#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 0.71 1.22 0.46 0.00 -1.99 -2.58 103.07 100.89 3gue h GLY 9 Ca 0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 47.33 46.65 3gue h GLY 9 CO 0.00 0.58 0.29 0.00 0.00 0.00 0.00 176.54 177.41 3gue h ALA 10 N 1.11 1.21 -0.13 3.60 0.00 -1.88 -1.00 119.26 122.16 3gue h ALA 10 Ca 0.07 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 3gue h ALA 10 Cb 0.80 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.32 3gue h ALA 10 CO 0.07 0.58 -0.57 0.00 0.00 0.00 0.00 179.25 179.33 3gue h ALA 11 N 1.32 0.24 -0.66 0.00 0.00 -1.83 -2.05 119.26 116.28 3gue h ALA 11 Ca 0.23 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3gue h ALA 11 Cb 0.17 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3gue h ALA 11 CO -0.02 0.47 0.36 1.25 0.00 0.00 0.00 179.25 181.31 3gue h LEU 12 N 0.26 0.82 -0.65 0.00 5.85 -1.39 0.26 115.31 120.46 3gue h LEU 12 Ca -0.04 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.64 3gue h LEU 12 Cb 1.21 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.98 3gue h LEU 12 CO 0.12 0.67 0.37 0.00 -0.34 0.00 0.00 178.44 179.26 3gue h ALA 13 N 1.18 0.86 -0.71 1.25 0.00 -1.18 -0.11 119.26 120.54 3gue h ALA 13 Ca 0.23 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 3gue h ALA 13 Cb 0.03 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3gue h ALA 13 CO -0.04 0.07 0.18 0.00 0.00 0.00 0.00 179.25 179.47 3gue h LEU 15 N 1.07 0.02 -0.41 0.00 6.46 0.03 -0.81 115.31 121.67 3gue h LEU 15 Ca 0.22 -0.08 -0.12 0.00 -0.12 0.00 0.00 57.88 57.78 3gue h LEU 15 Cb 0.36 -0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.28 3gue h LEU 15 CO 0.00 0.10 -0.22 -0.33 -0.62 0.00 0.00 178.44 177.36 3gue h GLU 16 N -0.06 0.87 -0.61 1.25 5.08 -1.01 -0.95 114.58 119.15 3gue h GLU 16 Ca 0.01 -0.39 -0.05 0.00 -1.00 0.00 0.00 59.36 57.92 3gue h GLU 16 Cb 0.08 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3gue h GLU 16 CO -0.00 1.04 0.17 -0.22 -1.00 0.00 0.00 179.01 179.00 3gue h LYS 17 N 0.69 0.93 -0.08 2.33 3.64 -1.29 -0.44 116.57 122.36 3gue h LYS 17 Ca 0.09 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 3gue h LYS 17 Cb 0.79 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.47 3gue h LYS 17 CO 0.07 0.82 -0.04 0.52 -2.27 0.00 0.00 179.45 178.54 3gue h MET 18 N 0.90 0.17 -0.57 1.90 2.86 -0.88 -2.93 114.93 116.38 3gue h MET 18 Ca 0.20 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.78 3gue h MET 18 Cb 0.29 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 3gue h MET 18 CO -0.00 0.54 0.37 1.96 1.06 0.00 0.00 176.91 180.84 3gue h GLN 19 N -0.21 0.69 0.00 1.72 4.20 -1.12 -1.96 115.11 118.43 3gue h GLN 19 Ca 0.02 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 3gue h GLN 19 Cb 0.49 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 3gue h GLN 19 CO 0.01 0.46 -0.14 0.00 -0.67 0.00 0.00 178.83 178.49 3gue h ALA 20 N 1.66 1.20 -0.29 3.87 0.00 -0.99 -2.92 119.26 121.79 3gue h ALA 20 Ca 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3gue h ALA 20 Cb -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3gue h ALA 20 CO -0.05 0.17 0.00 0.43 0.00 0.00 0.00 179.25 179.80 3gue n SER 21 N -3.54 3.16 0.00 0.00 7.64 -0.79 -4.98 113.62 115.10 3gue n SER 21 Ca -0.01 -1.92 0.00 0.00 1.01 0.00 0.00 58.87 57.95 3gue n SER 21 Cb 0.28 -0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 3gue n SER 21 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gue n GLY 22 N 1.26 0.61 3.76 0.23 0.00 -1.00 -5.03 105.19 105.02 3gue n GLY 22 Ca 0.16 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 3gue n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gue s VAL 23 N -2.00 2.38 0.25 1.61 1.01 -0.86 -4.93 120.40 117.85 3gue s VAL 23 Ca 0.00 0.36 -0.31 0.00 0.00 0.00 0.00 61.98 62.03 3gue s VAL 23 Cb 0.00 -3.23 -0.12 0.00 0.00 0.00 0.00 36.38 33.03 3gue s VAL 23 CO 0.00 0.08 1.65 1.21 0.00 0.00 0.00 175.10 178.03 3gue n GLU 24 N 1.22 2.68 -0.22 2.72 0.00 -1.26 -4.74 120.64 121.03 3gue n GLU 24 Ca 0.03 0.96 -0.01 0.00 0.00 0.00 0.00 57.16 58.14 3gue n GLU 24 Cb 0.40 -2.77 0.06 0.00 0.00 0.00 0.00 31.44 29.13 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 5.70 -0.03 -0.25 5.31 4.81 -2.00 -1.75 114.58 126.38 3gue h GLU 25 Ca -0.45 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.69 3gue h GLU 25 Cb 1.22 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 3gue h GLU 25 CO 0.87 -0.02 -0.22 0.87 -0.73 0.00 0.00 179.01 179.77 3gue h LYS 26 N -0.03 0.47 -0.51 1.92 1.79 -1.96 -2.08 116.57 116.17 3gue h LYS 26 Ca 0.31 -0.17 -0.02 0.00 -2.18 0.00 0.00 60.65 58.59 3gue h LYS 26 Cb 0.50 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.10 3gue h LYS 26 CO -0.69 0.67 0.25 0.00 -1.08 0.00 0.00 179.45 178.60 3gue h ILE 28 N 0.68 0.77 -0.16 0.00 2.04 -1.08 0.59 117.51 120.35 3gue h ILE 28 Ca 0.18 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.08 3gue h ILE 28 Cb 0.11 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 3gue h ILE 28 CO -0.02 0.00 -0.11 -0.74 0.00 0.00 0.00 178.15 177.28 3gue h HIS 29 N -0.10 -0.27 -0.49 1.37 2.76 -1.19 -0.51 115.15 116.73 3gue h HIS 29 Ca 0.06 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.25 3gue h HIS 29 Cb 0.18 0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.26 3gue h HIS 29 CO -0.18 -0.17 0.32 0.82 -1.30 0.00 0.00 177.93 177.42 3gue h ILE 30 N -0.11 1.12 -0.77 6.26 2.04 -0.98 -2.05 117.51 123.02 3gue h ILE 30 Ca 0.10 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.78 3gue h ILE 30 Cb 0.26 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.69 3gue h ILE 30 CO -0.23 0.12 0.47 0.15 0.00 0.00 0.00 178.15 178.66 3gue h PHE 31 N 0.66 0.87 0.00 1.37 3.57 -0.49 -2.21 116.94 120.70 3gue h PHE 31 Ca 0.18 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.59 3gue h PHE 31 Cb -0.07 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.37 3gue h PHE 31 CO -0.04 0.46 -0.53 -0.07 -2.23 0.00 0.00 178.31 175.90 3gue h LEU 32 N 0.88 0.00 0.32 0.59 3.38 -0.88 0.18 115.31 119.78 3gue h LEU 32 Ca 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 3gue h LEU 32 Cb 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3gue h LEU 32 CO -0.15 0.53 -0.30 0.40 0.09 0.00 0.00 178.44 179.01 3gue h ILE 33 N 0.00 0.37 -0.86 1.22 2.04 -1.14 -0.79 117.51 118.36 3gue h ILE 33 Ca -0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 3gue h ILE 33 Cb 1.17 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 3gue h ILE 33 CO 0.07 0.00 0.51 1.56 0.00 0.00 0.00 178.15 180.29 3gue h GLN 34 N -0.64 1.16 -0.11 2.37 4.20 -0.96 -2.70 115.11 118.44 3gue h GLN 34 Ca -0.02 -0.11 0.04 0.00 0.06 0.00 0.00 58.65 58.62 3gue h GLN 34 Cb 0.58 -0.24 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 3gue h GLN 34 CO -0.05 0.82 -0.14 1.25 -0.67 0.00 0.00 178.83 180.04 3gue h HIS 35 N 1.18 -0.36 -0.79 2.96 2.76 -0.60 -0.66 115.15 119.63 3gue h HIS 35 Ca 0.31 0.02 0.16 0.00 -2.20 0.00 0.00 60.37 58.65 3gue h HIS 35 Cb -0.04 0.18 -0.15 0.00 1.55 0.00 0.00 27.41 28.95 3gue h HIS 35 CO -0.00 -0.21 -0.22 0.00 -1.30 0.00 0.00 177.93 176.20 3gue h ALA 36 N 0.87 0.46 0.11 5.26 0.00 -1.00 -0.05 119.26 124.91 3gue h ALA 36 Ca 0.09 0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 3gue h ALA 36 Cb 0.31 0.65 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3gue h ALA 36 CO -0.22 -0.44 -0.05 -0.07 0.00 0.00 0.00 179.25 178.47 3gue h LEU 37 N -0.02 -0.12 -0.97 0.00 3.38 -1.02 -3.07 115.31 113.49 3gue h LEU 37 Ca 0.37 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 58.10 3gue h LEU 37 Cb 0.58 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3gue h LEU 37 CO -0.82 0.08 -0.10 0.58 0.09 0.00 0.00 178.44 178.27 3gue h VAL 38 N -0.33 1.24 -0.45 1.22 2.07 -1.08 -2.44 116.25 116.49 3gue h VAL 38 Ca -0.01 -1.07 0.08 0.00 0.82 0.00 0.00 66.70 66.51 3gue h VAL 38 Cb 0.27 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 3gue h VAL 38 CO 0.02 0.36 0.31 0.08 0.02 0.00 0.00 177.57 178.36 3gue h ARG 39 N 0.58 0.27 -0.55 1.57 0.11 -0.91 0.03 114.38 115.48 3gue h ARG 39 Ca 0.11 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.17 3gue h ARG 39 Cb 0.52 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.54 3gue h ARG 39 CO 0.03 0.18 0.00 1.63 0.10 0.00 0.00 179.97 181.91 3gue n LYS 40 N -4.47 2.43 -0.50 0.08 4.76 -0.96 -4.92 118.16 114.58 3gue n LYS 40 Ca 0.06 -1.61 0.00 0.00 -2.87 0.00 0.00 58.31 53.90 3gue n LYS 40 Cb 0.32 -1.55 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 3gue n LYS 40 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3gue n GLY 41 N 0.86 0.72 3.68 0.72 0.00 -0.00 -5.04 105.19 106.14 3gue n GLY 41 Ca 0.15 -0.28 -0.44 0.00 0.00 0.00 0.00 46.02 45.44 3gue n GLY 41 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3gue n GLU 42 N -2.50 2.53 0.04 1.61 4.07 -0.98 -4.89 120.64 120.53 3gue n GLU 42 Ca 0.00 0.92 0.09 0.00 -0.06 0.00 0.00 57.16 58.11 3gue n GLU 42 Cb 0.00 -2.78 -0.08 0.00 -0.06 0.00 0.00 31.44 28.52 3gue n GLU 42 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 3gue n THR 43 N 4.56 0.48 -0.98 6.31 -2.24 -1.26 -4.55 114.28 116.60 3gue n THR 43 Ca 0.19 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 3gue n THR 43 Cb 0.34 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 3gue n THR 43 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gue n GLY 44 N 1.26 0.55 3.82 3.38 0.00 -1.26 -3.92 105.19 109.01 3gue n GLY 44 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.34 3.36 -0.58 1.61 2.02 -1.26 -4.61 117.35 115.55 3gue s TYR 45 Ca 0.00 1.58 0.02 0.00 -0.37 0.00 0.00 57.07 58.30 3gue s TYR 45 Cb 0.00 -2.82 0.15 0.00 -0.40 0.00 0.00 41.96 38.89 3gue s TYR 45 CO 0.00 -0.05 0.35 0.42 -1.57 0.00 0.00 175.55 174.70 3gue s ILE 46 N -2.09 2.95 0.39 2.71 1.01 0.47 -5.03 121.20 121.60 3gue s ILE 46 Ca 0.60 -3.38 -0.26 0.00 0.00 0.00 0.00 60.65 57.61 3gue s ILE 46 Cb -0.10 -2.99 -0.09 0.00 0.01 0.00 0.00 42.46 39.29 3gue s ILE 46 CO 0.15 -0.85 1.23 -2.84 0.00 0.00 0.00 174.94 172.62 3gue s PRO 47 N -0.42 4.09 0.44 2.79 0.02 -1.26 -4.71 135.00 135.94 3gue s PRO 47 Ca 0.18 1.99 0.26 0.00 0.02 0.00 0.00 61.00 63.46 3gue s PRO 47 Cb -0.22 -2.78 1.31 0.00 0.02 0.00 0.00 34.50 32.84 3gue s PRO 47 CO -0.03 -0.33 1.70 1.49 -0.33 0.00 0.00 177.00 179.50 3gue h GLU 48 N 2.80 0.20 0.00 5.54 4.57 -1.94 0.30 114.58 126.04 3gue h GLU 48 Ca -0.49 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 3gue h GLU 48 Cb 1.24 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 3gue h GLU 48 CO 0.63 0.13 0.00 1.63 -1.18 0.00 0.00 179.01 180.22 3gue n LYS 49 N -4.58 0.50 0.00 1.92 5.02 -1.26 -2.70 118.16 117.05 3gue n LYS 49 Ca 0.31 0.03 0.11 0.00 -2.02 0.00 0.00 58.31 56.75 3gue n LYS 49 Cb 1.19 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 34.76 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 -1.20 1.29 -4.19 4.39 3.41 0.10 -4.98 113.62 112.45 3gue n SER 50 Ca 0.14 -1.05 -0.12 0.00 -0.26 0.00 0.00 58.87 57.58 3gue n SER 50 Cb 0.17 0.57 -0.10 0.00 -0.26 0.00 0.00 64.21 64.59 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 -2.74 0.47 0.09 -1.33 -4.36 -1.10 -4.74 121.20 107.48 3gue s ILE 51 Ca 0.15 -1.94 0.08 0.00 -0.26 0.00 0.00 60.65 58.68 3gue s ILE 51 Cb 0.17 -2.01 -0.03 0.00 1.25 0.00 0.00 42.46 41.84 3gue s ILE 51 CO 0.69 -0.55 -0.22 -0.44 0.24 0.00 0.00 174.94 174.66 3gue s SER 52 N -3.10 2.66 0.44 4.36 0.01 -0.52 -4.96 113.70 112.59 3gue s SER 52 Ca 0.21 -0.64 -0.23 0.00 1.31 0.00 0.00 55.95 56.60 3gue s SER 52 Cb 0.07 -0.18 -0.08 0.00 0.21 0.00 0.00 66.02 66.04 3gue s SER 52 CO 0.01 0.11 1.16 -2.16 0.41 0.00 0.00 173.24 172.78 3gue s PRO 53 N -1.69 3.84 -0.45 12.44 0.04 -1.26 -1.01 135.00 146.90 3gue s PRO 53 Ca 0.08 1.78 -0.27 0.00 0.04 0.00 0.00 61.00 62.62 3gue s PRO 53 Cb -0.10 -2.47 0.03 0.00 0.04 0.00 0.00 34.50 32.00 3gue s PRO 53 CO 0.04 -0.49 1.04 0.08 0.04 0.00 0.00 177.00 177.71 3gue s VAL 54 N -1.53 4.35 -0.17 -0.36 1.01 -1.26 -4.75 120.40 117.69 3gue s VAL 54 Ca 0.62 1.08 0.18 0.00 0.00 0.00 0.00 61.98 63.86 3gue s VAL 54 Cb -0.29 -4.51 -0.06 0.00 0.00 0.00 0.00 36.38 31.52 3gue s VAL 54 CO 0.35 -0.88 0.99 1.05 0.00 0.00 0.00 175.10 176.61 3gue h GLU 55 N 9.05 0.00 -3.04 2.72 9.09 -1.95 -3.44 114.58 127.01 3gue h GLU 55 Ca -0.23 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.08 3gue h GLU 55 Cb 1.07 0.00 -0.18 0.00 -1.65 0.00 0.00 28.75 27.98 3gue h GLU 55 CO 1.08 0.23 -0.21 -1.54 0.05 0.00 0.00 179.01 178.61 3gue s SER 56 N -5.77 -0.22 0.05 3.06 1.04 -1.26 -5.14 113.70 105.47 3gue s SER 56 Ca -0.01 0.03 -0.15 0.00 0.48 0.00 0.00 55.95 56.30 3gue s SER 56 Cb 0.09 0.36 0.03 0.00 0.10 0.00 0.00 66.02 66.59 3gue s SER 56 CO 0.79 -0.55 0.34 -0.76 0.98 0.00 0.00 173.24 174.05 3gue s LEU 57 N -1.66 0.71 0.42 2.42 1.43 -1.26 -5.16 118.68 115.58 3gue s LEU 57 Ca -0.09 -0.15 -0.25 0.00 -1.03 0.00 0.00 54.13 52.61 3gue s LEU 57 Cb -0.03 1.50 -0.08 0.00 0.03 0.00 0.00 46.19 47.61 3gue s LEU 57 CO 0.01 -0.65 1.26 -2.84 0.23 0.00 0.00 176.35 174.36 3gue s PRO 58 N -2.63 3.90 0.06 1.29 0.02 -1.26 -4.77 135.00 131.60 3gue s PRO 58 Ca -0.04 2.04 0.00 0.00 0.02 0.00 0.00 61.00 63.01 3gue s PRO 58 Cb -0.01 -2.66 -0.04 0.00 0.02 0.00 0.00 34.50 31.82 3gue s PRO 58 CO -0.04 -0.51 0.18 -0.06 -0.33 0.00 0.00 177.00 176.25 3gue s PHE 59 N -1.33 3.46 0.26 6.54 0.08 -1.26 -0.60 117.98 125.12 3gue s PHE 59 Ca 0.59 0.23 -0.04 0.00 0.12 0.00 0.00 56.93 57.83 3gue s PHE 59 Cb -0.35 -1.74 0.36 0.00 -0.57 0.00 0.00 43.02 40.72 3gue s PHE 59 CO 0.44 0.58 1.88 1.25 -0.10 0.00 0.00 175.22 179.27 3gue h LEU 60 N 3.20 0.99 -0.41 -0.37 5.85 -1.71 -2.69 115.31 120.17 3gue h LEU 60 Ca -0.46 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.29 3gue h LEU 60 Cb 1.16 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 3gue h LEU 60 CO 0.73 0.64 0.24 -0.61 -0.34 0.00 0.00 178.44 179.10 3gue h GLN 61 N 1.13 0.46 0.04 1.25 4.15 -1.93 -1.89 115.11 118.33 3gue h GLN 61 Ca 0.41 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.80 3gue h GLN 61 Cb 0.13 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 3gue h GLN 61 CO -0.16 0.31 -0.24 0.78 -1.93 0.00 0.00 178.83 177.59 3gue h GLY 62 N 0.48 -1.22 2.00 2.39 0.00 -1.93 -3.33 103.07 101.46 3gue h GLY 62 Ca 0.17 0.59 0.00 0.00 0.00 0.00 0.00 47.33 48.09 3gue h GLY 62 CO -0.08 -0.38 0.00 0.16 0.00 0.00 0.00 176.54 176.24 3gue h ILE 63 N -0.33 0.00 -3.39 2.60 3.07 -1.17 -3.45 117.51 114.84 3gue h ILE 63 Ca -0.00 -0.55 -0.51 0.00 1.55 0.00 0.00 64.86 65.34 3gue h ILE 63 Cb 0.34 1.49 -0.01 0.00 -0.27 0.00 0.00 36.82 38.37 3gue h ILE 63 CO -0.14 0.00 -0.05 -1.61 -1.05 0.00 0.00 178.15 175.30 3gue s GLU 64 N -3.34 3.71 0.34 0.16 2.02 -0.74 -4.88 118.70 115.97 3gue s GLU 64 Ca 0.05 0.20 0.06 0.00 0.02 0.00 0.00 54.97 55.30 3gue s GLU 64 Cb 0.09 -2.56 -0.07 0.00 0.10 0.00 0.00 34.13 31.69 3gue s GLU 64 CO 0.55 0.15 0.00 0.95 0.02 0.00 0.00 175.26 176.93 3gue s THR 65 N -2.13 1.61 0.70 3.63 -4.23 -1.26 -4.97 115.64 108.99 3gue s THR 65 Ca 0.47 -2.05 -0.13 0.00 -1.18 0.00 0.00 61.69 58.79 3gue s THR 65 Cb -0.11 -2.74 0.02 0.00 1.34 0.00 0.00 72.50 71.02 3gue s THR 65 CO 0.29 -0.10 1.11 -0.54 -0.54 0.00 0.00 174.62 174.84 3gue s LYS 66 N -3.78 2.57 0.00 3.99 1.02 -1.26 -4.90 119.74 117.38 3gue s LYS 66 Ca 0.34 1.34 0.00 0.00 0.02 0.00 0.00 55.97 57.67 3gue s LYS 66 Cb 0.07 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 35.46 3gue s LYS 66 CO 0.15 -1.43 0.00 0.41 -0.92 0.00 0.00 175.35 173.57 3gue n GLY 67 N -0.69 -0.49 3.15 -3.33 0.00 -1.26 -5.06 105.19 97.51 3gue n GLY 67 Ca 0.10 -1.54 -0.19 0.00 0.00 0.00 0.00 46.02 44.39 3gue n GLY 67 