#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tlc h LYS 2 N 0.00 -0.07 -0.54 3.17 6.56 -1.97 -2.34 116.57 121.38 1tlc h LYS 2 Ca 0.00 0.00 0.01 0.00 -1.06 0.00 0.00 60.65 59.60 1tlc h LYS 2 Cb 0.00 0.02 -0.03 0.00 -0.57 0.00 0.00 32.23 31.65 1tlc h LYS 2 CO 0.00 -0.05 0.36 1.96 -2.06 0.00 0.00 179.45 179.66 1tlc h GLN 3 N -0.07 0.70 0.14 3.15 7.50 -1.99 -2.71 115.11 121.83 1tlc h GLN 3 Ca 0.29 -0.04 -0.01 0.00 0.50 0.00 0.00 58.65 59.39 1tlc h GLN 3 Cb 0.57 -0.16 0.00 0.00 0.05 0.00 0.00 27.48 27.95 1tlc h GLN 3 CO -0.86 0.47 -0.07 -0.92 -1.50 0.00 0.00 178.83 175.94 1tlc h TYR 4 N 0.72 -0.17 -0.84 2.96 3.20 -1.87 -2.70 116.97 118.26 1tlc h TYR 4 Ca 0.20 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.07 1tlc h TYR 4 Cb -0.07 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 1tlc h TYR 4 CO -0.04 -0.07 0.56 -0.07 -1.64 0.00 0.00 178.16 176.90 1tlc h LEU 5 N -0.23 0.97 -0.72 2.82 3.38 -1.52 0.49 115.31 120.50 1tlc h LEU 5 Ca -0.02 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 1tlc h LEU 5 Cb 0.18 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1tlc h LEU 5 CO 0.03 0.71 -0.64 -0.33 0.09 0.00 0.00 178.44 178.30 1tlc h GLU 6 N 1.15 0.01 -0.05 1.13 5.08 -1.41 -1.79 114.58 118.70 1tlc h GLU 6 Ca 0.31 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.55 1tlc h GLU 6 Cb -0.13 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.13 1tlc h GLU 6 CO -0.07 0.65 -0.37 1.25 -1.00 0.00 0.00 179.01 179.47 1tlc h LEU 7 N 0.01 0.42 -0.65 1.33 5.85 -1.04 -2.14 115.31 119.09 1tlc h LEU 7 Ca -0.01 -0.68 0.09 0.00 0.84 0.00 0.00 57.88 58.12 1tlc h LEU 7 Cb 1.13 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.96 1tlc h LEU 7 CO 0.08 1.04 0.29 -0.03 -0.34 0.00 0.00 178.44 179.48 1tlc h MET 8 N -0.16 0.49 -0.45 1.25 4.05 -0.76 0.78 114.93 120.12 1tlc h MET 8 Ca -0.03 -0.03 -0.07 0.00 -0.28 0.00 0.00 59.70 59.29 1tlc h MET 8 Cb 1.05 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.72 1tlc h MET 8 CO 0.08 0.32 0.01 0.37 0.23 0.00 0.00 176.91 177.92 1tlc h GLN 9 N 0.50 0.78 -0.66 0.39 5.75 -1.34 -2.46 115.11 118.07 1tlc h GLN 9 Ca 0.32 -0.24 0.03 0.00 -0.15 0.00 0.00 58.65 58.61 1tlc h GLN 9 Cb 0.36 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 28.79 1tlc h GLN 9 CO -0.28 0.84 0.41 -0.22 -2.65 0.00 0.00 178.83 176.93 1tlc h LYS 10 N 0.63 0.77 -0.50 1.69 3.64 -1.12 -0.46 116.57 121.21 1tlc h LYS 10 Ca 0.13 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.40 1tlc h LYS 10 Cb 0.48 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1tlc h LYS 10 CO 0.02 0.51 0.05 0.28 -2.27 0.00 0.00 179.45 178.04 1tlc h VAL 11 N 0.79 1.23 0.05 2.00 2.07 -0.40 -1.93 116.25 120.07 1tlc h VAL 11 Ca 0.27 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.86 1tlc h VAL 11 Cb 0.05 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1tlc h VAL 11 CO -0.12 0.33 -0.03 -0.07 0.02 0.00 0.00 177.57 177.71 1tlc h LEU 12 N 0.76 -0.06 -0.56 2.57 3.38 -1.11 0.53 115.31 120.82 1tlc h LEU 12 Ca 0.16 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1tlc h LEU 12 Cb 0.39 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1tlc h LEU 12 CO 0.01 0.12 0.00 0.44 0.09 0.00 0.00 178.44 179.11 1tlc h ASP 13 N -0.25 0.96 0.00 -0.43 3.32 -1.11 -3.39 116.42 115.52 1tlc h ASP 13 Ca -0.01 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1tlc h ASP 13 Cb 0.22 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1tlc h ASP 13 CO 0.01 1.03 -0.09 -0.62 -1.72 0.00 0.00 179.24 177.86 1tlc n GLU 14 N -4.25 5.63 -1.55 3.56 1.02 -0.73 -5.07 120.64 119.25 1tlc n GLU 14 Ca 0.02 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.71 1tlc n GLU 14 Cb 0.33 -0.49 -0.02 0.00 -0.02 0.00 0.00 31.44 31.25 1tlc n GLU 14 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tlc n GLY 15 N 1.01 -0.61 3.85 0.62 0.00 0.18 -4.89 105.19 105.35 1tlc n GLY 15 Ca 0.00 0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.95 1tlc n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tlc s THR 16 N -1.08 5.23 -0.26 2.61 2.01 0.18 -4.66 115.64 119.66 1tlc s THR 16 Ca 0.60 0.58 -0.29 0.00 0.31 0.00 0.00 61.69 62.89 1tlc s THR 16 Cb -0.73 -3.59 -0.01 0.00 0.01 0.00 0.00 72.50 68.18 1tlc s THR 16 CO 0.59 0.59 1.47 -1.58 -0.69 0.00 0.00 174.62 175.00 1tlc s GLN 17 N -1.00 3.85 0.21 4.92 2.00 -1.26 -1.52 119.66 126.85 1tlc s GLN 17 Ca 0.20 1.46 0.11 0.00 -2.00 0.00 0.00 55.36 55.13 1tlc s GLN 17 Cb -0.15 -3.96 -0.05 0.00 0.80 0.00 0.00 33.01 29.65 1tlc s GLN 17 CO 0.09 -1.22 -0.23 0.15 -0.50 0.00 0.00 175.29 173.58 1tlc s LYS 18 N 4.44 1.53 -0.22 1.67 -0.14 -0.75 -4.98 119.74 121.30 1tlc s LYS 18 Ca 0.64 -1.56 -0.13 0.00 -1.36 0.00 0.00 55.97 53.56 1tlc s LYS 18 Cb -0.21 -1.81 -0.05 0.00 -1.68 0.00 0.00 37.83 34.09 1tlc s LYS 18 CO 0.26 0.38 0.25 1.21 -0.76 0.00 0.00 175.35 176.69 1tlc s ASN 19 N -2.81 6.25 0.53 2.83 3.84 -1.26 -1.59 114.94 122.74 1tlc s ASN 19 Ca 0.22 0.29 0.06 0.00 0.21 0.00 0.00 52.86 53.64 1tlc s ASN 19 Cb -0.07 -2.15 0.03 0.00 -0.55 0.00 0.00 41.25 38.51 1tlc s ASN 19 CO 0.11 0.03 0.42 1.51 -2.79 0.00 0.00 177.10 176.38 1tlc s ASP 20 N 0.96 4.70 0.30 -4.21 -4.77 -1.26 -4.91 116.67 107.48 1tlc s ASP 20 Ca 0.12 -1.16 0.03 0.00 -3.30 0.00 0.00 52.55 48.24 1tlc s ASP 20 Cb -0.14 0.28 0.75 0.00 -1.09 0.00 0.00 42.92 42.72 1tlc s ASP 20 CO 0.05 -1.06 1.63 0.03 0.70 0.00 0.00 175.17 176.52 1tlc h ARG 21 N 0.76 0.15 0.00 2.11 3.08 -2.01 0.29 114.38 118.75 1tlc h ARG 21 Ca -0.37 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.67 1tlc h ARG 21 Cb 1.30 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1tlc h ARG 21 CO 0.56 0.10 0.00 0.25 -1.07 0.00 0.00 179.97 179.81 1tlc n THR 22 N -5.28 0.47 -2.21 2.04 -2.24 -1.26 -4.92 114.28 100.88 1tlc n THR 22 Ca 0.22 0.01 -0.18 0.00 -2.27 0.00 0.00 64.05 61.84 1tlc n THR 22 Cb 0.73 -0.71 -0.02 0.00 -2.10 0.00 0.00 70.33 68.22 1tlc n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tlc n GLY 23 N 0.94 -0.03 0.07 3.38 0.00 0.10 -4.89 105.19 104.76 1tlc n GLY 23 Ca 0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 1tlc n GLY 23 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1tlc n THR 24 N -3.78 0.98 0.00 2.61 -1.04 -1.26 -4.92 114.28 106.88 1tlc n THR 24 Ca -0.20 -0.73 0.00 0.00 -2.04 0.00 0.00 64.05 61.07 1tlc n THR 24 Cb 0.65 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.77 1tlc n THR 24 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1tlc n GLY 25 N 1.56 -2.23 3.24 3.41 0.00 -1.26 -4.45 105.19 105.46 1tlc n GLY 25 Ca -0.21 -1.26 -0.13 0.00 0.00 0.00 0.00 46.02 44.41 1tlc n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tlc s THR 26 N -2.37 0.61 -0.20 2.61 -4.23 -0.62 -1.54 115.64 109.91 1tlc s THR 26 Ca 0.00 -1.98 -0.02 0.00 -1.18 0.00 0.00 61.69 58.51 1tlc s THR 26 Cb 0.00 -2.17 -0.00 0.00 1.34 0.00 0.00 72.50 71.67 1tlc s THR 26 CO 0.00 -0.42 -0.09 -0.76 -0.54 0.00 0.00 174.62 172.81 1tlc s LEU 27 N -3.18 2.70 0.02 4.79 1.43 0.74 -1.81 118.68 123.37 1tlc s LEU 27 Ca 0.25 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 52.93 1tlc s LEU 27 Cb 0.06 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 1tlc s LEU 27 CO 0.05 0.01 -0.05 -0.55 0.23 0.00 0.00 176.35 176.04 1tlc s SER 28 N 1.27 0.52 0.22 2.29 0.15 -0.57 -0.13 113.70 117.44 1tlc s SER 28 Ca 0.03 -0.31 0.09 0.00 0.70 0.00 0.00 55.95 56.46 1tlc s SER 28 Cb -0.14 0.01 -0.05 0.00 -1.71 0.00 0.00 66.02 64.13 1tlc s SER 28 CO -0.04 -0.11 -0.16 0.27 1.20 0.00 0.00 173.24 174.40 1tlc s ILE 29 N -0.78 1.91 -0.09 6.45 -4.36 -0.86 0.52 121.20 124.00 1tlc s ILE 29 Ca -0.06 -2.25 0.02 0.00 -0.26 0.00 0.00 60.65 58.11 1tlc s ILE 29 Cb -0.06 -2.10 0.01 0.00 1.25 0.00 0.00 42.46 41.57 1tlc s ILE 29 CO -0.00 -0.54 -0.17 0.12 0.24 0.00 0.00 174.94 174.59 1tlc s PHE 30 N -2.83 1.98 -0.00 1.37 5.36 -1.26 -1.56 117.98 121.03 1tlc s PHE 30 Ca 0.24 -0.85 -0.01 0.00 -0.96 0.00 0.00 56.93 55.36 1tlc s PHE 30 Cb -0.02 -1.40 0.00 0.00 -0.34 0.00 0.00 43.02 41.27 1tlc s PHE 30 CO 0.09 -0.40 0.01 0.41 -1.46 0.00 0.00 175.22 173.87 1tlc n GLY 31 N 3.90 -3.77 3.18 13.12 0.00 -1.11 -5.04 105.19 115.47 1tlc n GLY 31 Ca -0.20 -0.26 -0.12 0.00 0.00 0.00 0.00 46.02 45.43 1tlc n GLY 31 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1tlc s HIS 32 N -0.19 -0.10 -0.00 1.61 2.46 -1.14 -4.97 115.29 112.94 1tlc s HIS 32 Ca -0.01 0.14 0.01 0.00 0.47 0.00 0.00 55.06 55.66 1tlc s HIS 32 Cb 0.00 0.04 0.00 0.00 -0.13 0.00 0.00 32.58 32.49 1tlc s HIS 32 CO 0.04 -0.33 -0.03 -1.14 -2.47 0.00 0.00 174.74 170.81 1tlc s GLN 33 N -1.25 0.24 0.08 2.88 0.74 -1.26 -0.24 119.66 120.86 1tlc s GLN 33 Ca -0.13 -0.09 0.02 0.00 0.05 0.00 0.00 55.36 55.20 1tlc s GLN 33 Cb -0.06 -0.25 -0.04 0.00 1.10 0.00 0.00 33.01 33.76 1tlc s GLN 33 CO 0.03 0.05 -0.07 0.00 -0.55 0.00 0.00 175.29 174.75 1tlc s MET 34 N 0.01 0.76 -0.02 1.67 0.23 0.17 -4.97 119.30 117.14 1tlc s MET 34 Ca 0.00 -1.21 0.04 0.00 -1.03 0.00 0.00 55.69 53.49 1tlc s MET 