#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aje s SER -6 N 0.00 2.28 0.56 1.61 0.15 -1.26 -5.15 113.70 111.89 1aje s SER -6 Ca 0.00 -1.00 0.01 0.00 0.70 0.00 0.00 55.95 55.66 1aje s SER -6 Cb 0.00 -0.09 0.03 0.00 -1.71 0.00 0.00 66.02 64.25 1aje s SER -6 CO 0.00 -0.22 0.79 -0.54 1.20 0.00 0.00 173.24 174.47 1aje s LYS -5 N -3.58 2.54 0.93 5.44 -0.14 -1.26 -5.03 119.74 118.64 1aje s LYS -5 Ca 0.19 -0.75 -0.16 0.00 -1.36 0.00 0.00 55.97 53.90 1aje s LYS -5 Cb -0.00 -2.47 -0.10 0.00 -1.68 0.00 0.00 37.83 33.57 1aje s LYS -5 CO 0.04 -0.73 -0.40 -0.89 -0.76 0.00 0.00 175.35 172.61 1aje n ILE -4 N -2.37 0.11 -0.64 2.17 -0.00 -1.26 -4.85 119.36 112.52 1aje n ILE -4 Ca 0.08 -0.43 -0.20 0.00 -0.00 0.00 0.00 62.75 62.20 1aje n ILE -4 Cb 0.60 -0.18 0.12 0.00 -0.00 0.00 0.00 39.64 40.17 1aje n ILE -4 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1aje n ILE -3 N -2.65 0.00 -1.03 1.39 -0.00 -1.26 -4.82 119.36 111.00 1aje n ILE -3 Ca 0.02 -0.07 -0.36 0.00 -0.00 0.00 0.00 62.75 62.34 1aje n ILE -3 Cb 0.54 -0.38 0.06 0.00 -0.00 0.00 0.00 39.64 39.86 1aje n ILE -3 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35 1aje n SER -2 N -0.16 -4.11 -3.70 4.38 7.64 -1.26 -4.99 113.62 111.41 1aje n SER -2 Ca 0.03 0.34 -0.07 0.00 1.01 0.00 0.00 58.87 60.18 1aje n SER -2 Cb 0.39 -0.94 -0.01 0.00 -1.01 0.00 0.00 64.21 62.64 1aje n SER -2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aje s ALA -1 N -2.08 -1.15 -0.67 -0.43 0.00 -1.26 -4.74 121.76 111.43 1aje s ALA -1 Ca 0.50 -0.38 -0.09 0.00 0.00 0.00 0.00 51.96 52.00 1aje s ALA -1 Cb -0.26 0.82 0.09 0.00 0.00 0.00 0.00 23.12 23.76 1aje s ALA -1 CO 0.73 -1.03 0.21 0.00 0.00 0.00 0.00 175.76 175.68 1aje n MET 1 N -0.47 -1.39 0.31 0.00 0.00 -1.00 -4.63 117.12 109.94 1aje n MET 1 Ca -0.05 0.05 0.11 0.00 0.00 0.00 0.00 57.70 57.81 1aje n MET 1 Cb 0.59 -2.78 0.60 0.00 0.00 0.00 0.00 33.22 31.64 1aje n MET 1 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 175.97 177.93 1aje h GLN 2 N -0.31 0.00 -5.36 3.17 1.08 -1.91 -3.46 115.11 108.32 1aje h GLN 2 Ca -0.21 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 56.99 1aje h GLN 2 Cb 0.74 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 28.08 1aje h GLN 2 CO 0.32 0.00 -1.10 2.41 -0.95 0.00 0.00 178.83 179.51 1aje n THR 3 N -2.69 -9.15 -3.94 -0.54 -1.04 -1.26 -4.93 114.28 90.73 1aje n THR 3 Ca -0.01 1.92 -0.34 0.00 -2.04 0.00 0.00 64.05 63.58 1aje n THR 3 Cb 0.49 -5.26 -0.14 0.00 -1.82 0.00 0.00 70.33 63.60 1aje n THR 3 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1aje s ILE 4 N -0.45 2.74 -0.08 12.58 1.09 0.39 -4.88 121.20 132.59 1aje s ILE 4 Ca -0.20 -1.70 -0.21 0.00 -1.10 0.00 0.00 60.65 57.44 1aje s ILE 4 