#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aei s VAL 3 N 0.00 3.38 0.04 1.55 0.11 -1.26 -4.90 120.40 119.32 1aei s VAL 3 Ca 0.00 -0.54 -0.27 0.00 -2.93 0.00 0.00 61.98 58.24 1aei s VAL 3 Cb 0.00 -2.45 0.07 0.00 -1.53 0.00 0.00 36.38 32.48 1aei s VAL 3 CO 0.00 0.51 0.67 0.00 -3.33 0.00 0.00 175.10 172.95 1aei s GLN 4 N 0.39 1.13 0.62 1.54 -2.07 -1.18 -4.94 119.66 115.15 1aei s GLN 4 Ca -0.08 -0.11 -0.03 0.00 -1.82 0.00 0.00 55.36 53.32 1aei s GLN 4 Cb -0.15 0.52 0.13 0.00 -1.09 0.00 0.00 33.01 32.42 1aei s GLN 4 CO 0.04 -0.43 0.85 0.41 -1.32 0.00 0.00 175.29 174.84 1aei n GLY 5 N 0.25 0.27 0.31 2.60 0.00 -1.12 -0.92 105.19 106.58 1aei n GLY 5 Ca -0.17 -1.96 0.12 0.00 0.00 0.00 0.00 46.02 44.01 1aei n GLY 5 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1aei n THR 6 N -2.74 0.00 -4.76 2.61 -2.24 0.89 -4.46 114.28 103.59 1aei n THR 6 Ca 0.13 -0.16 -0.32 0.00 -2.27 0.00 0.00 64.05 61.43 1aei n THR 6 Cb 0.47 0.76 -0.17 0.00 -2.10 0.00 0.00 70.33 69.29 1aei n THR 6 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1aei s VAL 7 N -2.56 1.99 0.06 2.28 1.01 -1.03 -4.93 120.40 117.22 1aei s VAL 7 Ca 0.20 -0.95 0.09 0.00 0.00 0.00 0.00 61.98 61.32 1aei s VAL 7 Cb 0.18 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1aei s VAL 7 CO 0.58 0.54 -0.23 -0.75 0.00 0.00 0.00 175.10 175.23 1aei s LYS 8 N 0.74 1.47 0.24 2.72 2.36 -1.26 -4.68 119.74 121.33 1aei s LYS 8 Ca -0.09 -1.08 -0.31 0.00 -2.55 0.00 0.00 55.97 51.93 1aei s LYS 8 Cb -0.16 -1.68 -0.13 0.00 -1.05 0.00 0.00 37.83 34.81 1aei s LYS 8 CO 0.00 0.42 1.53 -0.35 1.55 0.00 0.00 175.35 178.50 1aei n PRO 9 N 1.59 2.35 -2.01 4.03 -0.04 -1.26 -4.24 135.00 135.42 1aei n PRO 9 Ca -0.18 0.84 -0.42 0.00 -0.04 0.00 0.00 63.50 63.70 1aei n PRO 9 Cb 0.53 -2.57 -0.03 0.00 -0.04 0.00 0.00 33.50 31.39 1aei n PRO 9 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1aei s HIS 10 N 0.23 2.91 0.11 0.54 2.46 -1.26 -4.91 115.29 115.37 1aei s HIS 10 Ca 0.69 0.64 -0.25 0.00 0.47 0.00 0.00 55.06 56.61 1aei s HIS 10 Cb -0.59 -3.85 -0.07 0.00 -0.13 0.00 0.00 32.58 27.94 1aei s HIS 10 CO 0.46 -3.21 0.75 0.00 -2.47 0.00 0.00 174.74 170.27 1aei s ALA 11 N 1.66 3.43 -0.97 1.58 0.00 -1.26 -4.12 121.76 122.08 1aei s ALA 11 Ca 0.69 0.30 -0.05 0.00 0.00 0.00 0.00 51.96 52.91 1aei s ALA 11 Cb -0.40 -2.94 -0.05 0.00 0.00 0.00 0.00 23.12 19.73 1aei s ALA 11 CO 0.31 0.22 0.86 0.43 0.00 0.00 0.00 175.76 177.58 1aei n SER 12 N 2.08 -6.92 -4.83 0.00 7.64 -1.26 -5.01 113.62 105.32 1aei n SER 12 Ca -0.05 -0.55 -0.36 0.00 1.01 0.00 0.00 58.87 58.91 1aei n SER 12 Cb 0.49 -5.23 -0.07 0.00 -1.01 0.00 0.00 64.21 58.40 1aei n SER 12 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1aei s PHE 13 N -3.29 3.54 -0.16 1.43 5.36 -1.26 -5.08 117.98 118.52 1aei s PHE 13 Ca 0.35 0.49 -0.03 0.00 -0.96 0.00 0.00 56.93 56.77 1aei s PHE 13 Cb -0.05 -2.03 0.05 0.00 -0.34 0.00 0.00 43.02 40.66 1aei s PHE 13 CO 0.74 0.58 0.05 1.21 -1.46 0.00 0.00 175.22 176.35 1aei s ASN 14 N -0.56 2.46 0.45 6.13 2.47 -1.26 -5.02 114.94 119.61 1aei s ASN 14 Ca 0.13 -0.62 0.10 0.00 0.42 0.00 0.00 52.86 52.90 1aei s ASN 14 Cb -0.12 -0.42 1.00 0.00 -1.45 0.00 0.00 41.25 40.26 1aei s ASN 14 CO 0.03 -0.31 2.09 0.77 -3.72 0.00 0.00 177.10 175.96 1aei h SER 15 N 8.33 0.31 -0.42 -4.21 4.64 -1.94 -1.07 113.55 119.19 1aei h SER 15 Ca -0.16 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.07 1aei h SER 15 Cb 1.13 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 1aei h SER 15 CO 0.30 0.22 -0.08 -0.09 -0.87 0.00 0.00 176.83 176.31 1aei h ARG 16 N 0.37 0.80 -0.19 4.77 2.43 -1.93 0.44 114.38 121.07 1aei h ARG 16 Ca 0.11 -0.30 -0.19 0.00 -0.81 0.00 0.00 59.98 58.79 1aei h ARG 16 Cb -0.02 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1aei h ARG 16 CO -0.02 0.91 -0.64 1.49 -1.51 0.00 0.00 179.97 180.20 1aei h GLU 17 N 0.62 0.67 -0.24 0.20 4.81 -1.76 -1.71 114.58 117.18 1aei h GLU 17 Ca 0.11 -0.47 -0.18 0.00 -0.13 0.00 0.00 59.36 58.69 1aei h GLU 17 Cb 0.61 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.06 1aei h GLU 17 CO 0.04 1.09 -0.56 -0.44 -0.73 0.00 0.00 179.01 178.41 1aei h ASP 18 N 0.49 0.82 -0.88 1.04 3.32 -1.14 0.76 116.42 120.83 1aei h ASP 18 Ca -0.01 -0.44 0.01 0.00 0.02 0.00 0.00 57.03 56.60 1aei h ASP 18 Cb 1.22 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 40.49 1aei h ASP 18 CO 0.13 1.21 0.58 0.00 -1.72 0.00 0.00 179.24 179.43 1aei h ALA 19 N 0.81 1.12 -0.37 3.45 0.00 -0.74 -1.92 119.26 121.60 1aei h ALA 19 Ca 0.01 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 1aei h ALA 19 Cb 1.14 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1aei h ALA 19 CO 0.12 0.52 -0.34 0.93 0.00 0.00 0.00 179.25 180.48 1aei h GLU 20 N 1.20 0.84 -0.68 0.00 4.39 -1.02 -2.06 114.58 117.24 1aei h GLU 20 Ca 0.32 -0.41 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 1aei h GLU 20 Cb -0.13 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.49 1aei h GLU 20 CO -0.07 1.05 0.18 1.15 -1.16 0.00 0.00 179.01 180.16 1aei h THR 21 N 0.70 1.26 -0.45 1.13 2.02 -0.63 -1.79 112.91 115.16 1aei h THR 21 Ca 0.07 -0.93 -0.06 0.00 0.77 0.00 0.00 66.41 66.25 1aei h THR 21 Cb 0.90 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1aei h THR 21 CO 0.08 0.36 0.03 -0.07 0.37 0.00 0.00 175.52 176.29 1aei h LEU 22 N 1.03 0.75 -0.56 2.58 3.38 -1.18 -0.20 115.31 121.09 1aei h LEU 22 Ca 0.22 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.95 1aei h LEU 22 Cb 0.34 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 1aei h LEU 22 CO -0.00 0.85 0.29 -0.09 0.09 0.00 0.00 178.44 179.58 1aei h ARG 23 N 0.62 0.53 -0.54 1.13 1.12 -1.18 -0.98 114.38 115.07 1aei h ARG 23 Ca 0.13 -0.03 -0.07 0.00 -1.11 0.00 0.00 59.98 58.90 1aei h ARG 23 Cb 0.45 -0.12 -0.02 0.00 -0.01 0.00 0.00 29.97 30.27 1aei h ARG 23 CO 0.02 0.35 0.07 0.87 -3.11 0.00 0.00 179.97 178.16 1aei h LYS 24 N 0.54 0.91 0.00 0.20 6.56 -1.12 -1.72 116.57 121.94 1aei h LYS 24 Ca 0.25 -0.25 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1aei h LYS 24 Cb 0.17 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 31.73 1aei h LYS 24 CO -0.18 0.89 0.00 0.00 -2.06 0.00 0.00 179.45 178.10 1aei h ALA 25 N 0.98 1.00 0.00 3.86 0.00 0.28 -2.89 119.26 122.49 1aei h ALA 25 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1aei h ALA 25 Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1aei h ALA 25 CO 0.01 0.00 -1.80 -1.33 0.00 0.00 0.00 179.25 176.14 1aei n MET 26 N -2.45 0.73 -1.63 0.00 2.81 -0.79 -0.29 117.12 115.50 1aei n MET 26 Ca -0.00 -0.11 -0.45 0.00 -1.81 0.00 0.00 57.70 55.32 1aei n MET 26 Cb 0.14 -1.38 -0.02 0.00 -0.71 0.00 0.00 33.22 31.24 1aei n MET 26 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1aei n LYS 27 N -2.17 1.63 -0.00 0.03 5.02 -0.66 -4.66 118.16 117.35 1aei n LYS 27 Ca -0.08 0.58 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 1aei n LYS 27 Cb 0.55 -2.08 -0.00 0.00 -0.02 0.00 0.00 35.03 33.47 1aei n LYS 27 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1aei n GLY 28 N 1.53 -2.10 3.78 0.72 0.00 -1.26 -4.79 105.19 103.06 1aei n GLY 28 Ca 0.10 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.33 1aei n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aei s ILE 29 N -0.02 3.94 0.00 -0.61 1.09 -1.26 -4.72 121.20 119.62 1aei s ILE 29 Ca 0.00 1.53 0.00 0.00 -1.10 0.00 0.00 60.65 61.08 1aei s ILE 29 Cb 0.00 -3.81 0.00 0.00 -1.06 0.00 0.00 42.46 37.59 1aei s ILE 29 CO 0.00 0.05 0.00 0.61 -0.10 0.00 0.00 174.94 175.50 1aei n GLY 30 N 0.39 -1.85 3.52 6.18 0.00 -1.26 -5.00 105.19 107.16 1aei n GLY 30 Ca 0.04 -1.34 -0.18 0.00 0.00 0.00 0.00 46.02 44.54 1aei n GLY 30 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aei s THR 31 N 0.00 0.00 -0.58 2.61 2.01 -1.26 -4.76 115.64 113.65 1aei s THR 31 Ca 0.00 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 61.97 1aei s THR 31 Cb 0.00 -1.00 0.15 0.00 0.01 0.00 0.00 72.50 71.66 1aei s THR 31 CO 0.00 0.00 0.40 -0.62 -0.69 0.00 0.00 174.62 173.71 1aei s ASP 32 N -1.26 5.29 0.36 3.53 2.15 0.60 -4.90 116.67 122.45 1aei s ASP 32 Ca -0.10 -2.66 0.16 0.00 0.43 0.00 0.00 52.55 50.37 1aei s ASP 32 Cb -0.00 -1.86 0.68 0.00 -0.30 0.00 0.00 42.92 41.44 1aei s ASP 32 CO 0.09 -0.42 1.76 -0.33 -0.17 0.00 0.00 175.17 176.10 1aei h GLU 33 N 7.29 0.00 0.00 4.34 3.07 -2.00 -2.08 114.58 125.20 1aei h GLU 33 Ca -0.04 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.74 1aei h GLU 33 Cb 0.98 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.88 1aei h GLU 33 CO 0.72 0.41 -0.36 0.87 -1.40 0.00 0.00 179.01 179.24 1aei h LYS 34 N 0.00 0.00 0.05 2.33 6.56 -1.98 0.12 116.57 123.64 1aei h LYS 34 Ca -0.00 0.00 -0.25 0.00 -1.06 0.00 0.00 60.65 59.34 1aei h LYS 34 Cb 0.84 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.48 1aei h LYS 34 CO 0.05 0.36 -1.24 1.03 -2.06 0.00 0.00 179.45 177.60 1aei h SER 35 N 0.00 0.15 0.00 0.86 0.87 -1.80 -2.19 113.55 111.44 1aei h SER 35 Ca -0.00 -0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1aei h SER 35 Cb 0.70 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 1aei h SER 35 CO 0.05 1.15 -0.00 0.40 -0.53 0.00 0.00 176.83 177.89 1aei h ILE 36 N 0.03 1.52 -0.96 2.23 2.04 -0.76 -2.46 117.51 119.14 1aei h ILE 36 Ca -0.11 -1.57 0.26 0.00 1.00 0.00 0.00 64.86 64.44 1aei h ILE 36 Cb 1.89 2.58 -0.13 0.00 -0.74 0.00 0.00 36.82 40.42 1aei h ILE 36 CO 0.14 0.41 0.49 0.74 0.00 0.00 0.00 178.15 179.93 1aei h THR 37 N -0.68 0.43 -0.17 -0.27 2.02 -0.90 -1.81 112.91 111.54 1aei h THR 37 Ca -0.00 -0.14 -0.18 0.00 0.77 0.00 0.00 66.41 66.86 1aei h THR 37 Cb 0.67 -0.02 0.01 0.00 -1.74 0.00 0.00 68.15 67.06 1aei h THR 37 CO 0.00 0.08 -0.58 -0.74 0.37 0.00 0.00 175.52 174.65 1aei h HIS 38 N 0.42 0.90 -0.10 3.16 -0.00 -1.31 -1.39 115.15 116.83 1aei h HIS 38 Ca 0.63 -0.37 -0.13 0.00 -0.00 0.00 0.00 60.37 60.50 1aei h HIS 38 Cb 1.28 -0.15 0.01 0.00 -0.00 0.00 0.00 27.41 28.54 1aei h HIS 38 CO -0.07 1.17 -0.43 0.82 -0.00 0.00 0.00 177.93 179.42 1aei h ILE 39 N 0.38 1.38 -0.43 6.26 2.04 -0.90 -2.88 117.51 123.36 1aei h ILE 39 Ca -0.03 -1.76 -0.02 0.00 1.00 0.00 0.00 64.86 64.05 1aei h ILE 39 Cb 1.21 2.20 -0.02 0.00 -0.74 0.00 0.00 36.82 39.46 1aei h ILE 39 CO 0.12 0.52 0.19 -0.07 0.00 0.00 0.00 178.15 178.91 1aei h LEU 40 N 0.05 0.59 -0.94 1.44 3.38 -1.41 -2.93 115.31 115.49 1aei h LEU 40 Ca -0.02 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1aei h LEU 40 Cb 1.07 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 1aei h LEU 40 CO 0.09 0.58 -0.08 0.00 0.09 0.00 0.00 178.44 179.12 1aei h ALA 41 N 1.03 0.99 -0.34 1.53 0.00 -1.35 -3.33 119.26 117.80 1aei h ALA 41 Ca 0.15 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1aei h ALA 41 Cb 0.16 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 1aei h ALA 41 CO -0.01 0.10 0.01 0.25 0.00 0.00 0.00 179.25 179.60 1aei n THR 42 N -3.17 2.43 -4.92 0.00 -2.24 -1.09 -4.74 114.28 100.56 1aei n THR 42 Ca 0.01 -2.12 -0.26 0.00 -2.27 0.00 0.00 64.05 59.41 1aei n THR 42 Cb 0.41 -0.29 -0.16 0.00 -2.10 0.00 0.00 70.33 68.20 1aei n THR 42 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1aei s ARG 43 N -2.98 1.70 0.83 -0.78 3.00 -1.18 -4.01 118.95 115.53 1aei s ARG 43 Ca 0.44 -0.67 -0.12 0.00 0.00 0.00 0.00 55.73 55.38 1aei s ARG 43 Cb 0.37 -1.56 0.09 0.00 0.00 0.00 0.00 34.95 33.85 1aei s ARG 43 CO 0.06 0.35 1.11 -1.54 0.00 0.00 0.00 175.30 175.28 1aei s SER 44 N -0.25 4.25 0.55 0.23 1.04 -1.26 -4.78 113.70 113.48 1aei s SER 44 Ca 0.03 1.21 0.26 0.00 0.48 0.00 0.00 55.95 57.93 1aei s SER 44 Cb -0.09 -1.90 1.45 0.00 0.10 0.00 0.00 66.02 65.58 1aei s SER 44 CO 0.01 -2.11 2.00 -1.13 0.98 0.00 0.00 173.24 172.99 1aei h ASN 45 N -1.19 0.00 1.22 7.02 -0.73 -1.94 -0.41 115.58 119.56 1aei h ASN 45 Ca -0.48 0.00 -0.14 0.00 1.87 0.00 0.00 56.30 57.55 1aei h ASN 45 Cb 1.29 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.85 1aei h ASN 45 CO 0.60 0.00 -0.81 0.00 -0.37 0.00 0.00 177.43 176.85 1aei h ALA 46 N 1.70 0.62 -0.29 1.57 0.00 -1.97 -1.66 119.26 119.24 1aei h ALA 46 Ca 0.21 -0.64 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 1aei h ALA 46 Cb 0.94 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1aei h ALA 46 CO -0.00 0.81 -0.35 1.96 0.00 0.00 0.00 179.25 181.67 1aei h GLN 47 N 0.00 0.75 -0.94 0.00 4.20 -1.48 -2.48 115.11 115.16 1aei h GLN 47 Ca -0.05 -0.42 0.01 0.00 0.06 0.00 0.00 58.65 58.25 1aei h GLN 47 Cb 1.51 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 29.27 1aei h GLN 47 CO 0.07 1.05 0.62 0.00 -0.67 0.00 0.00 178.83 179.90 1aei h ARG 48 N 0.50 1.23 -0.24 1.46 3.08 -0.95 -0.16 114.38 119.30 1aei h ARG 48 Ca 0.04 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.92 1aei h ARG 48 Cb 0.94 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1aei h ARG 48 CO 0.08 0.81 -0.23 1.96 -1.07 0.00 0.00 179.97 181.52 1aei h GLN 49 N 1.26 0.44 -0.26 0.04 1.08 -1.08 -1.85 115.11 114.75 1aei h GLN 49 Ca 0.35 -0.16 -0.11 0.00 -1.45 0.00 0.00 58.65 57.27 1aei h GLN 49 Cb -0.13 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 1aei h GLN 49 CO -0.08 0.65 -0.32 1.96 -0.95 0.00 0.00 178.83 180.10 1aei h GLN 50 N 0.40 0.54 -0.95 1.46 4.20 -0.63 -2.51 115.11 117.62 1aei h GLN 50 Ca 0.06 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.53 1aei h GLN 50 Cb 0.63 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.35 1aei h GLN 50 CO 0.04 0.80 0.58 0.82 -0.67 0.00 0.00 178.83 180.40 1aei h ILE 51 N 0.46 1.26 -0.40 2.54 2.04 -0.75 -2.89 117.51 119.77 1aei h ILE 51 Ca 0.06 -0.54 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 1aei h ILE 51 Cb 0.78 -0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1aei h ILE 51 CO 0.06 0.26 0.16 0.11 0.00 0.00 0.00 178.15 178.75 1aei h LYS 52 N 1.30 0.59 -0.19 2.37 1.57 -0.93 -1.12 116.57 120.15 1aei h LYS 52 Ca 0.34 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 1aei h LYS 52 Cb -0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1aei h LYS 52 CO -0.07 0.56 0.09 1.15 -0.57 0.00 0.00 179.45 180.61 1aei h THR 53 N 0.49 1.14 -0.21 -0.16 2.02 -1.39 -2.78 112.91 112.03 1aei h THR 53 Ca 0.13 -0.42 -0.05 0.00 0.77 0.00 0.00 66.41 66.84 1aei h THR 53 Cb 0.19 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1aei h THR 53 CO -0.01 0.14 -0.09 0.44 0.37 0.00 0.00 175.52 176.36 1aei h ASP 54 N 0.17 0.32 0.25 4.18 3.32 -1.41 -0.85 116.42 122.40 1aei h ASP 54 Ca 0.07 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1aei h ASP 54 Cb 0.14 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1aei h ASP 54 CO -0.01 0.45 -0.12 0.22 -1.72 0.00 0.00 179.24 178.06 1aei h TYR 55 N 0.32 -0.31 -0.27 4.55 5.03 -1.10 -0.79 116.97 124.39 1aei h TYR 55 Ca 0.07 -0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.30 1aei h TYR 55 Cb 0.37 0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.74 1aei h TYR 55 CO 0.01 -0.10 -0.14 1.15 -1.32 0.00 0.00 178.16 177.76 1aei h THR 56 N -0.47 1.23 0.01 1.81 2.02 -1.28 0.13 112.91 116.37 1aei h THR 56 Ca -0.03 -1.03 -0.26 0.00 0.77 0.00 0.00 66.41 65.86 1aei h THR 56 Cb 0.36 1.18 0.02 0.00 -1.74 0.00 0.00 68.15 67.97 1aei h THR 56 CO 0.06 0.33 -1.01 0.74 0.37 0.00 0.00 175.52 176.01 1aei h THR 57 N 0.43 1.30 0.06 3.16 2.02 -0.91 0.18 112.91 119.15 1aei h THR 57 Ca 0.08 -2.25 -0.00 0.00 0.77 0.00 0.00 66.41 65.01 1aei h THR 57 Cb 0.51 2.45 0.00 0.00 -1.74 0.00 0.00 68.15 69.36 1aei h THR 57 CO 0.03 0.69 -0.03 -0.07 0.37 0.00 0.00 175.52 176.51 1aei h LEU 58 N 0.32 -0.06 -0.55 2.58 3.38 -0.95 -3.38 115.31 116.64 1aei h LEU 58 Ca -0.13 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1aei h LEU 58 Cb 1.68 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.44 1aei h LEU 58 CO 0.20 0.18 -0.38 0.49 0.09 0.00 0.00 178.44 179.01 1aei n PHE 59 N -5.01 0.00 -1.37 1.13 3.72 0.45 -5.00 117.46 111.38 1aei n PHE 59 Ca -0.08 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.21 1aei n PHE 59 Cb 0.15 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.65 1aei n PHE 59 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1aei n GLY 60 N 1.12 1.14 2.99 1.37 0.00 0.63 -5.00 105.19 107.43 1aei n GLY 60 Ca 0.04 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.42 1aei n GLY 60 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1aei s LYS 61 N -3.01 0.35 0.31 1.61 2.20 -1.26 -5.05 119.74 114.88 1aei s LYS 61 Ca 0.00 -0.50 -0.25 0.00 -0.36 0.00 0.00 55.97 54.86 1aei s LYS 61 Cb 0.00 -0.11 -0.10 0.00 -1.51 0.00 0.00 37.83 36.11 1aei s LYS 61 CO 0.00 0.01 0.91 -1.01 -0.36 0.00 0.00 175.35 174.90 1aei s HIS 62 N -1.01 3.67 0.24 4.03 3.76 -1.26 -3.86 115.29 120.86 1aei s HIS 62 Ca -0.09 1.71 -0.05 0.00 -0.15 0.00 0.00 55.06 56.47 1aei s HIS 62 Cb -0.07 -2.87 0.42 0.00 1.11 0.00 0.00 32.58 31.17 1aei s HIS 62 CO -0.00 0.22 1.72 1.25 -0.85 0.00 0.00 174.74 177.08 1aei h LEU 63 N 3.16 0.22 -0.66 0.89 6.46 -1.93 -2.09 115.31 121.36 1aei h LEU 63 Ca -0.47 0.11 0.13 0.00 -0.12 0.00 0.00 57.88 57.53 1aei h LEU 63 Cb 1.19 0.10 -0.10 0.00 -0.73 0.00 0.00 40.66 41.12 1aei h LEU 63 CO 0.65 0.08 0.14 -0.33 -0.62 0.00 0.00 178.44 178.36 1aei h GLU 64 N 0.40 0.25 -0.20 1.25 3.07 -1.98 -0.38 114.58 116.98 1aei h GLU 64 Ca 0.39 -0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 59.17 1aei h GLU 64 Cb 0.59 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1aei h GLU 64 CO -0.40 0.16 -0.16 -0.44 -1.40 0.00 0.00 179.01 176.77 1aei h ASP 65 N 0.25 0.33 0.09 1.42 3.32 -1.78 -0.60 116.42 119.45 1aei h ASP 65 Ca 0.36 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 1aei h ASP 65 Cb 0.57 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1aei h ASP 65 CO -0.46 0.52 -0.05 -0.33 -1.72 0.00 0.00 179.24 177.20 1aei h GLU 66 N 0.32 -0.12 -0.71 3.56 4.39 -1.16 -3.11 114.58 117.75 1aei h GLU 66 Ca 0.06 0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.70 1aei h GLU 66 Cb 0.47 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 1aei h GLU 66 CO 0.03 0.29 0.18 -0.07 -1.16 0.00 0.00 179.01 178.28 1aei h LEU 67 N -0.58 1.06 -1.46 1.33 3.38 -0.69 -0.93 115.31 117.43 1aei h LEU 67 Ca -0.01 -0.22 0.10 0.00 0.09 0.00 0.00 57.88 57.84 1aei h LEU 67 Cb 0.47 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1aei h LEU 67 CO 0.02 1.01 0.48 0.11 0.09 0.00 0.00 178.44 180.15 1aei h LYS 68 N 1.07 0.58 -0.13 1.13 1.57 -1.17 0.26 116.57 119.90 1aei h LYS 68 Ca 0.22 -0.04 -0.23 0.00 -1.87 0.00 0.00 60.65 58.74 1aei h LYS 68 Cb 0.36 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 32.55 1aei h LYS 68 CO 0.00 0.39 -0.83 0.66 -0.57 0.00 0.00 179.45 179.10 1aei h SER 69 N 0.60 0.94 0.79 0.86 4.64 -1.39 -3.33 113.55 116.66 1aei h SER 69 Ca 0.34 -0.64 -0.22 0.00 -0.47 0.00 0.00 61.79 60.80 1aei h SER 69 Cb 0.51 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 1aei h SER 69 CO -0.12 1.44 -1.02 -0.33 -0.87 0.00 0.00 176.83 175.94 1aei h GLU 70 N 0.51 0.12 -6.19 4.77 4.39 -0.20 -3.47 114.58 114.51 1aei h GLU 70 Ca -0.07 -0.17 -0.49 0.00 0.34 0.00 0.00 59.36 58.97 1aei h GLU 70 Cb 1.46 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 30.14 1aei h GLU 70 CO 0.17 1.03 -0.40 -0.51 -1.16 0.00 0.00 179.01 178.14 1aei s LEU 71 N -7.04 3.48 0.08 1.33 1.43 0.84 -4.95 118.68 113.85 1aei s LEU 71 Ca -0.01 -0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 52.44 1aei s LEU 71 Cb 0.09 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 1aei s LEU 71 CO 0.84 -0.55 0.00 -0.44 0.23 0.00 0.00 176.35 176.43 1aei s SER 72 N -4.09 0.46 0.35 2.29 0.01 -1.26 -4.77 113.70 106.70 1aei s SER 72 Ca 0.46 -1.08 0.00 0.00 1.31 0.00 0.00 55.95 56.64 1aei s SER 72 Cb -0.04 0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.42 1aei s SER 72 CO 0.28 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 173.89 1aei n GLY 73 N 0.02 2.02 0.25 3.44 0.00 -1.26 -2.02 105.19 107.65 1aei n GLY 73 Ca -0.11 -0.23 0.03 0.00 0.00 0.00 0.00 46.02 45.71 1aei n GLY 73 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1aei h ASN 74 N 2.00 0.26 -0.54 1.61 2.35 -2.00 -0.85 115.58 118.40 1aei h ASN 74 Ca 0.00 -0.04 -0.11 0.00 -0.55 0.00 0.00 56.30 55.60 1aei h ASN 74 Cb 0.00 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1aei h ASN 74 CO 0.00 0.36 -0.07 0.22 -1.65 0.00 0.00 177.43 176.29 1aei h TYR 75 N 0.27 1.13 -0.64 1.19 3.20 -1.92 0.30 116.97 120.51 1aei h TYR 75 Ca 0.06 -0.22 -0.01 0.00 3.14 0.00 0.00 58.73 61.70 1aei h TYR 75 Cb 0.29 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.24 1aei h TYR 75 CO 0.01 1.03 0.37 1.49 -1.64 0.00 0.00 178.16 179.42 1aei h GLU 76 N 0.92 0.88 -0.07 1.82 4.81 -0.76 -0.18 114.58 122.01 1aei h GLU 76 Ca 0.15 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1aei h GLU 76 Cb 0.63 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 1aei h GLU 76 CO 0.04 0.64 -0.08 0.00 -0.73 0.00 0.00 179.01 178.89 1aei h ALA 77 N 1.19 0.10 -0.39 2.92 0.00 -0.99 -0.85 119.26 121.24 1aei h ALA 77 Ca 0.23 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1aei h ALA 77 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1aei h ALA 77 CO -0.04 -0.08 -0.25 0.00 0.00 0.00 0.00 179.25 178.88 1aei h ALA 78 N 0.54 0.83 -0.53 0.00 0.00 -0.85 -1.59 119.26 117.66 1aei h ALA 78 Ca 0.01 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.42 1aei h ALA 78 Cb 0.60 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1aei h ALA 78 CO 0.02 0.64 -0.10 0.00 0.00 0.00 0.00 179.25 179.81 1aei h ALA 79 N 1.03 0.72 0.00 0.00 0.00 -0.91 -2.23 119.26 117.88 1aei h ALA 79 Ca 0.09 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 1aei h ALA 79 Cb 0.78 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1aei h ALA 79 CO 0.06 0.63 -0.61 -0.07 0.00 0.00 0.00 179.25 179.27 1aei h LEU 80 N 0.87 0.00 -1.20 0.00 4.07 -1.11 -3.13 115.31 114.81 1aei h LEU 80 Ca 0.14 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.05 1aei h LEU 80 Cb 0.66 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.38 1aei h LEU 80 CO 0.05 0.61 0.05 0.00 -1.08 0.00 0.00 178.44 178.06 1aei h ALA 81 N 1.39 1.35 0.00 1.53 0.00 -0.67 -3.08 119.26 119.79 1aei h ALA 81 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1aei h ALA 81 Cb 1.13 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1aei h ALA 81 CO 0.08 0.45 0.00 1.25 0.00 0.00 0.00 179.25 181.03 1aei h LEU 82 N 0.58 0.00 0.00 0.00 5.85 -1.45 -2.80 115.31 117.49 1aei h LEU 82 Ca 0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1aei h LEU 82 Cb 0.