#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gue h GLY 9 N 0.00 -0.21 0.49 0.46 0.00 -1.99 -1.65 103.07 100.17 3gue h GLY 9 Ca 0.00 0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.51 3gue h GLY 9 CO 0.00 -0.10 0.21 0.00 0.00 0.00 0.00 176.54 176.65 3gue h ALA 10 N 0.65 0.68 -0.73 3.60 0.00 -1.88 -1.95 119.26 119.62 3gue h ALA 10 Ca -0.01 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3gue h ALA 10 Cb 0.20 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3gue h ALA 10 CO -0.00 -0.19 0.26 0.00 0.00 0.00 0.00 179.25 179.31 3gue h ALA 11 N 1.36 1.07 -0.34 0.00 0.00 -1.81 -2.51 119.26 117.03 3gue h ALA 11 Ca 0.26 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3gue h ALA 11 Cb 0.29 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3gue h ALA 11 CO -0.26 0.64 -0.16 -0.07 0.00 0.00 0.00 179.25 179.40 3gue h LEU 12 N 1.07 0.60 -0.74 0.00 3.38 -1.10 0.47 115.31 119.00 3gue h LEU 12 Ca 0.24 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 3gue h LEU 12 Cb 0.26 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3gue h LEU 12 CO -0.01 0.78 0.24 0.00 0.09 0.00 0.00 178.44 179.54 3gue h ALA 13 N 1.28 0.97 -0.18 1.53 0.00 -1.19 -1.90 119.26 119.77 3gue h ALA 13 Ca 0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 3gue h ALA 13 Cb 0.59 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3gue h ALA 13 CO 0.04 0.65 -0.04 0.00 0.00 0.00 0.00 179.25 179.90 3gue h LEU 15 N 0.07 -0.83 0.01 0.00 5.85 -0.83 -1.82 115.31 117.75 3gue h LEU 15 Ca 0.05 0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 3gue h LEU 15 Cb 0.47 0.41 0.00 0.00 0.37 0.00 0.00 40.66 41.91 3gue h LEU 15 CO 0.02 -0.28 -0.00 -0.33 -0.34 0.00 0.00 178.44 177.51 3gue h GLU 16 N -0.20 -0.01 -0.75 1.25 5.08 -1.35 0.25 114.58 118.84 3gue h GLU 16 Ca 0.17 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3gue h GLU 16 Cb 0.48 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 3gue h GLU 16 CO -0.47 0.06 0.46 -0.22 -1.00 0.00 0.00 179.01 177.84 3gue h LYS 17 N -0.09 1.02 -0.07 2.33 3.64 -1.28 0.34 116.57 122.46 3gue h LYS 17 Ca -0.00 -0.09 -0.07 0.00 -1.27 0.00 0.00 60.65 59.22 3gue h LYS 17 Cb 0.08 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3gue h LYS 17 CO 0.00 0.72 -0.24 0.52 -2.27 0.00 0.00 179.45 178.18 3gue h MET 18 N 1.03 0.28 0.17 1.90 2.86 -1.23 -2.32 114.93 117.61 3gue h MET 18 Ca 0.27 -0.21 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3gue h MET 18 Cb -0.04 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 3gue h MET 18 CO -0.05 0.84 -0.15 1.96 1.06 0.00 0.00 176.91 180.57 3gue h GLN 19 N -0.23 -0.33 -0.85 1.72 4.20 -0.39 -1.63 115.11 117.61 3gue h GLN 19 Ca -0.01 0.02 0.18 0.00 0.06 0.00 0.00 58.65 58.90 3gue h GLN 19 Cb 0.87 0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.67 3gue h GLN 19 CO 0.05 -0.22 0.56 0.00 -0.67 0.00 0.00 178.83 178.55 3gue h ALA 20 N 0.46 2.14 -0.00 3.87 0.00 -0.40 -2.57 119.26 122.76 3gue h ALA 20 Ca -0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3gue h ALA 20 Cb 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3gue h ALA 20 CO -0.03 -0.40 -0.28 0.45 0.00 0.00 0.00 179.25 179.00 3gue n SER 21 N -4.50 0.28 0.00 0.00 2.88 -0.81 -4.95 113.62 106.51 3gue n SER 21 Ca 0.17 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 3gue n SER 21 Cb 0.62 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 3gue n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3gue n GLY 22 N 1.50 0.65 3.74 0.46 0.00 -0.69 -5.05 105.19 105.80 3gue n GLY 22 Ca 0.06 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 3gue n GLY 22 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gue n VAL 23 N -2.62 1.84 -1.71 1.61 0.31 -0.75 -4.92 118.33 112.09 3gue n VAL 23 Ca 0.00 -0.46 -0.39 0.00 -0.01 0.00 0.00 64.34 63.48 3gue n VAL 23 Cb 0.00 -1.79 0.04 0.00 -0.91 0.00 0.00 33.84 31.18 3gue n VAL 23 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3gue n GLU 24 N 0.75 1.59 -0.12 5.55 0.00 -1.26 -4.80 120.64 122.34 3gue n GLU 24 Ca 0.04 0.58 -0.13 0.00 0.00 0.00 0.00 57.16 57.66 3gue n GLU 24 Cb 0.37 -2.46 -0.03 0.00 0.00 0.00 0.00 31.44 29.33 3gue n GLU 24 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 3gue h GLU 25 N 1.38 0.83 -0.08 5.31 4.57 -2.00 -2.42 114.58 122.18 3gue h GLU 25 Ca -0.50 -0.40 -0.05 0.00 -1.18 0.00 0.00 59.36 57.23 3gue h GLU 25 Cb 1.31 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.89 3gue h GLU 25 CO 0.56 1.04 -0.17 -0.22 -1.18 0.00 0.00 179.01 179.04 3gue h LYS 26 N 0.63 0.12 0.04 1.92 1.63 -1.97 -1.42 116.57 117.52 3gue h LYS 26 Ca 0.07 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.84 3gue h LYS 26 Cb 0.84 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.45 3gue h LYS 26 CO 0.07 0.30 -0.02 0.00 -3.45 0.00 0.00 179.45 176.35 3gue h ILE 28 N -0.29 0.65 -0.28 0.00 2.04 -1.37 0.16 117.51 118.43 3gue h ILE 28 Ca -0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.90 3gue h ILE 28 Cb 0.26 0.65 -0.08 0.00 -0.74 0.00 0.00 36.82 36.92 3gue h ILE 28 CO 0.01 0.00 -0.50 -0.74 0.00 0.00 0.00 178.15 176.92 3gue h HIS 29 N -0.06 -1.48 -0.52 1.37 2.76 -1.13 0.57 115.15 116.66 3gue h HIS 29 Ca 0.13 0.07 -0.03 0.00 -2.20 0.00 0.00 60.37 58.34 3gue h HIS 29 Cb 0.26 0.69 -0.02 0.00 1.55 0.00 0.00 27.41 29.89 3gue h HIS 29 CO -0.29 -0.50 0.22 0.82 -1.30 0.00 0.00 177.93 176.88 3gue h ILE 30 N -0.45 1.21 -0.68 6.26 2.04 -1.00 -1.92 117.51 122.97 3gue h ILE 30 Ca 0.08 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.33 3gue h ILE 30 Cb 0.63 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 3gue h ILE 30 CO -0.51 0.25 0.42 0.15 0.00 0.00 0.00 178.15 178.45 3gue h PHE 31 N 0.70 0.78 -0.64 1.37 3.57 -0.50 -1.62 116.94 120.59 3gue h PHE 31 Ca 0.17 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.72 3gue h PHE 31 Cb 0.18 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 3gue h PHE 31 CO 0.00 0.43 0.40 -0.07 -2.23 0.00 0.00 178.31 176.84 3gue h LEU 32 N 0.80 0.66 -0.14 0.59 3.38 -0.61 0.56 115.31 120.55 3gue h LEU 32 Ca 0.28 -0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.29 3gue h LEU 32 Cb 0.05 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.60 3gue h LEU 32 CO -0.12 0.46 -0.22 0.40 0.09 0.00 0.00 178.44 179.05 3gue h ILE 33 N 0.79 0.46 -0.62 1.22 1.08 -1.09 -1.19 117.51 118.16 3gue h ILE 33 Ca 0.25 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.72 3gue h ILE 33 Cb 0.01 0.46 -0.03 0.00 -3.07 0.00 0.00 36.82 34.19 3gue h ILE 33 CO -0.10 0.00 0.38 1.56 -0.69 0.00 0.00 178.15 179.30 3gue h GLN 34 N -0.27 0.83 -0.74 2.37 4.20 -0.78 -2.67 115.11 118.05 3gue h GLN 34 Ca 0.10 -0.07 0.08 0.00 0.06 0.00 0.00 58.65 58.82 3gue h GLN 34 Cb 0.42 -0.18 -0.07 0.00 0.30 0.00 0.00 27.48 27.96 3gue h GLN 34 CO -0.30 0.59 0.41 1.25 -0.67 0.00 0.00 178.83 180.11 3gue h HIS 35 N 0.83 0.75 -0.12 2.96 2.76 0.43 -1.33 115.15 121.43 3gue h HIS 35 Ca 0.22 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.45 3gue h HIS 35 Cb -0.04 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 28.66 3gue h HIS 35 CO -0.02 0.32 -0.09 0.00 -1.30 0.00 0.00 177.93 176.83 3gue h ALA 36 N 1.41 0.00 -0.10 5.26 0.00 -0.89 -0.44 119.26 124.50 3gue h ALA 36 Ca 0.35 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.35 3gue h ALA 36 Cb 0.29 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 3gue h ALA 36 CO -0.23 -0.55 -0.15 -0.07 0.00 0.00 0.00 179.25 178.26 3gue h LEU 37 N -0.10 -0.47 0.04 0.00 4.07 -1.22 -2.04 115.31 115.59 3gue h LEU 37 Ca 0.08 0.08 -0.00 0.00 0.08 0.00 0.00 57.88 58.12 3gue h LEU 37 Cb 0.22 0.22 0.00 0.00 1.08 0.00 0.00 40.66 42.18 3gue h LEU 37 CO -0.19 -0.20 -0.02 0.58 -1.08 0.00 0.00 178.44 177.53 3gue h VAL 38 N -0.20 1.05 -0.83 1.22 2.07 -1.04 -0.40 116.25 118.11 3gue h VAL 38 Ca 0.08 -0.30 0.10 0.00 0.82 0.00 0.00 66.70 67.41 3gue h VAL 38 Cb 0.32 1.25 -0.07 0.00 -1.52 0.00 0.00 31.29 31.26 3gue h VAL 38 CO -0.22 0.08 0.48 -0.09 0.02 0.00 0.00 177.57 177.83 3gue h ARG 39 N -0.19 0.77 0.00 1.57 2.43 -1.09 -1.84 114.38 116.04 3gue h ARG 39 Ca -0.01 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3gue h ARG 39 Cb 0.17 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3gue h ARG 39 CO 0.01 0.51 0.00 1.63 -1.51 0.00 0.00 179.97 180.61 3gue n LYS 40 N -4.74 0.12 0.00 0.20 5.02 -0.77 -4.89 118.16 113.10 3gue n LYS 40 Ca 0.14 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.52 3gue n LYS 40 Cb 0.28 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 3gue n LYS 40 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gue n GLY 41 N 0.85 0.30 3.68 0.72 0.00 -0.30 -5.06 105.19 105.37 3gue n GLY 41 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 3gue n GLY 41 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3gue s GLU 42 N 0.00 4.15 0.18 1.61 2.56 -0.40 -4.90 118.70 121.89 3gue s GLU 42 Ca 0.00 2.55 0.23 0.00 0.00 0.00 0.00 54.97 57.76 3gue s GLU 42 Cb 0.00 -3.82 0.21 0.00 2.00 0.00 0.00 34.13 32.52 3gue s GLU 42 CO 0.00 -0.87 1.24 1.79 -0.56 0.00 0.00 175.26 176.85 3gue h THR 43 N 5.09 0.00 -0.07 -1.70 1.35 -1.90 -3.39 112.91 112.28 3gue h THR 43 Ca -0.47 -0.73 -0.03 0.00 -0.55 0.00 0.00 66.41 64.63 3gue h THR 43 Cb 1.22 1.31 -0.01 0.00 -1.73 0.00 0.00 68.15 68.94 3gue h THR 43 CO 0.94 0.00 -0.03 0.61 -0.25 0.00 0.00 175.52 176.80 3gue n GLY 44 N 1.26 0.36 3.77 5.82 0.00 -1.26 -3.90 105.19 111.23 3gue n GLY 44 Ca 0.02 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 3gue n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gue s TYR 45 N -1.57 2.85 -0.55 1.61 2.02 -1.26 -4.65 117.35 115.81 3gue s TYR 45 Ca 0.00 1.55 0.01 0.00 -0.37 0.00 0.00 57.07 58.26 3gue s TYR 45 Cb 0.00 -3.32 0.14 0.00 -0.40 0.00 0.00 41.96 38.38 3gue s TYR 45 CO 0.00 -1.43 0.32 0.42 -1.57 0.00 0.00 175.55 173.29 3gue s ILE 46 N -1.64 3.08 0.50 2.71 1.01 0.33 -5.01 121.20 122.19 3gue s ILE 46 Ca 0.66 -3.05 -0.22 0.00 0.00 0.00 0.00 60.65 58.03 3gue s ILE 46 Cb -0.26 -3.08 -0.06 0.00 0.01 0.00 0.00 42.46 39.06 3gue s ILE 46 CO 0.31 -0.82 1.24 -2.16 0.00 0.00 0.00 174.94 173.52 3gue s PRO 47 N -0.06 3.48 0.43 2.79 0.04 -1.26 -4.71 135.00 135.72 3gue s PRO 47 Ca 0.16 1.95 0.24 0.00 0.04 0.00 0.00 61.00 63.40 3gue s PRO 47 Cb -0.23 -2.33 1.26 0.00 0.04 0.00 0.00 34.50 33.24 3gue s PRO 47 CO -0.02 -0.83 1.74 1.49 0.04 0.00 0.00 177.00 179.42 3gue h GLU 48 N 1.77 0.25 0.00 4.56 4.57 -1.94 -1.12 114.58 122.66 3gue h GLU 48 Ca -0.50 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 3gue h GLU 48 Cb 1.27 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 3gue h GLU 48 CO 0.59 0.16 0.00 1.63 -1.18 0.00 0.00 179.01 180.21 3gue n LYS 49 N -4.57 0.17 0.00 1.92 5.02 -1.26 -2.79 118.16 116.65 3gue n LYS 49 Ca 0.28 0.11 0.12 0.00 -2.02 0.00 0.00 58.31 56.80 3gue n LYS 49 Cb 1.08 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.65 3gue n LYS 49 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3gue n SER 50 N -1.38 2.39 -4.15 4.39 3.41 -0.43 -5.00 113.62 112.85 3gue n SER 50 Ca 0.08 -1.70 -0.13 0.00 -0.26 0.00 0.00 58.87 56.86 3gue n SER 50 Cb 0.20 0.27 -0.11 0.00 -0.26 0.00 0.00 64.21 64.31 3gue n SER 50 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3gue s ILE 51 N -2.28 0.79 0.00 -1.33 -4.36 -1.12 -4.69 121.20 108.21 3gue s ILE 51 Ca 0.23 -1.61 0.05 0.00 -0.26 0.00 0.00 60.65 59.06 3gue s ILE 51 Cb 0.19 -1.30 -0.03 0.00 1.25 0.00 0.00 42.46 42.57 3gue s ILE 51 CO 0.46 -0.61 -0.16 -0.44 0.24 0.00 0.00 174.94 174.43 3gue s SER 52 N -2.45 3.94 0.54 4.36 0.01 0.16 -4.94 113.70 115.33 3gue s SER 52 Ca 0.04 -0.31 -0.21 0.00 1.31 0.00 0.00 55.95 56.78 3gue s SER 52 Cb -0.02 -0.74 -0.05 0.00 0.21 0.00 0.00 66.02 65.42 3gue s SER 52 CO -0.01 0.29 1.28 -2.84 0.41 0.00 0.00 173.24 172.38 3gue s PRO 53 N -1.14 3.25 -0.28 12.44 0.02 -1.26 0.13 135.00 148.16 3gue s PRO 53 Ca 0.14 2.05 -0.24 0.00 0.02 0.00 0.00 61.00 62.97 3gue s PRO 53 Cb -0.11 -2.23 -0.00 0.00 0.02 0.00 0.00 34.50 32.18 3gue s PRO 53 CO 0.04 -1.05 0.80 0.08 -0.33 0.00 0.00 177.00 176.54 3gue s VAL 54 N -1.41 4.82 -0.55 3.83 1.01 -1.26 -4.68 120.40 122.15 3gue s VAL 54 Ca 0.71 1.35 0.23 0.00 0.00 0.00 0.00 61.98 64.27 3gue s VAL 54 Cb -0.36 -4.12 -0.07 0.00 0.00 0.00 0.00 36.38 31.83 3gue s VAL 54 CO 0.42 -0.16 1.08 -0.62 0.00 0.00 0.00 175.10 175.81 3gue n GLU 55 N 6.11 0.34 -3.51 2.72 4.71 -1.26 -4.69 120.64 125.05 3gue n GLU 55 Ca 0.04 0.02 -0.15 0.00 -0.01 0.00 0.00 57.16 57.07 3gue n GLU 55 Cb 0.48 -1.64 -0.05 0.00 -1.01 0.00 0.00 31.44 29.22 3gue n GLU 55 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3gue s SER 56 N -4.18 -0.58 0.09 1.62 1.04 -1.26 -5.15 113.70 105.28 3gue s SER 56 Ca 0.03 0.49 -0.10 0.00 0.48 0.00 0.00 55.95 56.86 3gue s SER 56 Cb 0.14 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.76 3gue s SER 56 CO 0.78 -0.64 0.22 -0.76 0.98 0.00 0.00 173.24 173.83 3gue s LEU 57 N -1.55 1.27 0.70 2.42 1.43 -1.26 -5.15 118.68 116.54 3gue s LEU 57 Ca -0.06 -0.59 -0.14 0.00 -1.03 0.00 0.00 54.13 52.30 3gue s LEU 57 Cb -0.00 1.15 0.02 0.00 0.03 0.00 0.00 46.19 47.39 3gue s LEU 57 CO 0.03 -0.74 1.13 -2.16 0.23 0.00 0.00 176.35 174.84 3gue s PRO 58 N -3.81 2.48 0.03 1.29 0.04 -1.26 -4.86 135.00 128.90 3gue s PRO 58 Ca 0.04 1.46 0.03 0.00 0.04 0.00 0.00 61.00 62.57 3gue s PRO 58 Cb 0.04 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 3gue s PRO 58 CO -0.11 -1.51 -0.01 -0.06 0.04 0.00 0.00 177.00 175.35 3gue s PHE 59 N -2.34 3.03 1.06 0.56 0.08 -1.26 -1.27 117.98 117.84 3gue s PHE 59 Ca 0.68 0.03 -0.14 0.00 0.12 0.00 0.00 56.93 57.62 3gue s PHE 59 Cb -0.22 -1.62 0.13 0.00 -0.57 0.00 0.00 43.02 40.74 3gue s PHE 59 CO 0.45 0.46 0.50 -0.11 -0.10 0.00 0.00 175.22 176.41 3gue n LEU 60 N 1.16 -0.76 0.00 -0.37 7.94 0.43 -4.88 117.00 120.51 3gue n LEU 60 Ca -0.13 0.07 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 3gue n LEU 60 Cb 0.52 -1.17 0.00 0.00 0.53 0.00 0.00 43.42 43.31 3gue n LEU 60 CO 0.35 -3.16 0.00 0.00 -1.11 0.00 0.00 177.39 173.47 3gue n ALA 71 N -4.30 0.00 0.02 1.96 0.00 -1.26 -5.02 120.51 111.91 3gue n ALA 71 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.33 3gue n ALA 71 Cb 0.57 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.96 3gue n ALA 71 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3gue h LEU 72 N 0.00 0.77 -2.03 0.00 5.85 -2.01 -3.10 115.31 114.79 3gue h LEU 72 Ca 0.00 -0.55 0.09 0.00 0.84 0.00 0.00 57.88 58.26 3gue h LEU 72 Cb 0.00 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 3gue h LEU 72 CO 0.00 1.34 0.24 0.17 -0.34 0.00 0.00 178.44 179.85 3gue h LEU 73 N 0.40 0.00 0.00 2.25 8.10 -1.97 -0.93 115.31 123.16 3gue h LEU 73 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.92 3gue h LEU 73 Cb 1.49 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.71 3gue h LEU 73 CO 0.17 0.00 0.00 0.54 -4.11 0.00 0.00 178.44 175.04 3gue n ARG 74 N -4.35 0.12 -0.01 0.17 1.74 -1.17 -1.97 116.66 111.21 3gue n ARG 74 Ca 0.05 0.21 0.06 0.00 -0.77 0.00 0.00 57.85 57.40 3gue n ARG 74 Cb 0.41 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.40 3gue n ARG 74 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3gue n GLN 75 N -1.34 0.82 -3.12 5.56 6.02 -0.35 -4.82 117.38 120.14 3gue n GLN 75 Ca 0.05 -1.28 -0.39 0.00 -0.01 0.00 0.00 57.00 55.37 3gue n GLN 75 Cb 0.11 -1.25 -0.06 0.00 1.02 0.00 0.00 30.24 30.06 3gue n GLN 75 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3gue s ALA 76 N -1.06 3.50 0.01 -1.58 0.00 -0.83 -1.46 121.76 120.34 3gue s ALA 76 Ca 0.15 0.19 0.06 0.00 0.00 0.00 0.00 51.96 52.35 3gue s ALA 76 Cb 0.11 -2.81 -0.03 0.00 0.00 0.00 0.00 23.12 20.38 3gue s ALA 76 CO 0.16 0.29 -0.15 0.08 0.00 0.00 0.00 175.76 176.13 3gue s VAL 77 N -0.87 3.00 -0.17 0.00 1.01 0.16 -4.30 120.40 119.23 3gue s VAL 77 Ca 0.33 -1.