#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ae8 s ILE 2 N 0.00 -0.17 -0.09 0.00 1.01 -1.26 -5.09 121.20 115.60 2ae8 s ILE 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.65 2ae8 s ILE 2 Cb 0.00 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.44 2ae8 s ILE 2 CO 0.00 0.00 -0.08 -0.31 0.00 0.00 0.00 174.94 174.55 2ae8 s TYR 3 N 1.74 2.90 -0.04 3.97 1.51 -0.44 -4.98 117.35 122.00 2ae8 s TYR 3 Ca -0.05 -0.17 -0.08 0.00 -1.01 0.00 0.00 57.07 55.75 2ae8 s TYR 3 Cb -0.04 -1.77 0.01 0.00 -0.11 0.00 0.00 41.96 40.06 2ae8 s TYR 3 CO -0.15 0.15 0.20 -1.14 -1.11 0.00 0.00 175.55 173.50 2ae8 s GLN 4 N -0.38 0.39 -0.19 -0.62 0.74 -1.26 -0.54 119.66 117.80 2ae8 s GLN 4 Ca 0.05 -0.02 -0.15 0.00 0.05 0.00 0.00 55.36 55.29 2ae8 s GLN 4 Cb -0.12 0.17 0.05 0.00 1.10 0.00 0.00 33.01 34.22 2ae8 s GLN 4 CO 0.02 -0.08 0.50 0.21 -0.55 0.00 0.00 175.29 175.39 2ae8 s LYS 5 N -0.62 0.55 -0.16 1.67 2.47 0.08 -5.00 119.74 118.74 2ae8 s LYS 5 Ca -0.07 0.77 0.00 0.00 -1.56 0.00 0.00 55.97 55.12 2ae8 s LYS 5 Cb -0.04 0.20 0.00 0.00 -1.46 0.00 0.00 37.83 36.53 2ae8 s LYS 5 CO 0.01 -0.10 -0.16 -1.14 0.16 0.00 0.00 175.35 174.12 2ae8 s GLN 6 N 0.68 3.17 -0.13 4.03 0.74 -1.26 -1.07 119.66 125.81 2ae8 s GLN 6 Ca -0.03 -0.77 -0.00 0.00 0.05 0.00 0.00 55.36 54.61 2ae8 s GLN 6 Cb -0.05 -2.61 0.03 0.00 1.10 0.00 0.00 33.01 31.48 2ae8 s GLN 6 CO -0.05 -0.02 -0.10 0.50 -0.55 0.00 0.00 175.29 175.08 2ae8 s ARG 7 N 0.88 1.83 -0.09 1.67 3.52 -0.46 -5.00 118.95 121.30 2ae8 s ARG 7 Ca -0.04 -0.40 0.01 0.00 -0.13 0.00 0.00 55.73 55.16 2ae8 s ARG 7 Cb -0.15 -1.83 0.02 0.00 -1.56 0.00 0.00 34.95 31.43 2ae8 s ARG 7 CO -0.02 -0.27 -0.09 -0.80 -0.81 0.00 0.00 175.30 173.31 2ae8 s ASN 8 N 1.61 2.00 -0.46 -2.12 0.02 -1.26 -1.37 114.94 113.36 2ae8 s ASN 8 Ca 0.05 -0.30 0.03 0.00 -1.02 0.00 0.00 52.86 51.61 2ae8 s ASN 8 Cb -0.13 -0.83 0.13 0.00 0.02 0.00 0.00 41.25 40.44 2ae8 s ASN 8 CO -0.09 -0.06 0.24 -1.10 0.02 0.00 0.00 177.10 176.11 2ae8 s GLN 13 N 1.30 1.50 -0.01 -0.60 -1.52 -1.21 -5.25 119.66 113.86 2ae8 s GLN 13 Ca -0.03 -2.19 0.08 0.00 -1.95 0.00 0.00 55.36 51.27 2ae8 s GLN 13 Cb -0.14 -2.65 -0.02 0.00 -0.22 0.00 0.00 33.01 29.98 2ae8 s GLN 13 CO -0.04 -1.14 -0.25 -0.51 -0.25 0.00 0.00 175.29 173.11 2ae8 s LEU 14 N 0.16 2.06 -0.16 2.90 1.02 -0.47 -0.18 118.68 124.01 2ae8 s LEU 14 Ca 0.17 -0.46 -0.00 0.00 0.02 0.00 0.00 54.13 53.86 2ae8 s LEU 14 Cb -0.25 -1.26 0.04 0.00 0.02 0.00 0.00 46.19 44.74 2ae8 s LEU 14 CO 0.00 0.30 -0.06 0.21 0.02 0.00 0.00 176.35 176.82 2ae8 s ASN 15 N -0.63 2.75 -0.02 2.29 3.84 0.76 -1.35 114.94 122.57 2ae8 s ASN 15 Ca 0.10 -0.61 0.02 0.00 0.21 0.00 0.00 52.86 52.57 2ae8 s ASN 15 Cb -0.09 -0.92 0.00 0.00 -0.55 0.00 0.00 41.25 39.69 2ae8 s ASN 15 CO -0.01 -0.17 -0.06 -0.63 -2.79 0.00 0.00 177.10 173.45 2ae8 s ILE 16 N 1.63 0.49 0.04 -5.21 1.01 -0.24 -0.57 121.20 118.35 2ae8 s ILE 16 Ca 0.01 -0.22 0.05 0.00 0.00 0.00 0.00 60.65 60.49 2ae8 s ILE 16 Cb -0.15 -0.45 -0.02 0.00 0.01 0.00 0.00 42.46 41.85 2ae8 s ILE 16 CO -0.08 0.16 -0.13 -0.94 0.00 0.00 0.00 174.94 173.95 2ae8 s SER 17 N 0.17 1.56 0.06 3.58 1.04 -0.46 -0.74 113.70 118.91 2ae8 s SER 17 Ca -0.02 -0.47 0.06 0.00 0.48 0.00 0.00 55.95 56.01 2ae8 s SER 17 Cb -0.06 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 65.95 2ae8 s SER 17 CO -0.00 0.00 -0.17 -0.51 0.98 0.00 0.00 173.24 173.54 2ae8 s ILE 18 N -0.91 1.35 -0.11 -1.02 2.07 0.30 -1.09 121.20 121.79 2ae8 s ILE 18 Ca 0.00 -1.22 -0.14 0.00 -1.41 0.00 0.00 60.65 57.89 2ae8 s ILE 18 Cb -0.08 -1.22 0.03 0.00 0.13 0.00 0.00 42.46 41.32 2ae8 s ILE 18 CO 0.01 -0.02 0.37 -0.55 -1.91 0.00 0.00 174.94 172.84 2ae8 s SER 19 N -1.43 -0.36 -0.46 4.50 0.15 -0.43 -1.33 113.70 114.35 2ae8 s SER 19 Ca 0.03 0.62 -0.03 0.00 0.70 0.00 0.00 55.95 57.27 2ae8 s SER 19 Cb -0.09 0.67 0.17 0.00 -1.71 0.00 0.00 66.02 65.06 2ae8 s SER 19 CO 0.02 -0.21 2.40 -0.67 1.20 0.00 0.00 173.24 175.98 2ae8 n ASP 20 N 2.49 6.66 0.00 5.45 -0.08 -1.26 0.25 116.55 130.07 2ae8 n ASP 20 Ca -0.15 -3.26 0.00 0.00 -1.51 0.00 0.00 54.79 49.87 2ae8 n ASP 20 Cb 0.57 -1.14 0.00 0.00 2.34 0.00 0.00 41.12 42.89 2ae8 n ASP 20 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2ae8 n ASP 21 N 0.43 1.17 -1.52 1.67 5.68 -1.26 -5.00 116.55 117.71 2ae8 n ASP 21 Ca 0.44 0.00 -0.05 0.00 -0.50 0.00 0.00 54.79 54.68 2ae8 n ASP 21 Cb 0.55 0.00 0.09 0.00 -1.14 0.00 0.00 41.12 40.62 2ae8 n ASP 21 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 2ae8 n GLN 22 N 0.00 2.07 -2.16 0.11 -0.06 -1.26 -4.35 117.38 111.73 2ae8 n GLN 22 Ca 0.00 -3.44 -0.34 0.00 -2.00 0.00 0.00 57.00 51.23 2ae8 n GLN 22 Cb 0.00 -1.61 0.00 0.00 -4.06 0.00 0.00 30.24 24.58 2ae8 n GLN 22 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 2ae8 s SER 23 N -3.26 5.78 0.50 1.69 1.04 -1.26 -5.01 113.70 113.18 2ae8 s SER 23 Ca 0.40 1.96 -0.23 0.00 0.48 0.00 0.00 55.95 58.57 2ae8 s SER 23 Cb 0.38 -2.55 -0.07 0.00 0.10 0.00 0.00 66.02 63.87 2ae8 s SER 23 CO -0.04 -1.17 1.24 -0.81 0.98 0.00 0.00 173.24 173.43 2ae8 n PRO 24 N -1.67 1.64 -3.82 4.02 -0.04 -1.26 -4.74 135.00 129.12 2ae8 n PRO 24 Ca 0.10 0.60 -0.35 0.00 -0.04 0.00 0.00 63.50 63.80 2ae8 n PRO 24 Cb 0.52 -2.40 -0.05 0.00 -0.04 0.00 0.00 33.50 31.53 2ae8 n PRO 24 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2ae8 s SER 25 N -0.80 6.45 -0.25 3.54 0.01 -1.26 -4.82 113.70 116.56 2ae8 s SER 25 Ca 0.67 0.50 0.01 0.00 1.31 0.00 0.00 55.95 58.44 2ae8 s SER 25 Cb -0.46 -2.07 0.07 0.00 0.21 0.00 0.00 66.02 63.77 2ae8 s SER 25 CO 0.53 0.31 -0.03 -2.28 0.41 0.00 0.00 173.24 172.18 2ae8 s HIS 26 N -1.21 2.45 -0.29 2.43 5.04 -0.80 -5.00 115.29 117.90 2ae8 s HIS 26 Ca 0.23 -1.87 -0.01 0.00 -1.54 0.00 0.00 55.06 51.87 2ae8 s HIS 26 Cb -0.13 -1.72 0.05 0.00 0.04 0.00 0.00 32.58 30.82 2ae8 s HIS 