#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ae6 s ILE 2 N 0.00 3.68 -0.15 0.53 1.01 -1.26 -5.06 121.20 119.94 1ae6 s ILE 2 Ca 0.00 -1.08 -0.29 0.00 0.00 0.00 0.00 60.65 59.28 1ae6 s ILE 2 Cb 0.00 -3.04 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 1ae6 s ILE 2 CO 0.00 -0.11 1.66 0.68 0.00 0.00 0.00 174.94 177.17 1ae6 s VAL 3 N 1.40 3.62 -0.27 2.92 -7.23 -1.26 -4.69 120.40 114.88 1ae6 s VAL 3 Ca -0.01 0.72 -0.13 0.00 -1.81 0.00 0.00 61.98 60.74 1ae6 s VAL 3 Cb -0.19 -3.57 -0.04 0.00 0.56 0.00 0.00 36.38 33.14 1ae6 s VAL 3 CO 0.02 -0.18 0.29 -0.04 -0.31 0.00 0.00 175.10 174.87 1ae6 s MET 4 N 4.49 3.99 -0.06 4.82 -1.94 -1.26 -1.52 119.30 127.82 1ae6 s MET 4 Ca 0.74 -0.12 0.05 0.00 -1.71 0.00 0.00 55.69 54.65 1ae6 s MET 4 Cb -0.29 -3.65 -0.01 0.00 2.01 0.00 0.00 34.83 32.90 1ae6 s MET 4 CO 0.29 -0.21 -0.23 0.95 -0.01 0.00 0.00 175.02 175.81 1ae6 s THR 5 N 1.87 1.94 -0.32 2.05 -4.23 0.26 -3.92 115.64 113.30 1ae6 s THR 5 Ca 0.11 -0.99 0.03 0.00 -1.18 0.00 0.00 61.69 59.67 1ae6 s THR 5 Cb -0.16 -1.65 0.09 0.00 1.34 0.00 0.00 72.50 72.12 1ae6 s THR 5 CO 0.10 0.54 0.01 -1.10 -0.54 0.00 0.00 174.62 173.63 1ae6 s GLN 6 N -0.00 1.65 0.00 3.99 -0.21 -1.26 0.22 119.66 124.04 1ae6 s GLN 6 Ca -0.07 -1.69 0.00 0.00 0.02 0.00 0.00 55.36 53.62 1ae6 s GLN 6 Cb -0.14 -3.07 0.00 0.00 1.00 0.00 0.00 33.01 30.80 1ae6 s GLN 6 CO 0.05 -0.84 0.31 0.00 -2.12 0.00 0.00 175.29 172.69 1ae6 n ALA 7 N 4.33 0.00 -2.66 6.09 0.00 -1.26 -4.49 120.51 122.52 1ae6 n ALA 7 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.05 1ae6 n ALA 7 Cb 0.42 0.15 -0.06 0.00 0.00 0.00 0.00 19.45 19.96 1ae6 n ALA 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ae6 s ALA 8 N -1.98 3.52 0.20 0.00 0.00 -1.26 -4.98 121.76 117.26 1ae6 s ALA 8 Ca 0.00 -0.18 -0.05 0.00 0.00 0.00 0.00 51.96 51.73 1ae6 s ALA 8 Cb 0.00 -2.60 0.15 0.00 0.00 0.00 0.00 23.12 20.66 1ae6 s ALA 8 CO 0.00 0.10 1.60 -1.35 0.00 0.00 0.00 175.76 176.11 1ae6 h PRO 9 N 6.26 0.77 -4.07 0.00 0.11 -1.80 -3.39 132.00 129.88 1ae6 h PRO 9 Ca -0.43 -0.34 -0.19 0.00 0.11 0.00 0.00 66.00 65.14 1ae6 h PRO 9 Cb 1.19 -0.02 -0.22 0.00 0.11 0.00 0.00 31.00 32.06 1ae6 h PRO 9 CO 0.73 0.96 -0.71 -1.54 -0.21 0.00 0.00 178.00 177.23 1ae6 s SER 10 N -6.78 0.34 -0.20 -2.05 1.04 -1.26 0.12 113.70 104.91 1ae6 s SER 10 Ca -0.09 -0.47 -0.04 0.00 0.48 0.00 0.00 55.95 55.82 1ae6 s SER 10 Cb 0.13 0.08 0.09 0.00 0.10 0.00 0.00 66.02 66.41 1ae6 s SER 10 CO 0.84 -0.26 0.19 -0.69 0.98 0.00 0.00 173.24 174.30 1ae6 s VAL 11 N -1.34 -0.27 0.11 5.02 1.01 0.26 -4.88 120.40 120.32 1ae6 s VAL 11 Ca -0.14 -0.13 -0.28 0.00 0.00 0.00 0.00 61.98 61.43 1ae6 s VAL 11 Cb -0.09 -0.66 -0.06 0.00 0.00 0.00 0.00 36.38 35.57 1ae6 s VAL 11 CO -0.01 -0.23 0.86 -2.16 0.00 0.00 0.00 175.10 173.57 1ae6 s PRO 12 N 2.28 4.63 -0.06 2.72 0.04 -1.26 -2.44 135.00 140.91 1ae6 s PRO 12 Ca 0.06 1.28 -0.07 0.00 0.04 0.00 0.00 61.00 62.30 1ae6 s PRO 12 Cb -0.16 -3.34 0.02 0.00 0.04 0.00 0.00 34.50 31.06 1ae6 s PRO 12 CO -0.12 0.33 0.20 0.14 0.04 0.00 0.00 177.00 177.60 1ae6 s VAL 13 N -0.36 0.02 0.30 -0.36 -7.23 0.13 -4.91 120.40 107.99 1ae6 s VAL 13 Ca 0.42 -0.13 -0.23 0.00 -1.81 0.00 0.00 61.98 60.22 1ae6 s VAL 13 Cb -0.23 -0.33 -0.09 0.00 0.56 0.00 0.00 36.38 36.29 1ae6 s VAL 13 CO 0.27 -0.07 0.87 0.42 -0.31 0.00 0.00 175.10 176.28 1ae6 s THR 14 N -0.19 4.34 0.05 5.32 -4.23 -1.26 -2.65 115.64 117.02 1ae6 s THR 14 Ca -0.03 1.62 -0.34 0.00 -1.18 0.00 0.00 61.69 61.75 1ae6 s THR 14 Cb -0.03 -3.93 -0.13 0.00 1.34 0.00 0.00 72.50 69.76 1ae6 s THR 14 CO 0.01 0.12 1.69 -2.65 -0.54 0.00 0.00 174.62 173.24 1ae6 n PRO 15 N 0.50 2.08 0.00 3.99 -0.02 -1.26 -1.49 135.00 138.80 1ae6 n PRO 15 Ca 0.01 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1ae6 n PRO 15 Cb 0.51 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 1ae6 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ae6 n GLY 16 N 3.76 1.90 3.68 -1.23 0.00 -0.41 -4.90 105.19 107.99 1ae6 n GLY 16 Ca 0.19 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 1ae6 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ae6 s GLU 17 N 0.00 0.66 -0.17 1.61 2.02 -0.55 -4.13 118.70 118.13 1ae6 s GLU 17 Ca 0.00 0.65 -0.07 0.00 0.02 0.00 0.00 54.97 55.57 1ae6 s GLU 17 Cb 0.00 -1.75 -0.04 0.00 0.10 0.00 0.00 34.13 32.44 1ae6 s GLU 17 CO 0.00 -2.61 0.08 -1.54 0.02 0.00 0.00 175.26 171.21 1ae6 s SER 18 N -3.39 5.77 0.03 -0.19 1.04 -1.23 -1.43 113.70 114.31 1ae6 s SER 18 Ca 0.65 0.16 0.03 0.00 0.48 0.00 0.00 55.95 57.27 1ae6 s SER 18 Cb -0.19 -1.94 -0.04 0.00 0.10 0.00 0.00 66.02 63.95 1ae6 s SER 18 CO 0.58 0.23 -0.02 -0.22 0.98 0.00 0.00 173.24 174.78 1ae6 s LEU 19 N 0.04 3.38 -0.18 2.42 2.96 -0.69 -4.96 118.68 121.64 1ae6 s LEU 19 Ca 0.06 -0.12 -0.02 0.00 -0.22 0.00 0.00 54.13 53.84 1ae6 s LEU 19 Cb -0.12 -2.01 0.05 0.00 0.50 0.00 0.00 46.19 44.62 1ae6 s LEU 19 CO 0.01 0.24 -0.00 -0.55 -1.32 0.00 0.00 176.35 174.73 1ae6 s SER 20 N -1.78 2.93 -0.15 3.68 0.15 -1.26 -1.66 113.70 115.61 1ae6 s SER 20 Ca 0.21 -0.78 -0.06 0.00 0.70 0.00 0.00 55.95 56.02 1ae6 s SER 20 Cb -0.11 -0.75 -0.04 0.00 -1.71 0.00 0.00 66.02 63.41 1ae6 s SER 20 CO 0.12 -0.26 0.04 -0.63 1.20 0.00 0.00 173.24 173.71 1ae6 s ILE 21 N 1.74 4.58 0.07 6.45 1.01 -0.73 -4.97 121.20 129.35 1ae6 s ILE 21 Ca -0.01 -0.12 0.02 0.00 0.00 0.00 0.00 60.65 60.54 1ae6 s ILE 21 Cb -0.17 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 1ae6 s ILE 21 CO -0.07 0.51 0.11 -0.55 0.00 0.00 0.00 174.94 174.94 1ae6 s SER 22 N 0.01 5.74 0.02 3.58 0.15 -1.26 -1.29 113.70 120.64 1ae6 s SER 22 Ca 0.05 0.07 0.01 0.00 0.70 0.00 0.00 55.95 56.77 1ae6 s SER 22 Cb -0.12 -1.61 -0.02 0.00 -1.71 0.00 0.00 66.02 62.56 1ae6 s SER 22 CO 0.01 0.18 -0.04 0.00 1.20 0.00 0.00 173.24 174.58 1ae6 s ARG 24 N -1.02 0.03 0.54 0.00 3.52 0.13 -1.78 118.95 120.38 1ae6 s ARG 24 Ca -0.08 0.15 0.03 0.00 -0.13 0.00 0.00 55.73 55.69 1ae6 s ARG 24 Cb -0.07 -0.28 0.04 0.00 -1.56 0.00 0.00 34.95 33.08 1ae6 s ARG 24 CO -0.00 -0.15 0.76 -1.54 -0.81 0.00 0.00 175.30 173.56 1ae6 s SER 25 N 0.98 5.26 -0.08 -2.12 1.04 -1.15 0.89 113.70 118.53 1ae6 s SER 25 Ca -0.08 -0.14 -0.11 0.00 0.48 0.00 0.00 55.95 56.10 1ae6 s SER 25 Cb -0.12 -0.73 -0.29 0.00 0.10 0.00 0.00 66.02 64.98 1ae6 s SER 25 CO -0.03 -1.14 0.56 -1.28 0.98 0.00 0.00 173.24 172.34 1ae6 h SER 26 N 0.13 0.53 0.00 7.02 0.87 -1.57 -3.46 113.55 117.06 1ae6 h SER 26 Ca -0.41 -0.93 0.00 0.00 -1.23 0.00 0.00 61.79 59.22 1ae6 h SER 26 Cb 1.29 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 1ae6 h SER 26 CO 0.50 1.79 0.00 0.29 -0.53 0.00 0.00 176.83 178.88 1ae6 n LYS 27 N -3.61 0.00 -1.29 2.24 5.02 -1.26 -4.97 118.16 114.29 1ae6 n LYS 27 Ca -0.27 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.02 1ae6 n LYS 27 Cb 1.04 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 36.05 1ae6 n LYS 27 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ae6 n SER 27 N 0.00 0.00 0.00 4.39 2.88 -1.26 -4.76 113.62 114.87 1ae6 n SER 27 Ca 0.00 -0.68 0.00 0.00 -1.33 0.00 0.00 58.87 56.86 1ae6 n SER 27 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1ae6 n SER 27 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1ae6 n LEU 27 N 0.00 0.00 0.00 2.46 7.94 -1.26 -5.08 117.00 121.06 1ae6 n LEU 27 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1ae6 n LEU 27 