.62 115.50 1wdm n SER 148 Ca -0.00 0.43 -0.14 0.00 1.01 0.00 0.00 58.87 60.17 1wdm n SER 148 Cb 0.39 -0.45 -0.12 0.00 -1.01 0.00 0.00 64.21 63.02 1wdm n SER 148 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1wdm h GLY 149 N 0.60 0.01 -7.57 0.23 0.00 -1.65 -3.42 103.07 91.26 1wdm h GLY 149 Ca 0.00 -0.02 -0.42 0.00 0.00 0.00 0.00 47.33 46.90 1wdm h GLY 149 CO 0.00 0.02 1.48 1.03 0.00 0.00 0.00 176.54 179.07 1wdm n MET 150 N -4.70 0.96 -0.35 4.80 2.81 -0.97 -4.81 117.12 114.87 1wdm n MET 150 Ca -0.09 -0.09 0.22 0.00 -1.81 0.00 0.00 57.70 55.92 1wdm n MET 150 Cb 0.39 -3.43 0.46 0.00 -0.71 0.00 0.00 33.22 29.93 1wdm n MET 150 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 1wdm h MET 151 N 18.81 0.41 -0.84 0.03 2.86 -1.86 -1.22 114.93 133.12 1wdm h MET 151 Ca -0.21 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.40 1wdm h MET 151 Cb 1.24 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.77 1wdm h MET 151 CO 1.15 0.27 0.50 0.78 1.06 0.00 0.00 176.91 180.68 1wdm h GLY 152 N 0.42 1.22 1.43 8.32 0.00 -1.96 -2.64 103.07 109.87 1wdm h GLY 152 Ca 0.68 -0.51 -0.09 0.00 0.00 0.00 0.00 47.33 47.40 1wdm h GLY 152 CO -0.48 0.50 -0.13 1.41 0.00 0.00 0.00 176.54 177.84 1wdm h LEU 153 N 1.16 0.66 -1.11 3.11 3.38 -1.55 -1.87 115.31 119.09 1wdm h LEU 153 Ca 0.30 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1wdm h LEU 153 Cb -0.04 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.53 1wdm h LEU 153 CO -0.06 0.82 0.00 0.71 0.09 0.00 0.00 178.44 180.00 1wdm h THR 154 N 0.61 0.00 0.14 0.22 1.35 -1.33 -0.61 112.91 113.28 1wdm h THR 154 Ca 0.10 -0.14 -0.33 0.00 -0.55 0.00 0.00 66.41 65.49 1wdm h THR 154 Cb 0.58 0.79 -0.01 0.00 -1.73 0.00 0.00 68.15 67.78 1wdm h THR 154 CO 0.04 0.00 -1.74 0.00 -0.25 0.00 0.00 175.52 173.57 1wdm h ALA 155 N 2.14 0.27 -0.27 6.62 0.00 -1.19 -3.21 119.26 123.61 1wdm h ALA 155 Ca 0.00 -1.23 0.06 0.00 0.00 0.00 0.00 54.91 53.74 1wdm h ALA 155 Cb 0.21 0.58 -0.06 0.00 0.00 0.00 0.00 17.79 18.51 1wdm h ALA 155 CO 0.00 1.07 -0.13 0.93 0.00 0.00 0.00 179.25 181.12 1wdm h GLU 156 N -0.07 -0.09 -0.32 0.00 4.39 -0.56 0.92 114.58 118.85 1wdm h GLU 156 Ca -0.37 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.32 1wdm h GLU 156 Cb 1.95 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 30.60 1wdm h GLU 156 CO 0.09 -0.06 0.14 1.98 -1.16 0.00 0.00 179.01 180.00 1wdm h MET 157 N -0.09 0.48 -0.43 2.33 4.05 -1.43 -1.47 114.93 118.36 1wdm h MET 157 Ca 0.14 -0.08 -0.04 0.00 -0.28 0.00 0.00 59.70 59.45 1wdm h MET 157 Cb 0.31 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.01 1wdm h MET 157 CO -0.33 0.47 0.12 1.25 0.23 0.00 0.00 176.91 178.64 1wdm h LEU 158 N 0.38 0.58 -0.16 3.39 6.46 -1.48 -1.43 115.31 123.05 1wdm h LEU 158 Ca 0.11 -0.08 -0.01 0.00 -0.12 0.00 0.00 57.88 57.78 1wdm h LEU 158 Cb 0.16 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1wdm h LEU 158 CO -0.01 0.57 0.06 1.23 -0.62 0.00 0.00 178.44 179.67 1wdm h GLY 159 N 0.83 0.26 0.83 3.75 0.00 -0.40 -2.00 103.07 106.34 1wdm h GLY 159 Ca 0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1wdm h GLY 159 CO -0.01 0.14 -0.17 0.50 0.00 0.00 0.00 176.54 177.00 1wdm h LYS 160 N 0.10 -0.46 -0.54 4.80 1.57 -0.98 0.48 116.57 121.53 1wdm h LYS 160 Ca 0.05 0.03 0.16 0.00 -1.87 0.00 0.00 60.65 59.02 1wdm h LYS 160 Cb 0.19 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 1wdm h LYS 160 CO -0.00 -0.21 0.45 0.52 -0.57 0.00 0.00 179.45 179.64 1wdm h MET 161 N -0.65 0.00 -0.33 3.15 2.86 -1.29 0.21 114.93 118.87 1wdm h MET 161 Ca -0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1wdm h MET 161 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1wdm h MET 161 CO 0.08 0.00 0.00 0.72 1.06 0.00 0.00 176.91 178.77 1wdm n HIS 162 N -4.09 0.44 -3.67 -0.22 8.25 -0.75 -5.02 115.22 110.16 1wdm n HIS 162 Ca 0.10 -0.42 -0.29 0.00 -0.26 0.00 0.00 57.72 56.86 1wdm n HIS 162 Cb 0.67 -0.02 0.03 0.00 1.12 0.00 0.00 29.99 31.79 1wdm n HIS 162 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wdm n GLY 163 N 0.66 -1.06 3.67 -1.41 0.00 0.14 -4.96 105.19 102.23 1wdm n GLY 163 Ca 0.12 0.47 -0.36 0.00 0.00 0.00 0.00 46.02 46.25 1wdm n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wdm s ILE 164 N -3.35 5.35 0.37 -0.61 1.09 0.40 -5.01 121.20 119.45 1wdm s ILE 164 Ca 0.36 0.23 -0.13 0.00 -1.10 0.00 0.00 60.65 60.01 1wdm s ILE 164 Cb -0.14 -3.52 -0.08 0.00 -1.06 0.00 0.00 42.46 37.67 1wdm s ILE 164 CO 0.86 0.35 0.77 -0.94 -0.10 0.00 0.00 174.94 175.88 1wdm s SER 165 N 0.98 6.65 0.45 3.58 1.04 -1.26 -4.78 113.70 120.36 1wdm s SER 165 Ca 0.09 1.23 0.16 0.00 0.48 0.00 0.00 55.95 57.91 1wdm s SER 165 Cb -0.13 -2.36 1.10 0.00 0.10 0.00 0.00 66.02 64.73 1wdm s SER 165 CO 0.04 -0.32 1.97 -0.09 0.98 0.00 0.00 173.24 175.82 1wdm h ARG 166 N 1.72 0.33 0.25 4.02 9.65 -1.95 -0.28 114.38 128.11 1wdm h ARG 166 Ca -0.47 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.37 1wdm h ARG 166 Cb 1.18 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.69 1wdm h ARG 166 CO 0.64 0.22 -0.12 0.93 2.80 0.00 0.00 179.97 184.44 1wdm h GLU 167 N 0.34 -0.32 -0.99 0.20 3.07 -1.95 -1.70 114.58 113.23 1wdm h GLU 167 Ca 0.29 0.02 0.16 0.00 -0.50 0.00 0.00 59.36 59.34 1wdm h GLU 167 Cb 0.70 0.07 -0.09 0.00 -0.84 0.00 0.00 28.75 28.59 1wdm h GLU 167 CO -0.07 -0.00 0.62 1.96 -1.40 0.00 0.00 179.01 180.11 1wdm h GLN 168 N -0.65 0.80 0.48 2.33 4.20 -1.56 -0.17 115.11 120.54 1wdm h GLN 168 Ca -0.03 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 1wdm h GLN 168 Cb 0.46 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1wdm h GLN 168 CO 0.06 0.53 -0.23 1.96 -0.67 0.00 0.00 178.83 180.48 1wdm h GLN 169 N 0.83 -0.62 -1.08 1.46 4.20 -1.05 -2.54 115.11 116.30 1wdm h GLN 169 Ca 0.53 0.04 0.29 0.00 0.06 0.00 0.00 58.65 59.58 1wdm h GLN 169 Cb 0.74 0.14 -0.10 0.00 0.30 0.00 0.00 27.48 28.57 1wdm h GLN 169 CO -0.31 -0.41 0.70 -0.44 -0.67 0.00 0.00 178.83 177.69 1wdm h ASP 170 N -1.04 0.41 -0.20 1.46 3.32 -1.04 0.20 116.42 119.52 1wdm h ASP 170 Ca -0.07 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1wdm h ASP 170 Cb 0.49 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1wdm h ASP 170 CO 0.11 0.04 0.08 0.00 -1.72 0.00 0.00 179.24 177.75 1wdm h ALA 171 N 1.62 0.26 -0.05 3.45 0.00 -1.02 -1.50 119.26 122.02 1wdm h ALA 171 Ca 0.63 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.38 1wdm h ALA 171 Cb 1.67 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1wdm h ALA 171 CO -0.31 -0.14 -0.18 0.35 0.00 0.00 0.00 179.25 178.96 1wdm h PHE 172 N 0.17 0.08 0.77 0.00 3.57 -0.25 -2.33 116.94 118.96 1wdm h PHE 172 Ca 0.07 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 1wdm h PHE 172 Cb 0.18 -0.02 0.01 0.00 2.79 0.00 0.00 35.95 38.90 1wdm h PHE 172 CO -0.01 0.26 -0.37 0.00 -2.23 0.00 0.00 178.31 175.96 1wdm h ALA 173 N 1.74 -1.04 -0.28 2.41 0.00 -0.62 -1.83 119.26 119.64 1wdm h ALA 173 Ca 0.01 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.78 1wdm h ALA 173 Cb 0.37 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1wdm h ALA 173 CO 0.03 -0.96 0.38 0.28 0.00 0.00 0.00 179.25 178.97 1wdm h VAL 174 N -1.28 0.30 -0.05 0.00 2.07 -1.15 0.26 116.25 116.42 1wdm h VAL 174 Ca -0.11 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 1wdm h VAL 174 Cb 0.79 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1wdm h VAL 174 CO 0.17 0.00 -0.14 -0.09 0.02 0.00 0.00 177.57 177.53 1wdm h ARG 175 N 0.00 0.18 -0.01 1.57 1.12 -1.09 -2.28 114.38 113.87 1wdm h ARG 175 Ca 0.13 -0.13 0.02 0.00 -1.11 0.00 0.00 59.98 58.90 1wdm h ARG 175 Cb 0.89 0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 30.85 1wdm h ARG 175 CO -0.00 0.75 -0.13 1.03 -3.11 0.00 0.00 179.97 178.51 1wdm h SER 176 N -0.36 -0.37 0.10 -3.80 0.87 -0.11 -0.28 113.55 109.59 1wdm h SER 176 Ca -0.00 0.06 0.02 0.00 -1.23 0.00 0.00 61.79 60.63 1wdm h SER 176 Cb 0.77 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.85 1wdm h SER 176 CO 0.03 -0.18 -0.22 0.45 -0.53 0.00 0.00 176.83 176.38 1wdm h HIS 177 N -0.21 -0.59 0.51 2.24 3.86 -1.51 -0.05 115.15 119.41 1wdm h HIS 177 Ca 0.05 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.26 1wdm h HIS 177 Cb 0.27 0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.97 1wdm h HIS 177 CO -0.19 -0.32 -0.44 1.96 0.86 0.00 0.00 177.93 179.80 1wdm h GLN 