#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wof s MET 7 N 0.00 3.61 0.04 1.57 -1.94 -1.26 -2.35 119.30 118.96 2wof s MET 7 Ca 0.00 0.15 -0.03 0.00 -1.71 0.00 0.00 55.69 54.10 2wof s MET 7 Cb 0.00 -2.47 -0.02 0.00 2.01 0.00 0.00 34.83 34.35 2wof s MET 7 CO 0.00 -0.03 0.04 0.54 -0.01 0.00 0.00 175.02 175.55 2wof s VAL 8 N -2.46 0.15 0.05 -6.03 0.11 0.12 -4.86 120.40 107.48 2wof s VAL 8 Ca 0.47 -1.20 -0.31 0.00 -2.93 0.00 0.00 61.98 58.01 2wof s VAL 8 Cb -0.10 -0.86 -0.06 0.00 -1.53 0.00 0.00 36.38 33.82 2wof s VAL 8 CO 0.37 -0.66 1.38 -2.16 -3.33 0.00 0.00 175.10 170.70 2wof s PRO 9 N -2.59 4.31 0.01 1.54 0.04 -1.26 -0.13 135.00 136.93 2wof s PRO 9 Ca -0.05 1.99 -0.25 0.00 0.04 0.00 0.00 61.00 62.72 2wof s PRO 9 Cb -0.01 -3.43 -0.18 0.00 0.04 0.00 0.00 34.50 30.91 2wof s PRO 9 CO -0.05 -0.49 1.35 1.98 0.04 0.00 0.00 177.00 179.83 2wof h MET 10 N 7.36 -0.19 0.56 4.56 4.05 -1.51 -2.44 114.93 127.33 2wof h MET 10 Ca -0.40 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.01 2wof h MET 10 Cb 1.19 0.04 0.01 0.00 -0.80 0.00 0.00 31.60 32.04 2wof h MET 10 CO 0.88 0.13 -0.27 0.22 0.23 0.00 0.00 176.91 178.10 2wof h ASP 11 N -0.52 -0.64 -0.28 1.39 3.58 -1.92 -0.66 116.42 117.37 2wof h ASP 11 Ca -0.02 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.47 2wof h ASP 11 Cb 0.41 0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.59 2wof h ASP 11 CO 0.03 -0.42 0.07 0.50 -2.88 0.00 0.00 179.24 176.54 2wof h LYS 12 N -0.80 0.18 -0.86 0.28 3.64 -1.96 -1.17 116.57 115.88 2wof h LYS 12 Ca -0.08 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 2wof h LYS 12 Cb 0.60 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.34 2wof h LYS 12 CO 0.13 0.12 0.44 1.15 -2.27 0.00 0.00 179.45 179.01 2wof h THR 13 N 0.18 1.26 -0.33 1.00 2.02 -1.33 -1.54 112.91 114.17 2wof h THR 13 Ca 0.13 -0.68 -0.16 0.00 0.77 0.00 0.00 66.41 66.46 2wof h THR 13 Cb 0.12 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 2wof h THR 13 CO -0.16 0.30 -0.44 -0.07 0.37 0.00 0.00 175.52 175.52 2wof h LEU 14 N 1.21 0.91 -0.12 2.58 3.38 -0.95 -2.43 115.31 119.90 2wof h LEU 14 Ca 0.30 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.87 2wof h LEU 14 Cb 0.08 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 2wof h LEU 14 CO -0.04 1.22 -0.15 0.11 0.09 0.00 0.00 178.44 179.66 2wof h LYS 15 N 0.68 -0.18 -0.28 1.13 6.56 -0.98 -1.19 116.57 122.30 2wof h LYS 15 Ca 0.04 0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.61 2wof h LYS 15 Cb 1.02 0.04 -0.02 0.00 -0.57 0.00 0.00 32.23 32.71 2wof h LYS 15 CO 0.10 -0.12 0.03 0.93 -2.06 0.00 0.00 179.45 178.33 2wof h GLU 16 N -0.19 0.41 0.00 3.15 5.08 -1.20 0.22 114.58 122.05 2wof h GLU 16 Ca 0.09 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2wof h GLU 16 Cb 0.32 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2wof h GLU 16 CO -0.23 0.41 0.00 0.35 -1.00 0.00 0.00 179.01 178.54 2wof h PHE 17 N 0.40 0.00 0.00 4.33 3.57 -1.18 -3.47 116.94 120.59 2wof h PHE 17 Ca 0.09 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2wof h PHE 17 Cb 0.21 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.95 2wof h PHE 17 CO 0.01 0.00 0.00 0.41 -2.23 0.00 0.00 178.31 176.50 2wof n GLY 18 N 0.48 0.84 3.87 2.40 0.00 0.07 -5.08 105.19 107.77 2wof n GLY 18 Ca 0.03 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 2wof n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wof s ALA 19 N -2.00 3.68 0.04 4.61 0.00 -0.54 -4.82 121.76 122.73 2wof s ALA 19 Ca 0.00 -0.35 -0.30 0.00 0.00 0.00 0.00 51.96 51.31 2wof s ALA 19 Cb 0.00 -2.32 -0.04 0.00 0.00 0.00 0.00 23.12 20.76 2wof s ALA 19 CO 0.00 0.55 1.04 0.34 0.00 0.00 0.00 175.76 177.69 2wof s ASP 20 N -2.00 7.31 -0.23 0.00 2.15 0.16 -4.30 116.67 119.77 2wof s ASP 20 Ca 0.38 1.78 0.00 0.00 0.43 0.00 0.00 52.55 55.15 2wof s ASP 20 Cb -0.13 -2.58 0.03 0.00 -0.30 0.00 0.00 42.92 39.94 2wof s ASP 20 CO 0.20 -0.29 -0.12 -0.69 -0.17 0.00 0.00 175.17 174.10 2wof s VAL 21 N 0.85 2.43 -0.10 1.11 1.01 -1.26 -1.40 120.40 123.04 2wof s VAL 21 Ca 0.53 -1.13 0.04 0.00 0.00 0.00 0.00 61.98 61.41 2wof s VAL 21 Cb -0.24 -2.21 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 2wof s VAL 21 CO 0.29 0.27 -0.23 -1.58 0.00 0.00 0.00 175.10 173.85 2wof s GLN 22 N 1.26 3.08 -0.13 2.72 2.00 -0.24 -5.00 119.66 123.35 2wof s GLN 22 Ca -0.00 -0.85 -0.02 0.00 -2.00 0.00 0.00 55.36 52.48 2wof s GLN 22 Cb -0.16 -2.34 -0.03 0.00 0.80 0.00 0.00 33.01 31.28 2wof s GLN 22 CO -0.08 0.19 -0.05 -0.46 -0.50 0.00 0.00 175.29 174.39 2wof s TRP 23 N 0.32 2.99 -0.33 1.67 -0.11 -1.26 -0.76 118.94 121.46 2wof s TRP 23 Ca -0.17 -0.25 -0.00 0.00 1.22 0.00 0.00 56.10 56.90 2wof s TRP 23 Cb -0.18 -1.89 0.08 0.00 -1.50 0.00 0.00 33.47 29.98 2wof s TRP 23 CO 0.08 0.04 0.04 0.34 -4.62 0.00 0.00 176.95 172.84 2wof s ASP 24 N 0.07 4.89 0.37 5.86 -1.08 0.12 -4.98 116.67 121.92 2wof s ASP 24 Ca -0.01 -1.66 0.09 0.00 -0.52 0.00 0.00 52.55 50.45 2wof s ASP 24 Cb -0.14 -1.70 0.72 0.00 -1.46 0.00 0.00 42.92 40.35 2wof s ASP 24 CO 0.03 -0.34 1.88 -0.78 0.52 0.00 0.00 175.17 176.47 2wof h ASP 25 N 7.90 0.23 -0.01 -0.34 3.58 -1.97 0.40 116.42 126.22 2wof h ASP 25 Ca -0.15 -0.05 -0.21 0.00 0.42 0.00 0.00 57.03 57.03 2wof h ASP 25 Cb 1.05 -0.06 0.02 0.00 1.72 0.00 0.00 39.33 42.05 2wof h ASP 25 CO 0.56 0.43 -0.83 0.22 -2.88 0.00 0.00 179.24 176.73 2wof h TYR 26 N 0.23 0.85 -0.00 0.28 3.20 -1.96 -3.16 116.97 116.40 2wof h TYR 26 Ca 0.04 -0.46 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2wof h TYR 26 Cb 0.45 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.62 2wof h TYR 26 CO 0.01 1.29 -0.35 0.00 -1.64 0.00 0.00 178.16 177.47 2wof n ALA 27 N -2.62 3.23 -3.74 1.82 0.00 -1.09 -4.95 120.51 113.16 2wof n ALA 27 Ca -0.11 -0.34 -0.26 0.00 0.00 0.00 0.00 53.44 52.74 2wof n ALA 27 Cb 0.78 -1.17 0.02 0.00 0.00 0.00 0.00 19.45 19.08 2wof n ALA 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2wof n GLN 28 N -1.19 -2.97 -3.75 0.00 1.13 0.13 -4.97 117.38 105.76 2wof n GLN 28 Ca 0.09 0.52 -0.16 0.00 -1.94 0.00 0.00 57.00 55.50 2wof n GLN 28 Cb 0.33 -4.65 -0.16 0.00 0.11 0.00 0.00 30.24 25.87 2wof n GLN 28 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2wof s LEU 29 N -6.61 0.88 0.03 1.08 2.96 -0.89 -4.24 118.68 111.90 2wof s LEU 29 Ca 0.20 0.07 -0.22 0.00 -0.22 0.00 0.00 54.13 53.95 2wof s LEU 29 Cb -0.07 -0.05 -0.06 0.00 0.50 0.00 0.00 46.19 46.52 2wof s LEU 29 CO 0.85 -0.15 0.67 -0.36 -1.32 0.00 0.00 176.35 176.03 2wof s PHE 30 N 1.28 3.73 -0.18 5.38 0.08 0.03 -0.71 117.98 127.60 2wof s PHE 30 Ca -0.07 1.34 -0.00 0.00 0.12 0.00 0.00 56.93 58.32 2wof s PHE 30 Cb -0.13 -2.69 0.01 0.00 -0.57 0.00 0.00 43.02 39.64 2wof s PHE 30 CO -0.03 0.35 -0.15 0.99 -0.10 0.00 0.00 175.22 176.28 2wof s THR 31 N -0.29 2.54 -0.10 0.64 2.01 0.06 -1.16 115.64 119.34 2wof s THR 31 Ca 0.34 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.59 2wof s THR 31 Cb -0.20 -2.09 0.00 0.00 0.01 0.00 0.00 72.50 70.23 2wof s THR 31 CO 0.20 0.51 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.66 2wof s LEU 32 N 1.18 2.04 -0.10 4.42 1.43 0.14 -1.08 118.68 126.70 2wof s LEU 32 Ca 0.02 -0.54 0.02 0.00 -1.03 0.00 0.00 54.13 52.60 2wof s LEU 32 Cb -0.14 -1.35 0.01 0.00 0.03 0.00 0.00 46.19 44.74 2wof s LEU 32 CO -0.06 0.13 -0.16 -0.63 0.23 0.00 0.00 176.35 175.86 2wof s ILE 33 N 0.48 1.50 -0.19 -0.59 1.01 -0.49 -0.76 121.20 122.15 2wof s ILE 33 Ca -0.16 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 59.79 2wof s ILE 33 Cb -0.17 -1.35 0.09 0.00 0.01 0.00 0.00 42.46 41.04 2wof s ILE 33 CO 0.06 0.44 0.30 -0.75 0.00 0.00 0.00 174.94 174.99 2wof s LYS 34 N 0.81 0.23 7.51 2.79 2.20 -0.87 0.36 119.74 132.77 2wof s LYS 34 Ca -0.11 0.56 0.00 0.00 -0.36 0.00 0.00 55.97 56.06 2wof s LYS 34 Cb -0.16 -0.47 0.00 0.00 -1.51 0.00 0.00 37.83 35.69 2wof s LYS 34 CO 0.01 -0.49 0.00 -0.25 -0.36 0.00 0.00 175.35 174.26 2wof n ASP 35 N 5.35 0.00 0.00 1.43 8.00 -1.26 -1.65 116.55 128.42 2wof n ASP 35 Ca -0.05 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.51 2wof n ASP 35 Cb 0.50 0.00 0.34 0.00 -0.02 0.00 0.00 41.12 41.94 2wof n ASP 35 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wof n GLY 36 N 0.00 -0.65 3.57 0.44 0.00 -1.26 -4.77 105.19 102.52 2wof n GLY 36 Ca 0.00 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 2wof n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wof s ALA 37 N -2.44 3.34 -0.24 4.61 0.00 -0.66 -4.54 121.76 121.83 2wof s ALA 37 Ca 0.14 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.20 2wof s ALA 37 Cb 0.09 -2.04 0.06 0.00 0.00 0.00 0.00 23.12 21.23 2wof s ALA 37 CO 0.19 -0.12 -0.06 -0.47 0.00 0.00 0.00 175.76 175.30 2wof s TYR 38 N 0.93 2.55 -0.06 0.00 6.14 -1.26 -2.04 117.35 123.60 2wof s TYR 38 Ca 0.04 -1.86 0.05 0.00 0.64 0.00 0.00 57.07 55.94 2wof s TYR 38 Cb -0.14 -1.65 -0.01 0.00 0.42 0.00 0.00 41.96 40.59 2wof s TYR 38 CO 0.03 -0.79 -0.22 0.08 0.64 0.00 0.00 175.55 175.29 2wof s VAL 39 N 1.34 1.80 -0.10 3.14 1.01 0.06 -1.75 120.40 125.91 2wof s VAL 39 Ca -0.06 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.03 2wof s VAL 39 Cb -0.19 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 2wof s VAL 39 CO -0.06 0.51 -0.18 -0.54 0.00 0.00 0.00 175.10 174.83 2wof s LYS 40 N 0.03 3.06 -0.10 2.72 1.02 -0.41 0.24 119.74 126.29 2wof s LYS 40 Ca -0.07 -0.77 -0.06 0.00 0.02 0.00 0.00 55.97 55.09 2wof s LYS 40 Cb -0.14 -2.44 0.04 0.00 -0.52 0.00 0.00 37.83 34.77 2wof s LYS 40 CO 0.04 0.29 0.25 0.54 -0.92 0.00 0.00 175.35 175.55 2wof s VAL 41 N 0.12 -0.03 -0.09 3.17 0.11 -0.31 -0.58 120.40 122.79 2wof s VAL 41 Ca -0.09 0.11 -0.05 0.00 -2.93 0.00 0.00 61.98 59.02 2wof s VAL 41 Cb -0.15 -0.38 -0.04 0.00 -1.53 0.00 0.00 36.38 34.28 2wof s VAL 41 CO 0.06 0.04 0.11 -0.54 -3.33 0.00 0.00 175.10 171.44 2wof s LYS 42 N 0.96 3.29 0.50 1.54 1.02 -1.26 -0.79 119.74 125.01 2wof s LYS 42 Ca -0.07 -0.26 -0.23 0.00 0.02 0.00 0.00 55.97 55.44 2wof s LYS 42 Cb -0.08 -3.05 -0.07 0.00 -0.52 0.00 0.00 37.83 34.11 2wof s LYS 42 CO -0.06 0.74 1.26 -2.30 -0.92 0.00 0.00 175.35 174.06 2wof n PRO 43 N 1.80 1.67 -0.91 -1.68 -0.02 -1.26 -1.51 135.00 133.09 2wof n PRO 43 Ca -0.18 0.61 -0.01 0.00 -2.02 0.00 0.00 63.50 61.90 2wof n PRO 43 Cb 0.54 -2.43 -0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2wof n PRO 43 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wof n GLY 44 N 0.87 0.10 3.87 -1.23 0.00 0.26 -4.93 105.19 104.12 2wof n GLY 44 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 2wof n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wof s ALA 45 N -0.97 3.35 -2.38 4.61 0.00 -0.57 -4.96 121.76 120.84 2wof s ALA 45 Ca 0.00 -0.13 0.19 0.00 0.00 0.00 0.00 51.96 52.02 2wof s ALA 45 Cb 0.00 -2.71 0.16 0.00 0.00 0.00 0.00 23.12 20.56 2wof s ALA 45 CO 0.00 0.11 1.11 1.04 0.00 0.00 0.00 175.76 178.02 2wof n GLN 46 N -0.98 1.67 -4.29 0.00 6.02 -1.26 -4.35 117.38 114.20 2wof n GLN 46 Ca 0.03 -1.65 -0.21 0.00 -0.01 0.00 0.00 57.00 55.15 2wof n GLN 46 Cb 0.54 -1.37 -0.11 0.00 1.02 0.00 0.00 30.24 30.31 2wof n GLN 46 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2wof s THR 47 N -1.58 1.62 0.37 5.09 -4.23 -1.26 -0.61 115.64 115.03 2wof s THR 47 Ca 0.23 -1.75 0.08 0.00 -1.18 0.00 0.00 61.69 59.07 2wof s THR 47 Cb 0.16 -1.66 -0.06 0.00 1.34 0.00 0.00 72.50 72.29 2wof s THR 47 CO 0.24 -0.29 0.05 0.00 -0.54 0.00 0.00 174.62 174.08 2wof s ALA 48 N -1.86 3.30 -0.17 3.99 0.00 0.18 -4.66 121.76 122.53 2wof s ALA 48 Ca 0.11 -2.04 -0.01 0.00 0.00 0.00 0.00 51.96 50.02 2wof s ALA 48 Cb -0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.74 2wof s ALA 48 CO 0.05 -0.01 -0.13 0.42 0.00 0.00 0.00 175.76 176.09 2wof s ILE 49 N -2.56 2.84 -0.24 0.00 -1.09 0.25 -0.72 121.20 119.67 2wof s ILE 49 Ca 0.36 -0.70 0.02 0.00 -2.23 0.00 0.00 60.65 58.10 2wof s ILE 49 Cb 0.02 -2.22 0.05 0.00 -1.58 0.00 0.00 42.46 38.73 2wof s ILE 49 CO 0.20 0.50 -0.13 -0.69 -1.23 0.00 0.00 174.94 173.59 2wof s VAL 50 N 0.97 2.20 -1.44 2.92 1.01 0.50 -1.29 120.40 125.27 2wof s VAL 50 Ca -0.02 -1.42 -0.08 0.00 0.00 0.00 0.00 61.98 60.46 2wof s VAL 50 Cb -0.15 -2.20 0.05 0.00 0.00 0.00 0.00 36.38 34.09 2wof s VAL 50 CO -0.02 0.13 0.89 0.59 0.00 0.00 0.00 175.10 176.68 2wof n ASN 51 N 4.50 -3.50 0.00 3.32 4.13 -0.71 -0.94 115.26 122.06 2wof n ASN 51 Ca -0.16 -0.78 0.00 0.00 1.68 0.00 0.00 54.58 55.32 2wof n ASN 51 Cb 0.44 -4.00 0.00 0.00 -1.54 0.00 0.00 39.78 34.68 2wof n ASN 51 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wof n GLY 52 N -1.67 1.08 3.37 7.41 0.00 -1.24 -4.64 105.19 109.50 2wof n GLY 52 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 2wof n GLY 52 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wof s GLN 53 N -0.50 2.27 0.42 1.61 -1.52 -0.11 -5.07 119.66 116.76 2wof s GLN 53 Ca 0.00 -0.84 -0.21 0.00 -1.95 0.00 0.00 55.36 52.36 2wof s GLN 53 Cb 0.00 -2.17 -0.11 0.00 -0.22 0.00 0.00 33.01 30.51 2wof s GLN 53 CO 0.00 0.57 0.94 -1.25 -0.25 0.00 0.00 175.29 175.30 2wof s PRO 54 N -0.63 4.22 -0.05 2.91 0.04 -1.26 -0.37 135.00 139.85 2wof s PRO 54 Ca 0.10 1.09 -0.00 0.00 0.04 0.00 0.00 61.00 62.23 2wof s PRO 54 Cb -0.10 -2.20 0.03 0.00 0.04 0.00 0.00 34.50 32.26 2wof s PRO 54 CO -0.00 -0.02 -0.00 -1.17 0.04 0.00 0.00 177.00 175.85 2wof s LEU 55 N -3.16 0.86 0.13 -3.56 2.96 0.10 -4.90 118.68 111.12 2wof s LEU 55 Ca 0.61 -0.05 -0.30 0.00 -0.22 0.00 0.00 54.13 54.17 2wof s LEU 55 Cb -0.09 -0.33 -0.07 0.00 0.50 0.00 0.00 46.19 46.19 2wof s LEU 55 CO 0.13 -0.14 1.26 0.00 -1.32 0.00 0.00 176.35 176.28 2wof s ALA 56 N 1.48 3.47 -0.17 5.97 0.00 -1.26 -0.65 121.76 130.60 2wof s ALA 56 Ca -0.03 0.98 -0.04 0.00 0.00 0.00 0.00 51.96 52.87 2wof s ALA 56 Cb -0.13 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.51 2wof s ALA 56 CO -0.03 -0.47 -0.04 -0.51 0.00 0.00 0.00 175.76 174.72 2wof s LEU 57 N 0.47 3.15 0.03 0.00 1.43 0.22 -4.89 118.68 119.09 2wof s LEU 57 Ca 0.58 -0.21 -0.25 0.00 -1.03 0.00 0.00 54.13 53.22 2wof s LEU 57 Cb -0.33 -1.77 -0.17 0.00 0.03 0.00 0.00 46.19 43.94 2wof s LEU 57 CO 0.33 0.11 1.46 -0.61 0.23 0.00 0.00 176.35 177.87 2wof h GLN 58 N 7.13 -0.13 -4.49 1.70 4.15 -1.96 -3.41 115.11 118.10 2wof h GLN 58 Ca -0.33 0.01 -0.72 0.00 0.77 0.00 0.00 58.65 58.38 2wof h GLN 58 Cb 1.19 0.03 -0.23 0.00 0.21 0.00 0.00 27.48 28.67 2wof h GLN 58 CO 0.61 0.13 -0.44 0.08 -1.93 0.00 0.00 178.83 177.28 2wof s VAL 59 N -5.17 4.94 0.70 2.39 1.01 -1.26 -5.05 120.40 117.97 2wof s VAL 59 Ca -0.15 -0.86 -0.13 0.00 0.00 0.00 0.00 61.98 60.85 2wof s VAL 59 Cb 0.03 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.62 2wof s VAL 59 CO 0.64 -0.35 1.10 -2.84 0.00 0.00 0.00 175.10 173.65 2wof s PRO 60 N 1.61 2.61 0.23 2.72 0.02 -1.26 -4.74 135.00 136.19 2wof s PRO 60 Ca 0.04 1.25 -0.31 0.00 0.02 0.00 0.00 61.00 62.00 2wof s PRO 60 Cb -0.20 -1.94 -0.11 0.00 0.02 0.00 0.00 34.50 32.28 2wof s PRO 60 CO 0.08 -1.38 1.54 0.08 -0.33 0.00 0.00 177.00 176.99 2wof s VAL 61 N -2.63 2.45 -0.14 3.83 1.01 -1.26 -4.78 120.40 118.88 2wof s VAL 61 Ca 0.64 0.36 -0.02 0.00 0.00 0.00 0.00 61.98 62.96 2wof s VAL 61 Cb -0.18 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 2wof s VAL 61 CO 0.48 0.05 -0.08 -0.69 0.00 0.00 0.00 175.10 174.86 2wof s VAL 62 N 0.43 3.50 -0.19 2.92 1.01 -0.35 0.91 120.40 128.63 2wof s VAL 62 Ca 0.65 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 62.07 2wof s VAL 62 Cb -0.44 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 2wof s VAL 62 CO 0.40 0.52 0.00 -0.32 0.00 0.00 0.00 175.10 175.70 2wof s MET 63 N 0.26 3.70 -0.19 2.72 1.75 -1.26 0.41 119.30 126.69 2wof s MET 63 Ca -0.06 -0.49 -0.05 0.00 -1.25 0.00 0.00 55.69 53.85 2wof s MET 63 Cb -0.15 -3.06 0.07 0.00 2.84 0.00 0.00 34.83 34.53 2wof s MET 63 CO 0.04 0.12 0.14 0.15 -0.65 0.00 0.00 175.02 174.82 2wof s LYS 64 N 0.72 0.11 -1.21 4.11 1.02 0.36 -4.91 119.74 119.95 2wof s LYS 64 Ca 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 55.97 55.90 2wof s LYS 64 Cb -0.14 -1.58 -0.01 0.00 -0.52 0.00 0.00 37.83 35.58 2wof s LYS 64 CO 0.02 -0.68 0.74 -0.25 -0.92 0.00 0.00 175.35 174.26 2wof n ASP 65 N 5.29 -3.67 -1.37 2.83 8.00 -1.26 -1.81 116.55 124.56 2wof n ASP 65 Ca -0.06 -0.91 -0.18 0.00 0.71 0.00 0.00 54.79 54.35 2wof n ASP 65 Cb 0.49 -3.83 -0.07 0.00 -0.02 0.00 0.00 41.12 37.68 2wof n ASP 65 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2wof n ASN 66 N -2.91 -5.11 -3.93 -2.24 3.02 -1.26 -5.00 115.26 97.83 2wof n ASN 66 Ca -0.18 0.41 -0.24 0.00 -0.03 0.00 0.00 54.58 54.54 2wof n ASN 66 Cb 0.63 -4.15 -0.17 0.00 -0.61 0.00 0.00 39.78 35.48 2wof n ASN 66 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2wof s LYS 67 N -3.55 1.37 0.09 3.52 2.20 -0.75 -5.14 119.74 117.49 2wof s LYS 67 Ca 0.00 -0.25 -0.16 0.00 -0.36 0.00 0.00 55.97 55.20 2wof s LYS 67 Cb 0.00 -1.33 -0.07 0.00 -1.51 0.00 0.00 37.83 34.93 2wof s LYS 67 CO 0.00 -0.13 0.52 0.00 -0.36 0.00 0.00 175.35 175.38 2wof s ALA 68 N 1.22 3.61 0.02 3.13 0.00 -1.26 -0.49 121.76 128.00 2wof s ALA 68 Ca -0.05 -0.11 0.04 0.00 0.00 0.00 0.00 51.96 51.84 2wof s ALA 68 Cb -0.14 -2.52 -0.02 0.00 0.00 0.00 0.00 23.12 20.45 2wof s ALA 68 CO -0.02 0.45 -0.11 -1.58 0.00 0.00 0.00 175.76 174.50 2wof s TRP 69 N -1.27 0.96 0.14 0.00 0.52 0.17 -1.29 118.94 118.16 2wof s TRP 69 Ca 0.32 -0.29 0.05 0.00 0.02 0.00 0.00 56.10 56.20 2wof s TRP 69 Cb -0.17 -0.59 -0.04 0.00 -1.15 0.00 0.00 33.47 31.52 2wof s TRP 69 CO 0.18 -0.00 -0.12 0.14 0.02 0.00 0.00 176.95 177.17 2wof s VAL 70 N -0.65 1.26 0.96 4.03 -7.23 0.82 -1.22 120.40 118.37 2wof s VAL 70 Ca 0.01 -1.96 -0.10 0.00 -1.81 0.00 0.00 61.98 58.12 2wof s VAL 70 Cb -0.06 -1.75 0.17 0.00 0.56 0.00 0.00 36.38 35.30 2wof s VAL 70 CO 0.00 -0.63 1.12 -1.54 -0.31 0.00 0.00 175.10 173.75 2wof n SER 71 N 0.03 0.00 0.00 4.85 3.41 -1.26 0.14 113.62 120.79 2wof n SER 71 Ca -0.12 0.33 0.10 0.00 -0.26 0.00 0.00 58.87 58.92 2wof n SER 71 Cb 0.59 -1.44 0.57 0.00 -0.26 0.00 0.00 64.21 63.67 2wof n SER 71 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2wof n ASP 72 N -4.36 0.00 -0.57 4.04 5.75 -0.99 -2.42 116.55 117.99 2wof n ASP 72 Ca 0.11 -1.33 0.08 0.00 -0.01 0.00 0.00 54.79 53.63 2wof n ASP 72 Cb 0.52 0.00 0.06 0.00 -1.03 0.00 0.00 41.12 40.67 2wof n ASP 72 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2wof n THR 73 N -0.81 0.00 -0.16 2.12 -2.24 -1.26 -4.73 114.28 107.19 2wof n THR 73 Ca 0.14 -0.48 -0.02 0.00 -2.27 0.00 0.00 64.05 61.42 2wof n THR 73 Cb 0.07 1.30 0.07 0.00 -2.10 0.00 0.00 70.33 69.66 2wof n THR 73 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2wof h PHE 74 N 2.82 0.09 -0.24 4.78 3.04 -1.83 0.22 116.94 125.81 2wof h PHE 74 Ca 0.00 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.96 2wof h PHE 74 Cb 0.62 0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.15 2wof h PHE 74 CO 0.00 -0.05 0.08 0.82 -2.02 0.00 0.00 178.31 177.14 2wof h ILE 75 N 0.19 1.19 -0.33 1.41 2.04 -1.85 -0.76 117.51 119.40 2wof h ILE 75 Ca 0.25 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 2wof h ILE 75 Cb 0.36 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 2wof h ILE 75 CO -0.36 0.20 0.16 -1.13 0.00 0.00 0.00 178.15 177.01 2wof h ASN 76 N 0.22 0.44 -1.00 1.72 -1.24 -1.80 -0.69 115.58 113.23 2wof h ASN 76 Ca 0.08 -0.13 0.06 0.00 0.71 0.00 0.00 56.30 57.02 2wof h ASN 76 Cb 0.23 -0.11 -0.07 0.00 0.73 0.00 0.00 38.32 39.11 2wof h ASN 76 CO -0.00 0.44 0.65 0.44 -1.29 0.00 0.00 177.43 177.67 2wof h ASP 77 N 0.40 1.04 0.00 1.15 3.32 -0.08 -2.04 116.42 120.21 2wof h ASP 77 Ca 0.11 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 2wof h ASP 77 Cb 0.12 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 2wof h ASP 77 CO -0.01 0.67 -0.59 0.52 -1.72 0.00 0.00 179.24 178.10 2wof n VAL 78 N -4.49 1.43 0.18 -1.35 0.31 -0.34 -3.85 118.33 110.22 2wof n VAL 78 Ca 0.15 0.19 0.04 0.00 -0.01 0.00 0.00 64.34 64.72 2wof n VAL 78 Cb 0.18 -2.36 0.33 0.00 -0.91 0.00 0.00 33.84 31.08 2wof n VAL 78 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2wof h PHE 79 N -1.00 0.00 -0.51 3.52 0.04 -1.23 -2.68 116.94 115.08 2wof h PHE 79 Ca -0.03 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.70 2wof h PHE 79 Cb 0.59 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.72 2wof h PHE 79 CO -0.20 0.41 0.04 1.04 -0.60 0.00 0.00 178.31 179.00 2wof n GLN 80 N -3.69 4.06 0.12 1.51 6.02 -0.77 -4.65 117.38 119.99 2wof n GLN 80 Ca -0.01 -3.07 -0.02 0.00 -0.01 0.00 0.00 57.00 53.89 2wof n GLN 80 Cb 0.49 -2.13 0.15 0.00 1.02 0.00 0.00 30.24 29.78 2wof n GLN 80 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2wof h SER 81 N 3.06 0.07 0.00 1.08 4.64 -1.58 -3.47 113.55 117.35 2wof h SER 81 Ca 0.05 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2wof h SER 81 Cb 1.89 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.96 2wof h SER 81 CO 0.46 0.68 0.00 0.61 -0.87 0.00 0.00 176.83 177.71 2wof n GLY 82 N 0.27 2.45 0.23 -0.77 0.00 -1.26 -4.93 105.19 101.19 2wof n GLY 82 Ca -0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.16 2wof n GLY 82 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wof h LEU 83 N 0.00 0.00 -8.54 0.99 3.38 -1.91 -3.37 115.31 105.86 2wof h LEU 83 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 2wof h LEU 83 Cb 0.00 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.64 2wof h LEU 83 CO 0.00 0.00 0.60 -0.62 0.09 0.00 0.00 178.44 178.51 2wof s ASP 84 N -5.30 6.38 -0.04 -0.43 2.15 -1.26 -4.72 116.67 113.44 2wof s ASP 84 Ca 0.02 -0.21 0.16 0.00 0.43 0.00 0.00 52.55 52.96 2wof s ASP 84 Cb 0.09 -2.45 0.55 0.00 -0.30 0.00 0.00 42.92 40.81 2wof s ASP 84 CO 0.51 -1.21 1.44 0.00 -0.17 0.00 0.00 175.17 175.74 2wof n GLN 85 N 7.47 2.76 -0.03 4.34 6.02 -1.26 -4.56 117.38 132.13 2wof n GLN 85 Ca 0.03 -2.19 -0.11 0.00 -0.01 0.00 0.00 57.00 54.72 2wof n GLN 85 Cb 0.48 -1.61 -0.05 0.00 1.02 0.00 0.00 30.24 30.08 2wof n GLN 85 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2wof h THR 86 N 3.35 1.11 -3.20 5.09 2.02 -1.90 -3.41 112.91 115.97 2wof h THR 86 Ca 0.00 -0.29 -0.63 0.00 0.77 0.00 0.00 66.41 66.26 2wof h THR 86 Cb 0.99 1.03 -0.14 0.00 -1.74 0.00 0.00 68.15 68.29 2wof h THR 86 CO 0.09 0.10 -0.55 -0.36 0.37 0.00 0.00 175.52 175.17 2wof s PHE 87 N -5.82 3.30 0.15 3.16 0.08 -1.26 -0.31 117.98 117.29 2wof s PHE 87 Ca -0.13 0.17 0.07 0.00 0.12 0.00 0.00 56.93 57.16 2wof s PHE 87 Cb 0.07 -2.04 -0.04 0.00 -0.57 0.00 0.00 43.02 40.44 2wof s PHE 87 CO 0.69 0.28 -0.15 -0.65 -0.10 0.00 0.00 175.22 175.29 2wof s GLN 88 N 0.04 1.13 0.10 0.44 -1.52 -0.54 -4.95 119.66 114.36 2wof s GLN 88 Ca 0.06 -1.34 -0.11 0.00 -1.95 0.00 0.00 55.36 52.02 2wof s GLN 88 Cb -0.12 -1.03 -0.06 0.00 -0.22 0.00 0.00 33.01 31.58 2wof s GLN 88 CO 0.01 0.19 0.44 0.14 -0.25 0.00 0.00 175.29 175.82 2wof s VAL 89 N -2.31 5.03 -0.06 1.09 -7.23 -1.26 -2.73 120.40 112.95 2wof s VAL 89 Ca 0.13 0.53 -0.30 0.00 -1.81 0.00 0.00 61.98 60.53 2wof s VAL 89 Cb -0.04 -3.67 -0.03 0.00 0.56 0.00 0.00 36.38 33.20 2wof s VAL 89 CO 0.04 0.26 1.17 -0.70 -0.31 0.00 0.00 175.10 175.56 2wof s GLU 90 N -1.97 4.37 -0.00 4.82 2.12 -1.26 -4.81 118.70 121.97 2wof s GLU 90 Ca 0.35 1.63 -0.19 0.00 0.36 0.00 0.00 54.97 57.12 2wof s GLU 90 Cb -0.14 -3.54 -0.10 0.00 0.26 0.00 0.00 34.13 30.60 2wof s GLU 90 CO 0.19 -0.41 0.88 0.87 -0.54 0.00 0.00 175.26 176.25 2wof h LYS 91 N 7.36 -0.66 -5.33 4.30 6.56 -1.96 -3.44 116.57 123.40 2wof h LYS 91 Ca -0.34 0.04 -0.66 0.00 -1.06 0.00 0.00 60.65 58.63 2wof h LYS 91 Cb 1.16 0.15 -0.28 0.00 -0.57 0.00 0.00 32.23 32.70 2wof h LYS 91 CO 0.87 -0.44 -0.78 1.03 -2.06 0.00 0.00 179.45 178.07 2wof s ARG 92 N -3.87 3.33 0.17 3.15 0.52 -1.26 -5.09 118.95 115.90 2wof s ARG 92 Ca -0.10 -0.71 -0.34 0.00 -0.52 0.00 0.00 55.73 54.06 2wof s ARG 92 Cb 0.01 -2.58 -0.14 0.00 0.52 0.00 0.00 34.95 32.76 2wof s ARG 92 CO 0.30 0.21 1.52 -0.35 0.02 0.00 0.00 175.30 177.01 2wof n PRO 93 N 3.51 2.05 -2.88 3.54 -0.04 -1.26 -4.93 135.00 134.98 2wof n PRO 93 Ca -0.18 0.74 -0.40 0.00 -0.04 0.00 0.00 63.50 63.61 2wof n PRO 93 Cb 0.53 -2.47 -0.05 0.00 -0.04 0.00 0.00 33.50 31.46 2wof n PRO 93 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2wof s HIS 94 N 0.67 3.81 0.13 0.54 2.46 -1.26 -4.92 115.29 116.72 2wof s HIS 94 Ca 0.77 1.64 0.32 0.00 0.47 0.00 0.00 55.06 58.26 2wof s HIS 94 Cb -0.69 -2.90 1.66 0.00 -0.13 0.00 0.00 32.58 30.52 2wof s HIS 94 CO 0.41 0.30 1.98 -1.00 -2.47 0.00 0.00 174.74 173.96 2wof h PRO 95 N 5.31 0.00 -0.08 2.88 0.13 -1.95 -1.34 132.00 136.94 2wof h PRO 95 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2wof h PRO 95 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2wof h PRO 95 CO 0.70 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.75 2wof n LEU 96 N -2.67 2.00 -4.71 1.56 4.77 -1.26 -4.78 117.00 111.92 2wof n LEU 96 Ca -0.01 -0.72 -0.43 0.00 -0.03 0.00 0.00 56.01 54.81 2wof n LEU 96 Cb 0.10 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2wof n LEU 96 CO 0.17 0.36 1.24 0.59 -1.33 0.00 0.00 177.39 178.42 2wof n