26 CO 0.13 -0.80 -0.02 0.42 -2.34 0.00 0.00 174.74 172.13 2ae8 s ILE 27 N 1.37 2.88 -0.55 0.89 1.01 -1.26 -0.29 121.20 125.25 2ae8 s ILE 27 Ca -0.02 -1.38 0.05 0.00 0.00 0.00 0.00 60.65 59.30 2ae8 s ILE 27 Cb -0.19 -2.64 0.19 0.00 0.01 0.00 0.00 42.46 39.83 2ae8 s ILE 27 CO -0.08 -0.07 0.48 -3.20 0.00 0.00 0.00 174.94 172.07 2ae8 n ASN 28 N 4.60 1.51 0.18 3.58 5.15 -0.36 -4.93 115.26 124.98 2ae8 n ASN 28 Ca -0.14 -2.88 0.12 0.00 -0.60 0.00 0.00 54.58 51.08 2ae8 n ASN 28 Cb 0.44 -0.66 0.11 0.00 -0.53 0.00 0.00 39.78 39.13 2ae8 n ASN 28 CO 0.00 0.00 0.00 0.71 1.40 0.00 0.00 177.26 179.37 2ae8 h THR 29 N 3.95 0.01 0.00 -0.44 1.35 -1.89 -1.44 112.91 114.45 2ae8 h THR 29 Ca 0.19 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 2ae8 h THR 29 Cb 0.81 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 2ae8 h THR 29 CO 0.58 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 176.46 2ae8 n GLY 30 N 1.13 0.62 2.80 5.82 0.00 -1.26 -4.73 105.19 109.56 2ae8 n GLY 30 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2ae8 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ae8 s VAL 31 N -2.17 0.85 0.17 1.61 1.01 -1.26 -5.05 120.40 115.56 2ae8 s VAL 31 Ca 0.00 -0.81 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 2ae8 s VAL 31 Cb 0.00 -1.30 0.07 0.00 0.00 0.00 0.00 36.38 35.15 2ae8 s VAL 31 CO 0.00 -0.21 1.71 1.23 0.00 0.00 0.00 175.10 177.83 2ae8 h GLY 32 N 8.15 0.44 1.28 4.51 0.00 -2.00 -0.15 103.07 115.31 2ae8 h GLY 32 Ca -0.16 0.02 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 2ae8 h GLY 32 CO 0.37 -0.08 -0.14 -2.75 0.00 0.00 0.00 176.54 173.94 2ae8 h PHE 33 N 0.15 0.93 -0.67 5.60 3.57 -1.96 -2.46 116.94 122.10 2ae8 h PHE 33 Ca 0.20 -0.19 -0.07 0.00 3.53 0.00 0.00 57.97 61.44 2ae8 h PHE 33 Cb 0.27 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 2ae8 h PHE 33 CO -0.24 0.92 0.12 1.25 -2.23 0.00 0.00 178.31 178.14 2ae8 h LEU 34 N 0.75 1.04 -0.45 0.59 5.85 -1.84 -2.63 115.31 118.62 2ae8 h LEU 34 Ca 0.12 -0.24 0.09 0.00 0.84 0.00 0.00 57.88 58.69 2ae8 h LEU 34 Cb 0.65 -0.28 -0.09 0.00 0.37 0.00 0.00 40.66 41.32 2ae8 h LEU 34 CO 0.05 1.02 -0.11 0.78 -0.34 0.00 0.00 178.44 179.84 2ae8 h ASN 35 N 1.03 -0.42 0.00 1.25 2.35 -0.60 -0.73 115.58 118.45 2ae8 h ASN 35 Ca 0.21 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 56.09 2ae8 h ASN 35 Cb 0.42 0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.06 2ae8 h ASN 35 CO 0.01 -0.15 0.00 1.41 -1.65 0.00 0.00 177.43 177.05 2ae8 n HIS 36 N -5.33 0.00 0.00 1.19 8.25 -0.97 -1.24 115.22 117.11 2ae8 n HIS 36 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2ae8 n HIS 36 Cb 0.24 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.35 2ae8 n HIS 36 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2ae8 n LEU 38 N 0.27 0.00 -0.27 2.41 4.77 -0.28 -1.92 117.00 121.98 2ae8 n LEU 38 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 2ae8 n LEU 38 Cb 0.00 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.15 2ae8 n LEU 38 CO 0.00 0.00 1.02 0.74 -1.33 0.00 0.00 177.39 177.82 2ae8 h THR 39 N 0.00 1.26 -0.49 -5.08 2.02 -1.40 -1.16 112.91 108.05 2ae8 h THR 39 Ca 0.00 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.33 2ae8 h THR 39 Cb 0.00 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 2ae8 h THR 39 CO 0.00 0.33 0.21 -0.07 0.37 0.00 0.00 175.52 176.36 2ae8 h LEU 40 N 1.08 0.66 -0.36 2.58 3.38 -1.65 -2.56 115.31 118.44 2ae8 h LEU 40 Ca 0.25 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 58.13 2ae8 h LEU 40 Cb 0.23 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.75 2ae8 h LEU 40 CO -0.02 0.63 -0.03 0.15 0.09 0.00 0.00 178.44 179.26 2ae8 h PHE 41 N 0.65 -0.08 -0.29 1.13 3.57 -1.79 -0.69 116.94 119.44 2ae8 h PHE 41 Ca 0.16 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.70 2ae8 h PHE 41 Cb 0.17 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 2ae8 h PHE 41 CO 0.00 -0.10 0.18 1.79 -2.23 0.00 0.00 178.31 177.95 2ae8 h THR 42 N 0.06 1.05 -0.43 4.41 1.35 -0.99 0.17 112.91 118.53 2ae8 h THR 42 Ca 0.18 -0.13 -0.03 0.00 -0.55 0.00 0.00 66.41 65.88 2ae8 h THR 42 Cb 0.25 0.65 -0.02 0.00 -1.73 0.00 0.00 68.15 67.31 2ae8 h THR 42 CO -0.32 0.07 0.16 0.15 -0.25 0.00 0.00 175.52 175.32 2ae8 h PHE 43 N 0.37 0.68 0.00 4.73 3.57 -1.19 -2.12 116.94 122.96 2ae8 h PHE 43 Ca 0.11 -0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.48 2ae8 h PHE 43 Cb -0.02 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 2ae8 h PHE 43 CO -0.07 0.60 -0.60 0.45 -2.23 0.00 0.00 178.31 176.45 2ae8 h HIS 44 N 0.56 0.00 0.00 0.41 3.86 -0.92 -3.27 115.15 115.80 2ae8 h HIS 44 Ca 0.14 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.32 2ae8 h HIS 44 Cb 0.22 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 2ae8 h HIS 44 CO 0.01 0.30 -0.82 0.66 0.86 0.00 0.00 177.93 178.93 2ae8 h SER 45 N 0.00 0.00 0.00 2.45 4.64 -1.00 -3.28 113.55 116.36 2ae8 h SER 45 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2ae8 h SER 45 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2ae8 h SER 45 CO 0.03 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 2ae8 n GLY 46 N 1.20 0.80 3.86 -0.77 0.00 -0.81 -4.38 105.19 105.09 2ae8 n GLY 46 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2ae8 n GLY 46 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ae8 s LEU 47 N 0.00 4.42 -0.15 0.99 1.43 -1.16 -4.32 118.68 119.89 2ae8 s LEU 47 Ca 0.00 0.69 -0.18 0.00 -1.03 0.00 0.00 54.13 53.61 2ae8 s LEU 47 Cb 0.00 -2.40 -0.04 0.00 0.03 0.00 0.00 46.19 43.78 2ae8 s LEU 47 CO 0.00 0.34 0.48 -0.44 0.23 0.00 0.00 176.35 176.96 2ae8 s SER 48 N -1.18 6.62 -0.09 2.29 0.01 0.14 -4.36 113.70 117.12 2ae8 s SER 48 Ca 0.21 0.74 0.01 0.00 1.31 0.00 0.00 55.95 58.22 2ae8 s SER 48 Cb -0.14 -2.28 -0.02 0.00 0.21 0.00 0.00 66.02 