#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t8o n GLY 2 N 0.00 0.16 2.87 0.00 0.00 -0.40 -4.70 105.19 103.12 1t8o n GLY 2 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1t8o n GLY 2 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t8o s VAL 3 N -1.34 1.66 0.30 1.61 1.01 -1.26 -1.25 120.40 121.13 1t8o s VAL 3 Ca 0.00 -2.07 -0.29 0.00 0.00 0.00 0.00 61.98 59.62 1t8o s VAL 3 Cb 0.00 -2.23 -0.10 0.00 0.00 0.00 0.00 36.38 34.05 1t8o s VAL 3 CO 0.00 -0.67 1.39 -2.84 0.00 0.00 0.00 175.10 172.97 1t8o s PRO 4 N 1.04 4.29 0.37 2.72 0.02 -1.26 -4.91 135.00 137.27 1t8o s PRO 4 Ca 0.12 2.29 0.11 0.00 0.02 0.00 0.00 61.00 63.54 1t8o s PRO 4 Cb -0.19 -3.08 0.71 0.00 0.02 0.00 0.00 34.50 31.96 1t8o s PRO 4 CO -0.13 -0.33 1.83 0.00 -0.33 0.00 0.00 177.00 178.04 1t8o h ALA 5 N 4.08 1.39 -3.26 -1.55 0.00 -1.88 -3.37 119.26 114.67 1t8o h ALA 5 Ca -0.48 -0.31 -0.69 0.00 0.00 0.00 0.00 54.91 53.43 1t8o h ALA 5 Cb 1.22 -0.07 -0.30 0.00 0.00 0.00 0.00 17.79 18.65 1t8o h ALA 5 CO 0.71 0.45 -0.65 0.42 0.00 0.00 0.00 179.25 180.17 1t8o s ILE 6 N -4.31 3.46 0.27 0.00 1.01 -1.26 -5.09 121.20 115.29 1t8o s ILE 6 Ca -0.04 -1.14 -0.30 0.00 0.00 0.00 0.00 60.65 59.18 1t8o s ILE 6 Cb 0.15 -2.92 -0.10 0.00 0.01 0.00 0.00 42.46 39.59 1t8o s ILE 6 CO 0.73 -0.08 1.39 -1.10 0.00 0.00 0.00 174.94 175.89 1t8o s GLN 7 N 1.36 4.30 0.61 2.79 -1.52 -1.26 -4.18 119.66 121.75 1t8o s GLN 7 Ca -0.02 2.26 -0.13 0.00 -1.95 0.00 0.00 55.36 55.53 1t8o s GLN 7 Cb -0.19 -3.10 -0.04 0.00 -0.22 0.00 0.00 33.01 29.46 1t8o s GLN 7 CO 0.01 -0.35 1.03 -1.25 -0.25 0.00 0.00 175.29 174.48 1t8o s PRO 8 N -0.78 3.56 -0.28 2.91 0.04 -1.26 -4.89 135.00 134.31 1t8o s PRO 8 Ca 0.56 0.86 -0.01 0.00 0.04 0.00 0.00 61.00 62.44 1t8o s PRO 8 Cb -0.41 -2.08 0.04 0.00 0.04 0.00 0.00 34.50 32.09 1t8o s PRO 8 CO 0.46 -0.60 -0.03 0.08 0.04 0.00 0.00 177.00 176.95 1t8o s VAL 9 N -2.99 2.90 0.27 -0.36 1.01 -1.26 -5.06 120.40 114.90 1t8o s VAL 9 Ca 0.57 -1.24 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1t8o s VAL 9 Cb -0.12 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 1t8o s VAL 9 CO 0.48 0.03 0.45 -0.76 0.00 0.00 0.00 175.10 175.30 1t8o s LEU 10 N 1.28 4.16 -0.41 3.92 1.43 -1.26 -4.84 118.68 122.95 1t8o s LEU 10 Ca -0.03 0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 53.42 1t8o s LEU 10 Cb -0.18 -3.17 0.00 0.00 0.03 0.00 0.00 46.19 42.87 1t8o s LEU 10 CO -0.03 -0.15 0.40 -1.20 0.23 0.00 0.00 176.35 175.61 1t8o n SER 11 N -1.26 -5.45 -0.29 2.29 7.64 -1.26 -5.17 113.62 110.12 1t8o n SER 11 Ca -0.06 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1t8o n SER 11 Cb 0.55 -3.56 0.00 0.00 -1.01 0.00 0.00 64.21 60.19 1t8o n SER 11 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1t8o n ILE 16 N -1.29 -1.34 -3.20 0.44 5.41 0.35 -5.08 119.36 114.65 1t8o n ILE 16 Ca 0.01 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.37 1t8o n ILE 16 Cb 0.47 -1.34 -0.05 0.00 -0.71 0.00 0.00 39.64 38.00 1t8o n ILE 16 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1t8o s VAL 17 N -0.17 5.06 -1.55 1.39 1.01 0.11 -4.06 120.40 122.19 1t8o s VAL 17 Ca 0.00 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.18 1t8o s VAL 17 Cb 0.00 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.46 1t8o s VAL 17 CO 0.00 0.33 0.00 -3.20 0.00 0.00 0.00 175.10 172.23 1t8o n ASN 18 N 3.41 -5.20 -0.47 3.32 5.15 -1.26 -2.46 115.26 117.75 1t8o n ASN 18 Ca -0.05 0.01 0.00 0.00 -0.60 0.00 0.00 54.58 53.94 1t8o n ASN 18 Cb 0.51 -4.27 0.00 0.00 -0.53 0.00 0.00 39.78 35.49 1t8o n ASN 18 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1t8o n GLY 19 N -1.00 1.58 3.10 8.20 0.00 -1.26 -4.79 105.19 111.02 1t8o n GLY 19 Ca -0.21 -1.93 -0.08 0.00 0.00 0.00 0.00 46.02 43.80 1t8o n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1t8o s GLU 20 N 2.81 0.60 0.28 1.61 1.03 0.56 -4.94 118.70 120.65 1t8o s GLU 20 Ca 0.00 -1.01 -0.30 0.00 0.03 0.00 0.00 54.97 53.69 1t8o s GLU 20 Cb 0.00 0.22 -0.10 0.00 -0.80 0.00 0.00 34.13 33.45 1t8o s GLU 20 CO 0.00 -0.13 1.42 -2.00 -1.33 0.00 0.00 175.26 173.22 1t8o s GLU 21 N -3.34 4.26 0.48 -4.83 2.12 -1.26 -0.57 118.70 115.56 1t8o s GLU 21 Ca 0.01 2.32 -0.08 0.00 0.36 0.00 0.00 54.97 57.59 1t8o s GLU 21 Cb 0.03 -3.08 -0.05 0.00 0.26 0.00 0.00 34.13 31.29 1t8o s GLU 21 CO -0.08 -0.39 0.82 0.00 -0.54 0.00 0.00 175.26 175.07 1t8o s ALA 22 N -0.34 3.33 0.08 6.30 0.00 -0.50 -4.82 121.76 125.81 1t8o s ALA 22 Ca 0.57 -0.34 -0.31 0.00 0.00 0.00 0.00 51.96 51.88 1t8o s ALA 22 Cb -0.42 -2.71 -0.07 0.00 0.00 0.00 0.00 23.12 19.93 1t8o s ALA 22 CO 0.47 -0.29 1.28 0.08 0.00 0.00 0.00 175.76 177.30 1t8o s VAL 23 N -2.69 3.73 -0.16 0.00 1.01 -1.26 -4.89 120.40 116.14 1t8o s VAL 23 Ca 0.50 1.24 -0.39 0.00 0.00 0.00 0.00 61.98 63.33 1t8o s VAL 23 Cb -0.10 -3.79 -0.16 0.00 0.00 0.00 0.00 36.38 32.32 1t8o s VAL 23 CO 0.42 0.09 1.61 -2.65 0.00 0.00 0.00 175.10 174.57 1t8o n PRO 24 N 3.99 1.15 -0.96 2.72 -0.02 -1.26 -1.25 135.00 139.37 1t8o n PRO 24 Ca 0.10 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1t8o n PRO 24 Cb 0.45 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1t8o n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1t8o n GLY 25 N 3.64 0.55 0.00 -1.23 0.00 -1.26 -4.91 105.19 101.98 1t8o n GLY 25 Ca 0.24 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.40 1t8o n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1t8o n SER 26 N -0.13 0.00 -3.22 1.61 3.41 -0.38 -3.60 113.62 111.31 1t8o n SER 26 Ca 0.00 -0.34 -0.24 0.00 -0.26 0.00 0.00 58.87 58.03 1t8o n SER 26 Cb 0.06 -0.20 -0.06 0.00 -0.26 0.00 0.00 64.21 63.75 1t8o n SER 26 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1t8o n TRP 27 N -1.20 1.36 0.26 7.33 7.02 -1.26 -4.41 117.44 126.53 1t8o n TRP 27 Ca 0.16 -3.82 0.12 0.00 -1.02 0.00 0.00 57.50 52.94 1t8o n TRP 27 Cb 0.19 -0.44 0.66 0.00 -2.42 0.00 0.00 31.31 29.30 1t8o n TRP 27 CO 0.00 0.00 0.00 -1.00 -2.02 0.00 0.00 177.69 174.67 1t8o h PRO 28 N 3.71 0.00 0.00 -0.99 0.13 -1.77 -1.36 132.00 131.72 1t8o h PRO 28 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1t8o h PRO 28 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1t8o h PRO 28 CO 0.61 0.00 -0.85 -2.67 -0.23 0.00 0.00 178.00 174.86 1t8o n TRP 29 N -2.56 0.45 -1.99 1.56 2.14 -1.12 -2.17 117.44 113.76 1t8o n TRP 29 Ca -0.02 0.13 -0.42 0.00 2.07 0.00 0.00 57.50 59.26 1t8o n TRP 29 Cb 0.32 -0.58 -0.03 0.00 -0.81 0.00 0.00 31.31 30.21 1t8o n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1t8o s GLN 30 N -3.20 4.21 0.29 -2.67 2.00 -0.52 -0.95 119.66 118.82 1t8o s GLN 30 Ca 0.04 2.24 0.10 0.00 -2.00 0.00 0.00 55.36 55.74 1t8o s GLN 30 Cb 0.14 -3.67 -0.06 0.00 0.80 0.00 0.00 33.01 30.22 1t8o s GLN 30 CO 0.76 -0.73 -0.14 0.14 -0.50 0.00 0.00 175.29 174.83 1t8o s VAL 31 N 2.86 2.15 -0.15 1.34 -7.23 -0.50 -4.44 120.40 114.42 1t8o s VAL 31 Ca 0.72 -2.27 -0.01 0.00 -1.81 0.00 0.00 61.98 58.61 1t8o s VAL 31 Cb -0.37 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.16 1t8o s VAL 31 CO 0.31 -0.35 -0.10 -0.55 -0.31 0.00 0.00 175.10 174.09 1t8o s SER 32 N -3.50 4.17 -0.25 4.85 0.15 -0.45 -2.05 113.70 116.62 1t8o s SER 32 Ca 0.29 -0.31 -0.14 0.00 0.70 0.00 0.00 55.95 56.49 1t8o s SER 32 Cb -0.01 -1.66 -0.04 0.00 -1.71 0.00 0.00 66.02 62.61 1t8o s SER 32 CO 0.14 0.13 0.34 -0.76 1.20 0.00 0.00 173.24 174.28 1t8o s LEU 33 N 0.56 4.07 0.16 3.45 1.43 0.88 -0.85 118.68 128.39 1t8o s LEU 33 Ca -0.07 0.30 0.06 0.00 -1.03 0.00 0.00 54.13 53.39 1t8o s LEU 33 Cb -0.15 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 1t8o s LEU 33 CO 0.03 -0.12 -0.13 -1.10 0.23 0.00 0.00 176.35 175.27 1t8o s GLN 34 N 1.74 1.15 0.81 1.70 -0.21 -0.72 -1.35 119.66 122.78 1t8o s GLN 34 Ca 0.14 -1.44 -0.10 0.00 0.02 0.00 0.00 55.36 53.99 1t8o s GLN 34 Cb -0.15 -0.90 0.18 0.00 1.00 0.00 0.00 33.01 33.14 1t8o s GLN 34 CO 0.09 0.15 1.10 -0.40 -2.12 0.00 0.00 175.29 174.11 1t8o n ASP 35 N -0.04 0.49 0.31 5.90 5.68 -0.51 -0.87 116.55 127.51 1t8o n ASP 35 Ca -0.11 -1.64 0.18 0.00 -0.50 0.00 0.00 54.79 52.71 1t8o n ASP 35 Cb 0.59 -0.81 0.95 0.00 -1.14 0.00 0.00 41.12 40.72 1t8o n ASP 35 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1t8o h LYS 36 N 0.00 0.00 -0.00 0.11 2.10 -1.92 -0.88 116.57 115.97 1t8o h LYS 36 Ca -0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 1t8o h LYS 36 Cb 1.