178 N -0.40 -0.91 -0.92 2.45 7.50 -1.24 0.17 115.11 121.76 1wdm h GLN 178 Ca 0.03 0.06 0.13 0.00 0.50 0.00 0.00 58.65 59.37 1wdm h GLN 178 Cb 0.44 0.21 -0.07 0.00 0.05 0.00 0.00 27.48 28.10 1wdm h GLN 178 CO -0.14 -0.61 0.59 -0.07 -1.50 0.00 0.00 178.83 177.11 1wdm h LEU 179 N -0.94 0.76 -0.02 1.46 3.38 -0.99 0.55 115.31 119.50 1wdm h LEU 179 Ca -0.06 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1wdm h LEU 179 Cb 0.81 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 1wdm h LEU 179 CO -0.02 0.40 0.00 0.00 0.09 0.00 0.00 178.44 178.91 1wdm h ALA 180 N 1.58 0.03 -0.42 1.53 0.00 -0.60 -1.33 119.26 120.04 1wdm h ALA 180 Ca 0.45 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.24 1wdm h ALA 180 Cb 0.60 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1wdm h ALA 180 CO -0.22 -0.33 0.26 1.25 0.00 0.00 0.00 179.25 180.21 1wdm h HIS 181 N -0.22 0.48 0.17 0.00 -0.00 0.59 -0.83 115.15 115.34 1wdm h HIS 181 Ca 0.01 0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.41 1wdm h HIS 181 Cb 0.28 -0.16 -0.04 0.00 -0.00 0.00 0.00 27.41 27.49 1wdm h HIS 181 CO 0.02 0.29 -0.44 -0.22 -0.00 0.00 0.00 177.93 177.58 1wdm h LYS 182 N 0.52 -0.68 -0.71 5.26 3.64 0.19 -1.20 116.57 123.59 1wdm h LYS 182 Ca 0.17 0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.68 1wdm h LYS 182 Cb -0.01 0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 31.92 1wdm h LYS 182 CO -0.07 -0.45 0.47 0.00 -2.27 0.00 0.00 179.45 177.13 1wdm h ALA 183 N -0.30 1.83 0.37 5.00 0.00 -1.02 -1.84 119.26 123.31 1wdm h ALA 183 Ca 0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1wdm h ALA 183 Cb 0.71 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1wdm h ALA 183 CO -0.22 0.03 -0.18 1.15 0.00 0.00 0.00 179.25 180.03 1wdm h THR 184 N 0.63 0.64 0.25 0.00 2.02 -0.37 0.16 112.91 116.25 1wdm h THR 184 Ca 0.32 -0.20 0.01 0.00 0.77 0.00 0.00 66.41 67.31 1wdm h THR 184 Cb 0.43 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.55 1wdm h THR 184 CO -0.11 0.04 -0.42 0.58 0.37 0.00 0.00 175.52 175.98 1wdm h VAL 185 N -0.61 0.15 0.00 3.16 2.07 -0.68 -0.73 116.25 119.61 1wdm h VAL 185 Ca -0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1wdm h VAL 185 Cb 0.45 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1wdm h VAL 185 CO 0.08 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 177.05 1wdm n GLU 186 N -5.48 0.34 -2.23 1.57 1.02 -0.74 -4.76 120.64 110.35 1wdm n GLU 186 Ca -0.09 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.91 1wdm n GLU 186 Cb 0.39 -1.08 -0.02 0.00 -0.02 0.00 0.00 31.44 30.71 1wdm n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wdm n GLY 187 N 0.08 -0.15 0.00 0.62 0.00 -0.28 -4.79 105.19 100.68 1wdm n GLY 187 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1wdm n GLY 187 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wdm n LYS 188 N -2.67 0.28 0.00 1.61 4.76 0.56 -2.06 118.16 120.64 1wdm n LYS 188 Ca -0.16 0.10 0.06 0.00 -2.87 0.00 0.00 58.31 55.44 1wdm n LYS 188 Cb 0.59 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.23 1wdm n LYS 188 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1wdm n PHE 189 N -1.28 0.00 -0.22 2.13 0.99 -1.23 -4.65 117.46 113.20 1wdm n PHE 189 Ca 0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 57.45 57.50 1wdm n PHE 189 Cb 0.15 0.00 0.06 0.00 -1.00 0.00 0.00 39.48 38.69 1wdm n PHE 189 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1wdm h LYS 190 N 0.29 0.72 -0.59 -1.08 3.64 -1.75 -0.33 116.57 117.47 1wdm h LYS 190 Ca 0.00 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1wdm h LYS 190 Cb 0.32 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 1wdm h LYS 190 CO 0.00 0.48 0.34 -0.44 -2.27 0.00 0.00 179.45 177.56 1wdm h ASP 191 N 0.75 0.71 0.33 4.20 3.32 -1.83 -3.24 116.42 120.65 1wdm h ASP 191 Ca 0.25 -0.04 -0.26 0.00 0.02 0.00 0.00 57.03 57.00 1wdm h ASP 191 Cb 0.03 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.35 1wdm h ASP 191 CO -0.11 0.56 -1.90 -1.84 -1.72 0.00 0.00 179.24 174.23 1wdm n GLU 192 N -4.40 0.65 -2.68 3.56 0.28 -1.08 -4.92 120.64 112.05 1wdm n GLU 192 Ca 0.06 0.13 -0.42 0.00 -0.16 0.00 0.00 57.16 56.77 1wdm n GLU 192 Cb 0.08 -1.68 -0.04 0.00 1.43 0.00 0.00 31.44 31.24 1wdm n GLU 192 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1wdm s ILE 193 N -2.72 4.58 -0.33 3.84 1.01 -0.16 -1.26 121.20 126.17 1wdm s ILE 193 Ca -0.06 1.99 -0.08 0.00 0.00 0.00 0.00 60.65 62.49 1wdm s ILE 193 Cb 0.08 -4.27 0.02 0.00 0.01 0.00 0.00 42.46 38.30 1wdm s ILE 193 CO 0.83 0.23 0.13 -0.63 0.00 0.00 0.00 174.94 175.50 1wdm s ILE 194 N 0.53 4.19 0.53 2.92 -1.09 -0.30 -4.88 121.20 123.09 1wdm s ILE 194 Ca 0.50 -0.77 -0.18 0.00 -2.23 0.00 0.00 60.65 57.97 1wdm s ILE 194 Cb -0.23 -3.24 -0.11 0.00 -1.58 0.00 0.00 42.46 37.29 1wdm s ILE 194 CO 0.29 -0.05 0.30 -2.65 -1.23 0.00 0.00 174.94 171.60 1wdm n PRO 195 N 4.91 0.34 -3.62 2.79 -0.02 -1.26 -4.41 135.00 133.73 1wdm n PRO 195 Ca -0.13 0.13 -0.15 0.00 -2.02 0.00 0.00 63.50 61.33 1wdm n PRO 195 Cb 0.47 -1.43 -0.07 0.00 -0.02 0.00 0.00 33.50 32.45 1wdm n PRO 195 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1wdm s MET 196 N -1.65 0.86 0.31 -0.52 1.75 -0.92 -4.96 119.30 114.17 1wdm s MET 196 Ca 0.64 0.84 -0.29 0.00 -1.25 0.00 0.00 55.69 55.63 1wdm s MET 196 Cb -0.48 0.42 -0.11 0.00 2.84 0.00 0.00 34.83 37.50 1wdm s MET 196 CO 0.59 -0.14 1.48 -0.65 -0.65 0.00 0.00 175.02 175.65 1wdm s GLN 197 N 0.07 4.19 0.31 4.11 -0.21 -1.26 -1.50 119.66 125.37 1wdm s GLN 197 Ca -0.02 2.46 -0.05 0.00 0.02 0.00 0.00 55.36 57.77 1wdm s GLN 197 Cb -0.04 -3.03 0.02 0.00 1.00 0.00 0.00 33.01 30.96 1wdm s GLN 197 CO 0.03 -0.49 0.49 0.41 -2.12 0.00 0.00 175.29 173.61 1wdm n GLY 198 N 1.44 1.93 2.94 3.09 0.00 0.16 -4.89 105.19 109.86 1wdm n GLY 198 Ca 0.04 -1.48 -0.25 0.00 0.00 0.00 0.00 46.02 44.33 1wdm n GLY 198 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wdm s TYR 199 N -3.22 1.39 1.10 1.61 1.51 -1.10 -1.18 117.35 117.47 1wdm s TYR 199 Ca 0.22 -0.61 -0.18 0.00 -1.01 0.00 0.00 57.07 55.49 1wdm s TYR 199 Cb -0.02 -1.12 0.25 0.00 -0.11 0.00 0.00 41.96 40.96 1wdm s TYR 199 CO 0.16 -0.40 1.18 0.16 -1.11 0.00 0.00 175.55 175.54 1wdm s ASP 200 N 1.31 1.82 0.05 2.29 1.47 -1.01 -4.16 116.67 118.42 1wdm s ASP 200 Ca -0.03 0.54 -0.09 0.00 1.18 0.00 0.00 52.55 54.15 1wdm s ASP 200 Cb -0.14 -0.74 -0.02 0.00 -0.34 0.00 0.00 42.92 41.68 1wdm s ASP 200 CO -0.03 -3.56 0.85 -0.62 0.68 0.00 0.00 175.17 172.48 1wdm n GLU 201 N -4.37 -0.13 0.11 2.11 4.71 -1.26 0.15 120.64 121.96 1wdm n GLU 201 Ca 0.13 0.84 0.08 0.00 -0.01 0.00 0.00 57.16 58.20 1wdm n GLU 201 Cb 0.59 -1.24 0.42 0.00 -1.01 0.00 0.00 31.44 30.20 1wdm n GLU 201 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1wdm n ASN 202 N -3.62 0.41 0.00 1.62 3.02 -1.26 -4.82 115.26 110.61 1wdm n ASN 202 Ca 0.01 0.67 0.00 0.00 -0.03 0.00 0.00 54.58 55.23 1wdm n ASN 202 Cb 0.08 -0.73 0.00 0.00 -0.61 0.00 0.00 39.78 38.51 1wdm n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdm n GLY 203 N -1.12 1.04 3.71 7.41 0.00 0.40 -5.06 105.19 111.56 1wdm n GLY 203 Ca -0.00 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 1wdm n GLY 203 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wdm s PHE 204 N -2.00 3.60 0.05 1.61 0.40 -1.25 -4.76 117.98 115.63 1wdm s PHE 204 Ca 0.00 1.55 -0.31 0.00 -0.60 0.00 0.00 56.93 57.57 1wdm s PHE 204 Cb 0.00 -3.05 -0.06 0.00 0.51 0.00 0.00 43.02 40.42 1wdm s PHE 204 CO 0.00 -0.03 1.34 -1.17 0.70 0.00 0.00 175.22 176.05 1wdm s LEU 205 N 1.19 4.34 0.22 -0.37 2.96 -1.26 -2.42 118.68 123.34 1wdm s LEU 205 Ca 0.47 2.14 -0.23 0.00 -0.22 0.00 0.00 54.13 56.29 1wdm s LEU 205 Cb -0.19 -3.57 0.04 0.00 0.50 0.00 0.00 46.19 42.96 1wdm s LEU 205 CO 0.23 -0.63 0.83 -1.59 -1.32 0.00 0.00 176.35 173.87 1wdm s LYS 206 N 1.65 1.51 -0.07 1.98 -2.85 -0.32 -4.99 119.74 116.65 1wdm s LYS 206 Ca 0.62 -0.83 -0.14 0.00 -1.00 0.00 0.00 55.97 54.63 1wdm s LYS 206 Cb -0.32 0.52 -0.05 0.00 -2.06 0.00 0.00 37.83 35.91 1wdm s LYS 206 CO 0.28 -0.69 0.34 0.42 0.10 0.00 0.00 175.35 175.80 1wdm s ILE 207 N -3.63 5.19 -0.02 3.79 1.01 -1.26 0.38 121.20 126.66 1wdm s ILE 207 Ca 0.11 0.67 0.03 0.00 0.00 0.00 0.00 60.65 61.46 1wdm s ILE 207 Cb -0.04 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.75 1wdm s ILE 207 CO 0.04 0.51 -0.08 -0.36 0.00 