63.79 2ae8 s SER 48 CO 0.10 -0.06 -0.13 -0.76 0.41 0.00 0.00 173.24 172.80 2ae8 s LEU 49 N 0.97 2.74 -0.16 2.44 1.43 -1.26 -1.31 118.68 123.53 2ae8 s LEU 49 Ca 0.25 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 53.09 2ae8 s LEU 49 Cb -0.15 -1.59 0.03 0.00 0.03 0.00 0.00 46.19 44.51 2ae8 s LEU 49 CO 0.10 0.25 -0.10 0.20 0.23 0.00 0.00 176.35 177.02 2ae8 s ASN 50 N -0.14 2.84 -0.09 2.29 0.01 -0.25 -1.91 114.94 117.69 2ae8 s ASN 50 Ca -0.01 -0.61 0.03 0.00 -0.71 0.00 0.00 52.86 51.56 2ae8 s ASN 50 Cb -0.14 -1.09 0.01 0.00 0.41 0.00 0.00 41.25 40.45 2ae8 s ASN 50 CO 0.03 -0.12 -0.17 -0.63 -1.51 0.00 0.00 177.10 174.71 2ae8 s ILE 51 N 1.53 1.54 -0.21 0.60 1.01 0.60 -1.35 121.20 124.92 2ae8 s ILE 51 Ca 0.02 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.98 2ae8 s ILE 51 Cb -0.14 -1.37 0.05 0.00 0.01 0.00 0.00 42.46 41.01 2ae8 s ILE 51 CO -0.09 0.45 -0.06 -1.61 0.00 0.00 0.00 174.94 173.62 2ae8 s GLU 52 N 0.67 1.67 -0.01 2.79 0.41 0.26 -1.23 118.70 123.27 2ae8 s GLU 52 Ca -0.13 -0.82 0.04 0.00 -0.41 0.00 0.00 54.97 53.65 2ae8 s GLU 52 Cb -0.16 -2.39 -0.03 0.00 -1.78 0.00 0.00 34.13 29.76 2ae8 s GLU 52 CO 0.04 -0.51 -0.12 0.00 -0.49 0.00 0.00 175.26 174.18 2ae8 s ALA 53 N 1.46 2.82 0.03 5.21 0.00 -0.54 -0.17 121.76 130.57 2ae8 s ALA 53 Ca -0.03 -1.05 0.03 0.00 0.00 0.00 0.00 51.96 50.91 2ae8 s ALA 53 Cb -0.17 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 21.93 2ae8 s ALA 53 CO -0.07 0.59 -0.09 -0.65 0.00 0.00 0.00 175.76 175.54 2ae8 s GLN 54 N -1.21 0.60 0.00 0.00 -1.52 0.75 -4.76 119.66 113.52 2ae8 s GLN 54 Ca 0.15 -0.63 0.00 0.00 -1.95 0.00 0.00 55.36 52.93 2ae8 s GLN 54 Cb -0.11 -0.48 0.00 0.00 -0.22 0.00 0.00 33.01 32.20 2ae8 s GLN 54 CO 0.05 0.11 0.00 0.41 -0.25 0.00 0.00 175.29 175.61 2ae8 n GLY 55 N 1.91 4.94 1.38 3.09 0.00 -1.26 -3.33 105.19 111.91 2ae8 n GLY 55 Ca -0.19 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.64 2ae8 n GLY 55 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ae8 n ASP 60 N 0.00 0.00 0.18 1.61 2.03 -1.26 -5.15 116.55 113.97 2ae8 n ASP 60 Ca 0.00 0.00 0.12 0.00 0.52 0.00 0.00 54.79 55.43 2ae8 n ASP 60 Cb 0.00 0.00 0.68 0.00 -0.72 0.00 0.00 41.12 41.08 2ae8 n ASP 60 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2ae8 h ASP 61 N 0.00 0.00 0.27 1.67 3.45 -1.99 -2.19 116.42 117.64 2ae8 h ASP 61 Ca 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.45 2ae8 h ASP 61 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 2ae8 h ASP 61 CO 0.00 0.00 -0.13 -0.74 -1.57 0.00 0.00 179.24 176.80 2ae8 h HIS 62 N 0.00 -0.34 -0.12 4.55 2.76 -1.99 -0.31 115.15 119.70 2ae8 h HIS 62 Ca 0.08 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 2ae8 h HIS 62 Cb 0.33 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.39 2ae8 h HIS 62 CO 0.00 -0.03 0.07 0.45 -1.30 0.00 0.00 177.93 177.12 2ae8 h HIS 63 N -0.66 0.13 0.01 5.26 3.86 -1.95 -0.90 115.15 120.89 2ae8 h HIS 63 Ca -0.04 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.20 2ae8 h HIS 63 Cb 0.47 -0.04 -0.04 0.00 1.06 0.00 0.00 27.41 28.86 2ae8 h HIS 63 CO 0.02 0.08 -0.18 0.28 0.86 0.00 0.00 177.93 178.98 2ae8 h VAL 64 N 0.14 0.56 -0.31 2.45 2.07 -1.40 0.12 116.25 119.88 2ae8 h VAL 64 Ca 0.05 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 2ae8 h VAL 64 Cb -0.00 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2ae8 h VAL 64 CO -0.02 0.00 0.16 0.74 0.02 0.00 0.00 177.57 178.47 2ae8 h THR 65 N -0.30 1.14 -0.34 2.57 2.02 -0.91 -0.89 112.91 116.20 2ae8 h THR 65 Ca 0.05 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 2ae8 h THR 65 Cb 0.37 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2ae8 h THR 65 CO -0.17 0.15 0.15 -0.08 0.37 0.00 0.00 175.52 175.93 2ae8 h GLU 66 N 0.38 0.50 -0.57 6.66 4.81 -0.96 -0.75 114.58 124.64 2ae8 h GLU 66 Ca 0.11 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.16 2ae8 h GLU 66 Cb 0.09 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2ae8 h GLU 66 CO -0.02 0.48 -0.03 -0.44 -0.73 0.00 0.00 179.01 178.28 2ae8 h ASP 67 N 0.40 1.00 -0.63 1.04 3.45 -0.59 0.63 116.42 121.72 2ae8 h ASP 67 Ca 0.11 -0.29 -0.01 0.00 0.43 0.00 0.00 57.03 57.27 2ae8 h ASP 67 Cb 0.16 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 38.63 2ae8 h ASP 67 CO -0.01 1.07 0.35 0.40 -1.57 0.00 0.00 179.24 179.48 2ae8 h ILE 68 N 0.92 1.20 -0.62 0.35 2.04 -1.11 -2.06 117.51 118.22 2ae8 h ILE 68 Ca 0.16 -0.49 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 2ae8 h ILE 68 Cb 0.58 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 2ae8 h ILE 68 CO 0.03 0.21 0.29 1.23 0.00 0.00 0.00 178.15 179.91 2ae8 h GLY 69 N 0.85 0.97 0.97 5.37 0.00 -0.62 -1.29 103.07 109.32 2ae8 h GLY 69 Ca 0.22 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 2ae8 h GLY 69 CO -0.04 0.47 0.16 -2.22 0.00 0.00 0.00 176.54 174.91 2ae8 h ILE 70 N 0.86 1.10 -0.35 2.60 2.04 -0.75 -0.96 117.51 122.06 2ae8 h ILE 70 Ca 0.21 -0.25 -0.05 0.00 1.00 0.00 0.00 64.86 65.77 2ae8 h ILE 70 Cb 0.14 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 2ae8 h ILE 70 CO -0.02 0.10 0.01 0.58 0.00 0.00 0.00 178.15 178.81 2ae8 h VAL 71 N 0.33 1.26 -0.67 1.67 2.07 -1.26 -0.49 116.25 119.16 2ae8 h VAL 71 Ca 0.09 -0.96 0.02 0.00 0.82 0.00 0.00 66.70 66.67 2ae8 h VAL 71 Cb 0.02 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 2ae8 h VAL 71 CO -0.02 0.32 0.42 0.40 0.02 0.00 0.00 177.57 178.72 2ae8 h ILE 72 N 0.43 1.11 -0.52 4.57 2.04 -1.20 0.42 117.51 124.36 2ae8 h ILE 72 Ca 0.10 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2ae8 h ILE 72 Cb 0.45 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 2ae8 h ILE 72 CO 0.02 0.15 0.32 1.23 0.00 0.00 0.00 178.15 179.87 2ae8 h GLY 73 N 0.84 0.74 1.00 5.37 0.00 -0.83 -0.18 103.07 110.01 2ae8 h GLY 73 Ca 0.26 