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 3gue s VAL 77 Cb -0.21 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 3gue s VAL 77 CO 0.22 0.41 0.05 -0.69 0.00 0.00 0.00 175.10 175.09 3gue s VAL 78 N -0.89 4.68 -0.05 2.92 1.01 0.24 -0.88 120.40 127.44 3gue s VAL 78 Ca 0.14 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.07 3gue s VAL 78 Cb -0.11 -3.09 0.01 0.00 0.00 0.00 0.00 36.38 33.20 3gue s VAL 78 CO 0.04 0.49 -0.11 -0.22 0.00 0.00 0.00 175.10 175.31 3gue s LEU 79 N 0.17 1.63 -0.18 3.92 0.20 -0.58 -0.88 118.68 122.97 3gue s LEU 79 Ca 0.04 -0.25 -0.06 0.00 0.69 0.00 0.00 54.13 54.55 3gue s LEU 79 Cb -0.12 -0.71 -0.03 0.00 -0.43 0.00 0.00 46.19 44.89 3gue s LEU 79 CO 0.01 0.03 0.02 -0.54 -0.29 0.00 0.00 176.35 175.58 3gue s LYS 80 N 0.57 3.80 0.32 1.98 -0.14 -0.46 -2.24 119.74 123.57 3gue s LYS 80 Ca -0.11 -0.44 -0.29 0.00 -1.36 0.00 0.00 55.97 53.77 3gue s LYS 80 Cb -0.14 -3.10 -0.10 0.00 -1.68 0.00 0.00 37.83 32.81 3gue s LYS 80 CO 0.02 0.19 1.34 -0.51 -0.76 0.00 0.00 175.35 175.64 3gue s LEU 81 N 0.54 4.41 0.00 3.17 1.43 0.24 -1.65 118.68 126.83 3gue s LEU 81 Ca 0.00 2.71 0.01 0.00 -1.03 0.00 0.00 54.13 55.82 3gue s LEU 81 Cb -0.14 -3.65 0.01 0.00 0.03 0.00 0.00 46.19 42.45 3gue s LEU 81 CO 0.02 -0.59 0.72 -3.20 0.23 0.00 0.00 176.35 173.53 3gue n ASN 82 N 1.03 -0.32 -0.14 2.29 5.15 -0.37 -1.62 115.26 121.28 3gue n ASN 82 Ca 0.01 -1.43 0.04 0.00 -0.60 0.00 0.00 54.58 52.60 3gue n ASN 82 Cb 0.41 0.09 -0.01 0.00 -0.53 0.00 0.00 39.78 39.74 3gue n ASN 82 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gue n GLY 83 N 0.02 -0.08 3.76 8.20 0.00 -0.64 -4.43 105.19 112.02 3gue n GLY 83 Ca -0.10 -0.23 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 3gue n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gue s GLY 84 N -1.32 2.91 0.25 -0.02 0.00 -1.26 -4.40 107.32 103.48 3gue s GLY 84 Ca 0.06 1.41 0.25 0.00 0.00 0.00 0.00 44.72 46.45 3gue s GLY 84 CO 0.23 2.00 1.75 1.41 0.00 0.00 0.00 173.10 178.49 3gue h LEU 85 N 2.08 0.00 -1.07 0.66 3.38 -1.96 -3.43 115.31 114.97 3gue h LEU 85 Ca -0.51 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.05 3gue h LEU 85 Cb 1.27 0.00 0.09 0.00 0.09 0.00 0.00 40.66 42.12 3gue h LEU 85 CO 0.60 0.00 -0.72 0.61 0.09 0.00 0.00 178.44 179.01 3gue n GLY 86 N 0.80 -0.49 0.19 0.83 0.00 -1.26 -4.34 105.19 100.92 3gue n GLY 86 Ca 0.04 0.21 0.13 0.00 0.00 0.00 0.00 46.02 46.40 3gue n GLY 86 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3gue h THR 87 N -2.37 0.00 0.00 2.61 1.35 -1.92 -2.11 112.91 110.46 3gue h THR 87 Ca -0.58 -0.80 -0.04 0.00 -0.55 0.00 0.00 66.41 64.44 3gue h THR 87 Cb 1.37 1.79 -0.01 0.00 -1.73 0.00 0.00 68.15 69.57 3gue h THR 87 CO 0.58 0.00 -0.18 1.23 -0.25 0.00 0.00 175.52 176.90 3gue h GLY 88 N 3.93 0.00 -2.24 5.82 0.00 -1.90 -1.72 103.07 106.96 3gue h GLY 88 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3gue h GLY 88 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.57 3gue n MET 89 N -3.45 2.47 -3.94 4.80 2.81 -1.03 -4.54 117.12 114.23 3gue n MET 89 Ca -0.01 -2.24 -0.32 0.00 -1.81 0.00 0.00 57.70 53.33 3gue n MET 89 Cb 0.36 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.37 3gue n MET 89 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gue n GLY 90 N 1.46 -0.56 3.79 3.03 0.00 -0.65 -0.51 105.19 111.75 3gue n GLY 90 Ca 0.18 0.28 -0.38 0.00 0.00 0.00 0.00 46.02 46.10 3gue n GLY 90 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gue s LEU 91 N -6.97 4.49 -0.71 0.99 1.43 -0.82 -4.57 118.68 112.52 3gue s LEU 91 Ca 0.24 1.61 -0.02 0.00 -1.03 0.00 0.00 54.13 54.93 3gue s LEU 91 Cb -0.10 -3.47 0.38 0.00 0.03 0.00 0.00 46.19 43.03 3gue s LEU 91 CO 0.91 0.12 2.07 -0.46 0.23 0.00 0.00 176.35 179.22 3gue n ASN 92 N 1.21 7.53 0.00 2.29 0.23 -1.26 -4.81 115.26 120.45 3gue n ASN 92 Ca -0.04 -3.74 0.00 0.00 -0.53 0.00 0.00 54.58 50.27 3gue n ASN 92 Cb 0.49 -1.03 0.00 0.00 -2.08 0.00 0.00 39.78 37.17 3gue n ASN 92 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3gue n GLY 93 N -0.63 0.25 3.71 4.83 0.00 -1.26 -5.13 105.19 106.95 3gue n GLY 93 Ca 0.57 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 3gue n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gue s PRO 94 N -2.00 4.35 0.34 1.61 0.04 -1.26 -4.66 135.00 133.42 3gue s PRO 94 Ca 0.00 2.00 0.02 0.00 0.04 0.00 0.00 61.00 63.06 3gue s PRO 94 Cb 0.00 -3.27 0.61 0.00 0.04 0.00 0.00 34.50 31.88 3gue s PRO 94 CO 0.00 -0.39 1.97 -0.22 0.04 0.00 0.00 177.00 178.39 3gue h LYS 95 N 6.80 0.77 0.00 4.56 3.64 -1.93 -2.63 116.57 127.78 3gue h LYS 95 Ca -0.42 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3gue h LYS 95 Cb 1.21 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 3gue h LYS 95 CO 0.85 0.57 0.24 0.66 -2.27 0.00 0.00 179.45 179.50 3gue h SER 96 N 0.78 0.00 -0.14 4.20 4.64 -1.91 0.12 113.55 121.24 3gue h SER 96 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3gue h SER 96 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3gue h SER 96 CO -0.03 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.11 3gue n LEU 97 N -2.56 2.18 -4.77 5.97 4.77 -0.99 -1.15 117.00 120.45 3gue n LEU 97 Ca -0.02 -0.84 -0.37 0.00 -0.03 0.00 0.00 56.01 54.75 3gue n LEU 97 Cb 0.28 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 3gue n LEU 97 CO 0.11 0.42 0.78 -0.76 -1.33 0.00 0.00 177.39 176.61 3gue s LEU 98 N -1.75 4.17 0.13 2.23 1.43 0.43 -4.89 118.68 120.43 3gue s LEU 98 Ca 0.34 2.17 -0.30 0.00 -1.03 0.00 0.00 54.13 55.32 3gue s LEU 98 Cb 0.20 -4.11 -0.07 0.00 0.03 0.00 0.00 46.19 42.24 3gue s LEU 98 CO 0.30 -0.58 1.10 -1.10 0.23 0.00 0.00 176.35 176.31 3gue s GLN 99 N -2.39 4.56 -0.15 1.70 -0.21 -1.26 -2.60 119.66 119.31 3gue s GLN 99 Ca 0.57 1.69 -0.10 0.00 0.02 0.00 0.00 55.36 57.54 3gue s GLN 99 Cb -0.26 -3.31 -0.06 0.00 1.00 0.00 0.00 33.01 30.37 3gue s GLN 99 CO 0.32 0.00 -0.23 0.28 -2.12 0.00 0.00 175.29 173.54 3gue n VAL 100 N 2.85 1.15 -4.65 1.09 0.31 0.98 -4.93 118.33 115.13 3gue n VAL 100 Ca 0.04 -0.08 -0.26 0.00 -0.01 0.00 0.00 64.34 64.04 3gue n VAL 100 Cb 0.47 -1.87 -0.17 0.00 -0.91 0.00 0.00 33.84 31.36 3gue n VAL 100 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3gue s LYS 101 N -2.43 1.88 -0.12 5.55 -0.14 -1.09 -3.93 119.74 119.47 3gue s LYS 101 Ca -0.23 -0.47 -0.15 0.00 -1.36 0.00 0.00 55.97 53.76 3gue s LYS 101 Cb 0.07 -1.53 -0.07 0.00 -1.68 0.00 0.00 37.83 34.62 3gue s LYS 101 CO 0.31 0.04 0.47 0.27 -0.76 0.00 0.00 175.35 175.68 3gue n ASN 102 N 3.81 0.28 0.00 2.83 2.04 -1.26 0.66 115.26 123.61 3gue n ASN 102 Ca -0.22 0.39 0.00 0.00 -0.44 0.00 0.00 54.58 54.31 3gue n ASN 102 Cb 0.52 -0.29 0.00 0.00 -2.53 0.00 0.00 39.78 37.48 3gue n ASN 102 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3gue n GLY 103 N 1.07 2.29 3.04 4.83 0.00 -1.26 -5.00 105.19 110.16 3gue n GLY 103 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 3gue n GLY 103 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gue s GLN 104 N -0.24 2.39 0.73 1.61 -0.21 0.21 -5.07 119.66 119.08 3gue s GLN 104 Ca 0.00 -0.71 -0.09 0.00 0.02 0.00 0.00 55.36 54.58 3gue s GLN 104 Cb 0.00 -2.31 0.06 0.00 1.00 0.00 0.00 33.01 31.76 3gue s GLN 104 CO 0.00 -0.29 1.06 0.95 -2.12 0.00 0.00 175.29 174.90 3gue s THR 105 N 1.41 2.42 0.25 -0.19 -4.23 -1.26 -0.01 115.64 114.02 3gue s THR 105 Ca 0.03 -0.09 -0.04 0.00 -1.18 0.00 0.00 61.69 60.41 3gue s THR 105 Cb -0.14 -3.08 0.22 0.00 1.34 0.00 0.00 72.50 70.84 3gue s THR 105 CO -0.10 -0.10 1.82 -0.26 -0.54 0.00 0.00 174.62 175.44 3gue h PHE 106 N -0.71 0.91 0.00 3.99 0.04 -1.17 -2.06 116.94 117.94 3gue h PHE 106 Ca -0.45 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.26 3gue h PHE 106 Cb 1.31 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 39.16 3gue h PHE 106 CO 0.35 0.39 -0.44 1.25 -0.60 0.00 0.00 178.31 179.26 3gue h LEU 107 N 0.85 0.00 -0.05 1.54 5.85 -1.44 -0.54 115.31 121.51 3gue h LEU 107 Ca 0.40 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.12 3gue h LEU 107 Cb 0.34 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 3gue h LEU 107 CO -0.24 0.44 0.02 0.44 -0.34 0.00 0.00 178.44 178.77 3gue h ASP 108 N 0.00 0.06 -0.67 1.25 3.32 -1.68 -1.72 116.42 116.99 3gue h ASP 108 Ca -0.00 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 56.84 3gue h ASP 108 Cb 0.90 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.41 3gue h ASP 108 CO 0.06 0.17 0.12 -0.26 -1.72 0.00 0.00 179.24 177.61 3gue h PHE 109 N -0.05 1.17 0.02 4.55 0.04 -1.10 -0.27 116.94 121.30 3gue h PHE 109 Ca 0.02 -0.15 0.03 0.00 2.80 0.00 0.00 57.97 60.66 3gue h PHE 109 Cb 0.13 -0.32 -0.04 0.00 2.20 0.00 0.00 35.95 37.91 3gue h PHE 109 CO -0.03 0.97 -0.22 1.15 -0.60 0.00 0.00 178.31 179.57 3gue h THR 110 N 1.03 0.48 -0.95 -1.55 2.02 -1.10 0.11 112.91 112.96 3gue h THR 110 Ca 0.21 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.46 3gue h THR 110 Cb 0.42 0.48 -0.07 0.00 -1.74 0.00 0.00 68.15 67.25 3gue h THR 110 CO 0.01 0.00 0.62 0.00 0.37 0.00 0.00 175.52 176.52 3gue h ALA 111 N 0.49 1.49 -0.35 6.16 0.00 -1.09 -2.37 119.26 123.59 3gue h ALA 111 Ca 0.05 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 3gue h ALA 111 Cb 0.43 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3gue h ALA 111 CO -0.19 0.35 -0.40 -0.07 0.00 0.00 0.00 179.25 178.94 3gue h LEU 112 N 1.06 0.96 -0.94 0.00 4.07 -0.43 -1.10 115.31 118.93 3gue h LEU 112 Ca 0.42 -0.48 0.07 0.00 0.08 0.00 0.00 57.88 57.97 3gue h LEU 112 Cb 0.25 -0.27 -0.07 0.00 1.08 0.00 0.00 40.66 41.65 3gue h LEU 112 CO -0.17 1.25 0.60 1.56 -1.08 0.00 0.00 178.44 180.59 3gue h GLN 113 N 0.69 1.04 -0.24 1.13 4.20 -0.65 -0.66 115.11 120.62 3gue h GLN 113 Ca 0.05 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 3gue h GLN 113 Cb 1.00 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 3gue h GLN 113 CO 0.10 0.69 0.12 1.25 -0.67 0.00 0.00 178.83 180.31 3gue h LEU 114 N 1.07 0.31 -1.69 1.46 5.85 -1.11 0.07 115.31 121.27 3gue h LEU 114 Ca 0.42 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.98 3gue h LEU 114 Cb 0.21 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 3gue h LEU 114 CO -0.19 0.34 -0.18 -0.33 -0.34 0.00 0.00 178.44 177.75 3gue h GLU 115 N 0.26 0.00 0.13 1.25 5.08 -0.92 -1.22 114.58 119.16 3gue h GLU 115 Ca 0.08 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.20 3gue h GLU 115 Cb 0.11 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.39 3gue h GLU 115 CO -0.01 0.18 -1.04 1.25 -1.00 0.00 0.00 179.01 178.39 3gue h HIS 116 N 0.00 0.81 0.69 4.33 2.76 -0.82 -3.24 115.15 119.68 3gue h HIS 116 Ca -0.00 -0.53 -0.03 0.00 -2.20 0.00 0.00 60.37 57.60 3gue h HIS 116 Cb 0.42 -0.06 0.01 0.00 1.55 0.00 0.00 27.41 29.33 3gue h HIS 116 CO 0.00 1.39 -0.33 0.35 -1.30 0.00 0.00 177.93 178.03 3gue h PHE 117 N 0.00 -0.86 -0.98 5.26 3.57 -0.82 -1.81 116.94 121.30 3gue h PHE 117 Ca -0.17 -0.02 0.34 0.00 3.53 0.00 0.00 57.97 61.66 3gue h PHE 117 Cb 1.77 0.29 -0.17 0.00 2.79 0.00 0.00 35.95 40.62 3gue h PHE 117 CO 0.15 -0.51 0.39 0.00 -2.23 0.00 0.00 178.31 176.10 3gue h ARG 118 N -1.05 0.09 0.02 1.11 3.08 -1.38 0.16 114.38 116.41 3gue h ARG 118 Ca -0.10 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 3gue h ARG 118 Cb 0.74 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.77 3gue h ARG 118 CO 0.16 0.06 -0.01 -0.56 -1.07 0.00 0.00 179.97 178.54 3gue h GLN 119 N 0.09 -0.03 0.48 0.04 -0.00 -1.57 -3.04 115.11 111.09 3gue h GLN 119 Ca 0.73 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 59.36 3gue h GLN 119 Cb 1.76 0.01 0.00 0.00 -0.00 0.00 0.00 27.48 29.25 3gue h GLN 119 CO -0.76 0.70 -0.23 0.28 -0.00 0.00 0.00 178.83 178.81 3gue h VAL 120 N -0.93 0.19 0.00 1.86 2.07 -0.59 -3.25 116.25 115.59 3gue h VAL 120 Ca -0.00 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3gue h VAL 120 Cb 0.73 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 3gue h VAL 120 CO 0.00 0.04 -0.02 0.03 0.02 0.00 0.00 177.57 177.64 3gue h ARG 121 N -1.10 0.00 0.00 1.57 3.08 -0.93 -3.51 114.38 113.50 3gue h ARG 121 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3gue h ARG 121 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 3gue h ARG 121 CO 0.11 0.02 0.00 0.09 -1.07 0.00 0.00 179.97 179.12 3gue n ASN 122 N -3.15 0.00 0.00 7.04 3.02 -1.15 -5.06 115.26 115.97 3gue n ASN 122 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 3gue n ASN 122 Cb 0.26 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 3gue n ASN 122 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3gue n VAL 125 N 0.00 0.00 -1.52 2.41 0.31 -1.26 -4.96 118.33 113.31 3gue n VAL 125 Ca 0.00 0.00 -0.48 0.00 -0.01 0.00 0.00 64.34 63.85 3gue n VAL 125 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 3gue n VAL 125 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3gue n PRO 126 N 0.00 0.73 -4.42 5.55 -0.02 -1.26 -4.84 135.00 130.74 3gue n PRO 126 Ca 0.00 0.26 -0.21 0.00 -2.02 0.00 0.00 63.50 61.53 3gue n PRO 126 Cb 0.00 -1.55 -0.16 0.00 -0.02 0.00 0.00 33.50 31.77 3gue n PRO 126 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3gue s PHE 127 N -0.70 1.03 0.09 6.00 5.36 -1.26 -0.59 117.98 127.92 3gue s PHE 127 Ca 0.67 -0.28 0.04 0.00 -0.96 0.00 0.00 56.93 56.41 3gue s PHE 127 Cb -0.87 -0.75 -0.03 0.00 -0.34 0.00 0.00 43.02 41.03 3gue s PHE 127 CO 0.56 -0.13 -0.11 -1.64 -1.46 0.00 0.00 175.22 172.44 3gue s MET 128 N 0.28 0.84 -0.13 10.12 -1.94 -0.06 -4.18 119.30 124.24 3gue s MET 128 Ca -0.05 -1.11 0.02 0.00 -1.71 0.00 0.00 55.69 52.84 3gue s MET 128 Cb -0.10 -0.60 0.01 0.00 2.01 0.00 0.00 34.83 36.16 3gue s MET 128 CO 0.01 0.10 -0.17 -0.51 -0.01 0.00 0.00 175.02 174.44 3gue s LEU 129 N -2.28 1.83 -0.47 -0.03 1.43 -0.42 -1.35 118.68 117.39 3gue s LEU 129 Ca 0.03 -0.49 -0.23 0.00 -1.03 0.00 0.00 54.13 52.42 3gue s LEU 129 Cb -0.05 -1.21 0.03 0.00 0.03 0.00 0.00 46.19 44.99 3gue s LEU 129 CO 0.01 0.02 0.78 -0.32 0.23 0.00 0.00 176.35 177.07 3gue s MET 130 N 1.03 3.34 0.31 1.70 -2.45 -0.66 -0.06 119.30 122.52 3gue s MET 130 Ca -0.04 -0.26 0.08 0.00 -1.25 0.00 0.00 55.69 54.22 3gue s MET 130 Cb -0.15 -3.98 -0.04 0.00 1.25 0.00 0.00 34.83 31.92 3gue s MET 130 CO -0.04 -1.19 0.14 -0.80 1.05 0.00 0.00 175.02 174.19 3gue s ASN 131 N 2.31 4.88 0.38 1.11 0.01 -0.27 -1.23 114.94 122.13 3gue s ASN 131 Ca 0.27 -0.62 0.04 0.00 -0.71 0.00 0.00 52.86 51.85 3gue s ASN 131 Cb -0.13 -0.90 -0.05 0.00 0.41 0.00 0.00 41.25 40.58 3gue s ASN 131 CO 0.20 -0.20 0.05 -0.94 -1.51 0.00 0.00 177.10 174.71 3gue s SER 132 N -3.83 2.97 0.61 -1.22 1.04 -1.26 -1.17 113.70 110.83 3gue s SER 132 Ca 0.36 -1.47 0.27 0.00 0.48 0.00 0.00 55.95 55.60 3gue s SER 132 Cb -0.05 0.04 1.33 0.00 0.10 0.00 0.00 66.02 67.44 3gue s SER 132 CO 0.23 -0.67 1.75 2.19 0.98 0.00 0.00 173.24 177.72 3gue h PHE 133 N 1.89 0.00 0.00 5.02 -5.15 -1.89 0.11 116.94 116.92 3gue h PHE 133 Ca -0.41 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.20 3gue h PHE 133 Cb 1.26 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 37.40 3gue h PHE 133 CO 0.89 0.00 -1.04 1.03 -2.00 0.00 0.00 178.31 177.19 3gue h SER 134 N 0.00 0.00 0.00 -0.68 0.87 -1.95 -3.40 113.55 108.39 3gue h SER 134 Ca 0.23 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 3gue h SER 134 Cb 1.49 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.45 3gue h SER 134 CO -0.00 0.64 -0.40 0.35 -0.53 0.00 0.00 176.83 176.89 3gue n THR 135 N -3.09 0.00 0.07 2.23 -2.24 -0.18 -4.48 114.28 106.60 