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1ae6 n LEU 27 CO 0.00 0.00 -0.35 1.57 -1.11 0.00 0.00 177.39 177.50 1ae6 n HIS 27 N 1.38 0.00 0.00 1.96 -0.00 -1.05 -4.90 115.22 112.61 1ae6 n HIS 27 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1ae6 n HIS 27 Cb 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 29.99 30.13 1ae6 n HIS 27 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1ae6 n SER 27 N -2.82 0.00 0.18 0.26 2.88 -1.26 -4.85 113.62 108.01 1ae6 n SER 27 Ca 0.00 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.68 1ae6 n SER 27 Cb 0.35 0.00 0.63 0.00 -0.75 0.00 0.00 64.21 64.44 1ae6 n SER 27 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 1ae6 h ASN 28 N 0.55 0.00 0.00 -3.46 -0.00 -2.07 -3.44 115.58 107.16 1ae6 h ASN 28 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 1ae6 h ASN 28 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 1ae6 h ASN 28 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 177.43 178.04 1ae6 n GLY 29 N -0.55 0.50 3.66 1.57 0.00 -1.26 -5.09 105.19 104.03 1ae6 n GLY 29 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1ae6 n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ae6 s ASP 30 N -2.37 4.95 -0.29 1.61 1.11 -1.26 -4.97 116.67 115.44 1ae6 s ASP 30 Ca 0.00 -0.12 -0.06 0.00 0.18 0.00 0.00 52.55 52.55 1ae6 s ASP 30 Cb 0.00 -1.20 0.01 0.00 1.07 0.00 0.00 42.92 42.80 1ae6 s ASP 30 CO 0.00 0.23 0.06 -0.89 1.18 0.00 0.00 175.17 175.76 1ae6 s THR 31 N -1.16 3.84 -1.13 -1.27 2.01 -1.26 -2.53 115.64 114.13 1ae6 s THR 31 Ca 0.22 -0.74 -0.20 0.00 0.31 0.00 0.00 61.69 61.27 1ae6 s THR 31 Cb -0.11 -2.98 -0.06 0.00 0.01 0.00 0.00 72.50 69.36 1ae6 s THR 31 CO 0.13 0.09 1.93 0.49 -0.69 0.00 0.00 174.62 176.57 1ae6 n PHE 32 N 4.84 3.03 -5.02 4.92 3.01 -1.26 -3.30 117.46 123.68 1ae6 n PHE 32 Ca -0.15 -2.07 -0.30 0.00 1.01 0.00 0.00 57.45 55.94 1ae6 n PHE 32 Cb 0.48 -2.36 -0.15 0.00 -0.01 0.00 0.00 39.48 37.44 1ae6 n PHE 32 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1ae6 s LEU 33 N 5.56 2.12 -0.01 4.37 2.96 -1.26 -2.72 118.68 129.71 1ae6 s LEU 33 Ca 0.59 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.99 1ae6 s LEU 33 Cb 0.07 -1.27 -0.00 0.00 0.50 0.00 0.00 46.19 45.48 1ae6 s LEU 33 CO 0.09 0.27 -0.07 -0.31 -1.32 0.00 0.00 176.35 175.01 1ae6 s TYR 34 N -0.73 0.63 -0.09 5.38 1.51 0.49 -1.84 117.35 122.71 1ae6 s TYR 34 Ca 0.11 -0.12 0.04 0.00 -1.01 0.00 0.00 57.07 56.09 1ae6 s TYR 34 Cb -0.10 -0.41 -0.00 0.00 -0.11 0.00 0.00 41.96 41.34 1ae6 s TYR 34 CO 0.01 -0.01 -0.24 -1.58 -1.11 0.00 0.00 175.55 172.62 1ae6 s TRP 35 N -0.14 2.48 0.29 2.71 0.52 -0.88 0.27 118.94 124.19 1ae6 s TRP 35 Ca 0.02 -0.95 0.05 0.00 0.02 0.00 0.00 56.10 55.24 1ae6 s TRP 35 Cb -0.03 -1.65 -0.06 0.00 -1.15 0.00 0.00 33.47 30.58 1ae6 s TRP 35 CO -0.00 -0.37 -0.01 -0.06 0.02 0.00 0.00 176.95 176.54 1ae6 s PHE 36 N 0.23 1.90 -0.31 -1.98 0.08 0.87 -1.01 117.98 117.76 1ae6 s PHE 36 Ca -0.15 -0.83 -0.03 0.00 0.12 0.00 0.00 56.93 56.04 1ae6 s PHE 36 Cb -0.17 -1.15 0.11 0.00 -0.57 0.00 0.00 43.02 41.24 1ae6 s PHE 36 CO 0.08 0.13 0.15 -1.17 -0.10 0.00 0.00 175.22 174.31 1ae6 s LEU 37 N -3.44 0.69 0.34 -0.37 2.96 -0.76 -1.24 118.68 116.87 1ae6 s LEU 37 Ca 0.32 -1.55 -0.27 0.00 -0.22 0.00 0.00 54.13 52.41 1ae6 s LEU 37 Cb 0.06 -0.37 -0.09 0.00 0.50 0.00 0.00 46.19 46.29 1ae6 s LEU 37 CO 0.13 -0.40 1.09 -1.58 -1.32 0.00 0.00 176.35 174.26 1ae6 s GLN 38 N 1.80 4.38 -0.45 1.98 0.74 -0.87 -2.75 119.66 124.49 1ae6 s GLN 38 Ca 0.12 1.69 0.07 0.00 0.05 0.00 0.00 55.36 57.29 1ae6 s GLN 38 Cb -0.18 -2.87 0.30 0.00 1.10 0.00 0.00 33.01 31.36 1ae6 s GLN 38 CO -0.26 0.01 0.95 -2.13 -0.55 0.00 0.00 175.29 173.31 1ae6 n ARG 39 N 0.55 0.92 0.00 1.67 0.63 -1.25 -2.60 116.66 116.57 1ae6 n ARG 39 Ca 0.02 -2.19 0.00 0.00 -0.92 0.00 0.00 57.85 54.76 1ae6 n ARG 39 Cb 0.47 -1.27 0.00 0.00 0.45 0.00 0.00 32.46 32.11 1ae6 n ARG 39 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1ae6 n PRO 40 N 0.79 3.18 -0.58 -0.14 -0.04 -1.26 -4.00 135.00 132.95 1ae6 n PRO 40 Ca 0.11 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.65 1ae6 n PRO 40 Cb 0.66 -0.94 0.31 0.00 -0.04 0.00 0.00 33.50 33.50 1ae6 n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ae6 n GLY 41 N 2.64 3.27 3.86 0.55 0.00 -1.26 -4.91 105.19 109.34 1ae6 n GLY 41 Ca 0.00 -0.89 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 1ae6 n GLY 41 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ae6 s GLN 42 N -2.34 2.38 0.18 1.61 0.74 -1.26 -5.13 119.66 115.85 1ae6 s GLN 42 Ca 0.46 -1.74 -0.09 0.00 0.05 0.00 0.00 55.36 54.04 1ae6 s GLN 42 Cb 0.33 -2.22 -0.07 0.00 1.10 0.00 0.00 33.01 32.15 1ae6 s GLN 42 CO 0.16 -0.32 0.48 -1.54 -0.55 0.00 0.00 175.29 173.52 1ae6 s SER 43 N -4.14 6.61 0.67 6.67 1.04 -1.26 -3.93 113.70 119.35 1ae6 s SER 43 Ca 0.43 0.83 -0.17 0.00 0.48 0.00 0.00 55.95 57.52 1ae6 s SER 43 Cb -0.02 -2.19 -0.01 0.00 0.10 0.00 0.00 66.02 63.90 1ae6 s SER 43 CO 0.25 0.01 1.10 -2.65 0.98 0.00 0.00 173.24 172.93 1ae6 n PRO 44 N 0.13 0.82 -4.41 4.02 -0.02 -1.26 -4.49 135.00 129.79 1ae6 n PRO 44 Ca -0.02 0.33 -0.21 0.00 -2.02 0.00 0.00 63.50 61.59 1ae6 n PRO 44 Cb 0.52 -2.33 -0.16 0.00 -0.02 0.00 0.00 33.50 31.51 1ae6 n PRO 44 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1ae6 s GLN 45 N -3.23 1.03 0.08 -0.52 -2.07 -1.11 -4.81 119.66 109.03 1ae6 s GLN 45 Ca 0.78 -0.31 -0.31 0.00 -1.82 0.00 0.00 55.36 53.70 1ae6 s GLN 45 Cb -0.37 -0.95 -0.09 0.00 -1.09 0.00 0.00 33.01 30.51 1ae6 s GLN 45 CO 0.45 0.10 1.63 -1.17 -1.32 0.00 0.00 175.29 174.99 1ae6 s LEU 46 N 0.26 4.37 -0.21 2.60 2.96 -1.26 -1.82 118.68 125.58 1ae6 s LEU 46 Ca -0.04 2.50 -0.12 0.00 -0.22 0.00 0.00 54.13 56.25 1ae6 s LEU 46 Cb -0.09 -3.57 -0.09 0.00 0.50 0.00 0.00 46.19 42.94 1ae6 s LEU 46 CO 0.01 -0.87 -0.29 0.18 -1.32 0.00 0.00 176.35 174.05 1ae6 n LEU 47 N 5.31 1.65 -3.82 -0.68 4.77 -0.18 -4.76 117.00 119.29 1ae6 n LEU 47 Ca 0.15 0.28 -0.16 0.00 -0.03 0.00 0.00 56.01 56.26 1ae6 n LEU 47 Cb 0.40 -0.67 -0.16 0.00 -2.33 0.00 0.00 43.42 40.66 1ae6 n LEU 47 CO 0.62 0.30 -0.37 -0.63 -1.33 0.00 0.00 177.39 175.98 1ae6 s ILE 48 N -2.49 0.11 0.20 -0.08 1.01 -1.22 -1.27 121.20 117.46 1ae6 s ILE 48 Ca -0.30 0.10 0.10 0.00 0.00 0.00 0.00 60.65 60.55 1ae6 s ILE 48 Cb 0.10 -0.20 -0.04 0.00 0.01 0.00 0.00 42.46 42.33 1ae6 s ILE 48 CO 0.39 0.12 -0.13 -0.72 0.00 0.00 0.00 174.94 174.59 1ae6 s TYR 49 N 0.89 2.52 -1.56 3.97 -0.85 0.73 -2.07 117.35 120.99 1ae6 s TYR 49 Ca -0.08 -0.27 -0.15 0.00 -0.52 0.00 0.00 57.07 56.05 1ae6 s TYR 49 Cb -0.12 -1.21 0.10 0.00 0.38 0.00 0.00 41.96 41.11 1ae6 s TYR 49 CO -0.02 0.54 0.97 0.54 -1.52 0.00 0.00 175.55 176.06 1ae6 n ARG 50 N -0.08 -5.24 0.00 -3.49 1.74 -0.77 -1.61 116.66 107.21 1ae6 n ARG 50 Ca -0.10 0.57 0.00 0.00 -0.77 0.00 0.00 57.85 57.55 1ae6 n ARG 50 Cb 0.56 -5.45 0.00 0.00 -1.02 0.00 0.00 32.46 26.56 1ae6 n ARG 50 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 1ae6 n MET 51 N -4.66 0.00 -0.68 5.56 0.00 -0.93 -4.33 117.12 112.08 1ae6 n MET 51 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 57.70 57.76 1ae6 n MET 51 Cb 0.52 0.00 0.20 0.00 0.00 0.00 0.00 33.22 33.94 1ae6 n MET 51 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1ae6 n SER 52 N 1.46 2.32 -4.04 6.12 7.64 -1.24 -4.02 113.62 121.87 1ae6 n SER 52 Ca 0.00 -3.73 -0.32 