ASN 97 N 0.55 3.55 -4.38 -1.43 3.02 -0.51 -4.92 115.26 111.14 2wof n ASN 97 Ca 0.17 1.10 -0.33 0.00 -0.03 0.00 0.00 54.58 55.50 2wof n ASN 97 Cb 0.42 -1.52 0.14 0.00 -0.61 0.00 0.00 39.78 38.21 2wof n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wof n ALA 98 N 3.03 -3.00 -1.79 5.41 0.00 -1.26 -4.89 120.51 118.01 2wof n ALA 98 Ca 0.14 -0.80 -0.41 0.00 0.00 0.00 0.00 53.44 52.36 2wof n ALA 98 Cb 0.33 -1.73 -0.01 0.00 0.00 0.00 0.00 19.45 18.04 2wof n ALA 98 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wof s LEU 99 N -1.31 4.35 0.93 0.00 1.43 -1.26 -5.00 118.68 117.82 2wof s LEU 99 Ca 0.57 2.92 -0.14 0.00 -1.03 0.00 0.00 54.13 56.44 2wof s LEU 99 Cb -0.19 -3.65 0.18 0.00 0.03 0.00 0.00 46.19 42.56 2wof s LEU 99 CO 0.67 -0.81 1.28 0.42 0.23 0.00 0.00 176.35 178.14 2wof s THR 100 N -0.68 2.01 0.20 5.49 -4.23 -1.26 -4.80 115.64 112.37 2wof s THR 100 Ca 0.56 -0.05 -0.09 0.00 -1.18 0.00 0.00 61.69 60.93 2wof s THR 100 Cb -0.45 -2.97 0.11 0.00 1.34 0.00 0.00 72.50 70.54 2wof s THR 100 CO 0.55 0.00 1.72 0.00 -0.54 0.00 0.00 174.62 176.35 2wof h ALA 101 N -1.49 0.93 -0.51 3.99 0.00 -1.95 0.72 119.26 120.95 2wof h ALA 101 Ca -0.44 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.11 2wof h ALA 101 Cb 1.25 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2wof h ALA 101 CO 0.41 0.63 -0.16 -0.44 0.00 0.00 0.00 179.25 179.69 2wof h ASP 102 N 1.05 1.01 -0.43 0.00 3.32 -1.99 -0.66 116.42 118.72 2wof h ASP 102 Ca 0.22 -0.36 -0.09 0.00 0.02 0.00 0.00 57.03 56.83 2wof h ASP 102 Cb 0.34 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2wof h ASP 102 CO -0.00 1.15 -0.07 -0.33 -1.72 0.00 0.00 179.24 178.26 2wof h GLU 103 N 0.87 0.81 0.08 3.56 5.08 -1.80 -1.17 114.58 122.01 2wof h GLU 103 Ca 0.12 -0.30 0.02 0.00 -1.00 0.00 0.00 59.36 58.21 2wof h GLU 103 Cb 0.73 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.89 2wof h GLU 103 CO 0.06 0.91 -0.27 0.82 -1.00 0.00 0.00 179.01 179.53 2wof h ILE 104 N 0.64 0.40 -0.52 3.13 2.04 -0.54 -1.01 117.51 121.64 2wof h ILE 104 Ca 0.11 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.00 2wof h ILE 104 Cb 0.60 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2wof h ILE 104 CO 0.04 0.00 0.35 0.11 0.00 0.00 0.00 178.15 178.64 2wof h LYS 105 N -0.47 0.59 -0.34 2.37 1.57 -1.01 -1.58 116.57 117.70 2wof h LYS 105 Ca 0.04 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 2wof h LYS 105 Cb 0.51 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 2wof h LYS 105 CO -0.18 0.39 -0.05 0.37 -0.57 0.00 0.00 179.45 179.40 2wof h GLN 106 N 0.60 0.64 -0.12 3.15 4.15 -0.88 -1.81 115.11 120.85 2wof h GLN 106 Ca 0.21 -0.23 -0.05 0.00 0.77 0.00 0.00 58.65 59.35 2wof h GLN 106 Cb 0.08 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 2wof h GLN 106 CO -0.05 0.79 -0.15 0.00 -1.93 0.00 0.00 178.83 177.49 2wof h ALA 107 N 0.83 1.53 0.01 3.38 0.00 -0.46 -1.43 119.26 123.12 2wof h ALA 107 Ca 0.09 -0.21 -0.21 0.00 0.00 0.00 0.00 54.91 54.59 2wof h ALA 107 Cb 0.54 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2wof h ALA 107 CO 0.03 0.34 -0.91 0.28 0.00 0.00 0.00 179.25 178.99 2wof h VAL 108 N 0.18 1.49 -0.22 0.00 2.07 -1.12 -2.81 116.25 115.84 2wof h VAL 108 Ca 0.04 -2.63 -0.16 0.00 0.82 0.00 0.00 66.70 64.76 2wof h VAL 108 Cb 0.38 2.49 -0.00 0.00 -1.52 0.00 0.00 31.29 32.64 2wof h VAL 108 CO 0.02 0.77 -0.54 -0.33 0.02 0.00 0.00 177.57 177.52 2wof h GLU 109 N 0.12 0.64 -0.14 1.57 5.08 -1.10 -1.79 114.58 118.96 2wof h GLU 109 Ca -0.05 -0.40 -0.01 0.00 -1.00 0.00 0.00 59.36 57.90 2wof h GLU 109 Cb 1.54 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.83 2wof h GLU 109 CO 0.14 1.01 0.03 0.82 -1.00 0.00 0.00 179.01 180.01 2wof h ILE 110 N 0.49 1.20 -0.09 3.13 2.04 -1.24 -2.13 117.51 120.92 2wof h ILE 110 Ca 0.01 -0.64 -0.09 0.00 1.00 0.00 0.00 64.86 65.14 2wof h ILE 110 Cb 1.09 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 2wof h ILE 110 CO 0.11 0.19 -0.36 -0.37 0.00 0.00 0.00 178.15 177.72 2wof h VAL 111 N 0.03 1.28 0.00 1.67 -1.51 -1.53 -2.35 116.25 113.84 2wof h VAL 111 Ca 0.04 -1.37 0.00 0.00 -1.23 0.00 0.00 66.70 64.14 2wof h VAL 111 Cb 0.27 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 31.05 2wof h VAL 111 CO 0.00 0.41 0.00 0.11 -1.23 0.00 0.00 177.57 176.86 2wof h LYS 112 N 0.16 0.00 -0.00 5.19 1.57 -1.17 -1.85 116.57 120.47 2wof h LYS 112 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2wof h LYS 112 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 2wof h LYS 112 CO 0.05 0.00 -0.00 0.00 -0.57 0.00 0.00 179.45 178.93 2wof n ALA 113 N -1.99 2.66 -2.42 3.86 0.00 -0.81 -4.81 120.51 117.00 2wof n ALA 113 Ca -0.00 -0.25 -0.32 0.00 0.00 0.00 0.00 53.44 52.87 2wof n ALA 113 Cb 0.19 -1.44 -0.05 0.00 0.00 0.00 0.00 19.45 18.14 2wof n ALA 113 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2wof s SER 114 N -2.05 6.64 0.00 0.00 0.15 -0.70 -4.96 113.70 112.79 2wof s SER 114 Ca 0.44 0.92 0.15 0.00 0.70 0.00 0.00 55.95 58.16 2wof s SER 114 Cb 0.22 -2.22 0.74 0.00 -1.71 0.00 0.00 66.02 63.05 2wof s SER 114 CO 0.37 -0.05 1.43 0.00 1.20 0.00 0.00 173.24 176.19 2wof n ALA 115 N -0.04 1.82 0.09 5.45 0.00 -1.26 -2.67 120.51 123.91 2wof n ALA 115 Ca -0.00 -0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.47 2wof n ALA 115 Cb 0.52 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.72 2wof n ALA 115 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2wof h ASP 116 N 0.00 0.00 -3.96 0.00 3.32 -1.92 -3.47 116.42 110.38 2wof h ASP 116 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 2wof h ASP 116 Cb 0.16 0.00 0.10 0.00 0.22 0.00 0.00 39.33 39.81 2wof h ASP 116 CO 0.00 0.09 0.67 0.12 -1.72 0.00 0.00 179.24 178.40 2wof s PHE 117 N -3.29 2.65 -0.01 4.55 5.36 -1.09 -5.01 117.98 121.14 2wof s PHE 117 Ca -0.01 1.32 0.04 0.00 -0.96 0.00 0.00 56.93 57.32 2wof s PHE 117 Cb 0.09 -3.81 -0.01 0.00 -0.34 0.00 0.00 43.02 38.95 2wof s PHE 117 CO 0.79 -2.53 -0.12 0.15 -1.46 0.00 0.00 175.22 172.05 2wof s LYS 118 N -2.30 0.98 0.62 10.12 1.02 -1.26 -5.03 119.74 123.90 2wof s LYS 118 Ca 0.58 -0.43 0.26 0.00 0.02 0.00 0.00 55.97 56.39 2wof s LYS 118 Cb -0.41 -0.95 1.29 0.00 -0.52 0.00 0.00 37.83 37.24 2wof s LYS 118 CO 0.54 0.26 1.72 -1.00 -0.92 0.00 0.00 175.35 175.95 2wof h PRO 119 N 5.84 0.00 0.00 -1.68 0.13 -2.03 2.76 132.00 137.03 2wof h PRO 119 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2wof h PRO 119 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2wof h PRO 119 CO 0.49 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.53 2wof n ASN 120 N -3.26 0.14 -4.69 1.44 6.94 -1.26 -4.91 115.26 109.67 2wof n ASN 120 Ca 0.06 0.52 -0.42 0.00 -0.02 0.00 0.00 54.58 54.72 2wof n ASN 120 Cb 0.74 -0.55 -0.03 0.00 -2.36 0.00 0.00 39.78 37.58 2wof n ASN 120 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2wof s THR 121 N -3.03 3.64 0.38 5.53 2.01 0.92 -4.56 115.64 120.54 2wof s THR 121 Ca 0.11 1.01 0.08 0.00 0.31 0.00 0.00 61.69 63.21 2wof s THR 121 Cb 0.16 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 2wof s THR 121 CO 0.47 -0.01 0.24 -0.13 -0.69 0.00 0.00 174.62 174.50 2wof s ARG 122 N 2.55 2.45 -0.32 4.92 0.52 -0.31 -4.93 118.95 123.82 2wof s ARG 122 Ca 0.65 -1.56 0.01 0.00 -0.52 0.00 0.00 55.73 54.30 2wof s ARG 122 Cb -0.32 -2.24 0.07 0.00 0.52 0.00 0.00 34.95 32.98 2wof s ARG 122 CO 0.27 -0.02 0.02 -0.06 0.02 0.00 0.00 175.30 175.52 2wof s PHE 123 N -2.45 3.43 0.17 -0.53 0.08 0.18 -0.70 117.98 118.16 2wof s PHE 123 Ca 0.42 -2.34 -0.10 0.00 0.12 0.00 0.00 56.93 55.03 2wof s PHE 123 Cb -0.02 -2.44 0.03 0.00 -0.57 0.00 0.00 43.02 40.02 2wof s PHE 123 CO 0.25 -0.89 1.58 1.79 -0.10 0.00 0.00 175.22 177.85 2wof h THR 124 N 6.56 1.27 -2.41 0.64 1.35 -1.64 -3.38 112.91 115.30 2wof h THR 124 Ca -0.15 -1.30 -0.08 0.00 -0.55 0.00 0.00 66.41 64.32 2wof h THR 124 Cb 1.04 1.00 -0.22 0.00 -1.73 0.00 0.00 68.15 68.24 2wof h THR 124 CO 0.54 0.46 -0.06 -0.70 -0.25 0.00 0.00 175.52 175.51 2wof s GLU 125 N -4.81 0.67 -0.21 4.72 2.12 -1.19 -4.96 118.70 115.04 2wof s GLU 125 Ca -0.12 0.70 -0.02 0.00 0.36 0.00 0.00 54.97 55.90 2wof s GLU 125 Cb 0.13 0.32 0.06 0.00 0.26 0.00 0.00 34.13 34.90 2wof s GLU 125 CO 0.87 -0.09 0.01 0.42 -0.54 0.00 0.00 175.26 175.92 2wof s ILE 126 N 0.14 0.82 0.01 -3.70 1.01 -1.26 -1.02 121.20 117.21 2wof s ILE 126 Ca -0.01 -0.75 -0.06 0.00 0.00 0.00 0.00 60.65 59.82 2wof s ILE 126 Cb -0.04 -1.26 -0.00 0.00 0.01 0.00 0.00 42.46 41.17 2wof s ILE 126 CO 0.01 -0.17 0.11 -0.44 0.00 0.00 0.00 174.94 174.45 2wof s SER 127 N 1.72 0.09 0.30 3.58 0.01 -0.56 -4.67 113.70 114.17 2wof s SER 127 Ca -0.02 -0.33 -0.29 0.00 1.31 0.00 0.00 55.95 56.61 2wof s SER 127 Cb -0.18 0.20 -0.13 0.00 0.21 0.00 0.00 66.02 66.12 2wof s SER 127 CO -0.07 -0.40 1.28 -0.11 0.41 0.00 0.00 173.24 174.34 2wof n LEU 128 N 1.27 3.09 -4.63 2.44 7.94 -1.26 -0.22 117.00 125.62 2wof n LEU 128 Ca -0.22 1.18 -0.41 0.00 -1.11 0.00 0.00 56.01 55.46 2wof n LEU 128 Cb 0.56 -1.43 -0.06 0.00 0.53 0.00 0.00 43.42 43.02 2wof n LEU 128 CO 0.21 -0.65 0.40 -0.22 -1.11 0.00 0.00 177.39 176.02 2wof s LEU 129 N -0.41 4.07 0.14 -1.96 2.96 -0.09 -4.60 118.68 118.80 2wof s LEU 129 Ca 0.60 0.73 -0.31 0.00 -0.22 0.00 0.00 54.13 54.93 2wof s LEU 129 Cb -0.62 -2.87 -0.09 0.00 0.50 0.00 0.00 46.19 43.12 2wof s LEU 129 CO 0.58 -0.36 1.43 -2.16 -1.32 0.00 0.00 176.35 174.52 2wof s PRO 130 N 2.43 4.30 1.29 0.98 0.04 -1.26 -4.47 135.00 138.30 2wof s PRO 130 Ca 0.27 2.16 -0.19 0.00 0.04 0.00 0.00 61.00 63.28 2wof s PRO 130 Cb -0.16 -3.21 0.32 0.00 0.04 0.00 0.00 34.50 31.49 2wof s PRO 130 CO 0.09 -0.46 1.00 -2.14 0.04 0.00 0.00 177.00 175.52 2wof s PRO 131 N 0.92 -1.87 0.35 0.56 0.02 -1.26 -4.92 135.00 128.79 2wof s PRO 131 Ca 0.65 0.29 -0.20 0.00 0.02 0.00 0.00 61.00 61.77 2wof s PRO 131 Cb -0.39 -1.49 -0.10 0.00 0.02 0.00 0.00 34.50 32.55 2wof s PRO 131 CO 0.32 -4.22 0.85 0.16 -0.33 0.00 0.00 177.00 173.78 2wof s ASP 132 N -3.16 6.96 0.19 2.53 -4.77 -1.26 -4.91 116.67 112.26 2wof s ASP 132 Ca 0.69 1.54 -0.12 0.00 -3.30 0.00 0.00 52.55 51.36 2wof s ASP 132 Cb -0.16 -2.47 0.11 0.00 -1.09 0.00 0.00 42.92 39.31 2wof s ASP 132 CO 0.59 -0.21 1.84 0.50 0.70 0.00 0.00 175.17 178.60 2wof h LYS 133 N 2.43 0.88 -0.70 2.11 3.64 -1.99 -1.43 116.57 121.51 2wof h LYS 133 Ca -0.48 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 2wof h LYS 133 Cb 1.18 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.78 2wof h LYS 133 CO 0.64 0.61 0.45 1.49 -2.27 0.00 0.00 179.45 180.37 2wof h GLU 134 N 0.89 0.94 -0.24 1.90 4.81 -2.00 -1.60 114.58 119.28 2wof h GLU 134 Ca 0.24 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.28 2wof h GLU 134 Cb -0.06 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.10 2wof h GLU 134 CO -0.05 0.64 -0.37 0.00 -0.73 0.00 0.00 179.01 178.50 2wof h ALA 135 N 1.24 0.91 -0.66 2.92 0.00 -1.83 -1.63 119.26 120.22 2wof h ALA 135 Ca 0.26 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2wof h ALA 135 Cb -0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2wof h ALA 135 CO -0.05 0.63 0.16 0.28 0.00 0.00 0.00 179.25 180.26 2wof h VAL 136 N 0.45 1.26 -0.39 0.00 2.07 -0.91 -1.08 116.25 117.65 2wof h VAL 136 Ca 0.05 -0.95 -0.07 0.00 0.82 0.00 0.00 66.70 66.54 2wof h VAL 136 Cb 0.85 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 2wof h VAL 136 CO 0.07 0.36 -0.05 -0.50 0.02 0.00 0.00 177.57 177.47 2wof h TRP 137 N 0.99 0.80 -0.61 1.57 -0.00 -1.07 -1.46 115.95 116.17 2wof h TRP 137 Ca 0.21 -0.16 0.01 0.00 -0.00 0.00 0.00 58.89 58.95 2wof h TRP 137 Cb 0.37 -0.20 -0.03 0.00 -0.00 0.00 0.00 29.16 29.30 2wof h TRP 137 CO 0.03 0.83 0.40 0.00 -0.00 0.00 0.00 178.44 179.70 2wof h ALA 138 N 0.86 1.59 0.08 1.49 0.00 -1.19 0.29 119.26 122.38 2wof h ALA 138 Ca 0.10 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2wof h ALA 138 Cb 0.55 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2wof h ALA 138 CO 0.03 0.38 -0.04 0.35 0.00 0.00 0.00 179.25 179.97 2wof h PHE 139 N 0.80 -0.10 -0.41 0.00 3.04 -0.96 0.15 116.94 119.46 2wof h PHE 139 Ca 0.23 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.14 2wof h PHE 139 Cb -0.06 0.03 -0.02 0.00 2.56 0.00 0.00 35.95 38.46 2wof h PHE 139 CO -0.00 0.09 0.12 0.00 -2.02 0.00 0.00 178.31 176.50 2wof h ALA 140 N 0.63 0.54 0.00 2.41 0.00 -0.26 -0.21 119.26 122.37 2wof h ALA 140 Ca -0.01 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.52 2wof h ALA 140 Cb 0.24 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2wof h ALA 140 CO 0.02 0.19 -1.95 1.28 0.00 0.00 0.00 179.25 178.79 2wof n LEU 141 N -4.58 0.31 -0.00 0.00 4.77 0.94 -4.49 117.00 113.95 2wof n LEU 141 Ca -0.00 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2wof n LEU 141 Cb 0.19 0.22 -0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2wof n LEU 141 CO 0.38 0.25 0.08 -0.62 -1.33 0.00 0.00 177.39 176.15 2wof n GLU 142 N -2.68 4.42 -1.56 3.23 1.02 -0.07 -5.00 120.64 120.00 2wof n GLU 142 Ca -0.18 -0.16 -0.14 0.00 -0.02 0.00 0.00 57.16 56.66 2wof n GLU 142 Cb 0.90 -0.66 -0.05 0.00 -0.02 0.00 0.00 31.44 31.61 2wof n GLU 142 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2wof n ASN 143 N -0.68 -4.63 -4.71 1.62 5.15 0.33 -4.92 115.26 107.42 2wof n ASN 143 Ca 0.00 0.28 -0.42 0.00 -0.60 0.00 0.00 54.58 53.84 2wof n ASN 143 Cb 0.00 -3.44 -0.03 0.00 -0.53 0.00 0.00 39.78 35.78 2wof n ASN 143 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2wof s LYS 144 N -3.46 4.43 0.65 1.20 2.20 -0.70 -4.87 119.74 119.18 2wof s LYS 144 Ca 0.00 1.74 -0.16 0.00 -0.36 0.00 0.00 55.97 57.19 2wof s LYS 144 Cb 0.00 -3.39 -0.00 0.00 -1.51 0.00 0.00 37.83 32.93 2wof s LYS 144 CO 0.00 -0.28 1.13 -2.14 -0.36 0.00 0.00 175.35 173.71 2wof s PRO 145 N 1.25 2.79 -0.34 4.03 0.02 -1.26 -3.27 135.00 138.22 2wof s PRO 145 Ca 0.58 1.51 -0.14 0.00 0.02 0.00 0.00 61.00 62.97 2wof s PRO 145 Cb -0.28 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.28 2wof s PRO 145 CO 0.28 -1.28 0.31 0.08 -0.33 0.00 0.00 177.00 176.06 2wof s VAL 146 N -2.15 5.22 -2.46 3.83 1.01 -1.26 -4.93 120.40 119.66 2wof s VAL 146 Ca 0.70 -0.04 0.27 0.00 0.00 0.00 0.00 61.98 62.90 2wof s VAL 146 Cb -0.23 -3.77 0.41 0.00 0.00 0.00 0.00 36.38 32.79 2wof s VAL 146 CO 0.39 -0.05 1.59 -0.90 0.00 0.00 0.00 175.10 176.14 2wof n ASP 147 N 5.26 1.75 -4.78 3.32 5.68 -1.26 -4.88 116.55 121.64 2wof n ASP 147 Ca -0.11 -1.50 -0.36 0.00 -0.50 0.00 0.00 54.79 52.32 2wof n ASP 147 Cb 0.50 0.05 -0.05 0.00 -1.14 0.00 0.00 41.12 40.47 2wof n ASP 147 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 2wof s GLN 148 N -2.10 4.26 0.27 0.11 -0.21 -1.26 -5.00 119.66 115.72 2wof s GLN 148 Ca 0.33 1.46 -0.30 0.00 0.02 0.00 0.00 55.36 56.87 2wof s GLN 148 Cb 0.20 -2.59 -0.09 0.00 1.00 0.00 0.00 33.01 31.54 2wof s GLN 148 CO 0.37 -0.04 1.10 -2.14 -2.12 0.00 0.00 175.29 172.45 2wof s PRO 149 N -2.43 4.64 0.11 2.91 0.02 -1.26 -4.97 135.00 134.02 2wof s PRO 149 Ca 0.56 1.79 -0.36 0.00 0.02 0.00 0.00 61.00 63.02 2wof s PRO 149 Cb -0.21 -3.20 -0.16 0.00 0.02 0.00 0.00 34.50 30.95 2wof s PRO 149 CO 0.26 0.20 1.38 0.54 -0.33 0.00 0.00 177.00 179.05 2wof n ARG 150 N 1.35 1.38 -4.36 5.54 5.12 -1.26 -4.84 116.66 119.58 2wof n ARG 150 Ca -0.01 0.50 -0.19 0.00 -1.93 0.00 0.00 57.85 56.22 2wof n ARG 150 Cb 0.45 -2.16 -0.10 0.00 -1.16 0.00 0.00 32.46 29.49 2wof n ARG 150 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2wof s LYS 151 N 0.51 1.37 -0.02 5.56 1.02 -1.26 -0.78 119.74 126.14 2wof s LYS 151 Ca 0.82 -1.64 0.05 0.00 0.02 0.00 0.00 55.97 55.22 2wof s LYS 151 Cb -0.88 -1.01 -0.01 0.00 -0.52 0.00 0.00 37.83 35.40 2wof s LYS 151 CO 0.45 0.09 -0.16 0.00 -0.92 0.00 0.00 175.35 174.82 2wof s ALA 152 N -3.08 1.32 -0.02 5.17 0.00 -0.76 -0.92 121.76 123.47 2wof s ALA 152 Ca 0.25 -0.67 -0.25 0.00 0.00 0.00 0.00 51.96 51.28 2wof s ALA 152 Cb 0.02 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 2wof s ALA 152 CO 0.08 0.31 0.77 -0.51 0.00 0.00 0.00 175.76 176.41 2wof s ASP 153 N -0.32 7.12 -0.22 0.00 1.01 0.69 -1.56 116.67 123.40 2wof s ASP 153 Ca 0.05 1.35 0.01 0.00 0.71 0.00 0.00 52.55 54.67 2wof s ASP 153 Cb -0.07 -2.46 0.05 0.00 1.01 0.00 0.00 42.92 41.46 2wof s ASP 153 CO -0.00 -0.11 -0.07 -0.69 0.21 0.00 0.00 175.17 174.51 2wof s VAL 154 N 0.61 1.57 -0.20 -1.27 1.01 0.25 -1.49 120.40 120.88 2wof s VAL 154 Ca 0.41 -1.15 -0.04 0.00 0.00 0.00 0.00 61.98 61.20 2wof s VAL 154 Cb -0.19 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 2wof s VAL 154 CO 0.21 -0.00 -0.04 -0.63 0.00 0.00 0.00 175.10 174.64 2wof s ILE 155 N 1.39 3.58 0.08 2.22 1.01 -0.19 0.27 121.20 129.56 2wof s ILE 155 Ca -0.04 -0.44 0.10 0.00 0.00 0.00 0.00 60.65 60.27 2wof s ILE 155 Cb -0.18 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 2wof s ILE 155 CO -0.07 0.44 -0.26 -0.04 0.00 0.00 0.00 174.94 175.02 2wof s MET 156 N 1.08 1.64 -0.32 2.79 -1.94 -0.03 -1.82 119.30 120.70 2wof s MET 156 Ca 0.01 -1.21 -0.02 0.00 -1.71 0.00 0.00 55.69 52.76 2wof s MET 156 Cb -0.15 -1.96 0.06 0.00 2.01 0.00 0.00 34.83 34.79 2wof s MET 156 CO 0.00 0.49 0.03 -1.17 -0.01 0.00 0.00 175.02 174.36 2wof s LEU 157 N -1.64 4.10 -0.75 -0.03 2.96 0.12 -1.09 118.68 122.35 2wof s LEU 157 Ca 0.13 -1.39 -0.16 0.00 -0.22 0.00 0.00 54.13 52.49 2wof s LEU 157 Cb -0.10 -1.73 0.17 0.00 0.50 0.00 0.00 46.19 45.03 2wof s LEU 157 CO 0.04 -0.30 0.77 -0.62 -1.32 0.00 0.00 176.35 174.92 2wof s ASP 158 N 1.32 6.53 1.53 3.68 -1.08 0.22 -1.17 116.67 127.70 2wof s ASP 158 Ca -0.03 -2.19 0.00 0.00 -0.52 0.00 0.00 52.55 49.81 2wof s ASP 158 Cb -0.20 -2.26 0.00 0.00 -1.46 0.00 0.00 42.92 39.00 2wof s ASP 158 CO -0.02 -0.81 0.00 0.61 0.52 0.00 0.00 175.17 175.48 2wof n GLY 159 N 4.70 1.66 1.00 2.66 0.00 -1.26 -1.39 105.19 112.54 2wof n GLY 159 Ca 0.06 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.27 2wof n GLY 159 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wof n LYS 160 N 1.21 2.35 -3.99 1.61 2.85 -1.26 -5.01 118.16 115.91 2wof n LYS 160 Ca 0.00 -1.99 -0.35 0.00 -1.05 0.00 0.00 58.31 54.93 2wof n LYS 160 Cb 0.00 -1.48 -0.06 0.00 -0.65 0.00 0.00 35.03 32.84 2wof n LYS 160 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 2wof s HIS 161 N -1.80 3.46 -0.18 5.58 3.76 -0.49 -4.48 115.29 121.14 2wof s HIS 161 Ca 0.33 0.36 -0.11 0.00 -0.15 0.00 0.00 55.06 55.49 2wof s HIS 161 Cb 0.21 -1.84 -0.05 0.00 1.11 0.00 0.00 32.58 32.01 2wof s HIS 161 CO 0.31 0.64 0.17 0.42 -0.85 0.00 0.00 174.74 175.43 2wof s ILE 162 N -1.15 5.39 -0.05 0.60 -1.09 -1.26 0.69 121.20 124.34 2wof s ILE 162 Ca 0.21 0.28 0.04 0.00 -2.23 0.00 0.00 60.65 58.95 2wof s ILE 162 Cb -0.12 -3.50 -0.00 0.00 -1.58 0.00 0.00 42.46 37.26 2wof s ILE 162 CO 0.11 0.46 -0.18 -0.63 -1.23 0.00 0.00 174.94 173.47 2wof s ILE 163 N 0.17 1.49 -0.29 2.92 1.09 -0.25 -0.85 121.20 125.49 2wof s ILE 163 Ca 0.11 -0.74 -0.11 0.00 -1.10 0.00 0.00 60.65 58.81 2wof s ILE 163 Cb -0.12 -1.29 -0.04 0.00 -1.06 0.00 0.00 42.46 39.95 2wof s ILE 163 CO 0.00 0.43 0.19 -1.61 -0.10 0.00 0.00 174.94 173.85 2wof s GLU 164 N 0.15 3.86 0.01 2.79 2.02 0.70 -0.85 118.70 127.38 2wof s GLU 164 Ca -0.07 -0.38 0.06 0.00 0.02 0.00 0.00 54.97 54.59 2wof s GLU 164 Cb -0.13 -3.66 -0.03 0.00 0.10 0.00 0.00 34.13 30.41 2wof s GLU 164 CO 0.03 -0.22 -0.15 0.00 0.02 0.00 0.00 175.26 174.94 2wof s ALA 165 N 1.74 2.67 -0.07 5.21 0.00 0.14 -0.85 121.76 130.61 2wof s ALA 165 Ca 0.07 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.95 2wof s ALA 165 Cb -0.16 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.07 2wof s ALA 165 CO 0.10 0.57 -0.12 0.08 0.00 0.00 0.00 175.76 176.40 2wof s VAL 166 N -0.88 3.28 0.12 0.00 1.01 -0.75 0.84 120.40 124.02 2wof s VAL 166 Ca 0.14 -0.63 0.08 0.00 0.00 0.00 0.00 61.98 61.57 2wof s VAL 166 Cb -0.11 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 2wof s VAL 166 CO 0.04 0.59 -0.19 0.68 0.00 0.00 0.00 175.10 176.22 2wof s VAL 167 N -0.63 1.66 -0.29 2.92 -7.23 -0.60 -1.41 120.40 114.83 2wof s VAL 167 Ca 0.09 -1.63 -0.09 0.00 -1.81 0.00 0.00 61.98 58.55 2wof s VAL 167 Cb -0.11 -1.59 -0.02 0.00 0.56 0.00 0.00 36.38 35.22 2wof s VAL 167 CO 0.01 -0.16 0.12 -0.62 -0.31 0.00 0.00 175.10 174.14 2wof s ASP 168 N -2.12 5.43 -0.02 4.85 -1.08 0.35 -1.83 116.67 122.23 2wof s ASP 168 Ca 0.08 -0.38 0.03 0.00 -0.52 0.00 0.00 52.55 51.77 2wof s ASP 168 Cb -0.09 -1.98 -0.25 0.00 -1.46 0.00 0.00 42.92 39.15 2wof s ASP 168 CO 0.05 -0.13 0.75 -0.07 0.52 0.00 0.00 175.17 176.29 2wof h LEU 169 N 8.31 0.21 -1.03 -1.34 3.38 -1.24 -1.60 115.31 121.99 2wof h LEU 169 Ca -0.35 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.28 2wof h LEU 169 Cb 1.16 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.79 2wof h LEU 169 CO 0.59 1.31 0.65 -0.61 0.09 0.00 0.00 178.44 180.48 2wof h GLN 170 N 0.04 1.30 -0.50 1.13 4.15 -1.91 -3.08 115.11 116.23 2wof h GLN 170 Ca -0.26 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.08 2wof h GLN 170 Cb 1.99 -0.29 0.00 0.00 0.21 0.00 0.00 27.48 29.39 2wof h GLN 170 CO 0.12 0.86 0.00 0.09 -1.93 0.00 0.00 178.83 177.96 2wof n ASN 171 N -4.39 3.56 -3.71 -0.69 3.02 -1.24 -4.98 115.26 106.84 2wof n ASN 171 Ca 0.12 -2.14 -0.28 0.00 -0.03 0.00 0.00 54.58 52.25 2wof n ASN 171 Cb 0.02 -0.38 -0.02 0.00 -0.61 0.00 0.00 39.78 38.78 2wof n ASN 171 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2wof n ASN 172 N 0.86 -3.01 -4.44 6.41 5.15 -0.65 -4.95 115.26 114.64 2wof n ASN 172 Ca 0.18 -0.61 -0.27 0.00 -0.60 0.00 0.00 54.58 53.28 2wof n ASN 172 Cb 0.58 -2.51 -0.12 0.00 -0.53 0.00 0.00 39.78 37.20 2wof n ASN 172 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 2wof s LYS 173 N -6.37 1.56 -0.05 1.20 -2.85 -0.89 -4.98 119.74 107.36 2wof s LYS 173 Ca 0.53 -1.50 -0.27 0.00 -1.00 0.00 0.00 55.97 53.73 2wof s LYS 173 Cb -0.29 -1.88 -0.03 0.00 -2.06 0.00 0.00 37.83 33.58 2wof s LYS 173 CO 0.65 0.40 0.88 -1.17 0.10 0.00 0.00 175.35 176.22 2wof s LEU 174 N -2.66 4.31 -0.19 2.77 2.96 -1.26 -0.50 118.68 124.12 2wof s LEU 174 Ca 0.21 1.44 0.16 0.00 -0.22 0.00 0.00 54.13 55.72 2wof s LEU 174 Cb -0.08 -3.38 -0.23 0.00 0.50 0.00 0.00 46.19 43.00 2wof s LEU 174 CO 0.10 -0.26 0.06 0.18 -1.32 0.00 0.00 176.35 175.12 2wof n LEU 175 N 4.17 0.04 -3.49 -0.68 4.77 -0.50 -4.92 117.00 116.39 2wof n LEU 175 Ca 0.04 -0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.92 2wof n LEU 175 Cb 0.51 0.45 -0.02 0.00 -2.33 0.00 0.00 43.42 42.02 2wof n LEU 175 CO 0.50 0.47 0.61 -0.94 -1.33 0.00 0.00 177.39 176.70 2wof s SER 176 N -5.31 -0.42 -0.36 -1.43 1.04 -1.09 -4.95 113.70 101.18 2wof s SER 176 Ca -0.09 0.03 0.04 0.00 0.48 0.00 0.00 55.95 56.41 2wof s SER 176 Cb 0.06 0.44 0.16 0.00 0.10 0.00 0.00 66.02 66.78 2wof s SER 176 CO 0.76 -0.70 0.44 0.86 0.98 0.00 0.00 173.24 175.58 2wof s TRP 177 N -3.15 -0.75 -0.26 5.02 -0.11 -1.26 -1.81 118.94 116.62 2wof s TRP 177 Ca 0.03 -0.35 0.02 0.00 1.22 0.00 0.00 56.10 57.02 2wof s TRP 177 Cb -0.01 -0.20 0.07 0.00 -1.50 0.00 0.00 33.47 31.82 2wof s TRP 177 CO -0.09 -1.02 -0.07 -1.14 -4.62 0.00 0.00 176.95 170.01 2wof s GLN 178 N 1.76 1.94 0.48 5.86 2.00 -0.03 -4.95 119.66 126.72 2wof s GLN 178 Ca 0.15 -1.31 -0.24 0.00 -2.00 0.00 0.00 55.36 51.96 2wof s GLN 178 Cb -0.12 -2.83 -0.07 0.00 0.80 0.00 0.00 33.01 30.79 2wof s GLN 178 CO -0.10 -0.63 1.40 -2.14 -0.50 0.00 0.00 175.29 173.31 2wof s PRO 179 N 1.17 3.52 -0.30 1.67 0.02 -1.26 -0.21 135.00 139.60 2wof s PRO 179 Ca -0.05 2.34 0.03 0.00 0.02 0.00 0.00 61.00 63.34 2wof s PRO 179 Cb -0.19 -2.52 0.08 0.00 0.02 0.00 0.00 34.50 31.88 2wof s PRO 179 CO -0.06 -0.93 -0.03 0.42 -0.33 0.00 0.00 177.00 176.07 2wof s ILE 180 N -1.24 2.20 0.21 2.83 -1.09 -0.03 -4.87 121.20 119.22 2wof s ILE 180 Ca 0.64 -1.98 -0.32 0.00 -2.23 0.00 0.00 60.65 56.77 2wof s ILE 180 Cb -0.42 -2.47 -0.12 0.00 -1.58 0.00 0.00 42.46 37.87 2wof s ILE 180 CO 0.53 -0.31 1.70 1.17 -1.23 0.00 0.00 174.94 176.80 2wof n LYS 181 N 4.35 2.72 0.00 2.79 4.81 -1.26 -3.25 118.16 128.33 2wof n LYS 181 Ca -0.05 0.98 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 2wof n LYS 181 Cb 0.42 -2.81 0.00 0.00 0.02 0.00 0.00 35.03 32.66 2wof n LYS 181 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2wof n ASP 182 N 3.72 0.00 -4.74 3.14 8.00 -1.26 -4.98 116.55 120.43 2wof n ASP 182 Ca 0.15 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.24 2wof n ASP 182 Cb 0.35 -0.12 -0.02 0.00 -0.02 0.00 0.00 41.12 41.30 2wof n ASP 182 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wof s ALA 183 N -1.15 3.70 0.10 2.24 0.00 -1.20 -5.03 121.76 120.42 2wof s ALA 183 Ca 0.00 1.45 -0.06 0.00 0.00 0.00 0.00 51.96 53.35 2wof s ALA 183 Cb 0.00 -3.61 -0.05 0.00 0.00 0.00 0.00 23.12 19.46 2wof s ALA 183 CO 0.00 -0.86 0.35 -1.01 0.00 0.00 0.00 175.76 174.24 2wof s HIS 184 N 0.10 3.52 0.52 0.00 3.76 -1.26 -4.48 115.29 117.45 2wof s HIS 184 Ca 0.62 0.59 -0.06 0.00 -0.15 0.00 0.00 55.06 56.06 2wof s HIS 184 Cb -0.45 -2.02 -0.03 0.00 1.11 0.00 0.00 32.58 31.19 2wof s HIS 184 CO 0.44 0.50 0.85 0.20 -0.85 0.00 0.00 174.74 175.88 2wof s GLY 185 