3gue n THR 135 Ca -0.05 -0.18 -0.13 0.00 -2.27 0.00 0.00 64.05 61.43 3gue n THR 135 Cb 0.83 0.67 -0.07 0.00 -2.10 0.00 0.00 70.33 69.66 3gue n THR 135 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3gue h SER 136 N 0.00 -0.09 0.33 3.42 0.87 -1.09 -2.20 113.55 114.78 3gue h SER 136 Ca 0.00 -0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 3gue h SER 136 Cb 0.00 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 3gue h SER 136 CO 0.00 -0.02 -0.16 1.23 -0.53 0.00 0.00 176.83 177.35 3gue h GLY 137 N -0.15 -0.46 0.85 5.77 0.00 -1.85 0.97 103.07 108.19 3gue h GLY 137 Ca -0.01 0.17 0.04 0.00 0.00 0.00 0.00 47.33 47.53 3gue h GLY 137 CO 0.02 -0.17 0.61 0.83 0.00 0.00 0.00 176.54 177.83 3gue h GLU 138 N -0.49 1.13 -0.17 4.80 3.07 -1.89 -1.09 114.58 119.94 3gue h GLU 138 Ca -0.04 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.72 3gue h GLU 138 Cb 0.37 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 3gue h GLU 138 CO 0.07 0.75 -0.02 1.15 -1.40 0.00 0.00 179.01 179.56 3gue h THR 139 N 1.16 1.27 -0.49 1.13 2.02 -1.10 -1.13 112.91 115.77 3gue h THR 139 Ca 0.38 -0.92 0.08 0.00 0.77 0.00 0.00 66.41 66.72 3gue h THR 139 Cb 0.04 1.54 -0.06 0.00 -1.74 0.00 0.00 68.15 67.93 3gue h THR 139 CO -0.13 0.27 0.13 0.50 0.37 0.00 0.00 175.52 176.66 3gue h LYS 140 N 0.03 0.27 -0.17 6.66 3.64 -0.56 -2.31 116.57 124.12 3gue h LYS 140 Ca 0.04 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 3gue h LYS 140 Cb 0.42 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 3gue h LYS 140 CO 0.01 0.18 -0.48 -0.97 -2.27 0.00 0.00 179.45 175.92 3gue h ASN 141 N 0.28 0.47 -0.81 4.20 -1.24 -1.05 -2.70 115.58 114.73 3gue h ASN 141 Ca 0.24 -0.23 -0.01 0.00 0.71 0.00 0.00 56.30 57.02 3gue h ASN 141 Cb 0.30 -0.13 -0.04 0.00 0.73 0.00 0.00 38.32 39.18 3gue h ASN 141 CO -0.29 0.88 0.47 0.15 -1.29 0.00 0.00 177.43 177.34 3gue h PHE 142 N 0.35 1.08 0.00 0.67 3.57 -0.88 -2.86 116.94 118.87 3gue h PHE 142 Ca 0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 3gue h PHE 142 Cb 0.97 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.36 3gue h PHE 142 CO 0.03 0.74 0.00 1.28 -2.23 0.00 0.00 178.31 178.13 3gue n LEU 143 N -4.44 0.00 -0.26 0.59 4.77 -0.90 -2.70 117.00 114.06 3gue n LEU 143 Ca 0.08 0.13 0.15 0.00 -0.03 0.00 0.00 56.01 56.34 3gue n LEU 143 Cb 0.07 -0.13 0.43 0.00 -2.33 0.00 0.00 43.42 41.46 3gue n LEU 143 CO 0.38 -0.03 1.22 0.03 -1.33 0.00 0.00 177.39 177.65 3gue h ARG 144 N 0.00 0.56 -0.05 3.23 3.08 -1.47 0.59 114.38 120.32 3gue h ARG 144 Ca 0.00 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.03 3gue h ARG 144 Cb 0.10 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 3gue h ARG 144 CO 0.00 0.37 0.08 -0.22 -1.07 0.00 0.00 179.97 179.13 3gue h LYS 145 N 0.57 0.00 -3.29 0.04 3.64 -1.74 -3.32 116.57 112.47 3gue h LYS 145 Ca 0.47 0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 59.18 3gue h LYS 145 Cb 0.93 0.00 -0.38 0.00 -0.41 0.00 0.00 32.23 32.37 3gue h LYS 145 CO -0.21 0.00 -0.32 0.71 -2.27 0.00 0.00 179.45 177.36 3gue s TYR 146 N -4.43 3.68 0.33 1.91 2.02 0.20 -4.99 117.35 116.07 3gue s TYR 146 Ca -0.05 -3.09 0.10 0.00 -0.37 0.00 0.00 57.07 53.66 3gue s TYR 146 Cb 0.14 -3.05 0.88 0.00 -0.40 0.00 0.00 41.96 39.54 3gue s TYR 146 CO 0.48 -0.69 1.74 -1.35 -1.57 0.00 0.00 175.55 174.16 3gue h PRO 147 N 6.00 0.58 0.00 -1.71 0.11 -1.74 -0.74 132.00 134.49 3gue h PRO 147 Ca 0.11 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.11 3gue h PRO 147 Cb 0.82 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 3gue h PRO 147 CO 0.78 0.38 -0.38 1.79 -0.21 0.00 0.00 178.00 180.37 3gue h THR 148 N 0.60 1.23 0.09 -1.15 1.35 -1.94 -0.51 112.91 112.59 3gue h THR 148 Ca 0.63 -1.31 -0.21 0.00 -0.55 0.00 0.00 66.41 64.96 3gue h THR 148 Cb 1.19 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 3gue h THR 148 CO -0.43 0.37 -1.05 -0.07 -0.25 0.00 0.00 175.52 174.09 3gue h LEU 149 N 0.00 0.31 -1.16 3.87 3.38 -1.54 -3.36 115.31 116.81 3gue h LEU 149 Ca -0.00 -0.86 0.08 0.00 0.09 0.00 0.00 57.88 57.19 3gue h LEU 149 Cb 0.68 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.27 3gue h LEU 149 CO 0.05 1.46 0.59 0.22 0.09 0.00 0.00 178.44 180.85 3gue h TYR 150 N -0.49 1.02 -0.32 1.13 3.20 -1.03 -1.46 116.97 119.01 3gue h TYR 150 Ca -0.23 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.69 3gue h TYR 150 Cb 1.58 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 39.50 3gue h TYR 150 CO 0.16 0.50 0.22 1.49 -1.64 0.00 0.00 178.16 178.89 3gue h GLU 151 N 0.98 0.37 -0.09 1.82 4.81 -1.24 -2.76 114.58 118.47 3gue h GLU 151 Ca 0.40 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.58 3gue h GLU 151 Cb 0.29 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3gue h GLU 151 CO -0.16 0.24 -0.22 1.33 -0.73 0.00 0.00 179.01 179.47 3gue n VAL 152 N -4.49 2.18 0.22 0.32 0.24 -0.72 -4.81 118.33 111.28 3gue n VAL 152 Ca 0.02 -2.73 -0.10 0.00 -2.04 0.00 0.00 64.34 59.50 3gue n VAL 152 Cb 0.11 -0.26 -0.05 0.00 -1.47 0.00 0.00 33.84 32.18 3gue n VAL 152 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 3gue h PHE 153 N 0.77 -0.58 -0.81 6.34 3.57 -0.99 -1.04 116.94 124.20 3gue h PHE 153 Ca 0.04 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.57 3gue h PHE 153 Cb 1.16 0.19 -0.05 0.00 2.79 0.00 0.00 35.95 40.04 3gue h PHE 153 CO 0.55 -0.36 0.51 -0.44 -2.23 0.00 0.00 178.31 176.34 3gue h ASP 154 N -1.17 0.81 0.65 0.41 5.19 -1.87 -0.02 116.42 120.42 3gue h ASP 154 Ca -0.06 0.01 -0.27 0.00 -0.62 0.00 0.00 57.03 56.08 3gue h ASP 154 Cb 0.48 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 3gue h ASP 154 CO 0.10 0.54 -1.32 0.77 -3.12 0.00 0.00 179.24 176.21 3gue h SER 155 N 0.95 0.27 0.00 6.45 4.64 -1.88 -3.43 113.55 120.55 3gue h SER 155 Ca 0.34 -0.33 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3gue h SER 155 Cb 0.10 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3gue h SER 155 CO -0.15 1.27 -0.45 0.47 -0.87 0.00 0.00 176.83 177.10 3gue n ASP 156 N -3.42 0.15 0.24 4.97 8.00 -0.49 -4.94 116.55 121.07 3gue n ASP 156 Ca -0.10 0.07 -0.12 0.00 0.71 0.00 0.00 54.79 55.35 3gue n ASP 156 Cb 1.01 -0.01 -0.06 0.00 -0.02 0.00 0.00 41.12 42.04 3gue n ASP 156 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3gue h ILE 157 N 0.00 0.17 -2.50 0.53 2.04 -1.09 -3.45 117.51 113.22 3gue h ILE 157 Ca 0.00 -0.51 -0.53 0.00 1.00 0.00 0.00 64.86 64.82 3gue h ILE 157 Cb 0.45 0.26 0.04 0.00 -0.74 0.00 0.00 36.82 36.84 3gue h ILE 157 CO 0.00 0.03 1.11 1.21 0.00 0.00 0.00 178.15 180.50 3gue n GLU 158 N -5.23 2.79 -3.80 2.37 2.13 -0.04 -1.30 120.64 117.56 3gue n GLU 158 Ca -0.09 1.02 -0.35 0.00 0.66 0.00 0.00 57.16 58.39 3gue n GLU 158 Cb 0.29 -2.91 -0.12 0.00 0.27 0.00 0.00 31.44 28.98 3gue n GLU 158 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 3gue s LEU 159 N 2.67 5.11 -0.12 4.31 2.96 0.91 -4.90 118.68 129.63 3gue s LEU 159 Ca 0.82 -2.40 -0.29 0.00 -0.22 0.00 0.00 54.13 52.04 3gue s LEU 159 Cb -0.48 -1.80 -0.02 0.00 0.50 0.00 0.00 46.19 44.39 3gue s LEU 159 CO 0.37 -0.44 1.28 -0.32 -1.32 0.00 0.00 176.35 175.92 3gue s MET 160 N 0.60 4.26 0.79 1.98 -2.45 -1.26 -1.11 119.30 122.11 3gue s MET 160 Ca 0.12 1.71 -0.04 0.00 -1.25 0.00 0.00 55.69 56.23 3gue s MET 160 Cb -0.22 -3.72 0.15 0.00 1.25 0.00 0.00 34.83 32.30 3gue s MET 160 CO -0.04 -0.65 1.08 1.14 1.05 0.00 0.00 175.02 177.61 3gue s GLN 161 N 3.16 1.35 0.95 4.11 -2.07 -0.32 -4.95 119.66 121.89 3gue s GLN 161 Ca 0.56 -1.02 -0.14 0.00 -1.82 0.00 0.00 55.36 52.95 3gue s GLN 161 Cb -0.24 -2.22 0.21 0.00 -1.09 0.00 0.00 33.01 29.68 3gue s GLN 161 CO 0.18 -1.73 1.29 -0.80 -1.32 0.00 0.00 175.29 172.90 3gue s ASN 162 N -4.81 3.08 -0.11 12.60 0.02 -1.26 -4.81 114.94 119.65 3gue s ASN 162 Ca 0.69 0.01 -0.14 0.00 -1.02 0.00 0.00 52.86 52.40 3gue s ASN 162 Cb -0.04 -0.02 0.04 0.00 0.02 0.00 0.00 41.25 41.24 3gue s ASN 162 CO 0.47 -2.74 0.38 -0.60 0.02 0.00 0.00 177.10 174.63 3gue s ARG 163 N -5.81 0.53 -0.01 -0.60 3.52 -1.26 -4.25 118.95 111.07 3gue s ARG 163 Ca 0.75 0.36 -0.08 0.00 -0.13 0.00 0.00 55.73 56.64 3gue s ARG 163 Cb -0.03 0.25 0.01 0.00 -1.56 0.00 0.00 34.95 33.62 3gue s ARG 163 CO 0.52 -0.09 0.16 0.08 -0.81 0.00 0.00 175.30 175.16 3gue s VAL 164 N -0.20 0.07 0.28 7.11 1.01 -0.68 -4.92 120.40 123.07 3gue s VAL 164 Ca -0.04 -0.54 -0.29 0.00 0.00 0.00 0.00 61.98 61.11 3gue s VAL 164 Cb -0.03 -0.42 -0.10 0.00 0.00 0.00 0.00 36.38 35.83 3gue s VAL 164 CO 0.02 -0.30 1.32 -2.84 0.00 0.00 0.00 175.10 173.29 3gue s PRO 165 N -1.10 4.37 0.14 2.72 0.02 -1.26 -1.28 135.00 138.61 3gue s PRO 165 Ca -0.12 2.16 -0.31 0.00 0.02 0.00 0.00 61.00 62.75 3gue s PRO 165 Cb -0.06 -3.12 -0.08 0.00 0.02 0.00 0.00 34.50 31.26 3gue s PRO 165 CO 0.02 -0.22 1.36 0.15 -0.33 0.00 0.00 177.00 177.98 3gue s LYS 166 N -1.05 4.35 -0.00 5.54 1.02 -0.38 -4.75 119.74 124.46 3gue s LYS 166 Ca 0.53 2.06 0.02 0.00 0.02 0.00 0.00 55.97 58.60 3gue s LYS 166 Cb -0.39 -3.23 -0.03 0.00 -0.52 0.00 0.00 37.83 33.66 3gue s LYS 166 CO 0.46 -0.37 -0.03 0.96 -0.92 0.00 0.00 175.35 175.45 3gue s ILE 167 N 0.76 3.91 0.32 2.17 -4.36 -0.72 -0.35 121.20 122.93 3gue s ILE 167 Ca 0.62 -0.68 -0.29 0.00 -0.26 0.00 0.00 60.65 60.03 3gue s ILE 167 Cb -0.36 -2.72 -0.11 0.00 1.25 0.00 0.00 42.46 40.52 3gue s ILE 167 CO 0.33 0.39 1.44 -0.13 0.24 0.00 0.00 174.94 177.21 3gue s ARG 168 N -1.48 4.22 0.43 0.37 0.52 -0.15 0.85 118.95 123.72 3gue s ARG 168 Ca 0.18 2.41 0.16 0.00 -0.52 0.00 0.00 55.73 57.95 3gue s ARG 168 Cb -0.11 -3.04 0.97 0.00 0.52 0.00 0.00 34.95 33.29 3gue s ARG 168 CO 0.09 -0.42 1.95 1.96 0.02 0.00 0.00 175.30 178.90 3gue h GLN 169 N 3.87 0.00 0.00 3.54 4.20 -1.71 -1.48 115.11 123.53 3gue h GLN 169 Ca -0.49 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.22 3gue h GLN 169 Cb 1.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.01 3gue h GLN 169 CO 0.70 0.23 0.00 -0.25 -0.67 0.00 0.00 178.83 178.84 3gue n ASP 170 N -4.15 0.00 0.00 1.46 9.92 -1.26 -4.56 116.55 117.96 3gue n ASP 170 Ca -0.02 0.84 0.00 0.00 -0.53 0.00 0.00 54.79 55.08 3gue n ASP 170 Cb 0.30 -0.34 0.00 0.00 -0.64 0.00 0.00 41.12 40.43 3gue n ASP 170 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 3gue n ASN 171 N -1.59 1.00 -0.08 -2.24 0.23 -1.25 -5.01 115.26 106.32 3gue n ASN 171 Ca 0.00 -1.11 -0.01 0.00 -0.53 0.00 0.00 54.58 52.93 3gue n ASN 171 Cb 0.00 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 37.70 3gue n ASN 171 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 3gue n PHE 172 N -0.06 0.00 -2.25 -2.53 3.72 -0.56 -4.71 117.46 111.07 3gue n PHE 172 Ca 0.00 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.07 3gue n PHE 172 Cb 0.06 -1.24 -0.01 0.00 -0.94 0.00 0.00 39.48 37.36 3gue n PHE 172 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3gue s PHE 173 N -1.51 2.98 0.42 1.38 0.08 -1.26 -4.58 117.98 115.49 3gue s PHE 173 Ca 0.00 1.54 -0.25 0.00 0.12 0.00 0.00 56.93 58.33 3gue s PHE 173 Cb 0.00 -3.04 -0.08 0.00 -0.57 0.00 0.00 43.02 39.32 3gue s PHE 173 CO 0.00 -1.02 1.30 -2.14 -0.10 0.00 0.00 175.22 173.26 3gue s PRO 174 N -3.71 3.88 0.57 0.24 0.02 -1.26 -0.97 135.00 133.76 3gue s PRO 174 Ca 0.65 2.15 -0.17 0.00 0.02 0.00 0.00 61.00 63.65 3gue s PRO 174 Cb -0.16 -2.69 -0.04 0.00 0.02 0.00 0.00 34.50 31.62 3gue s PRO 174 CO 0.30 -0.57 1.08 0.54 -0.33 0.00 0.00 177.00 178.03 3gue s VAL 175 N -1.28 3.50 -0.09 3.83 0.11 0.53 -4.78 120.40 122.22 3gue s VAL 175 Ca 0.59 0.81 0.04 0.00 -2.93 0.00 0.00 61.98 60.49 3gue s VAL 175 Cb -0.38 -3.30 -0.00 0.00 -1.53 0.00 0.00 36.38 31.17 3gue s VAL 175 CO 0.48 -0.33 -0.24 -0.89 -3.33 0.00 0.00 175.10 170.80 3gue s THR 176 N -2.15 2.02 -0.40 5.04 2.01 -1.26 -4.87 115.64 116.04 3gue s THR 176 Ca 0.67 -1.01 0.01 0.00 0.31 0.00 0.00 61.69 61.68 3gue s THR 176 Cb -0.19 -1.74 0.14 0.00 0.01 0.00 0.00 72.50 70.72 3gue s THR 176 CO 0.32 0.55 0.24 -0.47 -0.69 0.00 0.00 174.62 174.58 3gue s TYR 177 N 0.23 1.23 0.22 4.92 5.04 -1.26 -5.01 117.35 122.73 3gue s TYR 177 Ca -0.15 -2.01 -0.07 0.00 -2.44 0.00 0.00 57.07 52.40 3gue s TYR 177 Cb -0.17 -1.26 0.35 0.00 0.35 0.00 0.00 41.96 41.22 3gue s TYR 177 CO 0.08 -0.81 1.75 1.05 -1.34 0.00 0.00 175.55 176.28 3gue h GLU 178 N 6.71 0.46 -1.12 4.97 4.11 -1.98 -1.57 114.58 126.17 3gue h GLU 178 Ca 0.07 -0.03 0.32 0.00 0.07 0.00 0.00 59.36 59.78 3gue h GLU 178 Cb 0.94 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.03 3gue h GLU 178 CO 0.36 0.31 0.78 0.00 0.07 0.00 0.00 179.01 180.52 3gue h ALA 179 N 1.46 2.82 -0.64 1.06 0.00 -2.06 -3.36 119.26 118.53 3gue h ALA 179 Ca 0.35 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.29 3gue h ALA 179 Cb 0.44 0.07 -0.18 0.00 0.00 0.00 0.00 17.79 18.12 3gue h ALA 179 CO -0.32 -1.18 -0.29 0.34 0.00 0.00 0.00 179.25 177.80 3gue s ASP 180 N -5.22 -1.00 0.64 0.00 -1.08 -0.65 -5.04 116.67 104.32 3gue s ASP 180 Ca -0.06 -0.44 0.32 0.00 -0.52 0.00 0.00 52.55 51.85 3gue s ASP 180 Cb 0.24 1.31 1.75 0.00 -1.46 0.00 0.00 42.92 44.75 3gue s ASP 180 CO 0.80 -0.12 2.03 -0.65 0.52 0.00 0.00 175.17 177.75 3gue h PRO 181 N 6.42 0.00 0.00 4.34 0.11 -1.55 -1.67 132.00 139.65 3gue h PRO 181 Ca 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 3gue h PRO 181 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 3gue h PRO 181 CO 0.02 0.00 -0.34 1.79 -0.21 0.00 0.00 178.00 179.27 3gue h THR 182 N 0.00 1.04 0.00 -1.15 1.35 -1.96 -2.27 112.91 109.92 3gue h THR 182 Ca 0.04 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 64.66 3gue h THR 182 Cb 0.59 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 3gue h THR 182 CO -0.00 0.33 0.00 0.00 -0.25 0.00 0.00 175.52 175.60 3gue n GLU 184 N -1.15 0.16 -4.38 0.00 1.02 -0.85 -4.73 120.64 110.70 3gue n GLU 184 Ca 0.04 -0.09 -0.20 0.00 -0.02 0.00 0.00 57.16 56.90 3gue n GLU 184 Cb 0.04 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 29.86 3gue n GLU 184 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3gue s TRP 185 N -2.90 1.84 -0.22 -0.32 0.52 -1.15 -1.25 118.94 115.46 3gue s TRP 185 Ca 0.14 -0.56 -0.18 0.00 0.02 0.00 0.00 56.10 55.52 3gue s TRP 185 Cb 0.18 -0.88 0.06 0.00 -1.15 0.00 0.00 33.47 31.68 3gue s TRP 185 CO 0.65 0.39 0.58 0.54 0.02 0.00 0.00 176.95 179.13 3gue s VAL 186 N -2.92 -0.00 0.48 4.03 0.11 -0.41 -4.77 120.40 116.93 3gue s VAL 186 Ca 0.25 0.01 -0.23 0.00 -2.93 0.00 0.00 61.98 59.08 3gue s VAL 186 Cb -0.00 -0.81 -0.07 0.00 -1.53 0.00 0.00 36.38 33.97 3gue s VAL 186 CO 0.09 0.01 1.31 -2.16 -3.33 0.00 0.00 175.10 171.02 3gue s PRO 187 N 0.67 3.53 -0.05 1.54 0.04 -1.26 -1.69 135.00 137.78 3gue s PRO 187 Ca -0.03 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.16 3gue s PRO 187 Cb -0.05 -2.45 0.05 0.00 0.04 0.00 0.00 34.50 32.09 3gue s PRO 187 CO -0.04 -0.85 1.38 -0.35 0.04 0.00 0.00 177.00 177.18 3gue n PRO 188 N -0.55 1.13 0.00 0.56 -0.04 -1.26 -4.90 135.00 129.94 3gue n PRO 188 Ca 0.07 -0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.25 3gue n PRO 188 Cb 0.45 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.80 3gue n PRO 188 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3gue n GLY 189 N 0.65 -0.73 0.08 0.55 0.00 -1.26 -1.24 105.19 103.23 3gue n GLY 189 Ca 0.06 -1.67 0.13 0.00 0.00 0.00 0.00 46.02 44.54 3gue n GLY 189 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3gue n HIS 190 N -0.72 0.67 0.27 1.61 1.44 -1.08 -1.84 115.22 115.57 3gue n HIS 190 Ca 0.00 0.20 0.15 0.00 -2.01 0.00 0.00 57.72 56.06 3gue n HIS 190 Cb 0.00 -0.83 0.79 0.00 0.12 0.00 0.00 29.99 30.07 3gue n HIS 190 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 3gue h GLY 191 N 4.38 0.00 2.00 -1.39 