#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2byt n GLU 2 N 0.00 -3.46 -4.04 2.12 0.28 -1.26 -5.08 120.64 109.20 2byt n GLU 2 Ca 0.00 -0.77 -0.08 0.00 -0.16 0.00 0.00 57.16 56.14 2byt n GLU 2 Cb 0.00 -0.99 -0.09 0.00 1.43 0.00 0.00 31.44 31.79 2byt n GLU 2 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 2byt s LYS 3 N -4.10 0.83 -0.23 3.44 2.20 -1.26 -5.02 119.74 115.61 2byt s LYS 3 Ca 0.35 -1.23 -0.29 0.00 -0.36 0.00 0.00 55.97 54.45 2byt s LYS 3 Cb -0.06 0.27 -0.04 0.00 -1.51 0.00 0.00 37.83 36.49 2byt s LYS 3 CO 0.29 -0.23 1.90 -0.47 -0.36 0.00 0.00 175.35 176.48 2byt s TYR 4 N -3.95 1.63 -0.30 4.03 5.04 -1.26 -4.96 117.35 117.57 2byt s TYR 4 Ca 0.13 0.46 0.03 0.00 -2.44 0.00 0.00 57.07 55.25 2byt s TYR 4 Cb 0.07 -4.05 0.09 0.00 0.35 0.00 0.00 41.96 38.42 2byt s TYR 4 CO -0.05 -3.58 0.00 1.21 -1.34 0.00 0.00 175.55 171.79 2byt s ASN 5 N 6.14 4.50 0.04 4.32 3.84 -1.26 -5.03 114.94 127.48 2byt s ASN 5 Ca 0.85 -1.80 -0.18 0.00 0.21 0.00 0.00 52.86 51.95 2byt s ASN 5 Cb -0.28 -1.47 -0.09 0.00 -0.55 0.00 0.00 41.25 38.85 2byt s ASN 5 CO 0.34 -0.32 1.27 -0.65 -2.79 0.00 0.00 177.10 174.95 2byt h PRO 6 N 7.74 -0.53 -0.21 0.43 0.11 -1.93 -2.81 132.00 134.80 2byt h PRO 6 Ca -0.10 0.04 0.06 0.00 0.11 0.00 0.00 66.00 66.10 2byt h PRO 6 Cb 1.03 0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2byt h PRO 6 CO 0.49 -0.35 0.73 0.45 -0.21 0.00 0.00 178.00 179.10 2byt h HIS 7 N -0.55 0.00 -0.11 0.65 3.86 -1.93 0.27 115.15 117.34 2byt h HIS 7 Ca -0.04 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 58.98 2byt h HIS 7 Cb 0.45 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.93 2byt h HIS 7 CO -0.05 0.00 -0.66 0.00 0.86 0.00 0.00 177.93 178.08 2byt h ALA 8 N 0.74 0.23 0.00 2.45 0.00 -1.94 -3.41 119.26 117.33 2byt h ALA 8 Ca 0.10 -0.56 -0.17 0.00 0.00 0.00 0.00 54.91 54.27 2byt h ALA 8 Cb 1.56 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.31 2byt h ALA 8 CO -0.00 0.52 -1.66 0.44 0.00 0.00 0.00 179.25 178.55 2byt n ILE 9 N -4.09 0.66 0.00 0.00 -5.35 0.82 -4.73 119.36 106.68 2byt n ILE 9 Ca -0.08 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 2byt n ILE 9 Cb 0.69 -0.82 0.00 0.00 -1.74 0.00 0.00 39.64 37.76 2byt n ILE 9 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2byt n GLU 10 N -2.55 0.00 0.16 6.28 1.02 -0.38 -1.92 120.64 123.25 2byt n GLU 10 Ca -0.18 0.31 0.13 0.00 -0.02 0.00 0.00 57.16 57.40 2byt n GLU 10 Cb 0.77 -1.04 0.37 0.00 -0.02 0.00 0.00 31.44 31.52 2byt n GLU 10 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2byt h ALA 11 N -1.95 2.13 0.47 0.62 0.00 -1.83 0.91 119.26 119.60 2byt h ALA 11 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2byt h ALA 11 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2byt h ALA 11 CO 0.00 -1.02 -0.23 -0.22 0.00 0.00 0.00 179.25 177.78 2byt h LYS 12 N 0.00 -0.61 -0.85 0.00 3.64 -1.67 -3.14 116.57 113.94 2byt h LYS 12 Ca 0.15 0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 2byt h LYS 12 Cb 1.86 0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 33.78 2byt h LYS 12 CO -0.00 -0.32 0.47 -1.49 -2.27 0.00 0.00 179.45 175.84 2byt h TRP 13 N -1.04 1.16 -0.51 1.91 -0.00 -0.27 -2.51 115.95 114.69 2byt h TRP 13 Ca -0.07 -0.03 0.10 0.00 -0.00 0.00 0.00 58.89 58.90 2byt h TRP 13 Cb 0.58 -0.37 -0.09 0.00 -0.00 0.00 0.00 29.16 29.28 2byt h TRP 13 CO 0.01 0.80 -0.04 1.96 -0.00 0.00 0.00 178.44 181.18 2byt h GLN 14 N 1.18 0.07 -0.17 0.49 4.20 -1.52 0.43 115.11 119.79 2byt h GLN 14 Ca 0.30 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.97 2byt h GLN 14 Cb 0.02 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 2byt h GLN 14 CO -0.05 0.05 -0.05 0.00 -0.67 0.00 0.00 178.83 178.11 2byt h ARG 15 N 0.08 0.25 -0.38 1.46 3.08 -1.42 -2.02 114.38 115.42 2byt h ARG 15 Ca 0.25 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.19 2byt h ARG 15 Cb 0.39 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 2byt h ARG 15 CO -0.46 0.32 -0.03 0.35 -1.07 0.00 0.00 179.97 179.09 2byt h PHE 16 N 0.25 0.75 -0.44 3.04 3.57 0.15 -1.10 116.94 123.15 2byt h PHE 16 Ca 0.06 -0.14 -0.14 0.00 3.53 0.00 0.00 57.97 61.28 2byt h PHE 16 Cb 0.25 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 2byt h PHE 16 CO 0.00 0.79 -0.28 -1.49 -2.23 0.00 0.00 178.31 175.11 2byt h TRP 17 N 0.50 1.12 -0.72 0.41 6.55 -0.58 -2.33 115.95 120.90 2byt h TRP 17 Ca 0.10 -0.30 -0.04 0.00 0.95 0.00 0.00 58.89 59.61 2byt h TRP 17 Cb 0.51 -0.25 -0.03 0.00 -0.86 0.00 0.00 29.16 28.52 2byt h TRP 17 CO 0.04 1.12 0.29 1.49 -1.05 0.00 0.00 178.44 180.34 2byt h GLU 18 N 0.80 1.07 0.55 0.49 4.57 -1.29 -1.31 114.58 119.45 2byt h GLU 18 Ca 0.09 -0.19 -0.03 0.00 -1.18 0.00 0.00 59.36 58.05 2byt h GLU 18 Cb 0.86 -0.18 0.01 0.00 -0.16 0.00 0.00 28.75 29.28 2byt h GLU 18 CO 0.08 0.87 -0.26 0.93 -1.18 0.00 0.00 179.01 179.45 2byt h GLU 19 N 1.02 -0.71 0.00 1.92 5.08 -1.11 -3.07 114.58 117.71 2byt h GLU 19 Ca 0.24 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2byt h GLU 19 Cb 0.20 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2byt h GLU 19 CO -0.02 -0.40 0.00 1.63 -1.00 0.00 0.00 179.01 179.21 2byt n LYS 20 N -5.32 0.15 -3.39 2.33 4.76 -0.89 -4.93 118.16 110.87 2byt n LYS 20 Ca -0.11 0.51 -0.12 0.00 -2.87 0.00 0.00 58.31 55.72 2byt n LYS 20 Cb 0.33 -1.87 0.00 0.00 -1.84 0.00 0.00 35.03 31.65 2byt n LYS 20 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2byt n GLY 21 N -0.66 -1.24 0.09 0.72 0.00 -0.50 -4.93 105.19 98.67 2byt n GLY 21 Ca 0.00 0.57 -0.12 0.00 0.00 0.00 0.00 46.02 46.48 2byt n GLY 21 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2byt h PHE 22 N 0.21 0.19 -0.35 1.61 0.04 -1.88 -3.30 116.94 113.46 2byt h PHE 22 Ca -0.30 -0.14 0.00 0.00 2.80 0.00 0.00 57.97 60.33 2byt h PHE 22 Cb 1.19 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.33 2byt h PHE 22 CO 0.21 1.17 0.00 -1.33 -0.60 0.00 0.00 178.31 177.75 2byt n MET 23 N -3.31 2.72 -1.82 1.51 2.81 -1.26 -4.89 117.12 112.88 2byt n MET 23 Ca -0.12 -1.65 -0.42 0.00 -1.81 0.00 0.00 57.70 53.70 2byt n MET 23 Cb 1.01 -1.70 -0.03 0.00 -0.71 0.00 0.00 33.22 31.79 2byt n MET 23 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2byt s LYS 24 N -1.78 4.16 -0.29 0.03 2.47 -1.24 -3.99 119.74 119.09 2byt s LYS 24 Ca 0.29 2.44 -0.29 0.00 -1.56 0.00 0.00 55.97 56.85 2byt s LYS 24 Cb 0.20 -3.90 0.01 0.00 -1.46 0.00 0.00 37.83 32.68 2byt s LYS 24 CO 0.12 -0.86 1.10 0.00 0.16 0.00 0.00 175.35 175.87 2byt s ALA 25 N 3.67 3.53 0.35 3.13 0.00 -1.26 -4.93 121.76 126.25 2byt s ALA 25 Ca 0.80 0.03 -0.28 0.00 0.00 0.00 0.00 51.96 52.50 2byt s ALA 25 Cb -0.40 -3.66 -0.12 0.00 0.00 0.00 0.00 23.12 18.94 2byt s ALA 25 CO 0.36 -1.42 1.42 1.17 0.00 0.00 0.00 175.76 177.29 2byt n LYS 26 N 6.80 2.46 0.11 0.00 4.81 -1.26 -4.92 118.16 126.16 2byt n LYS 26 Ca 0.12 0.86 -0.13 0.00 -0.87 0.00 0.00 58.31 58.30 2byt n LYS 26 Cb 0.47 -2.54 -0.06 0.00 0.02 0.00 0.00 35.03 32.92 2byt n LYS 26 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2byt h ASP 27 N 2.96 -0.57 -3.46 3.14 3.32 -1.95 -3.39 116.42 116.47 2byt h ASP 27 Ca -0.49 0.06 -0.60 0.00 0.02 0.00 0.00 57.03 56.03 2byt h ASP 27 Cb 1.26 0.21 -0.39 0.00 0.22 0.00 0.00 39.33 40.63 2byt h ASP 27 CO 0.65 -0.29 -0.76 -0.76 -1.72 0.00 0.00 179.24 176.35 2byt s LEU 28 N -10.27 2.71 0.06 1.55 1.43 -1.26 -4.94 118.68 107.97 2byt s LEU 28 Ca -0.15 -1.46 -0.37 0.00 -1.03 0.00 0.00 54.13 51.12 2byt s LEU 28 Cb 0.07 -1.10 -0.17 0.00 0.03 0.00 0.00 46.19 45.02 2byt s LEU 28 CO 0.65 -0.32 1.31 -2.65 0.23 0.00 0.00 176.35 175.57 2byt n PRO 29 N 4.69 0.98 0.00 1.29 -0.02 -1.26 -4.99 135.00 135.69 2byt n PRO 29 Ca -0.06 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 2byt n PRO 29 Cb 0.43 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 2byt n PRO 29 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2byt n GLY 30 N 2.42 -1.15 0.66 -1.23 0.00 -1.26 -4.96 105.19 99.68 2byt n GLY 30 Ca 0.19 -1.14 0.07 0.00 0.00 0.00 0.00 46.02 45.14 2byt n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2byt n GLY 31 N 2.70 1.28 0.00 -0.02 0.00 -1.26 -4.34 105.19 103.55 2byt n GLY 31 Ca 0.00 -0.43 0.13 0.00 0.00 0.00 0.00 46.02 45.72 2byt n GLY 31 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2byt n ARG 32 N 0.76 0.18 0.00 1.61 3.00 -1.26 -5.00 116.66 115.94 2byt n ARG 32 Ca 0.11 0.05 0.00 0.00 -0.00 0.00 0.00 57.85 58.01 2byt n ARG 32 Cb 0.40 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.36 2byt n ARG 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2byt n GLY 33 N 1.06 1.34 3.37 5.14 0.00 -1.26 -4.57 105.19 110.28 2byt n GLY 33 Ca 0.09 -2.01 -0.15 0.00 0.00 0.00 0.00 46.02 43.95 2byt n GLY 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2byt s LYS 34 N -1.97 0.80 0.08 1.61 0.00 -1.26 -1.91 119.74 117.08 2byt s LYS 34 Ca 0.00 0.12 0.09 0.00 0.00 0.00 0.00 55.97 56.18 2byt s LYS 34 Cb 0.00 0.37 -0.03 0.00 0.00 0.00 0.00 37.83 38.17 2byt s LYS 34 CO 0.00 -0.22 -0.24 -0.65 0.00 0.00 0.00 175.35 174.24 2byt s GLN 35 N -1.01 1.44 -0.43 1.78 -1.52 -0.63 -4.87 119.66 114.41 2byt s GLN 35 Ca -0.10 -1.14 0.02 0.00 -1.95 0.00 0.00 55.36 52.19 2byt s GLN 35 Cb -0.03 -1.70 0.13 0.00 -0.22 0.00 0.00 33.01 31.19 2byt s GLN 35 CO 0.06 0.42 0.23 -0.47 -0.25 0.00 0.00 175.29 175.28 2byt s TYR 36 N -0.95 2.05 -0.08 0.91 6.14 -1.26 -2.33 117.35 121.84 2byt s TYR 36 Ca 0.10 -2.43 -0.21 0.00 0.64 0.00 0.00 57.07 55.17 2byt s TYR 36 Cb -0.10 -1.94 -0.04 0.00 0.42 0.00 0.00 41.96 40.30 2byt s TYR 36 CO 0.03 -0.79 0.61 0.08 0.64 0.00 0.00 175.55 176.13 2byt s VAL 37 N 0.41 5.08 -0.06 3.14 1.01 -1.10 -1.86 120.40 127.01 2byt s VAL 37 Ca 0.17 1.25 -0.03 0.00 0.00 0.00 0.00 61.98 63.37 2byt s VAL 37 Cb -0.24 -3.95 0.03 0.00 0.00 0.00 0.00 36.38 32.22 2byt s VAL 37 CO -0.01 0.30 0.14 -0.22 0.00 0.00 0.00 175.10 175.31 2byt s LEU 38 N 0.61 0.85 -0.13 3.92 2.96 -0.21 -4.26 118.68 122.41 2byt s LEU 38 Ca 0.33 0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 54.49 2byt s LEU 38 Cb -0.17 0.35 -0.03 0.00 0.50 0.00 0.00 46.19 46.85 2byt s LEU 38 CO 0.15 -0.13 -0.05 0.68 -1.32 0.00 0.00 176.35 175.68 2byt s VAL 39 N 1.01 3.85 -0.18 1.68 -7.23 -1.26 -0.95 120.40 117.32 2byt s VAL 39 Ca -0.08 -0.39 -0.40 0.00 -1.81 0.00 0.00 61.98 59.30 2byt s VAL 39 Cb -0.10 -2.66 -0.17 0.00 0.56 0.00 0.00 36.38 34.01 2byt s VAL 39 CO -0.05 0.52 1.53 0.23 -0.31 0.00 0.00 175.10 177.03 2byt n MET 40 N 3.20 0.85 -1.96 4.82 0.00 -1.09 -4.86 117.12 118.09 2byt n MET 40 Ca -0.18 0.31 -0.39 0.00 0.00 0.00 0.00 57.70 57.45 2byt n MET 40 Cb 0.53 -1.93 0.01 0.00 0.00 0.00 0.00 33.22 31.83 2byt n MET 40 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 175.97 175.38 2byt s PHE 41 N 2.20 2.57 0.44 2.03 -0.12 -1.26 -4.98 117.98 118.86 2byt s PHE 41 Ca 0.95 1.40 -0.18 0.00 -0.05 0.00 0.00 56.93 59.04 2byt s PHE 41 Cb -1.12 -3.69 -0.10 0.00 -0.63 0.00 0.00 43.02 37.48 2byt s PHE 41 CO 0.62 -2.40 0.92 -1.25 -0.05 0.00 0.00 175.22 173.06 2byt s PRO 42 N -2.62 4.10 -0.52 1.99 0.04 -1.26 -4.71 135.00 132.01 2byt s PRO 42 Ca 0.64 0.98 -0.27 0.00 0.04 0.00 0.00 61.00 62.40 2byt s PRO 42 Cb -0.38 -2.21 0.03 0.00 0.04 0.00 0.00 34.50 31.99 2byt s PRO 42 CO 0.46 -0.08 1.05 0.71 0.04 0.00 0.00 177.00 179.19 2byt s TYR 43 N -2.29 2.77 -0.40 0.56 2.02 -1.26 -1.57 117.35 117.17 2byt s TYR 43 Ca 0.60 0.35 -0.27 0.00 -0.37 0.00 0.00 57.07 57.38 2byt s TYR 43 Cb -0.09 -4.25 -0.06 0.00 -0.40 0.00 0.00 41.96 37.15 2byt s TYR 43 CO 0.20 -1.35 2.33 -1.25 -1.57 0.00 0.00 175.55 173.91 2byt s PRO 44 N 4.30 2.46 -0.44 -1.71 0.04 -1.26 -4.75 135.00 133.64 2byt s PRO 44 Ca 0.39 1.59 0.02 0.00 0.04 0.00 0.00 61.00 63.04 2byt s PRO 44 Cb -0.09 -4.51 0.21 0.00 0.04 0.00 0.00 34.50 30.15 2byt s PRO 44 CO 0.25 -2.87 0.90 -1.13 0.04 0.00 0.00 177.00 174.20 2byt n SER 45 N 14.40 -2.59 0.00 6.66 3.41 -1.26 -4.52 113.62 129.72 2byt n SER 45 Ca 0.34 -2.20 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 2byt n SER 45 Cb 0.51 1.35 0.00 0.00 -0.26 0.00 0.00 64.21 65.81 2byt n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2byt n GLY 46 N 2.62 0.70 3.55 5.00 0.00 -1.26 -5.06 105.19 110.73 2byt n GLY 46 Ca 0.14 -2.23 -0.34 0.00 0.00 0.00 0.00 46.02 43.59 2byt n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2byt s ASP 47 N -1.63 4.48 0.62 1.61 3.68 -1.26 -4.87 116.67 119.30 2byt s ASP 47 Ca 0.00 -0.08 -0.18 0.00 2.13 0.00 0.00 52.55 54.43 2byt s ASP 47 Cb 0.00 -1.13 -0.02 0.00 -1.45 0.00 0.00 42.92 40.32 2byt s ASP 47 CO 0.00 0.34 1.18 -0.76 0.13 0.00 0.00 175.17 176.07 2byt s LEU 48 N -0.70 3.57 0.26 -1.34 1.43 -1.26 -5.02 118.68 115.61 2byt s LEU 48 Ca 0.11 2.29 -0.08 0.00 -1.03 0.00 0.00 54.13 55.42 2byt s LEU 48 Cb -0.11 -4.59 -0.01 0.00 0.03 0.00 0.00 46.19 41.51 2byt s LEU 48 CO 0.01 -1.68 0.40 -1.38 0.23 0.00 0.00 176.35 173.94 2byt s HIS 49 N -1.81 0.69 0.44 0.29 -3.43 -1.26 -3.24 115.29 106.97 2byt s HIS 49 Ca 0.75 -1.00 0.28 0.00 -0.80 0.00 0.00 55.06 54.29 2byt s HIS 49 Cb -0.28 -0.04 1.34 0.00 -1.43 0.00 0.00 32.58 32.18 2byt s HIS 49 CO 0.36 -0.95 1.70 0.52 -2.00 0.00 0.00 174.74 174.37 2byt h MET 50 N 2.31 0.18 -0.75 -0.38 2.86 -1.80 0.47 114.93 117.81 2byt h MET 50 Ca -0.29 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.41 2byt h MET 50 Cb 1.25 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 32.82 2byt h MET 50 CO 0.40 0.12 0.49 0.78 1.06 0.00 0.00 176.91 179.76 2byt h GLY 51 N 0.18 0.99 0.46 8.32 0.00 -1.87 -3.00 103.07 108.15 2byt h GLY 51 Ca 0.71 -0.31 -0.23 0.00 0.00 0.00 0.00 47.33 47.50 2byt h GLY 51 CO -0.30 0.22 -1.15 0.45 0.00 0.00 0.00 176.54 175.76 2byt h HIS 52 N 0.76 0.36 0.00 5.60 -0.00 -0.44 -3.37 115.15 118.07 2byt h HIS 52 Ca 0.33 -0.26 0.00 0.00 -0.00 0.00 0.00 60.37 60.43 2byt h HIS 52 Cb 0.29 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.69 2byt h HIS 52 CO -0.00 1.45 0.19 -0.07 -0.00 0.00 0.00 177.93 179.50 2byt h LEU 53 N -0.47 0.00 -0.15 2.43 -0.00 -1.25 -3.07 115.31 112.80 2byt h LEU 53 Ca -0.25 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.66 2byt h LEU 53 Cb 1.61 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 42.21 2byt h LEU 53 CO 0.04 0.00 -0.52 0.50 -0.00 0.00 0.00 178.44 178.45 2byt h LYS 54 N 0.00 -0.53 0.00 1.13 3.64 -1.70 -0.73 116.57 118.38 2byt h LYS 54 Ca 0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2byt h LYS 54 Cb 0.38 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2byt h LYS 54 CO 0.00 -0.35 0.00 0.09 -2.27 0.00 0.00 179.45 176.92 2byt n ASN 55 N -5.31 0.00 -0.56 4.20 5.03 -1.16 -2.11 115.26 115.35 2byt n ASN 55 Ca -0.06 0.59 0.44 0.00 0.87 0.00 0.00 54.58 56.42 2byt n ASN 55 Cb 0.36 -0.09 0.70 0.00 -1.02 0.00 0.00 39.78 39.72 2byt n ASN 55 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2byt n TYR 56 N -1.04 0.26 0.30 3.10 4.02 -1.21 0.12 117.16 122.71 2byt n TYR 56 Ca 0.00 0.26 -0.16 0.00 -0.01 0.00 0.00 57.90 57.99 2byt n TYR 56 Cb 0.00 -0.70 -0.08 0.00 -0.02 0.00 0.00 39.34 38.54 2byt n TYR 56 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 2byt h THR 57 N 0.00 0.34 -0.19 -0.72 2.02 -0.64 -1.60 112.91 112.12 2byt h THR 57 Ca 0.83 -0.28 0.02 0.00 0.77 0.00 0.00 66.41 67.75 2byt h THR 57 Cb 3.10 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 69.91 2byt h THR 57 CO -0.18 0.04 -0.19 0.24 0.37 0.00 0.00 175.52 175.80 2byt h MET 58 N -0.98 -0.09 -0.95 6.66 2.86 0.14 0.56 114.93 123.14 2byt h MET 58 Ca -0.08 0.01 0.30 0.00 -2.06 0.00 0.00 59.70 57.86 2byt h MET 58 Cb 0.65 0.02 -0.18 0.00 0.06 0.00 0.00 31.60 32.16 2byt h MET 58 CO 0.13 -0.06 0.15 0.41 1.06 0.00 0.00 176.91 178.59 2byt n GLY 59 N -1.11 -1.14 0.20 8.32 0.00 -0.83 -0.43 105.19 110.19 2byt n GLY 59 Ca -0.01 0.89 -0.14 0.00 0.00 0.00 0.00 46.02 46.76 2byt n GLY 59 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2byt h ASP 60 N 0.00 -0.35 -0.36 1.61 1.82 0.95 0.31 116.42 120.41 2byt h ASP 60 Ca 0.64 -0.14 0.04 0.00 -0.39 0.00 0.00 57.03 57.18 2byt h ASP 60 Cb 1.43 0.09 -0.06 0.00 0.68 0.00 0.00 39.33 41.47 2byt h ASP 60 CO -0.85 -0.05 -0.42 0.58 -1.61 0.00 0.00 179.24 176.89 2byt h VAL 61 N -0.65 0.00 -0.81 2.25 2.07 0.24 0.50 116.25 119.85 2byt h VAL 61 Ca -0.04 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.62 2byt h VAL 61 Cb 0.46 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.14 2byt h VAL 61 CO 0.07 0.00 0.39 0.25 0.02 0.00 0.00 177.57 178.30 2byt h LEU 62 N -0.26 0.45 -0.51 2.57 6.46 -1.21 0.10 115.31 122.91 2byt h LEU 62 Ca 0.06 0.09 -0.07 0.00 -0.12 0.00 0.00 57.88 57.84 2byt h LEU 62 Cb 0.42 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.36 2byt h LEU 62 CO -0.47 0.19 0.03 0.00 -0.62 0.00 0.00 178.44 177.56 2byt h ALA 63 N 1.55 0.68 -0.33 1.25 0.00 0.14 -2.42 119.26 120.12 2byt h ALA 63 Ca 0.44 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2byt h ALA 63 Cb 0.63 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2byt h ALA 63 CO -0.37 0.47 -0.05 0.00 0.00 0.00 0.00 179.25 179.30 2byt h ARG 64 N 0.75 0.62 0.12 0.00 3.08 0.97 -2.36 114.38 117.56 2byt h ARG 64 Ca 0.15 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2byt h ARG 64 Cb 0.48 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 2byt h ARG 64 CO 0.02 0.78 -0.22 0.35 -1.07 0.00 0.00 179.97 179.82 2byt h PHE 65 N 0.41 -0.64 -0.45 3.04 3.57 -0.95 0.24 116.94 122.15 2byt h PHE 65 Ca 0.09 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.69 2byt h PHE 65 Cb 0.53 0.26 -0.10 0.00 2.79 0.00 0.00 35.95 39.44 2byt h PHE 65 CO 0.05 -0.27 -0.32 0.00 -2.23 0.00 0.00 178.31 175.53 2byt h ARG 66 N -0.37 -0.21 -0.99 1.11 2.47 -1.50 0.41 114.38 115.29 2byt h ARG 66 Ca -0.01 0.01 0.22 0.00 -1.26 0.00 0.00 59.98 58.94 2byt h ARG 66 Cb 0.35 0.05 -0.10 0.00 -1.65 0.00 0.00 29.97 28.62 2byt h ARG 66 CO -0.08 -0.14 0.62 -0.09 0.56 0.00 0.00 179.97 180.84 2byt h ARG 67 N -0.22 0.56 -0.59 0.04 9.65 -1.23 0.15 114.38 122.75 2byt h ARG 67 Ca 0.19 -0.03 -0.07 0.00 -1.10 0.00 0.00 59.98 58.96 2byt h ARG 67 Cb 0.54 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.97 2byt h ARG 67 CO -0.58 0.37 0.07 0.52 2.80 0.00 0.00 179.97 183.16 2byt h MET 68 N 0.58 0.96 -0.32 0.20 2.86 0.19 -2.80 114.93 116.60 2byt h MET 68 Ca 0.57 -0.25 -0.09 0.00 -2.06 0.00 0.00 59.70 57.87 2byt h MET 68 Cb 1.15 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.67 2byt h MET 68 CO -0.33 0.90 -0.19 1.96 1.06 0.00 0.00 176.91 180.32 2byt h GLN 69 N 0.90 0.59 0.00 1.72 4.20 0.56 -2.82 115.11 120.26 2byt h GLN 69 Ca 0.18 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2byt h GLN 69 Cb 0.42 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2byt h GLN 69 CO 0.01 0.75 0.00 0.41 -0.67 0.00 0.00 178.83 179.33 2byt n GLY 70 N -0.43 1.29 3.42 3.46 0.00 -0.75 -4.66 105.19 107.53 2byt n GLY 70 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2byt n GLY 70 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2byt n TYR 71 N 0.00 -1.14 -2.85 1.61 4.01 -1.20 -4.86 117.16 112.73 2byt n TYR 71 Ca 0.00 0.45 -0.43 0.00 -0.16 0.00 0.00 57.90 57.76 2byt n TYR 71 Cb 0.00 -1.90 -0.04 0.00 -0.31 0.00 0.00 39.34 37.09 2byt n TYR 71 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2byt s GLU 72 N -1.85 3.66 0.04 -0.72 2.56 -0.81 -4.39 118.70 117.20 2byt s GLU 72 Ca 0.66 0.30 -0.03 0.00 0.00 0.00 0.00 54.97 55.90 2byt s GLU 72 Cb -0.46 -3.87 -0.04 0.00 2.00 0.00 0.00 34.13 31.76 2byt s GLU 72 CO 0.57 -1.06 0.24 0.08 -0.56 0.00 0.00 175.26 174.53 2byt s VAL 73 N 3.50 5.36 -0.28 3.70 1.01 -1.26 -1.61 120.40 130.82 2byt s VAL 73 Ca 0.36 -0.14 -0.02 0.00 0.00 0.00 0.00 61.98 62.18 2byt s VAL 73 Cb -0.11 -3.59 0.09 0.00 0.00 0.00 0.00 36.38 32.77 2byt s VAL 73 CO 0.22 0.23 0.08 -0.22 0.00 0.00 0.00 175.10 175.41 2byt s LEU 74 N -2.19 1.84 -0.63 3.92 2.96 -0.98 -4.45 118.68 119.14 2byt s LEU 74 Ca 0.32 -1.41 0.00 0.00 -0.22 0.00 0.00 54.13 52.82 2byt s LEU 74 Cb -0.13 -0.76 0.16 0.00 0.50 0.00 0.00 46.19 45.96 2byt s LEU 74 CO 0.22 -0.39 0.43 -2.28 -1.32 0.00 0.00 176.35 173.01 2byt s HIS 75 N 1.71 3.40 0.64 5.38 5.65 -1.26 -2.72 115.29 128.09 2byt s HIS 75 Ca 0.07 -2.96 -0.05 0.00 0.25 0.00 0.00 55.06 52.37 2byt s HIS 75 Cb -0.17 -3.04 0.04 0.00 -1.18 0.00 0.00 32.58 28.23 2byt s HIS 75 CO -0.22 -0.77 0.93 -1.25 -0.65 0.00 0.00 174.74 172.78 2byt s PRO 76 N -0.44 2.46 -0.27 2.88 0.04 -1.26 -2.38 135.00 136.02 2byt s PRO 76 Ca 0.19 -0.32 -0.24 0.00 0.04 0.00 0.00 61.00 60.67 2byt s PRO 76 Cb -0.19 -2.27 0.09 0.00 0.04 0.00 0.00 34.50 32.17 2byt s PRO 76 CO -0.05 -0.97 0.81 1.41 0.04 0.00 0.00 177.00 178.24 2byt s MET 77 N -5.06 0.72 0.00 4.56 1.75 -1.26 -4.72 119.30 115.28 2byt s MET 77 Ca 0.58 0.90 0.00 0.00 -1.25 0.00 0.00 55.69 55.92 2byt s MET 77 Cb -0.11 0.33 0.00 0.00 2.84 0.00 0.00 34.83 37.89 2byt s MET 77 CO 0.43 -0.09 0.00 0.41 -0.65 0.00 0.00 175.02 175.12 2byt n GLY 78 N 2.75 2.56 3.10 2.11 0.00 -1.26 -4.05 105.19 110.40 2byt n GLY 78 Ca -0.14 -1.16 -0.27 0.00 0.00 0.00 0.00 46.02 44.45 2byt n GLY 78 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2byt s TRP 79 N -6.98 1.80 -1.35 1.61 0.52 -0.01 -4.29 118.94 110.25 2byt s TRP 79 Ca 0.00 -0.67 -0.10 0.00 0.02 0.00 0.00 56.10 55.35 2byt s TRP 79 Cb 0.00 -1.26 0.11 0.00 -1.15 0.00 0.00 33.47 31.18 2byt s TRP 79 CO 0.00 -0.30 2.08 -3.47 0.02 0.00 0.00 176.95 175.28 2byt n ASP 80 N 3.62 5.19 0.23 2.95 -0.08 -0.61 -2.38 116.55 125.46 2byt n ASP 80 Ca -0.21 -3.01 -0.14 0.00 -1.51 0.00 0.00 54.79 49.91 2byt n ASP 80 Cb 0.52 -1.52 -0.08 0.00 2.34 0.00 0.00 41.12 42.38 2byt n ASP 80 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2byt h ALA 81 N 5.67 -0.58 -2.03 -1.67 0.00 -1.93 -3.36 119.26 115.35 2byt h ALA 81 Ca 0.50 -0.18 -0.40 0.00 0.00 0.00 0.00 54.91 54.82 2byt h ALA 81 Cb 0.58 0.23 0.22 0.00 0.00 0.00 0.00 17.79 18.82 2byt h ALA 81 CO 1.70 -0.70 -0.10 -0.06 0.00 0.00 0.00 179.25 180.08 2byt s PHE 82 N -5.01 0.09 0.00 0.00 0.08 -1.26 -4.31 117.98 107.57 2byt s PHE 82 Ca -0.15 0.85 0.00 0.00 0.12 0.00 0.00 56.93 57.75 2byt s PHE 82 Cb 0.02 -2.92 0.00 0.00 -0.57 0.00 0.00 43.02 39.56 2byt s PHE 82 CO 0.54 -4.71 0.00 0.41 -0.10 0.00 0.00 175.22 171.37 2byt n GLY 83 N 1.48 -2.86 0.14 4.36 0.00 -1.14 -4.55 105.19 102.61 2byt n GLY 83 Ca 0.08 -1.77 -0.14 0.00 0.00 0.00 0.00 46.02 44.19 2byt n GLY 83 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2byt h LEU 84 N 0.00 -0.22 -0.56 0.99 3.38 -1.92 -2.95 115.31 114.02 2byt h LEU 84 Ca 0.00 -0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 2byt h LEU 84 Cb 0.00 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 2byt h LEU 84 CO 0.00 -0.15 -0.33 -2.65 0.09 0.00 0.00 178.44 175.40 2byt n PRO 85 N -5.20 -0.25 0.29 1.13 -0.02 -1.26 0.19 135.00 129.89 2byt n PRO 85 Ca -0.09 0.97 -0.13 0.00 -2.02 0.00 0.00 63.50 62.23 2byt n PRO 85 Cb 0.13 -1.43 -0.07 0.00 -0.02 0.00 0.00 33.50 32.12 2byt n PRO 85 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2byt h ALA 86 N 0.15 -0.78 -0.67 3.55 0.00 -1.75 -3.04 119.26 116.73 2byt h ALA 86 Ca 0.09 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.95 2byt h ALA 86 Cb 0.23 0.30 -0.11 0.00 0.00 0.00 0.00 17.79 18.21 2byt h ALA 86 CO -0.53 -0.76 0.05 1.49 0.00 0.00 0.00 179.25 179.50 2byt h GLU 87 N -1.14 0.15 -0.16 0.00 4.81 -1.14 0.35 114.58 117.46 2byt h GLU 87 Ca -0.08 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.19 2byt h GLU 87 Cb 0.64 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.98 2byt h GLU 87 CO 0.13 0.10 0.14 -0.91 -0.73 0.00 0.00 179.01 177.74 2byt h ASN 88 N 0.16 0.00 0.00 1.04 4.21 0.21 0.28 115.58 121.47 2byt h ASN 88 Ca 0.36 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.84 2byt h ASN 88 Cb 0.60 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.79 2byt h ASN 88 CO -0.54 0.00 -0.23 0.00 -1.29 0.00 0.00 177.43 175.37 2byt h ALA 89 N 1.87 0.04 -0.03 -0.83 0.00 -0.30 -3.20 119.26 116.81 2byt h ALA 89 Ca 0.07 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.54 2byt h ALA 89 Cb 0.35 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2byt h ALA 89 CO -0.00 0.15 0.14 0.00 0.00 0.00 0.00 179.25 179.54 2byt h ALA 90 N -0.47 1.26 0.00 0.00 0.00 -0.61 0.13 119.26 119.57 2byt h ALA 90 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2byt h ALA 90 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2byt h ALA 90 CO -0.03 -0.16 -0.63 -0.07 0.00 0.00 0.00 179.25 178.37 2byt h LEU 91 N 0.00 0.00 -0.29 0.00 4.07 -1.05 -0.29 115.31 117.75 2byt h LEU 91 Ca 0.01 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.81 2byt h LEU 91 Cb 0.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.03 2byt h LEU 91 CO -0.00 0.08 -0.26 1.17 -1.08 0.00 0.00 178.44 178.35 2byt n LYS 92 N -2.23 0.57 -0.11 1.13 4.81 0.44 -3.76 118.16 119.01 2byt n LYS 92 Ca 0.03 -0.29 0.03 0.00 -0.87 0.00 0.00 58.31 57.21 2byt n LYS 92 Cb 0.46 -1.49 0.05 0.00 0.02 0.00 0.00 35.03 34.06 2byt n LYS 92 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2byt n PHE 93 N -0.96 0.00 -3.96 5.64 3.01 -1.18 -5.01 117.46 115.00 2byt n PHE 93 Ca 0.11 -0.50 -0.29 0.00 1.01 0.00 0.00 57.45 57.78 2byt n PHE 93 Cb 0.33 -0.07 0.01 0.00 -0.01 0.00 0.00 39.48 39.73 2byt n PHE 93 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2byt n GLY 94 N -0.64 -0.39 3.43 1.37 0.00 -1.17 -4.98 105.19 102.80 2byt n GLY 94 Ca 0.05 0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 2byt n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2byt s VAL 95 N -3.49 2.37 0.08 1.61 1.01 -0.13 -5.04 120.40 116.81 2byt s VAL 95 Ca 0.44 -2.06 -0.30 0.00 0.00 0.00 0.00 61.98 60.06 2byt s VAL 95 Cb -0.23 -2.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.95 2byt s VAL 95 CO 0.86 -0.14 1.09 -2.28 0.00 0.00 0.00 175.10 174.64 2byt s HIS 96 N -1.74 3.57 0.17 5.22 5.65 -1.26 -4.45 115.29 122.46 2byt s HIS 96 Ca 0.22 1.53 -0.16 0.00 0.25 0.00 0.00 55.06 56.89 2byt s HIS 96 Cb -0.08 -3.27 0.11 0.00 -1.18 0.00 0.00 32.58 28.17 2byt s HIS 96 CO 0.10 -0.63 1.67 -1.00 -0.65 0.00 0.00 174.74 174.23 2byt h PRO 97 N 6.21 0.01 -0.38 2.88 0.13 -1.96 0.84 132.00 139.73 2byt h PRO 97 Ca -0.42 -0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.82 2byt h PRO 97 Cb 1.21 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 2byt h PRO 97 CO 0.76 0.01 0.33 -0.22 -0.23 0.00 0.00 178.00 178.65 2byt h LYS 98 N 0.01 0.00 0.11 0.86 3.64 -1.99 0.10 116.57 119.31 2byt h LYS 98 Ca 0.21 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.23 2byt h LYS 98 Cb 0.31 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2byt h LYS 98 CO -0.43 0.00 -1.93 -0.25 -2.27 0.00 0.00 179.45 174.57 2byt n ASP 99 N -4.07 2.10 0.17 4.20 8.00 -0.47 -3.43 116.55 123.05 2byt n ASP 99 Ca 0.06 0.23 0.04 0.00 0.71 0.00 0.00 54.79 55.83 2byt n ASP 99 Cb 0.51 -0.87 0.45 0.00 -0.02 0.00 0.00 41.12 41.18 2byt n ASP 99 CO 0.00 0.00 0.00 -0.25 -0.39 0.00 0.00 177.20 176.56 2byt h TRP 100 N -0.04 0.14 0.00 1.24 2.91 -0.24 -2.72 115.95 117.24 2byt h TRP 100 Ca -0.42 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.59 2byt h TRP 100 Cb 1.96 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 30.57 2byt h TRP 100 CO 0.08 0.27 0.00 2.41 -1.03 0.00 0.00 178.44 180.17 2byt n THR 101 N -4.31 0.00 0.03 2.65 -1.04 0.30 -1.87 114.28 110.04 2byt n THR 101 Ca -0.01 0.71 0.19 0.00 -2.04 0.00 0.00 64.05 62.90 2byt n THR 101 Cb 0.24 -1.67 0.46 0.00 -1.82 0.00 0.00 70.33 67.55 2byt n THR 101 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 2byt h TYR 102 N 0.00 0.00 0.02 -1.42 0.99 -1.63 0.50 116.97 115.43 2byt h TYR 102 Ca 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2byt h TYR 102 Cb 0.00 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.73 2byt h TYR 102 CO 0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 178.16 178.20 2byt h ALA 103 N 0.74 -0.02 -0.53 3.88 0.00 -1.55 -2.97 119.26 118.81 2byt h ALA 103 Ca 0.27 -0.33 0.10 0.00 0.00 0.00 0.00 54.91 54.94 2byt h ALA 103 Cb 2.06 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.83 2byt h ALA 103 CO -0.00 -0.04 0.36 -0.97 0.00 0.00 0.00 179.25 178.60 2byt h ASN 104 N -0.97 0.27 -0.20 0.00 -1.24 0.67 -1.58 115.58 112.53 2byt h ASN 104 Ca -0.00 0.01 -0.05 0.00 0.71 0.00 0.00 56.30 56.96 2byt h ASN 104 Cb 0.67 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.67 2byt h ASN 104 CO 0.00 0.16 -0.09 0.40 -1.29 0.00 0.00 177.43 176.62 2byt h ILE 105 N 0.30 1.30 -0.15 2.57 2.04 -1.23 -1.35 117.51 121.00 2byt h ILE 105 Ca 0.25 -1.13 0.04 0.00 1.00 0.00 0.00 64.86 65.01 2byt h ILE 105 Cb 0.57 1.62 -0.04 0.00 -0.74 0.00 0.00 36.82 38.23 2byt h ILE 105 CO -0.06 0.34 -0.09 -0.09 0.00 0.00 0.00 178.15 178.26 2byt h ARG 106 N 0.12 -0.08 -0.81 2.37 2.43 -1.13 0.02 114.38 117.30 2byt h ARG 106 Ca 0.05 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 2byt h ARG 106 Cb 0.57 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.08 2byt h ARG 106 CO 0.03 -0.05 0.51 1.96 -1.51 0.00 0.00 179.97 180.90 2byt h GLN 107 N -0.08 0.93 0.71 0.20 4.20 -1.39 -2.50 115.11 117.18 2byt h GLN 107 Ca 0.09 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 2byt h GLN 107 Cb 0.21 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 27.78 2byt h GLN 107 CO -0.20 0.62 -0.34 0.00 -0.67 0.00 0.00 178.83 178.24 2byt h ALA 108 N 1.36 -1.24 -1.11 3.87 0.00 -0.39 -2.63 119.26 119.12 2byt h ALA 108 Ca 0.34 -0.21 0.31 0.00 0.00 0.00 0.00 54.91 55.35 2byt h ALA 108 Cb 0.08 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 2byt h ALA 108 CO -0.14 -1.17 0.76 0.87 0.00 0.00 0.00 179.25 179.58 2byt h LYS 109 N -0.97 0.17 -0.13 0.00 1.57 -0.95 0.60 116.57 116.86 2byt h LYS 109 Ca -0.10 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 2byt h LYS 109 Cb 0.73 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 2byt h LYS 109 CO 0.16 0.11 0.04 1.49 -0.57 0.00 0.00 179.45 180.68 2byt h GLU 110 N 0.17 0.21 0.81 3.15 4.81 -1.25 -0.52 114.58 121.97 2byt h GLU 110 Ca 0.58 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.72 2byt h GLU 110 Cb 1.92 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 31.27 2byt h GLU 110 CO -0.15 0.36 -0.45 0.77 -0.73 0.00 0.00 179.01 178.82 2byt h SER 111 N 0.02 -1.10 -0.78 1.04 0.02 -0.55 -0.84 113.55 111.37 2byt h SER 111 Ca 0.04 0.05 0.18 0.00 -0.84 0.00 0.00 61.79 61.22 2byt h SER 111 Cb 0.24 0.31 -0.14 0.00 0.14 0.00 0.00 62.40 62.95 2byt h