N -2.15 1.54 1.08 -2.22 0.00 -1.26 -4.59 107.32 99.72 2wof s GLY 185 Ca 0.36 -0.44 -0.12 0.00 0.00 0.00 0.00 44.72 44.52 2wof s GLY 185 CO 0.22 -0.24 1.06 -3.16 0.00 0.00 0.00 173.10 170.97 2wof s MET 186 N -4.86 -0.27 0.04 2.90 0.23 -1.26 -4.90 119.30 111.17 2wof s MET 186 Ca 0.50 0.97 -0.30 0.00 -1.03 0.00 0.00 55.69 55.82 2wof s MET 186 Cb -0.10 -1.62 -0.05 0.00 -1.53 0.00 0.00 34.83 31.52 2wof s MET 186 CO 0.47 -3.33 1.23 0.08 -2.03 0.00 0.00 175.02 171.44 2wof s VAL 187 N -2.57 3.99 0.25 5.16 1.01 0.17 -5.03 120.40 123.38 2wof s VAL 187 Ca 0.67 1.41 0.08 0.00 0.00 0.00 0.00 61.98 64.14 2wof s VAL 187 Cb -0.24 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 2wof s VAL 187 CO 0.62 0.08 0.11 -0.76 0.00 0.00 0.00 175.10 175.15 2wof s LEU 188 N 1.42 3.57 0.38 3.92 1.43 -1.26 -4.60 118.68 123.53 2wof s LEU 188 Ca 0.59 -0.40 0.09 0.00 -1.03 0.00 0.00 54.13 53.39 2wof s LEU 188 Cb -0.29 -2.10 0.85 0.00 0.03 0.00 0.00 46.19 44.67 2wof s LEU 188 CO 0.28 -0.01 1.94 0.25 0.23 0.00 0.00 176.35 179.03 2wof h LEU 189 N 1.72 0.58 -1.17 1.79 5.85 -1.96 0.54 115.31 122.66 2wof h LEU 189 Ca -0.47 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.27 2wof h LEU 189 Cb 1.24 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.16 2wof h LEU 189 CO 0.61 0.34 0.00 -2.24 -0.34 0.00 0.00 178.44 176.81 2wof h ASP 190 N 0.64 0.00 -0.29 1.25 2.03 -2.01 -2.60 116.42 115.43 2wof h ASP 190 Ca 0.34 0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 56.55 2wof h ASP 190 Cb 0.49 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.97 2wof h ASP 190 CO -0.12 0.00 -0.12 0.44 -1.03 0.00 0.00 179.24 178.40 2wof h ASP 191 N 0.00 0.71 -0.55 4.15 3.32 -1.28 -0.59 116.42 122.17 2wof h ASP 191 Ca 0.00 -0.21 0.01 0.00 0.02 0.00 0.00 57.03 56.85 2wof h ASP 191 Cb 0.45 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 2wof h ASP 191 CO 0.00 0.85 0.36 -0.26 -1.72 0.00 0.00 179.24 178.47 2wof h PHE 192 N 0.65 0.68 -0.24 4.55 -1.00 -1.55 0.18 116.94 120.21 2wof h PHE 192 Ca 0.11 0.02 -0.20 0.00 2.81 0.00 0.00 57.97 60.71 2wof h PHE 192 Cb 0.58 -0.23 0.00 0.00 3.61 0.00 0.00 35.95 39.92 2wof h PHE 192 CO 0.03 0.42 -0.64 0.00 -1.61 0.00 0.00 178.31 176.51 2wof h ALA 193 N 1.21 0.40 -0.41 2.45 0.00 -1.57 -2.65 119.26 118.70 2wof h ALA 193 Ca 0.21 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2wof h ALA 193 Cb -0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2wof h ALA 193 CO -0.06 0.68 0.18 1.03 0.00 0.00 0.00 179.25 181.08 2wof h SER 194 N 0.63 0.55 -0.74 0.00 0.87 -0.75 -1.45 113.55 112.66 2wof h SER 194 Ca -0.01 -0.15 0.03 0.00 -1.23 0.00 0.00 61.79 60.43 2wof h SER 194 Cb 1.25 -0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 63.03 2wof h SER 194 CO 0.14 0.55 0.47 0.58 -0.53 0.00 0.00 176.83 178.04 2wof h VAL 195 N 0.51 1.10 -0.24 2.23 2.07 -0.60 -1.42 116.25 119.89 2wof h VAL 195 Ca 0.14 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.28 2wof h VAL 195 Cb 0.16 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 2wof h VAL 195 CO -0.01 0.17 -0.13 -0.61 0.02 0.00 0.00 177.57 177.00 2wof h GLN 196 N 0.91 0.41 0.02 1.57 5.75 -1.08 -2.27 115.11 120.41 2wof h GLN 196 Ca 0.30 -0.11 -0.00 0.00 -0.15 0.00 0.00 58.65 58.69 2wof h GLN 196 Cb 0.03 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.53 2wof h GLN 196 CO -0.12 0.54 -0.01 -0.97 -2.65 0.00 0.00 178.83 175.63 2wof h ASN 197 N 0.38 -0.02 -0.79 -0.69 -1.24 -1.09 -1.35 115.58 110.78 2wof h ASN 197 Ca 0.07 -0.57 0.11 0.00 0.71 0.00 0.00 56.30 56.62 2wof h ASN 197 Cb 0.46 0.01 -0.08 0.00 0.73 0.00 0.00 38.32 39.44 2wof h ASN 197 CO 0.03 0.56 0.42 0.40 -1.29 0.00 0.00 177.43 177.55 2wof h ILE 198 N -0.62 0.85 -0.44 2.57 2.04 -1.17 -1.44 117.51 119.30 2wof h ILE 198 Ca -0.00 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.55 2wof h ILE 198 Cb 0.59 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 2wof h ILE 198 CO 0.00 0.13 -0.00 0.40 0.00 0.00 0.00 178.15 178.67 2wof h ILE 199 N 0.69 1.26 0.00 -0.67 5.03 -1.38 -2.48 117.51 119.96 2wof h ILE 199 Ca 0.40 -1.04 -0.01 0.00 -0.12 0.00 0.00 64.86 64.08 2wof h ILE 199 Cb 0.43 1.07 -0.00 0.00 -3.03 0.00 0.00 36.82 35.29 2wof h ILE 199 CO -0.28 0.36 -0.06 0.78 -0.68 0.00 0.00 178.15 178.27 2wof h ASN 200 N 0.61 0.00 -0.13 1.72 4.21 -0.76 -2.25 115.58 118.98 2wof h ASN 200 Ca 0.12 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.63 2wof h ASN 200 Cb 0.50 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.70 2wof h ASN 200 CO 0.02 0.06 0.00 0.59 -1.29 0.00 0.00 177.43 176.81 2wof n ASN 201 N -4.30 2.38 -4.58 5.81 5.03 -0.59 -4.89 115.26 114.11 2wof n ASN 201 Ca -0.03 -1.79 -0.41 0.00 0.87 0.00 0.00 54.58 53.22 2wof n ASN 201 Cb 0.14 -0.08 -0.08 0.00 -1.02 0.00 0.00 39.78 38.74 2wof n ASN 201 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2wof s SER 202 N -1.79 6.36 0.14 6.41 0.15 -0.85 -4.94 113.70 119.18 2wof s SER 202 Ca 0.34 0.21 -0.09 0.00 0.70 0.00 0.00 55.95 57.10 2wof s SER 202 Cb 0.20 -2.27 -0.03 0.00 -1.71 0.00 0.00 66.02 62.21 2wof s SER 202 CO 0.30 -0.39 1.44 1.05 1.20 0.00 0.00 173.24 176.85 2wof h GLU 203 N 8.28 0.83 0.43 5.44 9.09 -1.90 -1.48 114.58 135.26 2wof h GLU 203 Ca -0.28 -0.50 -0.02 0.00 0.05 0.00 0.00 59.36 58.61 2wof h GLU 203 Cb 1.13 0.05 -0.00 0.00 -1.65 0.00 0.00 28.75 28.28 2wof h GLU 203 CO 0.74 1.13 -0.24 0.93 0.05 0.00 0.00 179.01 181.63 2wof h GLU 204 N 0.64 -0.61 -0.73 1.06 5.08 -1.96 -0.37 114.58 117.70 2wof h GLU 204 Ca 0.02 0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.49 2wof h GLU 204 Cb 1.10 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 30.43 2wof h GLU 204 CO 0.11 -0.40 0.41 0.35 -1.00 0.00 0.00 179.01 178.48 2wof h PHE 205 N -0.63 0.76 -0.51 4.33 3.04 -1.88 0.41 116.94 122.46 2wof h PHE 205 Ca -0.05 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.90 2wof h PHE 205 Cb 0.50 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.76 2wof h PHE 205 CO -0.08 0.35 0.23 0.00 -2.02 0.00 0.00 178.31 176.79 2wof h ALA 206 N 1.38 1.45 -0.23 2.41 0.00 -1.07 0.19 119.26 123.38 2wof h ALA 206 Ca 0.33 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 2wof h ALA 206 Cb 0.22 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2wof h ALA 206 CO -0.19 0.43 -0.17 0.00 0.00 0.00 0.00 179.25 179.32 2wof h ALA 207 N 1.54 0.33 -0.19 0.00 0.00 0.20 -0.78 119.26 120.36 2wof h ALA 207 Ca 0.18 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.79 2wof h ALA 207 Cb 0.10 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2wof h ALA 207 CO -0.02 0.24 -0.06 0.00 0.00 0.00 0.00 179.25 179.41 2wof h ALA 208 N 0.69 0.11 -0.62 0.00 0.00 0.36 -1.32 119.26 118.47 2wof h ALA 208 Ca 0.04 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2wof h ALA 208 Cb 0.70 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2wof h ALA 208 CO 0.05 -0.49 0.41 0.28 0.00 0.00 0.00 179.25 179.50 2wof h VAL 209 N -0.02 1.12 -0.39 0.00 2.07 -0.64 -2.89 116.25 115.50 2wof h VAL 209 Ca 0.09 -0.27 -0.14 0.00 0.82 0.00 0.00 66.70 67.21 2wof h VAL 209 Cb 0.16 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 2wof h VAL 209 CO -0.20 0.14 -0.28 0.50 0.02 0.00 0.00 177.57 177.75 2wof h LYS 210 N 0.79 0.88 0.00 1.57 3.64 -0.02 -2.27 116.57 121.17 2wof h LYS 210 Ca 0.24 -0.43 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 2wof h LYS 210 Cb -0.01 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2wof h LYS 210 CO -0.06 1.08 0.00 0.36 -2.27 0.00 0.00 179.45 178.56 2wof n LYS 211 N -4.15 0.15 -0.75 1.90 0.00 -0.81 -1.94 118.16 112.55 2wof n LYS 211 Ca -0.02 0.40 -0.08 0.00 -0.00 0.00 0.00 58.31 58.61 2wof n LYS 211 Cb 0.49 -1.79 0.18 0.00 -0.00 0.00 0.00 35.03 33.91 2wof n LYS 211 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2wof n ARG 212 N -2.07 2.56 0.00 -1.58 1.74 -0.89 -4.88 116.66 111.54 2wof n ARG 212 Ca 0.02 -2.09 0.00 0.00 -0.77 0.00 0.00 57.85 55.01 2wof n ARG 212 Cb 0.20 -1.89 0.00 0.00 -1.02 0.00 0.00 32.46 29.75 2wof n ARG 212 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wof n GLY 213 N -0.22 3.11 3.66 -0.13 0.00 -0.82 -4.66 105.19 106.13 2wof n GLY 213 Ca 0.32 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.92 2wof n GLY 213 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wof s ILE 214 N -2.04 3.79 -0.07 -0.61 1.09 -1.00 -4.87 121.20 117.48 2wof s ILE 214 Ca 0.00 0.95 0.02 0.00 -1.10 0.00 0.00 60.65 60.53 2wof s ILE 214 Cb 0.00 -3.63 -0.25 0.00 -1.06 0.00 0.00 42.46 37.52 2wof s ILE 214 CO 0.00 -0.10 0.55 0.71 -0.10 0.00 0.00 174.94 176.01 2wof h THR 215 N 5.58 0.78 -3.53 2.92 1.35 -1.88 -3.36 112.91 114.78 2wof h THR 215 Ca -0.35 -2.55 -0.72 0.00 -0.55 0.00 0.00 66.41 62.23 2wof h THR 215 Cb 1.15 2.50 -0.32 0.00 -1.73 0.00 0.00 68.15 69.75 2wof h THR 215 CO 0.96 0.71 -0.29 -0.62 -0.25 0.00 0.00 175.52 176.03 2wof s ASP 216 N -6.61 5.68 0.64 5.36 2.15 -1.26 -4.95 116.67 117.68 2wof s ASP 216 Ca -0.13 -2.51 0.26 0.00 0.43 0.00 0.00 52.55 50.60 2wof s ASP 216 Cb 0.07 -1.97 1.32 0.00 -0.30 0.00 0.00 42.92 42.05 2wof s ASP 216 CO 0.80 -0.51 1.75 0.00 -0.17 0.00 0.00 175.17 177.04 2wof h ALA 217 N 7.64 1.82 0.00 3.66 0.00 -1.93 -1.05 119.26 129.41 2wof h ALA 217 Ca -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2wof h ALA 217 Cb 1.01 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2wof h ALA 217 CO 0.76 -0.65 -0.13 0.87 0.00 0.00 0.00 179.25 180.10 2wof h LYS 218 N 0.00 0.00 -0.17 0.00 1.57 -1.99 -2.41 116.57 113.57 2wof h LYS 218 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2wof h LYS 218 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2wof h LYS 218 CO -0.00 0.13 0.00 1.63 -0.57 0.00 0.00 179.45 180.64 2wof n LYS 219 N -3.24 0.89 -3.53 3.15 5.02 -0.40 -4.86 118.16 115.20 2wof n LYS 219 Ca 0.01 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.92 2wof n LYS 219 Cb 0.41 -1.09 -0.10 0.00 -0.02 0.00 0.00 35.03 34.24 2wof n LYS 219 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wof s VAL 220 N -1.81 5.27 -0.21 -0.18 1.01 -0.91 -0.58 120.40 123.00 2wof s VAL 220 Ca 0.00 0.35 -0.09 0.00 0.00 0.00 0.00 61.98 62.24 2wof s VAL 220 Cb 0.00 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 2wof s VAL 220 CO 0.00 0.25 0.11 -0.63 0.00 0.00 0.00 175.10 174.83 2wof s ILE 221 N 1.58 5.00 0.31 2.22 1.09 0.38 -4.95 121.20 126.83 2wof s ILE 221 Ca 0.11 0.05 0.07 0.00 -1.10 0.00 0.00 60.65 59.77 2wof s ILE 221 Cb -0.15 -3.30 -0.02 0.00 -1.06 0.00 0.00 42.46 37.93 2wof s ILE 221 CO 0.08 0.40 0.36 0.42 -0.10 0.00 0.00 174.94 176.11 2wof s THR 222 N 0.76 4.16 -0.05 2.92 -4.23 -1.26 -1.40 115.64 116.54 2wof s THR 222 Ca 0.05 -1.16 -0.11 0.00 -1.18 0.00 0.00 61.69 59.30 2wof s THR 222 Cb -0.13 -3.42 0.02 0.00 1.34 0.00 0.00 72.50 70.31 2wof s THR 222 CO 0.02 -0.22 0.25 0.28 -0.54 0.00 0.00 174.62 174.42 2wof s THR 223 N -2.18 0.04 -0.15 3.99 -1.32 -0.78 -4.99 115.64 110.25 2wof s THR 223 Ca 0.40 -0.29 -0.08 0.00 -1.21 0.00 0.00 61.69 60.52 2wof s THR 223 Cb -0.08 -0.46 -0.04 0.00 -1.51 0.00 0.00 72.50 70.40 2wof s THR 223 CO 0.29 -0.16 0.13 -2.16 -2.21 0.00 0.00 174.62 170.50 2wof s PRO 224 N -0.62 3.68 0.08 7.08 0.04 -1.26 -2.51 135.00 141.49 2wof s PRO 224 Ca -0.07 -0.18 0.05 0.00 0.04 0.00 0.00 61.00 60.84 2wof s PRO 224 Cb -0.04 -3.25 -0.03 0.00 0.04 0.00 0.00 34.50 31.22 2wof s PRO 224 CO 0.02 0.60 -0.13 -0.51 0.04 0.00 0.00 177.00 177.02 2wof s LEU 225 N -0.52 2.32 0.68 -3.56 1.43 0.35 -4.97 118.68 114.40 2wof s LEU 225 Ca 0.12 -0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 52.43 2wof s LEU 225 Cb -0.12 -0.48 0.00 0.00 0.03 0.00 0.00 46.19 45.62 2wof s LEU 225 CO 0.02 -0.12 1.06 0.42 0.23 0.00 0.00 176.35 177.96 2wof s THR 226 N -1.59 3.92 -0.05 5.49 -4.23 -1.26 -1.07 115.64 116.86 2wof s THR 226 Ca 0.01 0.69 0.21 0.00 -1.18 0.00 0.00 61.69 61.42 2wof s THR 226 Cb -0.08 -3.36 -0.32 0.00 1.34 0.00 0.00 72.50 70.08 2wof s THR 226 CO 0.02 -0.75 0.42 1.33 -0.54 0.00 0.00 174.62 175.10 2wof n VAL 227 N -2.89 0.16 -3.80 2.29 0.24 -1.26 -4.71 118.33 108.35 2wof n VAL 227 Ca 0.08 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 2wof n VAL 227 Cb 0.53 -0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.85 2wof n VAL 227 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wof n GLY 228 N 1.34 -0.89 3.17 7.63 0.00 -1.26 -4.84 105.19 110.34 2wof n GLY 228 Ca -0.07 -1.24 -0.11 0.00 0.00 0.00 0.00 46.02 44.60 2wof n GLY 228 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2wof s TYR 229 N 0.00 -0.61 -0.12 1.61 5.04 -1.26 -4.38 117.35 117.63 2wof s TYR 229 Ca 0.00 1.26 0.16 0.00 -2.44 0.00 0.00 57.07 56.05 2wof s TYR 229 Cb 0.00 0.17 0.40 0.00 0.35 0.00 0.00 41.96 42.88 2wof s TYR 229 CO 0.00 -0.40 1.19 1.19 -1.34 0.00 0.00 175.55 176.19 2wof n PHE 230 N 5.12 0.00 -4.19 4.97 3.72 -1.26 -4.66 117.46 121.15 2wof n PHE 230 Ca -0.11 -1.06 -0.36 0.00 -0.05 0.00 0.00 57.45 55.87 2wof n PHE 230 Cb 0.51 -0.20 -0.03 0.00 -0.94 0.00 0.00 39.48 38.81 2wof n PHE 230 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2wof n ASP 231 N -0.52 -3.17 0.00 4.37 2.03 -1.26 -1.14 116.55 116.86 2wof n ASP 231 Ca 0.13 -0.98 0.00 0.00 0.52 0.00 0.00 54.79 54.46 2wof n ASP 231 Cb 0.85 -2.61 0.00 0.00 -0.72 0.00 0.00 41.12 38.64 2wof n ASP 231 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2wof n GLY 232 N -1.32 2.07 0.29 0.27 0.00 -1.26 -4.91 105.19 100.33 2wof n GLY 232 Ca 0.08 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.26 2wof n GLY 232 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wof h LYS 233 N 2.81 0.00 -0.00 1.61 1.57 -1.52 0.17 116.57 121.21 2wof h LYS 233 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wof h LYS 233 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2wof h LYS 233 CO 0.00 0.06 -0.10 -0.40 -0.57 0.00 0.00 179.45 178.44 2wof n ASP 234 N -3.42 0.29 -2.45 0.86 5.75 -1.26 -4.95 116.55 111.38 2wof n ASP 234 Ca -0.02 -0.32 -0.10 0.00 -0.01 0.00 0.00 54.79 54.34 2wof n ASP 234 Cb 0.19 -0.15 0.05 0.00 -1.03 0.00 0.00 41.12 40.19 2wof n ASP 234 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wof n GLY 235 N 1.32 -0.05 2.81 6.12 0.00 0.58 -5.04 105.19 110.93 2wof n GLY 235 Ca 0.13 -0.12 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 2wof n GLY 235 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wof s LEU 236 N -4.58 0.58 0.37 0.99 1.43 -1.26 -5.12 118.68 111.09 2wof s LEU 236 Ca 0.01 0.18 -0.27 0.00 -1.03 0.00 0.00 54.13 53.03 2wof s LEU 236 Cb -0.00 0.11 -0.09 0.00 0.03 0.00 0.00 46.19 46.24 2wof s LEU 236 CO 0.43 -0.18 1.19 -1.59 0.23 0.00 0.00 176.35 176.43 2wof s LYS 237 N 1.53 4.20 0.50 1.70 -2.85 -1.26 -4.70 119.74 118.86 2wof s LYS 237 Ca -0.04 1.92 0.29 0.00 -1.00 0.00 0.00 55.97 57.13 2wof s LYS 237 Cb -0.12 -2.83 1.16 0.00 -2.06 0.00 0.00 37.83 33.98 2wof s LYS 237 CO -0.04 -0.22 1.92 0.37 0.10 0.00 0.00 175.35 177.48 2wof h GLN 238 N 2.96 0.00 -0.00 1.78 5.75 -2.00 -3.28 115.11 120.32 2wof h GLN 238 Ca -0.48 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.02 2wof h GLN 238 Cb 1.23 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.78 2wof h GLN 238 CO 0.64 0.12 -0.93 -0.40 -2.65 0.00 0.00 178.83 175.61 2wof n ASP 239 N -3.28 1.12 -4.83 -0.69 5.68 -1.26 -4.92 116.55 108.38 2wof n ASP 239 Ca 0.00 -1.06 -0.35 0.00 -0.50 0.00 0.00 54.79 52.88 2wof n ASP 239 Cb 0.36 0.94 -0.06 0.00 -1.14 0.00 0.00 41.12 41.22 2wof n ASP 239 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wof s ALA 240 N -2.92 3.46 -0.68 2.12 0.00 -1.24 -5.02 121.76 117.47 2wof s ALA 240 Ca 0.09 0.06 -0.27 0.00 0.00 0.00 0.00 51.96 51.83 2wof s ALA 240 Cb 0.16 -2.72 0.03 0.00 0.00 0.00 0.00 23.12 20.59 2wof s ALA 240 CO 0.83 0.37 1.29 0.50 0.00 0.00 0.00 175.76 178.74 2wof s ARG 241 N -2.09 3.26 0.15 0.00 3.52 -1.26 -5.00 118.95 117.53 2wof s ARG 241 Ca 0.43 -0.04 0.10 0.00 -0.13 0.00 0.00 55.73 56.09 2wof s ARG 241 Cb -0.15 -4.14 -0.04 0.00 -1.56 0.00 0.00 34.95 29.06 2wof s ARG 241 CO 0.20 -2.03 -0.19 -0.51 -0.81 0.00 0.00 175.30 171.96 2wof s LEU 242 N 5.67 2.65 0.03 -0.88 1.43 -1.26 -0.95 118.68 125.37 2wof s LEU 242 Ca 0.39 -0.65 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 2wof s LEU 242 Cb -0.08 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.67 2wof s LEU 242 CO 0.19 0.15 -0.05 -0.76 0.23 0.00 0.00 176.35 176.11 2wof s LEU 243 N -2.38 2.24 0.25 1.79 1.43 -0.57 -4.67 118.68 116.77 2wof s LEU 243 Ca 0.19 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.82 2wof s LEU 243 Cb -0.10 0.00 -0.03 0.00 0.03 0.00 0.00 46.19 46.09 2wof s LEU 243 CO 0.11 -0.26 0.38 -0.54 0.23 0.00 0.00 176.35 176.26 2wof s LYS 244 N -1.49 3.45 -0.07 1.70 1.02 -0.23 -0.29 119.74 123.83 2wof s LYS 244 Ca -0.14 -0.69 -0.01 0.00 0.02 0.00 0.00 55.97 55.15 2wof s LYS 244 Cb -0.10 -2.86 0.03 0.00 -0.52 0.00 0.00 37.83 34.37 2wof s LYS 244 CO -0.00 0.40 -0.02 0.08 -0.92 0.00 0.00 175.35 174.89 2wof s VAL 245 N -2.01 0.50 -0.05 3.17 1.01 0.84 -0.50 120.40 123.36 2wof s VAL 245 Ca 0.35 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.35 2wof s VAL 245 Cb -0.09 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.64 2wof s VAL 245 CO 0.30 0.27 -0.03 -0.63 0.00 0.00 0.00 175.10 175.01 2wof s ILE 246 N 1.74 4.02 0.18 2.22 -1.09 -1.05 -1.93 121.20 125.29 2wof s ILE 246 Ca 0.02 -0.45 0.10 0.00 -2.23 0.00 0.00 60.65 58.09 2wof s ILE 246 Cb -0.13 -2.71 -0.04 0.00 -1.58 0.00 0.00 42.46 38.01 2wof s ILE 246 CO -0.05 0.53 -0.22 -0.44 -1.23 0.00 0.00 174.94 173.54 2wof s SER 247 N -1.07 3.10 0.03 3.58 0.01 -1.26 -1.87 113.70 116.22 2wof s SER 247 Ca 0.15 -0.85 0.00 0.00 1.31 0.00 0.00 55.95 56.56 2wof s SER 247 Cb -0.11 -0.21 -0.02 0.00 0.21 0.00 0.00 66.02 65.88 2wof s SER 247 CO 0.04 0.06 -0.03 -0.31 0.41 0.00 0.00 173.24 173.41 2wof s TYR 248 N -1.77 0.35 -0.14 2.43 1.51 -0.49 -1.24 117.35 118.00 2wof s TYR 248 Ca 0.18 -0.63 -0.16 0.00 -1.01 0.00 0.00 57.07 55.45 2wof s TYR 248 Cb -0.07 -0.25 -0.04 0.00 -0.11 0.00 0.00 41.96 41.49 2wof s TYR 248 CO 0.08 -0.21 0.39 -1.17 -1.11 0.00 0.00 175.55 173.53 2wof s LEU 249 N -1.75 4.25 -0.25 -1.29 2.96 -0.21 -0.47 118.68 121.93 2wof s LEU 249 Ca -0.11 0.66 -0.19 0.00 -0.22 0.00 0.00 54.13 54.27 2wof s LEU 249 Cb -0.07 -2.54 -0.03 0.00 0.50 0.00 0.00 46.19 44.06 2wof s LEU 249 CO -0.03 0.04 0.55 -0.62 -1.32 0.00 0.00 176.35 174.98 2wof s ASP 250 N 0.58 6.50 0.00 3.68 2.15 0.25 -4.62 116.67 125.21 2wof s ASP 250 Ca 0.21 0.61 0.05 0.00 0.43 0.00 0.00 52.55 53.85 2wof s ASP 250 Cb -0.14 -2.30 0.04 0.00 -0.30 0.00 0.00 42.92 40.22 2wof s ASP 250 CO 0.07 -0.29 0.67 0.52 -0.17 0.00 0.00 175.17 175.97 2wof n VAL 251 N 5.05 0.03 -0.48 1.11 0.31 -1.26 -4.93 118.33 118.17 2wof n VAL 251 Ca -0.03 -0.52 0.00 0.00 -0.01 0.00 0.00 64.34 63.78 2wof n VAL 251 Cb 0.50 1.08 0.00 0.00 -0.91 0.00 0.00 33.84 34.51 2wof n VAL 251 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wof n GLY 252 N 0.27 0.78 0.53 2.92 0.00 -1.26 -4.93 105.19 103.49 2wof n GLY 252 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.17 2wof n GLY 252 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2wof n ASP 253 N 0.00 1.60 0.00 1.61 5.68 -1.26 -4.90 116.55 119.28 2wof n ASP 253 Ca 0.00 -1.63 0.00 0.00 -0.50 0.00 0.00 54.79 52.66 2wof n ASP 253 Cb 0.00 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 39.91 2wof n ASP 253 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wof n GLY 254 N 1.15 0.36 2.31 6.12 0.00 -1.26 -3.98 105.19 109.89 2wof n GLY 254 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 2wof n GLY 254 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wof n ASN 255 N -0.30 1.79 0.31 1.61 5.15 -1.26 -4.88 115.26 117.67 2wof n ASN 255 Ca 0.00 -3.04 0.18 0.00 -0.60 0.00 0.00 54.58 51.11 2wof n ASN 255 Cb 0.15 -0.65 1.02 0.00 -0.53 0.00 0.00 39.78 39.77 2wof n ASN 255 CO 0.00 0.00 0.00 0.10 1.40 0.00 0.00 177.26 178.76 2wof h TYR 256 N 3.98 0.00 0.00 1.20 -0.00 -1.92 -0.54 116.97 119.69 2wof h TYR 256 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.85 2wof h TYR 256 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.51 2wof h TYR 256 CO 0.53 0.00 0.01 -1.49 -0.00 0.00 0.00 178.16 177.21 2wof h TRP 257 N 0.00 0.00 -0.35 0.10 4.06 -1.92 0.97 115.95 118.81 2wof h TRP 257 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2wof h TRP 257 Cb 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.18 2wof h TRP 257 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 2wof n ALA 258 N -2.01 2.49 -3.18 1.49 0.00 -0.21 -4.39 120.51 114.71 2wof n ALA 258 Ca -0.03 -0.65 -0.19 0.00 0.00 0.00 0.00 53.44 52.58 2wof n ALA 258 Cb 0.08 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.52 2wof n ALA 258 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2wof n HIS 259 N 0.53 0.39 -1.99 0.00 8.25 0.33 -4.70 115.22 118.02 2wof n HIS 259 Ca 0.12 -3.82 -0.38 0.00 -0.26 0.00 0.00 57.72 53.38 2wof n HIS 259 Cb 0.33 -0.42 0.02 0.00 1.12 0.00 0.00 29.99 31.04 2wof n HIS 259 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2wof s PRO 260 N -2.44 3.42 -0.61 -0.41 0.04 -1.26 -1.04 135.00 132.69 2wof s PRO 260 Ca 0.40 2.03 -0.12 0.00 0.04 0.00 0.00 61.00 63.35 2wof s PRO 260 Cb 0.34 -2.33 0.15 0.00 0.04 0.00 0.00 34.50 32.71 2wof s PRO 260 CO -0.08 -0.90 0.52 0.42 0.04 0.00 0.00 177.00 177.00 2wof s ILE 261 N -1.41 4.91 0.33 0.56 1.01 -0.37 -4.32 121.20 121.91 2wof s ILE 261 Ca 0.68 -1.97 -0.23 0.00 0.00 0.00 0.00 60.65 59.13 2wof s ILE 261 Cb -0.35 -4.14 -0.10 0.00 0.01 0.00 0.00 42.46 37.88 2wof s ILE 261 CO 0.42 -0.89 0.89 -0.70 0.00 0.00 0.00 174.94 174.66 2wof s GLU 262 N 1.00 4.40 -0.88 2.79 2.56 -1.26 -3.80 118.70 123.51 2wof s GLU 262 Ca 0.09 1.15 0.00 0.00 0.00 0.00 0.00 54.97 56.21 2wof s GLU 262 Cb -0.23 -2.64 0.00 0.00 2.00 0.00 0.00 34.13 33.27 2wof s GLU 262 CO -0.02 0.22 0.00 0.09 -0.56 0.00 0.00 175.26 174.99 2wof n ASN 263 N 0.23 -3.59 -3.94 -1.70 3.02 -1.26 -4.43 115.26 103.60 2wof n ASN 263 Ca 0.03 0.09 -0.29 0.00 -0.03 0.00 0.00 54.58 54.38 2wof n ASN 263 Cb 0.51 -2.48 -0.16 0.00 -0.61 0.00 0.00 39.78 37.04 2wof n ASN 263 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2wof s LEU 264 N -2.47 1.78 -0.08 3.41 2.96 -1.25 -0.35 118.68 122.68 2wof s LEU 264 Ca 0.00 -0.68 0.01 0.00 -0.22 0.00 0.00 54.13 53.24 2wof s LEU 264 Cb 0.00 -1.03 0.02 0.00 0.50 0.00 0.00 46.19 45.68 2wof s LEU 264 CO 0.00 -0.15 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.08 2wof s VAL 265 N 1.55 1.10 -0.06 1.68 1.01 -0.72 -4.37 120.40 120.60 2wof s VAL 265 Ca 0.01 -0.41 -0.02 0.00 0.00 0.00 0.00 61.98 61.56 2wof s VAL 265 Cb -0.15 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 2wof s VAL 265 CO -0.08 0.36 0.04 0.00 0.00 0.00 0.00 175.10 175.41 2wof s ALA 266 N 1.04 3.43 -0.21 5.51 0.00 -0.81 -1.35 121.76 129.36 2wof s ALA 266 Ca -0.08 -0.81 -0.07 0.00 0.00 0.00 0.00 51.96 51.00 2wof s ALA 266 Cb -0.15 -1.55 -0.03 0.00 0.00 0.00 0.00 23.12 21.39 2wof s ALA 266 CO -0.01 0.62 0.05 0.08 0.00 0.00 0.00 175.76 176.50 2wof s VAL 267 N -0.99 4.45 -0.13 0.00 1.01 0.16 -0.11 120.40 124.79 2wof s VAL 267 Ca 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 2wof s VAL 267 Cb -0.12 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 2wof s VAL 267 CO 0.06 0.41 -0.08 -0.69 0.00 0.00 0.00 175.10 174.80 2wof s VAL 268 N 0.94 3.57 -0.32 2.92 1.01 0.60 -1.40 120.40 127.72 2wof s VAL 268 Ca 0.03 -0.49 -0.18 0.00 0.00 0.00 0.00 61.98 61.34 2wof s VAL 268 Cb -0.14 -2.52 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 2wof s VAL 268 CO 0.03 0.53 0.53 -0.62 0.00 0.00 0.00 175.10 175.56 2wof s ASP 269 N 0.07 6.37 0.34 3.32 -1.08 -0.33 -1.51 116.67 123.85 2wof s ASP 269 Ca -0.02 0.20 0.18 0.00 -0.52 0.00 0.00 52.55 52.38 2wof s ASP 269 Cb -0.14 -2.28 0.41 0.00 -1.46 0.00 0.00 42.92 39.45 2wof s ASP 269 CO 0.03 -0.42 1.60 -0.07 0.52 0.00 0.00 175.17 176.84 2wof h LEU 270 N 9.01 0.00 0.00 -1.34 3.38 -1.34 -0.47 115.31 124.55 2wof h LEU 270 Ca -0.28 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 2wof h LEU 270 Cb 1.