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gue s GLU 68 N -3.72 0.84 -0.85 1.61 2.02 -1.26 -4.84 118.70 112.50 3gue s GLU 68 Ca 0.00 -0.86 -0.16 0.00 0.02 0.00 0.00 54.97 53.97 3gue s GLU 68 Cb 0.00 -0.84 0.19 0.00 0.10 0.00 0.00 34.13 33.57 3gue s GLU 68 CO 0.00 0.20 0.88 1.21 0.02 0.00 0.00 175.26 177.56 3gue s ASN 69 N -1.48 6.69 0.53 -0.19 3.84 -1.26 -4.90 114.94 118.18 3gue s ASN 69 Ca -0.01 -2.43 0.20 0.00 0.21 0.00 0.00 52.86 50.83 3gue s ASN 69 Cb -0.09 -2.27 1.38 0.00 -0.55 0.00 0.00 41.25 39.71 3gue s ASN 69 CO 0.02 -0.75 2.13 0.74 -2.79 0.00 0.00 177.10 176.45 3gue h THR 70 N 5.17 0.87 -0.95 -5.21 2.02 -1.98 -1.25 112.91 111.59 3gue h THR 70 Ca 0.10 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.47 3gue h THR 70 Cb 1.04 0.94 -0.08 0.00 -1.74 0.00 0.00 68.15 68.31 3gue h THR 70 CO 0.88 0.00 0.60 0.00 0.37 0.00 0.00 175.52 177.38 3gue h ALA 71 N 1.94 1.93 -0.38 6.16 0.00 -1.99 -1.32 119.26 125.59 3gue h ALA 71 Ca 0.05 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 3gue h ALA 71 Cb 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3gue h ALA 71 CO -0.00 -0.24 -0.23 -0.07 0.00 0.00 0.00 179.25 178.71 3gue h LEU 72 N 0.61 0.86 -1.19 0.00 3.38 -1.65 -3.14 115.31 114.18 3gue h LEU 72 Ca 0.51 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3gue h LEU 72 Cb 0.98 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 3gue h LEU 72 CO -0.26 1.09 0.55 0.25 0.09 0.00 0.00 178.44 180.16 3gue h LEU 73 N 0.62 0.94 -2.86 1.67 5.85 -1.38 0.90 115.31 121.06 3gue h LEU 73 Ca 0.08 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 3gue h LEU 73 Cb 0.79 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 3gue h LEU 73 CO 0.06 0.68 -0.00 0.03 -0.34 0.00 0.00 178.44 178.87 3gue h ARG 74 N 1.11 0.00 -0.02 1.25 3.08 -1.26 -0.80 114.38 117.75 3gue h ARG 74 Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.36 3gue h ARG 74 Cb -0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.93 3gue h ARG 74 CO -0.07 0.00 -0.07 1.04 -1.07 0.00 0.00 179.97 179.80 3gue n GLN 75 N -3.18 1.66 -3.70 0.04 6.02 0.29 -4.80 117.38 113.71 3gue n GLN 75 Ca -0.03 -1.13 -0.30 0.00 -0.01 0.00 0.00 57.00 55.53 3gue n GLN 75 Cb 0.08 -1.48 -0.04 0.00 1.02 0.00 0.00 30.24 29.83 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 -2.11 3.83 -0.01 -1.58 0.00 -0.31 -1.32 121.76 120.25 3gue s ALA 76 Ca 0.32 -0.67 -0.03 0.00 0.00 0.00 0.00 51.96 51.58 3gue s ALA 76 Cb 0.20 -2.06 0.00 0.00 0.00 0.00 0.00 23.12 21.27 3gue s ALA 76 CO 0.37 0.62 0.07 0.08 0.00 0.00 0.00 175.76 176.90 3gue s VAL 77 N -1.71 0.04 -0.10 0.00 1.01 -0.41 -4.32 120.40 114.91 3gue s VAL 77 Ca 0.40 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 3gue s VAL 77 Cb -0.12 -0.21 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 3gue s VAL 77 CO 0.26 -0.18 -0.07 -0.69 0.00 0.00 0.00 175.10 174.42 3gue s VAL 78 N -0.55 3.62 -0.08 2.92 1.01 -0.12 -0.91 120.40 126.30 3gue s VAL 78 Ca -0.06 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.46 3gue s VAL 78 Cb -0.04 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.84 3gue s VAL 78 CO 0.00 0.55 -0.15 -0.22 0.00 0.00 0.00 175.10 175.29 3gue s LEU 79 N -0.26 1.73 -0.20 3.92 2.96 0.05 -1.14 118.68 125.74 3gue s LEU 79 Ca 0.03 -0.36 -0.05 0.00 -0.22 0.00 0.00 54.13 53.53 3gue s LEU 79 Cb -0.13 -0.97 -0.02 0.00 0.50 0.00 0.00 46.19 45.57 3gue s LEU 79 CO 0.03 0.05 0.00 -0.54 -1.32 0.00 0.00 176.35 174.57 3gue s LYS 80 N 0.65 3.63 0.27 1.98 -0.14 -0.33 -2.67 119.74 123.14 3gue s LYS 80 Ca -0.14 -0.51 -0.29 0.00 -1.36 0.00 0.00 55.97 53.66 3gue s LYS 80 Cb -0.16 -3.08 -0.10 0.00 -1.68 0.00 0.00 37.83 32.81 3gue s LYS 80 CO 0.04 0.02 1.35 -0.51 -0.76 0.00 0.00 175.35 175.50 3gue s LEU 81 N 0.97 4.41 0.00 3.17 1.43 -0.48 -1.78 118.68 126.40 3gue s LEU 81 Ca 0.02 2.62 0.06 0.00 -1.03 0.00 0.00 54.13 55.79 3gue s LEU 81 Cb -0.14 -3.63 0.09 0.00 0.03 0.00 0.00 46.19 42.54 3gue s LEU 81 CO 0.02 -0.59 0.90 -3.20 0.23 0.00 0.00 176.35 173.71 3gue n ASN 82 N 1.74 -0.12 -0.00 2.29 5.15 0.47 -1.48 115.26 123.30 3gue n ASN 82 Ca 0.04 -1.73 0.07 0.00 -0.60 0.00 0.00 54.58 52.35 3gue n ASN 82 Cb 0.41 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.58 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 0.11 -0.38 3.82 8.20 0.00 -0.64 -4.34 105.19 111.95 3gue n GLY 83 Ca -0.08 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.44 1.62 -0.01 -0.02 0.00 -1.26 -4.33 107.32 100.88 3gue s GLY 84 Ca 0.05 -0.30 0.16 0.00 0.00 0.00 0.00 44.72 44.64 3gue s GLY 84 CO 0.60 0.15 0.60 1.04 0.00 0.00 0.00 173.10 175.48 3gue n LEU 85 N -3.41 0.56 -2.56 0.66 4.77 -1.26 -4.50 117.00 111.26 3gue n LEU 85 Ca 0.07 -0.37 -0.18 0.00 -0.03 0.00 0.00 56.01 55.50 3gue n LEU 85 Cb 0.57 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.69 3gue n LEU 85 CO 0.57 0.14 0.02 0.61 -1.33 0.00 0.00 177.39 177.40 3gue n GLY 86 N 1.43 -0.30 0.20 -0.72 0.00 -1.26 -2.67 105.19 101.88 3gue n GLY 86 Ca 0.01 -0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.26 1.33 -1.01 2.61 1.35 -1.92 -0.96 112.91 113.05 3gue h THR 87 Ca -0.44 -1.73 0.23 0.00 -0.55 0.00 0.00 66.41 63.92 3gue h THR 87 Cb 1.30 1.77 -0.10 0.00 -1.73 0.00 0.00 68.15 69.39 3gue h THR 87 CO 0.47 0.53 0.63 1.23 -0.25 0.00 0.00 175.52 178.12 3gue h GLY 88 N 1.22 1.48 -2.38 5.82 0.00 -1.90 0.14 103.07 107.44 3gue h GLY 88 Ca 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3gue h GLY 88 CO 0.09 -0.12 0.00 1.03 0.00 0.00 0.00 176.54 177.54 3gue n MET 89 N -4.70 2.55 -2.17 4.80 2.81 -0.96 -4.64 117.12 114.80 3gue n MET 89 Ca 0.24 -2.31 -0.04 0.00 -1.81 0.00 0.00 57.70 53.78 3gue n MET 89 Cb 0.74 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.73 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 1.48 0.31 3.88 3.03 0.00 0.50 -1.40 105.19 112.99 3gue n GLY 90 Ca 0.21 -0.70 -0.28 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.19 4.16 -0.49 0.99 1.43 -0.40 -4.73 118.68 118.45 3gue s LEU 91 Ca 0.02 0.11 0.04 0.00 -1.03 0.00 0.00 54.13 53.27 3gue s LEU 91 Cb -0.01 -2.76 0.41 0.00 0.03 0.00 0.00 46.19 43.86 3gue s LEU 91 CO 0.02 0.10 1.17 -3.20 0.23 0.00 0.00 176.35 174.68 3gue n ASN 92 N -0.13 4.93 0.00 2.29 5.15 -1.25 -3.99 115.26 122.26 3gue n ASN 92 Ca -0.07 -3.73 0.00 0.00 -0.60 0.00 0.00 54.58 50.18 3gue n ASN 92 Cb 0.53 -0.52 0.00 0.00 -0.53 0.00 0.00 39.78 39.26 3gue n ASN 92 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gue n GLY 93 N -0.46 -0.95 3.63 8.20 0.00 -1.09 -4.97 105.19 109.55 3gue n GLY 93 Ca 0.40 -1.03 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.38 3.87 0.61 1.61 0.04 -1.26 -4.21 135.00 134.28 3gue s PRO 94 Ca 0.00 1.63 0.34 0.00 0.04 0.00 0.00 61.00 63.02 3gue s PRO 94 Cb 0.00 -3.99 2.00 0.00 0.04 0.00 0.00 34.50 32.55 3gue s PRO 94 CO 0.00 -1.19 2.29 -0.22 0.04 0.00 0.00 177.00 177.91 3gue h LYS 95 N 10.24 0.00 0.00 4.56 3.64 -1.88 -2.57 116.57 130.56 3gue h LYS 95 Ca -0.32 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.05 3gue h LYS 95 Cb 1.14 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3gue h LYS 95 CO 1.00 0.00 -0.02 0.66 -2.27 0.00 0.00 179.45 178.82 3gue h SER 96 N 0.00 0.00 -0.05 4.20 4.64 -1.90 -1.32 113.55 119.12 3gue h SER 96 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gue h SER 96 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3gue h SER 96 CO 0.00 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.16 3gue n LEU 97 N -3.24 0.88 -4.75 5.97 4.77 -0.97 -1.57 117.00 118.10 3gue n LEU 97 Ca -0.02 -0.34 -0.41 0.00 -0.03 0.00 0.00 56.01 55.22 3gue n LEU 97 Cb 0.16 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 3gue n LEU 97 CO 0.24 0.17 0.94 -0.76 -1.33 0.00 0.00 177.39 176.65 3gue s LEU 98 N -1.77 4.45 0.31 2.23 1.02 -0.50 -4.86 118.68 119.57 3gue s LEU 98 Ca 0.36 2.48 -0.29 0.00 0.02 0.00 0.00 54.13 56.70 3gue s LEU 98 Cb 0.18 -3.63 -0.10 0.00 0.02 0.00 0.00 46.19 42.66 3gue s LEU 98 CO 0.29 -0.44 1.22 -1.10 0.02 0.00 0.00 176.35 176.34 3gue s GLN 99 N -1.06 4.47 0.05 1.70 -0.21 -1.26 -2.58 119.66 120.77 3gue s GLN 99 Ca 0.51 2.05 -0.02 0.00 0.02 0.00 0.00 55.36 57.91 3gue s GLN 99 Cb -0.37 -3.11 -0.01 0.00 1.00 0.00 0.00 33.01 30.52 3gue s GLN 99 CO 0.44 -0.03 -0.05 0.28 -2.12 0.00 0.00 175.29 173.82 3gue n VAL 100 N 0.94 1.19 -3.77 1.09 0.31 0.13 -4.92 118.33 113.31 3gue n VAL 100 Ca -0.00 0.34 -0.13 0.00 -0.01 0.00 0.00 64.34 64.53 3gue n VAL 100 Cb 0.43 -1.68 -0.10 0.00 -0.91 0.00 0.00 33.84 31.58 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 -2.12 0.55 -1.99 5.55 1.02 -1.08 -4.33 119.74 117.34 3gue s LYS 101 Ca -0.04 0.04 0.00 0.00 0.02 0.00 0.00 55.97 55.99 3gue s LYS 101 Cb 0.01 0.25 0.00 0.00 -0.52 0.00 0.00 37.83 37.57 3gue s LYS 101 CO 0.06 -0.13 0.00 0.09 -0.92 0.00 0.00 175.35 174.45 3gue n ASN 102 N 1.90 -5.58 -0.06 2.83 5.03 -1.26 0.47 115.26 118.61 3gue n ASN 102 Ca -0.18 0.28 -0.01 0.00 0.87 0.00 0.00 54.58 55.54 3gue n ASN 102 Cb 0.57 -4.80 -0.00 0.00 -1.02 0.00 0.00 39.78 34.52 3gue n ASN 102 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3gue n GLY 103 N -0.65 0.34 3.72 7.41 0.00 -1.26 -5.02 105.19 109.73 3gue n GLY 103 Ca -0.22 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.04 4.30 0.87 1.61 -1.52 0.18 -4.93 119.66 119.13 3gue s GLN 104 Ca 0.00 0.36 -0.10 0.00 -1.95 0.00 0.00 55.36 53.67 3gue s GLN 104 Cb 0.00 -3.45 0.19 0.00 -0.22 0.00 0.00 33.01 29.53 3gue s GLN 104 CO 0.00 0.14 1.19 0.25 -0.25 0.00 0.00 175.29 176.61 3gue n THR 105 N 3.76 0.00 -0.08 -0.19 -2.24 -1.26 0.20 114.28 114.48 3gue n THR 105 Ca -0.08 -1.18 -0.01 0.00 -2.27 0.00 0.00 64.05 60.51 3gue n THR 105 Cb 0.52 -1.29 0.25 0.00 -2.10 0.00 0.00 70.33 67.71 3gue n THR 105 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3gue h PHE 106 N -1.32 0.71 0.01 4.78 0.04 -1.02 -2.65 116.94 117.49 3gue h PHE 106 Ca -0.39 -0.05 -0.21 0.00 2.80 0.00 0.00 57.97 60.12 3gue h PHE 106 Cb 1.18 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 39.11 3gue h PHE 106 CO 0.00 0.61 -0.93 1.25 -0.60 0.00 0.00 178.31 178.64 3gue h LEU 107 N 0.68 0.37 0.09 1.54 5.85 -1.69 -1.29 115.31 120.87 3gue h LEU 107 Ca 0.16 -0.31 0.02 0.00 0.84 0.00 0.00 57.88 58.58 3gue h LEU 107 Cb 0.25 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 3gue h LEU 107 CO -0.00 1.12 -0.49 0.44 -0.34 0.00 0.00 178.44 179.16 3gue h ASP 108 N 0.15 -1.48 -0.99 1.25 3.32 -1.82 -0.23 116.42 116.62 3gue h ASP 108 Ca -0.06 0.16 0.13 0.00 0.02 0.00 0.00 57.03 57.28 3gue h ASP 108 Cb 1.57 0.55 -0.09 0.00 0.22 0.00 0.00 39.33 41.59 3gue h ASP 108 CO 0.15 -0.53 0.61 -0.26 -1.72 0.00 0.00 179.24 177.49 3gue h PHE 109 N -0.70 1.10 -0.18 4.55 0.04 -1.25 0.13 116.94 120.63 3gue h PHE 109 Ca 0.01 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 3gue h PHE 109 Cb 0.73 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 3gue h PHE 109 CO -0.44 0.40 0.05 1.15 -0.60 0.00 0.00 178.31 178.87 3gue h THR 110 N 0.93 1.19 -0.70 -1.55 2.02 -1.11 0.09 112.91 113.79 3gue h THR 110 Ca 0.50 -0.61 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 3gue h THR 110 Cb 0.55 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 3gue h THR 110 CO -0.29 0.19 0.29 0.00 0.37 0.00 0.00 175.52 176.08 3gue h ALA 111 N 0.87 1.19 -0.05 6.16 0.00 -0.62 -2.32 119.26 124.49 3gue h ALA 111 Ca 0.06 -0.17 -0.23 0.00 0.00 0.00 0.00 54.91 54.57 3gue h ALA 111 Cb 0.24 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.76 3gue h ALA 111 CO -0.00 0.59 -0.88 -0.07 0.00 0.00 0.00 179.25 178.89 3gue h LEU 112 N 1.01 0.70 -0.58 0.00 3.38 -0.90 -2.43 115.31 116.47 3gue h LEU 112 Ca 0.24 -0.51 0.01 0.00 0.09 0.00 0.00 57.88 57.71 3gue h LEU 112 Cb 0.18 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3gue h LEU 112 CO -0.02 1.30 0.38 1.56 0.09 0.00 0.00 178.44 181.74 3gue h GLN 113 N 0.35 0.74 -0.26 1.13 4.20 -0.91 -1.02 115.11 119.34 3gue h GLN 113 Ca -0.07 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.53 3gue h GLN 113 Cb 1.51 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 29.12 3gue h GLN 113 CO 0.16 0.49 -0.08 1.25 -0.67 0.00 0.00 178.83 179.98 3gue h LEU 114 N 0.76 0.51 -0.75 1.46 5.85 -1.41 -0.74 115.31 120.99 3gue h LEU 114 Ca 0.22 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 3gue h LEU 114 Cb -0.05 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 3gue h LEU 114 CO -0.07 0.78 0.42 -0.08 -0.34 0.00 0.00 178.44 179.15 3gue h GLU 115 N 0.24 1.05 -0.47 1.25 4.81 -1.40 0.01 114.58 120.07 3gue h GLU 115 Ca 0.06 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 3gue h GLU 115 Cb 0.56 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 3gue h GLU 115 CO 0.03 0.77 0.20 1.25 -0.73 0.00 0.00 179.01 180.53 3gue h HIS 116 N 1.04 0.71 0.48 0.92 2.76 -0.85 -1.48 115.15 118.74 3gue h HIS 116 Ca 0.27 -0.05 -0.02 0.00 -2.20 0.00 0.00 60.37 58.37 3gue h HIS 116 Cb 0.03 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 28.77 3gue h HIS 116 CO -0.00 0.59 -0.29 0.35 -1.30 0.00 0.00 177.93 177.28 3gue h PHE 117 N 0.62 -0.77 -0.77 5.26 3.57 -0.75 -1.28 116.94 122.82 3gue h PHE 117 Ca 0.16 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.72 3gue h PHE 117 Cb 0.18 0.27 -0.06 0.00 2.79 0.00 0.00 35.95 39.13 3gue h PHE 117 CO 0.00 -0.45 0.45 0.00 -2.23 0.00 0.00 178.31 176.07 3gue h ARG 118 N -0.74 0.77 0.41 1.11 3.08 -0.98 -2.30 114.38 115.73 3gue h ARG 118 Ca -0.06 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 3gue h ARG 118 Cb 0.60 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.48 3gue h ARG 118 CO 0.06 0.51 -0.20 1.96 -1.07 0.00 0.00 179.97 181.23 3gue h GLN 119 N 0.79 -0.53 -0.79 0.04 1.08 -1.18 -1.90 115.11 112.62 3gue h GLN 119 Ca 0.35 0.04 0.16 0.00 -1.45 0.00 0.00 58.65 57.75 3gue h GLN 119 Cb 0.25 0.12 -0.10 0.00 -0.05 0.00 0.00 27.48 27.70 3gue h GLN 119 CO -0.20 -0.36 0.32 0.28 -0.95 0.00 0.00 178.83 177.92 3gue h VAL 120 N -0.62 0.62 -0.01 -0.54 2.07 -1.24 -0.80 116.25 115.73 3gue h VAL 120 Ca -0.06 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.31 3gue h VAL 120 Cb 0.42 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 3gue h VAL 120 CO 0.09 0.08 -0.11 0.54 0.02 0.00 0.00 177.57 178.20 3gue n ARG 121 N -5.01 1.40 -4.06 1.57 1.74 -0.87 -4.96 116.66 106.46 3gue n ARG 121 Ca 0.16 -0.86 -0.40 0.00 -0.77 0.00 0.00 57.85 55.98 3gue n ARG 121 Cb 0.46 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.42 3gue n ARG 121 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3gue n ASN 122 N -0.05 -2.94 -3.55 0.55 5.15 -0.31 -4.97 115.26 109.14 3gue n ASN 122 Ca 0.16 -1.24 -0.12 0.00 -0.60 0.00 0.00 54.58 52.78 3gue n ASN 122 Cb 0.37 -2.01 -0.11 0.00 -0.53 0.00 0.00 39.78 37.50 3gue n ASN 122 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gue n ASN 124 N 5.36 6.69 -4.70 0.00 5.15 -1.26 -4.28 115.26 122.20 3gue n ASN 124 Ca -0.06 -2.60 -0.42 0.00 -0.60 0.00 0.00 54.58 50.90 3gue n ASN 124 Cb 0.50 -1.48 -0.03 0.00 -0.53 0.00 0.00 39.78 38.23 3gue n ASN 124 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 3gue n VAL 125 N 4.17 0.16 -1.74 3.44 3.14 -1.26 -4.93 118.33 121.32 3gue n VAL 125 Ca 0.66 -0.03 -0.39 0.00 -2.96 0.00 0.00 64.34 61.62 3gue n VAL 125 Cb 0.26 -2.04 0.03 0.00 -1.06 0.00 0.00 33.84 31.04 3gue n VAL 125 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 3gue n PRO 126 N 4.71 1.83 -3.89 1.45 -0.02 -1.26 -4.88 135.00 132.94 3gue n PRO 126 Ca 0.17 0.67 -0.13 0.00 -2.02 0.00 0.00 63.50 62.19 3gue n PRO 126 Cb 0.36 -2.56 -0.14 0.00 -0.02 0.00 0.00 33.50 31.14 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 -1.26 0.07 0.04 6.00 5.36 -1.26 -0.94 117.98 125.98 3gue s PHE 127 Ca 0.68 0.00 -0.03 