#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g49 s PHE 2 N 0.00 3.67 -0.02 5.64 5.36 -1.26 -5.08 117.98 126.29 3g49 s PHE 2 Ca 0.00 0.88 0.00 0.00 -0.96 0.00 0.00 56.93 56.85 3g49 s PHE 2 Cb 0.00 -2.21 0.02 0.00 -0.34 0.00 0.00 43.02 40.49 3g49 s PHE 2 CO 0.00 0.62 0.00 1.03 -1.46 0.00 0.00 175.22 175.41 3g49 s ARG 3 N -1.34 0.12 0.31 10.12 0.52 -1.26 -5.07 118.95 122.35 3g49 s ARG 3 Ca 0.26 0.06 0.22 0.00 -0.52 0.00 0.00 55.73 55.74 3g49 s ARG 3 Cb -0.15 -0.26 1.07 0.00 0.52 0.00 0.00 34.95 36.13 3g49 s ARG 3 CO 0.14 -0.08 1.15 -2.30 0.02 0.00 0.00 175.30 174.23 3g49 n PRO 4 N 3.72 -0.03 0.26 3.54 -0.01 -1.26 -1.70 135.00 139.51 3g49 n PRO 4 Ca -0.21 0.94 0.13 0.00 -0.01 0.00 0.00 63.50 64.35 3g49 n PRO 4 Cb 0.54 -1.81 0.65 0.00 -0.01 0.00 0.00 33.50 32.87 3g49 n PRO 4 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 175.50 176.42 3g49 h GLU 5 N 0.00 0.00 0.00 -0.52 3.07 -1.96 -1.70 114.58 113.47 3g49 h GLU 5 Ca 0.64 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.50 3g49 h GLU 5 Cb 1.97 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.88 3g49 h GLU 5 CO -0.40 0.13 0.00 -1.33 -1.40 0.00 0.00 179.01 176.01 3g49 n MET 6 N -3.42 0.00 0.00 2.33 2.81 -0.69 -2.20 117.12 115.96 3g49 n MET 6 Ca -0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 3g49 n MET 6 Cb 0.31 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.32 3g49 n MET 6 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3g49 n LEU 7 N -1.00 0.00 -4.63 4.03 7.99 -0.64 -4.95 117.00 117.80 3g49 n LEU 7 Ca 0.00 -0.18 -0.43 0.00 -0.01 0.00 0.00 56.01 55.39 3g49 n LEU 7 Cb 0.00 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.28 3g49 n LEU 7 CO 0.00 0.00 1.66 -1.58 -1.51 0.00 0.00 177.39 175.96 3g49 s GLN 8 N -1.61 3.69 0.00 3.23 0.74 -0.93 -1.22 119.66 123.55 3g49 s GLN 8 Ca 0.00 2.23 0.00 0.00 0.05 0.00 0.00 55.36 57.64 3g49 s GLN 8 Cb 0.00 -4.23 0.00 0.00 1.10 0.00 0.00 33.01 29.88 3g49 s GLN 8 CO 0.00 -1.46 0.00 0.41 -0.55 0.00 0.00 175.29 173.69 3g49 n GLY 9 N 5.04 0.75 3.89 2.59 0.00 0.48 -4.95 105.19 112.99 3g49 n GLY 9 Ca 0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 3g49 n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g49 s LYS 10 N -0.49 3.61 -0.12 1.61 -0.14 -0.36 -4.80 119.74 119.05 3g49 s LYS 10 Ca 0.00 -0.09 -0.04 0.00 -1.36 0.00 0.00 55.97 54.48 3g49 s LYS 10 Cb 0.00 -2.92 -0.04 0.00 -1.68 0.00 0.00 37.83 33.19 3g49 s LYS 10 CO 0.00 0.52 0.03 0.15 -0.76 0.00 0.00 175.35 175.29 3g49 s LYS 11 N -2.40 3.37 -0.11 1.68 1.02 -1.26 -2.12 119.74 119.92 3g49 s LYS 11 Ca 0.37 -0.36 -0.07 0.00 0.02 0.00 0.00 55.97 55.93 3g49 s LYS 11 Cb -0.13 -2.97 0.04 0.00 -0.52 0.00 0.00 37.83 34.26 3g49 s LYS 11 CO 0.23 0.56 0.27 0.08 -0.92 0.00 0.00 175.35 175.56 3g49 s VAL 12 N -0.45 -0.03 -0.28 3.17 1.01 -0.91 -1.00 120.40 121.91 3g49 s VAL 12 Ca 0.09 0.11 -0.10 0.00 0.00 0.00 0.00 61.98 62.08 3g49 s VAL 12 Cb -0.12 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 3g49 s VAL 12 CO 0.02 0.04 0.16 -0.63 0.00 0.00 0.00 175.10 174.70 3g49 s ILE 13 N 1.03 5.03 -0.29 2.22 1.01 -0.82 -2.02 121.20 127.36 3g49 s ILE 13 Ca -0.07 0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.51 3g49 s ILE 13 Cb -0.08 -3.40 -0.03 0.00 0.01 0.00 0.00 42.46 38.95 3g49 s ILE 13 CO -0.07 0.25 0.17 -0.69 0.00 0.00 0.00 174.94 174.59 3g49 s VAL 14 N 1.71 4.99 0.55 2.92 1.01 -0.68 0.55 120.40 131.45 3g49 s VAL 14 Ca 0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.99 3g49 s VAL 14 Cb -0.16 -3.43 0.03 0.00 0.00 0.00 0.00 36.38 32.82 3g49 s VAL 14 CO 0.09 0.20 0.79 0.42 0.00 0.00 0.00 175.10 176.59 3g49 s THR 15 N 1.70 3.02 -1.76 3.92 -4.23 -0.80 -2.21 115.64 115.28 3g49 s THR 15 Ca 0.06 -0.52 -0.20 0.00 -1.18 0.00 0.00 61.69 59.85 3g49 s THR 15 Cb -0.16 -3.15 0.18 0.00 1.34 0.00 0.00 72.50 70.71 3g49 s THR 15 CO 0.09 -0.12 0.71 0.61 -0.54 0.00 0.00 174.62 175.37 3g49 n GLY 16 N -2.37 -0.43 0.53 3.99 0.00 -1.00 -4.04 105.19 101.88 3g49 n GLY 16 Ca 0.06 0.11 0.07 0.00 0.00 0.00 0.00 46.02 46.27 3g49 n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g49 n ALA 17 N -4.28 2.48 0.12 4.61 0.00 -0.95 -3.93 120.51 118.57 3g49 n ALA 17 Ca 0.08 -0.51 0.01 0.00 0.00 0.00 0.00 53.44 53.02 3g49 n ALA 17 Cb 0.48 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.90 3g49 n ALA 17 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3g49 h SER 18 N 1.82 0.00 0.00 0.00 4.64 -1.90 -3.23 113.55 114.88 3g49 h SER 18 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g49 h SER 18 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3g49 h SER 18 CO 0.00 0.60 0.00 2.29 -0.87 0.00 0.00 176.83 178.85 3g49 n LYS 19 N -3.26 0.00 0.00 4.77 2.85 -1.26 -4.69 118.16 116.58 3g49 n LYS 19 Ca 0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 3g49 n LYS 19 Cb 0.77 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.15 3g49 n LYS 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3g49 n GLY 20 N 0.00 0.00 0.24 2.58 0.00 -1.26 0.42 105.19 107.17 3g49 n GLY 20 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 3g49 n GLY 20 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3g49 h ILE 21 N 0.00 0.68 -0.44 -0.61 2.04 -1.89 -1.45 117.51 115.84 3g49 h ILE 21 Ca 0.00 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 3g49 h ILE 21 Cb 0.00 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 3g49 h ILE 21 CO 0.00 0.06 0.25 1.23 0.00 0.00 0.00 178.15 179.70 3g49 h GLY 22 N 0.35 0.64 0.19 5.37 0.00 -1.67 0.38 103.07 108.33 3g49 h GLY 22 Ca 0.34 -0.28 0.18 0.00 0.00 0.00 0.00 47.33 47.57 3g49 h GLY 22 CO -0.38 0.27 0.62 -0.09 0.00 0.00 0.00 176.54 176.96 3g49 h ARG 23 N 0.57 0.79 0.00 4.80 2.43 0.10 -1.97 114.38 121.10 3g49 h ARG 23 Ca 0.16 -0.05 -0.15 0.00 -0.81 0.00 0.00 59.98 59.13 3g49 h ARG 23 Cb 0.02 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 3g49 h ARG 23 CO -0.03 0.52 -0.70 0.93 -1.51 0.00 0.00 179.97 179.18 3g49 h GLU 24 N 0.81 0.00 -0.14 0.20 4.39 -0.86 -2.77 114.58 116.20 3g49 h GLU 24 Ca 0.57 0.00 0.02 0.00 0.34 0.00 0.00 59.36 60.28 3g49 h GLU 24 Cb 0.82 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.46 3g49 h GLU 24 CO -0.36 0.70 0.04 0.82 -1.16 0.00 0.00 179.01 179.04 3g49 h ILE 25 N 0.00 0.95 0.01 3.13 2.04 -0.20 -1.78 117.51 121.66 3g49 h ILE 25 Ca -0.01 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.83 3g49 h ILE 25 Cb 1.51 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.42 3g49 h ILE 25 CO 0.09 0.02 -0.04 0.00 0.00 0.00 0.00 178.15 178.22 3g49 h ALA 26 N 1.09 -0.05 -0.06 1.87 0.00 -1.39 -2.03 119.26 118.70 3g49 h ALA 26 Ca 0.06 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.99 3g49 h ALA 26 Cb 0.05 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3g49 h ALA 26 CO -0.07 -0.54 -0.30 1.88 0.00 0.00 0.00 179.25 180.22 3g49 h TYR 27 N -0.08 -0.88 -0.95 0.00 0.05 -1.27 -0.76 116.97 113.08 3g49 h TYR 27 Ca 0.01 0.03 0.16 0.00 0.05 0.00 0.00 58.73 58.99 3g49 h TYR 27 Cb 0.09 0.39 -0.08 0.00 1.01 0.00 0.00 36.73 38.14 3g49 h TYR 27 CO -0.11 -0.30 0.60 0.45 -1.05 0.00 0.00 178.16 177.75 3g49 h HIS 28 N -0.33 0.90 -0.38 4.88 3.86 -1.29 0.14 115.15 122.92 3g49 h HIS 28 Ca 0.01 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.18 3g49 h HIS 28 Cb 0.38 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 3g49 h HIS 28 CO -0.50 0.29 -0.06 -0.07 0.86 0.00 0.00 177.93 178.45 3g49 h LEU 29 N 0.72 0.60 -0.66 2.43 3.38 -0.94 -1.77 115.31 119.07 3g49 h LEU 29 Ca 0.50 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 58.23 3g49 h LEU 29 Cb 0.81 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 3g49 h LEU 29 CO -0.26 0.71 0.01 0.00 0.09 0.00 0.00 178.44 178.99 3g49 h ALA 30 N 1.36 0.87 0.00 1.53 0.00 0.68 0.15 119.26 123.85 3g49 h ALA 30 Ca 0.11 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3g49 h ALA 30 Cb 0.46 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3g49 h ALA 30 CO 0.02 0.66 -0.02 0.87 0.00 0.00 0.00 179.25 180.79 3g49 h LYS 31 N 0.96 0.00 -0.00 0.00 1.79 -0.38 -0.73 116.57 118.21 3g49 h LYS 31 Ca 0.17 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.64 3g49 h LYS 31 Cb 0.54 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 3g49 h LYS 31 CO 0.03 0.02 -0.11 -1.33 -1.08 0.00 0.00 179.45 176.98 3g49 n MET 32 N -3.55 0.48 -2.55 3.15 2.81 0.47 -4.88 117.12 113.05 3g49 n MET 32 Ca -0.03 -0.13 -0.04 0.00 -1.81 0.00 0.00 57.70 55.69 3g49 n MET 32 Cb 0.11 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.13 3g49 n MET 32 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g49 n GLY 33 N 1.33 0.62 3.93 3.03 0.00 -1.08 -3.43 105.19 109.59 3g49 n GLY 33 Ca 0.13 -0.57 -0.25 0.00 0.00 0.00 0.00 46.02 45.32 3g49 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g49 s ALA 34 N -2.87 3.60 -0.04 4.61 0.00 -0.81 -0.39 121.76 125.86 3g49 s ALA 34 Ca 0.08 -0.77 -0.10 0.00 0.00 0.00 0.00 51.96 51.16 3g49 s ALA 34 Cb -0.03 -2.26 -0.05 0.00 0.00 0.00 0.00 23.12 20.77 3g49 s ALA 34 CO 0.09 -0.12 0.28 -1.01 0.00 0.00 0.00 175.76 175.00 3g49 s HIS 35 