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 2wof h LEU 270 CO 0.76 0.41 -0.13 -0.33 0.09 0.00 0.00 178.44 179.24 2wof h GLU 271 N 0.00 0.00 0.00 1.13 5.08 -1.94 -3.18 114.58 115.67 2wof h GLU 271 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wof h GLU 271 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2wof h GLU 271 CO 0.05 0.91 0.00 1.04 -1.00 0.00 0.00 179.01 180.01 2wof n GLN 272 N -4.61 0.02 -4.01 2.33 6.02 -1.24 -4.89 117.38 111.01 2wof n GLN 272 Ca -0.11 0.29 -0.26 0.00 -0.01 0.00 0.00 57.00 56.90 2wof n GLN 272 Cb 0.46 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.19 2wof n GLN 272 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2wof n LYS 273 N -1.47 -3.02 -3.85 -1.09 5.02 -0.21 -4.96 118.16 108.57 2wof n LYS 273 Ca 0.03 0.37 -0.09 0.00 -2.02 0.00 0.00 58.31 56.60 2wof n LYS 273 Cb 0.13 -4.44 -0.04 0.00 -0.02 0.00 0.00 35.03 30.66 2wof n LYS 273 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2wof s LYS 274 N -6.66 1.52 -0.20 1.97 -2.85 -1.05 -4.93 119.74 107.53 2wof s LYS 274 Ca 0.03 -1.02 -0.29 0.00 -1.00 0.00 0.00 55.97 53.69 2wof s LYS 274 Cb -0.02 0.52 -0.01 0.00 -2.06 0.00 0.00 37.83 36.27 2wof s LYS 274 CO 0.90 -0.65 1.25 0.42 0.10 0.00 0.00 175.35 177.37 2wof s ILE 275 N -3.93 4.29 -1.44 3.79 1.01 -1.26 -1.18 121.20 122.48 2wof s ILE 275 Ca 0.14 1.54 0.19 0.00 0.00 0.00 0.00 60.65 62.52 2wof s ILE 275 Cb -0.02 -4.07 -0.07 0.00 0.01 0.00 0.00 42.46 38.31 2wof s ILE 275 CO 0.03 -0.22 0.90 1.33 0.00 0.00 0.00 174.94 176.98 2wof n VAL 276 N 5.56 0.00 -3.64 2.92 0.24 -0.50 -4.94 118.33 117.97 2wof n VAL 276 Ca 0.14 -0.23 -0.09 0.00 -2.04 0.00 0.00 64.34 62.12 2wof n VAL 276 Cb 0.45 1.15 -0.07 0.00 -1.47 0.00 0.00 33.84 33.90 2wof n VAL 276 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2wof s LYS 277 N -2.34 0.60 -0.23 7.34 2.20 -1.18 -5.00 119.74 121.13 2wof s LYS 277 Ca 0.13 0.79 0.01 0.00 -0.36 0.00 0.00 55.97 56.54 2wof s LYS 277 Cb 0.15 0.25 0.06 0.00 -1.51 0.00 0.00 37.83 36.77 2wof s LYS 277 CO 0.57 -0.08 -0.07 0.42 -0.36 0.00 0.00 175.35 175.83 2wof s ILE 278 N 0.61 1.61 -0.06 5.43 1.01 -1.26 0.36 121.20 128.90 2wof s ILE 278 Ca -0.01 -1.22 -0.17 0.00 0.00 0.00 0.00 60.65 59.24 2wof s ILE 278 Cb -0.05 -1.83 -0.05 0.00 0.01 0.00 0.00 42.46 40.55 2wof s ILE 278 CO -0.07 -0.05 0.47 -1.61 0.00 0.00 0.00 174.94 173.67 2wof s GLU 279 N 1.37 4.19 -0.02 2.79 2.02 -0.46 -4.99 118.70 123.60 2wof s GLU 279 Ca -0.05 0.48 0.02 0.00 0.02 0.00 0.00 54.97 55.43 2wof s GLU 279 Cb -0.19 -3.34 0.00 0.00 0.10 0.00 0.00 34.13 30.70 2wof s GLU 279 CO -0.06 0.39 -0.07 -1.21 0.02 0.00 0.00 175.26 174.33 2wof s GLU 280 N -0.15 0.68 0.00 1.61 2.02 -1.26 -1.75 118.70 119.85 2wof s GLU 280 Ca 0.26 -0.22 0.00 0.00 0.02 0.00 0.00 54.97 55.02 2wof s GLU 280 Cb -0.16 -0.66 0.00 0.00 0.10 0.00 0.00 34.13 33.41 2wof s GLU 280 CO 0.12 0.09 0.00 0.41 0.02 0.00 0.00 175.26 175.91 2wof n GLY 281 N 3.22 5.35 3.66 -1.39 0.00 0.53 -5.02 105.19 111.53 2wof n GLY 281 Ca -0.17 -2.13 -0.34 0.00 0.00 0.00 0.00 46.02 43.39 2wof n GLY 281 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wof n PRO 282 N 0.00 0.16 -2.94 1.61 -0.02 -1.26 -4.90 135.00 127.65 2wof n PRO 282 Ca 0.00 0.13 -0.41 0.00 -2.02 0.00 0.00 63.50 61.20 2wof n PRO 282 Cb 0.00 -2.36 -0.04 0.00 -0.02 0.00 0.00 33.50 31.08 2wof n PRO 282 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wof s VAL 283 N -2.13 4.94 -0.19 -1.45 1.01 -1.26 -4.67 120.40 116.66 2wof s VAL 283 Ca 0.72 1.58 0.01 0.00 0.00 0.00 0.00 61.98 64.28 2wof s VAL 283 Cb -0.29 -4.11 0.03 0.00 0.00 0.00 0.00 36.38 32.01 2wof s VAL 283 CO 0.52 0.11 -0.14 -0.69 0.00 0.00 0.00 175.10 174.90 2wof s VAL 284 N 1.64 1.78 0.19 2.92 1.01 -1.26 -5.09 120.40 121.59 2wof s VAL 284 Ca 0.38 -0.95 -0.32 0.00 0.00 0.00 0.00 61.98 61.10 2wof s VAL 284 Cb -0.17 -1.74 -0.15 0.00 0.00 0.00 0.00 36.38 34.31 2wof s VAL 284 CO 0.15 0.32 1.12 -2.65 0.00 0.00 0.00 175.10 174.04 2wof n PRO 285 N 4.67 1.17 -1.98 2.72 -0.02 -1.26 -4.49 135.00 135.81 2wof n PRO 285 Ca -0.17 0.42 -0.42 0.00 -2.02 0.00 0.00 63.50 61.31 2wof n PRO 285 Cb 0.48 -1.88 -0.03 0.00 -0.02 0.00 0.00 33.50 32.05 2wof n PRO 285 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wof s VAL 286 N -0.37 2.73 0.08 -1.45 1.01 -1.26 -4.83 120.40 116.31 2wof s VAL 286 Ca 0.70 0.54 -0.31 0.00 0.00 0.00 0.00 61.98 62.91 2wof s VAL 286 Cb -0.82 -3.35 -0.09 0.00 0.00 0.00 0.00 36.38 32.12 2wof s VAL 286 CO 0.54 0.05 1.74 -2.84 0.00 0.00 0.00 175.10 174.59 2wof s PRO 287 N 0.86 4.17 -0.07 2.72 0.02 -1.26 -4.91 135.00 136.53 2wof s PRO 287 Ca 0.67 2.44 0.09 0.00 0.02 0.00 0.00 61.00 64.23 2wof s PRO 287 Cb -0.42 -3.68 -0.14 0.00 0.02 0.00 0.00 34.50 30.28 2wof s PRO 287 CO 0.33 -0.80 0.09 -1.33 -0.33 0.00 0.00 177.00 174.96 2wof n MET 288 N 5.93 1.77 -1.62 5.54 2.81 -1.26 -4.41 117.12 125.87 2wof n MET 288 Ca 0.17 -0.03 -0.45 0.00 -1.81 0.00 0.00 57.70 55.58 2wof n MET 288 Cb 0.40 -1.26 -0.02 0.00 -0.71 0.00 0.00 33.22 31.63 2wof n MET 288 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2wof n THR 289 N -2.22 1.61 -2.14 2.03 -1.04 -1.26 -4.87 114.28 106.38 2wof n THR 289 Ca -0.12 -0.40 -0.42 0.00 -2.04 0.00 0.00 64.05 61.07 2wof n THR 289 Cb 0.66 -1.17 -0.03 0.00 -1.82 0.00 0.00 70.33 67.97 2wof n THR 289 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wof s ALA 290 N -0.73 3.61 -0.43 2.41 0.00 -1.26 -4.94 121.76 120.42 2wof s ALA 290 Ca 0.62 1.13 0.09 0.00 0.00 0.00 0.00 51.96 53.80 2wof s ALA 290 Cb -0.69 -3.55 0.29 0.00 0.00 0.00 0.00 23.12 19.17 2wof s ALA 290 CO 0.57 -0.66 0.66 0.54 0.00 0.00 0.00 175.76 176.87 2wof n ARG 291 N 4.10 1.27 -1.85 0.00 5.12 -1.26 -5.11 116.66 118.93 2wof n ARG 291 Ca 0.12 -3.61 -0.40 0.00 -1.93 0.00 0.00 57.85 52.03 2wof n ARG 291 Cb 0.42 -1.61 0.01 0.00 -1.16 0.00 0.00 32.46 30.12 2wof n ARG 291 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2wof s PRO 292 N -2.00 3.81 0.00 5.56 0.04 -1.26 -4.73 135.00 136.42 2wof s PRO 292 Ca 0.39 2.39 0.13 0.00 0.04 0.00 0.00 61.00 63.95 2wof s PRO 292 Cb 0.24 -2.73 0.13 0.00 0.04 0.00 0.00 34.50 32.18 2wof s PRO 292 CO -0.09 -0.71 0.95 1.97 0.04 0.00 0.00 177.00 179.16 2wof n PHE 293 N -0.03 0.05 1.31 0.56 1.16 -1.26 -4.72 117.46 114.54 2wof n PHE 293 Ca 0.04 -0.05 0.13 0.00 -1.87 0.00 0.00 57.45 55.70 2wof n PHE 293 Cb 0.42 -0.00 0.41 0.00 -1.61 0.00 0.00 39.48 38.70 2wof n PHE 293 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 2wof n ASP 294 N 0.72 1.87 0.00 5.98 5.68 -1.26 -4.92 116.55 124.62 2wof n ASP 294 Ca 0.08 -1.64 0.00 0.00 -0.50 0.00 0.00 54.79 52.73 2wof n ASP 294 Cb 0.34 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 2wof n ASP 294 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wof n GLY 295 N 1.21 0.21 0.36 6.12 0.00 -1.26 -4.96 105.19 106.87 2wof n GLY 295 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 2wof n GLY 295 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2wof h ARG 296 N 4.08 0.59 -0.61 1.61 0.11 -1.92 0.15 114.38 118.40 2wof h ARG 296 Ca 0.00 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.04 2wof h ARG 296 Cb 0.00 -0.13 0.00 0.00 1.11 0.00 0.00 29.97 30.95 2wof h ARG 296 CO 0.00 0.39 0.00 -0.40 0.10 0.00 0.00 179.97 180.06 2wof n ASP 297 N -4.50 3.40 -4.57 0.08 5.75 -1.26 -4.98 116.55 110.48 2wof n ASP 297 Ca 0.13 -2.09 -0.28 0.00 -0.01 0.00 0.00 54.79 52.55 2wof n ASP 297 Cb 0.37 -0.43 -0.10 0.00 -1.03 0.00 0.00 41.12 39.94 2wof n ASP 297 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2wof s ARG 298 N -1.34 2.05 0.12 0.11 1.81 0.53 -5.11 118.95 117.13 2wof s ARG 298 Ca 0.41 -1.20 -0.30 0.00 -1.72 0.00 0.00 55.73 52.91 2wof s ARG 298 Cb 0.22 -2.19 -0.06 0.00 -0.45 0.00 0.00 34.95 32.47 2wof s ARG 298 CO 0.26 0.46 0.99 0.08 -0.68 0.00 0.00 175.30 176.40 2wof s VAL 299 N -1.54 4.37 -0.57 3.52 1.01 -1.26 -5.01 120.40 120.92 2wof s VAL 299 Ca 0.23 1.98 -0.21 0.00 0.00 0.00 0.00 61.98 63.98 2wof s VAL 299 Cb -0.09 -4.26 0.07 0.00 0.00 0.00 0.00 36.38 32.09 2wof s VAL 299 CO 0.14 0.31 0.79 0.00 0.00 0.00 0.00 175.10 176.34 2wof s ALA 300 N -0.02 3.28 1.06 5.51 0.00 -1.26 -5.07 121.76 125.26 2wof s ALA 300 Ca 0.48 -1.75 -0.12 0.00 0.00 0.00 0.00 51.96 50.57 2wof s ALA 300 Cb -0.25 -3.59 0.23 0.00 0.00 0.00 0.00 23.12 19.51 2wof s ALA 300 CO 0.31 -2.33 1.07 -1.25 0.00 0.00 0.00 175.76 173.55 2wof s PRO 301 N 3.26 -0.12 0.20 0.00 0.04 -1.26 -5.00 135.00 132.13 2wof s PRO 301 Ca 0.19 1.01 -0.30 0.00 0.04 0.00 0.00 61.00 61.94 2wof s PRO 301 Cb -0.18 -1.63 -0.08 0.00 0.04 0.00 0.00 34.50 32.64 2wof s PRO 301 CO 0.12 -3.23 1.18 0.00 0.04 0.00 0.00 177.00 175.11 2wof s ALA 302 N -2.59 3.43 -0.03 8.56 0.00 -1.26 -5.05 121.76 124.82 2wof s ALA 302 Ca 0.67 0.95 0.05 0.00 0.00 0.00 0.00 51.96 53.63 2wof s ALA 302 Cb -0.23 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.48 2wof s ALA 302 CO 0.62 -0.34 -0.18 0.08 0.00 0.00 0.00 175.76 175.94 2wof s VAL 303 N -0.29 1.46 0.38 0.00 1.01 -1.26 -5.13 120.40 116.58 2wof s VAL 303 Ca 0.51 -0.76 -0.25 0.00 0.00 0.00 0.00 61.98 61.48 2wof s VAL 303 Cb -0.33 -1.24 -0.09 0.00 0.00 0.00 0.00 36.38 34.73 2wof s VAL 303 CO 0.38 0.42 1.10 -0.54 0.00 0.00 0.00 175.10 176.46 2wof s LYS 304 N -0.18 4.19 0.51 2.72 1.02 -1.26 -4.99 119.74 121.75 2wof s LYS 304 Ca 0.01 1.69 -0.23 0.00 0.02 0.00 0.00 55.97 57.46 2wof s LYS 304 Cb -0.10 -2.69 -0.06 0.00 -0.52 0.00 0.00 37.83 34.46 2wof s LYS 304 CO 0.01 -0.16 1.37 -1.25 -0.92 0.00 0.00 175.35 174.40 2wof s PRO 305 N -2.25 3.34 -0.05 -1.68 0.04 -1.26 -5.04 135.00 128.10 2wof s PRO 305 Ca 0.55 2.27 0.01 0.00 0.04 0.00 0.00 61.00 63.87 2wof s PRO 305 Cb -0.27 -2.39 0.02 0.00 0.04 0.00 0.00 34.50 31.91 2wof s PRO 305 CO 0.34 -1.04 -0.03 1.41 0.04 0.00 0.00 177.00 177.72 2wof s MET 306 N -2.75 0.67 -0.03 4.56 1.75 -1.26 -5.14 119.30 117.10 2wof s MET 306 Ca 0.68 -0.03 0.04 0.00 -1.25 0.00 0.00 55.69 55.13 2wof s MET 306 Cb -0.41 -0.78 -0.01 0.00 2.84 0.00 0.00 34.83 36.48 2wof s MET 306 CO 0.50 -0.13 -0.15 -0.65 -0.65 0.00 0.00 175.02 173.94 2wof s GLN 307 N 1.11 1.44 -0.35 4.11 -0.21 -1.26 -5.00 119.66 119.49 2wof s GLN 307 Ca -0.08 -0.54 -0.13 0.00 0.02 0.00 0.00 55.36 54.63 2wof s GLN 307 Cb -0.14 -1.31 -0.00 0.00 1.00 0.00 0.00 33.01 32.55 2wof s GLN 307 CO -0.01 0.27 0.24 0.42 -2.12 0.00 0.00 175.29 174.08 2wof s ILE 308 N -0.11 5.12 0.03 1.08 1.01 -1.26 -5.08 121.20 121.99 2wof s ILE 308 Ca 0.01 -0.39 0.07 0.00 0.00 0.00 0.00 60.65 60.33 2wof s ILE 308 Cb -0.09 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 2wof s ILE 308 CO 0.01 -0.08 -0.20 0.27 0.00 0.00 0.00 174.94 174.94 2wof s ILE 309 N 1.68 2.64 -0.56 2.92 -4.36 -1.26 -3.37 121.20 118.90 2wof s ILE 309 Ca 0.05 -1.19 0.04 0.00 -0.26 0.00 0.00 60.65 59.30 2wof s ILE 309 Cb -0.18 -2.08 0.16 0.00 1.25 0.00 0.00 42.46 41.61 2wof s ILE 309 CO 0.09 0.38 0.39 -1.61 0.24 0.00 0.00 174.94 174.43 2wof s GLU 310 N -1.30 1.76 0.13 0.37 2.02 -1.26 -5.02 118.70 115.40 2wof s GLU 310 Ca 0.14 -2.70 0.24 0.00 0.02 0.00 0.00 54.97 52.67 2wof s GLU 310 Cb -0.10 -2.62 0.93 0.00 0.10 0.00 0.00 34.13 32.44 2wof s GLU 310 CO 0.04 -1.29 1.75 -0.35 0.02 0.00 0.00 175.26 175.44 2wof n PRO 311 N 2.57 0.13 -0.65 0.39 -0.04 -1.26 -1.75 135.00 134.39 2wof n PRO 311 Ca 0.20 0.21 0.09 0.00 -0.04 0.00 0.00 63.50 63.96 2wof n PRO 311 Cb 0.39 -1.69 0.37 0.00 -0.04 0.00 0.00 33.50 32.53 2wof n PRO 311 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2wof n GLU 312 N -1.92 3.89 0.00 0.54 1.02 -1.26 -3.71 120.64 119.20 2wof n GLU 312 Ca 0.05 -2.93 0.00 0.00 -0.02 0.00 0.00 57.16 54.25 2wof n GLU 312 Cb 0.32 -1.94 0.00 0.00 -0.02 0.00 0.00 31.44 29.80 2wof n GLU 312 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wof n GLY 313 N 1.06 -1.64 3.96 0.62 0.00 -0.71 -4.84 105.19 103.63 2wof n GLY 313 Ca 0.26 -2.06 -0.22 0.00 0.00 0.00 0.00 46.02 44.00 2wof n GLY 313 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wof s LYS 314 N 0.00 3.03 0.00 1.61 -0.14 -1.26 -4.82 119.74 118.16 2wof s LYS 314 Ca 0.00 -0.61 0.25 0.00 -1.36 0.00 0.00 55.97 54.25 2wof s LYS 314 Cb 0.00 -2.60 0.43 0.00 -1.68 0.00 0.00 37.83 33.98 2wof s LYS 314 CO 0.00 -0.25 1.36 0.09 -0.76 0.00 0.00 175.35 175.79 2wof n ASN 315 N -2.02 1.37 -4.77 2.83 3.02 -1.26 -4.90 115.26 109.52 2wof n ASN 315 Ca 0.02 -1.09 -0.25 0.00 -0.03 0.00 0.00 54.58 53.23 2wof n ASN 315 Cb 0.58 0.30 -0.06 0.00 -0.61 0.00 0.00 39.78 40.00 2wof n ASN 315 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 2wof s TYR 316 N -2.54 3.04 0.01 3.10 1.13 -1.26 -4.48 117.35 116.36 2wof s TYR 316 Ca 0.21 -0.09 0.07 0.00 -1.41 0.00 0.00 57.07 55.85 2wof s TYR 316 Cb 0.19 -1.42 -0.02 0.00 -1.10 0.00 0.00 41.96 39.60 2wof s TYR 316 CO 0.56 0.53 -0.21 0.99 -2.51 0.00 0.00 175.55 174.91 2wof s THR 317 N -1.92 1.68 -0.31 -3.49 2.01 -0.27 -4.78 115.64 108.55 2wof s THR 317 Ca 0.31 -1.06 0.01 0.00 0.31 0.00 0.00 61.69 61.27 2wof s THR 317 Cb -0.09 -1.43 0.07 0.00 0.01 0.00 0.00 72.50 71.07 2wof s THR 317 CO 0.23 0.34 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.87 2wof s ILE 318 N -0.65 2.56 -0.35 1.82 1.01 0.58 -1.27 121.20 124.89 2wof s ILE 318 Ca 0.08 -1.80 -0.07 0.00 0.00 0.00 0.00 60.65 58.86 2wof s ILE 318 Cb -0.08 -2.62 0.05 0.00 0.01 0.00 0.00 42.46 39.81 2wof s ILE 318 CO 0.01 -0.28 0.13 -0.89 0.00 0.00 0.00 174.94 173.91 2wof s THR 319 N 1.10 3.82 0.00 2.92 2.01 0.93 -1.47 115.64 124.96 2wof s THR 319 Ca -0.01 -1.22 0.00 0.00 0.31 0.00 0.00 61.69 60.77 2wof s THR 319 Cb -0.20 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.09 2wof s THR 319 CO -0.05 -0.26 0.00 0.61 -0.69 0.00 0.00 174.62 174.24 2wof n GLY 320 N 4.81 3.08 0.57 4.40 0.00 -1.10 -0.51 105.19 116.44 2wof n GLY 320 Ca -0.11 0.23 0.08 0.00 0.00 0.00 0.00 46.02 46.21 2wof n GLY 320 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wof n ASP 321 N 10.21 2.16 -4.73 1.61 8.00 -1.26 -4.97 116.55 127.56 2wof n ASP 321 Ca 0.00 -1.58 -0.41 0.00 0.71 0.00 0.00 54.79 53.51 2wof n ASP 321 Cb 0.00 0.07 -0.05 0.00 -0.02 0.00 0.00 41.12 41.12 2wof n ASP 321 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2wof s MET 322 N -1.34 4.73 -0.13 -1.24 -1.94 0.34 -1.87 119.30 117.85 2wof s MET 322 Ca 0.17 1.48 0.02 0.00 -1.71 0.00 0.00 55.69 55.65 2wof s MET 322 Cb 0.13 -3.35 -0.00 0.00 2.01 0.00 0.00 34.83 33.62 2wof s MET 322 CO 0.21 0.28 -0.19 0.42 -0.01 0.00 0.00 175.02 175.73 2wof s ILE 323 N -0.30 2.43 -0.07 2.53 1.01 0.10 -0.05 121.20 126.86 2wof s ILE 323 Ca 0.46 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 60.28 2wof s ILE 323 Cb -0.24 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.23 2wof s ILE 323 CO 0.31 0.54 -0.21 -2.28 0.00 0.00 0.00 174.94 173.30 2wof s HIS 324 N 0.53 2.56 -0.30 3.97 5.65 -0.40 -1.89 115.29 125.41 2wof s HIS 324 Ca -0.12 -0.66 -0.05 0.00 0.25 0.00 0.00 55.06 54.48 2wof s HIS 324 Cb -0.16 -1.66 0.17 0.00 -1.18 0.00 0.00 32.58 29.74 2wof s HIS 324 CO 0.04 -0.18 0.64 -0.46 -0.65 0.00 0.00 174.74 174.14 2wof s TRP 325 N -0.10 -1.47 0.00 3.88 -0.00 -0.78 -1.11 118.94 119.36 2wof s TRP 325 Ca -0.04 1.90 0.00 0.00 -0.00 0.00 0.00 56.10 57.96 2wof s TRP 325 Cb -0.14 0.64 0.00 0.00 -0.00 0.00 0.00 33.47 33.97 2wof s TRP 325 CO 0.04 -0.78 0.00 0.54 -0.00 0.00 0.00 176.95 176.76 2wof n ARG 326 N 5.43 0.00 -0.06 5.86 1.74 -1.26 -1.11 116.66 127.25 2wof n ARG 326 Ca -0.05 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.13 2wof n ARG 326 Cb 0.50 0.00 0.42 0.00 -1.02 0.00 0.00 32.46 32.36 2wof n ARG 326 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2wof n ASN 327 N 5.55 1.39 -4.88 0.55 3.02 -1.26 -4.90 115.26 114.73 2wof n ASN 327 Ca 0.00 -1.64 -0.34 0.00 -0.03 0.00 0.00 54.58 52.57 2wof n ASN 327 Cb 0.00 -0.08 -0.05 0.00 -0.61 0.00 0.00 39.78 39.04 2wof n ASN 327 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2wof s TRP 328 N -1.84 3.58 -0.01 3.10 0.52 -0.27 -0.08 118.94 123.95 2wof s TRP 328 Ca 0.32 0.69 0.01 0.00 0.02 0.00 0.00 56.10 57.14 2wof s TRP 328 Cb 0.17 -2.08 0.00 0.00 -1.15 0.00 0.00 33.47 30.41 2wof s TRP 328 CO 0.26 0.55 -0.02 -0.51 0.02 0.00 0.00 176.95 177.25 2wof s ASP 329 N -1.77 0.33 0.21 2.95 1.01 -0.95 -1.87 116.67 116.57 2wof s ASP 329 Ca 0.31 -0.05 -0.20 0.00 0.71 0.00 0.00 52.55 53.32 2wof s ASP 329 Cb -0.14 -0.06 0.04 0.00 1.01 0.00 0.00 42.92 43.77 2wof s ASP 329 CO 0.18 0.02 0.60 0.72 0.21 0.00 0.00 175.17 176.89 2wof s PHE 330 N 0.08 -0.26 -0.11 4.23 -0.12 -0.79 -1.55 117.98 119.46 2wof s PHE 330 Ca -0.00 -0.07 0.00 0.00 -0.05 0.00 0.00 56.93 56.81 2wof s PHE 330 Cb -0.03 0.53 -0.02 0.00 -0.63 0.00 0.00 43.02 42.87 2wof s PHE 330 CO -0.00 -0.98 -0.10 -1.58 -0.05 0.00 0.00 175.22 172.50 2wof s HIS 331 N -3.85 2.85 -0.18 3.49 5.65 -0.31 0.03 115.29 122.97 2wof s HIS 331 Ca 0.07 -0.35 0.01 0.00 0.25 0.00 0.00 55.06 55.03 2wof s HIS 331 Cb -0.02 -1.80 0.04 0.00 -1.18 0.00 0.00 32.58 29.62 2wof s HIS 331 CO -0.03 0.00 -0.12 -1.17 -0.65 0.00 0.00 174.74 172.78 2wof s LEU 332 N -0.08 2.07 0.27 8.88 2.96 -0.78 -0.63 118.68 131.36 2wof s LEU 332 Ca -0.01 -0.75 0.02 0.00 -0.22 0.00 0.00 54.13 53.17 2wof s LEU 332 Cb -0.14 -1.21 -0.04 0.00 0.50 0.00 0.00 46.19 45.31 2wof s LEU 332 CO 0.03 -0.12 0.16 -0.94 -1.32 0.00 0.00 176.35 174.17 2wof s SER 333 N 1.43 1.02 0.01 3.68 1.04 -0.57 -4.81 113.70 115.50 2wof s SER 333 Ca 0.01 -1.51 0.08 0.00 0.48 0.00 0.00 55.95 55.01 2wof s SER 333 Cb -0.15 0.39 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 2wof s SER 333 CO -0.09 -0.88 -0.24 -0.32 0.98 0.00 0.00 173.24 172.69 2wof s MET 334 N -3.91 1.78 -0.01 4.02 1.75 -1.26 -0.60 119.30 121.09 2wof s MET 334 Ca 0.38 -0.94 0.04 0.00 -1.25 0.00 0.00 55.69 53.92 2wof s MET 334 Cb 0.06 -1.82 -0.01 0.00 2.84 0.00 0.00 34.83 35.89 2wof s MET 334 CO 0.17 0.49 -0.12 1.21 -0.65 0.00 0.00 175.02 176.12 2wof s ASN 335 N -0.87 1.36 0.48 1.11 3.84 -0.28 -4.88 114.94 115.71 2wof s ASN 335 Ca 0.10 -0.22 0.23 0.00 0.21 0.00 0.00 52.86 53.17 2wof s ASN 335 Cb -0.09 -0.15 1.22 0.00 -0.55 0.00 0.00 41.25 41.68 2wof s ASN 335 CO 0.00 0.13 1.99 0.77 -2.79 0.00 0.00 177.10 177.21 2wof h SER 336 N 5.80 0.00 0.00 -4.21 4.64 -1.91 -1.06 113.55 116.81 2wof h SER 336 Ca -0.33 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.93 2wof h SER 336 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2wof h SER 336 CO 0.49 0.18 -0.48 -0.09 -0.87 0.00 0.00 176.83 176.06 2wof h ARG 337 N 0.00 0.00 -0.02 4.77 2.43 -1.88 0.11 114.38 119.79 2wof h ARG 337 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2wof h ARG 337 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 2wof h ARG 337 CO 0.02 0.44 -0.12 1.33 -1.51 0.00 0.00 179.97 180.13 2wof n VAL 338 N -4.61 0.00 -1.95 0.20 0.24 -1.24 -1.59 118.33 109.38 2wof n VAL 338 Ca -0.12 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 61.74 2wof n VAL 338 Cb 0.35 1.26 0.00 0.00 -1.47 0.00 0.00 33.84 33.98 2wof n VAL 338 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wof n GLY 339 N 0.96 0.48 3.77 7.63 0.00 -0.40 -4.42 105.19 113.20 2wof n GLY 339 Ca 0.08 -1.00 -0.40 0.00 0.00 0.00 0.00 46.02 44.70 2wof n GLY 339 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wof s PRO 340 N 0.00 4.28 -0.14 1.61 0.04 -1.26 -1.12 135.00 138.41 2wof s PRO 340 Ca 0.00 2.12 -0.00 0.00 0.04 0.00 0.00 61.00 63.16 2wof s PRO 340 Cb 0.00 -2.98 0.03 0.00 0.04 0.00 0.00 34.50 31.59 2wof s PRO 340 CO 0.00 -0.22 -0.10 -1.64 0.04 0.00 0.00 177.00 175.08 2wof s MET 341 N -1.90 1.86 -0.31 4.56 -1.94 0.24 -4.36 119.30 117.45 2wof s MET 341 Ca 0.51 -0.44 -0.10 0.00 -1.71 0.00 0.00 55.69 53.95 2wof s MET 341 Cb -0.38 -1.89 -0.01 0.00 2.01 0.00 0.00 34.83 34.57 2wof s MET 341 CO 0.49 -0.28 0.17 0.42 -0.01 0.00 0.00 175.02 175.81 2wof s ILE 342 N 1.59 4.77 0.22 2.53 -1.09 -0.48 -1.51 121.20 127.23 2wof s ILE 342 Ca 0.04 -0.35 0.07 0.00 -2.23 0.00 0.00 60.65 58.19 2wof s ILE 342 Cb -0.13 -3.42 -0.05 0.00 -1.58 0.00 0.00 42.46 37.28 2wof s ILE 342 CO -0.09 0.07 -0.11 -0.44 -1.23 0.00 0.00 174.94 173.14 2wof s SER 343 N 1.64 2.50 -1.25 3.58 0.01 0.20 -0.57 113.70 119.81 2wof s SER 343 Ca 0.05 -1.08 -0.23 0.00 1.31 0.00 0.00 55.95 56.00 2wof s SER 343 Cb -0.17 -0.12 0.02 0.00 0.21 0.00 0.00 66.02 65.96 2wof s SER 343 CO 0.07 -0.26 0.61 0.35 0.41 0.00 0.00 173.24 174.43 2wof n THR 344 N -0.42 -3.53 -2.85 1.44 -2.24 -0.10 -1.16 114.28 105.42 2wof n THR 344 Ca -0.07 -0.69 -0.42 0.00 -2.27 0.00 0.00 64.05 60.59 2wof n THR 344 Cb 0.61 -2.81 -0.04 0.00 -2.10 0.00 0.00 70.33 65.99 2wof n THR 344 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2wof s VAL 345 N -3.65 4.68 0.23 2.28 1.01 0.26 -4.33 120.40 120.88 2wof s VAL 345 Ca 0.38 1.28 0.11 0.00 0.00 0.00 0.00 61.98 63.75 2wof s VAL 345 Cb -0.18 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 31.90 2wof s VAL 345 CO 0.93 -0.37 -0.18 0.42 0.00 0.00 0.00 175.10 175.90 2wof s THR 346 N 3.22 2.62 -0.21 3.92 -4.23 -0.59 -0.96 115.64 119.41 2wof s THR 346 Ca 0.36 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 2wof s THR 346 Cb -0.13 -2.33 0.02 0.00 1.34 0.00 0.00 72.50 71.40 2wof s THR 346 CO 0.15 -0.26 -0.14 -0.47 -0.54 0.00 0.00 174.62 173.36 2wof s TYR 347 N -2.08 2.92 -0.51 3.99 6.14 0.73 -2.25 117.35 126.28 2wof s TYR 347 Ca 0.26 -1.62 -0.27 0.00 0.64 0.00 0.00 57.07 56.07 2wof s TYR 347 Cb -0.07 -1.97 -0.01 0.00 0.42 0.00 0.00 41.96 40.33 2wof s TYR 347 CO 0.14 -0.77 1.75 1.21 0.64 0.00 0.00 175.55 178.52 2wof s ASN 348 N 1.30 5.64 -0.57 4.32 3.84 0.89 -0.02 114.94 130.34 2wof s ASN 348 Ca 0.02 0.63 -0.16 0.00 0.21 0.00 0.00 52.86 53.56 2wof s ASN 348 Cb -0.15 -2.53 0.13 0.00 -0.55 0.00 0.00 41.25 38.15 2wof s ASN 348 CO -0.09 -2.03 0.54 -0.62 -2.79 0.00 0.00 177.10 172.11 2wof s ASP 349 N 6.72 6.23 -1.60 -4.21 -1.08 -0.11 -4.64 116.67 117.98 2wof s ASP 349 Ca 0.68 -1.80 -0.06 0.00 -0.52 0.00 0.00 52.55 50.85 2wof s ASP 349 Cb -0.15 -2.22 0.06 0.00 -1.46 0.00 0.00 42.92 39.14 2wof s ASP 349 CO 0.26 -0.88 0.25 0.59 0.52 0.00 0.00 175.17 175.91 2wof n ASN 350 N 5.31 -0.13 0.00 -0.34 3.02 -1.26 -0.54 115.26 121.32 2wof n ASN 350 Ca -0.12 -1.20 0.00 0.00 -0.03 0.00 0.00 54.58 53.23 2wof n ASN 350 Cb 0.41 -1.95 0.00 0.00 -0.61 0.00 0.00 39.78 37.63 2wof n ASN 350 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wof n GLY 351 N -2.10 2.51 3.46 7.41 0.00 -1.26 -5.06 105.19 110.16 2wof n GLY 351 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 2wof n GLY 351 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wof s THR 352 N -2.39 4.33 -0.13 2.61 2.01 0.30 -5.06 115.64 117.30 2wof s THR 352 Ca 0.00 -0.17 -0.29 0.00 0.31 0.00 0.00 61.69 61.54 2wof s THR 352 Cb 0.00 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.46 2wof s THR 352 CO 0.00 0.36 1.48 -0.54 -0.69 0.00 0.00 174.62 175.23 2wof s LYS 353 N 1.46 4.13 -0.13 4.92 1.02 -1.26 -0.93 119.74 128.94 2wof s LYS 353 Ca 0.06 1.86 -0.05 0.00 0.02 0.00 0.00 55.97 57.86 2wof s LYS 353 Cb -0.15 -3.91 -0.04 0.00 -0.52 0.00 0.00 37.83 33.22 2wof s LYS 353 CO 0.03 -0.88 0.04 1.03 -0.92 0.00 0.00 175.35 174.66 2wof s ARG 354 N 3.94 3.45 0.34 1.68 0.52 0.97 -4.87 118.95 124.98 2wof s ARG 354 Ca 0.65 -0.34 -0.29 0.00 -0.52 0.00 0.00 55.73 55.23 2wof s ARG 354 Cb -0.27 -3.01 -0.11 0.00 0.52 0.00 0.00 34.95 32.08 2wof s ARG 354 CO 0.23 0.54 1.38 0.15 0.02 0.00 0.00 175.30 177.62 2wof s LYS 355 N -0.40 4.27 0.00 3.54 1.02 -1.26 -0.20 119.74 126.71 2wof s LYS 355 Ca 0.09 2.34 0.00 0.00 0.02 0.00 0.00 55.97 58.42 2wof s LYS 355 Cb -0.12 -3.04 0.00 0.00 -0.52 0.00 0.00 37.83 34.15 2wof s LYS 355 CO 0.02 -0.32 0.00 0.28 -0.92 0.00 0.00 175.35 174.41 2wof n VAL 356 N 0.78 0.00 -3.68 3.17 0.31 -0.14 -0.73 118.33 118.04 2wof n VAL 356 Ca 0.01 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.19 2wof n VAL 356 Cb 0.41 -1.24 -0.15 0.00 -0.91 0.00 0.00 33.84 31.96 2wof n VAL 356 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 2wof s MET 357 N -1.99 0.09 0.05 5.55 -2.45 -1.08 -1.71 119.30 117.76 2wof s MET 357 Ca 0.00 0.58 -0.16 0.00 -1.25 0.00 0.00 55.69 54.86 2wof s MET 357 Cb 0.00 -0.18 -0.21 0.00 1.25 0.00 0.00 34.83 35.69 2wof s MET 357 CO 0.00 -0.27 1.19 -0.92 1.05 0.00 0.00 175.02 176.07 2wof h TYR 358 N 8.06 0.87 -2.28 4.11 3.20 -0.87 0.75 116.97 130.81 2wof h TYR 358 Ca -0.21 -0.44 -0.04 0.00 3.14 0.00 0.00 58.73 61.19 2wof h TYR 358 Cb 1.12 -0.11 -0.23 0.00 1.54 0.00 0.00 36.73 39.05 2wof h TYR 358 CO 0.41 1.26 -0.12 -2.00 -1.64 0.00 0.00 178.16 176.07 2wof s GLU 359 N -3.43 0.57 -0.01 1.82 2.12 -1.11 -0.92 118.70 117.74 2wof s GLU 359 Ca -0.11 1.04 0.04 0.00 0.36 0.00 0.00 54.97 56.29 2wof s GLU 359 Cb 0.06 0.07 -0.01 0.00 0.26 0.00 0.00 34.13 34.51 2wof s GLU 359 CO 0.87 -0.15 -0.13 0.20 -0.54 0.00 0.00 175.26 175.51 2wof s GLY 360 N 1.54 0.63 0.31 -1.50 0.00 0.26 -0.21 107.32 108.35 2wof s GLY 360 Ca -0.10 -0.54 -0.19 0.00 0.00 0.00 0.00 44.72 43.89 2wof s GLY 360 CO -0.17 -0.43 0.82 -1.35 0.00 0.00 0.00 173.10 171.97 2wof s SER 361 N -0.26 -0.09 0.30 1.64 1.04 -0.89 -1.39 113.70 114.06 2wof s SER 361 Ca 0.04 -0.86 -0.29 0.00 0.48 0.00 0.00 55.95 55.32 2wof s SER 361 Cb -0.05 0.74 -0.11 0.00 0.10 0.00 0.00 66.02 66.70 2wof s SER 361 CO -0.00 -1.43 1.47 -0.22 0.98 0.00 0.00 173.24 174.04 2wof s LEU 362 N -3.06 4.37 -0.12 2.42 2.96 -1.26 -1.90 118.68 122.09 2wof s LEU 362 Ca 0.15 2.81 -0.06 0.00 -0.22 0.00 0.00 54.13 56.81 2wof s LEU 362 Cb -0.05 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 2wof s LEU 362 CO 0.08 -0.76 0.02 1.23 -1.32 0.00 0.00 176.35 175.60 2wof h GLY 363 N 4.38 0.00 -2.40 7.98 0.00 -0.64 -3.42 103.07 108.97 2wof h GLY 363 Ca -0.48 0.00 0.37 0.00 0.00 0.00 0.00 47.33 47.22 2wof h GLY 363 CO 0.74 0.00 0.93 -0.32 0.00 0.00 0.00 176.54 177.89 2wof s GLY 364 N -3.85 -0.31 0.07 4.60 0.00 -1.04 -4.38 107.32 102.41 2wof s GLY 364 Ca -0.07 0.45 -0.12 0.00 0.00 0.00 0.00 44.72 44.99 2wof s GLY 364 CO 0.14 3.16 0.26 -3.16 0.00 0.00 0.00 173.10 173.50 2wof s MET 