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 1t8o h LYS 36 CO 0.29 0.00 -0.62 0.25 -2.00 0.00 0.00 179.45 177.37 1t8o n THR 37 N -2.87 0.00 0.00 0.07 -2.24 -1.26 -4.94 114.28 103.03 1t8o n THR 37 Ca -0.02 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1t8o n THR 37 Cb 0.21 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1t8o n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t8o n GLY 38 N 1.47 1.03 3.65 3.38 0.00 -0.34 -5.07 105.19 109.32 1t8o n GLY 38 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1t8o n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1t8o s PHE 39 N -2.00 3.29 -0.15 1.61 5.36 -1.26 -4.77 117.98 120.06 1t8o s PHE 39 Ca 0.00 1.39 -0.29 0.00 -0.96 0.00 0.00 56.93 57.06 1t8o s PHE 39 Cb 0.00 -3.39 -0.02 0.00 -0.34 0.00 0.00 43.02 39.27 1t8o s PHE 39 CO 0.00 -0.56 1.32 -1.58 -1.46 0.00 0.00 175.22 172.94 1t8o s HIS 40 N 3.32 2.72 -0.03 10.12 5.65 -1.26 -1.43 115.29 134.39 1t8o s HIS 40 Ca 0.44 0.89 0.01 0.00 0.25 0.00 0.00 55.06 56.66 1t8o s HIS 40 Cb -0.14 -3.56 -0.02 0.00 -1.18 0.00 0.00 32.58 27.68 1t8o s HIS 40 CO 0.09 -2.01 0.04 1.97 -0.65 0.00 0.00 174.74 174.18 1t8o n PHE 41 N 6.68 0.00 -3.63 3.88 -1.74 -0.45 -5.00 117.46 117.19 1t8o n PHE 41 Ca 0.14 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.96 1t8o n PHE 41 Cb 0.45 -0.01 -0.02 0.00 1.52 0.00 0.00 39.48 41.41 1t8o n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1t8o s GLY 43 N -2.76 2.09 0.23 0.00 0.00 0.82 -0.08 107.32 107.62 1t8o s GLY 43 Ca 0.08 -1.68 -0.22 0.00 0.00 0.00 0.00 44.72 42.90 1t8o s GLY 43 CO -0.03 -1.80 0.89 -0.32 0.00 0.00 0.00 173.10 171.83 1t8o s GLY 44 N -4.41 -0.02 -0.04 0.20 0.00 -0.87 -3.56 107.32 98.62 1t8o s GLY 44 Ca 0.47 -0.23 0.01 0.00 0.00 0.00 0.00 44.72 44.97 1t8o s GLY 44 CO 0.29 0.39 -0.04 -0.56 0.00 0.00 0.00 173.10 173.18 1t8o s SER 45 N -3.05 0.97 0.08 1.64 0.01 -0.40 -1.42 113.70 111.53 1t8o s SER 45 Ca 0.14 -0.13 -0.30 0.00 1.31 0.00 0.00 55.95 56.97 1t8o s SER 45 Cb -0.03 -0.45 -0.06 0.00 0.21 0.00 0.00 66.02 65.69 1t8o s SER 45 CO 0.06 -0.06 1.16 -0.76 0.41 0.00 0.00 173.24 174.05 1t8o s LEU 46 N 0.95 4.39 0.00 2.44 1.43 -0.12 -0.69 118.68 127.07 1t8o s LEU 46 Ca -0.11 2.00 0.12 0.00 -1.03 0.00 0.00 54.13 55.11 1t8o s LEU 46 Cb -0.14 -3.58 -0.08 0.00 0.03 0.00 0.00 46.19 42.41 1t8o s LEU 46 CO -0.00 -0.40 0.57 2.30 0.23 0.00 0.00 176.35 179.05 1t8o n ILE 47 N 3.58 0.00 -4.01 -0.59 -5.35 -0.65 -1.33 119.36 111.01 1t8o n ILE 47 Ca 0.07 -0.28 0.03 0.00 -0.27 0.00 0.00 62.75 62.30 1t8o n ILE 47 Cb 0.47 1.05 0.01 0.00 -1.74 0.00 0.00 39.64 39.43 1t8o n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1t8o n ASN 48 N -0.87 -1.05 0.17 7.28 0.23 -1.24 -4.70 115.26 115.07 1t8o n ASN 48 Ca 0.03 -1.16 0.13 0.00 -0.53 0.00 0.00 54.58 53.05 1t8o n ASN 48 Cb 0.21 1.62 0.59 0.00 -2.08 0.00 0.00 39.78 40.11 1t8o n ASN 48 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1t8o h GLU 49 N 0.00 0.00 -0.00 -3.83 3.07 -1.96 -3.22 114.58 108.64 1t8o h GLU 49 Ca -0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.67 1t8o h GLU 49 Cb 1.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.99 1t8o h GLU 49 CO 0.28 0.00 -0.02 0.09 -1.40 0.00 0.00 179.01 177.96 1t8o n ASN 50 N -2.40 0.79 -4.04 1.42 3.02 -1.26 -0.01 115.26 112.78 1t8o n ASN 50 Ca 0.01 -0.90 -0.17 0.00 -0.03 0.00 0.00 54.58 53.49 1t8o n ASN 50 Cb 0.18 0.32 -0.14 0.00 -0.61 0.00 0.00 39.78 39.53 1t8o n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1t8o s TRP 51 N -0.45 0.80 -0.03 3.10 0.52 -1.22 -0.80 118.94 120.87 1t8o s TRP 51 Ca 0.01 -0.23 0.05 0.00 0.02 0.00 0.00 56.10 55.95 1t8o s TRP 51 Cb 0.01 -0.50 -0.01 0.00 -1.15 0.00 0.00 33.47 31.82 1t8o s TRP 51 CO 0.03 -0.01 -0.18 0.08 0.02 0.00 0.00 176.95 176.89 1t8o s VAL 52 N -0.50 1.45 -0.11 4.03 1.01 -0.36 -1.63 120.40 124.30 1t8o s VAL 52 Ca 0.01 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1t8o s VAL 52 Cb -0.05 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 1t8o s VAL 52 CO 0.00 0.41 -0.04 0.54 0.00 0.00 0.00 175.10 176.01 1t8o s VAL 53 N -0.24 3.88 0.00 2.92 0.11 0.13 -0.19 120.40 127.01 1t8o s VAL 53 Ca 0.03 -0.39 0.00 0.00 -2.93 0.00 0.00 61.98 58.69 1t8o s VAL 53 Cb -0.09 -2.64 0.00 0.00 -1.53 0.00 0.00 36.38 32.12 1t8o s VAL 53 CO 0.01 0.56 0.00 1.07 -3.33 0.00 0.00 175.10 173.40 1t8o n THR 54 N 2.75 0.00 -3.49 5.04 5.66 -0.02 -1.28 114.28 122.94 1t8o n THR 54 Ca -0.18 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.49 1t8o n THR 54 Cb 0.53 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.26 1t8o n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1t8o s ALA 55 N -1.66 3.65 0.24 1.79 0.00 -1.26 -1.13 121.76 123.38 1t8o s ALA 55 Ca 0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 51.96 51.63 1t8o s ALA 55 Cb 0.00 -2.36 0.29 0.00 0.00 0.00 0.00 23.12 21.05 1t8o s ALA 55 CO 0.00 0.54 1.65 0.00 0.00 0.00 0.00 175.76 177.95 1t8o h ALA 56 N 3.03 0.95 0.00 0.00 0.00 -1.74 -2.90 119.26 118.60 1t8o h ALA 56 Ca -0.47 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.04 1t8o h ALA 56 Cb 1.18 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1t8o h ALA 56 CO 0.69 0.61 0.00 -2.39 0.00 0.00 0.00 179.25 178.16 1t8o n HIS 57 N -4.07 0.17 0.31 0.00 1.44 -1.26 -2.03 115.22 109.77 1t8o n HIS 57 Ca -0.01 0.07 0.16 0.00 -2.01 0.00 0.00 57.72 55.93 1t8o n HIS 57 Cb 0.46 -0.61 0.68 0.00 0.12 0.00 0.00 29.99 30.64 1t8o n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1t8o n GLY 59 N -0.08 -0.52 3.76 0.00 0.00 -0.86 -4.94 105.19 102.55 1t8o n GLY 59 Ca 0.01 0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1t8o n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t8o s VAL 60 N -3.25 2.06 0.32 1.61 1.01 -1.26 -5.03 120.40 115.85 1t8o s VAL 60 Ca 0.56 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.61 1t8o s VAL 60 Cb -0.26 -3.03 -0.06 0.00 0.00 0.00 0.00 36.38 33.03 1t8o s VAL 60 CO 0.69 0.00 0.08 0.42 0.00 0.00 0.00 175.10 176.29 1t8o s THR 61 N -1.25 0.95 -1.79 3.92 -4.23 -1.26 -4.96 115.64 107.02 1t8o s THR 61 Ca 0.66 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.34 1t8o s THR 61 Cb -0.42 -2.70 0.42 0.00 1.34 0.00 0.00 72.50 71.14 1t8o s THR 61 CO 0.52 0.00 1.46 0.35 -0.54 0.00 0.00 174.62 176.41 1t8o n THR 62 N -0.66 0.19 0.35 3.99 -2.24 -1.26 -1.73 114.28 112.91 1t8o n THR 62 Ca -0.02 0.05 0.12 0.00 -2.27 0.00 0.00 64.05 61.92 1t8o n THR 62 Cb 0.66 -0.78 0.09 0.00 -2.10 0.00 0.00 70.33 68.21 1t8o n THR 62 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1t8o h SER 63 N 0.00 0.00 -4.03 3.42 0.02 -1.95 -3.41 113.55 107.60 1t8o h SER 63 Ca 0.00 -0.12 -0.46 0.00 -0.84 0.00 0.00 61.79 60.37 1t8o h SER 63 Cb 0.06 0.00 0.08 0.00 0.14 0.00 0.00 62.40 62.68 1t8o h SER 63 CO 0.00 0.06 0.28 -1.81 -1.14 0.00 0.00 176.83 174.22 1t8o s ASP 64 N -4.82 4.87 0.10 3.07 1.01 -0.71 -4.05 116.67 116.14 1t8o s ASP 64 Ca 0.03 0.62 0.05 0.00 0.71 0.00 0.00 52.55 53.96 1t8o s ASP 64 Cb 0.11 -1.28 -0.04 0.00 1.01 0.00 0.00 42.92 42.73 1t8o s ASP 64 CO 0.75 -1.60 -0.12 0.68 0.21 0.00 0.00 175.17 175.09 1t8o s VAL 65 N -3.31 1.08 -0.24 -1.27 -7.23 -0.05 -4.07 120.40 105.31 1t8o s VAL 65 Ca 0.60 -1.60 -0.09 0.00 -1.81 0.00 0.00 61.98 59.07 1t8o s VAL 65 Cb -0.11 -1.35 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 1t8o s VAL 