Cb 0.01 -2.70 -0.04 0.00 -1.06 0.00 0.00 42.46 38.67 1aje s ILE 4 CO 0.54 -0.26 0.60 -0.54 -0.10 0.00 0.00 174.94 175.17 1aje s LYS 5 N 1.15 4.38 -0.02 2.79 -0.14 -1.26 0.16 119.74 126.79 1aje s LYS 5 Ca -0.01 0.69 0.07 0.00 -1.36 0.00 0.00 55.97 55.36 1aje s LYS 5 Cb -0.20 -3.43 -0.02 0.00 -1.68 0.00 0.00 37.83 32.50 1aje s LYS 5 CO -0.04 0.15 -0.25 0.00 -0.76 0.00 0.00 175.35 174.45 1aje s VAL 7 N -0.59 4.49 0.04 0.00 1.01 0.67 0.27 120.40 126.30 1aje s VAL 7 Ca 0.09 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.38 1aje s VAL 7 Cb -0.10 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1aje s VAL 7 CO -0.01 0.15 -0.15 -0.69 0.00 0.00 0.00 175.10 174.41 1aje s VAL 8 N -1.36 3.04 0.04 2.92 1.01 -0.49 0.10 120.40 125.68 1aje s VAL 8 Ca 0.28 -1.12 0.01 0.00 0.00 0.00 0.00 61.98 61.16 1aje s VAL 8 Cb -0.12 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1aje s VAL 8 CO 0.21 0.31 -0.06 0.68 0.00 0.00 0.00 175.10 176.24 1aje s VAL 9 N -0.98 0.43 0.02 2.92 -7.23 -1.05 -3.77 120.40 110.74 1aje s VAL 9 Ca 0.16 -1.18 0.00 0.00 -1.81 0.00 0.00 61.98 59.15 1aje s VAL 9 Cb -0.11 -0.70 0.00 0.00 0.56 0.00 0.00 36.38 36.13 1aje s VAL 9 CO 0.07 -0.50 0.00 0.61 -0.31 0.00 0.00 175.10 174.96 1aje n GLY 10 N 1.24 -2.21 0.96 2.32 0.00 -1.26 -2.91 105.19 103.33 1aje n GLY 10 Ca -0.21 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1aje n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1aje n ASP 11 N -0.86 0.74 0.00 1.61 8.00 -1.26 -4.87 116.55 119.91 1aje n ASP 11 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1aje n ASP 11 Cb 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 1aje n ASP 11 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aje n GLY 12 N 2.59 -1.04 0.44 0.44 0.00 -1.26 -2.35 105.19 104.01 1aje n GLY 12 Ca 0.00 -1.42 0.35 0.00 0.00 0.00 0.00 46.02 44.95 1aje n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aje n ALA 13 N -0.15 1.22 -0.00 4.61 0.00 -1.26 -2.86 120.51 122.06 1aje n ALA 13 Ca 0.00 0.61 -0.01 0.00 0.00 0.00 0.00 53.44 54.04 1aje n ALA 13 Cb 0.00 -0.84 -0.00 0.00 0.00 0.00 0.00 19.45 18.61 1aje n ALA 13 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1aje n VAL 14 N -3.94 0.04 0.00 0.00 3.14 -1.26 -5.01 118.33 111.31 1aje n VAL 14 Ca 0.32 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.69 1aje n VAL 14 Cb 1.35 -1.32 0.00 0.00 -1.06 0.00 0.00 33.84 32.80 1aje n VAL 14 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1aje n GLY 15 N 3.05 3.18 0.00 7.55 0.00 -0.99 -4.91 105.19 113.07 1aje n GLY 15 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1aje n GLY 15 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1aje n LYS 16 N 0.00 0.00 -0.05 1.61 3.00 -1.18 -3.94 118.16 117.59 1aje n LYS 16 Ca 0.00 0.32 -0.01 0.00 -0.00 0.00 0.00 58.31 58.61 1aje n LYS 16 Cb 0.00 -1.53 -0.01 0.00 0.00 0.00 0.00 35.03 33.49 1aje n LYS 16 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1aje n THR 17 N -1.31 -0.09 -0.14 3.15 -1.04 -1.26 0.14 114.28 113.75 1aje n THR 17 Ca 0.00 1.03 0.28 0.00 -2.04 0.00 0.00 64.05 63.32 1aje n THR 17 Cb 0.03 -1.35 0.71 0.00 -1.82 0.00 0.00 70.33 67.91 1aje n THR 17 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1aje h LEU 19 N 0.00 -0.49 -1.00 0.00 7.12 0.99 -2.67 115.31 119.27 1aje h LEU 19 Ca 0.40 0.02 0.18 0.00 0.13 0.00 0.00 57.88 58.60 1aje h LEU 19 Cb 1.79 0.13 -0.18 0.00 -0.53 0.00 0.00 40.66 41.87 1aje h LEU 19 CO -0.00 -0.34 -0.32 0.18 -0.13 0.00 0.00 178.44 177.82 1aje n LEU 20 N -3.54 -0.50 -0.35 2.25 4.32 -0.44 0.84 117.00 119.58 1aje n LEU 20 Ca -0.07 1.73 0.04 0.00 -0.02 0.00 0.00 56.01 57.69 1aje n LEU 20 Cb 0.22 -0.46 0.11 0.00 -1.62 0.00 0.00 43.42 41.67 1aje n LEU 20 CO 0.17 -1.61 0.65 0.40 -1.22 0.00 0.00 177.39 175.79 1aje h ILE 21 N 0.00 0.04 -0.26 -0.08 1.08 -1.24 0.52 117.51 117.57 1aje h ILE 21 Ca 0.42 0.00 -0.16 0.00 -0.39 0.00 0.00 64.86 64.72 1aje h ILE 21 Cb 0.66 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.45 1aje h ILE 21 CO -1.01 0.00 -0.47 0.77 -0.69 0.00 0.00 178.15 176.75 1aje h SER 22 N -0.01 0.86 -1.12 1.72 4.64 0.77 1.36 113.55 121.77 1aje h SER 22 Ca 0.43 -0.54 0.33 0.00 -0.47 0.00 0.00 61.79 61.54 1aje h SER 22 Cb 0.68 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 62.48 1aje h SER 22 CO -0.98 1.23 1.06 0.10 -0.87 0.00 0.00 176.83 177.37 1aje h TYR 23 N 0.52 0.00 0.00 4.77 -0.00 0.19 0.89 116.97 123.34 1aje h TYR 23 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.74 1aje h TYR 23 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.81 1aje h TYR 23 CO 0.08 0.00 -1.00 -2.37 -0.00 0.00 0.00 178.16 174.87 1aje n THR 24 N -3.60 0.00 0.70 -0.90 5.66 -0.87 -4.78 114.28 110.50 1aje n THR 24 Ca 0.25 0.00 0.08 0.00 -3.05 0.00 0.00 64.05 61.32 1aje n THR 24 Cb 1.41 -0.58 -0.03 0.00 -1.55 0.00 0.00 70.33 69.59 1aje n THR 24 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1aje n THR 25 N -2.54 0.00 -1.81 1.09 -2.24 0.46 -4.94 114.28 104.31 1aje n THR 25 Ca 0.00 -0.27 -0.02 0.00 -2.27 0.00 0.00 64.05 61.48 1aje n THR 25 Cb 0.50 1.13 -0.01 0.00 -2.10 0.00 0.00 70.33 69.85 1aje n THR 25 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1aje n ASN 26 N -0.53 -1.14 -3.36 3.42 2.85 0.31 -4.78 115.26 112.02 1aje n ASN 26 Ca 0.05 0.26 -0.15 0.00 -0.11 0.00 0.00 54.58 54.63 1aje n ASN 26 Cb 0.30 -1.25 -0.08 0.00 1.24 0.00 0.00 39.78 39.99 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1aje