365 N -2.12 0.84 0.00 2.90 0.23 -1.26 -0.85 119.30 119.05 2wof s MET 365 Ca 0.23 -0.71 0.00 0.00 -1.03 0.00 0.00 55.69 54.17 2wof s MET 365 Cb 0.03 0.36 -0.00 0.00 -1.53 0.00 0.00 34.83 33.68 2wof s MET 365 CO -0.03 -0.28 -0.01 -1.50 -2.03 0.00 0.00 175.02 171.17 2wof s ILE 366 N -3.21 0.06 -0.50 3.16 2.07 0.85 -3.62 121.20 120.02 2wof s ILE 366 Ca -0.00 -0.16 0.03 0.00 -1.41 0.00 0.00 60.65 59.11 2wof s ILE 366 Cb 0.02 -0.08 0.14 0.00 0.13 0.00 0.00 42.46 42.67 2wof s ILE 366 CO -0.07 -0.06 0.29 -0.69 -1.91 0.00 0.00 174.94 172.50 2wof s VAL 367 N -0.22 1.79 -0.03 4.00 1.01 -0.15 -0.48 120.40 126.32 2wof s VAL 367 Ca -0.02 -3.00 -0.13 0.00 0.00 0.00 0.00 61.98 58.83 2wof s VAL 367 Cb -0.02 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.08 2wof s VAL 367 CO -0.00 -0.92 0.35 -2.16 0.00 0.00 0.00 175.10 172.36 2wof s PRO 368 N -0.10 3.82 0.46 2.72 0.04 -1.19 -2.06 135.00 138.68 2wof s PRO 368 Ca 0.20 0.29 0.08 0.00 0.04 0.00 0.00 61.00 61.61 2wof s PRO 368 Cb -0.19 -3.22 0.02 0.00 0.04 0.00 0.00 34.50 31.15 2wof s PRO 368 CO -0.04 0.70 0.56 0.71 0.04 0.00 0.00 177.00 178.97 2wof s TYR 369 N -1.03 2.43 0.00 0.56 1.51 -0.82 -1.42 117.35 118.57 2wof s TYR 369 Ca 0.22 -0.51 0.00 0.00 -1.01 0.00 0.00 57.07 55.76 2wof s TYR 369 Cb -0.16 -2.27 0.00 0.00 -0.11 0.00 0.00 41.96 39.42 2wof s TYR 369 CO 0.11 -0.51 0.68 0.41 -1.11 0.00 0.00 175.55 175.14 2wof n GLY 370 N -1.86 0.58 3.77 0.71 0.00 -1.05 -4.96 105.19 102.39 2wof n GLY 370 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 2wof n GLY 370 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wof s ASP 371 N -0.46 6.17 0.00 1.61 -1.08 -1.26 -4.98 116.67 116.67 2wof s ASP 371 Ca 0.00 0.29 0.26 0.00 -0.52 0.00 0.00 52.55 52.58 2wof s ASP 371 Cb 0.00 -2.04 0.68 0.00 -1.46 0.00 0.00 42.92 40.10 2wof s ASP 371 CO 0.00 0.27 1.53 -0.81 0.52 0.00 0.00 175.17 176.68 2wof n PRO 372 N 2.91 0.27 -0.74 4.34 -0.04 -1.26 -3.15 135.00 137.33 2wof n PRO 372 Ca -0.18 -0.15 -0.29 0.00 -0.04 0.00 0.00 63.50 62.85 2wof n PRO 372 Cb 0.53 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.73 2wof n PRO 372 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2wof s ASP 373 N -2.83 1.01 0.24 3.54 1.01 -1.26 -4.36 116.67 114.02 2wof s ASP 373 Ca 0.16 1.20 -0.03 0.00 0.71 0.00 0.00 52.55 54.59 2wof s ASP 373 Cb 0.18 -1.84 0.27 0.00 1.01 0.00 0.00 42.92 42.54 2wof s ASP 373 CO 0.62 -4.14 1.72 0.16 0.21 0.00 0.00 175.17 173.75 2wof h ILE 374 N -2.58 1.25 0.00 0.77 3.07 -1.97 -0.86 117.51 117.19 2wof h ILE 374 Ca -0.56 -1.08 0.00 0.00 1.55 0.00 0.00 64.86 64.77 2wof h ILE 374 Cb 1.33 0.92 0.00 0.00 -0.27 0.00 0.00 36.82 38.80 2wof h ILE 374 CO 0.48 0.38 0.00 0.61 -1.05 0.00 0.00 178.15 178.57 2wof n GLY 375 N -0.54 -0.60 0.00 0.16 0.00 -1.26 -4.27 105.19 98.67 2wof n GLY 375 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2wof n GLY 375 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2wof n TRP 376 N -0.94 0.00 0.18 1.61 7.02 -0.45 -4.86 117.44 120.00 2wof n TRP 376 Ca 0.13 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.65 2wof n TRP 376 Cb 0.06 0.00 0.32 0.00 -2.42 0.00 0.00 31.31 29.27 2wof n TRP 376 CO 0.00 0.00 0.00 0.10 -2.02 0.00 0.00 177.69 175.77 2wof h TYR 377 N 0.00 0.00 -0.01 -5.99 -0.00 -1.17 -0.54 116.97 109.27 2wof h TYR 377 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2wof h TYR 377 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.80 2wof h TYR 377 CO 0.00 0.40 -0.31 1.97 -0.00 0.00 0.00 178.16 180.22 2wof n PHE 378 N -3.61 0.00 -2.31 0.10 -1.74 -1.26 -4.95 117.46 103.69 2wof n PHE 378 Ca -0.01 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.46 2wof n PHE 378 Cb 0.51 -0.14 -0.02 0.00 1.52 0.00 0.00 39.48 41.35 2wof n PHE 378 CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 2wof s LYS 379 N -2.59 3.63 -0.38 3.97 2.20 -0.21 -4.68 119.74 121.67 2wof s LYS 379 Ca 0.22 1.10 0.05 0.00 -0.36 0.00 0.00 55.97 56.98 2wof s LYS 379 Cb 0.19 -4.02 0.17 0.00 -1.51 0.00 0.00 37.83 32.66 2wof s LYS 379 CO 0.56 -1.50 0.51 0.00 -0.36 0.00 0.00 175.35 174.55 2wof s ALA 380 N 5.38 -1.47 -0.12 3.13 0.00 -1.26 -1.95 121.76 125.47 2wof s ALA 380 Ca 0.63 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 52.04 2wof s ALA 380 Cb -0.16 -2.39 -0.05 0.00 0.00 0.00 0.00 23.12 20.51 2wof s ALA 380 CO 0.31 -2.14 1.86 0.71 0.00 0.00 0.00 175.76 176.50 2wof s TYR 381 N 1.76 1.63 -1.10 0.00 1.51 -0.88 -4.79 117.35 115.48 2wof s TYR 381 Ca 0.16 0.19 -0.12 0.00 -1.01 0.00 0.00 57.07 56.29 2wof s TYR 381 Cb -0.10 -4.04 0.23 0.00 -0.11 0.00 0.00 41.96 37.94 2wof s TYR 381 CO -0.08 -4.11 1.18 -0.51 -1.11 0.00 0.00 175.55 170.93 2wof s LEU 382 N 5.50 5.89 0.14 -1.29 1.02 -1.26 -0.97 118.68 127.70 2wof s LEU 382 Ca 0.83 -3.21 -0.18 0.00 0.02 0.00 0.00 54.13 51.59 2wof s LEU 382 Cb -0.33 -2.28 0.01 0.00 0.02 0.00 0.00 46.19 43.60 2wof s LEU 382 CO 0.34 -0.51 1.74 0.44 0.02 0.00 0.00 176.35 178.38 2wof h ASP 383 N 7.07 0.06 -0.00 2.29 3.32 -1.92 0.29 116.42 127.53 2wof h ASP 383 Ca 0.21 0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.18 2wof h ASP 383 Cb 0.90 0.04 0.01 0.00 0.22 0.00 0.00 39.33 40.50 2wof h ASP 383 CO 1.07 0.07 -0.48 0.77 -1.72 0.00 0.00 179.24 178.95 2wof h SER 384 N 0.19 0.42 -0.11 6.45 4.64 -1.83 -2.27 113.55 121.04 2wof h SER 384 Ca 0.12 -0.77 -0.02 0.00 -0.47 0.00 0.00 61.79 60.66 2wof h SER 384 Cb 0.11 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2wof h SER 384 CO -0.14 1.13 0.01 1.23 -0.87 0.00 0.00 176.83 178.19 2wof h GLY 385 N -0.25 0.21 1.49 -0.77 0.00 -1.79 -1.55 103.07 100.41 2wof h GLY 385 Ca -0.06 -0.15 -0.19 0.00 0.00 0.00 0.00 47.33 46.94 2wof h GLY 385 CO 0.09 0.14 -1.14 -0.55 0.00 0.00 0.00 176.54 175.08 2wof h ASP 386 N -0.06 0.00 0.00 0.19 3.32 -0.57 -3.41 116.42 115.88 2wof h ASP 386 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2wof h ASP 386 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2wof h ASP 386 CO 0.00 0.74 -0.59 -1.22 -1.72 0.00 0.00 179.24 176.46 2wof n TYR 387 N -3.12 0.00 -1.65 4.55 4.02 -0.88 -0.66 117.16 119.42 2wof n TYR 387 Ca -0.06 0.00 -0.00 0.00 -0.01 0.00 0.00 57.90 57.83 2wof n TYR 387 Cb 0.88 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 40.18 2wof n TYR 387 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wof n GLY 388 N 1.72 -2.57 0.11 2.72 0.00 -0.58 -4.82 105.19 101.76 2wof n GLY 388 Ca -0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 46.02 45.85 2wof n GLY 388 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2wof h MET 389 N 0.35 0.05 -0.16 1.61 2.86 -1.27 -2.67 114.93 115.71 2wof h MET 389 Ca 0.00 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2wof h MET 389 Cb 0.02 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 2wof h MET 389 CO 0.01 0.84 0.10 0.78 1.06 0.00 0.00 176.91 179.71 2wof h GLY 390 N 2.28 0.22 0.67 8.32 0.00 -1.03 -1.93 103.07 111.60 2wof h GLY 390 Ca -0.02 -0.08 0.13 0.00 0.00 0.00 0.00 47.33 47.36 2wof h GLY 390 CO 0.11 0.08 0.54 -0.84 0.00 0.00 0.00 176.54 176.43 2wof h THR 391 N 0.21 0.87 -0.49 4.70 2.02 -1.17 -1.51 112.91 117.54 2wof h THR 391 Ca 0.06 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.02 2wof h THR 391 Cb -0.02 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.55 2wof h THR 391 CO -0.02 0.12 0.00 0.18 0.37 0.00 0.00 175.52 176.17 2wof n LEU 392 N -4.52 3.97 -4.50 2.58 4.77 -0.80 -4.96 117.00 113.54 2wof n LEU 392 Ca 0.15 -2.01 -0.48 0.00 -0.03 0.00 0.00 56.01 53.65 2wof n LEU 392 Cb 0.43 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.95 2wof n LEU 392 CO 0.31 0.62 0.35 0.41 -1.33 0.00 0.00 177.39 177.76 2wof n THR 393 N 0.75 1.68 -3.64 -5.08 -1.04 -0.57 -2.81 114.28 103.57 2wof n THR 393 Ca 0.20 -0.42 -0.39 0.00 -2.04 0.00 0.00 64.05 61.41 2wof n THR 393 Cb 0.77 -0.49 -0.11 0.00 -1.82 0.00 0.00 70.33 68.68 2wof n THR 393 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2wof s SER 394 N -0.61 5.65 0.28 8.00 0.01 0.28 -4.83 113.70 122.47 2wof s SER 394 Ca 0.65 -0.41 -0.30 0.00 1.31 0.00 0.00 55.95 57.21 2wof s SER 394 Cb -0.86 -2.03 -0.13 0.00 0.21 0.00 0.00 66.02 63.21 2wof s SER 394 CO 0.57 -0.17 1.27 -2.65 0.41 0.00 0.00 173.24 172.67 2wof n PRO 395 N 5.01 1.87 -1.89 12.44 -0.02 -1.26 -4.56 135.00 146.58 2wof n PRO 395 Ca -0.14 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.58 2wof n PRO 395 Cb 0.50 -2.22 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 2wof n PRO 395 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2wof s ILE 396 N -0.64 2.85 -0.44 4.25 -1.09 0.81 -4.93 121.20 122.01 2wof s ILE 396 Ca 0.62 0.39 -0.26 0.00 -2.23 0.00 0.00 60.65 59.17 2wof s ILE 396 Cb -0.65 -3.25 0.02 0.00 -1.58 0.00 0.00 42.46 37.01 2wof s ILE 396 CO 0.56 0.01 0.95 0.00 -1.23 0.00 0.00 174.94 175.23 2wof s ALA 397 N 2.35 3.27 0.23 9.38 0.00 -1.26 -4.95 121.76 130.78 2wof s ALA 397 Ca 0.74 -0.68 -0.31 0.00 0.00 0.00 0.00 51.96 51.71 2wof s ALA 397 Cb -0.42 -3.64 -0.11 0.00 0.00 0.00 0.00 23.12 18.95 2wof s ALA 397 CO 0.33 -1.98 1.65 0.50 0.00 0.00 0.00 175.76 176.27 2wof s ARG 398 N 3.76 4.14 0.00 0.00 3.52 -1.26 -0.50 118.95 128.62 2wof s ARG 398 Ca 0.38 2.55 0.00 0.00 -0.13 0.00 0.00 55.73 58.53 2wof s ARG 398 Cb -0.10 -3.07 0.00 0.00 -1.56 0.00 0.00 34.95 30.21 2wof s ARG 398 CO 0.25 -0.69 0.00 0.41 -0.81 0.00 0.00 175.30 174.47 2wof n GLY 399 N 3.40 2.99 0.53 8.12 0.00 -0.90 -4.72 105.19 114.60 2wof n GLY 399 Ca 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 2wof n GLY 399 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wof n LYS 400 N -2.00 0.30 0.23 1.61 5.02 -0.58 -4.42 118.16 118.32 2wof n LYS 400 Ca 0.00 0.12 0.14 0.00 -2.02 0.00 0.00 58.31 56.56 2wof n LYS 400 Cb 0.00 -1.02 0.43 0.00 -0.02 0.00 0.00 35.03 34.42 2wof n LYS 400 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2wof h ASP 401 N -0.55 0.00 -5.19 4.39 3.32 -1.08 -3.44 116.42 113.88 2wof h ASP 401 Ca -0.14 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.81 2wof h ASP 401 Cb 0.84 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.25 2wof h ASP 401 CO -0.09 0.00 -0.43 0.00 -1.72 0.00 0.00 179.24 177.01 2wof s ALA 402 N -3.41 -0.04 0.65 3.45 0.00 -1.25 -4.95 121.76 116.20 2wof s ALA 402 Ca 0.04 -0.78 -0.15 0.00 0.00 0.00 0.00 51.96 51.08 2wof s ALA 402 Cb 0.07 0.50 -0.01 0.00 0.00 0.00 0.00 23.12 23.69 2wof s ALA 402 CO 0.59 -0.50 1.11 -1.25 0.00 0.00 0.00 175.76 175.71 2wof s PRO 403 N -3.89 2.85 0.55 0.00 0.04 -1.26 -2.13 135.00 131.17 2wof s PRO 403 Ca 0.07 1.40 0.24 0.00 0.04 0.00 0.00 61.00 62.75 2wof s PRO 403 Cb 0.05 -1.96 1.32 0.00 0.04 0.00 0.00 34.50 33.96 2wof s PRO 403 CO -0.09 -1.21 1.72 0.66 0.04 0.00 0.00 177.00 178.11 2wof h SER 404 N 0.11 0.00 -0.54 6.66 4.64 -1.85 -1.32 113.55 121.25 2wof h SER 404 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2wof h SER 404 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2wof h SER 404 CO 0.54 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.04 2wof n ASN 405 N -2.61 3.59 -4.87 4.97 6.94 -1.22 -4.86 115.26 117.20 2wof n ASN 405 Ca -0.02 -2.22 -0.31 0.00 -0.02 0.00 0.00 54.58 52.01 2wof n ASN 405 Cb 0.36 -0.47 0.02 0.00 -2.36 0.00 0.00 39.78 37.33 2wof n ASN 405 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wof s ALA 406 N -1.58 3.04 -0.10 -2.53 0.00 -0.50 -4.73 121.76 115.36 2wof s ALA 406 Ca 0.40 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 52.25 2wof s ALA 406 Cb 0.24 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.26 2wof s ALA 406 CO 0.22 -0.79 -0.12 0.08 0.00 0.00 0.00 175.76 175.15 2wof s VAL 407 N -3.20 3.17 -0.20 0.00 1.01 -0.02 -4.25 120.40 116.91 2wof s VAL 407 Ca 0.56 -0.64 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 2wof s VAL 407 Cb -0.11 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 2wof s VAL 407 CO 0.54 0.55 -0.08 -0.76 0.00 0.00 0.00 175.10 175.35 2wof s LEU 408 N -0.07 2.77 0.03 3.92 1.43 -1.26 -0.95 118.68 124.55 2wof s LEU 408 Ca -0.02 -0.42 -0.06 0.00 -1.03 0.00 0.00 54.13 52.61 2wof s LEU 408 Cb -0.14 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.35 2wof s LEU 408 CO 0.04 0.01 0.28 -0.76 0.23 0.00 0.00 176.35 176.14 2wof s LEU 409 N 1.31 4.35 0.16 1.79 1.43 0.66 -4.74 118.68 123.65 2wof s LEU 409 Ca 0.04 0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 53.64 2wof s LEU 409 Cb -0.14 -2.79 -0.05 0.00 0.03 0.00 0.00 46.19 43.24 2wof s LEU 409 CO -0.04 0.22 0.38 0.20 0.23 0.00 0.00 176.35 177.34 2wof s ASN 410 N -1.88 6.45 0.02 2.29 0.01 -1.26 0.54 114.94 121.11 2wof s ASN 410 Ca 0.30 0.52 -0.00 0.00 -0.71 0.00 0.00 52.86 52.97 2wof s ASN 410 Cb -0.13 -2.06 -0.02 0.00 0.41 0.00 0.00 41.25 39.45 2wof s ASN 410 CO 0.18 0.02 -0.02 -1.61 -1.51 0.00 0.00 177.10 174.16 2wof s GLU 411 N -2.87 0.28 -0.12 -0.60 0.41 -0.77 -4.90 118.70 110.13 2wof s GLU 411 Ca 0.40 -0.54 0.02 0.00 -0.41 0.00 0.00 54.97 54.44 2wof s GLU 411 Cb -0.12 0.10 -0.00 0.00 -1.78 0.00 0.00 34.13 32.33 2wof s GLU 411 CO 0.26 -0.05 -0.21 0.99 -0.49 0.00 0.00 175.26 175.77 2wof s THR 412 N -1.31 2.30 0.38 3.63 2.01 -1.26 0.10 115.64 121.49 2wof s THR 412 Ca -0.14 -0.92 0.04 0.00 0.31 0.00 0.00 61.69 60.98 2wof s THR 412 Cb -0.09 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 2wof s THR 412 CO -0.01 0.55 0.16 0.27 -0.69 0.00 0.00 174.62 174.90 2wof s ILE 413 N 0.52 0.44 -0.06 1.82 -4.36 -0.45 -4.88 121.20 114.24 2wof s ILE 413 Ca -0.13 -2.00 -0.15 0.00 -0.26 0.00 0.00 60.65 58.11 2wof s ILE 413 Cb -0.17 -2.39 -0.05 0.00 1.25 0.00 0.00 42.46 41.10 2wof s ILE 413 CO 0.05 0.00 0.40 0.00 0.24 0.00 0.00 174.94 175.63 2wof s ALA 414 N -3.30 3.63 0.90 2.27 0.00 -1.26 -0.41 121.76 123.59 2wof s ALA 414 Ca 0.28 -0.25 -0.09 0.00 0.00 0.00 0.00 51.96 51.90 2wof s ALA 414 Cb 0.03 -2.44 0.15 0.00 0.00 0.00 0.00 23.12 20.85 2wof s ALA 414 CO 0.17 0.30 0.91 -0.40 0.00 0.00 0.00 175.76 176.75 2wof n ASP 415 N 2.56 0.34 0.10 0.00 5.68 0.31 -4.88 116.55 120.66 2wof n ASP 415 Ca -0.12 -1.50 0.12 0.00 -0.50 0.00 0.00 54.79 52.79 2wof n ASP 415 Cb 0.52 -0.67 0.46 0.00 -1.14 0.00 0.00 41.12 40.28 2wof n ASP 415 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wof n TYR 416 N -3.10 0.71 -0.41 2.11 4.11 -1.26 -1.46 117.16 117.85 2wof n TYR 416 Ca 0.12 0.25 0.10 0.00 -0.00 0.00 0.00 57.90 58.37 2wof n TYR 416 Cb 0.43 -0.90 0.29 0.00 -0.00 0.00 0.00 39.34 39.16 2wof n TYR 416 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 2wof n THR 417 N -2.12 1.24 -0.62 -3.48 -2.24 -1.26 0.51 114.28 106.31 2wof n THR 417 Ca 0.04 -1.08 0.00 0.00 -2.27 0.00 0.00 64.05 60.74 2wof n THR 417 Cb 0.29 0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 2wof n THR 417 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wof n GLY 418 N 1.20 0.73 3.78 3.38 0.00 -0.53 -4.93 105.19 108.82 2wof n GLY 418 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 2wof n GLY 418 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wof s VAL 419 N -2.43 5.22 0.55 1.61 1.01 -1.26 -4.57 120.40 120.54 2wof s VAL 419 Ca 0.00 0.66 -0.21 0.00 0.00 0.00 0.00 61.98 62.43 2wof s VAL 419 Cb 0.00 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2wof s VAL 419 CO 0.00 0.47 1.17 -2.65 0.00 0.00 0.00 175.10 174.09 2wof n PRO 420 N 2.83 1.34 -3.65 2.72 -0.02 -1.26 -0.53 135.00 136.42 2wof n PRO 420 Ca -0.13 0.50 -0.18 0.00 -2.02 0.00 0.00 63.50 61.67 2wof n PRO 420 Cb 0.52 -2.36 -0.16 0.00 -0.02 0.00 0.00 33.50 31.48 2wof n PRO 420 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2wof s MET 421 N -2.75 0.03 -0.22 -0.52 1.75 0.45 -4.76 119.30 113.28 2wof s MET 421 Ca 0.73 0.48 -0.15 0.00 -1.25 0.00 0.00 55.69 55.50 2wof s MET 421 Cb -0.43 -0.44 -0.04 0.00 2.84 0.00 0.00 34.83 36.75 2wof s MET 421 CO 0.49 -0.35 0.36 -2.00 -0.65 0.00 0.00 175.02 172.87 2wof s GLU 422 N 2.27 4.14 -0.29 4.11 2.12 -1.26 -1.34 118.70 128.45 2wof s GLU 422 Ca 0.04 0.11 -0.12 0.00 0.36 0.00 0.00 54.97 55.36 2wof s GLU 422 Cb -0.12 -3.55 -0.04 0.00 0.26 0.00 0.00 34.13 30.67 2wof s GLU 422 CO -0.06 -0.05 0.23 0.42 -0.54 0.00 0.00 175.26 175.26 2wof s ILE 423 N 1.37 5.28 0.25 -3.70 1.01 0.29 -4.95 121.20 120.75 2wof s ILE 423 Ca 0.17 0.16 -0.30 0.00 0.00 0.00 0.00 60.65 60.68 2wof s ILE 423 Cb -0.15 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 38.64 2wof s ILE 423 CO 0.08 0.19 0.96 -2.16 0.00 0.00 0.00 174.94 174.00 2wof s PRO 424 N 1.80 4.81 -1.34 2.79 0.04 -1.26 -1.85 135.00 139.98 2wof s PRO 424 Ca 0.08 1.50 -0.05 0.00 0.04 0.00 0.00 61.00 62.58 2wof s PRO 424 Cb -0.16 -3.22 0.02 0.00 0.04 0.00 0.00 34.50 31.18 2wof s PRO 424 CO 0.11 0.46 0.91 0.54 0.04 0.00 0.00 177.00 179.07 2wof n ARG 425 N 1.36 -5.96 0.11 4.56 1.74 -1.19 -4.36 116.66 112.93 2wof n ARG 425 Ca -0.01 0.70 -0.17 0.00 -0.77 0.00 0.00 57.85 57.59 2wof n ARG 425 Cb 0.47 -5.52 -0.13 0.00 -1.02 0.00 0.00 32.46 26.26 2wof n ARG 425 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wof h ALA 426 N 0.92 0.09 -3.84 7.54 0.00 -0.01 0.23 119.26 124.19 2wof h ALA 426 Ca -0.59 -0.85 -0.36 0.00 0.00 0.00 0.00 54.91 53.11 2wof h ALA 426 Cb 1.36 0.04 -0.30 0.00 0.00 0.00 0.00 17.79 18.89 2wof h ALA 426 CO 0.57 0.89 -0.76 0.42 0.00 0.00 0.00 179.25 180.37 2wof s ILE 427 N -2.76 0.51 -0.11 0.00 1.01 -1.07 -4.40 121.20 114.38 2wof s ILE 427 Ca -0.05 -0.24 -0.05 0.00 0.00 0.00 0.00 60.65 60.31 2wof s ILE 427 Cb 0.07 -0.45 -0.04 0.00 0.01 0.00 0.00 42.46 42.05 2wof s ILE 427 CO 0.89 0.16 0.07 0.00 0.00 0.00 0.00 174.94 176.07 2wof s ALA 428 N 0.08 3.58 -0.12 9.38 0.00 0.14 -0.24 121.76 134.58 2wof s ALA 428 Ca -0.01 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.25 2wof s ALA 428 Cb -0.05 -1.74 0.01 0.00 0.00 0.00 0.00 23.12 21.34 2wof s ALA 428 CO -0.00 0.58 -0.18 0.08 0.00 0.00 0.00 175.76 176.24 2wof s VAL 429 N -0.89 1.70 -0.18 0.00 1.01 -0.12 -0.54 120.40 121.38 2wof s VAL 429 Ca 0.14 -0.77 -0.16 0.00 0.00 0.00 0.00 61.98 61.19 2wof s VAL 429 Cb -0.12 -1.54 0.05 0.00 0.00 0.00 0.00 36.38 34.77 2wof s VAL 429 CO 0.03 0.48 0.47 0.72 0.00 0.00 0.00 175.10 176.80 2wof s PHE 430 N 0.93 -0.53 0.17 5.22 -0.71 -0.48 -0.84 117.98 121.73 2wof s PHE 430 Ca -0.07 1.28 -0.20 0.00 -1.04 0.00 0.00 56.93 56.90 2wof s PHE 430 Cb -0.15 0.19 -0.08 0.00 -1.21 0.00 0.00 43.02 41.77 2wof s PHE 430 CO -0.02 -0.26 0.68 -2.00 -1.34 0.00 0.00 175.22 172.28 2wof s GLU 431 N 0.33 4.28 -0.03 1.99 2.12 -1.26 -0.28 118.70 125.85 2wof s GLU 431 Ca -0.01 0.86 -0.08 0.00 0.36 0.00 0.00 54.97 56.10 2wof s GLU 431 Cb -0.04 -3.05 0.01 0.00 0.26 0.00 0.00 34.13 31.32 2wof s GLU 431 CO -0.00 0.50 0.18 -0.98 -0.54 0.00 0.00 175.26 174.41 2wof s ARG 432 N -1.60 0.40 0.14 4.30 1.70 0.29 -4.97 118.95 119.21 2wof s ARG 432 Ca 0.38 -0.11 -0.30 0.00 -0.47 0.00 0.00 55.73 55.22 2wof s ARG 432 Cb -0.18 0.18 -0.07 0.00 -0.57 0.00 0.00 34.95 34.30 2wof s ARG 432 CO 0.21 -0.09 1.13 -0.47 -1.08 0.00 0.00 175.30 175.01 2wof s TYR 433 N -0.79 3.54 -0.34 5.89 5.04 -1.26 -1.14 117.35 128.29 2wof s TYR 433 Ca -0.09 1.51 0.15 0.00 -2.44 0.00 0.00 57.07 56.21 2wof s TYR 433 Cb -0.05 -3.32 0.46 0.00 0.35 0.00 0.00 41.96 39.40 2wof s TYR 433 CO 0.01 -0.81 1.02 0.00 -1.34 0.00 0.00 175.55 174.43 2wof n ALA 434 N 2.82 3.74 -0.24 3.97 0.00 0.17 -4.91 120.51 126.06 2wof n ALA 434 Ca 0.04 -3.37 0.00 0.00 0.00 0.00 0.00 53.44 50.11 2wof n ALA 434 Cb 0.46 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.10 2wof n ALA 434 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wof n GLY 435 N -0.26 -1.79 3.73 0.00 0.00 -1.26 -4.67 105.19 100.94 2wof n GLY 435 Ca 0.17 -1.32 -0.41 0.00 0.00 0.00 0.00 46.02 44.45 2wof n GLY 435 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wof s PRO 436 N 0.00 4.47 0.03 1.61 0.04 -1.26 -0.27 135.00 139.62 2wof s PRO 436 Ca 0.00 1.86 -0.25 0.00 0.04 0.00 0.00 61.00 62.66 2wof s PRO 436 Cb 0.00 -3.26 -0.18 0.00 0.04 0.00 0.00 34.50 31.10 2wof s PRO 436 CO 0.00 -0.15 1.48 1.49 0.04 0.00 0.00 177.00 179.87 2wof h GLU 437 N 5.69 -0.04 -3.71 4.56 4.57 -0.93 -3.42 114.58 121.31 2wof h GLU 437 Ca -0.44 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 57.67 2wof h GLU 437 Cb 1.21 0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 29.72 2wof h GLU 437 CO 0.77 0.22 -0.14 1.52 -1.18 0.00 0.00 179.01 180.20 2wof s TYR 438 N -5.18 0.44 -0.23 0.92 -0.85 -1.25 -4.97 117.35 106.22 2wof s TYR 438 Ca -0.15 -0.79 -0.21 0.00 -0.52 0.00 0.00 57.07 55.40 2wof s TYR 438 Cb 0.04 0.15 0.06 0.00 0.38 0.00 0.00 41.96 42.59 2wof s TYR 438 CO 0.66 -1.00 0.62 0.21 -1.52 0.00 0.00 175.55 174.52 2wof s LYS 439 N -3.94 0.72 -0.08 -3.49 2.20 -1.26 -2.34 119.74 111.55 2wof s LYS 439 Ca 0.24 0.86 -0.03 0.00 -0.36 0.00 0.00 55.97 56.68 2wof s LYS 439 Cb -0.00 0.34 0.04 0.00 -1.51 0.00 0.00 37.83 36.70 2wof s LYS 439 CO 0.10 -0.09 0.15 -1.58 -0.36 0.00 0.00 175.35 173.57 2wof s HIS 440 N 0.36 -0.16 -0.93 4.03 2.46 0.19 -5.00 115.29 116.23 2wof s HIS 440 Ca -0.00 0.56 -0.09 0.00 0.47 0.00 0.00 55.06 55.99 2wof s HIS 440 Cb -0.04 -0.23 0.24 0.00 -0.13 0.00 0.00 32.58 32.42 2wof s HIS 440 CO 0.00 -0.24 0.87 -1.14 -2.47 0.00 0.00 174.74 171.77 2wof s GLN 441 N 2.00 3.69 0.19 2.88 2.00 -1.26 -1.59 119.66 127.57 2wof s GLN 441 Ca 0.00 -2.91 -0.30 0.00 -2.00 0.00 0.00 55.36 50.15 2wof s GLN 441 Cb -0.12 -4.33 -0.09 0.00 0.80 0.00 0.00 33.01 29.27 2wof s GLN 441 CO -0.06 -1.25 1.39 -2.00 -0.50 0.00 0.00 175.29 172.87 2wof s GLU 442 N -0.68 4.32 0.16 1.67 2.56 -1.26 -4.89 118.70 120.58 2wof s GLU 442 Ca 0.24 2.16 -0.34 0.00 0.00 0.00 0.00 54.97 57.04 2wof s GLU 442 Cb -0.11 -3.18 -0.13 0.00 2.00 0.00 0.00 34.13 32.71 2wof s GLU 442 CO -0.09 -0.37 1.61 -0.12 -0.56 0.00 0.00 175.26 175.73 2wof n MET 443 N 2.96 2.24 -0.63 4.30 0.00 -1.26 -1.27 117.12 123.45 2wof n MET 443 Ca 0.08 0.81 0.00 0.00 -0.00 0.00 0.00 57.70 58.59 2wof n MET 443 Cb 0.41 -2.59 0.00 0.00 0.00 0.00 0.00 33.22 31.04 2wof n MET 443 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2wof n GLY 444 N 3.54 1.37 3.81 -5.12 0.00 -1.26 -5.01 105.19 102.52 2wof n GLY 444 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 2wof n GLY 444 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wof s GLN 445 N -0.11 2.35 0.40 1.61 -1.52 -0.40 -5.09 119.66 116.90 2wof s GLN 445 Ca 0.00 -1.74 -0.26 0.00 -1.95 0.00 0.00 55.36 51.41 2wof s GLN 445 Cb 0.00 -2.15 -0.09 0.00 -0.22 0.00 0.00 33.01 30.55 2wof s GLN 445 CO 0.00 -0.19 1.31 -2.14 -0.25 0.00 0.00 175.29 174.02 2wof s PRO 446 N -4.03 4.01 0.90 2.91 0.02 -1.26 -4.69 135.00 132.85 2wof s PRO 446 Ca 0.43 2.17 -0.10 0.00 0.02 0.00 0.00 61.00 63.52 2wof s PRO 446 Cb 0.01 -2.79 0.13 0.00 0.02 0.00 0.00 34.50 31.87 2wof s PRO 446 CO 0.24 -0.47 1.14 1.21 -0.33 0.00 0.00 177.00 178.80 2wof s ASN 447 N -0.70 3.13 -0.11 2.53 2.47 -1.26 -4.59 114.94 116.40 2wof s ASN 447 Ca 0.56 2.13 -0.01 0.00 0.42 0.00 0.00 52.86 55.97 2wof s ASN 447 Cb -0.38 -2.56 0.03 0.00 -1.45 0.00 0.00 41.25 36.89 2wof s ASN 447 CO 0.50 -2.96 -0.05 -0.69 -3.72 0.00 0.00 177.10 170.17 2wof s VAL 448 N -2.69 0.88 0.02 -5.21 1.01 -0.62 -5.00 120.40 108.79 2wof s VAL 448 Ca 0.66 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.39 2wof s VAL 448 Cb -0.22 -0.97 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 2wof s VAL 448 CO 0.58 0.29 -0.03 -0.44 0.00 0.00 0.00 175.10 175.49 2wof s SER 449 N 1.76 0.30 0.10 3.32 0.01 -1.26 -0.64 113.70 117.29 2wof s SER 449 Ca 0.04 -0.52 0.02 0.00 1.31 0.00 0.00 55.95 56.81 2wof s SER 449 Cb -0.13 0.10 -0.04 0.00 0.21 0.00 0.00 66.02 66.16 2wof s SER 449 CO -0.07 -0.30 -0.07 0.42 0.41 0.00 0.00 173.24 173.62 2wof s THR 450 N -1.52 0.76 0.32 1.44 -4.23 -0.99 -5.01 115.64 106.41 2wof s THR 450 Ca -0.15 -1.84 -0.14 0.00 -1.18 0.00 0.00 61.69 58.38 2wof s THR 450 Cb -0.10 -1.57 -0.09 0.00 1.34 0.00 0.00 72.50 72.09 2wof s THR 450 CO -0.01 -0.78 0.71 -1.83 -0.54 0.00 0.00 174.62 172.17 2wof s GLU 451 N -3.51 3.97 -0.11 3.99 -1.05 -1.26 -0.45 118.70 120.27 2wof s GLU 451 Ca 0.10 0.61 -0.13 0.00 -0.15 0.00 0.00 54.97 55.40 2wof s GLU 451 Cb 0.03 -2.45 -0.05 0.00 -0.44 0.00 0.00 34.13 31.22 2wof s GLU 451 CO -0.03 0.17 0.31 0.50 0.95 0.00 0.00 175.26 177.15 2wof s ARG 452 N -3.00 4.06 -0.06 -4.83 3.52 0.63 -4.20 118.95 115.08 2wof s ARG 452 Ca 0.53 0.15 0.05 0.00 -0.13 0.00 0.00 55.73 56.34 2wof s ARG 452 Cb -0.10 -3.34 -0.02 0.00 -1.56 0.00 0.00 34.95 29.93 2wof s ARG 452 CO 0.18 0.42 -0.21 1.03 -0.81 0.00 0.00 175.30 175.91 2wof s ARG 453 N -0.10 2.54 0.03 5.12 1.81 -1.26 -0.65 118.95 126.43 2wof s ARG 453 Ca 0.18 -0.84 0.08 0.00 -1.72 0.00 0.00 55.73 53.43 2wof s ARG 453 Cb -0.14 -2.24 -0.02 0.00 -0.45 0.00 0.00 34.95 32.10 2wof s ARG 453 CO 0.06 0.46 -0.22 -1.21 -0.68 0.00 0.00 175.30 173.71 2wof s GLU 454 N -0.33 1.60 -0.23 3.54 2.02 -0.29 -2.95 118.70 122.06 2wof s GLU 454 Ca 0.02 -0.93 -0.10 0.00 0.02 0.00 0.00 54.97 53.97 2wof s GLU 454 Cb -0.12 -1.68 -0.05 0.00 0.10 0.00 0.00 34.13 32.38 2wof s GLU 454 CO 0.02 0.44 0.14 -1.17 0.02 0.00 0.00 175.26 174.71 2wof s LEU 455 N -1.00 4.07 -0.08 1.80 2.96 -0.43 -0.55 118.68 125.45 2wof s LEU 455 Ca 0.09 0.11 0.02 0.00 -0.22 0.00 0.00 54.13 54.13 2wof s LEU 455 Cb -0.09 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.50 2wof s LEU 455 CO 0.01 0.09 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.31 2wof s VAL 456 N 0.88 3.07 -0.22 1.68 1.01 0.62 -0.10 120.40 127.34 2wof s VAL 456 Ca 0.07 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 2wof s VAL 456 Cb -0.13 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 2wof s VAL 456 CO 0.03 0.56 -0.03 -0.69 0.00 0.00 0.00 175.10 174.97 2wof s VAL 457 N -0.28 3.50 -0.06 2.92 1.01 0.15 -1.39 120.40 126.24 2wof s VAL 457 Ca 0.02 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 61.60 2wof s VAL 457 Cb -0.13 -2.59 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 2wof s VAL 457 CO 0.03 0.42 -0.23 -0.60 0.00 0.00 0.00 175.10 174.72 2wof s ARG 458 N 1.40 2.47 -0.01 2.72 3.52 0.30 -0.41 118.95 128.94 2wof s ARG 458 Ca 0.05 -0.83 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 2wof s ARG 458 Cb -0.14 -2.05 0.02 0.00 -1.56 0.00 0.00 34.95 31.22 2wof s ARG 458 CO -0.02 0.31 0.01 -0.46 -0.81 0.00 0.00 175.30 174.33 2wof s TRP 459 N -0.00 0.07 -0.10 5.12 -0.00 -0.53 -0.69 118.94 122.81 2wof s TRP 459 Ca -0.07 0.05 0.04 0.00 -0.00 0.00 0.00 56.10 56.12 2wof s TRP 459 Cb -0.14 -0.16 -0.00 0.00 -0.00 0.00 0.00 33.47 33.17 2wof s TRP 459 CO 0.04 -0.05 -0.24 0.42 -0.00 0.00 0.00 176.95 177.12 2wof s ILE 460 N 0.57 2.05 -0.03 5.86 1.01 -1.26 -0.83 121.20 128.57 2wof s ILE 460 Ca -0.05 -1.02 0.04 0.00 0.00 0.00 0.00 60.65 59.63 2wof s ILE 460 Cb -0.07 -1.77 -0.01 0.00 0.01 0.00 0.00 42.46 40.62 2wof s ILE 460 CO -0.01 0.56 -0.16 -0.55 0.00 0.00 0.00 174.94 174.78 2wof s SER 461 N 0.33 1.95 -0.11 3.58 0.15 -0.17 -0.56 113.70 118.86 2wof s SER 461 Ca -0.19 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 56.18 2wof s SER 461 Cb -0.18 -0.43 -0.00 0.00 -1.71 0.00 0.00 66.02 63.69 2wof s SER 461 CO 0.09 0.16 -0.20 -0.89 1.20 0.00 0.00 173.24 173.60 2wof s THR 462 N -0.08 2.42 -0.31 6.45 2.01 -1.12 -0.22 115.64 124.78 2wof s THR 462 Ca -0.00 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.12 2wof s THR 462 Cb -0.09 -1.97 0.10 0.00 0.01 0.00 0.00 72.50 70.55 2wof s THR 462 CO 0.01 0.55 0.06 -0.69 -0.69 0.00 0.00 174.62 173.86 2wof s VAL 463 N 0.37 1.51 0.00 3.82 1.01 -1.26 -4.83 120.40 121.03 2wof s VAL 463 Ca -0.15 -1.76 0.00 0.00 0.00 0.00 0.00 61.98 60.07 2wof s VAL 463 Cb -0.17 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.12 2wof s VAL 463 CO 0.07 -0.58 0.00 0.61 0.00 0.00 0.00 175.10 175.20 2wof n GLY 464 N 4.59 2.34 2.19 4.51 0.00 -1.26 -4.84 105.19 112.72 2wof n GLY 464 Ca -0.01 0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 2wof n GLY 464 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2wof n ASN 465 N 10.45 6.36 -3.49 1.61 6.94 -1.26 -5.00 115.26 130.86 2wof n ASN 465 Ca 0.00 -3.08 0.00 0.00 -0.02 0.00 0.00 54.58 51.48 2wof n ASN 465 Cb 0.00 -1.18 -0.05 0.00 -2.36 0.00 0.00 39.78 36.20 2wof n ASN 465 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2wof s ASP 467 N 0.44 -0.61 -0.11 0.53 1.11 -0.13 -0.64 116.67 117.26 2wof s ASP 467 Ca 0.47 0.87 0.00 0.00 0.18 0.00 0.00 52.55 54.08 2wof s ASP 467 Cb 0.32 1.59 -0.02 0.00 1.07 0.00 0.00 42.92 45.87 2wof s ASP 467 CO -0.11 -0.13 -0.12 -0.31 1.18 0.00 0.00 175.17 175.68 2wof s TYR 468 N 2.18 2.82 -0.17 4.23 2.02 0.69 -1.25 117.35 127.87 2wof s TYR 468 Ca -0.05 -0.48 -0.02 0.00 -0.37 0.00 0.00 57.07 56.15 2wof s TYR 468 Cb -0.06 -1.81 -0.02 0.00 -0.40 0.00 0.00 41.96 39.67 2wof s TYR 468 CO -0.17 -0.09 -0.08 0.42 -1.57 0.00 0.00 175.55 174.06 2wof s ILE 469 N 0.10 3.40 -0.13 2.71 1.01 0.13 -1.00 121.20 127.41 2wof s ILE 469 Ca -0.05 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.09 2wof s ILE 469 Cb -0.15 -2.48 -0.01 0.00 0.01 0.00 0.00 42.46 39.83 2wof s ILE 469 CO 0.04 0.48 -0.16 -0.36 0.00 0.00 0.00 174.94 174.95 2wof s PHE 470 N 0.72 2.75 -0.12 3.97 0.40 -0.01 0.76 117.98 126.45 2wof s PHE 470 Ca -0.04 -0.78 0.01 0.00 -0.60 0.00 0.00 56.93 55.53 2wof s PHE 470 Cb -0.15 -1.82 -0.01 0.00 0.51 0.00 0.00 43.02 41.56 2wof s PHE 470 CO 0.02 -0.29 -0.16 -0.51 0.70 0.00 0.00 175.22 174.98 2wof s ASP 471 N 0.39 3.73 -0.29 1.36 1.01 -0.19 -1.45 116.67 121.23 2wof s ASP 471 Ca -0.12 -0.40 -0.08 0.00 0.71 0.00 0.00 52.55 52.66 2wof s ASP 471 Cb -0.16 -1.55 -0.00 0.00 1.01 0.00 0.00 42.92 42.21 2wof s ASP 471 CO 0.06 0.16 0.10 0.26 0.21 0.00 0.00 175.17 175.96 2wof s TRP 472 N 0.37 3.14 -0.26 4.23 0.52 0.45 -1.75 118.94 125.65 2wof s TRP 472 Ca -0.13 -0.77 -0.00 0.00 0.02 0.00 0.00 56.10 55.22 2wof s TRP 472 Cb -0.16 -2.28 0.04 0.00 -1.15 0.00 0.00 33.47 29.91 2wof s TRP 472 CO 0.06 -0.51 -0.07 0.42 0.02 0.00 0.00 176.95 176.88 2wof s ILE 473 N 1.55 2.67 -0.41 2.03 1.01 0.98 -0.68 121.20 128.36 2wof s ILE 473 Ca 0.04 -1.23 -0.15 0.00 0.00 0.00 0.00 60.65 59.31 2wof s ILE 473 Cb -0.17 -2.42 0.03 0.00 0.01 0.00 0.00 42.46 39.91 2wof s ILE 473 CO 0.04 0.11 0.30 -0.36 0.00 0.00 0.00 174.94 175.03 2wof s PHE 474 N 1.26 3.24 0.24 3.97 0.08 0.85 -0.54 117.98 127.08 2wof s PHE 474 Ca -0.03 -0.67 -0.21 0.00 0.12 0.00 0.00 56.93 56.15 2wof s PHE 474 Cb -0.18 -2.65 -0.08 0.00 -0.57 0.00 0.00 43.02 39.54 2wof s PHE 474 CO -0.05 -0.62 0.76 -1.01 -0.10 0.00 0.00 175.22 174.20 2wof s HIS 475 N 1.66 3.65 0.52 0.36 3.76 -0.18 -1.32 115.29 123.75 2wof s HIS 475 Ca 0.05 1.45 0.19 0.00 -0.15 0.00 0.00 55.06 56.60 2wof s HIS 475 Cb -0.20 -2.66 1.32 0.00 1.11 0.00 0.00 32.58 32.15 2wof s HIS 475 CO 0.09 0.31 2.09 1.49 -0.85 0.00 0.00 174.74 177.88 2wof h GLU 476 N 3.36 0.00 -0.26 1.40 4.81 -1.83 -2.09 114.58 119.97 2wof h GLU 476 Ca -0.48 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2wof h GLU 476 Cb 1.19 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2wof h GLU 476 CO 0.65 0.00 0.00 0.27 -0.73 0.00 0.00 179.01 179.20 2wof n ASN 477 N -4.48 1.24 0.00 1.04 0.23 -1.26 -4.86 115.26 107.18 2wof n ASN 477 Ca 0.02 -2.02 0.00 0.00 -0.53 0.00 0.00 54.58 52.05 2wof n ASN 477 Cb 0.28 -0.17 0.00 0.00 -2.08 0.00 0.00 39.78 37.81 2wof n ASN 477 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wof n GLY 478 N 0.80 0.96 3.78 4.83 0.00 -0.78 -4.77 105.19 110.02 2wof n GLY 478 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 2wof n GLY 478 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wof s THR 479 N -2.21 3.64 -0.09 2.61 2.01 -1.25 -4.42 115.64 115.92 2wof s THR 479 Ca 0.00 1.17 0.03 0.00 0.31 0.00 0.00 61.69 63.20 2wof s THR 479 Cb 0.00 -3.56 0.00 0.00 0.01 0.00 0.00 72.50 68.95 2wof s THR 479 CO 0.00 -0.08 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.02 2wof s ILE 480 N -1.74 1.78 0.01 1.82 1.01 -0.18 -1.01 121.20 122.88 2wof s ILE 480 Ca 0.62 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 60.43 2wof s ILE 480 Cb -0.21 -1.56 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 2wof s ILE 480 CO 0.26 0.50 0.02 -0.83 0.00 0.00 0.00 174.94 174.89 2wof s GLY 481 N 0.47 1.92 -0.17 6.18 0.00 0.29 -0.08 107.32 115.94 2wof s GLY 481 Ca -0.17 -0.96 -0.01 0.00 0.00 0.00 0.00 44.72 43.58 2wof s GLY 481 CO 0.07 -0.85 -0.01 -0.42 0.00 0.00 0.00 173.10 171.89 2wof s ILE 482 N -1.15 0.80 -0.02 0.90 1.01 -0.89 -0.01 121.20 121.84 2wof s ILE 482 Ca 0.22 -0.53 0.07 0.00 0.00 0.00 0.00 60.65 60.41 2wof s ILE 482 Cb -0.12 -1.11 -0.02 0.00 0.01 0.00 0.00 42.46 41.23 2wof s ILE 482 CO 0.13 0.00 -0.24 -1.81 0.00 0.00 0.00 174.94 173.02 2wof s ASP 483 N 1.75 2.83 -0.07 3.58 1.11 -0.72 -0.75 116.67 124.41 2wof s ASP 483 Ca 0.00 -0.44 0.05 0.00 0.18 0.00 0.00 52.55 52.34 2wof s ASP 483 Cb -0.16 -0.32 -0.01 0.00 1.07 0.00 0.00 42.92 43.50 2wof s ASP 483 CO -0.07 0.30 -0.22 0.00 1.18 0.00 0.00 175.17 176.35 2wof s ALA 484 N -0.56 2.28 -0.01 5.23 0.00 -0.63 -1.02 121.76 127.05 2wof s ALA 484 Ca 0.09 -1.02 0.08 0.00 0.00 0.00 0.00 51.96 51.12 2wof s ALA 484 Cb -0.09 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 2wof s ALA 484 CO -0.01 0.40 -0.25 0.20 0.00 0.00 0.00 175.76 176.10 2wof s GLY 485 N -0.13 1.25 -0.08 0.00 0.00 0.23 -1.08 107.32 107.51 2wof s GLY 485 Ca -0.04 -1.11 0.04 0.00 0.00 0.00 0.00 44.72 43.61 2wof s GLY 485 CO 0.04 -0.94 -0.20 0.00 0.00 0.00 0.00 173.10 172.00 2wof s ALA 486 N -0.63 1.85 0.00 3.20 0.00 -0.33 0.19 121.76 126.04 2wof s ALA 486 Ca 0.10 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.26 2wof s ALA 486 Cb -0.10 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.33 2wof s ALA 486 CO -0.00 0.26 0.00 -2.37 0.00 0.00 0.00 175.76 173.64 2wof n THR 487 N 3.48 0.00 0.00 0.00 5.66 -0.38 -1.47 114.28 121.57 2wof n THR 487 Ca -0.20 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.80 2wof n THR 487 Cb 0.53 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 2wof n THR 487 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2wof n GLY 488 N 0.00 -0.49 3.37 1.09 0.00 -1.26 -0.95 105.19 106.95 2wof n GLY 488 Ca 0.00 -1.98 -0.33 0.00 0.00 0.00 0.00 46.02 43.71 2wof n GLY 488 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wof s ILE 489 N 0.00 3.03 0.45 -0.61 -1.09 0.19 -1.49 121.20 121.68 2wof s ILE 489 Ca 0.00 -0.67 -0.24 0.00 -2.23 0.00 0.00 60.65 57.50 2wof s ILE 489 Cb 0.00 -2.27 -0.08 0.00 -1.58 0.00 0.00 42.46 38.54 2wof s ILE 489 CO 0.00 0.53 1.29 -1.61 -1.23 0.00 0.00 174.94 173.92 2wof s GLU 490 N 0.30 3.74 -0.32 2.79 2.02 -1.26 -4.73 118.70 121.23 2wof s GLU 490 Ca -0.10 2.11 -0.29 0.00 0.02 0.00 0.00 54.97 56.71 2wof s GLU 490 Cb -0.16 -2.57 0.00 0.00 0.10 0.00 0.00 34.13 31.50 2wof s GLU 490 CO 0.06 -0.67 1.36 0.00 0.02 0.00 0.00 175.26 176.02 2wof s ALA 491 N -1.33 3.27 0.27 5.21 0.00 -1.26 -4.94 121.76 122.98 2wof s ALA 491 Ca 0.62 0.06 0.10 0.00 0.00 0.00 0.00 51.96 52.73 2wof s ALA 491 Cb -0.37 -3.83 -0.04 0.00 0.00 0.00 0.00 23.12 18.88 2wof s ALA 491 CO 0.46 -1.96 -0.04 0.14 0.00 0.00 0.00 175.76 174.37 2wof s VAL 492 N 4.73 3.27 -0.17 0.00 -7.23 -1.26 -3.61 120.40 116.14 2wof s VAL 492 Ca 0.59 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.73 2wof s VAL 492 Cb -0.16 -2.75 -0.02 0.00 0.56 0.00 0.00 36.38 34.00 2wof s VAL 492 CO 0.26 -0.38 -0.05 -0.75 -0.31 0.00 0.00 175.10 173.88 2wof s LYS 493 N -3.65 3.58 0.09 4.82 2.20 -0.18 -4.83 119.74 121.77 2wof s LYS 493 Ca 0.31 -0.56 -0.30 0.00 -0.36 0.00 0.00 55.97 55.06 2wof s LYS 493 Cb -0.06 -2.91 -0.06 0.00 -1.51 0.00 0.00 37.83 33.29 2wof s LYS 493 CO 0.19 0.14 1.17 0.20 -0.36 0.00 0.00 175.35 176.70 2wof s GLY 494 N 0.61 2.53 0.20 5.54 0.00 -1.26 -2.16 107.32 112.79 2wof s GLY 494 Ca -0.03 0.84 0.00 0.00 0.00 0.00 0.00 44.72 45.53 2wof s GLY 494 CO 0.03 1.94 0.08 -1.34 0.00 0.00 0.00 173.10 173.81 2wof s VAL 495 N 0.72 0.35 0.11 1.40 -7.23 -0.42 -4.87 120.40 110.46 2wof s VAL 495 Ca 0.56 -1.98 0.05 0.00 -1.81 0.00 0.00 61.98 58.81 2wof s VAL 495 Cb -0.29 -2.41 -0.22 0.00 0.56 0.00 0.00 36.38 34.02 2wof s VAL 495 CO 0.31 -0.16 1.25 0.11 -0.31 0.00 0.00 175.10 176.30 2wof h LYS 496 N 2.59 0.04 -6.81 4.82 1.57 -1.94 -3.39 116.57 113.45 2wof h LYS 496 Ca -0.37 -0.07 -0.52 0.00 -1.87 0.00 0.00 60.65 57.82 2wof h LYS 496 Cb 1.23 0.02 0.06 0.00 0.08 0.00 0.00 32.23 33.62 2wof h LYS 496 CO 0.59 1.03 0.67 0.00 -0.57 0.00 0.00 179.45 181.16 2wof s ALA 497 N -2.70 3.53 -0.10 3.86 0.00 -1.26 -4.77 121.76 120.33 2wof s ALA 497 Ca 0.00 1.24 0.11 0.00 0.00 0.00 0.00 51.96 53.31 2wof s ALA 497 Cb 0.10 -3.50 -0.24 0.00 0.00 0.00 0.00 23.12 19.48 2wof s ALA 497 CO 0.83 -0.64 0.45 1.63 0.00 0.00 0.00 175.76 178.04 2wof n LYS 498 N 1.52 0.66 -4.21 0.00 5.02 -1.26 -0.67 118.16 119.21 2wof n LYS 498 Ca 0.03 0.22 -0.13 0.00 -2.02 0.00 0.00 58.31 56.41 2wof n LYS 498 Cb 0.42 -1.71 -0.10 0.00 -0.02 0.00 0.00 35.03 33.62 2wof n LYS 498 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2wof s THR 499 N -2.57 0.05 -1.66 -0.18 -4.23 -1.26 -4.16 115.64 101.63 2wof s THR 499 Ca -0.09 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.59 2wof s THR 499 Cb 0.07 -2.51 0.38 0.00 1.34 0.00 0.00 72.50 71.78 2wof s THR 499 CO 0.81 0.00 1.48 0.23 -0.54 0.00 0.00 174.62 176.60 2wof n MET 500 N -0.30 0.37 0.06 3.99 2.81 -1.26 -2.82 117.12 119.97 2wof n MET 500 Ca 0.02 0.07 0.02 0.00 -1.81 0.00 0.00 57.70 56.01 2wof n MET 500 Cb 0.66 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 31.61 2wof n MET 500 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2wof h HIS 501 N 0.00 0.00 -4.03 2.03 3.86 -1.99 -3.45 115.15 111.56 2wof h HIS 501 Ca 0.00 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.71 2wof h HIS 501 Cb 0.09 0.00 0.20 0.00 1.06 0.00 0.00 27.41 28.77 2wof h HIS 501 CO 0.00 0.46 0.15 -0.25 0.86 0.00 0.00 177.93 179.15 2wof n ASP 502 N -2.88 -0.14 0.10 2.45 8.00 -1.13 -4.95 116.55 118.00 2wof n ASP 502 Ca -0.07 0.30 -0.03 0.00 0.71 0.00 0.00 54.79 55.70 2wof n ASP 502 Cb 0.77 -1.43 0.02 0.00 -0.02 0.00 0.00 41.12 40.46 2wof n ASP 502 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2wof h GLU 503 N -2.07 0.00 -0.06 -1.24 5.08 -1.91 -2.72 114.58 111.67 2wof h GLU 503 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2wof h GLU 503 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2wof h GLU 503 CO 0.42 0.78 0.00 0.25 -1.00 0.00 0.00 179.01 179.46 2wof n THR 504 N -3.48 0.07 0.03 1.13 -2.24 -1.26 -4.54 114.28 103.99 2wof n THR 504 Ca -0.00 -0.18 -0.11 0.00 -2.27 0.00 0.00 64.05 61.49 2wof n THR 504 Cb 0.79 0.09 -0.05 0.00 -2.10 0.00 0.00 70.33 69.06 2wof n THR 504 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wof h ALA 505 N 4.01 -0.07 -0.22 6.98 0.00 -1.77 0.44 119.26 128.64 2wof h ALA 505 Ca 0.00 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2wof h ALA 505 Cb 0.29 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2wof h ALA 505 CO 0.00 -0.58 0.04 -0.22 0.00 0.00 0.00 179.25 178.50 2wof h LYS 506 N -0.15 0.12 -0.48 0.00 3.64 -1.81 -0.03 116.57 117.87 2wof h LYS 506 Ca 0.05 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 2wof h LYS 506 Cb 0.22 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 2wof h LYS 506 CO -0.13 0.08 -0.01 -0.44 -2.27 0.00 0.00 179.45 176.68 2wof h ASP 507 N 0.13 0.83 0.09 4.20 3.32 -1.72 -2.77 116.42 120.50 2wof h ASP 507 Ca 0.10 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.83 2wof h ASP 507 Cb 0.10 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.42 2wof h ASP 507 CO -0.13 0.94 -0.05 0.44 -1.72 0.00 0.00 179.24 178.72 2wof h ASP 508 N 0.70 0.00 -0.34 6.45 3.32 0.41 -3.04 116.42 123.92 2wof h ASP 508 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2wof h ASP 508 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2wof h ASP 508 CO 0.03 0.05 0.00 0.35 -1.72 0.00 0.00 179.24 177.95 2wof n THR 509 N -4.05 1.90 0.13 0.35 -2.24 -0.07 -4.55 114.28 105.75 2wof n THR 509 Ca -0.03 -1.54 0.04 0.00 -2.27 0.00 0.00 64.05 60.25 2wof n THR 509 Cb 0.14 -0.00 0.46 0.00 -2.10 0.00 0.00 70.33 68.82 2wof n THR 509 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2wof h ARG 510 N 2.20 0.23 -0.11 -0.78 2.43 -1.38 -2.96 114.38 114.01 2wof h ARG 510 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2wof h ARG 510 Cb 1.27 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2wof h ARG 510 CO 0.18 0.28 0.00 0.66 -1.51 0.00 0.00 179.97 179.58 2wof n TYR 511 N -4.37 0.22 0.00 2.20 4.01 -1.26 -5.06 117.16 112.89 2wof n TYR 511 Ca -0.01 -0.63 0.00 0.00 -0.16 0.00 0.00 57.90 57.10 2wof n TYR 511 Cb 0.19 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 2wof n TYR 511 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wof n GLY 512 N -0.42 -0.41 3.84 2.72 0.00 -1.12 -0.93 105.19 108.87 2wof n GLY 512 Ca 0.08 -0.98 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 2wof n GLY 512 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wof s THR 513 N -2.00 4.76 -0.68 2.61 2.01 -1.23 -4.33 115.64 116.77 2wof s THR 513 Ca 0.00 0.96 -0.27 0.00 0.31 0.00 0.00 61.69 62.69 2wof s THR 513 Cb 0.00 -3.76 0.02 0.00 0.01 0.00 0.00 72.50 68.77 2wof s THR 513 CO 0.00 0.19 1.32 -0.22 -0.69 0.00 0.00 174.62 175.22 2wof s LEU 514 N -2.07 3.25 0.00 4.42 2.96 -1.26 -0.86 118.68 125.12 2wof s LEU 514 Ca 0.41 -0.22 0.23 0.00 -0.22 0.00 0.00 54.13 54.33 2wof s LEU 514 Cb -0.15 -2.72 0.04 0.00 0.50 0.00 0.00 46.19 43.85 2wof s LEU 514 CO 0.20 -1.80 1.09 2.30 -1.32 0.00 0.00 176.35 176.82 2wof n ILE 515 N 6.54 0.00 -3.83 6.68 -5.35 -0.60 -4.79 119.36 118.01 2wof n ILE 515 Ca 0.06 -0.08 -0.06 0.00 -0.27 0.00 0.00 62.75 62.40 2wof n ILE 515 Cb 0.49 0.89 -0.02 0.00 -1.74 0.00 0.00 39.64 39.26 2wof n ILE 515 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2wof s ASP 516 N -2.82 -0.22 0.13 7.28 -1.08 -1.13 -4.57 116.67 114.26 2wof s ASP 516 Ca 0.13 -0.58 -0.33 0.00 -0.52 0.00 0.00 52.55 51.25 2wof s ASP 516 Cb 0.17 0.66 -0.12 0.00 -1.46 0.00 0.00 42.92 42.17 2wof s ASP 516 CO 0.73 -1.23 1.74 1.41 0.52 0.00 0.00 175.17 178.34 2wof n HIS 517 N -0.47 2.50 -1.20 -5.34 8.25 -1.26 -1.50 115.22 116.20 2wof n HIS 517 Ca -0.05 0.04 -0.07 0.00 -0.26 0.00 0.00 57.72 57.39 2wof n HIS 517 Cb 0.60 -2.65 -0.03 0.00 1.12 0.00 0.00 29.99 29.02 2wof n HIS 517 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2wof n ASN 518 N 4.69 -5.04 -3.89 0.41 4.13 0.15 -4.95 115.26 110.76 2wof n ASN 518 Ca 0.18 0.17 -0.24 0.00 1.68 0.00 0.00 54.58 56.37 2wof n ASN 518 Cb 0.33 -3.15 -0.17 0.00 -1.54 0.00 0.00 39.78 35.25 2wof n ASN 518 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2wof s ILE 519 N -1.86 0.81 -0.13 2.41 1.01 -0.56 -1.30 121.20 121.59 2wof s ILE 519 Ca 0.00 -0.20 0.03 0.00 0.00 0.00 0.00 60.65 60.48 2wof s ILE 519 Cb 0.00 -0.85 0.00 0.00 0.01 0.00 0.00 42.46 41.63 2wof s ILE 519 CO 0.00 0.32 -0.21 -0.69 0.00 0.00 0.00 174.94 174.36 2wof s VAL 520 N 1.48 2.21 -0.94 2.92 1.01 -0.92 -1.56 120.40 124.59 2wof s VAL 520 Ca -0.01 -0.94 -0.24 0.00 0.00 0.00 0.00 61.98 60.79 2wof s VAL 520 Cb -0.13 -1.88 0.04 0.00 0.00 0.00 0.00 36.38 34.41 2wof s VAL 520 CO -0.04 0.55 1.43 -0.83 0.00 0.00 0.00 175.10 176.20 2wof s GLY 521 N 0.60 1.12 0.22 4.51 0.00 -0.04 -1.01 107.32 112.73 2wof s GLY 521 Ca -0.12 -2.00 -0.32 0.00 0.00 0.00 0.00 44.72 42.28 2wof s GLY 521 CO 0.03 2.71 1.60 2.41 0.00 0.00 0.00 173.10 179.85 2wof n THR 522 N 6.80 0.42 -1.76 0.90 -1.04 -1.24 -3.56 114.28 114.80 2wof n THR 522 Ca 0.26 -0.11 -0.41 0.00 -2.04 0.00 0.00 64.05 61.75 2wof n THR 522 Cb 0.50 -1.78 -0.00 0.00 -1.82 0.00 0.00 70.33 67.23 2wof n THR 522 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2wof n THR 523 N 3.01 1.94 -3.84 12.58 -1.04 -0.11 -4.92 114.28 121.91 2wof n THR 523 Ca 0.14 -0.48 -0.08 0.00 -2.04 0.00 0.00 64.05 61.58 2wof n THR 523 Cb 0.33 -1.90 0.01 0.00 -1.82 0.00 0.00 70.33 66.95 2wof n THR 523 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 2wof s HIS 524 N -1.05 0.06 0.20 -1.42 -3.43 -1.13 -2.54 115.29 105.99 2wof s HIS 524 Ca 0.54 -0.66 0.10 0.00 -0.80 0.00 0.00 55.06 54.25 2wof s HIS 524 Cb -0.49 0.76 -0.04 0.00 -1.43 0.00 0.00 32.58 31.37 2wof s HIS 524 CO 0.63 -1.45 -0.18 -0.65 -2.00 0.00 0.00 174.74 171.09 2wof s GLN 525 N -2.85 1.75 -0.21 -0.38 -0.21 -0.51 -0.80 119.66 116.46 2wof s GLN 525 Ca 0.15 -1.45 -0.00 0.00 0.02 0.00 0.00 55.36 54.08 2wof s GLN 525 Cb -0.05 -1.96 0.02 0.00 1.00 0.00 0.00 33.01 32.02 2wof s GLN 525 CO 0.10 0.41 -0.13 -1.01 -2.12 0.00 0.00 175.29 172.54 2wof s HIS 526 N -1.77 2.94 -0.27 0.91 3.76 -0.71 -3.20 115.29 116.94 2wof s HIS 526 Ca 0.23 -1.61 0.01 0.00 -0.15 0.00 0.00 55.06 53.55 2wof s HIS 526 Cb -0.08 -1.98 0.08 0.00 1.11 0.00 0.00 32.58 31.71 2wof s HIS 526 CO 0.12 -0.76 -0.00 0.42 -0.85 0.00 0.00 174.74 173.67 2wof s ILE 527 N 1.30 1.61 0.05 0.60 1.01 0.37 -0.63 121.20 125.51 2wof s ILE 527 Ca 0.02 -1.54 -0.04 0.00 0.00 0.00 0.00 60.65 59.10 2wof s ILE 527 Cb -0.15 -2.00 -0.05 0.00 0.01 0.00 0.00 42.46 40.27 2wof s ILE 527 CO -0.08 -0.32 0.26 -0.31 0.00 0.00 0.00 174.94 174.48 2wof s TYR 528 N 1.31 3.54 -0.02 3.97 2.02 -0.32 -0.11 117.35 127.74 2wof s TYR 528 Ca 0.01 0.44 0.00 0.00 -0.37 0.00 0.00 57.07 57.15 2wof s TYR 528 Cb -0.19 -1.90 0.02 0.00 -0.40 0.00 0.00 41.96 39.50 2wof s TYR 528 CO -0.10 0.58 0.01 1.21 -1.57 0.00 0.00 175.55 175.68 2wof s ASN 529 N -2.12 0.20 -0.15 2.29 3.84 -0.03 -1.71 114.94 117.26 2wof s ASN 529 Ca 0.32 0.00 -0.03 0.00 0.21 0.00 0.00 52.86 53.37 2wof s ASN 529 Cb -0.13 -0.11 -0.02 0.00 -0.55 0.00 0.00 41.25 40.44 2wof s ASN 529 CO 0.22 -0.09 -0.06 -0.36 -2.79 0.00 0.00 177.10 174.02 2wof s PHE 530 N 0.82 2.97 -0.48 0.43 0.08 -0.13 0.09 117.98 121.76 2wof s PHE 530 Ca -0.07 -0.40 -0.17 0.00 0.12 0.00 0.00 56.93 56.41 2wof s PHE 530 Cb -0.11 -1.93 0.06 0.00 -0.57 0.00 0.00 43.02 40.47 2wof s PHE 530 CO -0.02 -0.09 0.51 0.50 -0.10 0.00 0.00 175.22 176.02 2wof s ARG 531 N 0.38 3.06 -0.37 0.44 3.52 -0.80 -1.04 118.95 124.14 2wof s ARG 531 Ca -0.06 -1.06 -0.02 0.00 -0.13 0.00 0.00 55.73 54.46 2wof s ARG 531 Cb -0.15 -4.09 0.09 0.00 -1.56 0.00 0.00 34.95 29.24 2wof s ARG 531 CO 0.04 -1.09 0.12 -0.51 -0.81 0.00 0.00 175.30 173.04 2wof s LEU 532 N 2.16 4.75 -0.96 -0.88 1.43 0.14 -2.09 118.68 123.24 2wof s LEU 532 Ca 0.10 -1.78 -0.20 0.00 -1.03 0.00 0.00 54.13 51.22 2wof s LEU 532 Cb -0.21 -1.77 0.10 0.00 0.03 0.00 0.00 46.19 44.34 2wof s LEU 532 CO 0.10 -0.43 1.25 -0.62 0.23 0.00 0.00 176.35 176.88 2wof s ASP 533 N 1.54 6.57 -0.01 2.29 2.15 0.71 0.08 116.67 129.99 2wof s ASP 533 Ca 0.04 -1.79 -0.16 0.00 0.43 0.00 0.00 52.55 51.07 2wof s ASP 533 Cb -0.21 -2.47 -0.06 0.00 -0.30 0.00 0.00 42.92 39.89 2wof s ASP 533 CO -0.03 -1.24 0.44 -0.76 -0.17 0.00 0.00 175.17 173.41 2wof s LEU 534 N 3.60 4.45 -0.47 -1.34 1.43 -1.25 -0.18 118.68 124.92 2wof s LEU 534 Ca 0.38 0.98 0.03 0.00 -1.03 0.00 0.00 54.13 54.49 2wof s LEU 534 Cb -0.03 -2.65 0.13 0.00 0.03 0.00 0.00 46.19 43.67 2wof s LEU 534 CO -0.09 0.26 0.23 -1.81 0.23 0.00 0.00 176.35 175.17 2wof s ASP 535 N -0.77 4.04 -0.74 2.29 1.01 -0.69 -4.57 116.67 117.24 2wof s ASP 535 Ca 0.25 -2.74 -0.26 0.00 0.71 0.00 0.00 52.55 50.50 2wof s ASP 535 Cb -0.17 -1.35 0.02 0.00 1.01 0.00 0.00 42.92 42.43 2wof s ASP 535 CO 0.14 -0.26 1.44 -0.69 0.21 0.00 0.00 175.17 176.00 2wof s VAL 536 N 0.13 3.65 -1.40 -1.27 1.01 -1.26 -3.15 120.40 118.11 2wof s VAL 536 Ca 0.17 0.24 -0.05 0.00 0.00 0.00 0.00 61.98 62.33 2wof s VAL 536 Cb -0.25 -4.70 0.03 0.00 0.00 0.00 0.00 36.38 31.46 2wof s VAL 536 CO -0.01 -1.64 0.39 -0.67 0.00 0.00 0.00 175.10 173.16 2wof n ASP 537 N 10.17 -4.91 0.00 3.32 -0.08 0.09 -4.50 116.55 120.64 2wof n ASP 537 Ca 0.10 -0.20 0.00 0.00 -1.51 0.00 0.00 54.79 53.19 2wof n ASP 537 Cb 0.50 -4.03 0.00 0.00 2.34 0.00 0.00 41.12 39.92 2wof n ASP 537 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2wof n GLY 538 N -1.22 3.40 0.08 0.27 0.00 -1.19 -4.84 105.19 101.68 2wof n GLY 538 Ca -0.10 -1.74 -0.05 0.00 0.00 0.00 0.00 46.02 44.13 2wof n GLY 538 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2wof h GLU 539 N 0.00 0.00 -6.21 1.61 4.11 -1.85 -3.39 114.58 108.85 2wof h GLU 539 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.88 2wof h GLU 539 Cb 0.00 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.16 2wof h GLU 539 CO 0.00 0.86 0.98 -0.80 0.07 0.00 0.00 179.01 180.13 2wof s ASN 540 N -6.61 6.17 0.24 3.06 0.01 -1.26 -2.79 114.94 113.75 2wof s ASN 540 Ca 0.01 -0.55 0.09 0.00 -0.71 0.00 0.00 52.86 51.71 2wof s ASN 540 Cb 0.09 -2.54 -0.05 0.00 0.41 0.00 0.00 41.25 39.17 2wof s ASN 540 CO 0.81 -1.77 -0.16 0.20 -1.51 0.00 0.00 177.10 174.66 2wof s ASN 541 N 3.74 3.00 0.09 -1.22 0.02 -0.91 -4.25 114.94 115.42 2wof s ASN 541 Ca 0.33 -1.03 0.05 0.00 -1.02 0.00 0.00 52.86 51.19 2wof s ASN 541 Cb -0.09 -0.21 -0.03 0.00 0.02 0.00 0.00 41.25 40.94 2wof s ASN 541 CO 0.14 -0.09 -0.12 -0.44 0.02 0.00 0.00 177.10 176.61 2wof s SER 542 N -3.40 1.62 -0.19 -1.22 0.01 0.80 -1.62 113.70 109.69 2wof s SER 542 Ca 0.26 -0.72 -0.17 0.00 1.31 0.00 0.00 55.95 56.64 2wof s SER 542 Cb -0.02 -0.03 -0.04 0.00 0.21 0.00 0.00 66.02 66.14 2wof s SER 542 CO 0.10 -0.16 0.43 -0.22 0.41 0.00 0.00 173.24 173.80 2wof s LEU 543 N -2.11 4.17 -0.04 2.44 2.96 -1.26 -0.58 118.68 124.26 2wof s LEU 543 Ca 0.02 0.58 0.06 0.00 -0.22 0.00 0.00 54.13 54.57 2wof s LEU 543 Cb -0.07 -2.57 -0.01 0.00 0.50 0.00 0.00 46.19 44.04 2wof s LEU 543 CO 0.02 -0.08 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.04 2wof s VAL 544 N 1.28 1.85 -0.09 1.68 1.01 -0.51 -1.05 120.40 124.57 2wof s VAL 544 Ca 0.21 -0.98 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 2wof s VAL 544 Cb -0.15 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 2wof s VAL 544 CO 0.08 0.52 0.12 0.00 0.00 0.00 0.00 175.10 175.82 2wof s ALA 545 N -0.32 3.77 -0.19 5.51 0.00 0.48 -0.71 121.76 130.30 2wof s ALA 545 Ca 0.02 -0.70 -0.02 0.00 0.00 0.00 0.00 51.96 51.26 2wof s ALA 545 Cb -0.11 -1.85 0.06 0.00 0.00 0.00 0.00 23.12 21.22 2wof s ALA 545 CO 0.01 0.64 0.01 -1.64 0.00 0.00 0.00 175.76 174.78 2wof s MET 546 N -1.18 0.90 -0.40 0.00 -1.94 0.68 -2.15 119.30 115.21 2wof s MET 546 Ca 0.17 -0.52 -0.10 0.00 -1.71 0.00 0.00 55.69 53.53 2wof s MET 546 Cb -0.12 -2.15 0.05 0.00 2.01 0.00 0.00 34.83 34.62 2wof s MET 546 CO 0.06 -0.60 0.24 -0.51 -0.01 0.00 0.00 175.02 174.20 2wof s ASP 547 N 1.75 5.69 0.25 3.03 1.01 -0.47 -0.26 116.67 127.67 2wof s ASP 547 Ca -0.02 -1.26 -0.31 0.00 0.71 0.00 0.00 52.55 51.67 2wof s ASP 547 Cb -0.17 -2.01 -0.13 0.00 1.01 0.00 0.00 42.92 41.62 2wof s ASP 547 CO -0.07 -0.47 1.50 -2.65 0.21 0.00 0.00 175.17 173.68 2wof n PRO 548 N 4.96 2.29 -3.97 8.23 -0.02 -1.26 -1.67 135.00 143.56 2wof n PRO 548 Ca -0.11 0.82 -0.09 0.00 -2.02 0.00 0.00 63.50 62.10 2wof n PRO 548 Cb 0.44 -2.53 -0.10 0.00 -0.02 0.00 0.00 33.50 31.29 2wof n PRO 548 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2wof s VAL 549 N 0.11 0.16 -0.30 -1.45 -7.23 0.10 -4.92 120.40 106.86 2wof s VAL 549 Ca 0.68 -1.28 -0.15 0.00 -1.81 0.00 0.00 61.98 59.43 2wof s VAL 549 Cb -0.60 -1.02 -0.03 0.00 0.56 0.00 0.00 36.38 35.29 2wof s VAL 549 CO 0.47 -0.70 0.36 -0.69 -0.31 0.00 0.00 175.10 174.23 2wof s VAL 550 N -2.93 5.18 0.02 1.32 1.01 -1.26 -0.62 120.40 123.12 2wof s VAL 550 Ca -0.02 0.32 0.08 0.00 0.00 0.00 0.00 61.98 62.37 2wof s VAL 550 Cb 0.01 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 2wof s VAL 550 CO -0.06 0.05 -0.24 -0.54 0.00 0.00 0.00 175.10 174.31 2wof s LYS 551 N 2.04 1.95 0.39 2.72 -0.14 -0.45 -4.93 119.74 121.34 2wof s LYS 551 Ca 0.13 -1.03 -0.25 0.00 -1.36 0.00 0.00 55.97 53.47 2wof s LYS 551 Cb -0.16 -2.05 -0.11 0.00 -1.68 0.00 0.00 37.83 33.83 2wof s LYS 551 CO 0.11 0.53 1.01 -2.30 -0.76 0.00 0.00 175.35 173.94 2wof n PRO 552 N 1.92 1.37 -2.49 -1.68 -0.02 -1.26 0.03 135.00 132.86 2wof n PRO 552 Ca -0.17 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.38 2wof n PRO 552 Cb 0.52 -2.01 -0.02 0.00 -0.02 0.00 0.00 33.50 31.96 2wof n PRO 552 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2wof s ASN 553 N -0.69 7.05 -0.06 2.55 2.47 0.86 -4.59 114.94 122.53 2wof s ASN 553 Ca 0.62 1.70 0.12 0.00 0.42 0.00 0.00 52.86 55.72 2wof s ASN 553 Cb -0.58 -2.55 0.35 0.00 -1.45 0.00 0.00 41.25 37.02 2wof s ASN 553 CO 0.58 -0.63 1.29 0.35 -3.72 0.00 0.00 177.10 174.96 2wof n THR 554 N 4.90 1.40 0.15 -5.21 -2.24 -1.26 -4.67 114.28 107.35 2wof n THR 554 Ca 0.12 -1.29 0.09 0.00 -2.27 0.00 0.00 64.05 60.71 2wof n THR 554 Cb 0.46 0.26 0.19 0.00 -2.10 0.00 0.00 70.33 69.14 2wof n THR 554 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wof n ALA 555 N 0.11 2.37 0.00 6.98 0.00 -1.26 -5.07 120.51 123.63 2wof n ALA 555 Ca 0.14 -1.00 0.00 0.00 0.00 0.00 0.00 53.44 52.58 2wof n ALA 555 Cb 0.56 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.31 2wof n ALA 555 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wof n GLY 556 N 1.16 -1.36 0.00 0.00 0.00 -1.26 -5.10 105.19 98.63 2wof n GLY 556 Ca 0.16 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.61 2wof n GLY 556 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wof n GLY 557 N -1.06 -3.32 0.23 -0.02 0.00 -1.26 -4.75 105.19 95.01 2wof n GLY 557 Ca 0.00 -2.16 0.13 0.00 0.00 0.00 0.00 46.02 43.99 2wof n GLY 557 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wof h PRO 558 N 1.68 0.00 -6.83 1.61 0.11 -2.03 -3.46 132.00 123.09 2wof h PRO 558 Ca 0.00 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.60 2wof h PRO 558 Cb 0.00 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.14 2wof h PRO 558 CO 0.00 0.02 0.54 1.03 -0.21 0.00 0.00 178.00 179.37 2wof s ARG 559 N -3.31 4.54 0.34 1.05 1.81 -1.26 -4.92 118.95 117.19 2wof s ARG 559 Ca 0.05 1.95 0.23 0.00 -1.72 0.00 0.00 55.73 56.25 2wof s ARG 559 Cb 0.06 -3.15 0.22 0.00 -0.45 0.00 0.00 34.95 31.64 2wof s ARG 559 CO 0.64 0.06 1.39 1.79 -0.68 0.00 0.00 175.30 178.51 2wof h THR 560 N 3.09 0.00 -4.21 0.02 1.35 -1.92 -3.42 112.91 107.82 2wof h THR 560 Ca -0.47 -0.97 -0.12 0.00 -0.55 0.00 0.00 66.41 64.29 2wof h THR 560 Cb 1.22 1.77 -0.15 0.00 -1.73 0.00 0.00 68.15 69.26 2wof h THR 560 CO 0.67 0.00 -0.64 -0.94 -0.25 0.00 0.00 175.52 174.36 2wof s SER 561 N -5.80 0.43 0.33 5.36 1.04 -1.26 -0.10 113.70 113.71 2wof s SER 561 Ca 0.04 -0.99 0.03 0.00 0.48 0.00 0.00 55.95 55.52 2wof s SER 561 Cb 0.07 0.23 -0.05 0.00 0.10 0.00 0.00 66.02 66.37 2wof s SER 561 CO 0.71 -0.63 0.08 0.42 0.98 0.00 0.00 173.24 174.81 2wof s THR 562 N -3.93 0.91 -0.24 2.02 -4.23 0.10 -4.64 115.64 105.64 2wof s THR 562 Ca 0.09 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.55 2wof s THR 562 Cb 0.08 -2.65 -0.01 0.00 1.34 0.00 0.00 72.50 71.26 2wof s THR 562 CO -0.09 0.00 0.00 -0.04 -0.54 0.00 0.00 174.62 173.96 2wof s MET 563 N -3.87 3.35 0.26 3.99 -1.94 -1.26 -1.33 119.30 118.50 2wof s MET 563 Ca 0.33 -0.65 0.02 0.00 -1.71 0.00 0.00 55.69 53.68 2wof s MET 563 Cb 0.07 -3.14 -0.05 0.00 2.01 0.00 0.00 34.83 33.71 2wof s MET 563 CO 0.15 -0.25 0.08 -0.65 -0.01 0.00 0.00 175.02 174.34 2wof s GLN 564 N 1.50 1.43 -0.07 2.03 -0.21 0.21 -4.98 119.66 119.58 2wof s GLN 564 Ca 0.05 -1.77 0.05 0.00 0.02 0.00 0.00 55.36 53.71 2wof s GLN 564 Cb -0.15 -0.38 -0.01 0.00 1.00 0.00 0.00 33.01 33.47 2wof s GLN 564 CO -0.01 -0.26 -0.24 0.08 -2.12 0.00 0.00 175.29 172.74 2wof s VAL 565 N -3.66 2.10 -0.35 1.09 1.01 -1.26 -0.72 120.40 118.61 2wof s VAL 565 Ca 0.37 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 2wof s VAL 565 Cb 0.08 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.68 2wof s VAL 565 CO 0.13 0.57 0.60 0.20 0.00 0.00 0.00 175.10 176.60 2wof s ASN 566 N 0.01 6.40 -0.16 3.32 0.01 -0.67 -4.91 114.94 118.93 2wof s ASN 566 Ca -0.09 0.10 -0.02 0.00 -0.71 0.00 0.00 52.86 52.15 2wof s ASN 566 Cb -0.15 -2.31 -0.01 0.00 0.41 0.00 0.00 41.25 39.19 2wof s ASN 566 CO 0.05 -0.56 -0.10 -1.58 -1.51 0.00 0.00 177.10 173.40 2wof s GLN 567 N 2.62 3.39 -0.04 -0.60 0.74 -1.26 -1.37 119.66 123.14 2wof s GLN 567 Ca 0.23 -0.66 -0.18 0.00 0.05 0.00 0.00 55.36 54.80 2wof s GLN 567 Cb -0.15 -2.77 0.03 0.00 1.10 0.00 0.00 33.01 31.22 2wof s GLN 567 CO 0.14 0.06 0.39 1.52 -0.55 0.00 0.00 175.29 176.86 2wof s TYR 568 N 0.76 -0.30 0.29 1.67 1.13 -0.92 -4.99 117.35 115.00 2wof s TYR 568 Ca -0.04 0.53 -0.29 0.00 -1.41 0.00 0.00 57.07 55.87 2wof s TYR 568 Cb -0.15 0.16 -0.09 0.00 -1.10 0.00 0.00 41.96 40.78 2wof s TYR 568 CO 0.01 -0.41 1.06 -0.80 -2.51 0.00 0.00 175.55 172.90 2wof s ASN 569 N -1.11 7.25 -0.41 -0.18 -0.87 -1.26 -0.39 114.94 117.97 2wof s ASN 569 Ca -0.11 2.16 -0.13 0.00 -1.57 0.00 0.00 52.86 53.21 2wof s ASN 569 Cb -0.04 -2.62 0.04 0.00 -0.02 0.00 0.00 41.25 38.62 2wof s ASN 569 CO 0.05 -0.15 0.28 -0.63 -2.57 0.00 0.00 177.10 174.08 2wof s ILE 570 N -1.26 4.84 -1.07 0.60 1.01 -0.22 -4.89 121.20 120.21 2wof s ILE 570 Ca 0.46 -0.95 0.24 0.00 0.00 0.00 0.00 60.65 60.40 2wof s ILE 570 Cb -0.29 -3.79 -0.06 0.00 0.01 0.00 0.00 42.46 38.34 2wof s ILE 570 CO 0.37 -0.38 1.25 0.61 0.00 0.00 0.00 174.94 176.79 2wof n GLY 571 N 5.07 -1.10 3.27 6.18 0.00 -1.26 -4.32 105.19 113.03 2wof n GLY 571 Ca -0.11 -0.44 -0.09 0.00 0.00 0.00 0.00 46.02 45.37 2wof n GLY 571 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wof s ASN 572 N -2.96 0.05 0.39 1.61 2.20 -1.26 -0.69 114.94 114.28 2wof s ASN 572 Ca 0.11 -0.70 0.07 0.00 -0.94 0.00 0.00 52.86 51.40 2wof s ASN 572 Cb 0.17 0.39 0.80 0.00 -2.00 0.00 0.00 41.25 40.62 2wof s ASN 572 CO 0.74 -0.81 2.01 -0.33 -2.94 0.00 0.00 177.10 175.77 2wof h GLU 573 N 2.63 0.64 -0.15 3.55 5.08 -1.55 -1.39 114.58 123.39 2wof h GLU 573 Ca -0.33 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 57.91 2wof h GLU 573 Cb 1.22 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 2wof h GLU 573 CO 0.52 0.42 -0.23 0.37 -1.00 0.00 0.00 179.01 179.09 2wof h GLN 574 N 0.66 0.42 0.00 2.33 5.75 -1.85 -1.82 115.11 120.61 2wof h GLN 574 Ca 0.24 -0.25 -0.03 0.00 -0.15 0.00 0.00 58.65 58.45 2wof h GLN 574 Cb 0.12 0.02 -0.00 0.00 1.07 0.00 0.00 27.48 28.69 2wof h GLN 574 CO -0.06 0.84 -0.14 -0.44 -2.65 0.00 0.00 178.83 176.38 2wof h ASP 575 N 0.04 0.00 1.41 -0.69 3.32 -1.89 -2.73 116.42 115.88 2wof h ASP 575 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2wof h ASP 575 Cb 0.80 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.35 2wof h ASP 575 CO 0.05 0.14 0.00 0.00 -1.72 0.00 0.00 179.24 177.71 2wof h ALA 576 N 1.86 1.00 -1.53 3.45 0.00 -0.66 -3.41 119.26 119.98 2wof h ALA 576 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 2wof h ALA 576 Cb 0.62 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.33 2wof h ALA 576 CO 0.02 0.00 0.94 0.00 0.00 0.00 0.00 179.25 180.21 2wof s ALA 577 N -3.43 2.93 0.20 0.00 0.00 -0.74 -4.16 121.76 116.55 2wof s ALA 577 Ca 0.04 -1.12 -0.13 0.00 0.00 0.00 0.00 51.96 50.75 2wof s ALA 577 Cb 0.08 -4.08 0.01 0.00 0.00 0.00 0.00 23.12 19.12 2wof s ALA 577 CO 0.59 -2.87 0.42 1.14 0.00 0.00 0.00 175.76 175.04 2wof s GLN 578 N 5.09 1.33 0.71 0.00 -2.07 0.08 -5.00 119.66 119.81 2wof s GLN 578 Ca 0.38 -1.08 -0.14 0.00 -1.82 0.00 0.00 55.36 52.70 2wof s GLN 578 Cb -0.09 0.45 0.03 0.00 -1.09 0.00 0.00 33.01 32.32 2wof s GLN 578 CO 0.20 -0.54 1.14 0.15 -1.32 0.00 0.00 175.29 174.93 2wof s LYS 579 N -3.95 2.39 -0.28 9.60 -0.14 -1.26 -1.98 119.74 124.13 2wof s LYS 579 Ca 0.15 1.50 -0.07 0.00 -1.36 0.00 0.00 55.97 56.19 2wof s LYS 579 Cb 0.01 -1.89 -0.01 0.00 -1.68 0.00 0.00 37.83 34.26 2wof s LYS 579 CO 0.01 -1.59 0.09 0.12 -0.76 0.00 0.00 175.35 173.22 2wof s PHE 580 N -2.30 3.13 -0.37 3.18 5.36 -1.26 -4.76 117.98 120.95 2wof s PHE 580 Ca 0.69 -0.73 -0.15 0.00 -0.96 0.00 0.00 56.93 55.77 2wof s PHE 580 Cb -0.23 -2.26 0.00 0.00 -0.34 0.00 0.00 43.02 40.18 2wof s PHE 580 CO 0.45 -0.49 0.35 0.34 -1.46 0.00 0.00 175.22 174.41 2wof s ASP 581 N 1.56 6.15 0.00 6.13 2.15 -1.26 -4.93 116.67 126.47 2wof s ASP 581 Ca 0.04 -0.49 0.13 0.00 0.43 0.00 0.00 52.55 52.67 2wof s ASP 581 Cb -0.16 -2.19 0.68 0.00 -0.30 0.00 0.00 42.92 40.95 2wof s ASP 581 CO 0.03 -0.40 1.31 -0.81 -0.17 0.00 0.00 175.17 175.14 2wof n PRO 582 N 5.35 0.23 0.00 4.34 -0.04 -1.26 -0.69 135.00 142.92 2wof n PRO 582 Ca -0.10 0.13 0.13 0.00 -0.04 0.00 0.00 63.50 63.63 2wof n PRO 582 Cb 0.49 -1.50 0.47 0.00 -0.04 0.00 0.00 33.50 32.91 2wof n PRO 582 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wof n GLY 583 N -0.18 -1.21 3.79 0.55 0.00 -1.26 -4.91 105.19 101.97 2wof n GLY 583 Ca 0.07 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 2wof n GLY 583 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wof s THR 584 N -2.83 2.65 -0.11 2.61 -4.23 0.13 -4.46 115.64 109.39 2wof s THR 584 Ca 0.17 -1.55 0.02 0.00 -1.18 0.00 0.00 61.69 59.16 2wof s THR 584 Cb 0.19 -3.01 -0.00 0.00 1.34 0.00 0.00 72.50 71.02 2wof s THR 584 CO 0.58 -0.05 -0.20 -0.63 -0.54 0.00 0.00 174.62 173.78 2wof s ILE 585 N -2.50 2.41 -0.17 2.99 1.01 0.64 -4.95 121.20 120.62 2wof s ILE 585 Ca 0.43 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 60.20 2wof s ILE 585 Cb -0.00 -1.96 0.02 0.00 0.01 0.00 0.00 42.46 40.52 2wof s ILE 585 CO 0.25 0.55 -0.19 -0.13 0.00 0.00 0.00 174.94 175.41 2wof s ARG 586 N 0.39 2.83 0.02 2.79 1.81 -1.26 -0.23 118.95 125.30 2wof s ARG 586 Ca -0.15 -0.77 0.02 0.00 -1.72 0.00 0.00 55.73 53.11 2wof s ARG 586 Cb -0.17 -2.45 -0.04 0.00 -0.45 0.00 0.00 34.95 31.84 2wof s ARG 586 CO 0.07 -0.20 0.01 -0.51 -0.68 0.00 0.00 175.30 173.99 2wof s LEU 587 N 1.29 3.53 -0.42 2.53 1.43 0.11 -1.39 118.68 125.76 2wof s LEU 587 Ca 0.04 -0.04 -0.14 0.00 -1.03 0.00 0.00 54.13 52.96 2wof s LEU 587 Cb -0.13 -2.08 0.04 0.00 0.03 0.00 0.00 46.19 44.04 2wof s LEU 587 CO -0.12 0.25 0.31 -0.22 0.23 0.00 0.00 176.35 176.81 2wof s LEU 588 N -1.76 5.18 0.14 1.79 2.96 0.10 -1.42 118.68 125.68 2wof s LEU 588 Ca 0.21 -1.03 0.05 0.00 -0.22 0.00 0.00 54.13 53.14 2wof s LEU 588 Cb -0.12 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 2wof s LEU 588 CO 0.13 -0.49 0.07 -0.44 -1.32 0.00 0.00 176.35 174.30 2wof s SER 589 N 1.89 5.28 -0.45 3.68 0.01 0.26 -1.77 113.70 122.60 2wof s SER 589 Ca 0.04 -0.17 -0.18 0.00 1.31 0.00 0.00 55.95 56.95 2wof s SER 589 Cb -0.20 -1.32 0.04 0.00 0.21 0.00 0.00 66.02 64.75 2wof s SER 589 CO 0.09 0.11 0.50 0.21 0.41 0.00 0.00 173.24 174.55 2wof s ASN 590 N -2.81 6.21 0.00 2.44 3.84 -0.10 -0.14 114.94 124.38 2wof s ASN 590 Ca 0.29 -0.78 0.16 0.00 0.21 0.00 0.00 52.86 52.74 2wof s ASN 590 Cb -0.11 -2.24 0.88 0.00 -0.55 0.00 0.00 41.25 39.23 2wof s ASN 590 CO 0.21 -0.68 1.42 -0.81 -2.79 0.00 0.00 177.10 174.45 2wof n PRO 591 N 5.75 0.36 0.00 0.43 -0.04 -1.26 -3.14 135.00 137.10 2wof n PRO 591 Ca -0.07 0.07 0.09 0.00 -0.04 0.00 0.00 63.50 63.55 2wof n PRO 591 Cb 0.46 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.39 2wof n PRO 591 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2wof n ASN 592 N -1.15 1.49 -3.77 3.54 3.02 -1.26 -4.96 115.26 112.16 2wof n ASN 592 Ca 0.10 -1.24 -0.14 0.00 -0.03 0.00 0.00 54.58 53.26 2wof n ASN 592 Cb 0.09 0.63 -0.15 0.00 -0.61 0.00 0.00 39.78 39.75 2wof n ASN 592 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2wof s LYS 593 N -2.28 0.02 0.23 3.52 1.02 -1.19 -5.12 119.74 115.95 2wof s LYS 593 Ca 0.13 0.24 0.11 0.00 0.02 0.00 0.00 55.97 56.47 2wof s LYS 593 Cb 0.14 -0.19 -0.05 0.00 -0.52 0.00 0.00 37.83 37.22 2wof s LYS 593 CO 0.54 -0.15 -0.18 -1.21 -0.92 0.00 0.00 175.35 173.43 2wof s GLU 594 N 0.99 1.73 0.66 1.68 2.02 -1.26 -1.06 118.70 123.47 2wof s GLU 594 Ca -0.08 -1.56 -0.08 0.00 0.02 0.00 0.00 54.97 53.27 2wof s GLU 594 Cb -0.11 -1.90 0.15 0.00 0.10 0.00 0.00 34.13 32.37 2wof s GLU 594 CO -0.04 0.38 0.90 0.27 0.02 0.00 0.00 175.26 176.79 2wof n ASN 595 N -0.19 0.42 0.10 -0.19 6.94 0.12 -4.81 115.26 117.65 2wof n ASN 595 Ca -0.09 -1.54 0.10 0.00 -0.02 0.00 0.00 54.58 53.03 2wof n ASN 595 Cb 0.58 -0.66 0.44 0.00 -2.36 0.00 0.00 39.78 37.78 2wof n ASN 595 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09 2wof n ARG 596 N -2.84 0.13 -0.35 -3.83 0.63 -1.26 -0.92 116.66 108.22 2wof n ARG 596 Ca 0.12 0.43 0.11 0.00 -0.92 0.00 0.00 57.85 57.60 2wof n ARG 596 Cb 0.44 -1.79 0.31 0.00 0.45 0.00 0.00 32.46 31.86 2wof n ARG 596 CO 0.00 0.00 0.00 -1.33 -2.51 0.00 0.00 177.63 173.79 2wof n MET 597 N -2.05 2.75 -0.89 -0.14 2.81 -1.26 -4.93 117.12 113.41 2wof n MET 597 Ca 0.02 -2.60 0.00 0.00 -1.81 0.00 0.00 57.70 53.30 2wof n MET 597 Cb 0.17 -1.54 0.00 0.00 -0.71 0.00 0.00 33.22 31.14 2wof n MET 597 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wof n GLY 598 N 1.53 0.53 3.83 3.03 0.00 -0.10 -5.03 105.19 108.98 2wof n GLY 598 Ca 0.23 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 2wof n GLY 598 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wof s ASN 599 N -2.24 6.62 0.26 1.61 0.01 -1.26 -4.82 114.94 115.13 2wof s ASN 599 Ca 0.00 0.74 -0.31 0.00 -0.71 0.00 0.00 52.86 52.58 2wof s ASN 599 Cb 0.00 -2.19 -0.12 0.00 0.41 0.00 0.00 41.25 39.36 2wof s ASN 599 CO 0.00 0.30 1.64 -2.84 -1.51 0.00 0.00 177.10 174.69 2wof s PRO 600 N -0.74 4.12 0.10 -0.60 0.02 -1.26 0.14 135.00 136.78 2wof s PRO 600 Ca 0.20 2.59 -0.31 0.00 0.02 0.00 0.00 61.00 63.50 2wof s PRO 600 Cb -0.15 -3.04 -0.08 0.00 0.02 0.00 0.00 34.50 31.25 2wof s PRO 600 CO 0.09 -0.67 1.41 0.14 -0.33 0.00 0.00 177.00 177.64 2wof s VAL 601 N 0.42 3.31 0.09 3.83 -7.23 -0.22 -4.72 120.40 115.88 2wof s VAL 601 Ca 0.67 0.91 -0.05 0.00 -1.81 0.00 0.00 61.98 61.71 2wof s VAL 601 Cb -0.48 -3.58 -0.02 0.00 0.56 0.00 0.00 36.38 32.85 2wof s VAL 601 CO 0.42 0.06 0.10 -0.44 -0.31 0.00 0.00 175.10 174.92 2wof s SER 602 N 1.27 0.28 -0.10 4.85 0.01 -0.70 -0.92 113.70 118.39 2wof s SER 602 Ca 0.65 -0.88 0.02 0.00 1.31 0.00 0.00 55.95 57.05 2wof s SER 602 Cb -0.37 0.29 -0.02 0.00 0.21 0.00 0.00 66.02 66.14 2wof s SER 602 CO 0.30 -0.69 -0.15 -0.31 0.41 0.00 0.00 173.24 172.79 2wof s TYR 603 N -3.92 2.73 -0.15 2.43 1.51 -0.73 0.11 117.35 119.33 2wof s TYR 603 Ca 0.09 -0.52 -0.20 0.00 -1.01 0.00 0.00 57.07 55.44 2wof s TYR 603 Cb 0.06 -1.74 -0.04 0.00 -0.11 0.00 0.00 41.96 40.13 2wof s TYR 603 CO -0.08 -0.10 0.55 -1.14 -1.11 0.00 0.00 175.55 173.67 2wof s GLN 604 N -0.05 4.29 -0.30 -0.62 0.74 0.14 -0.72 119.66 123.15 2wof s GLN 604 Ca -0.04 0.54 -0.10 0.00 0.05 0.00 0.00 55.36 55.81 2wof s GLN 604 Cb -0.14 -3.50 -0.02 0.00 1.10 0.00 0.00 33.01 30.45 2wof s GLN 604 CO 0.04 -0.01 0.17 0.42 -0.55 0.00 0.00 175.29 175.36 2wof s ILE 605 N 1.15 4.89 -0.43 -2.34 1.01 -0.49 -0.75 121.20 124.25 2wof s ILE 605 Ca 0.28 -0.17 0.02 0.00 0.00 0.00 0.00 60.65 60.78 2wof s ILE 605 Cb -0.16 -3.42 0.12 0.00 0.01 0.00 0.00 42.46 39.02 2wof s ILE 605 CO 0.11 0.15 0.20 -0.63 0.00 0.00 0.00 174.94 174.77 2wof s ILE 606 N 1.68 1.78 -0.14 2.92 1.01 0.08 -4.44 121.20 124.09 2wof s ILE 606 Ca 0.06 -2.58 0.30 0.00 0.00 0.00 0.00 60.65 58.43 2wof s ILE 606 Cb -0.16 -2.26 0.35 0.00 0.01 0.00 0.00 42.46 40.40 2wof s ILE 606 CO 0.08 -0.80 1.87 -0.65 0.00 0.00 0.00 174.94 175.44 2wof h PRO 607 N 6.98 0.00 -3.50 2.79 0.11 -1.89 -0.26 132.00 136.22 2wof h PRO 607 Ca -0.05 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.49 2wof h PRO 607 Cb 0.94 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.65 2wof h PRO 607 CO 0.54 0.00 -0.76 -0.47 -0.21 0.00 0.00 178.00 177.10 2wof s TYR 608 N -3.50 1.53 -0.15 0.65 5.04 -1.26 -4.57 117.35 115.08 2wof s TYR 608 Ca 0.03 -1.57 0.18 0.00 -2.44 0.00 0.00 57.07 53.27 2wof s TYR 608 Cb 0.09 -1.57 0.40 0.00 0.35 0.00 0.00 41.96 41.23 2wof s TYR 608 CO 0.53 -0.84 1.28 0.00 -1.34 0.00 0.00 175.55 175.17 2wof n ALA 609 N 4.90 2.61 0.00 3.97 0.00 -0.01 -4.88 120.51 127.09 2wof n ALA 609 Ca -0.03 -2.49 0.00 0.00 0.00 0.00 0.00 53.44 50.92 2wof n ALA 609 Cb 0.43 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.34 2wof n ALA 609 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wof n GLY 610 N -1.01 2.58 3.63 0.00 0.00 -1.22 -4.70 105.19 104.46 2wof n GLY 610 Ca 0.19 -2.13 -0.01 0.00 0.00 0.00 0.00 46.02 44.06 2wof n GLY 610 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wof s GLY 611 N 0.00 -0.26 0.00 -0.02 0.00 -1.26 -1.32 107.32 104.46 2wof s GLY 611 Ca 0.00 1.72 0.18 0.00 0.00 0.00 0.00 44.72 46.62 2wof s GLY 611 CO 0.00 0.55 0.87 -1.30 0.00 0.00 0.00 173.10 173.21 2wof n THR 612 N -0.10 0.00 -4.10 0.90 -2.24 -0.29 -4.91 114.28 103.54 2wof n THR 612 Ca 0.02 -0.26 -0.23 0.00 -2.27 0.00 0.00 64.05 61.31 2wof n THR 612 Cb 0.58 1.16 -0.06 0.00 -2.10 0.00 0.00 70.33 69.90 2wof n THR 612 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2wof s HIS 613 N -2.18 2.74 0.55 4.78 4.02 -1.26 -4.94 115.29 118.99 2wof s HIS 613 Ca 0.13 -0.34 -0.19 0.00 1.02 0.00 0.00 55.06 55.67 2wof s HIS 613 Cb 0.14 -1.59 -0.08 0.00 -1.02 0.00 0.00 32.58 30.04 2wof s HIS 613 CO 0.51 0.37 0.77 -2.30 1.02 0.00 0.00 174.74 175.11 2wof n PRO 614 N -1.14 0.79 -3.27 8.40 -0.02 -1.26 -4.86 135.00 133.65 2wof n PRO 614 Ca -0.04 0.30 -0.36 0.00 -2.02 0.00 0.00 63.50 61.38 2wof n PRO 614 Cb 0.61 -1.92 -0.06 0.00 -0.02 0.00 0.00 33.50 32.11 2wof n PRO 614 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wof s VAL 615 N -1.56 4.75 -0.27 -1.45 0.11 -1.26 -1.44 120.40 119.27 2wof s VAL 615 Ca 0.70 1.05 -0.24 0.00 -2.93 0.00 0.00 61.98 60.56 2wof s VAL 615 Cb -0.46 -3.81 -0.00 0.00 -1.53 0.00 0.00 36.38 30.58 2wof s VAL 615 CO 0.52 0.31 0.81 0.00 -3.33 0.00 0.00 175.10 173.40 2wof s ALA 616 N -1.40 3.59 -0.70 1.54 0.00 -1.02 -4.48 121.76 119.29 2wof s ALA 616 Ca 0.37 -0.28 0.25 0.00 0.00 0.00 0.00 51.96 52.30 2wof s ALA 616 Cb -0.17 -3.29 0.64 0.00 0.00 0.00 0.00 23.12 20.31 2wof s ALA 616 CO 0.20 -1.06 1.61 1.63 0.00 0.00 0.00 175.76 178.14 2wof n LYS 617 N 6.11 0.27 -0.48 0.00 5.02 -1.26 -4.53 118.16 123.30 2wof n LYS 617 Ca 0.05 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2wof n LYS 617 Cb 0.48 -1.76 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 2wof n LYS 617 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wof n GLY 618 N 1.32 0.95 3.71 0.72 0.00 -1.26 -4.88 105.19 105.75 2wof n GLY 618 Ca 0.05 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 2wof n GLY 618 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wof s ALA 619 N -1.00 3.19 -1.59 4.61 0.00 -1.20 -4.90 121.76 120.88 2wof s ALA 619 Ca 0.00 0.49 -0.10 0.00 0.00 0.00 0.00 51.96 52.35 2wof s ALA 619 Cb 0.00 -3.28 -0.08 0.00 0.00 0.00 0.00 23.12 19.76 2wof s ALA 619 CO 0.00 -0.19 2.90 1.04 0.00 0.00 0.00 175.76 179.51 2wof n GLN 620 N 3.78 3.60 -4.07 0.00 1.13 -1.26 -4.83 117.38 115.72 2wof n GLN 620 Ca 0.05 -2.18 -0.15 0.00 -1.94 0.00 0.00 57.00 52.78 2wof n GLN 620 Cb 0.51 -2.80 -0.14 0.00 0.11 0.00 0.00 30.24 27.91 2wof n GLN 620 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 2wof s PHE 621 N 2.27 0.34 0.76 1.08 0.08 -1.26 -5.01 117.98 116.23 2wof s PHE 621 Ca 0.68 -0.08 -0.15 0.00 0.12 0.00 0.00 56.93 57.50 2wof s PHE 621 Cb 0.17 -0.22 0.04 0.00 -0.57 0.00 0.00 43.02 42.45 2wof s PHE 621 CO -0.06 -0.01 1.09 0.00 -0.10 0.00 0.00 175.22 176.14 2wof n ALA 622 N 2.94 -0.05 0.30 5.36 0.00 -1.26 -4.86 120.51 122.94 2wof n ALA 622 Ca -0.13 -0.24 0.13 0.00 0.00 0.00 0.00 53.44 53.19 2wof n ALA 622 Cb 0.59 -2.19 0.59 0.00 0.00 0.00 0.00 19.45 18.43 2wof n ALA 622 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2wof h PRO 623 N -0.49 0.00 -0.10 0.00 0.13 -2.00 -2.46 132.00 127.08 2wof h PRO 623 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2wof h PRO 623 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2wof h PRO 623 CO 0.47 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.84 2wof n ASP 624 N -2.37 2.17 -4.77 1.44 5.75 -1.26 -4.67 116.55 112.84 2wof n ASP 624 Ca 0.00 -1.74 -0.40 0.00 -0.01 0.00 0.00 54.79 52.65 2wof n ASP 624 Cb 0.16 -0.05 -0.00 0.00 -1.03 0.00 0.00 41.12 40.19 2wof n ASP 624 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2wof s GLU 625 N -1.89 3.94 0.15 0.11 0.41 -0.93 -4.94 118.70 115.54 2wof s GLU 625 Ca 0.34 2.22 -0.15 0.00 -0.41 0.00 0.00 54.97 56.97 2wof s GLU 625 Cb 0.20 -2.76 0.02 0.00 -1.78 0.00 0.00 34.13 29.81 2wof s GLU 625 CO 0.31 -0.54 1.74 -1.49 -0.49 0.00 0.00 175.26 174.79 2wof h TRP 626 N 2.65 0.61 -0.66 1.61 4.06 -1.91 -1.83 115.95 120.48 2wof h TRP 626 Ca -0.50 -0.02 0.05 0.00 2.06 0.00 0.00 58.89 60.48 2wof h TRP 626 Cb 1.25 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 29.18 2wof h TRP 626 CO 0.53 0.48 0.44 0.97 -3.56 0.00 0.00 178.44 177.29 2wof h ILE 627 N 0.56 1.05 -0.14 1.49 2.10 -1.92 0.28 117.51 120.93 2wof h ILE 627 Ca 0.15 -0.25 0.02 0.00 1.08 0.00 0.00 64.86 65.86 2wof h ILE 627 Cb 0.08 0.26 -0.02 0.00 -1.09 0.00 0.00 36.82 36.06 2wof h ILE 627 CO -0.02 0.13 0.03 0.22 -1.08 0.00 0.00 178.15 177.43 2wof h TYR 628 N 0.73 0.05 -0.38 2.19 3.20 -1.81 -1.70 116.97 119.25 2wof h TYR 628 Ca 0.27 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.20 2wof h TYR 628 Cb 0.17 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.39 2wof h TYR 628 CO -0.00 0.02 0.14 1.25 -1.64 0.00 0.00 178.16 177.93 2wof h HIS 629 N 0.09 0.25 -0.06 -3.82 2.76 -0.19 -3.17 115.15 111.02 2wof h HIS 629 Ca 0.06 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.10 2wof h HIS 629 Cb 0.05 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 2wof h HIS 629 CO -0.12 0.11 -0.63 0.00 -1.30 0.00 0.00 177.93 175.99 2wof h ARG 630 N 0.30 0.21 -2.92 5.26 3.08 -0.48 -3.39 114.38 116.44 2wof h ARG 630 Ca 0.17 -0.15 -0.63 0.00 0.07 0.00 0.00 59.98 59.45 2wof h ARG 630 Cb 0.15 0.03 -0.41 0.00 0.08 0.00 0.00 29.97 29.81 2wof h ARG 630 CO -0.17 0.77 -0.52 1.28 -1.07 0.00 0.00 179.97 180.26 2wof n LEU 631 N -3.85 3.34 0.29 3.04 4.77 -0.65 -3.86 117.00 120.08 2wof n LEU 631 Ca -0.02 -5.26 0.16 0.00 -0.03 0.00 0.00 56.01 50.86 2wof n LEU 631 Cb 0.63 -0.78 0.86 0.00 -2.33 0.00 0.00 43.42 41.80 2wof n LEU 631 CO 0.44 1.80 1.05 0.77 -1.33 0.00 0.00 177.39 180.12 2wof h SER 632 N 5.19 0.00 0.06 -1.43 4.64 -1.75 -2.91 113.55 117.35 2wof h SER 632 Ca 0.16 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.48 2wof h SER 632 Cb 0.74 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2wof h SER 632 CO 0.76 0.06 -0.03 2.19 -0.87 0.00 0.00 176.83 178.95 2wof h PHE 633 N 0.00 0.00 -0.39 4.77 -0.00 -1.91 -2.32 116.94 117.09 2wof h PHE 633 Ca -0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.97 58.08 2wof h PHE 633 Cb 0.23 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 36.16 2wof h PHE 633 CO 0.00 0.03 0.30 0.52 -0.00 0.00 0.00 178.31 179.16 2wof h MET 634 N 0.00 0.00 -0.01 6.09 2.86 -1.91 -3.22 114.93 118.74 2wof h MET 634 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2wof h MET 634 Cb 0.