0.00 -0.96 0.00 0.00 56.93 56.63 3gue s PHE 127 Cb -0.43 -0.07 -0.02 0.00 -0.34 0.00 0.00 43.02 42.15 3gue s PHE 127 CO 0.52 -0.01 0.03 -1.64 -1.46 0.00 0.00 175.22 172.65 3gue s MET 128 N 0.14 0.52 -0.09 10.12 -1.94 -0.29 -4.27 119.30 123.48 3gue s MET 128 Ca -0.01 -0.84 0.01 0.00 -1.71 0.00 0.00 55.69 53.14 3gue s MET 128 Cb -0.02 0.19 0.02 0.00 2.01 0.00 0.00 34.83 37.03 3gue s MET 128 CO -0.00 -0.11 -0.09 -0.51 -0.01 0.00 0.00 175.02 174.30 3gue s LEU 129 N -2.15 1.33 -0.44 -0.03 1.43 -0.28 -1.18 118.68 117.37 3gue s LEU 129 Ca -0.05 -0.28 -0.25 0.00 -1.03 0.00 0.00 54.13 52.52 3gue s LEU 129 Cb -0.01 -0.79 0.02 0.00 0.03 0.00 0.00 46.19 45.44 3gue s LEU 129 CO -0.05 -0.06 0.91 -0.32 0.23 0.00 0.00 176.35 177.05 3gue s MET 130 N 1.30 3.60 0.21 1.70 -2.45 -0.74 -0.96 119.30 121.96 3gue s MET 130 Ca -0.03 0.24 0.06 0.00 -1.25 0.00 0.00 55.69 54.72 3gue s MET 130 Cb -0.14 -3.89 -0.04 0.00 1.25 0.00 0.00 34.83 32.01 3gue s MET 130 CO -0.03 -1.14 0.14 -0.80 1.05 0.00 0.00 175.02 174.23 3gue s ASN 131 N 2.15 5.36 0.53 1.11 0.01 -0.23 -0.40 114.94 123.48 3gue s ASN 131 Ca 0.36 -0.25 0.04 0.00 -0.71 0.00 0.00 52.86 52.31 3gue s ASN 131 Cb -0.11 -1.33 0.02 0.00 0.41 0.00 0.00 41.25 40.24 3gue s ASN 131 CO 0.24 0.02 0.26 -0.94 -1.51 0.00 0.00 177.10 175.17 3gue s SER 132 N -3.44 4.46 0.51 -1.22 1.04 -1.26 -1.22 113.70 112.58 3gue s SER 132 Ca 0.31 -1.38 0.24 0.00 0.48 0.00 0.00 55.95 55.60 3gue s SER 132 Cb -0.09 0.44 1.35 0.00 0.10 0.00 0.00 66.02 67.82 3gue s SER 132 CO 0.23 -1.01 1.97 2.19 0.98 0.00 0.00 173.24 177.60 3gue h PHE 133 N 0.96 0.08 0.00 5.02 -5.15 -1.88 -1.42 116.94 114.57 3gue h PHE 133 Ca -0.39 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.38 3gue h PHE 133 Cb 1.31 -0.03 0.00 0.00 0.22 0.00 0.00 35.95 37.45 3gue h PHE 133 CO 1.16 0.03 -0.39 0.77 -2.00 0.00 0.00 178.31 177.88 3gue h SER 134 N 0.07 0.00 0.00 -0.68 0.02 -1.95 -3.38 113.55 107.63 3gue h SER 134 Ca 0.29 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 3gue h SER 134 Cb 1.06 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.60 3gue h SER 134 CO -0.02 0.01 -1.15 0.35 -1.14 0.00 0.00 176.83 174.88 3gue n THR 135 N -2.81 0.00 0.21 -2.27 -2.24 -0.88 -4.34 114.28 101.95 3gue n THR 135 Ca 0.03 -0.07 -0.15 0.00 -2.27 0.00 0.00 64.05 61.59 3gue n THR 135 Cb 0.52 0.41 -0.07 0.00 -2.10 0.00 0.00 70.33 69.09 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 -0.61 0.01 3.42 0.87 -1.47 -2.08 113.55 113.69 3gue h SER 136 Ca -0.00 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3gue h SER 136 Cb 0.16 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 3gue h SER 136 CO 0.00 -0.37 -0.00 1.23 -0.53 0.00 0.00 176.83 177.16 3gue h GLY 137 N -0.56 -0.01 1.01 5.77 0.00 -1.86 0.33 103.07 107.76 3gue h GLY 137 Ca -0.03 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.31 3gue h GLY 137 CO 0.00 -0.00 0.57 0.83 0.00 0.00 0.00 176.54 177.94 3gue h GLU 138 N -0.08 1.16 -0.15 4.80 5.08 -1.88 -1.33 114.58 122.17 3gue h GLU 138 Ca -0.00 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3gue h GLU 138 Cb 0.07 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 3gue h GLU 138 CO 0.00 0.77 0.05 1.15 -1.00 0.00 0.00 179.01 179.98 3gue h THR 139 N 1.19 1.18 -0.34 1.13 2.02 -1.28 -1.09 112.91 115.72 3gue h THR 139 Ca 0.32 -0.56 0.04 0.00 0.77 0.00 0.00 66.41 66.98 3gue h THR 139 Cb -0.13 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 3gue h THR 139 CO -0.07 0.17 0.13 0.50 0.37 0.00 0.00 175.52 176.62 3gue h LYS 140 N 0.07 0.27 -0.43 6.66 3.64 -0.81 -1.43 116.57 124.54 3gue h LYS 140 Ca 0.05 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.28 3gue h LYS 140 Cb 0.22 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 3gue h LYS 140 CO -0.00 0.18 -0.25 -0.97 -2.27 0.00 0.00 179.45 176.14 3gue h ASN 141 N 0.28 0.91 -0.64 4.20 -1.24 -1.20 -2.51 115.58 115.37 3gue h ASN 141 Ca 0.15 -0.35 0.09 0.00 0.71 0.00 0.00 56.30 56.90 3gue h ASN 141 Cb 0.11 -0.25 -0.07 0.00 0.73 0.00 0.00 38.32 38.84 3gue h ASN 141 CO -0.14 1.10 0.28 0.15 -1.29 0.00 0.00 177.43 177.53 3gue h PHE 142 N 0.76 0.49 0.00 0.67 3.57 -0.97 -2.58 116.94 118.88 3gue h PHE 142 Ca 0.10 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.62 3gue h PHE 142 Cb 0.80 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.41 3gue h PHE 142 CO 0.05 0.15 0.00 1.28 -2.23 0.00 0.00 178.31 177.56 3gue n LEU 143 N -4.94 0.00 -0.27 0.59 4.77 -0.56 -2.67 117.00 113.92 3gue n LEU 143 Ca 0.09 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.21 3gue n LEU 143 Cb 0.27 -0.00 0.39 0.00 -2.33 0.00 0.00 43.42 41.75 3gue n LEU 143 CO 0.23 -0.00 1.22 0.03 -1.33 0.00 0.00 177.39 177.54 3gue h ARG 144 N 0.00 0.63 -0.45 3.23 3.08 -1.48 0.12 114.38 119.52 3gue h ARG 144 Ca 0.00 -0.04 0.13 0.00 0.07 0.00 0.00 59.98 60.14 3gue h ARG 144 Cb 0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3gue h ARG 144 CO 0.00 0.42 0.36 -0.22 -1.07 0.00 0.00 179.97 179.46 3gue h LYS 145 N 0.65 0.00 -3.25 0.04 3.64 -1.75 -3.31 116.57 112.60 3gue h LYS 145 Ca 0.46 0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 59.17 3gue h LYS 145 Cb 0.80 0.00 -0.38 0.00 -0.41 0.00 0.00 32.23 32.24 3gue h LYS 145 CO -0.21 0.00 -0.29 0.71 -2.27 0.00 0.00 179.45 177.38 3gue s TYR 146 N -4.89 3.74 0.46 1.91 2.02 0.42 -4.96 117.35 116.05 3gue s TYR 146 Ca -0.05 -3.14 0.23 0.00 -0.37 0.00 0.00 57.07 53.75 3gue s TYR 146 Cb 0.18 -3.04 1.24 0.00 -0.40 0.00 0.00 41.96 39.94 3gue s TYR 146 CO 0.67 -0.67 1.84 -1.35 -1.57 0.00 0.00 175.55 174.47 3gue h PRO 147 N 5.84 0.25 -0.89 -1.71 0.11 -1.71 0.13 132.00 134.02 3gue h PRO 147 Ca 0.14 -0.02 0.11 0.00 0.11 0.00 0.00 66.00 66.35 3gue h PRO 147 Cb 0.80 -0.06 -0.08 0.00 0.11 0.00 0.00 31.00 31.77 3gue h PRO 147 CO 0.79 0.17 0.52 1.15 -0.21 0.00 0.00 178.00 180.42 3gue h THR 148 N 0.26 0.88 0.05 -1.15 2.02 -1.93 -1.68 112.91 111.37 3gue h THR 148 Ca 0.49 -0.29 -0.18 0.00 0.77 0.00 0.00 66.41 67.21 3gue h THR 148 Cb 1.49 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 3gue h THR 148 CO -0.14 0.15 -0.92 -0.07 0.37 0.00 0.00 175.52 174.91 3gue h LEU 149 N 0.84 0.18 -0.51 2.58 3.38 -1.27 -3.40 115.31 117.11 3gue h LEU 149 Ca 0.44 -0.81 0.07 0.00 0.09 0.00 0.00 57.88 57.67 3gue h LEU 149 Cb 0.46 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 3gue h LEU 149 CO -0.27 1.39 0.19 0.22 0.09 0.00 0.00 178.44 180.06 3gue h TYR 150 N -0.69 0.34 0.00 1.13 3.20 -0.71 -0.31 116.97 119.93 3gue h TYR 150 Ca -0.21 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.68 3gue h TYR 150 Cb 1.41 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.61 3gue h TYR 150 CO 0.17 0.11 0.00 0.39 -1.64 0.00 0.00 178.16 177.19 3gue n GLU 151 N -4.99 0.13 -0.16 1.82 1.02 -0.64 -2.09 120.64 115.72 3gue n GLU 151 Ca 0.06 0.46 0.04 0.00 -0.02 0.00 0.00 57.16 57.69 3gue n GLU 151 Cb 0.20 -1.79 0.06 0.00 -0.02 0.00 0.00 31.44 29.89 3gue n GLU 151 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 3gue n VAL 152 N -2.04 0.96 0.24 2.62 0.24 -0.91 -4.90 118.33 114.54 3gue n VAL 152 Ca 0.01 -1.12 -0.16 0.00 -2.04 0.00 0.00 64.34 61.03 3gue n VAL 152 Cb 0.15 0.27 -0.08 0.00 -1.47 0.00 0.00 33.84 32.70 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 0.00 -1.10 -0.05 6.34 3.57 -0.50 0.13 116.94 125.33 3gue h PHE 153 Ca 0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 3gue h PHE 153 Cb 1.01 0.43 -0.00 0.00 2.79 0.00 0.00 35.95 40.17 3gue h PHE 153 CO 0.03 -0.55 0.03 -0.44 -2.23 0.00 0.00 178.31 175.14 3gue h ASP 154 N -0.81 0.07 0.53 0.41 3.32 -1.89 0.40 116.42 118.45 3gue h ASP 154 Ca -0.03 -0.09 -0.21 0.00 0.02 0.00 0.00 57.03 56.72 3gue h ASP 154 Cb 0.73 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 3gue h ASP 154 CO -0.08 0.14 -0.93 0.77 -1.72 0.00 0.00 179.24 177.42 3gue h SER 155 N -0.01 0.34 0.00 6.45 4.64 -1.91 -3.40 113.55 119.66 3gue h SER 155 Ca 0.02 -0.29 -0.03 0.00 -0.47 0.00 0.00 61.79 61.02 3gue h SER 155 Cb 0.09 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3gue h SER 155 CO -0.00 1.11 -1.11 0.47 -0.87 0.00 0.00 176.83 176.42 3gue n ASP 156 N -3.66 2.85 -0.04 4.97 9.92 0.41 -4.92 116.55 126.09 3gue n ASP 156 Ca -0.05 -0.00 -0.17 0.00 -0.53 0.00 0.00 54.79 54.04 3gue n ASP 156 Cb 0.84 -0.04 -0.13 0.00 -0.64 0.00 0.00 41.12 41.15 3gue n ASP 156 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 3gue h ILE 157 N -0.02 1.57 -3.61 0.53 1.08 -0.98 -3.44 117.51 112.65 3gue h ILE 157 Ca -0.05 -2.38 -0.51 0.00 -0.39 0.00 0.00 64.86 61.53 3gue h ILE 157 Cb 1.06 3.17 0.01 0.00 -3.07 0.00 0.00 36.82 37.99 3gue h ILE 157 CO -0.01 0.61 0.48 -0.70 -0.69 0.00 0.00 178.15 177.83 3gue s GLU 158 N -2.30 4.60 -0.30 2.37 2.12 0.09 -1.13 118.70 124.16 3gue s GLU 158 Ca -0.19 1.74 0.03 0.00 0.36 0.00 0.00 54.97 56.90 3gue s GLU 158 Cb -0.01 -3.26 0.08 0.00 0.26 0.00 0.00 34.13 31.21 3gue s GLU 158 CO 0.72 0.10 -0.01 -1.17 -0.54 0.00 0.00 175.26 174.36 3gue s LEU 159 N -0.59 3.79 -0.23 2.70 2.96 -0.14 -4.89 118.68 122.29 3gue s LEU 159 Ca 0.48 -1.73 -0.26 0.00 -0.22 0.00 0.00 54.13 52.41 3gue s LEU 159 Cb -0.30 -1.46 -0.00 0.00 0.50 0.00 0.00 46.19 44.93 3gue s LEU 159 CO 0.36 -0.30 0.87 -0.32 -1.32 0.00 0.00 176.35 175.64 3gue s MET 160 N 1.11 4.22 0.91 1.98 -2.45 -1.26 -1.07 119.30 122.73 3gue s MET 160 Ca 0.02 1.04 -0.11 0.00 -1.25 0.00 0.00 55.69 55.40 3gue s MET 160 Cb -0.19 -3.63 0.20 0.00 1.25 0.00 0.00 34.83 32.45 3gue s MET 160 CO -0.08 -0.51 1.24 1.14 1.05 0.00 0.00 175.02 177.85 3gue s GLN 161 N 2.82 0.78 0.77 4.11 -2.07 -0.35 -4.96 119.66 120.75 3gue s GLN 161 Ca 0.37 -0.77 -0.08 0.00 -1.82 0.00 0.00 55.36 53.06 3gue s GLN 161 Cb -0.15 -2.00 0.10 0.00 -1.09 0.00 0.00 33.01 29.86 3gue s GLN 161 CO 0.08 -2.22 1.09 -0.80 -1.32 0.00 0.00 175.29 172.11 3gue s ASN 162 N -4.90 4.39 0.06 12.60 0.02 -1.26 -4.78 114.94 121.07 3gue s ASN 162 Ca 0.73 0.33 0.03 0.00 -1.02 0.00 0.00 52.86 52.93 3gue s ASN 162 Cb -0.03 -0.81 -0.03 0.00 0.02 0.00 0.00 41.25 40.40 3gue s ASN 162 CO 0.51 -1.88 -0.09 0.00 0.02 0.00 0.00 177.10 175.65 3gue s ARG 163 N -5.39 0.67 0.04 -0.60 1.70 -1.26 -4.22 118.95 109.89 3gue s ARG 163 Ca 0.64 -0.92 0.03 0.00 -0.47 0.00 0.00 55.73 55.00 3gue s ARG 163 Cb -0.09 -0.42 -0.02 0.00 -0.57 0.00 0.00 34.95 33.86 3gue s ARG 163 CO 0.47 0.07 -0.09 0.14 -1.08 0.00 0.00 175.30 174.80 3gue s VAL 164 N -1.79 0.69 0.41 4.99 -7.23 -0.31 -4.94 120.40 112.22 3gue s VAL 164 Ca -0.04 -0.94 -0.23 0.00 -1.81 0.00 0.00 61.98 58.96 3gue s VAL 164 Cb -0.07 -0.69 -0.09 0.00 0.56 0.00 0.00 36.38 36.09 3gue s VAL 164 CO 0.00 -0.21 1.03 -2.16 -0.31 0.00 0.00 175.10 173.45 3gue s PRO 165 N -1.26 4.16 0.38 4.82 0.04 -1.26 -0.75 135.00 141.12 3gue s PRO 165 Ca -0.05 1.43 -0.27 0.00 0.04 0.00 0.00 61.00 62.16 3gue s PRO 165 Cb -0.08 -2.47 -0.09 0.00 0.04 0.00 0.00 34.50 31.89 3gue s PRO 165 CO 0.01 -0.13 1.27 0.15 0.04 0.00 0.00 177.00 178.34 3gue s LYS 166 N -2.62 4.11 0.04 4.56 1.02 -0.57 -4.80 119.74 121.48 3gue s LYS 166 Ca 0.59 2.10 0.08 0.00 0.02 0.00 0.00 55.97 58.76 3gue s LYS 166 Cb -0.20 -2.84 -0.03 0.00 -0.52 0.00 0.00 37.83 34.25 3gue s LYS 166 CO 0.25 -0.35 -0.24 0.96 -0.92 0.00 0.00 175.35 175.05 3gue s ILE 167 N -1.25 1.91 0.32 2.17 -4.36 -1.02 -1.83 121.20 117.14 3gue s ILE 167 Ca 0.54 -1.28 -0.29 0.00 -0.26 0.00 0.00 60.65 59.36 3gue s ILE 167 Cb -0.37 -1.64 -0.11 0.00 1.25 0.00 0.00 42.46 41.60 3gue s ILE 167 CO 0.48 0.30 1.42 -0.13 0.24 0.00 0.00 174.94 177.25 3gue s ARG 168 N -1.17 4.24 0.45 0.37 0.52 -0.15 -0.71 118.95 122.50 3gue s ARG 168 Ca 0.10 2.38 0.17 0.00 -0.52 0.00 0.00 55.73 57.85 3gue s ARG 168 Cb -0.09 -3.04 1.06 0.00 0.52 0.00 0.00 34.95 33.39 3gue s ARG 168 CO 0.02 -0.39 1.99 1.96 0.02 0.00 0.00 175.30 178.90 3gue h GLN 169 N 3.74 0.00 0.01 3.54 4.20 -1.56 -1.21 115.11 123.83 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 0.69 0.19 -0.01 0.38 -0.67 0.00 0.00 178.83 179.41 3gue h ASP 170 N 0.00 -0.01 -0.01 1.46 3.04 -1.91 -3.42 116.42 115.57 3gue h ASP 170 Ca -0.00 -0.72 0.00 0.00 -3.24 0.00 0.00 57.03 53.07 3gue h ASP 170 Cb 0.36 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.65 3gue h ASP 170 CO 0.02 0.83 0.00 -0.46 -2.04 0.00 0.00 179.24 177.59 3gue n ASN 171 N -4.68 1.34 -0.21 4.15 0.23 -1.24 -5.01 115.26 109.83 3gue n ASN 171 Ca -0.08 -1.21 -0.03 0.00 -0.53 0.00 0.00 54.58 52.73 3gue n ASN 171 Cb 0.35 -0.01 -0.01 0.00 -2.08 0.00 0.00 39.78 38.03 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 0.12 0.00 -2.10 -2.53 3.72 -0.46 -4.76 117.46 111.45 3gue n PHE 172 Ca 0.02 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.08 3gue n PHE 172 Cb 0.09 -1.79 0.01 0.00 -0.94 0.00 0.00 39.48 36.85 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 -1.45 2.82 0.37 1.38 0.08 -1.26 -4.55 117.98 115.37 3gue s PHE 173 Ca 0.00 1.54 -0.28 0.00 0.12 0.00 0.00 56.93 58.31 3gue s PHE 173 Cb 0.00 -3.13 -0.10 0.00 -0.57 0.00 0.00 43.02 39.22 3gue s PHE 173 CO 0.00 -1.33 1.42 -2.14 -0.10 0.00 0.00 175.22 173.07 3gue s PRO 174 N -3.76 4.13 0.52 0.24 0.02 -1.26 -0.97 135.00 133.91 3gue s PRO 174 Ca 0.67 2.43 -0.20 0.00 0.02 0.00 0.00 61.00 63.92 3gue s PRO 174 Cb -0.19 -2.95 -0.06 0.00 0.02 0.00 0.00 34.50 31.31 3gue s PRO 174 CO 0.33 -0.46 1.13 0.54 -0.33 0.00 0.00 177.00 178.22 3gue s VAL 175 N -1.14 3.18 -0.10 3.83 0.11 -0.76 -4.80 120.40 120.71 3gue s VAL 175 Ca 0.53 0.78 -0.01 0.00 -2.93 0.00 0.00 61.98 60.35 3gue s VAL 175 Cb -0.44 -3.34 -0.03 0.00 -1.53 0.00 0.00 36.38 31.05 3gue s VAL 175 CO 0.59 -0.12 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.28 3gue s THR 176 N -1.71 3.64 -0.42 5.04 2.01 -1.26 -4.86 115.64 118.07 3gue s THR 176 Ca 0.70 -0.48 0.04 0.00 0.31 0.00 0.00 61.69 62.26 3gue s THR 176 Cb -0.25 -2.52 0.17 0.00 0.01 0.00 0.00 72.50 69.91 3gue s THR 176 CO 0.29 0.56 0.34 -0.47 -0.69 0.00 0.00 174.62 174.65 3gue s TYR 177 N -0.29 1.18 0.26 4.92 5.04 -1.26 -5.03 117.35 122.17 3gue s TYR 177 Ca 0.04 -2.36 -0.01 0.00 -2.44 0.00 0.00 57.07 52.30 3gue s TYR 177 Cb -0.13 -0.98 0.55 0.00 0.35 0.00 0.00 41.96 41.75 3gue s TYR 177 CO 0.02 -0.82 1.75 1.05 -1.34 0.00 0.00 175.55 176.22 3gue h GLU 178 N 5.64 0.56 -0.93 4.97 4.11 -1.98 -1.12 114.58 125.83 3gue h GLU 178 Ca 0.26 -0.03 0.18 0.00 0.07 0.00 0.00 59.36 59.84 3gue h GLU 178 Cb 0.90 -0.13 -0.08 0.00 0.50 0.00 0.00 28.75 29.95 3gue h GLU 178 CO 0.38 0.37 0.60 0.00 0.07 0.00 0.00 179.01 180.43 3gue h ALA 179 N 1.58 1.93 -1.22 1.06 0.00 -2.07 -3.37 119.26 117.17 3gue h ALA 179 Ca 0.47 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.26 3gue h ALA 179 Cb 0.70 -0.08 -0.21 0.00 0.00 0.00 0.00 17.79 18.20 3gue h ALA 179 CO -0.39 -0.23 -0.52 0.34 0.00 0.00 0.00 179.25 178.46 3gue s ASP 180 N -5.63 -0.92 0.60 0.00 2.15 -0.54 -5.02 116.67 107.31 3gue s ASP 180 Ca -0.10 -1.17 0.37 0.00 0.43 0.00 0.00 52.55 52.08 3gue s ASP 180 Cb 0.23 1.62 2.03 0.00 -0.30 0.00 0.00 42.92 46.49 3gue s ASP 180 CO 0.79 -0.17 2.14 -0.65 -0.17 0.00 0.00 175.17 177.11 3gue h PRO 181 N 6.62 0.00 -0.59 4.34 0.11 -1.43 -0.67 132.00 140.37 3gue h PRO 181 Ca 0.06 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.19 3gue h PRO 181 Cb 1.14 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 3gue h PRO 181 CO 0.11 0.00 0.39 1.15 -0.21 0.00 0.00 178.00 179.44 3gue h THR 182 N 0.00 1.11 0.00 -1.15 2.02 -1.96 -2.04 112.91 110.89 3gue h THR 182 Ca 0.00 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.92 3gue h THR 182 Cb 0.14 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 3gue h THR 182 CO 0.00 0.14 0.00 0.00 0.37 0.00 0.00 175.52 176.03 3gue n GLU 184 N -1.43 0.30 -4.23 0.00 1.02 -0.77 -4.79 120.64 110.74 3gue n