34 Cb -0.02 -0.19 -0.01 0.00 -1.53 0.00 0.00 34.83 33.08 1tlc s MET 34 CO -0.00 -0.01 -0.14 0.50 -2.03 0.00 0.00 175.02 173.34 1tlc s ARG 35 N -3.39 1.26 -0.20 3.16 3.52 -1.26 -0.78 118.95 121.26 1tlc s ARG 35 Ca 0.07 -0.48 0.01 0.00 -0.13 0.00 0.00 55.73 55.20 1tlc s ARG 35 Cb 0.02 -1.17 0.03 0.00 -1.56 0.00 0.00 34.95 32.28 1tlc s ARG 35 CO -0.04 0.24 -0.16 -0.06 -0.81 0.00 0.00 175.30 174.47 1tlc s PHE 36 N -0.12 2.82 -0.48 5.12 0.08 0.11 -4.97 117.98 120.55 1tlc s PHE 36 Ca 0.01 -1.79 -0.28 0.00 0.12 0.00 0.00 56.93 55.00 1tlc s PHE 36 Cb -0.08 -1.87 0.03 0.00 -0.57 0.00 0.00 43.02 40.54 1tlc s PHE 36 CO 0.00 -0.81 1.07 1.21 -0.10 0.00 0.00 175.22 176.59 1tlc s ASN 37 N 1.27 6.58 0.00 1.36 3.84 -1.26 0.90 114.94 127.62 1tlc s ASN 37 Ca 0.01 0.33 0.21 0.00 0.21 0.00 0.00 52.86 53.62 1tlc s ASN 37 Cb -0.15 -2.52 0.96 0.00 -0.55 0.00 0.00 41.25 39.00 1tlc s ASN 37 CO -0.10 -1.19 1.67 0.18 -2.79 0.00 0.00 177.10 174.87 1tlc n LEU 38 N 7.63 0.00 0.23 3.21 4.32 -0.01 -2.33 117.00 130.05 1tlc n LEU 38 Ca 0.10 0.41 0.11 0.00 -0.02 0.00 0.00 56.01 56.62 1tlc n LEU 38 Cb 0.49 -0.41 0.43 0.00 -1.62 0.00 0.00 43.42 42.30 1tlc n LEU 38 CO 0.69 -0.12 0.82 1.56 -1.22 0.00 0.00 177.39 179.12 1tlc h GLN 39 N 0.00 0.00 -0.00 3.23 1.08 -1.81 -3.08 115.11 114.53 1tlc h GLN 39 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1tlc h GLN 39 Cb 0.29 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 1tlc h GLN 39 CO 0.00 0.16 -0.22 -0.25 -0.95 0.00 0.00 178.83 177.57 1tlc n ASP 40 N -3.25 0.27 0.00 1.46 8.00 -0.98 -5.04 116.55 117.01 1tlc n ASP 40 Ca 0.01 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.55 1tlc n ASP 40 Cb 0.44 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 1tlc n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tlc n GLY 41 N 1.47 3.40 3.68 0.44 0.00 -1.16 -4.75 105.19 108.26 1tlc n GLY 41 Ca 0.07 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.81 1tlc n GLY 41 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1tlc s PHE 42 N -2.38 2.61 -1.36 1.61 5.36 -0.59 -4.66 117.98 118.57 1tlc s PHE 42 Ca 0.00 0.61 -0.13 0.00 -0.96 0.00 0.00 56.93 56.45 1tlc s PHE 42 Cb 0.00 -3.77 -0.04 0.00 -0.34 0.00 0.00 43.02 38.88 1tlc s PHE 42 CO 0.00 -2.97 2.39 -0.35 -1.46 0.00 0.00 175.22 172.83 1tlc n PRO 43 N 5.76 2.83 -3.67 10.12 -0.04 -1.26 -4.05 135.00 144.70 1tlc n PRO 43 Ca 0.14 -2.26 -0.37 0.00 -0.04 0.00 0.00 63.50 60.97 1tlc n PRO 43 Cb 0.43 -3.01 -0.12 0.00 -0.04 0.00 0.00 33.50 30.76 1tlc n PRO 43 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1tlc s LEU 44 N 1.25 3.75 0.21 1.53 2.96 -1.26 -4.00 118.68 123.13 1tlc s LEU 44 Ca 0.54 -0.11 -0.32 0.00 -0.22 0.00 0.00 54.13 54.03 1tlc s LEU 44 Cb 0.15 -2.03 -0.14 0.00 0.50 0.00 0.00 46.19 44.67 1tlc s LEU 44 CO -0.05 -0.04 1.39 1.33 -1.32 0.00 0.00 176.35 177.66 1tlc n VAL 45 N 5.00 0.73 0.69 1.68 0.24 -1.26 -4.80 118.33 120.61 1tlc n VAL 45 Ca -0.15 -0.18 0.07 0.00 -2.04 0.00 0.00 64.34 62.04 1tlc n VAL 45 Cb 0.52 -1.35 -0.04 0.00 -1.47 0.00 0.00 33.84 31.50 1tlc n VAL 45 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1tlc n THR 46 N 2.12 0.00 1.61 3.34 -2.24 -1.26 -4.36 114.28 113.49 1tlc n THR 46 Ca 0.13 -0.25 0.15 0.00 -2.27 0.00 0.00 64.05 61.81 1tlc n THR 46 Cb 0.29 1.09 0.70 0.00 -2.10 0.00 0.00 70.33 70.32 1tlc n THR 46 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1tlc n THR 47 N -0.73 0.00 -3.65 4.28 -2.24 -1.26 -1.41 114.28 109.27 1tlc n THR 47 Ca 0.05 -0.08 -0.09 0.00 -2.27 0.00 0.00 64.05 61.65 1tlc n THR 47 Cb 0.28 -0.10 -0.08 0.00 -2.10 0.00 0.00 70.33 68.33 1tlc n THR 47 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1tlc s LYS 48 N -2.22 0.67 0.32 -0.78 -2.85 -1.26 -4.63 119.74 108.99 1tlc s LYS 48 Ca 0.37 1.06 -0.29 0.00 -1.00 0.00 0.00 55.97 56.11 1tlc s LYS 48 Cb 0.21 0.18 -0.11 0.00 -2.06 0.00 0.00 37.83 36.05 1tlc s LYS 48 CO 0.41 -0.13 1.46 0.50 0.10 0.00 0.00 175.35 177.68 1tlc s ARG 49 N 1.24 4.20 0.08 1.78 3.52 0.06 -4.76 118.95 125.06 1tlc s ARG 49 Ca -0.07 2.43 0.08 0.00 -0.13 0.00 0.00 55.73 58.04 1tlc s ARG 49 Cb -0.05 -3.03 -0.03 0.00 -1.56 0.00 0.00 34.95 30.27 1tlc s ARG 49 CO -0.13 -0.45 -0.22 0.00 -0.81 0.00 0.00 175.30 173.69 1tlc s HIS 51 N -0.98 3.02 0.58 0.00 3.76 -1.26 -4.93 115.29 115.48 1tlc s HIS 51 Ca 0.08 -0.73 0.28 0.00 -0.15 0.00 0.00 55.06 54.54 1tlc s HIS 51 Cb -0.10 -3.75 1.54 0.00 1.11 0.00 0.00 32.58 31.39 1tlc s HIS 51 CO 0.03 -1.15 2.01 1.25 -0.85 0.00 0.00 174.74 176.03 1tlc h LEU 52 N 9.83 0.00 -0.74 0.89 5.85 -2.00 -2.47 115.31 126.67 1tlc h LEU 52 Ca -0.28 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.37 1tlc h LEU 52 Cb 1.09 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 1tlc h LEU 52 CO 1.03 0.00 0.17 -0.09 -0.34 0.00 0.00 178.44 179.20 1tlc h ARG 53 N 0.00 1.13 -0.03 1.25 2.43 -1.99 -0.94 114.38 116.24 1tlc h ARG 53 Ca 0.16 -0.27 -0.17 0.00 -0.81 0.00 0.00 59.98 58.89 1tlc h ARG 53 Cb 0.82 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1tlc h ARG 53 CO -0.00 0.99 -0.75 0.66 -1.51 0.00 0.00 179.97 179.36 1tlc h SER 54 N 1.07 0.23 0.35 -3.80 4.64 -1.79 -2.33 113.55 111.91 1tlc h SER 54 Ca 0.22 -0.16 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 1tlc h SER 54 Cb 0.38 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1tlc h SER 54 CO 0.00 0.89 -0.17 0.40 -0.87 0.00 0.00 176.83 177.08 1tlc h ILE 55 N 0.12 0.66 0.02 0.95 2.04 -1.50 -2.58 117.51 117.22 1tlc h ILE 55 Ca -0.02 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 1tlc h ILE 55 Cb 1.32 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 1tlc h ILE 55 CO 0.11 0.02 -0.01 -0.29 0.00 0.00 0.00 178.15 177.98 1tlc h ILE 56 N -0.52 1.05 -0.62 -0.67 -0.00 -1.19 -1.52 117.51 114.04 1tlc h ILE 56 Ca -0.05 -0.22 -0.01 0.00 -0.00 0.00 0.00 64.86 64.58 1tlc h ILE 56 Cb 0.39 1.20 -0.03 0.00 -0.00 0.00 0.00 36.82 38.38 1tlc h ILE 56 CO 0.08 0.06 0.36 0.45 -0.00 0.00 0.00 178.15 179.09 1tlc h HIS 57 N -0.12 0.84 -0.39 2.19 3.86 -1.39 -1.80 115.15 118.34 1tlc h HIS 57 Ca -0.00 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1tlc h HIS 57 Cb 0.11 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.29 1tlc h HIS 57 CO -0.05 0.59 0.24 1.49 0.86 0.00 0.00 177.93 181.07 1tlc h GLU 58 N 0.85 0.53 -0.43 2.45 4.81 -1.38 -0.42 114.58 121.00 1tlc h GLU 58 Ca 0.22 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.43 1tlc h GLU 58 Cb 0.02 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1tlc h GLU 58 CO -0.04 0.39 0.22 1.25 -0.73 0.00 0.00 179.01 180.11 1tlc h LEU 59 N 0.52 0.34 -0.78 1.64 5.85 -0.98 -2.32 115.31 119.57 1tlc h LEU 59 Ca 0.14 0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.75 1tlc h LEU 59 Cb -0.00 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1tlc h LEU 59 CO -0.03 0.24 -0.61 -0.07 -0.34 0.00 0.00 178.44 177.64 1tlc h LEU 60 N 0.45 0.00 -0.39 2.25 3.38 -1.16 -2.19 115.31 117.66 1tlc h LEU 60 Ca 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1tlc h LEU 60 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1tlc h LEU 60 CO -0.11 0.61 0.20 -0.25 0.09 0.00 0.00 178.44 178.97 1tlc h TRP 61 N 0.00 0.55 0.41 1.13 7.01 -0.62 -2.73 115.95 121.70 1tlc h TRP 61 Ca -0.01 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.95 1tlc h TRP 61 Cb 1.08 -0.17 0.00 0.00 -2.10 0.00 0.00 29.16 27.97 1tlc h TRP 61 CO 0.00 0.45 -0.21 0.74 -2.79 0.00 0.00 178.44 176.63 1tlc h PHE 62 N 0.49 -0.55 0.00 2.65 0.04 -1.30 -2.96 116.94 115.32 1tlc h PHE 62 Ca 0.13 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 1tlc h PHE 62 Cb 0.10 0.19 -0.00 0.00 2.20 0.00 0.00 35.95 38.43 1tlc h PHE 62 CO -0.02 -0.34 -0.03 -0.07 -0.60 0.00 0.00 178.31 177.25 1tlc h LEU 63 N -0.57 0.00 0.00 1.54 3.38 -1.36 -1.85 115.31 116.45 1tlc h LEU 63 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1tlc h LEU 63 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1tlc h LEU 63 CO 0.08 0.03 -0.13 0.00 0.09 0.00 0.00 178.44 178.50 1tlc n GLN 64 N -3.57 0.21 -2.29 1.13 3.00 -1.03 -4.94 117.38 109.89 1tlc n GLN 64 Ca -0.03 0.14 -0.03 0.00 -0.01 0.00 0.00 57.00 57.07 1tlc n GLN 64 Cb 0.13 -1.71 0.00 0.00 0.00 0.00 0.00 30.24 28.66 1tlc n GLN 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1tlc n GLY 65 N 1.36 0.44 3.86 1.08 0.00 -0.69 -5.05 105.19 106.19 1tlc n GLY 65 Ca 0.05 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 45.02 1tlc n GLY 65 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tlc s ASP 66 N -2.94 6.52 -0.02 1.61 2.15 -1.17 -4.19 116.67 118.64 1tlc s ASP 66 Ca 0.03 0.63 0.02 0.00 0.43 0.00 0.00 52.55 53.66 1tlc s ASP 66 Cb -0.01 -2.13 0.04 0.00 -0.30 0.00 0.00 42.92 40.51 1tlc s ASP 66 CO 0.04 0.37 0.85 0.35 -0.17 0.00 0.00 175.17 176.62 1tlc n THR 67 N 1.98 0.68 -4.43 1.71 -2.24 -1.26 -4.22 114.28 106.50 1tlc n THR 67 Ca -0.18 -0.73 -0.34 0.00 -2.27 0.00 0.00 64.05 60.54 1tlc n THR 67 Cb 0.54 0.57 -0.14 0.00 -2.10 0.00 0.00 70.33 69.21 1tlc n