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1aei h LEU 82 CO 0.00 0.00 -1.43 0.18 -0.34 0.00 0.00 178.44 176.85 1aei n LEU 83 N -2.68 0.44 -4.77 2.25 4.77 -1.17 -4.85 117.00 110.99 1aei n LEU 83 Ca 0.03 -0.03 -0.38 0.00 -0.03 0.00 0.00 56.01 55.61 1aei n LEU 83 Cb 0.36 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.40 1aei n LEU 83 CO 0.27 0.02 0.83 -0.13 -1.33 0.00 0.00 177.39 177.06 1aei s ARG 84 N -3.33 3.92 0.44 3.23 1.81 -1.06 -4.84 118.95 119.12 1aei s ARG 84 Ca -0.01 1.80 -0.24 0.00 -1.72 0.00 0.00 55.73 55.56 1aei s ARG 84 Cb 0.14 -2.55 -0.08 0.00 -0.45 0.00 0.00 34.95 32.01 1aei s ARG 84 CO 0.85 -0.42 1.14 0.21 -0.68 0.00 0.00 175.30 176.41 1aei s LYS 85 N -2.49 3.90 0.29 3.54 2.20 -1.26 -4.80 119.74 121.12 1aei s LYS 85 Ca 0.60 1.73 -0.02 0.00 -0.36 0.00 0.00 55.97 57.92 1aei s LYS 85 Cb -0.29 -2.48 0.40 0.00 -1.51 0.00 0.00 37.83 33.95 1aei s LYS 85 CO 0.36 -0.43 1.91 -1.35 -0.36 0.00 0.00 175.35 175.49 1aei h PRO 86 N 2.25 1.02 -0.12 4.03 0.11 -1.95 -1.54 132.00 135.80 1aei h PRO 86 Ca -0.49 -0.11 -0.16 0.00 0.11 0.00 0.00 66.00 65.34 1aei h PRO 86 Cb 1.24 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1aei h PRO 86 CO 0.61 0.75 -0.62 0.38 -0.21 0.00 0.00 178.00 178.92 1aei h ASP 87 N 1.03 0.49 0.47 -2.05 3.04 -1.94 -3.06 116.42 114.39 1aei h ASP 87 Ca 0.26 -0.28 -0.20 0.00 -3.24 0.00 0.00 57.03 53.56 1aei h ASP 87 Cb 0.03 -0.14 -0.01 0.00 -1.04 0.00 0.00 39.33 38.17 1aei h ASP 87 CO -0.04 0.99 -0.88 -0.33 -2.04 0.00 0.00 179.24 176.94 1aei h GLU 88 N 0.32 0.28 -0.65 4.15 5.08 -1.76 -2.09 114.58 119.91 1aei h GLU 88 Ca -0.01 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.01 1aei h GLU 88 Cb 1.16 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1aei h GLU 88 CO 0.11 0.99 0.21 0.35 -1.00 0.00 0.00 179.01 179.67 1aei h PHE 89 N 0.16 1.04 0.00 4.33 3.57 -1.29 -1.72 116.94 123.03 1aei h PHE 89 Ca -0.05 -0.10 -0.23 0.00 3.53 0.00 0.00 57.97 61.11 1aei h PHE 89 Cb 1.50 -0.30 0.01 0.00 2.79 0.00 0.00 35.95 39.94 1aei h PHE 89 CO 0.04 0.84 -0.96 -0.07 -2.23 0.00 0.00 178.31 175.93 1aei h LEU 90 N 0.94 0.59 -1.46 0.59 3.38 -1.51 -0.73 115.31 117.10 1aei h LEU 90 Ca 0.21 -0.47 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1aei h LEU 90 Cb 0.28 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1aei h LEU 90 CO -0.01 1.27 0.11 0.00 0.09 0.00 0.00 178.44 179.91 1aei h ALA 91 N 0.69 1.58 -0.00 1.53 0.00 -1.32 -1.71 119.26 120.03 1aei h ALA 91 Ca -0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1aei h ALA 91 Cb 1.60 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1aei h ALA 91 CO 0.17 0.33 -0.06 1.49 0.00 0.00 0.00 179.25 181.18 1aei h GLU 92 N 0.47 0.04 -0.96 0.00 4.81 -1.22 -2.96 114.58 114.76 1aei h GLU 92 Ca 0.11 -0.04 0.23 0.00 -0.13 0.00 0.00 59.36 59.53 1aei h GLU 92 Cb 0.13 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.45 1aei h GLU 92 CO -0.01 0.82 0.63 1.96 -0.73 0.00 0.00 179.01 181.68 1aei h GLN 93 N -0.72 0.40 -0.37 1.92 1.08 -0.70 -0.52 115.11 116.20 1aei h GLN 93 Ca -0.01 -0.02 -0.07 0.00 -1.45 0.00 0.00 58.65 57.10 1aei h GLN 93 Cb 0.84 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 28.17 1aei h GLN 93 CO 0.01 0.26 -0.06 -0.07 -0.95 0.00 0.00 178.83 178.03 1aei h LEU 94 N 0.41 0.68 -0.34 1.46 3.38 -1.36 -2.46 115.31 117.08 1aei h LEU 94 Ca 0.52 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 58.16 1aei h LEU 94 Cb 1.30 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 1aei h LEU 94 CO -0.22 0.87 0.19 -0.74 0.09 0.00 0.00 178.44 178.63 1aei h HIS 95 N 0.49 0.35 -0.47 1.13 2.76 -1.06 -1.38 115.15 116.97 1aei h HIS 95 Ca 0.10 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.24 1aei h HIS 95 Cb 0.55 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.38 1aei h HIS 95 CO 0.05 0.20 0.12 0.00 -1.30 0.00 0.00 177.93 177.00 1aei h ALA 96 N 1.16 1.33 -0.23 5.26 0.00 -1.17 -1.84 119.26 123.77 1aei h ALA 96 Ca 0.14 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1aei h ALA 96 Cb 0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1aei h ALA 96 CO -0.07 0.48 -0.49 0.00 0.00 0.00 0.00 179.25 179.17 1aei h ALA 97 N 1.45 0.70 0.02 0.00 0.00 -0.90 -3.38 119.26 117.15 1aei h ALA 97 Ca 0.15 -0.49 -0.16 0.00 0.00 0.00 0.00 54.91 54.42 1aei h ALA 97 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1aei h ALA 97 CO -0.00 0.67 -0.86 0.52 0.00 0.00 0.00 179.25 179.58 1aei h MET 98 N 0.50 0.05 -1.33 0.00 2.86 -1.24 -1.16 114.93 114.62 1aei h MET 98 Ca 0.02 -0.08 -0.63 0.00 -2.06 0.00 0.00 59.70 56.95 1aei h MET 98 Cb 1.03 0.03 -0.26 0.00 0.06 0.00 0.00 31.60 32.47 1aei h MET 98 CO 0.10 1.04 0.82 1.63 1.06 0.00 0.00 176.91 181.55 1aei n LYS 99 N -4.39 2.55 0.00 1.72 4.76 -0.70 -4.79 118.16 117.31 1aei n LYS 99 Ca -0.23 -3.02 0.00 0.00 -2.87 0.00 0.00 58.31 52.19 1aei n LYS 99 Cb 0.66 -2.17 0.00 0.00 -1.84 0.00 0.00 35.03 31.67 1aei n LYS 99 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1aei n GLY 100 N -0.55 4.08 3.56 0.72 0.00 -1.26 -4.98 105.19 106.76 1aei n GLY 100 Ca 0.55 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 1aei n GLY 100 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1aei s LEU 101 N 0.00 3.69 0.00 0.99 0.20 -1.26 -4.88 118.68 117.42 1aei s LEU 101 Ca 0.00 -0.03 0.00 0.00 0.69 0.00 0.00 54.13 54.79 1aei s LEU 101 Cb 0.00 -3.07 0.00 0.00 -0.43 0.00 0.00 46.19 42.69 1aei s LEU 101 CO 0.00 -1.38 0.00 0.61 -0.29 0.00 0.00 176.35 175.29 1aei n GLY 102 N 5.07 -1.84 2.91 7.98 0.00 -1.26 -4.96 105.19 113.10 1aei n GLY 102 Ca 0.06 -2.02 -0.17 0.00 0.00 0.00 0.00 46.02 43.89 1aei n GLY 102 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aei s THR 103 N 0.00 0.38 -0.93 2.61 2.01 -1.26 -4.75 115.64 113.71 1aei s THR 103 Ca 0.00 -0.13 -0.16 0.00 0.31 0.00 0.00 61.69 61.72 1aei s THR 103 Cb 0.00 -0.38 0.18 0.00 0.01 0.00 0.00 72.50 72.31 1aei s THR 103 CO 0.00 0.15 1.01 -0.62 -0.69 0.00 0.00 174.62 174.46 1aei s ASP 104 N 0.38 6.78 0.35 3.53 2.15 -0.44 -4.81 116.67 124.60 1aei s ASP 104 Ca -0.04 -2.51 0.12 0.00 0.43 0.00 0.00 52.55 50.55 1aei s ASP 104 Cb -0.08 -2.31 0.94 0.00 -0.30 0.00 0.00 42.92 41.18 1aei s ASP 104 CO -0.00 -0.78 1.76 -0.33 -0.17 0.00 0.00 175.17 175.64 1aei h GLU 105 N 8.10 0.53 -0.00 4.34 3.07 -1.97 -2.19 114.58 126.45 1aei h GLU 105 Ca 0.15 -0.03 -0.15 0.00 -0.50 0.00 0.00 59.36 58.83 1aei h GLU 105 Cb 1.01 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.78 1aei h GLU 105 CO 0.97 0.35 -0.70 -0.91 -1.40 0.00 0.00 179.01 177.31 1aei h ASN 106 N 0.54 0.01 -0.34 1.42 -0.26 -1.99 -2.50 115.58 112.47 1aei h ASN 106 Ca 0.61 -0.01 -0.11 0.00 -0.56 0.00 0.00 56.30 56.24 1aei h ASN 106 Cb 1.27 -0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.52 1aei h ASN 106 CO -0.39 0.71 -0.20 0.00 -1.06 0.00 0.00 177.43 176.49 1aei h ALA 107 N 1.29 0.48 -0.68 -0.83 0.00 -1.80 -2.43 119.26 115.28 1aei h ALA 107 Ca -0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1aei h ALA 107 Cb 1.25 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1aei h ALA 107 CO 0.09 0.43 0.39 -0.07 0.00 0.00 0.00 179.25 180.09 1aei h LEU 108 N 0.50 0.84 -0.01 0.00 3.38 -1.41 -1.72 115.31 116.89 1aei h LEU 108 Ca 0.07 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1aei h LEU 108 Cb 0.75 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1aei h LEU 108 CO 0.06 0.68 -0.02 0.40 0.09 0.00 0.00 178.44 179.65 1aei h ILE 109 N 0.93 1.44 -1.10 1.22 2.04 -1.44 -1.41 117.51 119.19 1aei h ILE 109 Ca 0.24 -1.34 0.32 0.00 1.00 0.00 0.00 64.86 65.08 1aei h ILE 109 Cb 0.02 2.32 -0.11 0.00 -0.74 0.00 0.00 36.82 38.31 1aei h ILE 109 CO -0.04 0.35 0.70 0.44 0.00 0.00 0.00 178.15 179.60 1aei h ASP 110 N -0.52 0.42 0.05 1.72 3.32 -1.25 -1.76 116.42 118.40 1aei h ASP 110 Ca 0.00 0.12 -0.25 0.00 0.02 0.00 0.00 57.03 56.92 1aei h ASP 110 Cb 0.58 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.17 1aei h ASP 110 CO 0.00 -0.01 -1.32 0.40 -1.72 0.00 0.00 179.24 176.59 1aei h ILE 111 N 0.32 0.97 0.00 0.35 2.04 -1.16 -3.40 117.51 116.62 1aei h ILE 111 Ca 0.67 -2.27 -0.27 0.00 1.00 0.00 0.00 64.86 63.99 1aei h ILE 111 Cb 1.78 2.48 -0.05 0.00 -0.74 0.00 0.00 36.82 40.30 1aei h ILE 111 CO -0.38 0.53 -1.58 -0.07 0.00 0.00 0.00 178.15 176.65 1aei h LEU 112 N -0.65 0.00 -0.40 1.44 3.38 -1.18 -3.38 115.31 114.52 1aei h LEU 112 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1aei h LEU 112 Cb 1.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.26 1aei h LEU 112 CO -0.08 0.96 -0.28 0.00 0.09 0.00 0.00 178.44 179.13 1aei n THR 114 N -0.80 0.19 -3.48 0.00 -2.24 -1.26 -4.22 114.28 102.47 1aei n THR 114 Ca 0.11 -0.60 -0.26 0.00 -2.27 0.00 0.00 64.05 61.03 1aei n THR 114 Cb 0.34 0.93 -0.02 0.00 -2.10 0.00 0.00 70.33 69.48 1aei n THR 114 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1aei s GLN 115 N -0.31 3.54 0.73 -0.78 2.00 -1.26 -5.06 119.66 118.52 1aei s GLN 115 Ca 0.02 -0.24 -0.02 0.00 -2.00 0.00 0.00 55.36 53.12 1aei s GLN 115 Cb 0.02 -2.72 0.12 0.00 0.80 0.00 0.00 33.01 31.23 1aei s GLN 115 CO 0.02 0.26 1.01 -1.54 -0.50 0.00 0.00 175.29 174.54 1aei s SER 116 N -3.47 4.32 0.15 6.67 1.04 -1.26 -4.91 113.70 116.24 1aei s SER 116 Ca 0.41 -0.27 -0.16 0.00 0.48 0.00 0.00 55.95 56.41 1aei s SER 116 Cb -0.10 -0.13 0.01 0.00 0.10 0.00 0.00 66.02 65.90 1aei s SER 116 CO 0.32 -1.88 1.75 0.78 0.98 0.00 0.00 173.24 175.19 1aei h ASN 117 N -0.58 0.52 -0.54 7.02 2.35 -1.95 -1.16 115.58 121.24 1aei h ASN 117 Ca -0.38 -0.09 -0.07 0.00 -0.55 0.00 0.00 56.30 55.21 1aei h ASN 117 Cb 1.27 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 39.48 1aei h ASN 117 CO 0.41 0.45 0.06 0.00 -1.65 0.00 0.00 177.43 176.71 1aei h ALA 118 N 1.09 1.02 -0.34 -0.83 0.00 -1.94 -1.13 119.26 117.13 1aei h ALA 118 Ca 0.15 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1aei h ALA 118 Cb 0.05 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1aei h ALA 118 CO -0.02 0.62 -0.17 1.96 0.00 0.00 0.00 179.25 181.64 1aei h GLN 119 N 0.89 0.71 -0.71 0.00 4.20 -1.88 -2.39 115.11 115.93 1aei h GLN 119 Ca 0.18 -0.31 0.05 0.00 0.06 0.00 0.00 58.65 58.63 1aei h GLN 119 Cb 0.44 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.14 1aei h GLN 119 CO 0.01 0.91 0.42 0.82 -0.67 0.00 0.00 178.83 180.33 1aei h ILE 120 N 0.48 1.01 -0.01 2.54 1.08 -0.73 0.40 117.51 122.29 1aei h ILE 120 Ca 0.07 -0.27 -0.06 0.00 -0.39 0.00 0.00 64.86 64.22 1aei h ILE 120 Cb 0.70 0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 34.61 1aei h ILE 120 CO 0.05 0.14 -0.28 0.45 -0.69 0.00 0.00 178.15 177.82 1aei h HIS 121 N 0.78 0.03 0.10 1.37 3.86 -1.10 -0.15 115.15 120.04 1aei h HIS 