SER 111 CO -0.00 -0.72 -0.02 -0.07 -1.14 0.00 0.00 176.83 174.88 2byt h LEU 112 N -1.16 -0.41 -0.72 5.07 3.38 -1.34 0.18 115.31 120.29 2byt h LEU 112 Ca -0.11 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2byt h LEU 112 Cb 0.91 0.38 -0.04 0.00 0.09 0.00 0.00 40.66 42.01 2byt h LEU 112 CO 0.15 -0.21 0.46 -0.09 0.09 0.00 0.00 178.44 178.84 2byt h ARG 113 N 0.08 0.96 -0.59 1.13 2.43 -0.85 -2.29 114.38 115.25 2byt h ARG 113 Ca 0.42 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.51 2byt h ARG 113 Cb 0.75 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 30.06 2byt h ARG 113 CO -0.71 0.65 0.30 -0.07 -1.51 0.00 0.00 179.97 178.64 2byt h LEU 114 N 0.98 0.73 0.00 3.80 3.38 0.78 -1.23 115.31 123.75 2byt h LEU 114 Ca 0.26 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2byt h LEU 114 Cb -0.08 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.48 2byt h LEU 114 CO -0.05 0.60 0.00 0.23 0.09 0.00 0.00 178.44 179.31 2byt n MET 115 N -4.38 0.62 -2.27 1.13 2.81 -0.52 -4.70 117.12 109.82 2byt n MET 115 Ca 0.05 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.81 2byt n MET 115 Cb 0.11 -1.34 -0.01 0.00 -0.71 0.00 0.00 33.22 31.28 2byt n MET 115 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2byt n GLY 116 N 0.20 -0.18 3.70 3.03 0.00 -0.46 -4.83 105.19 106.65 2byt n GLY 116 Ca 0.10 -0.32 -0.37 0.00 0.00 0.00 0.00 46.02 45.43 2byt n GLY 116 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2byt s ILE 117 N -2.68 5.26 0.13 -0.61 1.01 -1.06 -5.01 121.20 118.24 2byt s ILE 117 Ca 0.01 0.61 0.04 0.00 0.00 0.00 0.00 60.65 61.31 2byt s ILE 117 Cb -0.00 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 2byt s ILE 117 CO 0.01 0.33 0.11 -0.76 0.00 0.00 0.00 174.94 174.63 2byt s LEU 118 N 0.81 3.80 0.00 2.97 1.02 -1.26 -4.49 118.68 121.53 2byt s LEU 118 Ca 0.17 -0.08 -0.01 0.00 0.02 0.00 0.00 54.13 54.23 2byt s LEU 118 Cb -0.14 -2.45 0.01 0.00 0.02 0.00 0.00 46.19 43.63 2byt s LEU 118 CO 0.06 0.11 0.49 -1.22 0.02 0.00 0.00 176.35 175.81 2byt n TYR 119 N -0.00 -1.43 -3.66 0.29 4.01 -1.26 -4.94 117.16 110.17 2byt n TYR 119 Ca -0.08 -2.43 -0.35 0.00 -0.16 0.00 0.00 57.90 54.88 2byt n TYR 119 Cb 0.53 0.55 -0.07 0.00 -0.31 0.00 0.00 39.34 40.04 2byt n TYR 119 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2byt n ASP 120 N -1.62 4.10 0.00 7.72 2.03 -1.00 -4.68 116.55 123.10 2byt n ASP 120 Ca 0.01 -3.14 0.01 0.00 0.52 0.00 0.00 54.79 52.19 2byt n ASP 120 Cb 0.60 -1.02 0.05 0.00 -0.72 0.00 0.00 41.12 40.03 2byt n ASP 120 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 2byt n TRP 121 N 2.25 0.00 1.02 -0.67 7.02 -1.26 -1.35 117.44 124.44 2byt n TRP 121 Ca 0.22 0.00 0.09 0.00 -1.02 0.00 0.00 57.50 56.79 2byt n TRP 121 Cb 0.37 -0.43 0.51 0.00 -2.42 0.00 0.00 31.31 29.34 2byt n TRP 121 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 2byt n ASP 122 N -1.43 0.00 -0.24 -0.99 8.00 -1.26 -2.05 116.55 118.57 2byt n ASP 122 Ca 0.01 -0.26 0.03 0.00 0.71 0.00 0.00 54.79 55.28 2byt n ASP 122 Cb 0.02 -0.16 0.03 0.00 -0.02 0.00 0.00 41.12 40.99 2byt n ASP 122 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2byt n ARG 123 N -1.16 0.02 -1.55 -1.24 1.74 -0.46 -4.94 116.66 109.08 2byt n ARG 123 Ca 0.11 -0.91 -0.49 0.00 -0.77 0.00 0.00 57.85 55.79 2byt n ARG 123 Cb 0.11 -1.12 -0.04 0.00 -1.02 0.00 0.00 32.46 30.40 2byt n ARG 123 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2byt n GLU 124 N 0.31 0.89 -4.59 5.56 2.13 -0.87 -4.78 120.64 119.29 2byt n GLU 124 Ca 0.04 0.32 -0.23 0.00 0.66 0.00 0.00 57.16 57.95 2byt n GLU 124 Cb 0.16 -1.73 -0.16 0.00 0.27 0.00 0.00 31.44 29.99 2byt n GLU 124 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 2byt s VAL 125 N -0.39 1.06 -0.30 6.31 -7.23 -1.26 -5.01 120.40 113.57 2byt s VAL 125 Ca 0.72 -0.53 0.02 0.00 -1.81 0.00 0.00 61.98 60.38 2byt s VAL 125 Cb -0.89 -0.91 0.07 0.00 0.56 0.00 0.00 36.38 35.21 2byt s VAL 125 CO 0.54 0.31 -0.01 -0.89 -0.31 0.00 0.00 175.10 174.74 2byt s THR 126 N 0.01 2.46 0.27 5.32 2.01 -1.26 -0.83 115.64 123.63 2byt s THR 126 Ca -0.01 -1.83 -0.01 0.00 0.31 0.00 0.00 61.69 60.14 2byt s THR 126 Cb -0.09 -2.57 0.27 0.00 0.01 0.00 0.00 72.50 70.12 2byt s THR 126 CO 0.01 -0.27 1.68 0.71 -0.69 0.00 0.00 174.62 176.06 2byt h THR 127 N 6.63 0.46 0.00 -0.82 1.35 -1.86 -1.83 112.91 116.83 2byt h THR 127 Ca -0.14 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 2byt h THR 127 Cb 1.04 0.13 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 2byt h THR 127 CO 0.51 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 175.84 2byt s GLU 129 N -2.34 4.30 0.23 0.00 2.02 -0.69 -4.89 118.70 117.33 2byt s GLU 129 Ca 0.18 0.93 -0.07 0.00 0.02 0.00 0.00 54.97 56.03 2byt s GLU 129 Cb 0.10 -2.89 0.35 0.00 0.10 0.00 0.00 34.13 31.80 2byt s GLU 129 CO 0.21 0.39 1.77 -1.35 0.02 0.00 0.00 175.26 176.30 2byt h PRO 130 N 3.43 0.57 0.00 0.39 0.11 -1.89 0.50 132.00 135.12 2byt h PRO 130 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2byt h PRO 130 Cb 1.19 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2byt h PRO 130 CO 0.65 0.38 0.24 0.39 -0.21 0.00 0.00 178.00 179.45 2byt n GLU 131 N -4.88 0.06 0.02 1.05 4.71 -1.26 -1.66 120.64 118.69 2byt n GLU 131 Ca 0.11 0.48 -0.01 0.00 -0.01 0.00 0.00 57.16 57.74 2byt n GLU 131 Cb 0.29 -1.94 -0.00 0.00 -1.01 0.00 0.00 31.44 28.78 2byt n GLU 131 CO 0.00 0.00 0.00 0.98 0.09 0.00 0.00 177.13 178.20 2byt n TYR 132 N -1.80 0.00 0.05 -0.32 4.19 0.02 -4.71 117.16 114.59 2byt n TYR 132 Ca -0.01 0.00 0.03 0.00 3.31 0.00 0.00 57.90 61.23 2byt n TYR 132 Cb 0.25 -0.03 0.14 0.00 0.49 0.00 0.00 39.34 40.20 2byt n TYR 132 CO 0.00 0.00 0.00 2.48 0.91 0.00 0.00 176.86 180.25 2byt n TYR 133 N -3.18 0.18 -0.08 2.98 4.11 -0.32 -0.59 117.16 120.25 2byt n TYR 133 Ca -0.01 0.09 -0.09 0.00 -0.00 0.00 0.00 57.90 57.89 2byt n TYR 133 Cb 0.04 -0.54 -0.02 0.00 -0.00 0.00 0.00 39.34 38.82 2byt n TYR 133 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.86 176.93 2byt h ARG 134 N 0.00 0.39 0.00 -3.48 0.11 -1.53 -1.57 114.38 108.30 2byt h ARG 134 Ca 0.00 -0.04 -0.02 0.00 0.10 0.00 0.00 59.98 60.02 2byt h ARG 134 Cb 0.26 -0.08 -0.00 0.00 1.11 0.00 0.00 29.97 31.26 2byt h ARG 134 CO 0.00 0.31 -0.09 -1.49 0.10 0.00 0.00 179.97 178.80 2byt h TRP 135 N 0.36 0.00 -0.47 4.08 4.06 -1.11 -0.55 115.95 122.33 2byt h TRP 135 Ca 0.10 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.03 2byt h TRP 135 Cb 0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.16 2byt h TRP 135 CO -0.04 0.09 0.21 -0.91 -3.56 0.00 0.00 178.44 174.22 2byt h ASN 136 N 0.00 0.60 0.04 -3.49 -0.26 -1.30 -0.48 115.58 110.69 2byt h ASN 136 Ca -0.00 -0.06 -0.00 0.00 -0.56 0.00 0.00 56.30 55.68 2byt h ASN 136 Cb 0.42 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.53 2byt h ASN 136 CO 0.01 0.53 -0.02 1.56 -1.06 0.00 0.00 177.43 178.45 2byt h GLN 137 N 0.66 -0.06 -0.88 0.81 4.20 -0.89 -2.50 115.11 116.45 2byt h GLN 137 Ca 0.16 0.00 0.24 0.00 0.06 0.00 0.00 58.65 59.11 2byt h GLN 137 Cb 0.11 0.01 -0.15 0.00 0.30 0.00 0.00 27.48 27.75 2byt h GLN 137 CO -0.02 0.59 0.13 2.35 -0.67 0.00 0.00 178.83 181.21 2byt h TRP 138 N -0.84 0.16 -0.09 2.96 7.01 -0.92 0.56 115.95 124.79 2byt h TRP 138 Ca -0.01 0.06 -0.01 0.00 2.11 0.00 0.00 58.89 61.04 2byt h TRP 138 Cb 0.67 0.07 -0.00 0.00 -2.10 0.00 0.00 29.16 27.80 2byt h TRP 138 CO 0.16 -0.29 0.02 0.82 -2.79 0.00 0.00 178.44 176.37 2byt h ILE 139 N 0.12 1.19 -1.00 2.65 2.04 -1.14 -2.24 117.51 119.13 2byt h ILE 139 Ca 0.54 -0.57 0.25 0.00 1.00 0.00 0.00 64.86 66.08 2byt h ILE 139 Cb 1.09 1.41 -0.08 0.00 -0.74 0.00 0.00 36.82 38.49 2byt h ILE 139 CO -0.74 0.16 0.66 0.15 0.00 0.00 0.00 178.15 178.38 2byt h PHE 140 N -0.06 0.57 0.62 1.37 3.04 0.47 -0.33 116.94 122.62 2byt h PHE 140 Ca 0.03 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.97 2byt h PHE 140 Cb 0.24 -0.17 0.01 0.00 2.56 0.00 0.00 35.95 38.58 2byt h PHE 140 CO 0.00 0.09 -0.30 -0.07 -2.02 0.00 0.00 178.31 176.01 2byt h LEU 141 N 0.38 -0.71 -1.77 0.59 3.38 -0.49 -2.11 115.31 114.58 2byt h LEU 141 Ca 0.55 0.02 0.28 0.00 0.09 0.00 0.00 57.88 58.82 2byt h LEU 141 Cb 1.43 0.18 -0.04 0.00 0.09 0.00 0.00 40.66 42.33 2byt h LEU 141 CO -0.23 -0.31 0.85 0.11 0.09 0.00 0.00 178.44 178.94 2byt h LYS 142 N -1.22 0.00 0.00 1.13 1.79 -0.56 1.42 116.57 119.12 2byt h LYS 142 Ca -0.09 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.24 2byt h LYS 142 Cb 0.64 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.27 2byt h LYS 142 CO 0.14 0.00 -0.78 0.52 -1.08 0.00 0.00 179.45 178.25 2byt h MET 143 N 0.00 0.00 0.37 3.15 2.86 -0.97 -3.10 114.93 117.24 2byt h MET 143 Ca 0.46 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 58.08 2byt h MET 143 Cb 2.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.82 2byt h MET 143 CO -0.00 0.59 -0.18 2.35 1.06 0.00 0.00 176.91 180.73 2byt h TRP 144 N 0.00 -0.46 -0.79 -0.22 2.91 0.26 0.33 115.95 117.97 2byt h TRP 144 Ca -0.04 -0.01 0.14 0.00 1.13 0.00 0.00 58.89 60.12 2byt h TRP 144 Cb 1.52 0.15 -0.06 0.00 -0.51 0.00 0.00 29.16 30.27 2byt h TRP 144 CO 0.00 -0.14 0.52 0.93 -1.03 0.00 0.00 178.44 178.72 2byt h GLU 145 N -0.97 0.50 -0.06 2.65 5.08 -1.51 0.68 114.58 120.96 2byt h GLU 145 Ca -0.05 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2byt h GLU 145 Cb 0.53 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2byt h GLU 145 CO 0.08 0.33 0.00 1.17 -1.00 0.00 0.00 179.01 179.60 2byt n LYS 146 N -4.50 1.23 -1.90 2.33 4.81 -1.17 -4.89 118.16 114.06 2byt n LYS 146 Ca 0.15 -0.34 -0.19 0.00 -0.87 0.00 0.00 58.31 57.06 2byt n LYS 146 Cb 0.49 -1.29 -0.05 0.00 0.02 0.00 0.00 35.03 34.21 2byt n LYS 146 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2byt n GLY 147 N 0.86 0.83 0.02 3.14 0.00 0.24 -4.86 105.19 105.43 2byt n GLY 147 Ca 0.13 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.14 2byt n GLY 147 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2byt n LEU 148 N -2.35 0.64 -4.63 0.99 4.77 0.11 -4.87 117.00 111.66 2byt n LEU 148 Ca -0.20 -0.08 -0.30 0.00 -0.03 0.00 0.00 56.01 55.40 2byt n LEU 148 Cb 0.63 -0.12 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 2byt n LEU 148 CO 0.27 0.09 -0.38 0.00 -1.33 0.00 0.00 177.39 176.04 2byt s ALA 149 N -3.12 3.11 -0.01 -1.18 0.00 -0.99 0.30 121.76 119.87 2byt s ALA 149 Ca 0.06 -1.19 -0.29 0.00 0.00 0.00 0.00 51.96 50.54 2byt s ALA 149 Cb 0.15 -1.03 0.11 0.00 0.00 0.00 0.00 23.12 22.36 2byt s ALA 149 CO 0.79 0.67 1.28 1.52 0.00 0.00 0.00 175.76 180.01 2byt s TYR 150 N -1.26 -0.01 0.17 0.00 -0.85 -0.73 -4.79 117.35 109.88 2byt s TYR 150 Ca 0.23 -0.11 0.10 0.00 -0.52 0.00 0.00 57.07 56.78 2byt s TYR 150 Cb -0.11 0.56 -0.04 0.00 0.38 0.00 0.00 41.96 42.74 2byt s TYR 150 CO 0.16 -0.30 -0.19 1.03 -1.52 0.00 0.00 175.55 174.73 2byt s ARG 151 N -2.26 1.73 -0.24 -3.49 0.52 -1.26 0.11 118.95 114.06 2byt s ARG 151 Ca 0.20 -1.37 -0.31 0.00 -0.52 0.00 0.00 55.73 53.74 2byt s ARG 151 Cb 0.03 -2.00 0.16 0.00 0.52 0.00 0.00 34.95 33.66 2byt s ARG 151 CO -0.02 0.43 1.24 0.00 0.02 0.00 0.00 175.30 176.97 2byt s ALA 152 N -1.53 -2.07 1.00 2.13 0.00 -0.82 -4.96 121.76 115.51 2byt s ALA 152 Ca 0.21 1.76 0.00 0.00 0.00 0.00 0.00 51.96 53.93 2byt s ALA 152 Cb -0.09 -1.00 0.00 0.00 0.00 0.00 0.00 23.12 22.03 2byt s ALA 152 CO 0.11 -0.34 0.00 1.63 0.00 0.00 0.00 175.76 177.16 2byt n LYS 153 N 0.43 2.29 0.00 0.00 5.02 -1.26 -2.07 118.16 122.57 2byt n LYS 153 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2byt n LYS 153 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.59 2byt n LYS 153 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2byt n GLY 154 N 4.89 2.15 3.69 0.72 0.00 -1.25 -4.82 105.19 110.57 2byt n GLY 154 Ca 0.00 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 2byt n GLY 154 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2byt s LEU 155 N -0.04 4.31 0.26 0.99 1.43 -1.26 -3.19 118.68 121.18 2byt s LEU 155 Ca 0.00 2.07 0.10 0.00 -1.03 0.00 0.00 54.13 55.27 2byt s LEU 155 Cb 0.00 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.62 2byt s LEU 155 CO 0.00 -0.70 -0.06 0.68 0.23 0.00 0.00 176.35 176.51 2byt s VAL 156 N 2.36 3.22 -0.00 -1.59 -7.23 -1.08 -4.90 120.40 111.17 2byt s VAL 156 Ca 0.63 -1.99 -0.28 0.00 -1.81 0.00 0.00 61.98 58.52 2byt s VAL 156 Cb -0.30 -2.70 -0.04 0.00 0.56 0.00 0.00 36.38 33.90 2byt s VAL 156 CO 0.26 -0.35 0.90 0.20 -0.31 0.00 0.00 175.10 175.79 2byt s ASN 157 N -3.55 7.28 -0.11 4.85 -0.87 -1.26 -1.70 114.94 119.58 2byt s ASN 157 Ca 0.30 1.55 0.01 0.00 -1.57 0.00 0.00 52.86 53.16 2byt s ASN 157 Cb -0.06 -2.53 -0.01 0.00 -0.02 0.00 0.00 41.25 38.62 2byt s ASN 157 CO 0.18 -0.19 -0.16 0.86 -2.57 0.00 0.00 177.10 175.23 2byt s TRP 158 N 0.79 2.73 -0.42 2.20 -0.11 0.54 -2.11 118.94 122.56 2byt s TRP 158 Ca 0.47 -0.66 -0.11 0.00 1.22 0.00 0.00 56.10 57.01 2byt s TRP 158 Cb -0.20 -1.78 0.06 0.00 -1.50 0.00 0.00 33.47 30.05 2byt s TRP 158 CO 0.26 -0.20 0.28 0.00 -4.62 0.00 0.00 176.95 172.66 2byt h PRO 160 N 8.51 0.52 0.07 0.00 0.13 -1.87 0.74 132.00 140.10 2byt h PRO 160 Ca -0.25 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2byt h PRO 160 Cb 1.10 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2byt h PRO 160 CO 0.77 0.35 -0.03 0.87 -0.23 0.00 0.00 178.00 179.72 2byt h LYS 161 N 0.54 -0.09 0.00 0.86 1.57 -1.93 -3.14 116.57 114.37 2byt h LYS 161 Ca 0.36 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2byt h LYS 161 Cb 0.65 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2byt h LYS 161 CO -0.13 0.43 0.00 0.00 -0.57 0.00 0.00 179.45 179.18 2byt n GLN 163 N -2.31 -4.17 -3.70 0.00 1.13 0.25 -4.93 117.38 103.65 2byt n GLN 163 Ca 0.03 0.52 -0.03 0.00 -1.94 0.00 0.00 57.00 55.57 2byt n GLN 163 Cb 0.28 -4.90 -0.01 0.00 0.11 0.00 0.00 30.24 25.73 2byt n GLN 163 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 2byt s THR 164 N -3.78 0.00 0.34 5.09 -1.32 -1.18 -4.49 115.64 110.31 2byt s THR 164 Ca 0.04 -0.49 -0.14 0.00 -1.21 0.00 0.00 61.69 59.90 2byt s THR 164 Cb -0.02 -1.83 -0.08 0.00 -1.51 0.00 0.00 72.50 69.05 2byt s THR 164 CO 0.85 0.00 0.74 0.68 -2.21 0.00 0.00 174.62 174.68 2byt s VAL 165 N -3.11 4.72 0.16 5.08 -7.23 -1.26 -1.72 120.40 117.04 2byt s VAL 165 Ca 0.11 0.85 0.08 0.00 -1.81 0.00 0.00 61.98 61.21 2byt s VAL 165 Cb -0.00 -3.64 -0.04 0.00 0.56 0.00 0.00 36.38 33.25 2byt s VAL 165 CO -0.00 -0.27 -0.16 -0.76 -0.31 0.00 0.00 175.10 173.59 2byt s LEU 166 N -3.20 2.46 0.58 1.32 1.43 -0.90 -4.82 118.68 115.55 2byt s LEU 166 Ca 0.53 -0.88 -0.15 0.00 -1.03 0.00 0.00 54.13 52.59 2byt s LEU 166 Cb -0.10 -0.72 -0.04 0.00 0.03 0.00 0.00 46.19 45.36 2byt s LEU 166 CO 0.21 -0.10 1.04 0.00 0.23 0.00 0.00 176.35 177.73 2byt s ALA 167 N -2.29 2.84 0.53 4.21 0.00 -1.26 -4.36 121.76 121.43 2byt s ALA 167 Ca 0.15 0.29 0.21 0.00 0.00 0.00 0.00 51.96 52.61 2byt s ALA 167 Cb -0.04 -3.19 1.34 0.00 0.00 0.00 0.00 23.12 21.23 2byt s ALA 167 CO 0.06 -0.68 2.07 -0.91 0.00 0.00 0.00 175.76 176.29 2byt h ASN 168 N 0.44 0.00 0.65 0.00 4.21 -1.93 0.29 115.58 119.24 2byt h ASN 168 Ca -0.46 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.05 2byt h ASN 168 Cb 1.21 -0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.41 2byt h ASN 168 CO 0.59 0.00 0.00 -0.33 -1.29 0.00 0.00 177.43 176.40 2byt h GLU 169 N 0.00 0.00 -0.62 0.81 3.07 -1.91 -2.50 114.58 113.43 2byt h GLU 169 Ca 0.14 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.97 2byt h GLU 169 Cb 0.55 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.45 2byt h GLU 169 CO -0.00 0.00 0.03 1.04 -1.40 0.00 0.00 179.01 178.68 2byt n GLN 170 N -2.59 4.60 -3.93 2.33 6.02 0.10 -4.73 117.38 119.17 2byt n GLN 170 Ca 0.01 -3.00 -0.29 0.00 -0.01 0.00 0.00 57.00 53.71 2byt n GLN 170 Cb 0.21 -2.23 -0.13 0.00 1.02 0.00 0.00 30.24 29.11 2byt n GLN 170 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2byt s VAL 171 N -2.70 2.68 -0.16 5.09 1.01 -0.94 -2.60 120.40 122.77 2byt s VAL 171 Ca 0.52 -3.62 -0.19 0.00 0.00 0.00 0.00 61.98 58.69 2byt s VAL 171 Cb 0.40 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 2byt s VAL 171 CO 0.15 -0.86 0.51 -0.69 0.00 0.00 0.00 175.10 174.21 2byt s VAL 172 N -0.66 5.14 -0.29 2.92 1.01 -0.61 -4.03 120.40 123.88 2byt s VAL 172 Ca 0.19 0.98 0.00 0.00 0.00 0.00 0.00 61.98 63.16 2byt s VAL 172 Cb -0.19 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.34 2byt s VAL 172 CO -0.05 0.24 0.00 -0.62 0.00 0.00 0.00 175.10 174.67 2byt n GLU 173 N 4.28 -1.76 -0.55 2.72 1.02 -1.26 -0.53 120.64 124.56 2byt n GLU 173 Ca -0.05 0.56 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 2byt n GLU 173 Cb 0.51 -4.92 0.00 0.00 -0.02 0.00 0.00 31.44 27.01 2byt n GLU 173 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2byt n GLY 174 N 0.47 0.69 3.56 0.62 0.00 -1.26 -4.78 105.19 104.48 2byt n GLY 174 Ca -0.03 -0.31 -0.26 0.00 0.00 0.00 0.00 46.02 45.42 2byt n GLY 174 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2byt s ARG 175 N -0.79 1.92 0.60 1.61 0.52 0.31 -3.76 118.95 119.37 2byt s ARG 175 Ca 0.00 -2.15 -0.18 0.00 -0.52 0.00 0.00 55.73 52.88 2byt s ARG 175 Cb 0.00 -0.92 -0.03 0.00 0.52 0.00 0.00 34.95 34.52 2byt s ARG 175 CO 0.00 -0.36 1.16 0.00 0.02 0.00 0.00 175.30 176.12 2byt h TRP 177 N 0.69 0.00 0.00 0.00 5.08 -1.83 -3.27 115.95 116.62 2byt h TRP 177 Ca -0.49 0.00 -0.23 0.00 1.08 0.00 0.00 58.89 59.24 2byt h TRP 177 Cb 1.27 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 27.39 2byt h TRP 177 CO 0.50 0.00 -1.88 0.54 -1.28 0.00 0.00 178.44 176.32 2byt n ARG 178 N -2.90 1.90 -3.63 0.12 5.12 -1.26 -4.74 116.66 111.26 2byt n ARG 178 Ca 0.03 -0.01 -0.33 0.00 -1.93 0.00 0.00 57.85 55.61 2byt n ARG 178 Cb 0.41 -1.33 -0.07 0.00 -1.16 0.00 0.00 32.46 30.31 2byt n ARG 178 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2byt n HIS 179 N -2.48 3.82 -0.21 -1.55 8.25 -1.24 -4.95 115.22 116.87 2byt n HIS 179 Ca -0.21 -4.08 0.00 0.00 -0.26 0.00 0.00 57.72 53.17 2byt n HIS 179 Cb 0.91 -0.96 0.00 0.00 1.12 0.00 0.00 29.99 31.07 2byt n HIS 179 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2byt n GLU 180 N 1.96 0.68 0.00 -0.41 4.07 -1.23 -1.78 120.64 123.93 2byt n GLU 180 Ca 0.23 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.33 2byt n GLU 180 Cb 0.37 -1.16 0.00 0.00 -0.06 0.00 0.00 31.44 30.59 2byt n GLU 180 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 2byt n ASP 181 N 1.53 0.00 -4.50 4.31 5.75 -1.26 -5.00 116.55 117.38 2byt n ASP 181 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.35 2byt n ASP 181 Cb 0.34 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.35 2byt n ASP 181 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2byt s THR 182 N 0.00 5.01 1.24 2.12 2.01 -0.73 -5.06 115.64 120.23 2byt s THR 182 Ca 0.00 -0.17 -0.18 0.00 0.31 0.00 0.00 61.69 61.66 2byt s THR 182 Cb 0.00 -4.07 0.27 0.00 0.01 0.00 0.00 72.50 68.71 2byt s THR 182 CO 0.00 -0.45 0.67 -2.65 -0.69 0.00 0.00 174.62 171.50 2byt n PRO 183 N 5.78 -3.05 -4.87 4.92 -0.02 -1.26 -3.13 135.00 133.37 2byt n PRO 183 Ca -0.06 -0.88 -0.26 0.00 -2.02 0.00 0.00 63.50 60.28 2byt n PRO 183 Cb 0.48 -1.91 -0.16 0.00 -0.02 0.00 0.00 33.50 31.89 2byt n PRO 183 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2byt s VAL 184 N -2.24 1.46 0.49 -1.45 1.01 -1.25 -4.63 120.40 113.80 2byt s VAL 184 Ca 0.62 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.89 2byt s VAL 184 Cb -0.17 -1.23 -0.00 0.00 0.00 0.00 0.00 36.38 34.98 2byt s VAL 184 CO 0.59 0.42 0.25 -1.61 0.00 0.00 0.00 175.10 174.75 2byt s GLU 185 N -0.20 2.24 0.01 2.72 2.02 -0.49 -4.55 118.70 120.45 2byt s GLU 185 Ca 0.02 -2.04 0.08 0.00 0.02 0.00 0.00 54.97 53.05 2byt s GLU 185 Cb -0.09 -1.95 -0.03 0.00 0.10 0.00 0.00 34.13 32.16 2byt s GLU 185 CO 0.01 -0.40 -0.24 0.15 0.02 0.00 0.00 175.26 174.80 2byt s LYS 186 N -4.08 2.04 -0.04 1.61 1.02 -1.26 0.20 119.74 119.24 2byt s LYS 186 Ca 0.30 -0.98 -0.02 0.00 0.02 0.00 0.00 55.97 55.30 2byt s LYS 186 Cb 0.00 -2.07 0.02 0.00 -0.52 0.00 0.00 37.83 35.27 2byt s LYS 186 CO 0.18 0.55 0.08 1.03 -0.92 0.00 0.00 175.35 176.26 2byt s ARG 187 N -0.95 0.04 -0.43 1.68 0.52 -0.69 -4.91 118.95 114.21 2byt s ARG 187 Ca 0.11 0.21 -0.27 0.00 -0.52 0.00 0.00 55.73 55.26 2byt s ARG 187 Cb -0.10 -0.12 -0.03 0.00 0.52 0.00 0.00 34.95 35.22 2byt s ARG 187 CO 0.01 -0.11 1.94 -2.00 0.02 0.00 0.00 175.30 175.16 2byt s GLU 188 N 0.73 2.92 0.00 3.54 2.56 -1.26 -2.65 118.70 124.53 2byt s GLU 188 Ca -0.06 1.21 -0.09 0.00 0.00 0.00 0.00 54.97 56.03 2byt s GLU 188 Cb -0.08 -4.33 0.01 0.00 2.00 0.00 0.00 34.13 31.73 2byt s GLU 188 CO -0.03 -2.36 0.17 -0.51 -0.56 0.00 0.00 175.26 171.97 2byt s LEU 189 N 8.46 1.42 -0.47 2.70 1.43 -1.19 -4.99 118.68 126.04 2byt s LEU 189 Ca 0.80 -0.16 -0.14 0.00 -1.03 0.00 0.00 54.13 53.59 2byt s LEU 189 Cb -0.19 0.79 0.08 0.00 0.03 0.00 0.00 46.19 46.90 2byt s LEU 189 CO 0.28 -0.39 0.38 -0.70 0.23 0.00 0.00 176.35 176.15 2byt s GLU 190 N -1.42 2.91 0.49 1.70 2.12 -1.26 -3.79 118.70 119.47 2byt s GLU 190 Ca -0.14 -1.39 0.04 0.00 0.36 0.00 0.00 54.97 53.84 2byt s GLU 190 Cb -0.07 -4.08 -0.01 0.00 0.26 0.00 0.00 34.13 30.23 2byt s GLU 190 CO 0.02 -1.03 0.15 -0.65 -0.54 0.00 0.00 175.26 173.21 2byt s GLN 191 N 1.60 2.20 0.01 4.30 -1.52 -0.88 -4.81 119.66 120.56 2byt s GLN 191 Ca 0.04 -2.17 -0.18 0.00 -1.95 0.00 0.00 55.36 51.10 2byt s GLN 191 Cb -0.24 -1.78 -0.06 0.00 -0.22 0.00 0.00 33.01 30.71 2byt s GLN 191 CO 0.06 -0.37 0.50 -1.58 -0.25 0.00 0.00 175.29 173.65 2byt s TRP 192 N -2.78 3.72 0.31 0.91 0.52 -1.26 -1.95 118.94 118.40 2byt s TRP 192 Ca 0.22 1.10 0.08 0.00 0.02 0.00 0.00 56.10 57.53 2byt s TRP 192 Cb 0.02 -2.45 -0.06 0.00 -1.15 0.00 0.00 33.47 29.83 2byt s TRP 192 CO 0.13 0.51 -0.07 0.71 0.02 0.00 0.00 176.95 178.24 2byt s TYR 193 N -0.69 2.15 -0.17 -1.98 1.51 0.29 -1.89 117.35 116.56 2byt s TYR 193 Ca 0.27 -0.61 0.01 0.00 -1.01 0.00 0.00 57.07 55.72 2byt s TYR 193 Cb -0.18 -1.23 0.03 0.00 -0.11 0.00 0.00 41.96 40.47 2byt s TYR 193 CO 0.15 0.41 -0.15 -0.51 -1.11 0.00 0.00 175.55 174.35 2byt s LEU 194 N -3.52 2.00 -0.69 -1.29 1.43 0.48 -1.78 118.68 115.31 2byt s LEU 194 Ca 0.31 -0.65 -0.04 0.00 -1.03 0.00 0.00 54.13 52.71 2byt s LEU 194 Cb 0.03 -1.29 -0.05 0.00 0.03 0.00 0.00 46.19 44.92 2byt s LEU 194 CO 0.14 -0.07 1.90 -1.14 0.23 0.00 0.00 176.35 177.42 2byt n ARG 195 N 4.70 1.64 0.25 1.70 0.63 0.88 -1.40 116.66 125.06 2byt n ARG 195 Ca -0.17 -1.22 0.09 0.00 -0.92 0.00 0.00 57.85 55.63 2byt n ARG 195 Cb 0.49 -2.32 0.64 0.00 0.45 0.00 0.00 32.46 31.72 2byt n ARG 195 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 2byt h ILE 196 N 3.47 0.83 -0.42 5.15 2.10 -1.91 -1.53 117.51 125.20 2byt h ILE 196 Ca 0.38 -0.53 0.11 0.00 1.08 0.00 0.00 64.86 65.90 2byt h ILE 196 Cb 0.17 1.31 -0.02 0.00 -1.09 0.00 0.00 36.82 37.19 2byt h ILE 196 CO 1.29 0.14 0.30 0.71 -1.08 0.00 0.00 178.15 179.51 2byt h THR 197 N 0.00 0.81 0.00 2.19 1.35 -1.88 0.14 112.91 115.53 2byt h THR 197 Ca -0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 2byt h THR 197 Cb 0.30 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 67.48 2byt h THR 197 CO 0.02 0.01 0.31 0.00 -0.25 0.00 0.00 175.52 175.61 2byt h ALA 198 N 1.79 1.28 -0.19 6.62 0.00 -1.66 0.44 119.26 127.54 2byt h ALA 198 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2byt h ALA 198 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2byt h ALA 198 CO -0.01 -0.28 0.00 0.66 0.00 0.00 0.00 179.25 179.62 2byt n TYR 199 N -2.58 0.34 -0.14 0.00 4.02 0.48 -4.76 117.16 114.52 2byt n TYR 199 Ca -0.02 -0.60 -0.04 0.00 -0.01 0.00 0.00 57.90 57.24 2byt n TYR 199 Cb 0.35 -0.08 0.03 0.00 -0.02 0.00 0.00 39.34 39.61 2byt n TYR 199 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2byt h ALA 200 N 1.16 0.31 -0.16 -0.72 0.00 -0.13 0.15 119.26 119.87 2byt h ALA 200 Ca 0.00 0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2byt h ALA 200 Cb 0.78 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2byt h ALA 200 CO 0.03 -0.44 0.07 1.49 0.00 0.00 0.00 179.25 180.40 2byt h GLU 201 N 0.01 0.16 -0.19 0.00 4.57 -1.86 -2.23 114.58 115.03 2byt h GLU 201 Ca 0.22 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.37 2byt h GLU 201 Cb 0.34 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 2byt h GLU 201 CO -0.47 0.11 0.02 0.00 -1.18 0.00 0.00 179.01 177.49 2byt h ARG 202 N 0.16 0.33 -0.80 1.92 3.08 -1.81 0.19 114.38 117.45 2byt h ARG 202 Ca 0.07 -0.09 0.19 0.00 0.07 0.00 0.00 59.98 60.21 2byt h ARG 202 Cb 0.02 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 29.98 2byt h ARG 202 CO -0.05 0.50 0.54 -0.07 -1.07 0.00 0.00 179.97 179.82 2byt h LEU 203 N 0.11 0.28 0.09 3.04 3.38 -0.60 0.29 115.31 121.90 2byt h LEU 203 Ca 0.06 0.02 -0.33 0.00 0.09 0.00 0.00 57.88 57.72 2byt h LEU 203 Cb 0.34 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2byt h LEU 203 CO 0.01 0.13 -1.79 0.25 0.09 0.00 0.00 178.44 177.13 2byt h LEU 204 N 0.29 0.29 -0.50 1.67 5.85 -1.17 -3.38 115.31 118.36 2byt h LEU 204 Ca 0.40 -0.57 -0.17 0.00 0.84 0.00 0.00 57.88 58.38 2byt h LEU 204 Cb 1.12 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 2byt h LEU 204 CO -0.11 1.50 -0.64 0.50 -0.34 0.00 0.00 178.44 179.35 2byt h LYS 205 N 0.05 0.41 -0.16 1.25 3.11 0.50 -3.13 116.57 118.61 2byt h LYS 205 Ca -0.34 -0.30 0.00 0.00 -2.81 0.00 0.00 60.65 57.21 2byt h LYS 205 Cb 2.03 0.05 0.00 0.00 -1.00 0.00 0.00 32.23 33.31 2byt h LYS 205 CO 0.11 0.92 0.00 -0.25 -2.81 0.00 0.00 179.45 177.41 2byt n ASP 206 N -3.89 0.64 0.09 4.20 8.00 0.90 -3.56 116.55 122.94 2byt n ASP 206 Ca -0.03 -2.01 -0.22 0.00 0.71 0.00 0.00 54.79 53.24 2byt n ASP 206 Cb 0.65 -0.10 -0.15 0.00 -0.02 0.00 0.00 41.12 41.50 2byt n ASP 206 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2byt h LEU 207 N 0.61 0.61 -0.73 0.64 3.38 -1.71 -3.38 115.31 114.74 2byt h LEU 207 Ca 0.00 -0.82 0.07 0.00 0.09 0.00 0.00 57.88 57.21 2byt h LEU 207 Cb 0.18 -0.20 -0.09 0.00 0.09 0.00 0.00 40.66 40.64 2byt h LEU 207 CO 0.00 1.68 -0.43 -0.62 0.09 0.00 0.00 178.44 179.16 2byt n GLU 208 N -3.59 -0.32 0.00 1.13 1.02 -1.23 -0.28 120.64 117.37 2byt n GLU 208 Ca -0.20 1.31 0.10 0.00 -0.02 0.00 0.00 57.16 58.34 2byt n GLU 208 Cb 1.07 -1.93 0.50 0.00 -0.02 0.00 0.00 31.44 31.07 2byt n GLU 208 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2byt n GLY 209 N -1.18 -1.10 3.74 0.62 0.00 -1.26 -4.81 105.19 101.19 2byt n GLY 209 Ca 0.01 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 2byt n GLY 209 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2byt s LEU 210 N -2.78 4.39 -1.11 0.99 2.96 0.62 -4.95 118.68 118.81 2byt s LEU 210 Ca 0.15 2.58 -0.08 0.00 -0.22 0.00 0.00 54.13 56.56 2byt s LEU 210 Cb 0.14 -3.61 0.28 0.00 0.50 0.00 0.00 46.19 43.50 2byt s LEU 210 CO 0.35 -0.68 1.18 -3.20 -1.32 0.00 0.00 176.35 172.69 2byt n ASN 211 N 2.72 5.66 -4.67 3.68 5.15 -1.26 -4.99 115.26 121.55 2byt n ASN 211 Ca 0.08 -3.11 -0.28 0.00 -0.60 0.00 0.00 54.58 50.67 2byt n ASN 211 Cb 0.41 -1.35 -0.09 0.00 -0.53 0.00 0.00 39.78 38.21 2byt n ASN 211 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 2byt s TRP 212 N -1.58 2.46 0.07 1.20 0.52 -1.26 -4.17 118.94 116.17 2byt s TRP 212 Ca 0.31 -0.68 -0.31 0.00 0.02 0.00 0.00 56.10 55.44 2byt s TRP 212 Cb -0.07 -1.81 -0.08 0.00 -1.15 0.00 0.00 33.47 30.36 2byt s TRP 212 CO -0.05 0.34 1.54 -2.14 0.02 0.00 0.00 176.95 176.66 2byt s PRO 213 N -3.79 4.24 0.57 4.98 0.02 -1.26 -4.81 135.00 134.94 2byt s PRO 213 Ca 0.34 2.20 0.36 0.00 0.02 0.00 0.00 61.00 63.92 2byt s PRO 213 Cb 0.07 -3.49 1.45 0.00 0.02 0.00 0.00 34.50 32.56 2byt s PRO 213 CO 0.18 -0.64 1.68 1.49 -0.33 0.00 0.00 177.00 179.39 2byt h GLU 214 N 7.79 0.00 -0.61 5.54 4.57 -1.98 0.30 114.58 130.20 2byt h GLU 214 Ca -0.41 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 57.68 2byt h GLU 214 Cb 1.20 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.76 2byt h GLU 214 CO 0.91 0.00 0.04 -0.22 -1.18 0.00 0.00 179.01 178.57 2byt h LYS 215 N 0.00 1.04 -0.01 1.92 3.64 -2.00 -2.72 116.57 118.44 2byt h LYS 215 Ca 0.55 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 2byt h LYS 215 Cb 2.46 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 34.18 2byt h LYS 215 CO -0.01 1.00 -0.06 0.28 -2.27 0.00 0.00 179.45 178.40 2byt h VAL 216 N 0.94 1.55 -0.16 2.00 2.07 -0.77 -3.17 116.25 118.71 2byt h VAL 216 Ca 0.18 -1.71 0.05 0.00 0.82 0.00 0.00 66.70 66.04 2byt h VAL 216 Cb 0.50 2.68 -0.05 0.00 -1.52 0.00 0.00 31.29 32.89 2byt h VAL 216 CO 0.02 0.45 -0.18 0.11 0.02 0.00 0.00 177.57 177.99 2byt h LYS 217 N -0.63 -0.21 -0.60 1.57 1.57 -1.58 -0.52 116.57 116.16 2byt h LYS 217 Ca -0.01 0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.96 2byt h LYS 217 Cb 0.77 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 2byt h LYS 217 CO 0.01 -0.14 0.49 0.00 -0.57 0.00 0.00 179.45 179.24 2byt h ALA 218 N 0.84 2.48 0.04 3.86 0.00 -1.58 0.24 119.26 125.13 2byt h ALA 218 Ca 0.11 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.77 2byt h ALA 218 Cb 0.38 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2byt h ALA 218 CO -0.29 -0.80 -1.02 0.52 0.00 0.00 0.00 179.25 177.67 2byt h MET 219 N 0.00 0.31 -0.03 0.00 2.86 -1.08 -2.42 114.93 114.58 2byt h MET 219 Ca 0.29 -0.39 -0.25 0.00 -2.06 0.00 0.00 59.70 57.29 2byt h MET 219 Cb 1.25 0.12 0.02 0.00 0.06 0.00 0.00 31.60 33.05 2byt h MET 219 CO -0.00 1.10 -0.95 1.96 1.06 0.00 0.00 176.91 180.08 2byt h GLN 220 N 0.15 0.70 -0.37 1.72 4.20 -0.23 -0.09 115.11 121.18 2byt h GLN 220 Ca -0.09 -0.71 0.06 0.00 0.06 0.00 0.00 58.65 57.98 2byt h GLN 220 Cb 1.68 0.19 -0.05 0.00 0.30 0.00 0.00 27.48 29.60 2byt h GLN 220 CO 0.17 1.29 0.04 0.00 -0.67 0.00 0.00 178.83 179.66 2byt h ARG 221 N 0.37 0.14 -0.11 1.46 3.08 -0.71 0.01 114.38 118.63 2byt h ARG 221 Ca -0.11 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 59.83 2byt h ARG 221 Cb 1.60 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.61 2byt h ARG 221 CO 0.19 0.10 -0.41 0.00 -1.07 0.00 0.00 179.97 178.77 2byt h ALA 222 N 1.30 1.11 -0.00 0.04 0.00 -1.38 -0.43 119.26 119.90 2byt h ALA 222 Ca 0.18 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.52 2byt h ALA 222 Cb 0.23 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2byt h ALA 222 CO -0.27 0.59 -0.77 2.35 0.00 0.00 0.00 179.25 181.14 2byt h TRP 223 N 0.20 0.04 0.15 0.00 2.91 -0.12 -3.05 115.95 116.08 2byt h TRP 223 Ca 0.02 -0.02 -0.29 0.00 1.13 0.00 0.00 58.89 59.73 2byt h TRP 223 Cb 0.81 -0.00 0.01 0.00 -0.51 0.00 0.00 29.16 29.47 2byt h TRP 223 CO 0.01 0.79 -1.31 0.82 -1.03 0.00 0.00 178.44 177.73 2byt h ILE 224 N 0.02 1.44 -6.62 2.65 2.04 -0.95 -3.17 117.51 112.92 2byt h ILE 224 Ca -0.01 -2.99 -0.42 0.00 1.00 0.00 0.00 64.86 62.44 2byt h ILE 224 Cb 1.37 2.95 0.02 0.00 -0.74 0.00 0.00 36.82 40.41 2byt h ILE 224 CO 0.10 0.88 -1.20 0.61 0.00 0.00 0.00 178.15 178.54 2byt n GLY 225 N 1.57 -0.17 3.79 5.37 0.00 -0.18 -1.15 105.19 114.42 2byt n GLY 225 Ca -0.10 1.04 -0.35 0.00 0.00 0.00 0.00 46.02 46.60 2byt n GLY 225 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2byt s ARG 226 N -3.06 4.14 -0.23 1.61 3.52 -1.26 -1.88 118.95 121.78 2byt s ARG 226 Ca 0.30 1.40 -0.09 0.00 -0.13 0.00 0.00 55.73 57.21 2byt s ARG 226 Cb -0.03 -2.42 0.10 0.00 -1.56 0.00 0.00 34.95 31.04 2byt s ARG 226 CO 0.88 -0.14 0.51 0.45 -0.81 0.00 0.00 175.30 176.19 2byt s SER 227 N -1.76 -0.62 0.13 -2.12 0.15 -1.04 -4.99 113.70 103.45 2byt s SER 227 Ca 0.60 1.20 -0.21 0.00 0.70 0.00 0.00 55.95 58.24 2byt s SER 227 Cb -0.18 1.58 -0.07 0.00 -1.71 0.00 0.00 66.02 65.63 2byt s SER 227 CO 0.23 -0.22 0.65 -1.61 1.20 0.00 0.00 173.24 173.49 2byt s GLU 228 N 2.48 4.31 0.00 5.44 2.02 -1.26 -2.56 118.70 129.12 2byt s GLU 228 Ca -0.05 0.87 0.00 0.00 0.02 0.00 0.00 54.97 55.82 2byt s GLU 228 Cb -0.11 -3.18 0.00 0.00 0.10 0.00 0.00 34.13 30.94 2byt s GLU 228 CO -0.15 0.58 0.00 0.41 0.02 0.00 0.00 175.26 176.11 2byt n GLY 229 N 1.48 1.47 3.04 -1.39 0.00 -0.01 -4.67 105.19 105.12 2byt n GLY 229 Ca -0.07 -0.40 -0.16 0.00 0.00 0.00 0.00 46.02 45.39 2byt n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2byt s ALA 230 N -1.00 0.67 -0.48 4.61 0.00 0.42 -0.62 121.76 125.35 2byt s ALA 230 Ca 0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 51.96 51.31 2byt s ALA 230 Cb 0.00 -0.08 0.12 0.00 0.00 0.00 0.00 23.12 23.16 2byt s ALA 230 CO 0.00 0.09 0.36 -2.00 0.00 0.00 0.00 175.76 174.21 2byt s GLU 231 N -0.86 2.51 0.15 0.00 2.12 0.14 -0.62 118.70 122.13 2byt s GLU 231 Ca -0.02 -1.80 -0.07 0.00 0.36 0.00 0.00 54.97 53.44 2byt s GLU 231 Cb -0.06 -3.94 -0.06 0.00 0.26 0.00 0.00 34.13 30.33 2byt s GLU 231 CO 0.00 -1.20 0.42 0.42 -0.54 0.00 0.00 175.26 174.37 2byt s ILE 232 N 1.31 5.09 -0.18 -3.70 1.01 -0.14 -1.90 121.20 122.70 2byt s ILE 232 Ca 0.06 0.23 -0.04 0.00 0.00 0.00 0.00 60.65 60.91 2byt s ILE 232 Cb -0.26 -3.63 -0.02 0.00 0.01 0.00 0.00 42.46 38.56 2byt s ILE 232 CO -0.01 0.07 -0.04 -0.76 0.00 0.00 0.00 174.94 174.19 2byt s LEU 233 N -2.53 3.08 -0.26 2.97 1.43 0.34 -0.61 118.68 123.10 2byt s LEU 233 Ca 0.41 -0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 53.21 2byt s LEU 233 Cb -0.12 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 44.34 2byt s LEU 233 CO 0.22 0.09 0.03 -0.36 0.23 0.00 0.00 176.35 176.56 2byt s PHE 234 N 0.81 3.07 0.38 0.29 0.40 0.46 -4.68 117.98 118.71 2byt s PHE 234 Ca -0.01 -0.96 -0.26 0.00 -0.60 0.00 0.00 56.93 55.10 2byt s PHE 234 Cb -0.15 -2.18 -0.09 0.00 0.51 0.00 0.00 43.02 41.11 2byt s PHE 234 CO 0.02 -0.55 1.20 -2.14 0.70 0.00 0.00 175.22 174.45 2byt s PRO 235 N 1.49 4.14 0.03 0.24 0.02 -1.25 -0.05 135.00 139.62 2byt s PRO 235 Ca 0.04 1.94 -0.20 0.00 0.02 0.00 0.00 61.00 62.81 2byt s PRO 235 Cb -0.16 -2.80 -0.06 0.00 0.02 0.00 0.00 34.50 31.50 2byt s PRO 235 CO 0.00 -0.27 0.57 0.08 -0.33 0.00 0.00 177.00 177.05 2byt s VAL 236 N -1.32 4.85 0.00 3.83 1.01 -1.01 0.00 120.40 127.76 2byt s VAL 236 Ca 0.55 1.21 -0.32 0.00 0.00 0.00 0.00 61.98 63.41 2byt s VAL 236 Cb -0.33 -3.90 -0.11 0.00 0.00 0.00 0.00 36.38 32.04 2byt s VAL 236 CO 0.43 0.48 1.90 1.21 0.00 0.00 0.00 175.10 179.12 2byt n GLU 237 N 2.28 2.53 0.00 2.72 2.13 -1.02 -2.73 120.64 126.55 2byt n GLU 237 Ca -0.09 0.93 0.00 0.00 0.66 0.00 0.00 57.16 58.66 2byt n GLU 237 Cb 0.51 -2.82 0.00 0.00 0.27 0.00 0.00 31.44 29.40 2byt n GLU 237 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2byt n GLY 238 N 4.39 1.35 3.57 8.31 0.00 -1.26 -4.89 105.19 116.66 2byt n GLY 238 Ca 0.21 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2byt n GLY 238 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2byt s LYS 239 N 0.00 -0.36 -0.10 1.61 -0.14 -1.10 -4.98 119.74 114.66 2byt s LYS 239 Ca 0.00 0.73 0.16 0.00 -1.36 0.00 0.00 55.97 55.50 2byt s LYS 239 Cb 0.00 -1.63 -0.23 0.00 -1.68 0.00 0.00 37.83 34.29 2byt s LYS 239 CO 0.00 -3.32 0.42 0.39 -0.76 0.00 0.00 175.35 172.08 2byt n GLU 240 N -4.62 0.66 -1.84 1.68 4.71 -1.26 -4.63 120.64 115.34 2byt n GLU 240 Ca 0.04 0.13 -0.34 0.00 -0.01 0.00 0.00 57.16 56.98 2byt n GLU 240 Cb 0.55 -1.66 0.04 0.00 -1.01 0.00 0.00 31.44 29.36 2byt n GLU 240 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2byt s VAL 241 N -2.64 3.13 0.00 2.62 0.11 -1.26 -4.90 120.40 117.47 2byt s VAL 241 Ca -0.07 0.57 0.07 0.00 -2.93 0.00 0.00 61.98 59.62 2byt s VAL 241 Cb 0.08 -3.11 -0.02 0.00 -1.53 0.00 0.00 36.38 31.80 2byt s VAL 241 CO 0.83 -0.29 -0.21 -0.13 -3.33 0.00 0.00 175.10 171.97 2byt s ARG 242 N -3.89 1.65 -0.29 1.54 0.52 -1.26 -2.40 118.95 114.82 2byt s ARG 242 Ca 0.69 -0.83 -0.11 0.00 -0.52 0.00 0.00 55.73 54.96 2byt s ARG 242 Cb -0.22 -1.65 -0.04 0.00 0.52 0.00 0.00 34.95 33.56 2byt s ARG 242 CO 0.39 0.44 0.18 0.42 0.02 0.00 0.00 175.30 176.75 2byt s ILE 243 N -0.59 5.08 -0.01 1.52 1.01 0.93 -4.86 121.20 124.28 2byt s ILE 243 Ca 0.08 -0.00 -0.23 0.00 0.00 0.00 0.00 60.65 60.50 2byt s ILE 243 Cb -0.08 -3.46 -0.05 0.00 0.01 0.00 0.00 42.46 38.87 2byt s ILE 243 CO 0.00 0.20 0.69 -2.84 0.00 0.00 0.00 174.94 172.99 2byt s PRO 244 N 1.72 4.42 0.05 2.79 0.02 -1.26 -0.40 135.00 142.33 2byt s PRO 244 Ca 0.07 0.90 0.04 0.00 0.02 0.00 0.00 61.00 62.03 2byt s PRO 244 Cb -0.16 -3.39 -0.02 0.00 0.02 0.00 0.00 34.50 30.95 2byt s PRO 244 CO 0.09 0.23 -0.12 0.14 -0.33 0.00 0.00 177.00 177.02 2byt s VAL 245 N 0.19 0.95 0.07 3.83 -7.23 0.22 -4.44 120.40 113.99 2byt s VAL 245 Ca 0.36 -1.06 0.01 0.00 -1.81 0.00 0.00 61.98 59.48 2byt s VAL 245 Cb -0.19 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.81 2byt s VAL 245 CO 0.20 -0.14 0.19 0.12 -0.31 0.00 0.00 175.10 175.16 2byt s PHE 246 N -1.04 3.45 -0.28 2.82 5.36 -1.23 -0.96 117.98 126.10 2byt s PHE 246 Ca -0.02 0.21 -0.16 0.00 -0.96 0.00 0.00 56.93 56.00 2byt s PHE 246 Cb -0.09 -1.73 0.09 0.00 -0.34 0.00 0.00 43.02 40.96 2byt s PHE 246 CO 0.01 0.57 0.73 -0.08 -1.46 0.00 0.00 175.22 175.00 2byt s THR 247 N -1.50 -0.05 -1.65 0.12 -1.32 0.21 -4.69 115.64 106.75 2byt s THR 247 Ca 0.34 0.00 0.11 0.00 -1.21 0.00 0.00 61.69 60.92 2byt s THR 247 Cb -0.13 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.22 2byt s THR 247 CO 0.27 0.00 1.24 0.35 -2.21 0.00 0.00 174.62 174.27 2byt n THR 248 N 4.29 0.74 -2.90 5.08 -2.24 -1.26 -0.44 114.28 117.55 2byt n THR 248 Ca -0.19 -0.56 -0.13 0.00 -2.27 0.00 0.00 64.05 60.90 2byt n THR 248 Cb 0.58 0.09 0.02 0.00 -2.10 0.00 0.00 70.33 68.92 2byt n THR 248 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2byt n ARG 249 N 0.54 1.06 0.21 -0.78 5.12 -1.26 -4.93 116.66 116.62 2byt n ARG 249 Ca 0.13 -3.04 0.14 0.00 -1.93 0.00 0.00 57.85 53.15 2byt n ARG 249 Cb 0.42 -1.31 0.72 0.00 -1.16 0.00 0.00 32.46 31.13 2byt n ARG 249 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2byt h PRO 250 N 2.91 0.00 -0.21 5.56 0.13 -1.93 -2.39 132.00 136.08 2byt h PRO 250 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2byt h PRO 250 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2byt h PRO 250 CO 0.41 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.78 2byt n ASP 251 N -2.50 0.21 0.00 1.44 5.75 -1.26 -1.86 116.55 118.33 2byt n ASP 251 Ca -0.01 -1.22 0.00 0.00 -0.01 0.00 0.00 54.79 53.55 2byt n ASP 251 Cb 0.09 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 2byt n ASP 251 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2byt n THR 252 N -0.26 0.28 -0.33 2.12 -2.24 -0.90 -4.83 114.28 108.11 2byt n THR 252 Ca 0.00 -0.38 0.26 0.00 -2.27 0.00 0.00 64.05 61.66 2byt n THR 252 Cb 0.05 1.08 0.51 0.00 -2.10 0.00 0.00 70.33 69.87 2byt n THR 252 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2byt h LEU 253 N 0.00 0.36 0.00 3.22 5.85 -1.55 1.76 115.31 124.94 2byt h LEU 253 Ca 0.00 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.95 2byt h LEU 253 Cb 0.55 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.80 2byt h LEU 253 CO 0.00 -0.28 0.00 0.49 -0.34 0.00 0.00 178.44 178.31 2byt n PHE 254 N -5.17 0.00 0.73 1.25 3.01 -1.26 -1.72 117.46 114.30 2byt n PHE 254 Ca 0.34 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.87 2byt n PHE 254 Cb 1.09 -0.16 -0.05 0.00 -0.01 0.00 0.00 39.48 40.35 2byt n PHE 254 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2byt n GLY 255 N -0.35 -0.27 3.65 1.37 0.00 0.60 -4.94 105.19 105.25 2byt n GLY 255 Ca 0.06 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 2byt n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2byt s ALA 256 N -2.23 3.54 -1.53 4.61 0.00 -0.70 -4.42 121.76 121.04 2byt s ALA 256 Ca 0.09 0.93 0.14 0.00 0.00 0.00 0.00 51.96 53.13 2byt s ALA 256 Cb 0.12 -3.79 0.05 0.00 0.00 0.00 0.00 23.12 19.51 2byt s ALA 256 CO 0.54 -1.54 0.86 0.25 0.00 0.00 0.00 175.76 175.87 2byt n THR 257 N 5.68 0.00 -3.61 0.00 -2.24 -0.72 -5.00 114.28 108.40 2byt n THR 257 Ca 0.18 -0.43 -0.02 0.00 -2.27 0.00 0.00 64.05 61.51 2byt n THR 257 Cb 0.43 1.23 -0.01 0.00 -2.10 0.00 0.00 70.33 69.87 2byt n THR 257 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 2byt s PHE 258 N -1.46 -0.11 0.21 4.78 -0.71 -1.25 -4.22 117.98 115.22 2byt s PHE 258 Ca 0.14 0.02 0.10 0.00 -1.04 0.00 0.00 56.93 56.16 2byt s PHE 258 Cb 0.12 0.53 -0.04 0.00 -1.21 0.00 0.00 43.02 42.42 2byt s PHE 258 CO 0.27 -0.28 -0.14 -0.51 -1.34 0.00 0.00 175.22 173.21 2byt s LEU 259 N -2.52 2.78 -0.05 -1.99 1.43 -0.91 -0.19 118.68 117.23 2byt s LEU 259 Ca 0.11 -0.75 -0.02 0.00 -1.03 0.00 0.00 54.13 52.45 2byt s LEU 259 Cb 0.01 -1.43 0.03 0.00 0.03 0.00 0.00 46.19 44.83 2byt s LEU 259 CO -0.04 0.09 0.03 -0.69 0.23 0.00 0.00 176.35 175.96 2byt s VAL 260 N -1.90 0.12 0.16 -1.59 1.01 -0.92 -0.53 120.40 116.75 2byt s VAL 260 Ca 0.25 0.27 -0.01 0.00 0.00 0.00 0.00 61.98 62.49 2byt s VAL 260 Cb -0.08 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 2byt s VAL 260 CO 0.14 0.21 0.34 -0.76 0.00 0.00 0.00 175.10 175.04 2byt s LEU 261 N 2.01 4.27 0.27 3.92 1.43 -0.35 -2.26 118.68 127.97 2byt s LEU 261 Ca 0.04 0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 53.24 2byt s LEU 261 Cb -0.12 -3.13 -0.09 0.00 0.03 0.00 0.00 46.19 42.87 2byt s LEU 261 CO -0.04 0.03 1.10 0.00 0.23 0.00 0.00 176.35 177.67 2byt s ALA 262 N -1.74 3.41 0.28 4.21 0.00 0.10 -2.94 121.76 125.08 2byt s ALA 262 Ca 0.38 0.89 -0.07 0.00 0.00 0.00 0.00 51.96 53.16 2byt s ALA 262 Cb -0.12 -3.33 0.48 0.00 0.00 0.00 0.00 23.12 20.15 2byt s ALA 262 CO 0.28 -0.17 1.57 -1.35 0.00 0.00 0.00 175.76 176.09 2byt h PRO 263 N 3.99 0.00 0.00 0.00 0.11 -1.82 1.25 132.00 135.54 2byt h PRO 263 Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2byt h PRO 263 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2byt h PRO 263 CO 0.68 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.86 2byt n GLU 264 N -5.59 0.76 -1.96 1.05 4.71 -1.26 -4.79 120.64 113.55 2byt n GLU 264 Ca 0.16 0.01 -0.41 0.00 -0.01 0.00 0.00 57.16 56.91 2byt n GLU 264 Cb 0.52 -1.50 -0.02 0.00 -1.01 0.00 0.00 31.44 29.43 2byt n GLU 264 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 2byt s HIS 265 N -2.08 2.88 0.13 -0.32 2.46 0.43 -4.92 115.29 113.87 2byt s HIS 265 Ca 0.37 1.16 -0.23 0.00 0.47 0.00 0.00 55.06 56.83 2byt s HIS 265 Cb 0.18 -3.86 -0.02 0.00 -0.13 0.00 0.00 32.58 28.75 2byt s HIS 265 CO 0.31 -2.60 1.65 -1.35 -2.47 0.00 0.00 174.74 170.28 2byt h PRO 266 N 3.92 -0.25 0.00 2.88 0.11 -1.87 -2.16 132.00 134.63 2byt h PRO 266 Ca -0.48 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2byt h PRO 266 Cb 1.23 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2byt h PRO 266 CO 0.70 -0.17 0.00 1.28 -0.21 0.00 0.00 178.00 179.61 2byt n LEU 267 N -5.33 0.00 0.22 2.35 4.77 -1.26 -2.47 117.00 115.27 2byt n LEU 267 Ca -0.03 0.14 0.08 0.00 -0.03 0.00 0.00 56.01 56.18 2byt n LEU 267 Cb 0.25 -0.14 0.47 0.00 -2.33 0.00 0.00 43.42 41.67 2byt n LEU 267 CO 0.20 -0.10 0.79 0.74 -1.33 0.00 0.00 177.39 177.69 2byt h THR 268 N 0.00 0.73 0.00 -5.08 2.02 -1.69 -2.74 112.91 106.15 2byt h THR 268 Ca 0.00 -1.13 -0.12 0.00 0.77 0.00 0.00 66.41 65.93 2byt h THR 268 Cb 0.04 1.71 -0.02 0.00 -1.74 0.00 0.00 68.15 68.14 2byt h THR 268 CO 0.00 0.26 -1.45 0.18 0.37 0.00 0.00 175.52 174.88 2byt n LEU 269 N -3.56 0.33 0.04 2.58 4.77 -1.03 -3.68 117.00 116.45 2byt n LEU 269 Ca -0.01 -0.01 0.09 0.00 -0.03 0.00 0.00 56.01 56.05 2byt n LEU 269 Cb 0.41 0.11 0.37 0.00 -2.33 0.00 0.00 43.42 41.98 2byt n LEU 269 CO 0.34 0.22 0.77 1.21 -1.33 0.00 0.00 177.39 178.60 2byt n GLU 270 N -2.30 0.06 -0.01 3.23 2.13 -1.14 -2.82 120.64 119.80 2byt n GLU 270 Ca -0.11 0.31 0.01 0.00 0.66 0.00 0.00 57.16 58.03 2byt n GLU 270 Cb 0.71 -1.62 -0.04 0.00 0.27 0.00 0.00 31.44 30.75 2byt n GLU 270 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2byt n LEU 271 N -1.75 0.00 -4.69 4.31 4.77 -1.03 -5.02 117.00 113.59 2byt n LEU 271 Ca 0.03 0.00 -0.53 0.00 -0.03 0.00 0.00 56.01 55.48 2byt n LEU 271 Cb 0.19 0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.26 2byt n LEU 271 CO 0.15 0.05 1.42 0.00 -1.33 0.00 0.00 177.39 177.68 2byt n ALA 272 N -1.88 0.35 -1.77 -1.18 0.00 -1.13 -4.66 120.51 110.24 2byt n ALA 272 Ca -0.04 0.32 -0.41 0.00 0.00 0.00 0.00 53.44 53.32 2byt n ALA 272 Cb 0.35 -2.36 -0.00 0.00 0.00 0.00 0.00 19.45 17.43 2byt n ALA 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2byt n ALA 273 N 6.14 2.42 0.23 0.00 0.00 -0.33 -4.62 120.51 124.35 2byt n ALA 273 Ca 0.25 0.34 0.17 0.00 0.00 0.00 0.00 53.44 54.21 2byt n ALA 273 Cb 0.21 -2.43 0.76 0.00 0.00 0.00 0.00 19.45 17.99 2byt n ALA 273 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2byt h PRO 274 N 3.18 0.00 0.00 0.00 0.11 -1.92 0.78 132.00 134.15 2byt h PRO 274 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2byt h PRO 274 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2byt h PRO 274 CO 0.66 0.00 -0.63 0.39 -0.21 0.00 0.00 178.00 178.21 2byt n GLU 275 N -3.21 0.20 -0.03 1.05 4.71 -1.26 -3.94 120.64 118.15 2byt n GLU 275 Ca 0.02 0.05 0.01 0.00 -0.01 0.00 0.00 57.16 57.23 2byt n GLU 275 Cb 0.51 -1.62 -0.11 0.00 -1.01 0.00 0.00 31.44 29.22 2byt n GLU 275 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2byt n LYS 276 N -1.90 1.07 -0.34 3.49 4.76 0.22 -4.70 118.16 120.75 2byt n LYS 276 Ca 0.04 -0.07 -0.01 0.00 -2.87 0.00 0.00 58.31 55.40 2byt n LYS 276 Cb 0.41 -1.34 0.05 0.00 -1.84 0.00 0.00 35.03 32.31 2byt n LYS 276 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 2byt h ARG 277 N 0.00 -0.03 0.00 1.97 9.65 -0.12 0.30 114.38 126.15 2byt h ARG 277 Ca -0.17 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.72 2byt h ARG 277 Cb 1.19 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.78 2byt h ARG 277 CO 0.01 -0.02 0.03 -1.91 2.80 0.00 0.00 179.97 180.88 2byt n GLU 278 N -5.49 0.00 -0.02 0.20 2.13 -1.26 -1.04 120.64 115.16 2byt n GLU 278 Ca 0.10 0.21 -0.03 0.00 0.66 0.00 0.00 57.16 58.10 2byt n GLU 278 Cb 0.41 -1.53 -0.02 0.00 0.27 0.00 0.00 31.44 30.56 2byt n GLU 278 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2byt n GLU 279 N -1.18 0.81 -0.05 5.31 2.13 0.94 -4.30 120.64 124.30 2byt n GLU 279 Ca 0.00 0.02 -0.12 0.00 0.66 0.00 0.00 57.16 57.72 2byt n GLU 279 Cb 0.03 -1.10 -0.06 0.00 0.27 0.00 0.00 31.44 30.58 2byt n GLU 279 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2byt h VAL 280 N 0.00 1.27 0.00 6.31 2.07 -0.46 -1.75 116.25 123.68 2byt h VAL 280 Ca -0.11 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.47 2byt h VAL 280 Cb 1.18 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 2byt h VAL 280 CO -0.01 0.26 -0.21 0.25 0.02 0.00 0.00 177.57 177.89 2byt h LEU 281 N -0.01 0.00 0.00 2.57 6.46 -1.35 -1.86 115.31 121.12 2byt h LEU 281 Ca 0.04 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.76 2byt h LEU 281 Cb 0.41 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.33 2byt h LEU 281 CO 0.01 0.21 -0.22 0.00 -0.62 0.00 0.00 178.44 177.82 2byt h ALA 282 N 1.79 0.87 0.14 1.25 0.00 -1.69 -3.10 119.26 118.53 2byt h ALA 282 Ca -0.00 -0.17 -0.28 0.00 0.00 0.00 0.00 54.91 54.45 2byt h ALA 282 Cb 0.45 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.22 2byt h ALA 282 CO 0.03 0.24 -1.30 -0.92 0.00 0.00 0.00 179.25 177.30 2byt h TYR 283 N 0.00 0.55 0.05 0.00 5.03 -0.53 -3.13 116.97 118.94 2byt h TYR 283 Ca -0.00 -0.40 -0.00 0.00 2.58 0.00 0.00 58.73 60.90 2byt h TYR 283 Cb 1.15 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 39.40 2byt h TYR 283 CO 0.00 1.32 -0.02 0.28 -1.32 0.00 0.00 178.16 178.42 2byt h VAL 284 N 0.08 1.11 0.00 1.81 2.07 -1.46 -1.58 116.25 118.28 2byt h VAL 284 Ca -0.16 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 66.85 2byt h VAL 284 Cb 2.00 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 33.21 2byt h VAL 284 CO 0.21 0.13 0.00 -0.62 0.02 0.00 0.00 177.57 177.31 2byt n GLU 285 N -5.01 0.09 -0.07 1.57 1.02 -1.17 -0.73 120.64 116.33 2byt n GLU 285 Ca -0.08 0.23 -0.19 0.00 -0.02 0.00 0.00 57.16 57.10 2byt n GLU 285 Cb 0.15 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.94 2byt n GLU 285 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2byt n ALA 286 N -1.30 1.23 0.00 0.62 0.00 -0.87 -3.79 120.51 116.41 2byt n ALA 286 Ca 0.03 -0.91 -0.19 0.00 0.00 0.00 0.00 53.44 52.38 2byt n ALA 286 Cb 0.06 -0.35 -0.09 0.00 0.00 0.00 0.00 19.45 19.07 2byt n ALA 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2byt h ALA 287 N 0.09 0.22 -0.37 0.00 0.00 -0.45 -2.28 119.26 116.47 2byt h ALA 287 Ca -0.51 -0.64 -0.03 0.00 0.00 0.00 0.00 54.91 53.73 2byt h ALA 287 Cb 1.97 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.76 2byt h ALA 287 CO -0.01 0.67 0.10 -0.22 0.00 0.00 0.00 179.25 179.79 2byt h LYS 288 N 0.47 0.53 0.00 0.00 3.64 -1.14 -2.69 116.57 117.38 2byt h LYS 288 Ca -0.09 -0.08 -0.19 0.00 -1.27 0.00 0.00 60.65 59.02 2byt h LYS 288 Cb 1.52 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 33.22 2byt h LYS 288 CO 0.18 0.49 -0.97 -0.09 -2.27 0.00 0.00 179.45 176.79 2byt h ARG 289 N 0.53 0.00 -7.28 1.90 2.43 -1.64 -3.39 114.38 106.93 2byt h ARG 289 Ca 0.13 0.00 -0.47 0.00 -0.81 0.00 0.00 59.98 58.82 2byt h ARG 289 Cb 0.19 0.00 0.17 0.00 -0.42 0.00 0.00 29.97 29.91 2byt h ARG 289 CO -0.01 0.82 0.17 0.21 -1.51 0.00 0.00 179.97 179.66 2byt s LYS 290 N -2.76 0.51 0.23 0.20 2.20 -0.86 -4.95 119.74 114.31 2byt s LYS 290 Ca 0.01 0.89 0.03 0.00 -0.36 0.00 0.00 55.97 56.53 2byt s LYS 290 Cb 0.09 -1.72 -0.01 0.00 -1.51 0.00 0.00 37.83 34.68 2byt s LYS 290 CO 0.80 -2.77 0.11 0.25 -0.36 0.00 0.00 175.35 173.38 2byt n THR 291 N -4.26 0.00 -0.05 3.43 -2.24 -1.26 -4.82 114.28 105.08 2byt n THR 291 Ca 0.06 -1.43 -0.12 0.00 -2.27 0.00 0.00 64.05 60.30 2byt n THR 291 Cb 0.55 0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 69.28 2byt n THR 291 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2byt h GLU 292 N 0.00 0.29 0.00 -0.78 4.39 -1.85 0.16 114.58 116.79 2byt h GLU 292 Ca -0.18 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.38 2byt h GLU 292 Cb 0.72 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.35 2byt h GLU 292 CO 0.28 0.54 -0.18 0.82 -1.16 0.00 0.00 179.01 179.31 2byt h ILE 293 N 0.01 0.78 0.12 3.13 2.04 -1.86 -1.77 117.51 119.95 2byt h ILE 293 Ca 0.04 -0.70 -0.17 0.00 1.00 0.00 0.00 64.86 65.03 2byt h ILE 293 Cb 0.43 1.42 0.02 0.00 -0.74 0.00 0.00 36.82 37.94 2byt h ILE 293 CO 0.01 0.17 -0.77 -0.33 0.00 0.00 0.00 178.15 177.23 2byt h GLU 294 N 0.00 0.25 -0.34 2.37 5.08 -1.92 -3.15 114.58 116.87 2byt h GLU 294 Ca -0.00 -0.43 0.02 0.00 -1.00 0.00 0.00 59.36 57.95 2byt h GLU 294 Cb 0.41 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 2byt h GLU 294 CO 0.02 1.21 0.18 0.00 -1.00 0.00 0.00 179.01 179.41 2byt h ARG 295 N -0.46 0.35 0.00 2.33 3.08 -0.48 0.30 114.38 119.51 2byt h ARG 295 Ca -0.14 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.89 2byt h ARG 295 Cb 1.57 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.54 2byt h ARG 295 CO 0.12 0.23 0.00 1.04 -1.07 0.00 0.00 179.97 180.29 2byt n GLN 296 N -4.93 0.17 0.04 0.04 1.13 -0.68 -1.85 117.38 111.28 2byt n GLN 296 Ca 0.00 0.17 -0.01 0.00 -1.94 0.00 0.00 57.00 55.22 2byt n GLN 296 Cb 0.08 -1.50 -0.08 0.00 0.11 0.00 0.00 30.24 28.85 2byt n GLN 296 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2byt h ALA 297 N 2.61 0.66 0.00 -1.58 0.00 -0.89 -3.33 119.26 116.73 2byt h ALA 297 Ca 0.00 -0.88 -0.11 0.00 0.00 0.00 0.00 54.91 53.91 2byt h ALA 297 Cb 0.13 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2byt h ALA 297 CO 0.00 0.98 -0.62 0.93 0.00 0.00 0.00 179.25 180.54 2byt h GLU 298 N 0.00 0.00 0.00 0.00 5.08 -1.14 -3.50 114.58 115.02 2byt h GLU 298 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2byt h GLU 298 Cb 1.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.87 2byt h GLU 298 CO 0.05 0.46 0.00 0.41 -1.00 0.00 0.00 179.01 178.93 2byt n GLY 299 N 1.25 0.56 1.74 -3.84 0.00 -1.20 -4.08 105.19 99.62 2byt n GLY 299 Ca 0.00 -1.43 0.07 0.00 0.00 0.00 0.00 46.02 44.67 2byt n GLY 299 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2byt n ARG 300 N 3.24 4.55 -1.91 1.61 1.85 -1.26 -4.83 116.66 119.91 2byt n ARG 300 Ca 0.00 -3.10 -0.43 0.00 -1.00 0.00 0.00 57.85 53.32 2byt n ARG 300 Cb 0.00 -2.18 -0.03 0.00 -1.05 0.00 0.00 32.46 29.21 2byt n ARG 300 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2byt s GLU 301 N -2.67 3.46 0.27 2.89 0.41 -1.26 -4.95 118.70 116.85 2byt s GLU 301 Ca 0.53 1.72 -0.29 0.00 -0.41 0.00 0.00 54.97 56.51 2byt s GLU 301 Cb 0.40 -4.20 -0.10 0.00 -1.78 0.00 0.00 34.13 28.45 2byt s GLU 301 CO 0.16 -1.72 1.28 0.15 -0.49 0.00 0.00 175.26 174.65 2byt s LYS 302 N 5.50 4.41 -0.16 1.61 3.01 -1.26 -5.03 119.74 127.82 2byt s LYS 302 Ca 0.83 2.10 -0.06 0.00 -1.01 0.00 0.00 55.97 57.83 2byt s LYS 302 Cb -0.27 -3.13 0.07 0.00 -1.01 0.00 0.00 37.83 33.49 2byt s LYS 302 CO 0.34 -0.15 0.34 0.99 0.51 0.00 0.00 175.35 177.38 2byt s THR 303 N -0.66 -0.38 0.12 2.17 2.01 -1.26 -5.06 115.64 112.58 2byt s THR 303 Ca 0.51 0.19 -0.02 0.00 0.31 0.00 0.00 61.69 62.68 2byt s THR 303 Cb -0.37 -0.55 0.01 0.00 0.01 0.00 0.00 72.50 71.60 2byt s THR 303 CO 0.45 0.08 0.20 0.61 -0.69 0.00 0.00 174.62 175.27 2byt n GLY 304 N 5.02 2.40 3.10 4.40 0.00 -1.26 -3.31 105.19 115.54 2byt n GLY 304 Ca -0.13 -1.33 -0.11 0.00 0.00 0.00 0.00 46.02 44.45 2byt n GLY 304 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2byt s VAL 305 N -2.61 0.08 -0.07 1.61 1.01 -0.15 -4.97 120.40 115.31 2byt s VAL 305 Ca 0.08 -0.65 -0.24 0.00 0.00 0.00 0.00 61.98 61.17 2byt s VAL 305 Cb -0.01 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 2byt s VAL 305 CO 0.06 -0.36 0.74 0.12 0.00 0.00 0.00 175.10 175.66 2byt s PHE 306 N -1.29 3.57 -0.97 5.22 5.36 -1.26 -0.19 117.98 128.41 2byt s PHE 306 Ca -0.14 1.29 0.22 0.00 -0.96 0.00 0.00 56.93 57.34 2byt s PHE 306 Cb -0.07 -2.85 0.91 0.00 -0.34 0.00 0.00 43.02 40.67 2byt s PHE 306 CO 0.01 0.05 1.69 1.28 -1.46 0.00 0.00 175.22 176.79 2byt n LEU 307 N 3.91 0.05 -1.22 6.12 4.77 -0.37 -4.90 117.00 125.36 2byt n LEU 307 Ca -0.00 0.51 -0.11 0.00 -0.03 0.00 0.00 56.01 56.37 2byt n LEU 307 Cb 0.51 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 2byt n LEU 307 CO 0.48 -0.15 -0.14 0.61 -1.33 0.00 0.00 177.39 176.86 2byt n GLY 308 N 0.70 0.16 3.17 -0.72 0.00 -1.26 -1.18 105.19 106.06 2byt n GLY 308 Ca 0.05 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 2byt n GLY 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2byt s ALA 309 N -2.54 0.96 0.32 4.61 0.00 -1.26 -4.37 121.76 119.48 2byt s ALA 309 Ca 0.00 -1.41 0.06 0.00 0.00 0.00 0.00 51.96 50.61 2byt s ALA 309 Cb 0.00 0.42 -0.06 0.00 0.00 0.00 0.00 23.12 23.48 2byt s ALA 309 CO 0.00 -0.33 -0.02 0.71 0.00 0.00 0.00 175.76 176.12 2byt s TYR 310 N -3.78 2.11 0.23 0.00 1.51 -1.26 -2.13 117.35 114.04 2byt s TYR 310 Ca 0.16 -0.74 0.01 0.00 -1.01 0.00 0.00 57.07 55.50 2byt s TYR 310 Cb 0.06 -1.31 -0.05 0.00 -0.11 0.00 0.00 41.96 40.56 2byt s TYR 310 CO -0.02 0.28 0.07 0.00 -1.11 0.00 0.00 175.55 174.77 2byt s ALA 311 N -2.98 1.59 -0.23 3.71 0.00 -0.79 -2.43 121.76 120.62 2byt s ALA 311 Ca 0.33 -1.78 -0.03 0.00 0.00 0.00 0.00 51.96 50.47 2byt s ALA 311 Cb 0.06 0.93 0.00 0.00 0.00 0.00 0.00 23.12 24.11 2byt s ALA 311 CO 0.14 -0.43 -0.04 -0.51 0.00 0.00 0.00 175.76 174.92 2byt s LEU 312 N -3.26 2.98 -0.30 0.00 2.01 0.10 -1.73 118.68 118.48 2byt s LEU 312 Ca 0.34 -0.52 -0.28 0.00 0.01 0.00 0.00 54.13 53.67 2byt s LEU 312 Cb 0.07 -1.72 -0.02 0.00 0.01 0.00 0.00 46.19 44.53 2byt s LEU 312 CO 0.11 -0.05 1.84 0.21 1.01 0.00 0.00 176.35 179.47 2byt s ASN 313 N 1.44 5.89 0.00 2.29 3.84 0.58 -3.82 114.94 125.16 2byt s ASN 313 Ca 0.04 1.44 0.04 0.00 0.21 0.00 0.00 52.86 54.59 2byt s ASN 313 Cb -0.15 -2.52 0.21 0.00 -0.55 0.00 0.00 41.25 38.24 2byt s ASN 313 CO -0.04 -1.69 0.63 -0.81 -2.79 0.00 0.00 177.10 172.41 2byt n PRO 314 N 8.39 0.13 -0.03 0.43 -0.04 -1.26 0.54 135.00 143.15 2byt n PRO 314 Ca 0.23 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.66 2byt n PRO 314 Cb 0.46 -1.42 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 2byt n PRO 314 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2byt n ALA 315 N -0.92 0.33 0.13 0.55 0.00 -1.26 -4.67 120.51 114.67 2byt n ALA 315 Ca 0.03 -0.46 0.01 0.00 0.00 0.00 0.00 53.44 53.02 2byt n ALA 315 Cb 0.01 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.48 2byt n ALA 315 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2byt h THR 316 N -0.38 0.95 0.00 0.00 1.35 -1.90 -3.48 112.91 109.45 2byt h THR 316 Ca 0.00 -2.35 0.00 0.00 -0.55 0.00 0.00 66.41 63.51 2byt h THR 316 Cb 0.38 2.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.26 2byt h THR 316 CO 0.00 0.54 0.00 0.61 -0.25 0.00 0.00 175.52 176.42 2byt n GLY 317 N 1.25 3.20 3.60 5.82 0.00 0.19 -5.03 105.19 114.21 2byt n GLY 317 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 2byt n GLY 317 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2byt s GLU 318 N -0.69 -0.83 0.12 1.61 -1.05 -1.26 -4.35 118.70 112.25 2byt s GLU 318 Ca 0.00 0.15 -0.06 0.00 -0.15 0.00 0.00 54.97 54.91 2byt s GLU 318 Cb 0.00 -1.62 -0.06 0.00 -0.44 0.00 0.00 34.13 32.01 2byt s GLU 318 CO 0.00 -3.50 0.38 1.03 0.95 0.00 0.00 175.26 174.12 2byt s ARG 319 N -5.21 3.65 -0.08 -4.83 0.52 -1.26 -0.31 118.95 111.43 2byt s ARG 319 Ca 0.69 -0.03 -0.03 0.00 -0.52 0.00 0.00 55.73 55.84 2byt s ARG 319 Cb -0.13 -2.89 0.04 0.00 0.52 0.00 0.00 34.95 32.49 2byt s ARG 319 CO 0.57 0.49 0.17 0.96 0.02 0.00 0.00 175.30 177.52 2byt s ILE 320 N -1.59 -0.07 0.75 1.52 -4.36 -0.71 -4.91 121.20 111.84 2byt s ILE 320 Ca 0.39 0.19 -0.15 0.00 -0.26 0.00 0.00 60.65 60.81 2byt s ILE 320 Cb -0.12 -0.28 0.01 0.00 1.25 0.00 0.00 42.46 43.31 2byt s ILE 320 CO 0.23 0.08 0.82 -0.81 0.24 0.00 0.00 174.94 175.49 2byt n PRO 321 N 4.32 0.33 -4.00 0.37 -0.04 -1.26 -1.89 135.00 132.83 2byt n PRO 321 Ca -0.24 0.17 -0.34 0.00 -0.04 0.00 0.00 63.50 63.04 2byt n PRO 321 Cb 0.52 -2.10 -0.15 0.00 -0.04 0.00 0.00 33.50 31.73 2byt n PRO 321 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2byt s ILE 322 N -1.94 2.77 0.55 0.52 1.01 -0.90 -2.14 121.20 121.07 2byt s ILE 322 Ca 0.70 -0.77 0.04 0.00 0.00 0.00 0.00 60.65 60.62 2byt s ILE 322 Cb -0.33 -2.26 0.04 0.00 0.01 0.00 0.00 42.46 39.92 2byt s ILE 322 CO 0.54 0.42 0.36 0.79 0.00 0.00 0.00 174.94 177.05 2byt n TRP 323 N 4.70 -0.31 -3.61 3.97 7.02 0.31 -1.23 117.44 128.29 2byt n TRP 323 Ca -0.19 -2.40 -0.22 0.00 -1.02 0.00 0.00 57.50 53.67 2byt n TRP 323 Cb 0.50 -0.44 -0.16 0.00 -2.42 0.00 0.00 31.31 28.79 2byt n TRP 323 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 2byt s THR 324 N -2.80 -0.17 0.24 -0.99 -1.32 0.74 -1.21 115.64 110.12 2byt s THR 324 Ca 0.27 0.05 0.08 0.00 -1.21 0.00 0.00 61.69 60.88 2byt s THR 324 Cb -0.02 -0.47 -0.05 0.00 -1.51 0.00 0.00 72.50 70.45 2byt s THR 324 CO 0.17 -0.10 -0.12 0.00 -2.21 0.00 0.00 174.62 172.36 2byt s ALA 325 N 2.21 2.19 -0.93 11.08 0.00 -1.15 -0.97 121.76 134.19 2byt s ALA 325 Ca 0.04 -1.76 0.26 0.00 0.00 0.00 0.00 51.96 50.50 2byt s ALA 325 Cb -0.15 -0.01 0.71 0.00 0.00 0.00 0.00 23.12 23.67 2byt s ALA 325 CO -0.08 0.04 1.57 -0.40 0.00 0.00 0.00 175.76 176.89 2byt n ASP 326 N -0.47 0.40 0.00 0.00 5.68 -1.21 -3.64 116.55 117.32 2byt n ASP 326 Ca -0.07 0.06 0.11 0.00 -0.50 0.00 0.00 54.79 54.39 2byt n ASP 326 Cb 0.61 -0.03 0.56 0.00 -1.14 0.00 0.00 41.12 41.12 2byt n ASP 326 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2byt n TYR 327 N -1.63 0.00 -4.41 2.11 0.18 -1.26 -4.56 117.16 107.59 2byt n TYR 327 Ca 0.06 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.50 2byt n TYR 327 Cb 0.36 -0.29 -0.12 0.00 -0.38 0.00 0.00 39.34 38.90 2byt n TYR 327 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2byt s VAL 328 N -2.59 3.88 -0.11 -3.48 1.01 -1.24 -5.10 120.40 112.77 2byt s VAL 328 Ca 0.21 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.71 2byt s VAL 328 Cb 0.15 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 2byt s VAL 328 CO 0.34 0.50 0.25 -0.76 0.00 0.00 0.00 175.10 175.43 2byt s LEU 329 N 0.32 4.35 0.11 3.92 1.43 -1.26 -4.59 118.68 122.96 2byt s LEU 329 Ca -0.04 0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 53.60 2byt s LEU 329 Cb -0.14 -2.29 -0.16 0.00 0.03 0.00 0.00 46.19 43.63 2byt s LEU 329 CO 0.03 0.27 1.25 0.15 0.23 0.00 0.00 176.35 178.28 2byt h PHE 330 N 5.62 0.52 0.00 0.29 3.57 -1.93 -3.24 116.94 121.77 2byt h PHE 330 Ca -0.48 -0.32 0.00 0.00 3.53 0.00 0.00 57.97 60.69 2byt h PHE 330 Cb 1.20 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.89 2byt h PHE 330 CO 0.68 1.18 0.00 0.41 -2.23 0.00 0.00 178.31 178.35 2byt n GLY 331 N 1.17 0.85 3.10 2.40 0.00 -1.26 -4.04 105.19 107.40 2byt n GLY 331 Ca -0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 2byt n GLY 331 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2byt s TYR 332 N -0.84 -0.34 0.00 1.61 6.14 -1.22 -4.94 117.35 117.75 2byt s TYR 332 Ca 0.00 0.80 0.00 0.00 0.64 0.00 0.00 57.07 58.51 2byt s TYR 332 Cb 0.00 0.08 0.00 0.00 0.42 0.00 0.00 41.96 42.46 2byt s TYR 332 CO 0.00 -0.22 0.00 0.41 0.64 0.00 0.00 175.55 176.38 2byt n GLY 333 N 3.86 1.03 0.00 8.97 0.00 -1.26 -1.64 105.19 116.15 2byt n GLY 333 Ca -0.22 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2byt n GLY 333 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2byt n THR 334 N 0.00 0.00 -0.92 2.61 -2.24 -1.26 -4.97 114.28 107.49 2byt n THR 334 Ca 0.00 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2byt n THR 334 Cb 0.00 1.