N -2.45 3.65 0.04 0.00 3.76 -0.90 -1.36 115.29 118.03 3g49 s HIS 35 Ca 0.42 0.73 0.03 0.00 -0.15 0.00 0.00 55.06 56.09 3g49 s HIS 35 Cb -0.10 -2.09 -0.02 0.00 1.11 0.00 0.00 32.58 31.47 3g49 s HIS 35 CO 0.39 0.67 -0.09 0.14 -0.85 0.00 0.00 174.74 175.00 3g49 s VAL 36 N -1.11 0.64 -0.15 -0.90 -7.23 -0.77 -2.15 120.40 108.73 3g49 s VAL 36 Ca 0.21 -1.01 0.00 0.00 -1.81 0.00 0.00 61.98 59.38 3g49 s VAL 36 Cb -0.14 -0.67 -0.00 0.00 0.56 0.00 0.00 36.38 36.13 3g49 s VAL 36 CO 0.10 -0.28 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.76 3g49 s VAL 37 N -1.20 2.60 0.22 1.32 1.01 -0.86 -1.61 120.40 121.89 3g49 s VAL 37 Ca -0.07 -0.79 0.10 0.00 0.00 0.00 0.00 61.98 61.21 3g49 s VAL 37 Cb -0.09 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 3g49 s VAL 37 CO 0.01 0.52 -0.08 0.68 0.00 0.00 0.00 175.10 176.22 3g49 s VAL 38 N 0.81 3.17 0.04 2.92 -7.23 -0.72 -1.69 120.40 117.70 3g49 s VAL 38 Ca -0.05 -1.85 -0.20 0.00 -1.81 0.00 0.00 61.98 58.06 3g49 s VAL 38 Cb -0.15 -2.63 0.04 0.00 0.56 0.00 0.00 36.38 34.21 3g49 s VAL 38 CO -0.00 -0.24 0.47 0.28 -0.31 0.00 0.00 175.10 175.30 3g49 s THR 39 N -2.02 0.04 -2.34 5.32 -1.32 -0.94 -1.63 115.64 112.75 3g49 s THR 39 Ca 0.28 -0.34 0.00 0.00 -1.21 0.00 0.00 61.69 60.42 3g49 s THR 39 Cb -0.07 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 69.96 3g49 s THR 39 CO 0.17 -0.19 0.00 0.00 -2.21 0.00 0.00 174.62 172.39 3g49 n ALA 40 N 0.47 0.00 -0.02 11.08 0.00 -1.18 -2.23 120.51 128.63 3g49 n ALA 40 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.15 3g49 n ALA 40 Cb 0.60 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.91 3g49 n ALA 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3g49 n ARG 41 N -0.43 0.65 -3.15 0.00 1.74 -1.26 -0.94 116.66 113.28 3g49 n ARG 41 Ca 0.00 0.29 -0.43 0.00 -0.77 0.00 0.00 57.85 56.93 3g49 n ARG 41 Cb 0.00 -1.77 -0.07 0.00 -1.02 0.00 0.00 32.46 29.60 3g49 n ARG 41 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3g49 s SER 42 N -6.24 6.25 0.04 0.55 0.01 -1.26 -4.44 113.70 108.62 3g49 s SER 42 Ca -0.08 -0.72 -0.25 0.00 1.31 0.00 0.00 55.95 56.22 3g49 s SER 42 Cb 0.08 -2.30 -0.17 0.00 0.21 0.00 0.00 66.02 63.84 3g49 s SER 42 CO 0.82 -0.85 1.53 0.50 0.41 0.00 0.00 173.24 175.65 3g49 h LYS 43 N 8.95 -0.09 0.12 12.44 3.64 -1.98 -2.33 116.57 137.32 3g49 h LYS 43 Ca -0.27 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.13 3g49 h LYS 43 Cb 1.10 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.89 3g49 h LYS 43 CO 0.93 0.12 -0.52 0.93 -2.27 0.00 0.00 179.45 178.64 3g49 h GLU 44 N -0.28 -0.71 -0.64 1.90 3.07 -2.00 0.69 114.58 116.60 3g49 h GLU 44 Ca -0.01 0.05 0.13 0.00 -0.50 0.00 0.00 59.36 59.03 3g49 h GLU 44 Cb 0.24 0.16 -0.12 0.00 -0.84 0.00 0.00 28.75 28.20 3g49 h GLU 44 CO 0.02 -0.48 -0.12 0.00 -1.40 0.00 0.00 179.01 177.03 3g49 h ALA 45 N -0.56 0.49 -0.85 3.43 0.00 -1.91 -0.83 119.26 119.02 3g49 h ALA 45 Ca -0.01 0.24 0.13 0.00 0.00 0.00 0.00 54.91 55.27 3g49 h ALA 45 Cb 0.75 0.45 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 3g49 h ALA 45 CO -0.28 -0.42 0.55 -0.07 0.00 0.00 0.00 179.25 179.03 3g49 h LEU 46 N 0.03 0.64 -0.49 0.00 3.38 -0.35 -2.29 115.31 116.24 3g49 h LEU 46 Ca 0.32 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.21 3g49 h LEU 46 Cb 0.50 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3g49 h LEU 46 CO -0.63 0.35 -0.12 1.56 0.09 0.00 0.00 178.44 179.68 3g49 h GLN 47 N 0.69 0.95 -0.32 1.13 4.20 0.22 -2.27 115.11 119.71 3g49 h GLN 47 Ca 0.42 -0.36 0.09 0.00 0.06 0.00 0.00 58.65 58.86 3g49 h GLN 47 Cb 0.63 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 3g49 h GLN 47 CO -0.18 1.03 0.28 0.87 -0.67 0.00 0.00 178.83 180.16 3g49 h LYS 48 N 0.80 0.00 0.13 1.46 1.57 -0.74 -2.29 116.57 117.50 3g49 h LYS 48 Ca 0.12 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.54 3g49 h LYS 48 Cb 0.68 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 3g49 h LYS 48 CO 0.05 0.00 -1.97 0.28 -0.57 0.00 0.00 179.45 177.24 3g49 h VAL 49 N 0.00 0.65 -0.75 0.50 2.07 -1.13 -3.04 116.25 114.55 3g49 h VAL 49 Ca 0.15 -2.37 0.01 0.00 0.82 0.00 0.00 66.70 65.31 3g49 h VAL 49 Cb 0.72 2.53 -0.04 0.00 -1.52 0.00 0.00 31.29 32.97 3g49 h VAL 49 CO -0.00 0.89 0.49 0.58 0.02 0.00 0.00 177.57 179.55 3g49 h VAL 50 N 0.07 1.20 0.04 2.57 2.07 -1.13 -0.23 116.25 120.84 3g49 h VAL 50 Ca -0.41 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 66.73 3g49 h VAL 50 Cb 2.04 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3g49 h VAL 50 CO 0.10 0.19 -0.02 0.00 0.02 0.00 0.00 177.57 177.86 3g49 h ALA 51 N 1.27 -0.05 -0.24 1.67 0.00 -1.58 0.21 119.26 120.53 3g49 h ALA 51 Ca 0.28 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 3g49 h ALA 51 Cb -0.11 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3g49 h ALA 51 CO -0.06 -0.47 -0.35 -0.09 0.00 0.00 0.00 179.25 178.29 3g49 h ARG 52 N -0.18 0.52 -0.32 0.00 2.43 -1.35 0.34 114.38 115.83 3g49 h ARG 52 Ca -0.01 -0.24 0.07 0.00 -0.81 0.00 0.00 59.98 58.99 3g49 h ARG 52 Cb 0.16 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.63 3g49 h ARG 52 CO 0.01 0.80 -0.12 0.00 -1.51 0.00 0.00 179.97 179.15 3g49 h LEU 54 N -0.06 -0.53 -1.43 0.00 3.38 -0.50 -2.32 115.31 113.87 3g49 h LEU 54 Ca 0.16 0.01 0.31 0.00 0.09 0.00 0.00 57.88 58.46 3g49 h LEU 54 Cb 0.30 0.14 -0.10 0.00 0.09 0.00 0.00 40.66 41.09 3g49 h LEU 54 CO -0.37 -0.37 0.72 -0.08 0.09 0.00 0.00 178.44 178.44 3g49 h GLU 55 N -0.63 0.28 -0.24 1.13 4.81 0.37 -2.63 114.58 117.67 3g49 h GLU 55 Ca -0.06 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 3g49 h GLU 55 Cb 0.48 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.80 3g49 h GLU 55 CO 0.10 0.19 0.00 1.28 -0.73 0.00 0.00 179.01 179.85 3g49 n LEU 56 N -4.60 2.01 0.00 1.64 4.77 0.10 -4.96 117.00 115.96 3g49 n LEU 56 Ca 0.28 -0.87 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 3g49 n LEU 56 Cb 1.03 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.96 3g49 n LEU 56 CO 0.26 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 3g49 n GLY 57 N 1.18 0.95 3.72 -0.72 0.00 -0.99 -3.65 105.19 105.68 3g49 n GLY 57 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3g49 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g49 n ALA 58 N 0.00 1.78 -0.24 4.61 0.00 -0.30 -3.91 120.51 122.44 3g49 n ALA 58 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 3g49 n ALA 58 Cb 0.00 -2.34 0.12 0.00 0.00 0.00 0.00 19.45 17.23 3g49 n ALA 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g49 h ALA 59 N 3.51 0.96 -2.76 0.00 0.00 -1.39 -3.44 119.26 116.13 3g49 h ALA 59 Ca -0.47 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 3g49 h ALA 59 Cb 1.26 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.86 3g49 h ALA 59 CO 0.69 0.00 -0.16 -1.54 0.00 0.00 0.00 179.25 178.25 3g49 s SER 60 N -5.55 -0.09 -0.29 0.00 1.04 -1.25 -4.94 113.70 102.63 3g49 s SER 60 Ca -0.13 -0.75 0.04 0.00 0.48 0.00 0.00 55.95 55.59 3g49 s SER 60 Cb 0.17 0.51 0.20 0.00 0.10 0.00 0.00 66.02 67.00 3g49 s SER 60 CO 0.76 -1.00 0.62 0.00 0.98 0.00 0.00 173.24 174.60 3g49 s ALA 61 N -3.95 -2.46 0.33 5.32 0.00 -1.25 -1.84 121.76 117.91 3g49 s ALA 61 Ca 0.15 1.21 0.10 0.00 0.00 0.00 0.00 51.96 53.42 3g49 s ALA 61 Cb 0.01 -2.49 -0.06 0.00 0.00 0.00 0.00 23.12 20.58 3g49 s ALA 61 CO 0.01 -1.76 -0.05 -1.01 0.00 0.00 0.00 175.76 172.95 3g49 s HIS 62 N 2.84 2.48 0.05 0.00 3.76 -0.63 -4.92 115.29 118.86 3g49 s HIS 62 Ca 0.12 -0.43 0.06 0.00 -0.15 0.00 0.00 55.06 54.66 3g49 s HIS 62 Cb -0.10 -1.37 -0.02 0.00 1.11 0.00 0.00 32.58 32.19 3g49 s HIS 62 CO -0.25 0.55 -0.17 1.52 -0.85 0.00 0.00 174.74 175.54 3g49 s TYR 63 N -2.54 1.46 -0.01 1.40 -0.85 -1.26 -1.76 117.35 113.79 3g49 s TYR 63 Ca 0.33 -0.37 0.05 0.00 -0.52 0.00 0.00 57.07 56.56 3g49 s TYR 63 Cb -0.00 -0.86 -0.01 0.00 0.38 0.00 0.00 41.96 41.47 3g49 s TYR 63 CO 0.18 0.07 -0.15 0.42 -1.52 0.00 0.00 175.55 174.55 3g49 s ILE 64 N -0.90 1.20 -0.15 -3.49 1.01 -0.64 -4.89 121.20 113.34 3g49 s ILE 64 Ca 0.04 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 60.01 3g49 s ILE 64 Cb -0.09 -1.01 -0.00 0.00 0.01 0.00 0.00 42.46 41.37 3g49 s ILE 64 CO 0.02 0.32 -0.15 0.00 0.00 0.00 0.00 174.94 175.13 3g49 s ALA 65 N -0.39 2.51 -0.02 9.38 0.00 -1.26 -3.12 121.76 128.86 3g49 s ALA 65 Ca 0.06 -1.01 -0.30 0.00 0.00 0.00 0.00 51.96 50.71 3g49 s ALA 65 Cb -0.06 -1.21 0.11 0.00 0.00 0.00 0.00 23.12 21.96 3g49 s ALA 65 CO -0.00 0.04 1.13 0.20 0.00 0.00 0.00 175.76 177.12 3g49 s GLY 66 N 0.70 -0.35 -0.05 0.00 0.00 -0.12 -4.95 107.32 102.56 3g49 s GLY 66 Ca -0.07 0.84 -0.28 0.00 0.00 0.00 0.00 44.72 45.21 3g49 s GLY 66 CO 0.02 0.23 0.90 -0.45 0.00 0.00 0.00 173.10 173.79 3g49 s SER 67 N -2.69 7.21 0.00 1.64 0.15 -1.26 -4.03 113.70 114.71 3g49 s SER 67 Ca 0.11 1.46 0.12 0.00 0.70 0.00 0.00 55.95 58.35 3g49 s SER 67 Cb 0.01 -2.51 0.73 0.00 -1.71 0.00 0.00 66.02 62.54 3g49 s SER 67 CO -0.03 -0.27 1.35 0.23 1.20 0.00 0.00 173.24 175.71 3g49 n MET 68 N 4.21 0.84 0.00 5.44 0.00 -1.26 -2.32 117.12 124.03 3g49 n MET 68 