65 CO 0.46 -0.46 0.13 -0.69 -0.31 0.00 0.00 175.10 174.23 1t8o s VAL 66 N -2.15 5.03 -0.32 1.32 1.01 0.27 -1.75 120.40 123.80 1t8o s VAL 66 Ca 0.05 0.07 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 1t8o s VAL 66 Cb -0.05 -3.34 0.03 0.00 0.00 0.00 0.00 36.38 33.02 1t8o s VAL 66 CO 0.01 0.35 0.09 -0.69 0.00 0.00 0.00 175.10 174.87 1t8o s VAL 67 N 1.12 3.80 0.20 2.92 1.01 -0.03 0.37 120.40 129.79 1t8o s VAL 67 Ca 0.06 -1.01 0.06 0.00 0.00 0.00 0.00 61.98 61.09 1t8o s VAL 67 Cb -0.14 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 1t8o s VAL 67 CO 0.04 -0.09 0.14 0.00 0.00 0.00 0.00 175.10 175.20 1t8o s ALA 68 N 1.43 3.54 -0.92 5.51 0.00 -0.26 -1.34 121.76 129.71 1t8o s ALA 68 Ca -0.00 -1.31 0.00 0.00 0.00 0.00 0.00 51.96 50.64 1t8o s ALA 68 Cb -0.19 -1.30 0.00 0.00 0.00 0.00 0.00 23.12 21.63 1t8o s ALA 68 CO 0.02 0.40 0.00 0.41 0.00 0.00 0.00 175.76 176.60 1t8o n GLY 69 N -0.65 0.94 3.90 0.00 0.00 -1.26 -1.33 105.19 106.79 1t8o n GLY 69 Ca -0.08 -0.62 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 1t8o n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1t8o s GLU 70 N -2.95 3.63 0.18 1.61 2.12 -1.26 -4.66 118.70 117.37 1t8o s GLU 70 Ca 0.00 -0.06 0.00 0.00 0.36 0.00 0.00 54.97 55.27 1t8o s GLU 70 Cb 0.00 -2.82 0.00 0.00 0.26 0.00 0.00 34.13 31.57 1t8o s GLU 70 CO 0.00 0.44 0.00 0.34 -0.54 0.00 0.00 175.26 175.50 1t8o n PHE 71 N -0.02 -1.36 -3.56 5.30 7.35 -1.26 -4.81 117.46 119.10 1t8o n PHE 71 Ca -0.02 0.24 -0.41 0.00 -0.76 0.00 0.00 57.45 56.50 1t8o n PHE 71 Cb 0.52 0.37 -0.09 0.00 0.35 0.00 0.00 39.48 40.63 1t8o n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1t8o s ASP 72 N -5.30 5.71 0.02 -2.13 -1.08 -1.26 -1.43 116.67 111.20 1t8o s ASP 72 Ca 0.00 -1.61 0.16 0.00 -0.52 0.00 0.00 52.55 50.58 1t8o s ASP 72 Cb 0.00 -2.02 0.67 0.00 -1.46 0.00 0.00 42.92 40.12 1t8o s ASP 72 CO 0.00 -0.60 1.50 0.00 0.52 0.00 0.00 175.17 176.59 1t8o n GLN 73 N 4.95 0.02 -0.05 4.34 6.02 0.25 -1.92 117.38 130.98 1t8o n GLN 73 Ca -0.10 0.26 0.12 0.00 -0.01 0.00 0.00 57.00 57.27 1t8o n GLN 73 Cb 0.42 -1.53 0.33 0.00 1.02 0.00 0.00 30.24 30.48 1t8o n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1t8o n GLY 74 N 0.05 0.62 3.49 1.08 0.00 -1.26 -4.82 105.19 104.35 1t8o n GLY 74 Ca 0.03 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.11 1t8o n GLY 74 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t8o s SER 75 N -1.80 5.82 0.41 1.61 0.15 -0.81 -4.95 113.70 114.13 1t8o s SER 75 Ca 0.34 -0.45 0.22 0.00 0.70 0.00 0.00 55.95 56.77 1t8o s SER 75 Cb 0.20 -2.07 0.45 0.00 -1.71 0.00 0.00 66.02 62.89 1t8o s SER 75 CO 0.30 -0.21 1.63 0.77 1.20 0.00 0.00 173.24 176.94 1t8o h SER 76 N 8.42 0.00 0.78 5.45 4.64 -1.87 -3.28 113.55 127.69 1t8o h SER 76 Ca -0.32 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.77 1t8o h SER 76 Cb 1.15 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.21 1t8o h SER 76 CO 0.62 0.16 -1.32 0.77 -0.87 0.00 0.00 176.83 176.18 1t8o h SER 77 N 0.00 0.00 -1.70 4.97 4.64 -1.96 -3.47 113.55 116.03 1t8o h SER 77 Ca -0.00 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.64 1t8o h SER 77 Cb 1.02 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 63.17 1t8o h SER 77 CO 0.02 0.88 0.38 1.21 -0.87 0.00 0.00 176.83 178.45 1t8o n GLU 78 N -3.13 1.08 -2.68 4.77 2.13 -1.24 -4.89 120.64 116.69 1t8o n GLU 78 Ca -0.09 0.39 -0.42 0.00 0.66 0.00 0.00 57.16 57.70 1t8o n GLU 78 Cb 0.95 -1.98 -0.03 0.00 0.27 0.00 0.00 31.44 30.65 1t8o n GLU 78 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1t8o s LYS 79 N 0.24 4.43 0.31 5.31 1.02 -1.26 -5.02 119.74 124.76 1t8o s LYS 79 Ca 0.82 1.41 0.05 0.00 0.02 0.00 0.00 55.97 58.27 1t8o s LYS 79 Cb -0.95 -3.54 -0.03 0.00 -0.52 0.00 0.00 37.83 32.80 1t8o s LYS 79 CO 0.49 -0.31 0.27 0.96 -0.92 0.00 0.00 175.35 175.84 1t8o s ILE 80 N 1.96 0.00 -0.24 2.17 -4.36 -1.26 -4.74 121.20 114.72 1t8o s ILE 80 Ca 0.49 -1.96 0.02 0.00 -0.26 0.00 0.00 60.65 58.94 1t8o s ILE 80 Cb -0.19 -2.51 0.06 0.00 1.25 0.00 0.00 42.46 41.07 1t8o s ILE 80 CO 0.19 0.00 -0.09 -1.10 0.24 0.00 0.00 174.94 174.18 1t8o s GLN 81 N -3.55 2.01 -0.50 0.37 -0.21 -0.44 -4.99 119.66 112.35 1t8o s GLN 81 Ca 0.40 -1.14 -0.21 0.00 0.02 0.00 0.00 55.36 54.43 1t8o s GLN 81 Cb 0.03 -2.71 0.05 0.00 1.00 0.00 0.00 33.01 31.37 1t8o s GLN 81 CO 0.24 -0.55 0.72 0.15 -2.12 0.00 0.00 175.29 173.73 1t8o s LYS 82 N 1.25 3.22 -0.17 2.91 1.02 -1.26 -1.10 119.74 125.60 1t8o s LYS 82 Ca -0.06 -0.60 -0.06 0.00 0.02 0.00 0.00 55.97 55.27 1t8o s LYS 82 Cb -0.19 -4.05 -0.03 0.00 -0.52 0.00 0.00 37.83 33.03 1t8o s LYS 82 CO -0.06 -1.25 0.02 -0.51 -0.92 0.00 0.00 175.35 172.62 1t8o s LEU 83 N 3.05 3.57 0.53 3.17 1.43 0.16 -4.95 118.68 125.64 1t8o s LEU 83 Ca 0.21 -0.01 -0.18 0.00 -1.03 0.00 0.00 54.13 53.12 1t8o s LEU 83 Cb -0.16 -1.88 -0.07 0.00 0.03 0.00 0.00 46.19 44.11 1t8o s LEU 83 CO 0.15 0.17 1.03 -0.54 0.23 0.00 0.00 176.35 177.40 1t8o s LYS 84 N 0.36 3.66 -0.25 1.70 1.02 -1.26 -0.57 119.74 124.41 1t8o s LYS 84 Ca -0.00 1.20 -0.09 0.00 0.02 0.00 0.00 55.97 57.10 1t8o s LYS 84 Cb -0.13 -2.08 -0.04 0.00 -0.52 0.00 0.00 37.83 35.05 1t8o s LYS 84 CO 0.01 -0.53 0.13 0.42 -0.92 0.00 0.00 175.35 174.47 1t8o s ILE 85 N -2.31 5.02 -0.03 2.17 1.01 -1.26 -1.22 121.20 124.58 1t8o s ILE 85 Ca 0.64 0.06 -0.19 0.00 0.00 0.00 0.00 60.65 61.16 1t8o s ILE 85 Cb -0.14 -3.35 -0.33 0.00 0.01 0.00 0.00 42.46 38.65 1t8o s ILE 85 CO 0.28 0.33 0.89 0.00 0.00 0.00 0.00 174.94 176.45 1t8o h ALA 86 N 7.83 -0.09 -2.29 9.38 0.00 -0.70 -3.44 119.26 129.95 1t8o h ALA 86 Ca -0.37 -0.80 -0.09 0.00 0.00 0.00 0.00 54.91 53.65 1t8o h ALA 86 Cb 1.18 0.17 -0.20 0.00 0.00 0.00 0.00 17.79 18.94 1t8o h ALA 86 CO 0.61 0.55 -0.05 0.21 0.00 0.00 0.00 179.25 180.56 1t8o s LYS 87 N -2.50 0.83 -0.17 0.00 2.20 -1.04 -4.97 119.74 114.08 1t8o s LYS 87 Ca -0.13 0.12 -0.03 0.00 -0.36 0.00 0.00 55.97 55.58 1t8o s LYS 87 Cb 0.02 0.38 -0.02 0.00 -1.51 0.00 0.00 37.83 36.71 1t8o s LYS 87 CO 0.87 -0.23 -0.07 0.08 -0.36 0.00 0.00 175.35 175.64 1t8o s VAL 88 N -1.06 3.40 -0.56 4.02 1.01 -1.26 -1.36 120.40 124.58 1t8o s VAL 88 Ca -0.11 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1t8o s VAL 88 Cb -0.03 -2.49 0.15 0.00 0.00 0.00 0.00 36.38 34.00 1t8o s VAL 88 CO 0.06 0.47 0.37 -0.36 0.00 0.00 0.00 175.10 175.65 1t8o s PHE 89 N 0.81 3.45 -0.01 5.22 0.40 0.77 -4.99 117.98 123.63 1t8o s PHE 89 Ca -0.02 -2.66 -0.25 0.00 -0.60 0.00 0.00 56.93 53.39 1t8o s PHE 89 Cb -0.15 -3.19 -0.04 0.00 0.51 0.00 0.00 43.02 40.15 1t8o s PHE 89 CO 0.01 -0.87 0.77 0.21 0.70 0.00 0.00 175.22 176.04 1t8o s LYS 90 N 0.24 4.48 0.06 0.44 2.20 -1.26 -0.61 119.74 125.29 1t8o s LYS 90 Ca 0.15 1.04 -0.30 0.00 -0.36 0.00 0.00 55.97 56.50 1t8o s LYS 90 Cb -0.21 -3.41 -0.09 0.00 -1.51 0.00 0.00 37.83 32.60 1t8o s LYS 90 CO -0.03 0.14 1.95 1.21 -0.36 0.00 0.00 175.35 178.26 1t8o s ASN 91 N 0.46 6.43 0.38 1.43 3.84 -0.95 -4.82 114.94 121.71 1t8o s ASN 91 Ca 0.40 2.71 0.26 0.00 0.21 0.00 0.00 52.86 56.44 1t8o s ASN 91 Cb -0.19 -2.54 1.36 0.00 -0.55 0.00 0.00 41.25 39.33 1t8o s ASN 91 CO 0.22 -1.05 1.80 0.77 -2.79 0.00 0.00 177.10 176.04 1t8o h SER 92 N 10.25 0.00 -0.06 -4.21 4.64 -1.93 -0.88 113.55 121.35 1t8o h SER 92 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1t8o h SER 92 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1t8o h SER 92 CO 0.94 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 177.19 1t8o n LYS 93 N -2.42 1.71 -1.70 4.77 5.02 -1.26 -4.89 118.16 119.39 1t8o n LYS 93 Ca -0.01 -1.05 -0.43 0.00 -2.02 0.00 0.00 58.31 54.80 1t8o n LYS 93 Cb 0.08 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.60 1t8o n LYS 93 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1t8o n TYR 94 N 0.27 2.61 -3.48 2.13 9.36 -0.34 -4.67 117.16 123.04 1t8o n TYR 94 Ca 0.18 0.03 -0.43 0.00 