0.00 0.00 174.94 175.06 1wdm s PHE 208 N -0.51 2.88 -0.00 3.97 0.40 -0.56 -4.92 117.98 119.23 1wdm s PHE 208 Ca 0.21 -0.03 0.00 0.00 -0.60 0.00 0.00 56.93 56.50 1wdm s PHE 208 Cb -0.15 -1.64 0.00 0.00 0.51 0.00 0.00 43.02 41.74 1wdm s PHE 208 CO 0.09 0.35 0.72 -0.40 0.70 0.00 0.00 175.22 176.68 1wdm n ASP 209 N 1.81 0.00 -4.08 1.36 5.75 -1.26 -2.17 116.55 117.96 1wdm n ASP 209 Ca -0.16 -1.45 -0.26 0.00 -0.01 0.00 0.00 54.79 52.90 1wdm n ASP 209 Cb 0.53 -0.09 -0.08 0.00 -1.03 0.00 0.00 41.12 40.45 1wdm n ASP 209 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 1wdm s TYR 210 N -0.00 1.78 -0.27 2.11 -0.85 -1.26 -4.95 117.35 113.90 1wdm s TYR 210 Ca 0.00 -1.32 -0.05 0.00 -0.52 0.00 0.00 57.07 55.18 1wdm s TYR 210 Cb 0.00 -1.16 0.01 0.00 0.38 0.00 0.00 41.96 41.19 1wdm s TYR 210 CO 0.00 -0.32 0.03 -0.51 -1.52 0.00 0.00 175.55 173.22 1wdm s ASP 211 N -3.63 4.81 0.24 -0.18 1.01 -1.26 -4.48 116.67 113.18 1wdm s ASP 211 Ca 0.22 -0.73 -0.06 0.00 0.71 0.00 0.00 52.55 52.68 1wdm s ASP 211 Cb 0.02 -1.80 0.25 0.00 1.01 0.00 0.00 42.92 42.40 1wdm s ASP 211 CO 0.14 -0.16 1.89 -0.33 0.21 0.00 0.00 175.17 176.93 1wdm h GLU 212 N 8.15 1.27 -0.88 8.23 5.08 -1.78 -3.09 114.58 131.56 1wdm h GLU 212 Ca -0.32 -0.12 0.23 0.00 -1.00 0.00 0.00 59.36 58.15 1wdm h GLU 212 Cb 1.12 -0.26 -0.14 0.00 0.50 0.00 0.00 28.75 29.97 1wdm h GLU 212 CO 0.59 0.89 0.27 1.79 -1.00 0.00 0.00 179.01 181.55 1wdm h THR 213 N 1.29 0.35 -2.33 1.13 1.35 -1.80 -3.42 112.91 109.47 1wdm h THR 213 Ca 0.33 -0.08 -0.57 0.00 -0.55 0.00 0.00 66.41 65.54 1wdm h THR 213 Cb -0.05 0.09 0.05 0.00 -1.73 0.00 0.00 68.15 66.51 1wdm h THR 213 CO -0.06 0.04 0.90 -0.38 -0.25 0.00 0.00 175.52 175.77 1wdm n ILE 214 N -5.19 0.10 -3.79 6.82 5.41 -0.80 -4.86 119.36 117.06 1wdm n ILE 214 Ca 0.21 -0.02 -0.28 0.00 1.00 0.00 0.00 62.75 63.66 1wdm n ILE 214 Cb 0.68 -1.71 -0.12 0.00 -0.71 0.00 0.00 39.64 37.78 1wdm n ILE 214 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1wdm s ARG 215 N 1.49 1.90 0.65 0.38 6.06 -1.26 -4.98 118.95 123.19 1wdm s ARG 215 Ca 0.80 -2.77 0.37 0.00 -2.50 0.00 0.00 55.73 51.63 1wdm s ARG 215 Cb -0.63 -2.87 2.03 0.00 0.06 0.00 0.00 34.95 33.54 1wdm s ARG 215 CO 0.38 -1.25 2.14 -1.35 -2.50 0.00 0.00 175.30 172.73 1wdm h PRO 216 N 5.87 0.00 -0.88 5.12 0.11 -1.93 -2.53 132.00 137.76 1wdm h PRO 216 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1wdm h PRO 216 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1wdm h PRO 216 CO 0.61 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.00 1wdm n ASP 217 N -2.95 1.25 -4.69 -2.05 5.75 -1.26 -4.84 116.55 107.76 1wdm n ASP 217 Ca -0.02 -2.06 -0.40 0.00 -0.01 0.00 0.00 54.79 52.29 1wdm n ASP 217 Cb 0.20 -0.47 -0.05 0.00 -1.03 0.00 0.00 41.12 39.78 1wdm n ASP 217 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1wdm s THR 218 N -1.21 4.98 0.04 2.12 2.01 -0.96 -4.96 115.64 117.66 1wdm s THR 218 Ca 0.04 1.44 -0.00 0.00 0.31 0.00 0.00 61.69 63.48 1wdm s THR 218 Cb 0.03 -4.05 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 1wdm s THR 218 CO 0.01 0.14 -0.04 0.42 -0.69 0.00 0.00 174.62 174.47 1wdm s THR 219 N 1.54 0.24 0.53 -0.82 -4.23 -1.26 -4.85 115.64 106.78 1wdm s THR 219 Ca 0.36 -1.33 0.31 0.00 -1.18 0.00 0.00 61.69 59.85 1wdm s THR 219 Cb -0.17 -0.86 0.49 0.00 1.34 0.00 0.00 72.50 73.30 1wdm s THR 219 CO 0.14 -0.70 1.86 -0.07 -0.54 0.00 0.00 174.62 175.32 1wdm h LEU 220 N 3.96 0.04 -0.82 4.79 3.38 -1.97 0.44 115.31 125.14 1wdm h LEU 220 Ca -0.33 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.52 1wdm h LEU 220 Cb 1.18 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1wdm h LEU 220 CO 0.52 0.01 -0.39 -0.33 0.09 0.00 0.00 178.44 178.34 1wdm h GLU 221 N 0.04 0.41 0.13 1.13 3.07 -1.99 -2.06 114.58 115.31 1wdm h GLU 221 Ca 0.47 -0.20 -0.31 0.00 -0.50 0.00 0.00 59.36 58.82 1wdm h GLU 221 Cb 1.80 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.70 1wdm h GLU 221 CO -0.03 0.74 -1.50 0.66 -1.40 0.00 0.00 179.01 177.48 1wdm h SER 222 N 0.34 0.44 1.35 1.42 4.64 -0.57 -3.31 113.55 117.87 1wdm h SER 222 Ca 0.03 -0.58 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 1wdm h SER 222 Cb 0.84 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1wdm h SER 222 CO 0.07 1.48 0.00 -0.07 -0.87 0.00 0.00 176.83 177.44 1wdm h LEU 223 N 0.08 0.00 -0.47 5.97 3.38 -1.13 -2.92 115.31 120.22 1wdm h LEU 223 Ca -0.24 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.56 1wdm h LEU 223 Cb 2.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.76 1wdm h LEU 223 CO 0.18 0.00 -0.75 0.00 0.09 0.00 0.00 178.44 177.96 1wdm h ALA 224 N 2.21 0.69 0.00 1.53 0.00 -1.45 -3.10 119.26 119.14 1wdm h ALA 224 Ca 0.00 -0.64 -0.05 0.00 0.00 0.00 0.00 54.91 54.22 1wdm h ALA 224 Cb 0.68 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1wdm h ALA 224 CO 0.00 0.84 -0.23 0.00 0.00 0.00 0.00 179.25 179.86 1wdm h ALA 225 N 1.10 1.12 -2.76 0.00 0.00 -1.60 -3.45 119.26 113.66 1wdm h ALA 225 Ca -0.02 -0.21 -0.54 0.00 0.00 0.00 0.00 54.91 54.13 1wdm h ALA 225 Cb 1.32 -0.04 0.18 0.00 0.00 0.00 0.00 17.79 19.25 1wdm h ALA 225 CO 0.11 0.29 0.37 1.28 0.00 0.00 0.00 179.25 181.30 1wdm n LEU 226 N -3.53 4.84 -4.63 0.00 4.77 -1.17 -5.03 117.00 112.24 1wdm n LEU 226 Ca -0.01 0.66 -0.31 0.00 -0.03 0.00 0.00 56.01 56.33 1wdm n LEU 226 Cb 0.38 -1.52 -0.09 0.00 -2.33 0.00 0.00 43.42 39.87 1wdm n LEU 226 CO 0.33 -1.51 -0.37 -1.59 -1.33 0.00 0.00 177.39 172.92 1wdm s LYS 227 N -3.84 2.43 -0.22 3.23 0.00 -1.26 -5.05 119.74 115.03 1wdm s LYS 227 Ca 0.76 -0.86 -0.40 0.00 0.00 0.00 0.00 55.97 55.47 1wdm s LYS 227 Cb -0.32 -2.46 -0.16 0.00 0.00 0.00 0.00 37.83 34.88 1wdm s LYS 227 CO 0.48 0.55 1.66 -2.30 0.00 0.00 0.00 175.35 175.73 1wdm n PRO 228 N 0.87 1.10 0.10 1.78 -0.02 -1.26 -4.38 135.00 133.19 1wdm n PRO 228 Ca -0.13 0.40 -0.01 0.00 -2.02 0.00 0.00 63.50 61.75 1wdm n PRO 228 Cb 0.52 -2.07 -0.03 0.00 -0.02 0.00 0.00 33.50 31.90 1wdm n PRO 228 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wdm h ALA 229 N 6.59 0.59 0.00 3.55 0.00 -1.75 -3.42 119.26 124.83 1wdm h ALA 229 Ca -0.47 -0.65 -0.19 0.00 0.00 0.00 0.00 54.91 53.61 1wdm h ALA 229 Cb 1.32 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1wdm h ALA 229 CO 0.92 0.85 -1.64 1.19 0.00 0.00 0.00 179.25 180.58 1wdm n PHE 230 N -3.21 0.00 -3.52 0.00 3.01 -1.25 -4.92 117.46 107.56 1wdm n PHE 230 Ca -0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 1wdm n PHE 230 Cb 0.81 -0.41 -0.07 0.00 -0.01 0.00 0.00 39.48 39.79 1wdm n PHE 230 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1wdm s ASN 231 N -5.85 5.82 0.03 4.37 3.84 -1.26 -4.99 114.94 116.89 1wdm s ASN 231 Ca -0.16 -2.12 -0.06 0.00 0.21 0.00 0.00 52.86 50.73 1wdm s ASN 231 Cb 0.06 -2.03 -0.02 0.00 -0.55 0.00 0.00 41.25 38.70 1wdm s ASN 231 CO 0.21 -0.65 1.10 -0.65 -2.79 0.00 0.00 177.10 174.32 1wdm h PRO 232 N 8.22 -0.06 -5.52 0.43 0.11 -1.92 -1.61 132.00 131.66 1wdm h PRO 232 Ca -0.15 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.31 1wdm h PRO 232 Cb 1.06 0.01 -0.14 0.00 0.11 0.00 0.00 31.00 32.04 1wdm h PRO 232 CO 0.84 -0.04 1.11 0.15 -0.21 0.00 0.00 178.00 179.86 1wdm s LYS 233 N -3.49 3.57 0.00 1.05 3.01 -1.26 -4.12 119.74 118.50 1wdm s LYS 233 Ca -0.03 -1.43 0.00 0.00 -1.01 0.00 0.00 55.97 53.50 1wdm s LYS 233 Cb 0.02 -5.07 0.00 0.00 -1.01 0.00 0.00 37.83 31.77 1wdm s LYS 233 CO 0.12 -1.97 0.00 0.41 0.51 0.00 0.00 175.35 174.42 1wdm n GLY 234 N 6.08 0.51 3.92 -3.33 0.00 -1.25 -5.10 105.19 106.02 1wdm n GLY 234 Ca 0.26 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1wdm n GLY 234 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wdm s GLY 235 N -1.82 2.05 -0.05 -0.02 0.00 -0.60 -4.95 107.32 101.93 1wdm s GLY 235 Ca 0.00 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 43.87 1wdm s GLY 235 CO 0.00 -0.84 -0.03 -1.30 0.00 0.00 0.00 173.10 170.92 1wdm n THR 236 N -0.00 0.30 -2.74 0.90 -2.24 -1.26 -4.74 114.28 104.50 1wdm n THR 236 Ca -0.05 -0.13 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 1wdm n THR 236 Cb 0.52 -0.74 -0.03 0.00 -2.10 0.00 0.00 70.33 67.98 1wdm n THR 236 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1wdm s VAL 237 N -2.11 4.83 0.43 2.28 1.01 -1.26 -4.76 120.40 120.82 1wdm s VAL 237 Ca -0.06 1.95 0.03 0.00 0.00 0.00 0.00 61.98 63.90 1wdm s VAL 237 Cb 