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.63 2byt n THR 334 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2byt n GLY 335 N 0.06 0.39 3.06 3.38 0.00 -0.65 -4.94 105.19 106.49 2byt n GLY 335 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2byt n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2byt s ALA 336 N -1.98 0.50 0.06 4.61 0.00 -1.26 -0.72 121.76 122.98 2byt s ALA 336 Ca 0.00 -0.85 -0.06 0.00 0.00 0.00 0.00 51.96 51.05 2byt s ALA 336 Cb 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.22 2byt s ALA 336 CO 0.00 -0.13 0.11 0.96 0.00 0.00 0.00 175.76 176.70 2byt s ILE 337 N -2.01 0.15 -0.62 0.00 -4.36 -0.96 -3.53 121.20 109.88 2byt s ILE 337 Ca -0.07 -1.26 -0.12 0.00 -0.26 0.00 0.00 60.65 58.94 2byt s ILE 337 Cb -0.06 -1.19 0.16 0.00 1.25 0.00 0.00 42.46 42.62 2byt s ILE 337 CO -0.02 -0.70 0.53 0.00 0.24 0.00 0.00 174.94 174.99 2byt s MET 338 N -3.33 2.97 0.20 0.37 0.23 -1.26 -2.15 119.30 116.32 2byt s MET 338 Ca 0.01 -2.05 -0.33 0.00 -1.03 0.00 0.00 55.69 52.29 2byt s MET 338 Cb 0.03 -4.16 -0.13 0.00 -1.53 0.00 0.00 34.83 29.04 2byt s MET 338 CO -0.08 -1.26 1.56 0.00 -2.03 0.00 0.00 175.02 173.21 2byt n ALA 339 N 4.55 1.59 -3.18 3.16 0.00 0.74 -4.83 120.51 122.54 2byt n ALA 339 Ca -0.01 0.43 -0.23 0.00 0.00 0.00 0.00 53.44 53.63 2byt n ALA 339 Cb 0.42 -2.36 -0.05 0.00 0.00 0.00 0.00 19.45 17.46 2byt n ALA 339 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2byt n VAL 340 N 3.01 0.52 -0.48 0.00 0.31 -1.26 -1.75 118.33 118.68 2byt n VAL 340 Ca 0.15 -4.65 0.37 0.00 -0.01 0.00 0.00 64.34 60.20 2byt n VAL 340 Cb 0.31 -1.22 0.59 0.00 -0.91 0.00 0.00 33.84 32.60 2byt n VAL 340 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2byt n PRO 341 N 0.63 -0.01 0.26 5.55 -0.02 -1.26 0.05 135.00 140.19 2byt n PRO 341 Ca 0.25 0.88 0.13 0.00 -2.02 0.00 0.00 63.50 62.75 2byt n PRO 341 Cb 0.54 -1.91 0.64 0.00 -0.02 0.00 0.00 33.50 32.76 2byt n PRO 341 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2byt h ALA 342 N 0.94 1.08 -0.82 3.55 0.00 -1.87 -3.26 119.26 118.87 2byt h ALA 342 Ca 0.70 -0.11 -0.34 0.00 0.00 0.00 0.00 54.91 55.16 2byt h ALA 342 Cb 2.62 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 19.99 2byt h ALA 342 CO -0.14 0.16 -1.14 0.72 0.00 0.00 0.00 179.25 178.84 2byt n HIS 343 N -3.36 1.34 -3.13 0.00 8.25 0.11 -2.49 115.22 115.94 2byt n HIS 343 Ca -0.00 -2.57 0.06 0.00 -0.26 0.00 0.00 57.72 54.94 2byt n HIS 343 Cb 0.32 -0.31 0.00 0.00 1.12 0.00 0.00 29.99 31.12 2byt n HIS 343 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2byt s ASP 344 N -3.39 -0.10 0.14 0.41 -1.08 -1.23 -4.59 116.67 106.84 2byt s ASP 344 Ca 0.29 0.01 -0.25 0.00 -0.52 0.00 0.00 52.55 52.08 2byt s ASP 344 Cb 0.41 1.02 -0.03 0.00 -1.46 0.00 0.00 42.92 42.86 2byt s ASP 344 CO 0.00 -0.02 1.30 1.67 0.52 0.00 0.00 175.17 178.64 2byt n GLN 345 N 4.96 -0.35 -0.15 4.34 -0.06 -1.26 0.25 117.38 125.11 2byt n GLN 345 Ca 0.10 1.27 -0.05 0.00 -2.00 0.00 0.00 57.00 56.32 2byt n GLN 345 Cb 0.59 -1.87 -0.05 0.00 -4.06 0.00 0.00 30.24 24.85 2byt n GLN 345 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2byt h ARG 346 N 0.00 -0.05 0.04 3.69 3.08 -1.97 1.43 114.38 120.59 2byt h ARG 346 Ca 0.15 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.23 2byt h ARG 346 Cb 0.36 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.38 2byt h ARG 346 CO -0.80 -0.04 -0.35 -0.44 -1.07 0.00 0.00 179.97 177.28 2byt h ASP 347 N -0.06 -1.04 -0.67 7.04 3.32 -1.38 0.49 116.42 124.13 2byt h ASP 347 Ca 0.06 0.13 0.06 0.00 0.02 0.00 0.00 57.03 57.30 2byt h ASP 347 Cb 0.21 0.41 -0.09 0.00 0.22 0.00 0.00 39.33 40.08 2byt h ASP 347 CO -0.38 -0.42 -0.50 0.22 -1.72 0.00 0.00 179.24 176.44 2byt h TYR 348 N -0.53 -1.58 -0.54 4.55 5.03 0.22 0.48 116.97 124.60 2byt h TYR 348 Ca 0.05 0.10 0.10 0.00 2.58 0.00 0.00 58.73 61.55 2byt h TYR 348 Cb 0.60 0.78 -0.08 0.00 1.55 0.00 0.00 36.73 39.58 2byt h TYR 348 CO -0.35 -0.36 0.09 0.93 -1.32 0.00 0.00 178.16 177.15 2byt h GLU 349 N -0.13 0.22 -0.53 1.82 5.08 0.23 0.13 114.58 121.39 2byt h GLU 349 Ca 0.11 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 2byt h GLU 349 Cb 0.42 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2byt h GLU 349 CO -0.70 0.14 0.35 0.35 -1.00 0.00 0.00 179.01 178.16 2byt h PHE 350 N 0.22 0.57 0.05 4.33 3.04 0.14 -1.76 116.94 123.53 2byt h PHE 350 Ca 0.27 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.24 2byt h PHE 350 Cb 0.39 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 38.71 2byt h PHE 350 CO -0.25 0.33 -0.03 0.00 -2.02 0.00 0.00 178.31 176.34 2byt h ALA 351 N 1.69 -0.07 0.00 2.41 0.00 0.23 -2.61 119.26 120.91 2byt h ALA 351 Ca 0.22 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2byt h ALA 351 Cb 0.14 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2byt h ALA 351 CO -0.06 -0.28 -0.02 -0.09 0.00 0.00 0.00 179.25 178.80 2byt h ARG 352 N -0.59 0.00 0.00 0.00 1.12 -0.47 -1.54 114.38 112.90 2byt h ARG 352 Ca -0.01 0.00 -0.04 0.00 -1.11 0.00 0.00 59.98 58.82 2byt h ARG 352 Cb 0.51 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.47 2byt h ARG 352 CO 0.01 0.02 -0.22 -0.22 -3.11 0.00 0.00 179.97 176.45 2byt h LYS 353 N 0.00 0.00 -1.48 0.20 3.64 -1.29 -3.37 116.57 114.28 2byt h LYS 353 Ca -0.00 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.78 2byt h LYS 353 Cb 0.09 0.00 -0.24 0.00 -0.41 0.00 0.00 32.23 31.67 2byt h LYS 353 CO 0.00 0.92 0.75 1.19 -2.27 0.00 0.00 179.45 180.05 2byt n PHE 354 N -4.59 2.58 -4.07 1.91 3.72 -0.99 -4.92 117.46 111.10 2byt n PHE 354 Ca -0.13 -2.49 -0.33 0.00 -0.05 0.00 0.00 57.45 54.45 2byt n PHE 354 Cb 0.48 -1.28 -0.07 0.00 -0.94 0.00 0.00 39.48 37.67 2byt n PHE 354 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2byt n GLY 355 N -0.31 -0.26 3.92 1.37 0.00 -1.09 -4.94 105.19 103.89 2byt n GLY 355 Ca 0.52 0.09 -0.28 0.00 0.00 0.00 0.00 46.02 46.34 2byt n GLY 355 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2byt s LEU 356 N -6.42 4.27 0.45 0.99 1.43 -0.60 -5.05 118.68 113.75 2byt s LEU 356 Ca 0.48 0.37 -0.23 0.00 -1.03 0.00 0.00 54.13 53.72 2byt s LEU 356 Cb -0.28 -3.11 -0.08 0.00 0.03 0.00 0.00 46.19 42.75 2byt s LEU 356 CO 0.86 0.02 1.12 -2.84 0.23 0.00 0.00 176.35 175.74 2byt s PRO 357 N -3.08 3.86 -0.22 1.29 0.02 -1.26 -4.56 135.00 131.06 2byt s PRO 357 Ca 0.38 1.66 0.02 0.00 0.02 0.00 0.00 61.00 63.07 2byt s PRO 357 Cb -0.11 -2.40 0.04 0.00 0.02 0.00 0.00 34.50 32.05 2byt s PRO 357 CO 0.28 -0.44 -0.13 0.42 -0.33 0.00 0.00 177.00 176.80 2byt s ILE 358 N -1.62 1.97 -0.15 2.83 1.01 -1.26 -4.77 121.20 119.21 2byt s ILE 358 Ca 0.63 -1.23 -0.03 0.00 0.00 0.00 0.00 60.65 60.01 2byt s ILE 358 Cb -0.25 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 2byt s ILE 358 CO 0.31 0.20 -0.04 -0.75 0.00 0.00 0.00 174.94 174.66 2byt s LYS 359 N 1.25 3.64 -0.04 2.79 2.20 -1.26 -4.92 119.74 123.40 2byt s LYS 359 Ca -0.02 -0.53 -0.22 0.00 -0.36 0.00 0.00 55.97 54.84 2byt s LYS 359 Cb -0.17 -2.89 -0.04 0.00 -1.51 0.00 0.00 37.83 33.22 2byt s LYS 359 CO -0.08 0.25 0.64 0.21 -0.36 0.00 0.00 175.35 176.01 2byt s LYS 360 N 0.33 4.39 0.00 4.03 2.20 -1.26 -4.34 119.74 125.08 2byt s LYS 360 Ca -0.04 0.78 0.00 0.00 -0.36 0.00 0.00 55.97 56.35 2byt s LYS 360 Cb -0.14 -3.40 0.00 0.00 -1.51 0.00 0.00 37.83 32.78 2byt s LYS 360 CO 0.03 0.21 0.10 1.33 -0.36 0.00 0.00 175.35 176.66 2byt n VAL 361 N 3.30 0.00 -3.75 4.02 0.24 -1.26 -4.71 118.33 116.17 2byt n VAL 361 Ca -0.04 -0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.97 2byt n VAL 361 Cb 0.51 1.80 -0.16 0.00 -1.47 0.00 0.00 33.84 34.53 2byt n VAL 361 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2byt s ILE 362 N -0.00 0.77 0.24 1.34 -1.09 -1.26 -2.00 121.20 119.20 2byt s ILE 362 Ca 0.00 -1.00 -0.20 0.00 -2.23 0.00 0.00 60.65 57.22 2byt s ILE 362 Cb 0.00 -1.39 -0.08 0.00 -1.58 0.00 0.00 42.46 39.41 2byt s ILE 362 CO 0.00 -0.42 0.75 -0.70 -1.23 0.00 0.00 174.94 173.34 2byt s GLU 363 N 1.71 4.25 0.00 2.79 2.56 0.21 -4.83 118.70 125.39 2byt s GLU 363 Ca 0.03 0.89 -0.29 0.00 0.00 0.00 0.00 54.97 55.60 2byt s GLU 363 Cb -0.17 -2.81 -0.03 0.00 2.00 0.00 0.00 34.13 33.11 2byt s GLU 363 CO -0.16 0.35 0.96 0.50 -0.56 0.00 0.00 175.26 176.35 2byt s ARG 364 N -2.11 4.56 0.07 4.30 3.52 -1.26 -0.61 118.95 127.42 2byt s ARG 364 Ca 0.45 1.38 -0.32 0.00 -0.13 0.00 0.00 55.73 57.12 2byt s ARG 364 Cb -0.16 -3.45 -0.11 0.00 -1.56 0.00 0.00 34.95 29.67 2byt s ARG 364 CO 0.21 -0.02 1.86 -2.30 -0.81 0.00 0.00 175.30 174.23 2byt n PRO 365 N 3.79 2.66 0.00 5.12 -0.02 -1.26 -4.28 135.00 141.02 2byt n PRO 365 Ca 0.05 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 2byt n PRO 365 Cb 0.51 -2.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.13 2byt n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2byt n GLY 366 N 4.27 2.07 3.57 -1.23 0.00 -1.26 -4.84 105.19 107.76 2byt n GLY 366 Ca 0.19 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2byt n GLY 366 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2byt n GLU 367 N 0.00 1.36 -0.89 1.61 0.00 -1.26 -4.94 120.64 116.52 2byt n GLU 367 Ca 0.00 0.19 -0.33 0.00 0.00 0.00 0.00 57.16 57.02 2byt n GLU 367 Cb 0.00 -3.33 0.11 0.00 0.00 0.00 0.00 31.44 28.22 2byt n GLU 367 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2byt n PRO 368 N 8.90 -0.16 -3.04 5.31 -0.02 -1.26 -4.63 135.00 140.10 2byt n PRO 368 Ca 0.35 -0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.43 2byt n PRO 368 Cb 0.50 -1.90 -0.05 0.00 -0.02 0.00 0.00 33.50 32.03 2byt n PRO 368 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2byt s LEU 369 N -1.37 4.25 -0.22 2.45 1.43 -1.26 -4.96 118.68 118.99 2byt s LEU 369 Ca 0.60 1.09 -0.31 0.00 -1.03 0.00 0.00 54.13 54.48 2byt s LEU 369 Cb -0.24 -3.06 -0.08 0.00 0.03 0.00 0.00 46.19 42.84 2byt s LEU 369 CO 0.65 -0.20 2.14 -0.81 0.23 0.00 0.00 176.35 178.35 2byt n PRO 370 N 4.35 1.79 -3.59 1.29 -0.04 -1.26 -4.96 135.00 132.58 2byt n PRO 370 Ca -0.00 0.54 -0.36 0.00 -0.04 0.00 0.00 63.50 63.64 2byt n PRO 370 Cb 0.50 -2.89 -0.08 0.00 -0.04 0.00 0.00 33.50 30.99 2byt n PRO 370 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2byt s GLU 371 N 5.82 4.21 0.53 0.54 2.56 -1.26 -2.49 118.70 128.61 2byt s GLU 371 Ca 1.01 -0.03 -0.10 0.00 0.00 0.00 0.00 54.97 55.85 2byt s GLU 371 Cb -0.56 -3.45 -0.05 0.00 2.00 0.00 0.00 34.13 32.07 2byt s GLU 371 CO 0.43 0.21 0.91 -1.25 -0.56 0.00 0.00 175.26 175.00 2byt s PRO 372 N 0.59 3.68 0.38 4.30 0.04 -1.26 -5.12 135.00 137.60 2byt s PRO 372 Ca 0.13 0.59 -0.26 0.00 0.04 0.00 0.00 61.00 61.50 2byt s PRO 372 Cb -0.13 -2.22 -0.09 0.00 0.04 0.00 0.00 34.50 32.10 2byt s PRO 372 CO 0.03 -0.33 1.24 -0.51 0.04 0.00 0.00 177.00 177.47 2byt s LEU 373 N -4.64 4.26 -0.03 -3.56 1.02 -1.04 -4.94 118.68 109.75 2byt s LEU 373 Ca 0.53 2.53 0.04 0.00 0.02 0.00 0.00 54.13 57.25 2byt s LEU 373 Cb -0.10 -3.89 0.07 0.00 0.02 0.00 0.00 46.19 42.28 2byt s LEU 373 CO 0.44 -0.70 0.91 -0.62 0.02 0.00 0.00 176.35 176.40 2byt n GLU 374 N 0.28 1.41 -3.62 1.70 1.02 -1.26 -5.03 120.64 115.14 2byt n GLU 374 Ca 0.03 -1.42 -0.07 0.00 -0.02 0.00 0.00 57.16 55.68 2byt n GLU 374 Cb 0.44 -0.91 -0.06 0.00 -0.02 0.00 0.00 31.44 30.89 2byt n GLU 374 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2byt s ARG 375 N -1.03 0.39 1.36 3.49 1.70 -1.26 -5.15 118.95 118.46 2byt s ARG 375 Ca 0.07 0.23 -0.20 0.00 -0.47 0.00 0.00 55.73 55.36 2byt s ARG 375 Cb 0.06 0.19 0.35 0.00 -0.57 0.00 0.00 34.95 34.98 2byt s ARG 375 CO 0.01 -0.09 0.96 0.00 -1.08 0.00 0.00 175.30 175.09 2byt s ALA 376 N -0.55 -0.65 -0.34 7.88 0.00 -1.26 -5.03 121.76 121.81 2byt s ALA 376 Ca 0.03 -0.67 -0.00 0.00 0.00 0.00 0.00 51.96 51.31 2byt s ALA 376 Cb -0.02 -3.01 0.14 0.00 0.00 0.00 0.00 23.12 20.23 2byt s ALA 376 CO -0.05 -4.41 0.24 -0.47 0.00 0.00 0.00 175.76 171.07 2byt s TYR 377 N -2.35 0.34 -2.31 0.00 5.04 -1.04 -4.95 117.35 112.08 2byt s TYR 377 Ca 0.69 -1.21 0.28 0.00 -2.44 0.00 0.00 57.07 54.38 2byt s TYR 377 Cb -0.16 -0.76 1.01 0.00 0.35 0.00 0.00 41.96 42.40 2byt s TYR 377 CO 0.59 -0.87 1.72 0.39 -1.34 0.00 0.00 175.55 176.05 2byt n GLU 378 N 4.39 1.45 -2.54 4.97 1.02 -1.26 -4.47 120.64 124.20 2byt n GLU 378 Ca 0.08 -0.82 -0.29 0.00 -0.02 0.00 0.00 57.16 56.10 2byt n GLU 378 Cb 0.40 -1.48 -0.01 0.00 -0.02 0.00 0.00 31.44 30.33 2byt n GLU 378 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2byt s GLU 379 N -2.12 3.66 0.56 3.49 8.01 -1.26 -5.05 118.70 125.99 2byt s GLU 379 Ca 0.35 0.45 -0.20 0.00 0.01 0.00 0.00 54.97 55.57 2byt s GLU 379 Cb 0.21 -2.31 -0.04 0.00 -4.31 0.00 0.00 34.13 27.68 2byt s GLU 379 CO 0.38 -0.23 1.25 -2.14 0.01 0.00 0.00 175.26 174.53 2byt s PRO 380 N -4.50 3.13 0.00 0.39 0.02 -1.26 -5.01 135.00 127.77 2byt s PRO 380 Ca 0.51 1.94 0.00 0.00 0.02 0.00 0.00 61.00 63.47 2byt s PRO 380 Cb -0.10 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.32 2byt s PRO 380 CO 0.41 -1.11 0.00 0.41 -0.33 0.00 0.00 177.00 176.38 2byt n GLY 381 N 0.59 2.87 3.87 0.52 0.00 -1.26 -4.69 105.19 107.08 2byt n GLY 381 Ca 0.12 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.07 2byt n GLY 381 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2byt s ILE 382 N -2.65 5.35 0.35 -0.61 -1.09 0.22 -1.36 121.20 121.43 2byt s ILE 382 Ca 0.00 0.34 -0.24 0.00 -2.23 0.00 0.00 60.65 58.52 2byt s ILE 382 Cb 0.00 -3.51 -0.10 0.00 -1.58 0.00 0.00 42.46 37.27 2byt s ILE 382 CO 0.00 0.55 0.93 -0.04 -1.23 0.00 0.00 174.94 175.16 2byt s MET 383 N -1.20 4.45 0.06 2.79 -1.94 -0.62 0.65 119.30 123.48 2byt s MET 383 Ca 0.20 1.23 -0.21 0.00 -1.71 0.00 0.00 55.69 55.20 2byt s MET 383 Cb -0.13 -2.61 0.05 0.00 2.01 0.00 0.00 34.83 34.15 2byt s MET 383 CO 0.09 0.19 0.50 0.54 -0.01 0.00 0.00 175.02 176.33 2byt s VAL 384 N -1.79 0.03 -1.78 -6.03 0.11 -0.85 -0.32 120.40 109.77 2byt s VAL 384 Ca 0.54 -0.28 0.00 0.00 -2.93 0.00 0.00 61.98 59.31 2byt s VAL 384 Cb -0.15 -0.99 0.00 0.00 -1.53 0.00 0.00 36.38 33.71 2byt s VAL 384 CO 0.20 -0.15 0.00 0.59 -3.33 0.00 0.00 175.10 172.41 2byt n ASN 385 N 0.34 -5.01 -2.23 3.54 3.02 -1.26 -4.28 115.26 109.38 2byt n ASN 385 Ca -0.18 0.29 -0.27 0.00 -0.03 0.00 0.00 54.58 54.39 2byt n ASN 385 Cb 0.61 -4.36 0.02 0.00 -0.61 0.00 0.00 39.78 35.44 2byt n ASN 385 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2byt n SER 386 N -1.44 5.23 0.00 6.41 7.64 -1.26 -4.90 113.62 125.30 2byt n SER 386 Ca -0.20 -3.75 0.00 0.00 1.01 0.00 0.00 58.87 55.93 2byt n SER 386 Cb 0.63 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 2byt n SER 386 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2byt n GLY 387 N -0.65 2.14 0.09 0.23 0.00 -1.26 -2.69 105.19 103.05 2byt n GLY 387 Ca 0.45 -0.53 0.09 0.00 0.00 0.00 0.00 46.02 46.03 2byt n GLY 387 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2byt n PRO 388 N 11.34 0.11 0.00 1.61 -0.04 -1.26 -2.68 135.00 144.07 2byt n PRO 388 Ca 0.00 0.45 0.13 0.00 -0.04 0.00 0.00 63.50 64.04 2byt n PRO 388 Cb 0.00 -1.75 0.68 0.00 -0.04 0.00 0.00 33.50 32.39 2byt n PRO 388 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2byt n PHE 389 N -1.96 0.00 -1.46 0.54 3.72 -1.10 -4.92 117.46 112.28 2byt n PHE 389 Ca 0.01 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.03 2byt n PHE 389 Cb 0.13 -0.27 0.04 0.00 -0.94 0.00 0.00 39.48 38.45 2byt n PHE 389 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2byt n ASP 390 N -1.27 -0.82 0.00 4.37 8.00 -1.09 -1.63 116.55 124.11 2byt n ASP 390 Ca 0.13 0.73 0.00 0.00 0.71 0.00 0.00 54.79 56.36 2byt n ASP 390 Cb 0.20 -1.21 0.00 0.00 -0.02 0.00 0.00 41.12 40.10 2byt n ASP 390 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2byt n GLY 391 N 1.70 2.09 3.77 0.44 0.00 0.56 -4.94 105.19 108.83 2byt n GLY 391 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2byt n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2byt s THR 392 N -0.24 2.14 0.94 2.61 2.01 -0.65 -4.53 115.64 117.93 2byt s THR 392 Ca 0.00 0.14 -0.10 0.00 0.31 0.00 0.00 61.69 62.04 2byt s THR 392 Cb 0.00 -3.09 0.16 0.00 0.01 0.00 0.00 72.50 69.59 2byt s THR 392 CO 0.00 0.03 1.14 -1.61 -0.69 0.00 0.00 174.62 173.49 2byt s GLU 393 N -2.15 0.77 -0.01 4.92 0.41 -1.26 -1.59 118.70 119.80 2byt s GLU 393 Ca 0.54 1.50 -0.24 0.00 -0.41 0.00 0.00 54.97 56.36 2byt s GLU 393 Cb -0.45 -1.70 -0.17 0.00 -1.78 0.00 0.00 34.13 30.03 2byt s GLU 393 CO 0.60 -2.79 1.19 1.03 -0.49 0.00 0.00 175.26 174.80 2byt h SER 394 N -1.98 -0.25 0.13 -0.19 0.87 -1.58 -1.18 113.55 109.36 2byt h SER 394 Ca -0.45 -0.25 -0.00 0.00 -1.23 0.00 0.00 61.79 59.86 2byt h SER 394 Cb 1.28 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 63.30 2byt h SER 394 CO 0.42 0.16 -0.09 -0.33 -0.53 0.00 0.00 176.83 176.45 2byt h GLU 395 N -0.71 -0.22 0.00 2.24 4.39 -1.93 -1.90 114.58 116.46 2byt h GLU 395 Ca -0.03 0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 2byt h GLU 395 Cb 0.49 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2byt h GLU 395 CO 0.05 -0.14 -0.15 1.49 -1.16 0.00 0.00 179.01 179.10 2byt h GLU 396 N -0.22 0.00 0.64 2.33 4.81 -1.96 -3.04 114.58 117.13 2byt h GLU 396 Ca -0.01 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2byt h GLU 396 Cb 0.20 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.58 2byt h GLU 396 CO -0.00 0.15 -0.31 0.78 -0.73 0.00 0.00 179.01 178.90 2byt h GLY 397 N 1.18 -0.89 -0.01 1.92 0.00 -0.40 -2.98 103.07 101.89 2byt h GLY 397 Ca -0.00 0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2byt h GLY 397 CO 0.02 -0.33 -0.00 0.28 0.00 0.00 0.00 176.54 176.51 2byt n LYS 398 N -5.44 -0.00 -0.08 4.80 5.02 -1.03 -0.13 118.16 121.29 2byt n LYS 398 Ca -0.13 0.89 0.24 0.00 -2.02 0.00 0.00 58.31 57.29 2byt n LYS 398 Cb 0.36 -1.33 0.70 0.00 -0.02 0.00 0.00 35.03 34.73 2byt n LYS 398 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 2byt h ARG 399 N 0.00 0.01 0.00 1.97 0.11 -1.70 -0.22 114.38 114.56 2byt h ARG 399 Ca 0.00 -0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 2byt h ARG 399 Cb 0.00 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2byt h ARG 399 CO -0.01 0.01 -0.00 0.87 0.10 0.00 0.00 179.97 180.94 2byt h LYS 400 N 0.01 -0.00 -0.67 0.08 1.57 -0.37 -1.14 116.57 116.05 2byt h LYS 400 Ca 0.33 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 59.13 2byt h LYS 400 Cb 1.32 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.59 2byt h LYS 400 CO -0.01 0.70 0.45 0.28 -0.57 0.00 0.00 179.45 180.30 2byt h VAL 401 N -0.70 1.15 -0.02 0.50 2.07 0.12 0.26 116.25 119.64 2byt h VAL 401 Ca -0.00 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 2byt h VAL 401 Cb 0.70 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2byt h VAL 401 CO 0.00 0.16 -0.00 0.40 0.02 0.00 0.00 177.57 178.15 2byt h ILE 402 N 0.88 1.28 -0.11 4.57 2.04 -1.08 -0.01 117.51 125.08 2byt h ILE 402 Ca 0.25 -0.85 0.03 0.00 1.00 0.00 0.00 64.86 65.30 2byt h ILE 402 Cb -0.05 1.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.85 2byt h ILE 402 CO -0.06 0.22 0.10 0.00 0.00 0.00 0.00 178.15 178.41 2byt h ALA 403 N 0.65 1.85 -0.04 1.87 0.00 -0.49 0.17 119.26 123.28 2byt h ALA 403 Ca 0.00 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 2byt h ALA 403 Cb 0.36 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.17 2byt h ALA 403 CO 0.00 -0.16 -0.66 2.35 0.00 0.00 0.00 179.25 180.79 2byt h TRP 404 N 0.00 0.73 0.03 0.00 7.01 -0.13 -3.22 115.95 120.37 2byt h TRP 404 Ca 0.05 -0.37 -0.00 0.00 2.11 0.00 0.00 58.89 60.68 2byt h TRP 404 Cb 0.25 -0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.22 2byt h TRP 404 CO 0.00 1.18 -0.02 -0.07 -2.79 0.00 0.00 178.44 176.75 2byt h LEU 405 N 0.07 -0.04 0.00 0.65 3.38 0.10 -2.26 115.31 117.21 2byt h LEU 405 Ca -0.07 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2byt h LEU 405 Cb 1.34 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.10 2byt h LEU 405 CO 0.13 0.18 0.00 -0.62 0.09 0.00 0.00 178.44 178.22 2byt n GLU 406 N -5.01 0.26 -0.09 1.13 1.02 0.37 -1.04 120.64 117.28 2byt n GLU 406 Ca -0.08 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.93 2byt n GLU 406 Cb 0.14 -1.09 -0.08 0.00 -0.02 0.00 0.00 31.44 30.38 2byt n GLU 406 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2byt n GLU 407 N -0.59 0.45 0.00 3.49 2.13 -0.87 -4.51 120.64 120.74 2byt n GLU 407 Ca 0.01 0.11 0.13 0.00 0.66 0.00 0.00 57.16 58.07 2byt n GLU 407 Cb 0.01 -1.35 0.33 0.00 0.27 0.00 0.00 31.44 30.70 2byt n GLU 407 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2byt n LYS 408 N -3.07 1.87 -2.66 5.31 4.76 -0.71 -4.94 118.16 118.73 2byt n LYS 408 Ca -0.32 -1.33 -0.12 0.00 -2.87 0.00 0.00 58.31 53.67 2byt n LYS 408 Cb 0.83 -1.47 0.02 0.00 -1.84 0.00 0.00 35.03 32.57 2byt n LYS 408 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2byt n GLY 409 N 1.26 0.02 0.09 0.72 0.00 -0.21 -4.93 105.19 102.14 2byt n GLY 409 Ca 0.16 -0.29 -0.06 0.00 0.00 0.00 0.00 46.02 45.84 2byt n GLY 409 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2byt n LEU 410 N -2.31 0.49 0.00 0.99 4.77 -0.86 -5.01 117.00 115.06 2byt n LEU 410 Ca -0.06 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2byt n LEU 410 Cb 0.57 0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 2byt n LEU 410 CO 0.26 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 2byt n GLY 411 N 1.58 2.44 3.58 -0.72 0.00 -1.24 -0.51 105.19 110.32 2byt n GLY 411 Ca -0.21 -0.70 -0.05 0.00 0.00 0.00 0.00 46.02 45.06 2byt n GLY 411 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2byt s LYS 412 N 1.06 0.61 -0.09 1.61 -2.85 -0.80 -3.63 119.74 115.66 2byt s LYS 412 Ca 0.00 -0.26 -0.25 0.00 -1.00 0.00 0.00 55.97 54.46 2byt s LYS 412 Cb 0.00 0.26 -0.03 0.00 -2.06 0.00 0.00 37.83 36.00 2byt s LYS 412 CO 0.00 -0.27 0.77 0.20 0.10 0.00 0.00 175.35 176.15 2byt s GLY 413 N -2.47 2.52 0.24 0.59 0.00 -1.26 0.24 107.32 107.17 2byt s GLY 413 Ca 0.09 0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.97 2byt s GLY 413 CO -0.06 1.38 0.09 -1.60 0.00 0.00 0.00 173.10 172.92 2byt s ARG 414 N 1.20 1.33 -0.25 2.90 3.52 0.20 -4.85 118.95 123.00 2byt s ARG 414 Ca 0.40 -1.71 -0.02 0.00 -0.13 0.00 0.00 55.73 54.26 2byt s ARG 414 Cb -0.18 -0.15 0.08 0.00 -1.56 0.00 0.00 34.95 33.14 2byt s ARG 414 CO 0.18 -0.30 0.08 0.08 -0.81 0.00 0.00 175.30 174.53 2byt s VAL 415 N -3.83 0.51 0.54 7.11 1.01 -1.26 -0.83 120.40 123.65 2byt s VAL 415 Ca 0.36 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.49 2byt s VAL 415 Cb 0.07 -1.22 0.03 0.00 0.00 0.00 0.00 36.38 35.27 2byt s VAL 415 CO 0.12 -0.47 0.76 0.42 0.00 0.00 0.00 175.10 175.94 2byt s THR 416 N 1.83 2.84 0.04 3.92 -4.23 -1.06 -4.91 115.64 114.08 2byt s THR 416 Ca 0.05 -0.64 0.04 0.00 -1.18 0.00 0.00 61.69 59.96 2byt s THR 416 Cb -0.17 -3.06 -0.02 0.00 1.34 0.00 0.00 72.50 70.58 2byt s THR 416 CO -0.19 -0.05 -0.12 -0.31 -0.54 0.00 0.00 174.62 173.41 2byt s TYR 417 N -2.74 1.03 0.18 3.99 2.02 -1.26 -2.50 117.35 118.07 2byt s TYR 417 Ca 0.56 -0.39 -0.03 0.00 -0.37 0.00 0.00 57.07 56.84 2byt s TYR 417 Cb -0.10 -0.60 0.09 0.00 -0.40 0.00 0.00 41.96 40.95 2byt s TYR 417 CO 0.38 0.01 1.49 0.00 -1.57 0.00 0.00 175.55 175.86 2byt h ARG 418 N 4.78 0.55 -6.18 -0.62 3.08 -0.40 -3.44 114.38 112.15 2byt h ARG 418 Ca -0.37 -0.36 -0.73 0.00 0.07 0.00 0.00 59.98 58.59 2byt h ARG 418 Cb 1.19 0.05 0.03 0.00 0.08 0.00 0.00 29.97 31.32 2byt h ARG 418 CO 0.43 0.97 0.65 -0.11 -1.07 0.00 0.00 179.97 180.84 2byt n LEU 419 N -3.95 1.84 -4.73 3.04 7.94 -0.92 -4.94 117.00 115.30 2byt n LEU 419 Ca -0.03 1.11 -0.33 0.00 -1.11 0.00 0.00 56.01 55.65 2byt n LEU 419 Cb 0.62 -1.13 -0.08 0.00 0.53 0.00 0.00 43.42 43.36 2byt n LEU 419 CO 0.47 -0.81 -0.29 -0.13 -1.11 0.00 0.00 177.39 175.52 2byt s ARG 420 N 2.01 2.89 0.70 1.96 0.52 -1.26 -4.88 118.95 120.89 2byt s ARG 420 Ca 0.93 -0.57 -0.16 0.00 -0.52 0.00 0.00 55.73 55.40 2byt s ARG 420 Cb -1.06 -2.74 -0.03 0.00 0.52 0.00 0.00 34.95 31.63 2byt s ARG 420 CO 0.58 0.63 0.66 -0.25 0.02 0.00 0.00 175.30 176.94 2byt n ASP 421 N 1.26 -0.67 -4.66 0.23 8.00 -1.26 -4.82 116.55 114.63 2byt n ASP 421 Ca -0.14 0.63 -0.43 0.00 0.71 0.00 0.00 54.79 55.57 2byt n ASP 421 Cb 0.53 -1.27 -0.02 0.00 -0.02 0.00 0.00 41.12 40.34 2byt n ASP 421 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 2byt s TRP 422 N -1.85 3.29 -0.52 1.24 -0.00 -0.49 -4.85 118.94 115.76 2byt s TRP 422 Ca 0.68 1.42 -0.19 0.00 -0.00 0.00 0.00 56.10 58.01 2byt s TRP 422 Cb -0.36 -3.29 0.06 0.00 -0.00 0.00 0.00 33.47 29.88 2byt s TRP 422 CO 0.55 -0.61 0.63 -1.17 -0.00 0.00 0.00 176.95 176.35 2byt s LEU 423 N 3.20 5.03 -0.12 5.86 0.20 -1.26 0.18 118.68 131.78 2byt s LEU 423 Ca 0.45 -0.98 0.16 0.00 0.69 0.00 0.00 54.13 54.45 2byt s LEU 423 Cb -0.16 -2.42 0.60 0.00 -0.43 0.00 0.00 46.19 43.78 2byt s LEU 423 CO 0.07 -0.91 1.52 2.30 -0.29 0.00 0.00 176.35 179.04 2byt n ILE 424 N 5.60 1.86 -4.23 6.68 -5.35 -0.79 -4.31 119.36 118.81 2byt n ILE 424 Ca -0.07 -1.35 -0.35 0.00 -0.27 0.00 0.00 62.75 60.72 2byt n ILE 424 Cb 0.45 0.08 -0.10 0.00 -1.74 0.00 0.00 39.64 38.32 2byt n ILE 424 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2byt s SER 425 N -1.17 5.31 0.01 7.28 1.04 -1.23 -1.49 113.70 123.45 2byt s SER 425 Ca 0.44 0.07 0.07 0.00 0.48 0.00 0.00 55.95 57.01 2byt s SER 425 Cb 0.30 -1.75 -0.02 0.00 0.10 0.00 0.00 66.02 64.65 2byt s SER 425 CO 0.18 0.26 -0.21 -0.13 0.98 0.00 0.00 173.24 174.33 2byt s ARG 426 N -0.16 1.56 -1.20 4.02 1.81 0.25 -4.70 118.95 120.53 2byt s ARG 426 Ca 0.05 -0.82 -0.04 0.00 -1.72 0.00 0.00 55.73 53.20 2byt s ARG 426 Cb -0.12 -1.57 0.21 0.00 -0.45 0.00 0.00 34.95 33.01 2byt s ARG 426 CO 0.02 0.42 2.11 1.04 -0.68 0.00 0.00 175.30 178.21 2byt n GLN 427 N 2.27 4.90 -4.25 3.54 3.00 -1.26 -0.94 117.38 124.63 2byt n GLN 427 Ca -0.16 -3.98 -0.14 0.00 -0.01 0.00 0.00 57.00 52.71 2byt n GLN 427 Cb 0.53 -2.58 -0.10 0.00 0.00 0.00 0.00 30.24 28.09 2byt n GLN 427 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 2byt s ARG 428 N -2.41 1.09 -0.10 -1.09 1.81 -1.26 -4.42 118.95 112.56 2byt s ARG 428 Ca 0.47 -1.48 -0.03 0.00 -1.72 0.00 0.00 55.73 52.97 2byt s ARG 428 Cb 0.18 -0.53 -0.02 0.00 -0.45 0.00 0.00 34.95 34.13 2byt s ARG 428 CO -0.10 0.01 0.06 -0.92 -0.68 0.00 0.00 175.30 173.67 2byt h TYR 429 N 2.74 0.00 -0.79 -0.53 3.20 -1.91 -3.42 116.97 116.26 2byt h TYR 429 Ca -0.37 0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.30 2byt h TYR 429 Cb 1.19 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 2byt h TYR 429 CO 0.62 0.09 0.59 -0.46 -1.64 0.00 0.00 178.16 177.35 2byt s TRP 430 N -1.63 1.39 -0.14 -3.82 -0.00 -1.26 -4.80 118.94 108.69 2byt s TRP 430 Ca -0.02 1.39 -0.34 0.00 -0.00 0.00 0.00 56.10 57.13 2byt s TRP 430 Cb -0.00 -3.71 0.13 0.00 -0.00 0.00 0.00 33.47 29.89 2byt s TRP 430 CO 0.06 -1.82 1.22 0.20 -0.00 0.00 0.00 176.95 176.61 2byt s GLY 431 N 9.89 -0.33 -0.10 5.86 0.00 -1.26 -2.89 107.32 118.49 2byt s GLY 431 Ca 0.84 1.35 -0.30 0.00 0.00 0.00 0.00 44.72 46.61 2byt s GLY 431 CO 0.09 0.42 1.22 -1.59 0.00 0.00 0.00 173.10 173.23 2byt s THR 432 N -2.45 4.28 0.13 0.90 2.01 -1.25 -4.78 115.64 114.49 2byt s THR 432 Ca 0.11 1.59 -0.31 0.00 0.31 0.00 0.00 61.69 63.38 2byt s THR 432 Cb 0.00 -4.02 -0.10 0.00 0.01 0.00 0.00 72.50 68.40 2byt s THR 432 CO -0.04 -0.06 1.65 -2.84 -0.69 0.00 0.00 174.62 172.64 2byt s PRO 433 N 2.72 4.19 -0.07 4.92 0.02 -1.26 0.67 135.00 146.19 2byt s PRO 433 Ca 0.55 2.41 -0.30 0.00 0.02 0.00 0.00 61.00 63.68 2byt s PRO 433 Cb -0.23 -3.36 -0.04 0.00 0.02 0.00 0.00 34.50 30.88 2byt s PRO 433 CO 0.19 -0.70 1.49 0.42 -0.33 0.00 0.00 177.00 178.07 2byt s ILE 434 N 1.89 3.78 0.00 2.83 1.01 -1.20 -4.86 121.20 124.65 2byt s ILE 434 Ca 0.73 1.02 -0.02 0.00 0.00 0.00 0.00 60.65 62.38 2byt s ILE 434 Cb -0.43 -3.66 -0.10 0.00 0.01 0.00 0.00 42.46 38.28 2byt s ILE 434 CO 0.32 -0.07 1.90 -0.81 0.00 0.00 0.00 174.94 176.29 2byt n PRO 435 N 6.50 0.95 -4.31 2.79 -0.04 -1.26 -4.49 135.00 135.14 2byt n PRO 435 Ca 0.15 -0.39 -0.22 0.00 -0.04 0.00 0.00 63.50 63.01 2byt n PRO 435 Cb 0.43 -1.61 -0.11 0.00 -0.04 0.00 0.00 33.50 32.17 2byt n PRO 435 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2byt s MET 436 N 1.57 1.21 0.18 0.54 -1.94 -1.26 -1.57 119.30 118.02 2byt s MET 436 Ca 0.26 -1.33 0.06 0.00 -1.71 0.00 0.00 55.69 52.96 2byt s MET 436 Cb 0.12 -1.28 -0.05 0.00 2.01 0.00 0.00 34.83 35.64 2byt s MET 436 CO 0.00 0.27 -0.10 0.08 -0.01 0.00 0.00 175.02 175.26 2byt s VAL 437 N -1.88 1.36 -0.35 -6.03 1.01 -0.17 -1.22 120.40 113.12 2byt s VAL 437 Ca 0.13 -2.11 0.03 0.00 0.00 0.00 0.00 61.98 60.03 2byt s VAL 437 Cb -0.06 -2.01 0.10 0.00 0.00 0.00 0.00 36.38 34.41 2byt s VAL 437 CO 0.06 -0.62 0.07 -1.00 0.00 0.00 0.00 175.10 173.61 2byt s HIS 438 N -3.21 3.41 0.39 5.22 3.76 0.46 -1.67 115.29 123.65 2byt s HIS 438 Ca 0.21 -2.82 -0.04 0.00 -0.15 0.00 0.00 55.06 52.25 2byt s HIS 438 Cb 0.02 -2.73 -0.04 0.00 1.11 0.00 0.00 32.58 30.94 2byt s HIS 438 CO 0.04 -0.93 0.66 0.00 -0.85 0.00 0.00 174.74 173.67 2byt n GLU 440 N -1.73 0.63 -0.10 0.00 2.13 -1.26 -2.47 120.64 117.84 2byt n GLU 440 Ca -0.01 0.16 -0.13 0.00 0.66 0.00 0.00 57.16 57.83 2byt n GLU 440 Cb 0.55 -1.75 -0.14 0.00 0.27 0.00 0.00 31.44 30.37 2byt n GLU 440 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2byt n ALA 441 N -2.41 1.45 -0.01 4.31 0.00 -1.26 -4.50 120.51 118.08 2byt n ALA 441 Ca -0.11 -1.19 -0.02 0.00 0.00 0.00 0.00 53.44 52.12 2byt n ALA 441 Cb 0.84 -0.21 -0.12 0.00 0.00 0.00 0.00 19.45 19.96 2byt n ALA 441 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2byt n GLY 443 N 1.48 0.79 3.56 0.00 0.00 -1.03 -4.80 105.19 105.19 2byt n GLY 443 Ca -0.15 -1.26 -0.43 0.00 0.00 0.00 0.00 46.02 44.18 2byt n GLY 443 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2byt