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 57.70 57.86 3g49 n MET 68 Cb 0.50 -1.23 0.63 0.00 0.00 0.00 0.00 33.22 33.13 3g49 n MET 68 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 3g49 n GLU 69 N -0.73 0.43 -3.89 0.03 2.13 -1.26 -4.51 120.64 112.84 3g49 n GLU 69 Ca 0.09 0.05 -0.34 0.00 0.66 0.00 0.00 57.16 57.62 3g49 n GLU 69 Cb 0.04 -1.50 -0.13 0.00 0.27 0.00 0.00 31.44 30.12 3g49 n GLU 69 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3g49 s ASP 70 N -2.45 5.00 0.28 4.31 -1.08 -0.98 -4.95 116.67 116.79 3g49 s ASP 70 Ca 0.26 -1.89 -0.01 0.00 -0.52 0.00 0.00 52.55 50.38 3g49 s ASP 70 Cb 0.16 -1.73 0.39 0.00 -1.46 0.00 0.00 42.92 40.28 3g49 s ASP 70 CO 0.35 -0.42 1.81 0.24 0.52 0.00 0.00 175.17 177.67 3g49 h MET 71 N 7.89 0.82 -0.44 4.34 2.86 -1.87 0.62 114.93 129.16 3g49 h MET 71 Ca -0.12 -0.18 -0.07 0.00 -2.06 0.00 0.00 59.70 57.28 3g49 h MET 71 Cb 1.04 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.56 3g49 h MET 71 CO 0.60 0.76 -0.01 1.15 1.06 0.00 0.00 176.91 180.47 3g49 h THR 72 N 0.79 1.23 -0.23 2.22 2.02 -1.96 -1.72 112.91 115.26 3g49 h THR 72 Ca 0.17 -0.96 -0.03 0.00 0.77 0.00 0.00 66.41 66.37 3g49 h THR 72 Cb 0.32 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 3g49 h THR 72 CO 0.00 0.33 0.05 0.15 0.37 0.00 0.00 175.52 176.42 3g49 h PHE 73 N 0.67 0.40 -0.73 3.16 3.57 -1.52 -0.97 116.94 121.52 3g49 h PHE 73 Ca 0.13 -0.05 0.16 0.00 3.53 0.00 0.00 57.97 61.74 3g49 h PHE 73 Cb 0.43 -0.11 -0.11 0.00 2.79 0.00 0.00 35.95 38.95 3g49 h PHE 73 CO 0.02 0.50 0.18 0.00 -2.23 0.00 0.00 178.31 176.78 3g49 h ALA 74 N 0.86 0.95 0.56 2.41 0.00 -0.51 0.69 119.26 124.22 3g49 h ALA 74 Ca 0.07 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 3g49 h ALA 74 Cb 0.30 0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.32 3g49 h ALA 74 CO 0.00 -0.33 -0.27 1.49 0.00 0.00 0.00 179.25 180.14 3g49 h GLU 75 N 0.28 -0.72 -0.37 0.00 4.81 -1.04 -2.92 114.58 114.62 3g49 h GLU 75 Ca 0.41 0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.77 3g49 h GLU 75 Cb 0.70 0.16 -0.07 0.00 0.63 0.00 0.00 28.75 30.17 3g49 h GLU 75 CO -0.50 -0.48 -0.09 0.93 -0.73 0.00 0.00 179.01 178.13 3g49 h GLU 76 N -0.82 -0.00 -0.80 1.92 5.08 -1.19 -1.39 114.58 117.37 3g49 h GLU 76 Ca -0.08 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.42 3g49 h GLU 76 Cb 0.57 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.73 3g49 h GLU 76 CO 0.13 -0.00 0.38 0.35 -1.00 0.00 0.00 179.01 178.86 3g49 h PHE 77 N -0.00 0.65 -0.67 4.33 3.57 -0.91 -1.12 116.94 122.79 3g49 h PHE 77 Ca 0.18 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.71 3g49 h PHE 77 Cb 0.27 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 3g49 h PHE 77 CO -0.34 0.14 0.40 0.28 -2.23 0.00 0.00 178.31 176.56 3g49 h VAL 78 N 0.55 1.19 0.18 1.41 2.07 -1.05 -2.63 116.25 117.96 3g49 h VAL 78 Ca 0.43 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3g49 h VAL 78 Cb 0.62 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3g49 h VAL 78 CO -0.37 0.20 -0.09 0.00 0.02 0.00 0.00 177.57 177.34 3g49 h ALA 79 N 1.51 -0.24 -0.96 1.67 0.00 -1.04 -0.91 119.26 119.29 3g49 h ALA 79 Ca 0.24 -0.22 0.31 0.00 0.00 0.00 0.00 54.91 55.24 3g49 h ALA 79 Cb -0.02 0.09 -0.16 0.00 0.00 0.00 0.00 17.79 17.70 3g49 h ALA 79 CO -0.04 -0.33 0.32 1.49 0.00 0.00 0.00 179.25 180.69 3g49 h GLU 80 N -0.85 0.13 -0.03 0.00 4.22 -1.42 -1.38 114.58 115.24 3g49 h GLU 80 Ca -0.02 -0.01 -0.20 0.00 0.08 0.00 0.00 59.36 59.21 3g49 h GLU 80 Cb 0.52 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.76 3g49 h GLU 80 CO 0.04 0.08 -0.75 0.00 -2.18 0.00 0.00 179.01 176.20 3g49 h ALA 81 N 1.90 0.14 -0.37 2.92 0.00 -1.29 0.21 119.26 122.77 3g49 h ALA 81 Ca 0.67 -0.60 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 3g49 h ALA 81 Cb 1.52 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 3g49 h ALA 81 CO -0.74 0.50 -0.09 0.78 0.00 0.00 0.00 179.25 179.70 3g49 h GLY 82 N 0.17 0.69 0.60 0.00 0.00 -0.35 -2.31 103.07 101.86 3g49 h GLY 82 Ca -0.08 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.76 3g49 h GLY 82 CO 0.15 0.45 -0.00 3.43 0.00 0.00 0.00 176.54 180.56 3g49 h ASN 83 N 0.59 0.01 -0.77 0.19 -0.26 -0.89 0.12 115.58 114.57 3g49 h ASN 83 Ca 0.11 -0.41 0.15 0.00 -0.56 0.00 0.00 56.30 55.59 3g49 h ASN 83 Cb 0.50 -0.00 -0.15 0.00 -1.06 0.00 0.00 38.32 37.62 3g49 h ASN 83 CO 0.03 0.42 -0.22 -0.07 -1.06 0.00 0.00 177.43 176.52 3g49 h LEU 84 N -0.39 -0.82 -2.06 1.61 3.38 -0.60 -2.93 115.31 113.50 3g49 h LEU 84 Ca 0.00 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3g49 h LEU 84 Cb 0.41 0.51 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3g49 h LEU 84 CO 0.00 -0.27 0.00 0.23 0.09 0.00 0.00 178.44 178.49 3g49 n MET 85 N -5.50 2.32 -0.49 1.13 2.81 -0.59 -4.90 117.12 111.91 3g49 n MET 85 Ca 0.10 -2.02 0.00 0.00 -1.81 0.00 0.00 57.70 53.97 3g49 n MET 85 Cb 0.39 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.43 3g49 n MET 85 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g49 n GLY 86 N 1.42 1.21 0.00 3.03 0.00 0.21 -4.81 105.19 106.25 3g49 n GLY 86 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3g49 n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g49 n GLY 87 N -2.00 -0.53 3.26 -0.02 0.00 -0.05 -4.96 105.19 100.89 3g49 n GLY 87 Ca 0.00 -0.06 0.03 0.00 0.00 0.00 0.00 46.02 45.99 3g49 n GLY 87 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g49 s LEU 88 N 0.00 -0.19 -0.09 0.99 2.96 -1.26 -4.28 118.68 116.80 3g49 s LEU 88 Ca 0.00 0.27 0.03 0.00 -0.22 0.00 0.00 54.13 54.21 3g49 s LEU 88 Cb 0.00 1.22 -0.24 0.00 0.50 0.00 0.00 46.19 47.67 3g49 s LEU 88 CO 0.00 -0.04 0.46 0.47 -1.32 0.00 0.00 176.35 175.92 3g49 n ASP 89 N 4.58 1.48 -3.73 3.68 9.92 -0.17 -4.06 116.55 128.25 3g49 n ASP 89 Ca -0.08 0.28 -0.12 0.00 -0.53 0.00 0.00 54.79 54.34 3g49 n ASP 89 Cb 0.55 -0.41 -0.12 0.00 -0.64 0.00 0.00 41.12 40.50 3g49 n ASP 89 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 3g49 s MET 90 N -2.57 0.33 -0.32 -1.24 0.00 -0.99 -1.18 119.30 113.33 3g49 s MET 90 Ca -0.14 0.60 -0.03 0.00 0.00 0.00 0.00 55.69 56.11 3g49 s MET 90 Cb 0.07 0.01 0.05 0.00 0.00 0.00 0.00 34.83 34.96 3g49 s MET 90 CO 0.79 -0.12 0.04 -1.17 0.00 0.00 0.00 175.02 174.56 3g49 s LEU 91 N 0.95 4.09 -0.56 4.11 2.96 0.31 -1.94 118.68 128.60 3g49 s LEU 91 Ca -0.06 -1.25 -0.20 0.00 -0.22 0.00 0.00 54.13 52.40 3g49 s LEU 91 Cb -0.07 -1.77 0.08 0.00 0.50 0.00 0.00 46.19 44.93 3g49 s LEU 91 CO -0.07 -0.29 0.72 -0.63 -1.32 0.00 0.00 176.35 174.76 3g49 s ILE 92 N 1.30 4.75 -0.76 6.68 1.01 0.19 0.11 121.20 134.48 3g49 s ILE 92 Ca -0.04 -0.64 -0.22 0.00 0.00 0.00 0.00 60.65 59.76 3g49 s ILE 92 Cb -0.20 -4.44 0.08 0.00 0.01 0.00 0.00 42.46 37.91 3g49 s ILE 92 CO 0.00 -1.05 1.07 -0.76 0.00 0.00 0.00 174.94 174.20 3g49 s LEU 93 N 2.93 4.40 0.00 2.97 1.43 0.72 -1.90 118.68 129.22 3g49 s LEU 93 Ca 0.15 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.00 3g49 s LEU 93 Cb -0.21 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.58 3g49 s LEU 93 CO 0.10 -1.38 0.08 -3.20 0.23 0.00 0.00 176.35 172.18 3g49 n ASN 94 N 7.62 0.16 -4.92 2.29 2.85 -1.26 -1.98 115.26 120.03 3g49 n ASN 94 Ca 0.07 -0.53 -0.27 0.00 -0.11 0.00 0.00 54.58 53.73 3g49 n ASN 94 Cb 0.47 0.68 0.06 0.00 1.24 0.00 0.00 39.78 42.23 3g49 n ASN 94 CO 0.00 0.00 0.00 -1.38 -2.11 0.00 0.00 177.26 173.77 3g49 s HIS 95 N -0.68 3.05 -0.13 1.20 -3.43 -1.26 -4.74 115.29 109.31 3g49 s HIS 95 Ca 0.00 0.61 -0.29 0.00 -0.80 0.00 0.00 55.06 54.58 3g49 s HIS 95 Cb 0.00 -3.11 0.08 0.00 -1.43 0.00 0.00 32.58 28.12 3g49 s HIS 95 CO 0.00 -1.29 0.73 0.54 -2.00 0.00 0.00 174.74 172.72 3g49 s VAL 96 N -3.25 0.00 0.00 -5.38 0.11 -1.26 -4.78 120.40 105.84 3g49 s VAL 96 Ca 0.59 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.34 3g49 s VAL 96 Cb -0.11 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.67 3g49 s VAL 96 CO 0.46 0.00 1.84 -0.22 -3.33 0.00 0.00 175.10 173.85 3g49 s LEU 97 N -0.69 4.39 0.03 2.54 2.96 -1.26 -5.01 118.68 121.64 3g49 s LEU 97 Ca -0.07 2.49 -0.34 0.00 -0.22 0.00 0.00 54.13 56.00 3g49 s LEU 97 Cb -0.02 -3.53 -0.12 0.00 0.50 0.00 0.00 46.19 43.02 3g49 s LEU 97 CO 0.06 -1.00 1.76 0.00 -1.32 0.00 0.00 176.35 175.85 3g49 n TYR 98 N 7.35 2.34 -4.60 5.38 4.19 -1.26 -5.03 117.16 125.53 3g49 n TYR 98 Ca 0.19 0.08 -0.23 0.00 3.31 0.00 0.00 57.90 61.24 3g49 n TYR 98 Cb 0.42 -2.63 -0.16 0.00 0.49 0.00 0.00 39.34 37.46 3g49 n TYR 98 CO 0.00 0.00 0.00 -0.80 0.91 0.00 0.00 176.86 176.97 3g49 s ASN 99 N 2.73 1.68 0.58 2.98 0.02 -1.26 -5.11 114.94 116.55 3g49 s ASN 99 Ca 0.86 -0.27 -0.16 0.00 -1.02 0.00 0.00 52.86 52.27 3g49 s ASN 99 Cb -0.66 -0.53 -0.04 0.00 0.02 0.00 0.00 41.25 40.04 3g49 s ASN 99 CO 0.45 0.09 1.05 -0.13 0.02 0.00 0.00 177.10 178.57 3g49 s ARG 100 N 0.23 3.42 -0.77 -0.60 0.52 -1.26 -4.95 118.95 115.54 3g49 s ARG 100 Ca -0.06 1.17 -0.20 0.00 -0.52 0.00 0.00 55.73 56.13 3g49 s ARG 100 Cb -0.11 -2.05 0.11 0.00 0.52 0.00 0.00 34.95 33.42 3g49 s ARG 100 CO 0.02 -0.72 0.97 -0.51 0.02 0.00 0.00 175.30 175.07 3g49 s LEU 101 