THR 67 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1tlc s ASN 68 N -0.90 4.28 0.00 3.42 3.84 -1.26 -2.19 114.94 122.12 1tlc s ASN 68 Ca 0.04 -0.30 0.00 0.00 0.21 0.00 0.00 52.86 52.81 1tlc s ASN 68 Cb 0.04 -1.69 0.00 0.00 -0.55 0.00 0.00 41.25 39.05 1tlc s ASN 68 CO 0.00 0.11 0.43 2.30 -2.79 0.00 0.00 177.10 177.16 1tlc n ILE 69 N 3.90 0.00 0.40 -5.21 -6.64 -0.29 -3.91 119.36 107.61 1tlc n ILE 69 Ca -0.18 0.00 -0.18 0.00 -1.77 0.00 0.00 62.75 60.62 1tlc n ILE 69 Cb 0.52 -0.25 -0.09 0.00 -1.44 0.00 0.00 39.64 38.38 1tlc n ILE 69 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1tlc h ALA 70 N 1.86 -1.02 -0.91 -1.28 0.00 -1.93 0.04 119.26 116.03 1tlc h ALA 70 Ca 0.00 -0.23 0.19 0.00 0.00 0.00 0.00 54.91 54.86 1tlc h ALA 70 Cb 0.07 0.39 -0.11 0.00 0.00 0.00 0.00 17.79 18.14 1tlc h ALA 70 CO 0.00 -1.02 0.47 -0.92 0.00 0.00 0.00 179.25 177.78 1tlc h TYR 71 N -1.12 0.81 -0.32 0.00 5.03 -1.99 0.04 116.97 119.43 1tlc h TYR 71 Ca -0.10 0.04 -0.16 0.00 2.58 0.00 0.00 58.73 61.08 1tlc h TYR 71 Cb 0.80 -0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.85 1tlc h TYR 71 CO -0.01 0.11 -0.44 -0.07 -1.32 0.00 0.00 178.16 176.43 1tlc h LEU 72 N 0.58 0.88 0.48 2.82 3.38 -1.72 -3.13 115.31 118.60 1tlc h LEU 72 Ca 0.53 -0.43 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1tlc h LEU 72 Cb 0.87 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1tlc h LEU 72 CO -0.42 1.19 -0.23 1.12 0.09 0.00 0.00 178.44 180.19 1tlc h HIS 73 N 0.65 -0.60 0.00 1.13 2.07 0.83 0.29 115.15 119.53 1tlc h HIS 73 Ca 0.04 -0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 1tlc h HIS 73 Cb 1.02 0.20 0.00 0.00 2.57 0.00 0.00 27.41 31.20 1tlc h HIS 73 CO 0.06 -0.27 0.35 -1.91 -3.07 0.00 0.00 177.93 173.08 1tlc n GLU 74 N -5.25 0.01 -0.51 5.12 2.13 -0.38 0.70 120.64 122.48 1tlc n GLU 74 Ca -0.10 0.26 0.05 0.00 0.66 0.00 0.00 57.16 58.03 1tlc n GLU 74 Cb 0.31 -1.89 0.08 0.00 0.27 0.00 0.00 31.44 30.21 1tlc n GLU 74 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1tlc n ASN 75 N -1.35 1.22 -0.17 4.31 4.13 -1.15 -5.00 115.26 117.25 1tlc n ASN 75 Ca -0.00 -2.66 -0.02 0.00 1.68 0.00 0.00 54.58 53.58 1tlc n ASN 75 Cb 0.35 -0.34 -0.01 0.00 -1.54 0.00 0.00 39.78 38.24 1tlc n ASN 75 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1tlc n ASN 76 N -0.60 -5.65 -4.65 6.41 4.13 0.22 -4.91 115.26 110.20 1tlc n ASN 76 Ca 0.09 0.05 -0.42 0.00 1.68 0.00 0.00 54.58 55.99 1tlc n ASN 76 Cb 0.74 -3.49 -0.04 0.00 -1.54 0.00 0.00 39.78 35.45 1tlc n ASN 76 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1tlc s VAL 77 N -1.14 4.81 -0.59 2.41 0.11 1.00 -4.89 120.40 122.10 1tlc s VAL 77 Ca 0.00 1.70 0.05 0.00 -2.93 0.00 0.00 61.98 60.80 1tlc s VAL 77 Cb 0.00 -4.17 0.03 0.00 -1.53 0.00 0.00 36.38 30.71 1tlc s VAL 77 CO 0.00 -0.07 0.60 0.35 -3.33 0.00 0.00 175.10 172.65 1tlc n THR 78 N 5.14 0.00 -0.26 5.04 -2.24 -1.26 -3.48 114.28 117.22 1tlc n THR 78 Ca 0.07 -0.49 0.18 0.00 -2.27 0.00 0.00 64.05 61.55 1tlc n THR 78 Cb 0.47 1.09 0.49 0.00 -2.10 0.00 0.00 70.33 70.29 1tlc n THR 78 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1tlc h ILE 79 N 0.89 0.68 -0.00 2.28 6.09 -1.96 -2.52 117.51 122.97 1tlc h ILE 79 Ca 0.00 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 1tlc h ILE 79 Cb 0.20 0.19 0.00 0.00 0.47 0.00 0.00 36.82 37.68 1tlc h ILE 79 CO 0.00 0.08 -0.04 0.79 -3.07 0.00 0.00 178.15 175.91 1tlc n TRP 80 N -4.54 0.00 0.20 2.19 7.02 -1.26 -4.42 117.44 116.63 1tlc n TRP 80 Ca 0.20 0.00 0.04 0.00 -1.02 0.00 0.00 57.50 56.72 1tlc n TRP 80 Cb 0.69 -0.28 0.46 0.00 -2.42 0.00 0.00 31.31 29.75 1tlc n TRP 80 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1tlc h ASP 81 N 0.14 0.04 0.55 -0.99 3.32 -1.80 -3.01 116.42 114.66 1tlc h ASP 81 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1tlc h ASP 81 Cb 0.33 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1tlc h ASP 81 CO 0.00 0.25 -0.00 1.21 -1.72 0.00 0.00 179.24 178.98 1tlc n GLU 82 N -4.27 0.45 -0.01 3.56 4.07 -1.26 -3.70 120.64 119.47 1tlc n GLU 82 Ca -0.02 -0.00 0.05 0.00 -0.06 0.00 0.00 57.16 57.13 1tlc n GLU 82 Cb 0.28 -1.50 -0.10 0.00 -0.06 0.00 0.00 31.44 30.06 1tlc n GLU 82 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 1tlc n TRP 83 N -1.27 0.00 -1.68 4.31 8.01 -1.14 -5.01 117.44 120.65 1tlc n TRP 83 Ca 0.15 0.00 -0.31 0.00 -1.31 0.00 0.00 57.50 56.03 1tlc n TRP 83 Cb 0.24 -0.34 0.04 0.00 -2.01 0.00 0.00 31.31 29.24 1tlc n TRP 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1tlc s ALA 84 N -2.84 2.82 0.86 6.99 0.00 -1.21 -4.74 121.76 123.65 1tlc s ALA 84 Ca -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 51.96 51.88 1tlc s ALA 84 Cb 0.08 -3.14 0.05 0.00 0.00 0.00 0.00 23.12 20.12 1tlc s ALA 84 CO 0.54 -1.05 0.33 -0.40 0.00 0.00 0.00 175.76 175.18 1tlc n ASP 85 N -3.01 0.11 0.09 0.00 5.68 -0.49 -4.86 116.55 114.07 1tlc n ASP 85 Ca 0.07 -1.17 0.09 0.00 -0.50 0.00 0.00 54.79 53.28 1tlc n ASP 85 Cb 0.54 -0.24 0.41 0.00 -1.14 0.00 0.00 41.12 40.69 1tlc n ASP 85 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1tlc n GLU 86 N -1.68 0.12 0.03 0.11 2.13 -1.26 -2.21 120.64 117.88 1tlc n GLU 86 Ca 0.04 0.41 0.11 0.00 0.66 0.00 0.00 57.16 58.38 1tlc n GLU 86 Cb 0.15 -1.75 0.01 0.00 0.27 0.00 0.00 31.44 30.13 1tlc n GLU 86 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1tlc n ASN 87 N -1.97 0.60 0.00 4.31 5.03 -1.26 -4.97 115.26 117.00 1tlc n ASN 87 Ca 0.02 -0.13 0.00 0.00 0.87 0.00 0.00 54.58 55.34 1tlc n ASN 87 Cb 0.17 0.81 0.00 0.00 -1.02 0.00 0.00 39.78 39.74 1tlc n ASN 87 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1tlc n GLY 88 N 1.34 0.97 3.81 7.41 0.00 -0.94 -4.95 105.19 112.83 1tlc n GLY 88 Ca 0.01 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1tlc n GLY 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tlc s ASP 89 N -2.03 6.75 -0.02 1.61 1.01 -1.26 -1.14 116.67 121.59 1tlc s ASP 89 Ca 0.00 0.89 0.17 0.00 0.71 0.00 0.00 52.55 54.33 1tlc s ASP 89 Cb 0.00 -2.25 -0.25 0.00 1.01 0.00 0.00 42.92 41.43 1tlc s ASP 89 CO 0.00 0.25 0.44 0.18 0.21 0.00 0.00 175.17 176.25 1tlc n LEU 90 N 2.30 0.14 0.00 1.23 4.77 -0.93 -1.40 117.00 123.11 1tlc n LEU 90 Ca -0.13 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1tlc n LEU 90 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1tlc n LEU 90 CO 0.39 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1tlc n GLY 91 N 1.50 -1.76 2.44 -0.72 0.00 -1.26 0.17 105.19 105.57 1tlc n GLY 91 Ca -0.02 -2.03 -0.40 0.00 0.00 0.00 0.00 46.02 43.57 1tlc n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1tlc n PRO 92 N 0.00 3.55 -1.15 1.61 -0.04 -1.26 -4.82 135.00 132.88 1tlc n PRO 92 Ca 0.00 -2.42 -0.23 0.00 -0.04 0.00 0.00 63.50 60.81 1tlc n PRO 92 Cb 0.00 -2.92 0.18 0.00 -0.04 0.00 0.00 33.50 30.72 1tlc n PRO 92 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1tlc n VAL 93 N 3.84 0.00 0.00 0.52 0.24 -1.26 -4.46 118.33 117.21 1tlc n VAL 93 Ca 0.70 -0.57 0.00 0.00 -2.04 0.00 0.00 64.34 62.43 1tlc n VAL 93 Cb 0.28 -1.41 0.00 0.00 -1.47 0.00 0.00 33.84 31.24 1tlc n VAL 93 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1tlc n TYR 94 N -3.86 0.00 -0.35 6.34 4.01 -1.26 0.04 117.16 122.07 1tlc n TYR 94 Ca 0.12 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.95 1tlc n TYR 94 Cb 0.45 0.00 0.19 0.00 -0.31 0.00 0.00 39.34 39.67 1tlc n TYR 94 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1tlc h GLY 95 N 0.00 0.89 0.77 2.72 0.00 -1.76 -1.57 103.07 104.12 1tlc h GLY 95 Ca 0.00 0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.64 1tlc h GLY 95 CO 0.00 -0.43 0.12 1.70 0.00 0.00 0.00 176.54 177.94 1tlc h LYS 96 N 0.00 0.26 -0.59 4.80 3.11 -0.56 -2.95 116.57 120.65 1tlc h LYS 96 Ca 0.52 -0.02 -0.10 0.00 -2.81 0.00 0.00 60.65 58.25 1tlc h LYS 96 Cb 0.90 -0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 32.04 1tlc h LYS 96 CO -1.00 0.17 -0.01 1.96 -2.81 0.00 0.00 179.45 177.77 1tlc h GLN 97 N 0.27 1.03 -0.43 1.90 1.08 -1.28 0.24 115.11 117.92 1tlc h GLN 97 Ca 0.14 -0.32 -0.05 0.00 -1.45 0.00 0.00 58.65 56.97 1tlc h GLN 97 Cb 0.09 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 1tlc h GLN 97 CO -0.13 1.01 0.08 -1.49 -0.95 0.00 0.00 178.83 177.35 1tlc h TRP 98 N 0.94 0.75 0.00 2.96 4.06 -1.33 -3.29 115.95 120.04 1tlc h TRP 98 Ca 0.17 -0.10 -0.26 0.00 2.06 0.00 0.00 58.89 60.75 1tlc h TRP 98 Cb 0.55 -0.21 -0.05 0.00 -1.00 0.00 0.00 29.16 28.46 1tlc h TRP 98 CO 0.04 0.71 -2.06 0.54 -3.56 0.00 0.00 178.44 174.11 1tlc n ARG 99 N -4.50 0.66 -3.03 0.49 5.12 -1.12 -0.62 116.66 113.66 1tlc n ARG 99 Ca -0.00 0.04 -0.17 0.00 -1.93 0.00 0.00 57.85 55.79 1tlc n ARG 99 Cb 0.23 -1.61 -0.01 0.00 -1.16 0.00 0.00 32.46 29.91 1tlc n ARG 99 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1tlc n ALA 100 N -2.58 1.02 -2.31 7.54 0.00 0.84 -3.74 120.51 121.27 1tlc n ALA 100 Ca -0.22 -2.68 -0.42 0.00 0.00 0.00 0.00 53.44 50.11 1tlc n ALA 100 Cb 0.99 