3.32 0.00 0.00 57.90 61.00 1t8o n TYR 94 Cb 0.36 -2.67 -0.09 0.00 -0.63 0.00 0.00 39.34 36.31 1t8o n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1t8o s ASN 95 N 1.67 5.98 0.00 2.98 3.84 -0.39 -4.94 114.94 124.07 1t8o s ASN 95 Ca 0.78 -1.20 0.12 0.00 0.21 0.00 0.00 52.86 52.78 1t8o s ASN 95 Cb -0.54 -2.12 0.62 0.00 -0.55 0.00 0.00 41.25 38.66 1t8o s ASN 95 CO 0.35 -0.54 1.32 -1.54 -2.79 0.00 0.00 177.10 173.91 1t8o n SER 96 N 5.11 0.00 -0.13 -4.21 3.41 -1.26 0.53 113.62 117.07 1t8o n SER 96 Ca -0.12 0.15 -0.23 0.00 -0.26 0.00 0.00 58.87 58.41 1t8o n SER 96 Cb 0.45 -0.31 -0.11 0.00 -0.26 0.00 0.00 64.21 63.98 1t8o n SER 96 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1t8o n LEU 97 N -1.31 2.43 0.02 1.04 4.77 -1.26 -4.59 117.00 118.11 1t8o n LEU 97 Ca 0.06 0.10 0.11 0.00 -0.03 0.00 0.00 56.01 56.25 1t8o n LEU 97 Cb 0.10 -0.83 -0.02 0.00 -2.33 0.00 0.00 43.42 40.34 1t8o n LEU 97 CO 0.10 0.74 -0.12 0.35 -1.33 0.00 0.00 177.39 177.12 1t8o n THR 98 N -3.72 0.16 -1.04 -5.08 -2.24 -1.17 -4.96 114.28 96.22 1t8o n THR 98 Ca -0.49 -0.28 -0.01 0.00 -2.27 0.00 0.00 64.05 61.00 1t8o n THR 98 Cb 0.92 0.21 -0.01 0.00 -2.10 0.00 0.00 70.33 69.36 1t8o n THR 98 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1t8o n ILE 99 N -2.01 0.00 -2.40 2.28 5.41 0.19 -4.96 119.36 117.86 1t8o n ILE 99 Ca 0.01 0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.43 1t8o n ILE 99 Cb 0.45 -0.44 -0.02 0.00 -0.71 0.00 0.00 39.64 38.92 1t8o n ILE 99 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1t8o s ASN 100 N -2.20 6.21 -1.14 4.38 2.47 -1.23 -3.71 114.94 119.73 1t8o s ASN 100 Ca 0.00 1.88 -0.04 0.00 0.42 0.00 0.00 52.86 55.12 1t8o s ASN 100 Cb 0.00 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.25 1t8o s ASN 100 CO 0.00 -0.87 0.97 0.59 -3.72 0.00 0.00 177.10 174.07 1t8o n ASN 101 N -1.28 -3.96 -4.19 -4.21 3.02 -1.26 -1.27 115.26 102.11 1t8o n ASN 101 Ca 0.09 -0.52 -0.43 0.00 -0.03 0.00 0.00 54.58 53.70 1t8o n ASN 101 Cb 0.53 -4.58 0.00 0.00 -0.61 0.00 0.00 39.78 35.11 1t8o n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1t8o n ASP 102 N -2.71 4.57 -3.80 6.41 2.03 -1.24 -3.94 116.55 117.87 1t8o n ASP 102 Ca -0.13 -2.91 -0.13 0.00 0.52 0.00 0.00 54.79 52.15 1t8o n ASP 102 Cb 0.60 -1.68 -0.11 0.00 -0.72 0.00 0.00 41.12 39.22 1t8o n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1t8o s ILE 103 N 3.27 0.03 -0.03 5.18 2.07 -1.26 -3.60 121.20 126.86 1t8o s ILE 103 Ca 0.49 -0.21 -0.04 0.00 -1.41 0.00 0.00 60.65 59.48 1t8o s ILE 103 Cb 0.08 -0.42 0.01 0.00 0.13 0.00 0.00 42.46 42.25 1t8o s ILE 103 CO 0.00 -0.12 0.10 -0.89 -1.91 0.00 0.00 174.94 172.13 1t8o s THR 104 N -0.41 0.03 -0.05 4.00 2.01 -0.29 -2.23 115.64 118.70 1t8o s THR 104 Ca -0.05 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 61.74 1t8o s THR 104 Cb -0.03 -0.22 -0.03 0.00 0.01 0.00 0.00 72.50 72.23 1t8o s THR 104 CO 0.01 -0.11 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.03 1t8o s LEU 105 N -0.34 3.34 -0.16 4.42 1.43 0.22 -0.84 118.68 126.75 1t8o s LEU 105 Ca -0.04 0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.08 1t8o s LEU 105 Cb -0.03 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1t8o s LEU 105 CO 0.00 0.35 -0.18 -0.76 0.23 0.00 0.00 176.35 175.99 1t8o s LEU 106 N -1.02 2.28 -0.27 1.79 1.43 0.73 -0.16 118.68 123.46 1t8o s LEU 106 Ca 0.14 -0.56 -0.13 0.00 -1.03 0.00 0.00 54.13 52.55 1t8o s LEU 106 Cb -0.11 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 1t8o s LEU 106 CO 0.04 0.05 0.27 -0.75 0.23 0.00 0.00 176.35 176.19 1t8o s LYS 107 N 1.02 3.99 0.37 1.70 2.20 -0.47 -1.22 119.74 127.33 1t8o s LYS 107 Ca -0.02 -0.15 -0.26 0.00 -0.36 0.00 0.00 55.97 55.19 1t8o s LYS 107 Cb -0.15 -3.65 -0.09 0.00 -1.51 0.00 0.00 37.83 32.43 1t8o s LYS 107 CO -0.05 -0.21 1.10 -0.51 -0.36 0.00 0.00 175.35 175.32 1t8o s LEU 108 N 1.86 4.26 0.11 5.43 1.43 0.02 -0.07 118.68 131.72 1t8o s LEU 108 Ca 0.11 2.19 -0.14 0.00 -1.03 0.00 0.00 54.13 55.26 1t8o s LEU 108 Cb -0.16 -3.99 -0.07 0.00 0.03 0.00 0.00 46.19 42.00 1t8o s LEU 108 CO 0.10 -0.46 1.44 0.28 0.23 0.00 0.00 176.35 177.94 1t8o h SER 109 N 2.87 0.81 -3.38 2.29 0.02 -1.44 -3.41 113.55 111.31 1t8o h SER 109 Ca -0.48 -0.46 -0.60 0.00 -0.84 0.00 0.00 61.79 59.41 1t8o h SER 109 Cb 1.22 -0.23 -0.33 0.00 0.14 0.00 0.00 62.40 63.20 1t8o h SER 109 CO 0.63 1.10 -0.85 -0.89 -1.14 0.00 0.00 176.83 175.69 1t8o s THR 110 N -4.40 1.61 0.52 -2.27 2.01 -1.26 -4.96 115.64 106.88 1t8o s THR 110 Ca -0.12 -0.76 -0.22 0.00 0.31 0.00 0.00 61.69 60.91 1t8o s THR 110 Cb 0.09 -1.42 -0.07 0.00 0.01 0.00 0.00 72.50 71.11 1t8o s THR 110 CO 0.84 0.46 1.09 0.00 -0.69 0.00 0.00 174.62 176.32 1t8o n ALA 111 N 3.66 0.60 -1.80 7.40 0.00 -1.26 -4.82 120.51 124.30 1t8o n ALA 111 Ca -0.21 0.13 -0.35 0.00 0.00 0.00 0.00 53.44 53.01 1t8o n ALA 111 Cb 0.52 -2.17 -0.06 0.00 0.00 0.00 0.00 19.45 17.75 1t8o n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t8o s ALA 112 N -1.36 3.08 -0.56 0.00 0.00 0.98 -5.00 121.76 118.90 1t8o s ALA 112 Ca 0.69 0.54 -0.19 0.00 0.00 0.00 0.00 51.96 53.01 1t8o s ALA 112 Cb -0.47 -3.20 0.09 0.00 0.00 0.00 0.00 23.12 19.54 1t8o s ALA 112 CO 0.52 0.00 0.67 0.45 0.00 0.00 0.00 175.76 177.40 1t8o s SER 113 N -1.82 6.19 0.55 0.00 0.15 -1.26 -4.81 113.70 112.69 1t8o s SER 113 Ca 0.58 -1.28 -0.21 0.00 0.70 0.00 0.00 55.95 55.74 1t8o s SER 113 Cb -0.16 -2.30 -0.05 0.00 -1.71 0.00 0.00 66.02 61.80 1t8o s SER 113 CO 0.21 -1.04 1.30 -0.36 1.20 0.00 0.00 173.24 174.54 1t8o s PHE 114 N 2.65 2.39 0.00 3.44 0.40 -1.26 -4.81 117.98 120.79 1t8o s PHE 114 Ca 0.12 1.43 0.00 0.00 -0.60 0.00 0.00 56.93 57.89 1t8o s PHE 114 Cb -0.23 -3.67 0.00 0.00 0.51 0.00 0.00 43.02 39.63 1t8o s PHE 114 CO 0.08 -2.56 0.00 -1.13 0.70 0.00 0.00 175.22 172.31 1t8o n SER 115 N -1.08 0.00 0.27 1.36 3.41 0.13 -4.93 113.62 112.77 1t8o n SER 115 Ca 0.11 -0.34 0.13 0.00 -0.26 0.00 0.00 58.87 58.50 1t8o n SER 115 Cb 0.46 0.00 0.76 0.00 -0.26 0.00 0.00 64.21 65.18 1t8o n SER 115 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1t8o h GLN 116 N 0.00 0.00 -0.04 4.33 4.15 -1.98 -2.90 115.11 118.67 1t8o h GLN 116 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1t8o h GLN 116 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1t8o h GLN 116 CO 0.00 0.09 0.00 0.25 -1.93 0.00 0.00 178.83 177.24 1t8o n THR 117 N -3.80 0.20 -3.65 2.39 -2.24 -1.26 -4.24 114.28 101.67 1t8o n THR 117 Ca -0.02 -0.60 -0.25 0.00 -2.27 0.00 0.00 64.05 60.91 1t8o n THR 117 Cb 0.18 1.00 -0.17 0.00 -2.10 0.00 0.00 70.33 69.24 1t8o n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1t8o s VAL 118 N -0.60 0.02 0.39 2.28 1.01 -1.09 -4.19 120.40 118.23 1t8o s VAL 118 Ca 0.08 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.84 1t8o s VAL 118 Cb 0.05 -0.55 0.05 0.00 0.00 0.00 0.00 36.38 35.94 1t8o s VAL 118 CO 0.08 -0.14 0.77 -0.94 0.00 0.00 0.00 175.10 174.86 1t8o s SER 119 N 2.09 0.12 0.18 3.32 1.04 -0.92 0.17 113.70 119.71 1t8o s SER 119 Ca 0.02 -1.23 0.01 0.00 0.48 0.00 0.00 55.95 55.24 1t8o s SER 119 Cb -0.15 0.85 -0.04 0.00 0.10 0.00 0.00 66.02 66.78 1t8o s SER 119 CO -0.07 -1.68 0.34 0.00 0.98 0.00 0.00 173.24 172.80 1t8o s ALA 120 N -2.25 3.90 0.24 5.32 0.00 -1.26 -2.77 121.76 124.94 1t8o s ALA 120 Ca 0.17 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 51.18 1t8o s ALA 120 Cb -0.05 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 21.14 1t8o s ALA 120 CO 0.13 0.48 0.46 0.54 0.00 0.00 0.00 175.76 177.37 1t8o s VAL 121 N -1.81 5.13 0.42 0.00 0.11 -0.44 -1.27 120.40 122.54 1t8o s VAL 121 Ca 0.36 -0.23 -0.14 0.00 -2.93 0.00 0.00 61.98 59.05 1t8o s VAL 121 Cb -0.11 -3.74 -0.08 0.00 -1.53 0.00 0.00 36.38 30.92 1t8o s VAL 121 CO 0.29 -0.25 0.83 0.00 -3.33 0.00 0.00 175.10 172.64 1t8o s LEU 123 N -3.71 3.82 0.80 0.00 1.43 -1.26 -0.30 118.68 