N -4.41 5.04 0.16 2.53 1.43 -1.26 -4.88 118.68 117.30 3g49 s LEU 101 Ca 0.63 -1.65 0.02 0.00 -1.03 0.00 0.00 54.13 52.09 3g49 s LEU 101 Cb -0.15 -2.37 -0.05 0.00 0.03 0.00 0.00 46.19 43.65 3g49 s LEU 101 CO 0.36 -1.15 -0.01 0.42 0.23 0.00 0.00 176.35 176.19 3g49 s THR 102 N 2.92 0.69 0.41 5.49 -4.23 -1.12 -5.03 115.64 114.78 3g49 s THR 102 Ca 0.24 -1.98 -0.26 0.00 -1.18 0.00 0.00 61.69 58.52 3g49 s THR 102 Cb -0.13 -2.06 -0.10 0.00 1.34 0.00 0.00 72.50 71.55 3g49 s THR 102 CO -0.00 -0.53 1.29 0.49 -0.54 0.00 0.00 174.62 175.33 3g49 n PHE 103 N -0.22 2.20 -2.34 3.99 3.72 -1.26 -4.24 117.46 119.31 3g49 n PHE 103 Ca -0.07 0.50 -0.41 0.00 -0.05 0.00 0.00 57.45 57.42 3g49 n PHE 103 Cb 0.63 -2.39 -0.03 0.00 -0.94 0.00 0.00 39.48 36.75 3g49 n PHE 103 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 3g49 s PHE 104 N -1.18 3.39 -0.20 1.38 5.36 -1.26 -4.99 117.98 120.47 3g49 s PHE 104 Ca 0.60 1.37 0.14 0.00 -0.96 0.00 0.00 56.93 58.07 3g49 s PHE 104 Cb -0.51 -3.47 0.44 0.00 -0.34 0.00 0.00 43.02 39.14 3g49 s PHE 104 CO 0.59 -1.36 1.19 0.72 -1.46 0.00 0.00 175.22 174.90 3g49 n HIS 105 N 2.67 0.85 -0.35 10.12 8.25 -1.26 -5.01 115.22 130.49 3g49 n HIS 105 Ca 0.05 -1.58 0.00 0.00 -0.26 0.00 0.00 57.72 55.93 3g49 n HIS 105 Cb 0.44 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.30 3g49 n HIS 105 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3g49 n GLY 106 N -0.68 0.70 2.74 -1.41 0.00 -1.26 -4.99 105.19 100.29 3g49 n GLY 106 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 3g49 n GLY 106 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3g49 n GLU 107 N -2.06 2.32 -0.31 1.61 4.71 -1.26 -4.70 120.64 120.95 3g49 n GLU 107 Ca 0.00 -1.94 0.23 0.00 -0.01 0.00 0.00 57.16 55.44 3g49 n GLU 107 Cb 0.00 -2.83 0.43 0.00 -1.01 0.00 0.00 31.44 28.02 3g49 n GLU 107 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 3g49 n ILE 108 N 4.86 -0.39 0.19 -3.67 5.41 -1.26 -0.41 119.36 124.09 3g49 n ILE 108 Ca 0.53 1.98 0.05 0.00 1.00 0.00 0.00 62.75 66.31 3g49 n ILE 108 Cb 0.29 -3.06 0.38 0.00 -0.71 0.00 0.00 39.64 36.54 3g49 n ILE 108 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 3g49 h ASP 109 N 0.00 0.00 -0.10 4.38 5.19 -1.99 0.30 116.42 124.20 3g49 h ASP 109 Ca 0.69 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 57.04 3g49 h ASP 109 Cb 1.68 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.19 3g49 h ASP 109 CO -0.80 0.37 -0.18 -1.13 -3.12 0.00 0.00 179.24 174.38 3g49 h ASN 110 N 0.00 0.33 -0.84 6.45 -0.73 -1.11 -2.14 115.58 117.54 3g49 h ASN 110 Ca -0.00 -0.55 0.19 0.00 1.87 0.00 0.00 56.30 57.81 3g49 h ASN 110 Cb 0.78 -0.10 -0.12 0.00 0.27 0.00 0.00 38.32 39.16 3g49 h ASN 110 CO 0.05 0.82 0.33 0.58 -0.37 0.00 0.00 177.43 178.84 3g49 h VAL 111 N -0.15 0.51 -0.31 2.57 2.07 -1.21 -0.58 116.25 119.16 3g49 h VAL 111 Ca 0.00 -0.13 -0.10 0.00 0.82 0.00 0.00 66.70 67.30 3g49 h VAL 111 Cb 0.76 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3g49 h VAL 111 CO 0.04 0.07 -0.18 -0.09 0.02 0.00 0.00 177.57 177.43 3g49 h ARG 112 N 0.38 0.67 0.03 1.57 2.43 -0.93 -1.39 114.38 117.13 3g49 h ARG 112 Ca 0.50 -0.30 -0.24 0.00 -0.81 0.00 0.00 59.98 59.13 3g49 h ARG 112 Cb 0.91 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 3g49 h ARG 112 CO -0.51 0.90 -1.00 0.87 -1.51 0.00 0.00 179.97 178.72 3g49 h LYS 113 N 0.42 0.39 -0.02 0.20 1.57 -0.98 -1.48 116.57 116.68 3g49 h LYS 113 Ca 0.07 -0.46 -0.13 0.00 -1.87 0.00 0.00 60.65 58.26 3g49 h LYS 113 Cb 0.72 0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 3g49 h LYS 113 CO 0.05 1.13 -0.60 0.66 -0.57 0.00 0.00 179.45 180.13 3g49 h SER 114 N 0.21 0.07 -0.37 0.86 4.64 -1.09 -0.47 113.55 117.39 3g49 h SER 114 Ca -0.09 -0.04 -0.10 0.00 -0.47 0.00 0.00 61.79 61.09 3g49 h SER 114 Cb 1.65 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.70 3g49 h SER 114 CO 0.17 0.65 -0.13 -0.03 -0.87 0.00 0.00 176.83 176.62 3g49 h MET 115 N 0.05 0.83 0.20 4.77 1.85 -0.52 -1.72 114.93 120.39 3g49 h MET 115 Ca -0.01 -0.29 -0.01 0.00 -0.61 0.00 0.00 59.70 58.78 3g49 h MET 115 Cb 1.07 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 33.04 3g49 h MET 115 CO 0.08 0.91 -0.10 0.93 -0.40 0.00 0.00 176.91 178.34 3g49 h GLU 116 N 0.74 -0.26 -0.08 0.39 4.39 -0.73 -1.94 114.58 117.10 3g49 h GLU 116 Ca 0.12 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.83 3g49 h GLU 116 Cb 0.63 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.34 3g49 h GLU 116 CO 0.04 0.08 0.04 0.28 -1.16 0.00 0.00 179.01 178.29 3g49 h VAL 117 N -0.63 1.12 0.00 3.13 2.07 -1.14 -2.16 116.25 118.64 3g49 h VAL 117 Ca -0.03 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.13 3g49 h VAL 117 Cb 0.46 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3g49 h VAL 117 CO 0.05 0.11 -1.42 0.59 0.02 0.00 0.00 177.57 176.91 3g49 n ASN 118 N -4.95 0.45 0.00 0.57 5.03 -0.65 -4.46 115.26 111.25 3g49 n ASN 118 Ca -0.06 0.01 0.00 0.00 0.87 0.00 0.00 54.58 55.40 3g49 n ASN 118 Cb 0.10 1.19 0.00 0.00 -1.02 0.00 0.00 39.78 40.05 3g49 n ASN 118 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 3g49 n PHE 119 N -2.29 0.00 -0.34 3.10 7.35 -0.77 -4.68 117.46 119.82 3g49 n PHE 119 Ca -0.01 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.77 3g49 n PHE 119 Cb 0.52 0.00 0.20 0.00 0.35 0.00 0.00 39.48 40.55 3g49 n PHE 119 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 3g49 n HIS 120 N -2.30 0.47 -0.31 -5.13 8.25 -0.93 -0.84 115.22 114.42 3g49 n HIS 120 Ca 0.00 1.18 -0.05 0.00 -0.26 0.00 0.00 57.72 58.59 3g49 n HIS 120 Cb 0.00 -1.13 0.08 0.00 1.12 0.00 0.00 29.99 30.05 3g49 n HIS 120 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3g49 h SER 121 N 0.00 1.10 -0.65 0.41 4.64 -1.61 -1.52 113.55 115.92 3g49 h SER 121 Ca 0.52 -0.13 0.09 0.00 -0.47 0.00 0.00 61.79 61.81 3g49 h SER 121 Cb 0.93 -0.28 -0.07 0.00 -0.31 0.00 0.00 62.40 62.66 3g49 h SER 121 CO -0.96 0.91 0.29 -0.26 -0.87 0.00 0.00 176.83 175.94 3g49 h PHE 122 N 1.20 0.51 -0.30 4.77 -1.00 -1.24 0.58 116.94 121.46 3g49 h PHE 122 Ca 0.29 0.03 -0.17 0.00 2.81 0.00 0.00 57.97 60.94 3g49 h PHE 122 Cb 0.09 -0.13 -0.00 0.00 3.61 0.00 0.00 35.95 39.52 3g49 h PHE 122 CO 0.01 0.16 -0.47 0.28 -1.61 0.00 0.00 178.31 176.68 3g49 h VAL 123 N 0.50 1.28 0.10 -0.55 2.07 -1.04 -1.02 116.25 117.60 3g49 h VAL 123 Ca 0.33 -1.66 -0.00 0.00 0.82 0.00 0.00 66.70 66.18 3g49 h VAL 123 Cb 0.37 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3g49 h VAL 123 CO -0.29 0.54 -0.05 0.58 0.02 0.00 0.00 177.57 178.37 3g49 h VAL 124 N 0.63 1.12 -0.86 2.57 2.07 -0.87 0.62 116.25 121.52 3g49 h VAL 124 Ca 0.03 -1.02 0.21 0.00 0.82 0.00 0.00 66.70 66.75 3g49 h VAL 124 Cb 1.05 1.75 -0.13 0.00 -1.52 0.00 0.00 31.29 32.44 3g49 h VAL 124 CO 0.10 0.24 0.31 -0.07 0.02 0.00 0.00 177.57 178.18 3g49 h LEU 125 N -0.62 0.18 -0.28 2.57 3.38 -0.97 1.08 115.31 120.65 3g49 h LEU 125 Ca -0.01 0.17 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 3g49 h LEU 125 Cb 0.50 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 3g49 h LEU 125 CO 0.02 -0.05 -0.22 0.28 0.09 0.00 0.00 178.44 178.56 3g49 h SER 126 N 0.32 0.67 0.08 -0.43 0.02 -0.80 -0.78 113.55 112.64 3g49 h SER 126 Ca 0.53 -0.45 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3g49 h SER 126 Cb 1.02 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.37 3g49 h SER 126 CO -0.56 0.98 -0.04 0.58 -1.14 0.00 0.00 176.83 176.65 3g49 h VAL 127 N 0.37 1.16 -0.81 2.27 2.07 0.25 -1.51 116.25 120.05 3g49 h VAL 127 Ca 0.05 -0.98 0.16 0.00 0.82 0.00 0.00 66.70 66.75 3g49 h VAL 127 Cb 0.77 1.79 -0.15 0.00 -1.52 0.00 0.00 31.29 32.18 3g49 h VAL 127 CO 0.06 0.24 -0.23 0.00 0.02 0.00 0.00 177.57 177.66 3g49 h ALA 128 N 0.29 0.47 0.00 1.67 0.00 0.11 -2.43 119.26 119.36 3g49 h ALA 128 Ca -0.01 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3g49 h ALA 128 Cb 0.47 0.66 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3g49 h ALA 128 CO 0.02 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 178.83 3g49 h ALA 129 N 1.73 1.00 0.03 0.00 0.00 -0.75 -3.40 119.26 117.87 3g49 h ALA 129 Ca 0.38 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.30 3g49 h ALA 129 Cb 0.60 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3g49 h ALA 129 CO -0.84 0.00 -0.13 1.98 0.00 0.00 0.00 179.25 180.26 3g49 h MET 130 N 0.00 -0.22 -0.86 0.00 4.05 -0.76 -0.81 114.93 116.32 3g49 h MET 130 Ca 0.00 0.02 0.15 0.00 -0.28 0.00 0.00 59.70 59.58 3g49 h MET 130 Cb 0.46 0.05 -0.15 0.00 -0.80 0.00 0.00 31.60 31.16 3g49 h MET 130 CO 0.00 -0.15 -0.33 -1.35 0.23 0.00 0.00 176.91 175.31 3g49 h PRO 131 N -0.23 -0.04 -0.11 0.39 0.11 -1.80 0.82 132.00 131.13 3g49 h PRO 131 Ca 0.03 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.91 3g49 h PRO 131 Cb 0.27 0.01 0.01 0.00 0.11 0.00 0.00 31.00 31.40 3g49 h PRO 131 CO -0.10 -0.03 -0.86 0.52 -0.21 0.00 0.00 178.00 177.32 3g49 h MET 132 N -0.04 0.78 -0.99 1.05 2.86 -1.63 -1.48 114.93 115.47 3g49 h MET 132 Ca 0.34 -0.69 0.24 0.00 -2.06 0.00 0.00 59.70 57.53 3g49 h MET 132 Cb 0.60 0.16 -0.08 0.00 0.06 