0.02 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 1wdm s VAL 237 CO 0.14 0.04 0.05 0.42 0.00 0.00 0.00 175.10 175.75 1wdm s THR 238 N 1.83 1.14 -0.37 3.92 -4.23 -1.26 -2.20 115.64 114.46 1wdm s THR 238 Ca 0.47 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.20 1wdm s THR 238 Cb -0.18 -2.46 0.23 0.00 1.34 0.00 0.00 72.50 71.43 1wdm s THR 238 CO 0.18 0.00 1.69 0.00 -0.54 0.00 0.00 174.62 175.95 1wdm n ALA 239 N -1.02 1.41 0.04 3.99 0.00 -1.26 -2.51 120.51 121.15 1wdm n ALA 239 Ca -0.10 0.13 -0.03 0.00 0.00 0.00 0.00 53.44 53.44 1wdm n ALA 239 Cb 0.66 -1.36 -0.08 0.00 0.00 0.00 0.00 19.45 18.67 1wdm n ALA 239 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1wdm h GLY 240 N 1.33 0.00 -2.71 0.00 0.00 -1.93 -3.32 103.07 96.44 1wdm h GLY 240 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wdm h GLY 240 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 1wdm n THR 241 N -3.04 1.36 -4.20 4.70 -2.24 -1.05 -4.89 114.28 104.92 1wdm n THR 241 Ca -0.08 -1.00 -0.24 0.00 -2.27 0.00 0.00 64.05 60.46 1wdm n THR 241 Cb 0.89 0.23 -0.06 0.00 -2.10 0.00 0.00 70.33 69.29 1wdm n THR 241 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1wdm s SER 242 N -0.91 4.98 0.74 3.42 0.01 -1.20 -1.62 113.70 119.12 1wdm s SER 242 Ca 0.46 -0.42 -0.13 0.00 1.31 0.00 0.00 55.95 57.17 1wdm s SER 242 Cb 0.27 -1.11 0.04 0.00 0.21 0.00 0.00 66.02 65.44 1wdm s SER 242 CO 0.26 0.01 1.13 -0.94 0.41 0.00 0.00 173.24 174.11 1wdm s SER 243 N -3.52 4.46 0.20 2.44 1.04 -1.11 -4.68 113.70 112.53 1wdm s SER 243 Ca 0.31 2.06 -0.07 0.00 0.48 0.00 0.00 55.95 58.72 1wdm s SER 243 Cb -0.08 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.42 1wdm s SER 243 CO 0.21 -2.07 0.48 -1.10 0.98 0.00 0.00 173.24 171.74 1wdm s GLN 244 N -4.34 3.72 -0.67 4.02 -0.21 -1.18 -4.87 119.66 116.13 1wdm s GLN 244 Ca 0.67 0.12 -0.27 0.00 0.02 0.00 0.00 55.36 55.90 1wdm s GLN 244 Cb -0.22 -2.73 0.00 0.00 1.00 0.00 0.00 33.01 31.07 1wdm s GLN 244 CO 0.48 0.37 1.57 0.42 -2.12 0.00 0.00 175.29 176.01 1wdm s ILE 245 N -1.76 3.54 -0.03 1.08 1.01 -1.26 -1.32 121.20 122.46 1wdm s ILE 245 Ca 0.45 0.31 0.05 0.00 0.00 0.00 0.00 60.65 61.46 1wdm s ILE 245 Cb -0.12 -4.43 -0.02 0.00 0.01 0.00 0.00 42.46 37.90 1wdm s ILE 245 CO 0.23 -1.38 -0.19 -0.89 0.00 0.00 0.00 174.94 172.71 1wdm s THR 246 N 7.38 2.69 -0.40 2.92 2.01 -1.26 -2.97 115.64 126.01 1wdm s THR 246 Ca 0.51 -0.91 -0.18 0.00 0.31 0.00 0.00 61.69 61.43 1wdm s THR 246 Cb -0.10 -2.03 0.01 0.00 0.01 0.00 0.00 72.50 70.39 1wdm s THR 246 CO 0.18 0.56 0.48 -1.81 -0.69 0.00 0.00 174.62 173.33 1wdm s ASP 247 N -0.77 6.24 0.20 3.53 1.01 -0.91 -4.05 116.67 121.92 1wdm s ASP 247 Ca 0.11 -0.41 -0.23 0.00 0.71 0.00 0.00 52.55 52.73 1wdm s ASP 247 Cb -0.10 -2.24 0.05 0.00 1.01 0.00 0.00 42.92 41.63 1wdm s ASP 247 CO 0.01 -0.55 0.71 -0.83 0.21 0.00 0.00 175.17 174.71 1wdm s GLY 248 N 1.82 -0.34 -0.01 0.21 0.00 -1.13 -2.65 107.32 105.22 1wdm s GLY 248 Ca 0.15 0.13 -0.06 0.00 0.00 0.00 0.00 44.72 44.94 1wdm s GLY 248 CO 0.14 0.04 0.12 0.00 0.00 0.00 0.00 173.10 173.41 1wdm s ALA 249 N -3.74 -0.29 0.13 3.20 0.00 -1.26 -2.25 121.76 117.55 1wdm s ALA 249 Ca 0.07 -0.00 0.09 0.00 0.00 0.00 0.00 51.96 52.11 1wdm s ALA 249 Cb -0.03 -0.00 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 1wdm s ALA 249 CO -0.02 -0.16 -0.20 -1.54 0.00 0.00 0.00 175.76 173.84 1wdm s SER 250 N -0.90 2.67 0.03 0.00 1.04 0.73 -1.42 113.70 115.86 1wdm s SER 250 Ca -0.10 -0.77 -0.03 0.00 0.48 0.00 0.00 55.95 55.54 1wdm s SER 250 Cb -0.06 -0.16 -0.02 0.00 0.10 0.00 0.00 66.02 65.89 1wdm s SER 250 CO 0.01 0.03 0.02 0.00 0.98 0.00 0.00 173.24 174.28 1wdm s MET 252 N -2.37 0.70 -0.18 0.00 -1.94 0.19 -1.92 119.30 113.79 1wdm s MET 252 Ca -0.07 0.36 -0.02 0.00 -1.71 0.00 0.00 55.69 54.24 1wdm s MET 252 Cb -0.03 0.33 -0.01 0.00 2.01 0.00 0.00 34.83 37.13 1wdm s MET 252 CO -0.04 -0.15 -0.08 0.42 -0.01 0.00 0.00 175.02 175.16 1wdm s ILE 253 N -0.47 3.30 0.09 2.53 1.01 -1.12 -0.97 121.20 125.57 1wdm s ILE 253 Ca -0.06 -0.54 0.06 0.00 0.00 0.00 0.00 60.65 60.11 1wdm s ILE 253 Cb -0.03 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 1wdm s ILE 253 CO 0.04 0.47 -0.16 -0.69 0.00 0.00 0.00 174.94 174.59 1wdm s VAL 254 N 0.92 1.34 0.17 2.92 1.01 -0.22 -0.54 120.40 126.00 1wdm s VAL 254 Ca -0.01 -1.43 -0.24 0.00 0.00 0.00 0.00 61.98 60.30 1wdm s VAL 254 Cb -0.15 -1.28 0.06 0.00 0.00 0.00 0.00 36.38 35.01 1wdm s VAL 254 CO 0.00 -0.19 0.73 0.00 0.00 0.00 0.00 175.10 175.64 1wdm s MET 255 N -1.91 1.35 1.08 2.72 0.23 -0.60 -0.38 119.30 121.80 1wdm s MET 255 Ca 0.02 -0.63 -0.13 0.00 -1.03 0.00 0.00 55.69 53.92 1wdm s MET 255 Cb -0.09 0.54 0.19 0.00 -1.53 0.00 0.00 34.83 33.94 1wdm s MET 255 CO 0.03 -0.61 0.78 -1.13 -2.03 0.00 0.00 175.02 172.06 1wdm n SER 256 N -0.39 -1.43 0.07 -1.18 3.41 -0.70 -0.83 113.62 112.56 1wdm n SER 256 Ca -0.10 0.03 -0.13 0.00 -0.26 0.00 0.00 58.87 58.41 1wdm n SER 256 Cb 0.62 -1.25 -0.04 0.00 -0.26 0.00 0.00 64.21 63.28 1wdm n SER 256 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wdm h ALA 257 N -2.27 0.37 0.49 7.33 0.00 -0.71 -2.66 119.26 121.82 1wdm h ALA 257 Ca -0.54 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 53.63 1wdm h ALA 257 Cb 1.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1wdm h ALA 257 CO 0.43 0.83 -0.24 0.37 0.00 0.00 0.00 179.25 180.65 1wdm h GLN 258 N 0.21 -0.64 -0.88 0.00 5.75 -1.65 0.12 115.11 118.04 1wdm h GLN 258 Ca -0.08 0.04 0.12 0.00 -0.15 0.00 0.00 58.65 58.59 1wdm h GLN 258 Cb 1.58 0.14 -0.07 0.00 1.07 0.00 0.00 27.48 30.21 1wdm h GLN 258 CO 0.16 -0.35 0.57 -0.09 -2.65 0.00 0.00 178.83 176.47 1wdm h ARG 259 N -0.85 0.74 -0.51 1.69 9.65 -1.81 0.19 114.38 123.48 1wdm h ARG 259 Ca -0.07 -0.04 -0.08 0.00 -1.10 0.00 0.00 59.98 58.69 1wdm h ARG 259 Cb 0.58 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.97 1wdm h ARG 259 CO 0.11 0.49 0.00 0.00 2.80 0.00 0.00 179.97 183.38 1wdm h ALA 260 N 1.58 1.05 0.06 2.80 0.00 -1.15 -1.84 119.26 121.77 1wdm h ALA 260 Ca 0.42 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1wdm h ALA 260 Cb 0.57 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1wdm h ALA 260 CO -0.19 0.59 -0.03 0.87 0.00 0.00 0.00 179.25 180.50 1wdm h LYS 261 N 0.79 -0.08 0.36 0.00 1.57 0.21 -2.00 116.57 117.42 1wdm h LYS 261 Ca 0.15 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1wdm h LYS 261 Cb 0.47 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1wdm h LYS 261 CO 0.02 0.11 -0.49 -0.44 -0.57 0.00 0.00 179.45 178.08 1wdm h ASP 262 N -0.27 -1.40 0.07 0.86 3.32 -0.87 -0.60 116.42 117.53 1wdm h ASP 262 Ca -0.01 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1wdm h ASP 262 Cb 0.23 0.48 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1wdm h ASP 262 CO 0.01 -0.62 0.00 -0.07 -1.72 0.00 0.00 179.24 176.85 1wdm h LEU 263 N -0.90 0.00 -2.32 1.55 3.38 -1.39 -3.47 115.31 112.16 1wdm h LEU 263 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1wdm h LEU 263 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1wdm h LEU 263 CO -0.14 0.00 -0.72 0.61 0.09 0.00 0.00 178.44 178.29 1wdm n GLY 264 N -1.11 -3.31 3.64 0.83 0.00 -0.23 -5.06 105.19 99.94 1wdm n GLY 264 Ca -0.02 0.53 -0.06 0.00 0.00 0.00 0.00 46.02 46.47 1wdm n GLY 264 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1wdm s LEU 265 N -1.62 -0.83 -0.00 0.99 2.34 -1.18 -5.06 118.68 113.30 1wdm s LEU 265 Ca 0.06 1.35 -0.30 0.00 0.06 0.00 0.00 54.13 55.30 1wdm s LEU 265 Cb -0.02 2.25 -0.07 0.00 -0.56 0.00 0.00 46.19 47.79 1wdm s LEU 265 CO 0.65 -0.21 1.76 -0.70 -1.06 0.00 0.00 176.35 176.79 1wdm s GLU 266 N 1.48 4.17 0.62 1.48 2.56 -1.26 -4.83 118.70 122.92 1wdm s GLU 266 Ca -0.09 2.36 -0.19 0.00 0.00 0.00 0.00 54.97 57.05 1wdm s GLU 266 Cb -0.05 -3.99 -0.02 0.00 2.00 0.00 0.00 34.13 32.07 1wdm s GLU 266 CO -0.18 -0.87 1.27 -2.30 -0.56 0.00 0.00 175.26 172.63 1wdm n PRO 267 N 7.05 1.22 0.10 4.30 -0.02 -1.26 -4.93 135.00 141.46 1wdm n PRO 267 Ca 0.18 0.47 0.12 0.00 -2.02 0.00 0.00 63.50 62.25 1wdm n PRO 267 Cb 0.42 -2.50 0.10 0.00 -0.02 0.00 0.00 33.50 31.49 1wdm n PRO 267 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1wdm h LEU 268 N 0.72 0.00 0.00 2.45 5.85 -1.19 -3.47 115.31 119.67 1wdm h LEU 268 Ca -0.51 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.12 1wdm h LEU 268 Cb 1.