0.00 -1.36 -0.91 103.07 105.80 3gue h GLY 191 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3gue h GLY 191 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 176.54 174.74 3gue h ASP 192 N 0.00 0.00 -0.99 0.19 3.58 -1.57 -3.25 116.42 114.38 3gue h ASP 192 Ca 0.00 0.00 0.17 0.00 0.42 0.00 0.00 57.03 57.62 3gue h ASP 192 Cb 0.35 0.00 -0.09 0.00 1.72 0.00 0.00 39.33 41.30 3gue h ASP 192 CO 0.00 0.00 0.62 1.62 -2.88 0.00 0.00 179.24 178.60 3gue h VAL 193 N 0.00 0.78 0.61 2.25 3.04 -1.40 -2.68 116.25 118.85 3gue h VAL 193 Ca 0.00 -0.27 -0.03 0.00 -1.01 0.00 0.00 66.70 65.39 3gue h VAL 193 Cb 0.21 -0.09 0.01 0.00 -2.01 0.00 0.00 31.29 29.42 3gue h VAL 193 CO 0.00 0.14 -0.29 1.88 -1.01 0.00 0.00 177.57 178.29 3gue h TYR 194 N 0.79 -0.76 -0.81 3.17 0.05 -1.83 -1.38 116.97 116.21 3gue h TYR 194 Ca 0.53 -0.02 0.10 0.00 0.05 0.00 0.00 58.73 59.39 3gue h TYR 194 Cb 0.79 0.25 -0.07 0.00 1.01 0.00 0.00 36.73 38.71 3gue h TYR 194 CO -0.00 -0.42 0.45 0.00 -1.05 0.00 0.00 178.16 177.14 3gue h THR 195 N -1.05 0.89 0.51 -2.88 1.03 -1.80 -2.04 112.91 107.57 3gue h THR 195 Ca -0.08 -0.26 -0.03 0.00 -0.01 0.00 0.00 66.41 66.03 3gue h THR 195 Cb 0.68 0.07 0.01 0.00 -1.07 0.00 0.00 68.15 67.83 3gue h THR 195 CO 0.14 0.14 -0.25 0.58 -0.01 0.00 0.00 175.52 176.12 3gue h VAL 196 N 0.76 0.50 -0.92 0.00 2.07 -1.46 1.11 116.25 118.30 3gue h VAL 196 Ca 0.39 -0.04 0.16 0.00 0.82 0.00 0.00 66.70 68.04 3gue h VAL 196 Cb 0.38 0.51 -0.10 0.00 -1.52 0.00 0.00 31.29 30.56 3gue h VAL 196 CO -0.26 0.01 0.52 -0.07 0.02 0.00 0.00 177.57 177.79 3gue h LEU 197 N -0.71 0.66 0.23 2.57 3.38 -1.16 0.53 115.31 120.81 3gue h LEU 197 Ca -0.07 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3gue h LEU 197 Cb 0.54 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3gue h LEU 197 CO 0.12 0.26 -0.11 0.22 0.09 0.00 0.00 178.44 179.01 3gue h TYR 198 N 0.71 -0.29 -0.07 1.13 3.20 -0.88 -0.56 116.97 120.21 3gue h TYR 198 Ca 0.51 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.28 3gue h TYR 198 Cb 0.74 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.10 3gue h TYR 198 CO -0.05 0.05 -0.40 0.66 -1.64 0.00 0.00 178.16 176.78 3gue h SER 199 N -0.96 0.14 0.42 -2.11 4.64 0.15 -2.48 113.55 113.35 3gue h SER 199 Ca -0.03 -0.06 -0.02 0.00 -0.47 0.00 0.00 61.79 61.21 3gue h SER 199 Cb 0.47 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.52 3gue h SER 199 CO 0.05 0.53 -0.09 0.77 -0.87 0.00 0.00 176.83 177.23 3gue h SER 200 N 0.12 0.00 0.00 4.97 4.64 -1.04 -3.46 113.55 118.77 3gue h SER 200 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3gue h SER 200 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 3gue h SER 200 CO 0.06 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 3gue n GLY 201 N -0.63 1.21 0.36 -0.77 0.00 -0.94 -4.94 105.19 99.47 3gue n GLY 201 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 3gue n GLY 201 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gue h LYS 202 N 3.25 1.14 -0.28 1.61 1.79 -1.78 -1.36 116.57 120.94 3gue h LYS 202 Ca 0.00 -0.10 0.06 0.00 -2.18 0.00 0.00 60.65 58.43 3gue h LYS 202 Cb 0.00 -0.24 -0.06 0.00 -1.58 0.00 0.00 32.23 30.35 3gue h LYS 202 CO 0.00 0.80 -0.10 1.25 -1.08 0.00 0.00 179.45 180.32 3gue h LEU 203 N 1.16 -0.34 -0.71 2.94 5.85 -1.38 0.76 115.31 123.59 3gue h LEU 203 Ca 0.30 0.09 -0.14 0.00 0.84 0.00 0.00 57.88 58.98 3gue h LEU 203 Cb -0.05 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3gue h LEU 203 CO -0.06 -0.13 -0.50 0.44 -0.34 0.00 0.00 178.44 177.86 3gue h ASP 204 N -0.04 0.40 0.01 1.25 3.32 -1.77 -1.29 116.42 118.29 3gue h ASP 204 Ca 0.14 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3gue h ASP 204 Cb 0.25 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3gue h ASP 204 CO -0.31 0.84 -0.00 0.22 -1.72 0.00 0.00 179.24 178.26 3gue h TYR 205 N 0.29 -0.01 -0.36 4.55 3.20 -0.89 -0.07 116.97 123.70 3gue h TYR 205 Ca 0.01 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.90 3gue h TYR 205 Cb 0.98 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 3gue h TYR 205 CO 0.03 0.14 0.20 -0.07 -1.64 0.00 0.00 178.16 176.82 3gue h LEU 206 N -0.15 0.31 -1.32 2.82 3.38 -0.77 -2.29 115.31 117.29 3gue h LEU 206 Ca -0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3gue h LEU 206 Cb 0.15 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 3gue h LEU 206 CO 0.00 0.23 0.30 -0.07 0.09 0.00 0.00 178.44 178.98 3gue h LEU 207 N 0.40 0.68 -1.08 1.67 3.38 -1.20 -2.18 115.31 116.98 3gue h LEU 207 Ca 0.14 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 3gue h LEU 207 Cb 0.02 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3gue h LEU 207 CO -0.08 0.55 -0.02 1.23 0.09 0.00 0.00 178.44 180.22 3gue h GLY 208 N 0.84 0.00 -1.34 0.83 0.00 -0.66 -2.69 103.07 100.06 3gue h GLY 208 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3gue h GLY 208 CO -0.03 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.79 3gue n LYS 209 N -3.11 2.02 -0.19 4.80 4.76 -0.87 -4.96 118.16 120.61 3gue n LYS 209 Ca 0.01 -1.53 0.00 0.00 -2.87 0.00 0.00 58.31 53.93 3gue n LYS 209 Cb 0.37 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.11 3gue n LYS 209 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3gue n GLY 210 N 1.27 0.68 3.80 0.72 0.00 -1.01 -5.07 105.19 105.58 3gue n GLY 210 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3gue n GLY 210 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gue s TYR 211 N -2.27 3.69 0.00 1.61 2.02 -0.90 -4.71 117.35 116.78 3gue s TYR 211 Ca 0.00 1.58 0.00 0.00 -0.37 0.00 0.00 57.07 58.28 3gue s TYR 211 Cb 0.00 -2.76 0.00 0.00 -0.40 0.00 0.00 41.96 38.80 3gue s TYR 211 CO 0.00 0.29 0.00 0.54 -1.57 0.00 0.00 175.55 174.81 3gue n ARG 212 N 0.71 4.15 -4.34 -0.62 5.12 -0.54 -4.03 116.66 117.12 3gue n ARG 212 Ca -0.01 0.00 -0.21 0.00 -1.93 0.00 0.00 57.85 55.71 3gue n ARG 212 Cb 0.50 -0.60 -0.13 0.00 -1.16 0.00 0.00 32.46 31.08 3gue n ARG 212 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3gue s TYR 213 N -0.52 1.32 -0.05 -1.55 2.02 -0.93 -0.84 117.35 116.80 3gue s TYR 213 Ca 0.00 -0.38 0.01 0.00 -0.37 0.00 0.00 57.07 56.33 3gue s TYR 213 Cb 0.00 -0.77 0.02 0.00 -0.40 0.00 0.00 41.96 40.81 3gue s TYR 213 CO 0.00 0.06 -0.06 1.41 -1.57 0.00 0.00 175.55 175.39 3gue s MET 214 N -1.32 0.97 -0.37 -0.62 -2.45 -0.19 -0.67 119.30 114.65 3gue s MET 214 Ca 0.02 -0.15 -0.12 0.00 -1.25 0.00 0.00 55.69 54.18 3gue s MET 214 Cb -0.09 -0.94 0.01 0.00 1.25 0.00 0.00 34.83 35.07 3gue s MET 214 CO 0.02 -0.07 0.23 0.12 1.05 0.00 0.00 175.02 176.37 3gue s PHE 215 N 0.90 3.23 -0.01 4.11 5.36 -0.06 -0.90 117.98 130.62 3gue s PHE 215 Ca -0.11 -0.68 0.01 0.00 -0.96 0.00 0.00 56.93 55.19 3gue s PHE 215 Cb -0.14 -2.48 -0.04 0.00 -0.34 0.00 0.00 43.02 40.02 3gue s PHE 215 CO 0.00 -0.56 -0.00 0.42 -1.46 0.00 0.00 175.22 173.62 3gue s ILE 216 N 1.63 4.15 0.16 3.12 1.01 0.34 -1.52 121.20 130.09 3gue s ILE 216 Ca 0.04 -0.58 -0.19 0.00 0.00 0.00 0.00 60.65 59.92 3gue s ILE 216 Cb -0.19 -2.84 0.04 0.00 0.01 0.00 0.00 42.46 39.49 3gue s ILE 216 CO 0.08 0.40 0.52 -0.94 0.00 0.00 0.00 174.94 175.00 3gue s SER 217 N -1.49 -0.36 0.30 3.58 1.04 -0.95 -0.82 113.70 115.00 3gue s SER 217 Ca 0.19 -0.27 -0.29 0.00 0.48 0.00 0.00 55.95 56.06 3gue s SER 217 Cb -0.11 0.56 -0.10 0.00 0.10 0.00 0.00 66.02 66.46 3gue s SER 217 CO 0.09 -0.97 1.38 0.20 0.98 0.00 0.00 173.24 174.92 3gue s ASN 218 N -2.81 6.68 0.55 7.02 0.01 -1.26 -0.59 114.94 124.54 3gue s ASN 218 Ca 0.04 2.71 0.24 0.00 -0.71 0.00 0.00 52.86 55.14 3gue s ASN 218 Cb -0.00 -2.64 1.45 0.00 0.41 0.00 0.00 41.25 40.47 3gue s ASN 218 CO -0.09 -0.64 2.08 1.23 -1.51 0.00 0.00 177.10 178.17 3gue h GLY 219 N 4.06 0.00 1.56 0.66 0.00 -1.63 -2.81 103.07 104.91 3gue h GLY 219 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 3gue h GLY 219 CO 0.71 0.00 -0.39 1.29 0.00 0.00 0.00 176.54 178.14 3gue h ASP 220 N 0.00 0.00 -2.96 0.19 3.04 -1.90 -3.44 116.42 111.35 3gue h ASP 220 Ca 0.12 -0.05 -0.72 0.00 -3.24 0.00 0.00 57.03 53.15 3gue h ASP 220 Cb 0.53 0.00 -0.21 0.00 -1.04 0.00 0.00 39.33 38.61 3gue h ASP 220 CO -0.00 0.02 0.10 0.21 -2.04 0.00 0.00 179.24 177.53 3gue s ASN 221 N -5.22 6.24 0.00 4.15 2.47 -1.06 -4.22 114.94 117.29 3gue s ASN 221 Ca 0.06 -1.59 0.14 0.00 0.42 0.00 0.00 52.86 51.89 3gue s ASN 221 Cb 0.09 -2.29 0.55 0.00 -1.45 0.00 0.00 41.25 38.15 3gue s ASN 221 CO 0.70 -1.05 1.40 0.18 -3.72 0.00 0.00 177.10 174.61 3gue n LEU 222 N 6.05 1.24 0.04 3.21 4.77 -1.26 -3.34 117.00 127.70 3gue n LEU 222 Ca -0.07 -0.57 0.12 0.00 -0.03 0.00 0.00 56.01 55.45 3gue n LEU 222 Cb 0.43 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.47 3gue n LEU 222 CO 0.56 0.28 0.12 0.61 -1.33 0.00 0.00 177.39 177.63 3gue n GLY 223 N 0.96 -1.29 3.54 -0.72 0.00 -1.25 -2.85 105.19 103.59 3gue n GLY 223 Ca 0.12 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 3gue n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gue s ALA 224 N -3.19 2.78 0.39 4.61 0.00 -1.21 -4.36 121.76 120.77 3gue s ALA 224 Ca 0.04 -1.46 0.05 0.00 0.00 0.00 0.00 51.96 50.59 3gue s ALA 224 Cb 0.14 -4.24 -0.06 0.00 0.00 0.00 0.00 23.12 18.96 3gue s ALA 224 CO 0.77 -3.26 0.04 0.95 0.00 0.00 0.00 175.76 174.26 3gue s THR 225 N 5.55 1.43 0.11 0.00 -4.23 -1.26 -5.04 115.64 112.20 3gue s THR 225 Ca 0.34 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.55 3gue s THR 225 Cb -0.08 -2.75 -0.07 0.00 1.34 0.00 0.00 72.50 70.94 3gue s THR 225 CO 0.13 0.00 1.26 -0.22 -0.54 0.00 0.00 174.62 175.25 3gue s LEU 226 N -3.63 4.39 -0.24 4.79 0.20 -1.26 -4.99 118.68 117.93 3gue s LEU 226 Ca 0.31 2.17 0.02 0.00 0.69 0.00 0.00 54.13 57.31 3gue s LEU 226 Cb 0.08 -3.59 0.05 0.00 -0.43 0.00 0.00 46.19 42.30 3gue s LEU 226 CO 0.15 -0.51 -0.13 -0.62 -0.29 0.00 0.00 176.35 174.95 3gue s ASP 227 N 0.88 4.12 0.40 3.68 -1.08 -1.26 -4.99 116.67 118.42 3gue s ASP 227 Ca 0.59 -1.16 0.28 0.00 -0.52 0.00 0.00 52.55 51.74 3gue s ASP 227 Cb -0.33 -1.55 1.40 0.00 -1.46 0.00 0.00 42.92 40.99 3gue s ASP 227 CO 0.31 -0.14 1.85 1.62 0.52 0.00 0.00 175.17 179.34 3gue h VAL 228 N 6.50 0.00 -0.16 1.11 3.04 -2.00 -1.96 116.25 122.79 3gue h VAL 228 Ca -0.27 -0.12 -0.22 0.00 -1.01 0.00 0.00 66.70 65.08 3gue h VAL 228 Cb 1.07 0.82 0.01 0.00 -2.01 0.00 0.00 31.29 31.19 3gue h VAL 228 CO 0.52 0.00 -0.77 0.03 -1.01 0.00 0.00 177.57 176.34 3gue h ARG 229 N 0.00 0.78 -0.01 4.17 3.08 -1.99 -2.58 114.38 117.83 3gue h ARG 229 Ca 0.00 -0.63 -0.19 0.00 0.07 0.00 0.00 59.98 59.24 3gue h ARG 229 Cb 0.15 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 3gue h ARG 229 CO 0.00 1.24 -0.83 -0.07 -1.07 0.00 0.00 179.97 179.24 3gue h LEU 230 N 0.53 0.22 -0.02 3.04 3.38 -1.80 -1.46 115.31 119.21 3gue h LEU 230 Ca -0.05 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 3gue h LEU 230 Cb 1.39 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 3gue h LEU 230 CO 0.16 0.95 0.00 0.25 0.09 0.00 0.00 178.44 179.89 3gue h LEU 231 N 0.10 0.03 -0.56 1.67 6.46 -1.57 -1.19 115.31 120.25 3gue h LEU 231 Ca -0.03 -0.22 0.05 0.00 -0.12 0.00 0.00 57.88 57.56 3gue h LEU 231 Cb 1.43 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 41.31 3gue h LEU 231 CO 0.12 0.24 0.28 -0.78 -0.62 0.00 0.00 178.44 177.69 3gue h ASP 232 N -0.19 0.40 0.43 1.25 3.58 -1.48 -1.61 116.42 118.81 3gue h ASP 232 Ca 0.01 0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 3gue h ASP 232 Cb 0.22 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.21 3gue h ASP 232 CO -0.00 0.27 -0.43 0.22 -2.88 0.00 0.00 179.24 176.42 3gue h TYR 233 N 0.54 -1.18 -0.81 0.28 3.20 -1.14 0.10 116.97 117.96 3gue h TYR 233 Ca 0.25 0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.30 3gue h TYR 233 Cb 0.17 0.46 -0.15 0.00 1.54 0.00 0.00 36.73 38.75 3gue h TYR 233 CO -0.10 -0.59 -0.16 1.98 -1.64 0.00 0.00 178.16 177.65 3gue h MET 234 N -0.88 0.01 0.06 1.82 4.05 -1.07 0.14 114.93 119.07 3gue h MET 234 Ca -0.04 -0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 3gue h MET 234 Cb 0.78 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.57 3gue h MET 234 CO -0.06 0.01 -0.03 1.25 0.23 0.00 0.00 176.91 178.31 3gue h HIS 235 N 0.01 -0.08 -0.64 1.39 -0.00 -0.97 -1.66 115.15 113.20 3gue h HIS 235 Ca 0.40 -0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.73 3gue h HIS 235 Cb 0.64 0.03 -0.03 0.00 -0.00 0.00 0.00 27.41 28.05 3gue h HIS 235 CO -0.60 0.21 0.26 0.93 -0.00 0.00 0.00 177.93 178.73 3gue h GLU 236 N -0.37 0.94 -0.01 5.26 5.08 -0.21 -2.53 114.58 122.74 3gue h GLU 236 Ca -0.01 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3gue h GLU 236 Cb 0.32 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.41 3gue h GLU 236 CO 0.01 0.76 -0.09 1.17 -1.00 0.00 0.00 179.01 179.87 3gue n LYS 237 N -4.31 0.91 -3.75 2.33 3.00 0.44 -4.95 118.16 111.84 3gue n LYS 237 Ca 0.06 -0.34 -0.25 0.00 -0.00 0.00 0.00 58.31 57.77 3gue n LYS 237 Cb 0.17 -1.49 0.04 0.00 0.00 0.00 0.00 35.03 33.75 3gue n LYS 237 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 3gue n GLN 238 N -0.74 -5.75 -3.05 1.64 1.13 -0.86 -4.98 117.38 104.76 3gue n GLN 238 Ca 0.16 0.66 -0.37 0.00 -1.94 0.00 0.00 57.00 55.52 3gue n GLN 238 Cb 0.27 -5.46 -0.06 0.00 0.11 0.00 0.00 30.24 25.10 3gue n GLN 238 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3gue s LEU 239 N -6.99 4.39 0.15 1.08 1.43 -0.68 -4.81 118.68 113.26 3gue s LEU 239 Ca 0.35 1.50 0.06 0.00 -1.03 0.00 0.00 54.13 55.01 3gue s LEU 239 Cb -0.17 -3.55 -0.07 0.00 0.03 0.00 0.00 46.19 42.42 3gue s LEU 239 CO 0.80 0.06 1.35 1.23 0.23 0.00 0.00 176.35 180.02 3gue h GLY 240 N 3.59 0.06 -5.91 -3.19 0.00 -0.79 -3.42 103.07 93.41 3gue h GLY 240 Ca -0.48 -0.12 -0.21 0.00 0.00 0.00 0.00 47.33 46.52 3gue h GLY 240 CO 0.65 0.11 -0.55 -0.12 0.00 0.00 0.00 176.54 176.63 3gue s PHE 241 N -2.96 -0.21 -0.06 5.60 5.36 -0.75 -0.55 117.98 124.40 3gue s PHE 241 Ca -0.00 0.54 -0.01 0.00 -0.96 0.00 0.00 56.93 56.49 3gue s PHE 241 Cb 0.10 -0.00 0.03 0.00 -0.34 0.00 0.00 43.02 42.81 3gue s PHE 241 CO 0.81 -0.15 0.02 -1.17 -1.46 0.00 0.00 175.22 173.27 3gue s LEU 242 N 0.81 0.50 -0.22 6.12 2.96 -0.41 -1.44 118.68 126.99 3gue s LEU 242 Ca -0.06 -0.04 -0.09 0.00 -0.22 0.00 0.00 54.13 53.72 3gue s LEU 242 Cb -0.08 -0.36 -0.04 0.00 0.50 0.00 0.00 46.19 46.21 3gue s LEU 242 CO -0.04 -0.20 0.11 -0.32 -1.32 0.00 0.00 176.35 174.58 3gue s MET 243 N 1.99 3.96 -0.12 1.98 -2.45 -0.11 -0.34 119.30 124.21 3gue s MET 243 Ca 0.04 -0.33 -0.24 0.00 -1.25 0.00 0.00 55.69 53.91 3gue s MET 243 Cb -0.12 -3.40 -0.03 0.00 1.25 0.00 0.00 34.83 32.53 3gue s MET 243 CO -0.05 0.08 0.75 -1.21 1.05 0.00 0.00 175.02 175.64 3gue s GLU 244 N 0.96 4.36 0.37 4.11 2.02 -0.76 -1.02 118.70 128.73 3gue s GLU 244 Ca 0.06 0.92 0.08 0.00 0.02 0.00 0.00 54.97 56.05 3gue s GLU 244 Cb -0.14 -3.51 -0.05 0.00 0.10 0.00 0.00 34.13 30.53 3gue s GLU 244 CO 0.03 -0.13 0.12 0.14 0.02 0.00 0.00 175.26 175.45 3gue s VAL 245 N 1.45 2.67 0.12 2.63 -7.23 0.31 -2.28 120.40 118.06 3gue s VAL 245 Ca 0.37 -1.77 0.08 0.00 -1.81 0.00 0.00 61.98 58.85 3gue s VAL 245 Cb -0.17 -2.94 -0.04 0.00 0.56 0.00 0.00 36.38 33.80 3gue s VAL 245 CO 0.16 -0.12 -0.18 0.00 -0.31 0.00 0.00 175.10 174.64 3gue n ARG 247 N 0.84 1.88 -2.11 0.00 3.00 -1.26 -0.86 116.66 118.15 3gue n ARG 247 Ca -0.18 0.69 -0.42 0.00 -0.00 0.00 0.00 57.85 57.95 3gue n ARG 247 Cb 0.55 -2.47 -0.03 0.00 0.00 0.00 0.00 32.46 30.51 3gue n ARG 247 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 3gue s ARG 248 N 2.97 4.31 0.49 -0.14 3.52 -0.15 -4.86 118.95 125.10 3gue s ARG 248 Ca 0.90 2.17 0.06 0.00 -0.13 0.00 0.00 55.73 58.73 3gue s ARG 