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 47.24 2ae8 h GLY 73 CO -0.09 0.29 0.13 1.46 0.00 0.00 0.00 176.54 178.32 2ae8 h GLN 74 N 0.69 0.88 -0.38 4.80 4.20 -0.67 -1.36 115.11 123.28 2ae8 h GLN 74 Ca 0.19 -0.22 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 2ae8 h GLN 74 Cb -0.04 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 2ae8 h GLN 74 CO -0.04 0.83 -0.23 -0.07 -0.67 0.00 0.00 178.83 178.66 2ae8 h LEU 75 N 0.78 0.76 -0.84 1.46 3.38 -0.78 -2.14 115.31 117.93 2ae8 h LEU 75 Ca 0.17 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2ae8 h LEU 75 Cb 0.35 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2ae8 h LEU 75 CO 0.00 0.97 0.54 -0.07 0.09 0.00 0.00 178.44 179.97 2ae8 h LEU 76 N 0.66 0.98 -0.44 1.67 3.38 -0.75 -2.48 115.31 118.32 2ae8 h LEU 76 Ca 0.09 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2ae8 h LEU 76 Cb 0.73 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2ae8 h LEU 76 CO 0.06 0.73 0.23 0.25 0.09 0.00 0.00 178.44 179.80 2ae8 h LEU 77 N 1.14 0.56 -1.26 1.67 5.85 -0.93 0.17 115.31 122.51 2ae8 h LEU 77 Ca 0.31 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.92 2ae8 h LEU 77 Cb -0.10 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.79 2ae8 h LEU 77 CO -0.06 0.51 0.00 -0.62 -0.34 0.00 0.00 178.44 177.92 2ae8 n GLU 78 N -4.68 0.00 0.00 1.25 -0.58 -0.83 -0.45 120.64 115.34 2ae8 n GLU 78 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2ae8 n GLU 78 Cb 0.09 -0.98 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 2ae8 n GLU 78 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2ae8 n ILE 80 N 0.50 0.00 -0.26 -3.67 5.41 0.60 -2.46 119.36 119.48 2ae8 n ILE 80 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.80 2ae8 n ILE 80 Cb 0.00 0.00 0.19 0.00 -0.71 0.00 0.00 39.64 39.12 2ae8 n ILE 80 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2ae8 h LYS 81 N 0.00 0.43 0.00 0.38 1.57 -1.01 -2.53 116.57 115.42 2ae8 h LYS 81 Ca 0.00 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.62 2ae8 h LYS 81 Cb 0.00 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2ae8 h LYS 81 CO 0.00 0.29 -0.62 -0.44 -0.57 0.00 0.00 179.45 178.10 2ae8 h ASP 82 N 0.45 0.00 -3.91 0.86 3.32 -1.74 -3.42 116.42 111.98 2ae8 h ASP 82 Ca 0.41 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.97 2ae8 h ASP 82 Cb 0.62 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.19 2ae8 h ASP 82 CO -0.40 0.62 0.43 -0.54 -1.72 0.00 0.00 179.24 177.63 2ae8 s LYS 83 N -3.36 4.33 -0.11 3.56 1.02 -0.95 -4.97 119.74 119.26 2ae8 s LYS 83 Ca 0.00 1.61 0.00 0.00 0.02 0.00 0.00 55.97 57.60 2ae8 s LYS 83 Cb 0.11 -2.76 -0.07 0.00 -0.52 0.00 0.00 37.83 34.59 2ae8 s LYS 83 CO 0.75 -0.02 -0.10 1.63 -0.92 0.00 0.00 175.35 176.70 2ae8 n LYS 84 N 0.36 0.26 -4.00 1.68 4.01 -1.26 -4.91 118.16 114.30 2ae8 n LYS 84 Ca 0.03 0.06 -0.33 0.00 -0.51 0.00 0.00 58.31 57.56 2ae8 n LYS 84 Cb 0.48 -1.19 -0.14 0.00 -0.51 0.00 0.00 35.03 33.67 2ae8 n LYS 84 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 2ae8 s HIS 85 N -2.21 3.31 0.12 2.13 3.76 -1.26 -5.08 115.29 116.06 2ae8 s HIS 85 Ca -0.14 -2.23 -0.01 0.00 -0.15 0.00 0.00 55.06 52.53 2ae8 s HIS 85 Cb 0.04 -2.10 -0.04 0.00 1.11 0.00 0.00 32.58 31.59 2ae8 s HIS 85 CO 0.24 -0.86 0.04 -0.59 -0.85 0.00 0.00 174.74 172.72 2ae8 s PHE 86 N 1.14 0.84 0.39 1.40 -0.12 -1.26 -0.44 117.98 119.93 2ae8 s PHE 86 Ca -0.06 -1.21 0.09 0.00 -0.05 0.00 0.00 56.93 55.70 2ae8 s PHE 86 Cb -0.20 -0.48 0.85 0.00 -0.63 0.00 0.00 43.02 42.57 2ae8 s PHE 86 CO -0.04 -0.50 1.97 0.28 -0.05 0.00 0.00 175.22 176.88 2ae8 h VAL 87 N 2.89 0.97 0.00 -2.49 2.07 -0.46 -3.44 116.25 115.80 2ae8 h VAL 87 Ca -0.35 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2ae8 h VAL 87 Cb 1.19 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2ae8 h VAL 87 CO 0.60 0.11 0.00 -1.14 0.02 0.00 0.00 177.57 177.16 2ae8 n ARG 88 N -4.48 0.00 -4.18 1.57 0.63 0.43 -4.90 116.66 105.72 2ae8 n ARG 88 Ca 0.10 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.69 2ae8 n ARG 88 Cb 0.28 -0.02 -0.11 0.00 0.45 0.00 0.00 32.46 33.06 2ae8 n ARG 88 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2ae8 s TYR 89 N 0.00 3.12 -0.01 -0.14 1.51 -1.26 -1.15 117.35 119.42 2ae8 s TYR 89 Ca 0.00 -0.16 0.00 0.00 -1.01 0.00 0.00 57.07 55.90 2ae8 s TYR 89 Cb 0.00 -2.03 0.01 0.00 -0.11 0.00 0.00 41.96 39.83 2ae8 s TYR 89 CO 0.00 0.02 0.01 0.20 -1.11 0.00 0.00 175.55 174.67 2ae8 s GLY 90 N 0.46 0.08 0.40 0.71 0.00 -0.49 -4.23 107.32 104.25 2ae8 s GLY 90 Ca -0.00 0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.88 2ae8 s GLY 90 CO 0.02 0.32 0.10 -1.59 0.00 0.00 0.00 173.10 171.95 2ae8 s THR 91 N 0.51 0.80 -0.12 0.90 2.01 -1.26 -0.13 115.64 118.36 2ae8 s THR 91 Ca -0.04 -2.00 -0.06 0.00 0.31 0.00 0.00 61.69 59.89 2ae8 s THR 91 Cb -0.07 -2.44 0.05 0.00 0.01 0.00 0.00 72.50 70.05 2ae8 s THR 91 CO -0.01 0.00 0.28 -0.31 -0.69 0.00 0.00 174.62 173.88 2ae8 s TYR 93 N -3.20 -0.37 -0.10 4.92 1.51 -1.26 -4.82 117.35 114.02 2ae8 s TYR 93 Ca 0.25 0.86 0.01 0.00 -1.01 0.00 0.00 57.07 57.18 2ae8 s TYR 93 Cb 0.04 0.09 0.02 0.00 -0.11 0.00 0.00 41.96 42.00 2ae8 s TYR 93 CO 0.14 -0.24 -0.11 0.42 -1.11 0.00 0.00 175.55 174.65 2ae8 s ILE 94 N 1.16 1.19 0.00 2.71 -1.09 0.15 -4.98 121.20 120.33 2ae8 s ILE 94 Ca -0.08 -0.43 0.00 0.00 -2.23 0.00 0.00 60.65 57.91 2ae8 s ILE 94 Cb -0.09 -1.14 0.00 0.00 -1.58 0.00 0.00 42.46 39.65 2ae8 s ILE 94 CO -0.08 0.39 0.00 -0.81 -1.23 0.00 0.00 174.94 173.20 2ae8 n PRO 95 N 4.53 0.79 0.00 2.79 -0.04 -1.26 -1.10 135.00 140.72 2ae8 n PRO 95 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2ae8 n PRO 95 Cb 0.51 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.97 2ae8 n PRO 95 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ae8 n ASP 97 N -2.63 0.00 0.27 3.54 