119.45 1t8o s LEU 123 Ca 0.54 0.09 -0.09 0.00 -1.03 0.00 0.00 54.13 53.64 1t8o s LEU 123 Cb -0.10 -2.28 0.12 0.00 0.03 0.00 0.00 46.19 43.96 1t8o s LEU 123 CO 0.28 0.25 1.12 -2.16 0.23 0.00 0.00 176.35 176.07 1t8o s PRO 124 N -1.85 1.61 0.15 1.29 0.04 -1.26 -4.89 135.00 130.09 1t8o s PRO 124 Ca 0.24 -0.41 -0.06 0.00 0.04 0.00 0.00 61.00 60.81 1t8o s PRO 124 Cb -0.12 -2.07 -0.06 0.00 0.04 0.00 0.00 34.50 32.29 1t8o s PRO 124 CO 0.15 -1.67 0.41 -1.12 0.04 0.00 0.00 177.00 174.81 1t8o s SER 125 N -4.67 6.54 0.56 6.66 0.01 -1.26 -4.95 113.70 116.58 1t8o s SER 125 Ca 0.66 0.68 0.28 0.00 1.31 0.00 0.00 55.95 58.87 1t8o s SER 125 Cb -0.08 -2.13 1.47 0.00 0.21 0.00 0.00 66.02 65.49 1t8o s SER 125 CO 0.48 0.05 1.96 0.00 0.41 0.00 0.00 173.24 176.13 1t8o h ALA 126 N 2.91 2.37 -0.01 1.44 0.00 -1.93 -0.71 119.26 123.33 1t8o h ALA 126 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1t8o h ALA 126 Cb 1.17 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1t8o h ALA 126 CO 0.71 -0.70 -0.24 -1.13 0.00 0.00 0.00 179.25 177.88 1t8o n SER 127 N -4.08 1.09 -4.74 0.00 3.41 -1.26 -4.73 113.62 103.32 1t8o n SER 127 Ca 0.10 -0.95 -0.40 0.00 -0.26 0.00 0.00 58.87 57.35 1t8o n SER 127 Cb 0.65 0.13 0.02 0.00 -0.26 0.00 0.00 64.21 64.75 1t8o n SER 127 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1t8o n ASP 128 N -0.57 3.01 -3.97 4.04 8.00 -0.27 -4.99 116.55 121.80 1t8o n ASP 128 Ca 0.13 1.11 -0.31 0.00 0.71 0.00 0.00 54.79 56.43 1t8o n ASP 128 Cb 0.35 -1.56 -0.15 0.00 -0.02 0.00 0.00 41.12 39.74 1t8o n ASP 128 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1t8o s ASP 129 N -0.50 4.31 -0.53 -2.24 2.15 -1.26 -4.99 116.67 113.62 1t8o s ASP 129 Ca 0.61 -1.60 -0.17 0.00 0.43 0.00 0.00 52.55 51.82 1t8o s ASP 129 Cb -0.47 -1.37 0.10 0.00 -0.30 0.00 0.00 42.92 40.87 1t8o s ASP 129 CO 0.58 -0.29 0.54 -0.36 -0.17 0.00 0.00 175.17 175.47 1t8o s PHE 130 N 1.19 3.16 0.49 -5.34 0.40 -1.26 -5.04 117.98 111.59 1t8o s PHE 130 Ca 0.01 -1.02 -0.22 0.00 -0.60 0.00 0.00 56.93 55.09 1t8o s PHE 130 Cb -0.19 -3.67 -0.08 0.00 0.51 0.00 0.00 43.02 39.59 1t8o s PHE 130 CO -0.09 -1.04 0.98 0.00 0.70 0.00 0.00 175.22 175.77 1t8o n ALA 131 N 5.63 0.16 -1.76 5.36 0.00 -1.26 -4.93 120.51 123.72 1t8o n ALA 131 Ca -0.12 0.14 -0.39 0.00 0.00 0.00 0.00 53.44 53.08 1t8o n ALA 131 Cb 0.42 -2.08 0.02 0.00 0.00 0.00 0.00 19.45 17.80 1t8o n ALA 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t8o s ALA 132 N -1.38 3.03 0.00 0.00 0.00 -1.26 -2.10 121.76 120.04 1t8o s ALA 132 Ca 0.67 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.91 1t8o s ALA 132 Cb -0.50 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.10 1t8o s ALA 132 CO 0.54 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.60 1t8o n GLY 133 N 0.63 3.20 3.73 0.00 0.00 0.22 -4.95 105.19 108.02 1t8o n GLY 133 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1t8o n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1t8o n THR 134 N -2.00 0.31 -2.84 2.61 -1.04 -0.89 -4.59 114.28 105.83 1t8o n THR 134 Ca 0.00 -0.08 -0.42 0.00 -2.04 0.00 0.00 64.05 61.51 1t8o n THR 134 Cb 0.00 -1.98 -0.04 0.00 -1.82 0.00 0.00 70.33 66.49 1t8o n THR 134 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1t8o s THR 135 N 0.82 4.78 0.15 12.58 2.01 -1.26 -1.46 115.64 133.25 1t8o s THR 135 Ca 0.72 1.59 0.00 0.00 0.31 0.00 0.00 61.69 64.31 1t8o s THR 135 Cb -0.50 -4.18 -0.00 0.00 0.01 0.00 0.00 72.50 67.83 1t8o s THR 135 CO 0.37 -0.15 0.01 0.00 -0.69 0.00 0.00 174.62 174.15 1t8o s VAL 137 N -1.62 0.27 0.08 0.00 1.01 0.32 -1.08 120.40 119.37 1t8o s VAL 137 Ca 0.01 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 61.64 1t8o s VAL 137 Cb 0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 1t8o s VAL 137 CO 0.01 -0.11 -0.18 0.28 0.00 0.00 0.00 175.10 175.10 1t8o s THR 138 N -0.53 1.50 0.13 3.92 -1.32 -0.65 -0.16 115.64 118.53 1t8o s THR 138 Ca -0.04 -1.38 0.00 0.00 -1.21 0.00 0.00 61.69 59.06 1t8o s THR 138 Cb -0.04 -1.37 -0.04 0.00 -1.51 0.00 0.00 72.50 69.54 1t8o s THR 138 CO -0.00 -0.06 0.00 0.42 -2.21 0.00 0.00 174.62 172.77 1t8o s THR 139 N -1.11 0.43 0.00 5.08 -4.23 -1.19 -1.56 115.64 113.07 1t8o s THR 139 Ca 0.04 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.62 1t8o s THR 139 Cb -0.10 -1.94 0.00 0.00 1.34 0.00 0.00 72.50 71.80 1t8o s THR 139 CO 0.03 -0.61 0.00 0.61 -0.54 0.00 0.00 174.62 174.11 1t8o n GLY 140 N -0.11 0.70 1.48 3.99 0.00 -0.76 -4.41 105.19 106.08 1t8o n GLY 140 Ca -0.08 -1.28 -0.03 0.00 0.00 0.00 0.00 46.02 44.63 1t8o n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1t8o n TRP 141 N -1.11 1.71 -1.22 1.61 8.01 -1.26 -1.71 117.44 123.48 1t8o n TRP 141 Ca 0.00 -1.28 -0.29 0.00 -1.31 0.00 0.00 57.50 54.62 1t8o n TRP 141 Cb 0.00 -0.55 0.15 0.00 -2.01 0.00 0.00 31.31 28.90 1t8o n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1t8o s GLY 142 N -1.73 1.59 0.43 6.99 0.00 -1.25 -4.08 107.32 109.27 1t8o s GLY 142 Ca 0.49 -0.21 -0.23 0.00 0.00 0.00 0.00 44.72 44.76 1t8o s GLY 142 CO 0.08 0.33 0.86 1.04 0.00 0.00 0.00 173.10 175.41 1t8o n LEU 143 N -3.98 1.84 -0.22 0.66 4.77 0.17 -2.09 117.00 118.14 1t8o n LEU 143 Ca 0.06 0.98 0.09 0.00 -0.03 0.00 0.00 56.01 57.12 1t8o n LEU 143 Cb 0.56 -1.28 -0.05 0.00 -2.33 0.00 0.00 43.42 40.32 1t8o n LEU 143 CO 0.56 -1.94 0.13 0.35 -1.33 0.00 0.00 177.39 175.15 1t8o n THR 144 N -0.67 0.00 -3.71 -5.08 -2.24 -1.26 -0.50 114.28 100.82 1t8o n THR 144 Ca 0.10 -0.19 -0.11 0.00 -2.27 0.00 0.00 64.05 61.58 1t8o n THR 144 Cb 0.39 1.12 -0.11 0.00 -2.10 0.00 0.00 70.33 69.63 1t8o n THR 144 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1t8o s ARG 145 N -2.45 0.39 -0.86 -0.78 3.52 -1.26 -4.08 118.95 113.43 1t8o s ARG 145 Ca 0.12 0.70 -0.21 0.00 -0.13 0.00 0.00 55.73 56.20 1t8o s ARG 145 Cb 0.15 0.03 0.09 0.00 -1.56 0.00 0.00 34.95 33.65 1t8o s ARG 145 CO 0.61 -0.13 1.17 -0.47 -0.81 0.00 0.00 175.30 175.67 1t8o s TYR 146 N 1.07 2.79 0.00 5.12 5.04 -1.26 -4.95 117.35 125.16 1t8o s TYR 146 Ca -0.07 -0.92 0.00 0.00 -2.44 0.00 0.00 57.07 53.64 1t8o s TYR 146 Cb -0.07 -4.41 0.00 0.00 0.35 0.00 0.00 41.96 37.83 1t8o s TYR 146 CO -0.09 -1.69 0.00 0.00 -1.34 0.00 0.00 175.55 172.43 1t8o n ALA 149 N 7.64 0.00 -2.79 3.97 0.00 -1.26 -5.15 120.51 122.92 1t8o n ALA 149 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.38 1t8o n ALA 149 Cb 0.49 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.89 1t8o n ALA 149 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1t8o s ASN 150 N 0.00 5.37 0.56 0.00 2.47 -1.26 -5.07 114.94 117.01 1t8o s ASN 150 Ca 0.00 -0.30 -0.18 0.00 0.42 0.00 0.00 52.86 52.80 1t8o s ASN 150 Cb 0.00 -1.32 -0.05 0.00 -1.45 0.00 0.00 41.25 38.43 1t8o s ASN 150 CO 0.00 -0.02 1.09 0.42 -3.72 0.00 0.00 177.10 174.86 1t8o s THR 151 N -2.13 3.48 0.46 -5.21 -4.23 -1.26 -4.74 115.64 102.00 1t8o s THR 151 Ca 0.32 0.82 -0.23 0.00 -1.18 0.00 0.00 61.69 61.42 1t8o s THR 151 Cb -0.08 -3.31 -0.07 0.00 1.34 0.00 0.00 72.50 70.38 1t8o s THR 151 CO 0.24 -0.30 1.17 -2.16 -0.54 0.00 0.00 174.62 173.04 1t8o s PRO 152 N -3.62 3.75 0.12 3.99 0.04 -1.26 -4.94 135.00 133.08 1t8o s PRO 152 Ca 0.68 1.79 -0.12 0.00 0.04 0.00 0.00 61.00 63.39 1t8o s PRO 152 Cb -0.20 -2.41 -0.08 0.00 0.04 0.00 0.00 34.50 31.85 1t8o s PRO 152 CO 0.30 -0.57 1.42 -0.44 0.04 0.00 0.00 177.00 177.76 1t8o h ASP 153 N 2.05 0.93 -2.94 6.66 3.32 -1.93 -3.45 116.42 121.05 1t8o h ASP 153 Ca -0.49 -0.50 -0.62 0.00 0.02 0.00 0.00 57.03 55.43 1t8o h ASP 153 Cb 1.25 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 40.48 1t8o h ASP 153 CO 0.60 1.25 -0.26 -0.13 -1.72 0.00 0.00 179.24 178.98 1t8o s ARG 154 N -4.24 3.82 0.19 3.56 0.52 -1.26 -0.59 118.95 120.95 1t8o s ARG 154 Ca -0.11 0.30 -0.33 0.00 -0.52 0.00 0.00 55.73 55.07 1t8o s ARG 154 Cb 0.10 -3.22 -0.15 0.00 0.52 0.00 0.00 34.95 32.21 