0.00 0.00 31.60 32.34 3g49 h MET 132 CO -0.89 1.28 0.64 -0.07 1.06 0.00 0.00 176.91 178.94 3g49 h LEU 133 N 0.50 0.44 0.00 1.22 3.38 -0.46 -0.43 115.31 119.96 3g49 h LEU 133 Ca -0.08 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3g49 h LEU 133 Cb 1.50 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.24 3g49 h LEU 133 CO 0.18 0.13 -0.00 0.24 0.09 0.00 0.00 178.44 179.07 3g49 h MET 134 N 0.41 -0.00 -0.51 1.13 2.86 0.14 -0.20 114.93 118.76 3g49 h MET 134 Ca 0.54 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 58.25 3g49 h MET 134 Cb 1.36 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.99 3g49 h MET 134 CO -0.24 0.57 0.34 1.96 1.06 0.00 0.00 176.91 180.61 3g49 h GLN 135 N -0.58 0.43 0.00 1.72 4.20 -1.23 -2.51 115.11 117.14 3g49 h GLN 135 Ca -0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3g49 h GLN 135 Cb 0.58 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.26 3g49 h GLN 135 CO 0.00 0.28 -0.68 -1.13 -0.67 0.00 0.00 178.83 176.64 3g49 n SER 136 N -4.47 0.68 -3.64 1.46 3.41 -0.18 -4.93 113.62 105.95 3g49 n SER 136 Ca 0.07 0.07 -0.23 0.00 -0.26 0.00 0.00 58.87 58.52 3g49 n SER 136 Cb 0.26 0.25 0.06 0.00 -0.26 0.00 0.00 64.21 64.52 3g49 n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g49 n GLN 137 N -2.07 -6.46 0.00 4.33 6.02 -0.21 -5.02 117.38 113.98 3g49 n GLN 137 Ca 0.03 0.74 0.00 0.00 -0.01 0.00 0.00 57.00 57.76 3g49 n GLN 137 Cb 0.44 -5.65 0.00 0.00 1.02 0.00 0.00 30.24 26.05 3g49 n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g49 n GLY 138 N -1.61 1.69 3.46 1.08 0.00 -0.48 -4.72 105.19 104.60 3g49 n GLY 138 Ca -0.13 -1.72 -0.16 0.00 0.00 0.00 0.00 46.02 44.01 3g49 n GLY 138 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3g49 s SER 139 N -1.00 -0.56 -0.05 1.61 0.01 -0.33 -2.16 113.70 111.22 3g49 s SER 139 Ca 0.00 0.47 0.01 0.00 1.31 0.00 0.00 55.95 57.75 3g49 s SER 139 Cb 0.00 0.51 0.02 0.00 0.21 0.00 0.00 66.02 66.76 3g49 s SER 139 CO 0.00 -0.65 -0.06 -0.63 0.41 0.00 0.00 173.24 172.31 3g49 s ILE 140 N -1.71 0.68 -0.20 1.44 1.01 -0.58 0.11 121.20 121.95 3g49 s ILE 140 Ca -0.09 -0.20 -0.04 0.00 0.00 0.00 0.00 60.65 60.32 3g49 s ILE 140 Cb -0.01 -0.68 -0.02 0.00 0.01 0.00 0.00 42.46 41.77 3g49 s ILE 140 CO 0.05 0.26 -0.03 0.00 0.00 0.00 0.00 174.94 175.22 3g49 s ALA 141 N 0.93 2.91 -0.44 9.38 0.00 0.31 -1.12 121.76 133.72 3g49 s ALA 141 Ca -0.11 -1.05 -0.09 0.00 0.00 0.00 0.00 51.96 50.71 3g49 s ALA 141 Cb -0.15 -1.69 0.10 0.00 0.00 0.00 0.00 23.12 21.38 3g49 s ALA 141 CO 0.00 -0.23 0.30 0.08 0.00 0.00 0.00 175.76 175.91 3g49 s VAL 142 N 1.14 4.19 -0.17 0.00 1.01 0.76 -0.20 120.40 127.13 3g49 s VAL 142 Ca 0.02 -1.59 -0.26 0.00 0.00 0.00 0.00 61.98 60.14 3g49 s VAL 142 Cb -0.15 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 3g49 s VAL 142 CO 0.00 -0.64 0.88 -0.69 0.00 0.00 0.00 175.10 174.66 3g49 s VAL 143 N 1.39 4.84 0.00 2.92 1.01 -0.84 0.02 120.40 129.74 3g49 s VAL 143 Ca 0.04 1.74 0.00 0.00 0.00 0.00 0.00 61.98 63.76 3g49 s VAL 143 Cb -0.24 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 31.95 3g49 s VAL 143 CO 0.01 -0.01 0.00 -0.24 0.00 0.00 0.00 175.10 174.86 3g49 n SER 144 N 5.38 0.00 -3.53 3.32 2.88 0.15 -4.86 113.62 116.96 3g49 n SER 144 Ca 0.06 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.45 3g49 n SER 144 Cb 0.48 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.89 3g49 n SER 144 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3g49 s SER 145 N 1.09 -0.56 0.26 -3.46 0.01 -1.24 -2.99 113.70 106.80 3g49 s SER 145 Ca 0.00 0.41 -0.04 0.00 1.31 0.00 0.00 55.95 57.62 3g49 s SER 145 Cb 0.00 0.53 0.51 0.00 0.21 0.00 0.00 66.02 67.27 3g49 s SER 145 CO 0.00 -0.70 1.64 0.58 0.41 0.00 0.00 173.24 175.18 3g49 h VAL 146 N 2.81 0.35 0.00 3.43 2.07 -1.70 1.29 116.25 124.49 3g49 h VAL 146 Ca -0.29 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3g49 h VAL 146 Cb 1.19 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 3g49 h VAL 146 CO 0.39 0.03 0.00 0.00 0.02 0.00 0.00 177.57 178.01 3g49 n ALA 147 N -2.86 1.24 0.49 1.67 0.00 -1.26 0.24 120.51 120.03 3g49 n ALA 147 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.71 3g49 n ALA 147 Cb 0.53 -0.83 0.18 0.00 0.00 0.00 0.00 19.45 19.33 3g49 n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g49 n GLY 148 N -0.91 1.48 0.00 0.00 0.00 0.44 -4.49 105.19 101.71 3g49 n GLY 148 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3g49 n GLY 148 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3g49 n LYS 149 N 1.41 2.05 -1.12 1.61 4.76 0.14 -4.00 118.16 123.01 3g49 n LYS 149 Ca 0.17 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.61 3g49 n LYS 149 Cb 0.59 -0.83 0.00 0.00 -1.84 0.00 0.00 35.03 32.95 3g49 n LYS 149 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 3g49 n ILE 150 N -1.62 0.00 -4.18 -0.18 -5.35 0.13 -5.10 119.36 103.05 3g49 n ILE 150 Ca 0.00 0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.31 3g49 n ILE 150 Cb 0.33 0.00 -0.15 0.00 -1.74 0.00 0.00 39.64 38.08 3g49 n ILE 150 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3g49 s THR 151 N -0.67 0.46 -0.13 7.28 -4.23 -1.26 -4.29 115.64 112.79 3g49 s THR 151 Ca 0.00 -0.21 -0.01 0.00 -1.18 0.00 0.00 61.69 60.28 3g49 s THR 151 Cb 0.00 -0.41 -0.02 0.00 1.34 0.00 0.00 72.50 73.41 3g49 s THR 151 CO 0.00 0.15 -0.09 -0.31 -0.54 0.00 0.00 174.62 173.83 3g49 s TYR 152 N 0.08 2.91 0.15 3.99 1.51 -1.26 -5.07 117.35 119.66 3g49 s TYR 152 Ca -0.01 -0.41 -0.34 0.00 -1.01 0.00 0.00 57.07 55.30 3g49 s TYR 152 Cb -0.05 -1.87 -0.16 0.00 -0.11 0.00 0.00 41.96 39.77 3g49 s TYR 152 CO -0.00 -0.07 1.23 -2.30 -1.11 0.00 0.00 175.55 173.30 3g49 n PRO 153 N 3.35 1.20 0.00 -1.71 -0.02 -1.26 -3.92 135.00 132.64 3g49 n PRO 153 Ca -0.18 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 3g49 n PRO 153 Cb 0.53 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 3g49 n PRO 153 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3g49 n LEU 154 N 2.20 0.00 -1.77 2.45 4.77 -1.26 -4.99 117.00 118.40 3g49 n LEU 154 Ca 0.16 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.12 3g49 n LEU 154 Cb 0.23 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.34 3g49 n LEU 154 CO 0.61 0.00 0.30 2.30 -1.33 0.00 0.00 177.39 179.28 3g49 n ILE 155 N -0.67 0.18 -0.26 -0.08 -5.35 -1.25 -2.79 119.36 109.14 3g49 n ILE 155 Ca 0.00 -0.88 0.04 0.00 -0.27 0.00 0.00 62.75 61.64 3g49 n ILE 155 Cb 0.00 0.85 0.13 0.00 -1.74 0.00 0.00 39.64 38.88 3g49 n ILE 155 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3g49 h ALA 156 N 0.84 0.65 -0.77 -1.28 0.00 -1.90 0.70 119.26 117.50 3g49 h ALA 156 Ca -0.40 0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3g49 h ALA 156 Cb 1.48 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 19.74 3g49 h ALA 156 CO -0.11 -0.42 0.41 -1.35 0.00 0.00 0.00 179.25 177.77 3g49 h PRO 157 N 0.04 1.07 0.28 0.00 0.11 -1.95 -2.00 132.00 129.55 3g49 h PRO 157 Ca 0.40 -0.13 -0.01 0.00 0.11 0.00 0.00 66.00 66.36 3g49 h PRO 157 Cb 0.66 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.56 3g49 h PRO 157 CO -0.74 0.80 -0.14 -0.92 -0.21 0.00 0.00 178.00 176.79 3g49 h TYR 158 N 1.08 -0.35 -0.21 0.65 5.03 -1.40 -3.12 116.97 118.64 3g49 h TYR 158 Ca 0.27 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.55 3g49 h TYR 158 Cb 0.05 0.12 -0.01 0.00 1.55 0.00 0.00 36.73 38.43 3g49 h TYR 158 CO 0.01 -0.01 0.02 1.03 -1.32 0.00 0.00 178.16 177.89 3g49 h SER 159 N -0.75 0.27 -0.69 -2.11 0.87 -0.98 -0.80 113.55 109.35 3g49 h SER 159 Ca -0.04 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.47 3g49 h SER 159 Cb 0.50 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.36 3g49 h SER 159 CO 0.06 0.31 0.37 0.00 -0.53 0.00 0.00 176.83 177.05 3g49 h ALA 160 N 1.73 0.89 -0.13 6.23 0.00 -1.35 -0.43 119.26 126.19 3g49 h ALA 160 Ca 0.07 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 3g49 h ALA 160 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3g49 h ALA 160 CO 0.00 0.41 -0.59 0.66 0.00 0.00 0.00 179.25 179.73 3g49 h SER 161 N 0.95 0.49 0.03 0.00 4.64 -1.13 -1.86 113.55 116.68 3g49 h SER 161 Ca 0.24 -0.27 -0.21 0.00 -0.47 0.00 0.00 61.79 61.08 3g49 h SER 161 Cb 0.05 -0.14 0.02 0.00 -0.31 0.00 0.00 62.40 62.02 3g49 h SER 161 CO -0.04 0.97 -0.82 0.11 -0.87 0.00 0.00 176.83 176.18 3g49 h LYS 162 N 0.33 0.51 -0.73 4.77 1.79 -1.01 -2.46 116.57 119.78 3g49 h LYS 162 Ca -0.00 -0.59 0.16 0.00 -2.18 0.00 0.00 60.65 58.04 3g49 h LYS 162 Cb 1.12 0.17 -0.13 0.00 -1.58 0.00 0.00 32.23 31.82 3g49 h LYS 162 CO 0.10 1.21 -0.03 0.74 -1.08 0.00 0.00 179.45 180.40 3g49 h PHE 163 N 0.06 -0.11 -0.65 -1.35 -1.00 -1.08 -2.71 116.94 110.11 3g49 h PHE 163 Ca -0.11 0.06 0.04 0.00 2.81 0.00 0.00 57.97 60.77 3g49 h PHE 163 Cb 1.52 0.16 -0.04 0.00 3.61 0.00 0.00 35.95 41.21 3g49 h PHE 163 CO 0.13 -0.24 0.43 0.00 -1.61 0.00 0.00 178.31 177.02 3g49 h ALA 164 N 1.69 1.69 -0.15 2.45 0.00 -1.30 -2.37 119.26 121.28 3g49 h ALA 164 Ca 0.39 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 3g49 h ALA 164 Cb 0.66 