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.37 1wdm h LEU 268 CO 0.54 0.04 0.00 0.00 -0.34 0.00 0.00 178.44 178.68 1wdm n ALA 269 N -2.02 0.00 -3.76 1.25 0.00 -1.25 -4.83 120.51 109.90 1wdm n ALA 269 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.20 1wdm n ALA 269 Cb 0.50 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.78 1wdm n ALA 269 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wdm s VAL 270 N -2.00 0.51 0.16 0.00 1.01 -0.30 -2.16 120.40 117.62 1wdm s VAL 270 Ca 0.00 -0.28 -0.31 0.00 0.00 0.00 0.00 61.98 61.39 1wdm s VAL 270 Cb 0.00 -0.84 -0.11 0.00 0.00 0.00 0.00 36.38 35.43 1wdm s VAL 270 CO 0.00 0.01 1.76 -0.63 0.00 0.00 0.00 175.10 176.25 1wdm s ILE 271 N 1.89 2.31 -0.06 2.22 1.01 -0.95 -1.47 121.20 126.15 1wdm s ILE 271 Ca 0.02 0.06 0.12 0.00 0.00 0.00 0.00 60.65 60.85 1wdm s ILE 271 Cb -0.15 -3.04 -0.18 0.00 0.01 0.00 0.00 42.46 39.10 1wdm s ILE 271 CO -0.07 0.00 0.19 0.54 0.00 0.00 0.00 174.94 175.60 1wdm n ARG 272 N 4.79 1.07 -3.48 2.79 5.12 0.80 -4.61 116.66 123.15 1wdm n ARG 272 Ca 0.17 -0.07 -0.11 0.00 -1.93 0.00 0.00 57.85 55.90 1wdm n ARG 272 Cb 0.37 -1.31 -0.03 0.00 -1.16 0.00 0.00 32.46 30.33 1wdm n ARG 272 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1wdm s SER 273 N -3.93 -0.47 0.04 0.55 1.04 -1.20 -4.61 113.70 105.12 1wdm s SER 273 Ca -0.05 0.12 -0.04 0.00 0.48 0.00 0.00 55.95 56.46 1wdm s SER 273 Cb 0.06 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.64 1wdm s SER 273 CO 0.53 -0.72 0.05 -0.04 0.98 0.00 0.00 173.24 174.03 1wdm s MET 274 N -2.96 0.58 -0.09 4.02 -1.94 -1.26 -2.18 119.30 115.45 1wdm s MET 274 Ca 0.01 -0.88 -0.32 0.00 -1.71 0.00 0.00 55.69 52.79 1wdm s MET 274 Cb -0.01 0.22 0.12 0.00 2.01 0.00 0.00 34.83 37.17 1wdm s MET 274 CO -0.07 -0.13 1.04 0.00 -0.01 0.00 0.00 175.02 175.84 1wdm s ALA 275 N -2.93 -1.94 0.04 3.03 0.00 -1.05 -4.66 121.76 114.26 1wdm s ALA 275 Ca -0.02 1.30 -0.03 0.00 0.00 0.00 0.00 51.96 53.21 1wdm s ALA 275 Cb 0.01 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.21 1wdm s ALA 275 CO -0.06 -0.62 0.03 0.14 0.00 0.00 0.00 175.76 175.25 1wdm s VAL 276 N -2.70 0.17 0.14 0.00 -7.23 -1.26 -2.23 120.40 107.29 1wdm s VAL 276 Ca 0.07 -1.37 -0.18 0.00 -1.81 0.00 0.00 61.98 58.68 1wdm s VAL 276 Cb -0.01 -1.09 0.04 0.00 0.56 0.00 0.00 36.38 35.88 1wdm s VAL 276 CO -0.07 -0.76 0.46 0.00 -0.31 0.00 0.00 175.10 174.43 1wdm s ALA 277 N -3.09 -1.12 0.12 1.32 0.00 0.11 -4.79 121.76 114.30 1wdm s ALA 277 Ca -0.01 0.10 0.09 0.00 0.00 0.00 0.00 51.96 52.15 1wdm s ALA 277 Cb 0.02 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.85 1wdm s ALA 277 CO -0.07 -0.68 -0.20 0.20 0.00 0.00 0.00 175.76 175.01 1wdm s GLY 278 N -2.79 1.66 0.21 0.00 0.00 -1.26 0.95 107.32 106.09 1wdm s GLY 278 Ca 0.03 -1.37 -0.05 0.00 0.00 0.00 0.00 44.72 43.33 1wdm s GLY 278 CO -0.12 -1.34 0.23 -1.34 0.00 0.00 0.00 173.10 170.53 1wdm s VAL 279 N -1.11 0.00 0.33 1.40 -7.23 -1.00 -4.93 120.40 107.86 1wdm s VAL 279 Ca 0.17 -1.81 -0.29 0.00 -1.81 0.00 0.00 61.98 58.24 1wdm s VAL 279 Cb -0.10 -2.38 -0.11 0.00 0.56 0.00 0.00 36.38 34.34 1wdm s VAL 279 CO 0.09 -0.02 1.54 0.47 -0.31 0.00 0.00 175.10 176.87 1wdm n ASP 280 N -0.30 3.76 -0.17 4.85 8.00 -1.26 -4.32 116.55 127.11 1wdm n ASP 280 Ca 0.00 1.18 0.18 0.00 0.71 0.00 0.00 54.79 56.87 1wdm n ASP 280 Cb 0.65 -1.59 0.55 0.00 -0.02 0.00 0.00 41.12 40.70 1wdm n ASP 280 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1wdm h PRO 281 N 3.97 0.31 -0.52 -0.24 0.11 -1.89 -2.19 132.00 131.55 1wdm h PRO 281 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1wdm h PRO 281 Cb 1.24 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1wdm h PRO 281 CO 0.73 0.21 0.15 0.00 -0.21 0.00 0.00 178.00 178.87 1wdm h ALA 282 N 1.64 0.68 -1.11 -0.75 0.00 -1.90 -3.14 119.26 114.67 1wdm h ALA 282 Ca 0.39 -0.20 -0.66 0.00 0.00 0.00 0.00 54.91 54.44 1wdm h ALA 282 Cb 1.05 -0.20 -0.34 0.00 0.00 0.00 0.00 17.79 18.29 1wdm h ALA 282 CO -0.11 0.35 0.19 0.44 0.00 0.00 0.00 179.25 180.12 1wdm n ILE 283 N -4.47 3.07 0.14 0.00 -5.35 -0.85 -4.37 119.36 107.52 1wdm n ILE 283 Ca 0.02 -4.20 0.14 0.00 -0.27 0.00 0.00 62.75 58.44 1wdm n ILE 283 Cb 0.21 -1.22 0.67 0.00 -1.74 0.00 0.00 39.64 37.56 1wdm n ILE 283 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wdm h MET 284 N 2.54 0.00 0.00 6.28 -0.00 -1.43 -1.36 114.93 120.96 1wdm h MET 284 Ca 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.17 1wdm h MET 284 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.29 1wdm h MET 284 CO 1.19 0.00 0.00 0.41 -0.00 0.00 0.00 176.91 178.51 1wdm n GLY 285 N -1.58 -0.86 0.42 -3.00 0.00 -1.26 -0.97 105.19 97.94 1wdm n GLY 285 Ca 0.03 0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1wdm n GLY 285 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1wdm n TYR 286 N -2.23 0.10 -0.36 1.61 9.36 -0.51 -4.37 117.16 120.76 1wdm n TYR 286 Ca -0.01 -0.05 0.08 0.00 3.32 0.00 0.00 57.90 61.24 1wdm n TYR 286 Cb 0.04 0.00 0.25 0.00 -0.63 0.00 0.00 39.34 39.00 1wdm n TYR 286 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1wdm h GLY 287 N 5.00 1.65 0.08 2.98 0.00 -1.23 -3.10 103.07 108.44 1wdm h GLY 287 Ca 0.00 -0.41 0.18 0.00 0.00 0.00 0.00 47.33 47.10 1wdm h GLY 287 CO 0.00 0.12 0.45 -2.55 0.00 0.00 0.00 176.54 174.56 1wdm h PRO 288 N 0.94 0.56 -0.25 4.80 0.11 -1.79 -2.93 132.00 133.44 1wdm h PRO 288 Ca 0.51 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.58 1wdm h PRO 288 Cb 0.56 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1wdm h PRO 288 CO -0.29 0.37 0.14 -0.24 -0.21 0.00 0.00 178.00 177.77 1wdm h VAL 289 N 0.58 1.12 -0.51 3.15 3.04 -1.89 0.18 116.25 121.92 1wdm h VAL 289 Ca 0.51 -0.32 -0.03 0.00 -1.01 0.00 0.00 66.70 65.85 1wdm h VAL 289 Cb 0.82 0.87 -0.02 0.00 -2.01 0.00 0.00 31.29 30.95 1wdm h VAL 289 CO -0.41 0.12 0.20 -0.65 -1.01 0.00 0.00 177.57 175.81 1wdm h PRO 290 N 0.30 0.76 -0.40 4.17 0.11 -1.68 -2.18 132.00 133.07 1wdm h PRO 290 Ca 0.09 -0.14 -0.11 0.00 0.11 0.00 0.00 66.00 65.95 1wdm h PRO 290 Cb 0.07 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 1wdm h PRO 290 CO -0.01 0.68 -0.17 0.00 -0.21 0.00 0.00 178.00 178.29 1wdm h ALA 291 N 1.04 0.56 -0.18 -0.75 0.00 -1.44 -2.69 119.26 115.80 1wdm h ALA 291 Ca 0.17 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1wdm h ALA 291 Cb 0.21 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1wdm h ALA 291 CO -0.01 0.49 0.08 1.15 0.00 0.00 0.00 179.25 180.96 1wdm h THR 292 N 0.63 0.99 -0.24 0.00 2.02 -0.55 0.09 112.91 115.84 1wdm h THR 292 Ca 0.09 -0.06 0.05 0.00 0.77 0.00 0.00 66.41 67.26 1wdm h THR 292 Cb 0.72 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 67.87 1wdm h THR 292 CO 0.05 0.03 -0.05 1.56 0.37 0.00 0.00 175.52 177.48 1wdm h GLN 293 N 0.18 0.01 -0.78 6.66 4.20 -1.37 0.19 115.11 124.20 1wdm h GLN 293 Ca 0.07 -0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.80 1wdm h GLN 293 Cb 0.02 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.76 1wdm h GLN 293 CO -0.06 0.01 0.51 -0.22 -0.67 0.00 0.00 178.83 178.40 1wdm h LYS 294 N 0.01 1.00 0.16 1.46 3.64 -1.18 -0.21 116.57 121.45 1wdm h LYS 294 Ca 0.12 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1wdm h LYS 294 Cb 0.17 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1wdm h LYS 294 CO -0.24 0.66 -0.08 0.00 -2.27 0.00 0.00 179.45 177.52 1wdm h ALA 295 N 1.29 -0.22 -0.15 5.00 0.00 -0.19 -2.15 119.26 122.85 1wdm h ALA 295 Ca 0.29 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1wdm h ALA 295 Cb -0.09 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1wdm h ALA 295 CO -0.07 -0.54 0.03 -0.07 0.00 0.00 0.00 179.25 178.60 1wdm h LEU 296 N -0.39 0.01 -1.41 0.00 3.38 -0.47 0.12 115.31 116.56 1wdm h LEU 296 Ca -0.02 0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.13 1wdm h LEU 296 Cb 0.30 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.02 1wdm h LEU 296 CO 0.04 0.03 0.56 0.50 0.09 0.00 0.00 178.44 179.66 1wdm h LYS 297 N 0.09 0.54 -0.04 1.13 3.64 -0.98 0.82 116.57 121.76 1wdm h LYS 297 Ca 0.07 -0.03 -0.23 0.00 -1.27 0.00 0.00 60.65 59.19 1wdm h LYS 297 Cb 0.06 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1wdm h LYS 297 CO -0.09 0.35 -0.90 0.00 -2.27 0.00 0.00 179.45 176.55 1wdm h ARG 298 N 0.55 0.54 0.00 1.90 3.08 -0.65 -3.02 114.38 116.78 1wdm h ARG 298 