248 Cb -0.79 -3.18 0.01 0.00 -1.56 0.00 0.00 34.95 29.43 3gue s ARG 248 CO 0.51 -0.40 0.33 0.95 -0.81 0.00 0.00 175.30 175.88 3gue s THR 249 N 0.51 1.93 0.28 4.11 -4.23 -1.26 -4.95 115.64 112.03 3gue s THR 249 Ca 0.61 -1.54 0.01 0.00 -1.18 0.00 0.00 61.69 59.59 3gue s THR 249 Cb -0.39 -2.47 0.26 0.00 1.34 0.00 0.00 72.50 71.24 3gue s THR 249 CO 0.36 0.00 1.77 -0.08 -0.54 0.00 0.00 174.62 176.14 3gue h GLU 250 N 0.98 0.69 0.00 3.99 4.81 -1.95 -2.22 114.58 120.87 3gue h GLU 250 Ca -0.39 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 3gue h GLU 250 Cb 1.29 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.51 3gue h GLU 250 CO 0.61 0.45 0.00 0.43 -0.73 0.00 0.00 179.01 179.77 3gue n SER 251 N -4.81 0.09 -4.53 1.04 7.64 -1.26 -4.53 113.62 107.25 3gue n SER 251 Ca 0.19 0.51 -0.43 0.00 1.01 0.00 0.00 58.87 60.15 3gue n SER 251 Cb 0.46 -0.54 -0.00 0.00 -1.01 0.00 0.00 64.21 63.12 3gue n SER 251 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3gue s ASP 252 N -3.17 6.92 -0.04 6.43 1.01 -0.84 -4.66 116.67 122.33 3gue s ASP 252 Ca 0.11 -2.64 0.05 0.00 0.71 0.00 0.00 52.55 50.78 3gue s ASP 252 Cb 0.14 -2.51 -0.08 0.00 1.01 0.00 0.00 42.92 41.49 3gue s ASP 252 CO 0.43 -1.01 0.05 0.29 0.21 0.00 0.00 175.17 175.14 3gue n LYS 253 N 7.34 2.27 -4.07 8.23 5.02 -1.26 -4.89 118.16 130.80 3gue n LYS 253 Ca 0.44 -0.02 -0.32 0.00 -2.02 0.00 0.00 58.31 56.39 3gue n LYS 253 Cb 0.45 -1.15 -0.16 0.00 -0.02 0.00 0.00 35.03 34.15 3gue n LYS 253 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3gue s LYS 254 N -2.22 2.56 0.00 1.97 2.36 -1.26 -4.98 119.74 118.17 3gue s LYS 254 Ca -0.03 -0.87 0.00 0.00 -2.55 0.00 0.00 55.97 52.52 3gue s LYS 254 Cb 0.02 -2.51 0.00 0.00 -1.05 0.00 0.00 37.83 34.29 3gue s LYS 254 CO 0.24 -0.32 0.00 0.41 1.55 0.00 0.00 175.35 177.24 3gue n GLY 255 N 4.63 -0.24 3.16 5.54 0.00 -1.26 -4.98 105.19 112.04 3gue n GLY 255 Ca -0.18 -0.77 -0.18 0.00 0.00 0.00 0.00 46.02 44.90 3gue n GLY 255 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gue s GLY 256 N 0.00 0.83 0.20 -0.02 0.00 -1.26 -0.94 107.32 106.13 3gue s GLY 256 Ca 0.00 -0.99 0.10 0.00 0.00 0.00 0.00 44.72 43.83 3gue s GLY 256 CO 0.00 -1.03 -0.17 -2.38 0.00 0.00 0.00 173.10 169.53 3gue s HIS 257 N -1.37 2.45 0.44 1.90 -3.43 -0.45 -1.12 115.29 113.72 3gue s HIS 257 Ca -0.02 -0.29 -0.14 0.00 -0.80 0.00 0.00 55.06 53.81 3gue s HIS 257 Cb -0.09 -1.19 -0.07 0.00 -1.43 0.00 0.00 32.58 29.80 3gue s HIS 257 CO 0.02 0.53 0.86 -0.51 -2.00 0.00 0.00 174.74 173.65 3gue s LEU 258 N -2.88 3.77 0.31 5.38 1.43 -0.91 -1.05 118.68 124.73 3gue s LEU 258 Ca 0.24 1.35 -0.18 0.00 -1.03 0.00 0.00 54.13 54.50 3gue s LEU 258 Cb -0.08 -4.24 0.03 0.00 0.03 0.00 0.00 46.19 41.93 3gue s LEU 258 CO 0.13 -0.45 0.72 0.00 0.23 0.00 0.00 176.35 176.97 3gue s ALA 259 N -2.43 -0.96 0.06 4.21 0.00 -0.15 -4.42 121.76 118.08 3gue s ALA 259 Ca 0.55 -0.51 0.08 0.00 0.00 0.00 0.00 51.96 52.08 3gue s ALA 259 Cb -0.10 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 3gue s ALA 259 CO 0.29 -1.00 -0.21 0.71 0.00 0.00 0.00 175.76 175.55 3gue s TYR 260 N -3.44 2.47 0.01 0.00 2.02 0.12 -0.03 117.35 118.50 3gue s TYR 260 Ca 0.14 -0.31 0.00 0.00 -0.37 0.00 0.00 57.07 56.53 3gue s TYR 260 Cb -0.05 -1.40 -0.01 0.00 -0.40 0.00 0.00 41.96 40.09 3gue s TYR 260 CO 0.09 0.25 -0.02 -1.59 -1.57 0.00 0.00 175.55 172.71 3gue s LYS 261 N -1.57 0.21 -0.09 -0.62 -2.85 -0.11 0.38 119.74 115.10 3gue s LYS 261 Ca 0.14 -0.32 -0.30 0.00 -1.00 0.00 0.00 55.97 54.50 3gue s LYS 261 Cb -0.10 -0.04 -0.02 0.00 -2.06 0.00 0.00 37.83 35.62 3gue s LYS 261 CO 0.05 -0.00 1.03 -0.51 0.10 0.00 0.00 175.35 176.02 3gue s ASP 262 N -0.70 7.23 0.18 0.03 1.11 -1.26 -1.86 116.67 121.40 3gue s ASP 262 Ca -0.07 1.57 0.09 0.00 0.18 0.00 0.00 52.55 54.32 3gue s ASP 262 Cb -0.05 -2.56 -0.04 0.00 1.07 0.00 0.00 42.92 41.34 3gue s ASP 262 CO -0.00 -0.45 -0.18 -0.69 1.18 0.00 0.00 175.17 175.03 3gue s VAL 263 N 1.97 1.86 -0.22 -1.27 1.01 -1.26 -4.97 120.40 117.52 3gue s VAL 263 Ca 0.49 -2.03 -0.05 0.00 0.00 0.00 0.00 61.98 60.40 3gue s VAL 263 Cb -0.19 -1.93 0.11 0.00 0.00 0.00 0.00 36.38 34.37 3gue s VAL 263 CO 0.19 -0.38 0.40 -0.51 0.00 0.00 0.00 175.10 174.80 3gue s ILE 264 N -2.29 -0.63 -0.58 2.22 2.07 -1.26 -4.88 121.20 115.85 3gue s ILE 264 Ca 0.18 0.05 0.12 0.00 -1.41 0.00 0.00 60.65 59.59 3gue s ILE 264 Cb -0.05 -0.74 -0.12 0.00 0.13 0.00 0.00 42.46 41.69 3gue s ILE 264 CO 0.07 -0.02 0.51 0.47 -1.91 0.00 0.00 174.94 174.06 3gue n ASP 265 N 5.38 0.59 -3.70 4.50 9.92 -1.26 -5.30 116.55 126.69 3gue n ASP 265 Ca -0.06 -0.80 0.00 0.00 -0.53 0.00 0.00 54.79 53.40 3gue n ASP 265 Cb 0.50 0.97 0.00 0.00 -0.64 0.00 0.00 41.12 41.95 3gue n ASP 265 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 3gue n ARG 272 N -1.21 0.00 -0.21 -1.24 3.00 -1.26 -5.40 116.66 110.34 3gue n ARG 272 Ca 0.02 0.00 -0.08 0.00 -0.00 0.00 0.00 57.85 57.79 3gue n ARG 272 Cb 0.18 -0.95 0.03 0.00 0.00 0.00 0.00 32.46 31.72 3gue n ARG 272 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 3gue h ARG 273 N 6.24 0.95 -4.65 -0.14 2.43 -1.90 -3.46 114.38 113.85 3gue h ARG 273 Ca 0.00 -0.22 -0.36 0.00 -0.81 0.00 0.00 59.98 58.58 3gue h ARG 273 Cb 0.37 -0.13 -0.27 0.00 -0.42 0.00 0.00 29.97 29.52 3gue h ARG 273 CO 0.37 0.87 -0.77 0.50 -1.51 0.00 0.00 179.97 179.44 3gue s ARG 274 N -5.33 0.63 0.26 0.20 3.52 -0.78 -4.93 118.95 112.52 3gue s ARG 274 Ca -0.12 -0.40 -0.30 0.00 -0.13 0.00 0.00 55.73 54.78 3gue s ARG 274 Cb 0.13 -0.58 -0.10 0.00 -1.56 0.00 0.00 34.95 32.84 3gue s ARG 274 CO 0.82 0.15 1.32 -0.06 -0.81 0.00 0.00 175.30 176.72 3gue s PHE 275 N -0.44 3.16 -0.02 5.12 0.08 -1.26 -0.93 117.98 123.69 3gue s PHE 275 Ca 0.01 1.27 0.07 0.00 0.12 0.00 0.00 56.93 58.39 3gue s PHE 275 Cb -0.05 -3.66 -0.02 0.00 -0.57 0.00 0.00 43.02 38.73 3gue s PHE 275 CO 0.00 -1.97 -0.21 0.54 -0.10 0.00 0.00 175.22 173.48 3gue s VAL 276 N -0.38 1.68 -0.18 -0.44 0.11 0.96 -4.50 120.40 117.67 3gue s VAL 276 Ca 0.54 -0.91 -0.08 0.00 -2.93 0.00 0.00 61.98 58.61 3gue s VAL 276 Cb -0.38 -1.40 -0.04 0.00 -1.53 0.00 0.00 36.38 33.02 3gue s VAL 276 CO 0.44 0.48 0.08 -0.22 -3.33 0.00 0.00 175.10 172.54 3gue s LEU 277 N -0.48 3.93 -0.31 2.54 2.96 -1.26 -0.98 118.68 125.07 3gue s LEU 277 Ca 0.08 0.14 -0.00 0.00 -0.22 0.00 0.00 54.13 54.13 3gue s LEU 277 Cb -0.08 -1.99 0.07 0.00 0.50 0.00 0.00 46.19 44.68 3gue s LEU 277 CO -0.01 0.20 0.01 -0.60 -1.32 0.00 0.00 176.35 174.64 3gue s ARG 278 N 0.21 2.19 0.52 1.98 3.52 -0.22 -4.96 118.95 122.19 3gue s ARG 278 Ca 0.05 -1.45 -0.11 0.00 -0.13 0.00 0.00 55.73 54.09 3gue s ARG 278 Cb -0.12 -3.18 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 3gue s ARG 278 CO -0.00 -0.72 0.91 -1.21 -0.81 0.00 0.00 175.30 173.47 3gue s GLU 279 N 1.15 3.71 0.31 5.12 0.41 -1.26 -1.34 118.70 126.80 3gue s GLU 279 Ca -0.02 0.61 0.08 0.00 -0.41 0.00 0.00 54.97 55.23 3gue s GLU 279 Cb -0.20 -2.23 0.83 0.00 -1.78 0.00 0.00 34.13 30.75 3gue s GLU 279 CO -0.03 -0.30 1.73 0.77 -0.49 0.00 0.00 175.26 176.94 3gue h SER 280 N 0.44 0.63 0.36 -0.19 0.02 -1.42 -0.51 113.55 112.88 3gue h SER 280 Ca -0.46 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 3gue h SER 280 Cb 1.19 0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.77 3gue h SER 280 CO 0.62 0.11 0.00 0.00 -1.14 0.00 0.00 176.83 176.42 3gue n ALA 281 N -2.34 2.30 0.01 3.77 0.00 -1.26 -2.71 120.51 120.27 3gue n ALA 281 Ca 0.25 -0.13 0.09 0.00 0.00 0.00 0.00 53.44 53.65 3gue n ALA 281 Cb 0.70 -1.40 0.19 0.00 0.00 0.00 0.00 19.45 18.94 3gue n ALA 281 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3gue n GLN 282 N -1.22 2.40 -3.72 0.00 6.02 -0.20 -4.53 117.38 116.13 3gue n GLN 282 Ca 0.13 -2.12 -0.38 0.00 -0.01 0.00 0.00 57.00 54.63 3gue n GLN 282 Cb 0.17 -1.39 -0.12 0.00 1.02 0.00 0.00 30.24 29.91 3gue n GLN 282 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3gue n PRO 284 N 4.93 1.37 -0.29 0.00 -0.02 -1.26 -4.89 135.00 134.83 3gue n PRO 284 Ca -0.15 0.52 0.01 0.00 -2.02 0.00 0.00 63.50 61.86 3gue n PRO 284 Cb 0.49 -2.49 0.08 0.00 -0.02 0.00 0.00 33.50 31.57 3gue n PRO 284 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3gue h LYS 285 N 0.98 -0.02 0.00 -0.52 1.79 -1.98 -1.59 116.57 115.23 3gue h LYS 285 Ca -0.50 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 3gue h LYS 285 Cb 1.33 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 3gue h LYS 285 CO 0.55 -0.01 0.00 1.05 -1.08 0.00 0.00 179.45 179.95 3gue h GLU 286 N -0.02 0.00 -0.46 3.15 4.11 -2.05 -1.92 114.58 117.39 3gue h GLU 286 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.80 3gue h GLU 286 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 3gue h GLU 286 CO -0.85 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 177.98 3gue n ASP 287 N -3.08 3.58 -0.22 3.06 8.00 -0.61 -4.61 116.55 122.68 3gue n ASP 287 Ca -0.02 -2.00 -0.01 0.00 0.71 0.00 0.00 54.79 53.47 3gue n ASP 287 Cb 0.15 -0.30 0.10 0.00 -0.02 0.00 0.00 41.12 41.05 3gue n ASP 287 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3gue h GLU 288 N 4.46 0.58 -0.71 -1.24 4.39 -1.25 -1.32 114.58 119.49 3gue h GLU 288 Ca 0.00 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.73 3gue h GLU 288 Cb 0.99 -0.13 -0.06 0.00 -0.10 0.00 0.00 28.75 29.45 3gue h GLU 288 CO 0.00 0.38 0.41 -0.44 -1.16 0.00 0.00 179.01 178.20 3gue h ASP 289 N 0.60 0.61 -0.33 1.42 5.19 -1.82 -1.34 116.42 120.74 3gue h ASP 289 Ca 0.29 0.03 -0.06 0.00 -0.62 0.00 0.00 57.03 56.68 3gue h ASP 289 Cb 0.23 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.64 3gue h ASP 289 CO -0.21 0.39 -0.01 0.28 -3.12 0.00 0.00 179.24 176.57 3gue h SER 290 N 0.74 0.58 -0.64 6.45 0.02 -1.74 -2.24 113.55 116.73 3gue h SER 290 Ca 0.32 -0.32 0.11 0.00 -0.84 0.00 0.00 61.79 61.07 3gue h SER 290 Cb 0.20 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.54 3gue h SER 290 CO -0.19 0.76 0.43 0.15 -1.14 0.00 0.00 176.83 176.84 3gue h PHE 291 N 0.39 0.43 -0.37 3.45 3.57 -0.95 -2.66 116.94 120.79 3gue h PHE 291 Ca 0.09 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.60 3gue h PHE 291 Cb 0.47 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.07 3gue h PHE 291 CO 0.04 0.19 0.00 1.04 -2.23 0.00 0.00 178.31 177.35 3gue n GLN 292 N -4.47 2.28 -2.55 1.11 1.13 -0.53 -4.80 117.38 109.55 3gue n GLN 292 Ca 0.11 -1.95 -0.42 0.00 -1.94 0.00 0.00 57.00 52.80 3gue n GLN 292 Cb 0.43 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 29.28 3gue n GLN 292 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 3gue s ASN 293 N -1.41 6.36 0.04 1.08 3.84 -0.88 -4.88 114.94 119.09 3gue s ASN 293 Ca 0.37 0.03 0.28 0.00 0.21 0.00 0.00 52.86 53.75 3gue s ASN 293 Cb 0.21 -2.55 1.00 0.00 -0.55 0.00 0.00 41.25 39.36 3gue s ASN 293 CO 0.29 -1.57 1.79 2.30 -2.79 0.00 0.00 177.10 177.12 3gue n ILE 294 N 6.64 0.12 0.10 -5.21 -5.35 -1.26 -1.58 119.36 112.83 3gue n ILE 294 Ca 0.08 -0.06 -0.19 0.00 -0.27 0.00 0.00 62.75 62.30 3gue n ILE 294 Cb 0.49 -0.38 -0.15 0.00 -1.74 0.00 0.00 39.64 37.86 3gue n ILE 294 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3gue h ALA 295 N 2.89 0.07 0.15 -1.28 0.00 -1.92 -3.28 119.26 115.89 3gue h ALA 295 Ca 0.00 -0.95 -0.01 0.00 0.00 0.00 0.00 54.91 53.95 3gue h ALA 295 Cb 0.55 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3gue h ALA 295 CO 0.00 0.94 -0.07 -0.22 0.00 0.00 0.00 179.25 179.90 3gue h LYS 296 N 0.10 -0.20 -3.34 0.00 3.64 -1.89 -3.38 116.57 111.51 3gue h LYS 296 Ca -0.21 0.01 -0.77 0.00 -1.27 0.00 0.00 60.65 58.41 3gue h LYS 296 Cb 2.05 0.04 -0.31 0.00 -0.41 0.00 0.00 32.23 33.61 3gue h LYS 296 CO 0.21 0.07 0.33 0.72 -2.27 0.00 0.00 179.45 178.51 3gue n HIS 297 N -4.89 4.45 0.85 1.91 8.25 -0.61 -4.69 115.22 120.48 3gue n HIS 297 Ca -0.05 -3.77 0.11 0.00 -0.26 0.00 0.00 57.72 53.76 3gue n HIS 297 Cb 0.18 -1.44 0.29 0.00 1.12 0.00 0.00 29.99 30.14 3gue n HIS 297 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3gue s PHE 299 N -1.69 3.28 -0.14 0.00 0.08 -1.26 -0.98 117.98 117.27 3gue s PHE 299 Ca 0.35 -1.97 -0.03 0.00 0.12 0.00 0.00 56.93 55.39 3gue s PHE 299 Cb 0.20 -2.12 -0.03 0.00 -0.57 0.00 0.00 43.02 40.50 3gue s PHE 299 CO 0.29 -0.82 -0.04 0.12 -0.10 0.00 0.00 175.22 174.67 3gue s PHE 300 N 1.22 3.02 0.04 0.36 5.36 -0.04 -2.14 117.98 125.81 3gue s PHE 300 Ca -0.05 -0.23 -0.30 0.00 -0.96 0.00 0.00 56.93 55.39 3gue s PHE 300 Cb -0.20 -1.92 -0.07 0.00 -0.34 0.00 0.00 43.02 40.50 3gue s PHE 300 CO -0.02 0.04 1.51 1.21 -1.46 0.00 0.00 175.22 176.50 3gue s ASN 301 N 0.14 6.74 0.38 6.13 2.47 -0.27 -0.57 114.94 129.96 3gue s ASN 301 Ca -0.01 2.29 0.23 0.00 0.42 0.00 0.00 52.86 55.79 3gue s ASN 301 Cb -0.14 -2.56 0.28 0.00 -1.45 0.00 0.00 41.25 37.38 3gue s ASN 301 CO 0.03 -0.79 1.49 0.71 -3.72 0.00 0.00 177.10 174.82 3gue h THR 302 N 4.82 0.00 -0.34 -5.21 1.35 -1.79 -3.43 112.91 108.31 3gue h THR 302 Ca -0.40 -0.98 -0.14 0.00 -0.55 0.00 0.00 66.41 64.34 3gue h THR 302 Cb 1.19 1.86 -0.06 0.00 -1.73 0.00 0.00 68.15 69.42 3gue h THR 302 CO 0.91 0.00 -0.13 -3.20 -0.25 0.00 0.00 175.52 172.85 3gue n ASN 303 N -2.97 -4.68 -4.54 5.36 5.15 -1.26 -4.74 115.26 107.58 3gue n ASN 303 Ca 0.03 0.18 -0.43 0.00 -0.60 0.00 0.00 54.58 53.76 3gue n ASN 303 Cb 0.53 -2.81 -0.04 0.00 -0.53 0.00 0.00 39.78 36.94 3gue n ASN 303 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3gue s ASN 304 N -2.47 6.35 -0.04 1.20 0.01 -1.26 -4.01 114.94 114.71 3gue s ASN 304 Ca 0.00 -0.26 0.03 0.00 -0.71 0.00 0.00 52.86 51.92 3gue s ASN 304 Cb 0.00 -2.48 0.00 0.00 0.41 0.00 0.00 41.25 39.19 3gue s ASN 304 CO 0.00 -1.35 -0.13 -0.63 -1.51 0.00 0.00 177.10 173.49 3gue s ILE 305 N 4.34 1.10 -0.14 0.60 1.01 0.00 -1.82 121.20 126.30 3gue s ILE 305 Ca 0.34 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 60.44 3gue s ILE 305 Cb -0.11 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.35 3gue s ILE 305 CO 0.20 0.33 -0.02 0.26 0.00 0.00 0.00 174.94 175.72 3gue s TRP 306 N 0.29 3.08 -0.07 3.97 0.52 0.54 -0.50 118.94 126.77 3gue s TRP 306 Ca -0.07 -0.11 0.04 0.00 0.02 0.00 0.00 56.10 55.98 3gue s TRP 306 Cb -0.12 -1.92 0.00 0.00 -1.15 0.00 0.00 33.47 30.28 3gue s TRP 306 CO 0.02 0.13 -0.19 0.42 0.02 0.00 0.00 176.95 177.35 3gue s ILE 307 N -0.00 1.66 -0.32 2.03 -1.09 -0.08 -1.29 121.20 122.10 3gue s ILE 307 Ca 0.02 -0.81 -0.27 0.00 -2.23 0.00 0.00 60.65 57.36 3gue s ILE 307 Cb -0.13 -1.44 0.01 0.00 -1.58 0.00 0.00 42.46 39.32 3gue s ILE 307 CO 0.02 0.47 0.96 0.21 -1.23 0.00 0.00 174.94 175.38 3gue s ASN 308 N 0.24 6.81 0.27 3.58 3.84 0.28 -1.02 114.94 128.95 3gue s ASN 308 Ca -0.11 0.87 0.00 0.00 0.21 0.00 0.00 52.86 53.83 3gue s ASN 308 Cb -0.15 -2.49 0.39 0.00 -0.55 0.00 0.00 41.25 38.45 3gue s ASN 308 CO 0.05 -0.79 1.76 -0.07 -2.79 0.00 0.00 177.10 175.25 3gue h LEU 309 N 9.88 0.64 -0.19 3.21 3.38 -1.32 0.13 115.31 131.04 3gue h LEU 309 Ca -0.22 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 3gue h LEU 309 Cb 1.