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.41 1tlc n ALA 100 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1tlc s TRP 101 N -0.84 3.17 -0.11 0.00 -0.11 0.76 -4.59 118.94 117.22 1tlc s TRP 101 Ca 0.34 1.06 -0.28 0.00 1.22 0.00 0.00 56.10 58.44 1tlc s TRP 101 Cb 0.24 -3.55 -0.02 0.00 -1.50 0.00 0.00 33.47 28.64 1tlc s TRP 101 CO -0.13 -1.89 0.92 -1.25 -4.62 0.00 0.00 176.95 169.98 1tlc s PRO 102 N 1.70 4.40 0.56 5.86 0.04 -1.26 -0.54 135.00 145.75 1tlc s PRO 102 Ca 0.61 1.23 -0.15 0.00 0.04 0.00 0.00 61.00 62.73 1tlc s PRO 102 Cb -0.31 -3.54 -0.06 0.00 0.04 0.00 0.00 34.50 30.64 1tlc s PRO 102 CO 0.27 -0.26 1.02 0.95 0.04 0.00 0.00 177.00 179.02 1tlc s THR 103 N 1.84 4.30 0.63 1.26 -4.23 -0.50 -4.92 115.64 114.04 1tlc s THR 103 Ca 0.44 1.05 0.36 0.00 -1.18 0.00 0.00 61.69 62.36 1tlc s THR 103 Cb -0.18 -3.61 0.39 0.00 1.34 0.00 0.00 72.50 70.44 1tlc s THR 103 CO 0.17 -0.68 2.24 -0.65 -0.54 0.00 0.00 174.62 175.16 1tlc h PRO 104 N 0.57 0.00 -1.50 3.99 0.11 -1.96 -3.23 132.00 129.98 1tlc h PRO 104 Ca -0.46 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 64.98 1tlc h PRO 104 Cb 1.20 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.96 1tlc h PRO 104 CO 0.60 0.00 0.14 -0.40 -0.21 0.00 0.00 178.00 178.13 1tlc n ASP 105 N -3.38 6.20 0.00 -2.05 5.75 -1.26 -5.00 116.55 116.81 1tlc n ASP 105 Ca -0.02 -3.78 0.00 0.00 -0.01 0.00 0.00 54.79 50.98 1tlc n ASP 105 Cb 0.16 -0.74 0.00 0.00 -1.03 0.00 0.00 41.12 39.51 1tlc n ASP 105 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tlc n GLY 106 N -0.60 1.28 3.97 6.12 0.00 -1.22 -5.04 105.19 109.71 1tlc n GLY 106 Ca 0.49 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.27 1tlc n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tlc s ARG 107 N -0.18 1.78 -0.02 1.61 0.52 -1.26 -4.92 118.95 116.49 1tlc s ARG 107 Ca 0.00 -0.87 0.01 0.00 -0.52 0.00 0.00 55.73 54.35 1tlc s ARG 107 Cb 0.00 -2.28 0.01 0.00 0.52 0.00 0.00 34.95 33.20 1tlc s ARG 107 CO 0.00 -1.40 -0.03 -1.01 0.02 0.00 0.00 175.30 172.88 1tlc s HIS 108 N -3.17 0.47 -0.16 -0.53 3.76 -1.26 -1.41 115.29 112.99 1tlc s HIS 108 Ca 0.65 -0.09 -0.08 0.00 -0.15 0.00 0.00 55.06 55.39 1tlc s HIS 108 Cb -0.07 -0.40 -0.04 0.00 1.11 0.00 0.00 32.58 33.18 1tlc s HIS 108 CO 0.44 -0.08 0.10 0.42 -0.85 0.00 0.00 174.74 174.77 1tlc s ILE 109 N 0.42 5.16 -0.73 0.60 1.01 0.30 -4.84 121.20 123.11 1tlc s ILE 109 Ca -0.05 0.09 -0.13 0.00 0.00 0.00 0.00 60.65 60.57 1tlc s ILE 109 Cb -0.08 -3.30 0.19 0.00 0.01 0.00 0.00 42.46 39.28 1tlc s ILE 109 CO -0.00 0.51 0.66 -0.62 0.00 0.00 0.00 174.94 175.48 1tlc s ASP 110 N -0.15 6.42 0.46 3.58 -1.08 -1.25 -0.17 116.67 124.48 1tlc s ASP 110 Ca 0.09 -2.49 0.18 0.00 -0.52 0.00 0.00 52.55 49.81 1tlc s ASP 110 Cb -0.12 -2.16 1.09 0.00 -1.46 0.00 0.00 42.92 40.27 1tlc s ASP 110 CO 0.01 -0.61 1.98 1.56 0.52 0.00 0.00 175.17 178.62 1tlc h GLN 111 N 7.95 0.00 -0.18 4.34 4.20 -1.10 -1.75 115.11 128.57 1tlc h GLN 111 Ca -0.00 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.49 1tlc h GLN 111 Cb 1.04 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.83 1tlc h GLN 111 CO 0.81 0.20 -0.74 0.82 -0.67 0.00 0.00 178.83 179.25 1tlc h ILE 112 N 0.00 1.27 -0.06 2.54 1.08 -1.89 -2.03 117.51 118.41 1tlc h ILE 112 Ca -0.00 -1.93 -0.00 0.00 -0.39 0.00 0.00 64.86 62.54 1tlc h ILE 112 Cb 0.41 1.92 -0.00 0.00 -3.07 0.00 0.00 36.82 36.07 1tlc h ILE 112 CO 0.03 0.62 0.03 0.74 -0.69 0.00 0.00 178.15 178.87 1tlc h THR 113 N 0.57 1.11 -0.04 -0.27 2.02 -1.88 0.15 112.91 114.57 1tlc h THR 113 Ca -0.04 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 66.84 1tlc h THR 113 Cb 1.37 1.22 -0.05 0.00 -1.74 0.00 0.00 68.15 68.95 1tlc h THR 113 CO 0.16 0.10 -0.23 0.74 0.37 0.00 0.00 175.52 176.65 1tlc h THR 114 N -0.02 0.46 -0.48 3.16 2.02 -1.31 -2.47 112.91 114.27 1tlc h THR 114 Ca 0.02 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.25 1tlc h THR 114 Cb 0.13 0.46 -0.05 0.00 -1.74 0.00 0.00 68.15 66.95 1tlc h THR 114 CO -0.00 0.00 0.22 0.58 0.37 0.00 0.00 175.52 176.69 1tlc h VAL 115 N -0.34 0.92 -0.49 3.16 2.07 -1.22 -0.30 116.25 120.05 1tlc h VAL 115 Ca 0.07 -0.15 0.08 0.00 0.82 0.00 0.00 66.70 67.52 1tlc h VAL 115 Cb 0.44 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.59 1tlc h VAL 115 CO -0.24 0.08 0.14 0.25 0.02 0.00 0.00 177.57 177.82 1tlc h LEU 116 N 0.44 0.09 -0.94 2.57 7.12 -0.52 0.10 115.31 124.17 1tlc h LEU 116 Ca 0.22 0.07 -0.11 0.00 0.13 0.00 0.00 57.88 58.19 1tlc h LEU 116 Cb 0.16 0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 40.36 1tlc h LEU 116 CO -0.17 0.08 -0.46 0.78 -0.13 0.00 0.00 178.44 178.53 1tlc h ASN 117 N 0.29 0.17 0.16 1.25 -0.26 -1.15 0.93 115.58 116.97 1tlc h ASN 117 Ca 0.24 -0.08 -0.28 0.00 -0.56 0.00 0.00 56.30 55.63 1tlc h ASN 117 Cb 0.30 -0.05 0.02 0.00 -1.06 0.00 0.00 38.32 37.53 1tlc h ASN 117 CO -0.28 0.61 -1.13 1.56 -1.06 0.00 0.00 177.43 177.12 1tlc h GLN 118 N 0.13 0.59 -0.28 0.81 4.20 -0.31 -1.71 115.11 118.54 1tlc h GLN 118 Ca 0.01 -0.72 -0.07 0.00 0.06 0.00 0.00 58.65 57.93 1tlc h GLN 118 Cb 0.87 0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 1tlc h GLN 118 CO 0.07 1.31 -0.12 -0.07 -0.67 0.00 0.00 178.83 179.35 1tlc h LEU 119 N 0.29 0.45 0.11 1.46 3.38 -0.54 0.11 115.31 120.57 1tlc h LEU 119 Ca -0.15 -0.11 -0.27 0.00 0.09 0.00 0.00 57.88 57.44 1tlc h LEU 119 Cb 1.80 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.42 1tlc h LEU 119 CO 0.21 0.61 -1.28 0.11 0.09 0.00 0.00 178.44 178.18 1tlc h LYS 120 N 0.44 0.22 0.00 1.13 1.57 -0.81 -3.38 116.57 115.74 1tlc h LYS 120 Ca 0.08 -0.38 -0.24 0.00 -1.87 0.00 0.00 60.65 58.24 1tlc h LYS 120 Cb 0.47 0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.88 1tlc h LYS 120 CO 0.03 1.15 -2.15 0.09 -0.57 0.00 0.00 179.45 178.00 1tlc n ASN 121 N -3.48 0.52 -3.10 0.86 4.13 -0.65 -4.85 115.26 108.69 1tlc n ASN 121 Ca -0.09 0.00 -0.20 0.00 1.68 0.00 0.00 54.58 55.97 1tlc n ASN 121 Cb 1.02 1.21 -0.04 0.00 -1.54 0.00 0.00 39.78 40.42 1tlc n ASN 121 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1tlc n ASP 122 N -2.54 -0.42 0.23 6.41 2.03 0.36 -5.00 116.55 117.62 1tlc n ASP 122 Ca -0.22 -2.84 0.07 0.00 0.52 0.00 0.00 54.79 52.31 1tlc n ASP 122 Cb 0.93 -0.12 0.54 0.00 -0.72 0.00 0.00 41.12 41.74 1tlc n ASP 122 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1tlc h PRO 123 N 3.93 0.00 0.00 -0.67 0.13 -1.66 -2.64 132.00 131.09 1tlc h PRO 123 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1tlc h PRO 123 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1tlc h PRO 123 CO 0.43 0.21 0.00 -0.25 -0.23 0.00 0.00 178.00 178.16 1tlc n ASP 124 N -4.04 0.52 -4.46 1.44 8.00 -1.26 -3.88 116.55 112.87 1tlc n ASP 124 Ca -0.02 0.58 -0.47 0.00 0.71 0.00 0.00 54.79 55.59 1tlc n ASP 124 Cb 0.29 -0.71 -0.03 0.00 -0.02 0.00 0.00 41.12 40.65 1tlc n ASP 124 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1tlc n SER 125 N -2.02 -0.46 -1.35 -2.24 2.88 -1.00 -4.88 113.62 104.56 1tlc n SER 125 Ca 0.05 1.15 0.09 0.00 -1.33 0.00 0.00 58.87 58.82 1tlc n SER 125 Cb 0.32 -1.05 0.31 0.00 -0.75 0.00 0.00 64.21 63.04 1tlc n SER 125 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1tlc n ARG 126 N 0.92 3.49 -1.68 -1.46 1.74 -1.26 -4.43 116.66 113.99 1tlc n ARG 126 Ca 0.15 -2.76 -0.14 0.00 -0.77 0.00 0.00 57.85 54.34 1tlc n ARG 126 Cb 0.27 -1.79 0.07 0.00 -1.02 0.00 0.00 32.46 30.00 1tlc n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1tlc n ARG 127 N 0.83 2.86 -3.13 5.56 1.74 -1.26 -4.94 116.66 118.32 1tlc n ARG 127 Ca 0.23 -3.84 -0.44 0.00 -0.77 0.00 0.00 57.85 53.03 1tlc n ARG 127 Cb 0.82 -2.00 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 1tlc n ARG 127 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1tlc n ILE 128 N -0.78 4.53 -4.61 0.55 5.41 -1.26 -4.99 119.36 118.21 1tlc n ILE 128 Ca 0.34 -5.17 -0.30 0.00 1.00 0.00 0.00 62.75 58.62 1tlc n ILE 128 Cb 0.89 -2.49 -0.13 0.00 -0.71 0.00 0.00 39.64 37.20 1tlc n ILE 128 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1tlc s ILE 129 N -0.40 2.54 -0.09 1.39 1.01 -1.26 -0.29 121.20 124.10 1tlc s ILE 129 Ca 0.35 -1.40 0.02 0.00 0.00 0.00 0.00 60.65 59.62 1tlc s ILE 129 Cb -0.05 -2.08 0.02 0.00 0.01 0.00 0.00 42.46 40.35 1tlc s ILE 129 CO -0.03 0.26 -0.13 0.54 0.00 0.00 0.00 174.94 175.57 1tlc s VAL 130 N -0.96 1.31 -0.11 2.92 0.11 0.31 -4.91 120.40 119.08 1tlc s VAL 130 Ca 0.14 -0.54 0.04 0.00 -2.93 0.00 0.00 61.98 58.69 1tlc s VAL 130 Cb -0.10 -1.21 0.00 0.00 -1.53 0.00 0.00 36.38 33.53 1tlc s VAL 130 CO 0.05 0.40 -0.23 -0.55 -3.33 0.00 0.00 175.10 171.45 1tlc s SER 131 N 0.96 3.14 0.00 3.54 0.15 -1.26 -0.87 113.70 119.36 1tlc s SER 131 Ca -0.08 -0.56 0.22 0.00 0.70 0.00 0.00 55.95 56.24 1tlc s SER 131 Cb -0.15 -1.43 0.00 0.00 -1.71 0.00 0.00 66.02 62.74 1tlc s SER 131 CO -0.00 0.15 1.06 0.00 1.20 0.00 0.00 173.24 175.65 1tlc n ALA 132 N 3.61 4.36 -2.05 5.45 0.00 0.10 -4.66 120.51 127.33 1tlc n ALA 132 Ca -0.19 -0.53 -0.42 0.00 0.00 