Ca 0.44 -0.52 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 1wdm h ARG 298 Cb 0.88 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 31.06 1wdm h ARG 298 CO -0.18 1.15 -0.13 0.00 -1.07 0.00 0.00 179.97 179.74 1wdm h ALA 299 N 0.68 1.04 -1.38 0.04 0.00 0.22 -3.47 119.26 116.38 1wdm h ALA 299 Ca -0.08 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1wdm h ALA 299 Cb 1.52 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.30 1wdm h ALA 299 CO 0.16 0.16 -0.15 0.41 0.00 0.00 0.00 179.25 179.84 1wdm n GLY 300 N 0.02 0.36 3.44 0.00 0.00 0.25 -5.02 105.19 104.24 1wdm n GLY 300 Ca 0.00 -0.57 -0.21 0.00 0.00 0.00 0.00 46.02 45.23 1wdm n GLY 300 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wdm s LEU 301 N -1.94 2.16 -0.01 0.99 1.43 -1.05 -5.04 118.68 115.21 1wdm s LEU 301 Ca 0.07 -1.38 0.05 0.00 -1.03 0.00 0.00 54.13 51.84 1wdm s LEU 301 Cb -0.03 -0.37 -0.03 0.00 0.03 0.00 0.00 46.19 45.80 1wdm s LEU 301 CO 0.08 -0.61 -0.16 0.20 0.23 0.00 0.00 176.35 176.09 1wdm s ASN 302 N -3.48 3.89 0.62 2.29 0.01 -1.26 -4.46 114.94 112.55 1wdm s ASN 302 Ca 0.37 -0.30 0.03 0.00 -0.71 0.00 0.00 52.86 52.24 1wdm s ASN 302 Cb 0.09 -0.73 0.15 0.00 0.41 0.00 0.00 41.25 41.17 1wdm s ASN 302 CO 0.15 0.31 1.06 -0.03 -1.51 0.00 0.00 177.10 177.08 1wdm h MET 303 N 5.01 0.00 0.00 -0.60 1.85 -1.98 1.75 114.93 120.96 1wdm h MET 303 Ca -0.47 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.62 1wdm h MET 303 Cb 1.15 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.18 1wdm h MET 303 CO 0.49 0.00 -0.38 0.00 -0.40 0.00 0.00 176.91 176.62 1wdm n ALA 304 N -1.51 3.05 0.33 0.39 0.00 -1.26 -3.67 120.51 117.84 1wdm n ALA 304 Ca -0.00 -0.25 0.12 0.00 0.00 0.00 0.00 53.44 53.31 1wdm n ALA 304 Cb 0.91 -1.24 0.14 0.00 0.00 0.00 0.00 19.45 19.26 1wdm n ALA 304 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1wdm h ASP 305 N 0.00 0.00 -3.52 0.00 3.32 0.23 -3.46 116.42 112.99 1wdm h ASP 305 Ca 0.00 -0.06 -0.52 0.00 0.02 0.00 0.00 57.03 56.47 1wdm h ASP 305 Cb 0.57 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 1wdm h ASP 305 CO 0.00 0.03 0.40 -0.63 -1.72 0.00 0.00 179.24 177.32 1wdm s ILE 306 N -3.24 4.36 -0.11 0.35 1.01 -1.24 -4.65 121.20 117.69 1wdm s ILE 306 Ca 0.05 1.92 -0.11 0.00 0.00 0.00 0.00 60.65 62.51 1wdm s ILE 306 Cb 0.10 -4.23 -0.27 0.00 0.01 0.00 0.00 42.46 38.07 1wdm s ILE 306 CO 0.72 0.28 0.46 0.44 0.00 0.00 0.00 174.94 176.83 1wdm h ASP 307 N 5.69 0.42 -4.29 3.58 3.32 -1.44 -3.48 116.42 120.22 1wdm h ASP 307 Ca -0.43 -0.89 -0.31 0.00 0.02 0.00 0.00 57.03 55.43 1wdm h ASP 307 Cb 1.21 -0.14 -0.25 0.00 0.22 0.00 0.00 39.33 40.37 1wdm h ASP 307 CO 0.73 1.76 -0.75 -0.36 -1.72 0.00 0.00 179.24 178.90 1wdm s PHE 308 N -2.53 0.58 0.09 4.55 0.40 -1.19 -4.71 117.98 115.17 1wdm s PHE 308 Ca -0.21 -0.27 0.09 0.00 -0.60 0.00 0.00 56.93 55.94 1wdm s PHE 308 Cb 0.06 -0.36 -0.03 0.00 0.51 0.00 0.00 43.02 43.20 1wdm s PHE 308 CO 0.77 -0.04 -0.24 0.42 0.70 0.00 0.00 175.22 176.83 1wdm s ILE 309 N -0.68 1.96 -0.38 0.64 1.01 0.27 -1.59 121.20 122.42 1wdm s ILE 309 Ca -0.03 -1.50 0.01 0.00 0.00 0.00 0.00 60.65 59.12 1wdm s ILE 309 Cb -0.06 -1.72 0.13 0.00 0.01 0.00 0.00 42.46 40.82 1wdm s ILE 309 CO 0.00 0.13 0.20 -1.61 0.00 0.00 0.00 174.94 173.66 1wdm s GLU 310 N -1.65 0.91 -0.26 2.79 0.41 -0.09 -1.54 118.70 119.26 1wdm s GLU 310 Ca 0.10 -1.55 -0.10 0.00 -0.41 0.00 0.00 54.97 53.01 1wdm s GLU 310 Cb -0.10 -1.91 -0.04 0.00 -1.78 0.00 0.00 34.13 30.30 1wdm s GLU 310 CO 0.04 -1.13 0.15 -1.17 -0.49 0.00 0.00 175.26 172.65 1wdm s LEU 311 N 0.90 3.90 0.21 1.80 2.96 -1.26 -2.47 118.68 124.72 1wdm s LEU 311 Ca 0.16 -0.02 -0.32 0.00 -0.22 0.00 0.00 54.13 53.72 1wdm s LEU 311 Cb -0.22 -2.07 -0.13 0.00 0.50 0.00 0.00 46.19 44.28 1wdm s LEU 311 CO -0.06 -0.01 1.66 -3.20 -1.32 0.00 0.00 176.35 173.42 1wdm n ASN 312 N 4.80 3.71 -4.13 3.68 5.15 -0.97 -4.87 115.26 122.62 1wdm n ASN 312 Ca -0.15 1.08 -0.43 0.00 -0.60 0.00 0.00 54.58 54.48 1wdm n ASN 312 Cb 0.52 -1.53 0.00 0.00 -0.53 0.00 0.00 39.78 38.24 1wdm n ASN 312 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1wdm n GLU 313 N 3.54 3.44 0.28 1.20 1.02 -1.26 -4.79 120.64 124.07 1wdm n GLU 313 Ca 0.15 -3.56 -0.16 0.00 -0.02 0.00 0.00 57.16 53.57 1wdm n GLU 313 Cb 0.33 -3.04 -0.08 0.00 -0.02 0.00 0.00 31.44 28.63 1wdm n GLU 313 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wdm h ALA 314 N 6.42 -0.65 -2.61 0.62 0.00 -1.95 -3.37 119.26 117.72 1wdm h ALA 314 Ca 0.38 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 55.03 1wdm h ALA 314 Cb 0.74 0.25 -0.18 0.00 0.00 0.00 0.00 17.79 18.60 1wdm h ALA 314 CO 1.49 -0.86 -0.41 -0.06 0.00 0.00 0.00 179.25 179.41 1wdm s PHE 315 N -6.00 0.03 0.04 0.00 0.08 -1.26 -2.77 117.98 108.10 1wdm s PHE 315 Ca -0.16 -0.20 -0.22 0.00 0.12 0.00 0.00 56.93 56.47 1wdm s PHE 315 Cb 0.04 -0.03 -0.15 0.00 -0.57 0.00 0.00 43.02 42.32 1wdm s PHE 315 CO 0.62 -0.39 1.41 0.00 -0.10 0.00 0.00 175.22 176.77 1wdm h ALA 316 N 3.71 0.16 0.00 5.36 0.00 -1.62 0.13 119.26 127.00 1wdm h ALA 316 Ca -0.32 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1wdm h ALA 316 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1wdm h ALA 316 CO 0.46 -0.09 0.03 0.00 0.00 0.00 0.00 179.25 179.64 1wdm n ALA 317 N -2.34 0.95 -0.05 0.00 0.00 -1.26 -2.05 120.51 115.77 1wdm n ALA 317 Ca -0.06 0.05 -0.06 0.00 0.00 0.00 0.00 53.44 53.37 1wdm n ALA 317 Cb 0.25 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 18.63 1wdm n ALA 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wdm n GLN 318 N -1.68 0.78 -0.15 0.00 -0.00 -1.02 -3.63 117.38 111.67 1wdm n GLN 318 Ca -0.00 0.04 -0.08 0.00 -0.00 0.00 0.00 57.00 56.96 1wdm n GLN 318 Cb 0.04 -1.20 0.01 0.00 -0.00 0.00 0.00 30.24 29.09 1wdm n GLN 318 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wdm h ALA 319 N 0.08 0.58 0.33 2.61 0.00 -0.38 -2.97 119.26 119.51 1wdm h ALA 319 Ca -0.22 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1wdm h ALA 319 Cb 1.37 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1wdm h ALA 319 CO -0.02 0.12 -0.23 -0.07 0.00 0.00 0.00 179.25 179.05 1wdm h LEU 320 N 0.60 -0.60 -0.83 0.00 3.38 -1.65 -2.43 115.31 113.77 1wdm h LEU 320 Ca 0.16 0.04 0.14 0.00 0.09 0.00 0.00 57.88 58.31 1wdm h LEU 320 Cb 0.08 0.19 -0.09 0.00 0.09 0.00 0.00 40.66 40.93 1wdm h LEU 320 CO -0.02 -0.36 0.42 -0.65 0.09 0.00 0.00 178.44 177.92 1wdm h PRO 321 N -0.56 0.59 0.21 1.13 0.11 -1.78 -0.67 132.00 131.04 1wdm h PRO 321 Ca -0.03 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1wdm h PRO 321 Cb 0.48 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.43 1wdm h PRO 321 CO 0.01 0.39 -0.38 0.28 -0.21 0.00 0.00 178.00 178.09 1wdm h VAL 322 N 0.61 0.00 -0.70 3.15 2.07 -1.33 0.11 116.25 120.16 1wdm h VAL 322 Ca 0.45 0.00 0.15 0.00 0.82 0.00 0.00 66.70 68.12 1wdm h VAL 322 Cb 0.63 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.30 1wdm h VAL 322 CO -0.36 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.33 1wdm h LEU 323 N -0.64 0.02 0.45 2.57 3.38 -0.93 0.25 115.31 120.41 1wdm h LEU 323 Ca -0.02 0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1wdm h LEU 323 Cb 0.60 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1wdm h LEU 323 CO -0.14 -0.02 -0.37 0.11 0.09 0.00 0.00 178.44 178.12 1wdm h LYS 324 N 0.27 -0.76 -0.04 1.13 1.57 -0.60 -1.01 116.57 117.13 1wdm h LYS 324 Ca 0.39 0.05 0.01 0.00 -1.87 0.00 0.00 60.65 59.23 1wdm h LYS 324 Cb 0.64 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.12 1wdm h LYS 324 CO -0.48 -0.51 0.05 -0.44 -0.57 0.00 0.00 179.45 177.51 1wdm h ASP 325 N -0.79 0.00 1.01 0.86 5.19 -0.24 0.53 116.42 122.98 1wdm h ASP 325 Ca -0.06 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1wdm h ASP 325 Cb 0.66 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.17 1wdm h ASP 325 CO 0.00 0.00 0.00 0.18 -3.12 0.00 0.00 179.24 176.30 1wdm n LEU 326 N -3.81 0.12 -2.74 1.55 4.77 0.83 -4.92 117.00 112.79 1wdm n LEU 326 Ca -0.02 0.51 -0.12 0.00 -0.03 0.00 0.00 56.01 56.36 1wdm n LEU 326 Cb 0.14 -0.48 0.06 0.00 -2.33 0.00 0.00 43.42 40.82 1wdm n LEU 326 CO 0.27 -0.06 0.07 0.29 -1.33 0.00 0.00 177.39 176.63 1wdm n LYS 327 N -1.61 -4.00 0.00 3.23 5.02 0.19 -4.94 118.16 116.05 1wdm n LYS 327 Ca 0.06 0.61 0.00 0.00 -2.02 0.00 0.00 58.31 56.96 1wdm n LYS 327 Cb 0.33 -4.83 