GLU 184 Ca 0.03 0.03 -0.19 0.00 -0.02 0.00 0.00 57.16 57.02 3gue n GLU 184 Cb 0.11 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 29.90 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 -2.66 1.23 0.01 -0.32 0.52 -1.18 -1.52 118.94 115.02 3gue s TRP 185 Ca 0.23 -0.42 -0.00 0.00 0.02 0.00 0.00 56.10 55.92 3gue s TRP 185 Cb 0.18 -0.70 -0.01 0.00 -1.15 0.00 0.00 33.47 31.78 3gue s TRP 185 CO 0.43 0.05 -0.01 0.14 0.02 0.00 0.00 176.95 177.58 3gue s VAL 186 N -1.14 0.06 0.39 4.03 -7.23 0.07 -4.81 120.40 111.77 3gue s VAL 186 Ca -0.01 -0.52 -0.28 0.00 -1.81 0.00 0.00 61.98 59.36 3gue s VAL 186 Cb -0.09 -0.17 -0.10 0.00 0.56 0.00 0.00 36.38 36.57 3gue s VAL 186 CO 0.02 -0.29 1.46 -2.16 -0.31 0.00 0.00 175.10 173.82 3gue s PRO 187 N -0.85 4.05 -0.04 4.82 0.04 -1.26 -1.16 135.00 140.60 3gue s PRO 187 Ca -0.09 2.51 0.01 0.00 0.04 0.00 0.00 61.00 63.47 3gue s PRO 187 Cb -0.06 -2.92 0.09 0.00 0.04 0.00 0.00 34.50 31.66 3gue s PRO 187 CO -0.00 -0.56 0.86 -0.35 0.04 0.00 0.00 177.00 176.99 3gue n PRO 188 N 0.36 1.34 0.00 0.56 -0.04 -1.26 -4.88 135.00 131.08 3gue n PRO 188 Ca 0.02 -0.38 0.00 0.00 -0.04 0.00 0.00 63.50 63.09 3gue n PRO 188 Cb 0.40 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 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 0.18 2.35 0.24 0.55 0.00 -1.26 -1.12 105.19 106.12 3gue n GLY 189 Ca 0.05 -1.88 0.17 0.00 0.00 0.00 0.00 46.02 44.36 3gue n GLY 189 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 3gue h HIS 190 N 0.00 0.00 -0.00 1.61 2.07 -1.92 -2.51 115.15 114.41 3gue h HIS 190 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3gue h HIS 190 Cb 0.00 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 29.98 3gue h HIS 190 CO 0.00 0.00 0.22 0.78 -3.07 0.00 0.00 177.93 175.86 3gue h GLY 191 N 0.97 0.00 2.00 6.13 0.00 -1.25 -1.57 103.07 109.35 3gue h GLY 191 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3gue h GLY 191 CO 0.00 0.00 -0.06 -1.80 0.00 0.00 0.00 176.54 174.68 3gue h ASP 192 N 0.00 0.00 -1.02 0.19 3.58 -1.65 -3.26 116.42 114.25 3gue h ASP 192 Ca 0.00 0.00 0.25 0.00 0.42 0.00 0.00 57.03 57.70 3gue h ASP 192 Cb 0.44 0.00 -0.11 0.00 1.72 0.00 0.00 39.33 41.39 3gue h ASP 192 CO -0.00 0.06 0.63 1.62 -2.88 0.00 0.00 179.24 178.67 3gue h VAL 193 N 0.00 0.56 0.07 2.25 3.04 -1.52 -1.96 116.25 118.68 3gue h VAL 193 Ca -0.00 -0.18 -0.00 0.00 -1.01 0.00 0.00 66.70 65.51 3gue h VAL 193 Cb 0.22 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.50 3gue h VAL 193 CO 0.01 0.09 -0.03 1.88 -1.01 0.00 0.00 177.57 178.51 3gue h TYR 194 N 0.51 -0.08 -0.75 3.17 0.05 -1.83 -0.17 116.97 117.87 3gue h TYR 194 Ca 0.61 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.36 3gue h TYR 194 Cb 1.32 0.03 -0.04 0.00 1.01 0.00 0.00 36.73 39.05 3gue h TYR 194 CO -0.00 0.40 0.38 0.00 -1.05 0.00 0.00 178.16 177.88 3gue h THR 195 N -0.61 1.23 -0.13 -2.88 1.03 -1.78 -1.26 112.91 108.50 3gue h THR 195 Ca -0.01 -0.61 -0.01 0.00 -0.01 0.00 0.00 66.41 65.77 3gue h THR 195 Cb 0.52 0.25 -0.01 0.00 -1.07 0.00 0.00 68.15 67.84 3gue h THR 195 CO 0.01 0.27 0.05 0.58 -0.01 0.00 0.00 175.52 176.43 3gue h VAL 196 N 1.05 1.15 -0.69 0.00 2.07 -1.29 0.41 116.25 118.95 3gue h VAL 196 Ca 0.26 -0.44 0.08 0.00 0.82 0.00 0.00 66.70 67.42 3gue h VAL 196 Cb 0.07 1.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.97 3gue h VAL 196 CO -0.04 0.13 0.35 -0.07 0.02 0.00 0.00 177.57 177.97 3gue h LEU 197 N 0.06 0.49 0.22 2.57 3.38 -0.85 -0.52 115.31 120.66 3gue h LEU 197 Ca 0.04 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 3gue h LEU 197 Cb 0.16 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3gue h LEU 197 CO -0.00 0.30 -0.11 0.22 0.09 0.00 0.00 178.44 178.94 3gue h TYR 198 N 0.63 -0.27 0.00 1.13 3.20 -0.96 -0.80 116.97 119.89 3gue h TYR 198 Ca 0.33 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.11 3gue h TYR 198 Cb 0.29 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 3gue h TYR 198 CO -0.10 0.11 -0.37 0.66 -1.64 0.00 0.00 178.16 176.83 3gue h SER 199 N -0.86 0.00 1.38 -2.11 4.64 -0.20 -3.10 113.55 113.30 3gue h SER 199 Ca -0.03 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.23 3gue h SER 199 Cb 0.51 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 3gue h SER 199 CO 0.05 0.37 -0.28 0.77 -0.87 0.00 0.00 176.83 176.87 3gue h SER 200 N 0.00 0.00 0.00 4.97 4.64 -1.20 -3.47 113.55 118.49 3gue h SER 200 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gue h SER 200 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3gue h SER 200 CO 0.05 0.28 0.00 0.61 -0.87 0.00 0.00 176.83 176.90 3gue n GLY 201 N 0.77 0.73 0.26 -0.77 0.00 -1.17 -4.94 105.19 100.07 3gue n GLY 201 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 3.97 0.89 0.38 1.61 1.79 -1.82 -1.49 116.57 121.90 3gue h LYS 202 Ca 0.00 -0.29 -0.01 0.00 -2.18 0.00 0.00 60.65 58.16 3gue h LYS 202 Cb 0.00 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 30.57 3gue h LYS 202 CO 0.00 0.93 -0.21 1.25 -1.08 0.00 0.00 179.45 180.34 3gue h LEU 203 N 0.76 -0.52 -0.98 2.94 5.85 -1.44 0.71 115.31 122.63 3gue h LEU 203 Ca 0.14 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.99 3gue h LEU 203 Cb 0.54 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.64 3gue h LEU 203 CO 0.03 -0.35 0.61 0.44 -0.34 0.00 0.00 178.44 178.84 3gue h ASP 204 N -0.56 0.93 0.43 1.25 3.32 -1.81 -1.54 116.42 118.44 3gue h ASP 204 Ca -0.04 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 3gue h ASP 204 Cb 0.45 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.85 3gue h ASP 204 CO 0.06 0.53 -0.21 0.22 -1.72 0.00 0.00 179.24 178.12 3gue h TYR 205 N 1.03 -0.53 -0.40 4.55 3.20 -0.84 -1.47 116.97 122.50 3gue h TYR 205 Ca 0.46 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.37 3gue h TYR 205 Cb 0.36 0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.76 3gue h TYR 205 CO -0.01 -0.31 0.14 -0.07 -1.64 0.00 0.00 178.16 176.27 3gue h LEU 206 N -0.62 0.15 -1.43 2.82 3.38 -0.72 -2.52 115.31 116.37 3gue h LEU 206 Ca -0.06 0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.96 3gue h LEU 206 Cb 0.46 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 3gue h LEU 206 CO 0.10 0.12 0.38 -0.07 0.09 0.00 0.00 178.44 179.06 3gue h LEU 207 N 0.30 0.67 -1.50 1.67 3.38 -1.32 -1.57 115.31 116.94 3gue h LEU 207 Ca 0.19 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 3gue h LEU 207 Cb 0.17 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3gue h LEU 207 CO -0.19 0.49 -0.24 1.23 0.09 0.00 0.00 178.44 179.82 3gue h GLY 208 N 0.79 0.00 -0.88 0.83 0.00 -0.85 -1.93 103.07 101.03 3gue h GLY 208 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 3gue h GLY 208 CO -0.05 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.77 3gue n LYS 209 N -3.77 1.82 -0.02 4.80 4.76 -0.87 -4.93 118.16 119.95 3gue n LYS 209 Ca -0.01 -1.21 0.00 0.00 -2.87 0.00 0.00 58.31 54.22 3gue n LYS 209 Cb 0.34 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.08 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 1.20 0.55 3.76 0.72 0.00 -0.73 -5.06 105.19 105.63 3gue n GLY 210 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.03 3.33 0.00 1.61 2.02 -0.65 -4.76 117.35 116.87 3gue s TYR 211 Ca 0.00 1.53 0.00 0.00 -0.37 0.00 0.00 57.07 58.23 3gue s TYR 211 Cb 0.00 -3.48 0.00 0.00 -0.40 0.00 0.00 41.96 38.08 3gue s TYR 211 CO 0.00 -1.22 0.00 0.54 -1.57 0.00 0.00 175.55 173.30 3gue n ARG 212 N 1.20 3.18 -4.29 -0.62 5.12 -0.44 -3.85 116.66 116.95 3gue n ARG 212 Ca 0.00 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.74 3gue n ARG 212 Cb 0.43 -0.36 -0.14 0.00 -1.16 0.00 0.00 32.46 31.23 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 -0.57 0.81 -0.07 -1.55 2.02 -0.87 0.33 117.35 117.45 3gue s TYR 213 Ca 0.00 -0.22 0.01 0.00 -0.37 0.00 0.00 57.07 56.49 3gue s TYR 213 Cb 0.00 -0.51 0.02 0.00 -0.40 0.00 0.00 41.96 41.07 3gue s TYR 213 CO 0.00 -0.01 -0.08 1.41 -1.57 0.00 0.00 175.55 175.30 3gue s MET 214 N -0.53 1.31 -0.27 -0.62 -2.45 -0.01 -1.29 119.30 115.44 3gue s MET 214 Ca 0.01 -0.24 -0.14 0.00 -1.25 0.00 0.00 55.69 54.08 3gue s MET 214 Cb -0.05 -1.25 -0.04 0.00 1.25 0.00 0.00 34.83 34.74 3gue s MET 214 CO 0.00 -0.10 0.31 0.12 1.05 0.00 0.00 175.02 176.40 3gue s PHE 215 N 1.10 3.25 -0.05 4.11 5.36 -0.09 -1.02 117.98 130.65 3gue s PHE 215 Ca -0.07 0.33 0.06 0.00 -0.96 0.00 0.00 56.93 56.29 3gue s PHE 215 Cb -0.14 -2.50 -0.02 0.00 -0.34 0.00 0.00 43.02 40.02 3gue s PHE 215 CO -0.01 -0.18 -0.23 0.42 -1.46 0.00 0.00 175.22 173.76 3gue s ILE 216 N 1.90 2.29 0.12 3.12 1.01 -0.18 -0.77 121.20 128.69 3gue s ILE 216 Ca 0.13 -0.99 -0.11 0.00 0.00 0.00 0.00 60.65 59.67 3gue s ILE 216 Cb -0.16 -1.84 0.01 0.00 0.01 0.00 0.00 42.46 40.48 3gue s ILE 216 CO 0.10 0.57 0.28 -0.94 0.00 0.00 0.00 174.94 174.95 3gue s SER 217 N -0.34 -0.00 0.29 3.58 1.04 -1.09 -0.08 113.70 117.10 3gue s SER 217 Ca 0.02 -0.61 -0.30 0.00 0.48 0.00 0.00 55.95 55.54 3gue s SER 217 Cb -0.12 0.41 -0.11 0.00 0.10 0.00 0.00 66.02 66.29 3gue s SER 217 CO 0.02 -0.81 1.54 0.20 0.98 0.00 0.00 173.24 175.16 3gue s ASN 218 N -2.87 6.45 0.57 7.02 0.01 -1.26 -1.39 114.94 123.47 3gue s ASN 218 Ca 0.07 2.88 0.27 0.00 -0.71 0.00 0.00 52.86 55.37 3gue s ASN 218 Cb 0.03 -2.64 1.57 0.00 0.41 0.00 0.00 41.25 40.63 3gue s ASN 218 CO -0.08 -0.84 2.10 1.23 -1.51 0.00 0.00 177.10 177.99 3gue h GLY 219 N 4.65 0.00 1.73 0.66 0.00 -1.59 -2.38 103.07 106.14 3gue h GLY 219 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3gue h GLY 219 CO 0.77 0.00 -0.14 2.09 0.00 0.00 0.00 176.54 179.26 3gue n ASP 220 N -4.00 0.14 -4.30 0.19 5.68 -1.26 -4.74 116.55 108.27 3gue n ASP 220 Ca 0.02 0.30 -0.45 0.00 -0.50 0.00 0.00 54.79 54.16 3gue n ASP 220 Cb 0.33 -0.30 -0.05 0.00 -1.14 0.00 0.00 41.12 39.96 3gue n ASP 220 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 3gue s ASN 221 N -3.02 6.23 -0.00 -1.12 2.47 -0.90 -3.98 114.94 114.62 3gue s ASN 221 Ca 0.13 -2.03 0.12 0.00 0.42 0.00 0.00 52.86 51.50 3gue s ASN 221 Cb 0.19 -2.18 0.35 0.00 -1.45 0.00 0.00 41.25 38.16 3gue s ASN 221 CO 0.58 -0.76 1.29 0.18 -3.72 0.00 0.00 177.10 174.66 3gue n LEU 222 N 4.88 2.14 0.05 3.21 4.77 -1.26 -3.38 117.00 127.42 3gue n LEU 222 Ca -0.07 -1.07 0.11 0.00 -0.03 0.00 0.00 56.01 54.95 3gue n LEU 222 Cb 0.42 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 3gue n LEU 222 CO 0.48 0.52 -0.17 0.61 -1.33 0.00 0.00 177.39 177.50 3gue n GLY 223 N 1.10 -1.28 3.67 -0.72 0.00 -1.24 -1.51 105.19 105.21 3gue n GLY 223 Ca 0.13 -0.35 -0.45 0.00 0.00 0.00 0.00 46.02 45.35 3gue n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gue n ALA 224 N -2.09 1.17 -3.16 4.61 0.00 -1.19 -4.30 120.51 115.56 3gue n ALA 224 Ca -0.00 0.42 -0.18 0.00 0.00 0.00 0.00 53.44 53.68 3gue n ALA 224 Cb 0.52 -2.29 -0.15 0.00 0.00 0.00 0.00 19.45 17.53 3gue n ALA 224 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3gue s THR 225 N 0.06 0.45 -0.41 0.00 -1.32 -1.26 -5.04 115.64 108.12 3gue s THR 225 Ca 0.69 -0.17 -0.28 0.00 -1.21 0.00 0.00 61.69 60.72 3gue s THR 225 Cb -0.65 -0.43 -0.00 0.00 -1.51 0.00 0.00 72.50 69.90 3gue s THR 225 CO 0.48 0.16 1.61 -0.22 -2.21 0.00 0.00 174.62 174.45 3gue s LEU 226 N 0.34 3.51 -0.46 9.08 0.20 -1.26 -4.97 118.68 125.12 3gue s LEU 226 Ca -0.04 0.93 -0.15 0.00 0.69 0.00 0.00 54.13 55.56 3gue s LEU 226 Cb -0.08 -3.40 0.06 0.00 -0.43 0.00 0.00 46.19 42.35 3gue s LEU 226 CO -0.00 -1.65 0.37 -0.62 -0.29 0.00 0.00 176.35 174.16 3gue s ASP 227 N 5.23 6.12 0.50 3.68 -1.08 -1.26 -4.95 116.67 124.91 3gue s ASP 227 Ca 0.69 -1.25 0.15 0.00 -0.52 0.00 0.00 52.55 51.61 3gue s ASP 227 Cb -0.17 -2.17 1.18 0.00 -1.46 0.00 0.00 42.92 40.30 3gue s ASP 227 CO 0.31 -0.61 2.11 0.58 0.52 0.00 0.00 175.17 178.09 3gue h VAL 228 N 5.74 1.04 0.00 1.11 2.07 -1.99 -0.77 116.25 123.45 3gue h VAL 228 Ca -0.28 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 3gue h VAL 228 Cb 1.11 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 3gue h VAL 228 CO 0.85 0.04 -0.32 0.03 0.02 0.00 0.00 177.57 178.19 3gue h ARG 229 N 0.05 0.00 0.22 1.57 3.08 -1.92 0.23 114.38 117.60 3gue h ARG 229 Ca 0.01 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.72 3gue h ARG 229 Cb 0.06 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.14 3gue h ARG 229 CO 0.00 0.32 -1.57 1.25 -1.07 0.00 0.00 179.97 178.91 3gue h LEU 230 N 0.00 0.74 -0.49 3.04 5.85 -1.85 -2.59 115.31 120.02 3gue h LEU 230 Ca -0.00 -0.88 0.09 0.00 0.84 0.00 0.00 57.88 57.92 3gue h LEU 230 Cb 0.73 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 41.44 3gue h LEU 230 CO 0.04 1.71 0.03 0.25 -0.34 0.00 0.00 178.44 180.13 3gue h LEU 231 N 0.13 -0.14 -0.45 2.25 5.85 -0.90 -0.75 115.31 121.31 3gue h LEU 231 Ca -0.28 0.11 0.06 0.00 0.84 0.00 0.00 57.88 58.61 3gue h LEU 231 Cb 2.14 0.18 -0.06 0.00 0.37 0.00 0.00 40.66 43.29 3gue h LEU 231 CO 0.24 -0.04 0.13 0.44 -0.34 0.00 0.00 178.44 178.87 3gue h ASP 232 N 0.15 0.10 -0.21 1.25 3.32 -0.55 -1.87 116.42 118.61 3gue h ASP 232 Ca 0.24 0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.37 3gue h ASP 232 Cb 0.36 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 3gue h ASP 232 CO -0.38 0.09 0.10 0.22 -1.72 0.00 0.00 179.24 177.55 3gue h TYR 233 N 0.28 0.18 -0.28 4.55 3.20 -1.10 -1.38 116.97 122.43 3gue h TYR 233 Ca 0.21 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.12 3gue h TYR 233 Cb 0.24 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.43 3gue h TYR 233 CO -0.18 0.10 0.11 1.98 -1.64 0.00 0.00 178.16 178.53 3gue h MET 234 N 0.21 0.24 -0.59 1.82 4.05 -0.78 -1.57 114.93 118.31 3gue h MET 234 Ca 0.09 -0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.50 3gue h MET 234 Cb 0.03 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 30.74 3gue h MET 234 CO -0.07 0.16 0.39 1.25 0.23 0.00 0.00 176.91 178.87 3gue h HIS 235 N 0.24 0.74 -0.65 1.39 -0.00 -1.26 0.28 115.15 115.90 3gue h HIS 235 Ca 0.12 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.45 3gue h HIS 235 Cb 0.07 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.20 3gue h HIS 235 CO -0.12 0.46 0.17 0.93 -0.00 0.00 0.00 177.93 179.38 3gue h GLU 236 N 0.80 1.02 -0.07 5.26 5.08 -0.92 -1.11 114.58 124.64 3gue h GLU 236 Ca 0.22 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3gue h GLU 236 Cb -0.09 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.02 3gue h GLU 236 CO -0.05 0.89 0.00 1.63 -1.00 0.00 0.00 179.01 180.48 3gue n LYS 237 N -4.25 1.30 -3.97 2.33 4.76 -0.62 -4.95 118.16 112.76 3gue n LYS 237 Ca 0.05 -0.45 -0.26 0.00 -2.87 0.00 0.00 58.31 54.78 3gue n LYS 237 Cb 0.24 -1.33 -0.02 0.00 -1.84 0.00 0.00 35.03 32.08 3gue n LYS 237 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3gue n GLN 238 N -0.33 -3.38 -3.04 1.97 6.02 -0.42 -4.95 117.38 113.26 3gue n GLN 238 Ca 0.15 0.41 -0.37 0.00 -0.01 0.00 0.00 57.00 57.18 3gue n GLN 238 Cb 0.17 -4.61 -0.06 0.00 1.02 0.00 0.00 30.24 26.76 3gue n GLN 238 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3gue s LEU 239 N -6.99 4.40 0.20 1.08 1.43 0.02 -4.80 118.68 114.02 3gue s LEU 239 Ca 0.07 1.52 0.18 0.00 -1.03 0.00 0.00 54.13 54.87 3gue s LEU 239 Cb -0.04 -3.56 0.01 0.00 0.03 0.00 0.00 46.19 42.63 3gue s LEU 239 CO 0.89 0.06 1.14 1.23 0.23 0.00 0.00 176.35 179.90 3gue h GLY 240 N 3.61 0.00 -5.50 -3.19 0.00 -0.27 -3.42 103.07 94.30 3gue h GLY 240 Ca -0.48 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.79 3gue h GLY 240 CO 0.65 0.00 -0.23 -0.12 0.00 0.00 0.00 176.54 176.85 3gue s PHE 241 N -3.07 -0.80 -0.11 5.60 5.36 -1.14 -1.22 117.98 122.60 3gue s PHE 241 Ca 0.01 1.60 0.01 0.00 -0.96 0.00 0.00 56.93 57.58 3gue s PHE 241 Cb 0.08 0.39 0.02 