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3g49 h ALA 164 CO -0.66 0.22 0.09 -0.07 0.00 0.00 0.00 179.25 178.83 3g49 h LEU 165 N 0.72 0.17 -0.70 0.00 3.38 -1.12 -0.86 115.31 116.91 3g49 h LEU 165 Ca 0.27 -0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.30 3g49 h LEU 165 Cb 0.15 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.78 3g49 h LEU 165 CO -0.08 0.16 0.32 -0.78 0.09 0.00 0.00 178.44 178.15 3g49 h ASP 166 N 0.17 0.38 -0.06 -0.43 1.82 -1.36 0.22 116.42 117.16 3g49 h ASP 166 Ca 0.05 0.07 -0.22 0.00 -0.39 0.00 0.00 57.03 56.55 3g49 h ASP 166 Cb 0.02 0.02 0.01 0.00 0.68 0.00 0.00 39.33 40.06 3g49 h ASP 166 CO -0.01 0.20 -0.82 1.23 -1.61 0.00 0.00 179.24 178.23 3g49 h GLY 167 N 0.53 0.74 0.43 -0.78 0.00 -1.21 0.50 103.07 103.28 3g49 h GLY 167 Ca 0.35 -1.18 -0.02 0.00 0.00 0.00 0.00 47.33 46.49 3g49 h GLY 167 CO -0.30 1.05 -0.17 -2.75 0.00 0.00 0.00 176.54 174.37 3g49 h PHE 168 N 0.33 -0.43 -0.25 5.60 3.57 -1.08 -3.16 116.94 121.52 3g49 h PHE 168 Ca -0.09 -0.01 -0.18 0.00 3.53 0.00 0.00 57.97 61.22 3g49 h PHE 168 Cb 1.48 0.14 0.00 0.00 2.79 0.00 0.00 35.95 40.36 3g49 h PHE 168 CO 0.11 -0.15 -0.55 0.74 -2.23 0.00 0.00 178.31 176.22 3g49 h PHE 169 N -1.04 1.04 -0.69 0.41 0.04 -0.57 -2.15 116.94 113.99 3g49 h PHE 169 Ca -0.05 -0.39 0.12 0.00 2.80 0.00 0.00 57.97 60.45 3g49 h PHE 169 Cb 0.47 -0.19 -0.08 0.00 2.20 0.00 0.00 35.95 38.35 3g49 h PHE 169 CO 0.03 1.21 0.27 0.77 -0.60 0.00 0.00 178.31 179.98 3g49 h SER 170 N 0.58 0.26 -0.91 2.17 0.02 -0.14 0.10 113.55 115.63 3g49 h SER 170 Ca 0.00 0.09 0.05 0.00 -0.84 0.00 0.00 61.79 61.09 3g49 h SER 170 Cb 1.16 0.07 -0.06 0.00 0.14 0.00 0.00 62.40 63.72 3g49 h SER 170 CO 0.12 0.13 0.59 0.74 -1.14 0.00 0.00 176.83 177.27 3g49 h THR 171 N 0.44 1.11 -0.75 -2.27 2.02 -1.47 -1.28 112.91 110.70 3g49 h THR 171 Ca 0.36 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 67.17 3g49 h THR 171 Cb 0.50 -0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 66.78 3g49 h THR 171 CO -0.36 0.20 0.47 0.25 0.37 0.00 0.00 175.52 176.46 3g49 h LEU 172 N 1.10 0.89 -0.25 2.58 5.85 -0.62 -0.90 115.31 123.97 3g49 h LEU 172 Ca 0.38 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 59.12 3g49 h LEU 172 Cb 0.08 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 40.82 3g49 h LEU 172 CO -0.14 0.67 -0.28 -0.09 -0.34 0.00 0.00 178.44 178.26 3g49 h ARG 173 N 1.02 -0.27 -0.14 1.25 2.43 -0.06 -1.37 114.38 117.24 3g49 h ARG 173 Ca 0.27 0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.33 3g49 h ARG 173 Cb -0.07 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 3g49 h ARG 173 CO -0.05 -0.18 -0.50 0.66 -1.51 0.00 0.00 179.97 178.39 3g49 h SER 174 N -0.28 0.41 -0.48 -3.80 4.64 -0.29 -1.58 113.55 112.17 3g49 h SER 174 Ca 0.13 -0.20 -0.08 0.00 -0.47 0.00 0.00 61.79 61.18 3g49 h SER 174 Cb 0.50 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 3g49 h SER 174 CO -0.41 0.84 -0.01 -0.33 -0.87 0.00 0.00 176.83 176.05 3g49 h GLU 175 N 0.30 0.85 -0.59 4.77 5.08 -0.90 -2.68 114.58 121.40 3g49 h GLU 175 Ca 0.01 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 3g49 h GLU 175 Cb 0.98 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.13 3g49 h GLU 175 CO 0.08 0.90 0.28 0.74 -1.00 0.00 0.00 179.01 180.02 3g49 h PHE 176 N 0.70 0.82 -0.11 4.33 -1.00 -0.55 -2.26 116.94 118.87 3g49 h PHE 176 Ca 0.13 -0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 3g49 h PHE 176 Cb 0.52 -0.26 -0.00 0.00 3.61 0.00 0.00 35.95 39.82 3g49 h PHE 176 CO 0.04 0.60 0.04 1.25 -1.61 0.00 0.00 178.31 178.63 3g49 h LEU 177 N 0.83 0.15 -1.37 1.54 6.46 -1.16 0.50 115.31 122.25 3g49 h LEU 177 Ca 0.21 -0.16 -0.06 0.00 -0.12 0.00 0.00 57.88 57.74 3g49 h LEU 177 Cb 0.08 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 39.97 3g49 h LEU 177 CO -0.03 0.27 -0.26 0.58 -0.62 0.00 0.00 178.44 178.38 3g49 h VAL 178 N 0.02 1.21 -0.72 1.05 2.07 -1.32 -1.64 116.25 116.93 3g49 h VAL 178 Ca 0.04 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.57 3g49 h VAL 178 Cb 0.17 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 3g49 h VAL 178 CO -0.00 0.29 0.00 0.59 0.02 0.00 0.00 177.57 178.47 3g49 n ASN 179 N -4.20 4.09 -3.86 0.57 3.02 -0.87 -4.94 115.26 109.08 3g49 n ASN 179 Ca -0.02 -2.09 -0.30 0.00 -0.03 0.00 0.00 54.58 52.15 3g49 n ASN 179 Cb 0.33 -0.51 0.03 0.00 -0.61 0.00 0.00 39.78 39.02 3g49 n ASN 179 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3g49 n LYS 180 N 1.54 -5.52 -3.17 3.52 4.76 -0.62 -4.95 118.16 113.73 3g49 n LYS 180 Ca 0.25 0.61 -0.40 0.00 -2.87 0.00 0.00 58.31 55.90 3g49 n LYS 180 Cb 0.67 -5.50 -0.06 0.00 -1.84 0.00 0.00 35.03 28.30 3g49 n LYS 180 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3g49 s VAL 181 N -3.28 5.07 -0.80 -0.18 1.01 0.17 -4.95 120.40 117.44 3g49 s VAL 181 Ca 0.65 1.12 0.02 0.00 0.00 0.00 0.00 61.98 63.77 3g49 s VAL 181 Cb -0.32 -3.91 0.32 0.00 0.00 0.00 0.00 36.38 32.47 3g49 s VAL 181 CO 0.80 0.17 1.33 -3.20 0.00 0.00 0.00 175.10 174.20 3g49 n ASN 182 N 4.70 5.75 -4.10 3.32 4.05 -1.26 -4.49 115.26 123.23 3g49 n ASN 182 Ca -0.03 -3.66 -0.33 0.00 0.45 0.00 0.00 54.58 51.02 3g49 n ASN 182 Cb 0.50 -0.86 -0.15 0.00 1.23 0.00 0.00 39.78 40.50 3g49 n ASN 182 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3g49 s VAL 183 N -4.18 2.27 0.51 3.44 1.01 -1.26 -3.81 120.40 118.39 3g49 s VAL 183 Ca 0.43 -1.44 -0.06 0.00 0.00 0.00 0.00 61.98 60.91 3g49 s VAL 183 Cb 0.22 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 3g49 s VAL 183 CO -0.11 0.09 0.84 -0.94 0.00 0.00 0.00 175.10 174.98 3g49 s SER 184 N 1.17 6.24 -0.23 3.32 1.04 -0.92 -4.95 113.70 119.37 3g49 s SER 184 Ca -0.05 1.02 -0.04 0.00 0.48 0.00 0.00 55.95 57.36 3g49 s SER 184 Cb -0.18 -2.28 0.09 0.00 0.10 0.00 0.00 66.02 63.75 3g49 s SER 184 CO -0.06 -0.65 0.18 -0.63 0.98 0.00 0.00 173.24 173.06 3g49 s ILE 185 N -2.84 -0.23 -0.29 -1.02 1.01 -1.26 -1.53 121.20 115.05 3g49 s ILE 185 Ca 0.49 -0.33 -0.06 0.00 0.00 0.00 0.00 60.65 60.75 3g49 s ILE 185 Cb -0.10 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.61 3g49 s ILE 185 CO 0.47 -0.38 0.05 -0.89 0.00 0.00 0.00 174.94 174.19 3g49 s THR 186 N 2.24 3.77 -0.15 2.92 2.01 -0.28 -4.52 115.64 121.62 3g49 s THR 186 Ca 0.07 -0.76 -0.20 0.00 0.31 0.00 0.00 61.69 61.11 3g49 s THR 186 Cb -0.16 -2.94 -0.03 0.00 0.01 0.00 0.00 72.50 69.38 3g49 s THR 186 CO -0.20 0.10 0.59 -0.22 -0.69 0.00 0.00 174.62 174.19 3g49 s LEU 187 N 1.47 4.21 -0.22 4.42 2.96 -0.67 -0.17 118.68 130.67 3g49 s LEU 187 Ca 0.02 0.87 -0.04 0.00 -0.22 0.00 0.00 54.13 54.76 3g49 s LEU 187 Cb -0.17 -2.85 -0.01 0.00 0.50 0.00 0.00 46.19 43.66 3g49 s LEU 187 CO 0.01 -0.16 -0.03 0.00 -1.32 0.00 0.00 176.35 174.85 3g49 s ILE 189 N 1.43 3.25 -0.20 0.00 -1.09 0.97 0.35 121.20 125.90 3g49 s ILE 189 Ca 0.05 -1.53 -0.06 0.00 -2.23 0.00 0.00 60.65 56.88 3g49 s ILE 189 Cb -0.14 -2.97 -0.03 0.00 -1.58 0.00 0.00 42.46 37.74 3g49 s ILE 189 CO -0.02 -0.30 0.02 -0.76 -1.23 0.00 0.00 174.94 172.65 3g49 s LEU 190 N 1.25 3.42 0.00 2.97 1.43 -1.16 -1.03 118.68 125.55 3g49 s LEU 190 Ca -0.00 -0.12 -0.08 0.00 -1.03 0.00 0.00 54.13 52.90 3g49 s LEU 190 Cb -0.21 -1.87 0.11 0.00 0.03 0.00 0.00 46.19 44.26 3g49 s LEU 190 CO -0.01 0.09 0.55 0.61 0.23 0.00 0.00 176.35 177.82 3g49 n GLY 191 N 4.06 -1.69 3.63 -3.19 0.00 -0.56 -2.00 105.19 105.43 3g49 n GLY 191 Ca -0.17 -1.62 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 3g49 n GLY 191 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3g49 n LEU 192 N 0.00 3.30 -3.77 0.99 0.00 -1.26 -4.87 117.00 111.39 3g49 n LEU 192 Ca 0.07 0.95 -0.15 0.00 0.00 0.00 0.00 56.01 56.88 3g49 n LEU 192 Cb 0.25 -1.39 -0.16 0.00 0.00 0.00 0.00 43.42 42.12 3g49 n LEU 192 CO 0.18 -1.51 -0.32 -0.63 0.00 0.00 0.00 177.39 175.11 3g49 s ILE 193 N -1.37 -0.06 0.00 1.96 -1.09 -1.26 -1.69 121.20 117.69 3g49 s ILE 193 Ca 0.68 0.20 -0.04 0.00 -2.23 0.00 0.00 60.65 59.27 3g49 s ILE 193 Cb -0.49 -0.11 -0.18 0.00 -1.58 0.00 0.00 42.46 40.10 3g49 s ILE 193 CO 0.53 0.08 2.79 -0.90 -1.23 0.00 0.00 174.94 176.21 3g49 n ASP 194 N 4.15 4.30 -4.79 3.58 5.75 0.42 -4.70 116.55 125.26 3g49 n ASP 194 Ca -0.27 -2.27 -0.34 0.00 -0.01 0.00 0.00 54.79 51.90 3g49 n ASP 194 Cb 0.51 -1.11 0.00 0.00 -1.03 0.00 0.00 41.12 39.48 3g49 n ASP 194 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3g49 s THR 195 N 1.17 3.54 0.12 2.12 -4.23 -1.26 -4.70 115.64 112.41 3g49 s THR 195 Ca 0.44 0.84 -0.20 0.00 -1.18 0.00 0.00 61.69 61.60 3g49 s THR 195 Cb 0.21 -3.33 -0.05 0.00 1.34 0.00 0.00 72.50 70.67 3g49 s THR 195 CO 0.00 -0.32 1.74 -0.08 -0.54 0.00 0.00 174.62 175.42 3g49 h GLU 196 N 0.86 0.11 -0.09 3.99 4.81 -1.98 0.24 114.58 122.53 3g49 h GLU 196 Ca -0.48 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 58.74 3g49 h GLU 196 Cb 1.24 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 3g49 h GLU 196 CO 0.57 0.08 0.04 1.79 -0.73 0.00 0.00 179.01 180.76 3g49 h THR 197 N 0.12 1.03 0.00 0.32 1.35 -1.95 0.32 112.91 114.09 3g49 h THR 197 Ca 0.09 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.87 