0.00 1.01 0.00 0.00 58.87 55.84 1ae6 n SER 52 Cb 0.00 -0.59 -0.15 0.00 -1.01 0.00 0.00 64.21 62.46 1ae6 n SER 52 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1ae6 s ASN 53 N -2.73 3.93 -0.25 6.43 -0.87 -0.64 -4.87 114.94 115.94 1ae6 s ASN 53 Ca 0.42 -1.14 -0.29 0.00 -1.57 0.00 0.00 52.86 50.28 1ae6 s ASN 53 Cb 0.38 -1.42 -0.03 0.00 -0.02 0.00 0.00 41.25 40.17 1ae6 s ASN 53 CO -0.02 -0.16 1.76 -0.22 -2.57 0.00 0.00 177.10 175.90 1ae6 s LEU 54 N 1.23 3.71 1.36 0.60 2.96 -1.26 -0.19 118.68 127.10 1ae6 s LEU 54 Ca -0.05 1.56 -0.20 0.00 -0.22 0.00 0.00 54.13 55.22 1ae6 s LEU 54 Cb -0.18 -3.53 0.34 0.00 0.50 0.00 0.00 46.19 43.32 1ae6 s LEU 54 CO -0.07 -1.50 0.85 0.00 -1.32 0.00 0.00 176.35 174.31 1ae6 n ALA 55 N 9.45 -4.31 -1.77 5.97 0.00 -0.40 -4.93 120.51 124.52 1ae6 n ALA 55 Ca 0.22 -1.68 -0.34 0.00 0.00 0.00 0.00 53.44 51.63 1ae6 n ALA 55 Cb 0.46 -1.66 -0.02 0.00 0.00 0.00 0.00 19.45 18.23 1ae6 n ALA 55 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ae6 s SER 56 N -2.77 6.12 0.00 0.00 0.15 -1.26 -3.42 113.70 112.52 1ae6 s SER 56 Ca 0.66 1.98 0.00 0.00 0.70 0.00 0.00 55.95 59.28 1ae6 s SER 56 Cb -0.16 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.59 1ae6 s SER 56 CO 0.58 -0.94 0.00 0.61 1.20 0.00 0.00 173.24 174.69 1ae6 n GLY 57 N -0.23 2.27 3.70 9.45 0.00 -1.26 -4.96 105.19 114.16 1ae6 n GLY 57 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1ae6 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ae6 s VAL 58 N -0.55 3.73 0.87 1.61 1.01 -1.22 -5.00 120.40 120.86 1ae6 s VAL 58 Ca 0.00 1.16 -0.13 0.00 0.00 0.00 0.00 61.98 63.01 1ae6 s VAL 58 Cb 0.00 -3.74 0.06 0.00 0.00 0.00 0.00 36.38 32.69 1ae6 s VAL 58 CO 0.00 0.03 0.77 -2.65 0.00 0.00 0.00 175.10 173.25 1ae6 n PRO 59 N 4.93 -0.11 0.20 2.72 -0.02 -1.26 -4.88 135.00 136.58 1ae6 n PRO 59 Ca 0.12 0.03 0.14 0.00 -2.02 0.00 0.00 63.50 61.77 1ae6 n PRO 59 Cb 0.44 -2.10 0.69 0.00 -0.02 0.00 0.00 33.50 32.51 1ae6 n PRO 59 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1ae6 h ASP 60 N -1.27 0.00 1.92 2.55 3.58 -2.00 -3.13 116.42 118.08 1ae6 h ASP 60 Ca -0.44 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.00 1ae6 h ASP 60 Cb 1.29 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.34 1ae6 h ASP 60 CO 0.40 0.00 -0.08 0.08 -2.88 0.00 0.00 179.24 176.76 1ae6 h ARG 61 N 0.00 0.00 -7.02 0.28 0.11 -1.93 -3.46 114.38 102.36 1ae6 h ARG 61 Ca 0.00 0.00 -0.46 0.00 0.10 0.00 0.00 59.98 59.62 1ae6 h ARG 61 Cb 0.18 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.25 1ae6 h ARG 61 CO 0.00 0.04 0.30 -0.06 0.10 0.00 0.00 179.97 180.35 1ae6 s PHE 62 N -3.19 3.35 -0.29 4.08 0.40 -1.19 -1.48 117.98 119.66 1ae6 s PHE 62 Ca 0.06 1.50 -0.15 0.00 -0.60 0.00 0.00 56.93 57.75 1ae6 s PHE 62 Cb 0.05 -2.77 0.10 0.00 0.51 0.00 0.00 43.02 40.91 1ae6 s PHE 62 CO 0.68 -0.13 0.69 -1.54 0.70 0.00 0.00 175.22 175.63 1ae6 s SER 63 N -2.40 -0.98 -0.12 1.36 1.04 0.19 -4.95 113.70 107.84 1ae6 s SER 63 Ca 0.60 1.50 -0.06 0.00 0.48 0.00 0.00 55.95 58.47 1ae6 s SER 63 Cb -0.09 1.60 -0.04 0.00 0.10 0.00 0.00 66.02 67.59 1ae6 s SER 63 CO 0.18 -0.23 0.10 -0.83 0.98 0.00 0.00 173.24 173.43 1ae6 s GLY 64 N 1.94 2.05 0.21 7.32 0.00 -1.26 -0.66 107.32 116.92 1ae6 s GLY 64 Ca -0.09 -0.70 -0.17 0.00 0.00 0.00 0.00 44.72 43.76 1ae6 s GLY 64 CO -0.20 -0.38 0.54 -1.35 0.00 0.00 0.00 173.10 171.72 1ae6 s SER 65 N -0.82 -0.23 0.00 1.64 1.04 -0.65 -4.35 113.70 110.32 1ae6 s SER 65 Ca 0.13 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.99 1ae6 s SER 65 Cb -0.12 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.60 1ae6 s SER 65 CO 0.03 -1.11 0.00 0.61 0.98 0.00 0.00 173.24 173.75 1ae6 n GLY 66 N -0.36 0.91 3.63 7.32 0.00 -1.26 0.34 105.19 115.77 1ae6 n GLY 66 Ca -0.08 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 43.85 1ae6 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ae6 s SER 67 N -2.31 -0.41 0.24 1.61 1.04 -0.36 -4.98 113.70 108.53 1ae6 s SER 67 Ca 0.00 0.74 0.00 0.00 0.48 0.00 0.00 55.95 57.17 1ae6 s SER 67 Cb 0.00 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1ae6 s SER 67 CO 0.00 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.66 1ae6 n GLY 68 N 1.94 1.50 0.01 7.32 0.00 -1.26 -2.68 105.19 112.03 1ae6 n GLY 68 Ca -0.12 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1ae6 n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ae6 n THR 69 N 0.00 0.00 -3.55 2.61 -2.24 -1.26 -4.62 114.28 105.22 1ae6 n THR 69 Ca 0.00 -0.49 -0.41 0.00 -2.27 0.00 0.00 64.05 60.89 1ae6 n THR 69 Cb 0.00 1.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.13 1ae6 n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ae6 s ALA 70 N -0.82 3.41 0.03 6.98 0.00 -1.09 -2.93 121.76 127.34 1ae6 s ALA 70 Ca 0.01 -1.54 0.08 0.00 0.00 0.00 0.00 51.96 50.50 1ae6 s ALA 70 Cb 0.01 -2.67 -0.03 0.00 0.00 0.00 0.00 23.12 20.44 1ae6 s ALA 70 CO 0.03 -1.18 -0.24 -0.06 0.00 0.00 0.00 175.76 174.31 1ae6 s PHE 71 N 1.66 2.09 -0.04 0.00 0.08 -0.73 -1.23 117.98 119.81 1ae6 s PHE 71 Ca 0.05 -0.40 -0.02 0.00 0.12 0.00 0.00 56.93 56.68 1ae6 s PHE 71 Cb -0.18 -1.27 0.03 0.00 -0.57 0.00 0.00 43.02 41.03 1ae6 s PHE 71 CO 0.09 0.08 0.06 0.99 -0.10 0.00 0.00 175.22 176.34 1ae6 s THR 72 N -0.74 -0.11 0.12 0.64 2.01 0.15 -1.06 115.64 116.65 1ae6 s THR 72 Ca 0.10 0.42 -0.14 0.00 0.31 0.00 0.00 61.69 62.38 1ae6 s THR 72 Cb -0.09 -0.15 -0.07 0.00 0.01 0.00 0.00 72.50 72.20 1ae6 s THR 72 CO 0.01 0.18 0.51 -0.22 -0.69 0.00 0.00 174.62 174.41 1ae6 s LEU 73 N 2.12 4.36 -0.08 4.42 2.96 -0.41 -1.64 118.68 130.41 1ae6 s LEU 73 Ca 0.04 1.02 -0.03 0.00 -0.22 0.00 0.00 54.13 54.94 1ae6 s LEU 73 Cb -0.12 -3.14 0.05 0.00 0.50 0.00 0.00 46.19 43.48 1ae6 s LEU 73 CO -0.03 0.14 0.16 -0.13 -1.32 0.00 0.00 176.35 175.17 1ae6 s ARG 74 N -1.83 0.04 -0.23 1.98 0.52 0.17 -1.77 118.95 117.82 1ae6 s ARG 74 Ca 0.35 0.53 -0.09 0.00 -0.52 0.00 0.00 55.73 56.00 1ae6 s ARG 74 Cb -0.15 -0.26 -0.04 0.00 0.52 0.00 0.00 34.95 35.02 1ae6 s ARG 74 CO 0.19 -0.28 0.12 0.08 0.02 0.00 0.00 175.30 175.42 1ae6 s VAL 75 N 2.08 4.99 -0.00 3.52 1.01 -0.66 -0.64 120.40 130.70 1ae6 s VAL 75 Ca 0.01 0.05 -0.21 0.00 0.00 0.00 0.00 61.98 61.83 1ae6 s VAL 75 Cb -0.12 -3.32 -0.12 0.00 0.00 0.00 0.00 36.38 32.83 1ae6 s VAL 75 CO -0.06 0.36 0.93 0.28 0.00 0.00 0.00 175.10 176.61 1ae6 h SER 76 N 7.59 -0.64 -3.62 3.32 0.02 -1.56 -1.85 113.55 116.80 1ae6 h SER 76 Ca -0.37 0.02 -0.67 0.00 -0.84 0.00 0.00 61.79 59.93 1ae6 h SER 76 Cb 1.17 0.17 -0.36 0.00 0.14 0.00 0.00 62.40 63.52 1ae6 h SER 76 CO 0.63 -0.29 -0.81 -0.60 -1.14 0.00 0.00 176.83 174.63 1ae6 s ARG 77 N -4.08 2.50 -0.11 3.45 3.52 -1.26 -3.48 118.95 119.50 1ae6 s ARG 77 Ca -0.11 -1.18 -0.30 0.00 -0.13 0.00 0.00 55.73 54.02 1ae6 s ARG 77 Cb 0.01 -2.83 -0.03 0.00 -1.56 0.00 0.00 34.95 30.54 1ae6 s ARG 77 CO 0.33 -0.46 1.39 0.08 -0.81 0.00 0.00 175.30 175.83 1ae6 s VAL 78 N 1.18 4.00 0.33 7.11 1.01 -0.51 -4.78 120.40 128.74 1ae6 s VAL 78 Ca -0.04 1.25 0.09 0.00 0.00 0.00 0.00 61.98 63.27 1ae6 s VAL 78 Cb -0.18 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 1ae6 s VAL 78 CO -0.07 -0.09 0.07 -1.61 0.00 0.00 0.00 175.10 173.40 1ae6 s GLU 79 N 3.44 2.25 0.34 2.72 2.02 -1.26 -1.29 118.70 126.92 1ae6 s GLU 79 Ca 0.61 -1.61 0.07 0.00 0.02 0.00 0.00 54.97 54.07 1ae6 s GLU 79 Cb -0.26 -2.08 0.76 0.00 0.10 0.00 