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 3gue h LEU 309 CO 0.98 0.77 0.01 0.24 0.09 0.00 0.00 178.44 180.52 3gue h MET 310 N 0.61 0.33 -0.16 1.13 2.86 -1.91 0.17 114.93 117.96 3gue h MET 310 Ca 0.11 -0.10 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 3gue h MET 310 Cb 0.51 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 32.09 3gue h MET 310 CO 0.03 0.53 -0.21 0.93 1.06 0.00 0.00 176.91 179.24 3gue h GLU 311 N 0.09 -0.25 -0.44 1.72 4.39 -1.91 -0.74 114.58 117.44 3gue h GLU 311 Ca 0.05 0.02 0.06 0.00 0.34 0.00 0.00 59.36 59.83 3gue h GLU 311 Cb 0.37 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 3gue h GLU 311 CO 0.01 -0.16 0.14 1.25 -1.16 0.00 0.00 179.01 179.08 3gue h LEU 312 N -0.26 0.11 -0.31 1.33 5.85 -0.60 -0.66 115.31 120.77 3gue h LEU 312 Ca 0.11 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.94 3gue h LEU 312 Cb 0.42 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 3gue h LEU 312 CO -0.31 0.10 0.01 0.50 -0.34 0.00 0.00 178.44 178.40 3gue h LYS 313 N 0.29 0.10 -0.00 1.25 3.64 -0.51 -0.61 116.57 120.74 3gue h LYS 313 Ca 0.21 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.60 3gue h LYS 313 Cb 0.23 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 3gue h LYS 313 CO -0.24 0.07 -0.09 0.87 -2.27 0.00 0.00 179.45 177.80 3gue h LYS 314 N 0.11 -0.14 -0.22 1.90 1.57 -0.86 -0.45 116.57 118.48 3gue h LYS 314 Ca 0.15 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.98 3gue h LYS 314 Cb 0.19 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 3gue h LYS 314 CO -0.24 -0.10 -0.04 1.98 -0.57 0.00 0.00 179.45 180.48 3gue h MET 315 N -0.15 0.02 -0.41 3.15 4.05 -1.02 -1.41 114.93 119.15 3gue h MET 315 Ca 0.03 -0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.46 3gue h MET 315 Cb 0.19 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.97 3gue h MET 315 CO -0.09 0.01 0.27 0.52 0.23 0.00 0.00 176.91 177.85 3gue h MET 316 N 0.02 0.54 -0.45 0.39 2.86 -0.98 -1.11 114.93 116.20 3gue h MET 316 Ca 0.10 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.74 3gue h MET 316 Cb 0.15 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 3gue h MET 316 CO -0.21 0.36 0.24 -0.44 1.06 0.00 0.00 176.91 177.92 3gue h ASP 317 N 0.56 0.37 0.86 1.22 3.32 -0.89 -0.19 116.42 121.67 3gue h ASP 317 Ca 0.15 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.10 3gue h ASP 317 Cb -0.06 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 3gue h ASP 317 CO -0.04 0.27 -0.57 1.05 -1.72 0.00 0.00 179.24 178.23 3gue h GLU 318 N 0.49 0.00 -0.32 3.56 4.11 -0.95 -2.76 114.58 118.70 3gue h GLU 318 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.62 3gue h GLU 318 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3gue h GLU 318 CO -0.11 0.57 0.00 1.04 0.07 0.00 0.00 179.01 180.58 3gue n GLN 319 N -3.57 1.95 -4.01 1.06 1.13 -0.45 -4.95 117.38 108.55 3gue n GLN 319 Ca -0.00 -1.46 -0.31 0.00 -1.94 0.00 0.00 57.00 53.29 3gue n GLN 319 Cb 0.64 -1.38 0.00 0.00 0.11 0.00 0.00 30.24 29.61 3gue n GLN 319 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3gue n LEU 320 N 0.67 -2.26 0.00 1.08 4.77 -0.88 -2.09 117.00 118.29 3gue n LEU 320 Ca 0.16 -0.89 0.00 0.00 -0.03 0.00 0.00 56.01 55.25 3gue n LEU 320 Cb 0.38 -2.36 0.00 0.00 -2.33 0.00 0.00 43.42 39.11 3gue n LEU 320 CO 0.12 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 3gue n GLY 321 N -1.62 1.00 3.06 -0.72 0.00 -0.14 -5.00 105.19 101.78 3gue n GLY 321 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 3gue n GLY 321 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gue s VAL 322 N -3.85 3.17 0.36 1.61 1.01 -0.89 -4.85 120.40 116.96 3gue s VAL 322 Ca 0.00 -2.67 -0.24 0.00 0.00 0.00 0.00 61.98 59.07 3gue s VAL 322 Cb 0.00 -3.15 -0.10 0.00 0.00 0.00 0.00 36.38 33.12 3gue s VAL 322 CO 0.00 -0.77 0.95 -0.22 0.00 0.00 0.00 175.10 175.06 3gue s LEU 323 N 0.39 4.20 -0.93 3.92 2.96 -1.26 -4.87 118.68 123.09 3gue s LEU 323 Ca 0.13 1.79 -0.01 0.00 -0.22 0.00 0.00 54.13 55.82 3gue s LEU 323 Cb -0.22 -4.20 0.34 0.00 0.50 0.00 0.00 46.19 42.61 3gue s LEU 323 CO -0.04 -0.17 1.87 0.54 -1.32 0.00 0.00 176.35 177.23 3gue n ARG 324 N 0.14 4.24 -2.32 1.98 5.12 -1.26 -4.98 116.66 119.57 3gue n ARG 324 Ca 0.04 -4.20 -0.40 0.00 -1.93 0.00 0.00 57.85 51.36 3gue n ARG 324 Cb 0.51 -2.38 -0.03 0.00 -1.16 0.00 0.00 32.46 29.40 3gue n ARG 324 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3gue s LEU 325 N -4.19 4.48 0.10 0.55 1.43 -1.26 -4.97 118.68 114.82 3gue s LEU 325 Ca 0.45 2.44 -0.31 0.00 -1.03 0.00 0.00 54.13 55.68 3gue s LEU 325 Cb 0.30 -3.66 -0.07 0.00 0.03 0.00 0.00 46.19 42.79 3gue s LEU 325 CO -0.25 -0.33 1.29 -2.16 0.23 0.00 0.00 176.35 175.13 3gue s PRO 326 N -1.64 4.39 0.27 1.29 0.04 -1.26 -4.98 135.00 133.11 3gue s PRO 326 Ca 0.47 1.93 -0.29 0.00 0.04 0.00 0.00 61.00 63.14 3gue s PRO 326 Cb -0.35 -3.29 -0.09 0.00 0.04 0.00 0.00 34.50 30.81 3gue s PRO 326 CO 0.45 -0.32 1.19 0.54 0.04 0.00 0.00 177.00 178.90 3gue s VAL 327 N 0.92 3.26 -0.16 -0.36 0.11 -1.26 -4.59 120.40 118.32 3gue s VAL 327 Ca 0.61 1.22 -0.03 0.00 -2.93 0.00 0.00 61.98 60.84 3gue s VAL 327 Cb -0.33 -3.77 -0.02 0.00 -1.53 0.00 0.00 36.38 30.72 3gue s VAL 327 CO 0.31 0.27 -0.05 -0.04 -3.33 0.00 0.00 175.10 172.26 3gue s MET 328 N -1.28 3.59 -0.66 1.54 -1.94 0.96 -4.49 119.30 117.02 3gue s MET 328 Ca 0.48 -0.56 -0.16 0.00 -1.71 0.00 0.00 55.69 53.74 3gue s MET 328 Cb -0.35 -2.89 0.15 0.00 2.01 0.00 0.00 34.83 33.75 3gue s MET 328 CO 0.44 0.17 0.66 0.50 -0.01 0.00 0.00 175.02 176.77 3gue s ARG 329 N 0.55 3.21 -0.46 2.03 3.52 -1.25 -1.62 118.95 124.93 3gue s ARG 329 Ca -0.04 -1.85 -0.16 0.00 -0.13 0.00 0.00 55.73 53.55 3gue s ARG 329 Cb -0.15 -4.36 0.06 0.00 -1.56 0.00 0.00 34.95 28.94 3gue s ARG 329 CO 0.03 -1.39 0.41 1.21 -0.81 0.00 0.00 175.30 174.75 3gue s ASN 330 N 3.19 6.15 0.17 -2.12 2.47 -0.76 -4.94 114.94 119.10 3gue s ASN 330 Ca 0.11 -1.17 -0.30 0.00 0.42 0.00 0.00 52.86 51.92 3gue s ASN 330 Cb -0.22 -2.20 -0.08 0.00 -1.45 0.00 0.00 41.25 37.31 3gue s ASN 330 CO -0.00 -0.64 1.15 -2.16 -3.72 0.00 0.00 177.10 171.73 3gue s PRO 331 N 1.80 4.53 0.28 0.43 0.04 -1.26 -1.43 135.00 139.38 3gue s PRO 331 Ca 0.06 1.79 -0.06 0.00 0.04 0.00 0.00 61.00 62.84 3gue s PRO 331 Cb -0.22 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.04 3gue s PRO 331 CO 0.08 -0.04 0.40 0.15 0.04 0.00 0.00 177.00 177.64 3gue s LYS 332 N -0.14 1.64 0.15 4.56 -0.14 0.03 -4.97 119.74 120.87 3gue s LYS 332 Ca 0.52 -1.56 0.03 0.00 -1.36 0.00 0.00 55.97 53.60 3gue s LYS 332 Cb -0.31 0.42 -0.04 0.00 -1.68 0.00 0.00 37.83 36.22 3gue s LYS 332 CO 0.35 -0.66 0.21 0.95 -0.76 0.00 0.00 175.35 175.45 3gue s THR 333 N -3.62 4.95 0.40 2.17 -4.23 -1.26 0.33 115.64 114.38 3gue s THR 333 Ca 0.30 -0.85 0.15 0.00 -1.18 0.00 0.00 61.69 60.11 3gue s THR 333 Cb 0.01 -3.53 0.16 0.00 1.34 0.00 0.00 72.50 70.48 3gue s THR 333 CO 0.15 -0.08 1.93 1.62 -0.54 0.00 0.00 174.62 177.69 3gue h VAL 334 N 1.85 1.11 -3.70 2.29 3.04 -0.75 -3.19 116.25 116.91 3gue h VAL 334 Ca -0.48 -0.91 -0.69 0.00 -1.01 0.00 0.00 66.70 63.61 3gue h VAL 334 Cb 1.19 1.50 -0.30 0.00 -2.01 0.00 0.00 31.29 31.67 3gue h VAL 334 CO 0.66 0.25 -0.63 0.21 -1.01 0.00 0.00 177.57 177.06 3gue s ASN 335 N -6.86 5.19 0.26 3.17 3.84 -1.26 -4.72 114.94 114.56 3gue s ASN 335 Ca -0.03 -1.20 -0.02 0.00 0.21 0.00 0.00 52.86 51.82 3gue s ASN 335 Cb 0.15 -1.82 0.51 0.00 -0.55 0.00 0.00 41.25 39.54 3gue s ASN 335 CO 0.69 -0.31 1.77 1.55 -2.79 0.00 0.00 177.10 178.01 3gue h PRO 336 N 8.15 0.63 0.00 0.43 0.13 -1.91 -1.70 132.00 137.74 3gue h PRO 336 Ca -0.22 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3gue h PRO 336 Cb 1.07 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.06 3gue h PRO 336 CO 0.58 0.42 0.00 1.04 -0.23 0.00 0.00 178.00 179.81 3gue n GLN 337 N -4.85 0.26 -3.88 0.86 6.02 -1.26 -4.43 117.38 110.10 3gue n GLN 337 Ca 0.16 0.10 -0.30 0.00 -0.01 0.00 0.00 57.00 56.96 3gue n GLN 337 Cb 0.41 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 30.01 3gue n GLN 337 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3gue s ASP 338 N -2.62 3.89 0.16 1.08 3.68 -0.64 -5.02 116.67 117.21 3gue s ASP 338 Ca 0.18 -1.36 0.19 0.00 2.13 0.00 0.00 52.55 53.69 3gue s ASP 338 Cb 0.13 -1.10 0.82 0.00 -1.45 0.00 0.00 42.92 41.33 3gue s ASP 338 CO 0.31 -0.30 1.58 -1.54 0.13 0.00 0.00 175.17 175.35 3gue n SER 339 N 4.70 0.39 -1.20 -0.34 3.41 -1.26 -2.35 113.62 116.98 3gue n SER 339 Ca -0.07 0.61 0.10 0.00 -0.26 0.00 0.00 58.87 59.24 3gue n SER 339 Cb 0.44 -0.69 0.28 0.00 -0.26 0.00 0.00 64.21 63.98 3gue n SER 339 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gue n GLN 340 N -1.95 2.88 -1.90 4.33 1.13 -1.26 -4.97 117.38 115.65 3gue n GLN 340 Ca 0.02 -2.54 -0.30 0.00 -1.94 0.00 0.00 57.00 52.24 3gue n GLN 340 Cb 0.18 -1.54 0.04 0.00 0.11 0.00 0.00 30.24 29.04 3gue n GLN 340 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 3gue s SER 341 N -1.01 5.47 0.09 1.08 1.04 -0.99 -4.98 113.70 114.41 3gue s SER 341 Ca 0.43 1.12 -0.36 0.00 0.48 0.00 0.00 55.95 57.62 3gue s SER 341 Cb 0.23 -1.93 -0.17 0.00 0.10 0.00 0.00 66.02 64.25 3gue s SER 341 CO 0.28 -1.32 1.22 0.41 0.98 0.00 0.00 173.24 174.80 3gue n THR 342 N -2.98 0.28 -2.61 2.02 -1.04 -1.26 -4.47 114.28 104.21 3gue n THR 342 Ca 0.07 -0.07 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 3gue n THR 342 Cb 0.57 -0.63 -0.03 0.00 -1.82 0.00 0.00 70.33 68.42 3gue n THR 342 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3gue s LYS 343 N 0.13 4.45 0.24 -2.82 1.02 -1.26 -0.13 119.74 121.37 3gue s LYS 343 Ca 0.82 1.51 0.04 0.00 0.02 0.00 0.00 55.97 58.37 3gue s LYS 343 Cb -0.99 -3.49 -0.05 0.00 -0.52 0.00 0.00 37.83 32.77 3gue s LYS 343 CO 0.50 -0.25 -0.03 0.14 -0.92 0.00 0.00 175.35 174.80 3gue s VAL 344 N 1.61 1.20 -0.02 3.17 -7.23 0.15 -2.04 120.40 117.24 3gue s VAL 344 Ca 0.52 -2.06 0.04 0.00 -1.81 0.00 0.00 61.98 58.67 3gue s VAL 344 Cb -0.22 -2.32 -0.03 0.00 0.56 0.00 0.00 36.38 34.37 3gue s VAL 344 CO 0.23 -0.36 -0.13 -0.31 -0.31 0.00 0.00 175.10 174.23 3gue s TYR 345 N -3.31 2.73 -0.23 2.82 2.02 0.25 -0.79 117.35 120.85 3gue s TYR 345 Ca 0.28 -0.14 -0.07 0.00 -0.37 0.00 0.00 57.07 56.77 3gue s TYR 345 Cb 0.05 -1.60 -0.03 0.00 -0.40 0.00 0.00 41.96 39.98 3gue s TYR 345 CO 0.09 0.25 0.05 -0.65 -1.57 0.00 0.00 175.55 173.72 3gue s GLN 346 N -1.03 3.66 -0.29 -0.62 -0.21 -0.52 -1.76 119.66 118.89 3gue s GLN 346 Ca 0.13 -0.48 -0.21 0.00 0.02 0.00 0.00 55.36 54.82 3gue s GLN 346 Cb -0.11 -3.24 -0.01 0.00 1.00 0.00 0.00 33.01 30.65 3gue s GLN 346 CO 0.03 -0.10 0.69 -0.51 -2.12 0.00 0.00 175.29 173.27 3gue s LEU 347 N 1.36 4.11 0.09 2.90 1.02 -1.26 -1.82 118.68 125.08 3gue s LEU 347 Ca 0.05 0.58 0.06 0.00 0.02 0.00 0.00 54.13 54.84 3gue s LEU 347 Cb -0.15 -2.92 -0.03 0.00 0.02 0.00 0.00 46.19 43.11 3gue s LEU 347 CO 0.03 -0.50 -0.15 -1.61 0.02 0.00 0.00 176.35 174.14 3gue s GLU 348 N 2.70 0.91 0.22 1.70 2.02 -0.64 -4.63 118.70 120.98 3gue s GLU 348 Ca 0.28 -1.06 0.11 0.00 0.02 0.00 0.00 54.97 54.32 3gue s GLU 348 Cb -0.15 -0.91 -0.05 0.00 0.10 0.00 0.00 34.13 33.12 3gue s GLU 348 CO 0.11 0.20 -0.20 0.14 0.02 0.00 0.00 175.26 175.52 3gue s VAL 349 N -1.51 2.22 -0.05 2.63 -7.23 -0.38 -0.03 120.40 116.06 3gue s VAL 349 Ca 0.02 -2.17 0.05 0.00 -1.81 0.00 0.00 61.98 58.07 3gue s VAL 349 Cb -0.09 -2.13 -0.02 0.00 0.56 0.00 0.00 36.38 34.71 3gue s VAL 349 CO 0.03 -0.32 -0.20 0.00 -0.31 0.00 0.00 175.10 174.30 3gue s ALA 350 N -2.21 2.39 0.27 1.32 0.00 -1.26 -1.18 121.76 121.10 3gue s ALA 350 Ca 0.23 -1.03 0.27 0.00 0.00 0.00 0.00 51.96 51.43 3gue s ALA 350 Cb -0.06 -0.79 1.26 0.00 0.00 0.00 0.00 23.12 23.53 3gue s ALA 350 CO 0.11 0.49 1.97 0.00 0.00 0.00 0.00 175.76 178.33 3gue h MET 351 N 5.65 0.00 0.00 0.00 -0.00 -1.85 -2.26 114.93 116.47 3gue h MET 351 Ca -0.41 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.29 3gue h MET 351 Cb 1.15 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.75 3gue h MET 351 CO 0.49 0.15 -0.03 0.78 -0.00 0.00 0.00 176.91 178.29 3gue h GLY 352 N 1.47 0.00 2.00 -3.00 0.00 -1.95 -2.98 103.07 98.60 3gue h GLY 352 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3gue h GLY 352 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.56 3gue n ALA 353 N -2.11 1.65 0.51 3.60 0.00 -0.85 -1.83 120.51 121.49 3gue n ALA 353 Ca 0.02 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.48 3gue n ALA 353 Cb 0.41 -1.25 0.29 0.00 0.00 0.00 0.00 19.45 18.90 3gue n ALA 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gue n ALA 354 N -1.53 1.66 0.07 0.00 0.00 -1.13 -3.49 120.51 116.10 3gue n ALA 354 Ca 0.03 -0.05 0.15 0.00 0.00 0.00 0.00 53.44 53.57 3gue n ALA 354 Cb 0.17 -1.20 0.64 0.00 0.00 0.00 0.00 19.45 19.07 3gue n ALA 354 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3gue h ILE 355 N 0.00 0.85 0.00 0.00 2.10 -1.61 -0.74 117.51 118.11 3gue h ILE 355 Ca 0.00 -0.02 0.00 0.00 1.08 0.00 0.00 64.86 65.92 3gue h ILE 355 Cb 0.16 0.78 0.00 0.00 -1.09 0.00 0.00 36.82 36.67 3gue h ILE 355 CO 0.00 0.01 -0.59 -1.20 -1.08 0.00 0.00 178.15 175.29 3gue n SER 356 N -4.45 0.63 -0.09 2.19 7.64 -1.23 -4.32 113.62 114.00 3gue n SER 356 Ca 0.05 0.05 -0.09 0.00 1.01 0.00 0.00 58.87 59.89 3gue n SER 356 Cb 0.39 0.17 -0.16 0.00 -1.01 0.00 0.00 64.21 63.61 3gue n SER 356 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3gue n LEU 357 N -1.96 0.09 -4.75 -3.43 4.77 -0.31 -4.89 117.00 106.51 3gue n LEU 357 Ca 0.04 0.04 -0.40 0.00 -0.03 0.00 0.00 56.01 55.65 3gue n LEU 357 Cb 0.41 0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 41.90 3gue n LEU 357 CO 0.36 0.46 0.79 -0.36 -1.33 0.00 0.00 177.39 177.30 3gue s PHE 358 N -2.56 3.61 0.22 -1.77 0.08 -1.03 -4.94 117.98 111.60 3gue s PHE 358 Ca -0.09 1.68 -0.09 0.00 0.12 0.00 0.00 56.93 58.55 3gue s PHE 358 Cb 0.07 -3.26 0.34 0.00 -0.57 0.00 0.00 43.02 39.60 3gue s PHE 358 CO 0.83 -0.51 1.68 -0.44 -0.10 0.00 0.00 175.22 176.69 3gue h ASP 359 N 4.25 -0.10 -3.69 1.36 3.32 -1.93 -3.37 116.42 116.25 3gue h ASP 359 Ca -0.46 0.14 -0.64 0.00 0.02 0.00 0.00 57.03 56.09 3gue h ASP 359 Cb 1.21 0.21 -0.38 0.00 0.22 0.00 0.00 39.33 40.59 3gue h ASP 359 CO 0.69 -0.05 -0.77 -0.13 -1.72 0.00 0.00 179.24 177.26 3gue s ARG 360 N -6.10 1.71 -0.03 3.56 0.52 -1.26 -5.03 118.95 112.32 3gue s ARG 360 Ca -0.13 -1.38 0.05 0.00 -0.52 0.00 0.00 55.73 53.75 3gue s ARG 360 Cb 0.19 -2.82 -0.01 0.00 0.52 0.00 0.00 34.95 32.83 3gue s ARG 360 CO 0.74 -0.72 -0.18 -1.12 0.02 0.00 0.00 175.30 174.04 3gue s SER 361 N 1.17 2.18 0.09 0.23 0.01 -1.26 -0.03 113.70 116.09 3gue s SER 361 Ca -0.01 -0.34 0.03 0.00 1.31 0.00 0.00 55.95 56.94 3gue s SER 361 Cb -0.19 -0.38 -0.04 0.00 0.21 0.00 0.00 66.02 65.63 3gue s SER 361 CO -0.08 0.20 -0.10 -1.61 0.41 0.00 0.00 173.24 172.07 3gue s GLU 362 N -0.26 0.82 -0.06 12.44 2.02 -0.52 -5.00 118.70 128.15 3gue s GLU 362 Ca 0.03 -1.15 0.03 0.00 0.02 0.00 0.00 54.97 53.90 3gue s GLU 362 Cb -0.09 -0.48 -0.03 0.00 0.10 0.00 0.00 34.13 33.64 3gue s GLU 362 CO 0.00 0.07 -0.14 0.00 0.02 0.00 0.00 175.26 175.22 3gue s ALA 363 N -2.50 2.69 -0.01 5.21 0.00 -1.26 -0.94 121.76 124.95 3gue s ALA 363 Ca 0.05 -0.96 0.03 0.00 0.00 0.00 0.00 51.96 51.08 3gue s ALA 363 Cb -0.02 -1.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.08 3gue s ALA 363 CO -0.00 0.53 -0.10 0.54 0.00 0.00 0.00 175.76 176.72 3gue s VAL 364 N -0.64 0.79 -0.07 0.00 0.11 -0.19 -4.40 120.40 116.00 3gue s VAL 364 Ca 0.09 -0.43 -0.24 0.00 -2.93 0.00 0.00 61.98 58.47 3gue s VAL 364 Cb -0.11 -0.67 -0.03 0.00 -1.53 0.00 0.00 36.38 34.04 3gue s VAL 364 CO 0.01 0.22 0.74 -0.69 -3.33 0.00 0.00 175.10 172.05 3gue s VAL 365 N -0.23 5.02 0.14 2.04 1.01 -0.39 -0.53 120.40 127.45 3gue s VAL 365 Ca 0.04 1.52 0.10 0.00 0.00 0.00 0.00 61.98 63.64 3gue s VAL 365 Cb -0.04 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 3gue s VAL 365 CO -0.00 0.23 -0.24 0.68 0.00 0.00 0.00 175.10 175.76 3gue s VAL 366 N 0.93 2.13 0.54 2.92 -7.23 -0.31 -0.43 120.40 118.95 3gue s VAL 366 Ca 0.39 -1.80 -0.21 0.00 -1.81 0.00 0.00 61.98 58.56 3gue s VAL 366 Cb -0.18 -1.93 -0.06 0.00 0.56 0.00 0.00 36.38 34.77 3gue s VAL 366 CO 0.19 -0.03 1.08 -2.65 -0.31 0.00 0.00 175.10 173.38 3gue n PRO 367 N 0.74 1.23 -0.64 4.82 -0.02 -1.26 -4.55 135.00 135.31 3gue n PRO 367 Ca -0.17 0.46 0.50 0.00 -2.02 0.00 0.00 63.50 62.27 3gue n PRO 367 Cb 0.54 -2.25 0.81 0.00 -0.02 0.00 0.00 33.50 32.58 3gue n PRO 367 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gue h ARG 368 N 1.00 0.00 -0.00 -0.52 2.47 -1.91 -2.09 114.38 113.33 3gue h ARG 368 Ca -0.48 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.24 3gue h ARG 368 Cb 1.34 -0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.66 3gue h ARG 368 CO 0.54 0.00 0.12 1.05 0.56 0.00 0.00 179.97 182.24 3gue h GLU 369 N 0.00 0.00 -0.46 0.04 4.11 -1.95 -1.34 114.58 114.98 3gue h GLU 369 Ca 0.88 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.31 3gue h GLU 369 Cb 3.