1t8o s ARG 154 CO 0.87 0.71 1.36 -0.11 0.02 0.00 0.00 175.30 178.15 1t8o n LEU 155 N 1.87 2.45 -4.77 2.53 7.94 -0.52 -4.89 117.00 121.62 1t8o n LEU 155 Ca -0.15 1.13 -0.22 0.00 -1.11 0.00 0.00 56.01 55.65 1t8o n LEU 155 Cb 0.53 -1.34 -0.05 0.00 0.53 0.00 0.00 43.42 43.09 1t8o n LEU 155 CO 0.36 -0.76 -0.18 -1.10 -1.11 0.00 0.00 177.39 174.60 1t8o s GLN 156 N -0.06 2.53 0.12 1.96 -1.52 -0.70 -1.40 119.66 120.59 1t8o s GLN 156 Ca 0.74 -1.40 -0.09 0.00 -1.95 0.00 0.00 55.36 52.66 1t8o s GLN 156 Cb -0.75 -2.30 -0.00 0.00 -0.22 0.00 0.00 33.01 29.73 1t8o s GLN 156 CO 0.48 0.18 0.22 1.14 -0.25 0.00 0.00 175.29 177.06 1t8o s GLN 157 N -3.86 0.96 -0.27 2.91 -2.07 0.27 -1.83 119.66 115.76 1t8o s GLN 157 Ca 0.37 -1.04 -0.22 0.00 -1.82 0.00 0.00 55.36 52.65 1t8o s GLN 157 Cb -0.05 0.35 0.07 0.00 -1.09 0.00 0.00 33.01 32.30 1t8o s GLN 157 CO 0.24 -0.32 0.72 0.00 -1.32 0.00 0.00 175.29 174.60 1t8o s ALA 158 N -3.90 -1.82 0.00 2.60 0.00 -0.60 -0.32 121.76 117.72 1t8o s ALA 158 Ca 0.10 2.15 -0.17 0.00 0.00 0.00 0.00 51.96 54.04 1t8o s ALA 158 Cb 0.04 -1.27 -0.06 0.00 0.00 0.00 0.00 23.12 21.84 1t8o s ALA 158 CO -0.07 -0.35 0.47 -1.12 0.00 0.00 0.00 175.76 174.69 1t8o s SER 159 N 0.78 6.87 0.02 0.00 0.01 -1.26 -1.63 113.70 118.48 1t8o s SER 159 Ca -0.03 1.04 -0.21 0.00 1.31 0.00 0.00 55.95 58.05 1t8o s SER 159 Cb -0.05 -2.29 0.05 0.00 0.21 0.00 0.00 66.02 63.93 1t8o s SER 159 CO -0.06 0.26 0.48 -1.48 0.41 0.00 0.00 173.24 172.85 1t8o s LEU 160 N -0.81 0.13 0.22 2.44 2.34 -0.24 -4.94 118.68 117.81 1t8o s LEU 160 Ca 0.26 0.21 -0.15 0.00 0.06 0.00 0.00 54.13 54.51 1t8o s LEU 160 Cb -0.17 1.93 -0.08 0.00 -0.56 0.00 0.00 46.19 47.31 1t8o s LEU 160 CO 0.15 -0.63 0.63 -2.16 -1.06 0.00 0.00 176.35 173.27 1t8o s PRO 161 N -2.01 4.00 0.43 1.48 0.04 -1.26 -0.62 135.00 137.07 1t8o s PRO 161 Ca -0.08 0.56 -0.22 0.00 0.04 0.00 0.00 61.00 61.30 1t8o s PRO 161 Cb -0.01 -2.75 -0.09 0.00 0.04 0.00 0.00 34.50 31.69 1t8o s PRO 161 CO 0.01 0.35 1.02 -0.51 0.04 0.00 0.00 177.00 177.92 1t8o s LEU 162 N -2.38 4.01 0.11 -3.56 1.43 -0.53 -1.45 118.68 116.31 1t8o s LEU 162 Ca 0.45 1.93 0.08 0.00 -1.03 0.00 0.00 54.13 55.56 1t8o s LEU 162 Cb -0.13 -4.37 -0.04 0.00 0.03 0.00 0.00 46.19 41.68 1t8o s LEU 162 CO 0.20 -0.55 -0.14 -0.76 0.23 0.00 0.00 176.35 175.32 1t8o s LEU 163 N -2.99 2.87 0.57 1.79 1.43 -0.19 -0.61 118.68 121.54 1t8o s LEU 163 Ca 0.61 -0.47 -0.17 0.00 -1.03 0.00 0.00 54.13 53.08 1t8o s LEU 163 Cb -0.18 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.30 1t8o s LEU 163 CO 0.22 0.18 1.06 -0.94 0.23 0.00 0.00 176.35 177.11 1t8o s SER 164 N -2.15 5.86 0.31 2.29 1.04 -1.26 -4.43 113.70 115.36 1t8o s SER 164 Ca 0.20 1.90 0.01 0.00 0.48 0.00 0.00 55.95 58.54 1t8o s SER 164 Cb -0.11 -2.55 0.55 0.00 0.10 0.00 0.00 66.02 64.02 1t8o s SER 164 CO 0.12 -1.11 1.93 0.78 0.98 0.00 0.00 173.24 175.94 1t8o h ASN 165 N 0.77 0.87 -0.41 7.02 2.35 -1.97 -0.06 115.58 124.14 1t8o h ASN 165 Ca -0.48 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.27 1t8o h ASN 165 Cb 1.23 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.39 1t8o h ASN 165 CO 0.57 0.58 0.24 0.74 -1.65 0.00 0.00 177.43 177.91 1t8o h THR 166 N 1.00 1.14 -0.22 2.81 2.02 -1.98 0.95 112.91 118.62 1t8o h THR 166 Ca 0.36 -0.35 -0.13 0.00 0.77 0.00 0.00 66.41 67.06 1t8o h THR 166 Cb 0.14 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1t8o h THR 166 CO -0.12 0.15 -0.42 0.78 0.37 0.00 0.00 175.52 176.28 1t8o h ASN 167 N 0.54 0.56 -0.43 4.18 2.35 -1.75 -2.72 115.58 118.31 1t8o h ASN 167 Ca 0.15 -0.25 -0.10 0.00 -0.55 0.00 0.00 56.30 55.54 1t8o h ASN 167 Cb 0.03 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 1t8o h ASN 167 CO -0.03 0.92 -0.12 0.00 -1.65 0.00 0.00 177.43 176.55 1t8o h LYS 169 N 0.67 0.00 0.00 0.00 1.57 -0.71 -1.37 116.57 116.74 1t8o h LYS 169 Ca 0.11 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1t8o h LYS 169 Cb 0.66 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.97 1t8o h LYS 169 CO 0.05 0.00 -0.01 0.87 -0.57 0.00 0.00 179.45 179.78 1t8o h LYS 170 N 0.00 0.00 0.00 3.15 1.57 -1.14 0.74 116.57 120.90 1t8o h LYS 170 Ca 0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 1t8o h LYS 170 Cb 0.26 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1t8o h LYS 170 CO 0.00 0.01 -1.10 0.98 -0.57 0.00 0.00 179.45 178.77 1t8o n TYR 171 N -3.61 0.00 1.22 -1.35 9.36 -0.59 -4.75 117.16 117.44 1t8o n TYR 171 Ca -0.03 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.33 1t8o n TYR 171 Cb 0.09 -0.43 0.63 0.00 -0.63 0.00 0.00 39.34 39.00 1t8o n TYR 171 CO 0.00 0.00 0.00 0.91 0.22 0.00 0.00 176.86 177.99 1t8o n TRP 172 N -4.03 0.00 -2.18 2.98 7.02 -0.77 -5.01 117.44 115.44 1t8o n TRP 172 Ca -0.18 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.30 1t8o n TRP 172 Cb 0.48 -0.34 0.00 0.00 -2.42 0.00 0.00 31.31 29.03 1t8o n TRP 172 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1t8o n GLY 173 N 1.39 2.53 0.00 6.99 0.00 0.25 -2.01 105.19 114.34 1t8o n GLY 173 Ca 0.11 -0.26 0.07 0.00 0.00 0.00 0.00 46.02 45.94 1t8o n GLY 173 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1t8o n THR 174 N 0.00 0.00 0.51 2.61 -2.24 -1.26 -2.78 114.28 111.12 1t8o n THR 174 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 1t8o n THR 174 Cb 0.00 -0.66 0.44 0.00 -2.10 0.00 0.00 70.33 68.01 1t8o n THR 174 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1t8o h LYS 175 N 0.00 0.00 -5.87 -0.78 1.79 -1.82 -3.42 116.57 106.47 1t8o h LYS 175 Ca 0.00 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.87 1t8o h LYS 175 Cb 0.00 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.56 1t8o h LYS 175 CO 0.00 0.00 0.50 0.42 -1.08 0.00 0.00 179.45 179.29 1t8o s ILE 176 N -3.20 4.75 0.47 1.86 -1.09 -1.12 -5.02 121.20 117.85 1t8o s ILE 176 Ca 0.08 1.40 0.08 0.00 -2.23 0.00 0.00 60.65 59.98 1t8o s ILE 176 Cb 0.11 -4.19 0.02 0.00 -1.58 0.00 0.00 42.46 36.82 1t8o s ILE 176 CO 0.53 -0.24 0.50 -0.54 -1.23 0.00 0.00 174.94 173.96 1t8o s LYS 177 N 3.05 2.51 0.64 2.79 -0.14 -1.26 -5.03 119.74 122.29 1t8o s LYS 177 Ca 0.36 -1.57 0.42 0.00 -1.36 0.00 0.00 55.97 53.81 1t8o s LYS 177 Cb -0.14 -2.47 2.15 0.00 -1.68 0.00 0.00 37.83 35.69 1t8o s LYS 177 CO 0.11 -0.41 2.27 0.38 -0.76 0.00 0.00 175.35 176.95 1t8o h ASP 178 N 0.73 0.00 -0.69 2.83 3.04 -1.99 -2.32 116.42 118.03 1t8o h ASP 178 Ca -0.38 0.00 -0.28 0.00 -3.24 0.00 0.00 57.03 53.13 1t8o h ASP 178 Cb 1.28 0.00 -0.17 0.00 -1.04 0.00 0.00 39.33 39.40 1t8o h ASP 178 CO 0.51 0.00 0.29 0.00 -2.04 0.00 0.00 179.24 178.00 1t8o n ALA 179 N -2.09 4.68 -2.49 4.15 0.00 -1.26 -4.91 120.51 118.60 1t8o n ALA 179 Ca -0.02 -2.68 -0.26 0.00 0.00 0.00 0.00 53.44 50.49 1t8o n ALA 179 Cb 0.13 -1.15 -0.13 0.00 0.00 0.00 0.00 19.45 18.30 1t8o n ALA 179 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1t8o s MET 180 N -3.12 1.27 -0.01 0.00 -1.94 -0.87 -0.27 119.30 114.35 1t8o s MET 180 Ca 0.52 -1.16 0.00 0.00 -1.71 0.00 0.00 55.69 53.35 1t8o s MET 180 Cb 0.44 -1.56 0.01 0.00 2.01 0.00 0.00 34.83 35.73 1t8o s MET 180 CO 0.09 0.37 0.00 -1.50 -0.01 0.00 0.00 175.02 173.98 1t8o s ILE 181 N -1.05 0.04 0.20 2.53 2.07 0.35 -4.64 121.20 120.69 1t8o s ILE 181 Ca 0.09 0.03 0.05 0.00 -1.41 0.00 0.00 60.65 59.40 1t8o s ILE 181 Cb -0.10 -0.07 -0.04 0.00 0.13 0.00 0.00 42.46 42.38 1t8o s ILE 181 CO 0.04 0.04 0.22 0.00 -1.91 0.00 0.00 174.94 173.33 1t8o s ALA 183 N -1.88 -1.74 0.00 0.00 0.00 -0.58 -1.02 121.76 116.53 1t8o s ALA 183 Ca 0.33 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.41 1t8o s ALA 183 Cb -0.10 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.21 1t8o s ALA 183 CO 0.26 -0.47 0.00 0.41 0.00 0.00 0.00 175.76 175.96 1t8o n GLY 184 N 0.55 0.65 2.51 0.00 0.00 -0.53 -0.65 105.19 107.72 1t8o n GLY 184 Ca -0.18 -1.73 -0.21 0.00 0.00 0.00 0.00 46.02 