121 Ca 0.31 -0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 59.25 1aei h HIS 121 Cb 0.14 -0.01 0.03 0.00 1.06 0.00 0.00 27.41 28.63 1aei h HIS 121 CO -0.06 0.31 -1.11 0.00 0.86 0.00 0.00 177.93 177.93 1aei h ALA 122 N 1.69 0.00 -0.79 2.45 0.00 -0.59 -2.66 119.26 119.36 1aei h ALA 122 Ca 0.00 -0.73 -0.03 0.00 0.00 0.00 0.00 54.91 54.14 1aei h ALA 122 Cb 0.52 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1aei h ALA 122 CO 0.04 0.61 0.36 0.82 0.00 0.00 0.00 179.25 181.09 1aei h ILE 123 N 0.18 1.25 -0.44 0.00 2.04 -0.61 -0.76 117.51 119.17 1aei h ILE 123 Ca -0.17 -0.74 0.06 0.00 1.00 0.00 0.00 64.86 65.02 1aei h ILE 123 Cb 1.80 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 38.09 1aei h ILE 123 CO 0.21 0.31 0.13 0.11 0.00 0.00 0.00 178.15 178.92 1aei h LYS 124 N 1.13 0.28 -0.05 2.37 1.57 -1.09 -2.44 116.57 118.35 1aei h LYS 124 Ca 0.27 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1aei h LYS 124 Cb 0.15 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1aei h LYS 124 CO -0.03 0.19 -0.00 0.00 -0.57 0.00 0.00 179.45 179.04 1aei h ALA 125 N 1.30 0.06 -0.75 3.86 0.00 -1.08 -2.59 119.26 120.06 1aei h ALA 125 Ca 0.21 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1aei h ALA 125 Cb 0.22 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1aei h ALA 125 CO -0.23 -0.27 0.49 0.00 0.00 0.00 0.00 179.25 179.25 1aei h ALA 126 N 0.71 1.61 0.25 0.00 0.00 -1.18 -1.73 119.26 118.93 1aei h ALA 126 Ca 0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1aei h ALA 126 Cb 0.33 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1aei h ALA 126 CO 0.00 0.30 -0.12 0.35 0.00 0.00 0.00 179.25 179.78 1aei h PHE 127 N 0.86 -0.31 -0.90 0.00 3.04 -1.35 -1.38 116.94 116.91 1aei h PHE 127 Ca 0.31 -0.01 0.07 0.00 3.98 0.00 0.00 57.97 62.32 1aei h PHE 127 Cb 0.14 0.10 -0.06 0.00 2.56 0.00 0.00 35.95 38.70 1aei h PHE 127 CO -0.00 -0.11 0.58 -0.22 -2.02 0.00 0.00 178.31 176.55 1aei h LYS 128 N -0.46 0.98 0.35 1.11 1.63 -1.14 0.21 116.57 119.25 1aei h LYS 128 Ca -0.03 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 59.69 1aei h LYS 128 Cb 0.35 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.76 1aei h LYS 128 CO 0.06 0.65 -0.17 1.25 -3.45 0.00 0.00 179.45 177.79 1aei h LEU 129 N 1.01 -0.40 -0.79 5.20 5.85 -1.19 0.19 115.31 125.19 1aei h LEU 129 Ca 0.39 -0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.97 1aei h LEU 129 Cb 0.21 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1aei h LEU 129 CO -0.15 -0.22 -0.16 -0.07 -0.34 0.00 0.00 178.44 177.51 1aei h LEU 130 N -0.55 0.74 -0.85 2.25 3.38 -0.86 -3.35 115.31 116.08 1aei h LEU 130 Ca -0.05 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1aei h LEU 130 Cb 0.41 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1aei h LEU 130 CO 0.08 0.91 0.00 -1.22 0.09 0.00 0.00 178.44 178.30 1aei n TYR 131 N -4.14 0.00 0.00 1.13 4.01 0.69 -5.00 117.16 113.85 1aei n TYR 131 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1aei n TYR 131 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 1aei n TYR 131 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1aei n LYS 132 N -0.11 0.00 -2.92 -0.72 0.00 0.66 -4.90 118.16 110.17 1aei n LYS 132 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 58.31 58.09 1aei n LYS 132 Cb 0.01 -3.64 0.02 0.00 0.00 0.00 0.00 35.03 31.42 1aei n LYS 132 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1aei s GLU 133 N 0.00 2.90 -0.23 1.64 0.41 -1.26 -4.94 118.70 117.22 1aei s GLU 133 Ca 0.00 -0.65 -0.18 0.00 -0.41 0.00 0.00 54.97 53.74 1aei s GLU 133 Cb 0.00 -2.56 -0.03 0.00 -1.78 0.00 0.00 34.13 29.75 1aei s GLU 133 CO 0.00 -0.38 0.49 0.34 -0.49 0.00 0.00 175.26 175.22 1aei s ASP 134 N -4.28 6.48 0.35 -0.19 -1.08 -1.26 -3.52 116.67 113.17 1aei s ASP 134 Ca 0.51 0.57 0.04 0.00 -0.52 0.00 0.00 52.55 53.15 1aei s ASP 134 Cb -0.10 -2.28 0.67 0.00 -1.46 0.00 0.00 42.92 39.76 1aei s ASP 134 CO 0.37 -0.21 1.99 0.25 0.52 0.00 0.00 175.17 178.09 1aei h LEU 135 N 8.27 0.71 -0.19 -1.34 5.85 -1.94 -1.10 115.31 125.58 1aei h LEU 135 Ca -0.32 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.27 1aei h LEU 135 Cb 1.15 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.01 1aei h LEU 135 CO 0.72 0.49 -0.35 -0.08 -0.34 0.00 0.00 178.44 178.88 1aei h GLU 136 N 0.83 0.58 -0.54 1.25 4.81 -1.97 0.69 114.58 120.22 1aei h GLU 136 Ca 0.27 -0.36 0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1aei h GLU 136 Cb 0.05 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 1aei h GLU 136 CO -0.07 0.98 0.36 -0.22 -0.73 0.00 0.00 179.01 179.32 1aei h LYS 137 N 0.24 0.69 -0.00 1.92 3.64 -1.81 -0.11 116.57 121.14 1aei h LYS 137 Ca 0.01 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.14 1aei h LYS 137 Cb 0.95 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1aei h LYS 137 CO 0.08 0.46 -0.88 0.93 -2.27 0.00 0.00 179.45 177.76 1aei h GLU 138 N 0.71 0.27 -0.26 1.90 4.39 -0.60 -2.66 114.58 118.34 1aei h GLU 138 Ca 0.20 -0.28 -0.07 0.00 0.34 0.00 0.00 59.36 59.55 1aei h GLU 138 Cb -0.05 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 1aei h GLU 138 CO -0.05 0.99 -0.12 0.82 -1.16 0.00 0.00 179.01 179.50 1aei h ILE 139 N 0.15 1.30 0.00 3.13 1.08 -0.08 -1.55 117.51 121.55 1aei h ILE 139 Ca -0.05 -1.19 -0.01 0.00 -0.39 0.00 0.00 64.86 63.21 1aei h ILE 139 Cb 1.51 1.53 -0.00 0.00 -3.07 0.00 0.00 36.82 36.79 1aei h ILE 139 CO 0.14 0.37 -0.05 0.40 -0.69 0.00 0.00 178.15 178.32 1aei h ILE 140 N 0.26 0.30 0.16 -0.67 2.04 -1.05 -0.66 117.51 117.90 1aei h ILE 140 Ca 0.06 -0.34 -0.25 0.00 1.00 0.00 0.00 64.86 65.32 1aei h ILE 140 Cb 0.62 1.26 0.02 0.00 -0.74 0.00 0.00 36.82 37.97 1aei h ILE 140 CO 0.04 0.05 -1.18 0.28 0.00 0.00 0.00 178.15 177.34 1aei h SER 141 N 0.00 0.54 -0.05 1.72 0.02 -1.08 -3.37 113.55 111.34 1aei h SER 141 Ca -0.00 -0.92 0.00 0.00 -0.84 0.00 0.00 61.79 60.03 1aei h SER 141 Cb 0.25 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1aei h SER 141 CO 0.01 1.55 0.00 -0.62 -1.14 0.00 0.00 176.83 176.63 1aei n GLU 142 N -3.95 1.84 -4.17 3.45 -0.58 -0.62 -4.91 120.64 111.69 1aei n GLU 142 Ca -0.18 -1.22 -0.14 0.00 -0.42 0.00 0.00 57.16 55.20 1aei n GLU 142 Cb 0.92 -1.47 -0.11 0.00 -0.57 0.00 0.00 31.44 30.22 1aei n GLU 142 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1aei s THR 143 N -1.96 0.91 0.15 2.62 -4.23 -0.31 -5.04 115.64 107.78 1aei s THR 143 Ca 0.35 -1.62 0.05 0.00 -1.18 0.00 0.00 61.69 59.29 1aei s THR 143 Cb 0.20 -1.33 -0.04 0.00 1.34 0.00 0.00 72.50 72.67 1aei s THR 143 CO 0.32 -0.56 -0.10 -0.44 -0.54 0.00 0.00 174.62 173.30 1aei s SER 144 N -2.42 1.85 0.40 3.99 0.01 -1.26 -4.75 113.70 111.51 1aei s SER 144 Ca 0.05 -1.02 0.00 0.00 1.31 0.00 0.00 55.95 56.29 1aei s SER 144 Cb -0.03 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.18 1aei s SER 144 CO -0.00 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 173.93 1aei n GLY 145 N -0.22 0.13 0.36 3.44 0.00 -1.26 -2.71 105.19 104.94 1aei n GLY 145 Ca -0.10 -0.92 0.09 0.00 0.00 0.00 0.00 46.02 45.09 1aei n GLY 145 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1aei h ASN 146 N 8.10 0.86 -0.54 1.61 2.35 -1.99 -1.37 115.58 124.61 1aei h ASN 146 Ca 0.00 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1aei h ASN 146 Cb 0.00 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 1aei h ASN 146 CO 0.00 0.43 0.25 0.15 -1.65 0.00 0.00 177.43 176.61 1aei h PHE 147 N 0.91 0.78 -0.87 1.19 3.57 -1.95 -2.39 116.94 118.18 1aei h PHE 147 Ca 0.50 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.95 1aei h PHE 147 Cb 0.59 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.05 1aei h PHE 147 CO -0.00 0.61 0.49 0.37 -2.23 0.00 0.00 178.31 177.55 1aei h GLN 148 N 0.72 1.20 -0.22 1.11 4.15 -1.07 -1.59 115.11 119.42 1aei h GLN 148 Ca 0.18 -0.13 -0.09 0.00 0.77 0.00 0.00 58.65 59.38 1aei h GLN 148 Cb 0.13 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 1aei h GLN 148 CO -0.02 0.87 -0.25 0.00 -1.93 0.00 0.00 178.83 177.50 1aei h ARG 149 N 1.20 0.41 -0.19 1.69 3.08 -1.22 0.74 114.38 120.10 1aei h ARG 149 Ca 0.31 -0.15 -0.10 0.00 0.07 0.00 0.00 59.98 60.11 1aei h ARG 149 Cb 0.01 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1aei h ARG 149 CO -0.05 0.63 -0.32 1.25 -1.07 0.00 0.00 179.97 180.42 1aei h LEU 150 N 0.36 0.38 0.12 3.04 5.85 -0.85 -1.91 115.31 122.30 1aei h LEU 150 Ca 0.05 -0.14 -0.30 0.00 0.84 0.00 0.00 57.88 58.34 1aei h LEU 150 Cb 0.64 -0.10 0.03 0.00 0.37 0.00 0.00 40.66 41.59 1aei h LEU 150 CO 0.05 0.68 -1.26 -0.07 -0.34 0.00 0.00 178.44 177.50 1aei h LEU 151 N 0.32 0.81 -0.66 2.25 3.38 -0.60 -2.34 115.31 118.47 1aei h LEU 151 Ca 0.04 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 57.25 1aei h LEU 151 Cb 0.72 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1aei h LEU 151 CO 0.05 1.58 0.42 0.58 0.09 0.00 0.00 178.44 181.17 1aei h VAL 152 N 0.24 1.18 -0.55 1.22 2.07 -0.81 -1.75 116.25 117.83 1aei h VAL 152 Ca -0.19 -0.34 0.10 0.00 0.82 0.00 0.00 66.70 67.10 1aei h VAL 152 Cb 1.94 0.22 -0.08 0.00 -1.52 0.00 0.00 31.29 31.85 1aei h VAL 152 CO 0.24 0.17 0.08 0.28 0.02 0.00 0.00 177.57 178.36 1aei h SER 153 N 0.89 -0.08 -0.51 0.57 0.02 -1.33 -2.80 113.55 110.31 1aei h SER 153 Ca 0.24 0.11 -0.05 0.00 -0.84 0.00 0.00 61.79 61.25 1aei h SER 153 Cb -0.08 0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1aei h SER 153 CO -0.05 -0.02 0.12 0.24 -1.14 0.00 0.00 176.83 175.98 1aei h MET 154 N 0.20 0.82 0.00 3.45 2.07 -1.01 -2.67 114.93 117.79 1aei h MET 154 Ca 0.28 -0.20 0.00 0.00 -2.07 0.00 0.00 59.70 57.72 1aei h MET 154 Cb 0.42 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 30.04 1aei h MET 154 CO -0.40 0.79 0.00 1.28 1.07 0.00 0.00 176.91 179.65 1aei n LEU 155 N -4.44 0.00 0.15 1.22 4.77 -0.70 -2.97 117.00 115.03 1aei n LEU 155 Ca 0.02 0.39 0.05 0.00 -0.03 0.00 0.00 56.01 56.43 1aei n LEU 155 Cb 0.23 -0.39 0.05 0.00 -2.33 0.00 0.00 43.42 40.97 1aei n LEU 155 CO 0.40 -0.30 0.47 1.56 -1.33 0.00 0.00 177.39 178.18 1aei h GLN 156 N 0.00 0.00 -4.53 3.23 1.08 -1.40 -3.48 115.11 110.01 1aei h GLN 156 Ca 0.00 0.00 -0.25 0.00 -1.45 0.00 0.00 58.65 56.95 1aei h GLN 156 Cb 0.09 0.00 0.11 0.00 -0.05 0.00 0.00 27.48 27.63 1aei h GLN 156 CO 0.00 0.35 -0.52 0.41 -0.95 0.00 0.00 178.83 178.12 1aei n GLY 157 N 1.21 -0.12 0.56 3.46 0.00 -1.16 -4.96 105.19 104.18 1aei n GLY 157 Ca 0.01 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.05 1aei n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aei n GLY 158 N -1.26 4.71 3.74 -0.02 0.00 -1.26 -4.90 105.19 106.20 1aei n GLY 158 Ca -0.13 -1.22 -0.41 0.00 0.00 0.00 0.00 46.02 44.26 1aei n GLY 158 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1aei s ARG 159 N -2.88 4.53 -1.44 1.61 3.52 -1.26 -4.84 118.95 118.19 1aei s ARG 159 Ca 0.36 1.83 -0.14 0.00 -0.13 0.00 0.00 55.73 57.65 1aei s ARG 159 Cb 0.35 -3.24 0.03 0.00 -1.56 0.00 0.00 34.95 30.53 1aei s ARG 159 CO -0.06 -0.01 2.23 1.17 -0.81 0.00 0.00 175.30 177.82 1aei n LYS 160 N 2.30 2.82 