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 32.73 3gue h GLU 369 CO -0.04 0.00 0.00 0.54 0.07 0.00 0.00 179.01 179.58 3gue n ARG 370 N -3.02 2.13 -3.31 1.06 1.74 -0.79 -4.57 116.66 109.90 3gue n ARG 370 Ca -0.03 -1.53 -0.08 0.00 -0.77 0.00 0.00 57.85 55.45 3gue n ARG 370 Cb 0.18 -1.41 -0.06 0.00 -1.02 0.00 0.00 32.46 30.15 3gue n ARG 370 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3gue s PHE 371 N -1.52 -0.98 -0.45 -1.55 5.36 -0.50 -3.72 117.98 114.62 3gue s PHE 371 Ca 0.28 0.76 0.07 0.00 -0.96 0.00 0.00 56.93 57.08 3gue s PHE 371 Cb 0.16 0.02 0.24 0.00 -0.34 0.00 0.00 43.02 43.10 3gue s PHE 371 CO 0.17 -0.83 0.54 0.00 -1.46 0.00 0.00 175.22 173.64 3gue n ALA 372 N 5.37 2.80 -1.79 11.12 0.00 -1.26 -4.93 120.51 131.82 3gue n ALA 372 Ca -0.02 -3.64 -0.35 0.00 0.00 0.00 0.00 53.44 49.44 3gue n ALA 372 Cb 0.50 -0.83 -0.03 0.00 0.00 0.00 0.00 19.45 19.10 3gue n ALA 372 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3gue s PRO 373 N -1.26 3.75 -0.39 0.00 0.04 -1.26 -4.13 135.00 131.75 3gue s PRO 373 Ca 0.35 1.45 0.01 0.00 0.04 0.00 0.00 61.00 62.85 3gue s PRO 373 Cb 0.14 -2.15 0.13 0.00 0.04 0.00 0.00 34.50 32.67 3gue s PRO 373 CO -0.11 -0.48 0.20 0.08 0.04 0.00 0.00 177.00 176.73 3gue s VAL 374 N -1.88 0.97 -0.13 -0.36 1.01 -1.26 -4.79 120.40 113.97 3gue s VAL 374 Ca 0.67 -2.10 0.16 0.00 0.00 0.00 0.00 61.98 60.71 3gue s VAL 374 Cb -0.19 -1.70 -0.24 0.00 0.00 0.00 0.00 36.38 34.25 3gue s VAL 374 CO 0.23 -0.87 0.37 0.29 0.00 0.00 0.00 175.10 175.11 3gue n LYS 375 N 3.94 0.66 -4.27 2.72 4.76 -1.26 -4.90 118.16 119.81 3gue n LYS 375 Ca 0.07 0.12 -0.15 0.00 -2.87 0.00 0.00 58.31 55.49 3gue n LYS 375 Cb 0.37 -1.65 -0.10 0.00 -1.84 0.00 0.00 35.03 31.81 3gue n LYS 375 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3gue s THR 376 N -2.59 0.68 0.56 -0.18 -4.23 -1.26 -4.72 115.64 103.90 3gue s THR 376 Ca -0.07 -1.99 0.23 0.00 -1.18 0.00 0.00 61.69 58.68 3gue s THR 376 Cb 0.07 -2.29 0.32 0.00 1.34 0.00 0.00 72.50 71.94 3gue s THR 376 CO 0.83 -0.32 2.19 0.00 -0.54 0.00 0.00 174.62 176.77 3gue h SER 378 N 0.00 0.51 -0.71 0.00 0.02 -1.93 0.14 113.55 111.58 3gue h SER 378 Ca 0.02 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 3gue h SER 378 Cb 0.09 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 3gue h SER 378 CO -0.00 0.51 0.41 0.44 -1.14 0.00 0.00 176.83 177.05 3gue h ASP 379 N 0.47 0.88 -0.42 3.07 3.32 -1.61 -2.85 116.42 119.28 3gue h ASP 379 Ca 0.13 -0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 3gue h ASP 379 Cb 0.15 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 3gue h ASP 379 CO -0.01 0.70 -0.07 0.25 -1.72 0.00 0.00 179.24 178.38 3gue h LEU 380 N 1.01 0.80 -0.84 1.55 5.85 -0.64 -1.47 115.31 121.56 3gue h LEU 380 Ca 0.26 -0.35 0.09 0.00 0.84 0.00 0.00 57.88 58.72 3gue h LEU 380 Cb -0.00 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 40.74 3gue h LEU 380 CO -0.04 0.96 0.50 0.25 -0.34 0.00 0.00 178.44 179.77 3gue h LEU 381 N 0.63 0.74 -0.13 2.25 5.85 -0.62 -0.24 115.31 123.78 3gue h LEU 381 Ca 0.11 0.04 -0.21 0.00 0.84 0.00 0.00 57.88 58.66 3gue h LEU 381 Cb 0.60 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 41.53 3gue h LEU 381 CO 0.04 0.43 -0.75 0.00 -0.34 0.00 0.00 178.44 177.82 3gue h ALA 382 N 1.45 0.27 -0.60 1.25 0.00 -1.25 -1.51 119.26 118.87 3gue h ALA 382 Ca 0.40 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 3gue h ALA 382 Cb 0.32 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3gue h ALA 382 CO -0.23 0.62 0.09 1.25 0.00 0.00 0.00 179.25 180.99 3gue h LEU 383 N 0.45 0.92 -0.92 0.00 5.85 -1.04 -2.62 115.31 117.94 3gue h LEU 383 Ca -0.06 -0.20 -0.10 0.00 0.84 0.00 0.00 57.88 58.36 3gue h LEU 383 Cb 1.38 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 3gue h LEU 383 CO 0.15 0.92 -0.46 0.03 -0.34 0.00 0.00 178.44 178.75 3gue h ARG 384 N 0.91 0.00 -7.66 1.25 3.08 -1.02 -3.42 114.38 107.51 3gue h ARG 384 Ca 0.18 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.78 3gue h ARG 384 Cb 0.40 0.00 0.13 0.00 0.08 0.00 0.00 29.97 30.58 3gue h ARG 384 CO 0.01 0.46 0.39 -1.54 -1.07 0.00 0.00 179.97 178.22 3gue s SER 385 N -6.63 3.75 0.00 7.04 1.04 -0.57 -4.90 113.70 113.43 3gue s SER 385 Ca -0.01 0.62 0.02 0.00 0.48 0.00 0.00 55.95 57.06 3gue s SER 385 Cb 0.12 -0.96 0.10 0.00 0.10 0.00 0.00 66.02 65.37 3gue s SER 385 CO 0.72 -2.37 0.96 -0.90 0.98 0.00 0.00 173.24 172.63 3gue n ASP 386 N -3.59 0.00 0.18 7.02 5.68 -1.26 -3.03 116.55 121.55 3gue n ASP 386 Ca 0.10 -1.74 0.14 0.00 -0.50 0.00 0.00 54.79 52.79 3gue n ASP 386 Cb 0.60 0.00 0.55 0.00 -1.14 0.00 0.00 41.12 41.14 3gue n ASP 386 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3gue h ALA 387 N 2.85 1.00 -4.04 2.12 0.00 -1.83 -3.40 119.26 115.97 3gue h ALA 387 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 3gue h ALA 387 Cb 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 17.48 3gue h ALA 387 CO 0.00 0.00 -0.86 0.71 0.00 0.00 0.00 179.25 179.10 3gue s TYR 388 N -3.42 1.98 -0.07 0.00 2.02 -1.17 -1.08 117.35 115.60 3gue s TYR 388 Ca 0.03 -0.54 0.00 0.00 -0.37 0.00 0.00 57.07 56.19 3gue s TYR 388 Cb 0.09 -1.31 -0.03 0.00 -0.40 0.00 0.00 41.96 40.31 3gue s TYR 388 CO 0.44 -0.16 -0.05 -1.14 -1.57 0.00 0.00 175.55 173.07 3gue s GLN 389 N -0.12 2.79 -0.00 -0.62 0.74 0.23 -4.90 119.66 117.78 3gue s GLN 389 Ca -0.02 -0.52 -0.30 0.00 0.05 0.00 0.00 55.36 54.57 3gue s GLN 389 Cb -0.12 -2.63 -0.04 0.00 1.10 0.00 0.00 33.01 31.32 3gue s GLN 389 CO 0.02 0.67 1.17 0.08 -0.55 0.00 0.00 175.29 176.68 3gue s VAL 390 N -0.83 4.25 0.70 1.34 1.01 -1.26 -0.99 120.40 124.61 3gue s VAL 390 Ca 0.13 1.59 -0.04 0.00 0.00 0.00 0.00 61.98 63.66 3gue s VAL 390 Cb -0.11 -4.02 0.09 0.00 0.00 0.00 0.00 36.38 32.33 3gue s VAL 390 CO 0.02 0.06 0.98 0.42 0.00 0.00 0.00 175.10 176.58 3gue s THR 391 N 1.61 2.30 0.32 3.92 -4.23 0.14 -4.95 115.64 114.75 3gue s THR 391 Ca 0.56 -0.42 0.01 0.00 -1.18 0.00 0.00 61.69 60.67 3gue s THR 391 Cb -0.26 -2.88 0.27 0.00 1.34 0.00 0.00 72.50 70.97 3gue s THR 391 CO 0.26 0.00 1.96 -0.33 -0.54 0.00 0.00 174.62 175.96 3gue h GLU 392 N -0.53 0.95 -0.90 3.99 3.07 -1.98 -1.95 114.58 117.24 3gue h GLU 392 Ca -0.42 -0.06 -0.18 0.00 -0.50 0.00 0.00 59.36 58.21 3gue h GLU 392 Cb 1.29 -0.21 -0.11 0.00 -0.84 0.00 0.00 28.75 28.88 3gue h GLU 392 CO 0.51 0.63 0.23 -0.40 -1.40 0.00 0.00 179.01 178.58 3gue n ASP 393 N -4.45 3.61 -1.13 1.42 5.75 -1.26 -4.89 116.55 115.60 3gue n ASP 393 Ca 0.11 -2.79 -0.15 0.00 -0.01 0.00 0.00 54.79 51.95 3gue n ASP 393 Cb 0.12 -0.66 -0.06 0.00 -1.03 0.00 0.00 41.12 39.49 3gue n ASP 393 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3gue n GLN 394 N -0.12 -1.04 -2.54 0.11 1.13 -0.73 -4.57 117.38 109.61 3gue n GLN 394 Ca 0.28 1.02 -0.29 0.00 -1.94 0.00 0.00 57.00 56.06 3gue n GLN 394 Cb 1.04 -5.15 -0.01 0.00 0.11 0.00 0.00 30.24 26.23 3gue n GLN 394 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3gue s ARG 395 N -3.24 3.65 -0.23 -1.09 0.52 -1.26 -4.63 118.95 112.67 3gue s ARG 395 Ca 0.00 0.44 -0.08 0.00 -0.52 0.00 0.00 55.73 55.57 3gue s ARG 395 Cb 0.00 -2.31 -0.03 0.00 0.52 0.00 0.00 34.95 33.13 3gue s ARG 395 CO 0.00 -0.23 0.08 -0.51 0.02 0.00 0.00 175.30 174.66 3gue s LEU 396 N -4.51 3.60 0.04 2.53 1.02 -1.13 0.27 118.68 120.50 3gue s LEU 396 Ca 0.51 -0.10 0.04 0.00 0.02 0.00 0.00 54.13 54.61 3gue s LEU 396 Cb -0.10 -1.95 -0.02 0.00 0.02 0.00 0.00 46.19 44.14 3gue s LEU 396 CO 0.42 0.04 -0.13 0.68 0.02 0.00 0.00 176.35 177.37 3gue s VAL 397 N 1.19 1.01 0.38 -1.59 -7.23 -0.17 -3.91 120.40 110.08 3gue s VAL 397 Ca 0.05 -0.95 -0.27 0.00 -1.81 0.00 0.00 61.98 58.99 3gue s VAL 397 Cb -0.14 -0.92 -0.11 0.00 0.56 0.00 0.00 36.38 35.76 3gue s VAL 397 CO 0.04 -0.03 1.32 -0.11 -0.31 0.00 0.00 175.10 176.01 3gue n LEU 398 N 1.93 3.97 -4.72 1.32 7.94 -1.26 -0.60 117.00 125.58 3gue n LEU 398 Ca -0.18 1.17 -0.33 0.00 -1.11 0.00 0.00 56.01 55.56 3gue n LEU 398 Cb 0.55 -1.52 0.11 0.00 0.53 0.00 0.00 43.42 43.09 3gue n LEU 398 CO 0.23 -0.43 0.77 0.00 -1.11 0.00 0.00 177.39 176.85 3gue h GLU 400 N -0.63 0.53 0.00 0.00 5.08 -1.92 -3.11 114.58 114.54 3gue h GLU 400 Ca -0.47 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 3gue h GLU 400 Cb 1.29 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3gue h GLU 400 CO 0.48 0.49 0.00 1.05 -1.00 0.00 0.00 179.01 180.04 3gue h GLU 401 N 0.52 0.00 0.00 2.33 4.11 -1.93 -1.14 114.58 118.47 3gue h GLU 401 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.55 3gue h GLU 401 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3gue h GLU 401 CO -0.00 0.00 -0.12 0.54 0.07 0.00 0.00 179.01 179.49 3gue n ARG 402 N -3.01 0.03 0.00 1.06 5.12 -1.17 -5.01 116.66 113.67 3gue n ARG 402 Ca 0.03 0.02 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 3gue n ARG 402 Cb 0.46 -1.53 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 3gue n ARG 402 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 3gue n ASN 403 N -1.57 0.00 0.00 0.55 3.02 -0.43 -2.83 115.26 113.99 3gue n ASN 403 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 3gue n ASN 403 Cb 0.35 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 3gue n ASN 403 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gue n GLY 404 N 0.00 1.83 3.34 7.41 0.00 -1.26 -4.74 105.19 111.78 3gue n GLY 404 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3gue n GLY 404 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gue s LYS 405 N -0.79 3.00 0.81 1.61 1.02 -1.13 -4.90 119.74 119.37 3gue s LYS 405 Ca 0.00 -0.93 -0.12 0.00 0.02 0.00 0.00 55.97 54.94 3gue s LYS 405 Cb 0.00 -3.45 0.09 0.00 -0.52 0.00 0.00 37.83 33.95 3gue s LYS 405 CO 0.00 -0.51 1.17 -2.14 -0.92 0.00 0.00 175.35 172.95 3gue s PRO 406 N 1.50 1.68 0.35 -1.68 0.02 -1.26 -4.80 135.00 130.82 3gue s PRO 406 Ca 0.02 1.59 -0.29 0.00 0.02 0.00 0.00 61.00 62.35 3gue s PRO 406 Cb -0.18 -1.80 -0.11 0.00 0.02 0.00 0.00 34.50 32.43 3gue s PRO 406 CO 0.03 -2.15 1.50 -2.30 -0.33 0.00 0.00 177.00 173.75 3gue n PRO 407 N -3.46 2.63 -2.74 5.54 -0.02 -1.26 -4.83 135.00 130.87 3gue n PRO 407 Ca 0.12 0.93 -0.42 0.00 -2.02 0.00 0.00 63.50 62.10 3gue n PRO 407 Cb 0.51 -2.66 -0.04 0.00 -0.02 0.00 0.00 33.50 31.30 3gue n PRO 407 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gue s ALA 408 N -0.85 3.00 -0.26 3.55 0.00 0.08 -4.84 121.76 122.44 3gue s ALA 408 Ca 0.56 -1.49 -0.07 0.00 0.00 0.00 0.00 51.96 50.96 3gue s ALA 408 Cb -0.49 -3.97 -0.01 0.00 0.00 0.00 0.00 23.12 18.64 3gue s ALA 408 CO 0.60 -2.85 0.07 0.42 0.00 0.00 0.00 175.76 174.00 3gue s ILE 409 N 4.63 4.12 -0.25 0.00 1.01 -1.26 0.11 121.20 129.56 3gue s ILE 409 Ca 0.29 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 3gue s ILE 409 Cb -0.12 -2.99 0.03 0.00 0.01 0.00 0.00 42.46 39.38 3gue s ILE 409 CO 0.15 0.25 -0.05 -0.62 0.00 0.00 0.00 174.94 174.67 3gue s ASP 410 N 1.57 4.40 -0.14 3.58 2.15 0.10 -4.92 116.67 123.40 3gue s ASP 410 Ca 0.05 -0.91 -0.03 0.00 0.43 0.00 0.00 52.55 52.09 3gue s ASP 410 Cb -0.16 -1.67 -0.03 0.00 -0.30 0.00 0.00 42.92 40.76 3gue s ASP 410 CO 0.03 -0.14 -0.05 -0.76 -0.17 0.00 0.00 175.17 174.07 3gue s LEU 411 N 1.32 3.17 -0.08 -1.34 1.02 -1.26 -1.29 118.68 120.22 3gue s LEU 411 Ca -0.00 -0.14 -0.41 0.00 0.02 0.00 0.00 54.13 53.60 3gue s LEU 411 Cb -0.17 -1.75 -0.19 0.00 0.02 0.00 0.00 46.19 44.10 3gue s LEU 411 CO -0.04 0.20 1.23 -0.67 0.02 0.00 0.00 176.35 177.09 3gue n ASP 412 N 3.35 0.56 0.20 2.29 -0.08 -0.26 -4.85 116.55 117.76 3gue n ASP 412 Ca -0.18 1.15 0.08 0.00 -1.51 0.00 0.00 54.79 54.34 3gue n ASP 412 Cb 0.53 -0.97 0.32 0.00 2.34 0.00 0.00 41.12 43.33 3gue n ASP 412 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 3gue h GLY 413 N 3.76 0.00 2.00 0.27 0.00 -1.95 -2.23 103.07 104.92 3gue h GLY 413 Ca -0.49 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 3gue h GLY 413 CO 0.74 0.00 -0.16 0.83 0.00 0.00 0.00 176.54 177.95 3gue h GLU 414 N 0.00 0.00 0.00 4.80 4.39 -1.99 -3.34 114.58 118.43 3gue h GLU 414 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3gue h GLU 414 Cb 0.94 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.59 3gue h GLU 414 CO 0.04 0.16 -0.80 0.72 -1.16 0.00 0.00 179.01 177.96 3gue n HIS 415 N -3.33 0.00 -0.38 4.33 8.25 -1.18 -4.87 115.22 118.05 3gue n HIS 415 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.48 3gue n HIS 415 Cb 0.39 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.53 3gue n HIS 415 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3gue n TYR 416 N -1.50 0.00 -0.03 4.41 4.01 -0.85 -4.03 117.16 119.17 3gue n TYR 416 Ca 0.00 -0.56 -0.15 0.00 -0.16 0.00 0.00 57.90 57.04 3gue n TYR 416 Cb 0.23 -0.07 -0.10 0.00 -0.31 0.00 0.00 39.34 39.09 3gue n TYR 416 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3gue h LYS 417 N 0.00 0.19 -6.65 -0.72 3.64 -1.72 -3.41 116.57 107.90 3gue h LYS 417 Ca 0.00 -0.16 -0.51 0.00 -1.27 0.00 0.00 60.65 58.71 3gue h LYS 417 Cb 0.68 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 3gue h LYS 417 CO 0.00 0.84 0.40 -1.64 -2.27 0.00 0.00 179.45 176.78 3gue s MET 418 N -3.47 4.70 0.30 1.90 -1.94 -1.26 -4.13 119.30 115.40 3gue s MET 418 Ca -0.16 1.56 0.05 0.00 -1.71 0.00 0.00 55.69 55.44 3gue s MET 418 Cb 0.02 -3.32 0.73 0.00 2.01 0.00 0.00 34.83 34.27 3gue s MET 418 CO 0.74 0.23 1.76 0.97 -0.01 0.00 0.00 175.02 178.70 3gue h ILE 419 N 3.71 0.65 -0.55 2.53 6.09 -1.04 -0.45 117.51 128.45 3gue h ILE 419 Ca -0.44 -0.23 0.06 0.00 -1.37 0.00 0.00 64.86 62.88 3gue h ILE 419 Cb 1.21 -0.08 -0.03 0.00 0.47 0.00 0.00 36.82 38.39 3gue h ILE 419 CO 0.71 0.12 0.36 -0.78 -3.07 0.00 0.00 178.15 175.50 3gue h ASP 420 N 0.67 0.46 0.61 2.19 3.58 -1.88 -0.74 116.42 121.31 3gue h ASP 420 Ca 0.57 -0.00 -0.26 0.00 0.42 0.00 0.00 57.03 57.77 3gue h ASP 420 Cb 0.94 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.89 3gue h ASP 420 CO -0.41 0.30 -1.15 1.23 -2.88 0.00 0.00 179.24 176.33 3gue h GLY 421 N 0.53 0.30 1.19 -0.78 0.00 -1.26 -3.37 103.07 99.68 3gue h GLY 421 Ca 0.23 -0.70 -0.12 0.00 0.00 0.00 0.00 47.33 46.75 3gue h GLY 421 CO -0.06 0.61 -0.18 -2.75 0.00 0.00 0.00 176.54 174.16 3gue h PHE 422 N 0.09 1.05 -0.23 5.60 3.57 -0.53 -2.80 116.94 123.70 3gue h PHE 422 Ca -0.11 -0.23 0.07 0.00 3.53 0.00 0.00 57.97 61.22 3gue h PHE 422 Cb 1.86 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 40.34 3gue h PHE 422 CO 0.06 1.02 0.43 0.93 -2.23 0.00 0.00 178.31 178.52 3gue h GLU 423 N 0.81 0.00 0.22 1.11 4.39 -1.33 -0.40 114.58 119.38 3gue h GLU 423 Ca 0.12 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.47 3gue h GLU 423 Cb 0.73 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.40 3gue h GLU 423 CO 0.06 0.00 -1.61 0.87 -1.16 0.00 0.00 179.01 177.17 3gue h LYS 424 N 0.00 0.46 -0.82 2.33 1.79 -1.69 -2.50 116.57 116.15 3gue h LYS 424 Ca 0.11 -0.79 0.20 0.00 -2.18 0.00 0.00 60.65 57.99 3gue h LYS 424 Cb 0.98 0.29 -0.14 0.00 -1.58 0.00 0.00 32.23 31.78 3gue h LYS 424 CO -0.00 1.38 0.08 1.25 -1.08 0.00 0.00 179.45 181.07 3gue h LEU 425 N 0.11 -0.26 -3.19 2.94 6.46 -1.10 -1.63 115.31 118.64 3gue h LEU 425 Ca -0.30 0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.66 3gue h LEU 425 Cb 2.12 0.33 0.00 0.00 -0.73 0.00 0.00 40.66 42.38 3gue h LEU 425 CO 0.22 -0.19 0.00 1.33 -0.62 0.00 0.00 178.44 179.19 3gue n VAL 426 N -5.32 1.96 -0.33 1.05 0.24 -1.11 -0.52 118.33 114.30 3gue n VAL 426 Ca 0.17 -1.36 0.10 0.00 -2.04 0.00 0.00 64.34 61.21 3gue n VAL 426 Cb 0.56 0.04 0.20 0.00 -1.47 0.00 0.00 33.84 33.17 3gue n VAL 426 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 3gue n LYS 427 N 0.60 -0.08 0.02 7.34 4.81 -0.61 -0.19 118.16 130.05 3gue n LYS 427 Ca 0.23 1.45 0.11 0.00 -0.87 0.00 0.00 58.31 59.24 3gue n LYS 427 Cb 0.87 -2.23 0.11 0.00 0.02 0.00 0.00 35.03 33.80 3gue n LYS 427 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gue n GLY 428 N -1.54 -1.21 0.00 3.14 0.00 -0.43 -5.05 105.19 100.10 3gue n GLY 428 Ca 0.19 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3gue n GLY 428 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gue n GLY 429 N 1.44 -1.52 3.21 -0.02 0.00 0.74 -3.62 105.19 105.41 3gue n GLY 429 Ca 0.04 -1.42 -0.34 0.00 0.00 0.00 0.00 46.02 44.30 3gue n GLY 429 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gue s VAL 430 N -2.27 2.68 0.81 1.61 1.01 -1.26 -4.34 120.40 118.64 3gue s VAL 430 Ca 0.00 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.13 3gue s VAL 430 Cb 0.00 -2.18 0.08 0.00 0.00 0.00 0.00 36.38 34.29 3gue s VAL 430 CO 0.00 0.49 1.15 -2.16 0.00 0.00 0.00 175.10 174.58 3gue s PRO 431 N 1.36 1.74 0.09 2.72 0.04 -1.26 -4.84 135.00 134.85 3gue s PRO 431 Ca 0.05 1.54 -0.31 0.00 0.04 0.00 0.00 61.00 62.32 3gue s PRO 431 Cb -0.14 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.53 3gue s PRO 431 CO -0.08 -2.09 1.28 0.45 0.04 0.00 0.00 177.00 176.60 3gue s SER 432 N -2.60 6.96 0.00 6.66 0.15 -0.74 -4.47 113.70 119.66 3gue s SER 432 Ca 0.68 2.17 0.00 0.00 0.70 0.00 0.00 55.95 59.50 3gue s SER 432 Cb -0.24 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.49 3gue s SER 432 CO 0.52 -0.55 0.65 0.18 1.20 0.00 0.00 173.24 175.25 3gue n LEU 433 N 3.85 1.19 -0.18 3.45 4.77 -1.26 -1.34 117.00 127.48 3gue n LEU 433 Ca 0.10 -1.19 0.10 0.00 -0.03 0.00 0.00 56.01 54.99 3gue n LEU 433 Cb 0.44 0.00 0.40 0.00 -2.33 0.00 0.00 43.42 41.94 3gue n LEU 433 CO 0.57 0.30 1.21 0.08 -1.33 0.00 0.00 177.39 178.22 3gue h ARG 434 N 0.00 0.62 -0.00 3.23 0.11 -1.83 -1.02 114.38 115.49 3gue h ARG 434 Ca 0.00 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.04 3gue h ARG 434 Cb 0.37 -0.14 0.00 0.00 1.11 0.00 0.00 29.97 31.31 3gue h ARG 434 CO 0.00 0.41 -0.19 1.04 0.10 0.00 0.00 179.97 181.33 3gue n GLN 435 N -4.50 0.64 -2.73 0.08 1.13 -1.26 -4.62 117.38 106.12 3gue n GLN 435 Ca 0.13 -0.29 -0.42 0.00 -1.94 0.00 0.00 57.00 54.47 3gue n GLN 435 Cb 0.35 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.18 3gue n GLN 435 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3gue n THR 437 N 4.70 1.65 -3.81 0.00 -1.04 0.20 -4.27 114.28 111.71 3gue n THR 437 Ca 0.08 -0.66 -0.12 0.00 -2.04 0.00 0.00 64.05 61.32 3gue n THR 437 Cb 0.48 -1.48 -0.09 0.00 -1.82 0.00 0.00 70.33 67.42 3gue n THR 437 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3gue s SER 438 N -6.68 -0.08 -0.15 8.00 1.04 -0.72 -0.74 113.70 114.38 3gue s SER 438 Ca -0.24 -0.10 -0.04 0.00 0.48 0.00 0.00 55.95 56.05 3gue s SER 438 Cb 0.07 0.28 0.07 0.00 0.10 0.00 0.00 66.02 66.54 3gue s SER 438 CO 0.73 -0.45 0.19 -0.22 0.98 0.00 0.00 173.24 174.47 3gue s LEU 439 N -1.52 -0.08 -0.16 2.42 2.96 0.12 -2.49 118.68 119.92 3gue s LEU 439 Ca -0.12 0.04 -0.03 0.00 -0.22 0.00 0.00 54.13 53.80 3gue s LEU 439 Cb -0.05 0.33 -0.02 0.00 0.50 0.00 0.00 46.19 46.95 3gue s LEU 439 CO 0.02 -0.29 -0.06 -0.89 -1.32 0.00 0.00 176.35 173.81 3gue s THR 440 N 2.31 3.63 -0.07 3.68 2.01 -0.75 0.01 115.64 126.47 3gue s THR 440 Ca 0.04 -0.45 0.03 0.00 0.31 0.00 0.00 61.69 61.63 3gue s THR 440 Cb -0.14 -2.59 0.01 0.00 0.01 0.00 0.00 72.50 69.79 3gue s THR 440 CO -0.09 0.49 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.48 3gue s VAL 441 N 0.54 1.37 0.01 3.82 1.01 -0.41 -0.58 120.40 126.15 3gue s VAL 441 Ca -0.04 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.31 3gue s VAL 441 Cb -0.15 -1.22 -0.01 0.00 0.00 0.00 0.00 36.38 35.01 3gue s VAL 441 CO 0.03 0.41 -0.01 -0.60 0.00 0.00 0.00 175.10 174.93 3gue s ARG 442 N 0.48 0.09 0.00 2.72 3.52 0.57 -1.10 118.95 125.23 3gue s ARG 442 Ca -0.14 -0.16 0.00 0.00 -0.13 0.00 0.00 55.73 55.30 3gue s ARG 442 Cb -0.15 0.02 0.00 0.00 -1.56 0.00 0.00 34.95 33.26 3gue s ARG 442 CO 0.05 -0.01 0.00 0.41 -0.81 0.00 0.00 175.30 174.93 3gue n GLY 443 N 2.69 -3.22 3.57 8.12 0.00 -1.22 -0.87 105.19 114.26 3gue n GLY 443 Ca -0.15 -1.80 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 3gue n GLY 443 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gue s LEU 444 N 0.00 4.02 0.05 0.99 1.43 -1.26 -4.85 118.68 119.06 3gue s LEU 444 Ca 0.00 0.18 0.04 0.00 -1.03 0.00 0.00 54.13 53.32 3gue s LEU 444 Cb 0.00 -3.19 -0.02 0.00 0.03 0.00 0.00 46.19 43.01 3gue s LEU 444 CO 0.00 -1.00 -0.11 0.54 0.23 0.00 0.00 176.35 176.01 3gue s VAL 445 N 3.67 0.84 -0.04 -1.59 0.11 -1.26 0.27 120.40 122.39 3gue s VAL 445 Ca 0.37 -1.09 -0.01 0.00 -2.93 0.00 0.00 61.98 58.31 3gue s VAL 445 Cb -0.11 -0.83 0.03 0.00 -1.53 0.00 0.00 36.38 33.95 3gue s VAL 445 CO 0.25 -0.23 0.07 -1.83 -3.33 0.00 0.00 175.10 170.03 3gue s GLU 446 N -1.47 -0.03 0.42 1.54 -1.05 0.02 -3.80 118.70 114.32 3gue s GLU 446 Ca -0.04 0.33 -0.24 0.00 -0.15 0.00 0.00 54.97 54.86 3gue s GLU 446 Cb -0.09 -0.35 -0.08 0.00 -0.44 0.00 0.00 34.13 33.17 3gue s GLU 446 CO 0.01 -0.25 1.16 -0.06 0.95 0.00 0.00 175.26 177.07 3gue s PHE 447 N 1.65 3.02 0.00 4.83 0.08 0.33 -1.65 117.98 126.24 3gue s PHE 447 Ca -0.02 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.58 3gue s PHE 447 Cb -0.12 -3.37 0.00 0.00 -0.57 0.00 0.00 43.02 38.96 3gue s PHE 447 CO -0.04 -1.33 0.00 0.41 -0.10 0.00 0.00 175.22 174.16 3gue n GLY 448 N 0.55 1.40 3.94 4.36 0.00 -1.15 -1.31 105.19 112.98 3gue n GLY 448 Ca 0.05 -1.64 -0.24 0.00 0.00 0.00 0.00 46.02 44.19 3gue n GLY 448 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gue s ALA 449 N -3.50 3.67 -1.33 4.61 0.00 -1.24 -3.01 121.76 120.96 3gue s ALA 449 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.04 3gue s ALA 449 Cb 0.00 -2.20 0.00 0.00 0.00 0.00 0.00 23.12 20.92 3gue s ALA 449 CO 0.00 -0.26 0.00 -0.25 0.00 0.00 0.00 175.76 175.25 3gue n ASP 450 N -2.02 -3.81 -4.77 0.00 8.00 -1.26 -2.04 116.55 110.66 3gue n ASP 450 Ca -0.01 0.27 -0.38 0.00 0.71 0.00 0.00 54.79 55.38 3gue n ASP 450 Cb 0.57 -3.41 -0.06 0.00 -0.02 0.00 0.00 41.12 38.19 3gue n ASP 450 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3gue s VAL 451 N -2.35 4.22 -0.07 2.53 -7.23 -1.26 -3.69 120.40 112.55 3gue s VAL 451 Ca 0.00 1.85 0.05 0.00 -1.81 0.00 0.00 61.98 62.07 3gue s VAL 451 Cb 0.00 -4.12 -0.01 0.00 0.56 0.00 0.00 36.38 32.81 3gue s VAL 451 CO 0.00 0.32 -0.23 -0.55 -0.31 0.00 0.00 175.10 174.33 3gue s SER 452 N -1.41 3.21 -0.21 4.85 0.15 -0.45 -1.79 113.70 118.05 3gue s SER 452 Ca 0.44 -0.48 -0.01 0.00 0.70 0.00 0.00 55.95 56.61 3gue s SER 452 Cb -0.22 -0.94 0.01 0.00 -1.71 0.00 0.00 66.02 63.17 3gue s SER 452 CO 0.27 0.24 -0.11 -0.69 1.20 0.00 0.00 173.24 174.14 3gue s VAL 453 N -0.13 2.67 -0.05 4.45 1.01 -0.45 -0.02 120.40 127.88 3gue s VAL 453 Ca -0.04 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.13 3gue s VAL 453 Cb -0.14 -2.23 0.00 0.00 0.00 0.00 0.00 36.38 34.02 3gue s VAL 453 CO 0.04 0.40 -0.15 -0.13 0.00 0.00 0.00 175.10 175.26 3gue s ARG 454 N 1.35 1.69 6.08 2.72 0.52 -0.52 -2.81 118.95 127.98 3gue s ARG 454 Ca 0.04 -0.52 0.00 0.00 -0.52 0.00 0.00 55.73 54.73 3gue s ARG 454 Cb -0.14 -1.44 0.00 0.00 0.52 0.00 0.00 34.95 33.88 3gue s ARG 454 CO -0.08 0.16 0.00 0.41 0.02 0.00 0.00 175.30 175.81 3gue n GLY 455 N 3.37 1.48 3.31 -3.53 0.00 -0.52 -2.08 105.19 107.22 3gue n GLY 455 Ca -0.19 -0.56 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 3gue n GLY 455 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gue s ASN 456 N -4.00 5.66 -0.06 1.61 0.02 -1.26 -0.63 114.94 116.28 3gue s ASN 456 Ca 0.00 -1.29 0.05 0.00 -1.02 0.00 0.00 52.86 50.59 3gue s ASN 456 Cb 0.00 -2.00 -0.02 0.00 0.02 0.00 0.00 41.25 39.26 3gue s ASN 456 CO 0.00 -0.47 -0.20 -0.69 0.02 0.00 0.00 177.10 175.75 3gue s VAL 457 N 1.47 2.48 -0.07 1.60 1.01 -1.04 -3.60 120.40 122.26 3gue s VAL 457 Ca 0.02 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.10 3gue s VAL 457 Cb -0.21 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.24 3gue s VAL 457 CO 0.04 0.57 -0.12 -0.69 0.00 0.00 0.00 175.10 174.90 3gue s VAL 458 N -0.31 1.18 -0.13 2.92 1.01 -0.69 -1.80 120.40 122.59 3gue s VAL 458 Ca 0.01 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.50 3gue s VAL 458 Cb -0.13 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.19 3gue s VAL 458 CO 0.02 0.37 -0.11 -0.63 0.00 0.00 0.00 175.10 174.75 3gue s ILE 459 N 0.76 1.31 -0.19 2.22 1.01 0.25 0.15 121.20 126.71 3gue s ILE 459 Ca -0.13 -0.48 0.01 0.00 0.00 0.00 0.00 60.65 60.06 3gue s ILE 459 Cb -0.16 -1.26 0.03 0.00 0.01 0.00 0.00 42.46 41.09 3gue s ILE 459 CO 0.03 0.41 -0.15 -0.54 0.00 0.00 0.00 174.94 174.69 3gue s LYS 460 N 1.49 2.50 -0.20 2.79 1.02 0.71 -0.32 119.74 127.72 3gue s LYS 460 Ca 0.03 -0.83 -0.05 0.00 0.02 0.00 0.00 55.97 55.14 3gue s LYS 460 Cb -0.13 -2.45 -0.02 0.00 -0.52 0.00 0.00 37.83 34.70 3gue s LYS 460 CO -0.08 -0.31 -0.01 1.21 -0.92 0.00 0.00 175.35 175.24 3gue s ASN 461 N 1.34 4.76 -0.00 2.83 2.47 -0.05 -0.71 114.94 125.58 3gue s ASN 461 Ca 0.02 -0.22 0.04 0.00 0.42 0.00 0.00 52.86 53.11 3gue s ASN 461 Cb -0.15 -1.81 -0.05 0.00 -1.45 0.00 0.00 41.25 37.79 3gue s ASN 461 CO -0.10 0.06 0.08 0.18 -3.72 0.00 0.00 177.10 173.60 3gue n LEU 462 N 4.29 0.01 -4.66 3.21 4.77 -1.26 -3.38 117.00 119.99 3gue n LEU 462 Ca -0.17 -0.03 -0.30 0.00 -0.03 0.00 0.00 56.01 55.47 3gue n LEU 462 Cb 0.52 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.77 3gue n LEU 462 CO 0.31 0.00 0.64 -0.54 -1.33 0.00 0.00 177.39 176.48 3gue s LYS 463 N -2.19 0.81 0.25 3.23 -0.14 -1.26 -4.99 119.74 115.46 3gue s LYS 463 Ca -0.01 1.12 0.12 0.00 -1.36 0.00 0.00 55.97 55.85 3gue s LYS 463 Cb 0.02 -1.73 0.21 0.00 -1.68 0.00 0.00 37.83 34.65 3gue s LYS 463 CO 0.15 -2.63 1.51 0.93 -0.76 0.00 0.00 175.35 174.55 3gue h GLU 464 N -1.85 0.00 -6.48 1.68 5.08 -1.99 -3.45 114.58 107.57 3gue h GLU 464 Ca -0.49 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.33 3gue h GLU 464 Cb 1.28 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.55 3gue h GLU 464 CO 0.49 0.65 0.75 -1.83 -1.00 0.00 0.00 179.01 178.07 3gue s GLU 465 N -3.22 4.32 -0.22 2.33 -1.05 -1.26 -4.90 118.70 114.69 3gue s GLU 465 Ca 0.01 2.02 -0.37 0.00 -0.15 0.00 0.00 54.97 56.47 3gue s GLU 465 Cb 0.11 -3.37 -0.14 0.00 -0.44 0.00 0.00 34.13 30.29 3gue s GLU 465 CO 0.76 -0.47 1.86 -2.30 0.95 0.00 0.00 175.26 176.06 3gue n PRO 466 N 4.45 1.53 -2.49 -4.83 -0.02 -1.26 -4.83 135.00 127.56 3gue n PRO 466 Ca 0.12 0.55 -0.42 0.00 -2.02 0.00 0.00 63.50 61.72 3gue n PRO 466 Cb 0.43 -2.36 -0.02 0.00 -0.02 0.00 0.00 33.50 31.53 3gue n PRO 466 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3gue s LEU 467 N 4.30 3.50 -0.23 2.45 2.96 0.14 -4.91 118.68 126.88 3gue s LEU 467 Ca 0.98 0.36 -0.29 0.00 -0.22 0.00 0.00 54.13 54.95 3gue s LEU 467 Cb -0.90 -3.28 -0.00 0.00 0.50 0.00 0.00 46.19 42.51 3gue s LEU 467 CO 0.58 -1.49 1.24 -0.63 -1.32 0.00 0.00 176.35 174.73 3gue s ILE 468 N 5.26 4.29 -0.35 6.68 1.01 -1.26 -0.80 121.20 136.02 3gue s ILE 468 Ca 0.50 1.52 -0.29 0.00 0.00 0.00 0.00 60.65 62.38 3gue s ILE 468 Cb -0.09 -4.11 0.02 0.00 0.01 0.00 0.00 42.46 38.28 3gue s ILE 468 CO 0.28 -0.28 1.07 -0.63 0.00 0.00 0.00 174.94 175.37 3gue s ILE 469 N 3.79 4.47 0.25 2.92 -1.09 -0.66 -4.96 121.20 125.92 3gue s ILE 469 Ca 0.54 1.60 -0.31 0.00 -2.23 0.00 0.00 60.65 60.24 3gue s ILE 469 Cb -0.19 -4.44 -0.13 0.00 -1.58 0.00 0.00 42.46 36.12 3gue s ILE 469 CO 0.17 -0.57 1.38 0.61 -1.23 0.00 0.00 174.94 175.30 3gue n GLY 470 N 4.08 0.72 3.77 6.18 0.00 -1.26 -2.93 105.19 115.75 3gue n GLY 470 Ca 0.11 0.48 -0.40 0.00 0.00 0.00 0.00 46.02 46.21 3gue n GLY 470 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gue s SER 471 N 0.22 6.58 0.00 1.61 0.01 -1.26 -2.06 113.70 118.81 3gue s SER 471 Ca 0.67 2.74 0.00 0.00 1.31 0.00 0.00 55.95 60.67 3gue s SER 471 Cb -0.65 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 62.93 3gue s SER 471 CO 0.51 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 174.10 3gue n GLY 472 N 0.71 1.81 3.61 3.44 0.00 -0.86 -4.96 105.19 108.92 3gue n GLY 472 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 3gue n GLY 472 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gue s ARG 473 N -0.57 3.23 -0.44 1.61 6.06 -0.87 -4.69 118.95 123.27 3gue s ARG 473 Ca 0.00 2.01 -0.22 0.00 -2.50 0.00 0.00 55.73 55.02 3gue s ARG 473 Cb 0.00 -4.34 0.02 0.00 0.06 0.00 0.00 34.95 30.70 3gue s ARG 473 CO 0.00 -1.99 0.73 0.08 -2.50 0.00 0.00 175.30 171.62 3gue s VAL 474 N 7.86 4.72 -0.22 7.11 1.01 -1.26 -1.34 120.40 138.27 3gue s VAL 474 Ca 0.97 0.32 -0.15 0.00 0.00 0.00 0.00 61.98 63.12 3gue s VAL 474 Cb -0.33 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.74 3gue s VAL 474 CO 0.35 -0.67 0.38 -0.76 0.00 0.00 0.00 175.10 174.40 3gue s LEU 475 N 3.11 4.12 -0.30 3.92 1.43 0.98 -4.94 118.68 127.00 3gue s LEU 475 Ca 0.27 0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 53.77 3gue s LEU 475 Cb -0.13 -2.47 0.10 0.00 0.03 0.00 0.00 46.19 43.73 3gue s LEU 475 CO 0.21 -0.10 0.14 -0.62 0.23 0.00 0.00 176.35 176.21 3gue s ASP 476 N 1.20 3.54 -1.19 2.29 2.15 -1.26 -1.44 116.67 121.95 3gue s ASP 476 Ca 0.17 -1.43 -0.19 0.00 0.43 0.00 0.00 52.55 51.54 3gue s ASP 476 Cb -0.15 -0.41 -0.00 0.00 -0.30 0.00 0.00 42.92 42.06 3gue s ASP 476 CO 0.08 -0.42 0.72 0.59 -0.17 0.00 0.00 175.17 175.97 3gue n ASN 477 N 5.07 -4.32 -4.01 -0.34 3.02 -0.88 -5.01 115.26 108.80 3gue n ASN 477 Ca -0.04 -1.05 -0.12 0.00 -0.03 0.00 0.00 54.58 53.35 3gue n ASN 477 Cb 0.41 -3.14 -0.12 0.00 -0.61 0.00 0.00 39.78 36.33 3gue n ASN 477 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 3gue s GLU 478 N -6.24 0.40 -0.23 3.52 -1.05 -1.24 -4.98 118.70 108.88 3gue s GLU 478 Ca 0.40 -0.58 -0.08 0.00 -0.15 0.00 0.00 54.97 54.56 3gue s GLU 478 Cb -0.15 -0.15 -0.04 0.00 -0.44 0.00 0.00 34.13 33.36 3gue s GLU 478 CO 0.88 0.02 0.09 0.08 0.95 0.00 0.00 175.26 177.27 3gue s VAL 479 N -1.14 4.64 -0.24 1.83 1.01 -1.26 -1.70 120.40 123.53 3gue s VAL 479 Ca -0.10 -0.07 -0.03 0.00 0.00 0.00 0.00 61.98 61.78 3gue s VAL 479 Cb -0.08 -3.15 0.01 0.00 0.00 0.00 0.00 36.38 33.16 3gue s VAL 479 CO -0.00 0.37 -0.03 -0.69 0.00 0.00 0.00 175.10 174.74 3gue s VAL 480 N 1.21 3.25 -0.04 2.92 1.01 0.12 -5.00 120.40 123.88 3gue s VAL 480 Ca 0.05 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.34 3gue s VAL 480 Cb -0.14 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.64 3gue s VAL 480 CO 0.04 0.27 -0.22 -0.69 0.00 0.00 0.00 175.10 174.50 3gue s VAL 481 N 1.42 1.82 0.00 2.92 1.01 -1.25 0.26 120.40 126.58 3gue s VAL 481 Ca 0.03 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.06 3gue s VAL 481 Cb -0.16 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.69 3gue s VAL 481 CO -0.03 0.51 0.26 0.52 0.00 0.00 0.00 175.10 176.36