0.00 34.13 32.65 1ae6 s GLU 79 CO 0.21 0.16 1.87 0.00 0.02 0.00 0.00 175.26 177.51 1ae6 h ALA 80 N 1.70 1.76 -0.74 5.21 0.00 -1.99 -2.48 119.26 122.72 1ae6 h ALA 80 Ca -0.43 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.46 1ae6 h ALA 80 Cb 1.25 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1ae6 h ALA 80 CO 0.64 -0.00 0.32 0.93 0.00 0.00 0.00 179.25 181.14 1ae6 h GLU 81 N 0.76 1.08 0.00 0.00 5.08 -2.01 -2.90 114.58 116.59 1ae6 h GLU 81 Ca 0.45 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1ae6 h GLU 81 Cb 0.65 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1ae6 h GLU 81 CO -0.21 0.86 0.12 -0.25 -1.00 0.00 0.00 179.01 178.52 1ae6 n ASP 82 N -4.30 0.11 -4.75 1.42 8.00 -0.93 -4.73 116.55 111.37 1ae6 n ASP 82 Ca 0.07 0.46 -0.41 0.00 0.71 0.00 0.00 54.79 55.61 1ae6 n ASP 82 Cb 0.16 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.12 40.78 1ae6 n ASP 82 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ae6 s VAL 83 N -2.95 2.15 -5.00 2.53 1.01 -1.10 -4.87 120.40 112.18 1ae6 s VAL 83 Ca -0.00 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1ae6 s VAL 83 Cb 0.01 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.31 1ae6 s VAL 83 CO 0.04 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1ae6 n GLY 84 N 2.24 -1.04 3.71 4.51 0.00 -1.25 -4.74 105.19 108.62 1ae6 n GLY 84 Ca 0.08 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 44.18 1ae6 n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ae6 s VAL 85 N -2.01 5.19 -0.20 1.61 1.01 -1.07 -0.88 120.40 124.05 1ae6 s VAL 85 Ca 0.00 0.92 -0.08 0.00 0.00 0.00 0.00 61.98 62.82 1ae6 s VAL 85 Cb 0.00 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1ae6 s VAL 85 CO 0.00 0.31 0.09 -0.31 0.00 0.00 0.00 175.10 175.19 1ae6 s TYR 86 N 0.75 3.26 -0.12 5.22 1.51 0.08 -2.05 117.35 126.00 1ae6 s TYR 86 Ca 0.25 0.07 -0.00 0.00 -1.01 0.00 0.00 57.07 56.38 1ae6 s TYR 86 Cb -0.15 -2.14 -0.02 0.00 -0.11 0.00 0.00 41.96 39.54 1ae6 s TYR 86 CO 0.10 0.10 -0.10 0.71 -1.11 0.00 0.00 175.55 175.24 1ae6 s TYR 87 N 0.62 2.86 -0.18 2.71 2.02 -0.37 -2.44 117.35 122.57 1ae6 s TYR 87 Ca 0.05 -0.43 -0.02 0.00 -0.37 0.00 0.00 57.07 56.29 1ae6 s TYR 87 Cb -0.13 -1.83 -0.01 0.00 -0.40 0.00 0.00 41.96 39.59 1ae6 s TYR 87 CO 0.01 -0.06 -0.09 0.00 -1.57 0.00 0.00 175.55 173.84 1ae6 s MET 89 N 0.98 0.66 0.11 0.00 0.00 0.14 -0.60 119.30 120.60 1ae6 s MET 89 Ca -0.01 -0.42 -0.07 0.00 0.00 0.00 0.00 55.69 55.18 1ae6 s MET 89 Cb -0.15 -0.61 -0.06 0.00 0.00 0.00 0.00 34.83 34.02 1ae6 s MET 89 CO -0.01 0.16 0.39 -1.14 0.00 0.00 0.00 175.02 174.43 1ae6 s GLN 90 N -0.54 3.69 -0.37 4.11 -0.44 -0.93 -0.38 119.66 124.80 1ae6 s GLN 90 Ca 0.01 0.06 0.13 0.00 -2.50 0.00 0.00 55.36 53.05 1ae6 s GLN 90 Cb -0.05 -2.91 0.44 0.00 -1.64 0.00 0.00 33.01 28.85 1ae6 s GLN 90 CO 0.00 0.50 0.99 1.58 0.50 0.00 0.00 175.29 178.87 1ae6 n HIS 91 N 0.48 1.97 -0.00 1.67 -0.00 -1.10 -3.91 115.22 114.33 1ae6 n HIS 91 Ca -0.05 -2.99 -0.01 0.00 0.46 0.00 0.00 57.72 55.13 1ae6 n HIS 91 Cb 0.52 -0.28 -0.00 0.00 -0.12 0.00 0.00 29.99 30.11 1ae6 n HIS 91 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 1ae6 n LEU 92 N -0.19 0.40 -5.02 0.27 7.94 -1.26 -4.92 117.00 114.21 1ae6 n LEU 92 Ca 0.21 0.06 -0.18 0.00 -1.11 0.00 0.00 56.01 54.99 1ae6 n LEU 92 Cb 0.74 -0.29 0.02 0.00 0.53 0.00 0.00 43.42 44.42 1ae6 n LEU 92 CO 0.29 -0.51 0.21 -1.61 -1.11 0.00 0.00 177.39 174.65 1ae6 s GLU 93 N -1.37 2.68 -0.09 1.96 2.02 -1.26 -5.09 118.70 117.55 1ae6 s GLU 93 Ca -0.03 -1.34 -0.01 0.00 0.02 0.00 0.00 54.97 53.60 1ae6 s GLU 93 Cb 0.00 -2.73 -0.03 0.00 0.10 0.00 0.00 34.13 31.48 1ae6 s GLU 93 CO 0.05 -0.44 -0.04 0.71 0.02 0.00 0.00 175.26 175.56 1ae6 s TYR 94 N -2.44 3.02 0.78 1.61 1.51 -1.26 -3.72 117.35 116.85 1ae6 s TYR 94 Ca 0.57 0.03 -0.09 0.00 -1.01 0.00 0.00 57.07 56.56 1ae6 s TYR 94 Cb -0.09 -1.77 0.09 0.00 -0.11 0.00 0.00 41.96 40.08 1ae6 s TYR 94 CO 0.35 0.32 1.11 -1.25 -1.11 0.00 0.00 175.55 174.97 1ae6 s PRO 95 N -0.65 1.83 0.05 -1.71 0.04 -1.26 -4.36 135.00 128.94 1ae6 s PRO 95 Ca 0.10 -0.25 -0.30 0.00 0.04 0.00 0.00 61.00 60.59 1ae6 s PRO 95 Cb -0.12 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 1ae6 s PRO 95 CO 0.02 -1.55 1.13 -0.06 0.04 0.00 0.00 177.00 176.58 1ae6 s PHE 96 N -3.44 3.51 0.02 0.56 0.08 -1.24 -4.67 117.98 112.80 1ae6 s PHE 96 Ca 0.63 1.43 0.03 0.00 0.12 0.00 0.00 56.93 59.15 1ae6 s PHE 96 Cb -0.09 -3.33 -0.04 0.00 -0.57 0.00 0.00 43.02 38.99 1ae6 s PHE 96 CO 0.47 -0.89 -0.04 0.95 -0.10 0.00 0.00 175.22 175.62 1ae6 s THR 97 N 0.98 3.85 -0.07 0.64 -4.23 -1.25 -5.01 115.64 110.55 1ae6 s THR 97 Ca 0.56 -0.80 0.02 0.00 -1.18 0.00 0.00 61.69 60.30 1ae6 s THR 97 Cb -0.27 -2.73 -0.02 0.00 1.34 0.00 0.00 72.50 70.82 1ae6 s THR 97 CO 0.29 0.32 -0.13 -0.36 -0.54 0.00 0.00 174.62 174.20 1ae6 s PHE 98 N -1.10 2.76 0.83 3.99 0.40 -1.26 -2.19 117.98 121.42 1ae6 s PHE 98 Ca 0.20 -0.21 -0.11 0.00 -0.60 0.00 0.00 56.93 56.21 1ae6 s PHE 98 Cb -0.11 -1.68 0.09 0.00 0.51 0.00 0.00 43.02 41.83 1ae6 s PHE 98 CO 0.11 0.14 1.10 0.20 0.70 0.00 0.00 175.22 177.47 1ae6 s GLY 99 N -0.55 1.66 0.12 4.36 0.00 0.23 -4.68 107.32 108.47 1ae6 s GLY 99 Ca 0.08 0.25 -0.32 0.00 0.00 0.00 0.00 44.72 44.73 1ae6 s GLY 99 CO 0.01 0.65 1.57 0.00 0.00 0.00 0.00 173.10 175.33 1ae6 h ALA 100 N -1.38 -0.78 0.00 3.20 0.00 -1.89 -3.44 119.26 114.98 1ae6 h ALA 100 Ca -0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1ae6 h ALA 100 Cb 1.25 0.89 0.00 0.00 0.00 0.00 0.00 17.79 19.93 1ae6 h ALA 100 CO 0.50 -1.03 0.00 0.41 0.00 0.00 0.00 179.25 179.14 1ae6 n GLY 101 N -1.45 3.29 3.44 0.00 0.00 -1.26 -5.04 105.19 104.17 1ae6 n GLY 101 Ca -0.06 -0.82 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 1ae6 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ae6 s THR 102 N 0.00 4.43 0.15 2.61 2.01 -1.02 -4.55 115.64 119.26 1ae6 s THR 102 Ca 0.00 -0.28 -0.17 0.00 0.31 0.00 0.00 61.69 61.54 1ae6 s THR 102 Cb 0.00 -3.16 -0.07 0.00 0.01 0.00 0.00 72.50 69.28 1ae6 s THR 102 CO 0.00 0.22 0.61 -0.75 -0.69 0.00 0.00 174.62 174.01 1ae6 s LYS 103 N 1.61 4.13 -0.31 4.92 2.20 0.33 -0.74 119.74 131.89 1ae6 s LYS 103 Ca 0.05 0.69 -0.09 0.00 -0.36 0.00 0.00 55.97 56.26 1ae6 s LYS 103 Cb -0.16 -3.00 -0.00 0.00 -1.51 0.00 0.00 37.83 33.15 1ae6 s LYS 103 CO 0.05 0.50 0.14 -1.17 -0.36 0.00 0.00 175.35 174.50 1ae6 s LEU 104 N -1.73 4.08 0.13 5.43 0.20 -0.06 -0.58 118.68 126.16 1ae6 s LEU 104 Ca 0.37 -0.58 0.04 0.00 0.69 0.00 0.00 54.13 54.65 1ae6 s LEU 104 Cb -0.17 -1.98 -0.04 0.00 -0.43 0.00 0.00 46.19 43.58 1ae6 s LEU 104 CO 0.20 -0.20 0.12 -1.61 -0.29 0.00 0.00 176.35 174.57 1ae6 s GLU 105 N 1.59 2.92 -0.05 1.98 2.02 -1.02 -3.76 118.70 122.37 1ae6 s GLU 105 Ca 0.04 -0.79 -0.13 0.00 0.02 0.00 0.00 54.97 54.12 1ae6 s GLU 105 Cb -0.17 -2.69 -0.05 0.00 0.10 0.00 0.00 34.13 31.32 1ae6 s GLU 105 CO 0.05 0.52 0.32 -0.51 0.02 0.00 0.00 175.26 175.66 1ae6 s LEU 106 N -2.85 4.42 0.42 1.80 1.02 -1.26 -0.69 118.68 121.54 1ae6 s LEU 106 Ca 0.31 0.77 0.01 0.00 0.02 0.00 0.00 54.13 55.23 1ae6 s LEU 106 Cb -0.11 -2.42 -0.01 0.00 0.02 0.00 0.00 46.19 43.67 1ae6 s LEU 106 CO 0.23 0.32 0.63 -0.54 0.02 0.00 0.00 176.35 177.01 1ae6 s LYS 106 N -0.85 3.20 0.00 1.70 1.02 -1.08 -4.82 119.74 118.90 1ae6 s LYS 106 Ca 0.20 -0.45 0.00 0.00 0.02 0.00 0.00 55.97 55.74 1ae6 s LYS 106 