0.33 5.12 4.81 -0.23 -4.77 118.16 128.54 1aei n LYS 160 Ca 0.03 -2.58 0.14 0.00 -0.87 0.00 0.00 58.31 55.03 1aei n LYS 160 Cb 0.45 -3.27 0.73 0.00 0.02 0.00 0.00 35.03 32.95 1aei n LYS 160 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1aei h GLU 161 N 6.04 0.00 -0.49 1.64 5.08 -1.89 -0.03 114.58 124.93 1aei h GLU 161 Ca 0.57 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.93 1aei h GLU 161 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1aei h GLU 161 CO 1.89 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 179.50 1aei n ASP 162 N -2.83 3.53 -4.70 1.42 5.75 -1.26 -4.84 116.55 113.61 1aei n ASP 162 Ca -0.02 -1.97 -0.42 0.00 -0.01 0.00 0.00 54.79 52.37 1aei n ASP 162 Cb 0.44 -0.32 -0.03 0.00 -1.03 0.00 0.00 41.12 40.18 1aei n ASP 162 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1aei s GLU 163 N -1.25 4.31 0.41 0.11 2.12 -0.03 -5.00 118.70 119.37 1aei s GLU 163 Ca 0.40 2.01 -0.12 0.00 0.36 0.00 0.00 54.97 57.62 1aei s GLU 163 Cb 0.22 -3.40 -0.07 0.00 0.26 0.00 0.00 34.13 31.14 1aei s GLU 163 CO 0.30 -0.49 0.80 -1.25 -0.54 0.00 0.00 175.26 174.09 1aei s PRO 164 N 1.67 3.83 0.08 4.30 0.05 -1.26 -4.62 135.00 139.05 1aei s PRO 164 Ca 0.64 0.57 -0.31 0.00 0.05 0.00 0.00 61.00 61.95 1aei s PRO 164 Cb -0.34 -2.35 -0.09 0.00 0.05 0.00 0.00 34.50 31.76 1aei s PRO 164 CO 0.29 -0.05 1.82 0.08 0.05 0.00 0.00 177.00 179.18 1aei s VAL 165 N -2.37 2.81 -0.24 -0.36 1.01 -1.26 -4.81 120.40 115.19 1aei s VAL 165 Ca 0.53 0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.64 1aei s VAL 165 Cb -0.10 -3.11 0.08 0.00 0.00 0.00 0.00 36.38 33.25 1aei s VAL 165 CO 0.30 -0.00 0.09 0.21 0.00 0.00 0.00 175.10 175.70 1aei s ASN 166 N 3.12 3.13 0.30 3.32 3.84 -1.26 -5.04 114.94 122.34 1aei s ASN 166 Ca 0.81 -1.04 -0.02 0.00 0.21 0.00 0.00 52.86 52.81 1aei s ASN 166 Cb -0.43 -0.44 0.43 0.00 -0.55 0.00 0.00 41.25 40.26 1aei s ASN 166 CO 0.36 -0.38 1.96 0.00 -2.79 0.00 0.00 177.10 176.25 1aei h ALA 167 N 8.33 1.39 -0.77 1.71 0.00 -1.98 0.44 119.26 128.39 1aei h ALA 167 Ca -0.17 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 54.82 1aei h ALA 167 Cb 1.07 -0.33 -0.10 0.00 0.00 0.00 0.00 17.79 18.44 1aei h ALA 167 CO 0.38 0.55 0.32 0.00 0.00 0.00 0.00 179.25 180.50 1aei h ALA 168 N 1.47 1.09 0.14 0.00 0.00 -1.99 -1.30 119.26 118.67 1aei h ALA 168 Ca 0.29 0.11 -0.28 0.00 0.00 0.00 0.00 54.91 55.03 1aei h ALA 168 Cb -0.10 0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1aei h ALA 168 CO -0.06 -0.20 -1.25 0.45 0.00 0.00 0.00 179.25 178.19 1aei h HIS 169 N 0.46 0.66 -0.99 0.00 3.86 -1.93 -0.99 115.15 116.21 1aei h HIS 169 Ca 0.42 -0.46 0.18 0.00 -1.16 0.00 0.00 60.37 59.36 1aei h HIS 169 Cb 0.64 -0.04 -0.10 0.00 1.06 0.00 0.00 27.41 28.97 1aei h HIS 169 CO -0.16 1.34 0.61 0.00 0.86 0.00 0.00 177.93 180.59 1aei h ALA 170 N 0.49 1.72 -0.09 2.45 0.00 -0.31 0.42 119.26 123.94 1aei h ALA 170 Ca -0.16 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1aei h ALA 170 Cb 1.95 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 1aei h ALA 170 CO 0.22 -0.06 -0.05 0.00 0.00 0.00 0.00 179.25 179.36 1aei h ALA 171 N 1.62 0.13 -0.94 0.00 0.00 -1.05 -0.36 119.26 118.67 1aei h ALA 171 Ca 0.55 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 55.30 1aei h ALA 171 Cb 0.87 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 1aei h ALA 171 CO -0.34 -0.10 0.58 0.93 0.00 0.00 0.00 179.25 180.32 1aei h GLU 172 N -0.17 0.99 0.01 0.00 5.08 -0.22 -1.03 114.58 119.23 1aei h GLU 172 Ca 0.02 -0.06 -0.27 0.00 -1.00 0.00 0.00 59.36 58.05 1aei h GLU 172 Cb 0.50 -0.22 0.02 0.00 0.50 0.00 0.00 28.75 29.54 1aei h GLU 172 CO 0.01 0.65 -1.06 -0.44 -1.00 0.00 0.00 179.01 177.18 1aei h ASP 173 N 1.01 0.90 -0.84 1.42 3.32 -0.86 -2.40 116.42 118.97 1aei h ASP 173 Ca 0.43 -0.73 0.03 0.00 0.02 0.00 0.00 57.03 56.78 1aei h ASP 173 Cb 0.28 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.50 1aei h ASP 173 CO -0.21 1.53 0.54 0.00 -1.72 0.00 0.00 179.24 179.38 1aei h ALA 174 N 0.41 1.11 -0.40 3.45 0.00 -0.94 0.11 119.26 123.00 1aei h ALA 174 Ca -0.13 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1aei h ALA 174 Cb 1.71 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1aei h ALA 174 CO 0.21 0.37 0.03 0.00 0.00 0.00 0.00 179.25 179.85 1aei h ALA 175 N 1.35 1.30 -0.41 0.00 0.00 -1.12 -0.11 119.26 120.27 1aei h ALA 175 Ca 0.34 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 1aei h ALA 175 Cb 0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1aei h ALA 175 CO -0.12 0.48 -0.30 0.00 0.00 0.00 0.00 179.25 179.31 1aei h ALA 176 N 1.44 0.59 -0.38 0.00 0.00 -0.52 -1.66 119.26 118.73 1aei h ALA 176 Ca 0.13 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1aei h ALA 176 Cb 0.34 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1aei h ALA 176 CO 0.01 0.64 0.07 0.82 0.00 0.00 0.00 179.25 180.79 1aei h ILE 177 N 0.76 1.24 -0.03 0.00 2.04 -0.75 -2.28 117.51 118.49 1aei h ILE 177 Ca 0.08 -0.84 0.03 0.00 1.00 0.00 0.00 64.86 65.13 1aei h ILE 177 Cb 0.89 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.98 1aei h ILE 177 CO 0.08 0.29 -0.19 0.22 0.00 0.00 0.00 178.15 178.54 1aei h TYR 178 N 0.47 -0.51 -0.28 1.37 3.20 -0.34 -1.90 116.97 118.99 1aei h TYR 178 Ca 0.12 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.02 1aei h TYR 178 Cb 0.35 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 1aei h TYR 178 CO 0.02 -0.28 0.19 1.96 -1.64 0.00 0.00 178.16 178.41 1aei h GLN 179 N -0.30 0.33 -0.16 1.82 1.08 -1.32 0.81 115.11 117.36 1aei h GLN 179 Ca 0.07 -0.02 -0.08 0.00 -1.45 0.00 0.00 58.65 57.17 1aei h GLN 179 Cb 0.39 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 1aei h GLN 179 CO -0.20 0.22 -0.25 0.00 -0.95 0.00 0.00 178.83 177.64 1aei h ALA 180 N 1.83 1.27 -3.00 3.87 0.00 -0.76 -3.36 119.26 119.12 1aei h ALA 180 Ca 0.11 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1aei h ALA 180 Cb 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1aei h ALA 180 CO -0.02 0.49 0.00 0.41 0.00 0.00 0.00 179.25 180.12 1aei n GLY 181 N -0.52 0.30 0.27 0.00 0.00 -0.73 -0.53 105.19 103.98 1aei n GLY 181 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1aei n GLY 181 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1aei h GLU 182 N 0.00 0.39 -0.64 1.61 5.08 -1.62 -2.49 114.58 116.92 1aei h GLU 182 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1aei h GLU 182 Cb 0.00 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1aei h GLU 182 CO 0.00 0.26 0.00 0.41 -1.00 0.00 0.00 179.01 178.68 1aei n GLY 183 N -1.33 0.78 3.56 -3.84 0.00 0.20 -4.67 105.19 99.90 1aei n GLY 183 Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.08 1aei n GLY 183 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1aei s GLN 184 N -0.79 0.53 0.00 1.61 -2.07 -0.94 -4.88 119.66 113.13 1aei s GLN 184 Ca 0.00 -0.12 -0.02 0.00 -1.82 0.00 0.00 55.36 53.40 1aei s GLN 184 Cb 0.00 0.24 -0.01 0.00 -1.09 0.00 0.00 33.01 32.15 1aei s GLN 184 CO 0.00 -0.22 1.03 0.82 -1.32 0.00 0.00 175.29 175.60 1aei h ILE 185 N 2.11 0.00 0.00 3.63 2.04 -1.83 -3.43 117.51 120.03 1aei h ILE 185 Ca -0.15 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.71 1aei h ILE 185 Cb 1.19 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1aei h ILE 185 CO 0.27 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.03 1aei n GLY 186 N -1.03 -2.27 2.89 5.37 0.00 -1.26 -5.00 105.19 103.89 1aei n GLY 186 Ca -0.01 -1.09 -0.14 0.00 0.00 0.00 0.00 46.02 44.79 1aei n GLY 186 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aei s THR 187 N 0.00 -0.06 -0.53 2.61 2.01 -1.26 -4.69 115.64 113.72 1aei s THR 187 Ca 0.00 0.20 -0.23 0.00 0.31 0.00 0.00 61.69 61.97 1aei s THR 187 Cb 0.00 -0.22 0.04 0.00 0.01 0.00 0.00 72.50 72.34 1aei s THR 187 CO 0.00 0.08 0.84 -0.62 -0.69 0.00 0.00 174.62 174.23 1aei s ASP 188 N 1.23 6.31 0.19 3.53 2.15 0.31 -4.94 116.67 125.45 1aei s ASP 188 Ca -0.08 -0.48 -0.03 0.00 0.43 0.00 0.00 52.55 52.39 1aei s ASP 188 Cb -0.12 -2.39 0.10 0.00 -0.30 0.00 0.00 42.92 40.21 1aei s ASP 188 CO -0.05 -1.11 1.49 -0.33 -0.17 0.00 0.00 175.17 174.99 1aei h GLU 189 N 9.20 0.51 -0.88 4.34 3.07 -1.99 -3.27 114.58 125.56 1aei h GLU 189 Ca -0.26 -0.35 0.23 0.00 -0.50 0.00 0.00 59.36 58.48 1aei h GLU 189 Cb 1.08 0.05 -0.15 0.00 -0.84 0.00 0.00 28.75 28.89 1aei h GLU 189 CO 1.04 0.96 0.10 0.77 -1.40 0.00 0.00 179.01 180.48 1aei h SER 190 N 0.38 -0.26 -0.82 1.42 0.02 -1.99 0.90 113.55 113.20 1aei h SER 190 Ca -0.00 0.22 -0.04 0.00 -0.84 0.00 0.00 61.79 61.14 1aei h SER 190 Cb 1.15 0.36 -0.04 0.00 0.14 0.00 0.00 62.40 64.01 1aei h SER 190 CO 0.11 -0.23 0.38 -0.09 -1.14 0.00 0.00 176.83 175.85 1aei h ARG 191 N 0.11 1.20 -0.29 3.45 9.65 -1.96 0.80 114.38 127.34 1aei h ARG 191 Ca 0.53 -0.19 -0.02 0.00 -1.10 0.00 0.00 59.98 59.20 1aei h ARG 191 Cb 1.04 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 29.40 1aei h ARG 191 CO -0.75 0.94 0.11 0.74 2.80 0.00 0.00 179.97 183.81 1aei h PHE 192 N 1.18 0.45 0.04 2.20 -1.00 -0.96 -2.43 116.94 116.41 1aei h PHE 192 Ca 0.28 -0.04 0.02 0.00 2.81 0.00 0.00 57.97 61.05 1aei h PHE 192 Cb 0.15 -0.13 -0.04 0.00 3.61 0.00 0.00 35.95 39.54 1aei h PHE 192 CO 0.02 0.45 -0.22 -0.97 -1.61 0.00 0.00 178.31 175.98 1aei h ASN 193 N 0.32 -0.63 0.13 2.17 -1.24 -1.29 -2.41 115.58 112.63 1aei h ASN 193 Ca 0.10 0.08 0.01 0.00 0.71 0.00 0.00 56.30 57.20 1aei h ASN 193 Cb 0.20 0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.48 1aei h ASN 193 CO -0.01 -0.29 -0.15 0.00 -1.29 0.00 0.00 177.43 175.69 1aei h ALA 194 N 0.48 -0.28 -0.11 1.57 0.00 -0.77 -0.76 119.26 119.39 1aei h ALA 194 Ca 0.05 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.71 1aei h ALA 194 Cb 0.42 0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.44 1aei h ALA 194 CO -0.17 -0.68 -0.79 0.28 0.00 0.00 0.00 179.25 177.89 1aei h VAL 195 N -0.32 1.31 0.00 0.00 2.07 -1.51 -2.51 116.25 115.30 1aei h VAL 195 Ca 0.01 -2.07 -0.02 0.00 0.82 0.00 0.00 66.70 65.45 1aei h VAL 195 Cb 0.31 2.07 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 1aei h VAL 195 CO -0.06 0.64 -0.09 -0.07 0.02 0.00 0.00 177.57 178.01 1aei h LEU 196 N 0.44 0.00 0.00 2.57 4.07 -1.35 -3.01 115.31 118.03 1aei h LEU 196 Ca -0.05 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.79 1aei h LEU 196 Cb 1.40 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.12 1aei h LEU 196 CO 0.15 0.09 -1.40 0.00 -1.08 0.00 0.00 178.44 176.20 1aei n ALA 197 N -2.13 2.13 0.00 1.53 0.00 -0.30 -4.57 120.51 117.18 1aei n ALA 197 Ca 0.02 -0.50 0.07 0.00 0.00 0.00 0.00 53.44 53.03 1aei n ALA 197 Cb 0.47 -0.94 -0.10 0.00 0.00 0.00 0.00 19.45 18.87 1aei n ALA 197 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1aei n THR 198 N -2.78 0.00 -2.95 0.00 -2.24 -0.95 -4.40 114.28 100.96 1aei n THR 198 Ca -0.08 -0.30 -0.31 0.00 -2.27 0.00 0.00 64.05 61.09 1aei n THR 198 Cb 0.76 0.20 -0.04 0.00 -2.10 0.00 0.00 70.33 69.15 1aei n THR 198 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1aei s ARG 199 N -2.92 3.85 0.99 -0.78 1.81 -1.14 -1.07 118.95 119.69 1aei s ARG 199 Ca -0.05 0.53 -0.11 0.00 -1.72 0.00 0.00 55.73 54.38 1aei s ARG 199 Cb 0.09 -2.41 0.19 0.00 -0.45 0.00 0.00 34.95 32.37 1aei s ARG 199 CO 0.56 0.03 1.09 -1.54 -0.68 0.00 0.00 175.30 174.76 1aei s SER 200 N -2.87 2.36 0.13 0.23 1.04 -1.22 -4.69 113.70 108.68 1aei s SER 200 Ca 0.52 1.84 -0.13 0.00 0.48 0.00 0.00 55.95 58.66 1aei s SER 200 Cb -0.10 -2.42 -0.03 0.00 0.10 0.00 0.00 66.02 63.56 1aei s SER 200 CO 0.27 -3.39 1.51 1.88 0.98 0.00 0.00 173.24 174.48 1aei h TYR 201 N -2.07 0.96 -0.34 5.02 -1.99 -1.89 0.66 116.97 117.32 1aei h TYR 201 Ca -0.51 -0.24 0.05 0.00 2.00 0.00 0.00 58.73 60.04 1aei h TYR 201 Cb 1.29 -0.22 -0.05 0.00 2.00 0.00 0.00 36.73 39.75 1aei h TYR 201 CO 0.41 1.00 0.06 -1.35 -0.00 0.00 0.00 178.16 178.28 1aei h PRO 202 N 0.64 0.17 -0.55 4.88 0.11 -1.92 -1.85 132.00 133.48 1aei h PRO 202 Ca 0.09 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.12 1aei h PRO 202 Cb 0.75 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.80 1aei h PRO 202 CO 0.06 0.11 0.08 0.37 -0.21 0.00 0.00 178.00 178.41 1aei h GLN 203 N 0.17 0.88 -0.75 1.05 5.75 -1.81 -2.82 115.11 117.59 1aei h GLN 203 Ca 0.16 -0.21 -0.05 0.00 -0.15 0.00 0.00 58.65 58.40 1aei h GLN 203 Cb 0.19 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.59 1aei h GLN 203 CO -0.22 0.82 0.26 -0.07 -2.65 0.00 0.00 178.83 176.98 1aei h LEU 204 N 0.83 1.06 -0.56 -2.39 3.38 -0.13 -2.20 115.31 115.30 1aei h LEU 204 Ca 0.17 -0.18 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1aei h LEU 204 Cb 0.38 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 1aei h LEU 204 CO 0.01 0.96 0.22 -0.74 0.09 0.00 0.00 178.44 178.99 1aei h HIS 205 N 1.10 0.40 -0.65 1.13 2.76 -1.18 -1.87 115.15 116.84 1aei h HIS 205 Ca 0.25 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.38 1aei h HIS 205 Cb 0.26 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.10 1aei h HIS 205 CO 0.02 0.13 0.15 0.37 -1.30 0.00 0.00 177.93 177.30 1aei h GLN 206 N 0.42 1.02 -0.49 5.26 5.75 -1.17 -2.62 115.11 123.28 1aei h GLN 206 Ca 0.27 -0.24 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 1aei h GLN 206 Cb 0.28 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 1aei h GLN 206 CO -0.25 0.91 0.29 0.82 -2.65 0.00 0.00 178.83 177.95 1aei h ILE 207 N 0.97 1.05 -0.62 2.39 2.04 -0.86 -0.96 117.51 121.53 1aei h ILE 207 Ca 0.20 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1aei h ILE 207 Cb 0.36 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1aei h ILE 207 CO 0.00 0.11 0.29 -0.26 0.00 0.00 0.00 178.15 178.29 1aei h PHE 208 N 0.58 0.90 0.05 1.37 0.04 -1.19 0.13 116.94 118.82 1aei h PHE 208 Ca 0.20 -0.05 0.01 0.00 2.80 0.00 0.00 57.97 60.93 1aei h PHE 208 Cb 0.01 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.87 1aei h PHE 208 CO -0.07 0.68 -0.13 1.25 -0.60 0.00 0.00 178.31 179.45 1aei h HIS 209 N 0.85 -0.33 -0.84 -0.55 -0.00 -1.35 -1.89 115.15 111.03 1aei h HIS 209 Ca 0.21 0.01 0.05 0.00 -0.00 0.00 0.00 60.37 60.64 1aei h HIS 209 Cb 0.13 0.14 -0.06 0.00 -0.00 0.00 0.00 27.41 27.62 1aei h HIS 209 CO 0.00 -0.19 0.52 0.93 -0.00 0.00 0.00 177.93 179.19 1aei h GLU 210 N -0.24 0.95 -0.50 5.26 4.39 -0.34 -2.82 114.58 121.28 1aei h GLU 210 Ca 0.03 -0.06 0.06 0.00 0.34 0.00 0.00 59.36 59.73 1aei h GLU 210 Cb 0.27 -0.21 -0.05 0.00 -0.10 0.00 0.00 28.75 28.66 1aei h GLU 210 CO -0.09 0.63 0.20 -0.92 -1.16 0.00 0.00 179.01 177.67 1aei h TYR 211 N 0.98 0.37 0.00 4.33 3.20 -0.47 -1.81 116.97 123.56 1aei h TYR 211 Ca 0.36 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.25 1aei h TYR 211 Cb 0.12 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.30 1aei h TYR 211 CO -0.03 0.14 -0.02 0.66 -1.64 0.00 0.00 178.16 177.27 1aei h SER 212 N 0.40 0.00 1.51 -2.11 4.64 -1.09 -0.54 113.55 116.36 1aei h SER 212 Ca 0.23 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.46 1aei h SER 212 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1aei h SER 212 CO -0.21 0.02 -0.50 0.11 -0.87 0.00 0.00 176.83 175.38 1aei h LYS 213 N 0.00 0.00 0.00 4.77 1.57 -1.29 -3.32 116.57 118.30 1aei h LYS 213 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1aei h LYS 213 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1aei h LYS 213 CO 0.00 0.40 -1.37 0.44 -0.57 0.00 0.00 179.45 178.35 1aei n ILE 214 N -3.17 0.13 -4.46 1.86 -5.35 -0.32 -4.96 119.36 103.08 1aei n ILE 214 Ca 0.01 -0.33 -0.23 0.00 -0.27 0.00 0.00 62.75 61.94 1aei n ILE 214 Cb 0.71 0.21 -0.10 0.00 -1.74 0.00 0.00 39.64 38.71 1aei n ILE 214 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1aei s SER 215 N -4.13 3.27 0.00 7.28 0.15 -0.54 -5.01 113.70 114.71 1aei s SER 215 Ca -0.00 -1.11 0.24 0.00 0.70 0.00 0.00 55.95 55.78 1aei s SER 215 Cb 0.14 -0.26 0.29 0.00 -1.71 0.00 0.00 66.02 64.49 1aei s SER 215 CO 0.85 -0.15 1.32 -0.46 1.20 0.00 0.00 173.24 176.00 1aei n ASN 216 N -0.62 2.81 -4.67 5.45 0.23 -1.26 -4.63 115.26 112.57 1aei n ASN 216 Ca -0.06 -1.94 -0.26 0.00 -0.53 0.00 0.00 54.58 51.80 1aei n ASN 216 Cb 0.62 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.25 1aei n ASN 216 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1aei s LYS 217 N -2.00 2.42 0.83 -3.83 1.02 -1.26 -5.12 119.74 111.79 1aei s LYS 217 Ca 0.29 -1.16 -0.12 0.00 0.02 0.00 0.00 55.97 55.00 1aei s LYS 217 Cb 0.20 -2.33 0.09 0.00 -0.52 0.00 0.00 37.83 35.27 1aei s LYS 217 CO 0.31 0.44 1.12 0.95 -0.92 0.00 0.00 175.35 177.24 1aei s THR 218 N -1.86 2.57 0.31 2.17 -4.23 -1.26 -4.57 115.64 108.78 1aei s THR 218 Ca 0.28 0.19 -0.01 0.00 -1.18 0.00 0.00 61.69 60.98 1aei s THR 218 Cb -0.09 -2.99 0.26 0.00 1.34 0.00 0.00 72.50 71.03 1aei s THR 218 CO 0.19 -0.24 1.98 -0.29 -0.54 0.00 0.00 174.62 175.72 1aei h ILE 219 N -1.20 1.19 -0.12 2.99 6.09 -1.94 0.16 117.51 124.68 1aei h ILE 219 Ca -0.48 -0.36 0.03 0.00 -1.37 0.00 0.00 64.86 62.69 1aei h ILE 219 Cb 1.30 0.06 -0.03 0.00 0.47 0.00 0.00 36.82 38.62 1aei h ILE 219 CO 0.62 0.19 -0.07 -0.07 -3.07 0.00 0.00 178.15 175.74 1aei h LEU 220 N 1.04 -0.24 -0.33 2.19 4.07 -1.99 0.22 115.31 120.26 1aei h LEU 220 Ca 0.29 0.06 -0.01 0.00 0.08 0.00 0.00 57.88 58.29 1aei h LEU 220 Cb -0.10 0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.76 1aei h LEU 220 CO -0.07 -0.10 0.17 1.56 -1.08 0.00 0.00 178.44 178.92 1aei h GLN 221 N -0.07 0.47 -0.81 1.13 4.20 -1.84 0.15 115.11 118.34 1aei h GLN 221 Ca 0.07 -0.06 0.06 0.00 0.06 0.00 0.00 58.65 58.78 1aei h GLN 221 Cb 0.18 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.82 1aei h GLN 221 CO -0.17 0.42 0.53 0.00 -0.67 0.00 0.00 178.83 178.94 1aei h ALA 222 N 1.03 1.59 -0.15 3.87 0.00 0.06 -1.56 119.26 124.10 1aei h ALA 222 Ca 0.12 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1aei h ALA 222 Cb 0.09 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1aei h ALA 222 CO -0.02 0.30 -0.23 0.82 0.00 0.00 0.00 179.25 180.13 1aei h ILE 223 N 0.91 1.36 -0.69 0.00 2.04 -0.26 -1.08 117.51 119.79 1aei h ILE 223 Ca 0.34 -1.45 0.19 0.00 1.00 0.00 0.00 64.86 64.94 1aei h ILE 223 Cb 0.18 1.95 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 1aei h ILE 223 CO -0.12 0.43 0.49 -0.33 0.00 0.00 0.00 178.15 178.63 1aei h GLU 224 N 0.04 0.05 0.02 2.37 4.39 -0.33 -1.47 114.58 119.64 1aei h GLU 224 Ca 0.01 -0.00 -0.40 0.00 0.34 0.00 0.00 59.36 59.31 1aei h GLU 224 Cb 0.80 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.38 1aei h GLU 224 CO 0.05 0.03 -2.30 0.09 -1.16 0.00 0.00 179.01 175.72 1aei n ASN 225 N -4.35 1.98 0.24 1.42 5.03 -0.62 -4.49 115.26 114.46 1aei n ASN 225 Ca 0.14 0.16 0.11 0.00 0.87 0.00 0.00 54.58 55.86 1aei n ASN 225 Cb 0.73 -0.70 0.60 0.00 -1.02 0.00 0.00 39.78 39.40 1aei n ASN 225 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 1aei h GLU 226 N -0.51 0.00 -6.27 3.52 4.39 -1.11 -3.46 114.58 111.14 1aei h GLU 226 Ca -0.58 0.00 -0.61 0.00 0.34 0.00 0.00 59.36 58.51 1aei h GLU 226 Cb 1.73 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 30.24 1aei h GLU 226 CO -0.22 0.18 -0.75 -0.06 -1.16 0.00 0.00 179.01 177.00 1aei s PHE 227 N -3.95 2.36 0.03 4.33 0.08 -0.56 -4.89 117.98 115.39 1aei s PHE 227 Ca -0.01 -0.31 0.04 0.00 0.12 0.00 0.00 56.93 56.76 1aei s PHE 227 Cb 0.12 -1.05 -0.02 0.00 -0.57 0.00 0.00 43.02 41.50 1aei s PHE 227 CO 0.61 0.67 -0.11 -1.12 -0.10 0.00 0.00 175.22 175.17 1aei s SER 228 N -3.41 1.28 0.72 1.36 0.01 -1.26 -4.78 113.70 107.62 1aei s SER 228 Ca 0.29 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.14 1aei s SER 228 Cb -0.06 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.11 1aei s SER 228 CO 0.15 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.40 1aei n GLY 229 N 2.01 1.30 0.30 3.44 0.00 -1.26 -3.42 105.19 107.56 1aei n GLY 229 Ca -0.18 -0.65 -0.04 0.00 0.00 0.00 0.00 46.02 45.14 1aei n GLY 229 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1aei h ASP 230 N 9.13 -0.89 -0.12 1.61 3.32 -1.99 0.98 116.42 128.46 1aei h ASP 230 Ca 0.00 0.20 -0.07 0.00 0.02 0.00 0.00 57.03 57.17 1aei h ASP 230 Cb 0.00 0.47 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 1aei h ASP 230 CO 0.00 -0.27 -0.14 -0.29 -1.72 0.00 0.00 179.24 176.82 1aei h ILE 231 N -0.13 1.23 -0.57 0.35 6.09 -1.94 0.05 117.51 122.59 1aei h ILE 231 Ca 0.24 -1.04 -0.00 0.00 -1.37 0.00 0.00 64.86 62.68 1aei h ILE 231 Cb 0.51 1.17 -0.03 0.00 0.47 0.00 0.00 36.82 38.94 1aei h ILE 231 CO -0.61 0.34 0.34 0.50 -3.07 0.00 0.00 178.15 175.65 1aei h LYS 232 N 0.45 0.78 -0.06 2.19 3.11 -0.87 -0.27 116.57 121.90 1aei h LYS 232 Ca 0.08 -0.07 -0.14 0.00 -2.81 0.00 0.00 60.65 57.71 1aei h LYS 232 Cb 0.51 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 31.57 1aei h LYS 232 CO 0.03 0.57 -0.60 -0.91 -2.81 0.00 0.00 179.45 175.74 1aei h ASN 233 N 0.77 0.22 0.61 4.20 -0.26 -0.64 -1.67 115.58 118.80 1aei h ASN 233 Ca 0.21 -0.12 -0.03 0.00 -0.56 0.00 0.00 56.30 55.80 1aei h ASN 233 Cb -0.01 -0.06 -0.00 0.00 -1.06 0.00 0.00 38.32 37.19 1aei h ASN 233 CO -0.04 0.76 -0.34 1.23 -1.06 0.00 0.00 177.43 177.99 1aei h GLY 234 N 1.53 -0.93 1.54 2.83 0.00 -0.70 -1.97 103.07 105.37 1aei h GLY 234 Ca -0.01 0.37 -0.13 0.00 0.00 0.00 0.00 47.33 47.57 1aei h GLY 234 CO 0.09 -0.34 -0.41 1.41 0.00 0.00 0.00 176.54 177.29 1aei h LEU 235 N -0.88 0.53 -1.24 3.11 3.38 -0.98 -2.72 115.31 116.51 1aei h LEU 235 Ca -0.08 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.59 1aei h LEU 235 Cb 0.70 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1aei h LEU 235 CO 0.10 0.89 -0.23 -0.07 0.09 0.00 0.00 178.44 179.22 1aei h LEU 236 N 0.41 0.23 -0.46 1.67 3.38 -1.34 -2.75 115.31 116.45 1aei h LEU 236 Ca 0.03 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 57.96 1aei h LEU 236 Cb 0.90 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 1aei h LEU 236 CO 0.08 0.47 0.27 0.00 0.09 0.00 0.00 178.44 179.35 1aei h ALA 237 N 1.55 0.59 0.32 1.53 0.00 -1.03 -0.42 119.26 121.81 1aei h ALA 237 Ca 0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1aei h ALA 237 Cb 0.53 