0.00 0.00 53.44 52.31 1tlc n ALA 132 Cb 0.53 -0.88 -0.01 0.00 0.00 0.00 0.00 19.45 19.09 1tlc n ALA 132 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1tlc n TRP 133 N -1.45 3.82 -3.01 0.00 -0.00 -1.19 -4.81 117.44 110.79 1tlc n TRP 133 Ca 0.05 -2.75 -0.44 0.00 -0.00 0.00 0.00 57.50 54.35 1tlc n TRP 133 Cb 0.34 -2.53 -0.04 0.00 -0.00 0.00 0.00 31.31 29.07 1tlc n TRP 133 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 1tlc s ASN 134 N 3.93 6.26 0.26 5.87 3.04 -1.26 -4.94 114.94 128.10 1tlc s ASN 134 Ca 0.52 -1.42 -0.01 0.00 0.04 0.00 0.00 52.86 51.99 1tlc s ASN 134 Cb 0.09 -2.35 0.57 0.00 -1.54 0.00 0.00 41.25 38.02 1tlc s ASN 134 CO 0.01 -1.20 1.70 0.58 -3.04 0.00 0.00 177.10 175.15 1tlc h VAL 135 N 5.88 0.52 0.00 -5.21 2.07 -2.01 -1.49 116.25 116.02 1tlc h VAL 135 Ca -0.22 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 1tlc h VAL 135 Cb 1.07 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1tlc h VAL 135 CO 1.12 0.07 -0.02 1.23 0.02 0.00 0.00 177.57 179.98 1tlc h GLY 136 N 0.36 0.00 0.00 2.17 0.00 -2.00 -3.03 103.07 100.56 1tlc h GLY 136 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 1tlc h GLY 136 CO -0.50 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.22 1tlc n GLU 137 N -3.47 2.02 -0.34 4.80 1.02 -0.60 -4.79 120.64 119.28 1tlc n GLU 137 Ca -0.03 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 55.89 1tlc n GLU 137 Cb 0.11 -0.95 0.14 0.00 -0.02 0.00 0.00 31.44 30.72 1tlc n GLU 137 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1tlc h LEU 138 N 0.00 0.97 -1.04 -4.62 3.38 -1.32 -2.37 115.31 110.31 1tlc h LEU 138 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tlc h LEU 138 Cb 0.45 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1tlc h LEU 138 CO 0.00 0.64 0.00 -0.90 0.09 0.00 0.00 178.44 178.27 1tlc n ASP 139 N -4.53 0.65 0.03 -0.43 5.75 -1.26 -2.73 116.55 114.03 1tlc n ASP 139 Ca 0.13 0.71 0.11 0.00 -0.01 0.00 0.00 54.79 55.73 1tlc n ASP 139 Cb 0.14 -0.83 0.01 0.00 -1.03 0.00 0.00 41.12 39.41 1tlc n ASP 139 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1tlc n LYS 140 N -2.28 0.33 -2.58 0.11 5.02 -0.89 -4.95 118.16 112.91 1tlc n LYS 140 Ca 0.01 -0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.89 1tlc n LYS 140 Cb 0.15 -1.61 -0.05 0.00 -0.02 0.00 0.00 35.03 33.51 1tlc n LYS 140 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1tlc s MET 141 N -3.22 4.71 0.39 1.97 -1.94 -1.11 -4.24 119.30 115.86 1tlc s MET 141 Ca 0.03 1.67 0.13 0.00 -1.71 0.00 0.00 55.69 55.82 1tlc s MET 141 Cb 0.14 -3.24 0.80 0.00 2.01 0.00 0.00 34.83 34.54 1tlc s MET 141 CO 0.80 0.30 1.87 0.00 -0.01 0.00 0.00 175.02 177.97 1tlc h ALA 142 N 4.20 1.44 -2.96 3.03 0.00 0.15 -3.43 119.26 121.69 1tlc h ALA 142 Ca -0.46 -0.30 -0.16 0.00 0.00 0.00 0.00 54.91 54.00 1tlc h ALA 142 Cb 1.21 -0.05 -0.26 0.00 0.00 0.00 0.00 17.79 18.68 1tlc h ALA 142 CO 0.68 0.41 -0.39 -1.17 0.00 0.00 0.00 179.25 178.78 1tlc s LEU 143 N -8.24 0.62 0.22 0.00 2.96 -1.26 -5.08 118.68 107.89 1tlc s LEU 143 Ca -0.03 0.62 -0.30 0.00 -0.22 0.00 0.00 54.13 54.21 1tlc s LEU 143 Cb 0.15 1.00 -0.09 0.00 0.50 0.00 0.00 46.19 47.75 1tlc s LEU 143 CO 0.72 -0.13 1.18 0.00 -1.32 0.00 0.00 176.35 176.80 1tlc s ALA 144 N 0.60 3.44 -0.00 5.97 0.00 -1.26 -4.90 121.76 125.60 1tlc s ALA 144 Ca -0.04 0.96 -0.38 0.00 0.00 0.00 0.00 51.96 52.51 1tlc s ALA 144 Cb -0.05 -3.40 -0.17 0.00 0.00 0.00 0.00 23.12 19.50 1tlc s ALA 144 CO -0.04 -0.34 1.37 -2.30 0.00 0.00 0.00 175.76 174.45 1tlc n PRO 145 N 2.04 0.94 -0.06 0.00 -0.02 -1.26 -4.90 135.00 131.73 1tlc n PRO 145 Ca 0.03 0.34 -0.09 0.00 -2.02 0.00 0.00 63.50 61.76 1tlc n PRO 145 Cb 0.44 -1.96 -0.08 0.00 -0.02 0.00 0.00 33.50 31.88 1tlc n PRO 145 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tlc s HIS 147 N -1.98 2.94 -0.13 0.00 0.00 -1.26 -0.97 115.29 113.89 1tlc s HIS 147 Ca -0.12 -1.32 0.16 0.00 -3.00 0.00 0.00 55.06 50.78 1tlc s HIS 147 Cb -0.01 -4.47 -0.23 0.00 -4.00 0.00 0.00 32.58 23.87 1tlc s HIS 147 CO 0.41 -1.65 0.39 0.00 -1.00 0.00 0.00 174.74 172.89 1tlc n ALA 148 N 7.37 1.64 -3.28 -1.38 0.00 -0.95 -4.81 120.51 119.11 1tlc n ALA 148 Ca 0.31 -0.99 -0.13 0.00 0.00 0.00 0.00 53.44 52.63 1tlc n ALA 148 Cb 0.49 -0.54 -0.13 0.00 0.00 0.00 0.00 19.45 19.26 1tlc n ALA 148 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1tlc s PHE 149 N -2.65 -0.19 -0.02 0.00 5.36 -1.22 0.02 117.98 119.28 1tlc s PHE 149 Ca -0.07 0.49 -0.10 0.00 -0.96 0.00 0.00 56.93 56.29 1tlc s PHE 149 Cb 0.08 0.03 0.01 0.00 -0.34 0.00 0.00 43.02 42.79 1tlc s PHE 149 CO 0.83 -0.12 0.20 -0.59 -1.46 0.00 0.00 175.22 174.08 1tlc s PHE 150 N 0.46 -0.07 0.04 10.12 -0.71 -0.05 -1.45 117.98 126.32 1tlc s PHE 150 Ca -0.03 0.10 0.04 0.00 -1.04 0.00 0.00 56.93 56.00 1tlc s PHE 150 Cb -0.04 0.02 -0.02 0.00 -1.21 0.00 0.00 43.02 41.76 1tlc s PHE 150 CO -0.02 -0.29 -0.12 -1.14 -1.34 0.00 0.00 175.22 172.31 1tlc s GLN 151 N -1.14 0.76 0.27 1.99 0.74 -0.25 -0.53 119.66 121.51 1tlc s GLN 151 Ca -0.12 -0.72 0.08 0.00 0.05 0.00 0.00 55.36 54.65 1tlc s GLN 151 Cb -0.06 -0.71 -0.04 0.00 1.10 0.00 0.00 33.01 33.31 1tlc s GLN 151 CO 0.02 0.17 0.16 -0.06 -0.55 0.00 0.00 175.29 175.03 1tlc s PHE 152 N -0.95 2.95 -0.26 1.67 0.08 0.61 -1.05 117.98 121.03 1tlc s PHE 152 Ca -0.02 -0.19 -0.19 0.00 0.12 0.00 0.00 56.93 56.66 1tlc s PHE 152 Cb -0.08 -1.43 0.07 0.00 -0.57 0.00 0.00 43.02 41.01 1tlc s PHE 152 CO 0.01 0.48 0.65 -0.47 -0.10 0.00 0.00 175.22 175.79 1tlc s TYR 153 N -2.23 -0.87 -0.09 0.36 5.04 -0.74 -4.49 117.35 114.34 1tlc s TYR 153 Ca 0.34 1.90 0.02 0.00 -2.44 0.00 0.00 57.07 56.89 1tlc s TYR 153 Cb -0.07 0.42 -0.02 0.00 0.35 0.00 0.00 41.96 42.65 1tlc s TYR 153 CO 0.24 -0.43 -0.16 0.08 -1.34 0.00 0.00 175.55 173.94 1tlc s VAL 154 N 1.01 2.85 -0.11 3.14 1.01 -1.25 -1.41 120.40 125.64 1tlc s VAL 154 Ca -0.05 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 1tlc s VAL 154 Cb -0.05 -2.14 0.06 0.00 0.00 0.00 0.00 36.38 34.24 1tlc s VAL 154 CO -0.10 0.56 0.20 0.00 0.00 0.00 0.00 175.10 175.77 1tlc s ALA 155 N -0.14 -0.31 -1.15 5.51 0.00 -1.03 -4.77 121.76 119.87 1tlc s ALA 155 Ca -0.02 0.66 -0.10 0.00 0.00 0.00 0.00 51.96 52.50 1tlc s ALA 155 Cb -0.14 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 1tlc s ALA 155 CO 0.04 -0.66 0.83 -0.25 0.00 0.00 0.00 175.76 175.71 1tlc n ASP 156 N 5.33 -4.67 0.00 0.00 8.00 -1.26 -2.12 116.55 121.83 1tlc n ASP 156 Ca -0.05 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.60 1tlc n ASP 156 Cb 0.50 -4.27 0.00 0.00 -0.02 0.00 0.00 41.12 37.33 1tlc n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tlc n GLY 157 N -1.47 0.11 3.48 0.44 0.00 -1.26 -4.98 105.19 101.50 1tlc n GLY 157 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1tlc n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tlc s LYS 158 N -1.41 2.44 -0.28 1.61 1.02 -0.90 -0.43 119.74 121.79 1tlc s LYS 158 Ca 0.00 -0.74 -0.10 0.00 0.02 0.00 0.00 55.97 55.15 1tlc s LYS 158 Cb 0.00 -2.35 -0.04 0.00 -0.52 0.00 0.00 37.83 34.92 1tlc s LYS 158 CO 0.00 0.61 0.17 -1.17 -0.92 0.00 0.00 175.35 174.04 1tlc s LEU 159 N -0.86 3.98 0.26 3.17 2.96 0.18 -2.48 118.68 125.89 1tlc s LEU 159 Ca 0.12 -0.15 0.09 0.00 -0.22 0.00 0.00 54.13 53.97 1tlc s LEU 159 Cb -0.11 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 1tlc s LEU 159 CO 0.01 -0.08 0.06 -0.44 -1.32 0.00 0.00 176.35 174.58 1tlc s SER 160 N 1.71 4.82 -0.04 3.68 0.01 -0.50 0.27 113.70 123.66 1tlc s SER 160 Ca 0.07 -0.54 -0.03 0.00 1.31 0.00 0.00 55.95 56.76 1tlc s SER 160 Cb -0.16 -1.00 0.02 0.00 0.21 0.00 0.00 66.02 65.08 1tlc s SER 160 CO 0.09 -0.01 0.11 0.00 0.41 0.00 0.00 173.24 173.83 1tlc s GLN 162 N 0.27 3.15 -0.08 0.00 0.74 -0.22 -0.56 119.66 122.96 1tlc s GLN 162 Ca -0.02 -0.80 -0.02 0.00 0.05 0.00 0.00 55.36 54.57 1tlc s GLN 162 Cb -0.03 -2.48 -0.03 0.00 1.10 0.00 0.00 33.01 31.57 1tlc s GLN 162 CO -0.01 0.10 0.03 -1.17 -0.55 0.00 0.00 175.29 173.70 1tlc s LEU 163 N 0.56 3.73 -0.33 3.68 0.20 0.36 -1.09 118.68 125.79 1tlc s LEU 163 Ca -0.11 0.19 -0.10 0.00 0.69 0.00 0.00 54.13 54.80 1tlc s LEU 163 Cb -0.16 -1.91 0.01 0.00 -0.43 0.00 0.00 46.19 43.70 1tlc s LEU 163 CO 0.04 0.37 0.16 -0.47 -0.29 0.00 0.00 176.35 176.16 1tlc s TYR 164 N -0.95 3.20 -0.34 5.38 6.14 -0.53 -1.07 117.35 129.18 1tlc s TYR 164 Ca 0.15 -0.79 -0.04 0.00 0.64 0.00 0.00 57.07 57.03 1tlc s TYR 164 Cb -0.11 -2.37 0.06 0.00 0.42 0.00 0.00 41.96 39.96 1tlc s TYR 164 CO 0.04 -0.55 0.09 -1.14 0.64 0.00 0.00 175.55 174.63 1tlc s GLN 165 N 1.57 2.42 0.33 4.97 0.74 0.33 -2.24 119.66 127.78 1tlc s GLN 165 Ca 0.03 -1.35 0.14 0.00 0.05 0.00 0.00 55.36 54.23 1tlc s GLN 165 Cb -0.18 -3.38 0.57 0.00 1.10 0.00 0.00 33.01 31.12 1tlc s GLN 165 CO 0.06 -0.74 1.71 0.07 -0.55 0.00 0.00 175.29 175.84 1tlc h ARG 166 N 8.11 0.00 -2.74 1.67 0.11 -1.35 2.81 114.38 122.99 1tlc h ARG 166 Ca -0.20 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.75 1tlc h ARG 166 Cb 1.07 0.00 -0.26 