3g49 h THR 197 Cb 0.08 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 67.42 3g49 h THR 197 CO -0.11 0.03 -0.73 0.00 -0.25 0.00 0.00 175.52 174.46 3g49 h ALA 198 N 1.93 0.59 0.03 6.62 0.00 -1.71 -0.81 119.26 125.92 3g49 h ALA 198 Ca 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3g49 h ALA 198 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3g49 h ALA 198 CO -0.01 0.00 -0.02 0.82 0.00 0.00 0.00 179.25 180.05 3g49 h ILE 199 N 0.00 1.39 -0.78 0.00 1.08 0.02 -3.04 117.51 116.18 3g49 h ILE 199 Ca 0.00 -1.56 0.10 0.00 -0.39 0.00 0.00 64.86 63.01 3g49 h ILE 199 Cb 0.89 2.40 -0.07 0.00 -3.07 0.00 0.00 36.82 36.97 3g49 h ILE 199 CO 0.00 0.38 0.42 0.11 -0.69 0.00 0.00 178.15 178.37 3g49 h LYS 200 N -0.75 0.67 0.00 2.37 1.57 -0.39 -0.68 116.57 119.36 3g49 h LYS 200 Ca -0.00 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3g49 h LYS 200 Cb 0.66 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 3g49 h LYS 200 CO 0.01 0.44 -0.20 0.00 -0.57 0.00 0.00 179.45 179.13 3g49 h ALA 201 N 1.46 0.93 -0.01 3.86 0.00 -1.24 -3.24 119.26 121.02 3g49 h ALA 201 Ca 0.38 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3g49 h ALA 201 Cb 0.40 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3g49 h ALA 201 CO -0.27 0.25 -0.21 0.25 0.00 0.00 0.00 179.25 179.27 3g49 n THR 202 N -3.23 0.00 -2.09 0.00 -2.24 -0.34 -4.70 114.28 101.69 3g49 n THR 202 Ca 0.02 -0.40 -0.42 0.00 -2.27 0.00 0.00 64.05 60.98 3g49 n THR 202 Cb 0.51 1.23 -0.03 0.00 -2.10 0.00 0.00 70.33 69.94 3g49 n THR 202 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3g49 s SER 203 N -1.66 6.74 -0.39 3.42 1.04 -0.75 -1.86 113.70 120.24 3g49 s SER 203 Ca 0.15 2.45 0.00 0.00 0.48 0.00 0.00 55.95 59.02 3g49 s SER 203 Cb 0.13 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.65 3g49 s SER 203 CO 0.32 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.45 3g49 n GLY 204 N 3.44 0.65 1.60 7.32 0.00 -1.26 -4.84 105.19 112.10 3g49 n GLY 204 Ca 0.12 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3g49 n GLY 204 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3g49 n ILE 205 N -2.78 0.08 -3.54 -0.61 5.41 -0.77 -5.06 119.36 112.09 3g49 n ILE 205 Ca -0.04 0.03 -0.37 0.00 1.00 0.00 0.00 62.75 63.37 3g49 n ILE 205 Cb 0.18 -0.49 -0.08 0.00 -0.71 0.00 0.00 39.64 38.54 3g49 n ILE 205 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 3g49 s TYR 206 N -1.16 3.38 -1.45 1.39 5.04 -0.94 -5.03 117.35 118.58 3g49 s TYR 206 Ca 0.00 0.47 0.24 0.00 -2.44 0.00 0.00 57.07 55.34 3g49 s TYR 206 Cb 0.00 -2.37 0.38 0.00 0.35 0.00 0.00 41.96 40.33 3g49 s TYR 206 CO 0.00 0.10 1.33 1.28 -1.34 0.00 0.00 175.55 176.92 3g49 n LEU 207 N 4.10 1.04 -4.69 6.97 4.77 -1.26 -4.70 117.00 123.23 3g49 n LEU 207 Ca -0.12 -0.31 -0.29 0.00 -0.03 0.00 0.00 56.01 55.26 3g49 n LEU 207 Cb 0.52 -0.12 0.16 0.00 -2.33 0.00 0.00 43.42 41.64 3g49 n LEU 207 CO 0.38 0.21 0.65 -0.83 -1.33 0.00 0.00 177.39 176.48 3g49 s GLY 208 N -2.73 1.60 1.03 -0.72 0.00 -1.26 -4.98 107.32 100.25 3g49 s GLY 208 Ca 0.17 -0.12 -0.12 0.00 0.00 0.00 0.00 44.72 44.64 3g49 s GLY 208 CO 0.64 0.41 1.07 2.56 0.00 0.00 0.00 173.10 177.79 3g49 s PRO 209 N -4.90 0.20 -0.06 2.90 0.04 -1.26 -5.05 135.00 126.86 3g49 s PRO 209 Ca 0.64 0.81 0.02 0.00 0.04 0.00 0.00 61.00 62.51 3g49 s PRO 209 Cb -0.19 -1.69 0.01 0.00 0.04 0.00 0.00 34.50 32.68 3g49 s PRO 209 CO 0.58 -2.96 -0.11 0.00 0.04 0.00 0.00 177.00 174.55 3g49 s ALA 210 N -2.75 1.16 0.44 8.56 0.00 -1.26 -4.72 121.76 123.18 3g49 s ALA 210 Ca 0.66 -0.35 -0.03 0.00 0.00 0.00 0.00 51.96 52.24 3g49 s ALA 210 Cb -0.21 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 3g49 s ALA 210 CO 0.60 0.09 0.71 -1.12 0.00 0.00 0.00 175.76 176.03 3g49 s SER 211 N 0.71 6.28 0.16 0.00 0.01 -0.68 -4.70 113.70 115.48 3g49 s SER 211 Ca -0.14 0.77 -0.30 0.00 1.31 0.00 0.00 55.95 57.59 3g49 s SER 211 Cb -0.16 -2.18 -0.08 0.00 0.21 0.00 0.00 66.02 63.82 3g49 s SER 211 CO 0.03 -0.48 1.31 -2.84 0.41 0.00 0.00 173.24 171.67 3g49 s PRO 212 N -4.59 4.38 0.54 12.44 0.02 -1.26 -0.43 135.00 146.10 3g49 s PRO 212 Ca 0.45 2.02 0.27 0.00 0.02 0.00 0.00 61.00 63.76 3g49 s PRO 212 Cb -0.10 -3.23 1.43 0.00 0.02 0.00 0.00 34.50 32.62 3g49 s PRO 212 CO 0.42 -0.30 1.97 1.57 -0.33 0.00 0.00 177.00 180.33 3g49 h LYS 213 N 5.93 0.00 0.11 5.54 2.10 -1.92 -2.75 116.57 125.59 3g49 h LYS 213 Ca -0.44 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 57.95 3g49 h LYS 213 Cb 1.21 0.00 0.03 0.00 -0.90 0.00 0.00 32.23 32.57 3g49 h LYS 213 CO 0.80 0.00 -1.09 0.93 -2.00 0.00 0.00 179.45 178.09 3g49 h GLU 214 N 0.00 0.54 -0.27 0.07 3.07 -1.97 -1.69 114.58 114.33 3g49 h GLU 214 Ca 0.27 -0.73 -0.15 0.00 -0.50 0.00 0.00 59.36 58.25 3g49 h GLU 214 Cb 1.13 0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 29.28 3g49 h GLU 214 CO -0.00 1.32 -0.46 1.49 -1.40 0.00 0.00 179.01 179.96 3g49 h GLU 215 N 0.10 0.70 0.07 2.33 4.81 -1.97 -2.40 114.58 118.22 3g49 h GLU 215 Ca -0.17 -0.39 0.01 0.00 -0.13 0.00 0.00 59.36 58.68 3g49 h GLU 215 Cb 1.80 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 31.18 3g49 h GLU 215 CO 0.21 1.01 -0.11 0.00 -0.73 0.00 0.00 179.01 179.38 3g49 h ALA 217 N 0.68 0.17 0.41 0.00 0.00 -1.30 -1.87 119.26 117.35 3g49 h ALA 217 Ca 0.02 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3g49 h ALA 217 Cb 0.24 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3g49 h ALA 217 CO -0.07 -0.52 -0.22 1.25 0.00 0.00 0.00 179.25 179.69 3g49 h LEU 218 N -0.08 -0.53 -0.97 0.00 6.46 -0.70 -2.12 115.31 117.37 3g49 h LEU 218 Ca 0.21 0.02 0.19 0.00 -0.12 0.00 0.00 57.88 58.18 3g49 h LEU 218 Cb 0.40 0.15 -0.11 0.00 -0.73 0.00 0.00 40.66 40.37 3g49 h LEU 218 CO -0.48 -0.36 0.56 -0.33 -0.62 0.00 0.00 178.44 177.21 3g49 h GLU 219 N -0.59 0.68 -0.10 1.25 4.39 -1.01 0.14 114.58 119.35 3g49 h GLU 219 Ca -0.05 -0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.65 3g49 h GLU 219 Cb 0.46 -0.15 -0.05 0.00 -0.10 0.00 0.00 28.75 28.91 3g49 h GLU 219 CO 0.08 0.45 -0.19 0.82 -1.16 0.00 0.00 179.01 179.01 3g49 h ILE 220 N 0.70 0.53 -0.54 3.13 2.04 -0.72 -1.94 117.51 120.71 3g49 h ILE 220 Ca 0.56 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.48 3g49 h ILE 220 Cb 0.88 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.43 3g49 h ILE 220 CO -0.39 0.00 0.26 0.40 0.00 0.00 0.00 178.15 178.42 3g49 h ILE 221 N -0.25 0.92 -0.06 -0.67 2.04 -0.21 -1.55 117.51 117.73 3g49 h ILE 221 Ca 0.09 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3g49 h ILE 221 Cb 0.38 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3g49 h ILE 221 CO -0.25 0.09 0.04 0.11 0.00 0.00 0.00 178.15 178.14 3g49 h LYS 222 N 0.50 0.08 -0.08 2.37 1.57 -0.84 -0.40 116.57 119.77 3g49 h LYS 222 Ca 0.25 -0.01 -0.22 0.00 -1.87 0.00 0.00 60.65 58.80 3g49 h LYS 222 Cb 0.19 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.49 3g49 h LYS 222 CO -0.19 0.08 -0.85 0.78 -0.57 0.00 0.00 179.45 178.70 3g49 h GLY 223 N 0.06 0.68 0.80 3.86 0.00 -1.21 -1.16 103.07 106.11 3g49 h GLY 223 Ca 0.02 -1.05 0.03 0.00 0.00 0.00 0.00 47.33 46.34 3g49 h GLY 223 CO -0.00 0.93 0.28 -0.84 0.00 0.00 0.00 176.54 176.91 3g49 h THR 224 N 0.40 1.01 -0.50 4.70 2.02 -1.22 -1.40 112.91 117.91 3g49 h THR 224 Ca -0.07 -0.19 -0.06 0.00 0.77 0.00 0.00 66.41 66.86 3g49 h THR 224 Cb 1.47 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 68.26 3g49 h THR 224 CO 0.16 0.10 0.08 0.00 0.37 0.00 0.00 175.52 176.24 3g49 h ALA 225 N 1.25 0.67 0.00 6.16 0.00 -0.85 -2.17 119.26 124.31 3g49 h ALA 225 Ca 0.22 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3g49 h ALA 225 Cb 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3g49 h ALA 225 CO -0.12 0.40 0.00 1.28 0.00 0.00 0.00 179.25 180.80 3g49 n LEU 226 N -4.41 0.00 -2.53 0.00 4.77 -0.46 -4.90 117.00 109.48 3g49 n LEU 226 Ca 0.01 0.19 -0.18 0.00 -0.03 0.00 0.00 56.01 56.00 3g49 n LEU 226 Cb 0.25 -0.19 0.04 0.00 -2.33 0.00 0.00 43.42 41.19 3g49 n LEU 226 CO 0.41 -0.10 0.06 0.54 -1.33 0.00 0.00 177.39 176.97 3g49 n ARG 227 N -1.19 -4.52 -2.06 3.23 1.74 -0.82 -4.97 116.66 108.07 3g49 n ARG 227 Ca 0.09 0.68 -0.42 0.00 -0.77 0.00 0.00 57.85 57.43 3g49 n ARG 227 Cb 0.10 -5.12 -0.03 0.00 -1.02 0.00 0.00 32.46 26.39 3g49 n ARG 227 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3g49 s GLN 228 N -5.61 4.29 0.19 5.56 -0.21 -0.55 -4.88 119.66 118.45 3g49 s GLN 228 Ca 0.30 2.23 -0.14 0.00 0.02 0.00 0.00 55.36 57.77 3g49 s GLN 228 Cb -0.13 -3.16 0.19 0.00 1.00 0.00 0.00 33.01 30.90 3g49 s GLN 228 CO 0.37 -0.43 1.67 -0.44 -2.12 0.00 0.00 175.29 174.34 3g49 h ASP 229 N 5.77 -0.33 -5.03 5.90 5.19 -1.89 -3.35 116.42 122.68 3g49 h ASP 229 Ca -0.44 0.14 -0.16 0.00 -0.62 0.00 0.00 57.03 55.94 3g49 h ASP 229 Cb 1.21 0.26 -0.17 0.00 0.18 0.00 0.00 39.33 40.82 3g49 h ASP 229 CO 0.82 -0.12 -0.69 -1.61 -3.12 0.00 0.00 179.24 174.52 3g49 s GLU 230 N -6.19 0.59 -0.19 3.56 2.02 -1.26 -1.68 118.70 115.56 3g49 s GLU 230 Ca -0.14 -1.09 -0.04 0.00 0.02 0.00 0.00 54.97 53.72 3g49 s GLU 230 Cb 0.17 0.07 0.09 0.00 0.10 0.00 0.00 