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1aei h ALA 237 CO 0.04 -0.05 -0.16 0.82 0.00 0.00 0.00 179.25 179.91 1aei h ILE 238 N 0.54 0.70 -0.31 0.00 2.04 -1.52 0.17 117.51 119.13 1aei h ILE 238 Ca 0.19 -0.19 0.06 0.00 1.00 0.00 0.00 64.86 65.93 1aei h ILE 238 Cb 0.02 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 1aei h ILE 238 CO -0.09 0.04 -0.11 0.58 0.00 0.00 0.00 178.15 178.57 1aei h VAL 239 N -0.53 0.63 -0.33 1.67 2.07 -1.30 -0.45 116.25 118.01 1aei h VAL 239 Ca -0.04 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.39 1aei h VAL 239 Cb 0.40 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1aei h VAL 239 CO 0.07 0.00 -0.16 0.11 0.02 0.00 0.00 177.57 177.61 1aei h LYS 240 N -0.04 0.59 -0.81 1.57 6.56 -1.01 -1.06 116.57 122.37 1aei h LYS 240 Ca 0.15 -0.20 -0.02 0.00 -1.06 0.00 0.00 60.65 59.53 1aei h LYS 240 Cb 0.28 -0.05 -0.04 0.00 -0.57 0.00 0.00 32.23 31.85 1aei h LYS 240 CO -0.34 0.73 0.43 0.77 -2.06 0.00 0.00 179.45 178.98 1aei h SER 241 N 0.53 1.02 -0.29 0.86 0.02 0.14 -0.01 113.55 115.83 1aei h SER 241 Ca 0.09 -0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 1aei h SER 241 Cb 0.59 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1aei h SER 241 CO 0.04 0.83 0.00 0.58 -1.14 0.00 0.00 176.83 177.14 1aei h VAL 242 N 1.13 1.26 0.29 2.27 2.07 -0.77 -3.21 116.25 119.28 1aei h VAL 242 Ca 0.28 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.85 1aei h VAL 242 Cb 0.05 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1aei h VAL 242 CO -0.04 0.30 -0.14 -0.33 0.02 0.00 0.00 177.57 177.38 1aei h GLU 243 N 0.31 -0.38 -1.17 1.57 4.39 -1.15 -3.46 114.58 114.70 1aei h GLU 243 Ca 0.08 0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 1aei h GLU 243 Cb 0.43 0.09 -0.23 0.00 -0.10 0.00 0.00 28.75 28.94 1aei h GLU 243 CO 0.02 -0.06 -0.39 1.21 -1.16 0.00 0.00 179.01 178.62 1aei s ASN 244 N -5.18 -1.14 0.29 1.42 3.84 -0.02 -5.04 114.94 109.12 1aei s ASN 244 Ca -0.11 0.21 0.02 0.00 0.21 0.00 0.00 52.86 53.18 1aei s ASN 244 Cb 0.01 1.85 0.44 0.00 -0.55 0.00 0.00 41.25 42.99 1aei s ASN 244 CO 0.40 -0.30 1.77 -0.09 -2.79 0.00 0.00 177.10 176.09 1aei h ARG 245 N 8.04 0.57 -0.51 0.43 2.43 -1.58 -2.64 114.38 121.12 1aei h ARG 245 Ca -0.07 -0.17 -0.05 0.00 -0.81 0.00 0.00 59.98 58.87 1aei h ARG 245 Cb 1.17 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 1aei h ARG 245 CO 0.20 0.69 0.10 0.74 -1.51 0.00 0.00 179.97 180.18 1aei h PHE 246 N 0.52 0.82 0.00 2.20 0.04 -1.92 -2.28 116.94 116.32 1aei h PHE 246 Ca 0.09 -0.08 -0.12 0.00 2.80 0.00 0.00 57.97 60.66 1aei h PHE 246 Cb 0.54 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 1aei h PHE 246 CO 0.02 0.71 -0.59 0.00 -0.60 0.00 0.00 178.31 177.84 1aei h ALA 247 N 1.35 0.83 -0.42 2.45 0.00 -1.86 -0.74 119.26 120.88 1aei h ALA 247 Ca 0.16 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1aei h ALA 247 Cb 0.32 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1aei h ALA 247 CO 0.00 0.74 0.19 -0.92 0.00 0.00 0.00 179.25 179.26 1aei h TYR 248 N 0.00 0.61 -0.03 0.00 3.20 -1.07 -2.15 116.97 117.53 1aei h TYR 248 Ca -0.01 -0.04 -0.22 0.00 3.14 0.00 0.00 58.73 61.61 1aei h TYR 248 Cb 1.19 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.27 1aei h TYR 248 CO 0.00 0.51 -0.89 0.74 -1.64 0.00 0.00 178.16 176.89 1aei h PHE 249 N 0.53 0.66 -0.07 -3.82 0.04 -1.33 -2.01 116.94 110.94 1aei h PHE 249 Ca 0.14 -0.34 0.02 0.00 2.80 0.00 0.00 57.97 60.59 1aei h PHE 249 Cb 0.14 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1aei h PHE 249 CO -0.01 1.15 0.05 0.00 -0.60 0.00 0.00 178.31 178.90 1aei h ALA 250 N 0.75 2.03 0.28 2.45 0.00 -0.96 -0.75 119.26 123.07 1aei h ALA 250 Ca -0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1aei h ALA 250 Cb 1.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1aei h ALA 250 CO 0.16 -0.08 -0.14 1.49 0.00 0.00 0.00 179.25 180.68 1aei h GLU 251 N 0.00 -0.37 -0.96 0.00 4.81 -1.18 -1.89 114.58 115.00 1aei h GLU 251 Ca 0.03 0.03 0.20 0.00 -0.13 0.00 0.00 59.36 59.48 1aei h GLU 251 Cb 0.13 0.08 -0.11 0.00 0.63 0.00 0.00 28.75 29.48 1aei h GLU 251 CO -0.00 -0.19 0.54 0.00 -0.73 0.00 0.00 179.01 178.63 1aei h ARG 252 N -1.08 0.63 -0.39 1.92 2.47 -0.89 -1.22 114.38 115.83 1aei h ARG 252 Ca -0.04 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.61 1aei h ARG 252 Cb 0.35 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.51 1aei h ARG 252 CO 0.06 0.42 0.12 -0.07 0.56 0.00 0.00 179.97 181.07 1aei h LEU 253 N 0.65 0.56 -0.49 3.04 3.38 -1.22 -2.11 115.31 119.12 1aei h LEU 253 Ca 0.57 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 58.35 1aei h LEU 253 Cb 0.94 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1aei h LEU 253 CO -0.42 0.61 0.30 -0.74 0.09 0.00 0.00 178.44 178.28 1aei h HIS 254 N 0.48 0.56 0.00 1.13 2.76 -0.75 -1.66 115.15 117.66 1aei h HIS 254 Ca 0.13 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.26 1aei h HIS 254 Cb 0.25 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 1aei h HIS 254 CO 0.01 0.33 -0.24 0.45 -1.30 0.00 0.00 177.93 177.17 1aei h HIS 255 N 0.60 0.00 -0.15 5.26 3.86 -1.14 -2.91 115.15 120.67 1aei h HIS 255 Ca 0.19 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.30 1aei h HIS 255 Cb -0.00 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 1aei h HIS 255 CO -0.06 0.24 -0.35 0.00 0.86 0.00 0.00 177.93 178.62 1aei h ALA 256 N 1.76 1.12 -0.20 2.45 0.00 -0.60 -2.98 119.26 120.81 1aei h ALA 256 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1aei h ALA 256 Cb 0.64 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1aei h ALA 256 CO 0.03 0.57 0.00 -1.33 0.00 0.00 0.00 179.25 178.52 1aei n MET 257 N -4.07 2.12 -2.89 0.00 2.81 -1.02 -0.39 117.12 113.68 1aei n MET 257 Ca -0.01 -1.67 -0.31 0.00 -1.81 0.00 0.00 57.70 53.90 1aei n MET 257 Cb 0.45 -1.46 -0.04 0.00 -0.71 0.00 0.00 33.22 31.46 1aei n MET 257 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 1aei s LYS 258 N -1.75 3.83 2.54 0.03 2.47 -1.11 -4.87 119.74 120.88 1aei s LYS 258 Ca 0.35 0.53 0.00 0.00 -1.56 0.00 0.00 55.97 55.28 1aei s LYS 258 Cb 0.20 -2.39 0.00 0.00 -1.46 0.00 0.00 37.83 34.18 1aei s LYS 258 CO 0.30 -0.01 0.00 0.41 0.16 0.00 0.00 175.35 176.21 1aei n GLY 259 N -1.12 0.07 3.77 5.54 0.00 -1.26 -4.74 105.19 107.45 1aei n GLY 259 Ca 0.03 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 1aei n GLY 259 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aei s LEU 260 N 0.00 4.33 0.00 0.99 1.43 -1.26 -4.72 118.68 119.44 1aei s LEU 260 Ca 0.00 2.89 0.00 0.00 -1.03 0.00 0.00 54.13 55.99 1aei s LEU 260 Cb 0.00 -3.71 0.00 0.00 0.03 0.00 0.00 46.19 42.51 1aei s LEU 260 CO 0.00 -0.79 0.00 0.61 0.23 0.00 0.00 176.35 176.40 1aei n GLY 261 N 0.59 -0.07 3.14 -3.19 0.00 -1.26 -4.95 105.19 99.45 1aei n GLY 261 Ca 0.01 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 1aei n GLY 261 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aei s THR 262 N 0.00 0.12 -0.93 2.61 2.01 -1.26 -4.69 115.64 113.50 1aei s THR 262 Ca 0.00 -0.98 -0.06 0.00 0.31 0.00 0.00 61.69 60.96 1aei s THR 262 Cb 0.00 -0.85 0.23 0.00 0.01 0.00 0.00 72.50 71.89 1aei s THR 262 CO 0.00 -0.54 0.85 -0.55 -0.69 0.00 0.00 174.62 173.69 1aei s SER 263 N -2.04 6.47 0.58 3.53 0.15 0.48 -4.89 113.70 117.98 1aei s SER 263 Ca -0.06 -3.43 0.27 0.00 0.70 0.00 0.00 55.95 53.43 1aei s SER 263 Cb -0.02 -2.05 1.67 0.00 -1.71 0.00 0.00 66.02 63.91 1aei s SER 263 CO -0.04 -0.30 2.19 0.44 1.20 0.00 0.00 173.24 176.74 1aei h ASP 264 N 6.62 0.00 -0.07 5.45 3.32 -1.98 -1.41 116.42 128.34 1aei h ASP 264 Ca 0.14 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1aei h ASP 264 Cb 0.88 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.43 1aei h ASP 264 CO 0.88 0.00 -0.00 0.11 -1.72 0.00 0.00 179.24 178.50 1aei h LYS 265 N 0.00 0.12 0.07 3.56 6.56 -1.98 0.32 116.57 125.23 1aei h LYS 265 Ca 0.03 -0.04 -0.00 0.00 -1.06 0.00 0.00 60.65 59.58 1aei h LYS 265 Cb 0.14 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.79 1aei h LYS 265 CO -0.00 0.40 -0.03 1.15 -2.06 0.00 0.00 179.45 178.90 1aei h THR 266 N -0.17 1.15 -0.33 -0.16 2.02 -1.90 -1.99 112.91 111.53 1aei h THR 266 Ca 0.02 -0.82 0.07 0.00 0.77 0.00 0.00 66.41 66.45 1aei h THR 266 Cb 0.34 1.68 -0.07 0.00 -1.74 0.00 0.00 68.15 68.36 1aei h THR 266 CO 0.00 0.20 -0.17 0.25 0.37 0.00 0.00 175.52 176.17 1aei h LEU 267 N -0.47 -0.57 0.16 2.58 5.85 -0.76 -0.75 115.31 121.35 1aei h LEU 267 Ca -0.01 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1aei h LEU 267 Cb 0.40 0.31 0.00 0.00 0.37 0.00 0.00 40.66 41.74 1aei h LEU 267 CO 0.02 -0.21 -0.08 0.40 -0.34 0.00 0.00 178.44 178.23 1aei h ILE 268 N -0.12 0.92 -0.22 4.05 2.04 -0.44 -2.49 117.51 121.25 1aei h ILE 268 Ca 0.17 -0.38 0.06 0.00 1.00 0.00 0.00 64.86 65.70 1aei h ILE 268 Cb 0.38 1.16 -0.07 0.00 -0.74 0.00 0.00 36.82 37.55 1aei h ILE 268 CO -0.40 0.09 -0.28 -0.09 0.00 0.00 0.00 178.15 177.46 1aei h ARG 269 N -0.40 -0.29 -0.29 2.37 2.43 -0.54 -1.55 114.38 116.10 1aei h ARG 269 Ca -0.02 0.02 -0.18 0.00 -0.81 0.00 0.00 59.98 58.99 1aei h ARG 269 Cb 0.32 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1aei h ARG 269 CO 0.04 -0.20 -0.52 0.82 -1.51 0.00 0.00 179.97 178.60 1aei h ILE 270 N -0.30 1.28 -0.08 1.20 2.04 -1.19 -1.86 117.51 118.60 1aei h ILE 270 Ca 0.13 -1.71 -0.01 0.00 1.00 0.00 0.00 64.86 64.27 1aei h ILE 270 Cb 0.50 1.63 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1aei h ILE 270 CO -0.39 0.56 0.01 -0.07 0.00 0.00 0.00 178.15 178.26 1aei h LEU 271 N 0.65 0.13 0.23 1.44 3.38 -1.28 -1.31 115.31 118.55 1aei h LEU 271 Ca 0.02 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1aei h LEU 271 Cb 1.13 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1aei h LEU 271 CO 0.12 0.37 -0.11 0.58 0.09 0.00 0.00 178.44 179.49 1aei h VAL 272 N -0.11 0.84 0.00 1.22 2.07 -1.39 -2.59 116.25 116.29 1aei h VAL 272 Ca 0.02 -0.