0.00 1.11 0.00 0.00 29.97 31.88 1tlc h ARG 166 CO 0.60 0.48 -0.32 0.45 0.10 0.00 0.00 179.97 181.28 1tlc s SER 167 N -6.74 -0.45 -0.06 0.08 0.15 -1.26 -1.15 113.70 104.27 1tlc s SER 167 Ca -0.01 0.81 -0.03 0.00 0.70 0.00 0.00 55.95 57.42 1tlc s SER 167 Cb 0.13 0.72 0.04 0.00 -1.71 0.00 0.00 66.02 65.19 1tlc s SER 167 CO 0.73 -0.18 0.10 0.00 1.20 0.00 0.00 173.24 175.09 1tlc s ASP 169 N 2.21 6.22 0.10 0.00 -1.08 -1.26 -0.31 116.67 122.54 1tlc s ASP 169 Ca 0.04 -0.74 -0.32 0.00 -0.52 0.00 0.00 52.55 51.01 1tlc s ASP 169 Cb -0.12 -2.52 -0.13 0.00 -1.46 0.00 0.00 42.92 38.68 1tlc s ASP 169 CO -0.04 -1.69 1.60 0.58 0.52 0.00 0.00 175.17 176.14 1tlc h VAL 170 N 6.10 0.20 0.02 1.11 2.07 -0.92 -2.44 116.25 122.38 1tlc h VAL 170 Ca -0.21 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1tlc h VAL 170 Cb 1.05 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1tlc h VAL 170 CO 1.27 0.00 -0.01 0.15 0.02 0.00 0.00 177.57 179.00 1tlc h PHE 171 N -0.77 -0.02 0.00 1.57 3.04 -1.91 -3.30 116.94 115.55 1tlc h PHE 171 Ca -0.02 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.93 1tlc h PHE 171 Cb 0.71 0.01 0.00 0.00 2.56 0.00 0.00 35.95 39.23 1tlc h PHE 171 CO -0.25 0.11 -0.13 1.25 -2.02 0.00 0.00 178.31 177.27 1tlc h LEU 172 N -0.15 0.00 0.12 0.59 5.85 -1.95 -3.44 115.31 116.33 1tlc h LEU 172 Ca -0.00 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.41 1tlc h LEU 172 Cb 0.14 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 1tlc h LEU 172 CO 0.00 0.53 -1.50 1.23 -0.34 0.00 0.00 178.44 178.36 1tlc h GLY 173 N -0.92 0.30 -0.44 3.75 0.00 -1.66 -3.41 103.07 100.70 1tlc h GLY 173 Ca 0.00 -0.76 0.12 0.00 0.00 0.00 0.00 47.33 46.69 1tlc h GLY 173 CO 0.00 0.66 -0.28 -2.00 0.00 0.00 0.00 176.54 174.93 1tlc h LEU 174 N 0.07 -0.98 -0.93 3.11 5.85 -1.57 -1.17 115.31 119.68 1tlc h LEU 174 Ca -0.23 0.22 0.22 0.00 0.84 0.00 0.00 57.88 58.93 1tlc h LEU 174 Cb 2.01 0.53 -0.12 0.00 0.37 0.00 0.00 40.66 43.45 1tlc h LEU 174 CO 0.17 -0.28 0.48 -0.65 -0.34 0.00 0.00 178.44 177.82 1tlc h PRO 175 N -0.10 0.49 -0.07 5.25 0.11 -1.78 -1.81 132.00 134.09 1tlc h PRO 175 Ca 0.28 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.35 1tlc h PRO 175 Cb 0.54 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.54 1tlc h PRO 175 CO -0.71 0.32 -0.00 0.74 -0.21 0.00 0.00 178.00 178.14 1tlc h PHE 176 N 0.51 0.14 -0.46 0.65 -1.00 -1.46 -3.06 116.94 112.24 1tlc h PHE 176 Ca 0.58 -0.03 -0.06 0.00 2.81 0.00 0.00 57.97 61.27 1tlc h PHE 176 Cb 1.07 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 40.58 1tlc h PHE 176 CO -0.08 0.41 0.03 -0.91 -1.61 0.00 0.00 178.31 176.15 1tlc h ASN 177 N -0.18 0.77 -0.41 2.17 -0.26 -1.14 -2.22 115.58 114.31 1tlc h ASN 177 Ca 0.02 -0.29 -0.02 0.00 -0.56 0.00 0.00 56.30 55.45 1tlc h ASN 177 Cb 0.36 -0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 37.39 1tlc h ASN 177 CO 0.00 0.86 0.18 0.40 -1.06 0.00 0.00 177.43 177.82 1tlc h ILE 178 N 0.64 1.19 -0.36 2.81 2.04 -1.39 -2.26 117.51 120.19 1tlc h ILE 178 Ca 0.13 -0.55 -0.09 0.00 1.00 0.00 0.00 64.86 65.35 1tlc h ILE 178 Cb 0.45 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1tlc h ILE 178 CO 0.02 0.21 -0.15 0.00 0.00 0.00 0.00 178.15 178.23 1tlc h ALA 179 N 1.03 0.50 0.01 1.87 0.00 -1.51 -1.89 119.26 119.26 1tlc h ALA 179 Ca 0.14 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1tlc h ALA 179 Cb 0.15 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1tlc h ALA 179 CO -0.01 0.40 -0.02 1.03 0.00 0.00 0.00 179.25 180.65 1tlc h SER 180 N 0.52 -0.06 -0.30 0.00 0.87 -1.42 0.12 113.55 113.27 1tlc h SER 180 Ca 0.08 0.01 -0.16 0.00 -1.23 0.00 0.00 61.79 60.50 1tlc h SER 180 Cb 0.68 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 1tlc h SER 180 CO 0.05 -0.03 -0.40 1.88 -0.53 0.00 0.00 176.83 177.80 1tlc h TYR 181 N -0.04 1.03 -0.68 2.24 0.05 -1.44 -1.75 116.97 116.37 1tlc h TYR 181 Ca 0.01 -0.31 -0.01 0.00 0.05 0.00 0.00 58.73 58.47 1tlc h TYR 181 Cb 0.05 -0.22 -0.03 0.00 1.01 0.00 0.00 36.73 37.54 1tlc h TYR 181 CO -0.09 1.11 0.38 0.00 -1.05 0.00 0.00 178.16 178.50 1tlc h ALA 182 N 0.85 0.87 -0.13 3.88 0.00 -1.17 -2.66 119.26 120.90 1tlc h ALA 182 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1tlc h ALA 182 Cb 0.97 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1tlc h ALA 182 CO 0.09 0.38 0.08 1.25 0.00 0.00 0.00 179.25 181.05 1tlc h LEU 183 N 0.93 0.15 -0.83 0.00 6.46 -0.41 -2.34 115.31 119.27 1tlc h LEU 183 Ca 0.24 -0.03 0.06 0.00 -0.12 0.00 0.00 57.88 58.04 1tlc h LEU 183 Cb 0.03 -0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 39.86 1tlc h LEU 183 CO -0.04 0.13 0.51 0.25 -0.62 0.00 0.00 178.44 178.67 1tlc h LEU 184 N 0.16 0.79 -0.63 2.25 5.85 -1.03 -1.61 115.31 121.10 1tlc h LEU 184 Ca 0.05 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1tlc h LEU 184 Cb 0.01 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 1tlc h LEU 184 CO -0.01 0.51 0.37 0.58 -0.34 0.00 0.00 178.44 179.55 1tlc h VAL 185 N 0.93 1.19 0.22 1.05 2.07 -1.37 0.56 116.25 120.89 1tlc h VAL 185 Ca 0.37 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1tlc h VAL 185 Cb 0.18 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1tlc h VAL 185 CO -0.18 0.19 -0.11 0.45 0.02 0.00 0.00 177.57 177.95 1tlc h HIS 186 N 0.85 -0.28 -0.09 1.57 3.86 -0.79 0.53 115.15 120.79 1tlc h HIS 186 Ca 0.22 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.41 1tlc h HIS 186 Cb -0.01 0.09 -0.00 0.00 1.06 0.00 0.00 27.41 28.55 1tlc h HIS 186 CO -0.02 -0.13 0.00 0.52 0.86 0.00 0.00 177.93 179.16 1tlc h MET 187 N -0.35 0.16 -0.39 2.45 2.07 -1.11 -2.72 114.93 115.03 1tlc h MET 187 Ca -0.03 -0.05 0.00 0.00 -2.07 0.00 0.00 59.70 57.55 1tlc h MET 187 Cb 0.27 -0.02 -0.02 0.00 -1.87 0.00 0.00 31.60 29.97 1tlc h MET 187 CO 0.05 0.42 0.25 0.52 1.07 0.00 0.00 176.91 179.22 1tlc h MET 188 N -0.11 0.53 -0.80 1.72 2.86 0.18 -2.60 114.93 116.71 1tlc h MET 188 Ca 0.03 -0.04 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 1tlc h MET 188 Cb 0.34 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.84 1tlc h MET 188 CO 0.00 0.38 0.53 0.00 1.06 0.00 0.00 176.91 178.88 1tlc h ALA 189 N 1.12 1.58 -0.12 6.32 0.00 -0.87 -2.71 119.26 124.58 1tlc h ALA 189 Ca 0.14 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1tlc h ALA 189 Cb -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1tlc h ALA 189 CO -0.03 0.32 -0.35 0.37 0.00 0.00 0.00 179.25 179.56 1tlc h GLN 190 N 0.92 0.45 0.00 0.00 4.15 -1.40 0.17 115.11 119.40 1tlc h GLN 190 Ca 0.33 -0.32 -0.02 0.00 0.77 0.00 0.00 58.65 59.41 1tlc h GLN 190 Cb 0.15 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 27.89 1tlc h GLN 190 CO -0.11 0.94 -0.09 1.96 -1.93 0.00 0.00 178.83 179.60 1tlc h GLN 191 N 0.04 0.00 -0.01 1.69 1.08 -1.38 -3.17 115.11 113.36 1tlc h GLN 191 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1tlc h GLN 191 Cb 0.96 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.39 1tlc h GLN 191 CO 0.07 0.09 -0.04 0.00 -0.95 0.00 0.00 178.83 178.01 1tlc n ASP 193 N 0.58 -2.22 -4.53 0.00 8.00 0.00 -4.95 116.55 113.43 1tlc n ASP 193 Ca 0.07 -0.60 -0.25 0.00 0.71 0.00 0.00 54.79 54.72 1tlc n ASP 193 Cb 0.31 -4.96 -0.11 0.00 -0.02 0.00 0.00 41.12 36.34 1tlc n ASP 193 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1tlc s LEU 194 N -6.16 2.53 0.29 0.64 1.43 0.39 -5.03 118.68 112.78 1tlc s LEU 194 Ca 0.02 -1.37 0.02 0.00 -1.03 0.00 0.00 54.13 51.77 1tlc s LEU 194 Cb -0.00 -0.64 -0.03 0.00 0.03 0.00 0.00 46.19 45.54 1tlc s LEU 194 CO 0.70 -0.53 0.46 -1.61 0.23 0.00 0.00 176.35 175.61 1tlc s GLU 195 N -3.80 3.47 0.16 1.70 0.41 0.43 -4.53 118.70 116.54 1tlc s GLU 195 Ca 0.36 -0.50 -0.30 0.00 -0.41 0.00 0.00 54.97 54.12 1tlc s GLU 195 Cb 0.09 -2.76 -0.07 0.00 -1.78 0.00 0.00 34.13 29.61 1tlc s GLU 195 CO 0.17 0.28 1.04 0.14 -0.49 0.00 0.00 175.26 176.39 1tlc s VAL 196 N -2.15 4.11 0.00 2.63 -7.23 -1.26 -0.65 120.40 115.84 1tlc s VAL 196 Ca 0.37 1.81 0.00 0.00 -1.81 0.00 0.00 61.98 62.36 1tlc s VAL 196 Cb -0.09 -4.16 0.00 0.00 0.56 0.00 0.00 36.38 32.69 1tlc s VAL 196 CO 0.33 0.31 0.00 0.61 -0.31 0.00 0.00 175.10 176.04 1tlc n GLY 197 N 2.07 0.72 3.58 2.32 0.00 0.14 -4.59 105.19 109.43 1tlc n GLY 197 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1tlc n GLY 197 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tlc s ASP 198 N -0.48 4.30 -0.30 1.61 1.01 -1.26 -0.83 116.67 120.73 1tlc s ASP 198 Ca 0.00 -0.55 -0.06 0.00 0.71 0.00 0.00 52.55 52.65 1tlc s ASP 198 Cb 0.00 -0.75 0.02 0.00 1.01 0.00 0.00 42.92 43.20 1tlc s ASP 198 CO 0.00 0.11 0.06 0.12 0.21 0.00 0.00 175.17 175.67 1tlc s PHE 199 N -1.68 3.16 -0.28 4.23 5.36 0.26 -1.56 117.98 127.47 1tlc s PHE 199 Ca 0.25 -1.18 -0.10 0.00 -0.96 0.00 0.00 56.93 54.93 1tlc s PHE 199 Cb -0.09 -2.22 -0.05 0.00 -0.34 0.00 0.00 43.02 40.32 1tlc s PHE 199 CO 0.15 -0.64 0.17 0.08 -1.46 0.00 0.00 175.22 173.53 1tlc s VAL 200 N 1.45 5.15 -0.25 3.12 1.01 0.28 -0.71 