s VAL 444 N 0.00 4.69 -0.06 1.61 1.01 -1.26 0.21 120.40 126.60 2byt s VAL 444 Ca 0.00 0.66 0.05 0.00 0.00 0.00 0.00 61.98 62.70 2byt s VAL 444 Cb 0.00 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 32.10 2byt s VAL 444 CO 0.00 -0.58 -0.23 -0.69 0.00 0.00 0.00 175.10 173.61 2byt s VAL 445 N 3.21 2.28 0.09 2.92 1.01 -0.67 -4.98 120.40 124.26 2byt s VAL 445 Ca 0.31 -0.99 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 2byt s VAL 445 Cb -0.13 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.36 2byt s VAL 445 CO 0.20 0.57 1.00 -2.16 0.00 0.00 0.00 175.10 174.71 2byt s PRO 446 N -0.25 4.63 0.55 2.72 0.04 -1.26 -1.00 135.00 140.42 2byt s PRO 446 Ca -0.00 1.51 -0.21 0.00 0.04 0.00 0.00 61.00 62.33 2byt s PRO 446 Cb -0.13 -3.38 -0.05 0.00 0.04 0.00 0.00 34.50 30.98 2byt s PRO 446 CO 0.03 0.10 1.27 0.08 0.04 0.00 0.00 177.00 178.52 2byt s VAL 447 N 0.27 2.43 0.50 -0.36 1.01 -0.61 -4.94 120.40 118.70 2byt s VAL 447 Ca 0.49 0.30 -0.23 0.00 0.00 0.00 0.00 61.98 62.54 2byt s VAL 447 Cb -0.24 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 2byt s VAL 447 CO 0.30 -0.02 1.39 -2.84 0.00 0.00 0.00 175.10 173.92 2byt s PRO 448 N -3.01 3.41 0.33 2.72 0.02 -1.26 -4.92 135.00 132.30 2byt s PRO 448 Ca 0.72 2.31 0.02 0.00 0.02 0.00 0.00 61.00 64.08 2byt s PRO 448 Cb -0.35 -2.45 0.58 0.00 0.02 0.00 0.00 34.50 32.30 2byt s PRO 448 CO 0.41 -1.00 1.91 1.49 -0.33 0.00 0.00 177.00 179.48 2byt h GLU 449 N 1.88 0.70 -0.01 5.54 4.81 -2.00 -2.53 114.58 122.97 2byt h GLU 449 Ca -0.51 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 58.62 2byt h GLU 449 Cb 1.28 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.54 2byt h GLU 449 CO 0.59 0.59 -0.10 -0.85 -0.73 0.00 0.00 179.01 178.51 2byt n GLU 450 N -4.34 0.97 0.00 1.92 0.28 -1.26 -3.35 120.64 114.86 2byt n GLU 450 Ca 0.04 -0.41 0.12 0.00 -0.16 0.00 0.00 57.16 56.74 2byt n GLU 450 Cb 0.17 -1.49 0.21 0.00 1.43 0.00 0.00 31.44 31.76 2byt n GLU 450 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2byt n GLU 451 N -0.65 0.64 -1.74 3.44 2.13 -0.95 -4.93 120.64 118.57 2byt n GLU 451 Ca 0.16 -0.44 -0.33 0.00 0.66 0.00 0.00 57.16 57.21 2byt n GLU 451 Cb 0.29 -1.49 0.05 0.00 0.27 0.00 0.00 31.44 30.56 2byt n GLU 451 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2byt s LEU 452 N -2.66 3.40 0.00 4.31 1.43 -1.21 -4.69 118.68 119.25 2byt s LEU 452 Ca 0.18 2.08 -0.07 0.00 -1.03 0.00 0.00 54.13 55.29 2byt s LEU 452 Cb 0.18 -4.56 0.09 0.00 0.03 0.00 0.00 46.19 41.93 2byt s LEU 452 CO 0.61 -1.71 0.52 -0.81 0.23 0.00 0.00 176.35 175.19 2byt n PRO 453 N -2.39 -0.60 -3.51 1.29 -0.04 -1.26 -5.11 135.00 123.38 2byt n PRO 453 Ca 0.11 -0.80 -0.27 0.00 -0.04 0.00 0.00 63.50 62.50 2byt n PRO 453 Cb 0.52 -0.55 -0.09 0.00 -0.04 0.00 0.00 33.50 33.34 2byt n PRO 453 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2byt n VAL 454 N -2.77 1.28 -1.02 0.52 0.31 -1.26 -5.10 118.33 110.29 2byt n VAL 454 Ca 0.07 -4.74 -0.36 0.00 -0.01 0.00 0.00 64.34 59.30 2byt n VAL 454 Cb 0.23 -2.05 0.05 0.00 -0.91 0.00 0.00 33.84 31.16 2byt n VAL 454 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2byt n LEU 455 N 1.45 -4.26 -4.79 7.52 4.32 -1.26 -4.61 117.00 115.37 2byt n LEU 455 Ca 0.26 0.30 -0.39 0.00 -0.02 0.00 0.00 56.01 56.16 2byt n LEU 455 Cb 0.42 -0.88 -0.06 0.00 -1.62 0.00 0.00 43.42 41.28 2byt n LEU 455 CO 0.30 -5.27 0.28 -0.22 -1.22 0.00 0.00 177.39 171.26 2byt s LEU 456 N 5.49 4.48 0.15 2.23 0.20 -1.26 -4.97 118.68 125.01 2byt s LEU 456 Ca 0.47 1.23 -0.34 0.00 0.69 0.00 0.00 54.13 56.17 2byt s LEU 456 Cb -0.24 -2.91 -0.15 0.00 -0.43 0.00 0.00 46.19 42.46 2byt s LEU 456 CO 0.76 0.21 1.45 -2.65 -0.29 0.00 0.00 176.35 175.83 2byt n PRO 457 N 2.12 1.76 -2.37 0.98 -0.02 -1.26 -4.86 135.00 131.36 2byt n PRO 457 Ca -0.09 0.63 -0.43 0.00 -2.02 0.00 0.00 63.50 61.60 2byt n PRO 457 Cb 0.51 -2.33 -0.02 0.00 -0.02 0.00 0.00 33.50 31.64 2byt n PRO 457 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2byt s ASP 458 N 0.61 6.37 -0.14 2.55 -1.08 -1.26 -4.98 116.67 118.73 2byt s ASP 458 Ca 0.78 0.83 0.02 0.00 -0.52 0.00 0.00 52.55 53.66 2byt s ASP 458 Cb -0.77 -2.54 0.01 0.00 -1.46 0.00 0.00 42.92 38.17 2byt s ASP 458 CO 0.43 -1.41 -0.19 -0.76 0.52 0.00 0.00 175.17 173.77 2byt s LEU 459 N 5.33 1.97 -0.19 -1.34 1.02 -1.26 -5.01 118.68 119.20 2byt s LEU 459 Ca 0.60 -0.56 0.08 0.00 0.02 0.00 0.00 54.13 54.27 2byt s LEU 459 Cb -0.13 -1.34 -0.22 0.00 0.02 0.00 0.00 46.19 44.52 2byt s LEU 459 CO 0.32 0.03 0.07 0.29 0.02 0.00 0.00 176.35 177.08 2byt n LYS 460 N 4.32 0.68 -1.57 1.70 4.76 -1.26 -4.88 118.16 121.90 2byt n LYS 460 Ca -0.20 0.12 -0.40 0.00 -2.87 0.00 0.00 58.31 54.97 2byt n LYS 460 Cb 0.51 -1.58 -0.03 0.00 -1.84 0.00 0.00 35.03 32.09 2byt n LYS 460 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2byt n ASP 461 N -3.07 2.74 -0.37 4.39 4.64 -1.26 -4.84 116.55 118.77 2byt n ASP 461 Ca -0.36 -0.15 0.03 0.00 -1.38 0.00 0.00 54.79 52.93 2byt n ASP 461 Cb 1.07 -1.56 0.18 0.00 -1.04 0.00 0.00 41.12 39.76 2byt n ASP 461 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 2byt h VAL 462 N 7.44 1.08 0.00 5.18 2.07 -1.96 0.63 116.25 130.69 2byt h VAL 462 Ca -0.32 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 66.80 2byt h VAL 462 Cb 1.26 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2byt h VAL 462 CO 1.06 0.21 0.00 -0.62 0.02 0.00 0.00 177.57 178.25 2byt n GLU 463 N -4.51 0.46 -0.10 1.57 1.02 -1.26 -3.35 120.64 114.47 2byt n GLU 463 Ca 0.16 0.05 -0.18 0.00 -0.02 0.00 0.00 57.16 57.16 2byt n GLU 463 Cb 0.19 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.01 2byt n GLU 463 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 2byt h ASP 464 N 0.00 0.00 0.00 1.62 -0.00 -1.25 -3.38 116.42 113.41 2byt h ASP 464 Ca 0.00 -0.43 -0.04 0.00 -0.00 0.00 0.00 57.03 56.56 2byt h ASP 464 Cb 0.11 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 39.43 2byt h ASP 464 CO 0.00 1.34 -0.08 2.30 -0.00 0.00 0.00 179.24 182.80 2byt n ILE 465 N -4.47 2.09 -4.97 2.25 -5.35 -1.08 -4.82 119.36 103.00 2byt n ILE 465 Ca -0.27 -0.68 -0.32 0.00 -0.27 0.00 0.00 62.75 61.21 2byt n ILE 465 Cb 0.59 -1.58 -0.15 0.00 -1.74 0.00 0.00 39.64 36.76 2byt n ILE 465 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2byt s ARG 466 N 0.35 2.90 0.12 6.28 3.52 -1.26 -4.73 118.95 126.13 2byt s ARG 466 Ca 0.14 -0.76 -0.31 0.00 -0.13 0.00 0.00 55.73 54.67 2byt s ARG 466 Cb 0.07 -2.41 -0.08 0.00 -1.56 0.00 0.00 34.95 30.97 2byt s ARG 466 CO 0.00 0.36 1.33 -1.25 -0.81 0.00 0.00 175.30 174.94 2byt s PRO 467 N -0.08 4.36 -0.03 5.12 0.04 -1.26 -4.79 135.00 138.36 2byt s PRO 467 Ca -0.04 2.00 0.05 0.00 0.04 0.00 0.00 61.00 63.05 2byt s PRO 467 Cb -0.14 -3.26 0.07 0.00 0.04 0.00 0.00 34.50 31.21 2byt s PRO 467 CO 0.04 -0.37 0.93 1.63 0.04 0.00 0.00 177.00 179.27 2byt n LYS 468 N 3.75 0.72 0.00 4.56 5.02 -1.26 -4.93 118.16 126.02 2byt n LYS 468 Ca 0.10 -1.34 0.00 0.00 -2.02 0.00 0.00 58.31 55.05 2byt n LYS 468 Cb 0.43 -0.81 0.00 0.00 -0.02 0.00 0.00 35.03 34.63 2byt n LYS 468 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2byt n GLY 469 N -0.42 0.84 3.55 0.72 0.00 -1.26 -5.09 105.19 103.53 2byt n GLY 469 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 2byt n GLY 469 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2byt s LYS 470 N 0.00 1.84 -0.03 1.61 1.02 -1.26 -4.95 119.74 117.98 2byt s LYS 470 Ca 0.00 -2.05 -0.30 0.00 0.02 0.00 0.00 55.97 53.64 2byt s LYS 470 Cb 0.00 -1.23 -0.05 0.00 -0.52 0.00 0.00 37.83 36.03 2byt s LYS 470 CO 0.00 -0.16 1.49 0.45 -0.92 0.00 0.00 175.35 176.21 2byt s SER 471 N -3.62 6.78 0.39 2.83 0.15 -1.26 -4.82 113.70 114.15 2byt s SER 471 Ca 0.33 2.15 0.21 0.00 0.70 0.00 0.00 55.95 59.33 2byt s SER 471 Cb 0.08 -2.55 1.12 0.00 -1.71 0.00 0.00 66.02 62.96 2byt s SER 471 CO 0.15 -0.81 1.59 -0.65 1.20 0.00 0.00 173.24 174.73 2byt h PRO 472 N 8.42 0.00 0.00 5.44 0.11 -1.85 0.87 132.00 144.99 2byt h PRO 472 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2byt h PRO 472 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2byt h PRO 472 CO 0.93 0.00 -0.23 -0.07 -0.21 0.00 0.00 178.00 178.42 2byt h LEU 473 N 0.00 0.00 -1.87 2.35 3.38 -1.89 -3.30 115.31 113.97 2byt h LEU 473 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2byt h LEU 473 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2byt h LEU 473 CO 0.00 0.02 0.00 -0.62 0.09 0.00 0.00 178.44 177.93 2byt n GLU 474 N -2.49 0.68 -0.30 1.13 -0.58 0.30 -2.54 120.64 116.84 2byt n GLU 474 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 2byt n GLU 474 Cb 0.47 -1.18 0.00 0.00 -0.57 0.00 0.00 31.44 30.16 2byt n GLU 474 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2byt n ALA 475 N 0.60 1.60 -3.50 0.62 0.00 -1.24 -5.00 120.51 113.59 2byt n ALA 475 Ca 0.00 -0.61 -0.27 0.00 0.00 0.00 0.00 53.44 52.56 2byt n ALA 475 Cb 0.32 -0.23 -0.11 0.00 0.00 0.00 0.00 19.45 19.44 2byt n ALA 475 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2byt s HIS 476 N 0.00 1.52 0.43 0.00 3.76 -1.05 -4.97 115.29 114.97 2byt s HIS 476 Ca 0.00 -2.45 0.21 0.00 -0.15 0.00 0.00 55.06 52.66 2byt s HIS 476 Cb 0.00 -1.26 1.17 0.00 1.11 0.00 0.00 32.58 33.60 2byt s HIS 476 CO 0.00 -0.78 1.81 -1.35 -0.85 0.00 0.00 174.74 173.58 2byt h PRO 477 N 5.74 0.32 0.00 8.40 0.11 -1.95 0.84 132.00 145.46 2byt h PRO 477 Ca 0.22 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.31 2byt h PRO 477 Cb 0.89 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2byt h PRO 477 CO 0.43 0.21 0.28 1.05 -0.21 0.00 0.00 178.00 179.76 2byt h GLU 478 N 0.33 0.00 0.00 1.05 9.09 -1.94 0.50 114.58 123.61 2byt h GLU 478 Ca 0.53 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.94 2byt h GLU 478 Cb 1.47 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.57 2byt h GLU 478 CO -0.20 0.00 -0.92 0.34 0.05 0.00 0.00 179.01 178.28 2byt n PHE 479 N -2.36 0.13 0.25 2.06 7.35 0.29 -4.72 117.46 120.46 2byt n PHE 479 Ca -0.01 0.05 0.12 0.00 -0.76 0.00 0.00 57.45 56.85 2byt n PHE 479 Cb 0.31 -0.53 0.18 0.00 0.35 0.00 0.00 39.48 39.79 2byt n PHE 479 CO 0.00 0.00 0.00 0.10 -0.76 0.00 0.00 176.76 176.10 2byt h TYR 480 N -0.98 0.00 0.00 -5.13 -0.00 -1.54 -3.39 116.97 105.93 2byt h TYR 480 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 58.73 58.34 2byt h TYR 480 Cb 0.92 0.00 0.02 0.00 0.00 0.00 0.00 36.73 37.67 2byt h TYR 480 CO -0.39 0.00 2.54 0.39 -0.00 0.00 0.00 178.16 180.70 2byt n GLU 481 N -3.01 1.97 -3.25 0.10 1.02 0.15 -2.87 120.64 114.75 2byt n GLU 481 Ca 0.04 -1.47 -0.20 0.00 -0.02 0.00 0.00 57.16 55.51 2byt n GLU 481 Cb 0.52 -2.48 0.01 0.00 -0.02 0.00 0.00 31.44 29.47 2byt n GLU 481 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 2byt n THR 482 N 4.39 0.00 -4.09 2.62 5.66 -1.25 -4.98 114.28 116.64 2byt n THR 482 Ca 0.44 -1.74 -0.22 0.00 -3.05 0.00 0.00 64.05 59.47 2byt n THR 482 Cb 0.15 -0.21 -0.04 0.00 -1.55 0.00 0.00 70.33 68.69 2byt n THR 482 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2byt s THR 483 N -2.18 4.61 -0.02 1.09 -4.23 -1.26 -1.14 115.64 112.51 2byt s THR 483 Ca 0.30 -1.31 -0.29 0.00 -1.18 0.00 0.00 61.69 59.21 2byt s THR 483 Cb -0.02 -3.49 -0.03 0.00 1.34 0.00 0.00 72.50 70.30 2byt s THR 483 CO 0.19 -0.34 0.94 0.00 -0.54 0.00 0.00 174.62 174.87 2byt n PRO 485 N 3.99 1.20 -0.03 0.00 -0.04 -1.26 -2.28 135.00 136.59 2byt n PRO 485 Ca 0.05 -0.31 -0.02 0.00 -0.04 0.00 0.00 63.50 63.17 2byt n PRO 485 Cb 0.51 -1.22 -0.01 0.00 -0.04 0.00 0.00 33.50 32.74 2byt n PRO 485 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2byt n LYS 486 N -0.38 0.16 -0.07 0.54 4.81 -1.26 -4.86 118.16 117.09 2byt n LYS 486 Ca 0.10 0.14 -0.08 0.00 -0.87 0.00 0.00 58.31 57.61 2byt n LYS 486 Cb 0.11 -0.86 -0.04 0.00 0.02 0.00 0.00 35.03 34.26 2byt n LYS 486 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2byt n GLY 488 N 1.61 0.16 0.33 0.00 0.00 -0.97 -5.05 105.19 101.28 2byt n GLY 488 Ca -0.11 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 2byt n GLY 488 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2byt n GLY 489 N 0.00 -0.23 3.70 -0.02 0.00 -1.26 -4.64 105.19 102.74 2byt n GLY 489 Ca 0.00 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 2byt n GLY 489 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2byt s PRO 490 N -2.94 4.33 0.03 1.61 0.04 -1.26 -1.31 135.00 135.50 2byt s PRO 490 Ca 0.06 1.91 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2byt s PRO 490 Cb -0.00 -3.46 -0.00 0.00 0.04 0.00 0.00 34.50 31.07 2byt s PRO 490 CO 0.04 -0.47 0.01 0.00 0.04 0.00 0.00 177.00 176.62 2byt n ALA 491 N 4.80 0.04 -3.66 8.56 0.00 -0.29 -4.42 120.51 125.53 2byt n ALA 491 Ca 0.12 -0.16 -0.07 0.00 0.00 0.00 0.00 53.44 53.32 2byt n ALA 491 Cb 0.44 0.10 -0.09 0.00 0.00 0.00 0.00 19.45 19.91 2byt n ALA 491 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2byt s LYS 492 N -2.12 0.41 0.42 0.00 2.20 -0.94 -3.80 119.74 115.91 2byt s LYS 492 Ca 0.01 1.08 -0.25 0.00 -0.36 0.00 0.00 55.97 56.45 2byt s LYS 492 Cb 0.00 0.35 -0.08 0.00 -1.51 0.00 0.00 37.83 36.59 2byt s LYS 492 CO 0.01 -0.22 1.23 1.03 -0.36 0.00 0.00 175.35 177.04 2byt s ARG 493 N 2.36 3.91 0.10 4.03 0.52 -1.14 0.17 118.95 128.90 2byt s ARG 493 Ca -0.05 1.97 -0.31 0.00 -0.52 0.00 0.00 55.73 56.82 2byt s ARG 493 Cb -0.11 -2.63 -0.08 0.00 0.52 0.00 0.00 34.95 32.65 2byt s ARG 493 CO -0.14 -0.48 1.57 0.34 0.02 0.00 0.00 175.30 176.60 2byt s ASP 494 N -1.02 6.65 0.30 0.23 2.15 -0.36 -4.84 116.67 119.79 2byt s ASP 494 Ca 0.59 2.47 0.26 0.00 0.43 0.00 0.00 52.55 56.30 2byt s ASP 494 Cb -0.34 -2.58 0.82 0.00 -0.30 0.00 0.00 42.92 40.53 2byt s ASP 494 CO 0.42 -0.82 1.75 0.71 -0.17 0.00 0.00 175.17 177.06 2byt h THR 495 N 4.50 0.00 -4.26 1.71 1.35 -1.91 -3.42 112.91 110.88 2byt h THR 495 Ca -0.42 -0.53 -0.50 0.00 -0.55 0.00 0.00 66.41 64.41 2byt h THR 495 Cb 1.20 1.47 0.12 0.00 -1.73 0.00 0.00 68.15 69.21 2byt h THR 495 CO 0.91 0.00 0.32 -1.81 -0.25 0.00 0.00 175.52 174.70 2byt s ASP 496 N -4.93 4.48 0.12 5.36 1.01 -1.26 -4.60 116.67 116.85 2byt s ASP 496 Ca 0.07 1.49 0.05 0.00 0.71 0.00 0.00 52.55 54.88 2byt s ASP 496 Cb 0.10 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.75 2byt s ASP 496 CO 0.56 -2.00 -0.13 0.42 0.21 0.00 0.00 175.17 174.23 2byt s THR 497 N -3.05 1.27 0.15 -1.27 -4.23 -0.12 -3.22 115.64 105.17 2byt s THR 497 Ca 0.61 -1.75 -0.30 0.00 -1.18 0.00 0.00 61.69 59.07 2byt s THR 497 Cb -0.15 -1.54 -0.08 0.00 1.34 0.00 0.00 72.50 72.06 2byt s THR 497 CO 0.55 -0.47 1.28 -0.04 -0.54 0.00 0.00 174.62 175.40 2byt s MET 498 N -2.80 4.40 0.66 3.99 -1.94 0.21 0.86 119.30 124.69 2byt s MET 498 Ca 0.09 1.96 -0.18 0.00 -1.71 0.00 0.00 55.69 55.86 2byt s MET 498 Cb -0.04 -3.25 -0.00 0.00 2.01 0.00 0.00 34.83 33.55 2byt s MET 498 CO 0.02 -0.26 1.27 -3.47 -0.01 0.00 0.00 175.02 172.57 2byt n ASP 499 N 3.19 1.90 -0.17 3.03 -0.08 -0.55 -3.79 116.55 120.08 2byt n ASP 499 Ca 0.08 0.80 -0.06 0.00 -1.51 0.00 0.00 54.79 54.10 2byt n ASP 499 Cb 0.44 -1.54 -0.01 0.00 2.34 0.00 0.00 41.12 42.35 2byt n ASP 499 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2byt h THR 500 N 0.38 0.19 -1.36 5.18 1.03 -1.93 -1.91 112.91 114.49 2byt h THR 500 Ca -0.50 0.00 0.40 0.00 -0.01 0.00 0.00 66.41 66.29 2byt h THR 500 Cb 1.34 0.19 -0.05 0.00 -1.07 0.00 0.00 68.15 68.56 2byt h THR 500 CO 0.52 0.00 1.07 -0.26 -0.01 0.00 0.00 175.52 176.84 2byt h PHE 501 N -0.20 0.00 0.38 0.00 0.04 -1.94 -1.39 116.94 113.82 2byt h PHE 501 Ca 0.20 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.97 2byt h PHE 501 Cb 0.54 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.67 2byt h PHE 501 CO -0.60 0.00 -0.41 0.35 -0.60 0.00 0.00 178.31 177.06 2byt h PHE 502 N 0.00 -1.12 0.00 -0.55 3.04 -1.69 -1.74 116.94 114.88 2byt h PHE 502 Ca 0.65 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.61 2byt h PHE 502 Cb 2.78 0.44 0.00 0.00 2.56 0.00 0.00 35.95 41.73 2byt h PHE 502 CO 0.00 -0.56 0.00 0.38 -2.02 0.00 0.00 178.31 176.11 2byt h ASP 503 N -0.81 0.00 -0.43 0.41 3.04 -1.42 -1.94 116.42 115.26 2byt h ASP 503 Ca -0.03 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.76 2byt h ASP 503 Cb 0.73 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.02 2byt h ASP 503 CO -0.08 0.00 0.00 -1.54 -2.04 0.00 0.00 179.24 175.58 2byt n SER 504 N -3.08 3.22 -0.52 4.15 3.41 -0.72 -3.85 113.62 116.23 2byt n SER 504 Ca -0.01 -2.27 0.08 0.00 -0.26 0.00 0.00 58.87 56.41 2byt n SER 504 Cb 0.23 -0.46 0.03 0.00 -0.26 0.00 0.00 64.21 63.75 2byt n SER 504 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2byt n SER 505 N 0.67 2.00 -0.08 4.04 7.64 -0.73 -4.59 113.62 122.58 2byt n SER 505 Ca 0.17 -1.50 0.00 0.00 1.01 0.00 0.00 58.87 58.55 2byt n SER 505 Cb 0.61 0.25 0.00 0.00 -1.01 0.00 0.00 64.21 64.05 2byt n SER 505 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 2byt n TRP 506 N 0.39 0.00 -0.29 1.43 4.27 -1.26 -4.48 117.44 117.50 2byt n TRP 506 Ca 0.08 0.00 -0.05 0.00 -3.89 0.00 0.00 57.50 53.65 2byt n TRP 506 Cb 0.38 0.07 0.07 0.00 -1.36 0.00 0.00 31.31 30.47 2byt n TRP 506 CO 0.00 0.00 0.00 0.10 -2.29 0.00 0.00 177.69 175.50 2byt h TYR 507 N 0.00 1.02 -0.74 -2.67 -0.00 -1.81 -0.82 116.97 111.95 2byt h TYR 507 Ca 0.00 0.00 0.21 0.00 -0.00 0.00 0.00 58.73 58.95 2byt h TYR 507 Cb 1.03 -0.34 -0.03 0.00 -0.00 0.00 0.00 36.73 37.40 2byt h TYR 507 CO -0.01 0.68 0.75 0.10 -0.00 0.00 0.00 178.16 179.68 2byt h TYR 508 N 1.07 0.00 0.13 0.10 -0.00 -1.91 0.67 116.97 117.03 2byt h TYR 508 Ca 0.28 0.00 -0.29 0.00 0.00 0.00 0.00 58.73 58.72 2byt h TYR 508 Cb -0.05 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.68 2byt h TYR 508 CO -0.01 0.00 -1.34 -0.07 -0.00 0.00 0.00 178.16 176.74 2byt h LEU 509 N 0.00 0.44 -0.87 0.10 3.38 -1.54 -3.33 115.31 113.50 2byt h LEU 509 Ca 0.35 -0.51 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 2byt h LEU 509 Cb 1.84 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 42.42 2byt h LEU 509 CO -0.00 1.41 0.31 -0.09 0.09 0.00 0.00 178.44 180.15 2byt h ARG 510 N 0.08 1.14 -0.38 1.13 9.65 0.46 -2.42 114.38 124.03 2byt h ARG 510 Ca -0.17 -0.20 0.11 0.00 -1.10 0.00 0.00 59.98 58.61 2byt h ARG 510 Cb 2.00 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 30.38 2byt h ARG 510 CO 0.20 0.92 0.49 1.88 2.80 0.00 0.00 179.97 186.25 2byt h TYR 511 N 1.11 0.00 0.00 2.20 0.05 -1.56 0.31 116.97 119.08 2byt h TYR 511 Ca 0.26 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.01 2byt h TYR 511 Cb 0.21 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.94 2byt h TYR 511 CO 0.02 0.00 -0.12 1.79 -1.05 0.00 0.00 178.16 178.80 2byt h THR 512 N 0.00 0.26 -0.70 -2.88 1.35 -1.61 -3.37 112.91 105.95 2byt h THR 512 Ca 0.18 -0.94 -0.16 0.00 -0.55 0.00 0.00 66.41 64.94 2byt h THR 512 Cb 1.15 1.76 -0.15 0.00 -1.73 0.00 0.00 68.15 69.17 2byt h THR 512 CO -0.00 0.11 -0.47 -0.67 -0.25 0.00 0.00 175.52 174.24 2byt n ASP 513 N -3.21 -3.24 0.03 5.36 2.03 0.94 -4.69 116.55 113.77 2byt n ASP 513 Ca 0.01 -2.95 0.10 0.00 0.52 0.00 0.00 54.79 52.47 2byt n ASP 513 Cb 0.42 1.74 0.41 0.00 -0.72 0.00 0.00 41.12 42.97 2byt n ASP 513 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2byt n PRO 514 N 2.57 0.04 -1.99 -0.67 -0.04 -0.25 -3.80 135.00 130.86 2byt n PRO 514 Ca 0.15 0.22 -0.22 0.00 -0.04 0.00 0.00 63.50 63.61 2byt n PRO 514 Cb 0.58 -1.57 0.03 0.00 -0.04 0.00 0.00 33.50 32.50 2byt n PRO 514 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2byt n HIS 515 N -1.65 2.59 -3.59 0.54 8.25 -1.26 -5.03 115.22 115.06 2byt n HIS 515 Ca 0.04 -2.19 -0.37 0.00 -0.26 0.00 0.00 57.72 54.95 2byt n HIS 515 Cb 0.23 -0.33 -0.07 0.00 1.12 0.00 0.00 29.99 30.94 2byt n HIS 515 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2byt s ASN 516 N -3.59 6.50 -0.10 0.41 3.84 -1.25 -4.95 114.94 115.80 2byt s ASN 516 Ca 0.50 0.59 0.14 0.00 0.21 0.00 0.00 52.86 54.30 2byt s ASN 516 Cb 0.41 -2.17 0.31 0.00 -0.55 0.00 0.00 41.25 39.24 2byt s ASN 516 CO 0.03 0.21 1.21 -0.90 -2.79 0.00 0.00 177.10 174.86 2byt n ASP 517 N 2.90 2.80 -0.01 -4.21 5.75 -1.26 -4.58 116.55 117.94 2byt n ASP 517 Ca -0.14 -2.72 -0.01 0.00 -0.01 0.00 0.00 54.79 51.91 2byt n ASP 517 Cb 0.53 -0.36 -0.01 0.00 -1.03 0.00 0.00 41.12 40.25 2byt n ASP 517 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2byt n ARG 518 N -0.74 1.42 -3.92 0.11 5.12 -1.26 -5.08 116.66 112.30 2byt n ARG 518 Ca 0.14 0.01 -0.09 0.00 -1.93 0.00 0.00 57.85 55.98 2byt n ARG 518 Cb 0.61 -1.05 -0.08 0.00 -1.16 0.00 0.00 32.46 30.78 2byt n ARG 518 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2byt s LEU 519 N -4.77 1.51 0.65 0.55 1.43 -1.26 -5.01 118.68 111.78 2byt s LEU 519 Ca -0.02 -0.77 0.34 0.00 -1.03 0.00 0.00 54.13 52.65 2byt s LEU 519 Cb 0.01 0.91 1.88 0.00 0.03 0.00 0.00 46.19 49.01 2byt s LEU 519 CO 0.07 -0.74 2.08 -0.65 0.23 0.00 0.00 176.35 177.34 2byt h PRO 520 N 2.77 0.00 0.00 1.29 0.11 -1.93 -3.43 132.00 130.81 2byt h PRO 520 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2byt h PRO 520 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2byt h PRO 520 CO 0.56 0.00 0.00 1.97 -0.21 0.00 0.00 178.00 180.32 2byt n PHE 521 N -3.09 0.00 -2.84 0.65 1.16 -1.26 -4.65 117.46 107.42 2byt n PHE 521 Ca -0.01 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.15 2byt n PHE 521 Cb 0.29 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.12 2byt n PHE 521 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2byt s ASP 522 N 0.00 6.92 0.27 5.98 3.68 -1.26 -4.93 116.67 127.33 2byt s ASP 522 Ca 0.00 1.15 -0.00 0.00 2.13 0.00 0.00 52.55 55.82 2byt s ASP 522 Cb 0.00 -2.46 0.61 0.00 -1.45 0.00 0.00 42.92 39.61 2byt s ASP 522 CO 0.00 -0.52 1.69 -0.65 0.13 0.00 0.00 175.17 175.82 2byt h PRO 523 N 7.55 0.35 -0.83 4.34 0.11 -1.97 -0.17 132.00 141.38 2byt h PRO 523 Ca -0.24 -0.02 0.17 0.00 0.11 0.00 0.00 66.00 66.02 2byt h PRO 523 Cb 1.09 -0.08 -0.11 0.00 0.11 0.00 0.00 31.00 32.02 2byt h PRO 523 CO 0.89 0.23 0.36 1.49 -0.21 0.00 0.00 178.00 180.75 2byt h GLU 524 N 0.36 0.45 0.00 1.05 4.81 -1.91 -0.30 114.58 119.04 2byt h GLU 524 Ca 0.49 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.70 2byt h GLU 524 Cb 0.89 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.17 2byt h GLU 524 CO -0.52 0.30 0.00 1.63 -0.73 0.00 0.00 179.01 179.69 2byt n LYS 525 N -5.00 0.00 -0.30 1.92 4.76 -0.12 -3.01 118.16 116.41 2byt n LYS 525 Ca 0.18 0.36 0.28 0.00 -2.87 0.00 0.00 58.31 56.26 2byt n LYS 525 Cb 0.51 -1.16 0.51 0.00 -1.84 0.00 0.00 35.03 33.04 2byt n LYS 525 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2byt n ALA 526 N -1.59 0.93 0.18 7.82 0.00 -0.92 0.19 120.51 127.11 2byt n ALA 526 Ca 0.00 0.82 0.03 0.00 0.00 0.00 0.00 53.44 54.29 2byt n ALA 526 Cb 0.00 -0.86 0.31 0.00 0.00 0.00 0.00 19.45 18.90 2byt n ALA 526 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2byt h ASN 527 N 0.00 0.00 0.67 0.00 2.35 -1.12 0.13 115.58 117.61 2byt h ASN 527 Ca 0.72 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 56.34 2byt h ASN 527 Cb 2.00 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 40.35 2byt h ASN 527 CO -0.59 0.44 -0.59 0.00 -1.65 0.00 0.00 177.43 175.04 2byt h ALA 528 N 1.56 0.97 0.00 -0.83 0.00 0.22 -3.36 119.26 117.81 2byt h ALA 528 Ca -0.00 -0.54 -0.38 0.00 0.00 0.00 0.00 54.91 53.99 2byt h ALA 528 Cb 0.85 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 2byt h ALA 528 CO 0.06 0.74 -2.37 0.91 0.00 0.00 0.00 179.25 178.58 2byt n TRP 529 N -3.75 0.00 -1.17 0.00 7.02 -1.11 -4.73 117.44 113.70 2byt n TRP 529 Ca -0.01 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.13 2byt n TRP 529 Cb 0.61 -0.90 0.11 0.00 -2.42 0.00 0.00 31.31 28.71 2byt n TRP 529 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2byt n MET 530 N -3.59 0.27 -2.09 -0.99 2.81 0.43 -4.59 117.12 109.37 2byt n MET 530 Ca -0.45 0.16 -0.28 0.00 -1.81 0.00 0.00 57.70 55.32 2byt n MET 530 Cb 0.90 -2.34 0.16 0.00 -0.71 0.00 0.00 33.22 31.23 2byt n MET 530 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2byt s PRO 531 N -3.84 0.99 0.02 0.03 0.04 -1.26 -4.85 135.00 126.13 2byt s PRO 531 Ca 0.73 -0.54 -0.30 0.00 0.04 0.00 0.00 61.00 60.92 2byt s PRO 531 Cb -0.30 -1.97 -0.06 0.00 0.04 0.00 0.00 34.50 32.20 2byt s PRO 531 CO 0.51 -2.12 1.42 0.08 0.04 0.00 0.00 177.00 176.94 2byt s VAL 532 N -3.68 3.62 0.10 -0.36 1.01 0.94 -4.77 120.40 117.25 2byt s VAL 532 Ca 0.71 1.03 -0.09 0.00 0.00 0.00 0.00 61.98 63.62 2byt s VAL 532 Cb -0.05 -3.66 -0.20 0.00 0.00 0.00 0.00 36.38 32.47 2byt s VAL 532 CO 0.51 0.00 1.25 0.44 0.00 0.00 0.00 175.10 177.30 2byt h ASP 533 N 7.79 0.75 -3.16 3.32 5.19 -1.68 0.12 116.42 128.76 2byt h ASP 533 Ca -0.39 -0.59 -0.24 0.00 -0.62 0.00 0.00 57.03 55.19 2byt h ASP 533 Cb 1.18 -0.23 -0.33 0.00 0.18 0.00 0.00 39.33 40.14 2byt h ASP 533 CO 0.90 1.39 -0.57 -1.58 -3.12 0.00 0.00 179.24 176.26 2byt s GLN 534 N -3.33 0.11 -0.37 3.56 2.00 -1.11 -2.07 119.66 118.44 2byt s GLN 534 Ca -0.08 0.56 0.00 0.00 -2.00 0.00 0.00 55.36 53.84 2byt s GLN 534 Cb 0.08 -0.16 0.10 0.00 0.80 0.00 0.00 33.01 33.83 2byt s GLN 534 CO 0.90 -0.24 0.11 -0.47 -0.50 0.00 0.00 175.29 175.09 2byt s TYR 535 N 1.86 3.62 -0.12 1.67 5.04 0.58 -1.05 117.35 128.95 2byt s TYR 535 Ca -0.03 -2.59 -0.26 0.00 -2.44 0.00 0.00 57.07 51.75 2byt s TYR 535 Cb -0.12 -2.96 -0.02 0.00 0.35 0.00 0.00 41.96 39.22 2byt s TYR 535 CO -0.07 -0.94 0.83 0.42 -1.34 0.00 0.00 175.55 174.44 2byt s ILE 536 N 1.06 4.91 0.00 3.14 1.09 -0.13 -1.60 121.20 129.67 2byt s ILE 536 Ca 0.07 1.66 0.00 0.00 -1.10 0.00 0.00 60.65 61.29 2byt s ILE 536 Cb -0.21 -4.15 0.00 0.00 -1.06 0.00 0.00 42.46 37.04 2byt s ILE 536 CO -0.05 0.10 0.00 0.61 -0.10 0.00 0.00 174.94 175.49 2byt n GLY 537 N 3.28 1.79 3.83 6.18 0.00 -0.69 -2.66 105.19 116.92 2byt n GLY 537 Ca 0.03 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 2byt n GLY 537 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2byt s GLY 538 N -0.06 2.75 -0.08 -0.02 0.00 -1.26 -1.71 107.32 106.94 2byt s GLY 538 Ca 0.00 -0.72 0.17 0.00 0.00 0.00 0.00 44.72 44.17 2byt s GLY 538 CO 0.00 -2.09 0.42 -0.62 0.00 0.00 0.00 173.10 170.81 2byt n VAL 539 N -1.50 1.19 0.17 1.40 0.31 -1.26 -4.16 118.33 114.49 2byt n VAL 539 Ca -0.12 -0.76 0.08 0.00 -0.01 0.00 0.00 64.34 63.54 2byt n VAL 539 Cb 0.66 -0.57 0.43 0.00 -0.91 0.00 0.00 33.84 33.45 2byt n VAL 539 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 2byt h GLU 540 N 0.00 0.00 -0.78 5.55 9.09 -2.00 0.24 114.58 126.68 2byt h GLU 540 Ca -0.33 0.00 -0.28 0.00 0.05 0.00 0.00 59.36 58.80 2byt h GLU 540 Cb 1.87 0.00 -0.17 0.00 -1.65 0.00 0.00 28.75 28.81 2byt h GLU 540 CO 0.04 0.00 0.35 0.72 0.05 0.00 0.00 179.01 180.17 2byt n HIS 541 N -2.14 2.55 0.24 2.06 8.25 -1.26 -4.65 115.22 120.27 2byt n HIS 541 Ca -0.01 -1.36 -0.10 0.00 -0.26 0.00 0.00 57.72 55.99 2byt n HIS 541 Cb 0.27 -0.74 -0.05 0.00 1.12 0.00 0.00 29.99 30.59 2byt n HIS 541 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2byt h ALA 542 N 2.24 -1.14 -0.34 -1.41 0.00 -0.79 -2.10 119.26 115.72 2byt h ALA 542 Ca 0.35 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 2byt h ALA 542 Cb 2.44 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 20.39 2byt h ALA 542 CO 0.81 -1.10 0.16 1.33 0.00 0.00 0.00 179.25 180.45 2byt n VAL 543 N -3.70 1.60 0.00 0.00 0.24 -1.26 -3.82 118.33 111.38 2byt n VAL 543 Ca -0.08 -0.71 0.00 0.00 -2.04 0.00 0.00 64.34 61.52 2byt n VAL 543 Cb 0.24 -0.62 0.00 0.00 -1.47 0.00 0.00 33.84 31.99 2byt n VAL 543 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2byt n LEU 544 N 0.00 0.00 -0.02 1.34 4.77 -1.20 -4.81 117.00 117.08 2byt n LEU 544 Ca 0.19 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.08 2byt n LEU 544 Cb 0.84 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.90 2byt n LEU 544 CO 0.20 0.00 0.84 -0.74 -1.33 0.00 0.00 177.39 176.37 2byt h HIS 545 N 0.00 -0.07 0.00 -1.77 6.17 -1.82 0.48 115.15 118.14 2byt h HIS 545 Ca 0.00 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.09 2byt h HIS 545 Cb 0.00 0.05 0.00 0.00 2.52 0.00 0.00 27.41 29.98 2byt h HIS 545 CO 0.00 -0.06 0.00 1.28 0.71 0.00 0.00 177.93 179.86 2byt n LEU 546 N -5.16 0.00 -0.01 0.26 4.77 -0.79 -0.29 117.00 115.78 2byt n LEU 546 Ca -0.04 0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 56.11 2byt n LEU 546 Cb 0.10 -0.20 -0.01 0.00 -2.33 0.00 0.00 43.42 40.98 2byt n LEU 546 CO 0.27 -0.16 -0.21 -0.11 -1.33 0.00 0.00 177.39 175.84 2byt n LEU 547 N -1.20 1.10 -0.36 2.23 7.94 -0.59 -4.44 117.00 121.68 2byt n LEU 547 Ca 0.03 0.17 0.27 0.00 -1.11 0.00 0.00 56.01 55.37 2byt n LEU 547 Cb 0.04 -0.43 0.54 0.00 0.53 0.00 0.00 43.42 44.09 2byt n LEU 547 CO 0.04 -0.54 1.20 1.88 -1.11 0.00 0.00 177.39 178.86 2byt h TYR 548 N -0.31 0.70 -0.65 1.96 0.05 0.03 0.16 116.97 118.90 2byt h TYR 548 Ca 0.00 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.75 2byt h TYR 548 Cb 0.31 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.84 2byt h TYR 548 CO -0.14 -0.07 0.17 0.77 -1.05 0.00 0.00 178.16 177.84 2byt h SER 549 N 0.29 0.98 0.47 3.88 0.02 -0.84 -1.05 113.55 117.31 2byt h SER 549 Ca 0.70 -0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 61.40 2byt h SER 549 Cb 1.85 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 64.14 2byt h SER 549 CO -0.41 0.95 -0.23 0.03 -1.14 0.00 0.00 176.83 176.04 2byt h ARG 550 N 0.97 -0.61 -0.63 3.45 3.08 -0.92 -1.02 114.38 118.69 2byt h ARG 550 Ca 0.21 0.04 0.13 0.00 0.07 0.00 0.00 59.98 60.42 2byt h ARG 550 Cb 0.35 0.14 -0.12 0.00 0.08 0.00 0.00 29.97 30.41 2byt h ARG 550 CO -0.00 -0.30 -0.19 0.35 -1.07 0.00 0.00 179.97 178.76 2byt h PHE 551 N -0.94 -0.42 -0.87 3.04 3.57 -1.43 0.22 116.94 120.11 2byt h PHE 551 Ca -0.06 0.06 0.12 0.00 3.53 0.00 0.00 57.97 61.61 2byt h PHE 551 Cb 0.59 0.28 -0.08 0.00 2.79 0.00 0.00 35.95 39.53 2byt h PHE 551 CO 0.01 -0.29 0.50 0.74 -2.23 0.00 0.00 178.31 177.03 2byt h PHE 552 N -0.03 0.89 -0.03 0.41 -1.00 -1.04 -0.37 116.94 115.78 2byt h PHE 552 Ca 0.30 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 61.10 2byt h PHE 552 Cb 0.48 -0.27 -0.00 0.00 3.61 0.00 0.00 35.95 39.78 2byt h PHE 552 CO -0.54 0.31 -0.01 1.15 -1.61 0.00 0.00 178.31 177.61 2byt h THR 553 N 0.78 1.30 -0.39 -1.55 2.02 0.69 -1.10 112.91 114.66 2byt h THR 553 Ca 0.44 -0.93 0.07 0.00 0.77 0.00 0.00 66.41 66.77 2byt h THR 553 Cb 0.50 1.86 -0.06 0.00 -1.74 0.00 0.00 