0.00 -0.34 0.00 0.00 43.02 43.17 3gue s PHE 241 CO 0.77 -0.43 -0.13 -1.17 -1.46 0.00 0.00 175.22 172.80 3gue s LEU 242 N 1.78 1.60 -0.22 6.12 0.20 -0.48 -1.54 118.68 126.14 3gue s LEU 242 Ca -0.08 -0.40 -0.09 0.00 0.69 0.00 0.00 54.13 54.25 3gue s LEU 242 Cb -0.09 -1.02 -0.04 0.00 -0.43 0.00 0.00 46.19 44.61 3gue s LEU 242 CO -0.15 -0.02 0.11 -0.32 -0.29 0.00 0.00 176.35 175.68 3gue s MET 243 N 1.17 3.98 -0.02 1.98 -2.45 -0.06 -1.09 119.30 122.83 3gue s MET 243 Ca -0.03 -0.32 -0.27 0.00 -1.25 0.00 0.00 55.69 53.81 3gue s MET 243 Cb -0.14 -3.37 -0.04 0.00 1.25 0.00 0.00 34.83 32.53 3gue s MET 243 CO -0.04 0.13 0.84 -1.21 1.05 0.00 0.00 175.02 175.79 3gue s GLU 244 N 0.81 4.51 0.24 4.11 2.02 -0.54 -1.61 118.70 128.23 3gue s GLU 244 Ca 0.06 1.17 0.11 0.00 0.02 0.00 0.00 54.97 56.32 3gue s GLU 244 Cb -0.13 -3.44 -0.05 0.00 0.10 0.00 0.00 34.13 30.61 3gue s GLU 244 CO 0.02 0.04 -0.19 0.14 0.02 0.00 0.00 175.26 175.29 3gue s VAL 245 N 0.76 2.25 0.13 2.63 -7.23 -0.43 -2.38 120.40 116.13 3gue s VAL 245 Ca 0.44 -2.25 0.09 0.00 -1.81 0.00 0.00 61.98 58.45 3gue s VAL 245 Cb -0.20 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 3gue s VAL 245 CO 0.24 -0.38 -0.17 0.00 -0.31 0.00 0.00 175.10 174.48 3gue n ARG 247 N 0.65 1.45 -1.71 0.00 3.00 -1.26 -1.18 116.66 117.61 3gue n ARG 247 Ca -0.15 0.45 -0.42 0.00 -0.00 0.00 0.00 57.85 57.73 3gue n ARG 247 Cb 0.53 -2.59 -0.00 0.00 0.00 0.00 0.00 32.46 30.40 3gue n ARG 247 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 3gue n ARG 248 N 7.74 2.17 -4.32 -0.14 0.63 0.12 -4.90 116.66 117.96 3gue n ARG 248 Ca 0.34 0.76 -0.27 0.00 -0.92 0.00 0.00 57.85 57.77 3gue n ARG 248 Cb 0.27 -2.40 -0.07 0.00 0.45 0.00 0.00 32.46 30.71 3gue n ARG 248 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3gue s THR 249 N -1.13 1.94 0.53 5.15 -4.23 -1.26 -4.97 115.64 111.67 3gue s THR 249 Ca 0.56 -1.79 0.20 0.00 -1.18 0.00 0.00 61.69 59.49 3gue s THR 249 Cb -0.54 -2.73 0.28 0.00 1.34 0.00 0.00 72.50 70.86 3gue s THR 249 CO 0.61 0.00 2.16 -0.08 -0.54 0.00 0.00 174.62 176.77 3gue h GLU 250 N 1.40 0.00 0.00 3.99 4.81 -1.96 -1.80 114.58 121.02 3gue h GLU 250 Ca -0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 3gue h GLU 250 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 3gue h GLU 250 CO 0.72 0.03 0.00 -1.13 -0.73 0.00 0.00 179.01 177.90 3gue n SER 251 N -4.26 0.40 -4.44 1.04 3.41 -1.26 -4.58 113.62 103.93 3gue n SER 251 Ca -0.03 0.58 -0.44 0.00 -0.26 0.00 0.00 58.87 58.72 3gue n SER 251 Cb 0.12 -0.67 -0.03 0.00 -0.26 0.00 0.00 64.21 63.36 3gue n SER 251 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3gue s ASP 252 N -3.74 6.52 -0.04 4.04 1.01 -0.68 -4.70 116.67 119.08 3gue s ASP 252 Ca 0.07 -1.85 0.04 0.00 0.71 0.00 0.00 52.55 51.52 3gue s ASP 252 Cb 0.11 -2.38 -0.05 0.00 1.01 0.00 0.00 42.92 41.60 3gue s ASP 252 CO 0.39 -1.10 0.02 0.29 0.21 0.00 0.00 175.17 174.98 3gue n LYS 253 N 6.56 3.00 -4.53 8.23 5.02 -1.26 -4.86 118.16 130.32 3gue n LYS 253 Ca 0.16 -0.01 -0.31 0.00 -2.02 0.00 0.00 58.31 56.13 3gue n LYS 253 Cb 0.48 -1.11 -0.17 0.00 -0.02 0.00 0.00 35.03 34.22 3gue n LYS 253 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3gue s LYS 254 N -2.12 2.61 0.00 1.97 1.02 -1.26 -4.98 119.74 116.98 3gue s LYS 254 Ca -0.02 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.27 3gue s LYS 254 Cb 0.01 -2.17 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 3gue s LYS 254 CO 0.17 -0.05 0.00 0.41 -0.92 0.00 0.00 175.35 174.96 3gue n GLY 255 N 4.18 0.37 3.06 -3.33 0.00 -1.26 -5.01 105.19 103.20 3gue n GLY 255 Ca -0.19 -1.23 -0.18 0.00 0.00 0.00 0.00 46.02 44.42 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 0.55 0.19 -0.02 0.00 -1.26 -0.79 107.32 105.99 3gue s GLY 256 Ca 0.00 -0.60 0.07 0.00 0.00 0.00 0.00 44.72 44.19 3gue s GLY 256 CO 0.00 -0.57 0.04 -2.38 0.00 0.00 0.00 173.10 170.18 3gue s HIS 257 N -0.66 2.91 0.42 1.90 -3.43 -0.97 -1.50 115.29 113.95 3gue s HIS 257 Ca -0.00 -0.12 -0.17 0.00 -0.80 0.00 0.00 55.06 53.97 3gue s HIS 257 Cb -0.06 -1.39 -0.09 0.00 -1.43 0.00 0.00 32.58 29.61 3gue s HIS 257 CO 0.00 0.53 0.88 -0.51 -2.00 0.00 0.00 174.74 173.65 3gue s LEU 258 N -3.10 3.89 0.00 5.38 1.43 -0.82 -1.10 118.68 124.35 3gue s LEU 258 Ca 0.29 1.50 -0.04 0.00 -1.03 0.00 0.00 54.13 54.85 3gue s LEU 258 Cb -0.09 -4.36 0.02 0.00 0.03 0.00 0.00 46.19 41.79 3gue s LEU 258 CO 0.20 -0.37 0.36 0.00 0.23 0.00 0.00 176.35 176.76 3gue n ALA 259 N -0.85 -0.49 -2.54 4.21 0.00 0.06 -4.46 120.51 116.44 3gue n ALA 259 Ca 0.06 -0.91 -0.24 0.00 0.00 0.00 0.00 53.44 52.34 3gue n ALA 259 Cb 0.54 0.73 -0.13 0.00 0.00 0.00 0.00 19.45 20.59 3gue n ALA 259 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3gue s TYR 260 N -4.13 1.72 0.02 0.00 2.02 -0.18 -0.99 117.35 115.81 3gue s TYR 260 Ca 0.15 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.47 3gue s TYR 260 Cb -0.01 -0.97 -0.02 0.00 -0.40 0.00 0.00 41.96 40.56 3gue s TYR 260 CO 0.11 0.15 -0.07 0.21 -1.57 0.00 0.00 175.55 174.38 3gue s LYS 261 N -1.63 0.52 0.64 -0.62 2.20 -0.12 -1.44 119.74 119.28 3gue s LYS 261 Ca 0.06 -0.53 -0.02 0.00 -0.36 0.00 0.00 55.97 55.12 3gue s LYS 261 Cb -0.10 -0.39 0.06 0.00 -1.51 0.00 0.00 37.83 35.90 3gue s LYS 261 CO 0.03 0.09 0.90 -0.51 -0.36 0.00 0.00 175.35 175.50 3gue s ASP 262 N -0.96 4.92 0.00 1.43 -0.00 -1.26 -1.30 116.67 119.50 3gue s ASP 262 Ca -0.04 0.09 0.00 0.00 -0.00 0.00 0.00 52.55 52.60 3gue s ASP 262 Cb -0.07 -0.80 0.00 0.00 -0.00 0.00 0.00 42.92 42.06 3gue s ASP 262 CO 0.00 -1.44 0.00 0.41 -0.00 0.00 0.00 175.17 174.14 3gue n THR 271 N -2.64 0.00 -1.43 -1.27 -1.04 -1.26 -4.68 114.28 101.96 3gue n THR 271 Ca 0.09 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.73 3gue n THR 271 Cb 0.60 -0.07 0.04 0.00 -1.82 0.00 0.00 70.33 69.08 3gue n THR 271 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 3gue n ARG 272 N 0.52 0.46 -2.04 -2.82 1.85 -1.26 -4.93 116.66 108.44 3gue n ARG 272 Ca 0.00 0.19 -0.42 0.00 -1.00 0.00 0.00 57.85 56.62 3gue n ARG 272 Cb 0.00 -1.71 -0.03 0.00 -1.05 0.00 0.00 32.46 29.67 3gue n ARG 272 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3gue s ARG 273 N -2.19 4.27 0.06 2.89 1.81 -1.26 -4.95 118.95 119.58 3gue s ARG 273 Ca 0.68 2.25 0.04 0.00 -1.72 0.00 0.00 55.73 56.98 3gue s ARG 273 Cb -0.43 -3.16 -0.03 0.00 -0.45 0.00 0.00 34.95 30.89 3gue s ARG 273 CO 0.55 -0.47 -0.13 1.03 -0.68 0.00 0.00 175.30 175.60 3gue s ARG 274 N 0.48 0.78 0.47 3.54 0.52 -0.42 -4.97 118.95 119.36 3gue s ARG 274 Ca 0.64 -0.85 -0.23 0.00 -0.52 0.00 0.00 55.73 54.77 3gue s ARG 274 Cb -0.41 -0.75 -0.07 0.00 0.52 0.00 0.00 34.95 34.24 3gue s ARG 274 CO 0.36 0.17 1.25 -0.06 0.02 0.00 0.00 175.30 177.04 3gue s PHE 275 N -1.16 2.69 0.04 -0.53 0.08 -1.26 -0.95 117.98 116.89 3gue s PHE 275 Ca -0.02 1.46 0.04 0.00 0.12 0.00 0.00 56.93 58.53 3gue s PHE 275 Cb -0.09 -3.56 -0.02 0.00 -0.57 0.00 0.00 43.02 38.78 3gue s PHE 275 CO 0.02 -2.03 -0.11 0.14 -0.10 0.00 0.00 175.22 173.14 3gue s VAL 276 N -1.42 0.82 -0.24 -0.44 -7.23 -0.16 -4.51 120.40 107.22 3gue s VAL 276 Ca 0.65 -0.93 -0.07 0.00 -1.81 0.00 0.00 61.98 59.81 3gue s VAL 276 Cb -0.34 -0.78 -0.03 0.00 0.56 0.00 0.00 36.38 35.79 3gue s VAL 276 CO 0.41 -0.12 0.05 -0.22 -0.31 0.00 0.00 175.10 174.91 3gue s LEU 277 N -1.18 3.39 -0.39 1.32 2.96 -1.26 -0.77 118.68 122.76 3gue s LEU 277 Ca -0.02 -0.21 -0.10 0.00 -0.22 0.00 0.00 54.13 53.58 3gue s LEU 277 Cb -0.08 -1.90 0.05 0.00 0.50 0.00 0.00 46.19 44.76 3gue s LEU 277 CO 0.01 -0.01 0.21 -0.60 -1.32 0.00 0.00 176.35 174.64 3gue s ARG 278 N 1.46 2.70 0.71 1.98 3.52 -0.26 -4.98 118.95 124.08 3gue s ARG 278 Ca 0.05 -1.24 -0.11 0.00 -0.13 0.00 0.00 55.73 54.30 3gue s ARG 278 Cb -0.15 -3.71 0.02 0.00 -1.56 0.00 0.00 34.95 29.55 3gue s ARG 278 CO 0.03 -0.79 1.08 -1.21 -0.81 0.00 0.00 175.30 173.60 3gue s GLU 279 N 1.48 2.79 0.23 5.12 0.41 -1.26 -2.30 118.70 125.17 3gue s GLU 279 Ca 0.02 0.61 -0.07 0.00 -0.41 0.00 0.00 54.97 55.11 3gue s GLU 279 Cb -0.21 -2.00 0.39 0.00 -1.78 0.00 0.00 34.13 30.53 3gue s GLU 279 CO 0.04 -1.12 1.68 0.77 -0.49 0.00 0.00 175.26 176.14 3gue h SER 280 N -0.72 -0.10 0.43 -0.19 0.02 -1.34 -1.40 113.55 110.25 3gue h SER 280 Ca -0.45 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3gue h SER 280 Cb 1.24 0.22 0.00 0.00 0.14 0.00 0.00 62.40 64.00 3gue h SER 280 CO 0.62 -0.06 0.00 0.00 -1.14 0.00 0.00 176.83 176.24 3gue n ALA 281 N -2.71 1.53 0.84 3.77 0.00 -1.26 -2.16 120.51 120.52 3gue n ALA 281 Ca 0.12 -0.02 0.11 0.00 0.00 0.00 0.00 53.44 53.65 3gue n ALA 281 Cb 0.41 -1.22 0.09 0.00 0.00 0.00 0.00 19.45 18.74 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 -1.61 1.96 -3.52 0.00 6.02 -0.53 -4.62 117.38 115.08 3gue n GLN 282 Ca 0.03 -1.78 -0.40 0.00 -0.01 0.00 0.00 57.00 54.83 3gue n GLN 282 Cb 0.14 -1.41 -0.10 0.00 1.02 0.00 0.00 30.24 29.89 3gue n GLN 282 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3gue s PRO 284 N 1.76 3.64 0.25 0.00 0.02 -1.26 -4.91 135.00 134.50 3gue s PRO 284 Ca 0.07 2.19 -0.09 0.00 0.02 0.00 0.00 61.00 63.18 3gue s PRO 284 Cb -0.17 -2.54 0.39 0.00 0.02 0.00 0.00 34.50 32.19 3gue s PRO 284 CO 0.11 -0.77 1.59 -0.22 -0.33 0.00 0.00 177.00 177.38 3gue h LYS 285 N 2.16 0.01 0.00 5.54 3.64 -1.97 0.71 116.57 126.66 3gue h LYS 285 Ca -0.50 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3gue h LYS 285 Cb 1.27 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 3gue h LYS 285 CO 0.60 0.01 0.08 0.93 -2.27 0.00 0.00 179.45 178.80 3gue h GLU 286 N 0.01 0.00 -0.48 1.90 3.07 -2.05 -2.57 114.58 114.47 3gue h GLU 286 Ca 0.41 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 3gue h GLU 286 Cb 0.66 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 3gue h GLU 286 CO -0.84 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 176.52 3gue n ASP 287 N -2.66 3.36 -0.31 1.42 8.00 0.24 -4.63 116.55 121.98 3gue n ASP 287 Ca -0.02 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.52 3gue n ASP 287 Cb 0.12 -0.32 0.13 0.00 -0.02 0.00 0.00 41.12 41.04 3gue n ASP 287 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 3gue h GLU 288 N 3.43 0.96 0.01 -1.24 4.57 -1.50 0.90 114.58 121.71 3gue h GLU 288 Ca 0.00 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.13 3gue h GLU 288 Cb 0.87 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 3gue h GLU 288 CO 0.00 0.64 -0.07 -0.44 -1.18 0.00 0.00 179.01 177.96 3gue h ASP 289 N 0.99 -0.19 0.17 1.04 3.32 -1.85 -0.36 116.42 119.54 3gue h ASP 289 Ca 0.37 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.45 3gue h ASP 289 Cb 0.13 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 3gue h ASP 289 CO -0.16 -0.10 -0.20 0.28 -1.72 0.00 0.00 179.24 177.34 3gue h SER 290 N -0.12 -0.54 -0.94 6.45 0.02 -1.82 -1.36 113.55 115.24 3gue h SER 290 Ca 0.02 0.06 0.26 0.00 -0.84 0.00 0.00 61.79 61.29 3gue h SER 290 Cb 0.15 0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.83 3gue h SER 290 CO -0.06 -0.29 0.66 0.15 -1.14 0.00 0.00 176.83 176.14 3gue h PHE 291 N -0.41 0.19 -0.40 3.45 3.57 -0.51 -0.23 116.94 122.60 3gue h PHE 291 Ca 0.01 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3gue h PHE 291 Cb 0.40 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.09 3gue h PHE 291 CO -0.17 0.04 0.00 1.04 -2.23 0.00 0.00 178.31 176.99 3gue n GLN 292 N -4.35 2.53 -2.37 1.11 1.13 -0.17 -4.80 117.38 110.46 3gue n GLN 292 Ca 0.20 -2.31 -0.39 0.00 -1.94 0.00 0.00 57.00 52.55 3gue n GLN 292 Cb 0.92 -1.52 -0.03 0.00 0.11 0.00 0.00 30.24 29.72 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 -1.48 5.87 0.25 1.08 3.84 -0.10 -4.86 114.94 119.54 3gue s ASN 293 Ca 0.39 -0.36 0.25 0.00 0.21 0.00 0.00 52.86 53.35 3gue s ASN 293 Cb 0.23 -2.55 0.92 0.00 -0.55 0.00 0.00 41.25 39.30 3gue s ASN 293 CO 0.32 -2.02 1.74 2.30 -2.79 0.00 0.00 177.10 176.65 3gue n ILE 294 N 6.79 0.73 0.07 -5.21 -5.35 -1.26 -1.74 119.36 113.39 3gue n ILE 294 Ca 0.14 0.01 -0.19 0.00 -0.27 0.00 0.00 62.75 62.45 3gue n ILE 294 Cb 0.50 -0.93 -0.14 0.00 -1.74 0.00 0.00 39.64 37.32 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 2.36 0.22 0.03 -1.28 0.00 -1.93 -3.10 119.26 115.55 3gue h ALA 295 Ca 0.00 -1.10 -0.00 0.00 0.00 0.00 0.00 54.91 53.81 3gue h ALA 295 Cb 0.52 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3gue h ALA 295 CO 0.00 1.09 -0.01 -0.22 0.00 0.00 0.00 179.25 180.10 3gue h LYS 296 N 0.08 -0.03 -3.25 0.00 3.64 -1.91 -3.39 116.57 111.71 3gue h LYS 296 Ca -0.26 0.00 -0.71 0.00 -1.27 0.00 0.00 60.65 58.41 3gue h LYS 296 Cb 2.04 0.01 -0.35 0.00 -0.41 0.00 0.00 32.23 33.52 3gue h LYS 296 CO 0.17 0.66 -0.02 0.72 -2.27 0.00 0.00 179.45 178.71 3gue n HIS 297 N -4.75 4.18 1.10 1.91 8.25 -0.71 -4.59 115.22 120.61 3gue n HIS 297 Ca -0.09 -4.04 0.12 0.00 -0.26 0.00 0.00 57.72 53.45 3gue n HIS 297 Cb 0.35 -1.16 0.15 0.00 1.12 0.00 0.00 29.99 30.45 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 -2.50 3.33 -0.21 0.00 0.08 -1.26 0.15 117.98 117.57 3gue s PHE 299 Ca 0.21 -1.60 -0.07 0.00 0.12 0.00 0.00 56.93 55.58 3gue s PHE 299 Cb 0.18 -2.69 -0.03 0.00 -0.57 0.00 0.00 43.02 39.91 3gue s PHE 299 CO 0.56 -0.81 0.05 0.12 -0.10 0.00 0.00 175.22 175.04 3gue s PHE 300 N 1.38 3.13 0.10 0.36 5.36 -0.33 -1.94 117.98 126.04 3gue s PHE 300 Ca 0.02 -0.22 -0.31 0.00 -0.96 0.00 0.00 56.93 55.46 3gue s PHE 300 Cb -0.21 -2.14 -0.10 0.00 -0.34 0.00 0.00 43.02 40.22 3gue s PHE 300 CO 0.02 -0.13 1.82 1.21 -1.46 0.00 0.00 175.22 176.67 3gue s ASN 301 N 1.00 6.46 0.37 6.13 2.47 -0.56 -1.26 114.94 129.54 3gue s ASN 301 Ca 0.03 2.69 0.23 0.00 0.42 0.00 0.00 52.86 56.24 3gue s ASN 301 Cb -0.14 -2.56 0.38 0.00 -1.45 0.00 0.00 41.25 37.48 3gue s ASN 301 CO 0.03 -0.99 1.57 0.71 -3.72 0.00 0.00 177.10 174.69 3gue h THR 302 N 4.89 0.00 0.00 -5.21 1.35 -1.81 -3.43 112.91 108.70 3gue h THR 302 Ca -0.46 -0.90 0.00 0.00 -0.55 0.00 0.00 66.41 64.50 3gue h THR 302 Cb 1.22 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.47 3gue h THR 302 CO 0.94 0.00 0.00 -3.20 -0.25 0.00 0.00 175.52 173.01 3gue n ASN 303 N -2.89 -4.22 -4.56 5.36 5.15 -1.26 -4.72 115.26 108.12 3gue n ASN 303 Ca 0.04 0.00 -0.40 0.00 -0.60 0.00 0.00 54.58 53.61 3gue n ASN 303 Cb 0.51 -2.17 -0.03 0.00 -0.53 0.00 0.00 39.78 37.57 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 -2.05 5.86 -0.08 1.20 0.01 -1.26 -3.93 114.94 114.70 3gue s ASN 304 Ca 0.00 0.01 0.03 0.00 -0.71 0.00 0.00 52.86 52.19 3gue s ASN 304 Cb 0.00 -2.55 0.01 0.00 0.41 0.00 0.00 41.25 39.12 3gue s ASN 304 CO 0.00 -1.98 -0.17 -0.63 -1.51 0.00 0.00 177.10 172.81 3gue s ILE 305 N 6.90 1.54 -0.18 0.60 -1.09 0.89 -1.47 121.20 128.39 3gue s ILE 305 Ca 0.50 -0.72 -0.13 0.00 -2.23 0.00 0.00 60.65 58.07 3gue s ILE 305 Cb -0.10 -1.36 -0.05 0.00 -1.58 0.00 0.00 42.46 39.37 3gue s ILE 305 CO 0.20 0.44 0.25 0.26 -1.23 0.00 0.00 174.94 174.86 3gue s TRP 306 N 0.50 3.43 0.03 3.97 0.52 -0.25 -1.01 118.94 126.14 3gue s TRP 306 Ca -0.16 0.51 0.08 0.00 0.02 0.00 0.00 56.10 56.55 3gue s TRP 306 Cb -0.17 -2.30 -0.03 0.00 -1.15 0.00 0.00 33.47 29.82 3gue s TRP 306 CO 0.06 0.22 -0.24 0.96 0.02 0.00 0.00 176.95 177.97 3gue s ILE 307 N 0.54 1.92 -0.22 2.03 -4.36 -0.19 -1.38 121.20 119.54 3gue s ILE 307 Ca 0.14 -1.26 -0.23 0.00 -0.26 0.00 0.00 60.65 59.04 3gue s ILE 307 Cb -0.13 -1.64 -0.02 0.00 1.25 0.00 0.00 42.46 41.92 3gue s ILE 307 CO 0.03 0.33 0.73 0.21 0.24 0.00 0.00 174.94 176.48 3gue s ASN 308 N -1.11 6.76 0.15 4.36 3.84 -0.36 -0.83 114.94 127.76 3gue s ASN 308 Ca 0.10 0.93 -0.05 0.00 0.21 0.00 0.00 52.86 54.06 3gue s ASN 308 Cb -0.09 -2.39 -0.01 0.00 -0.55 0.00 0.00 41.25 38.21 3gue s ASN 308 CO 0.01 -0.40 1.39 -0.07 -2.79 0.00 0.00 177.10 