120.40 130.44 1tlc s VAL 200 Ca 0.01 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.04 1tlc s VAL 200 Cb -0.18 -3.45 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 1tlc s VAL 200 CO 0.01 0.26 0.02 0.86 0.00 0.00 0.00 175.10 176.25 1tlc s TRP 201 N 1.74 3.05 -0.13 5.22 -0.00 0.04 -0.49 118.94 128.37 1tlc s TRP 201 Ca 0.07 -0.84 0.02 0.00 -0.00 0.00 0.00 56.10 55.35 1tlc s TRP 201 Cb -0.16 -2.18 -0.00 0.00 -0.00 0.00 0.00 33.47 31.13 1tlc s TRP 201 CO 0.10 -0.51 -0.19 0.99 -0.00 0.00 0.00 176.95 177.33 1tlc s THR 202 N 1.51 2.39 0.11 5.86 2.01 -0.24 0.42 115.64 127.71 1tlc s THR 202 Ca 0.05 -0.88 0.08 0.00 0.31 0.00 0.00 61.69 61.25 1tlc s THR 202 Cb -0.15 -1.97 -0.04 0.00 0.01 0.00 0.00 72.50 70.35 1tlc s THR 202 CO 0.00 0.54 -0.13 -0.83 -0.69 0.00 0.00 174.62 173.51 1tlc s GLY 203 N 0.61 1.76 0.00 4.40 0.00 0.67 -0.51 107.32 114.24 1tlc s GLY 203 Ca -0.10 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 43.32 1tlc s GLY 203 CO 0.03 -1.27 0.00 0.61 0.00 0.00 0.00 173.10 172.47 1tlc n GLY 204 N 0.72 1.15 3.57 0.20 0.00 0.94 -2.89 105.19 108.88 1tlc n GLY 204 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1tlc n GLY 204 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tlc s ASP 205 N -1.00 5.93 -0.30 1.61 -1.08 -0.30 -2.77 116.67 118.76 1tlc s ASP 205 Ca 0.00 0.40 -0.09 0.00 -0.52 0.00 0.00 52.55 52.34 1tlc s ASP 205 Cb 0.00 -2.54 -0.01 0.00 -1.46 0.00 0.00 42.92 38.91 1tlc s ASP 205 CO 0.00 -1.85 0.14 -0.89 0.52 0.00 0.00 175.17 173.09 1tlc s THR 206 N 6.76 4.53 0.14 1.71 2.01 -0.60 -1.32 115.64 128.86 1tlc s THR 206 Ca 0.58 -0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.17 1tlc s THR 206 Cb -0.13 -3.29 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 1tlc s THR 206 CO 0.25 0.09 0.02 -1.38 -0.69 0.00 0.00 174.62 172.91 1tlc s HIS 207 N 1.60 0.97 -0.10 4.92 -3.43 0.57 -2.02 115.29 117.81 1tlc s HIS 207 Ca 0.05 -1.12 0.04 0.00 -0.80 0.00 0.00 55.06 53.23 1tlc s HIS 207 Cb -0.17 -0.56 0.00 0.00 -1.43 0.00 0.00 32.58 30.42 1tlc s HIS 207 CO 0.06 -0.36 -0.24 -1.17 -2.00 0.00 0.00 174.74 171.03 1tlc s LEU 208 N -3.09 2.07 0.43 5.38 2.96 0.82 -0.14 118.68 127.12 1tlc s LEU 208 Ca 0.22 -0.55 -0.24 0.00 -0.22 0.00 0.00 54.13 53.34 1tlc s LEU 208 Cb 0.07 -1.39 -0.08 0.00 0.50 0.00 0.00 46.19 45.29 1tlc s LEU 208 CO 0.01 0.16 1.18 -0.31 -1.32 0.00 0.00 176.35 176.07 1tlc s TYR 209 N 0.35 2.94 -1.13 5.38 2.02 -1.26 -0.18 117.35 125.47 1tlc s TYR 209 Ca -0.19 1.53 0.05 0.00 -0.37 0.00 0.00 57.07 58.09 1tlc s TYR 209 Cb -0.18 -3.41 0.22 0.00 -0.40 0.00 0.00 41.96 38.20 1tlc s TYR 209 CO 0.09 -1.48 1.11 -1.13 -1.57 0.00 0.00 175.55 172.56 1tlc n SER 210 N -0.23 0.00 -1.31 2.29 3.41 -0.59 -1.78 113.62 115.42 1tlc n SER 210 Ca 0.06 0.41 0.05 0.00 -0.26 0.00 0.00 58.87 59.13 1tlc n SER 210 Cb 0.47 -0.44 0.29 0.00 -0.26 0.00 0.00 64.21 64.28 1tlc n SER 210 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1tlc n ASN 211 N -1.44 4.33 -0.02 4.04 6.94 -1.26 -4.29 115.26 123.56 1tlc n ASN 211 Ca 0.02 -3.10 0.01 0.00 -0.02 0.00 0.00 54.58 51.48 1tlc n ASN 211 Cb 0.05 -0.62 0.01 0.00 -2.36 0.00 0.00 39.78 36.87 1tlc n ASN 211 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1tlc n HIS 212 N -0.27 0.00 0.17 -2.53 8.25 -0.73 -4.76 115.22 115.35 1tlc n HIS 212 Ca 0.27 -0.40 -0.14 0.00 -0.26 0.00 0.00 57.72 57.19 1tlc n HIS 212 Cb 1.05 -0.04 -0.08 0.00 1.12 0.00 0.00 29.99 32.04 1tlc n HIS 212 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1tlc h MET 213 N 0.00 -0.40 -0.48 -0.41 2.86 -1.75 0.59 114.93 115.34 1tlc h MET 213 Ca 0.00 0.03 0.05 0.00 -2.06 0.00 0.00 59.70 57.72 1tlc h MET 213 Cb 0.68 0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.39 1tlc h MET 213 CO 0.00 -0.12 0.22 -0.44 1.06 0.00 0.00 176.91 177.62 1tlc h ASP 214 N -0.66 0.29 -0.39 1.22 3.32 -1.92 0.68 116.42 118.97 1tlc h ASP 214 Ca -0.04 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 1tlc h ASP 214 Cb 0.47 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 1tlc h ASP 214 CO 0.07 0.21 0.10 1.56 -1.72 0.00 0.00 179.24 179.46 1tlc h GLN 215 N 0.43 0.62 -0.34 3.56 7.50 -1.92 -1.48 115.11 123.49 1tlc h GLN 215 Ca 0.22 -0.15 -0.01 0.00 0.50 0.00 0.00 58.65 59.21 1tlc h GLN 215 Cb 0.16 -0.08 -0.02 0.00 0.05 0.00 0.00 27.48 27.59 1tlc h GLN 215 CO -0.18 0.65 0.18 1.15 -1.50 0.00 0.00 178.83 179.13 1tlc h THR 216 N 0.49 1.14 -0.72 -0.54 2.02 -0.41 -2.26 112.91 112.63 1tlc h THR 216 Ca 0.12 -0.38 0.06 0.00 0.77 0.00 0.00 66.41 66.98 1tlc h THR 216 Cb 0.30 0.78 -0.06 0.00 -1.74 0.00 0.00 68.15 67.43 1tlc h THR 216 CO 0.00 0.15 0.41 0.45 0.37 0.00 0.00 175.52 176.89 1tlc h HIS 217 N 0.42 0.75 -0.61 3.16 3.86 -0.66 0.08 115.15 122.14 1tlc h HIS 217 Ca 0.12 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.37 1tlc h HIS 217 Cb 0.08 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.28 1tlc h HIS 217 CO -0.03 0.35 0.39 1.25 0.86 0.00 0.00 177.93 180.76 1tlc h LEU 218 N 0.74 0.66 -0.04 2.43 5.85 -1.09 -3.12 115.31 120.75 1tlc h LEU 218 Ca 0.32 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.97 1tlc h LEU 218 Cb 0.21 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.09 1tlc h LEU 218 CO -0.19 0.47 -0.22 -0.61 -0.34 0.00 0.00 178.44 177.55 1tlc h GLN 219 N 0.78 0.21 0.00 1.25 4.15 -0.98 -3.21 115.11 117.31 1tlc h GLN 219 Ca 0.23 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1tlc h GLN 219 Cb -0.04 0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1tlc h GLN 219 CO -0.07 0.85 0.15 -0.07 -1.93 0.00 0.00 178.83 177.75 1tlc h LEU 220 N -0.36 0.00 -2.40 -2.39 4.07 -0.93 -2.32 115.31 110.98 1tlc h LEU 220 Ca -0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.94 1tlc h LEU 220 Cb 0.89 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.63 1tlc h LEU 220 CO 0.05 0.00 0.00 -1.54 -1.08 0.00 0.00 178.44 175.87 1tlc n SER 221 N -2.81 3.50 -4.89 -0.43 3.41 -1.19 -4.94 113.62 106.26 1tlc n SER 221 Ca -0.02 -1.99 -0.27 0.00 -0.26 0.00 0.00 58.87 56.33 1tlc n SER 221 Cb 0.20 -0.42 -0.04 0.00 -0.26 0.00 0.00 64.21 63.69 1tlc n SER 221 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1tlc s ARG 222 N -1.16 3.26 -0.23 4.33 0.52 -0.87 -5.08 118.95 119.71 1tlc s ARG 222 Ca 0.44 -0.67 -0.17 0.00 -0.52 0.00 0.00 55.73 54.81 1tlc s ARG 222 Cb 0.23 -2.87 -0.03 0.00 0.52 0.00 0.00 34.95 32.80 1tlc s ARG 222 CO 0.30 0.52 0.44 -1.21 0.02 0.00 0.00 175.30 175.38 1tlc s GLU 223 N -3.10 4.11 0.49 3.54 0.41 -1.26 -5.02 118.70 117.86 1tlc s GLU 223 Ca 0.33 0.23 -0.22 0.00 -0.41 0.00 0.00 54.97 54.90 1tlc s GLU 223 Cb -0.11 -3.60 -0.07 0.00 -1.78 0.00 0.00 34.13 28.57 1tlc s GLU 223 CO 0.27 -0.20 1.22 -1.25 -0.49 0.00 0.00 175.26 174.81 1tlc s PRO 224 N 1.83 3.57 0.34 0.39 0.04 -1.26 -4.83 135.00 135.08 1tlc s PRO 224 Ca 0.19 1.91 0.09 0.00 0.04 0.00 0.00 61.00 63.23 1tlc s PRO 224 Cb -0.15 -2.36 -0.05 0.00 0.04 0.00 0.00 34.50 31.98 1tlc s PRO 224 CO 0.09 -0.75 0.07 1.03 0.04 0.00 0.00 177.00 177.49 1tlc s ARG 225 N -2.77 2.21 0.28 4.56 0.52 -1.26 -5.07 118.95 117.43 1tlc s ARG 225 Ca 0.66 -1.66 -0.28 0.00 -0.52 0.00 0.00 55.73 53.93 1tlc s ARG 225 Cb -0.32 -2.04 -0.14 0.00 0.52 0.00 0.00 34.95 32.97 1tlc s ARG 225 CO 0.38 0.12 0.99 -2.30 0.02 0.00 0.00 175.30 174.52 1tlc n PRO 226 N -1.05 1.30 -2.33 3.54 -0.02 -1.26 -4.87 135.00 130.31 1tlc n PRO 226 Ca -0.04 0.46 -0.35 0.00 -2.02 0.00 0.00 63.50 61.55 1tlc n PRO 226 Cb 0.62 -1.82 -0.01 0.00 -0.02 0.00 0.00 33.50 32.27 1tlc n PRO 226 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1tlc s LEU 227 N 0.54 3.81 0.00 2.45 2.01 -1.26 -4.81 118.68 121.42 1tlc s LEU 227 Ca 0.59 2.13 -0.11 0.00 0.01 0.00 0.00 54.13 56.75 1tlc s LEU 227 Cb -0.71 -4.53 0.16 0.00 0.01 0.00 0.00 46.19 41.11 1tlc s LEU 227 CO 0.60 -1.07 0.62 -0.81 1.01 0.00 0.00 176.35 176.69 1tlc n PRO 228 N -1.11 -1.93 -4.06 1.29 -0.04 -1.26 -4.74 135.00 123.15 1tlc n PRO 228 Ca 0.10 -0.98 -0.17 0.00 -0.04 0.00 0.00 63.50 62.41 1tlc n PRO 228 Cb 0.51 -0.87 -0.16 0.00 -0.04 0.00 0.00 33.50 32.95 1tlc n PRO 228 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1tlc s LYS 229 N -4.39 0.46 0.08 0.54 -0.14 -0.60 -1.54 119.74 114.14 1tlc s LYS 229 Ca 0.39 -0.05 -0.14 0.00 -1.36 0.00 0.00 55.97 54.81 1tlc s LYS 229 Cb -0.03 -0.52 -0.06 0.00 -1.68 0.00 0.00 37.83 35.53 1tlc s LYS 229 CO 0.29 -0.04 0.47 -1.17 -0.76 0.00 0.00 175.35 174.15 1tlc s LEU 230 N 0.59 4.40 -0.08 3.17 1.98 -1.26 -1.10 118.68 126.38 1tlc s LEU 230 Ca -0.06 0.99 0.00 0.00 -2.89 0.00 0.00 54.13 52.17 1tlc s LEU 230 Cb -0.10 -2.96 0.02 0.00 0.66 0.00 0.00 46.19 43.81 1tlc s LEU 230 CO -0.01 0.20 -0.07 -0.63 -1.89 0.00 0.00 176.35 173.95 1tlc s ILE 231 N -1.30 0.89 -0.44 6.68 1.09 -0.74 -5.00 121.20 122.38 1tlc s ILE 231 Ca 0.32 -0.26 -0.10 0.00 -1.10 0.00 0.00 60.65 59.51 1tlc s ILE 231 Cb -0.16 -0.90 0.09 0.00 -1.06 0.00 0.00 42.46 40.44 1tlc s ILE 231 CO 0.17 0.33 0.31 -0.63 -0.10 0.00 0.00 174.94 175.02 1tlc s ILE 