43.91 1t8o n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t8o n ALA 185 N 0.21 -0.44 -1.01 4.61 0.00 -1.15 -4.70 120.51 118.03 1t8o n ALA 185 Ca 0.00 0.27 0.09 0.00 0.00 0.00 0.00 53.44 53.80 1t8o n ALA 185 Cb 0.00 -2.10 0.16 0.00 0.00 0.00 0.00 19.45 17.51 1t8o n ALA 185 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1t8o n SER 186 N -1.62 2.66 0.00 0.00 3.41 -1.06 -4.60 113.62 112.41 1t8o n SER 186 Ca -0.22 -3.03 0.00 0.00 -0.26 0.00 0.00 58.87 55.36 1t8o n SER 186 Cb 0.68 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 1t8o n SER 186 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1t8o n GLY 187 N -1.20 0.65 3.28 5.00 0.00 -0.23 -5.06 105.19 107.64 1t8o n GLY 187 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.03 1t8o n GLY 187 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1t8o s VAL 188 N -2.00 0.79 -0.27 1.61 -7.23 -1.25 -4.68 120.40 107.36 1t8o s VAL 188 Ca 0.00 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 57.93 1t8o s VAL 188 Cb 0.00 -2.27 0.09 0.00 0.56 0.00 0.00 36.38 34.76 1t8o s VAL 188 CO 0.00 -0.36 0.81 -0.55 -0.31 0.00 0.00 175.10 174.69 1t8o s SER 189 N -3.24 -0.69 0.82 4.85 0.15 -1.03 -4.16 113.70 110.40 1t8o s SER 189 Ca 0.27 1.29 -0.11 0.00 0.70 0.00 0.00 55.95 58.10 1t8o s SER 189 Cb 0.06 1.30 0.08 0.00 -1.71 0.00 0.00 66.02 65.76 1t8o s SER 189 CO 0.07 -0.22 1.09 -0.44 1.20 0.00 0.00 173.24 174.94 1t8o s SER 190 N 0.52 4.15 0.31 5.45 0.01 -1.26 0.08 113.70 122.95 1t8o s SER 190 Ca -0.01 1.60 -0.07 0.00 1.31 0.00 0.00 55.95 58.78 1t8o s SER 190 Cb -0.05 -2.31 0.03 0.00 0.21 0.00 0.00 66.02 63.90 1t8o s SER 190 CO -0.04 -2.23 0.54 0.00 0.41 0.00 0.00 173.24 171.93 1t8o n MET 192 N -0.46 0.45 0.00 0.00 1.56 -1.26 -0.43 117.12 116.98 1t8o n MET 192 Ca -0.04 0.16 0.00 0.00 -0.27 0.00 0.00 57.70 57.55 1t8o n MET 192 Cb 0.49 -1.77 0.00 0.00 2.15 0.00 0.00 33.22 34.08 1t8o n MET 192 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1t8o n GLY 193 N 5.04 1.70 0.13 -5.12 0.00 -1.26 -0.65 105.19 105.02 1t8o n GLY 193 Ca 0.36 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.46 1t8o n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1t8o h ASP 194 N 0.00 0.00 -1.90 1.61 3.32 -1.06 -3.35 116.42 115.04 1t8o h ASP 194 Ca 0.00 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.42 1t8o h ASP 194 Cb 0.00 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.66 1t8o h ASP 194 CO 0.00 0.15 -0.19 -1.20 -1.72 0.00 0.00 179.24 176.28 1t8o n SER 195 N -2.82 0.07 0.00 6.45 7.64 -1.26 -1.43 113.62 122.26 1t8o n SER 195 Ca -0.01 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.00 1t8o n SER 195 Cb 0.62 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 1t8o n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t8o n GLY 196 N 1.58 3.04 3.68 0.23 0.00 -0.40 -0.12 105.19 113.20 1t8o n GLY 196 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1t8o n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1t8o s GLY 197 N -1.85 1.60 0.31 -0.02 0.00 -0.51 -3.42 107.32 103.43 1t8o s GLY 197 Ca 0.00 -0.81 -0.09 0.00 0.00 0.00 0.00 44.72 43.81 1t8o s GLY 197 CO 0.00 -0.04 0.64 2.56 0.00 0.00 0.00 173.10 176.26 1t8o s PRO 198 N -5.36 3.77 -0.26 2.90 0.04 -1.26 -1.30 135.00 133.53 1t8o s PRO 198 Ca 0.69 0.30 0.00 0.00 0.04 0.00 0.00 61.00 62.03 1t8o s PRO 198 Cb -0.11 -2.55 0.07 0.00 0.04 0.00 0.00 34.50 31.95 1t8o s PRO 198 CO 0.56 0.17 0.01 -1.17 0.04 0.00 0.00 177.00 176.60 1t8o s LEU 199 N -3.35 2.56 0.07 -3.56 2.96 -0.26 -3.15 118.68 113.96 1t8o s LEU 199 Ca 0.48 -1.36 0.07 0.00 -0.22 0.00 0.00 54.13 53.10 1t8o s LEU 199 Cb -0.11 -1.07 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 1t8o s LEU 199 CO 0.26 -0.31 -0.14 0.68 -1.32 0.00 0.00 176.35 175.52 1t8o s VAL 200 N 1.46 3.10 0.07 1.68 -7.23 0.77 -0.95 120.40 119.29 1t8o s VAL 200 Ca 0.01 -1.23 0.03 0.00 -1.81 0.00 0.00 61.98 58.97 1t8o s VAL 200 Cb -0.18 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.34 1t8o s VAL 200 CO -0.11 0.22 -0.08 0.00 -0.31 0.00 0.00 175.10 174.81 1t8o s LYS 202 N -2.32 4.71 -0.26 0.00 1.02 -1.26 -0.46 119.74 121.16 1t8o s LYS 202 Ca -0.02 1.54 -0.00 0.00 0.02 0.00 0.00 55.97 57.51 1t8o s LYS 202 Cb -0.05 -3.32 0.08 0.00 -0.52 0.00 0.00 37.83 34.01 1t8o s LYS 202 CO -0.01 0.25 0.03 0.21 -0.92 0.00 0.00 175.35 174.92 1t8o s LYS 203 N -0.43 1.04 -1.48 1.68 2.20 -0.03 -4.70 119.74 118.02 1t8o s LYS 203 Ca 0.46 -0.97 -0.07 0.00 -0.36 0.00 0.00 55.97 55.03 1t8o s LYS 203 Cb -0.26 -2.31 0.01 0.00 -1.51 0.00 0.00 37.83 33.76 1t8o s LYS 203 CO 0.32 -0.78 0.85 0.09 -0.36 0.00 0.00 175.35 175.47 1t8o n ASN 204 N 4.79 -6.24 0.00 1.43 3.02 -1.26 -1.89 115.26 115.11 1t8o n ASN 204 Ca -0.06 -0.40 0.00 0.00 -0.03 0.00 0.00 54.58 54.09 1t8o n ASN 204 Cb 0.44 -4.98 0.00 0.00 -0.61 0.00 0.00 39.78 34.63 1t8o n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1t8o n GLY 205 N -1.73 2.56 3.75 7.41 0.00 -1.26 -5.02 105.19 110.90 1t8o n GLY 205 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 1t8o n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t8o s ALA 206 N -2.38 3.68 0.03 4.61 0.00 -0.79 -4.94 121.76 121.96 1t8o s ALA 206 Ca 0.00 -0.60 -0.30 0.00 0.00 0.00 0.00 51.96 51.06 1t8o s ALA 206 Cb 0.00 -2.22 -0.08 0.00 0.00 0.00 0.00 23.12 20.82 1t8o s ALA 206 CO 0.00 0.20 1.74 -1.58 0.00 0.00 0.00 175.76 176.11 1t8o s TRP 207 N 0.20 2.02 -0.02 0.00 0.52 -0.38 -0.85 118.94 120.43 1t8o s TRP 207 Ca 0.12 0.09 0.07 0.00 0.02 0.00 0.00 56.10 56.40 1t8o s TRP 207 Cb -0.12 -4.03 -0.02 0.00 -1.15 0.00 0.00 33.47 28.15 1t8o s TRP 207 CO 0.01 -4.31 -0.24 0.99 0.02 0.00 0.00 176.95 173.41 1t8o s THR 208 N 3.45 1.88 -0.41 2.01 2.01 0.39 -2.39 115.64 122.59 1t8o s THR 208 Ca 0.77 -1.02 -0.28 0.00 0.31 0.00 0.00 61.69 61.47 1t8o s THR 208 Cb -0.39 -1.56 -0.00 0.00 0.01 0.00 0.00 72.50 70.56 1t8o s THR 208 CO 0.34 0.53 1.57 -0.22 -0.69 0.00 0.00 174.62 176.15 1t8o s LEU 209 N -0.56 3.53 -0.18 4.42 2.96 0.59 -1.68 118.68 127.75 1t8o s LEU 209 Ca 0.09 0.92 0.17 0.00 -0.22 0.00 0.00 54.13 55.10 1t8o s LEU 209 Cb -0.09 -3.44 -0.24 0.00 0.50 0.00 0.00 46.19 42.92 1t8o s LEU 209 CO -0.01 -1.60 0.08 0.52 -1.32 0.00 0.00 176.35 174.02 1t8o n VAL 210 N 7.19 1.27 -3.88 1.68 0.31 -0.12 -4.23 118.33 120.55 1t8o n VAL 210 Ca 0.19 -0.81 -0.09 0.00 -0.01 0.00 0.00 64.34 63.62 1t8o n VAL 210 Cb 0.48 -0.46 -0.07 0.00 -0.91 0.00 0.00 33.84 32.88 1t8o n VAL 210 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1t8o s GLY 211 N -5.34 0.22 -0.13 2.92 0.00 -0.71 -1.84 107.32 102.44 1t8o s GLY 211 Ca -0.09 -0.67 0.01 0.00 0.00 0.00 0.00 44.72 43.97 1t8o s GLY 211 CO 0.80 -0.75 -0.16 -0.42 0.00 0.00 0.00 173.10 172.56 1t8o s ILE 212 N -3.90 1.63 -0.07 0.90 1.01 -0.86 -1.10 121.20 118.81 1t8o s ILE 212 Ca 0.10 -0.70 -0.38 0.00 0.00 0.00 0.00 60.65 59.67 1t8o s ILE 212 Cb 0.04 -1.50 -0.16 0.00 0.01 0.00 0.00 42.46 40.85 1t8o s ILE 212 CO -0.06 0.47 1.51 0.52 0.00 0.00 0.00 174.94 177.38 1t8o n VAL 213 N 4.43 0.13 0.00 2.92 0.31 -0.42 -0.78 118.33 124.93 1t8o n VAL 213 Ca -0.18 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1t8o n VAL 213 Cb 0.51 -1.