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.72 2wof h MET 634 CO 0.00 0.00 -0.46 -3.47 1.06 0.00 0.00 176.91 174.04 2wof n ASP 635 N -4.26 1.70 -4.17 1.22 2.03 -0.87 -3.25 116.55 108.95 2wof n ASP 635 Ca 0.06 -1.35 -0.20 0.00 0.52 0.00 0.00 54.79 53.83 2wof n ASP 635 Cb 0.49 0.54 -0.12 0.00 -0.72 0.00 0.00 41.12 41.30 2wof n ASP 635 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2wof s LYS 636 N -2.25 0.90 0.04 -0.67 -0.14 -1.22 -4.77 119.74 111.64 2wof s LYS 636 Ca 0.15 -0.91 0.19 0.00 -1.36 0.00 0.00 55.97 54.04 2wof s LYS 636 Cb 0.15 -0.94 -0.16 0.00 -1.68 0.00 0.00 37.83 35.20 2wof s LYS 636 CO 0.52 0.22 0.70 1.04 -0.76 0.00 0.00 175.35 177.07 2wof n GLN 637 N 1.48 0.63 -4.74 1.68 3.00 -0.85 -4.48 117.38 114.11 2wof n GLN 637 Ca -0.20 0.08 -0.26 0.00 -0.01 0.00 0.00 57.00 56.61 2wof n GLN 637 Cb 0.54 -1.71 -0.17 0.00 0.00 0.00 0.00 30.24 28.90 2wof n GLN 637 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 2wof s LEU 638 N -5.37 1.77 0.07 1.08 2.96 -0.84 -0.50 118.68 117.85 2wof s LEU 638 Ca -0.04 -0.36 0.06 0.00 -0.22 0.00 0.00 54.13 53.57 2wof s LEU 638 Cb 0.10 -0.96 -0.03 0.00 0.50 0.00 0.00 46.19 45.80 2wof s LEU 638 CO 0.83 0.07 -0.15 0.26 -1.32 0.00 0.00 176.35 176.04 2wof s TRP 639 N 0.52 1.32 -0.04 5.38 0.52 -0.65 -0.74 118.94 125.26 2wof s TRP 639 Ca -0.14 -0.43 0.00 0.00 0.02 0.00 0.00 56.10 55.55 2wof s TRP 639 Cb -0.16 -0.75 0.03 0.00 -1.15 0.00 0.00 33.47 31.44 2wof s TRP 639 CO 0.05 0.08 -0.01 0.08 0.02 0.00 0.00 176.95 177.16 2wof s VAL 640 N -1.15 0.31 0.15 4.03 1.01 -1.26 -1.26 120.40 122.23 2wof s VAL 640 Ca 0.00 0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.08 2wof s VAL 640 Cb -0.09 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.85 2wof s VAL 640 CO 0.02 0.19 -0.14 0.42 0.00 0.00 0.00 175.10 175.59 2wof s THR 641 N 1.13 1.42 0.41 3.92 -4.23 -0.52 -4.49 115.64 113.28 2wof s THR 641 Ca -0.08 -1.90 -0.26 0.00 -1.18 0.00 0.00 61.69 58.27 2wof s THR 641 Cb -0.14 -1.72 -0.09 0.00 1.34 0.00 0.00 72.50 71.90 2wof s THR 641 CO -0.02 -0.51 1.34 -0.13 -0.54 0.00 0.00 174.62 174.77 2wof s ARG 642 N -3.08 3.96 0.27 3.99 0.52 -1.26 0.04 118.95 123.38 2wof s ARG 642 Ca 0.14 2.25 -0.30 0.00 -0.52 0.00 0.00 55.73 57.29 2wof s ARG 642 Cb -0.03 -2.78 -0.13 0.00 0.52 0.00 0.00 34.95 32.53 2wof s ARG 642 CO 0.04 -0.53 1.42 0.98 0.02 0.00 0.00 175.30 177.22 2wof n TYR 643 N 0.15 2.31 -3.64 -0.53 9.36 0.56 -4.71 117.16 120.66 2wof n TYR 643 Ca 0.03 0.42 -0.03 0.00 3.32 0.00 0.00 57.90 61.65 2wof n TYR 643 Cb 0.43 -2.48 -0.05 0.00 -0.63 0.00 0.00 39.34 36.61 2wof n TYR 643 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2wof s HIS 644 N -0.25 -1.24 0.11 2.98 5.65 -1.26 -5.03 115.29 116.25 2wof s HIS 644 Ca 0.65 2.23 0.33 0.00 0.25 0.00 0.00 55.06 58.53 2wof s HIS 644 Cb -0.61 0.74 1.55 0.00 -1.18 0.00 0.00 32.58 33.08 2wof s HIS 644 CO 0.52 -0.61 2.00 -1.00 -0.65 0.00 0.00 174.74 175.00 2wof h PRO 645 N 7.65 0.00 -0.64 2.88 0.13 -2.03 -1.37 132.00 138.62 2wof h PRO 645 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 2wof h PRO 645 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2wof h PRO 645 CO 0.12 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.30 2wof n GLY 646 N -0.37 2.10 3.11 1.56 0.00 -1.26 -4.76 105.19 105.57 2wof n GLY 646 Ca -0.00 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 44.92 2wof n GLY 646 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wof s GLU 647 N -1.15 2.25 0.00 1.61 2.02 -0.52 -4.87 118.70 118.04 2wof s GLU 647 Ca 0.45 -2.12 0.00 0.00 0.02 0.00 0.00 54.97 53.31 2wof s GLU 647 Cb 0.24 -3.65 0.00 0.00 0.10 0.00 0.00 34.13 30.81 2wof s GLU 647 CO 0.31 -1.12 0.00 0.54 0.02 0.00 0.00 175.26 175.01 2wof n ARG 648 N 4.13 3.58 -4.26 1.61 1.74 -1.26 -4.84 116.66 117.35 2wof n ARG 648 Ca 0.02 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.80 2wof n ARG 648 Cb 0.40 -0.54 -0.16 0.00 -1.02 0.00 0.00 32.46 31.14 2wof n ARG 648 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2wof s PHE 649 N -0.94 2.25 0.36 -1.55 0.08 -1.26 -4.74 117.98 112.18 2wof s PHE 649 Ca 0.00 -1.20 0.05 0.00 0.12 0.00 0.00 56.93 55.90 2wof s PHE 649 Cb 0.00 -1.61 0.69 0.00 -0.57 0.00 0.00 43.02 41.52 2wof s PHE 649 CO 0.00 -0.62 1.95 -1.00 -0.10 0.00 0.00 175.22 175.45 2wof h PRO 650 N 7.74 0.56 -0.01 0.24 0.13 -1.93 -1.76 132.00 136.97 2wof h PRO 650 Ca -0.36 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2wof h PRO 650 Cb 1.16 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2wof h PRO 650 CO 0.53 0.49 -0.08 -0.85 -0.23 0.00 0.00 178.00 177.87 2wof n GLU 651 N -4.36 1.28 0.00 0.86 0.00 -1.26 -1.26 120.64 115.90 2wof n GLU 651 Ca 0.03 -0.67 0.00 0.00 0.00 0.00 0.00 57.16 56.52 2wof n GLU 651 Cb 0.16 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.12 2wof n GLU 651 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2wof n GLY 652 N 1.21 1.29 0.23 -1.84 0.00 -0.66 -4.35 105.19 101.07 2wof n GLY 652 Ca 0.17 -1.71 -0.05 0.00 0.00 0.00 0.00 46.02 44.43 2wof n GLY 652 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2wof h LYS 653 N 0.00 0.49 -2.50 1.61 3.64 -1.84 -3.36 116.57 114.61 2wof h LYS 653 Ca 0.00 -0.21 -0.60 0.00 -1.27 0.00 0.00 60.65 58.57 2wof h LYS 653 Cb 0.00 -0.01 -0.40 0.00 -0.41 0.00 0.00 32.23 31.40 2wof h LYS 653 CO 0.00 0.76 -0.80 0.66 -2.27 0.00 0.00 179.45 177.80 2wof n TYR 654 N -4.08 1.39 0.86 1.91 4.01 -1.26 -4.97 117.16 115.03 2wof n TYR 654 Ca -0.01 -3.84 0.13 0.00 -0.16 0.00 0.00 57.90 54.02 2wof n TYR 654 Cb 0.45 -0.29 0.54 0.00 -0.31 0.00 0.00 39.34 39.74 2wof n TYR 654 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2wof n PRO 655 N 1.93 0.05 -2.15 -0.72 -0.04 -1.26 -4.46 135.00 128.36 2wof n PRO 655 Ca 0.25 0.08 -0.43 0.00 -0.04 0.00 0.00 63.50 63.36 2wof n PRO 655 Cb 0.43 -1.57 -0.02 0.00 -0.04 0.00 0.00 33.50 32.30 2wof n PRO 655 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2wof s ASN 656 N -3.32 6.41 -1.82 3.54 2.47 -1.26 -2.86 114.94 118.10 2wof s ASN 656 Ca 0.12 1.57 0.00 0.00 0.42 0.00 0.00 52.86 54.98 2wof s ASN 656 Cb 0.16 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.43 2wof s ASN 656 CO 0.51 -1.24 0.00 0.54 -3.72 0.00 0.00 177.10 173.19 2wof n ARG 657 N 7.62 -1.61 -1.68 0.43 1.74 -1.26 -4.19 116.66 117.71 2wof n ARG 657 Ca 0.18 1.03 -0.33 0.00 -0.77 0.00 0.00 57.85 57.96 2wof n ARG 657 Cb 0.45 -5.63 0.06 0.00 -1.02 0.00 0.00 32.46 26.32 2wof n ARG 657 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2wof s SER 658 N -2.18 4.89 -0.00 0.55 1.04 -1.13 -4.87 113.70 111.99 2wof s SER 658 Ca 0.00 2.08 0.06 0.00 0.48 0.00 0.00 55.95 58.57 2wof s SER 658 Cb 0.00 -2.56 -0.08 0.00 0.10 0.00 0.00 66.02 63.48 2wof s SER 658 CO 0.00 -1.78 0.18 0.35 0.98 0.00 0.00 173.24 172.97 2wof n THR 659 N -2.49 0.00 -4.12 2.02 -2.24 -1.26 -4.63 114.28 101.55 2wof n THR 659 Ca 0.11 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.52 2wof n THR 659 Cb 0.52 0.68 -0.07 0.00 -2.10 0.00 0.00 70.33 69.35 2wof n THR 659 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2wof s HIS 660 N -1.98 0.98 -0.45 4.78 -3.43 -1.26 -4.86 115.29 109.07 2wof s HIS 660 Ca -0.00 -1.21 -0.28 0.00 -0.80 0.00 0.00 55.06 52.77 2wof s HIS 660 Cb 0.04 -0.25 0.03 0.00 -1.43 0.00 0.00 32.58 30.97 2wof s HIS 660 CO 0.24 -0.89 1.07 0.34 -2.00 0.00 0.00 174.74 173.50 2wof s ASP 661 N -3.16 6.64 -0.06 7.38 -1.08 -1.25 -4.86 116.67 120.27 2wof s ASP 661 Ca 0.32 0.46 0.16 0.00 -0.52 0.00 0.00 52.55 52.98 2wof s ASP 661 Cb 0.02 -2.52 0.54 0.00 -1.46 0.00 0.00 42.92 39.50 2wof s ASP 661 CO 0.15 -1.14 1.45 0.35 0.52 0.00 0.00 175.17 176.50 2wof n THR 662 N 6.58 1.44 0.00 1.71 -2.24 -1.26 -3.70 114.28 116.81 2wof n THR 662 Ca 0.10 -1.19 0.00 0.00 -2.27 0.00 0.00 64.05 60.70 2wof n THR 662 Cb 0.49 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 2wof n THR 662 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wof n GLY 663 N 0.79 1.11 0.23 3.38 0.00 -1.26 -4.39 105.19 105.04 2wof n GLY 663 Ca 0.20 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.29 2wof n GLY 663 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wof h LEU 664 N 0.00 0.00 -0.28 0.99 3.38 -1.34 0.16 115.31 118.21 2wof h LEU 664 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2wof h LEU 664 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2wof h LEU 664 CO 0.00 0.20 0.14 1.23 0.09 0.00 0.00 178.44 180.10 2wof h GLY 665 N 0.73 0.38 0.84 0.83 0.00 -1.85 -2.34 103.07 101.67 2wof h GLY 665 Ca -0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 2wof h GLY 665 CO 0.03 0.08 -0.01 -1.61 0.00 0.00 0.00 176.54 175.03 2wof h GLN 666 N 0.30 0.41 0.00 4.80 4.15 -1.23 -2.47 115.11 121.07 2wof h GLN 666 Ca 0.12 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 2wof h GLN 666 Cb 0.04 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.69 2wof h GLN 666 CO -0.08 0.60 -0.05 1.88 -1.93 0.00 0.00 178.83 179.25 2wof h TYR 667 N 0.17 0.00 -0.18 3.99 0.05 -0.65 -2.79 116.97 117.57 2wof h TYR 667 Ca 0.06 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.84 2wof h TYR 667 Cb 0.42 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.16 2wof h TYR 667 CO 0.04 0.05 0.00 -1.13 -1.05 0.00 0.00 178.16 176.06 2wof n SER 668 N -3.21 2.38 -0.20 3.88 3.41 -0.89 -4.75 113.62 114.23 2wof n SER 668 Ca -0.01 -1.80 -0.09 0.00 -0.26 0.00 0.00 58.87 56.72 2wof n SER 668 Cb 0.26 -0.12 0.02 0.00 -0.26 0.00 0.00 64.21 64.11 2wof n SER 668 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2wof h LYS 669 N 1.52 0.97 0.00 4.33 1.63 -1.15 -1.04 116.57 122.84 2wof h LYS 669 Ca 0.00 -0.27 0.00 0.00 -0.85 0.00 0.00 60.65 59.53 2wof h LYS 669 Cb 0.57 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 2wof h LYS 669 CO 0.00 0.94 0.00 -0.25 -3.45 0.00 0.00 179.45 176.69 2wof n ASP 670 N -4.30 0.00 -3.79 4.20 8.00 -1.26 -4.94 116.55 114.46 2wof n ASP 670 Ca 0.03 -0.49 -0.26 0.00 0.71 0.00 0.00 54.79 54.77 2wof n ASP 670 Cb 0.29 -0.09 0.01 0.00 -0.02 0.00 0.00 41.12 41.31 2wof n ASP 670 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2wof n ASN 671 N -1.09 -2.27 -4.52 -2.24 5.15 -0.39 -4.93 115.26 104.96 2wof n ASN 671 Ca 0.15 -0.96 -0.29 0.00 -0.60 0.00 0.00 54.58 52.87 2wof n ASN 671 Cb 0.11 -3.43 0.17 0.00 -0.53 0.00 0.00 39.78 36.09 2wof n ASN 671 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2wof s GLU 672 N -6.19 0.55 0.10 1.20 2.02 -1.26 -4.52 118.70 110.60 2wof s GLU 672 Ca 0.17 0.17 -0.27 0.00 0.02 0.00 0.00 54.97 55.06 2wof s GLU 672 Cb -0.06 -1.78 -0.06 0.00 0.10 0.00 0.00 34.13 32.33 2wof s GLU 672 CO 0.86 -2.57 0.84 0.45 0.02 0.00 0.00 175.26 174.85 2wof s SER 673 N -4.03 7.35 -0.15 -0.19 0.15 -1.26 -1.68 113.70 113.90 2wof s SER 673 Ca 0.66 1.61 0.15 0.00 0.70 0.00 0.00 55.95 59.08 2wof s SER 673 Cb -0.13 -2.52 0.52 0.00 -1.71 0.00 0.00 66.02 62.18 2wof s SER 673 CO 0.54 0.03 1.42 0.18 1.20 0.00 0.00 173.24 176.62 2wof n LEU 674 N 2.53 3.88 -4.63 3.45 4.77 0.13 -4.84 117.00 122.29 2wof n LEU 674 Ca -0.01 -2.80 -0.42 0.00 -0.03 0.00 0.00 56.01 52.74 2wof n LEU 674 Cb 0.49 -0.50 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 2wof n LEU 674 CO 0.48 0.69 0.74 -0.62 -1.33 0.00 0.00 177.39 177.35 2wof s ASP 675 N -1.64 6.79 -1.19 -1.43 2.15 -1.25 -4.26 116.67 115.84 2wof s ASP 675 Ca 0.40 0.85 -0.31 0.00 0.43 0.00 0.00 52.55 53.92 2wof s ASP 675 Cb 0.31 -2.46 0.03 0.00 -0.30 0.00 0.00 42.92 40.49 2wof s ASP 675 CO 0.11 -0.71 0.72 -3.20 -0.17 0.00 0.00 175.17 171.92 2wof n ASN 676 N 6.44 -4.51 -4.00 -0.34 5.15 -1.02 -4.97 115.26 112.00 2wof n ASN 676 Ca 0.07 -1.22 -0.10 0.00 -0.60 0.00 0.00 54.58 52.74 2wof n ASN 676 Cb 0.48 -2.18 -0.06 0.00 -0.53 0.00 0.00 39.78 37.49 2wof n ASN 676 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2wof s THR 677 N -3.51 0.00 -0.13 -0.44 -1.32 -0.64 -4.56 115.64 105.04 2wof s THR 677 Ca 0.49 -1.48 -0.29 0.00 -1.21 0.00 0.00 61.69 59.20 2wof s THR 677 Cb -0.24 -2.25 -0.04 0.00 -1.51 0.00 0.00 72.50 68.45 2wof s THR 677 CO 0.94 0.00 1.66 -0.62 -2.21 0.00 0.00 174.62 174.39 2wof s ASP 678 N -3.04 6.49 0.16 8.08 -1.08 -1.12 -2.14 116.67 124.02 2wof s ASP 678 Ca 0.25 1.96 0.10 0.00 -0.52 0.00 0.00 52.55 54.33 2wof s ASP 678 Cb 0.00 -2.53 -0.04 0.00 -1.46 0.00 0.00 42.92 38.89 2wof s ASP 678 CO 0.10 -1.12 -0.17 0.00 0.52 0.00 0.00 175.17 174.50 2wof s ALA 679 N 4.74 2.72 -0.11 3.66 0.00 -1.26 -0.32 121.76 131.17 2wof s ALA 679 Ca 0.74 -1.47 0.02 0.00 0.00 0.00 0.00 51.96 51.25 2wof s ALA 679 Cb -0.30 -0.58 0.01 0.00 0.00 0.00 0.00 23.12 22.25 2wof s ALA 679 CO 0.29 0.51 -0.16 0.08 0.00 0.00 0.00 175.76 176.48 2wof s VAL 680 N -1.45 1.58 -0.12 0.00 1.01 0.11 -3.85 120.40 117.68 2wof s VAL 680 Ca 0.21 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.41 2wof s VAL 680 Cb -0.09 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2wof s VAL 680 CO 0.11 0.46 0.19 -0.69 0.00 0.00 0.00 175.10 175.17 2wof s VAL 681 N 0.98 5.41 -0.12 2.92 1.01 0.11 -1.43 120.40 129.28 2wof s VAL 681 Ca -0.06 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.24 2wof s VAL 681 Cb -0.15 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.78 2wof s VAL 681 CO -0.02 0.57 -0.10 0.26 0.00 0.00 0.00 175.10 175.81 2wof s TRP 682 N -0.75 1.74 -0.19 5.22 0.52 -0.39 0.28 118.94 125.37 2wof s TRP 682 Ca 0.15 -0.91 -0.05 0.00 0.02 0.00 0.00 56.10 55.31 2wof s TRP 682 Cb -0.13 -1.36 -0.03 0.00 -1.15 0.00 0.00 33.47 30.80 2wof s TRP 682 CO 0.05 -0.56 0.01 -1.64 0.02 0.00 0.00 176.95 174.83 2wof s MET 683 N 1.56 3.72 -0.13 4.98 -1.94 -0.21 -1.63 119.30 125.65 2wof s MET 683 Ca 0.04 -0.48 -0.02 0.00 -1.71 0.00 0.00 55.69 53.53 2wof s MET 683 Cb -0.13 -3.09 -0.02 0.00 2.01 0.00 0.00 34.83 33.60 2wof s MET 683 CO -0.08 0.11 -0.07 0.99 -0.01 0.00 0.00 175.02 175.96 2wof s THR 684 N 0.74 3.63 -0.09 2.05 2.01 0.35 -0.96 115.64 123.37 2wof s THR 684 Ca 0.01 -0.47 -0.07 0.00 0.31 0.00 0.00 61.69 61.47 2wof s THR 684 Cb -0.14 -2.55 0.03 0.00 0.01 0.00 0.00 72.50 69.85 2wof s THR 684 CO 0.02 0.53 0.24 0.28 -0.69 0.00 0.00 174.62 175.00 2wof s THR 685 N 0.06 -0.01 0.22 -0.82 -1.32 -0.69 -4.43 115.64 108.64 2wof s THR 685 Ca -0.02 0.05 0.01 0.00 -1.21 0.00 0.00 61.69 60.53 2wof s THR 685 Cb -0.14 -0.35 -0.00 0.00 -1.51 0.00 0.00 72.50 70.50 2wof s THR 685 CO 0.03 0.02 0.25 0.61 -2.21 0.00 0.00 174.62 173.33 2wof n GLY 686 N 3.41 2.84 3.38 6.08 0.00 -1.26 -1.18 105.19 118.47 2wof n GLY 686 Ca -0.17 -1.65 -0.22 0.00 0.00 0.00 0.00 46.02 43.98 2wof n GLY 686 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wof s THR 687 N -2.75 2.05 -0.31 2.61 -4.23 0.19 -2.43 115.64 110.77 2wof s THR 687 Ca 0.21 -2.14 -0.07 0.00 -1.18 0.00 0.00 61.69 58.51 2wof s THR 687 Cb 0.00 -2.05 0.02 0.00 1.34 0.00 0.00 72.50 71.80 2wof s THR 687 CO 0.15 -0.38 0.10 -0.89 -0.54 0.00 0.00 174.62 173.06 2wof s THR 688 N -2.35 4.03 -0.48 3.99 2.01 -0.52 -1.75 115.64 120.57 2wof s THR 688 Ca 0.22 -0.79 -0.15 0.00 0.31 0.00 0.00 61.69 61.27 2wof s THR 688 Cb -0.05 -3.14 0.08 0.00 0.01 0.00 0.00 72.50 69.40 2wof s THR 688 CO 0.09 -0.01 0.41 -2.28 -0.69 0.00 0.00 174.62 172.14 2wof s HIS 689 N 1.49 3.25 -0.23 4.92 5.04 0.02 -4.02 115.29 125.76 2wof s HIS 689 Ca 0.02 -0.98 -0.10 0.00 -1.54 0.00 0.00 55.06 52.46 2wof s HIS 689 Cb -0.18 -3.25 -0.05 0.00 0.04 0.00 0.00 32.58 29.15 2wof s HIS 689 CO 0.03 -0.82 0.14 0.08 -2.34 0.00 0.00 174.74 171.82 2wof s VAL 690 N 1.63 5.15 0.75 0.89 1.01 -1.26 -2.84 120.40 125.73 2wof s VAL 690 Ca 0.04 0.11 -0.11 0.00 0.00 0.00 0.00 61.98 62.02 2wof s VAL 690 Cb -0.25 -3.39 0.05 0.00 0.00 0.00 0.00 36.38 32.79 2wof s VAL 690 CO 0.06 0.36 1.12 0.00 0.00 0.00 0.00 175.10 176.64 2wof s ALA 691 N 1.04 2.83 0.13 5.51 0.00 -1.26 -5.04 121.76 124.97 2wof s ALA 691 Ca 0.07 -0.58 -0.14 0.00 0.00 0.00 0.00 51.96 51.30 2wof s ALA 691 Cb -0.14 -2.92 0.03 0.00 0.00 0.00 0.00 23.12 20.09 2wof s ALA 691 CO 0.04 -1.40 0.37 -0.98 0.00 0.00 0.00 175.76 173.79 2wof s ARG 692 N -5.43 1.07 0.56 0.00 1.70 -1.26 -4.70 118.95 110.89 2wof s ARG 692 Ca 0.60 -0.80 0.25 0.00 -0.47 0.00 0.00 55.73 55.31 2wof s ARG 692 Cb -0.11 0.45 1.61 0.00 -0.57 0.00 0.00 34.95 36.33 2wof s ARG 692 CO 0.49 -0.41 2.21 0.00 -1.08 0.00 0.00 175.30 176.51 2wof h ALA 693 N 2.42 1.73 0.00 7.88 0.00 -1.87 0.01 119.26 129.43 2wof h ALA 693 Ca -0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2wof h ALA 693 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2wof h ALA 693 CO 0.48 -0.03 0.00 0.39 0.00 0.00 0.00 179.25 180.09 2wof n GLU 694 N -4.10 0.12 -0.44 0.00 4.71 -1.26 -2.34 120.64 117.33 2wof n GLU 694 Ca -0.03 0.58 0.10 0.00 -0.01 0.00 0.00 57.16 57.81 2wof n GLU 694 Cb 0.11 -1.87 0.32 0.00 -1.01 0.00 0.00 31.44 28.99 2wof n GLU 694 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2wof n GLU 695 N -2.13 3.10 -4.18 3.49 1.02 -0.01 -4.66 120.64 117.28 2wof n GLU 695 Ca -0.01 -2.70 -0.19 0.00 -0.02 0.00 0.00 57.16 54.25 2wof n GLU 695 Cb 0.06 -1.66 -0.16 0.00 -0.02 0.00 0.00 31.44 29.66 2wof n GLU 695 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 2wof s TRP 696 N -1.32 0.65 -1.10 -0.32 -0.11 -0.99 -3.19 118.94 112.55 2wof s TRP 696 Ca 0.48 -0.15 0.28 0.00 1.22 0.00 0.00 56.10 57.92 2wof s TRP 696 Cb 0.27 -0.54 1.08 0.00 -1.50 0.00 0.00 33.47 32.78 2wof s TRP 696 CO 0.29 -0.12 1.81 -0.35 -4.62 0.00 0.00 176.95 173.95 2wof n PRO 697 N 3.65 0.11 -4.33 5.86 -0.04 -1.26 -5.01 135.00 133.98 2wof n PRO 697 Ca -0.21 -0.03 -0.18 0.00 -0.04 0.00 0.00 63.50 63.04 2wof n PRO 697 Cb 0.53 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.35 2wof n PRO 697 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2wof s ILE 698 N -2.91 0.72 -0.19 0.52 2.07 -1.24 -4.63 121.20 115.54 2wof s ILE 698 Ca 0.16 -0.50 -0.14 0.00 -1.41 0.00 0.00 60.65 58.76 2wof s ILE 698 Cb 0.19 -0.63 -0.04 0.00 0.13 0.00 0.00 42.46 42.11 2wof s ILE 698 CO 0.56 0.13 0.33 -0.32 -1.91 0.00 0.00 174.94 173.72 2wof s MET 699 N -0.42 4.20 0.36 3.50 -2.45 -0.55 -4.56 119.30 119.37 2wof s MET 699 Ca 0.02 0.10 -0.28 0.00 -1.25 0.00 0.00 55.69 54.29 2wof s MET 699 Cb -0.04 -3.49 -0.10 0.00 1.25 0.00 0.00 34.83 32.45 2wof s MET 699 CO -0.00 0.09 1.32 -2.14 1.05 0.00 0.00 175.02 175.34 2wof s PRO 700 N 0.92 4.20 0.14 4.11 0.02 -1.26 -4.01 135.00 139.12 2wof s PRO 700 Ca 0.17 2.22 -0.31 0.00 0.02 0.00 0.00 61.00 63.09 2wof s PRO 700 Cb -0.14 -2.95 -0.10 0.00 0.02 0.00 0.00 34.50 31.33 2wof s PRO 700 CO 0.06 -0.32 1.61 0.99 -0.33 0.00 0.00 177.00 179.01 2wof s THR 701 N -1.18 2.72 -0.04 0.99 2.01 -1.26 -4.80 115.64 114.08 2wof s THR 701 Ca 0.52 0.43 0.01 0.00 0.31 0.00 0.00 61.69 62.96 2wof s THR 701 Cb -0.40 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 2wof s THR 701 CO 0.52 0.02 -0.02 -1.61 -0.69 0.00 0.00 174.62 172.84 2wof s GLU 702 N 1.64 2.80 0.01 4.92 0.41 -0.54 -4.93 118.70 123.01 2wof s GLU 702 Ca 0.72 -0.56 0.06 0.00 -0.41 0.00 0.00 54.97 54.78 2wof s GLU 702 Cb -0.43 -2.67 -0.02 0.00 -1.78 0.00 0.00 34.13 29.23 2wof s GLU 702 CO 0.32 0.65 -0.19 -1.58 -0.49 0.00 0.00 175.26 173.96 2wof s TRP 703 N -0.97 1.73 0.13 1.61 0.52 -1.26 -1.19 118.94 119.50 2wof s TRP 703 Ca 0.16 -0.35 0.10 0.00 0.02 0.00 0.00 56.10 56.04 2wof s TRP 703 Cb -0.11 -1.07 -0.04 0.00 -1.15 0.00 0.00 33.47 31.10 2wof s TRP 703 CO 0.06 0.02 -0.25 0.14 0.02 0.00 0.00 176.95 176.95 2wof s VAL 704 N -0.61 2.08 -0.04 4.03 -7.23 -0.24 -1.14 120.40 117.24 2wof s VAL 704 Ca 0.07 -1.71 0.04 0.00 -1.81 0.00 0.00 61.98 58.57 2wof s VAL 704 Cb -0.08 -1.86 -0.00 0.00 0.56 0.00 0.00 36.38 34.99 2wof s VAL 704 CO 0.00 0.02 -0.17 -1.00 -0.31 0.00 0.00 175.10 173.64 2wof s HIS 705 N -1.16 1.72 0.26 2.82 0.09 -0.43 -1.61 115.29 116.98 2wof s HIS 705 Ca 0.12 -0.48 0.07 0.00 -0.00 0.00 0.00 55.06 54.76 2wof s HIS 705 Cb -0.10 -1.16 -0.06 0.00 -0.00 0.00 0.00 32.58 31.27 2wof s HIS 705 CO 0.06 -0.16 -0.07 0.95 -0.00 0.00 0.00 174.74 175.52 2wof s THR 706 N -0.01 1.61 -0.07 1.30 -4.23 0.08 -0.83 115.64 113.50 2wof s THR 706 Ca -0.03 -2.13 -0.12 0.00 -1.18 0.00 0.00 61.69 58.23 2wof s THR 706 Cb -0.11 -2.38 0.02 0.00 1.34 0.00 0.00 72.50 71.37 2wof s THR 706 CO 0.02 -0.34 0.29 -0.22 -0.54 0.00 0.00 174.62 173.82 2wof s LEU 707 N -3.41 0.91 -0.23 4.79 2.96 -0.11 -2.10 118.68 121.49 2wof s LEU 707 Ca 0.28 0.34 0.02 0.00 -0.22 0.00 0.00 54.13 54.55 2wof s LEU 707 Cb 0.03 1.09 0.05 0.00 0.50 0.00 0.00 46.19 47.86 2wof s LEU 707 CO 0.11 -0.26 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.00 2wof s LEU 708 N -0.55 2.80 -0.07 -0.68 1.43 0.89 -0.74 118.68 121.76 2wof s LEU 708 Ca -0.07 -1.09 0.05 0.00 -1.03 0.00 0.00 54.13 51.99 2wof s LEU 708 Cb -0.04 -1.43 -0.01 0.00 0.03 0.00 0.00 46.19 44.74 2wof s LEU 708 CO 0.02 -0.14 -0.22 -0.54 0.23 0.00 0.00 176.35 175.70 2wof s LYS 709 N 1.24 2.72 0.26 1.70 1.02 0.07 -1.02 119.74 125.74 2wof s LYS 709 Ca -0.04 -0.84 -0.30 0.00 0.02 0.00 0.00 55.97 54.81 2wof s LYS 709 Cb -0.17 -2.27 -0.11 0.00 -0.52 0.00 0.00 37.83 34.75 2wof s LYS 709 CO -0.08 0.37 1.57 -1.25 -0.92 0.00 0.00 175.35 175.04 2wof s PRO 710 N -0.11 4.17 -0.31 -1.68 0.04 -1.26 0.26 135.00 136.10 2wof s PRO 710 Ca -0.04 2.49 0.01 0.00 0.04 0.00 0.00 61.00 63.50 2wof s PRO 710 Cb -0.14 -3.06 0.10 0.00 0.04 0.00 0.00 34.50 31.43 2wof s PRO 710 CO 0.04 -0.59 0.06 -0.46 0.04 0.00 0.00 177.00 176.09 2wof s TRP 711 N 0.26 2.63 -1.75 0.56 -0.11 0.30 -4.67 118.94 116.16 2wof s TRP 711 Ca 0.64 -2.27 0.00 0.00 1.22 0.00 0.00 56.10 55.70 2wof s TRP 711 Cb -0.46 -2.21 0.00 0.00 -1.50 0.00 0.00 33.47 29.30 2wof s TRP 711 CO 0.43 -0.90 0.00 0.09 -4.62 0.00 0.00 176.95 171.96 2wof n ASN 712 N 4.58 -5.25 0.07 5.86 3.02 -1.26 -1.73 115.26 120.55 2wof n ASN 712 Ca -0.00 0.19 -0.14 0.00 -0.03 0.00 0.00 54.58 54.60 2wof n ASN 712 Cb 0.42 -4.49 -0.05 0.00 -0.61 0.00 0.00 39.78 35.05 2wof n ASN 712 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2wof h PHE 713 N 0.00 0.59 -0.81 3.10 3.57 -1.83 -3.35 116.94 118.21 2wof h PHE 713 Ca -0.42 -0.33 -0.54 0.00 3.53 0.00 0.00 57.97 60.20 2wof h PHE 713 Cb 1.29 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.94 2wof h PHE 713 CO 0.57 1.16 -0.26 -0.06 -2.23 0.00 0.00 178.31 177.49 2wof s PHE 714 N -3.20 1.79 -0.46 0.41 0.08 -1.26 -4.86 117.98 110.47 2wof s PHE 714 Ca -0.06 -0.74 0.12 0.00 0.12 0.00 0.00 56.93 56.37 2wof s PHE 714 Cb 0.09 -2.04 -0.14 0.00 -0.57 0.00 0.00 43.02 40.35 2wof s PHE 714 CO 0.87 -0.58 0.46 -0.25 -0.10 0.00 0.00 175.22 175.62 2wof n ASP 715 N -1.85 0.86 -3.40 1.36 8.00 -1.26 -4.80 116.55 115.46 2wof n ASP 715 Ca 0.04 -0.64 -0.07 0.00 0.71 0.00 0.00 54.79 54.83 2wof n ASP 715 Cb 0.63 1.10 0.00 0.00 -0.02 0.00 0.00 41.12 42.84 2wof n ASP 715 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2wof s GLU 716 N -2.26 1.94 -0.36 -1.24 -1.05 -1.26 -4.95 118.70 109.53 2wof s GLU 716 Ca 0.03 -1.17 -0.41 0.00 -0.15 0.00 0.00 54.97 53.27 2wof s GLU 716 Cb 0.09 0.60 -0.16 0.00 -0.44 0.00 0.00 34.13 34.22 2wof s GLU 716 CO 0.50 -0.90 1.88 2.41 0.95 0.00 0.00 175.26 180.09 2wof n THR 717 N -0.50 0.20 0.27 1.83 -1.04 -1.26 -4.82 114.28 108.95 2wof n THR 717 Ca -0.06 -0.08 0.17 0.00 -2.04 0.00 0.00 64.05 62.03 2wof n THR 717 Cb 0.60 -1.10 0.65 0.00 -1.82 0.00 0.00 70.33 68.65 2wof n THR 717 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 2wof h PRO 718 N 8.28 0.00 -0.47 -2.82 0.11 -1.97 -2.90 132.00 132.23 2wof h PRO 718 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2wof h PRO 718 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2wof h PRO 718 CO 1.00 0.02 0.00 0.25 -0.21 0.00 0.00 178.00 179.05 2wof n THR 719 N -3.12 0.61 -0.26 -1.15 -2.24 -1.26 -4.51 114.28 102.35 2wof n THR 719 Ca 0.01 -0.76 0.15 0.00 -2.27 0.00 0.00 64.05 61.18 2wof n THR 719 Cb 0.33 0.74 0.43 0.00 -2.10 0.00 0.00 70.33 69.73 2wof n THR 719 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2wof h LEU 720 N 4.09 0.56 0.00 3.22 3.38 -1.90 -3.48 115.31 121.18 2wof h LEU 720 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2wof h LEU 720 Cb 0.91 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2wof h LEU 720 CO 0.00 0.25 0.00 0.61 0.09 0.00 0.00 178.44 179.39 2wof n GLY 721 N -1.46 2.45 3.72 0.83 0.00 -1.26 -5.03 105.19 104.44 2wof n GLY 721 Ca 0.18 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 2wof n GLY 721 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wof s ALA 722 N -2.29 3.53 -0.02 4.61 0.00 -1.26 -4.96 121.76 121.37 2wof s ALA 722 Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.71 2wof s ALA 722 Cb 0.00 -3.50 -0.05 0.00 0.00 0.00 0.00 23.12 19.56 2wof s ALA 722 CO 0.00 -0.55 1.48 -1.17 0.00 0.00 0.00 175.76 175.52 2wof s LEU 723 N 0.88 4.31 0.16 0.00 2.96 -1.26 -4.91 118.68 120.82 2wof s LEU 723 Ca 0.62 2.15 0.25 0.00 -0.22 0.00 0.00 54.13 56.93 2wof s LEU 723 Cb -0.35 -3.55 0.58 0.00 0.50 0.00 0.00 46.19 43.37 2wof s LEU 723 CO 0.31 -0.79 1.55 1.17 -1.32 0.00 0.00 176.35 177.27 2wof n LYS 724 N 5.92 0.27 -3.89 1.98 4.81 -1.26 -4.59 118.16 121.40 2wof n LYS 724 Ca 0.14 0.15 -0.28 0.00 -0.87 0.00 0.00 58.31 57.45 2wof n LYS 724 Cb 0.43 -1.74 -0.16 0.00 0.02 0.00 0.00 35.03 33.58 2wof n LYS 724 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2wof s LYS 725 N -3.13 1.41 0.00 1.64 1.02 -1.26 -5.36 119.74 114.06 2wof s LYS 725 Ca 0.09 -0.49 0.00 0.00 0.02 0.00 0.00 55.97 55.59 2wof s LYS 725 Cb 0.13 -1.96 0.00 0.00 -0.52 0.00 0.00 37.83 35.48 2wof s LYS 725 CO 0.66 -0.42 0.00 -3.47 -0.92 0.00 0.00 175.35 171.20