8.00 -1.26 -4.97 116.55 119.50 2ae8 n ASP 97 Ca 0.00 0.00 0.15 0.00 0.71 0.00 0.00 54.79 55.65 2ae8 n ASP 97 Cb 0.00 0.00 0.77 0.00 -0.02 0.00 0.00 41.12 41.87 2ae8 n ASP 97 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2ae8 h GLU 98 N 0.00 0.00 -6.50 -1.24 9.09 -1.97 -3.44 114.58 110.52 2ae8 h GLU 98 Ca 0.00 0.00 -0.53 0.00 0.05 0.00 0.00 59.36 58.88 2ae8 h GLU 98 Cb 0.00 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.07 2ae8 h GLU 98 CO 0.00 0.08 0.03 0.99 0.05 0.00 0.00 179.01 180.16 2ae8 s THR 99 N -3.99 4.70 -0.05 -1.06 2.01 -1.26 -4.36 115.64 111.63 2ae8 s THR 99 Ca -0.02 1.03 -0.00 0.00 0.31 0.00 0.00 61.69 63.01 2ae8 s THR 99 Cb 0.12 -3.77 0.03 0.00 0.01 0.00 0.00 72.50 68.89 2ae8 s THR 99 CO 0.55 0.15 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.40 2ae8 s LEU 100 N -2.16 0.93 0.09 4.42 2.96 -0.30 -4.34 118.68 120.28 2ae8 s LEU 100 Ca 0.43 -0.07 0.10 0.00 -0.22 0.00 0.00 54.13 54.36 2ae8 s LEU 100 Cb -0.15 -0.37 -0.04 0.00 0.50 0.00 0.00 46.19 46.13 2ae8 s LEU 100 CO 0.20 -0.13 -0.24 0.00 -1.32 0.00 0.00 176.35 174.85 2ae8 s ALA 101 N 1.44 2.43 -0.07 5.97 0.00 -0.26 -0.48 121.76 130.79 2ae8 s ALA 101 Ca -0.03 -1.36 0.04 0.00 0.00 0.00 0.00 51.96 50.61 2ae8 s ALA 101 Cb -0.13 -0.50 -0.00 0.00 0.00 0.00 0.00 23.12 22.49 2ae8 s ALA 101 CO -0.03 0.55 -0.21 0.50 0.00 0.00 0.00 175.76 176.58 2ae8 s ARG 102 N -1.77 2.46 -0.05 0.00 3.52 -0.01 -0.68 118.95 122.42 2ae8 s ARG 102 Ca 0.14 -0.76 0.03 0.00 -0.13 0.00 0.00 55.73 55.02 2ae8 s ARG 102 Cb -0.10 -1.97 0.00 0.00 -1.56 0.00 0.00 34.95 31.32 2ae8 s ARG 102 CO 0.06 0.22 -0.15 0.08 -0.81 0.00 0.00 175.30 174.69 2ae8 s VAL 103 N 0.21 1.29 -0.16 7.11 1.01 -1.26 -1.02 120.40 127.57 2ae8 s VAL 103 Ca -0.12 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.26 2ae8 s VAL 103 Cb -0.15 -1.13 0.01 0.00 0.00 0.00 0.00 36.38 35.11 2ae8 s VAL 103 CO 0.06 0.38 -0.20 -0.69 0.00 0.00 0.00 175.10 174.64 2ae8 s VAL 104 N 0.24 2.14 -0.01 2.92 1.01 -0.34 -4.29 120.40 122.07 2ae8 s VAL 104 Ca -0.07 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.05 2ae8 s VAL 104 Cb -0.13 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 2ae8 s VAL 104 CO 0.03 0.54 -0.24 0.68 0.00 0.00 0.00 175.10 176.11 2ae8 s VAL 105 N 1.08 1.90 -0.19 2.92 -7.23 0.82 -1.04 120.40 118.67 2ae8 s VAL 105 Ca -0.00 -1.08 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 2ae8 s VAL 105 Cb -0.14 -1.59 0.04 0.00 0.56 0.00 0.00 36.38 35.25 2ae8 s VAL 105 CO -0.08 0.49 -0.08 -0.62 -0.31 0.00 0.00 175.10 174.50 2ae8 s ASP 106 N -0.69 3.19 -1.23 4.85 2.15 0.45 -1.39 116.67 123.99 2ae8 s ASP 106 Ca 0.09 -0.80 -0.21 0.00 0.43 0.00 0.00 52.55 52.06 2ae8 s ASP 106 Cb -0.09 -1.11 -0.03 0.00 -0.30 0.00 0.00 42.92 41.39 2ae8 s ASP 106 CO -0.00 -0.16 1.86 -0.63 -0.17 0.00 0.00 175.17 176.06 2ae8 s ILE 107 N 1.48 3.77 -0.05 4.11 1.01 -0.30 -1.13 121.20 130.09 2ae8 s ILE 107 Ca -0.00 -1.32 0.18 0.00 0.00 0.00 0.00 60.65 59.51 2ae8 s ILE 107 Cb -0.16 -4.82 -0.27 0.00 0.01 0.00 0.00 42.46 37.21 2ae8 s ILE 107 CO -0.08 -1.40 0.34 -1.54 0.00 0.00 0.00 174.94 172.26 2ae8 n SER 108 N 12.06 0.74 0.00 3.58 3.41 -1.26 -4.94 113.62 127.21 2ae8 n SER 108 Ca 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 2ae8 n SER 108 Cb 0.46 1.67 0.00 0.00 -0.26 0.00 0.00 64.21 66.08 2ae8 n SER 108 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ae8 n GLY 109 N 1.54 1.43 3.32 5.00 0.00 -0.66 -5.01 105.19 110.82 2ae8 n GLY 109 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2ae8 n GLY 109 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ae8 s ARG 110 N -0.11 2.78 -0.16 1.61 0.52 -1.23 -4.91 118.95 117.45 2ae8 s ARG 110 Ca 0.00 -1.40 -0.29 0.00 -0.52 0.00 0.00 55.73 53.52 2ae8 s ARG 110 Cb 0.00 -3.93 -0.03 0.00 0.52 0.00 0.00 34.95 31.51 2ae8 s ARG 110 CO 0.00 -0.98 1.44 -2.14 0.02 0.00 0.00 175.30 173.64 2ae8 s PRO 111 N 1.52 4.11 -0.29 3.54 0.02 -1.26 -3.35 135.00 139.29 2ae8 s PRO 111 Ca 0.03 1.77 -0.15 0.00 0.02 0.00 0.00 61.00 62.67 2ae8 s PRO 111 Cb -0.23 -3.89 0.11 0.00 0.02 0.00 0.00 34.50 30.50 2ae8 s PRO 111 CO 0.04 -0.90 0.78 -0.47 -0.33 0.00 0.00 177.00 176.13 2ae8 s TYR 112 N 4.05 -0.94 -0.10 6.54 6.14 -0.47 -4.97 117.35 127.60 2ae8 s TYR 112 Ca 0.63 1.83 0.02 0.00 0.64 0.00 0.00 57.07 60.19 2ae8 s TYR 112 Cb -0.25 0.56 0.01 0.00 0.42 0.00 0.00 41.96 42.70 2ae8 s TYR 112 CO 0.22 -0.46 -0.17 -1.17 0.64 0.00 0.00 175.55 174.61 2ae8 s LEU 113 N 1.71 1.82 -0.39 6.97 2.96 -1.26 -0.32 118.68 130.17 2ae8 s LEU 113 Ca -0.09 -0.45 -0.06 0.00 -0.22 0.00 0.00 54.13 53.31 2ae8 s LEU 113 Cb -0.05 -1.14 0.08 0.00 0.50 0.00 0.00 46.19 45.57 2ae8 s LEU 113 CO -0.18 0.05 0.19 -0.55 -1.32 0.00 0.00 176.35 174.54 2ae8 s SER 114 N 0.79 5.39 -0.33 3.68 0.15 -0.02 -5.00 113.70 118.37 2ae8 s SER 114 Ca -0.10 -1.59 -0.09 0.00 0.70 0.00 0.00 55.95 54.87 2ae8 s SER 114 Cb -0.16 -1.89 0.01 0.00 -1.71 0.00 0.00 66.02 62.28 2ae8 s SER 114 CO 0.01 -0.48 0.14 0.12 1.20 0.00 0.00 173.24 174.23 2ae8 s PHE 115 N 1.32 3.20 -0.54 3.44 5.36 -1.26 -0.53 117.98 128.96 2ae8 s PHE 115 Ca 0.03 -0.92 0.05 0.00 -0.96 0.00 0.00 56.93 55.13 2ae8 s PHE 115 Cb -0.22 -2.34 0.18 0.00 -0.34 0.00 0.00 43.02 40.30 2ae8 s PHE 115 CO -0.00 -0.58 0.45 0.09 -1.46 0.00 0.00 175.22 173.71 2ae8 n ASN 116 N 4.93 1.27 -3.35 6.13 3.02 0.35 -4.99 115.26 122.63 2ae8 n ASN 116 Ca -0.13 -2.81 -0.05 0.00 -0.03 0.00 0.00 54.58 51.56 2ae8 n ASN 116 Cb 0.47 -0.65 -0.06 0.00 -0.61 0.00 0.00 39.78 38.93 2ae8 n ASN 116 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ae8 s ALA 117 N -0.84 -1.47 -0.49 5.41 0.00 -1.26 -1.52 121.76 121.59 2ae8 s ALA 117 Ca 0.30 1.32 -0.19 0.00 0.00 0.00 0.00 51.96 53.39 2ae8 s ALA 117 Cb 0.03 -1.77 0.05 0.00 0.00 0.00 0.00 23.12 21.42 2ae8 s ALA 117 CO -0.17 -1.20 0.62 -1.12 