175.25 3gue h LEU 309 N 8.71 0.61 -0.37 3.21 3.38 -0.46 -1.32 115.31 129.07 3gue h LEU 309 Ca -0.27 -0.40 -0.09 0.00 0.09 0.00 0.00 57.88 57.21 3gue h LEU 309 Cb 1.12 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 3gue h LEU 309 CO 0.82 1.16 -0.10 -0.03 0.09 0.00 0.00 178.44 180.38 3gue h MET 310 N 0.34 0.72 -0.48 1.13 4.05 -1.89 0.82 114.93 119.63 3gue h MET 310 Ca -0.04 -0.28 0.02 0.00 -0.28 0.00 0.00 59.70 59.12 3gue h MET 310 Cb 1.35 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 32.08 3gue h MET 310 CO 0.14 0.88 0.28 0.93 0.23 0.00 0.00 176.91 179.37 3gue h GLU 311 N 0.52 0.55 -0.65 0.39 4.39 -1.89 -0.07 114.58 117.82 3gue h GLU 311 Ca 0.09 -0.03 0.07 0.00 0.34 0.00 0.00 59.36 59.83 3gue h GLU 311 Cb 0.62 -0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 29.09 3gue h GLU 311 CO 0.04 0.36 0.33 1.25 -1.16 0.00 0.00 179.01 179.83 3gue h LEU 312 N 0.56 0.47 -0.16 1.33 5.85 -1.04 -0.44 115.31 121.88 3gue h LEU 312 Ca 0.19 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.96 3gue h LEU 312 Cb 0.02 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3gue h LEU 312 CO -0.09 0.30 0.09 0.50 -0.34 0.00 0.00 178.44 178.90 3gue h LYS 313 N 0.61 0.19 -0.91 1.25 1.63 -0.28 0.12 116.57 119.18 3gue h LYS 313 Ca 0.30 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.09 3gue h LYS 313 Cb 0.24 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.78 3gue h LYS 313 CO -0.21 0.12 0.58 0.87 -3.45 0.00 0.00 179.45 177.37 3gue h LYS 314 N 0.19 1.20 -0.01 1.90 1.57 -0.74 -1.28 116.57 119.40 3gue h LYS 314 Ca 0.06 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3gue h LYS 314 Cb -0.00 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 32.04 3gue h LYS 314 CO -0.03 0.81 -0.00 1.98 -0.57 0.00 0.00 179.45 181.64 3gue h MET 315 N 1.23 0.02 -0.53 3.15 4.05 -0.66 -2.08 114.93 120.12 3gue h MET 315 Ca 0.33 -0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.76 3gue h MET 315 Cb -0.11 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.65 3gue h MET 315 CO -0.07 0.35 0.32 0.52 0.23 0.00 0.00 176.91 178.27 3gue h MET 316 N -0.31 0.63 0.06 0.39 2.86 -0.76 0.12 114.93 117.91 3gue h MET 316 Ca 0.00 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3gue h MET 316 Cb 0.34 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 3gue h MET 316 CO 0.00 0.42 -0.09 -0.44 1.06 0.00 0.00 176.91 177.86 3gue h ASP 317 N 0.65 -0.24 -0.41 1.22 3.32 -1.30 0.40 116.42 120.06 3gue h ASP 317 Ca 0.21 0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.35 3gue h ASP 317 Cb -0.00 0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 3gue h ASP 317 CO -0.08 -0.13 0.08 -0.08 -1.72 0.00 0.00 179.24 177.30 3gue h GLU 318 N -0.18 0.20 -0.49 3.56 4.81 -0.68 -2.48 114.58 119.31 3gue h GLU 318 Ca 0.01 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3gue h GLU 318 Cb 0.19 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.53 3gue h GLU 318 CO -0.05 0.13 0.00 1.04 -0.73 0.00 0.00 179.01 179.41 3gue n GLN 319 N -5.10 2.22 -3.48 1.92 6.02 0.35 -4.93 117.38 114.38 3gue n GLN 319 Ca 0.03 -1.70 -0.19 0.00 -0.01 0.00 0.00 57.00 55.13 3gue n GLN 319 Cb 0.19 -1.43 0.08 0.00 1.02 0.00 0.00 30.24 30.10 3gue n GLN 319 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3gue n LEU 320 N 0.81 -3.85 0.00 1.08 4.77 -0.42 -2.37 117.00 117.02 3gue n LEU 320 Ca 0.16 -0.62 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 3gue n LEU 320 Cb 0.44 -3.08 0.00 0.00 -2.33 0.00 0.00 43.42 38.45 3gue n LEU 320 CO 0.12 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3gue n GLY 321 N -1.33 0.27 2.92 -0.72 0.00 0.13 -4.98 105.19 101.48 3gue n GLY 321 Ca -0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.62 2.41 0.31 1.61 1.01 -1.00 -4.89 120.40 118.24 3gue s VAL 322 Ca 0.00 -3.20 -0.29 0.00 0.00 0.00 0.00 61.98 58.49 3gue s VAL 322 Cb 0.00 -2.68 -0.10 0.00 0.00 0.00 0.00 36.38 33.60 3gue s VAL 322 CO 0.00 -0.81 1.19 -0.76 0.00 0.00 0.00 175.10 174.72 3gue s LEU 323 N -0.19 4.48 -0.39 3.92 1.43 -1.26 -4.87 118.68 121.81 3gue s LEU 323 Ca 0.17 2.45 -0.05 0.00 -1.03 0.00 0.00 54.13 55.67 3gue s LEU 323 Cb -0.26 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.27 3gue s LEU 323 CO -0.00 -0.33 3.02 0.54 0.23 0.00 0.00 176.35 179.81 3gue n ARG 324 N 0.97 2.43 -2.14 1.70 1.74 -1.26 -4.96 116.66 115.14 3gue n ARG 324 Ca -0.00 -2.00 -0.40 0.00 -0.77 0.00 0.00 57.85 54.67 3gue n ARG 324 Cb 0.44 -2.14 -0.02 0.00 -1.02 0.00 0.00 32.46 29.72 3gue n ARG 324 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3gue s LEU 325 N -1.47 4.39 0.13 0.55 1.43 -1.26 -4.96 118.68 117.48 3gue s LEU 325 Ca 0.61 2.64 -0.31 0.00 -1.03 0.00 0.00 54.13 56.04 3gue s LEU 325 Cb 0.35 -3.71 -0.08 0.00 0.03 0.00 0.00 46.19 42.78 3gue s LEU 325 CO -0.15 -0.57 1.40 -2.16 0.23 0.00 0.00 176.35 175.11 3gue s PRO 326 N -1.87 4.31 0.16 1.29 0.04 -1.26 -4.98 135.00 132.69 3gue s PRO 326 Ca 0.50 2.11 -0.29 0.00 0.04 0.00 0.00 61.00 63.36 3gue s PRO 326 Cb -0.39 -3.23 -0.07 0.00 0.04 0.00 0.00 34.50 30.85 3gue s PRO 326 CO 0.51 -0.44 0.93 0.54 0.04 0.00 0.00 177.00 178.58 3gue s VAL 327 N 0.99 4.33 -0.13 -0.36 0.11 -1.26 -4.63 120.40 119.44 3gue s VAL 327 Ca 0.64 2.02 -0.02 0.00 -2.93 0.00 0.00 61.98 61.69 3gue s VAL 327 Cb -0.38 -4.30 -0.03 0.00 -1.53 0.00 0.00 36.38 30.15 3gue s VAL 327 CO 0.31 0.41 -0.05 -0.04 -3.33 0.00 0.00 175.10 172.40 3gue s MET 328 N -0.57 3.42 -0.57 1.54 -1.94 0.35 -4.40 119.30 117.13 3gue s MET 328 Ca 0.43 -0.53 -0.06 0.00 -1.71 0.00 0.00 55.69 53.82 3gue s MET 328 Cb -0.24 -2.82 0.15 0.00 2.01 0.00 0.00 34.83 33.93 3gue s MET 328 CO 0.30 0.35 0.42 0.50 -0.01 0.00 0.00 175.02 176.58 3gue s ARG 329 N 0.04 2.58 -0.45 2.03 3.52 -1.25 -1.99 118.95 123.43 3gue s ARG 329 Ca -0.00 -2.20 -0.18 0.00 -0.13 0.00 0.00 55.73 53.21 3gue s ARG 329 Cb -0.14 -3.85 0.03 0.00 -1.56 0.00 0.00 34.95 29.44 3gue s ARG 329 CO 0.03 -1.18 0.53 1.21 -0.81 0.00 0.00 175.30 175.08 3gue s ASN 330 N 1.60 6.23 0.15 -2.12 2.47 0.16 -4.89 114.94 118.53 3gue s ASN 330 Ca 0.13 -0.71 -0.29 0.00 0.42 0.00 0.00 52.86 52.40 3gue s ASN 330 Cb -0.21 -2.26 -0.07 0.00 -1.45 0.00 0.00 41.25 37.26 3gue s ASN 330 CO -0.04 -0.71 0.93 -2.16 -3.72 0.00 0.00 177.10 171.41 3gue s PRO 331 N 2.37 4.73 0.35 0.43 0.04 -1.26 0.30 135.00 141.97 3gue s PRO 331 Ca 0.14 1.42 -0.06 0.00 0.04 0.00 0.00 61.00 62.55 3gue s PRO 331 Cb -0.17 -3.34 0.02 0.00 0.04 0.00 0.00 34.50 31.04 3gue s PRO 331 CO 0.14 0.33 0.55 0.15 0.04 0.00 0.00 177.00 178.21 3gue s LYS 332 N -0.42 2.00 0.01 4.56 -0.14 -0.44 -4.94 119.74 120.36 3gue s LYS 332 Ca 0.44 -1.68 -0.01 0.00 -1.36 0.00 0.00 55.97 53.36 3gue s LYS 332 Cb -0.24 0.49 -0.04 0.00 -1.68 0.00 0.00 37.83 36.36 3gue s LYS 332 CO 0.30 -0.86 0.11 0.95 -0.76 0.00 0.00 175.35 175.09 3gue s THR 333 N -2.87 4.91 0.24 2.17 -4.23 -1.26 -0.14 115.64 114.46 3gue s THR 333 Ca 0.27 -0.39 -0.05 0.00 -1.18 0.00 0.00 61.69 60.34 3gue s THR 333 Cb -0.02 -3.28 0.23 0.00 1.34 0.00 0.00 72.50 70.77 3gue s THR 333 CO 0.18 0.31 1.69 1.62 -0.54 0.00 0.00 174.62 177.88 3gue h VAL 334 N 2.98 0.53 -3.45 2.29 3.04 -0.92 -3.12 116.25 117.60 3gue h VAL 334 Ca -0.49 -0.10 -0.71 0.00 -1.01 0.00 0.00 66.70 64.40 3gue h VAL 334 Cb 1.18 0.22 -0.20 0.00 -2.01 0.00 0.00 31.29 30.48 3gue h VAL 334 CO 0.65 0.05 -0.28 0.21 -1.01 0.00 0.00 177.57 177.19 3gue s ASN 335 N -5.25 6.16 0.36 3.17 3.84 -1.26 -4.78 114.94 117.18 3gue s ASN 335 Ca -0.13 -0.90 0.08 0.00 0.21 0.00 0.00 52.86 52.12 3gue s ASN 335 Cb 0.21 -2.20 0.79 0.00 -0.55 0.00 0.00 41.25 39.50 3gue s ASN 335 CO 0.76 -0.58 1.91 -0.65 -2.79 0.00 0.00 177.10 175.75 3gue h PRO 336 N 8.73 0.69 0.00 0.43 0.11 -1.95 -1.54 132.00 138.47 3gue h PRO 336 Ca -0.27 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.72 3gue h PRO 336 Cb 1.11 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 3gue h PRO 336 CO 0.81 0.46 -0.36 1.96 -0.21 0.00 0.00 178.00 180.65 3gue h GLN 337 N 0.71 0.00 -4.29 1.05 7.50 -1.93 -3.42 115.11 114.73 3gue h GLN 337 Ca 0.38 0.00 -0.73 0.00 0.50 0.00 0.00 58.65 58.80 3gue h GLN 337 Cb 0.51 0.00 -0.27 0.00 0.05 0.00 0.00 27.48 27.77 3gue h GLN 337 CO -0.15 0.36 -0.36 0.34 -1.50 0.00 0.00 178.83 177.52 3gue s ASP 338 N -6.46 5.87 0.00 1.46 3.68 -0.58 -4.96 116.67 115.68 3gue s ASP 338 Ca -0.00 -1.68 0.07 0.00 2.13 0.00 0.00 52.55 53.07 3gue s ASP 338 Cb 0.11 -2.08 0.31 0.00 -1.45 0.00 0.00 42.92 39.81 3gue s ASP 338 CO 0.68 -0.68 1.19 -1.54 0.13 0.00 0.00 175.17 174.95 3gue n SER 339 N 5.04 0.00 -0.64 -0.34 3.41 -1.26 -1.53 113.62 118.29 3gue n SER 339 Ca -0.11 0.43 0.09 0.00 -0.26 0.00 0.00 58.87 59.03 3gue n SER 339 Cb 0.42 -0.46 0.06 0.00 -0.26 0.00 0.00 64.21 63.97 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 -1.46 1.52 -1.87 4.33 6.02 -1.26 -4.97 117.38 119.69 3gue n GLN 340 Ca 0.02 -1.40 -0.31 0.00 -0.01 0.00 0.00 57.00 55.29 3gue n GLN 340 Cb 0.08 -1.33 0.02 0.00 1.02 0.00 0.00 30.24 30.02 3gue n GLN 340 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3gue s SER 341 N -1.60 5.94 -0.18 1.08 1.04 -0.59 -4.93 113.70 114.47 3gue s SER 341 Ca 0.19 1.56 -0.42 0.00 0.48 0.00 0.00 55.95 57.77 3gue s SER 341 Cb 0.15 -2.49 -0.19 0.00 0.10 0.00 0.00 66.02 63.58 3gue s SER 341 CO 0.27 -1.06 1.33 0.41 0.98 0.00 0.00 173.24 175.17 3gue n THR 342 N -2.60 0.03 -2.38 2.02 -1.04 -1.26 -4.49 114.28 104.55 3gue n THR 342 Ca 0.07 -0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.66 3gue n THR 342 Cb 0.54 -0.36 -0.03 0.00 -1.82 0.00 0.00 70.33 68.66 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 1.34 4.42 0.33 -2.82 1.02 -1.26 -0.36 119.74 122.41 3gue s LYS 343 Ca 0.95 1.82 0.03 0.00 0.02 0.00 0.00 55.97 58.80 3gue s LYS 343 Cb -1.29 -3.32 -0.04 0.00 -0.52 0.00 0.00 37.83 32.66 3gue s LYS 343 CO 0.65 -0.27 0.14 0.14 -0.92 0.00 0.00 175.35 175.09 3gue s VAL 344 N 0.96 0.48 -0.08 3.17 -7.23 0.80 -1.55 120.40 116.95 3gue s VAL 344 Ca 0.59 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.78 3gue s VAL 344 Cb -0.31 -2.51 0.01 0.00 0.56 0.00 0.00 36.38 34.13 3gue s VAL 344 CO 0.30 0.00 -0.14 -0.31 -0.31 0.00 0.00 175.10 174.64 3gue s TYR 345 N -3.50 1.68 -0.30 2.82 2.02 0.11 -1.32 117.35 118.86 3gue s TYR 345 Ca 0.33 -0.67 -0.12 0.00 -0.37 0.00 0.00 57.07 56.24 3gue s TYR 345 Cb 0.05 -1.21 -0.04 0.00 -0.40 0.00 0.00 41.96 40.36 3gue s TYR 345 CO 0.17 -0.34 0.21 -0.65 -1.57 0.00 0.00 175.55 173.36 3gue s GLN 346 N 0.74 3.79 -0.17 -0.62 -0.21 0.15 -2.43 119.66 120.91 3gue s GLN 346 Ca -0.13 -0.43 -0.21 0.00 0.02 0.00 0.00 55.36 54.61 3gue s GLN 346 Cb -0.16 -3.71 -0.03 0.00 1.00 0.00 0.00 33.01 30.11 3gue s GLN 346 CO 0.03 -0.27 0.61 -0.51 -2.12 0.00 0.00 175.29 173.02 3gue s LEU 347 N 1.75 4.19 -0.01 2.90 1.43 -1.26 -0.67 118.68 127.00 3gue s LEU 347 Ca 0.07 0.87 -0.13 0.00 -1.03 0.00 0.00 54.13 53.91 3gue s LEU 347 Cb -0.16 -2.87 0.02 0.00 0.03 0.00 0.00 46.19 43.20 3gue s LEU 347 CO 0.11 -0.20 0.27 -1.61 0.23 0.00 0.00 176.35 175.15 3gue s GLU 348 N 1.53 0.61 0.23 1.70 2.02 -0.84 -4.68 118.70 119.26 3gue s GLU 348 Ca 0.29 -0.21 0.11 0.00 0.02 0.00 0.00 54.97 55.18 3gue s GLU 348 Cb -0.16 0.27 -0.05 0.00 0.10 0.00 0.00 34.13 34.29 3gue s GLU 348 CO 0.11 -0.16 -0.21 0.14 0.02 0.00 0.00 175.26 175.17 3gue s VAL 349 N -1.26 2.30 -0.10 2.63 -7.23 -0.28 -0.49 120.40 115.97 3gue s VAL 349 Ca -0.13 -2.22 0.01 0.00 -1.81 0.00 0.00 61.98 57.82 3gue s VAL 349 Cb -0.06 -2.17 -0.02 0.00 0.56 0.00 0.00 36.38 34.69 3gue s VAL 349 CO 0.03 -0.32 -0.10 0.00 -0.31 0.00 0.00 175.10 174.40 3gue s ALA 350 N -2.24 2.78 0.47 1.32 0.00 -1.26 -0.94 121.76 121.89 3gue s ALA 350 Ca 0.25 -0.90 0.34 0.00 0.00 0.00 0.00 51.96 51.65 3gue s ALA 350 Cb -0.06 -1.20 1.81 0.00 0.00 0.00 0.00 23.12 23.67 3gue s ALA 350 CO 0.12 0.40 2.18 0.00 0.00 0.00 0.00 175.76 178.46 3gue h MET 351 N 5.99 0.00 0.00 0.00 -0.00 -1.84 -1.63 114.93 117.45 3gue h MET 351 Ca -0.38 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 59.30 3gue h MET 351 Cb 1.18 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.78 3gue h MET 351 CO 0.55 0.04 -0.10 0.78 -0.00 0.00 0.00 176.91 178.18 3gue h GLY 352 N 0.67 0.00 2.00 -3.00 0.00 -1.95 -2.95 103.07 97.84 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 0.01 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.55 3gue n ALA 353 N -2.14 1.59 0.79 3.60 0.00 -0.61 -1.82 120.51 121.92 3gue n ALA 353 Ca 0.01 0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.59 3gue n ALA 353 Cb 0.40 -1.34 0.40 0.00 0.00 0.00 0.00 19.45 18.91 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 -1.71 1.92 0.09 0.00 0.00 -1.11 -3.49 120.51 116.21 3gue n ALA 354 Ca 0.02 -0.08 0.05 0.00 0.00 0.00 0.00 53.44 53.43 3gue n ALA 354 Cb 0.19 -1.24 0.47 0.00 0.00 0.00 0.00 19.45 18.88 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 1.09 0.00 0.00 2.10 -1.61 -2.03 117.51 117.07 3gue h ILE 355 Ca 0.00 -0.26 0.00 0.00 1.08 0.00 0.00 64.86 65.68 3gue h ILE 355 Cb 0.08 0.77 0.00 0.00 -1.09 0.00 0.00 36.82 36.57 3gue h ILE 355 CO 0.00 0.10 -0.48 -1.54 -1.08 0.00 0.00 178.15 175.15 3gue n SER 356 N -4.45 0.57 0.02 2.19 3.41 -1.23 -4.37 113.62 109.76 3gue n SER 356 Ca 0.01 0.07 -0.12 0.00 -0.26 0.00 0.00 58.87 58.57 3gue n SER 356 Cb 0.11 0.06 -0.14 0.00 -0.26 0.00 0.00 64.21 63.98 3gue n SER 356 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3gue h LEU 357 N 0.00 0.17 -9.93 1.04 3.38 -1.57 -3.46 115.31 104.94 3gue h LEU 357 Ca 0.00 -0.26 -0.51 0.00 0.09 0.00 0.00 57.88 57.20 3gue h LEU 357 Cb 0.64 -0.05 0.05 0.00 0.09 0.00 0.00 40.66 41.38 3gue h LEU 357 CO 0.00 1.23 0.50 -0.36 0.09 0.00 0.00 178.44 179.90 3gue s PHE 358 N -2.62 3.13 0.15 1.13 0.08 -1.09 -4.97 117.98 113.79 3gue s PHE 358 Ca -0.07 1.57 -0.17 0.00 0.12 0.00 0.00 56.93 58.38 3gue s PHE 358 Cb 0.08 -3.38 0.01 0.00 -0.57 0.00 0.00 43.02 39.16 3gue s PHE 358 CO 0.83 -1.22 1.78 0.22 -0.10 0.00 0.00 175.22 176.73 3gue h ASP 359 N 2.76 0.29 -3.69 1.36 3.58 -1.93 -3.39 116.42 115.40 3gue h ASP 359 Ca -0.49 0.01 -0.63 0.00 0.42 0.00 0.00 57.03 56.34 3gue h ASP 359 Cb 1.23 -0.05 -0.38 0.00 1.72 0.00 0.00 39.33 41.85 3gue h ASP 359 CO 0.63 0.21 -0.79 -0.13 -2.88 0.00 0.00 179.24 176.29 3gue s ARG 360 N -6.16 1.76 0.08 0.28 0.52 -1.26 -5.03 118.95 109.14 3gue s ARG 360 Ca -0.13 -1.14 0.03 0.00 -0.52 0.00 0.00 55.73 53.98 3gue s ARG 360 Cb 0.11 -2.69 -0.03 0.00 0.52 0.00 0.00 34.95 32.86 3gue s ARG 360 CO 0.71 -0.62 -0.10 -1.54 0.02 0.00 0.00 175.30 173.77 3gue s SER 361 N 1.30 1.31 0.04 0.23 1.04 -1.26 0.52 113.70 116.87 3gue s SER 361 Ca -0.05 -0.73 -0.13 0.00 0.48 0.00 0.00 55.95 55.52 3gue s SER 361 Cb -0.19 0.01 0.02 0.00 0.10 0.00 0.00 66.02 65.96 3gue s SER 361 CO -0.06 -0.23 0.28 -1.61 0.98 0.00 0.00 173.24 172.59 3gue s GLU 362 N -2.38 0.78 -0.03 4.02 2.02 -0.59 -5.00 118.70 117.52 3gue s GLU 362 Ca 0.01 -0.53 0.07 0.00 0.02 0.00 0.00 54.97 54.54 3gue s GLU 362 Cb -0.05 0.33 -0.02 0.00 0.10 0.00 0.00 34.13 34.49 3gue s GLU 362 CO 0.00 -0.24 -0.23 0.00 0.02 0.00 0.00 175.26 174.80 3gue s ALA 363 N -2.54 2.27 -0.01 5.21 0.00 -1.26 -0.88 121.76 124.54 3gue s ALA 363 Ca -0.05 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 50.86 3gue s ALA 363 Cb -0.01 -0.64 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 3gue s ALA 363 CO -0.03 0.53 -0.14 0.08 0.00 0.00 0.00 175.76 176.19 3gue s VAL 364 N -0.62 1.15 -0.13 0.00 1.01 -0.63 -4.44 120.40 116.73 3gue s VAL 364 Ca 0.10 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.17 3gue s VAL 364 Cb -0.10 -0.96 -0.01 0.00 0.00 0.00 0.00 36.38 35.30 3gue s VAL 364 CO -0.01 0.33 1.06 -0.69 0.00 0.00 0.00 175.10 175.80 3gue s VAL 365 N -0.27 4.64 0.21 2.92 1.01 0.23 -1.31 120.40 127.83 3gue s VAL 365 Ca 0.04 1.93 0.09 0.00 0.00 0.00 0.00 61.98 64.04 3gue s VAL 365 Cb -0.06 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 3gue s VAL 365 CO -0.00 -0.05 -0.05 0.68 0.00 0.00 0.00 175.10 175.68 3gue s VAL 366 N 2.42 3.37 0.57 2.92 -7.23 0.89 -1.81 120.40 121.53 3gue s VAL 366 Ca 0.49 -1.72 -0.21 0.00 -1.81 0.00 0.00 61.98 58.73 3gue s VAL 366 Cb -0.19 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 33.98 3gue s VAL 366 CO 0.16 -0.21 1.34 -2.84 -0.31 0.00 0.00 175.10 173.23 3gue s PRO 367 N -3.17 3.01 0.66 4.82 0.02 -1.26 -4.54 135.00 134.53 3gue s PRO 367 Ca 0.28 2.18 0.29 0.00 0.02 0.00 0.00 61.00 63.76 3gue s PRO 367 Cb -0.08 -2.15 1.56 0.00 0.02 0.00 0.00 34.50 33.85 3gue s PRO 367 CO 0.18 -1.28 1.88 -0.09 -0.33 0.00 0.00 177.00 177.36 3gue h ARG 368 N 1.24 0.00 0.00 5.54 9.65 -1.92 -2.31 114.38 126.57 3gue h ARG 368 Ca -0.51 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.37 3gue h ARG 368 Cb 1.31 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.89 3gue h ARG 368 CO 0.56 0.00 0.00 -0.85 2.80 0.00 0.00 179.97 182.48 3gue n GLU 369 N -2.93 0.10 -0.19 0.20 0.28 -1.26 -1.79 120.64 115.05 3gue n GLU 369 Ca -0.01 0.49 0.10 0.00 -0.16 0.00 0.00 57.16 57.57 3gue n GLU 369 Cb 0.42 -1.76 0.27 0.00 1.43 0.00 0.00 31.44 31.79 3gue n GLU 369 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3gue n ARG 370 N -1.97 2.11 -3.40 3.44 1.74 -0.87 -4.69 116.66 113.02 3gue n ARG 370 Ca 0.01 -1.70 -0.16 0.00 -0.77 0.00 0.00 57.85 55.23 3gue n ARG 370 Cb 0.10 -1.42 -0.10 0.00 -1.02 0.00 0.00 32.46 30.03 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 -1.51 -0.52 -0.62 -1.55 5.36 -0.74 -3.14 117.98 115.26 3gue s PHE 371 Ca 0.34 0.02 0.06 0.00 -0.96 0.00 0.00 56.93 56.38 3gue s PHE 371 Cb 0.19 -0.38 0.21 0.00 -0.34 0.00 0.00 43.02 42.70 3gue s PHE 371 CO 0.26 -0.87 0.58 0.00 -1.46 0.00 0.00 175.22 173.73 3gue n ALA 372 N 5.32 3.51 -1.80 11.12 0.00 -1.26 -4.94 120.51 132.47 3gue n ALA 372 Ca -0.02 -4.36 -0.35 0.00 0.00 0.00 0.00 53.44 48.71 3gue n ALA 372 Cb 0.47 -0.