Cb -0.15 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.57 1ae6 s LYS 106 CO 0.10 -0.13 0.00 2.89 -0.92 0.00 0.00 175.35 177.28 1ae6 n ARG 107 N -1.98 -2.30 -2.27 1.68 1.85 -1.26 -4.72 116.66 107.66 1ae6 n ARG 107 Ca -0.00 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.49 1ae6 n ARG 107 Cb 0.57 0.00 -0.00 0.00 -1.05 0.00 0.00 32.46 31.98 1ae6 n ARG 107 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ae6 s ALA 108 N -1.63 2.80 0.34 2.89 0.00 -1.26 -4.98 121.76 119.92 1ae6 s ALA 108 Ca 0.00 0.86 -0.28 0.00 0.00 0.00 0.00 51.96 52.53 1ae6 s ALA 108 Cb 0.00 -3.36 -0.10 0.00 0.00 0.00 0.00 23.12 19.65 1ae6 s ALA 108 CO 0.00 -0.71 1.30 -0.51 0.00 0.00 0.00 175.76 175.85 1ae6 s ASP 109 N -1.63 6.73 0.07 0.00 1.01 -1.26 -4.87 116.67 116.72 1ae6 s ASP 109 Ca 0.69 2.68 0.05 0.00 0.71 0.00 0.00 52.55 56.68 1ae6 s ASP 109 Cb -0.25 -2.65 -0.03 0.00 1.01 0.00 0.00 42.92 41.00 1ae6 s ASP 109 CO 0.29 -0.56 -0.14 0.00 0.21 0.00 0.00 175.17 174.97 1ae6 s ALA 110 N -1.16 1.12 0.03 5.23 0.00 -1.08 -4.96 121.76 120.94 1ae6 s ALA 110 Ca 0.50 -0.96 -0.15 0.00 0.00 0.00 0.00 51.96 51.35 1ae6 s ALA 110 Cb -0.39 -0.10 -0.06 0.00 0.00 0.00 0.00 23.12 22.57 1ae6 s ALA 110 CO 0.52 0.16 0.44 0.00 0.00 0.00 0.00 175.76 176.88 1ae6 s ALA 111 N -1.23 3.68 0.00 0.00 0.00 -1.26 -2.93 121.76 120.02 1ae6 s ALA 111 Ca -0.02 -0.18 -0.30 0.00 0.00 0.00 0.00 51.96 51.46 1ae6 s ALA 111 Cb -0.10 -2.43 -0.06 0.00 0.00 0.00 0.00 23.12 20.54 1ae6 s ALA 111 CO 0.02 0.47 1.50 -1.25 0.00 0.00 0.00 175.76 176.50 1ae6 s PRO 112 N -1.18 4.24 -1.34 0.00 0.04 -1.25 -4.60 135.00 130.92 1ae6 s PRO 112 Ca 0.26 2.08 -0.12 0.00 0.04 0.00 0.00 61.00 63.26 1ae6 s PRO 112 Cb -0.17 -3.65 0.11 0.00 0.04 0.00 0.00 34.50 30.83 1ae6 s PRO 112 CO 0.15 -0.66 1.93 2.41 0.04 0.00 0.00 177.00 180.87 1ae6 n THR 113 N 4.84 3.98 -1.70 1.26 -1.04 -1.26 -4.86 114.28 115.50 1ae6 n THR 113 Ca 0.14 -3.92 -0.38 0.00 -2.04 0.00 0.00 64.05 57.86 1ae6 n THR 113 Cb 0.43 -2.46 0.06 0.00 -1.82 0.00 0.00 70.33 66.54 1ae6 n THR 113 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1ae6 n VAL 114 N 4.41 4.41 -3.72 12.58 0.31 -1.25 -2.91 118.33 132.16 1ae6 n VAL 114 Ca 0.45 -0.50 -0.13 0.00 -0.01 0.00 0.00 64.34 64.14 1ae6 n VAL 114 Cb 0.39 -1.44 -0.09 0.00 -0.91 0.00 0.00 33.84 31.79 1ae6 n VAL 114 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1ae6 s SER 115 N -1.25 -0.45 -0.05 4.52 0.01 0.35 -4.94 113.70 111.90 1ae6 s SER 115 Ca 0.79 0.82 0.04 0.00 1.31 0.00 0.00 55.95 58.90 1ae6 s SER 115 Cb -0.40 0.84 0.00 0.00 0.21 0.00 0.00 66.02 66.67 1ae6 s SER 115 CO 0.44 -0.20 -0.16 -0.51 0.41 0.00 0.00 173.24 173.22 1ae6 s ILE 116 N 0.03 1.35 -0.06 1.44 2.07 -1.26 0.42 121.20 125.18 1ae6 s ILE 116 Ca -0.02 -0.66 0.03 0.00 -1.41 0.00 0.00 60.65 58.60 1ae6 s ILE 116 Cb -0.03 -1.17 0.00 0.00 0.13 0.00 0.00 42.46 41.39 1ae6 s ILE 116 CO 0.01 0.39 -0.17 -0.36 -1.91 0.00 0.00 174.94 172.91 1ae6 s PHE 117 N 0.16 1.82 0.65 3.50 0.40 0.21 -4.99 117.98 119.73 1ae6 s PHE 117 Ca -0.06 -0.64 -0.13 0.00 -0.60 0.00 0.00 56.93 55.50 1ae6 s PHE 117 Cb -0.12 -1.26 -0.01 0.00 0.51 0.00 0.00 43.02 42.14 1ae6 s PHE 117 CO 0.03 -0.27 1.06 -2.14 0.70 0.00 0.00 175.22 174.60 1ae6 s PRO 118 N 0.34 3.10 0.39 0.24 0.02 -1.26 -1.89 135.00 135.94 1ae6 s PRO 118 Ca -0.11 1.09 -0.26 0.00 0.02 0.00 0.00 61.00 61.73 1ae6 s PRO 118 Cb -0.15 -2.01 -0.11 0.00 0.02 0.00 0.00 34.50 32.26 1ae6 s PRO 118 CO 0.04 -0.98 1.26 -2.30 -0.33 0.00 0.00 177.00 174.69 1ae6 n PRO 119 N -2.61 1.96 -2.32 5.54 -0.02 -1.20 -4.84 135.00 131.52 1ae6 n PRO 119 Ca 0.08 0.69 -0.36 0.00 -2.02 0.00 0.00 63.50 61.89 1ae6 n PRO 119 Cb 0.53 -2.34 -0.01 0.00 -0.02 0.00 0.00 33.50 31.66 1ae6 n PRO 119 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1ae6 s SER 120 N -0.47 6.10 0.35 2.55 0.01 -1.26 -4.91 113.70 116.08 1ae6 s SER 120 Ca 0.59 2.20 0.08 0.00 1.31 0.00 0.00 55.95 60.13 1ae6 s SER 120 Cb -0.53 -2.59 0.79 0.00 0.21 0.00 0.00 66.02 63.90 1ae6 s SER 120 CO 0.59 -0.96 1.89 0.28 0.41 0.00 0.00 173.24 175.45 1ae6 h SER 121 N 1.77 0.67 -0.13 2.44 0.02 -2.00 -1.58 113.55 114.74 1ae6 h SER 121 Ca -0.49 0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 60.33 1ae6 h SER 121 Cb 1.25 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 1ae6 h SER 121 CO 0.59 0.36 -0.46 -0.33 -1.14 0.00 0.00 176.83 175.85 1ae6 h GLU 122 N 0.72 0.69 -0.30 3.45 5.08 -2.00 -2.96 114.58 119.26 1ae6 h GLU 122 Ca 0.42 -0.39 -0.16 0.00 -1.00 0.00 0.00 59.36 58.24 1ae6 h GLU 122 Cb 0.61 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1ae6 h GLU 122 CO -0.18 1.00 -0.44 0.37 -1.00 0.00 0.00 179.01 178.76 1ae6 h GLN 123 N 0.55 0.77 -0.50 2.33 4.15 -1.63 -3.18 115.11 117.59 1ae6 h GLN 123 Ca 0.03 -0.42 -0.00 0.00 0.77 0.00 0.00 58.65 59.03 1ae6 h GLN 123 Cb 1.01 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.70 1ae6 h GLN 123 CO 0.10 1.05 0.31 -0.07 -1.93 0.00 0.00 178.83 178.28 1ae6 h LEU 124 N 0.61 0.60 -1.11 -2.39 3.38 -1.36 -1.90 115.31 113.14 1ae6 h LEU 124 Ca 0.04 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1ae6 h LEU 124 Cb 1.01 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1ae6 h LEU 124 CO 0.10 0.48 0.00 0.35 0.09 0.00 0.00 178.44 179.45 1ae6 n THR 125 N -4.69 1.15 1.35 0.22 -2.24 -1.12 -0.58 114.28 108.35 1ae6 n THR 125 Ca 0.02 0.63 0.13 0.00 -2.27 0.00 0.00 64.05 62.57 1ae6 n THR 125 Cb 0.05 -1.62 0.41 0.00 -2.10 0.00 0.00 70.33 67.07 1ae6 n THR 125 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ae6 n SER 126 N -2.13 1.91 0.00 3.42 2.88 -0.72 -4.94 113.62 114.03 1ae6 n SER 126 Ca -0.01 -1.64 0.00 0.00 -1.33 0.00 0.00 58.87 55.89 1ae6 n SER 126 Cb 0.06 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 1ae6 n SER 126 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ae6 n GLY 127 N 1.22 0.76 3.51 0.46 0.00 0.25 -5.06 105.19 106.33 1ae6 n GLY 127 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 1ae6 n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ae6 s GLY 128 N -1.47 2.06 -0.09 -0.02 0.00 -1.19 -3.89 107.32 102.72 1ae6 s GLY 128 Ca 0.00 -2.00 -0.03 0.00 0.00 0.00 0.00 44.72 42.68 1ae6 s GLY 128 CO 0.00 -2.00 0.16 0.00 0.00 0.00 0.00 173.10 171.27 1ae6 s ALA 129 N -2.61 -0.17 -0.10 3.20 0.00 -1.14 -3.31 121.76 117.64 1ae6 s ALA 129 Ca 0.31 0.57 0.03 0.00 0.00 0.00 0.00 51.96 52.87 1ae6 s ALA 129 Cb -0.00 -0.83 0.01 0.00 0.00 0.00 0.00 23.12 22.30 1ae6 s ALA 129 CO 0.16 -0.57 -0.18 -1.12 0.00 0.00 0.00 175.76 174.04 1ae6 s SER 130 N 2.30 2.59 -0.30 0.00 0.01 -1.26 0.42 113.70 117.46 1ae6 s SER 130 Ca 0.03 -0.46 -0.09 0.00 1.31 0.00 0.00 55.95 56.74 1ae6 s SER 130 Cb -0.12 -1.18 -0.01 0.00 0.21 0.00 0.00 66.02 64.92 1ae6 s SER 130 CO -0.06 0.08 0.13 -0.69 0.41 0.00 0.00 173.24 173.11 1ae6 s VAL 131 N 0.66 4.47 -0.17 3.43 1.01 0.05 -3.20 120.40 126.65 1ae6 s VAL 131 Ca -0.13 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 61.34 1ae6 s VAL 131 Cb -0.16 -3.25 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 1ae6 s VAL 131 CO 0.03 0.12 0.16 -0.69 0.00 0.00 0.00 175.10 174.72 1ae6 s VAL 132 N 1.60 5.42 -0.20 2.92 1.01 -0.79 -1.51 120.40 128.85 1ae6 s VAL 132 Ca 0.05 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.28 1ae6 s VAL 132 Cb -0.17 -3.47 0.05 0.00 0.00 0.00 0.00 36.38 32.79 1ae6 s VAL 132 CO 0.05 0.49 -0.05 