0.00 0.00 0.00 175.76 173.89 2ae8 s SER 118 N 2.66 6.24 0.38 0.00 0.01 -1.26 -5.02 113.70 116.72 2ae8 s SER 118 Ca 0.12 -0.75 -0.24 0.00 1.31 0.00 0.00 55.95 56.39 2ae8 s SER 118 Cb -0.15 -2.29 -0.10 0.00 0.21 0.00 0.00 66.02 63.69 2ae8 s SER 118 CO -0.17 -0.85 0.98 -0.76 0.41 0.00 0.00 173.24 172.85 2ae8 s LEU 119 N 2.66 4.15 0.40 2.44 1.43 -1.26 -4.97 118.68 123.53 2ae8 s LEU 119 Ca 0.17 1.86 0.21 0.00 -1.03 0.00 0.00 54.13 55.34 2ae8 s LEU 119 Cb -0.18 -4.24 0.71 0.00 0.03 0.00 0.00 46.19 42.51 2ae8 s LEU 119 CO 0.14 -0.31 1.74 0.28 0.23 0.00 0.00 176.35 178.43 2ae8 h SER 120 N 2.54 0.00 -4.53 2.29 0.02 -1.91 -3.45 113.55 108.51 2ae8 h SER 120 Ca -0.48 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.21 2ae8 h SER 120 Cb 1.20 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.57 2ae8 h SER 120 CO 0.63 0.30 -0.71 -0.54 -1.14 0.00 0.00 176.83 175.36 2ae8 s LYS 121 N -3.52 0.80 0.39 3.45 -0.14 -1.26 -5.00 119.74 114.46 2ae8 s LYS 121 Ca 0.01 -1.19 0.21 0.00 -1.36 0.00 0.00 55.97 53.64 2ae8 s LYS 121 Cb 0.10 -0.34 0.41 0.00 -1.68 0.00 0.00 37.83 36.32 2ae8 s LYS 121 CO 0.67 0.03 1.61 0.93 -0.76 0.00 0.00 175.35 177.83 2ae8 h GLU 122 N 3.39 0.00 -4.11 1.68 5.08 -1.96 -3.44 114.58 115.22 2ae8 h GLU 122 Ca -0.36 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.79 2ae8 h GLU 122 Cb 1.18 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.21 2ae8 h GLU 122 CO 0.57 0.22 -0.71 0.15 -1.00 0.00 0.00 179.01 178.24 2ae8 s LYS 123 N -3.22 0.33 -0.22 2.33 1.02 -1.26 -1.73 119.74 116.98 2ae8 s LYS 123 Ca 0.04 -0.54 -0.00 0.00 0.02 0.00 0.00 55.97 55.49 2ae8 s LYS 123 Cb 0.07 -0.03 0.02 0.00 -0.52 0.00 0.00 37.83 37.38 2ae8 s LYS 123 CO 0.68 -0.01 -0.11 0.14 -0.92 0.00 0.00 175.35 175.13 2ae8 s VAL 124 N -1.18 2.55 0.00 3.17 -7.23 -0.63 -4.92 120.40 112.15 2ae8 s VAL 124 Ca -0.12 -1.02 0.00 0.00 -1.81 0.00 0.00 61.98 59.03 2ae8 s VAL 124 Cb -0.08 -2.24 0.00 0.00 0.56 0.00 0.00 36.38 34.62 2ae8 s VAL 124 CO -0.00 0.31 0.00 0.61 -0.31 0.00 0.00 175.10 175.71 2ae8 n GLY 125 N 4.63 3.17 0.61 2.32 0.00 -1.26 -0.98 105.19 113.69 2ae8 n GLY 125 Ca -0.18 0.27 0.11 0.00 0.00 0.00 0.00 46.02 46.22 2ae8 n GLY 125 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2ae8 n THR 126 N 0.00 0.00 -2.86 2.61 5.66 -1.26 -4.95 114.28 113.48 2ae8 n THR 126 Ca 0.00 -0.34 -0.42 0.00 -3.05 0.00 0.00 64.05 60.25 2ae8 n THR 126 Cb 0.00 1.32 -0.04 0.00 -1.55 0.00 0.00 70.33 70.06 2ae8 n THR 126 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 2ae8 s PHE 127 N -2.28 3.42 -0.21 1.09 5.36 -0.15 -5.01 117.98 120.21 2ae8 s PHE 127 Ca 0.21 1.29 -0.29 0.00 -0.96 0.00 0.00 56.93 57.17 2ae8 s PHE 127 Cb 0.18 -3.04 -0.03 0.00 -0.34 0.00 0.00 43.02 39.79 2ae8 s PHE 127 CO 0.48 -0.26 1.66 -0.51 -1.46 0.00 0.00 175.22 175.13 2ae8 s ASP 128 N 1.17 6.34 0.46 6.13 -0.00 -1.26 -1.61 116.67 127.89 2ae8 s ASP 128 Ca 0.39 1.68 0.20 0.00 -0.00 0.00 0.00 52.55 54.82 2ae8 s ASP 128 Cb -0.16 -2.53 1.12 0.00 -0.00 0.00 0.00 42.92 41.35 2ae8 s ASP 128 CO 0.12 -1.28 1.97 0.00 -0.00 0.00 0.00 175.17 175.98 2ae8 h THR 129 N 6.17 0.88 0.00 -1.27 1.03 -1.62 -1.30 112.91 116.79 2ae8 h THR 129 Ca -0.35 -0.78 0.00 0.00 -0.01 0.00 0.00 66.41 65.27 2ae8 h THR 129 Cb 1.16 1.46 0.00 0.00 -1.07 0.00 0.00 68.15 69.70 2ae8 h THR 129 CO 1.00 0.20 0.03 1.05 -0.01 0.00 0.00 175.52 177.79 2ae8 h GLU 130 N 0.00 0.00 0.00 0.00 4.11 -1.90 -2.17 114.58 114.62 2ae8 h GLU 130 Ca -0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.38 2ae8 h GLU 130 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2ae8 h GLU 130 CO 0.03 0.00 -0.22 -0.07 0.07 0.00 0.00 179.01 178.82 2ae8 h LEU 131 N 0.00 0.00 -0.09 3.06 3.38 -1.63 -3.25 115.31 116.78 2ae8 h LEU 131 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2ae8 h LEU 131 Cb 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2ae8 h LEU 131 CO 0.00 0.22 0.01 0.58 0.09 0.00 0.00 178.44 179.34 2ae8 h VAL 132 N 0.00 0.95 -0.66 1.22 2.07 -1.58 -0.18 116.25 118.07 2ae8 h VAL 132 Ca -0.00 -0.02 -0.08 0.00 0.82 0.00 0.00 66.70 67.42 2ae8 h VAL 132 Cb 0.86 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 2ae8 h VAL 132 CO 0.03 0.01 0.10 -0.08 0.02 0.00 0.00 177.57 177.65 2ae8 h GLU 133 N 0.05 1.08 -0.82 1.57 4.81 -1.76 -2.05 114.58 117.45 2ae8 h GLU 133 Ca 0.04 -0.28 0.05 0.00 -0.13 0.00 0.00 59.36 59.03 2ae8 h GLU 133 Cb 0.04 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.24 2ae8 h GLU 133 CO -0.06 0.99 0.54 0.93 -0.73 0.00 0.00 179.01 180.67 2ae8 h GLU 134 N 1.01 0.94 -0.04 1.92 4.39 -1.49 -0.80 114.58 120.52 2ae8 h GLU 134 Ca 0.20 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 2ae8 h GLU 134 Cb 0.43 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2ae8 h GLU 134 CO 0.01 0.62 -0.01 0.35 -1.16 0.00 0.00 179.01 178.83 2ae8 h PHE 135 N 0.97 0.08 -0.47 4.33 3.57 -0.66 -2.28 116.94 122.49 2ae8 h PHE 135 Ca 0.34 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.74 2ae8 h PHE 135 Cb 0.11 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2ae8 h PHE 135 CO -0.00 0.42 -0.01 0.74 -2.23 0.00 0.00 178.31 177.22 2ae8 h PHE 136 N -0.28 0.83 -0.30 0.41 0.04 -1.18 -1.38 116.94 115.09 2ae8 h PHE 136 Ca 0.01 -0.12 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 2ae8 h PHE 136 Cb 0.39 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 2ae8 h PHE 136 CO 0.05 0.78 0.15 -0.09 -0.60 0.00 0.00 178.31 178.61 2ae8 h ARG 137 N 0.73 0.43 -0.45 1.51 2.43 -1.17 -0.66 114.38 117.20 2ae8 h ARG 137 Ca 0.14 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.27 2ae8 h ARG 137 Cb 0.47 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 2ae8 h ARG 137 CO 0.02 0.40 0.26 0.00 -1.51 0.00 0.00 179.97 179.14 2ae8 h ALA 138 N 1.01 0.57 0.28 2.80 0.00 -1.00 -1.22 119.26 121.70 2ae8 h