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.96 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 -1.67 3.96 -0.36 0.00 0.04 -1.26 -4.12 135.00 131.59 3gue s PRO 373 Ca 0.33 1.37 0.01 0.00 0.04 0.00 0.00 61.00 62.75 3gue s PRO 373 Cb 0.06 -2.23 0.11 0.00 0.04 0.00 0.00 34.50 32.48 3gue s PRO 373 CO -0.11 -0.30 0.14 0.08 0.04 0.00 0.00 177.00 176.86 3gue s VAL 374 N -1.91 1.22 -0.15 -0.36 1.01 -1.26 -4.80 120.40 114.16 3gue s VAL 374 Ca 0.64 -1.92 0.18 0.00 0.00 0.00 0.00 61.98 60.88 3gue s VAL 374 Cb -0.17 -1.90 -0.26 0.00 0.00 0.00 0.00 36.38 34.05 3gue s VAL 374 CO 0.21 -0.75 0.18 0.29 0.00 0.00 0.00 175.10 175.03 3gue n LYS 375 N 4.31 0.77 -4.37 2.72 4.76 -1.26 -4.86 118.16 120.24 3gue n LYS 375 Ca 0.03 -0.06 -0.19 0.00 -2.87 0.00 0.00 58.31 55.22 3gue n LYS 375 Cb 0.39 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 31.99 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 -2.75 0.62 0.31 -0.18 -4.23 -1.26 -4.63 115.64 103.52 3gue s THR 376 Ca -0.09 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.52 3gue s THR 376 Cb 0.08 -2.61 0.03 0.00 1.34 0.00 0.00 72.50 71.34 3gue s THR 376 CO 0.82 0.00 1.71 0.00 -0.54 0.00 0.00 174.62 176.60 3gue h SER 378 N 0.06 0.93 -0.52 0.00 4.64 -1.90 0.28 113.55 117.06 3gue h SER 378 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 3gue h SER 378 Cb 0.87 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.74 3gue h SER 378 CO 0.07 0.62 0.05 0.44 -0.87 0.00 0.00 176.83 177.14 3gue h ASP 379 N 1.08 0.85 -0.51 4.97 3.32 -1.81 -2.89 116.42 121.43 3gue h ASP 379 Ca 0.38 -0.28 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 3gue h ASP 379 Cb 0.09 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3gue h ASP 379 CO -0.15 0.91 0.25 0.25 -1.72 0.00 0.00 179.24 178.79 3gue h LEU 380 N 0.75 0.67 -0.61 1.55 5.85 -0.90 -0.61 115.31 122.01 3gue h LEU 380 Ca 0.15 -0.12 0.11 0.00 0.84 0.00 0.00 57.88 58.86 3gue h LEU 380 Cb 0.45 -0.17 -0.08 0.00 0.37 0.00 0.00 40.66 41.22 3gue h LEU 380 CO 0.02 0.60 0.16 0.25 -0.34 0.00 0.00 178.44 179.13 3gue h LEU 381 N 0.69 0.06 -0.48 2.25 5.85 -0.95 -0.94 115.31 121.79 3gue h LEU 381 Ca 0.18 0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.89 3gue h LEU 381 Cb 0.11 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 3gue h LEU 381 CO -0.02 0.04 -0.14 0.00 -0.34 0.00 0.00 178.44 177.97 3gue h ALA 382 N 1.47 0.66 -0.53 1.25 0.00 -1.18 -1.91 119.26 119.03 3gue h ALA 382 Ca 0.32 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3gue h ALA 382 Cb 0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3gue h ALA 382 CO -0.39 0.59 0.09 1.25 0.00 0.00 0.00 179.25 180.79 3gue h LEU 383 N 0.79 0.84 -1.07 0.00 5.85 -0.90 -2.68 115.31 118.13 3gue h LEU 383 Ca 0.12 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.50 3gue h LEU 383 Cb 0.70 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3gue h LEU 383 CO 0.05 0.88 -0.37 0.03 -0.34 0.00 0.00 178.44 178.69 3gue h ARG 384 N 0.76 0.00 -7.54 1.25 3.08 -1.12 -3.41 114.38 107.40 3gue h ARG 384 Ca 0.16 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.73 3gue h ARG 384 Cb 0.40 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.55 3gue h ARG 384 CO 0.01 0.37 0.40 -1.54 -1.07 0.00 0.00 179.97 178.14 3gue s SER 385 N -6.53 4.80 0.00 7.04 1.04 -0.72 -4.92 113.70 114.41 3gue s SER 385 Ca -0.01 0.97 0.12 0.00 0.48 0.00 0.00 55.95 57.51 3gue s SER 385 Cb 0.12 -1.60 0.71 0.00 0.10 0.00 0.00 66.02 65.35 3gue s SER 385 CO 0.69 -1.74 1.14 -0.90 0.98 0.00 0.00 173.24 173.41 3gue n ASP 386 N -3.24 0.00 0.24 7.02 5.68 -1.26 -1.96 116.55 123.03 3gue n ASP 386 Ca 0.07 -0.42 0.08 0.00 -0.50 0.00 0.00 54.79 54.03 3gue n ASP 386 Cb 0.59 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.17 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 2.73 1.53 -3.96 2.12 0.00 -1.81 -3.40 119.26 116.47 3gue h ALA 387 Ca 0.00 -0.14 -0.68 0.00 0.00 0.00 0.00 54.91 54.08 3gue h ALA 387 Cb 0.00 -0.02 -0.22 0.00 0.00 0.00 0.00 17.79 17.55 3gue h ALA 387 CO 0.00 0.19 -0.80 0.71 0.00 0.00 0.00 179.25 179.35 3gue s TYR 388 N -4.47 2.58 0.06 0.00 2.02 -0.83 -0.24 117.35 116.46 3gue s TYR 388 Ca -0.04 -0.24 0.04 0.00 -0.37 0.00 0.00 57.07 56.46 3gue s TYR 388 Cb 0.15 -1.48 -0.03 0.00 -0.40 0.00 0.00 41.96 40.20 3gue s TYR 388 CO 0.65 0.25 -0.11 -0.65 -1.57 0.00 0.00 175.55 174.12 3gue s GLN 389 N -1.40 0.69 -0.08 -0.62 -0.21 -0.00 -4.89 119.66 113.15 3gue s GLN 389 Ca 0.15 -0.87 -0.24 0.00 0.02 0.00 0.00 55.36 54.41 3gue s GLN 389 Cb -0.11 -0.58 -0.03 0.00 1.00 0.00 0.00 33.01 33.29 3gue s GLN 389 CO 0.05 0.12 0.75 0.08 -2.12 0.00 0.00 175.29 174.17 3gue s VAL 390 N -1.35 5.00 0.48 1.09 1.01 -1.26 -1.43 120.40 123.94 3gue s VAL 390 Ca -0.05 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.46 3gue s VAL 390 Cb -0.10 -4.08 0.01 0.00 0.00 0.00 0.00 36.38 32.21 3gue s VAL 390 CO 0.01 0.20 0.71 0.42 0.00 0.00 0.00 175.10 176.44 3gue s THR 391 N 1.08 3.60 0.27 3.92 -4.23 -0.46 -4.95 115.64 114.87 3gue s THR 391 Ca 0.39 -0.52 -0.00 0.00 -1.18 0.00 0.00 61.69 60.37 3gue s THR 391 Cb -0.18 -3.34 0.27 0.00 1.34 0.00 0.00 72.50 70.59 3gue s THR 391 CO 0.18 -0.24 1.83 -0.08 -0.54 0.00 0.00 174.62 175.77 3gue h GLU 392 N 0.28 0.92 -0.55 3.99 4.81 -1.98 0.19 114.58 122.24 3gue h GLU 392 Ca -0.45 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3gue h GLU 392 Cb 1.27 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.44 3gue h GLU 392 CO 0.56 0.61 0.00 -0.40 -0.73 0.00 0.00 179.01 179.05 3gue n ASP 393 N -4.65 0.94 -0.89 1.04 5.75 -1.26 -4.87 116.55 112.62 3gue n ASP 393 Ca 0.17 -2.05 -0.10 0.00 -0.01 0.00 0.00 54.79 52.80 3gue n ASP 393 Cb 0.33 -0.30 -0.03 0.00 -1.03 0.00 0.00 41.12 40.09 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 -0.11 -0.74 -2.86 0.11 1.13 0.66 -4.58 117.38 110.98 3gue n GLN 394 Ca 0.02 0.77 -0.25 0.00 -1.94 0.00 0.00 57.00 55.60 3gue n GLN 394 Cb 0.21 -4.74 0.00 0.00 0.11 0.00 0.00 30.24 25.82 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 -3.29 3.35 -0.17 -1.09 0.52 -1.26 -4.67 118.95 112.35 3gue s ARG 395 Ca 0.00 -0.10 -0.05 0.00 -0.52 0.00 0.00 55.73 55.06 3gue s ARG 395 Cb 0.00 -2.47 -0.03 0.00 0.52 0.00 0.00 34.95 32.97 3gue s ARG 395 CO 0.00 -0.19 0.00 -0.51 0.02 0.00 0.00 175.30 174.62 3gue s LEU 396 N -4.63 3.49 0.00 2.53 1.02 -0.57 -1.36 118.68 119.16 3gue s LEU 396 Ca 0.47 -0.04 -0.02 0.00 0.02 0.00 0.00 54.13 54.55 3gue s LEU 396 Cb -0.10 -1.86 -0.01 0.00 0.02 0.00 0.00 46.19 44.24 3gue s LEU 396 CO 0.41 0.17 0.03 0.68 0.02 0.00 0.00 176.35 177.67 3gue s VAL 397 N 0.36 0.07 0.36 -1.59 -7.23 -0.52 -3.69 120.40 108.16 3gue s VAL 397 Ca -0.01 -0.59 -0.28 0.00 -1.81 0.00 0.00 61.98 59.29 3gue s VAL 397 Cb -0.13 -0.24 -0.11 0.00 0.56 0.00 0.00 36.38 36.46 3gue s VAL 397 CO 0.02 -0.32 1.46 -0.22 -0.31 0.00 0.00 175.10 175.72 3gue s LEU 398 N -0.99 4.34 0.73 1.32 2.96 -1.26 -0.82 118.68 124.96 3gue s LEU 398 Ca -0.11 2.97 -0.15 0.00 -0.22 0.00 0.00 54.13 56.62 3gue s LEU 398 Cb -0.07 -3.66 0.04 0.00 0.50 0.00 0.00 46.19 43.00 3gue s LEU 398 CO -0.00 -0.81 1.24 0.00 -1.32 0.00 0.00 176.35 175.46 3gue h GLU 400 N -0.23 1.02 0.00 0.00 4.81 -1.93 -2.77 114.58 115.48 3gue h GLU 400 Ca -0.48 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 58.57 3gue h GLU 400 Cb 1.31 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.52 3gue h GLU 400 CO 0.49 0.84 0.00 -0.85 -0.73 0.00 0.00 179.01 178.77 3gue n GLU 401 N -4.29 0.19 -0.03 1.92 0.28 -1.26 -1.83 120.64 115.62 3gue n GLU 401 Ca 0.06 0.36 0.05 0.00 -0.16 0.00 0.00 57.16 57.47 3gue n GLU 401 Cb 0.19 -1.83 0.23 0.00 1.43 0.00 0.00 31.44 31.45 3gue n GLU 401 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3gue n ARG 402 N -2.18 1.17 -4.48 3.44 5.12 -1.05 -4.94 116.66 113.75 3gue n ARG 402 Ca 0.03 -0.26 -0.41 0.00 -1.93 0.00 0.00 57.85 55.28 3gue n ARG 402 Cb 0.26 -1.16 -0.08 0.00 -1.16 0.00 0.00 32.46 30.32 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 -0.38 -1.36 0.00 0.55 3.02 -0.76 0.10 115.26 116.43 3gue n ASN 403 Ca 0.07 -1.24 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 3gue n ASN 403 Cb 0.09 -1.58 0.00 0.00 -0.61 0.00 0.00 39.78 37.68 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 -1.30 1.55 3.23 7.41 0.00 -1.26 -5.02 105.19 109.79 3gue n GLY 404 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.19 2.53 0.72 1.61 1.02 0.11 -4.88 119.74 120.67 3gue s LYS 405 Ca 0.00 -1.22 -0.15 0.00 0.02 0.00 0.00 55.97 54.62 3gue s LYS 405 Cb 0.00 -3.35 0.04 0.00 -0.52 0.00 0.00 37.83 34.00 3gue s LYS 405 CO 0.00 -0.65 1.20 -2.14 -0.92 0.00 0.00 175.35 172.84 3gue s PRO 406 N 1.34 2.19 0.31 -1.68 0.02 -1.26 -4.81 135.00 131.11 3gue s PRO 406 Ca -0.03 1.73 -0.29 0.00 0.02 0.00 0.00 61.00 62.43 3gue s PRO 406 Cb -0.20 -1.84 -0.13 0.00 0.02 0.00 0.00 34.50 32.35 3gue s PRO 406 CO 0.01 -1.79 1.25 -2.30 -0.33 0.00 0.00 177.00 173.84 3gue n PRO 407 N -2.70 1.93 -2.95 5.54 -0.02 -1.26 -4.76 135.00 130.79 3gue n PRO 407 Ca 0.13 0.68 -0.43 0.00 -2.02 0.00 0.00 63.50 61.85 3gue n PRO 407 Cb 0.50 -2.22 -0.04 0.00 -0.02 0.00 0.00 33.50 31.72 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 -0.90 3.22 -0.33 3.55 0.00 -0.60 -4.81 121.76 121.89 3gue s ALA 408 Ca 0.58 -1.87 -0.12 0.00 0.00 0.00 0.00 51.96 50.56 3gue s ALA 408 Cb -0.62 -3.71 -0.01 0.00 0.00 0.00 0.00 23.12 18.78 3gue s ALA 408 CO 0.60 -2.56 0.21 0.42 0.00 0.00 0.00 175.76 174.43 3gue s ILE 409 N 3.57 5.01 -0.37 0.00 1.01 -1.26 -1.62 121.20 127.53 3gue s ILE 409 Ca 0.20 -0.32 -0.05 0.00 0.00 0.00 0.00 60.65 60.47 3gue s ILE 409 Cb -0.18 -3.58 0.07 0.00 0.01 0.00 0.00 42.46 38.78 3gue s ILE 409 CO 0.10 0.00 0.16 -0.62 0.00 0.00 0.00 174.94 174.58 3gue s ASP 410 N 1.68 5.31 -0.22 3.58 2.15 -0.13 -4.88 116.67 124.15 3gue s ASP 410 Ca 0.05 -1.53 -0.08 0.00 0.43 0.00 0.00 52.55 51.42 3gue s ASP 410 Cb -0.17 -1.86 -0.04 0.00 -0.30 0.00 0.00 42.92 40.55 3gue s ASP 410 CO 0.09 -0.44 0.08 -0.76 -0.17 0.00 0.00 175.17 173.97 3gue s LEU 411 N 1.30 3.71 -0.44 -1.34 1.43 -1.26 -0.91 118.68 121.17 3gue s LEU 411 Ca 0.02 -0.03 -0.40 0.00 -1.03 0.00 0.00 54.13 52.69 3gue s LEU 411 Cb -0.22 -1.97 -0.17 0.00 0.03 0.00 0.00 46.19 43.86 3gue s LEU 411 CO -0.00 0.07 1.67 -0.67 0.23 0.00 0.00 176.35 177.65 3gue n ASP 412 N 4.24 0.83 0.31 2.29 -0.08 -0.12 -4.79 116.55 119.23 3gue n ASP 412 Ca -0.16 0.79 0.21 0.00 -1.51 0.00 0.00 54.79 54.12 3gue n ASP 412 Cb 0.52 -0.78 1.09 0.00 2.34 0.00 0.00 41.12 44.29 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 6.37 0.00 1.87 0.27 0.00 -1.95 -0.59 103.07 109.05 3gue h GLY 413 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.11 3gue h GLY 413 CO 0.91 0.00 -0.09 1.18 0.00 0.00 0.00 176.54 178.55 3gue n GLU 414 N -3.00 0.22 0.00 4.80 1.02 -1.26 -4.26 120.64 118.16 3gue n GLU 414 Ca -0.02 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 3gue n GLU 414 Cb 0.10 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 29.79 3gue n GLU 414 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3gue n HIS 415 N -2.10 0.00 -0.14 -0.32 8.25 -0.78 -4.91 115.22 115.22 3gue n HIS 415 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 3gue n HIS 415 Cb 0.41 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.52 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 -1.48 0.00 0.08 4.41 4.01 -0.30 -3.89 117.16 119.99 3gue n TYR 416 Ca 0.00 -0.21 -0.22 0.00 -0.16 0.00 0.00 57.90 57.31 3gue n TYR 416 Cb 0.30 -0.02 -0.15 0.00 -0.31 0.00 0.00 39.34 39.16 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 0.40 -6.69 -0.72 3.64 -1.74 -3.38 116.57 108.08 3gue h LYS 417 Ca 0.00 -0.66 -0.50 0.00 -1.27 0.00 0.00 60.65 58.22 3gue h LYS 417 Cb 0.32 0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.35 3gue h LYS 417 CO 0.00 1.31 0.22 -1.64 -2.27 0.00 0.00 179.45 177.07 3gue s MET 418 N -2.55 4.45 0.43 1.90 -1.94 -1.26 -4.38 119.30 115.95 3gue s MET 418 Ca -0.12 1.11 0.11 0.00 -1.71 0.00 0.00 55.69 55.08 3gue s MET 418 Cb 0.02 -2.92 0.93 0.00 2.01 0.00 0.00 34.83 34.87 3gue s MET 418 CO 0.87 0.38 2.00 0.97 -0.01 0.00 0.00 175.02 179.23 3gue h ILE 419 N 2.78 1.12 -0.94 2.53 2.10 -1.52 -0.08 117.51 123.51 3gue h ILE 419 Ca -0.47 -0.51 0.06 0.00 1.08 0.00 0.00 64.86 65.02 3gue h ILE 419 Cb 1.19 1.08 -0.06 0.00 -1.09 0.00 0.00 36.82 37.94 3gue h ILE 419 CO 0.65 0.16 0.61 -0.78 -1.08 0.00 0.00 178.15 177.71 3gue h ASP 420 N 0.20 0.95 -0.06 2.19 3.58 -1.92 0.17 116.42 121.52 3gue h ASP 420 Ca 0.05 0.01 -0.24 0.00 0.42 0.00 0.00 57.03 57.27 3gue h ASP 420 Cb 0.22 -0.20 0.02 0.00 1.72 0.00 0.00 39.33 41.09 3gue h ASP 420 CO 0.01 0.61 -0.88 1.23 -2.88 0.00 0.00 179.24 177.32 3gue h GLY 421 N 1.08 0.78 1.69 -0.78 0.00 -1.21 -3.21 103.07 101.42 3gue h GLY 421 Ca 0.40 -1.25 -0.02 0.00 0.00 0.00 0.00 47.33 46.46 3gue h GLY 421 CO -0.15 1.11 0.10 -2.75 0.00 0.00 0.00 176.54 174.85 3gue h PHE 422 N 0.38 0.40 -0.87 5.60 3.57 -0.99 -2.71 116.94 122.33 3gue h PHE 422 Ca -0.09 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.47 3gue h PHE 422 Cb 1.54 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 40.09 3gue h PHE 422 CO 0.10 0.34 0.57 0.93 -2.23 0.00 0.00 178.31 178.02 3gue h GLU 423 N 0.41 0.93 -0.22 1.11 5.08 -0.67 -2.46 114.58 118.75 3gue h GLU 423 Ca 0.10 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 3gue h GLU 423 Cb 0.11 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 3gue h GLU 423 CO -0.01 0.61 -0.24 0.87 -1.00 0.00 0.00 179.01 179.24 3gue h LYS 424 N 0.95 0.40 -0.46 2.33 1.57 -1.57 -1.46 116.57 