0.00 0.00 0.00 0.00 175.10 175.59 1ae6 s PHE 134 N 1.52 3.41 -0.59 0.00 0.08 0.17 -0.68 117.98 121.88 1ae6 s PHE 134 Ca -0.02 0.36 0.02 0.00 0.12 0.00 0.00 56.93 57.41 1ae6 s PHE 134 Cb -0.17 -2.19 0.15 0.00 -0.57 0.00 0.00 43.02 40.24 1ae6 s PHE 134 CO -0.07 0.27 0.36 -0.51 -0.10 0.00 0.00 175.22 175.17 1ae6 s LEU 135 N 0.40 4.63 0.00 -0.37 1.43 -0.93 0.13 118.68 123.98 1ae6 s LEU 135 Ca 0.09 -3.15 0.00 0.00 -1.03 0.00 0.00 54.13 50.05 1ae6 s LEU 135 Cb -0.11 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.41 1ae6 s LEU 135 CO -0.01 -0.23 0.00 0.59 0.23 0.00 0.00 176.35 176.93 1ae6 n ASN 136 N 2.97 0.00 -4.66 2.29 3.02 -1.15 -2.38 115.26 115.36 1ae6 n ASN 136 Ca 0.09 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.22 1ae6 n ASN 136 Cb 0.34 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.46 1ae6 n ASN 136 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1ae6 s ASN 137 N -2.55 6.85 0.06 6.41 0.01 -1.26 -3.43 114.94 121.05 1ae6 s ASN 137 Ca 0.00 1.05 -0.22 0.00 -0.71 0.00 0.00 52.86 52.99 1ae6 s ASN 137 Cb 0.00 -2.42 0.05 0.00 0.41 0.00 0.00 41.25 39.29 1ae6 s ASN 137 CO 0.00 -0.41 0.51 0.72 -1.51 0.00 0.00 177.10 176.41 1ae6 s PHE 138 N 2.33 -0.40 -0.21 2.20 -0.12 -0.61 -3.81 117.98 117.36 1ae6 s PHE 138 Ca 0.35 0.39 -0.19 0.00 -0.05 0.00 0.00 56.93 57.43 1ae6 s PHE 138 Cb -0.16 0.34 0.05 0.00 -0.63 0.00 0.00 43.02 42.63 1ae6 s PHE 138 CO 0.10 -0.66 0.56 -0.47 -0.05 0.00 0.00 175.22 174.70 1ae6 s TYR 139 N -2.69 -0.62 1.12 3.49 6.14 -1.15 -0.92 117.35 122.72 1ae6 s TYR 139 Ca -0.04 1.50 -0.19 0.00 0.64 0.00 0.00 57.07 58.98 1ae6 s TYR 139 Cb -0.00 0.22 0.28 0.00 0.42 0.00 0.00 41.96 42.88 1ae6 s TYR 139 CO -0.04 -0.30 0.83 -0.35 0.64 0.00 0.00 175.55 176.33 1ae6 n PRO 140 N 2.84 -3.53 0.15 4.97 -0.04 -1.26 -2.64 135.00 135.49 1ae6 n PRO 140 Ca -0.14 -1.35 0.02 0.00 -0.04 0.00 0.00 63.50 61.98 1ae6 n PRO 140 Cb 0.56 -1.46 0.34 0.00 -0.04 0.00 0.00 33.50 32.90 1ae6 n PRO 140 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1ae6 h LYS 141 N 0.00 0.11 -6.72 0.54 3.64 -1.98 -3.45 116.57 108.71 1ae6 h LYS 141 Ca -0.34 -0.04 -0.53 0.00 -1.27 0.00 0.00 60.65 58.48 1ae6 h LYS 141 Cb 1.08 -0.01 0.06 0.00 -0.41 0.00 0.00 32.23 32.95 1ae6 h LYS 141 CO 0.21 0.42 0.86 -0.51 -2.27 0.00 0.00 179.45 178.16 1ae6 s ASP 142 N -6.91 6.51 -0.08 4.20 1.11 -1.26 -5.00 116.67 115.24 1ae6 s ASP 142 Ca -0.04 2.78 -0.30 0.00 0.18 0.00 0.00 52.55 55.17 1ae6 s ASP 142 Cb 0.14 -2.62 0.12 0.00 1.07 0.00 0.00 42.92 41.63 1ae6 s ASP 142 CO 0.74 -0.83 0.97 -0.51 1.18 0.00 0.00 175.17 176.71 1ae6 s ILE 143 N 0.38 0.00 -0.05 0.77 2.07 -1.26 -4.69 121.20 118.42 1ae6 s ILE 143 Ca 0.65 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.88 1ae6 s ILE 143 Cb -0.45 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.17 1ae6 s ILE 143 CO 0.41 0.00 0.02 0.21 -1.91 0.00 0.00 174.94 173.66 1ae6 s ASN 144 N -2.06 1.09 -0.29 4.50 3.04 -0.97 -4.96 114.94 115.28 1ae6 s ASN 144 Ca 0.04 -0.02 -0.08 0.00 0.04 0.00 0.00 52.86 52.84 1ae6 s ASN 144 Cb -0.01 -0.29 -0.01 0.00 -1.54 0.00 0.00 41.25 39.40 1ae6 s ASN 144 CO -0.06 -0.18 0.11 -0.69 -3.04 0.00 0.00 177.10 173.24 1ae6 s VAL 145 N 1.71 4.31 -0.33 -5.21 1.01 -1.26 -0.52 120.40 120.11 1ae6 s VAL 145 Ca -0.00 -0.45 -0.05 0.00 0.00 0.00 0.00 61.98 61.49 1ae6 s VAL 145 Cb -0.13 -3.16 0.05 0.00 0.00 0.00 0.00 36.38 33.15 1ae6 s VAL 145 CO -0.03 0.14 0.08 -0.54 0.00 0.00 0.00 175.10 174.75 1ae6 s LYS 146 N 1.58 2.50 0.03 2.72 1.02 -0.24 -4.94 119.74 122.41 1ae6 s LYS 146 Ca 0.04 -1.28 -0.30 0.00 0.02 0.00 0.00 55.97 54.46 1ae6 s LYS 146 Cb -0.17 -3.38 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 1ae6 s LYS 146 CO 0.04 -0.69 1.09 -1.58 -0.92 0.00 0.00 175.35 173.29 1ae6 s TRP 147 N 1.33 3.55 -0.05 3.18 0.52 -1.26 -2.17 118.94 124.04 1ae6 s TRP 147 Ca -0.02 1.50 0.06 0.00 0.02 0.00 0.00 56.10 57.66 1ae6 s TRP 147 Cb -0.20 -3.27 -0.01 0.00 -1.15 0.00 0.00 33.47 28.84 1ae6 s TRP 147 CO 0.01 -0.65 -0.23 0.15 0.02 0.00 0.00 176.95 176.25 1ae6 s LYS 148 N 1.03 2.25 -0.34 4.98 1.02 0.23 0.27 119.74 129.18 1ae6 s LYS 148 Ca 0.55 -0.82 0.01 0.00 0.02 0.00 0.00 55.97 55.73 1ae6 s LYS 148 Cb -0.25 -1.96 0.10 0.00 -0.52 0.00 0.00 37.83 35.21 1ae6 s LYS 148 CO 0.29 0.37 0.10 0.42 -0.92 0.00 0.00 175.35 175.61 1ae6 s ILE 149 N -0.18 1.34 -1.03 2.17 1.01 0.12 0.45 121.20 125.09 1ae6 s ILE 149 Ca -0.02 -1.81 -0.06 0.00 0.00 0.00 0.00 60.65 58.76 1ae6 s ILE 149 Cb -0.12 -2.00 0.01 0.00 0.01 0.00 0.00 42.46 40.35 1ae6 s ILE 149 CO 0.03 -0.68 0.90 0.47 0.00 0.00 0.00 174.94 175.65 1ae6 n ASP 150 N 4.52 -4.85 0.00 3.58 9.92 -0.40 -2.65 116.55 126.67 1ae6 n ASP 150 Ca 0.01 -0.43 0.00 0.00 -0.53 0.00 0.00 54.79 53.84 1ae6 n ASP 150 Cb 0.41 -4.04 0.00 0.00 -0.64 0.00 0.00 41.12 36.85 1ae6 n ASP 150 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ae6 n GLY 151 N -1.58 2.32 3.64 0.44 0.00 -1.26 -5.01 105.19 103.74 1ae6 n GLY 151 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 1ae6 n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ae6 s SER 152 N -3.62 5.70 0.04 1.61 1.04 -1.08 -5.05 113.70 112.35 1ae6 s SER 152 Ca 0.00 0.10 -0.31 0.00 0.48 0.00 0.00 55.95 56.22 1ae6 s SER 152 Cb 0.00 -1.98 -0.07 0.00 0.10 0.00 0.00 66.02 64.07 1ae6 s SER 152 CO 0.00 0.17 1.52 -0.70 0.98 0.00 0.00 173.24 175.21 1ae6 s GLU 153 N 0.39 4.24 -0.30 4.02 2.12 -1.26 0.16 118.70 128.07 1ae6 s GLU 153 Ca 0.04 2.15 -0.13 0.00 0.36 0.00 0.00 54.97 57.38 1ae6 s GLU 153 Cb -0.12 -3.56 -0.03 0.00 0.26 0.00 0.00 34.13 30.68 1ae6 s GLU 153 CO -0.00 -0.64 0.29 0.50 -0.54 0.00 0.00 175.26 174.87 1ae6 s ARG 154 N 2.40 3.79 -0.00 4.30 6.06 0.14 -4.92 118.95 130.72 1ae6 s ARG 154 Ca 0.69 -0.31 0.10 0.00 -2.50 0.00 0.00 55.73 53.71 1ae6 s ARG 154 Cb -0.36 -3.72 -0.12 0.00 0.06 0.00 0.00 34.95 30.81 1ae6 s ARG 154 CO 0.29 -0.34 0.33 0.94 -2.50 0.00 0.00 175.30 174.02 1ae6 n GLN 155 N 5.23 2.57 -4.07 5.12 7.27 -1.26 -4.31 117.38 127.93 1ae6 n GLN 155 Ca -0.11 -0.03 -0.32 0.00 0.07 0.00 0.00 57.00 56.60 1ae6 n GLN 155 Cb 0.51 -1.05 -0.15 0.00 2.41 0.00 0.00 30.24 31.95 1ae6 n GLN 155 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 1ae6 s ASN 156 N -2.34 4.24 0.00 1.69 0.01 -1.26 -4.67 114.94 112.61 1ae6 s ASN 156 Ca 0.01 -1.25 0.00 0.00 -0.71 0.00 0.00 52.86 50.91 1ae6 s ASN 156 Cb 0.07 -1.55 0.00 0.00 0.41 0.00 0.00 41.25 40.18 1ae6 s ASN 156 CO 0.40 -0.16 0.00 0.61 -1.51 0.00 0.00 177.10 176.44 1ae6 n GLY 157 N 4.48 0.74 3.75 0.66 0.00 -1.26 -4.98 105.19 108.58 1ae6 n GLY 157 Ca -0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1ae6 n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ae6 s VAL 158 N -1.45 5.12 -0.22 1.61 1.01 -1.26 -1.68 120.40 123.52 1ae6 s VAL 158 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.05 1ae6 s VAL 158 Cb 0.00 -3.26 0.06 0.00 0.00 0.00 0.00 36.38 33.18 1ae6 s VAL 158 CO 0.00 0.54 -0.02 -1.48 0.00 0.00 0.00 175.10 174.14 1ae6 s LEU 159 N -0.35 2.08 0.53 3.92 2.34 0.78 -4.98 118.68 123.00 1ae6 s LEU 159 Ca 0.10 -1.05 -0.07 0.00 0.06 0.00 0.00 54.13 53.17 1ae6 s LEU 159 Cb -0.12 -0.97 -0.04 0.00 -0.56 0.00 0.00 46.19 44.50 1ae6 s LEU 159 CO 0.01 -0.26 0.87 0.20 -1.06 0.00 0.00 176.35 176.12 1ae6 s ASN 160 N 1.56 6.26 -0.32 1.48 0.02 -1.26 -2.33 114.94 120.34 1ae6 s ASN 160 Ca -0.04 1.11 0.04 0.00 -1.02 