0.00 0.00 -0.02 0.00 0.00 35.03 30.51 1wdm n LYS 327 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1wdm n VAL 328 N -3.12 0.00 -0.16 -0.18 0.24 -0.67 -4.89 118.33 109.56 1wdm n VAL 328 Ca -0.17 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.12 1wdm n VAL 328 Cb 0.61 1.01 0.22 0.00 -1.47 0.00 0.00 33.84 34.21 1wdm n VAL 328 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1wdm h LEU 329 N 0.00 0.80 -0.68 1.34 6.46 -1.81 -0.26 115.31 121.15 1wdm h LEU 329 Ca 0.00 -0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.67 1wdm h LEU 329 Cb 0.79 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.51 1wdm h LEU 329 CO 0.00 0.70 0.00 -0.90 -0.62 0.00 0.00 178.44 177.62 1wdm n ASP 330 N -4.33 0.66 -0.85 1.25 5.75 -1.26 -2.07 116.55 115.70 1wdm n ASP 330 Ca 0.05 0.66 0.08 0.00 -0.01 0.00 0.00 54.79 55.58 1wdm n ASP 330 Cb 0.15 -0.80 0.17 0.00 -1.03 0.00 0.00 41.12 39.60 1wdm n ASP 330 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1wdm n LYS 331 N -2.23 2.23 0.00 0.11 4.76 -0.17 -4.85 118.16 118.01 1wdm n LYS 331 Ca 0.02 -2.00 0.00 0.00 -2.87 0.00 0.00 58.31 53.46 1wdm n LYS 331 Cb 0.23 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 32.05 1wdm n LYS 331 CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 1wdm n MET 332 N 1.00 0.00 0.20 1.97 1.56 -0.82 -1.22 117.12 119.80 1wdm n MET 332 Ca 0.14 0.16 0.04 0.00 -0.27 0.00 0.00 57.70 57.78 1wdm n MET 332 Cb 0.48 -0.71 0.23 0.00 2.15 0.00 0.00 33.22 35.37 1wdm n MET 332 CO 0.00 0.00 0.00 -0.91 -0.73 0.00 0.00 175.97 174.33 1wdm h ASN 333 N 0.00 0.00 0.72 6.12 2.35 -1.85 0.59 115.58 123.51 1wdm h ASN 333 Ca 0.00 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.61 1wdm h ASN 333 Cb 0.00 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 1wdm h ASN 333 CO 0.00 0.00 -1.38 1.21 -1.65 0.00 0.00 177.43 175.61 1wdm n GLU 334 N -2.06 0.62 -1.68 0.81 2.13 -0.81 -4.70 120.64 114.95 1wdm n GLU 334 Ca -0.01 0.18 -0.05 0.00 0.66 0.00 0.00 57.16 57.95 1wdm n GLU 334 Cb 0.56 -1.79 0.01 0.00 0.27 0.00 0.00 31.44 30.48 1wdm n GLU 334 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1wdm n LYS 335 N -2.82 0.56 -3.66 5.31 2.85 0.16 -5.02 118.16 115.53 1wdm n LYS 335 Ca -0.08 -1.08 -0.21 0.00 -1.05 0.00 0.00 58.31 55.89 1wdm n LYS 335 Cb 0.78 0.47 -0.18 0.00 -0.65 0.00 0.00 35.03 35.46 1wdm n LYS 335 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1wdm s VAL 336 N 0.05 -0.11 -1.41 0.58 1.01 0.12 -0.56 120.40 120.08 1wdm s VAL 336 Ca 0.04 0.36 -0.01 0.00 0.00 0.00 0.00 61.98 62.36 1wdm s VAL 336 Cb 0.18 -0.21 0.01 0.00 0.00 0.00 0.00 36.38 36.36 1wdm s VAL 336 CO -0.05 0.12 0.46 0.59 0.00 0.00 0.00 175.10 176.22 1wdm n ASN 337 N 5.30 -0.53 0.04 3.32 4.13 -0.59 -4.64 115.26 122.29 1wdm n ASN 337 Ca -0.04 -0.99 0.10 0.00 1.68 0.00 0.00 54.58 55.33 1wdm n ASN 337 Cb 0.50 -3.14 0.53 0.00 -1.54 0.00 0.00 39.78 36.13 1wdm n ASN 337 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 1wdm h LEU 338 N -1.83 0.26 -2.94 3.41 3.38 -1.90 -0.77 115.31 114.92 1wdm h LEU 338 Ca -0.63 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.34 1wdm h LEU 338 Cb 1.37 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1wdm h LEU 338 CO 0.62 0.18 0.00 1.41 0.09 0.00 0.00 178.44 180.74 1wdm n HIS 339 N -4.48 1.56 0.00 1.13 8.25 -1.26 -4.68 115.22 115.75 1wdm n HIS 339 Ca 0.05 -0.55 0.00 0.00 -0.26 0.00 0.00 57.72 56.95 1wdm n HIS 339 Cb 0.23 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 30.96 1wdm n HIS 339 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wdm n GLY 340 N 0.60 -0.40 0.00 -1.41 0.00 -0.30 -3.66 105.19 100.02 1wdm n GLY 340 Ca 0.22 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.51 1wdm n GLY 340 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wdm n GLY 341 N -0.36 6.47 0.27 -0.02 0.00 -1.26 -4.86 105.19 105.43 1wdm n GLY 341 Ca 0.00 -1.86 0.18 0.00 0.00 0.00 0.00 46.02 44.34 1wdm n GLY 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdm h ALA 342 N 1.00 1.00 0.00 4.61 0.00 -1.78 0.37 119.26 124.46 1wdm h ALA 342 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1wdm h ALA 342 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1wdm h ALA 342 CO 0.00 0.00 -0.23 0.82 0.00 0.00 0.00 179.25 179.84 1wdm h ILE 343 N 0.00 0.61 0.00 0.00 2.04 -1.83 0.41 117.51 118.74 1wdm h ILE 343 Ca 0.00 -1.07 -0.04 0.00 1.00 0.00 0.00 64.86 64.75 1wdm h ILE 343 Cb 0.13 1.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.91 1wdm h ILE 343 CO 0.00 0.22 -1.26 0.00 0.00 0.00 0.00 178.15 177.12 1wdm n ALA 344 N -2.25 2.04 0.96 1.87 0.00 -0.60 -4.60 120.51 117.94 1wdm n ALA 344 Ca -0.00 -0.20 0.10 0.00 0.00 0.00 0.00 53.44 53.34 1wdm n ALA 344 Cb 0.40 -0.01 -0.05 0.00 0.00 0.00 0.00 19.45 19.79 1wdm n ALA 344 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wdm n LEU 345 N -1.90 1.57 0.00 0.00 4.77 0.12 -1.90 117.00 119.66 1wdm n LEU 345 Ca -0.04 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 1wdm n LEU 345 Cb 0.37 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1wdm n LEU 345 CO 0.10 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1wdm n GLY 346 N 1.42 -0.57 2.35 -0.72 0.00 0.13 -4.82 105.19 102.98 1wdm n GLY 346 Ca 0.07 -1.74 -0.25 0.00 0.00 0.00 0.00 46.02 44.09 1wdm n GLY 346 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1wdm n HIS 347 N -0.60 -0.92 -2.41 1.61 -0.00 -0.43 -4.29 115.22 108.17 1wdm n HIS 347 Ca 0.00 -3.28 -0.37 0.00 0.46 0.00 0.00 57.72 54.53 1wdm n HIS 347 Cb 0.00 0.15 -0.03 0.00 -0.12 0.00 0.00 29.99 29.99 1wdm n HIS 347 CO 0.00 0.00 0.00 -2.14 0.46 0.00 0.00 176.34 174.66 1wdm s PRO 348 N -0.28 3.38 0.00 1.57 0.02 -1.26 -4.57 135.00 133.87 1wdm s PRO 348 Ca 0.33 -1.22 0.00 0.00 0.02 0.00 0.00 61.00 60.13 1wdm s PRO 348 Cb 0.08 -5.34 0.00 0.00 0.02 0.00 0.00 34.50 29.26 1wdm s PRO 348 CO -0.17 -2.66 0.00 1.19 -0.33 0.00 0.00 177.00 175.04 1wdm n PHE 349 N 10.35 0.00 -0.08 6.54 0.99 -1.26 0.25 117.46 134.26 1wdm n PHE 349 Ca 0.40 0.00 0.25 0.00 -0.00 0.00 0.00 57.45 58.11 1wdm n PHE 349 Cb 0.48 0.00 0.64 0.00 -1.00 0.00 0.00 39.48 39.61 1wdm n PHE 349 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 1wdm h GLY 350 N 0.00 0.00 0.00 1.37 0.00 -1.80 -2.95 103.07 99.69 1wdm h GLY 350 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1wdm h GLY 350 CO 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 176.54 175.90 1wdm n SER 352 N -4.58 -0.10 -0.01 0.00 7.64 -0.46 -2.53 113.62 113.58 1wdm n SER 352 Ca -0.13 0.73 -0.00 0.00 1.01 0.00 0.00 58.87 60.48 1wdm n SER 352 Cb 0.35 -0.24 -0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1wdm n SER 352 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wdm n GLY 353 N -1.24 -2.50 0.15 0.23 0.00 -1.25 -1.38 105.19 99.20 1wdm n GLY 353 Ca 0.09 0.48 0.03 0.00 0.00 0.00 0.00 46.02 46.61 1wdm n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wdm h ALA 354 N -0.78 0.76 -0.16 4.61 0.00 -1.64 -3.26 119.26 118.79 1wdm h ALA 354 Ca 0.00 -0.46 0.03 0.00 0.00 0.00 0.00 54.91 54.48 1wdm h ALA 354 Cb 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 1wdm h ALA 354 CO -0.01 0.64 -0.53 -0.09 0.00 0.00 0.00 179.25 179.26 1wdm h ARG 355 N 0.00 -0.53 -0.24 0.00 1.12 -1.04 1.39 114.38 115.08 1wdm h ARG 355 Ca -0.01 0.04 -0.07 0.00 -1.11 0.00 0.00 59.98 58.83 1wdm h ARG 355 Cb 1.25 0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 31.31 1wdm h ARG 355 CO 0.07 -0.35 -0.14 -0.84 -3.11 0.00 0.00 179.97 175.59 1wdm h ILE 356 N -0.55 1.22 -0.24 1.20 3.07 -1.54 0.48 117.51 121.16 1wdm h ILE 356 Ca 0.05 -0.99 -0.06 0.00 1.55 0.00 0.00 64.86 65.40 1wdm h ILE 356 Cb 0.67 1.20 -0.01 0.00 -0.27 0.00 0.00 36.82 38.40 1wdm h ILE 356 CO -0.45 0.32 -0.12 0.28 -1.05 0.00 0.00 178.15 177.13 1wdm h SER 357 N 0.38 0.37 0.13 2.16 0.02 -1.12 0.07 113.55 115.56 1wdm h SER 357 Ca 0.07 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1wdm h SER 357 Cb 0.48 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1wdm h SER 357 CO 0.03 0.52 -0.06 1.23 -1.14 0.00 0.00 176.83 177.41 1wdm h GLY 358 N 0.85 -0.19 0.33 -3.77 0.00 0.29 -3.17 103.07 97.42 1wdm h GLY 358 Ca 0.07 0.07 0.19 0.00 0.00 0.00 0.00 47.33 47.66 1wdm h GLY 358 CO 0.02 -0.07 0.59 -0.84 0.00 0.00 0.00 176.54 176.25 1wdm h THR 359 N -0.94 0.72 -0.62 4.70 2.02 -0.88 0.97 112.91 118.87 1wdm h