118.34 3gue h LYS 424 Ca 0.38 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 3gue h LYS 424 Cb 0.26 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 3gue h LYS 424 CO -0.15 0.62 0.21 1.25 -0.57 0.00 0.00 179.45 180.82 3gue h LEU 425 N 0.36 0.61 -1.62 2.94 5.85 -1.51 -3.24 115.31 118.70 3gue h LEU 425 Ca 0.06 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.64 3gue h LEU 425 Cb 0.62 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.50 3gue h LEU 425 CO 0.04 0.58 -0.05 1.33 -0.34 0.00 0.00 178.44 180.01 3gue n VAL 426 N -4.62 0.00 -0.26 1.05 0.24 -1.18 -1.26 118.33 112.29 3gue n VAL 426 Ca 0.01 -0.48 -0.02 0.00 -2.04 0.00 0.00 64.34 61.81 3gue n VAL 426 Cb 0.13 1.37 0.04 0.00 -1.47 0.00 0.00 33.84 33.90 3gue n VAL 426 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3gue h LYS 427 N 3.44 -0.08 -0.26 7.34 3.64 -1.29 0.15 116.57 129.51 3gue h LYS 427 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3gue h LYS 427 Cb 0.75 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 3gue h LYS 427 CO 0.00 -0.06 0.00 0.41 -2.27 0.00 0.00 179.45 177.53 3gue n GLY 428 N -1.46 0.63 0.00 5.01 0.00 -1.18 -4.95 105.19 103.24 3gue n GLY 428 Ca 0.07 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 1.18 4.18 3.67 -0.02 0.00 0.04 -2.30 105.19 111.95 3gue n GLY 429 Ca 0.16 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.60 4.84 0.70 1.61 1.01 -1.25 -4.44 120.40 122.27 3gue s VAL 430 Ca 0.00 1.75 -0.12 0.00 0.00 0.00 0.00 61.98 63.61 3gue s VAL 430 Cb 0.00 -4.19 0.01 0.00 0.00 0.00 0.00 36.38 32.21 3gue s VAL 430 CO 0.00 -0.00 1.08 -2.16 0.00 0.00 0.00 175.10 174.02 3gue s PRO 431 N 2.26 2.75 0.11 2.72 0.04 -1.26 -4.75 135.00 136.87 3gue s PRO 431 Ca 0.41 1.15 -0.31 0.00 0.04 0.00 0.00 61.00 62.29 3gue s PRO 431 Cb -0.17 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 3gue s PRO 431 CO 0.13 -1.26 1.31 0.45 0.04 0.00 0.00 177.00 177.66 3gue s SER 432 N -3.27 6.93 0.00 6.66 0.15 0.78 -4.55 113.70 120.41 3gue s SER 432 Ca 0.62 2.22 0.00 0.00 0.70 0.00 0.00 55.95 59.49 3gue s SER 432 Cb -0.17 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 3gue s SER 432 CO 0.50 -0.57 0.58 0.18 1.20 0.00 0.00 173.24 175.13 3gue n LEU 433 N 3.76 0.84 0.26 3.45 4.77 -1.26 -0.99 117.00 127.83 3gue n LEU 433 Ca 0.10 -0.84 0.09 0.00 -0.03 0.00 0.00 56.01 55.32 3gue n LEU 433 Cb 0.44 0.00 0.66 0.00 -2.33 0.00 0.00 43.42 42.19 3gue n LEU 433 CO 0.57 0.21 1.03 0.08 -1.33 0.00 0.00 177.39 177.96 3gue h ARG 434 N 0.00 0.00 -0.67 3.23 0.11 -1.83 -1.70 114.38 113.52 3gue h ARG 434 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3gue h ARG 434 Cb 0.57 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.65 3gue h ARG 434 CO 0.00 0.05 0.00 1.04 0.10 0.00 0.00 179.97 181.16 3gue n GLN 435 N -4.31 2.57 -3.32 0.08 6.02 -1.26 -4.45 117.38 112.71 3gue n GLN 435 Ca -0.03 -2.44 -0.39 0.00 -0.01 0.00 0.00 57.00 54.14 3gue n GLN 435 Cb 0.14 -1.53 -0.07 0.00 1.02 0.00 0.00 30.24 29.80 3gue n GLN 435 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3gue n THR 437 N 4.49 1.01 -3.64 0.00 -2.24 0.90 -4.10 114.28 110.69 3gue n THR 437 Ca -0.06 -0.65 -0.06 0.00 -2.27 0.00 0.00 64.05 61.00 3gue n THR 437 Cb 0.51 -0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 68.06 3gue n THR 437 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3gue s SER 438 N -5.63 -0.76 -0.06 3.42 0.15 -0.96 -1.56 113.70 108.30 3gue s SER 438 Ca -0.02 1.25 -0.02 0.00 0.70 0.00 0.00 55.95 57.85 3gue s SER 438 Cb 0.09 1.30 0.03 0.00 -1.71 0.00 0.00 66.02 65.73 3gue s SER 438 CO 0.81 -0.20 0.03 -0.22 1.20 0.00 0.00 173.24 174.86 3gue s LEU 439 N 1.31 0.37 -0.13 3.45 2.96 -0.64 -0.89 118.68 125.11 3gue s LEU 439 Ca -0.08 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 3gue s LEU 439 Cb -0.05 -0.29 -0.01 0.00 0.50 0.00 0.00 46.19 46.35 3gue s LEU 439 CO -0.15 -0.23 -0.15 -0.89 -1.32 0.00 0.00 176.35 173.61 3gue s THR 440 N 2.07 2.83 -0.06 3.68 2.01 -0.32 -0.95 115.64 124.90 3gue s THR 440 Ca 0.05 -0.73 0.03 0.00 0.31 0.00 0.00 61.69 61.34 3gue s THR 440 Cb -0.12 -2.18 0.01 0.00 0.01 0.00 0.00 72.50 70.22 3gue s THR 440 CO -0.04 0.52 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.58 3gue s VAL 441 N 0.49 1.23 -0.01 3.82 1.01 -0.09 -0.12 120.40 126.74 3gue s VAL 441 Ca -0.10 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.33 3gue s VAL 441 Cb -0.16 -1.10 0.01 0.00 0.00 0.00 0.00 36.38 35.13 3gue s VAL 441 CO 0.04 0.37 -0.01 -0.13 0.00 0.00 0.00 175.10 175.37 3gue s ARG 442 N 0.45 0.20 0.77 2.72 1.81 -0.03 -0.95 118.95 123.93 3gue s ARG 442 Ca -0.11 -0.02 0.00 0.00 -1.72 0.00 0.00 55.73 53.88 3gue s ARG 442 Cb -0.14 -0.27 0.00 0.00 -0.45 0.00 0.00 34.95 34.09 3gue s ARG 442 CO 0.03 -0.02 0.00 0.41 -0.68 0.00 0.00 175.30 175.05 3gue n GLY 443 N 3.42 -2.04 3.68 -3.53 0.00 -1.26 -0.38 105.19 105.08 3gue n GLY 443 Ca -0.18 -1.41 -0.43 0.00 0.00 0.00 0.00 46.02 44.01 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 4.21 -0.07 0.99 1.43 -1.26 -4.81 118.68 119.17 3gue s LEU 444 Ca 0.00 1.54 -0.08 0.00 -1.03 0.00 0.00 54.13 54.57 3gue s LEU 444 Cb 0.00 -3.55 0.02 0.00 0.03 0.00 0.00 46.19 42.69 3gue s LEU 444 CO 0.00 -0.54 0.21 -0.69 0.23 0.00 0.00 176.35 175.56 3gue s VAL 445 N 2.41 0.01 -0.19 -1.59 1.01 -1.26 -1.80 120.40 118.98 3gue s VAL 445 Ca 0.49 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.34 3gue s VAL 445 Cb -0.19 -0.33 0.07 0.00 0.00 0.00 0.00 36.38 35.93 3gue s VAL 445 CO 0.15 -0.05 0.08 -1.61 0.00 0.00 0.00 175.10 173.68 3gue s GLU 446 N -0.09 0.26 0.32 2.72 2.02 0.72 -3.99 118.70 120.66 3gue s GLU 446 Ca -0.02 -0.25 -0.29 0.00 0.02 0.00 0.00 54.97 54.43 3gue s GLU 446 Cb -0.02 -1.84 -0.10 0.00 0.10 0.00 0.00 34.13 32.26 3gue s GLU 446 CO 0.01 -0.71 1.26 -0.06 0.02 0.00 0.00 175.26 175.77 3gue s PHE 447 N 2.04 3.18 0.00 1.61 0.08 -0.39 -0.35 117.98 124.15 3gue s PHE 447 Ca 0.02 1.48 0.00 0.00 0.12 0.00 0.00 56.93 58.55 3gue s PHE 447 Cb -0.16 -3.58 0.00 0.00 -0.57 0.00 0.00 43.02 38.70 3gue s PHE 447 CO -0.12 -1.55 0.00 0.41 -0.10 0.00 0.00 175.22 173.86 3gue n GLY 448 N 0.93 1.83 3.87 4.36 0.00 -0.72 -3.08 105.19 112.37 3gue n GLY 448 Ca -0.00 -1.88 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 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 -3.02 3.65 -1.35 4.61 0.00 -0.97 -3.68 121.76 121.00 3gue s ALA 449 Ca 0.00 -0.33 -0.13 0.00 0.00 0.00 0.00 51.96 51.50 3gue s ALA 449 Cb 0.00 -2.35 0.11 0.00 0.00 0.00 0.00 23.12 20.87 3gue s ALA 449 CO 0.00 0.54 0.54 -0.25 0.00 0.00 0.00 175.76 176.59 3gue n ASP 450 N 0.27 -3.17 -4.72 0.00 8.00 -1.26 0.42 116.55 116.09 3gue n ASP 450 Ca -0.03 -0.57 -0.42 0.00 0.71 0.00 0.00 54.79 54.48 3gue n ASP 450 Cb 0.52 -2.64 -0.03 0.00 -0.02 0.00 0.00 41.12 38.95 3gue n ASP 450 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3gue s VAL 451 N -2.97 3.78 -0.26 2.53 1.01 -1.26 -3.50 120.40 119.73 3gue s VAL 451 Ca 0.51 1.32 -0.06 0.00 0.00 0.00 0.00 61.98 63.74 3gue s VAL 451 Cb -0.28 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.25 3gue s VAL 451 CO 0.62 0.12 0.05 -0.55 0.00 0.00 0.00 175.10 175.34 3gue s SER 452 N 0.88 4.92 -0.22 3.32 0.15 -0.59 -0.16 113.70 122.01 3gue s SER 452 Ca 0.59 -0.44 -0.09 0.00 0.70 0.00 0.00 55.95 56.71 3gue s SER 452 Cb -0.32 -1.86 -0.04 0.00 -1.71 0.00 0.00 66.02 62.09 3gue s SER 452 CO 0.31 -0.09 0.11 -0.69 1.20 0.00 0.00 173.24 174.08 3gue s VAL 453 N 1.54 4.94 -0.02 4.45 1.01 -0.16 -0.87 120.40 131.27 3gue s VAL 453 Ca 0.05 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.08 3gue s VAL 453 Cb -0.16 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 32.95 3gue s VAL 453 CO 0.01 0.38 -0.09 -0.13 0.00 0.00 0.00 175.10 175.27 3gue s ARG 454 N 0.95 0.95 5.66 2.72 0.52 0.15 -3.34 118.95 126.57 3gue s ARG 454 Ca 0.05 -0.31 0.00 0.00 -0.52 0.00 0.00 55.73 54.95 3gue s ARG 454 Cb -0.14 -0.89 0.00 0.00 0.52 0.00 0.00 34.95 34.44 3gue s ARG 454 CO 0.03 0.12 0.00 0.41 0.02 0.00 0.00 175.30 175.88 3gue n GLY 455 N 3.25 1.35 3.30 -3.53 0.00 -0.32 0.76 105.19 110.01 3gue n GLY 455 Ca -0.18 -0.62 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 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 5.94 -0.16 1.61 0.02 -1.26 -0.07 114.94 117.02 3gue s ASN 456 Ca 0.00 -1.62 -0.05 0.00 -1.02 0.00 0.00 52.86 50.17 3gue s ASN 456 Cb 0.00 -2.11 -0.03 0.00 0.02 0.00 0.00 41.25 39.13 3gue s ASN 456 CO 0.00 -0.69 -0.01 -0.69 0.02 0.00 0.00 177.10 175.74 3gue s VAL 457 N 1.52 4.18 -0.09 1.60 1.01 -0.07 -3.45 120.40 125.10 3gue s VAL 457 Ca 0.04 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.79 3gue s VAL 457 Cb -0.26 -2.85 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 3gue s VAL 457 CO 0.03 0.49 -0.16 -0.69 0.00 0.00 0.00 175.10 174.77 3gue s VAL 458 N 0.30 2.85 -0.24 2.92 1.01 -0.54 -1.17 120.40 125.53 3gue s VAL 458 Ca -0.01 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 3gue s VAL 458 Cb -0.13 -2.14 0.07 0.00 0.00 0.00 0.00 36.38 34.18 3gue s VAL 458 CO 0.02 0.56 0.02 -0.63 0.00 0.00 0.00 175.10 175.07 3gue s ILE 459 N -0.15 1.03 -0.22 2.22 1.01 0.83 0.44 121.20 126.36 3gue s ILE 459 Ca -0.01 -1.05 -0.02 0.00 0.00 0.00 0.00 60.65 59.57 3gue s ILE 459 Cb -0.14 -1.51 0.01 0.00 0.01 0.00 0.00 42.46 40.84 3gue s ILE 459 CO 0.03 -0.29 -0.09 -0.54 0.00 0.00 0.00 174.94 174.06 3gue s LYS 460 N 1.60 3.10 -0.21 2.79 1.02 0.89 -0.85 119.74 128.09 3gue s LYS 460 Ca 0.00 -0.80 -0.05 0.00 0.02 0.00 0.00 55.97 55.15 3gue s LYS 460 Cb -0.18 -2.90 -0.02 0.00 -0.52 0.00 0.00 37.83 34.21 3gue s LYS 460 CO -0.11 -0.27 -0.01 1.21 -0.92 0.00 0.00 175.35 175.25 3gue s ASN 461 N 1.38 4.73 0.00 2.83 2.47 0.48 -0.73 114.94 126.11 3gue s ASN 461 Ca 0.04 -0.24 0.12 0.00 0.42 0.00 0.00 52.86 53.20 3gue s ASN 461 Cb -0.15 -1.81 0.02 0.00 -1.45 0.00 0.00 41.25 37.86 3gue s ASN 461 CO -0.06 0.04 0.75 0.18 -3.72 0.00 0.00 177.10 174.30 3gue n LEU 462 N 4.40 1.53 -4.89 3.21 4.77 0.57 -4.09 117.00 122.49 3gue n LEU 462 Ca -0.17 -0.83 -0.29 0.00 -0.03 0.00 0.00 56.01 54.69 3gue n LEU 462 Cb 0.52 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.63 3gue n LEU 462 CO 0.31 0.30 0.63 -0.54 -1.33 0.00 0.00 177.39 176.75 3gue s LYS 463 N -1.41 3.28 0.05 3.23 1.02 -1.24 -4.93 119.74 119.75 3gue s LYS 463 Ca 0.11 0.41 -0.14 0.00 0.02 0.00 0.00 55.97 56.37 3gue s LYS 463 Cb 0.10 -2.17 -0.31 0.00 -0.52 0.00 0.00 37.83 34.93 3gue s LYS 463 CO 0.26 -0.62 1.07 0.93 -0.92 0.00 0.00 175.35 176.08 3gue h GLU 464 N -0.24 0.56 -6.72 1.68 4.39 -1.97 -3.44 114.58 108.83 3gue h GLU 464 Ca -0.45 -0.83 -0.53 0.00 0.34 0.00 0.00 59.36 57.89 3gue h GLU 464 Cb 1.22 0.29 0.06 0.00 -0.10 0.00 0.00 28.75 30.23 3gue h GLU 464 CO 0.62 1.39 0.87 -1.83 -1.16 0.00 0.00 179.01 178.89 3gue s GLU 465 N -2.83 4.18 0.27 2.33 -1.05 -1.26 -4.92 118.70 115.43 3gue s GLU 465 Ca -0.09 2.46 -0.30 0.00 -0.15 0.00 0.00 54.97 56.89 3gue s GLU 465 Cb 0.05 -3.08 -0.14 0.00 -0.44 0.00 0.00 34.13 30.52 3gue s GLU 465 CO 0.93 -0.58 1.22 -2.30 0.95 0.00 0.00 175.26 175.48 3gue n PRO 466 N 2.86 1.73 -2.62 -4.83 -0.02 -1.26 -4.91 135.00 125.96 3gue n PRO 466 Ca 0.10 0.61 -0.43 0.00 -2.02 0.00 0.00 63.50 61.76 3gue n PRO 466 Cb 0.38 -2.14 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 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 -0.03 3.77 -0.10 2.45 2.96 -0.75 -4.94 118.68 122.05 3gue s LEU 467 Ca 0.62 0.74 -0.19 0.00 -0.22 0.00 0.00 54.13 55.08 3gue s LEU 467 Cb -0.67 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.43 3gue s LEU 467 CO 0.57 -1.09 0.51 -0.63 -1.32 0.00 0.00 176.35 174.39 3gue s ILE 468 N 4.10 5.15 -0.47 6.68 1.01 -1.26 -0.20 121.20 136.19 3gue s ILE 468 Ca 0.47 1.03 -0.19 0.00 0.00 0.00 0.00 60.65 61.96 3gue s ILE 468 Cb -0.09 -3.85 0.05 0.00 0.01 0.00 0.00 42.46 38.57 3gue s ILE 468 CO 0.24 0.33 0.56 -0.63 0.00 0.00 0.00 174.94 175.45 3gue s ILE 469 N 0.52 4.95 0.42 2.92 -1.09 0.52 -4.94 121.20 124.50 3gue s ILE 469 Ca 0.28 -0.43 -0.22 0.00 -2.23 0.00 0.00 60.65 58.04 3gue s ILE 469 Cb -0.16 -4.21 -0.12 0.00 -1.58 0.00 0.00 42.46 36.39 3gue s ILE 469 CO 0.12 -0.67 0.56 0.61 -1.23 0.00 0.00 174.94 174.32 3gue n GLY 470 N 5.14 -1.47 3.74 6.18 0.00 -1.26 -1.76 105.19 115.76 3gue n GLY 470 Ca -0.07 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.95 6.36 0.00 1.61 0.01 -1.26 -2.31 113.70 117.17 3gue s SER 471 Ca 0.63 2.93 0.00 0.00 1.31 0.00 0.00 55.95 60.83 3gue s SER 471 Cb -0.60 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.01 3gue s SER 471 CO 0.58 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.89 3gue n GLY 472 N 2.85 1.34 3.68 3.44 0.00 0.17 -4.92 105.19 111.76 3gue n GLY 472 Ca 0.11 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 3gue n GLY 472 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3gue n ARG 473 N -2.00 2.42 -3.48 1.61 3.00 -0.98 -4.78 116.66 112.46 3gue n ARG 473 Ca 0.00 0.88 -0.39 0.00 -0.00 0.00 0.00 57.85 58.34 3gue n ARG 473 Cb 0.00 -2.71 -0.10 0.00 0.00 0.00 0.00 32.46 29.65 3gue n ARG 473 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 3gue s VAL 474 N 2.12 5.23 -0.43 5.15 1.01 -1.26 -1.54 120.40 130.68 3gue s VAL 474 Ca 0.82 0.22 -0.10 0.00 0.00 0.00 0.00 61.98 62.93 3gue s VAL 474 Cb -0.60 -3.67 0.09 0.00 0.00 0.00 0.00 36.38 32.19 3gue s VAL 474 CO 0.40 0.11 0.28 -0.76 0.00 0.00 0.00 175.10 175.14 3gue s LEU 475 N 1.91 5.28 -0.40 3.92 1.43 -0.05 -4.98 118.68 125.79 3gue s LEU 475 Ca 0.10 -1.57 -0.02 0.00 -1.03 0.00 0.00 54.13 51.62 3gue s LEU 475 Cb -0.16 -2.00 0.11 0.00 0.03 0.00 0.00 46.19 44.16 3gue s LEU 475 CO 0.11 -0.57 0.18 -0.62 0.23 0.00 0.00 176.35 175.67 3gue s ASP 476 N 2.25 5.17 -1.57 2.29 -1.08 -1.26 0.35 116.67 122.82 3gue s ASP 476 Ca 0.04 -2.05 -0.15 0.00 -0.52 0.00 0.00 52.55 49.86 3gue s ASP 476 Cb -0.24 -1.79 0.12 0.00 -1.46 0.00 0.00 42.92 39.55 3gue s ASP 476 CO 0.02 -0.52 0.82 0.59 0.52 0.00 0.00 175.17 176.60 3gue n ASN 477 N 4.53 -4.02 -4.65 -0.34 3.02 0.23 -4.94 115.26 109.08 3gue n ASN 477 Ca -0.01 -0.81 -0.31 0.00 -0.03 0.00 0.00 54.58 53.42 3gue n ASN 477 Cb 0.41 -3.26 -0.09 0.00 -0.61 0.00 0.00 39.78 36.24 3gue n ASN 477 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3gue s GLU 478 N -6.65 2.52 -0.21 3.52 2.12 -1.22 -4.86 118.70 113.93 3gue s GLU 478 Ca 0.66 -0.81 -0.03 0.00 0.36 0.00 0.00 54.97 55.14 3gue s GLU 478 Cb -0.35 -2.52 -0.01 0.00 0.26 0.00 0.00 34.13 31.52 3gue s GLU 478 CO 0.81 0.56 -0.05 0.08 -0.54 0.00 0.00 175.26 176.12 3gue s VAL 479 N -1.20 3.35 -0.23 3.70 1.01 -1.26 -1.47 120.40 124.30 3gue s VAL 479 Ca 0.23 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 3gue s VAL 479 Cb -0.11 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 3gue s VAL 479 CO 0.14 0.44 -0.01 -0.69 0.00 0.00 0.00 175.10 174.98 3gue s VAL 480 N 1.31 3.60 -0.16 2.92 1.01 0.17 -4.96 120.40 124.28 3gue s VAL 480 Ca 0.04 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 3gue s VAL 480 Cb -0.14 -2.67 0.04 0.00 0.00 0.00 0.00 36.38 33.61 3gue s VAL 480 CO -0.02 0.38 -0.07 -0.69 0.00 0.00 0.00 175.10 174.70 3gue s VAL 481 N 1.51 1.24 -0.19 2.92 1.01 -1.26 -0.08 120.40 125.55 3gue s VAL 481 Ca 0.06 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.33 3gue s VAL 481 Cb -0.15 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 34.86 3gue s VAL 481 CO -0.01 0.20 -0.02 -0.69 0.00 0.00 0.00 175.10 174.57 3gue s VAL 482 N 1.58 3.82 0.00 2.92 1.01 0.09 -5.01 120.40 124.82 3gue s VAL 482 Ca 0.01 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.63 3gue s VAL 482 Cb -0.15 -2.72 0.00 0.00 0.00 0.00 0.00 36.38 33.51 3gue s VAL 482 CO -0.08 0.44 0.11 -1.84 0.00 0.00 0.00 175.10 173.73