ALA 138 Ca 0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2ae8 h ALA 138 Cb 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2ae8 h ALA 138 CO -0.01 -0.06 -0.13 0.28 0.00 0.00 0.00 179.25 179.32 2ae8 h VAL 139 N 0.52 0.76 -0.50 0.00 2.07 -1.17 -2.80 116.25 115.14 2ae8 h VAL 139 Ca 0.18 -0.50 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 2ae8 h VAL 139 Cb 0.03 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 2ae8 h VAL 139 CO -0.09 0.10 0.11 0.58 0.02 0.00 0.00 177.57 178.29 2ae8 h VAL 140 N -0.64 1.24 -0.23 2.57 2.07 -1.04 -0.35 116.25 119.88 2ae8 h VAL 140 Ca -0.04 -0.86 -0.13 0.00 0.82 0.00 0.00 66.70 66.48 2ae8 h VAL 140 Cb 0.45 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2ae8 h VAL 140 CO 0.06 0.31 -0.38 0.40 0.02 0.00 0.00 177.57 177.98 2ae8 h ILE 141 N 0.68 1.32 0.00 4.57 1.08 -1.32 -0.98 117.51 122.86 2ae8 h ILE 141 Ca 0.15 -1.59 -0.14 0.00 -0.39 0.00 0.00 64.86 62.89 2ae8 h ILE 141 Cb 0.35 1.78 -0.02 0.00 -3.07 0.00 0.00 36.82 35.86 2ae8 h ILE 141 CO 0.00 0.50 -0.65 0.78 -0.69 0.00 0.00 178.15 178.10 2ae8 h ASN 142 N 0.36 0.00 0.64 1.72 2.35 -1.44 -2.48 115.58 116.73 2ae8 h ASN 142 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2ae8 h ASN 142 Cb 0.98 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.35 2ae8 h ASN 142 CO 0.09 0.65 0.00 0.00 -1.65 0.00 0.00 177.43 176.51 2ae8 n ALA 143 N -2.30 2.20 -3.70 -0.83 0.00 -0.15 -4.08 120.51 111.65 2ae8 n ALA 143 Ca 0.00 -0.10 -0.24 0.00 0.00 0.00 0.00 53.44 53.10 2ae8 n ALA 143 Cb 0.74 -1.40 0.05 0.00 0.00 0.00 0.00 19.45 18.84 2ae8 n ALA 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ae8 n ARG 144 N -1.38 -6.31 -3.68 0.00 1.74 -0.79 -4.50 116.66 101.73 2ae8 n ARG 144 Ca 0.09 0.71 -0.30 0.00 -0.77 0.00 0.00 57.85 57.59 2ae8 n ARG 144 Cb 0.24 -5.60 -0.04 0.00 -1.02 0.00 0.00 32.46 26.04 2ae8 n ARG 144 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2ae8 s LEU 145 N -7.01 4.25 -0.24 0.55 1.43 -0.44 -1.65 118.68 115.56 2ae8 s LEU 145 Ca 0.39 0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 53.86 2ae8 s LEU 145 Cb -0.18 -3.24 -0.05 0.00 0.03 0.00 0.00 46.19 42.75 2ae8 s LEU 145 CO 0.78 0.01 0.23 -0.89 0.23 0.00 0.00 176.35 176.71 2ae8 s THR 146 N -1.76 5.30 -0.03 5.49 2.01 -0.29 -1.36 115.64 125.01 2ae8 s THR 146 Ca 0.40 0.31 0.01 0.00 0.31 0.00 0.00 61.69 62.72 2ae8 s THR 146 Cb -0.12 -3.57 0.02 0.00 0.01 0.00 0.00 72.50 68.85 2ae8 s THR 146 CO 0.27 0.29 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.59 2ae8 s THR 147 N 1.33 0.28 -0.20 -0.82 2.01 0.57 -0.41 115.64 118.38 2ae8 s THR 147 Ca 0.10 -0.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.07 2ae8 s THR 147 Cb -0.14 -0.33 -0.00 0.00 0.01 0.00 0.00 72.50 72.04 2ae8 s THR 147 CO 0.07 0.15 -0.08 -1.00 -0.69 0.00 0.00 174.62 173.06 2ae8 s HIS 148 N 0.76 2.91 -0.18 4.92 3.76 -0.20 -0.84 115.29 126.41 2ae8 s HIS 148 Ca -0.08 -1.07 -0.04 0.00 -0.15 0.00 0.00 55.06 53.73 2ae8 s HIS 148 Cb -0.11 -2.04 -0.02 0.00 1.11 0.00 0.00 32.58 31.51 2ae8 s HIS 148 CO -0.01 -0.58 -0.04 0.42 -0.85 0.00 0.00 174.74 173.68 2ae8 s ILE 149 N 1.34 3.67 -0.08 0.60 1.01 0.30 -1.20 121.20 126.84 2ae8 s ILE 149 Ca 0.04 -0.42 -0.00 0.00 0.00 0.00 0.00 60.65 60.27 2ae8 s ILE 149 Cb -0.14 -2.63 0.02 0.00 0.01 0.00 0.00 42.46 39.72 2ae8 s ILE 149 CO -0.05 0.46 -0.04 -1.81 0.00 0.00 0.00 174.94 173.50 2ae8 s ASP 150 N 0.82 1.66 -0.53 3.58 1.01 -0.19 -0.49 116.67 122.53 2ae8 s ASP 150 Ca -0.01 -0.18 -0.22 0.00 0.71 0.00 0.00 52.55 52.84 2ae8 s ASP 150 Cb -0.15 -0.61 0.05 0.00 1.01 0.00 0.00 42.92 43.22 2ae8 s ASP 150 CO 0.02 -0.12 0.82 -0.22 0.21 0.00 0.00 175.17 175.87 2ae8 s LEU 151 N 1.54 4.41 0.11 1.23 0.20 -0.58 -0.83 118.68 124.77 2ae8 s LEU 151 Ca -0.00 -0.53 -0.13 0.00 0.69 0.00 0.00 54.13 54.17 2ae8 s LEU 151 Cb -0.13 -2.71 -0.13 0.00 -0.43 0.00 0.00 46.19 42.80 2ae8 s LEU 151 CO -0.04 -1.08 1.35 0.40 -0.29 0.00 0.00 176.35 176.68 2ae8 h ILE 152 N 5.96 1.28 -3.01 6.68 2.04 -1.11 -3.46 117.51 125.89 2ae8 h ILE 152 Ca -0.26 -1.85 -0.08 0.00 1.00 0.00 0.00 64.86 63.67 2ae8 h ILE 152 Cb 1.08 1.82 -0.17 0.00 -0.74 0.00 0.00 36.82 38.82 2ae8 h ILE 152 CO 1.03 0.59 -0.11 0.00 0.00 0.00 0.00 178.15 179.67 2ae8 s ARG 153 N -3.93 0.91 0.00 2.37 1.70 -1.12 -4.96 118.95 113.91 2ae8 s ARG 153 Ca -0.11 -0.34 0.00 0.00 -0.47 0.00 0.00 55.73 54.81 2ae8 s ARG 153 Cb 0.09 0.41 0.00 0.00 -0.57 0.00 0.00 34.95 34.88 2ae8 s ARG 153 CO 0.90 -0.31 0.00 0.41 -1.08 0.00 0.00 175.30 175.22 2ae8 n GLY 154 N 0.56 5.19 0.00 3.88 0.00 -1.26 -1.15 105.19 112.40 2ae8 n GLY 154 Ca -0.19 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.65 2ae8 n GLY 154 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ae8 n GLY 155 N 0.00 0.95 3.53 -0.02 0.00 -1.26 -4.59 105.19 103.79 2ae8 n GLY 155 Ca 0.00 0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2ae8 n GLY 155 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ae8 s ASN 156 N 0.00 5.23 0.20 1.61 3.84 -1.26 -4.86 114.94 119.70 2ae8 s ASN 156 Ca 0.00 -0.09 -0.07 0.00 0.21 0.00 0.00 52.86 52.92 2ae8 s ASN 156 Cb 0.00 -1.90 0.13 0.00 -0.55 0.00 0.00 41.25 38.93 2ae8 s ASN 156 CO 0.00 0.09 1.63 0.74 -2.79 0.00 0.00 177.10 176.77 2ae8 h THR 157 N 5.21 1.27 -0.39 -5.21 2.02 -1.96 -0.01 112.91 113.83 2ae8 h THR 157 Ca -0.36 -1.26 0.00 0.00 0.77 0.00 0.00 66.41 65.57 2ae8 h THR 157 Cb 1.18 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 68.60 2ae8 h THR 157 CO 0.63 0.44 0.26 -0.74 0.37 0.00 0.00 175.52 176.47 2ae8 h HIS 158 N 0.81 0.49 -0.80 3.16 -0.00 -1.95 -1.48 115.15 115.38 2ae8 h HIS 158 Ca 0.13 0.01 -0.03 0.00 -0.00 0.00 0.00 60.37 60.48 2ae8 h HIS 158 Cb 0.66 -0.17 -0.04 0.00 -0.00 0.00 0.00 27.41 27.87 2ae8 h HIS 158 CO 0.04 0.32 0.39 0.45 -0.00 0.00 0.00 177.93 179.13 2ae8 h HIS 