THR 359 Ca -0.02 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 1wdm h THR 359 Cb 0.48 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 1wdm h THR 359 CO 0.03 0.10 0.37 0.25 0.37 0.00 0.00 175.52 176.64 1wdm h LEU 360 N 0.53 0.74 -0.59 2.58 5.85 -1.03 -1.30 115.31 122.08 1wdm h LEU 360 Ca 0.48 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 59.05 1wdm h LEU 360 Cb 1.02 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 1wdm h LEU 360 CO -0.22 0.57 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.29 1wdm h LEU 361 N 0.85 1.02 -0.49 2.25 3.38 -0.78 -2.71 115.31 118.83 1wdm h LEU 361 Ca 0.22 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1wdm h LEU 361 Cb -0.03 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1wdm h LEU 361 CO -0.04 1.12 -0.08 0.78 0.09 0.00 0.00 178.44 180.31 1wdm h ASN 362 N 0.91 0.92 -0.05 -0.43 2.35 -1.15 -1.13 115.58 117.01 1wdm h ASN 362 Ca 0.15 -0.34 0.01 0.00 -0.55 0.00 0.00 56.30 55.56 1wdm h ASN 362 Cb 0.65 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 1wdm h ASN 362 CO 0.05 1.05 0.04 0.58 -1.65 0.00 0.00 177.43 177.49 1wdm h VAL 363 N 0.78 0.83 0.14 2.81 2.07 -1.15 0.20 116.25 121.92 1wdm h VAL 363 Ca 0.13 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 67.44 1wdm h VAL 363 Cb 0.62 0.97 0.02 0.00 -1.52 0.00 0.00 31.29 31.39 1wdm h VAL 363 CO 0.04 0.00 -0.92 0.24 0.02 0.00 0.00 177.57 176.95 1wdm h MET 364 N 0.00 0.37 0.00 1.57 2.86 -1.12 -2.28 114.93 116.33 1wdm h MET 364 Ca 0.02 -0.59 -0.04 0.00 -2.06 0.00 0.00 59.70 57.04 1wdm h MET 364 Cb 0.10 0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1wdm h MET 364 CO -0.00 1.27 -0.17 0.87 1.06 0.00 0.00 176.91 179.94 1wdm h LYS 365 N -0.23 0.00 0.14 1.72 1.57 -0.25 0.14 116.57 119.66 1wdm h LYS 365 Ca -0.16 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.33 1wdm h LYS 365 Cb 1.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.02 1wdm h LYS 365 CO 0.17 0.17 -1.50 1.96 -0.57 0.00 0.00 179.45 179.68 1wdm h GLN 366 N 0.00 0.30 -0.50 3.15 4.20 -0.69 -3.37 115.11 118.20 1wdm h GLN 366 Ca -0.00 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.19 1wdm h GLN 366 Cb 0.43 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.40 1wdm h GLN 366 CO 0.02 1.25 0.00 0.09 -0.67 0.00 0.00 178.83 179.52 1wdm n ASN 367 N -3.82 5.30 -3.43 1.46 3.02 -0.86 -4.97 115.26 111.96 1wdm n ASN 367 Ca -0.24 -2.95 -0.20 0.00 -0.03 0.00 0.00 54.58 51.16 1wdm n ASN 367 Cb 0.96 -0.65 0.04 0.00 -0.61 0.00 0.00 39.78 39.52 1wdm n ASN 367 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wdm n GLY 368 N 0.36 -1.12 4.00 7.41 0.00 -0.39 -5.01 105.19 110.44 1wdm n GLY 368 Ca 0.26 0.52 -0.21 0.00 0.00 0.00 0.00 46.02 46.59 1wdm n GLY 368 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wdm s GLY 369 N -3.32 1.81 0.06 -0.02 0.00 0.34 -5.04 107.32 101.15 1wdm s GLY 369 Ca 0.35 -1.69 0.00 0.00 0.00 0.00 0.00 44.72 43.38 1wdm s GLY 369 CO 0.80 -1.30 0.00 2.41 0.00 0.00 0.00 173.10 175.01 1wdm n THR 370 N -2.38 0.41 -5.08 0.90 -1.04 -1.26 -4.65 114.28 101.18 1wdm n THR 370 Ca 0.12 0.14 -0.32 0.00 -2.04 0.00 0.00 64.05 61.94 1wdm n THR 370 Cb 0.60 -1.32 -0.16 0.00 -1.82 0.00 0.00 70.33 67.63 1wdm n THR 370 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1wdm s PHE 371 N -2.00 2.63 0.24 -1.42 0.40 -1.26 -0.20 117.98 116.37 1wdm s PHE 371 Ca 0.00 -0.97 0.11 0.00 -0.60 0.00 0.00 56.93 55.48 1wdm s PHE 371 Cb 0.00 -1.75 -0.05 0.00 0.51 0.00 0.00 43.02 41.73 1wdm s PHE 371 CO 0.00 -0.38 -0.19 0.20 0.70 0.00 0.00 175.22 175.55 1wdm s GLY 372 N 0.37 1.79 -0.11 4.36 0.00 -0.55 -1.09 107.32 112.09 1wdm s GLY 372 Ca -0.16 -1.74 -0.01 0.00 0.00 0.00 0.00 44.72 42.80 1wdm s GLY 372 CO 0.08 -1.80 -0.03 -2.27 0.00 0.00 0.00 173.10 169.08 1wdm s LEU 373 N -3.17 0.93 -0.26 0.66 2.96 -0.62 -2.16 118.68 117.02 1wdm s LEU 373 Ca 0.26 -0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 53.86 1wdm s LEU 373 Cb -0.06 -0.63 0.02 0.00 0.50 0.00 0.00 46.19 46.01 1wdm s LEU 373 CO 0.14 -0.18 -0.02 -0.94 -1.32 0.00 0.00 176.35 174.03 1wdm s SER 374 N 1.85 4.55 0.16 3.68 1.04 -0.73 -0.91 113.70 123.33 1wdm s SER 374 Ca 0.04 -0.77 0.02 0.00 0.48 0.00 0.00 55.95 55.73 1wdm s SER 374 Cb -0.13 -1.74 -0.05 0.00 0.10 0.00 0.00 66.02 64.21 1wdm s SER 374 CO -0.07 -0.13 -0.02 0.28 0.98 0.00 0.00 173.24 174.28 1wdm s THR 375 N 1.39 0.75 -0.23 2.02 -1.32 -1.03 -0.65 115.64 116.56 1wdm s THR 375 Ca 0.02 -1.98 -0.27 0.00 -1.21 0.00 0.00 61.69 58.24 1wdm s THR 375 Cb -0.16 -2.02 0.13 0.00 -1.51 0.00 0.00 72.50 68.94 1wdm s THR 375 CO -0.02 -0.57 1.07 0.00 -2.21 0.00 0.00 174.62 172.88 1wdm s MET 376 N -3.88 0.49 0.73 7.08 0.23 -0.69 -2.29 119.30 120.97 1wdm s MET 376 Ca 0.21 0.35 -0.11 0.00 -1.03 0.00 0.00 55.69 55.11 1wdm s MET 376 Cb 0.06 0.23 0.03 0.00 -1.53 0.00 0.00 34.83 33.62 1wdm s MET 376 CO 0.02 -0.10 1.08 0.00 -2.03 0.00 0.00 175.02 173.99 1wdm s ILE 378 N -3.17 0.95 0.54 0.00 1.01 0.38 -4.63 121.20 116.29 1wdm s ILE 378 Ca 0.59 -1.93 -0.20 0.00 0.00 0.00 0.00 60.65 59.11 1wdm s ILE 378 Cb -0.13 -1.69 -0.06 0.00 0.01 0.00 0.00 42.46 40.59 1wdm s ILE 378 CO 0.54 -0.75 1.14 -0.83 0.00 0.00 0.00 174.94 175.04 1wdm s GLY 379 N -2.98 2.67 0.00 6.18 0.00 -1.26 -3.08 107.32 108.84 1wdm s GLY 379 Ca 0.13 0.86 0.00 0.00 0.00 0.00 0.00 44.72 45.71 1wdm s GLY 379 CO -0.01 1.24 0.00 1.04 0.00 0.00 0.00 173.10 175.36 1wdm n LEU 380 N -1.24 0.58 -0.08 0.66 7.99 -1.26 -4.26 117.00 119.39 1wdm n LEU 380 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.11 1wdm n LEU 380 Cb 0.50 -1.38 0.00 0.00 -0.11 0.00 0.00 43.42 42.43 1wdm n LEU 380 CO 0.43 -0.48 0.00 0.61 -1.51 0.00 0.00 177.39 176.44 1wdm n GLY 381 N -1.15 0.76 3.34 -0.72 0.00 -1.18 -3.90 105.19 102.34 1wdm n GLY 381 Ca 0.00 -0.71 -0.09 0.00 0.00 0.00 0.00 46.02 45.22 1wdm n GLY 381 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wdm s GLN 382 N -1.99 1.13 0.02 1.61 -0.21 -1.21 -2.36 119.66 116.64 1wdm s GLN 382 Ca 0.00 -1.03 -0.07 0.00 0.02 0.00 0.00 55.36 54.28 1wdm s GLN 382 Cb 0.00 0.41 -0.00 0.00 1.00 0.00 0.00 33.01 34.41 1wdm s GLN 382 CO 0.00 -0.42 0.13 0.20 -2.12 0.00 0.00 175.29 173.08 1wdm s GLY 383 N -2.91 0.08 -0.18 3.09 0.00 0.27 -0.47 107.32 107.20 1wdm s GLY 383 Ca 0.12 -0.27 -0.19 0.00 0.00 0.00 0.00 44.72 44.37 1wdm s GLY 383 CO -0.04 -0.41 0.54 -1.50 0.00 0.00 0.00 173.10 171.69 1wdm s ILE 384 N -1.87 0.00 0.04 0.90 2.07 -1.11 -0.72 121.20 120.51 1wdm s ILE 384 Ca -0.11 -0.03 -0.19 0.00 -1.41 0.00 0.00 60.65 58.91 1wdm s ILE 384 Cb -0.05 -0.76 0.04 0.00 0.13 0.00 0.00 42.46 41.81 1wdm s ILE 384 CO -0.01 -0.02 0.42 0.00 -1.91 0.00 0.00 174.94 173.43 1wdm s ALA 385 N 0.08 -1.05 0.08 1.50 0.00 -0.94 -1.70 121.76 119.74 1wdm s ALA 385 Ca -0.02 0.36 0.05 0.00 0.00 0.00 0.00 51.96 52.36 1wdm s ALA 385 Cb -0.04 0.33 -0.03 0.00 0.00 0.00 0.00 23.12 23.38 1wdm s ALA 385 CO 0.02 -0.45 -0.13 0.99 0.00 0.00 0.00 175.76 176.19 1wdm s THR 386 N -2.38 1.10 -0.29 0.00 2.01 0.17 -2.54 115.64 113.71 1wdm s THR 386 Ca -0.06 -1.43 0.00 0.00 0.31 0.00 0.00 61.69 60.51 1wdm s THR 386 Cb -0.01 -1.19 0.09 0.00 0.01 0.00 0.00 72.50 71.40 1wdm s THR 386 CO -0.02 -0.33 0.05 -0.69 -0.69 0.00 0.00 174.62 172.95 1wdm s VAL 387 N -1.65 1.29 0.54 3.82 1.01 -0.93 -1.77 120.40 122.72 1wdm s VAL 387 Ca 0.01 -1.52 0.02 0.00 0.00 0.00 0.00 61.98 60.49 1wdm s VAL 387 Cb -0.08 -1.88 0.03 0.00 0.00 0.00 0.00 36.38 34.46 1wdm s VAL 387 CO 0.02 -0.51 0.75 -0.36 0.00 0.00 0.00 175.10 175.00 1wdm s PHE 388 N 1.43 2.86 -0.14 5.22 0.40 -0.92 -0.14 117.98 126.69 1wdm s PHE 388 Ca 0.06 -0.04 -0.06 0.00 -0.60 0.00 0.00 56.93 56.29 1wdm s PHE 388 Cb -0.18 -2.71 0.06 0.00 0.51 0.00 0.00 43.02 40.70 1wdm s PHE 388 CO -0.16 -0.82 0.31 -2.00 0.70 0.00 0.00 175.22 173.25 1wdm s GLU 389 N -4.72 0.24 -0.13 0.44 2.12 -0.54 -1.48 118.70 114.63 1wdm s GLU 389 Ca 0.57 0.73 -0.29 0.00 0.36 0.00 0.00 54.97 56.33 1wdm s GLU 389 Cb -0.10 -0.01 -0.01 0.00 0.26 0.00 0.00 34.13 34.27 1wdm s GLU 389 CO 0.38 -0.22 1.03 1.03 -0.54 0.00 0.00 175.26 176.94 1wdm s ARG 390 N 1.89 4.38 0.00 4.30 1.81 0.72 -1.15 118.95 130.90 1wdm s ARG 390 Ca -0.05 1.41 0.00 0.00 -1.72 0.00 0.00 55.73 55.38 1wdm s ARG 390 Cb -0.11 -3.57 0.00 0.00 -0.45 0.00 0.00 34.95 30.83 1wdm s ARG 390 CO -0.10 -0.39 0.00 1.55 -0.68 0.00 0.00 175.30 175.68