68.15 68.71 2byt h THR 553 CO -0.29 0.25 0.03 0.11 0.37 0.00 0.00 175.52 175.98 2byt h LYS 554 N -0.30 0.14 -0.85 6.66 1.57 -0.41 0.94 116.57 124.31 2byt h LYS 554 Ca 0.01 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2byt h LYS 554 Cb 0.40 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 2byt h LYS 554 CO 0.00 0.09 0.52 0.35 -0.57 0.00 0.00 179.45 179.85 2byt h PHE 555 N 0.14 1.12 0.00 -1.35 3.57 -1.06 0.38 116.94 119.73 2byt h PHE 555 Ca 0.19 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.64 2byt h PHE 555 Cb 0.26 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 2byt h PHE 555 CO -0.24 0.74 -0.28 -0.07 -2.23 0.00 0.00 178.31 176.22 2byt h LEU 556 N 1.17 0.00 -0.15 0.59 3.38 0.35 -2.35 115.31 118.30 2byt h LEU 556 Ca 0.31 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.22 2byt h LEU 556 Cb -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 2byt h LEU 556 CO -0.06 0.28 -0.12 -0.74 0.09 0.00 0.00 178.44 177.89 2byt h HIS 557 N 0.00 0.40 0.00 1.13 2.76 0.31 -2.52 115.15 117.24 2byt h HIS 557 Ca -0.00 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 58.05 2byt h HIS 557 Cb 0.57 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.44 2byt h HIS 557 CO 0.00 0.72 0.00 -0.25 -1.30 0.00 0.00 177.93 177.10 2byt n ASP 558 N -4.58 0.00 -0.77 3.26 8.00 0.11 0.80 116.55 123.36 2byt n ASP 558 Ca -0.06 0.22 0.08 0.00 0.71 0.00 0.00 54.79 55.74 2byt n ASP 558 Cb 0.34 -0.29 0.13 0.00 -0.02 0.00 0.00 41.12 41.29 2byt n ASP 558 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2byt n LEU 559 N -1.29 2.77 -1.99 0.64 4.77 -1.05 -4.97 117.00 115.89 2byt n LEU 559 Ca 0.02 -1.41 -0.16 0.00 -0.03 0.00 0.00 56.01 54.43 2byt n LEU 559 Cb 0.04 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2byt n LEU 559 CO 0.04 0.59 -0.14 0.61 -1.33 0.00 0.00 177.39 177.16 2byt n GLY 560 N 0.95 -0.27 0.01 -0.72 0.00 0.24 -4.91 105.19 100.48 2byt n GLY 560 Ca 0.13 -0.18 0.09 0.00 0.00 0.00 0.00 46.02 46.06 2byt n GLY 560 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2byt n MET 561 N -2.76 0.64 -3.67 1.61 2.81 -0.98 -4.90 117.12 109.88 2byt n MET 561 Ca -0.16 -0.14 -0.24 0.00 -1.81 0.00 0.00 57.70 55.35 2byt n MET 561 Cb 0.63 -1.43 -0.17 0.00 -0.71 0.00 0.00 33.22 31.53 2byt n MET 561 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2byt s VAL 562 N -3.21 0.06 0.17 2.03 1.01 -1.24 -4.40 120.40 114.84 2byt s VAL 562 Ca -0.04 -0.03 -0.15 0.00 0.00 0.00 0.00 61.98 61.75 2byt s VAL 562 Cb 0.12 -0.53 0.09 0.00 0.00 0.00 0.00 36.38 36.07 2byt s VAL 562 CO 0.78 -0.08 1.69 0.50 0.00 0.00 0.00 175.10 178.00 2byt h LYS 563 N 8.39 0.11 -7.25 2.72 3.64 -1.92 -3.39 116.57 118.86 2byt h LYS 563 Ca -0.15 -0.01 -0.42 0.00 -1.27 0.00 0.00 60.65 58.81 2byt h LYS 563 Cb 1.13 -0.03 0.19 0.00 -0.41 0.00 0.00 32.23 33.12 2byt h LYS 563 CO 0.26 0.07 0.06 0.14 -2.27 0.00 0.00 179.45 177.71 2byt s VAL 564 N -6.18 1.66 0.00 2.00 -7.23 -1.26 -5.01 120.40 104.39 2byt s VAL 564 Ca -0.13 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.04 2byt s VAL 564 Cb 0.15 -2.31 0.00 0.00 0.56 0.00 0.00 36.38 34.78 2byt s VAL 564 CO 0.71 0.00 0.00 -0.62 -0.31 0.00 0.00 175.10 174.88 2byt n GLU 565 N -4.90 3.25 -3.86 4.82 1.02 -1.26 -4.78 120.64 114.93 2byt n GLU 565 Ca 0.09 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.96 2byt n GLU 565 Cb 0.58 -0.26 -0.17 0.00 -0.02 0.00 0.00 31.44 31.57 2byt n GLU 565 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2byt s GLU 566 N -0.49 1.26 0.27 3.49 0.41 -1.26 -4.30 118.70 118.06 2byt s GLU 566 Ca 0.00 -0.37 0.01 0.00 -0.41 0.00 0.00 54.97 54.20 2byt s GLU 566 Cb 0.00 -1.79 0.36 0.00 -1.78 0.00 0.00 34.13 30.92 2byt s GLU 566 CO 0.00 -0.40 1.69 -1.00 -0.49 0.00 0.00 175.26 175.06 2byt h PRO 567 N 8.17 0.52 -4.65 0.39 0.13 -1.92 -3.41 132.00 131.23 2byt h PRO 567 Ca -0.24 -0.21 -0.70 0.00 -0.87 0.00 0.00 66.00 63.99 2byt h PRO 567 Cb 1.12 -0.03 -0.30 0.00 0.13 0.00 0.00 31.00 31.92 2byt h PRO 567 CO 0.38 0.74 -0.61 -0.06 -0.23 0.00 0.00 178.00 178.22 2byt s PHE 568 N -4.46 3.31 -0.04 1.56 0.08 -1.26 -0.04 117.98 117.12 2byt s PHE 568 Ca -0.07 -1.69 -0.21 0.00 0.12 0.00 0.00 56.93 55.08 2byt s PHE 568 Cb 0.13 -2.45 -0.15 0.00 -0.57 0.00 0.00 43.02 39.98 2byt s PHE 568 CO 0.80 -0.80 0.88 0.37 -0.10 0.00 0.00 175.22 176.38 2byt h GLN 569 N 8.16 -0.27 -5.59 0.44 4.15 -0.99 -3.44 115.11 117.58 2byt h GLN 569 Ca -0.21 0.02 -0.65 0.00 0.77 0.00 0.00 58.65 58.58 2byt h GLN 569 Cb 1.07 0.06 -0.12 0.00 0.21 0.00 0.00 27.48 28.70 2byt h GLN 569 CO 0.62 0.11 -0.55 0.20 -1.93 0.00 0.00 178.83 177.28 2byt s GLY 570 N -3.16 1.99 -0.47 2.39 0.00 -0.88 -4.30 107.32 102.88 2byt s GLY 570 Ca -0.12 -0.72 0.03 0.00 0.00 0.00 0.00 44.72 43.90 2byt s GLY 570 CO 0.45 -0.25 0.27 -2.27 0.00 0.00 0.00 173.10 171.30 2byt s LEU 571 N -0.44 3.13 -0.26 0.66 2.96 -1.26 -0.31 118.68 123.16 2byt s LEU 571 Ca 0.10 -2.82 -0.18 0.00 -0.22 0.00 0.00 54.13 51.01 2byt s LEU 571 Cb -0.12 -1.18 -0.02 0.00 0.50 0.00 0.00 46.19 45.37 2byt s LEU 571 CO 0.02 -0.24 0.54 0.12 -1.32 0.00 0.00 176.35 175.47 2byt s PHE 572 N 0.07 3.27 0.51 5.38 2.19 -0.63 -4.40 117.98 124.36 2byt s PHE 572 Ca 0.19 0.66 -0.01 0.00 0.33 0.00 0.00 56.93 58.10 2byt s PHE 572 Cb -0.22 -2.76 0.01 0.00 -1.31 0.00 0.00 43.02 38.74 2byt s PHE 572 CO -0.02 -0.30 0.74 0.95 1.83 0.00 0.00 175.22 178.42 2byt s THR 573 N 2.36 3.56 0.26 0.12 -4.23 -1.26 -1.71 115.64 114.74 2byt s THR 573 Ca 0.22 -0.45 0.05 0.00 -1.18 0.00 0.00 61.69 60.33 2byt s THR 573 Cb -0.16 -3.34 -0.05 0.00 1.34 0.00 0.00 72.50 70.29 2byt s THR 573 CO 0.09 -0.26 -0.04 -1.10 -0.54 0.00 0.00 174.62 172.77 2byt s GLN 574 N -4.70 1.45 0.27 3.99 -1.52 -0.69 -4.34 119.66 114.12 2byt s GLN 574 Ca 0.52 -1.73 0.06 0.00 -1.95 0.00 0.00 55.36 52.26 2byt s GLN 574 Cb -0.10 -0.92 -0.03 0.00 -0.22 0.00 0.00 33.01 31.74 2byt s GLN 574 CO 0.39 -0.02 0.28 0.20 -0.25 0.00 0.00 175.29 175.90 2byt s GLY 575 N -3.38 1.42 0.35 3.09 0.00 -0.23 -4.83 107.32 103.74 2byt s GLY 575 Ca 0.29 -1.40 -0.26 0.00 0.00 0.00 0.00 44.72 43.34 2byt s GLY 575 CO 0.10 -1.41 1.08 1.06 0.00 0.00 0.00 173.10 173.93 2byt s MET 576 N -3.93 4.36 0.23 2.90 1.00 -1.26 -4.74 119.30 117.85 2byt s MET 576 Ca 0.35 1.67 -0.22 0.00 0.00 0.00 0.00 55.69 57.49 2byt s MET 576 Cb -0.08 -2.84 -0.08 0.00 0.00 0.00 0.00 34.83 31.83 2byt s MET 576 CO 0.27 -0.01 0.78 0.08 0.00 0.00 0.00 175.02 176.14 2byt s VAL 577 N -1.42 4.46 0.17 -6.03 1.01 -1.26 -2.66 120.40 114.67 2byt s VAL 577 Ca 0.52 1.47 0.05 0.00 0.00 0.00 0.00 61.98 64.02 2byt s VAL 577 Cb -0.27 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.12 2byt s VAL 577 CO 0.34 0.26 -0.11 -0.76 0.00 0.00 0.00 175.10 174.84 2byt s LEU 578 N -1.82 2.52 0.07 3.92 1.02 -0.07 -2.29 118.68 122.04 2byt s LEU 578 Ca 0.43 -1.03 -0.09 0.00 0.02 0.00 0.00 54.13 53.46 2byt s LEU 578 Cb -0.18 -0.44 -0.00 0.00 0.02 0.00 0.00 46.19 45.59 2byt s LEU 578 CO 0.22 -0.30 0.19 0.00 0.02 0.00 0.00 176.35 176.49 2byt s ALA 579 N -3.23 -0.26 0.03 4.21 0.00 -0.79 0.23 121.76 121.95 2byt s ALA 579 Ca 0.19 -0.51 -0.30 0.00 0.00 0.00 0.00 51.96 51.34 2byt s ALA 579 Cb 0.02 0.41 -0.05 0.00 0.00 0.00 0.00 23.12 23.50 2byt s ALA 579 CO 0.03 -0.45 1.17 -1.58 0.00 0.00 0.00 175.76 174.92 2byt s TRP 580 N -3.40 3.42 0.10 0.00 0.52 -1.26 -0.49 118.94 117.82 2byt s TRP 580 Ca 0.01 1.34 0.08 0.00 0.02 0.00 0.00 56.10 57.55 2byt s TRP 580 Cb 0.03 -3.38 -0.04 0.00 -1.15 0.00 0.00 33.47 28.93 2byt s TRP 580 CO -0.08 -1.11 -0.15 0.99 0.02 0.00 0.00 176.95 176.62 2byt s THR 581 N 1.30 3.06 -0.34 2.01 2.01 0.41 -4.91 115.64 119.18 2byt s THR 581 Ca 0.57 -1.35 -0.27 0.00 0.31 0.00 0.00 61.69 60.95 2byt s THR 581 Cb -0.27 -2.40 0.01 0.00 0.01 0.00 0.00 72.50 69.85 2byt s THR 581 CO 0.27 0.14 0.98 -0.62 -0.69 0.00 0.00 174.62 174.70 2byt s ASP 582 N -2.06 6.79 -0.16 3.53 -1.08 -1.26 -3.38 116.67 119.05 2byt s ASP 582 Ca 0.19 0.80 0.16 0.00 -0.52 0.00 0.00 52.55 53.17 2byt s ASP 582 Cb -0.11 -2.49 0.67 0.00 -1.46 0.00 0.00 42.92 39.53 2byt s ASP 582 CO 0.11 -0.84 1.59 0.49 0.52 0.00 0.00 175.17 177.03 2byt n PHE 583 N 6.77 1.46 0.00 -5.34 3.72 -1.26 -5.07 117.46 117.73 2byt n PHE 583 Ca 0.09 -0.71 0.00 0.00 -0.05 0.00 0.00 57.45 56.78 2byt n PHE 583 Cb 0.48 -0.33 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 2byt n PHE 583 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2byt n GLY 584 N 0.51 0.58 3.85 1.37 0.00 -1.26 -4.51 105.19 105.72 2byt n GLY 584 Ca 0.24 -2.12 -0.30 0.00 0.00 0.00 0.00 46.02 43.84 2byt n GLY 584 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2byt s PRO 585 N -1.13 2.92 0.03 1.61 0.04 -1.26 -4.31 135.00 132.89 2byt s PRO 585 Ca 0.00 0.68 -0.13 0.00 0.04 0.00 0.00 61.00 61.59 2byt s PRO 585 Cb 0.00 -2.01 0.02 0.00 0.04 0.00 0.00 34.50 32.55 2byt s PRO 585 CO 0.00 -1.04 0.29 0.14 0.04 0.00 0.00 177.00 176.43 2byt s VAL 586 N -3.20 0.08 -0.57 -0.36 -7.23 -1.26 -4.53 120.40 103.32 2byt s VAL 586 Ca 0.58 -0.66 -0.06 0.00 -1.81 0.00 0.00 61.98 60.03 2byt s VAL 586 Cb -0.12 -0.85 0.15 0.00 0.56 0.00 0.00 36.38 36.12 2byt s VAL 586 CO 0.54 -0.36 0.42 -1.61 -0.31 0.00 0.00 175.10 173.77 2byt s GLU 587 N -2.23 2.58 -0.05 4.82 2.02 -1.11 -4.85 118.70 119.88 2byt s GLU 587 Ca -0.07 -2.19 -0.28 0.00 0.02 0.00 0.00 54.97 52.45 2byt s GLU 587 Cb -0.02 -3.85 -0.03 0.00 0.10 0.00 0.00 34.13 30.33 2byt s GLU 587 CO -0.01 -1.18 0.90 0.08 0.02 0.00 0.00 175.26 175.07 2byt s VAL 588 N 0.56 4.90 -0.31 2.63 1.01 -1.26 -2.61 120.40 125.32 2byt s VAL 588 Ca 0.12 1.86 -0.02 0.00 0.00 0.00 0.00 61.98 63.95 2byt s VAL 588 Cb -0.21 -4.23 0.11 0.00 0.00 0.00 0.00 36.38 32.04 2byt s VAL 588 CO -0.04 0.15 0.13 -0.70 0.00 0.00 0.00 175.10 174.65 2byt s GLU 589 N 1.20 0.48 7.29 2.72 2.56 -0.04 -5.03 118.70 127.88 2byt s GLU 589 Ca 0.47 -0.90 0.00 0.00 0.00 0.00 0.00 54.97 54.53 2byt s GLU 589 Cb -0.19 -1.54 0.00 0.00 2.00 0.00 0.00 34.13 34.40 2byt s GLU 589 CO 0.23 -1.04 0.00 0.41 -0.56 0.00 0.00 175.26 174.30 2byt n GLY 590 N 4.87 2.46 0.91 -1.50 0.00 -1.26 -1.95 105.19 108.72 2byt n GLY 590 Ca -0.02 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 45.89 2byt n GLY 590 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2byt n SER 591 N 9.59 3.60 -4.50 1.61 3.41 -1.26 -4.95 113.62 121.11 2byt n SER 591 Ca 0.00 -2.41 -0.34 0.00 -0.26 0.00 0.00 58.87 55.87 2byt n SER 591 Cb 0.00 -0.40 -0.12 0.00 -0.26 0.00 0.00 64.21 63.43 2byt n SER 591 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2byt s VAL 592 N -1.74 3.62 -0.51 -3.33 1.01 -0.82 -3.30 120.40 115.33 2byt s VAL 592 Ca 0.35 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.89 2byt s VAL 592 Cb 0.23 -2.53 0.13 0.00 0.00 0.00 0.00 36.38 34.22 2byt s VAL 592 CO 0.16 0.54 0.26 -0.69 0.00 0.00 0.00 175.10 175.37 2byt s VAL 593 N -0.13 2.49 0.39 2.92 1.01 -0.75 -0.86 120.40 125.47 2byt s VAL 593 Ca 0.01 -3.26 -0.26 0.00 0.00 0.00 0.00 61.98 58.47 2byt s VAL 593 Cb -0.13 -2.73 -0.09 0.00 0.00 0.00 0.00 36.38 33.43 2byt s VAL 593 CO 0.03 -0.81 1.22 -0.60 0.00 0.00 0.00 175.10 174.94 2byt s ARG 594 N -0.24 4.06 -0.27 2.72 3.52 -1.07 -1.71 118.95 125.96 2byt s ARG 594 Ca 0.17 1.97 -0.01 0.00 -0.13 0.00 0.00 55.73 57.73 2byt s ARG 594 Cb -0.26 -2.75 0.04 0.00 -1.56 0.00 0.00 34.95 30.42 2byt s ARG 594 CO 0.00 -0.36 -0.04 -0.51 -0.81 0.00 0.00 175.30 173.58 2byt s LEU 595 N -2.39 3.48 0.48 -0.88 1.43 -0.86 -2.75 118.68 117.19 2byt s LEU 595 Ca 0.56 -1.08 -0.23 0.00 -1.03 0.00 0.00 54.13 52.35 2byt s LEU 595 Cb -0.34 -1.67 -0.07 0.00 0.03 0.00 0.00 46.19 44.15 2byt s LEU 595 CO 0.43 -0.18 1.25 -2.16 0.23 0.00 0.00 176.35 175.91 2byt s PRO 596 N 1.27 3.56 0.37 1.29 0.04 -1.26 -4.69 135.00 135.59 2byt s PRO 596 Ca -0.03 1.98 0.14 0.00 0.04 0.00 0.00 61.00 63.13 2byt s PRO 596 Cb -0.18 -2.39 0.99 0.00 0.04 0.00 0.00 34.50 32.95 2byt s PRO 596 CO -0.03 -0.77 1.80 0.93 0.04 0.00 0.00 177.00 178.97 2byt h GLU 597 N 1.91 0.50 -0.89 4.56 4.39 -1.97 -1.50 114.58 121.58 2byt h GLU 597 Ca -0.50 -0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.26 2byt h GLU 597 Cb 1.27 -0.11 -0.07 0.00 -0.10 0.00 0.00 28.75 29.73 2byt h GLU 597 CO 0.59 0.33 0.54 -1.35 -1.16 0.00 0.00 179.01 177.96 2byt h PRO 598 N 0.51 0.89 0.10 2.33 0.11 -1.97 -2.03 132.00 131.95 2byt h PRO 598 Ca 0.55 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.60 2byt h PRO 598 Cb 1.22 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2byt h PRO 598 CO -0.29 0.59 -0.05 1.15 -0.21 0.00 0.00 178.00 179.20 2byt h THR 599 N 0.92 0.00 -1.31 -1.15 2.02 -1.54 -3.23 112.91 108.62 2byt h THR 599 Ca 0.42 -0.37 0.44 0.00 0.77 0.00 0.00 66.41 67.67 2byt h THR 599 Cb 0.32 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.61 2byt h THR 599 CO -0.23 0.00 0.86 -1.14 0.37 0.00 0.00 175.52 175.38 2byt n ARG 600 N -3.37 -0.03 -0.05 6.66 0.63 -0.74 0.10 116.66 119.87 2byt n ARG 600 Ca -0.02 1.13 -0.13 0.00 -0.92 0.00 0.00 57.85 57.91 2byt n ARG 600 Cb 0.05 -2.26 -0.07 0.00 0.45 0.00 0.00 32.46 30.63 2byt n ARG 600 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 2byt h ILE 601 N 0.00 1.34 0.00 5.15 2.04 -1.48 -2.84 117.51 121.72 2byt h ILE 601 Ca 0.81 -1.21 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 2byt h ILE 601 Cb 2.68 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 40.63 2byt h ILE 601 CO -0.38 0.35 -0.22 0.03 0.00 0.00 0.00 178.15 177.92 2byt h ARG 602 N -0.10 0.00 0.00 2.37 3.08 0.68 -0.91 114.38 119.51 2byt h ARG 602 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2byt h ARG 602 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2byt h ARG 602 CO 0.03 0.22 0.00 1.28 -1.07 0.00 0.00 179.97 180.43 2byt n LEU 603 N -3.89 0.00 -3.79 3.04 4.77 -0.47 -4.93 117.00 111.73 2byt n LEU 603 Ca -0.02 0.45 -0.33 0.00 -0.03 0.00 0.00 56.01 56.08 2byt n LEU 603 Cb 0.31 -0.45 0.03 0.00 -2.33 0.00 0.00 43.42 40.98 2byt n LEU 603 CO 0.34 -0.06 -0.11 -0.62 -1.33 0.00 0.00 177.39 175.61 2byt n GLU 604 N -1.45 -1.36 -4.16 3.23 1.02 -0.35 -5.00 120.64 112.57 2byt n GLU 604 Ca 0.08 0.38 -0.10 0.00 -0.02 0.00 0.00 57.16 57.50 2byt n GLU 604 Cb 0.27 -3.91 -0.10 0.00 -0.02 0.00 0.00 31.44 27.68 2byt n GLU 604 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2byt s ILE 605 N -3.55 0.29 -0.10 -3.67 -4.36 -1.21 -5.08 121.20 103.51 2byt s ILE 605 Ca 0.41 -1.91 -0.19 0.00 -0.26 0.00 0.00 60.65 58.70 2byt s ILE 605 Cb -0.16 -1.97 -0.28 0.00 1.25 0.00 0.00 42.46 41.30 2byt s ILE 605 CO 0.88 -0.57 0.64 1.55 0.24 0.00 0.00 174.94 177.69 2byt h PRO 606 N 2.87 0.23 -6.68 0.37 0.13 -1.94 -3.45 132.00 123.52 2byt h PRO 606 Ca -0.35 -0.39 -0.58 0.00 -0.87 0.00 0.00 66.00 63.81 2byt h PRO 606 Cb 1.19 0.14 0.11 0.00 0.13 0.00 0.00 31.00 32.57 2byt h PRO 606 CO 0.61 1.19 0.41 0.39 -0.23 0.00 0.00 178.00 180.37 2byt n GLU 607 N -4.06 1.94 -0.24 0.86 1.02 -1.26 -4.91 120.64 113.99 2byt n GLU 607 Ca -0.21 0.68 0.08 0.00 -0.02 0.00 0.00 57.16 57.69 2byt n GLU 607 Cb 0.84 -2.21 0.13 0.00 -0.02 0.00 0.00 31.44 30.19 2byt n GLU 607 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2byt n SER 608 N 0.88 1.96 -3.15 1.62 7.64 -1.26 -4.93 113.62 116.38 2byt n SER 608 Ca 0.06 -3.09 0.05 0.00 1.01 0.00 0.00 58.87 56.89 2byt n SER 608 Cb 0.35 -0.42 -0.01 0.00 -1.01 0.00 0.00 64.21 63.12 2byt n SER 608 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2byt s ALA 609 N -2.57 -2.85 0.00 -0.43 0.00 -1.26 -2.04 121.76 112.62 2byt s ALA 609 Ca 0.30 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.74 2byt s ALA 609 Cb 0.27 -2.44 0.00 0.00 0.00 0.00 0.00 23.12 20.95 2byt s ALA 609 CO 0.00 -1.60 0.00 1.28 0.00 0.00 0.00 175.76 175.45 2byt n LEU 610 N 5.39 0.00 -4.14 0.00 4.77 -0.69 -4.94 117.00 117.39 2byt n LEU 610 Ca 0.01 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.88 2byt n LEU 610 Cb 0.53 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.53 2byt n LEU 610 CO -0.05 -0.03 -0.20 -0.94 -1.33 0.00 0.00 177.39 174.84 2byt s SER 611 N -0.32 0.18 0.20 -1.43 1.04 -1.26 -1.82 113.70 110.29 2byt s SER 611 Ca 0.00 -1.23 0.16 0.00 0.48 0.00 0.00 55.95 55.36 2byt s SER 611 Cb 0.00 0.37 0.78 0.00 0.10 0.00 0.00 66.02 67.28 2byt s SER 611 CO 0.00 -0.83 1.48 0.18 0.98 0.00 0.00 173.24 175.05 2byt n LEU 612 N -0.21 0.38 -0.07 2.42 4.77 -1.21 -2.56 117.00 120.52 2byt n LEU 612 Ca -0.02 0.66 -0.07 0.00 -0.03 0.00 0.00 56.01 56.54 2byt n LEU 612 Cb 0.64 -0.68 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 2byt n LEU 612 CO 0.30 -0.71 -0.22 -0.33 -1.33 0.00 0.00 177.39 175.10 2byt h GLU 613 N 0.00 0.00 -1.23 3.23 5.08 -1.95 -3.23 114.58 116.48 2byt h GLU 613 Ca 0.00 0.00 0.36 0.00 -1.00 0.00 0.00 59.36 58.72 2byt h GLU 613 Cb 0.08 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 2byt h GLU 613 CO 0.00 0.25 0.90 -0.44 -1.00 0.00 0.00 179.01 178.72 2byt h ASP 614 N -1.00 0.00 -0.05 1.42 3.32 -1.90 0.54 116.42 118.75 2byt h ASP 614 Ca -0.06 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 2byt h ASP 614 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2byt h ASP 614 CO -0.03 0.00 -0.15 0.58 -1.72 0.00 0.00 179.24 177.92 2byt h VAL 615 N 0.00 1.45 0.52 -1.35 2.07 -1.64 -2.66 116.25 114.64 2byt h VAL 615 Ca 0.58 -1.55 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 2byt h VAL 615 Cb 2.37 2.34 0.01 0.00 -1.52 0.00 0.00 31.29 34.49 2byt h VAL 615 CO -0.01 0.43 -0.25 -0.09 0.02 0.00 0.00 177.57 177.67 2byt h ARG 616 N -0.35 -0.68 -0.31 1.57 2.43 -0.09 -0.53 114.38 116.42 2byt h ARG 616 Ca -0.00 0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.30 2byt h ARG 616 Cb 0.77 0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 2byt h ARG 616 CO 0.03 -0.41 0.39 0.87 -1.51 0.00 0.00 179.97 179.34 2byt h LYS 617 N -0.79 0.00 -0.46 0.20 1.57 -0.78 0.38 116.57 116.69 2byt h LYS 617 Ca -0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2byt h LYS 617 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2byt h LYS 617 CO 0.12 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.00 2byt n MET 618 N -3.60 2.46 -2.24 3.15 0.00 -1.00 -4.97 117.12 110.92 2byt n MET 618 Ca 0.05 -2.23 -0.02 0.00 0.00 0.00 0.00 57.70 55.49 2byt n MET 618 Cb 0.53 -1.51 0.01 0.00 0.00 0.00 0.00 33.22 32.26 2byt n MET 618 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2byt n GLY 619 N 1.50 0.38 2.93 3.17 0.00 0.13 -4.98 105.19 108.32 2byt n GLY 619 Ca 0.20 -0.42 -0.17 0.00 0.00 0.00 0.00 46.02 45.64 2byt n GLY 619 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2byt s ALA 620 N -3.05 0.45 0.17 4.61 0.00 -0.23 -3.95 121.76 119.77 2byt s ALA 620 Ca 0.01 -0.14 0.08 0.00 0.00 0.00 0.00 51.96 51.91 2byt s ALA 620 Cb -0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 2byt s ALA 620 CO 0.10 0.07 -0.07 -1.83 0.00 0.00 0.00 175.76 174.02 2byt s GLU 621 N 0.19 2.16 -0.28 0.00 -1.05 0.18 -3.83 118.70 116.07 2byt s GLU 621 Ca -0.02 -1.20 -0.12 0.00 -0.15 0.00 0.00 54.97 53.48 2byt s GLU 621 Cb -0.06 -2.22 -0.05 0.00 -0.44 0.00 0.00 34.13 31.37 2byt s GLU 621 CO -0.00 0.45 0.23 -0.51 0.95 0.00 0.00 175.26 176.38 2byt s LEU 622 N -2.80 4.05 0.29 1.83 1.43 -1.26 0.99 118.68 123.21 2byt s LEU 622 Ca 0.25 0.03 0.11 0.00 -1.03 0.00 0.00 54.13 53.49 2byt s LEU 622 Cb -0.09 -2.19 -0.05 0.00 0.03 0.00 0.00 46.19 43.89 2byt s LEU 622 CO 0.16 -0.09 -0.14 -0.13 0.23 0.00 0.00 176.35 176.38 2byt s ARG 623 N 1.83 1.81 0.32 1.70 0.52 0.53 -4.89 118.95 120.77 2byt s ARG 623 Ca 0.09 -1.75 -0.25 0.00 -0.52 0.00 0.00 55.73 53.29 2byt s ARG 623 Cb -0.16 -1.82 -0.10 0.00 0.52 0.00 0.00 34.95 33.39 2byt s ARG 623 CO 0.11 0.29 0.93 -2.14 0.02 0.00 0.00 175.30 174.50 2byt s PRO 624 N -3.56 4.55 0.47 3.54 0.02 -1.26 0.82 135.00 139.57 2byt s PRO 624 Ca 0.31 1.29 0.05 0.00 0.02 0.00 0.00 61.00 62.67 2byt s PRO 624 Cb -0.03 -2.79 -0.03 0.00 0.02 0.00 0.00 34.50 31.66 2byt s PRO 624 CO 0.16 0.28 0.13 -1.58 -0.33 0.00 0.00 177.00 175.67 2byt s HIS 625 N -1.62 2.19 -0.67 6.54 2.46 0.38 -4.82 115.29 119.74 2byt s HIS 625 Ca 0.50 -0.76 0.24 0.00 0.47 0.00 0.00 55.06 55.50 2byt s HIS 625 Cb -0.18 -1.81 0.91 0.00 -0.13 0.00 0.00 32.58 31.36 2byt s HIS 625 CO 0.23 0.13 1.72 0.39 -2.47 0.00 0.00 174.74 174.75 2byt n GLU 626 N -1.29 0.18 -0.05 2.88 4.71 -1.26 -2.38 120.64 123.42 2byt n GLU 626 Ca -0.07 0.29 0.12 0.00 -0.01 0.00 0.00 57.16 57.49 2byt n GLU 626 Cb 0.66 -1.77 0.40 0.00 -1.01 0.00 0.00 31.44 29.72 2byt n GLU 626 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 2byt n ASP 627 N -2.09 1.83 0.00 1.62 3.85 -1.26 -4.92 116.55 115.57 2byt n ASP 627 Ca 0.04 -1.67 0.00 0.00 -0.71 0.00 0.00 54.79 52.45 2byt n ASP 627 Cb 0.30 -0.07 0.00 0.00 -1.35 0.00 0.00 41.12 40.00 2byt n ASP 627 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2byt n GLY 628 N 1.19 0.53 3.49 6.12 0.00 -1.00 -5.05 105.19 110.46 2byt n GLY 628 Ca 0.17 -0.42 -0.23 0.00 0.00 0.00 0.00 46.02 45.54 2byt n GLY 628 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2byt s THR 629 N -2.00 1.79 0.11 2.61 -4.23 -1.26 -4.90 115.64 107.76 2byt s THR 629 Ca 0.00 -2.11 -0.24 0.00 -1.18 0.00 0.00 61.69 58.16 2byt s THR 629 Cb 0.00 -2.62 -0.07 0.00 1.34 0.00 0.00 72.50 71.15 2byt s THR 629 CO 0.00 -0.20 0.71 -0.76 -0.54 0.00 0.00 174.62 173.84 2byt s LEU 630 N -3.53 4.54 -0.05 4.79 1.43 -1.26 -0.47 118.68 124.13 2byt s LEU 630 Ca 0.32 1.48 0.05 0.00 -1.03 0.00 0.00 54.13 54.95 2byt s LEU 630 Cb 0.05 -3.16 -0.01 0.00 0.03 0.00 0.00 46.19 43.10 2byt s LEU 630 CO 0.14 0.18 -0.21 -1.00 0.23 0.00 0.00 176.35 175.69 2byt s HIS 631 N -0.84 2.10 -0.50 0.29 3.76 0.24 -4.33 115.29 116.02 2byt s HIS 631 Ca 0.34 -0.63 -0.25 0.00 -0.15 0.00 0.00 55.06 54.38 2byt s HIS 631 Cb -0.21 -1.40 0.03 0.00 1.11 0.00 0.00 32.58 32.11 2byt s HIS 631 CO 0.23 -0.20 0.92 -1.17 -0.85 0.00 0.00 174.74 173.67 2byt s LEU 632 N -0.05 4.07 0.19 0.89 0.20 -1.26 -0.35 118.68 122.38 2byt s LEU 632 Ca -0.04 -0.12 -0.00 0.00 0.69 0.00 0.00 54.13 54.65 2byt s LEU 632 Cb -0.13 -3.00 -0.04 0.00 -0.43 0.00 0.00 46.19 42.59 2byt s LEU 632 CO 0.03 -1.12 0.37 0.26 -0.29 0.00 0.00 176.35 175.61 2byt s TRP 633 N 3.80 3.48 -0.18 5.38 0.52 0.28 -4.03 118.94 128.19 2byt s TRP 633 Ca 0.33 0.30 -0.29 0.00 0.02 0.00 0.00 56.10 56.47 2byt s TRP 633 Cb -0.11 -1.82 0.11 0.00 -1.15 0.00 0.00 33.47 30.50 2byt s TRP 633 CO 0.23 0.40 0.94 0.21 0.02 0.00 0.00 176.95 178.74 2byt s LYS 634 N -3.32 0.66 0.75 4.98 2.20 -1.22 0.51 119.74 124.29 2byt s LYS 634 Ca 0.38 0.34 -0.13 0.00 -0.36 0.00 0.00 55.97 56.20 2byt s LYS 634 Cb -0.11 0.32 0.05 0.00 -1.51 0.00 0.00 37.83 36.57 2byt s LYS 634 CO 0.29 -0.17 1.13 -2.14 -0.36 0.00 0.00 175.35 174.10 2byt s PRO 635 N -0.65 2.23 0.00 4.03 0.02 -1.25 -0.45 135.00 138.93 2byt s PRO 635 Ca -0.02 1.43 -0.28 0.00 0.02 0.00 0.00 61.00 62.15 2byt s PRO 635 Cb -0.02 -1.88 0.09 0.00 0.02 0.00 0.00 34.50 32.72 2byt s PRO 635 CO 0.01 -1.70 0.80 0.00 -0.33 0.00 0.00 177.00 175.78 2byt s ALA 636 N -2.48 -1.78 -0.03 -1.55 0.00 0.35 -4.76 121.76 111.52 2byt s ALA 636 Ca 0.67 1.03 -0.37 0.00 0.00 0.00 0.00 51.96 53.28 2byt s ALA 636 Cb -0.22 0.28 -0.16 0.00 0.00 0.00 0.00 23.12 23.03 2byt s ALA 636 CO 0.49 -0.60 1.50 0.28 0.00 0.00 0.00 175.76 177.43 2byt n VAL 637 N 0.06 0.12 -2.33 0.00 0.31 -1.26 -1.88 118.33 113.34 2byt n VAL 637 Ca -0.13 -0.02 -0.35 0.00 -0.01 0.00 0.00 64.34 63.84 2byt n VAL 637 Cb 0.61 -1.03 -0.04 0.00 -0.91 0.00 0.00 33.84 32.47 2byt n VAL 637 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 2byt s MET 638 N 1.59 3.15 0.16 5.55 1.75 -0.97 -4.77 119.30 125.75 2byt s MET 638 Ca 0.89 -0.87 0.04 0.00 -1.25 0.00 0.00 55.69 54.49 2byt s MET 638 Cb -0.96 -5.25 -0.05 0.00 2.84 0.00 0.00 34.83 31.41 2byt s MET 638 CO 0.52 -2.78 -0.08 -1.54 -0.65 0.00 0.00 175.02 170.49 2byt s SER 639 N 6.20 1.70 0.13 1.11 1.04 -1.26 -4.71 113.70 117.91 2byt s SER 639 Ca 0.57 -1.05 -0.26 0.00 0.48 0.00 0.00 55.95 55.69 2byt s SER 639 Cb -0.02 0.01 -0.03 0.00 0.10 0.00 0.00 66.02 66.07 2byt s SER 639 CO -0.04 -0.39 1.62 0.50 0.98 0.00 0.00 173.24 175.92 2byt h LYS 640 N 2.74 -0.38 -0.63 4.02 3.64 -1.97 -1.65 116.57 122.35 2byt h LYS 640 Ca -0.37 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.13 2byt h LYS 640 Cb 1.19 0.09 -0.11 0.00 -0.41 0.00 0.00 32.23 32.99 2byt h LYS 640 CO 0.64 -0.25 -0.43 1.03 -2.27 0.00 0.00 179.45 178.16 2byt h SER 641 N -0.40 -1.51 0.27 4.20 0.87 -1.96 0.76 113.55 115.78 2byt h SER 641 Ca 0.08 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 2byt h SER 641 Cb 0.52 0.69 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 2byt h SER 641 CO -0.29 -0.33 0.00 0.29 -0.53 0.00 0.00 176.83 175.97 2byt n LYS 642 N -5.40 0.14 -3.41 2.24 4.76 -0.92 -4.89 118.16 110.67 2byt n LYS 642 Ca 0.02 0.54 -0.12 0.00 -2.87 0.00 0.00 58.31 55.88 2byt n LYS 642 Cb 0.35 -1.87 0.00 0.00 -1.84 0.00 0.00 35.03 31.67 2byt n LYS 642 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2byt n GLY 643 N -0.82 -1.27 0.00 0.72 0.00 0.26 -4.89 105.19 99.19 2byt n GLY 643 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.55 2byt n GLY 643 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2byt n ASN 644 N -2.19 0.00 -4.70 1.61 0.23 -1.24 -4.87 115.26 104.11 2byt n ASN 644 Ca -0.15 -1.00 -0.33 0.00 -0.53 0.00 0.00 54.58 52.57 2byt n ASN 644 Cb 0.59 0.00 0.13 0.00 -2.08 0.00 0.00 39.78 38.42 2byt n ASN 644 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 2byt s GLY 645 N 0.00 2.03 -0.81 4.83 0.00 -1.26 -4.87 107.32 107.23 2byt s GLY 645 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 44.72 45.47 2byt s GLY 645 CO 0.00 1.17 0.67 0.14 0.00 0.00 0.00 173.10 175.07 2byt s VAL 646 N -2.30 3.86 0.06 1.40 1.01 -1.26 -5.02 120.40 118.14 2byt s VAL 646 Ca 0.71 -3.92 -0.37 0.00 0.00 0.00 0.00 61.98 58.39 2byt s VAL 646 Cb -0.26 -3.44 -0.19 0.00 0.00 0.00 0.00 36.38 32.49 2byt s VAL 646 CO 0.52 -1.04 1.05 0.23 0.00 0.00 0.00 175.10 175.85 2byt n MET 647 N 2.31 0.29 0.40 2.72 2.81 -1.26 -2.38 117.12 122.00 2byt n MET 647 Ca 0.20 0.10 -0.16 0.00 -1.81 0.00 0.00 57.70 56.03 2byt n MET 647 Cb 0.36 -1.56 -0.07 0.00 -0.71 0.00 0.00 33.22 31.24 2byt n MET 647 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2byt h VAL 648 N 2.76 0.00 -0.29 2.03 2.07 -1.88 -2.64 116.25 118.31 2byt h VAL 648 Ca -0.47 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.02 2byt h VAL 648 Cb 1.41 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2byt h VAL 648 CO 0.66 0.00 -0.17 1.23 0.02 0.00 0.00 177.57 179.31 2byt h GLY 649 N -1.08 -2.17 0.00 2.17 0.00 -1.90 0.11 103.07 100.20 2byt h GLY 649 Ca -0.10 1.06 0.00 0.00 0.00 0.00 0.00 47.33 48.29 2byt h GLY 649 CO 0.17 -0.72 0.00 -1.05 0.00 0.00 0.00 176.54 174.94 2byt n PRO 650 N -3.66 0.00 -0.23 4.80 -0.02 -1.24 -2.09 135.00 132.56 2byt n PRO 650 Ca 0.01 0.56 -0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2byt n PRO 650 Cb 0.08 -1.21 0.03 0.00 -0.02 0.00 0.00 33.50 32.37 2byt n PRO 650 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2byt n PHE 651 N -1.64 0.04 -0.37 6.00 7.35 -0.99 0.10 117.46 127.95 2byt n PHE 651 Ca 0.00 0.73 0.02 0.00 -0.76 0.00 0.00 57.45 57.44 2byt n PHE 651 Cb 0.00 -0.73 0.16 0.00 0.35 0.00 0.00 39.48 39.26 2byt n PHE 651 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2byt h VAL 652 N 0.00 1.12 -0.11 -2.13 2.07 -0.48 0.65 116.25 117.36 2byt h VAL 652 Ca 0.21 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2byt h VAL 652 Cb 0.36 -0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 29.93 2byt h VAL 652 CO -0.59 0.22 0.03 0.11 0.02 0.00 0.00 177.57 177.36 2byt h LYS 653 N 1.21 0.18 0.00 1.57 1.79 0.13 -2.81 116.57 118.63 2byt h LYS 653 Ca 0.42 -0.04 -0.06 0.00 -2.18 0.00 0.00 60.65 58.79 2byt h LYS 653 Cb 0.11 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 2byt h LYS 653 CO -0.16 0.33 -0.31 1.49 -1.08 0.00 0.00 179.45 179.73 2byt h GLU 654 N -0.01 0.00 0.00 3.15 4.57 -0.92 -3.45 114.58 117.92 2byt h GLU 654 Ca 0.04 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2byt h GLU 654 Cb 0.