0.00 0.00 52.86 52.96 1ae6 s ASN 160 Cb -0.18 -2.33 0.19 0.00 0.02 0.00 0.00 41.25 38.95 1ae6 s ASN 160 CO -0.07 -0.68 0.66 -0.55 0.02 0.00 0.00 177.10 176.48 1ae6 s SER 161 N -4.10 -1.46 -0.14 -1.22 0.15 -1.14 -4.98 113.70 100.82 1ae6 s SER 161 Ca 0.50 -0.05 -0.17 0.00 0.70 0.00 0.00 55.95 56.93 1ae6 s SER 161 Cb -0.11 1.90 -0.04 0.00 -1.71 0.00 0.00 66.02 66.06 1ae6 s SER 161 CO 0.48 -0.24 0.43 0.26 1.20 0.00 0.00 173.24 175.36 1ae6 s TRP 162 N 2.60 3.48 0.79 3.44 0.52 -1.26 -1.85 118.94 126.66 1ae6 s TRP 162 Ca 0.13 0.80 -0.12 0.00 0.02 0.00 0.00 56.10 56.93 1ae6 s TRP 162 Cb -0.07 -2.51 0.06 0.00 -1.15 0.00 0.00 33.47 29.80 1ae6 s TRP 162 CO -0.21 0.16 1.11 0.95 0.02 0.00 0.00 176.95 178.98 1ae6 s THR 163 N 0.68 2.96 0.87 2.01 -4.23 -0.26 -4.99 115.64 112.67 1ae6 s THR 163 Ca 0.23 0.31 -0.12 0.00 -1.18 0.00 0.00 61.69 60.93 1ae6 s THR 163 Cb -0.15 -3.15 0.11 0.00 1.34 0.00 0.00 72.50 70.66 1ae6 s THR 163 CO 0.08 -0.41 1.14 -0.62 -0.54 0.00 0.00 174.62 174.28 1ae6 s ASP 164 N -4.10 3.90 0.06 3.99 -1.08 -1.26 -4.52 116.67 113.65 1ae6 s ASP 164 Ca 0.61 0.95 -0.31 0.00 -0.52 0.00 0.00 52.55 53.28 1ae6 s ASP 164 Cb -0.13 -1.52 -0.08 0.00 -1.46 0.00 0.00 42.92 39.73 1ae6 s ASP 164 CO 0.53 -2.30 1.65 -1.58 0.52 0.00 0.00 175.17 173.99 1ae6 s GLN 165 N -5.35 4.20 0.33 4.34 0.74 -1.26 -4.70 119.66 117.96 1ae6 s GLN 165 Ca 0.63 2.32 -0.29 0.00 0.05 0.00 0.00 55.36 58.07 1ae6 s GLN 165 Cb -0.14 -3.63 -0.11 0.00 1.10 0.00 0.00 33.01 30.24 1ae6 s GLN 165 CO 0.52 -0.74 1.51 0.34 -0.55 0.00 0.00 175.29 176.37 1ae6 s ASP 166 N 2.48 6.41 0.21 6.67 2.15 -0.64 -4.92 116.67 129.03 1ae6 s ASP 166 Ca 0.74 2.96 -0.01 0.00 0.43 0.00 0.00 52.55 56.67 1ae6 s ASP 166 Cb -0.39 -2.65 0.16 0.00 -0.30 0.00 0.00 42.92 39.74 1ae6 s ASP 166 CO 0.32 -0.85 1.53 0.77 -0.17 0.00 0.00 175.17 176.78 1ae6 h SER 167 N 3.83 0.55 0.03 -0.34 4.64 -1.92 -2.75 113.55 117.59 1ae6 h SER 167 Ca -0.49 -0.29 -0.00 0.00 -0.47 0.00 0.00 61.79 60.54 1ae6 h SER 167 Cb 1.23 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1ae6 h SER 167 CO 0.71 0.98 -0.01 0.11 -0.87 0.00 0.00 176.83 177.74 1ae6 h LYS 168 N 0.39 -0.04 -0.02 4.77 1.57 -1.99 -3.40 116.57 117.85 1ae6 h LYS 168 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1ae6 h LYS 168 Cb 1.05 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1ae6 h LYS 168 CO 0.10 -0.03 -0.07 -0.40 -0.57 0.00 0.00 179.45 178.48 1ae6 n ASP 169 N -3.18 2.17 -2.12 0.86 5.68 -1.26 -4.97 116.55 113.73 1ae6 n ASP 169 Ca -0.00 -1.67 -0.20 0.00 -0.50 0.00 0.00 54.79 52.42 1ae6 n ASP 169 Cb 0.02 0.06 -0.02 0.00 -1.14 0.00 0.00 41.12 40.03 1ae6 n ASP 169 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1ae6 n SER 170 N 0.60 -5.58 -4.84 -1.12 7.64 -1.04 -5.01 113.62 104.28 1ae6 n SER 170 Ca 0.15 0.06 -0.21 0.00 1.01 0.00 0.00 58.87 59.88 1ae6 n SER 170 Cb 0.47 -4.64 0.09 0.00 -1.01 0.00 0.00 64.21 59.12 1ae6 n SER 170 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1ae6 n THR 171 N -3.76 0.00 -4.55 0.44 -2.24 -1.26 -4.72 114.28 98.19 1ae6 n THR 171 Ca -0.23 -1.82 -0.21 0.00 -2.27 0.00 0.00 64.05 59.52 1ae6 n THR 171 Cb 0.67 -0.67 -0.15 0.00 -2.10 0.00 0.00 70.33 68.08 1ae6 n THR 171 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1ae6 s TYR 172 N -2.90 1.14 0.22 4.78 2.02 -0.09 -1.61 117.35 120.91 1ae6 s TYR 172 Ca 0.65 -0.24 0.11 0.00 -0.37 0.00 0.00 57.07 57.21 1ae6 s TYR 172 Cb -0.04 -0.76 -0.05 0.00 -0.40 0.00 0.00 41.96 40.71 1ae6 s TYR 172 CO 0.42 -0.05 -0.21 -1.12 -1.57 0.00 0.00 175.55 173.02 1ae6 s SER 173 N -0.16 3.28 0.04 2.29 0.01 -1.22 -1.57 113.70 116.37 1ae6 s SER 173 Ca 0.02 -0.94 -0.11 0.00 1.31 0.00 0.00 55.95 56.23 1ae6 s SER 173 Cb -0.06 -0.24 0.01 0.00 0.21 0.00 0.00 66.02 65.93 1ae6 s SER 173 CO -0.00 0.03 0.22 -0.32 0.41 0.00 0.00 173.24 173.59 1ae6 s MET 174 N -3.11 0.73 -0.29 12.44 1.75 -1.00 -1.10 119.30 128.70 1ae6 s MET 174 Ca 0.24 -0.60 -0.03 0.00 -1.25 0.00 0.00 55.69 54.04 1ae6 s MET 174 Cb -0.06 0.30 0.10 0.00 2.84 0.00 0.00 34.83 38.02 1ae6 s MET 174 CO 0.11 -0.22 0.13 -1.54 -0.65 0.00 0.00 175.02 172.85 1ae6 s SER 175 N -2.10 3.62 -0.21 1.11 1.04 -0.77 -2.18 113.70 114.21 1ae6 s SER 175 Ca -0.05 -1.35 -0.19 0.00 0.48 0.00 0.00 55.95 54.84 1ae6 s SER 175 Cb -0.01 -0.43 -0.03 0.00 0.10 0.00 0.00 66.02 65.65 1ae6 s SER 175 CO -0.04 -0.44 0.57 -0.55 0.98 0.00 0.00 173.24 173.77 1ae6 s SER 176 N 2.02 6.61 -0.10 7.02 0.15 0.14 -2.88 113.70 126.65 1ae6 s SER 176 Ca 0.09 0.73 0.02 0.00 0.70 0.00 0.00 55.95 57.50 1ae6 s SER 176 Cb -0.16 -2.32 0.01 0.00 -1.71 0.00 0.00 66.02 61.84 1ae6 s SER 176 CO -0.35 -0.24 -0.16 -0.89 1.20 0.00 0.00 173.24 172.80 1ae6 s THR 177 N 1.84 1.56 -0.10 6.45 2.01 -0.99 0.11 115.64 126.53 1ae6 s THR 177 Ca 0.26 -0.69 -0.01 0.00 0.31 0.00 0.00 61.69 61.55 1ae6 s THR 177 Cb -0.16 -1.41 -0.03 0.00 0.01 0.00 0.00 72.50 70.92 1ae6 s THR 177 CO 0.10 0.45 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.23 1ae6 s LEU 178 N 0.83 3.36 -0.04 4.42 2.96 -0.57 -0.15 118.68 129.49 1ae6 s LEU 178 Ca -0.10 0.02 0.05 0.00 -0.22 0.00 0.00 54.13 53.88 1ae6 s LEU 178 Cb -0.16 -1.76 -0.01 0.00 0.50 0.00 0.00 46.19 44.76 1ae6 s LEU 178 CO 0.01 0.32 -0.18 -0.89 -1.32 0.00 0.00 176.35 174.29 1ae6 s THR 179 N -0.56 1.49 0.00 3.68 2.01 -0.68 -0.77 115.64 120.80 1ae6 s THR 179 Ca 0.09 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 61.33 1ae6 s THR 179 Cb -0.12 -1.27 0.00 0.00 0.01 0.00 0.00 72.50 71.13 1ae6 s THR 179 CO 0.02 0.43 0.00 0.18 -0.69 0.00 0.00 174.62 174.56 1ae6 n LEU 180 N 2.99 0.00 -0.90 4.42 4.77 0.17 -4.85 117.00 123.60 1ae6 n LEU 180 Ca -0.17 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 55.91 1ae6 n LEU 180 Cb 0.53 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.76 1ae6 n LEU 180 CO 0.25 0.00 0.61 0.35 -1.33 0.00 0.00 177.39 177.27 1ae6 n THR 181 N 0.00 0.28 -3.61 -5.08 -2.24 -1.26 -2.87 114.28 99.51 1ae6 n THR 181 Ca 0.00 -0.64 -0.25 0.00 -2.27 0.00 0.00 64.05 60.89 1ae6 n THR 181 Cb 0.00 1.16 0.04 0.00 -2.10 0.00 0.00 70.33 69.43 1ae6 n THR 181 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1ae6 n LYS 182 N 1.18 -2.50 0.00 -0.78 0.00 -1.25 -4.49 118.16 110.32 1ae6 n LYS 182 Ca 0.14 0.58 0.00 0.00 0.00 0.00 0.00 58.31 59.04 1ae6 n LYS 182 Cb 0.52 -4.78 0.00 0.00 0.00 0.00 0.00 35.03 30.77 1ae6 n LYS 182 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1ae6 n ASP 183 N -2.91 0.00 -0.00 3.14 2.03 -1.26 -4.81 116.55 112.73 1ae6 n ASP 183 Ca -0.15 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.26 1ae6 n ASP 183 Cb 0.62 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.87 1ae6 n ASP 183 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1ae6 n GLU 184 N -0.49 0.66 0.05 -0.67 2.13 -1.26 -4.14 120.64 116.92 1ae6 n GLU 184 Ca 0.00 -0.18 -0.20 0.00 0.66 0.00 0.00 57.16 57.44 1ae6 n GLU 184 Cb 0.00 -1.54 -0.13 0.00 0.27 0.00 0.00 31.44 30.05 1ae6 n GLU 184 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 1ae6 h TYR 185 N 0.00 0.81 -0.04 4.31 3.20 -1.90 -3.31 116.97 120.05 1ae6 h TYR 185 Ca -0.01 -0.50 -0.07 0.00 3.14 0.00 0.00 58.73 61.29 1ae6 h TYR 185 Cb 1.03 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 1ae6 h TYR 185 CO 0.00 1.35 -0.29 0.93 -1.64 0.00 0.00 178.16 178.51 1ae6 h GLU 186 N 0.05 0.07 0.00 1.82 5.08 -1.89 -2.97 114.58 