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.80 1aei h VAL 272 Cb 0.30 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1aei h VAL 272 CO 0.00 0.15 -0.17 0.77 0.02 0.00 0.00 177.57 178.34 1aei h SER 273 N -0.68 0.00 -0.39 0.57 4.64 -1.29 -2.88 113.55 113.51 1aei h SER 273 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1aei h SER 273 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1aei h SER 273 CO 0.05 0.17 0.00 0.54 -0.87 0.00 0.00 176.83 176.72 1aei n ARG 274 N -4.28 2.31 -0.15 4.77 5.12 -0.50 -4.50 116.66 119.43 1aei n ARG 274 Ca -0.02 -1.99 -0.03 0.00 -1.93 0.00 0.00 57.85 53.88 1aei n ARG 274 Cb 0.24 -1.48 0.19 0.00 -1.16 0.00 0.00 32.46 30.25 1aei n ARG 274 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1aei h SER 275 N 3.73 0.81 -0.40 0.55 4.64 -1.23 -0.21 113.55 121.45 1aei h SER 275 Ca 0.00 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1aei h SER 275 Cb 0.83 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1aei h SER 275 CO 0.00 0.76 0.00 -0.62 -0.87 0.00 0.00 176.83 176.10 1aei n GLU 276 N -4.30 3.62 0.01 4.77 1.02 -1.26 -0.08 120.64 124.43 1aei n GLU 276 Ca 0.05 -2.91 -0.01 0.00 -0.02 0.00 0.00 57.16 54.27 1aei n GLU 276 Cb 0.20 -1.95 -0.00 0.00 -0.02 0.00 0.00 31.44 29.66 1aei n GLU 276 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1aei n ILE 277 N 0.03 0.71 -2.40 -3.67 5.41 -0.48 -4.29 119.36 114.67 1aei n ILE 277 Ca 0.23 0.24 -0.02 0.00 1.00 0.00 0.00 62.75 64.20 1aei n ILE 277 Cb 0.97 -1.44 0.02 0.00 -0.71 0.00 0.00 39.64 38.48 1aei n ILE 277 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1aei n ASP 278 N -3.14 -0.27 0.24 4.38 5.68 -1.00 -2.80 116.55 119.63 1aei n ASP 278 Ca -0.01 -2.06 0.16 0.00 -0.50 0.00 0.00 54.79 52.38 1aei n ASP 278 Cb 0.05 0.14 0.72 0.00 -1.14 0.00 0.00 41.12 40.89 1aei n ASP 278 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1aei h LEU 279 N 0.85 0.00 -0.37 -2.12 5.85 -1.09 -0.66 115.31 117.77 1aei h LEU 279 Ca -0.40 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.18 1aei h LEU 279 Cb 1.48 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.50 1aei h LEU 279 CO -0.11 0.00 -0.32 0.00 -0.34 0.00 0.00 178.44 177.67 1aei h ALA 280 N 2.07 0.54 -0.10 1.25 0.00 -1.25 -1.70 119.26 120.08 1aei h ALA 280 Ca 0.00 -0.43 -0.24 0.00 0.00 0.00 0.00 54.91 54.25 1aei h ALA 280 Cb 0.32 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1aei h ALA 280 CO 0.00 0.60 -0.86 -0.91 0.00 0.00 0.00 179.25 178.08 1aei h ASN 281 N 0.69 0.93 -0.54 0.00 4.21 -1.56 -2.78 115.58 116.52 1aei h ASN 281 Ca 0.07 -0.67 0.01 0.00 1.21 0.00 0.00 56.30 56.92 1aei h ASN 281 Cb 0.91 -0.28 -0.03 0.00 -1.12 0.00 0.00 38.32 37.80 1aei h ASN 281 CO 0.08 1.45 0.36 0.40 -1.29 0.00 0.00 177.43 178.44 1aei h ILE 282 N 0.48 1.12 -0.69 2.81 2.04 -1.10 -1.45 117.51 120.72 1aei h ILE 282 Ca -0.08 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.48 1aei h ILE 282 Cb 1.50 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 1aei h ILE 282 CO 0.17 0.13 0.21 0.11 0.00 0.00 0.00 178.15 178.77 1aei h LYS 283 N 0.70 1.07 -0.27 2.37 1.57 -1.06 -1.06 116.57 119.90 1aei h LYS 283 Ca 0.21 -0.22 -0.19 0.00 -1.87 0.00 0.00 60.65 58.57 1aei h LYS 283 Cb -0.03 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.12 1aei h LYS 283 CO -0.05 0.91 -0.59 1.05 -0.57 0.00 0.00 179.45 180.21 1aei h GLU 284 N 1.03 0.87 -0.47 3.15 4.11 -1.14 -2.78 114.58 119.34 1aei h GLU 284 Ca 0.22 -0.58 -0.13 0.00 0.07 0.00 0.00 59.36 58.95 1aei h GLU 284 Cb 0.30 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1aei h GLU 284 CO -0.01 1.21 -0.20 1.15 0.07 0.00 0.00 179.01 181.23 1aei h THR 285 N 0.65 1.27 0.53 -1.06 2.02 -1.25 -0.71 112.91 114.36 1aei h THR 285 Ca 0.00 -1.36 -0.02 0.00 0.77 0.00 0.00 66.41 65.81 1aei h THR 285 Cb 1.20 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.72 1aei h THR 285 CO 0.13 0.47 -0.47 0.15 0.37 0.00 0.00 175.52 176.17 1aei h PHE 286 N 0.82 -1.28 -0.47 3.16 3.57 -1.11 -0.68 116.94 120.97 1aei h PHE 286 Ca 0.11 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.71 1aei h PHE 286 Cb 0.77 0.49 -0.10 0.00 2.79 0.00 0.00 35.95 39.90 1aei h PHE 286 CO 0.05 -0.65 -0.26 0.37 -2.23 0.00 0.00 178.31 175.59 1aei h GLN 287 N -0.99 -0.15 -0.81 1.11 5.75 -1.31 0.31 115.11 119.00 1aei h GLN 287 Ca -0.06 0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.46 1aei h GLN 287 Cb 0.85 0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.39 1aei h GLN 287 CO -0.03 -0.10 0.54 0.00 -2.65 0.00 0.00 178.83 176.59 1aei h ALA 288 N 1.07 1.42 0.06 3.38 0.00 -1.01 0.52 119.26 124.69 1aei h ALA 288 Ca 0.21 -0.06 -0.25 0.00 0.00 0.00 0.00 54.91 54.81 1aei h ALA 288 Cb 0.49 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1aei h ALA 288 CO -0.56 0.54 -1.24 0.52 0.00 0.00 0.00 179.25 178.51 1aei h MET 289 N 1.10 0.12 -0.00 0.00 2.86 -0.45 -3.41 114.93 115.16 1aei h MET 289 Ca 0.30 -0.21 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1aei h MET 289 Cb -0.12 0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.62 1aei h MET 289 CO -0.07 1.03 -0.28 0.66 1.06 0.00 0.00 176.91 179.32 1aei n TYR 290 N -3.39 0.00 0.00 -0.22 4.01 0.10 -5.05 117.16 112.61 1aei n TYR 290 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 1aei n TYR 290 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.02 1aei n TYR 290 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1aei n GLY 291 N 1.07 2.05 3.80 2.72 0.00 0.15 -4.98 105.19 110.01 1aei n GLY 291 Ca 0.02 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 1aei n GLY 291 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aei s LYS 292 N 0.00 1.87 0.70 1.61 1.02 -1.26 -4.90 119.74 118.78 1aei s LYS 292 Ca 0.00 0.57 -0.11 0.00 0.02 0.00 0.00 55.97 56.45 1aei s LYS 292 Cb 0.00 -1.90 0.01 0.00 -0.52 0.00 0.00 37.83 35.42 1aei s LYS 292 CO 0.00 -1.75 1.08 0.45 -0.92 0.00 0.00 175.35 174.21 1aei s SER 293 N -3.92 5.50 0.04 2.83 0.15 -1.26 -3.91 113.70 113.12 1aei s SER 293 Ca 0.61 1.28 -0.25 0.00 0.70 0.00 0.00 55.95 58.29 1aei s SER 293 Cb -0.14 -2.14 -0.17 0.00 -1.71 0.00 0.00 66.02 61.86 1aei s SER 293 CO 0.54 -1.33 1.52 0.25 1.20 0.00 0.00 173.24 175.42 1aei h LEU 294 N -0.64 -0.15 -0.68 3.45 5.85 -1.91 -1.69 115.31 119.53 1aei h LEU 294 Ca -0.45 -0.15 0.14 0.00 0.84 0.00 0.00 57.88 58.26 1aei h LEU 294 Cb 1.24 0.04 -0.13 0.00 0.37 0.00 0.00 40.66 42.18 1aei h LEU 294 CO 0.62 0.07 -0.14 0.22 -0.34 0.00 0.00 178.44 178.87 1aei h TYR 295 N -0.36 -0.31 -0.65 1.25 5.03 -1.85 -1.36 116.97 118.73 1aei h TYR 295 Ca -0.02 0.06 0.00 0.00 2.58 0.00 0.00 58.73 61.36 1aei h TYR 295 Cb 0.29 0.24 -0.03 0.00 1.55 0.00 0.00 36.73 38.78 1aei h TYR 295 CO -0.01 -0.28 0.42 0.93 -1.32 0.00 0.00 178.16 177.89 1aei h GLU 296 N 0.02 0.86 0.36 1.82 5.08 -1.92 -0.22 114.58 120.57 1aei h GLU 296 Ca 0.34 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.63 1aei h GLU 296 Cb 0.53 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1aei h GLU 296 CO -0.69 0.58 -0.29 0.74 -1.00 0.00 0.00 179.01 178.36 1aei h PHE 297 N 0.88 -0.76 -0.42 4.33 -1.00 -0.30 -2.76 116.94 116.91 1aei h PHE 297 Ca 0.24 -0.00 0.06 0.00 2.81 0.00 0.00 57.97 61.08 1aei h PHE 297 Cb -0.08 0.29 -0.05 0.00 3.61 0.00 0.00 35.95 39.72 1aei h PHE 297 CO -0.02 -0.42 0.11 0.82 -1.61 0.00 0.00 178.31 177.18 1aei h ILE 298 N -0.65 0.81 -0.78 -0.55 2.04 -1.31 -0.60 117.51 116.48 1aei h ILE 298 Ca -0.03 -0.08 0.11 0.00 1.00 0.00 0.00 64.86 65.86 1aei h ILE 298 Cb 0.57 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 1aei h ILE 298 CO -0.01 0.04 0.51 0.00 0.00 0.00 0.00 178.15 178.69 1aei h ALA 299 N 1.30 1.85 0.04 1.87 0.00 -1.00 -1.22 119.26 122.10 1aei h ALA 299 Ca 0.20 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 1aei h ALA 299 Cb 0.23 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1aei h ALA 299 CO -0.24 -0.02 -0.45 -0.44 0.00 0.00 0.00 179.25 178.10 1aei h ASP 300 N 0.64 0.33 1.48 0.00 5.19 -1.18 -3.39 116.42 119.49 1aei h ASP 300 Ca 0.37 -0.85 -0.10 0.00 -0.62 0.00 0.00 57.03 55.83 1aei h ASP 300 Cb 0.55 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.94 1aei h ASP 300 CO -0.14 1.15 -0.47 -0.78 -3.12 0.00 0.00 179.24 175.88 1aei h ASP 301 N -0.45 0.00 -1.88 6.45 3.58 -0.95 -3.47 116.42 119.71 1aei h ASP 301 Ca -0.07 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.86 1aei h ASP 301 Cb 1.25 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.24 1aei h ASP 301 CO 0.09 0.47 -0.50 0.00 -2.88 0.00 0.00 179.24 176.41 1aei s SER 303 N -3.90 1.07 0.93 0.00 1.04 -1.26 -4.75 113.70 106.83 1aei s SER 303 Ca 0.39 -1.56 0.00 0.00 0.48 0.00 0.00 55.95 55.26 1aei s SER 303 Cb -0.04 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1aei s SER 303 CO 0.24 -1.11 0.00 0.61 0.98 0.00 0.00 173.24 173.97 1aei n GLY 304 N -0.53 0.88 0.18 7.32 0.00 -1.26 -1.24 105.19 110.54 1aei n GLY 304 Ca 0.04 -0.72 0.03 0.00 0.00 0.00 0.00 46.02 45.36 1aei n GLY 304 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1aei h ASP 305 N 5.48 0.00 -0.06 1.61 3.32 -1.99 -3.02 116.42 121.76 1aei h ASP 305 Ca 0.00 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.09 1aei h ASP 305 Cb 0.00 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.49 1aei h ASP 305 CO 0.00 0.43 -0.36 0.22 -1.72 0.00 0.00 179.24 177.81 1aei h TYR 306 N 0.00 -1.00 -0.91 4.55 3.20 -1.88 -1.11 116.97 119.82 1aei h TYR 306 Ca -0.00 0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.98 1aei h TYR 306 Cb 0.82 0.45 -0.06 0.00 1.54 0.00 0.00 36.73 39.47 1aei h TYR 306 CO 0.00 -0.44 0.59 -0.22 -1.64 0.00 0.00 178.16 176.45 1aei h LYS 307 N -0.47 0.97 -0.17 1.82 3.64 -1.05 -1.69 116.57 119.63 1aei h LYS 307 Ca 0.07 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1aei h LYS 307 Cb 0.59 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1aei h LYS 307 CO -0.33 0.64 -0.03 -0.44 -2.27 0.00 0.00 179.45 177.02 1aei h ASP 308 N 1.00 0.32 -0.36 4.20 5.19 -1.35 0.00 116.42 125.42 1aei h ASP 308 Ca 0.40 -0.36 0.07 0.00 -0.62 0.00 0.00 57.03 56.52 1aei h ASP 308 Cb 0.25 -0.09 -0.06 0.00 0.18 0.00 0.00 39.33 39.62 1aei h ASP 308 CO -0.16 0.60 -0.02 0.25 -3.12 0.00 0.00 179.24 176.79 1aei h LEU 309 N 0.03 -0.20 -1.04 1.55 5.85 -1.05 0.32 115.31 120.77 1aei h LEU 309 Ca 0.04 0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 1aei h LEU 309 Cb 0.46 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1aei h LEU 309 CO 0.02 -0.06 -0.19 -0.07 -0.34 0.00 0.00 178.44 177.79 1aei h LEU 310 N 0.07 0.45 -0.47 2.25 4.07 -1.21 -1.22 115.31 119.24 1aei h LEU 310 Ca 0.18 -0.13 -0.09 0.00 0.08 0.00 0.00 57.88 57.91 1aei h LEU 310 Cb 0.25 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 1aei h LEU 310 CO -0.32 0.66 -0.44 -0.07 -1.08 0.00 0.00 178.44 177.19 1aei h LEU 311 N 0.42 0.00 -0.03 1.67 3.38 -0.42 -1.71 115.31 118.63 1aei h LEU 311 Ca 0.07 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.79 1aei h LEU 311 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1aei h LEU 311 CO 0.04 0.44 -1.10 1.56 0.09 0.00 0.00 178.44 179.47 1aei h GLN 312 N 0.00 0.34 -0.35 1.13 4.20 0.06 -1.43 115.11 119.06 1aei h GLN 312 Ca -0.00 -0.46 -0.09 0.00 0.06 0.00 0.00 58.65 58.16 1aei h GLN 312 Cb 1.15 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 29.07 1aei h GLN 312 CO 0.06 1.16 -0.13 0.82 -0.67 0.00 0.00 178.83 180.07 1aei h ILE 313 N 0.15 1.28 -0.02 2.54 2.04 -1.22 -3.29 117.51 118.99 1aei h ILE 313 Ca -0.11 -1.23 -0.11 0.00 1.00 0.00 0.00 64.86 64.41 1aei h ILE 313 Cb 1.78 1.35 0.01 0.00 -0.74 0.00 0.00 36.82 39.21 1aei h ILE 313 CO 0.18 0.40 -0.41 0.74 0.00 0.00 0.00 178.15 179.07 1aei h THR 314 N 0.49 1.47 -0.20 -0.27 2.02 -1.38 -3.43 112.91 111.61 1aei h THR 314 Ca 0.08 -1.95 0.02 0.00 0.77 0.00 0.00 66.41 65.34 1aei h THR 314 Cb 0.66 2.60 -0.01 0.00 -1.74 0.00 0.00 68.15 69.66 1aei h THR 314 CO 0.04 0.55 -0.05 0.61 0.37 0.00 0.00 175.52 177.05 1aei n GLY 315 N 0.97 -1.75 0.23 2.16 0.00 -0.54 -4.90 105.19 101.36 1aei n GLY 315 Ca -0.10 -1.49 0.15 0.00 0.00 0.00 0.00 46.02 44.58 1aei n GLY 315 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74