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.44 1t8o n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1t8o n SER 214 N 3.75 0.00 -3.65 4.52 2.88 -0.87 -1.27 113.62 118.97 1t8o n SER 214 Ca 0.22 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.67 1t8o n SER 214 Cb 0.17 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.60 1t8o n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1t8o s TRP 215 N -0.91 0.10 -0.69 0.66 1.48 -0.74 -4.91 118.94 113.93 1t8o s TRP 215 Ca 0.00 -0.57 0.00 0.00 -1.06 0.00 0.00 56.10 54.47 1t8o s TRP 215 Cb 0.00 0.55 0.00 0.00 -1.16 0.00 0.00 33.47 32.86 1t8o s TRP 215 CO 0.00 -1.24 0.00 0.41 -4.06 0.00 0.00 176.95 172.06 1t8o n GLY 216 N -0.46 -0.82 3.64 3.67 0.00 -1.26 -0.28 105.19 109.68 1t8o n GLY 216 Ca -0.04 -0.23 -0.47 0.00 0.00 0.00 0.00 46.02 45.28 1t8o n GLY 216 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1t8o n SER 217 N 0.00 2.47 0.00 1.61 2.88 -1.26 -4.84 113.62 114.47 1t8o n SER 217 Ca 0.00 1.11 0.09 0.00 -1.33 0.00 0.00 58.87 58.75 1t8o n SER 217 Cb 0.00 -1.35 0.49 0.00 -0.75 0.00 0.00 64.21 62.60 1t8o n SER 217 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1t8o n SER 218 N 2.70 0.00 -0.07 -3.46 7.64 -1.26 -2.03 113.62 117.14 1t8o n SER 218 Ca 0.16 -0.13 0.03 0.00 1.01 0.00 0.00 58.87 59.93 1t8o n SER 218 Cb 0.27 -0.22 0.04 0.00 -1.01 0.00 0.00 64.21 63.30 1t8o n SER 218 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1t8o n THR 219 N -1.22 1.03 -3.80 0.44 -2.24 -1.26 -5.00 114.28 102.23 1t8o n THR 219 Ca 0.10 -1.15 -0.27 0.00 -2.27 0.00 0.00 64.05 60.47 1t8o n THR 219 Cb 0.13 0.34 0.04 0.00 -2.10 0.00 0.00 70.33 68.74 1t8o n THR 219 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t8o s SER 221 N -3.62 6.60 0.00 0.00 0.15 -1.26 -4.76 113.70 110.81 1t8o s SER 221 Ca 0.46 2.65 0.29 0.00 0.70 0.00 0.00 55.95 60.04 1t8o s SER 221 Cb -0.23 -2.61 1.65 0.00 -1.71 0.00 0.00 66.02 63.12 1t8o s SER 221 CO 0.81 -0.78 2.04 0.35 1.20 0.00 0.00 173.24 176.86 1t8o n THR 222 N 3.26 0.03 -0.04 6.45 -2.24 -1.26 -2.89 114.28 117.59 1t8o n THR 222 Ca 0.11 0.01 0.06 0.00 -2.27 0.00 0.00 64.05 61.96 1t8o n THR 222 Cb 0.39 -0.55 0.15 0.00 -2.10 0.00 0.00 70.33 68.22 1t8o n THR 222 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1t8o n SER 223 N -1.07 2.86 -4.50 3.42 3.41 -1.26 -1.06 113.62 115.41 1t8o n SER 223 Ca 0.20 -1.90 -0.32 0.00 -0.26 0.00 0.00 58.87 56.59 1t8o n SER 223 Cb 0.13 -0.21 -0.12 0.00 -0.26 0.00 0.00 64.21 63.75 1t8o n SER 223 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1t8o s THR 224 N -1.02 3.15 0.24 6.66 2.01 -1.14 -4.76 115.64 120.78 1t8o s THR 224 Ca 0.24 -0.82 -0.30 0.00 0.31 0.00 0.00 61.69 61.12 1t8o s THR 224 Cb 0.13 -2.28 -0.10 0.00 0.01 0.00 0.00 72.50 70.26 1t8o s THR 224 CO 0.18 0.50 1.49 -2.84 -0.69 0.00 0.00 174.62 173.26 1t8o s PRO 225 N -1.02 4.23 0.26 4.92 0.02 -1.26 -2.94 135.00 139.20 1t8o s PRO 225 Ca 0.13 2.36 -0.12 0.00 0.02 0.00 0.00 61.00 63.39 1t8o s PRO 225 Cb -0.11 -3.11 -0.08 0.00 0.02 0.00 0.00 34.50 31.23 1t8o s PRO 225 CO 0.03 -0.49 0.61 0.20 -0.33 0.00 0.00 177.00 177.02 1t8o s GLY 226 N 0.55 2.31 -0.09 0.52 0.00 0.17 -4.52 107.32 106.26 1t8o s GLY 226 Ca 0.62 -0.16 0.02 0.00 0.00 0.00 0.00 44.72 45.20 1t8o s GLY 226 CO 0.41 0.01 -0.16 0.14 0.00 0.00 0.00 173.10 173.50 1t8o s VAL 227 N -1.85 2.88 0.12 1.40 1.01 0.61 -1.53 120.40 123.04 1t8o s VAL 227 Ca 0.49 -0.76 0.07 0.00 0.00 0.00 0.00 61.98 61.78 1t8o s VAL 227 Cb -0.11 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1t8o s VAL 227 CO 0.20 0.56 -0.16 -0.31 0.00 0.00 0.00 175.10 175.39 1t8o s TYR 228 N -0.13 1.52 0.10 5.22 1.51 0.27 -1.80 117.35 124.04 1t8o s TYR 228 Ca -0.02 -0.51 -0.31 0.00 -1.01 0.00 0.00 57.07 55.23 1t8o s TYR 228 Cb -0.14 -0.80 -0.07 0.00 -0.11 0.00 0.00 41.96 40.85 1t8o s TYR 228 CO 0.04 0.18 1.30 0.00 -1.11 0.00 0.00 175.55 175.95 1t8o s ALA 229 N -1.87 3.50 -0.63 3.71 0.00 0.04 -0.49 121.76 126.01 1t8o s ALA 229 Ca 0.09 1.00 -0.28 0.00 0.00 0.00 0.00 51.96 52.77 1t8o s ALA 229 Cb -0.06 -3.49 0.03 0.00 0.00 0.00 0.00 23.12 19.59 1t8o s ALA 229 CO 0.04 -0.52 1.27 0.50 0.00 0.00 0.00 175.76 177.05 1t8o s ARG 230 N 0.95 3.35 0.38 0.00 3.52 0.63 -2.03 118.95 125.75 1t8o s ARG 230 Ca 0.61 0.12 0.05 0.00 -0.13 0.00 0.00 55.73 56.39 1t8o s ARG 230 Cb -0.34 -4.10 0.75 0.00 -1.56 0.00 0.00 34.95 29.71 1t8o s ARG 230 CO 0.30 -1.90 2.02 0.28 -0.81 0.00 0.00 175.30 175.19 1t8o h VAL 231 N 6.16 1.10 -0.03 7.11 2.07 -1.66 -2.00 116.25 129.02 1t8o h VAL 231 Ca -0.26 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1t8o h VAL 231 Cb 1.06 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1t8o h VAL 231 CO 1.22 0.13 -0.01 0.71 0.02 0.00 0.00 177.57 179.64 1t8o h THR 232 N 0.71 1.03 -0.00 2.57 1.35 -1.86 0.40 112.91 117.11 1t8o h THR 232 Ca 0.22 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 1t8o h THR 232 Cb 0.01 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.45 1t8o h THR 232 CO -0.05 0.04 -0.19 0.00 -0.25 0.00 0.00 175.52 175.07 1t8o n ALA 233 N -2.53 2.84 -0.06 6.62 0.00 -0.76 -3.96 120.51 122.66 1t8o n ALA 233 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1t8o n ALA 233 Cb 0.11 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1t8o n ALA 233 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1t8o n LEU 234 N -1.31 0.38 0.19 0.00 4.77 -0.26 -4.78 117.00 116.00 1t8o n LEU 234 Ca 0.09 -0.62 0.03 0.00 -0.03 0.00 0.00 56.01 55.48 1t8o n LEU 234 Cb 0.32 0.00 0.41 0.00 -2.33 0.00 0.00 43.42 41.81 1t8o n LEU 234 CO 0.28 0.10 0.80 1.62 -1.33 0.00 0.00 177.39 178.85 1t8o h VAL 235 N 0.06 1.21 -0.53 4.08 3.04 -0.41 -2.16 116.25 121.54 1t8o h VAL 235 Ca 0.00 -1.02 -0.09 0.00 -1.01 0.00 0.00 66.70 64.58 1t8o h VAL 235 Cb 0.03 1.53 -0.02 0.00 -2.01 0.00 0.00 31.29 30.82 1t8o h VAL 235 CO 0.00 0.29 -0.02 0.78 -1.01 0.00 0.00 177.57 177.61 1t8o h ASN 236 N 0.02 0.90 -0.58 3.17 2.35 -1.85 0.12 115.58 119.71 1t8o h ASN 236 Ca 0.00 -0.24 -0.05 0.00 -0.55 0.00 0.00 56.30 55.45 1t8o h ASN 236 Cb 0.52 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.63 1t8o h ASN 236 CO 0.04 0.97 0.17 -0.25 -1.65 0.00 0.00 177.43 176.71 1t8o h TRP 237 N 0.85 0.97 0.37 1.19 7.01 -1.77 -0.94 115.95 123.62 1t8o h TRP 237 Ca 0.15 -0.09 -0.02 0.00 2.11 0.00 0.00 58.89 61.05 1t8o h TRP 237 Cb 0.53 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.31 1t8o h TRP 237 CO 0.03 0.79 -0.18 0.28 -2.79 0.00 0.00 178.44 176.58 1t8o h VAL 238 N 0.91 0.65 -0.79 2.65 2.07 -0.74 -1.17 116.25 119.84 1t8o h VAL 238 Ca 0.20 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 67.56 1t8o h VAL 238 Cb 0.29 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 1t8o h VAL 238 CO -0.00 0.04 0.48 1.56 0.02 0.00 0.00 177.57 179.67 1t8o h GLN 239 N -0.61 0.88 -0.76 1.57 1.08 -0.84 -1.33 115.11 115.11 1t8o h GLN 239 Ca -0.05 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 57.05 1t8o h GLN 239 Cb 0.45 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.65 1t8o h GLN 239 CO 0.08 0.59 0.30 1.96 -0.95 0.00 0.00 178.83 180.81 1t8o h GLN 240 N 0.91 1.13 -0.53 1.46 4.20 -1.08 -0.94 115.11 120.25 1t8o h GLN 240 Ca 0.33 -0.20 -0.11 0.00 0.06 0.00 0.00 58.65 58.73 1t8o h GLN 240 Cb 0.11 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 1t8o h GLN 240 CO -0.15 0.91 -0.10 1.15 -0.67 0.00 0.00 178.83 179.98 1t8o h THR 241 N 1.10 1.27 -0.34 -0.54 2.02 -0.48 -2.29 112.91 113.64 1t8o h THR 241 Ca 0.25 -1.25 -0.06 0.00 0.77 0.00 0.00 66.41 66.12 1t8o h THR 241 Cb 0.21 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1t8o h THR 241 CO -0.02 0.44 -0.03 -0.07 0.37 0.00 0.00 175.52 176.21 1t8o h LEU 242 N 0.88 0.61 -1.65 2.58 3.38 -1.00 -2.59 115.31 117.52 1t8o h LEU 242 Ca 0.14 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1t8o h LEU 242 Cb 0.66 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1t8o h LEU 242 CO 0.05 0.79 0.06 0.00 0.09 0.00 0.00 178.44 179.43 1t8o h ALA 243 N 0.84 1.73 -0.01 1.53 0.00 -1.09 -2.06 119.26 120.19 1t8o h ALA 243 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1t8o h ALA 243 Cb 0.50 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1t8o h ALA 243 CO 0.02 0.22 -0.08 0.00 0.00 0.00 0.00 179.25 179.41 1t8o n ALA 244 N -2.50 2.72 -0.94 0.00 0.00 -0.87 -5.10 120.51 113.82 1t8o n ALA 244 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1t8o n ALA 244 Cb 0.14 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1t8o n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59