116.74 1ae6 h GLU 186 Ca -0.14 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 1ae6 h GLU 186 Cb 1.67 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.91 1ae6 h GLU 186 CO 0.19 0.36 -0.08 0.00 -1.00 0.00 0.00 179.01 178.47 1ae6 h ARG 187 N 0.06 0.00 -6.27 2.33 3.08 -1.72 -3.45 114.38 108.42 1ae6 h ARG 187 Ca 0.01 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.60 1ae6 h ARG 187 Cb 0.55 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1ae6 h ARG 187 CO 0.04 0.08 -0.39 -1.01 -1.07 0.00 0.00 179.97 177.63 1ae6 s HIS 188 N -4.05 3.10 -0.07 3.04 3.76 -1.12 -5.07 115.29 114.88 1ae6 s HIS 188 Ca -0.02 -0.21 -0.08 0.00 -0.15 0.00 0.00 55.06 54.59 1ae6 s HIS 188 Cb 0.12 -1.87 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 1ae6 s HIS 188 CO 0.55 0.11 -0.17 0.09 -0.85 0.00 0.00 174.74 174.48 1ae6 n ASN 189 N -1.53 1.12 -4.77 1.40 3.02 -1.26 -4.73 115.26 108.51 1ae6 n ASN 189 Ca -0.02 0.18 -0.34 0.00 -0.03 0.00 0.00 54.58 54.38 1ae6 n ASN 189 Cb 0.58 -0.54 -0.07 0.00 -0.61 0.00 0.00 39.78 39.14 1ae6 n ASN 189 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1ae6 s SER 190 N -5.36 5.62 -0.14 6.41 1.04 -1.26 0.50 113.70 120.51 1ae6 s SER 190 Ca -0.14 0.16 -0.02 0.00 0.48 0.00 0.00 55.95 56.44 1ae6 s SER 190 Cb 0.02 -1.62 0.04 0.00 0.10 0.00 0.00 66.02 64.57 1ae6 s SER 190 CO 0.20 0.30 -0.00 -0.31 0.98 0.00 0.00 173.24 174.41 1ae6 s TYR 191 N -1.12 1.11 -0.07 5.02 2.02 -0.83 -1.27 117.35 122.20 1ae6 s TYR 191 Ca 0.20 -0.68 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 1ae6 s TYR 191 Cb -0.12 -1.04 -0.03 0.00 -0.40 0.00 0.00 41.96 40.37 1ae6 s TYR 191 CO 0.11 -0.51 -0.08 0.99 -1.57 0.00 0.00 175.55 174.49 1ae6 s THR 192 N 1.83 3.60 -0.39 -0.71 2.01 0.17 -2.95 115.64 119.20 1ae6 s THR 192 Ca 0.02 -0.51 -0.03 0.00 0.31 0.00 0.00 61.69 61.48 1ae6 s THR 192 Cb -0.15 -2.47 0.10 0.00 0.01 0.00 0.00 72.50 69.99 1ae6 s THR 192 CO -0.07 0.59 0.18 0.00 -0.69 0.00 0.00 174.62 174.63 1ae6 s GLU 194 N 1.16 3.67 -0.13 0.00 2.12 -0.92 -2.20 118.70 122.40 1ae6 s GLU 194 Ca 0.06 0.07 -0.03 0.00 0.36 0.00 0.00 54.97 55.43 1ae6 s GLU 194 Cb -0.22 -3.09 0.05 0.00 0.26 0.00 0.00 34.13 31.13 1ae6 s GLU 194 CO -0.04 0.64 0.05 0.00 -0.54 0.00 0.00 175.26 175.38 1ae6 s ALA 195 N -1.27 0.61 -0.46 6.30 0.00 0.09 -1.08 121.76 125.96 1ae6 s ALA 195 Ca 0.27 -0.29 -0.21 0.00 0.00 0.00 0.00 51.96 51.74 1ae6 s ALA 195 Cb -0.14 -0.94 0.03 0.00 0.00 0.00 0.00 23.12 22.07 1ae6 s ALA 195 CO 0.15 -0.91 0.66 0.99 0.00 0.00 0.00 175.76 176.65 1ae6 s THR 196 N 2.03 4.81 0.19 0.00 2.01 0.32 -1.10 115.64 123.91 1ae6 s THR 196 Ca 0.02 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.10 1ae6 s THR 196 Cb -0.15 -4.24 -0.05 0.00 0.01 0.00 0.00 72.50 68.07 1ae6 s THR 196 CO -0.07 -0.66 -0.09 -2.28 -0.69 0.00 0.00 174.62 170.83 1ae6 s HIS 197 N 2.86 1.52 0.48 4.92 2.46 -1.26 -2.30 115.29 123.97 1ae6 s HIS 197 Ca 0.22 -0.73 0.14 0.00 0.47 0.00 0.00 55.06 55.15 1ae6 s HIS 197 Cb -0.15 -0.79 1.12 0.00 -0.13 0.00 0.00 32.58 32.64 1ae6 s HIS 197 CO 0.18 0.16 2.10 0.87 -2.47 0.00 0.00 174.74 175.57 1ae6 h LYS 198 N 2.60 0.12 -1.80 2.88 6.56 -1.94 -3.04 116.57 121.96 1ae6 h LYS 198 Ca -0.38 -0.01 -0.20 0.00 -1.06 0.00 0.00 60.65 59.00 1ae6 h LYS 198 Cb 1.21 -0.02 -0.08 0.00 -0.57 0.00 0.00 32.23 32.76 1ae6 h LYS 198 CO 0.64 0.12 0.17 0.25 -2.06 0.00 0.00 179.45 178.57 1ae6 n THR 199 N -4.48 2.56 -3.54 -0.16 -2.24 -1.26 -4.75 114.28 100.41 1ae6 n THR 199 Ca -0.02 -1.33 -0.01 0.00 -2.27 0.00 0.00 64.05 60.43 1ae6 n THR 199 Cb 0.12 -1.49 -0.05 0.00 -2.10 0.00 0.00 70.33 66.80 1ae6 n THR 199 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ae6 s SER 200 N 1.07 -0.54 0.39 3.42 1.04 -1.15 -4.90 113.70 113.04 1ae6 s SER 200 Ca 0.26 0.80 0.11 0.00 0.48 0.00 0.00 55.95 57.60 1ae6 s SER 200 Cb 0.17 1.42 0.79 0.00 0.10 0.00 0.00 66.02 68.50 1ae6 s SER 200 CO -0.02 -0.12 1.89 0.74 0.98 0.00 0.00 173.24 176.71 1ae6 h THR 201 N 5.24 1.20 -3.61 2.02 2.02 -1.85 -3.44 112.91 114.49 1ae6 h THR 201 Ca -0.22 -0.92 -0.36 0.00 0.77 0.00 0.00 66.41 65.67 1ae6 h THR 201 Cb 1.16 1.39 -0.18 0.00 -1.74 0.00 0.00 68.15 68.78 1ae6 h THR 201 CO 0.14 0.27 -0.74 -0.94 0.37 0.00 0.00 175.52 174.63 1ae6 s SER 202 N -6.92 1.75 0.28 4.18 1.04 -1.26 -5.13 113.70 107.63 1ae6 s SER 202 Ca -0.04 -0.84 -0.30 0.00 0.48 0.00 0.00 55.95 55.24 1ae6 s SER 202 Cb 0.15 -0.03 -0.12 0.00 0.10 0.00 0.00 66.02 66.12 1ae6 s SER 202 CO 0.73 -0.22 1.50 -0.81 0.98 0.00 0.00 173.24 175.42 1ae6 n PRO 203 N 0.44 2.41 -2.43 4.02 -0.04 -1.26 -4.89 135.00 133.25 1ae6 n PRO 203 Ca -0.15 0.86 -0.43 0.00 -0.04 0.00 0.00 63.50 63.74 1ae6 n PRO 203 Cb 0.58 -2.58 -0.02 0.00 -0.04 0.00 0.00 33.50 31.44 1ae6 n PRO 203 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ae6 s ILE 204 N -0.15 4.26 -0.19 0.52 1.01 -0.26 -4.83 121.20 121.56 1ae6 s ILE 204 Ca 0.64 1.50 -0.03 0.00 0.00 0.00 0.00 60.65 62.77 1ae6 s ILE 204 Cb -0.56 -4.04 -0.01 0.00 0.01 0.00 0.00 42.46 37.86 1ae6 s ILE 204 CO 0.51 -0.21 -0.07 -0.69 0.00 0.00 0.00 174.94 174.48 1ae6 s VAL 205 N 3.69 3.34 -0.10 2.92 1.01 -1.26 -0.73 120.40 129.27 1ae6 s VAL 205 Ca 0.55 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 62.03 1ae6 s VAL 205 Cb -0.20 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.70 1ae6 s VAL 205 CO 0.16 0.46 -0.19 -0.54 0.00 0.00 0.00 175.10 174.99 1ae6 s LYS 206 N 1.06 2.55 0.20 2.72 -0.14 -0.93 -5.01 119.74 120.19 1ae6 s LYS 206 Ca 0.00 -0.70 -0.04 0.00 -1.36 0.00 0.00 55.97 53.88 1ae6 s LYS 206 Cb -0.15 -2.02 -0.03 0.00 -1.68 0.00 0.00 37.83 33.95 1ae6 s LYS 206 CO -0.01 0.06 0.20 0.45 -0.76 0.00 0.00 175.35 175.30 1ae6 s SER 207 N 0.63 0.11 -0.13 2.83 0.15 -1.26 -0.17 113.70 115.85 1ae6 s SER 207 Ca -0.13 -1.25 -0.22 0.00 0.70 0.00 0.00 55.95 55.04 1ae6 s SER 207 Cb -0.16 0.42 0.05 0.00 -1.71 0.00 0.00 66.02 64.62 1ae6 s SER 207 CO 0.04 -0.90 0.56 0.72 1.20 0.00 0.00 173.24 174.86 1ae6 s PHE 208 N -4.11 -0.55 -0.07 3.44 -0.71 -1.15 -5.02 117.98 109.81 1ae6 s PHE 208 Ca 0.33 1.17 0.03 0.00 -1.04 0.00 0.00 56.93 57.43 1ae6 s PHE 208 Cb 0.05 0.25 -0.02 0.00 -1.21 0.00 0.00 43.02 42.09 1ae6 s PHE 208 CO 0.10 -0.41 -0.15 -0.80 -1.34 0.00 0.00 175.22 172.61 1ae6 s ASN 209 N -0.46 3.91 0.03 1.98 0.02 -1.26 -1.97 114.94 117.19 1ae6 s ASN 209 Ca -0.06 -0.26 -0.11 0.00 -1.02 0.00 0.00 52.86 51.41 1ae6 s ASN 209 Cb -0.03 -0.98 -0.05 0.00 0.02 0.00 0.00 41.25 40.21 1ae6 s ASN 209 CO 0.04 0.30 1.18 0.03 0.02 0.00 0.00 177.10 178.67 1ae6 h ARG 210 N 5.69 -0.23 -5.77 -0.60 3.08 -0.24 -3.21 114.38 113.09 1ae6 h ARG 210 Ca -0.41 0.02 -0.58 0.00 0.07 0.00 0.00 59.98 59.07 1ae6 h ARG 210 Cb 1.17 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 31.20 1ae6 h ARG 210 CO 0.51 -0.15 1.87 -0.80 -1.07 0.00 0.00 179.97 180.33 1ae6 s ASN 211 N -3.16 6.35 -0.29 7.04 0.02 -1.26 -4.75 114.94 118.89 1ae6 s ASN 211 Ca -0.05 -2.18 0.04 0.00 -1.02 0.00 0.00 52.86 49.65 1ae6 s ASN 211 Cb 0.02 -2.58 0.20 0.00 0.02 0.00 0.00 41.25 38.91 1ae6 s ASN 211 CO 0.19 -1.69 0.62 -0.70 0.02 0.00 0.00 177.10 175.54 1ae6 s GLU 212 N 4.86 0.54 0.00 -0.60 2.12 -1.22 -5.18 118.70 119.22 1ae6 s GLU 212 Ca 0.57 0.59 0.06 0.00 0.36 0.00 0.00 54.97 56.55 1ae6 s GLU 212 Cb 0.02 0.28 0.05 0.00 0.26 0.00 0.00 34.13 34.74 1ae6 s GLU 212 CO 0.08 -0.95 0.69 0.00 -0.54 0.00 0.00 175.26 174.55