159 N 0.53 1.15 0.21 5.26 3.86 -1.90 -0.68 115.15 123.57 2ae8 h HIS 159 Ca 0.14 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 2ae8 h HIS 159 Cb -0.05 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.06 2ae8 h HIS 159 CO -0.05 0.82 -0.10 0.93 0.86 0.00 0.00 177.93 180.40 2ae8 h GLU 160 N 1.14 -0.27 -0.50 2.45 5.08 -0.55 0.63 114.58 122.55 2ae8 h GLU 160 Ca 0.28 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.63 2ae8 h GLU 160 Cb 0.10 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2ae8 h GLU 160 CO -0.04 -0.07 0.20 0.82 -1.00 0.00 0.00 179.01 178.93 2ae8 h ILE 161 N -0.44 1.21 -0.21 3.13 2.04 -1.21 -2.46 117.51 119.57 2ae8 h ILE 161 Ca -0.03 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.17 2ae8 h ILE 161 Cb 0.33 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2ae8 h ILE 161 CO 0.05 0.25 0.11 -0.08 0.00 0.00 0.00 178.15 178.48 2ae8 h GLU 162 N 0.67 0.30 -0.82 2.37 4.81 -1.01 -0.47 114.58 120.43 2ae8 h GLU 162 Ca 0.17 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.45 2ae8 h GLU 162 Cb 0.19 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.44 2ae8 h GLU 162 CO -0.01 0.29 0.47 0.00 -0.73 0.00 0.00 179.01 179.02 2ae8 h ALA 163 N 0.99 1.15 -0.19 2.92 0.00 -0.85 0.52 119.26 123.81 2ae8 h ALA 163 Ca 0.07 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2ae8 h ALA 163 Cb 0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2ae8 h ALA 163 CO -0.01 0.11 0.07 0.82 0.00 0.00 0.00 179.25 180.24 2ae8 h ILE 164 N 0.80 1.18 -0.57 0.00 2.04 -1.04 -0.05 117.51 119.86 2ae8 h ILE 164 Ca 0.39 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 2ae8 h ILE 164 Cb 0.33 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 2ae8 h ILE 164 CO -0.23 0.17 0.34 -0.26 0.00 0.00 0.00 178.15 178.16 2ae8 h PHE 165 N 0.14 0.76 -0.12 1.37 0.04 -0.79 -0.54 116.94 117.80 2ae8 h PHE 165 Ca 0.06 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 2ae8 h PHE 165 Cb 0.20 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 2ae8 h PHE 165 CO -0.00 0.53 0.07 0.87 -0.60 0.00 0.00 178.31 179.17 2ae8 h LYS 166 N 0.77 0.16 -0.34 1.51 1.57 -0.80 -2.06 116.57 117.38 2ae8 h LYS 166 Ca 0.20 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.93 2ae8 h LYS 166 Cb -0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2ae8 h LYS 166 CO -0.04 0.16 0.06 0.00 -0.57 0.00 0.00 179.45 179.06 2ae8 h ALA 167 N 0.99 0.46 -0.30 3.86 0.00 -0.90 -1.67 119.26 121.71 2ae8 h ALA 167 Ca 0.04 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.75 2ae8 h ALA 167 Cb 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2ae8 h ALA 167 CO -0.01 0.16 0.19 0.35 0.00 0.00 0.00 179.25 179.94 2ae8 h PHE 168 N 0.41 0.36 -0.29 0.00 3.57 -1.09 -0.86 116.94 119.05 2ae8 h PHE 168 Ca 0.10 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.63 2ae8 h PHE 168 Cb 0.36 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 2ae8 h PHE 168 CO 0.02 0.22 0.16 0.77 -2.23 0.00 0.00 178.31 177.26 2ae8 h SER 169 N 0.39 0.26 -0.27 0.41 0.02 -1.27 0.10 113.55 113.19 2ae8 h SER 169 Ca 0.11 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 2ae8 h SER 169 Cb -0.03 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 2ae8 h SER 169 CO -0.03 0.19 0.00 0.03 -1.14 0.00 0.00 176.83 175.88 2ae8 h ARG 170 N 0.34 0.47 -0.55 3.45 3.08 -1.21 0.99 114.38 120.95 2ae8 h ARG 170 Ca 0.11 -0.15 0.01 0.00 0.07 0.00 0.00 59.98 60.03 2ae8 h ARG 170 Cb 0.00 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 2ae8 h ARG 170 CO -0.06 0.63 0.35 0.00 -1.07 0.00 0.00 179.97 179.83 2ae8 h ALA 171 N 0.82 0.71 0.16 0.04 0.00 -0.97 0.03 119.26 120.05 2ae8 h ALA 171 Ca 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2ae8 h ALA 171 Cb 0.42 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2ae8 h ALA 171 CO 0.01 0.10 -0.08 1.25 0.00 0.00 0.00 179.25 180.54 2ae8 h LEU 172 N 0.71 -0.19 -0.53 0.00 5.85 -0.65 -1.30 115.31 119.21 2ae8 h LEU 172 Ca 0.21 -0.00 0.11 0.00 0.84 0.00 0.00 57.88 59.03 2ae8 h LEU 172 Cb -0.04 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 40.93 2ae8 h LEU 172 CO -0.07 -0.12 -0.20 1.23 -0.34 0.00 0.00 178.44 178.94 2ae8 h GLY 173 N -0.23 0.21 0.69 3.75 0.00 -0.48 -0.26 103.07 106.75 2ae8 h GLY 173 Ca -0.02 0.26 0.04 0.00 0.00 0.00 0.00 47.33 47.61 2ae8 h GLY 173 CO 0.04 -0.22 0.10 -2.22 0.00 0.00 0.00 176.54 174.24 2ae8 h ILE 174 N -0.08 0.89 -0.39 2.60 2.04 -0.82 -2.49 117.51 119.26 2ae8 h ILE 174 Ca 0.25 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.99 2ae8 h ILE 174 Cb 0.46 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 2ae8 h ILE 174 CO -0.58 0.04 0.09 0.00 0.00 0.00 0.00 178.15 177.70 2ae8 h ALA 175 N 1.22 1.43 0.00 1.87 0.00 -0.37 -2.51 119.26 120.90 2ae8 h ALA 175 Ca 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ae8 h ALA 175 Cb 0.13 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2ae8 h ALA 175 CO -0.17 0.41 0.00 1.28 0.00 0.00 0.00 179.25 180.78 2ae8 n LEU 176 N -4.33 0.00 -4.69 0.00 4.77 -0.19 -0.43 117.00 112.13 2ae8 n LEU 176 Ca 0.02 0.35 -0.42 0.00 -0.03 0.00 0.00 56.01 55.93 2ae8 n LEU 176 Cb 0.19 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 2ae8 n LEU 176 CO 0.38 -0.02 1.49 -0.89 -1.33 0.00 0.00 177.39 177.02 2ae8 s THR 177 N -2.70 2.54 0.47 -5.08 2.01 -0.95 -4.73 115.64 107.19 2ae8 s THR 177 Ca 0.23 0.02 -0.25 0.00 0.31 0.00 0.00 61.69 62.00 2ae8 s THR 177 Cb 0.19 -3.01 -0.08 0.00 0.01 0.00 0.00 72.50 69.61 2ae8 s THR 177 CO 0.45 -0.00 1.39 0.00 -0.69 0.00 0.00 174.62 175.77 2ae8 n ALA 178 N 5.84 1.80 0.20 7.40 0.00 -1.26 -0.18 120.51 134.31 2ae8 n ALA 178 Ca 0.18 0.23 0.02 0.00 0.00 0.00 0.00 53.44 53.87 2ae8 n ALA 178 Cb 0.38 -2.36 0.02 0.00 0.00 0.00 0.00 19.45 17.49 2ae8 n ALA 178 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13