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 2byt h GLU 654 CO -0.00 0.31 0.00 1.04 -1.18 0.00 0.00 179.01 179.18 2byt n GLN 655 N -3.36 0.00 -3.68 1.92 1.13 0.22 -5.08 117.38 108.53 2byt n GLN 655 Ca 0.01 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.06 2byt n GLN 655 Cb 0.52 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.86 2byt n GLN 655 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2byt s GLY 656 N 0.00 -0.33 0.00 1.08 0.00 -1.07 -4.69 107.32 102.31 2byt s GLY 656 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 44.72 45.17 2byt s GLY 656 CO 0.00 0.07 0.19 0.00 0.00 0.00 0.00 173.10 173.36 2byt n ALA 657 N -0.48 -0.09 -0.50 3.20 0.00 -1.26 -3.28 120.51 118.10 2byt n ALA 657 Ca -0.07 0.00 0.43 0.00 0.00 0.00 0.00 53.44 53.80 2byt n ALA 657 Cb 0.62 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.75 2byt n ALA 657 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2byt h ASP 658 N 0.00 0.00 -0.24 0.00 3.32 -1.90 2.17 116.42 119.77 2byt h ASP 658 Ca 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 2byt h ASP 658 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2byt h ASP 658 CO 0.00 0.00 -0.23 0.40 -1.72 0.00 0.00 179.24 177.69 2byt h ILE 659 N 0.00 1.32 -0.02 0.35 2.04 -1.92 -1.94 117.51 117.34 2byt h ILE 659 Ca 0.75 -1.39 0.02 0.00 1.00 0.00 0.00 64.86 65.24 2byt h ILE 659 Cb 3.36 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 41.10 2byt h ILE 659 CO -0.01 0.43 -0.12 0.00 0.00 0.00 0.00 178.15 178.46 2byt h ALA 660 N 0.67 -0.12 -2.13 1.87 0.00 0.36 -2.03 119.26 117.87 2byt h ALA 660 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2byt h ALA 660 Cb 0.79 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2byt h ALA 660 CO 0.06 -0.61 0.00 0.54 0.00 0.00 0.00 179.25 179.24 2byt n ARG 661 N -5.25 0.00 -0.27 0.00 1.74 -0.88 -1.00 116.66 110.99 2byt n ARG 661 Ca -0.05 0.38 0.25 0.00 -0.77 0.00 0.00 57.85 57.65 2byt n ARG 661 Cb 0.17 -1.14 0.46 0.00 -1.02 0.00 0.00 32.46 30.93 2byt n ARG 661 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2byt n ILE 662 N -1.23 -0.35 0.08 0.55 2.08 -0.74 0.10 119.36 119.85 2byt n ILE 662 Ca 0.00 1.73 -0.13 0.00 0.56 0.00 0.00 62.75 64.91 2byt n ILE 662 Cb 0.00 -2.77 -0.07 0.00 -0.75 0.00 0.00 39.64 36.05 2byt n ILE 662 CO 0.00 0.00 0.00 0.74 0.56 0.00 0.00 176.55 177.85 2byt h THR 663 N 0.00 0.92 0.06 1.39 2.02 -0.66 -1.13 112.91 115.51 2byt h THR 663 Ca 0.69 -0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.86 2byt h THR 663 Cb 1.77 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 69.10 2byt h THR 663 CO -0.67 0.00 -0.03 0.40 0.37 0.00 0.00 175.52 175.59 2byt h ILE 664 N -0.12 1.15 -0.03 3.11 2.04 0.24 -2.66 117.51 121.24 2byt h ILE 664 Ca -0.01 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.10 2byt h ILE 664 Cb 0.09 1.63 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 2byt h ILE 664 CO 0.02 0.19 0.01 -0.07 0.00 0.00 0.00 178.15 178.30 2byt h LEU 665 N -0.42 0.04 0.00 1.44 3.38 -1.14 -3.19 115.31 115.41 2byt h LEU 665 Ca -0.01 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2byt h LEU 665 Cb 0.37 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2byt h LEU 665 CO 0.01 0.18 0.00 0.33 0.09 0.00 0.00 178.44 179.05 2byt n PHE 666 N -4.99 0.00 -0.08 1.13 7.35 -0.43 -3.60 117.46 116.84 2byt n PHE 666 Ca -0.07 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.55 2byt n PHE 666 Cb 0.10 -0.49 -0.00 0.00 0.35 0.00 0.00 39.48 39.43 2byt n PHE 666 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2byt h ALA 667 N 2.90 0.06 -1.94 3.13 0.00 -1.46 -3.47 119.26 118.48 2byt h ALA 667 Ca 0.00 0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2byt h ALA 667 Cb 0.44 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2byt h ALA 667 CO 0.00 -0.56 0.12 0.00 0.00 0.00 0.00 179.25 178.82 2byt n ALA 668 N -2.73 -0.60 -2.17 0.00 0.00 -1.26 -4.98 120.51 108.77 2byt n ALA 668 Ca 0.00 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 52.75 2byt n ALA 668 Cb 0.25 0.17 -0.03 0.00 0.00 0.00 0.00 19.45 19.84 2byt n ALA 668 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2byt s PRO 669 N -2.02 4.30 0.47 0.00 0.02 -1.26 -4.53 135.00 131.98 2byt s PRO 669 Ca 0.05 2.05 0.31 0.00 0.02 0.00 0.00 61.00 63.43 2byt s PRO 669 Cb -0.01 -3.41 1.41 0.00 0.02 0.00 0.00 34.50 32.51 2byt s PRO 669 CO 0.02 -0.52 1.69 -1.00 -0.33 0.00 0.00 177.00 176.86 2byt h PRO 670 N 7.37 0.13 -0.05 5.54 0.13 -1.87 0.50 132.00 143.74 2byt h PRO 670 Ca -0.40 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.62 2byt h PRO 670 Cb 1.20 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2byt h PRO 670 CO 0.88 0.09 -0.42 1.05 -0.23 0.00 0.00 178.00 179.37 2byt h GLU 671 N 0.14 0.11 -7.55 0.86 4.11 -1.89 -0.60 114.58 109.75 2byt h GLU 671 Ca 0.73 -0.05 -0.47 0.00 0.07 0.00 0.00 59.36 59.63 2byt h GLU 671 Cb 2.39 -0.00 0.11 0.00 0.50 0.00 0.00 28.75 31.75 2byt h GLU 671 CO -0.25 0.52 0.37 -0.80 0.07 0.00 0.00 179.01 178.92 2byt s ASN 672 N -6.90 4.25 -0.20 3.06 -0.87 0.17 -3.61 114.94 110.84 2byt s ASN 672 Ca -0.03 0.91 -0.13 0.00 -1.57 0.00 0.00 52.86 52.04 2byt s ASN 672 Cb 0.14 -1.48 -0.05 0.00 -0.02 0.00 0.00 41.25 39.85 2byt s ASN 672 CO 0.75 -2.08 0.26 -1.83 -2.57 0.00 0.00 177.10 171.63 2byt s GLU 673 N -5.43 4.16 0.56 -0.60 -1.05 -1.26 -3.31 118.70 111.77 2byt s GLU 673 Ca 0.62 -0.04 0.02 0.00 -0.15 0.00 0.00 54.97 55.42 2byt s GLU 673 Cb -0.13 -3.50 0.04 0.00 -0.44 0.00 0.00 34.13 30.11 2byt s GLU 673 CO 0.51 0.10 0.78 0.00 0.95 0.00 0.00 175.26 177.61 2byt s MET 674 N 0.91 2.47 -0.36 -4.83 0.23 -1.09 -4.95 119.30 111.68 2byt s MET 674 Ca 0.13 -0.86 0.01 0.00 -1.03 0.00 0.00 55.69 53.93 2byt s MET 674 Cb -0.13 -2.49 0.12 0.00 -1.53 0.00 0.00 34.83 30.79 2byt s MET 674 CO 0.04 -0.76 0.15 0.08 -2.03 0.00 0.00 175.02 172.51 2byt s VAL 675 N -2.77 1.10 -0.06 5.16 1.01 -1.26 -0.89 120.40 122.70 2byt s VAL 675 Ca 0.58 -1.89 -0.34 0.00 0.00 0.00 0.00 61.98 60.33 2byt s VAL 675 Cb -0.10 -1.81 -0.12 0.00 0.00 0.00 0.00 36.38 34.35 2byt s VAL 675 CO 0.39 -0.77 1.83 1.87 0.00 0.00 0.00 175.10 178.41 2byt n TRP 676 N 4.29 2.30 -4.14 5.22 -0.00 0.63 -4.88 117.44 120.87 2byt n TRP 676 Ca 0.03 0.06 -0.09 0.00 -0.00 0.00 0.00 57.50 57.49 2byt n TRP 676 Cb 0.39 -2.64 -0.10 0.00 -0.00 0.00 0.00 31.31 28.96 2byt n TRP 676 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 177.69 178.64 2byt s THR 677 N 3.56 0.55 0.12 5.87 -4.23 -1.26 -4.45 115.64 115.79 2byt s THR 677 Ca 0.91 -1.89 -0.24 0.00 -1.18 0.00 0.00 61.69 59.28 2byt s THR 677 Cb -0.71 -1.63 -0.05 0.00 1.34 0.00 0.00 72.50 71.45 2byt s THR 677 CO 0.50 -0.91 1.65 -0.08 -0.54 0.00 0.00 174.62 175.24 2byt h GLU 678 N 3.03 -0.30 -0.94 3.99 4.81 -2.00 -2.00 114.58 121.16 2byt h GLU 678 Ca -0.35 0.02 0.20 0.00 -0.13 0.00 0.00 59.36 59.10 2byt h GLU 678 Cb 1.16 0.07 -0.11 0.00 0.63 0.00 0.00 28.75 30.49 2byt h GLU 678 CO 0.65 -0.20 0.52 0.93 -0.73 0.00 0.00 179.01 180.18 2byt h GLU 679 N -0.31 0.60 -0.03 1.92 3.07 -1.99 -1.43 114.58 116.41 2byt h GLU 679 Ca 0.07 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 58.89 2byt h GLU 679 Cb 0.40 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.17 2byt h GLU 679 CO -0.21 0.40 0.01 0.78 -1.40 0.00 0.00 179.01 178.59 2byt h GLY 680 N 0.62 0.04 0.32 -3.84 0.00 -1.77 -1.83 103.07 96.61 2byt h GLY 680 Ca 0.56 -0.02 0.13 0.00 0.00 0.00 0.00 47.33 47.99 2byt h GLY 680 CO -0.43 0.02 0.43 -2.08 0.00 0.00 0.00 176.54 174.49 2byt h VAL 681 N -0.13 0.78 0.45 4.60 2.07 -0.80 -1.24 116.25 121.98 2byt h VAL 681 Ca 0.01 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 2byt h VAL 681 Cb 0.18 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 2byt h VAL 681 CO -0.00 0.12 -0.41 1.56 0.02 0.00 0.00 177.57 178.86 2byt h GLN 682 N 0.66 -0.83 -1.01 1.57 4.20 -1.05 -1.53 115.11 117.11 2byt h GLN 682 Ca 0.43 0.06 0.26 0.00 0.06 0.00 0.00 58.65 59.46 2byt h GLN 682 Cb 0.55 0.19 -0.12 0.00 0.30 0.00 0.00 27.48 28.40 2byt h GLN 682 CO -0.33 -0.56 0.61 0.78 -0.67 0.00 0.00 178.83 178.67 2byt h GLY 683 N -0.87 1.83 1.01 3.46 0.00 -0.42 0.83 103.07 108.92 2byt h GLY 683 Ca -0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 2byt h GLY 683 CO -0.04 -0.27 0.42 0.00 0.00 0.00 0.00 176.54 176.65 2byt h ALA 684 N 1.73 0.95 0.33 3.60 0.00 -0.53 0.21 119.26 125.56 2byt h ALA 684 Ca 0.65 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.44 2byt h ALA 684 Cb 1.35 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2byt h ALA 684 CO -0.47 0.46 -0.16 -1.49 0.00 0.00 0.00 179.25 177.58 2byt h TRP 685 N 1.02 -0.42 0.41 0.00 4.06 0.15 -0.72 115.95 120.45 2byt h TRP 685 Ca 0.26 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 61.19 2byt h TRP 685 Cb 0.02 0.14 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 2byt h TRP 685 CO -0.00 -0.26 -0.36 0.00 -3.56 0.00 0.00 178.44 174.25 2byt h ARG 686 N -0.45 -0.73 -0.71 0.49 3.08 -0.71 0.13 114.38 115.48 2byt h ARG 686 Ca -0.04 0.05 0.14 0.00 0.07 0.00 0.00 59.98 60.19 2byt h ARG 686 Cb 0.35 0.17 -0.13 0.00 0.08 0.00 0.00 29.97 30.43 2byt h ARG 686 CO 0.07 -0.49 -0.22 0.35 -1.07 0.00 0.00 179.97 178.61 2byt h PHE 687 N -0.76 -0.52 -0.55 3.04 3.57 -0.57 0.63 116.94 121.77 2byt h PHE 687 Ca -0.05 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 2byt h PHE 687 Cb 0.65 0.34 -0.03 0.00 2.79 0.00 0.00 35.95 39.70 2byt h PHE 687 CO -0.17 -0.33 0.26 -0.07 -2.23 0.00 0.00 178.31 175.76 2byt h LEU 688 N -0.04 0.70 0.47 0.59 3.38 -0.84 -2.59 115.31 116.98 2byt h LEU 688 Ca 0.33 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 2byt h LEU 688 Cb 0.54 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2byt h LEU 688 CO -0.75 0.61 -0.22 0.78 0.09 0.00 0.00 178.44 178.95 2byt h ASN 689 N 0.78 -0.53 -1.19 -0.43 2.35 0.15 -2.46 115.58 114.25 2byt h ASN 689 Ca 0.19 -0.07 0.34 0.00 -0.55 0.00 0.00 56.30 56.21 2byt h ASN 689 Cb 0.10 0.14 -0.07 0.00 0.05 0.00 0.00 38.32 38.54 2byt h ASN 689 CO -0.02 -0.13 0.83 0.03 -1.65 0.00 0.00 177.43 176.49 2byt h ARG 690 N -1.04 0.11 -0.38 0.81 3.08 -1.17 1.52 114.38 117.32 2byt h ARG 690 Ca -0.06 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.88 2byt h ARG 690 Cb 0.57 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 2byt h ARG 690 CO 0.10 0.07 -0.17 0.82 -1.07 0.00 0.00 179.97 179.73 2byt h ILE 691 N 0.11 1.28 0.87 2.04 2.04 -1.36 -2.54 117.51 119.95 2byt h ILE 691 Ca 0.61 -1.29 -0.04 0.00 1.00 0.00 0.00 64.86 65.13 2byt h ILE 691 Cb 2.15 1.32 0.01 0.00 -0.74 0.00 0.00 36.82 39.56 2byt h ILE 691 CO -0.11 0.43 -0.42 0.22 0.00 0.00 0.00 178.15 178.27 2byt h TYR 692 N 0.57 -1.08 -0.19 1.37 5.03 0.25 -3.11 116.97 119.82 2byt h TYR 692 Ca 0.09 -0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.40 2byt h TYR 692 Cb 0.71 0.36 -0.05 0.00 1.55 0.00 0.00 36.73 39.30 2byt h TYR 692 CO 0.06 -0.67 -0.35 0.00 -1.32 0.00 0.00 178.16 175.88 2byt h ARG 693 N -1.27 -0.30 -1.26 1.82 3.08 -1.06 0.36 114.38 115.76 2byt h ARG 693 Ca -0.12 0.02 0.46 0.00 0.07 0.00 0.00 59.98 60.41 2byt h ARG 693 Cb 0.90 0.07 -0.15 0.00 0.08 0.00 0.00 29.97 30.86 2byt h ARG 693 CO 0.20 -0.20 0.77 -2.13 -1.07 0.00 0.00 179.97 177.54 2byt n ARG 694 N -4.40 -0.04 -0.01 0.04 3.00 -0.96 0.45 116.66 114.74 2byt n ARG 694 Ca -0.03 1.29 -0.04 0.00 -0.00 0.00 0.00 57.85 59.06 2byt n ARG 694 Cb 0.23 -2.46 -0.12 0.00 0.00 0.00 0.00 32.46 30.11 2byt n ARG 694 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2byt n VAL 695 N -4.87 1.35 0.07 5.15 0.31 -0.53 -3.74 118.33 116.06 2byt n VAL 695 Ca 0.39 -0.75 -0.11 0.00 -0.01 0.00 0.00 64.34 63.87 2byt n VAL 695 Cb 1.48 -0.81 -0.01 0.00 -0.91 0.00 0.00 33.84 33.58 2byt n VAL 695 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2byt h ALA 696 N 1.21 0.47 0.00 3.52 0.00 0.41 -1.35 119.26 123.53 2byt h ALA 696 Ca -0.26 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 53.97 2byt h ALA 696 Cb 1.83 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.57 2byt h ALA 696 CO 0.06 0.83 0.00 1.49 0.00 0.00 0.00 179.25 181.63 2byt h GLU 697 N 0.20 0.00 -0.04 0.00 4.81 -0.28 -3.07 114.58 116.20 2byt h GLU 697 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2byt h GLU 697 Cb 1.49 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.87 2byt h GLU 697 CO 0.14 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 178.17 2byt n ASP 698 N -2.81 1.66 -0.21 1.04 8.00 -1.19 -4.76 116.55 118.27 2byt n ASP 698 Ca 0.02 -1.48 -0.03 0.00 0.71 0.00 0.00 54.79 54.00 2byt n ASP 698 Cb 0.32 -0.03 0.03 0.00 -0.02 0.00 0.00 41.12 41.42 2byt n ASP 698 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2byt h ARG 699 N 0.60 -0.10 0.67 -1.24 2.43 -1.14 1.03 114.38 116.62 2byt h ARG 699 Ca 0.00 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2byt h ARG 699 Cb 0.31 0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2byt h ARG 699 CO 0.00 -0.07 -0.32 1.49 -1.51 0.00 0.00 179.97 179.56 2byt h GLU 700 N -0.10 -0.86 -0.94 0.20 4.81 -1.86 -0.05 114.58 115.77 2byt h GLU 700 Ca 0.27 0.06 0.22 0.00 -0.13 0.00 0.00 59.36 59.78 2byt h GLU 700 Cb 0.53 0.20 -0.12 0.00 0.63 0.00 0.00 28.75 29.99 2byt h GLU 700 CO -0.69 -0.54 0.50 0.00 -0.73 0.00 0.00 179.01 177.55 2byt h ALA 701 N -1.04 1.58 -0.21 2.92 0.00 -1.71 -0.31 119.26 120.50 2byt h ALA 701 Ca -0.09 0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.74 2byt h ALA 701 Cb 0.72 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.56 2byt h ALA 701 CO 0.15 -0.25 -0.69 -0.07 0.00 0.00 0.00 179.25 178.39 2byt h LEU 702 N 0.54 0.94 -2.20 0.00 3.38 0.11 -3.21 115.31 114.87 2byt h LEU 702 Ca 0.58 -0.57 0.05 0.00 0.09 0.00 0.00 57.88 58.03 2byt h LEU 702 Cb 1.06 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2byt h LEU 702 CO -0.47 1.37 0.27 -0.07 0.09 0.00 0.00 178.44 179.62 2byt h LEU 703 N 0.59 0.00 -3.08 1.67 3.38 0.83 -0.55 115.31 118.14 2byt h LEU 703 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2byt h LEU 703 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2byt h LEU 703 CO 0.14 0.00 0.00 -1.84 0.09 0.00 0.00 178.44 176.83 2byt n GLU 704 N -3.52 3.11 -4.25 1.13 0.28 -1.13 -4.99 120.64 111.27 2byt n GLU 704 Ca 0.02 -2.53 -0.28 0.00 -0.16 0.00 0.00 57.16 54.21 2byt n GLU 704 Cb 0.38 -1.62 -0.09 0.00 1.43 0.00 0.00 31.44 31.53 2byt n GLU 704 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2byt s THR 705 N -1.85 3.35 -0.08 3.84 2.01 -0.22 -5.11 115.64 117.58 2byt s THR 705 Ca 0.37 -1.49 -0.05 0.00 0.31 0.00 0.00 61.69 60.83 2byt s THR 705 Cb 0.25 -2.63 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 2byt s THR 705 CO 0.15 -0.04 0.13 -0.55 -0.69 0.00 0.00 174.62 173.62 2byt s SER 706 N -2.66 6.17 -0.20 3.53 0.15 -1.26 -4.99 113.70 114.44 2byt s SER 706 Ca 0.24 0.37 0.09 0.00 0.70 0.00 0.00 55.95 57.36 2byt s SER 706 Cb -0.10 -1.94 0.61 0.00 -1.71 0.00 0.00 66.02 62.88 2byt s SER 706 CO 0.15 0.36 1.48 0.61 1.20 0.00 0.00 173.24 177.05 2byt n GLY 707 N 1.68 2.81 3.80 9.45 0.00 -1.26 -4.15 105.19 117.52 2byt n GLY 707 Ca -0.17 -0.72 -0.36 0.00 0.00 0.00 0.00 46.02 44.77 2byt n GLY 707 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2byt s VAL 708 N -2.36 5.04 -0.07 1.61 1.01 -1.26 -4.72 120.40 119.65 2byt s VAL 708 Ca 0.42 0.03 -0.31 0.00 0.00 0.00 0.00 61.98 62.11 2byt s VAL 708 Cb 0.32 -3.17 0.12 0.00 0.00 0.00 0.00 36.38 33.64 2byt s VAL 708 CO 0.12 0.61 1.10 0.72 0.00 0.00 0.00 175.10 177.64 2byt s PHE 709 N -0.91 -0.18 -0.15 5.22 -0.71 -1.26 -4.90 117.98 115.10 2byt s PHE 709 Ca 0.14 0.07 -0.21 0.00 -1.04 0.00 0.00 56.93 55.88 2byt s PHE 709 Cb -0.12 0.54 -0.03 0.00 -1.21 0.00 0.00 43.02 42.20 2byt s PHE 709 CO 0.03 -0.38 0.62 -1.14 -1.34 0.00 0.00 175.22 173.01 2byt s GLN 710 N -2.72 4.29 0.04 1.99 0.74 -1.26 -5.00 119.66 117.73 2byt s GLN 710 Ca 0.09 0.65 -0.12 0.00 0.05 0.00 0.00 55.36 56.03 2byt s GLN 710 Cb -0.00 -3.52 -0.05 0.00 1.10 0.00 0.00 33.01 30.54 2byt s GLN 710 CO -0.05 -0.09 1.20 0.00 -0.55 0.00 0.00 175.29 175.79 2byt h ALA 711 N 7.16 -0.72 -0.28 1.58 0.00 -2.00 -3.12 119.26 121.88 2byt h ALA 711 Ca -0.35 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2byt h ALA 711 Cb 1.16 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 19.54 2byt h ALA 711 CO 0.77 -0.77 0.12 0.93 0.00 0.00 0.00 179.25 180.30 2byt h GLU 712 N -0.27 0.38 -0.37 0.00 3.07 -2.03 -2.81 114.58 112.55 2byt h GLU 712 Ca -0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2byt h GLU 712 Cb 0.27 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 2byt h GLU 712 CO -0.10 0.32 0.00 0.00 -1.40 0.00 0.00 179.01 177.83 2byt n ALA 713 N -2.49 1.56 -2.88 3.43 0.00 -1.18 -4.71 120.51 114.23 2byt n ALA 713 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.12 2byt n ALA 713 Cb 0.12 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.53 2byt n ALA 713 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2byt s LEU 714 N 0.00 4.36 -0.06 0.00 1.43 -1.06 -4.98 118.68 118.38 2byt s LEU 714 Ca 0.00 0.36 -0.30 0.00 -1.03 0.00 0.00 54.13 53.16 2byt s LEU 714 Cb 0.00 -2.73 0.08 0.00 0.03 0.00 0.00 46.19 43.57 2byt s LEU 714 CO 0.00 0.23 0.75 -1.83 0.23 0.00 0.00 176.35 175.73 2byt s GLU 715 N -2.09 0.97 1.41 1.70 -1.05 -1.26 -4.73 118.70 113.65 2byt s GLU 715 Ca 0.30 0.16 0.00 0.00 -0.15 0.00 0.00 54.97 55.28 2byt s GLU 715 Cb -0.13 0.46 0.00 0.00 -0.44 0.00 0.00 34.13 34.02 2byt s GLU 715 CO 0.21 -0.32 0.00 0.41 0.95 0.00 0.00 175.26 176.51 2byt n GLY 716 N 0.73 -1.35 0.37 -3.83 0.00 -1.26 -3.82 105.19 96.03 2byt n GLY 716 Ca -0.17 -1.52 0.12 0.00 0.00 0.00 0.00 46.02 44.45 2byt n GLY 716 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2byt h LYS 717 N 0.00 0.69 0.25 1.61 1.79 -1.99 -1.94 116.57 116.99 2byt h LYS 717 Ca 0.00 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2byt h LYS 717 Cb 0.00 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.49 2byt h LYS 717 CO 0.00 0.46 -0.22 -0.44 -1.08 0.00 0.00 179.45 178.17 2byt h ASP 718 N 0.72 -0.59 -1.17 0.86 5.19 -1.99 0.58 116.42 120.02 2byt h ASP 718 Ca 0.48 0.04 0.37 0.00 -0.62 0.00 0.00 57.03 57.30 2byt h ASP 718 Cb 0.78 0.19 -0.12 0.00 0.18 0.00 0.00 39.33 40.36 2byt h ASP 718 CO -0.24 -0.30 0.74 -0.09 -3.12 0.00 0.00 179.24 176.22 2byt h ARG 719 N -0.46 0.21 0.39 3.56 2.43 -1.48 0.15 114.38 119.17 2byt h ARG 719 Ca -0.03 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 2byt h ARG 719 Cb 0.39 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2byt h ARG 719 CO -0.01 0.14 -0.19 1.49 -1.51 0.00 0.00 179.97 179.89 2byt h GLU 720 N 0.21 -0.50 -0.90 0.20 4.81 -0.71 -2.71 114.58 114.98 2byt h GLU 720 Ca 0.74 0.03 0.23 0.00 -0.13 0.00 0.00 59.36 60.23 2byt h GLU 720 Cb 2.09 0.11 -0.13 0.00 0.63 0.00 0.00 28.75 31.46 2byt h GLU 720 CO -0.43 -0.33 0.38 1.25 -0.73 0.00 0.00 179.01 179.14 2byt h LEU 721 N -1.03 0.30 -1.10 1.64 5.85 0.15 0.46 115.31 121.58 2byt h LEU 721 Ca -0.05 0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 2byt h LEU 721 Cb 0.40 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 2byt h LEU 721 CO 0.09 -0.03 0.52 0.22 -0.34 0.00 0.00 178.44 178.90 2byt h TYR 722 N 0.37 1.09 -0.27 1.25 3.20 -0.82 0.13 116.97 121.92 2byt h TYR 722 Ca 0.57 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.36 2byt h TYR 722 Cb 1.09 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 39.00 2byt h TYR 722 CO -0.15 0.71 -0.16 0.78 -1.64 0.00 0.00 178.16 177.71 2byt h GLY 723 N 1.16 0.64 0.91 1.82 0.00 0.16 -2.89 103.07 104.87 2byt h GLY 723 Ca 0.30 -0.59 0.08 0.00 0.00 0.00 0.00 47.33 47.12 2byt h GLY 723 CO -0.06 0.54 0.52 1.70 0.00 0.00 0.00 176.54 179.24 2byt h LYS 724 N 0.32 0.79 0.00 4.80 1.63 -0.26 0.32 116.57 124.16 2byt h LYS 724 Ca 0.06 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2byt h LYS 724 Cb 0.68 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 2byt h LYS 724 CO 0.04 0.52 0.00 -0.11 -3.45 0.00 0.00 179.45 176.45 2byt n LEU 725 N -4.49 0.00 -0.25 5.20 7.94 -0.03 -1.15 117.00 124.21 2byt n LEU 725 Ca 0.12 0.91 0.22 0.00 -1.11 0.00 0.00 56.01 56.16 2byt n LEU 725 Cb 0.26 -0.41 0.56 0.00 0.53 0.00 0.00 43.42 44.37 2byt n LEU 725 CO 0.33 -0.41 1.23 0.45 -1.11 0.00 0.00 177.39 177.89 2byt h HIS 726 N 0.00 0.43 -0.64 1.96 3.86 -1.31 0.96 115.15 120.41 2byt h HIS 726 Ca 0.00 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 2byt h HIS 726 Cb 0.00 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.31 2byt h HIS 726 CO 0.14 0.09 0.24 1.49 0.86 0.00 0.00 177.93 180.75 2byt h GLU 727 N 0.30 0.95 -0.01 2.45 4.81 -0.26 -1.76 114.58 121.06 2byt h GLU 727 Ca 0.49 -0.16 -0.03 0.00 -0.13 0.00 0.00 59.36 59.53 2byt h GLU 727 Cb 1.40 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.62 2byt h GLU 727 CO -0.16 0.78 -0.10 1.15 -0.73 0.00 0.00 179.01 179.95 2byt h THR 728 N 0.93 1.55 -0.95 0.32 2.02 0.22 -3.15 112.91 113.85 2byt h THR 728 Ca 0.22 -1.77 0.21 0.00 0.77 0.00 0.00 66.41 65.84 2byt h THR 728 Cb 0.20 2.70 -0.12 0.00 -1.74 0.00 0.00 68.15 69.19 2byt h THR 728 CO -0.02 0.47 0.52 0.25 0.37 0.00 0.00 175.52 177.11 2byt h LEU 729 N -0.60 0.58 0.45 2.58 5.85 -0.01 -0.08 115.31 124.08 2byt h LEU 729 Ca -0.01 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 2byt h LEU 729 Cb 0.82 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 2byt h LEU 729 CO 0.02 0.13 -0.49 0.50 -0.34 0.00 0.00 178.44 178.26 2byt h LYS 730 N 0.58 -0.92 0.01 1.25 3.64 -1.34 0.41 116.57 120.20 2byt h LYS 730 Ca 0.58 0.06 0.03 0.00 -1.27 0.00 0.00 60.65 60.05 2byt h LYS 730 Cb 1.02 0.21 -0.05 0.00 -0.41 0.00 0.00 32.23 33.00 2byt h LYS 730 CO -0.45 -0.62 -0.31 -0.22 -2.27 0.00 0.00 179.45 175.58 2byt h LYS 731 N -0.96 -0.45 0.14 1.90 1.63 -1.14 0.11 116.57 117.81 2byt h LYS 731 Ca -0.05 0.03 0.02 0.00 -0.85 0.00 0.00 60.65 59.79 2byt h LYS 731 Cb 0.85 0.10 -0.05 0.00 -0.60 0.00 0.00 32.23 32.53 2byt h LYS 731 CO -0.08 -0.30 -0.46 0.28 -3.45 0.00 0.00 179.45 175.43 2byt h VAL 732 N -0.46 0.09 -1.00 2.00 2.07 -0.96 0.33 116.25 118.32 2byt h VAL 732 Ca 0.06 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.72 2byt h VAL 732 Cb 0.54 0.09 -0.09 0.00 -1.52 0.00 0.00 31.29 30.32 2byt h VAL 732 CO -0.25 0.00 0.63 0.74 0.02 0.00 0.00 177.57 178.71 2byt h THR 733 N -0.71 0.86 0.07 2.57 2.02 -0.60 0.99 112.91 118.11 2byt h THR 733 Ca 0.01 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 2byt h THR 733 Cb 0.72 -0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2byt h THR 733 CO -0.25 0.17 -0.03 -0.33 0.37 0.00 0.00 175.52 175.44 2byt h GLU 734 N 0.92 -0.09 -0.85 6.66 5.08 -0.31 -2.94 114.58 123.06 2byt h GLU 734 Ca 0.52 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.95 2byt h GLU 734 Cb 0.61 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.83 2byt h GLU 734 CO -0.29 0.42 0.55 -0.44 -1.00 0.00 0.00 179.01 178.25 2byt h ASP 735 N -0.66 0.81 -0.76 1.42 3.32 -0.49 -0.07 116.42 119.98 2byt h ASP 735 Ca -0.01 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 2byt h ASP 735 Cb 0.55 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 2byt h ASP 735 CO 0.02 0.51 0.33 -0.07 -1.72 0.00 0.00 179.24 178.30 2byt h LEU 736 N 0.91 1.04 -0.81 1.55 3.38 -0.85 -0.08 115.31 120.45 2byt h LEU 736 Ca 0.37 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 2byt h LEU 736 Cb 0.26 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2byt h LEU 736 CO -0.14 0.91 -0.15 -0.33 0.09 0.00 0.00 178.44 178.82 2byt h GLU 737 N 1.10 0.73 -0.00 1.13 5.08 -0.88 -2.72 114.58 119.01 2byt h GLU 737 Ca 0.26 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2byt h GLU 737 Cb 0.18 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2byt h GLU 737 CO -0.02 0.84 -0.08 0.00 -1.00 0.00 0.00 179.01 178.75 2byt n ALA 738 N -2.49 2.71 -2.97 3.43 0.00 -0.40 -4.93 120.51 115.86 2byt n ALA 738 Ca 0.01 -0.25 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 2byt n ALA 738 Cb 0.38 -1.37 0.04 0.00 0.00 0.00 0.00 19.45 18.50 2byt n ALA 738 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2byt n LEU 739 N -0.96 -2.69 -3.36 0.00 4.32 -0.62 -4.97 117.00 108.72 2byt n LEU 739 Ca 0.15 -0.26 -0.31 0.00 -0.02 0.00 0.00 56.01 55.58 2byt n LEU 739 Cb 0.26 -1.69 -0.04 0.00 -1.62 0.00 0.00 43.42 40.33 2byt n LEU 739 CO 0.23 0.29 0.38 0.54 -1.22 0.00 0.00 177.39 177.61 2byt n ARG 740 N -2.58 3.33 -0.11 3.23 1.74 -0.14 -4.80 116.66 117.32 2byt n ARG 740 Ca -0.01 -4.73 0.07 0.00 -0.77 0.00 0.00 57.85 52.41 2byt n ARG 740 Cb 0.53 -2.31 0.41 0.00 -1.02 0.00 0.00 32.46 30.07 2byt n ARG 740 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2byt h PHE 741 N 3.94 0.62 0.06 -1.55 0.04 -1.89 -2.00 116.94 116.16 2byt h PHE 741 Ca 0.21 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.99 2byt h PHE 741 Cb 0.57 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.51 2byt h PHE 741 CO 0.86 0.34 -0.04 -2.95 -0.60 0.00 0.00 178.31 175.92 2byt h ASN 742 N 0.62 -0.11 -0.06 2.17 -1.07 -1.79 -1.01 115.58 114.33 2byt h ASN 742 Ca 0.26 0.01 0.02 0.00 0.07 0.00 0.00 56.30 56.65 2byt h ASN 742 Cb 0.24 0.03 -0.00 0.00 -2.07 0.00 0.00 38.32 36.52 2byt h ASN 742 CO -0.08 -0.06 0.12 0.71 0.07 0.00 0.00 177.43 178.19 2byt h THR 743 N -0.10 0.24 -0.49 6.14 1.35 -1.90 0.32 112.91 118.47 2byt h THR 743 Ca -0.01 0.00 -0.08 0.00 -0.55 0.00 0.00 66.41 65.77 2byt h THR 743 Cb 0.08 0.90 -0.02 0.00 -1.73 0.00 0.00 68.15 67.38 2byt h THR 743 CO 0.00 0.00 -0.02 0.00 -0.25 0.00 0.00 175.52 175.25 2byt h ALA 744 N 1.82 1.05 0.22 6.62 0.00 -0.90 -1.24 119.26 126.82 2byt h ALA 744 Ca 0.03 -0.28 -0.31 0.00 0.00 0.00 0.00 54.91 54.34 2byt h ALA 744 Cb 0.26 -0.19 0.03 0.00 0.00 0.00 0.00 17.79 17.88 2byt h ALA 744 CO -0.00 0.59 -1.43 0.82 0.00 0.00 0.00 179.25 179.23 2byt h ILE 745 N 0.77 1.23 -0.82 0.00 2.04 0.86 -3.10 117.51 118.49 2byt h ILE 745 Ca 0.14 -2.62 0.20 0.00 1.00 0.00 0.00 64.86 63.59 2byt h ILE 745 Cb 0.49 2.99 -0.05 0.00 -0.74 0.00 0.00 36.82 39.52 2byt h ILE 745 CO 0.02 0.80 0.56 0.00 0.00 0.00 0.00 178.15 179.53 2byt h ALA 746 N 0.12 2.41 -0.03 1.87 0.00 -0.83 0.61 119.26 123.41 2byt h ALA 746 Ca -0.26 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.46 2byt h ALA 746 Cb 2.05 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.84 2byt h ALA 746 CO 0.22 -0.66 -0.79 0.00 0.00 0.00 0.00 179.25 178.03 2byt h ALA 747 N 1.62 0.58 -0.00 0.00 0.00 -1.23 -2.60 119.26 117.63 2byt h ALA 747 Ca 0.41 -0.65 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 2byt h ALA 747 Cb 1.24 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2byt h ALA 747 CO -0.09 0.82 -0.51 -0.07 0.00 0.00 0.00 179.25 179.40 2byt h LEU 748 N 0.19 0.01 -0.12 0.00 3.38 0.22 -2.32 115.31 116.66 2byt h LEU 748 Ca -0.04 -0.01 -0.24 0.00 0.09 0.00 0.00 57.88 57.69 2byt h LEU 748 Cb 1.38 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.14 2byt h LEU 748 CO 0.13 0.52 -0.97 0.24 0.09 0.00 0.00 178.44 178.45 2byt h MET 749 N 0.01 0.51 -0.50 1.13 2.86 -1.01 -2.67 114.93 115.26 2byt h MET 749 Ca -0.00 -0.54 -0.01 0.00 -2.06 0.00 0.00 59.70 57.09 2byt h MET 749 Cb 0.91 0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.70 2byt h MET 749 CO 0.07 1.18 0.29 1.49 1.06 0.00 0.00 176.91 180.99 2byt h GLU 750 N 0.29 0.69 -0.55 1.72 4.81 -1.30 -2.30 114.58 117.94 2byt h GLU 750 Ca -0.09 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 58.97 2byt h GLU 750 Cb 1.61 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.83 2byt h GLU 750 CO 0.18 0.52 -0.02 0.35 -0.73 0.00 0.00 179.01 179.31 2byt h PHE 751 N 0.67 1.09 -0.58 0.92 3.57 -1.45 -2.24 116.94 118.92 2byt h PHE 751 Ca 0.18 -0.20 0.12 0.00 3.53 0.00 0.00 57.97 61.60 2byt h PHE 751 Cb 0.02 -0.28 -0.09 0.00 2.79 0.00 0.00 35.95 38.39 2byt h PHE 751 CO -0.02 0.99 0.03 1.25 -2.23 0.00 0.00 178.31 178.33 2byt h LEU 752 N 0.87 -0.19 -0.33 0.59 5.85 -1.09 0.21 115.31 121.22 2byt h LEU 752 Ca 0.15 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 59.00 2byt h LEU 752 Cb 0.57 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 2byt h LEU 752 CO 0.03 -0.08 0.19 0.78 -0.34 0.00 0.00 178.44 179.03 2byt h ASN 753 N 0.15 0.41 -0.88 1.25 2.35 -1.25 -1.51 115.58 116.10 2byt h ASN 753 Ca 0.30 -0.08 0.21 0.00 -0.55 0.00 0.00 56.30 56.19 2byt h ASN 753 Cb 0.48 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.69 2byt h ASN 753 CO -0.47 0.37 0.59 0.00 -1.65 0.00 0.00 177.43 176.27 2byt h ALA 754 N 1.06 2.39 -0.05 -0.83 0.00 -0.12 0.24 119.26 121.95 2byt h ALA 754 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.82 2byt h ALA 754 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2byt h ALA 754 CO -0.02 -0.66 -0.86 -0.07 0.00 0.00 0.00 179.25 177.64 2byt h LEU 755 N 0.28 0.61 -0.77 0.00 3.38 0.21 -1.86 115.31 117.15 2byt h LEU 755 Ca 0.45 -0.45 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2byt h LEU 755 Cb 1.30 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 2byt h LEU 755 CO -0.12 1.23 -0.24 1.88 0.09 0.00 0.00 178.44 181.27 2byt h TYR 756 N 0.31 0.75 0.00 1.13 -1.99 0.28 -2.47 116.97 114.97 2byt h TYR 756 Ca -0.07 -0.17 -0.11 0.00 2.00 0.00 0.00 58.73 60.38 2byt h TYR 756 Cb 1.48 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 40.02 2byt h TYR 756 CO 0.06 0.84 -0.54 0.93 -0.00 0.00 0.00 178.16 179.46 2byt h GLU 757 N 0.58 0.00 0.00 4.88 4.39 -0.94 -2.95 114.58 120.53 2byt h GLU 757 Ca 0.08 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.78 2byt h GLU 757 Cb 0.72 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2byt h GLU 757 CO 0.06 0.54 -0.01 -0.92 -1.16 0.00 0.00 179.01 177.51 2byt h TYR 758 N 0.00 0.00 -0.13 4.33 3.20 -1.04 -3.21 116.97 120.12 2byt h TYR 758 Ca -0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2byt h TYR 758 Cb 1.08 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.35 2byt h TYR 758 CO 0.00 0.01 0.00 0.54 -1.64 0.00 0.00 178.16 177.07 2byt n ARG 759 N -3.10 1.77 0.00 1.82 5.12 -0.96 -2.69 116.66 118.62 2byt n ARG 759 Ca 0.03 -1.15 0.11 0.00 -1.93 0.00 0.00 57.85 54.91 2byt n ARG 759 Cb 0.47 -1.43 -0.02 0.00 -1.16 0.00 0.00 32.46 30.32 2byt n ARG 759 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2byt n LYS 760 N 0.37 0.19 -0.26 5.56 5.02 -1.21 -4.30 118.16 123.54 2byt n LYS 760 Ca 0.17 -0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2byt n LYS 760 Cb 0.36 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.88 2byt n LYS 760 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2byt n ASP 761 N -1.27 0.16 -3.56 4.39 8.00 -1.24 -5.09 116.55 117.93 2byt n ASP 761 Ca 0.05 -1.62 -0.17 0.00 0.71 0.00 0.00 54.79 53.76 2byt n ASP 761 Cb 0.35 -0.12 -0.06 0.00 -0.02 0.00 0.00 41.12 41.27 2byt n ASP 761 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2byt s ARG 762 N -0.15 0.98 0.68 -1.24 6.06 -1.10 -5.04 118.95 119.15 2byt s ARG 762 Ca 0.01 0.52 -0.02 0.00 -2.50 0.00 0.00 55.73 53.75 2byt s ARG 762 Cb 0.01 0.47 0.09 0.00 0.06 0.00 0.00 34.95 35.58 2byt s ARG 762 CO 0.00 -0.25 0.95 -2.14 -2.50 0.00 0.00 175.30 171.36 2byt s PRO 763 N -0.63 1.96 -0.63 5.12 0.02 -1.26 -4.40 135.00 135.18 2byt s PRO 763 Ca -0.07 -0.84 -0.26 0.00 0.02 0.00 0.00 61.00 59.85 2byt s PRO 763 Cb -0.02 -2.33 -0.10 0.00 0.02 0.00 0.00 34.50 32.07 2byt s PRO 763 CO 0.07 -1.25 2.42 0.28 -0.33 0.00 0.00 177.00 178.19 2byt n VAL 764 N -2.75 -0.05 -3.55 3.83 0.31 -1.26 -4.91 118.33 109.95 2byt n VAL 764 Ca 0.12 -0.67 -0.19 0.00 -0.01 0.00 0.00 64.34 63.59 2byt n VAL 764 Cb 0.60 -2.42 -0.01 0.00 -0.91 0.00 0.00 33.84 31.10 2byt n VAL 764 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2byt s THR 765 N 13.21 4.07 0.21 2.52 -4.23 -1.26 -4.94 115.64 125.22 2byt s THR 765 Ca 0.97 -1.05 -0.09 0.00 -1.18 0.00 0.00 61.69 60.34 2byt s THR 765 Cb -0.18 -3.40 0.15 0.00 1.34 0.00 0.00 72.50 70.41 2byt s THR 765 CO 0.19 -0.17 1.76 -0.65 -0.54 0.00 0.00 174.62 175.21 2byt h PRO 766 N 0.96 0.47 -0.46 3.99 0.11 -1.91 0.84 132.00 136.00 2byt h PRO 766 Ca -0.46 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.67 2byt h PRO 766 Cb 1.25 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 2byt h PRO 766 CO 0.54 0.31 0.20 -0.24 -0.21 0.00 0.00 178.00 178.60 2byt h VAL 767 N 0.48 0.90 -0.51 3.15 3.04 -1.90 -1.35 116.25 120.07 2byt h VAL 767 Ca 0.32 -0.14 0.02 0.00 -1.01 0.00 0.00 66.70 65.89 2byt h VAL 767 Cb 0.36 0.47 -0.03 0.00 -2.01 0.00 0.00 31.29 30.08 2byt h VAL 767 CO -0.28 0.07 0.31 0.22 -1.01 0.00 0.00 177.57 176.88 2byt h TYR 768 N 0.40 0.58 -0.08 3.17 3.20 -1.30 0.41 116.97 123.34 2byt h TYR 768 Ca 0.21 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.14 2byt h TYR 768 Cb 0.17 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 2byt h TYR 768 CO -0.13 0.34 -0.18 -0.09 -1.64 0.00 0.00 178.16 176.46 2byt h ARG 769 N 0.62 -0.24 -0.69 1.82 2.43 -0.29 0.10 114.38 118.13 2byt h ARG 769 Ca 0.20 0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.53 2byt h ARG 769 Cb 0.01 0.05 -0.10 0.00 -0.42 0.00 0.00 29.97 29.52 2byt h ARG 769 CO -0.09 -0.16 0.20 1.15 -1.51 0.00 0.00 179.97 179.56 2byt h THR 770 N -0.25 0.61 -0.52 0.20 2.02 -0.62 0.66 112.91 115.01 2byt h THR 770 Ca 0.08 -0.11 0.09 0.00 0.77 0.00 0.00 66.41 67.24 2byt h THR 770 Cb 0.37 0.26 -0.07 0.00 -1.74 0.00 0.00 68.15 66.97 2byt h THR 770 CO -0.23 0.06 0.13 0.00 0.37 0.00 0.00 175.52 175.84 2byt h ALA 771 N 1.54 0.60 -0.40 6.16 0.00 0.13 0.91 119.26 128.20 2byt h ALA 771 Ca 0.37 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.36 2byt h ALA 771 Cb 0.58 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2byt h ALA 771 CO -0.43 -0.28 0.15 0.82 0.00 0.00 0.00 179.25 179.50 2byt h ILE 772 N 0.27 1.20 0.19 0.00 1.08 0.93 0.13 117.51 121.31 2byt h ILE 772 Ca 0.26 -0.64 0.01 0.00 -0.39 0.00 0.00 64.86 64.11 2byt h ILE 772 Cb 0.34 0.87 -0.03 0.00 -3.07 0.00 0.00 36.82 34.92 2byt h ILE 772 CO -0.32 0.23 -0.34 -0.09 -0.69 0.00 0.00 178.15 176.95 2byt h ARG 773 N 0.50 -0.58 -0.95 2.37 2.43 -0.09 0.19 114.38 118.25 2byt h ARG 773 Ca 0.13 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.45 2byt h ARG 773 Cb 0.21 0.13 -0.08 0.00 -0.42 0.00 0.00 29.97 29.81 2byt h ARG 773 CO -0.01 -0.39 0.59 1.88 -1.51 0.00 0.00 179.97 180.53 2byt h TYR 774 N -0.60 1.07 -0.32 2.20 -1.99 -0.72 -2.05 116.97 114.56 2byt h TYR 774 Ca 0.01 0.03 -0.03 0.00 2.00 0.00 0.00 58.73 60.75 2byt h TYR 774 Cb 0.60 -0.34 -0.01 0.00 2.00 0.00 0.00 36.73 38.98 2byt h TYR 774 CO -0.27 0.45 0.09 -0.92 -0.00 0.00 0.00 178.16 177.51 2byt h TYR 775 N 0.96 0.52 -0.47 4.88 5.03 -0.38 -1.54 116.97 125.97 2byt h TYR 775 Ca 0.46 -0.06 0.00 0.00 2.58 0.00 0.00 58.73 61.71 2byt h TYR 775 Cb 0.40 -0.15 -0.02 0.00 1.55 0.00 0.00 36.73 38.51 2byt h TYR 775 CO -0.02 0.54 0.31 -0.07 -1.32 0.00 0.00 178.16 177.60 2byt h LEU 776 N 0.36 0.54 -0.51 2.82 3.38 -0.34 -0.52 115.31 121.04 2byt h LEU 776 Ca 0.10 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.90 2byt h LEU 776 Cb 0.27 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2byt h LEU 776 CO -0.00 0.39 -0.51 1.56 0.09 0.00 0.00 178.44 179.97 2byt h GLN 777 N 0.64 0.64 0.00 1.13 4.20 -1.10 -2.51 115.11 118.11 2byt h GLN 777 Ca 0.17 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.50 2byt h GLN 777 Cb -0.07 0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.74 2byt h GLN 777 CO -0.04 0.99 0.00 -1.33 -0.67 0.00 0.00 178.83 177.79 2byt n MET 778 N -3.99 0.11 0.00 1.46 2.81 -0.57 -3.32 117.12 113.63 2byt n MET 778 Ca -0.03 0.18 -0.20 0.00 -1.81 0.00 0.00 57.70 55.84 2byt n MET 778 Cb 0.59 -1.65 -0.14 0.00 -0.71 0.00 0.00 33.22 31.31 2byt n MET 778 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2byt n LEU 779 N -1.84 2.41 -0.57 4.03 7.94 -0.31 -4.41 117.00 124.26 2byt n LEU 779 Ca 0.05 0.24 0.43 0.00 -1.11 0.00 0.00 56.01 55.62 2byt n LEU 779 Cb 0.31 -0.96 0.65 0.00 0.53 0.00 0.00 43.42 43.96 2byt n LEU 779 CO 0.24 0.80 1.18 0.33 -1.11 0.00 0.00 177.39 178.83 2byt n PHE 780 N -3.43 0.00 0.07 1.96 7.35 -0.97 -0.36 117.46 122.09 2byt n PHE 780 Ca -0.30 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.30 2byt n PHE 780 Cb 1.05 -0.39 -0.12 0.00 0.35 0.00 0.00 39.48 40.36 2byt n PHE 780 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 2byt h PRO 781 N 0.00 0.08 0.05 -7.13 0.11 -1.80 -3.09 132.00 120.22 2byt h PRO 781 Ca 0.75 -0.14 -0.33 0.00 0.11 0.00 0.00 66.00 66.40 2byt h PRO 781 Cb 3.01 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 34.13 2byt h PRO 781 CO -0.01 1.06 -1.81 1.19 -0.21 0.00 0.00 178.00 178.22 2byt n PHE 782 N -3.40 0.92 -3.46 0.65 3.72 0.51 -4.26 117.46 112.13 2byt n PHE 782 Ca -0.02 0.28 -0.27 0.00 -0.05 0.00 0.00 57.45 57.39 2byt n PHE 782 Cb 0.96 -1.11 -0.09 0.00 -0.94 0.00 0.00 39.48 38.31 2byt n PHE 782 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2byt n ALA 783 N -3.32 3.61 0.24 4.37 0.00 -0.81 -4.53 120.51 120.08 2byt n ALA 783 Ca -0.36 -4.41 0.08 0.00 0.00 0.00 0.00 53.44 48.75 2byt n ALA 783 Cb 0.88 -0.90 0.62 0.00 0.00 0.00 0.00 19.45 20.05 2byt n ALA 783 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2byt h PRO 784 N 4.43 0.02 0.00 0.00 0.13 -1.72 -1.96 132.00 132.90 2byt h PRO 784 Ca 0.17 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2byt h PRO 784 Cb 0.73 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2byt h PRO 784 CO 0.73 0.04 0.00 0.72 -0.23 0.00 0.00 178.00 179.25 2byt n HIS 785 N -4.51 0.00 -0.12 1.56 8.25 -1.26 -1.37 115.22 117.76 2byt n HIS 785 Ca -0.03 0.00 0.27 0.00 -0.26 0.00 0.00 57.72 57.71 2byt n HIS 785 Cb 0.11 -0.41 0.71 0.00 1.12 0.00 0.00 29.99 31.52 2byt n HIS 785 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2byt h LEU 786 N 0.00 0.00 -0.13 2.41 5.85 -1.98 0.25 115.31 121.71 2byt h LEU 786 Ca 0.00 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 2byt h LEU 786 Cb 0.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.04 2byt h LEU 786 CO 0.00 0.00 -0.48 0.00 -0.34 0.00 0.00 178.44 177.62 2byt h ALA 787 N 1.40 0.23 -0.05 1.25 0.00 -1.41 -2.90 119.26 117.79 2byt h ALA 787 Ca 0.38 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2byt h ALA 787 Cb 1.73 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 2byt h ALA 787 CO -0.00 0.40 -0.36 1.49 0.00 0.00 0.00 179.25 180.77 2byt h GLU 788 N 0.18 0.11 0.00 0.00 4.57 0.68 -2.42 114.58 117.70 2byt h GLU 788 Ca -0.02 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2byt h GLU 788 Cb 1.12 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.70 2byt h GLU 788 CO 0.10 0.46 0.00 -1.91 -1.18 0.00 0.00 179.01 176.48 2byt n GLU 789 N -4.08 0.00 -0.25 1.92 4.07 -0.36 -2.83 120.64 119.11 2byt n GLU 789 Ca -0.02 0.42 0.25 0.00 -0.06 0.00 0.00 57.16 57.75 2byt n GLU 789 Cb 0.42 -1.29 0.61 0.00 -0.06 0.00 0.00 31.44 31.12 2byt n GLU 789 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2byt h LEU 790 N 0.00 0.24 -0.78 4.31 3.38 -1.60 -0.40 115.31 120.46 2byt h LEU 790 Ca 0.00 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2byt h LEU 790 Cb 0.00 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2byt h LEU 790 CO 0.00 0.07 0.32 -0.25 0.09 0.00 0.00 178.44 178.68 2byt h TRP 791 N 0.23 1.19 0.00 1.13 2.91 -1.47 -2.94 115.95 117.00 2byt h TRP 791 Ca 0.49 -0.09 -0.04 0.00 1.13 0.00 0.00 58.89 60.39 2byt h TRP 791 Cb 1.54 -0.36 -0.01 0.00 -0.51 0.00 0.00 29.16 29.83 2byt h TRP 791 CO -0.00 0.89 -0.18 0.45 -1.03 0.00 0.00 178.44 178.57 2byt h HIS 792 N 1.13 0.00 -0.02 2.65 3.86 -0.90 -0.08 115.15 121.79 2byt h HIS 792 Ca 0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.48 2byt h HIS 792 Cb 0.20 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.67 2byt h HIS 792 CO 0.02 0.18 0.12 -1.49 0.86 0.00 0.00 177.93 177.62 2byt h TRP 793 N 0.00 0.00 0.00 2.45 6.55 -1.48 -3.26 115.95 120.21 2byt h TRP 793 Ca -0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 2byt h TRP 793 Cb 0.59 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.89 2byt h TRP 793 CO 0.00 0.00 -0.80 1.19 -1.05 0.00 0.00 178.44 177.78 2byt n PHE 794 N -3.12 0.00 -4.29 0.49 3.72 -1.02 -4.99 117.46 108.26 2byt n PHE 794 Ca -0.02 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.08 2byt n PHE 794 Cb 0.18 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.62 2byt n PHE 794 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 2byt s TRP 795 N -1.80 2.76 0.00 1.38 0.51 -0.08 -5.10 118.94 116.61 2byt s TRP 795 Ca 0.00 -0.14 0.00 0.00 -2.12 0.00 0.00 56.10 53.84 2byt s TRP 795 Cb 0.00 -1.46 0.00 0.00 -0.81 0.00 0.00 33.47 31.20 2byt s TRP 795 CO 0.00 0.41 0.13 -0.35 -0.51 0.00 0.00 176.95 176.63 2byt n PRO 796 N 0.88 0.00 -0.70 4.98 -0.04 -1.26 -4.05 135.00 134.82 2byt n PRO 796 Ca -0.14 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.01 2byt n PRO 796 Cb 0.52 -0.55 0.17 0.00 -0.04 0.00 0.00 33.50 33.60 2byt n PRO 796 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2byt s ASP 797 N -1.77 2.81 0.55 3.54 1.01 -1.26 -4.89 116.67 116.67 2byt s ASP 797 Ca 0.00 2.14 -0.21 0.00 0.71 0.00 0.00 52.55 55.19 2byt s ASP 797 Cb 0.00 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.33 2byt s ASP 797 CO 0.00 -3.17 1.22 -0.24 0.21 0.00 0.00 175.17 173.19 2byt n SER 798 N -4.27 2.01 0.29 0.27 2.88 -1.26 -4.88 113.62 108.66 2byt n SER 798 Ca 0.11 0.93 0.16 0.00 -1.33 0.00 0.00 58.87 58.75 2byt n SER 798 Cb 0.52 -1.50 0.82 0.00 -0.75 0.00 0.00 64.21 63.30 2byt n SER 798 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2byt h LEU 799 N 1.14 0.00 -1.19 2.46 3.38 -1.93 0.27 115.31 119.44 2byt h LEU 799 Ca -0.49 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.44 2byt h LEU 799 Cb 1.33 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 2byt h LEU 799 CO 0.55 0.00 0.15 -0.26 0.09 0.00 0.00 178.44 178.97 2byt h PHE 800 N 0.00 0.73 -0.18 1.13 -1.00 -1.98 -2.28 116.94 113.35 2byt h PHE 800 Ca 0.04 -0.05 0.00 0.00 2.81 0.00 0.00 57.97 60.77 2byt h PHE 800 Cb 0.72 -0.22 0.00 0.00 3.61 0.00 0.00 35.95 40.06 2byt h PHE 800 CO 0.00 0.60 0.00 0.39 -1.61 0.00 0.00 178.31 177.69 2byt n GLU 801 N -4.32 1.88 0.06 1.51 1.02 0.08 -4.16 120.64 116.72 2byt n GLU 801 Ca 0.04 -1.32 -0.06 0.00 -0.02 0.00 0.00 57.16 55.80 2byt n GLU 801 Cb 0.19 -1.43 0.13 0.00 -0.02 0.00 0.00 31.44 30.31 2byt n GLU 801 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2byt h ALA 802 N 4.19 0.88 0.00 0.62 0.00 -1.42 -3.50 119.26 120.03 2byt h ALA 802 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2byt h ALA 802 Cb 0.60 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2byt h ALA 802 CO 0.00 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.33 2byt n GLY 803 N 0.11 -1.98 3.77 0.00 0.00 -1.24 -4.90 105.19 100.95 2byt n GLY 803 Ca -0.02 -1.51 -0.38 0.00 0.00 0.00 0.00 46.02 44.11 2byt n GLY 803 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2byt s TRP 804 N -2.64 3.60 0.27 1.61 -0.11 -1.06 -4.90 118.94 115.71 2byt s TRP 804 Ca 0.00 0.91 -0.26 0.00 1.22 0.00 0.00 56.10 57.97 2byt s TRP 804 Cb 0.00 -2.43 -0.16 0.00 -1.50 0.00 0.00 33.47 29.38 2byt s TRP 804 CO 0.00 0.37 0.53 -2.30 -4.62 0.00 0.00 176.95 170.93 2byt n PRO 805 N 2.89 0.26 -3.32 5.86 -0.02 -1.26 -4.94 135.00 134.47 2byt n PRO 805 Ca -0.10 0.09 -0.39 0.00 -2.02 0.00 0.00 63.50 61.08 2byt n PRO 805 Cb 0.52 -1.17 -0.07 0.00 -0.02 0.00 0.00 33.50 32.75 2byt n PRO 805 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2byt s GLU 806 N -1.14 4.20 0.35 -0.52 2.12 -1.26 -5.05 118.70 117.40 2byt s GLU 806 Ca 0.62 0.33 -0.27 0.00 0.36 0.00 0.00 54.97 56.02 2byt s GLU 806 Cb -0.82 -3.53 -0.09 0.00 0.26 0.00 0.00 34.13 29.95 2byt s GLU 806 CO 0.58 -0.06 1.10 -1.17 -0.54 0.00 0.00 175.26 175.17 2byt s LEU 807 N 1.36 4.33 -0.69 2.70 2.96 -1.26 -5.00 118.68 123.09 2byt s LEU 807 Ca 0.22 2.22 0.02 0.00 -0.22 0.00 0.00 54.13 56.37 2byt s LEU 807 Cb -0.15 -3.90 0.17 0.00 0.50 0.00 0.00 46.19 42.80 2byt s LEU 807 CO 0.09 -0.39 0.49 -0.62 -1.32 0.00 0.00 176.35 174.60 2byt s ASP 808 N -1.16 4.99 0.21 3.68 2.15 -1.26 -4.98 116.67 120.31 2byt s ASP 808 Ca 0.52 -3.49 -0.16 0.00 0.43 0.00 0.00 52.55 49.85 2byt s ASP 808 Cb -0.28 -1.72 0.22 0.00 -0.30 0.00 0.00 42.92 40.83 2byt s ASP 808 CO 0.36 -0.18 1.41 -0.62 -0.17 0.00 0.00 175.17 175.98 2byt n GLU 809 N 2.53 -0.22 0.31 4.34 -0.58 -1.26 0.36 120.64 126.12 2byt n GLU 809 Ca 0.15 1.40 0.16 0.00 -0.42 0.00 0.00 57.16 58.45 2byt n GLU 809 Cb 0.35 -2.08 0.82 0.00 -0.57 0.00 0.00 31.44 29.96 2byt n GLU 809 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2byt h LYS 810 N 0.00 0.00 0.00 3.49 1.57 -1.99 0.23 116.57 119.87 2byt h LYS 810 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 2byt h LYS 810 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2byt h LYS 810 CO -0.90 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 177.98 2byt h ALA 811 N 1.37 1.00 0.00 3.86 0.00 -0.52 -3.15 119.26 121.81 2byt h ALA 811 Ca 0.02 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 2byt h ALA 811 Cb 0.70 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2byt h ALA 811 CO -0.00 0.00 -0.96 -0.07 0.00 0.00 0.00 179.25 178.22 2byt h LEU 812 N 0.00 0.00 -9.23 0.00 3.38 -0.61 -3.42 115.31 105.43 2byt h LEU 812 Ca 0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 2byt h LEU 812 Cb 0.77 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.56 2byt h LEU 812 CO 0.00 0.94 0.65 -0.62 0.09 0.00 0.00 178.44 179.50 2byt n GLU 813 N -3.33 1.21 -3.67 1.13 1.02 -1.19 -4.94 120.64 110.86 2byt n GLU 813 Ca -0.00 0.44 -0.36 0.00 -0.02 0.00 0.00 57.16 57.22 2byt n GLU 813 Cb 0.92 -2.11 -0.07 0.00 -0.02 0.00 0.00 31.44 30.16 2byt n GLU 813 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2byt s LYS 814 N 1.74 4.07 -0.24 3.49 1.02 -1.26 -5.06 119.74 123.49 2byt s LYS 814 Ca 0.90 -0.05 0.02 0.00 0.02 0.00 0.00 55.97 56.86 2byt s LYS 814 Cb -0.98 -3.37 0.05 0.00 -0.52 0.00 0.00 37.83 33.01 2byt s LYS 814 CO 0.54 0.38 -0.11 0.16 -0.92 0.00 0.00 175.35 175.40 2byt s ASP 815 N 0.07 4.16 0.00 2.83 -4.77 -1.26 -4.64 116.67 113.06 2byt s ASP 815 Ca 0.13 -1.26 0.00 0.00 -3.30 0.00 0.00 52.55 48.13 2byt s ASP 815 Cb -0.12 -1.47 0.00 0.00 -1.09 0.00 0.00 42.92 40.23 2byt s ASP 815 CO 0.02 -0.17 0.00 0.52 0.70 0.00 0.00 175.17 176.24 2byt n VAL 816 N 4.50 -1.38 -3.18 2.11 0.31 -1.26 -4.93 118.33 114.50 2byt n VAL 816 Ca -0.15 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 63.93 2byt n VAL 816 Cb 0.43 -3.66 -0.01 0.00 -0.91 0.00 0.00 33.84 29.69 2byt n VAL 816 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2byt s VAL 817 N -2.20 5.03 -0.09 2.52 1.01 -0.95 -4.79 120.40 120.93 2byt s VAL 817 Ca 0.00 -0.16 -0.24 0.00 0.00 0.00 0.00 61.98 61.57 2byt s VAL 817 Cb 0.00 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 2byt s VAL 817 CO 0.00 -0.57 0.76 -0.70 0.00 0.00 0.00 175.10 174.59 2byt s GLU 818 N -4.23 4.40 0.02 2.72 2.12 -1.26 -2.61 118.70 119.87 2byt s GLU 818 Ca 0.43 0.96 0.04 0.00 0.36 0.00 0.00 54.97 56.76 2byt s GLU 818 Cb -0.10 -3.49 -0.03 0.00 0.26 0.00 0.00 34.13 30.77 2byt s GLU 818 CO 0.37 -0.06 -0.07 0.08 -0.54 0.00 0.00 175.26 175.03 2byt s VAL 819 N 1.22 3.60 -0.13 3.70 1.01 0.27 -4.72 120.40 125.35 2byt s VAL 819 Ca 0.39 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.38 2byt s VAL 819 Cb -0.18 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 2byt s VAL 819 CO 0.17 0.35 0.33 0.00 0.00 0.00 0.00 175.10 175.96 2byt s ALA 820 N -1.03 3.59 -0.35 5.51 0.00 -1.04 -0.57 121.76 127.87 2byt s ALA 820 Ca 0.18 -0.39 -0.12 0.00 0.00 0.00 0.00 51.96 51.63 2byt s ALA 820 Cb -0.11 -2.42 -0.00 0.00 0.00 0.00 0.00 23.12 20.59 2byt s ALA 820 CO 0.09 0.14 0.23 0.08 0.00 0.00 0.00 175.76 176.30 2byt s VAL 821 N 0.25 5.05 0.06 0.00 1.01 0.50 -1.59 120.40 125.67 2byt s VAL 821 Ca 0.19 -0.43 0.09 0.00 0.00 0.00 0.00 61.98 61.83 2byt s VAL 821 Cb -0.14 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 2byt s VAL 821 CO 0.06 -0.08 -0.26 0.00 0.00 0.00 0.00 175.10 174.82 2byt s GLN 822 N 1.67 1.68 -0.11 2.72 -2.07 0.63 -1.25 119.66 122.93 2byt s GLN 822 Ca 0.05 -1.12 0.02 0.00 -1.82 0.00 0.00 55.36 52.50 2byt s GLN 822 Cb -0.18 -1.89 0.01 0.00 -1.09 0.00 0.00 33.01 29.86 2byt s GLN 822 CO 0.09 0.48 -0.18 0.08 -1.32 0.00 0.00 175.29 174.44 2byt s VAL 823 N -0.84 1.71 -1.25 3.63 1.01 -0.07 -0.97 120.40 123.62 2byt s VAL 823 Ca 0.11 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 61.06 2byt s VAL 823 Cb -0.10 -1.52 0.02 0.00 0.00 0.00 0.00 36.38 34.78 2byt s VAL 823 CO 0.02 0.48 0.62 0.59 0.00 0.00 0.00 175.10 176.81 2byt n ASN 824 N 3.98 -3.58 0.00 3.32 3.02 -1.13 -1.59 115.26 119.29 2byt n ASN 824 Ca -0.20 -1.20 0.00 0.00 -0.03 0.00 0.00 54.58 53.15 2byt n ASN 824 Cb 0.52 -2.22 0.00 0.00 -0.61 0.00 0.00 39.78 37.47 2byt n ASN 824 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2byt n GLY 825 N -2.03 0.67 3.73 7.41 0.00 -1.26 -4.99 105.19 108.71 2byt n GLY 825 Ca -0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 2byt n GLY 825 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2byt s ARG 826 N -0.41 2.98 -0.77 1.61 0.52 -0.62 -5.04 118.95 117.22 2byt s ARG 826 Ca 0.00 -0.48 -0.25 0.00 -0.52 0.00 0.00 55.73 54.48 2byt s ARG 826 Cb 0.00 -2.80 0.04 0.00 0.52 0.00 0.00 34.95 32.71 2byt s ARG 826 CO 0.00 0.67 1.24 0.08 0.02 0.00 0.00 175.30 177.30 2byt s VAL 827 N -1.05 3.91 0.25 3.52 1.01 -1.26 -0.90 120.40 125.88 2byt s VAL 827 Ca 0.18 0.01 0.09 0.00 0.00 0.00 0.00 61.98 62.27 2byt s VAL 827 Cb -0.12 -4.89 -0.05 0.00 0.00 0.00 0.00 36.38 31.32 2byt s VAL 827 CO 0.09 -1.78 1.56 0.03 0.00 0.00 0.00 175.10 175.00 2byt h ARG 828 N 9.86 0.03 0.00 2.72 2.47 -1.53 -3.49 114.38 124.44 2byt h ARG 828 Ca -0.19 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.50 2byt h ARG 828 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.37 2byt h ARG 828 CO 1.28 0.68 0.00 0.41 0.56 0.00 0.00 179.97 182.90 2byt n GLY 829 N 0.39 -1.47 2.77 0.04 0.00 -0.89 -4.76 105.19 101.27 2byt n GLY 829 Ca -0.01 -1.02 -0.20 0.00 0.00 0.00 0.00 46.02 44.78 2byt n GLY 829 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2byt s THR 830 N -2.45 0.21 0.46 2.61 -4.23 -1.26 0.19 115.64 111.17 2byt s THR 830 Ca 0.00 0.16 0.08 0.00 -1.18 0.00 0.00 61.69 60.75 2byt s THR 830 Cb 0.00 -0.36 0.02 0.00 1.34 0.00 0.00 72.50 73.49 2byt s THR 830 CO 0.00 0.20 0.54 0.27 -0.54 0.00 0.00 174.62 175.09 2byt s ILE 831 N 1.64 2.62 -0.32 2.99 -4.36 0.26 -4.90 121.20 119.14 2byt s ILE 831 Ca -0.01 -1.14 0.01 0.00 -0.26 0.00 0.00 60.65 59.25 2byt s ILE 831 Cb -0.13 -2.77 0.10 0.00 1.25 0.00 0.00 42.46 40.91 2byt s ILE 831 CO -0.03 0.00 0.07 -1.00 0.24 0.00 0.00 174.94 174.21 2byt s HIS 832 N -2.48 2.63 0.08 1.37 3.76 -1.26 -0.57 115.29 118.81 2byt s HIS 832 Ca 0.53 -2.27 0.01 0.00 -0.15 0.00 0.00 55.06 53.17 2byt s HIS 832 Cb -0.06 -2.22 -0.04 0.00 1.11 0.00 0.00 32.58 31.37 2byt s HIS 832 CO 0.32 -0.90 -0.05 0.96 -0.85 0.00 0.00 174.74 174.21 2byt s ILE 833 N 1.30 0.52 0.95 0.60 -5.25 -1.07 -4.96 121.20 113.29 2byt s ILE 833 Ca 0.09 -1.79 -0.13 0.00 -0.99 0.00 0.00 60.65 57.83 2byt s ILE 833 Cb -0.18 -1.50 0.04 0.00 2.95 0.00 0.00 42.46 43.77 2byt s ILE 833 CO -0.16 -0.86 0.41 -2.65 -1.79 0.00 0.00 174.94 169.89 2byt n PRO 834 N 0.18 -0.31 -0.17 0.37 -0.02 -1.26 -2.25 135.00 131.54 2byt n PRO 834 Ca -0.14 -0.05 -0.06 0.00 -2.02 0.00 0.00 63.50 61.23 2byt n PRO 834 Cb 0.60 -1.86 0.11 0.00 -0.02 0.00 0.00 33.50 32.33 2byt n PRO 834 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2byt h LYS 835 N -1.58 0.95 -0.00 -0.52 3.64 -1.85 -2.75 116.57 114.47 2byt h LYS 835 Ca -0.44 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 58.70 2byt h LYS 835 Cb 1.28 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2byt h LYS 835 CO 0.34 0.90 -0.38 -0.25 -2.27 0.00 0.00 179.45 177.79 2byt n ASP 836 N -4.22 0.56 -3.86 4.20 9.92 -1.26 -4.62 116.55 117.27 2byt n ASP 836 Ca 0.04 -0.33 -0.54 0.00 -0.53 0.00 0.00 54.79 53.42 2byt n ASP 836 Cb 0.29 0.14 -0.08 0.00 -0.64 0.00 0.00 41.12 40.84 2byt n ASP 836 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2byt n ALA 837 N -1.30 -1.45 -1.76 2.24 0.00 -1.04 -4.83 120.51 112.37 2byt n ALA 837 Ca 0.08 0.42 -0.38 0.00 0.00 0.00 0.00 53.44 53.56 2byt n ALA 837 Cb 0.33 -1.55 0.01 0.00 0.00 0.00 0.00 19.45 18.24 2byt n ALA 837 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2byt s PRO 838 N 2.04 3.63 0.36 0.00 0.02 -1.26 -4.74 135.00 135.06 2byt s PRO 838 Ca 0.84 1.99 0.24 0.00 0.02 0.00 0.00 61.00 64.10 2byt s PRO 838 Cb -1.20 -2.45 1.27 0.00 0.02 0.00 0.00 34.50 32.14 2byt s PRO 838 CO 0.64 -0.72 1.39 1.28 -0.33 0.00 0.00 177.00 179.27 2byt n LEU 839 N -0.49 0.25 0.08 -5.54 4.32 -1.26 0.18 117.00 114.54 2byt n LEU 839 Ca 0.07 1.35 -0.04 0.00 -0.02 0.00 0.00 56.01 57.37 2byt n LEU 839 Cb 0.46 -0.66 0.16 0.00 -1.62 0.00 0.00 43.42 41.76 2byt n LEU 839 CO 0.51 -1.49 0.55 -0.33 -1.22 0.00 0.00 177.39 175.41 2byt h GLU 840 N 0.00 0.27 -0.09 3.23 3.07 -1.99 -0.05 114.58 119.03 2byt h GLU 840 Ca 0.77 -0.16 -0.19 0.00 -0.50 0.00 0.00 59.36 59.28 2byt h GLU 840 Cb 2.28 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 30.20 2byt h GLU 840 CO -0.54 0.73 -0.72 0.28 -1.40 0.00 0.00 179.01 177.35 2byt h VAL 841 N 0.22 1.37 0.16 3.13 2.07 0.16 -2.40 116.25 120.96 2byt h VAL 841 Ca 0.01 -2.10 -0.01 0.00 0.82 0.00 0.00 66.70 65.42 2byt h VAL 841 Cb 0.98 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 2byt h VAL 841 CO 0.08 0.64 -0.08 0.00 0.02 0.00 0.00 177.57 178.23 2byt h ALA 842 N 0.91 -0.21 -0.91 1.67 0.00 -1.36 -2.48 119.26 116.88 2byt h ALA 842 Ca -0.03 -0.20 0.17 0.00 0.00 0.00 0.00 54.91 54.86 2byt h ALA 842 Cb 1.30 0.08 -0.17 0.00 0.00 0.00 0.00 17.79 19.00 2byt h ALA 842 CO 0.13 -0.25 -0.26 -0.09 0.00 0.00 0.00 179.25 178.77 2byt h ARG 843 N -0.95 -0.01 0.70 0.00 2.43 -1.07 0.21 114.38 115.69 2byt h ARG 843 Ca -0.02 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 2byt h ARG 843 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2byt h ARG 843 CO 0.04 -0.01 -0.40 0.00 -1.51 0.00 0.00 179.97 178.09 2byt h ALA 844 N 1.77 -1.24 0.00 2.80 0.00 -1.49 -0.67 119.26 120.43 2byt h ALA 844 Ca 0.41 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2byt h ALA 844 Cb 0.65 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2byt h ALA 844 CO -0.93 -1.18 0.07 0.39 0.00 0.00 0.00 179.25 177.59 2byt n GLU 845 N -4.93 0.00 -0.10 0.00 -0.58 -0.39 -1.91 120.64 112.74 2byt n GLU 845 Ca -0.13 0.43 -0.17 0.00 -0.42 0.00 0.00 57.16 56.88 2byt n GLU 845 Cb 0.42 -1.59 -0.09 0.00 -0.57 0.00 0.00 31.44 29.61 2byt n GLU 845 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2byt h ALA 846 N 1.71 0.19 0.00 0.62 0.00 0.19 -3.39 119.26 118.59 2byt h ALA 846 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.89 2byt h ALA 846 Cb 0.14 0.67 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2byt h ALA 846 CO 0.00 0.64 0.28 1.28 0.00 0.00 0.00 179.25 181.45 2byt n LEU 847 N -4.48 0.00 -2.66 0.00 4.77 -0.34 -1.03 117.00 113.26 2byt n LEU 847 Ca -0.25 0.08 -0.09 0.00 -0.03 0.00 0.00 56.01 55.72 2byt n LEU 847 Cb 0.57 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.61 2byt n LEU 847 CO 0.17 -0.08 -0.05 2.29 -1.33 0.00 0.00 177.39 178.38 2byt n LYS 848 N -0.98 1.63 -0.43 3.23 2.85 -1.26 -4.77 118.16 118.44 2byt n LYS 848 Ca 0.00 -3.48 -0.26 0.00 -1.05 0.00 0.00 58.31 53.52 2byt n LYS 848 Cb 0.28 -1.48 0.22 0.00 -0.65 0.00 0.00 35.03 33.40 2byt n LYS 848 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 2byt n VAL 849 N -0.27 0.00 -0.24 0.58 0.24 -0.19 -4.69 118.33 113.76 2byt n VAL 849 Ca 0.13 -0.12 -0.08 0.00 -2.04 0.00 0.00 64.34 62.23 2byt n VAL 849 Cb 0.80 -0.75 -0.07 0.00 -1.47 0.00 0.00 33.84 32.35 2byt n VAL 849 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 2byt h ARG 850 N -2.97 -0.05 -0.55 7.34 3.08 -1.93 -0.95 114.38 118.35 2byt h ARG 850 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.66 2byt h ARG 850 Cb 1.13 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.19 2byt h ARG 850 CO 0.26 -0.03 0.00 0.27 -1.07 0.00 0.00 179.97 179.40 2byt n ASN 851 N -4.49 4.64 -2.11 7.04 6.94 -1.26 -4.91 115.26 121.11 2byt n ASN 851 Ca 0.01 -2.57 -0.18 0.00 -0.02 0.00 0.00 54.58 51.81 2byt n ASN 851 Cb 0.18 -0.56 -0.03 0.00 -2.36 0.00 0.00 39.78 37.01 2byt n ASN 851 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 2byt n VAL 852 N 0.74 -0.56 -0.32 3.53 0.31 -0.36 -4.82 118.33 116.84 2byt n VAL 852 Ca 0.24 0.00 0.21 0.00 -0.01 0.00 0.00 64.34 64.78 2byt n VAL 852 Cb 0.90 -2.29 0.48 0.00 -0.91 0.00 0.00 33.84 32.03 2byt n VAL 852 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2byt h ARG 853 N 0.00 0.43 -0.38 5.55 9.65 -1.88 0.37 114.38 128.10 2byt h ARG 853 Ca -0.41 -0.03 0.09 0.00 -1.10 0.00 0.00 59.98 58.53 2byt h ARG 853 Cb 1.27 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.74 2byt h ARG 853 CO 0.52 0.28 0.27 0.00 2.80 0.00 0.00 179.97 183.84 2byt h ALA 854 N 1.63 2.19 0.17 2.80 0.00 -1.87 -1.82 119.26 122.36 2byt h ALA 854 Ca 0.59 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 55.19 2byt h ALA 854 Cb 1.41 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.20 2byt h ALA 854 CO -0.31 -0.29 -1.41 0.45 0.00 0.00 0.00 179.25 177.70 2byt h HIS 855 N 0.13 0.64 0.00 0.00 3.86 -0.57 -1.18 115.15 118.02 2byt h HIS 855 Ca 0.18 -0.47 0.00 0.00 -1.16 0.00 0.00 60.37 58.92 2byt h HIS 855 Cb 0.54 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.99 2byt h HIS 855 CO -0.00 1.55 0.00 1.28 0.86 0.00 0.00 177.93 181.62 2byt n LEU 856 N -3.83 0.00 0.00 2.43 4.32 -0.68 -2.37 117.00 116.87 2byt n LEU 856 Ca -0.21 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.78 2byt n LEU 856 Cb 0.97 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.77 2byt n LEU 856 CO 0.49 0.00 0.00 -0.62 -1.22 0.00 0.00 177.39 176.04 2byt n GLU 857 N -0.48 0.00 -3.61 3.23 1.02 -1.22 -5.02 120.64 114.55 2byt n GLU 857 Ca 0.00 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.76 2byt n GLU 857 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.35 2byt n GLU 857 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2byt s GLY 858 N 0.00 2.80 -0.13 0.62 0.00 -0.45 -4.79 107.32 105.38 2byt s GLY 858 Ca 0.00 -3.54 0.16 0.00 0.00 0.00 0.00 44.72 41.34 2byt s GLY 858 CO 0.00 1.17 1.14 0.28 0.00 0.00 0.00 173.10 175.70 2byt n LYS 859 N 3.04 1.17 0.06 2.90 5.02 -1.26 -4.69 118.16 124.40 2byt n LYS 859 Ca 0.15 -2.51 0.00 0.00 -2.02 0.00 0.00 58.31 53.93 2byt n LYS 859 Cb 0.39 -1.39 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 2byt n LYS 859 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2byt n GLU 860 N -1.22 0.00 -1.55 1.97 4.71 -1.26 -5.18 120.64 118.11 2byt n GLU 860 Ca 0.15 0.00 0.01 0.00 -0.01 0.00 0.00 57.16 57.31 2byt n GLU 860 Cb 0.66 0.00 -0.01 0.00 -1.01 0.00 0.00 31.44 31.09 2byt n GLU 860 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2byt n VAL 861 N -2.91 -2.60 0.00 2.62 0.31 -1.23 -5.02 118.33 109.50 2byt n VAL 861 Ca 0.00 1.33 0.00 0.00 -0.01 0.00 0.00 64.34 65.66 2byt n VAL 861 Cb 0.00 -2.21 0.00 0.00 -0.91 0.00 0.00 33.84 30.72 2byt n VAL 861 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2byt n VAL 862 N -2.72 0.00 -3.80 2.52 0.31 0.12 -4.89 118.33 109.87 2byt n VAL 862 Ca -0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.20 2byt n VAL 862 Cb 0.47 -0.07 -0.10 0.00 -0.91 0.00 0.00 33.84 33.23 2byt n VAL 862 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2byt s LYS 863 N -1.20 0.51 -0.03 5.55 2.20 -1.20 -5.03 119.74 120.53 2byt s LYS 863 Ca 0.00 -0.12 0.03 0.00 -0.36 0.00 0.00 55.97 55.52 2byt s LYS 863 Cb 0.00 0.22 0.00 0.00 -1.51 0.00 0.00 37.83 36.55 2byt s LYS 863 CO 0.00 -0.12 -0.10 -1.21 -0.36 0.00 0.00 175.35 173.56 2byt s GLU 864 N -0.96 1.08 -0.11 4.03 2.02 -1.26 -0.10 118.70 123.40 2byt s GLU 864 Ca -0.10 -0.33 0.01 0.00 0.02 0.00 0.00 54.97 54.57 2byt s GLU 864 Cb -0.05 -0.99 -0.02 0.00 0.10 0.00 0.00 34.13 33.17 2byt s GLU 864 CO 0.02 0.11 -0.12 0.42 0.02 0.00 0.00 175.26 175.70 2byt s ILE 865 N 0.26 3.14 -0.07 -1.63 -1.09 -0.09 -4.98 121.20 116.75 2byt s ILE 865 Ca -0.05 -0.65 0.03 0.00 -2.23 0.00 0.00 60.65 57.76 2byt s ILE 865 Cb -0.10 -2.30 0.00 0.00 -1.58 0.00 0.00 42.46 38.49 2byt s ILE 865 CO 0.01 0.54 -0.18 -0.47 -1.23 0.00 0.00 174.94 173.62 2byt s TYR 866 N 0.02 1.90 -0.28 3.97 5.04 -1.26 -0.59 117.35 126.15 2byt s TYR 866 Ca -0.04 -0.70 0.01 0.00 -2.44 0.00 0.00 57.07 53.91 2byt s TYR 866 Cb -0.14 -1.31 0.08 0.00 0.35 0.00 0.00 41.96 40.94 2byt s TYR 866 CO 0.04 -0.29 0.01 0.08 -1.34 0.00 0.00 175.55 174.05 2byt s VAL 867 N 0.39 1.60 0.19 3.14 1.01 -0.53 -5.00 120.40 121.20 2byt s VAL 867 Ca -0.13 -1.59 0.08 0.00 0.00 0.00 0.00 61.98 60.33 2byt s VAL 867 Cb -0.15 -2.03 0.20 0.00 0.00 0.00 0.00 36.38 34.40 2byt s VAL 867 CO 0.05 -0.38 0.84 -2.65 0.00 0.00 0.00 175.10 172.96 2byt n PRO 868 N 4.59 -0.04 0.00 2.72 -0.02 -1.26 -2.92 135.00 138.07 2byt n PRO 868 Ca -0.05 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2byt n PRO 868 Cb 0.43 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 2byt n PRO 868 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2byt n GLY 869 N -1.18 -0.86 2.67 -1.23 0.00 -1.26 -4.73 105.19 98.59 2byt n GLY 869 Ca 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 2byt n GLY 869 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2byt n LYS 870 N 0.00 1.16 -3.58 1.61 5.02 -1.15 -4.78 118.16 116.44 2byt n LYS 870 Ca 0.00 -2.72 -0.14 0.00 -2.02 0.00 0.00 58.31 53.43 2byt n LYS 870 Cb 0.00 -0.81 -0.06 0.00 -0.02 0.00 0.00 35.03 34.14 2byt n LYS 870 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 2byt s ILE 871 N -1.86 0.00 -0.22 -0.18 1.10 -1.16 -2.51 121.20 116.37 2byt s ILE 871 Ca 0.25 0.00 -0.04 0.00 -0.51 0.00 0.00 60.65 60.36 2byt s ILE 871 Cb 0.43 -1.00 0.11 0.00 0.15 0.00 0.00 42.46 42.16 2byt s ILE 871 CO -0.01 0.00 0.34 -0.22 -2.11 0.00 0.00 174.94 172.94 2byt s LEU 872 N -0.59 -0.49 -0.10 8.50 2.96 -0.62 -1.45 118.68 126.89 2byt s LEU 872 Ca -0.04 0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 54.13 2byt s LEU 872 Cb -0.02 0.95 -0.03 0.00 0.50 0.00 0.00 46.19 47.59 2byt s LEU 872 CO 0.04 -0.29 -0.06 0.21 -1.32 0.00 0.00 176.35 174.92 2byt s ASN 873 N 2.49 4.64 -0.37 3.68 2.47 0.25 -0.27 114.94 127.83 2byt s ASN 873 Ca 0.08 -0.08 -0.05 0.00 0.42 0.00 0.00 52.86 53.24 2byt s ASN 873 Cb -0.15 -1.42 0.08 0.00 -1.45 0.00 0.00 41.25 38.31 2byt s ASN 873 CO -0.14 0.28 0.15 -0.76 -3.72 0.00 0.00 177.10 172.91 2byt s LEU 874 N -0.32 4.76 -0.53 3.21 1.43 -0.14 -0.91 118.68 126.18 2byt s LEU 874 Ca 0.05 -1.59 -0.28 0.00 -1.03 0.00 0.00 54.13 51.27 2byt s LEU 874 Cb -0.13 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.26 2byt s LEU 874 CO 0.02 -0.44 1.43 -0.69 0.23 0.00 0.00 176.35 176.91 2byt s VAL 875 N 1.27 3.80 -2.00 -1.59 1.01 0.86 -2.83 120.40 120.92 2byt s VAL 875 Ca 0.02 0.71 0.31 0.00 0.00 0.00 0.00 61.98 63.02 2byt s VAL 875 Cb -0.22 -4.36 0.88 0.00 0.00 0.00 0.00 36.38 32.68 2byt s VAL 875 CO -0.01 -1.06 2.17 0.52 0.00 0.00 0.00 175.10 176.73