34.13 34.56 3g49 s GLU 230 CO 0.72 -0.07 0.25 1.41 0.02 0.00 0.00 175.26 177.60 3g49 s MET 231 N -3.27 0.20 -0.16 1.61 -2.45 -0.73 -4.89 119.30 109.62 3g49 s MET 231 Ca 0.02 0.40 -0.03 0.00 -1.25 0.00 0.00 55.69 54.83 3g49 s MET 231 Cb 0.03 -0.78 -0.02 0.00 1.25 0.00 0.00 34.83 35.30 3g49 s MET 231 CO -0.06 -0.55 -0.05 0.71 1.05 0.00 0.00 175.02 176.12 3g49 s TYR 232 N 2.38 3.00 -0.46 4.11 2.02 -1.26 -0.02 117.35 127.12 3g49 s TYR 232 Ca 0.06 -0.38 0.04 0.00 -0.37 0.00 0.00 57.07 56.42 3g49 s TYR 232 Cb -0.15 -1.96 0.17 0.00 -0.40 0.00 0.00 41.96 39.62 3g49 s TYR 232 CO -0.12 -0.10 0.35 -0.47 -1.57 0.00 0.00 175.55 173.65 3g49 s TYR 233 N 0.47 1.49 -0.17 2.71 5.04 -0.20 -4.96 117.35 121.73 3g49 s TYR 233 Ca -0.04 -2.45 0.15 0.00 -2.44 0.00 0.00 57.07 52.29 3g49 s TYR 233 Cb -0.14 -1.24 0.36 0.00 0.35 0.00 0.00 41.96 41.28 3g49 s TYR 233 CO 0.03 -0.78 1.19 1.33 -1.34 0.00 0.00 175.55 175.97 3g49 n VAL 234 N 2.81 2.05 -0.64 3.14 0.24 -1.26 -1.50 118.33 123.18 3g49 n VAL 234 Ca 0.26 -2.78 0.00 0.00 -2.04 0.00 0.00 64.34 59.78 3g49 n VAL 234 Cb 0.45 -0.23 0.00 0.00 -1.47 0.00 0.00 33.84 32.58 3g49 n VAL 234 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3g49 n GLY 235 N -1.26 0.75 3.15 7.63 0.00 -1.26 -4.60 105.19 109.59 3g49 n GLY 235 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 3g49 n GLY 235 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3g49 s SER 236 N -2.46 0.10 0.17 1.61 0.15 -1.26 -5.04 113.70 106.96 3g49 s SER 236 Ca 0.00 -0.44 0.20 0.00 0.70 0.00 0.00 55.95 56.41 3g49 s SER 236 Cb 0.00 0.26 -0.03 0.00 -1.71 0.00 0.00 66.02 64.55 3g49 s SER 236 CO 0.00 -0.54 1.02 -0.09 1.20 0.00 0.00 173.24 174.83 3g49 h ARG 237 N 3.53 0.00 0.05 5.44 2.43 -2.01 -3.39 114.38 120.43 3g49 h ARG 237 Ca -0.32 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.58 3g49 h ARG 237 Cb 1.19 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.72 3g49 h ARG 237 CO 0.49 0.13 -1.34 -1.49 -1.51 0.00 0.00 179.97 176.26 3g49 h TRP 238 N 0.00 0.20 -0.04 2.20 4.06 -2.00 -3.40 115.95 116.97 3g49 h TRP 238 Ca -0.06 -0.15 -0.15 0.00 2.06 0.00 0.00 58.89 60.60 3g49 h TRP 238 Cb 1.23 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 29.37 3g49 h TRP 238 CO 0.00 1.15 -0.64 0.28 -3.56 0.00 0.00 178.44 175.67 3g49 h VAL 239 N 0.03 1.42 -0.92 1.49 2.07 -1.96 -1.20 116.25 117.17 3g49 h VAL 239 Ca -0.15 -2.12 0.21 0.00 0.82 0.00 0.00 66.70 65.46 3g49 h VAL 239 Cb 1.92 2.11 -0.07 0.00 -1.52 0.00 0.00 31.29 33.73 3g49 h VAL 239 CO 0.14 0.62 0.61 -0.65 0.02 0.00 0.00 177.57 178.30 3g49 h PRO 240 N 0.11 0.42 0.00 1.57 0.11 -1.82 -0.50 132.00 131.89 3g49 h PRO 240 Ca -0.01 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3g49 h PRO 240 Cb 1.15 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3g49 h PRO 240 CO 0.09 0.28 0.00 1.88 -0.21 0.00 0.00 178.00 180.04 3g49 h TYR 241 N 0.44 0.00 0.00 0.65 -1.99 -1.48 -1.01 116.97 113.58 3g49 h TYR 241 Ca 0.49 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.22 3g49 h TYR 241 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.91 3g49 h TYR 241 CO -0.00 0.00 -0.69 1.28 -0.00 0.00 0.00 178.16 178.74 3g49 n LEU 242 N -2.36 0.64 -0.04 3.88 4.77 -0.30 -4.12 117.00 119.47 3g49 n LEU 242 Ca 0.05 0.13 -0.11 0.00 -0.03 0.00 0.00 56.01 56.05 3g49 n LEU 242 Cb 0.44 -0.18 -0.14 0.00 -2.33 0.00 0.00 43.42 41.21 3g49 n LEU 242 CO 0.31 -0.00 -0.74 0.18 -1.33 0.00 0.00 177.39 175.80 3g49 n LEU 243 N -1.97 1.09 0.00 2.23 4.77 -0.58 -4.63 117.00 117.91 3g49 n LEU 243 Ca 0.03 0.27 0.12 0.00 -0.03 0.00 0.00 56.01 56.41 3g49 n LEU 243 Cb 0.42 -0.02 0.73 0.00 -2.33 0.00 0.00 43.42 42.22 3g49 n LEU 243 CO 0.37 0.51 0.95 0.61 -1.33 0.00 0.00 177.39 178.51 3g49 n GLY 244 N 1.70 -0.94 2.92 -0.72 0.00 -0.40 -4.96 105.19 102.78 3g49 n GLY 244 Ca -0.24 -0.15 -0.03 0.00 0.00 0.00 0.00 46.02 45.59 3g49 n GLY 244 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3g49 n ASN 245 N -0.91 -7.46 0.15 1.61 4.05 -1.26 -4.80 115.26 106.64 3g49 n ASN 245 Ca 0.19 0.95 0.03 0.00 0.45 0.00 0.00 54.58 56.20 3g49 n ASN 245 Cb 0.08 -4.04 0.42 0.00 1.23 0.00 0.00 39.78 37.47 3g49 n ASN 245 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 3g49 h PRO 246 N 3.05 0.16 -0.91 1.20 0.11 -1.94 -2.07 132.00 131.59 3g49 h PRO 246 Ca -0.03 -0.04 0.16 0.00 0.11 0.00 0.00 66.00 66.20 3g49 h PRO 246 Cb 0.48 -0.02 -0.10 0.00 0.11 0.00 0.00 31.00 31.48 3g49 h PRO 246 CO 0.09 0.32 0.51 0.78 -0.21 0.00 0.00 178.00 179.49 3g49 h GLY 247 N 0.69 1.53 1.28 -0.55 0.00 -2.00 -1.91 103.07 102.11 3g49 h GLY 247 Ca 0.03 -0.30 -0.27 0.00 0.00 0.00 0.00 47.33 46.79 3g49 h GLY 247 CO 0.02 -0.03 -1.10 -0.09 0.00 0.00 0.00 176.54 175.35 3g49 h ARG 248 N 0.70 0.63 -0.51 4.80 2.43 -1.72 -0.46 114.38 120.25 3g49 h ARG 248 Ca 0.50 -0.73 -0.01 0.00 -0.81 0.00 0.00 59.98 58.93 3g49 h ARG 248 Cb 0.71 0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.46 3g49 h ARG 248 CO -0.36 1.31 0.27 0.87 -1.51 0.00 0.00 179.97 180.56 3g49 h LYS 249 N 0.33 0.72 0.24 0.20 1.57 -1.19 -1.55 116.57 116.89 3g49 h LYS 249 Ca -0.14 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 3g49 h LYS 249 Cb 1.76 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.93 3g49 h LYS 249 CO 0.21 0.57 -0.12 0.82 -0.57 0.00 0.00 179.45 180.36 3g49 h ILE 250 N 0.68 0.78 -0.07 1.86 2.04 -1.25 -2.24 117.51 119.31 3g49 h ILE 250 Ca 0.18 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.98 3g49 h ILE 250 Cb 0.06 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 3g49 h ILE 250 CO -0.03 0.02 0.07 0.24 0.00 0.00 0.00 178.15 178.45 3g49 h MET 251 N -0.36 0.00 0.19 2.37 2.86 -0.91 -0.99 114.93 118.09 3g49 h MET 251 Ca -0.03 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.27 3g49 h MET 251 Cb 0.28 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.95 3g49 h MET 251 CO 0.05 0.00 -1.67 0.93 1.06 0.00 0.00 176.91 177.29 3g49 h GLU 252 N 0.00 0.40 0.50 1.72 5.08 -0.84 -2.29 114.58 119.14 3g49 h GLU 252 Ca 0.03 -0.68 -0.02 0.00 -1.00 0.00 0.00 59.36 57.70 3g49 h GLU 252 Cb 0.17 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 3g49 h GLU 252 CO -0.00 1.32 -0.45 0.35 -1.00 0.00 0.00 179.01 179.23 3g49 h PHE 253 N 0.05 -1.24 0.38 4.33 3.04 -1.13 -2.53 116.94 119.85 3g49 h PHE 253 Ca -0.33 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.61 3g49 h PHE 253 Cb 2.06 0.48 -0.01 0.00 2.56 0.00 0.00 35.95 41.04 3g49 h PHE 253 CO 0.11 -0.61 -0.32 -0.07 -2.02 0.00 0.00 178.31 175.40 3g49 h LEU 254 N -0.94 -0.86 -1.94 0.59 3.38 -1.25 -1.21 115.31 113.07 3g49 h LEU 254 Ca -0.06 0.06 0.56 0.00 0.09 0.00 0.00 57.88 58.52 3g49 h LEU 254 Cb 0.80 0.27 -0.08 0.00 0.09 0.00 0.00 40.66 41.74 3g49 h LEU 254 CO -0.03 -0.45 1.35 0.28 0.09 0.00 0.00 178.44 179.69 3g49 h SER 255 N -0.69 0.02 0.14 -0.43 0.02 -1.47 0.33 113.55 111.47 3g49 h SER 255 Ca -0.05 0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.81 3g49 h SER 255 Cb 0.58 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 3g49 h SER 255 CO -0.00 -0.02 -0.38 0.00 -1.14 0.00 0.00 176.83 175.29 3g49 h ALA 256 N 1.08 1.08 0.00 3.77 0.00 -0.75 -2.33 119.26 122.11 3g49 h ALA 256 Ca 0.92 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3g49 h ALA 256 Cb 3.64 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 21.33 3g49 h ALA 256 CO -0.05 0.59 0.00 0.00 0.00 0.00 0.00 179.25 179.78 3g49 n ALA 257 N -2.48 1.63 1.30 0.00 0.00 0.12 -2.55 120.51 118.52 3g49 n ALA 257 Ca -0.01 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.48 3g49 n ALA 257 Cb 0.47 -1.21 0.37 0.00 0.00 0.00 0.00 19.45 19.08 3g49 n ALA 257 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3g49 n GLU 258 N -1.43 1.64 -3.74 0.00 1.02 -0.87 -4.86 120.64 112.39 3g49 n GLU 258 Ca 0.04 -0.96 -0.33 0.00 -0.02 0.00 0.00 57.16 55.88 3g49 n GLU 258 Cb 0.13 -1.37 -0.05 0.00 -0.02 0.00 0.00 31.44 30.14 3g49 n GLU 258 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3g49 s TYR 259 N -1.79 3.54 -1.06 -0.32 1.51 -1.06 -5.04 117.35 113.13 3g49 s TYR 259 Ca 0.30 0.54 -0.16 0.00 -1.01 0.00 0.00 57.07 56.75 3g49 s TYR 259 Cb 0.16 -1.98 0.16 0.00 -0.11 0.00 0.00 41.96 40.20 3g49 s TYR 259 CO 0.24 0.55 1.25 1.21 -1.11 0.00 0.00 175.55 177.69 3g49 s ASN 260 N -2.04 6.88 0.16 2.29 3.04 -1.26 -4.87 114.94 119.13 3g49 s ASN 260 Ca 0.33 -2.60 -0.15 0.00 0.04 0.00 0.00 52.86 50.48 3g49 s ASN 260 Cb -0.13 -2.38 0.04 0.00 -1.54 0.00 0.00 41.25 37.24 3g49 s ASN 260 CO 0.21 -0.85 1.78 -0.50 -3.04 0.00 0.00 177.10 174.69 3g49 h TRP 261 N 7.89 0.64 -0.81 0.43 4.06 -1.95 -1.27 115.95 124.93 3g49 h TRP 261 Ca 0.23 -0.01 0.16 0.00 2.06 0.00 0.00 58.89 61.33 3g49 h TRP 261 Cb 0.95 -0.21 -0.15 0.00 -1.00 0.00 0.00 29.16 28.75 3g49 h TRP 261 CO 1.11 0.46 -0.23 -0.44 -3.56 0.00 0.00 178.44 175.78 3g49 h ASP 262 N 0.63 -0.84 0.00 -3.49 3.32 -2.04 -3.55 116.42 110.45 3g49 h ASP 262 Ca 0.17 0.25 0.00 0.00 0.02 0.00 0.00 57.03 57.47 3g49 h ASP 262 Cb 0.02 0.53 0.00 0.00 0.22 0.00 0.00 39.33 40.10 3g49 h ASP 262 CO -0.03 -0.27 0.00 -3.20 -1.72 0.00 0.00 179.24 174.02