232 N 1.32 4.30 0.48 2.92 1.01 -1.26 -1.64 121.20 128.33 1tlc s ILE 232 Ca -0.03 -1.53 0.15 0.00 0.00 0.00 0.00 60.65 59.24 1tlc s ILE 232 Cb -0.14 -3.71 0.23 0.00 0.01 0.00 0.00 42.46 38.86 1tlc s ILE 232 CO -0.03 -0.62 2.08 0.11 0.00 0.00 0.00 174.94 176.47 1tlc h LYS 233 N 8.46 0.04 -3.63 2.79 1.57 -0.13 -3.44 116.57 122.23 1tlc h LYS 233 Ca -0.23 -0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.38 1tlc h LYS 233 Cb 1.08 -0.01 -0.22 0.00 0.08 0.00 0.00 32.23 33.16 1tlc h LYS 233 CO 0.81 0.10 -0.57 -0.98 -0.57 0.00 0.00 179.45 178.25 1tlc s ARG 234 N -4.93 0.36 -0.63 3.15 1.70 -1.26 -5.09 118.95 112.25 1tlc s ARG 234 Ca -0.05 -0.34 -0.13 0.00 -0.47 0.00 0.00 55.73 54.74 1tlc s ARG 234 Cb 0.16 0.15 0.16 0.00 -0.57 0.00 0.00 34.95 34.85 1tlc s ARG 234 CO 0.69 -0.08 0.55 0.21 -1.08 0.00 0.00 175.30 175.59 1tlc s LYS 235 N -1.10 3.06 1.04 3.89 2.20 -1.26 -5.03 119.74 122.54 1tlc s LYS 235 Ca -0.12 -2.04 -0.12 0.00 -0.36 0.00 0.00 55.97 53.33 1tlc s LYS 235 Cb -0.07 -4.22 0.21 0.00 -1.51 0.00 0.00 37.83 32.24 1tlc s LYS 235 CO 0.01 -1.28 1.07 -2.14 -0.36 0.00 0.00 175.35 172.65 1tlc s PRO 236 N 0.93 0.08 0.32 4.03 0.02 -1.26 -4.92 135.00 134.20 1tlc s PRO 236 Ca 0.10 1.00 0.26 0.00 0.02 0.00 0.00 61.00 62.37 1tlc s PRO 236 Cb -0.22 -1.66 0.82 0.00 0.02 0.00 0.00 34.50 33.46 1tlc s PRO 236 CO -0.02 -3.10 1.75 0.93 -0.33 0.00 0.00 177.00 176.23 1tlc h GLU 237 N -2.18 0.00 -3.00 5.54 4.39 -1.97 -3.46 114.58 113.90 1tlc h GLU 237 Ca -0.54 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.11 1tlc h GLU 237 Cb 1.31 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.81 1tlc h GLU 237 CO 0.49 0.00 0.03 -1.54 -1.16 0.00 0.00 179.01 176.83 1tlc s SER 238 N -4.99 -0.40 0.58 1.42 1.04 -1.26 -5.04 113.70 105.05 1tlc s SER 238 Ca 0.07 -0.01 0.39 0.00 0.48 0.00 0.00 55.95 56.88 1tlc s SER 238 Cb 0.10 0.50 2.11 0.00 0.10 0.00 0.00 66.02 68.82 1tlc s SER 238 CO 0.56 -0.80 2.19 -0.29 0.98 0.00 0.00 173.24 175.88 1tlc h ILE 239 N 2.53 0.00 0.00 -1.02 6.09 -1.92 -0.57 117.51 122.62 1tlc h ILE 239 Ca -0.32 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.17 1tlc h ILE 239 Cb 1.24 0.86 0.00 0.00 0.47 0.00 0.00 36.82 39.39 1tlc h ILE 239 CO 0.42 0.00 -0.69 0.49 -3.07 0.00 0.00 178.15 175.31 1tlc n PHE 240 N -2.86 0.05 0.73 2.19 3.72 -1.26 -4.22 117.46 115.80 1tlc n PHE 240 Ca -0.03 0.01 0.11 0.00 -0.05 0.00 0.00 57.45 57.50 1tlc n PHE 240 Cb 0.06 -0.23 0.28 0.00 -0.94 0.00 0.00 39.48 38.66 1tlc n PHE 240 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1tlc n ASP 241 N -1.58 2.61 -4.75 4.37 8.00 -0.22 -4.97 116.55 120.00 1tlc n ASP 241 Ca 0.05 -1.88 -0.31 0.00 0.71 0.00 0.00 54.79 53.36 1tlc n ASP 241 Cb 0.35 -0.19 0.11 0.00 -0.02 0.00 0.00 41.12 41.36 1tlc n ASP 241 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1tlc s TYR 242 N -1.61 2.49 0.16 1.24 1.51 -1.26 -4.91 117.35 114.97 1tlc s TYR 242 Ca 0.35 1.48 -0.12 0.00 -1.01 0.00 0.00 57.07 57.77 1tlc s TYR 242 Cb 0.20 -3.08 0.01 0.00 -0.11 0.00 0.00 41.96 38.97 1tlc s TYR 242 CO 0.28 -1.98 0.34 -0.98 -1.11 0.00 0.00 175.55 172.10 1tlc s ARG 243 N -4.91 1.15 0.13 -0.62 1.70 -1.26 -5.07 118.95 110.07 1tlc s ARG 243 Ca 0.62 -1.02 -0.22 0.00 -0.47 0.00 0.00 55.73 54.64 1tlc s ARG 243 Cb -0.17 0.41 -0.03 0.00 -0.57 0.00 0.00 34.95 34.59 1tlc s ARG 243 CO 0.56 -0.44 1.67 0.35 -1.08 0.00 0.00 175.30 176.37 1tlc h PHE 244 N 2.47 -0.33 -0.10 5.89 3.57 -1.96 -2.70 116.94 123.78 1tlc h PHE 244 Ca -0.32 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.23 1tlc h PHE 244 Cb 1.23 0.17 -0.00 0.00 2.79 0.00 0.00 35.95 40.14 1tlc h PHE 244 CO 0.38 -0.20 0.61 0.93 -2.23 0.00 0.00 178.31 177.80 1tlc h GLU 245 N -0.16 0.00 0.00 1.11 3.07 -2.03 -2.19 114.58 114.38 1tlc h GLU 245 Ca 0.09 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.91 1tlc h GLU 245 Cb 0.29 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.20 1tlc h GLU 245 CO -0.22 0.00 -0.17 -0.44 -1.40 0.00 0.00 179.01 176.78 1tlc h ASP 246 N 0.00 0.00 -3.72 1.42 3.32 -1.87 -3.45 116.42 112.12 1tlc h ASP 246 Ca 0.05 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.42 1tlc h ASP 246 Cb 1.26 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.62 1tlc h ASP 246 CO -0.00 0.17 -0.74 -0.36 -1.72 0.00 0.00 179.24 176.58 1tlc s PHE 247 N -3.64 2.75 -0.00 4.55 0.08 -0.82 0.64 117.98 121.53 1tlc s PHE 247 Ca 0.01 -0.14 -0.08 0.00 0.12 0.00 0.00 56.93 56.84 1tlc s PHE 247 Cb 0.10 -1.52 0.00 0.00 -0.57 0.00 0.00 43.02 41.03 1tlc s PHE 247 CO 0.62 0.34 0.15 -2.00 -0.10 0.00 0.00 175.22 174.23 1tlc s GLU 248 N -1.59 0.49 -0.21 0.44 2.56 -0.65 -4.97 118.70 114.77 1tlc s GLU 248 Ca 0.17 -0.37 0.01 0.00 0.00 0.00 0.00 54.97 54.79 1tlc s GLU 248 Cb -0.11 0.21 0.03 0.00 2.00 0.00 0.00 34.13 36.26 1tlc s GLU 248 CO 0.08 -0.12 -0.15 -1.50 -0.56 0.00 0.00 175.26 173.01 1tlc s ILE 249 N -1.34 2.22 -0.20 -3.70 1.10 -1.26 -1.79 121.20 116.23 1tlc s ILE 249 Ca -0.14 -1.14 -0.09 0.00 -0.51 0.00 0.00 60.65 58.77 1tlc s ILE 249 Cb -0.07 -2.07 -0.05 0.00 0.15 0.00 0.00 42.46 40.43 1tlc s ILE 249 CO 0.02 0.34 0.10 -1.61 -2.11 0.00 0.00 174.94 171.68 1tlc s GLU 250 N 1.24 4.08 0.00 3.50 2.02 -0.26 -4.53 118.70 124.76 1tlc s GLU 250 Ca 0.00 -0.28 0.00 0.00 0.02 0.00 0.00 54.97 54.72 1tlc s GLU 250 Cb -0.15 -3.34 0.00 0.00 0.10 0.00 0.00 34.13 30.74 1tlc s GLU 250 CO -0.09 0.26 0.00 0.41 0.02 0.00 0.00 175.26 175.86 1tlc n GLY 251 N 3.60 0.43 3.54 -1.39 0.00 -1.26 -1.56 105.19 108.55 1tlc n GLY 251 Ca -0.16 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.45 1tlc n GLY 251 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1tlc s TYR 252 N -2.00 2.99 -0.46 1.61 5.04 -1.26 -4.33 117.35 118.93 1tlc s TYR 252 Ca 0.00 0.18 0.03 0.00 -2.44 0.00 0.00 57.07 54.84 1tlc s TYR 252 Cb 0.00 -3.69 0.15 0.00 0.35 0.00 0.00 41.96 38.78 1tlc s TYR 252 CO 0.00 -1.00 0.32 0.34 -1.34 0.00 0.00 175.55 173.87 1tlc s ASP 253 N 2.15 2.95 0.69 4.32 2.15 -1.26 -5.10 116.67 122.57 1tlc s ASP 253 Ca 0.30 -2.94 -0.06 0.00 0.43 0.00 0.00 52.55 50.28 1tlc s ASP 253 Cb -0.12 -0.83 0.06 0.00 -0.30 0.00 0.00 42.92 41.73 1tlc s ASP 253 CO 0.23 -0.20 0.99 -2.16 -0.17 0.00 0.00 175.17 173.86 1tlc s PRO 254 N 0.03 2.23 0.51 4.34 0.04 -1.26 -4.92 135.00 135.96 1tlc s PRO 254 Ca 0.25 -0.30 -0.19 0.00 0.04 0.00 0.00 61.00 60.80 1tlc s PRO 254 Cb -0.10 -2.20 -0.08 0.00 0.04 0.00 0.00 34.50 32.16 1tlc s PRO 254 CO -0.10 -1.19 1.02 -1.01 0.04 0.00 0.00 177.00 175.76 1tlc s HIS 255 N -3.20 3.13 0.73 0.56 3.76 -0.50 -4.84 115.29 114.93 1tlc s HIS 255 Ca 0.60 1.55 -0.16 0.00 -0.15 0.00 0.00 55.06 56.90 1tlc s HIS 255 Cb -0.11 -2.97 -0.00 0.00 1.11 0.00 0.00 32.58 30.61 1tlc s HIS 255 CO 0.44 -0.69 0.83 -2.30 -0.85 0.00 0.00 174.74 172.17 1tlc n PRO 256 N -1.26 0.39 -0.95 8.40 -0.02 -1.26 -0.76 135.00 139.53 1tlc n PRO 256 Ca 0.08 0.19 -0.33 0.00 -2.02 0.00 0.00 63.50 61.42 1tlc n PRO 256 Cb 0.53 -2.10 0.14 0.00 -0.02 0.00 0.00 33.50 32.04 1tlc n PRO 256 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tlc n GLY 257 N 1.24 -0.44 3.00 -1.23 0.00 -1.26 -3.72 105.19 102.77 1tlc n GLY 257 Ca 0.12 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1tlc n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tlc s ILE 258 N -2.29 1.45 0.12 -0.61 1.01 -1.26 -4.83 121.20 114.79 1tlc s ILE 258 Ca 0.69 -0.56 -0.22 0.00 0.00 0.00 0.00 60.65 60.56 1tlc s ILE 258 Cb -0.27 -1.37 -0.07 0.00 0.01 0.00 0.00 42.46 40.75 1tlc s ILE 258 CO 0.55 0.44 0.67 -0.54 0.00 0.00 0.00 174.94 176.06 1tlc s LYS 259 N 1.52 4.38 -0.16 2.79 3.01 -1.26 -5.07 119.74 124.95 1tlc s LYS 259 Ca 0.04 0.94 -0.20 0.00 -1.01 0.00 0.00 55.97 55.75 1tlc s LYS 259 Cb -0.13 -3.23 0.05 0.00 -1.01 0.00 0.00 37.83 33.51 1tlc s LYS 259 CO -0.10 0.60 0.53 0.00 0.51 0.00 0.00 175.35 176.89 1tlc s ALA 260 N -1.15 -1.32 0.32 5.17 0.00 -1.26 -4.96 121.76 118.56 1tlc s ALA 260 Ca 0.33 1.33 -0.29 0.00 0.00 0.00 0.00 51.96 53.33 1tlc s ALA 260 Cb -0.21 -0.63 -0.10 0.00 0.00 0.00 0.00 23.12 22.18 1tlc s ALA 260 CO 0.23 -0.27 1.31 -1.25 0.00 0.00 0.00 175.76 175.77 1tlc s PRO 261 N -0.14 4.36 0.14 0.00 0.04 -1.26 -5.02 135.00 133.13 1tlc s PRO 261 Ca -0.03 2.20 -0.22 0.00 0.04 0.00 0.00 61.00 62.99 1tlc s PRO 261 Cb -0.03 -3.08 -0.08 0.00 0.04 0.00 0.00 34.50 31.35 1tlc s PRO 261 CO 0.03 -0.19 0.69 0.08 0.04 0.00 0.00 177.00 177.64 1tlc s VAL 262 N -1.00 4.55 -0.37 -0.36 1.01 -1.26 -5.01 120.40 117.96 1tlc s VAL 262 Ca 0.50 1.43 -0.18 0.00 0.00 0.00 0.00 61.98 63.74 1tlc s VAL 262 Cb -0.39 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 31.99 1tlc s VAL 262 CO 0.51 0.47 0.48 0.00 0.00 0.00 0.00 175.10 176.56 1tlc s ALA 263 N -1.21 3.46 0.00 5.51 0.00 -1.26 -5.25 121.76 123.01 1tlc s ALA 263 Ca 0.35 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 51.13 1tlc s ALA 263 Cb -0.20 -3.01 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1tlc s ALA 263 CO 0.23 -1.32 0.50 0.44 0.00 0.00 0.00 175.76 175.60