s LYS 27 N -3.66 0.48 0.13 1.20 2.20 -1.26 -4.76 119.74 114.07 1aje s LYS 27 Ca 0.00 -0.38 -0.14 0.00 -0.36 0.00 0.00 55.97 55.09 1aje s LYS 27 Cb 0.00 -0.59 -0.07 0.00 -1.51 0.00 0.00 37.83 35.66 1aje s LYS 27 CO 0.00 -1.10 0.54 -0.59 -0.36 0.00 0.00 175.35 173.83 1aje s PHE 28 N 2.01 3.62 -0.43 4.03 -0.71 -1.26 -4.77 117.98 120.47 1aje s PHE 28 Ca 0.13 1.05 -0.03 0.00 -1.04 0.00 0.00 56.93 57.03 1aje s PHE 28 Cb -0.14 -2.36 0.09 0.00 -1.21 0.00 0.00 43.02 39.40 1aje s PHE 28 CO -0.20 0.45 2.64 -0.35 -1.34 0.00 0.00 175.22 176.41 1aje n PRO 29 N 0.88 2.29 0.00 1.99 -0.04 -1.26 -4.90 135.00 133.95 1aje n PRO 29 Ca -0.06 -2.20 0.00 0.00 -0.04 0.00 0.00 63.50 61.20 1aje n PRO 29 Cb 0.52 -2.05 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 1aje n PRO 29 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1aje n SER 30 N 0.77 0.00 -2.45 3.54 3.41 -1.26 -3.65 113.62 113.98 1aje n SER 30 Ca 0.46 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.82 1aje n SER 30 Cb 0.56 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.52 1aje n SER 30 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1aje n GLU 31 N 0.00 3.17 -1.42 4.33 1.02 -1.26 -5.01 120.64 121.47 1aje n GLU 31 Ca 0.00 -4.31 0.00 0.00 -0.02 0.00 0.00 57.16 52.83 1aje n GLU 31 Cb 0.00 -2.13 0.00 0.00 -0.02 0.00 0.00 31.44 29.29 1aje n GLU 31 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1aje n TYR 32 N -0.46 0.00 -2.71 -0.32 4.19 -1.24 -4.99 117.16 111.63 1aje n TYR 32 Ca 0.36 0.00 -0.08 0.00 3.31 0.00 0.00 57.90 61.49 1aje n TYR 32 Cb 0.72 -0.47 0.10 0.00 0.49 0.00 0.00 39.34 40.17 1aje n TYR 32 CO 0.00 0.00 0.00 1.55 0.91 0.00 0.00 176.86 179.32 1aje n VAL 33 N 0.80 0.00 0.47 2.97 3.14 -1.26 -4.96 118.33 119.49 1aje n VAL 33 Ca 0.00 -1.39 0.12 0.00 -2.96 0.00 0.00 64.34 60.12 1aje n VAL 33 Cb 0.00 1.24 0.47 0.00 -1.06 0.00 0.00 33.84 34.49 1aje n VAL 33 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1aje n PRO 34 N -0.01 0.22 0.00 1.45 -0.04 -1.26 -4.89 135.00 130.47 1aje n PRO 34 Ca 0.00 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 1aje n PRO 34 Cb 0.75 -1.85 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 1aje n PRO 34 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1aje n THR 35 N -2.25 0.00 -3.77 0.52 -1.04 -1.26 -4.71 114.28 101.77 1aje n THR 35 Ca 0.03 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.91 1aje n THR 35 Cb 0.29 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.67 1aje n THR 35 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1aje s VAL 36 N 0.00 -0.02 -0.00 12.58 -7.23 -1.26 -5.16 120.40 119.30 1aje s VAL 36 Ca 0.00 0.08 -0.19 0.00 -1.81 0.00 0.00 61.98 60.07 1aje s VAL 36 Cb 0.00 -0.29 0.04 0.00 0.56 0.00 0.00 36.38 36.68 1aje s VAL 36 CO 0.00 0.03 0.41 0.12 -0.31 0.00 0.00 175.10 175.35 1aje s PHE 37 N 0.68 -0.29 0.00 2.82 5.36 -1.26 -5.17 117.98 120.12 1aje s PHE 37 Ca -0.05 0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.33 1aje s PHE 37 Cb -0.06 0.19 0.00 0.00 -0.34 0.00 0.00 43.02 42.81 1aje s PHE 37 CO -0.04 -0.49 0.00 -0.40 -1.46 0.00 0.00 175.22 172.84 1aje n ASP 38 N 0.96 0.00 -4.68 6.13 5.75 -1.26 -5.10 116.55 118.35 1aje n ASP 38 Ca -0.20 -0.17 -0.44 0.00 -0.01 0.00 0.00 54.79 53.97 1aje n ASP 38 Cb 0.57 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.63 1aje n ASP 38 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1aje n ASN 39 N -0.38 3.77 -3.75 -1.12 5.15 -1.26 -4.96 115.26 112.70 1aje n ASN 39 Ca 0.00 0.98 -0.13 0.00 -0.60 0.00 0.00 54.58 54.83 1aje n ASN 39 Cb 0.00 -1.48 -0.14 0.00 -0.53 0.00 0.00 39.78 37.63 1aje n ASN 39 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1aje s TYR 40 N 3.07 -0.23 -0.19 1.20 5.04 -1.26 -5.08 117.35 119.91 1aje s TYR 40 Ca 0.85 0.59 -0.01 0.00 -2.44 0.00 0.00 57.07 56.06 1aje s TYR 40 Cb -0.56 -0.01 0.05 0.00 0.35 0.00 0.00 41.96 41.79 1aje s TYR 40 CO 0.42 -0.18 -0.02 0.00 -1.34 0.00 0.00 175.55 174.42 1aje s ALA 41 N 1.04 1.44 0.77 3.97 0.00 -1.25 -2.46 121.76 125.27 1aje s ALA 41 Ca -0.08 -0.91 -0.07 0.00 0.00 0.00 0.00 51.96 50.91 1aje s ALA 41 Cb -0.10 -1.21 0.12 0.00 0.00 0.00 0.00 23.12 21.94 1aje s ALA 41 CO -0.06 -1.00 1.08 0.14 0.00 0.00 0.00 175.76 175.92 1aje s VAL 42 N 1.65 2.17 -0.20 0.00 -7.23 -0.73 -4.41 120.40 111.65 1aje s VAL 42 Ca -0.01 -0.34 -0.05 0.00 -1.81 0.00 0.00 61.98 59.77 1aje s VAL 42 Cb -0.17 -2.83 -0.02 0.00 0.56 0.00 0.00 36.38 33.93 1aje s VAL 42 CO -0.07 0.00 -0.01 -0.89 -0.31 0.00 0.00 175.10 173.82 1aje s THR 43 N -3.36 3.81 0.22 5.32 2.01 -1.26 0.13 115.64 122.51 1aje s THR 43 Ca 0.66 -0.36 0.03 0.00 0.31 0.00 0.00 61.69 62.33 1aje s THR 43 Cb -0.07 -2.73 0.03 0.00 0.01 0.00 0.00 72.50 69.75 1aje s THR 43 CO 0.46 0.43 0.26 0.52 -0.69 0.00 0.00 174.62 175.60 1aje n VAL 44 N 4.37 0.00 -3.66 3.82 0.31 -1.00 -4.82 118.33 117.35 1aje n VAL 44 Ca -0.17 -0.79 -0.09 0.00 -0.01 0.00 0.00 64.34 63.27 1aje n VAL 44 Cb 0.52 -0.64 -0.10 0.00 -0.91 0.00 0.00 33.84 32.70 1aje n VAL 44 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1aje s MET 45 N -2.98 0.29 -0.13 5.55 -1.94 -1.26 -1.78 119.30 117.05 1aje s MET 45 Ca 0.20 0.99 -0.14 0.00 -1.71 0.00 0.00 55.69 55.03 1aje s MET 45 Cb -0.02 0.27 -0.12 0.00 2.01 0.00 0.00 34.83 36.98 1aje s MET 45 CO 0.13 -0.25 0.26 0.82 -0.01 0.00 0.00 175.02 175.96 1aje h ILE 46 N 6.18 0.73 -0.08 2.53 5.03 -1.88 -3.44 117.51 126.58 1aje h ILE 46 Ca -0.16 -1.62 -0.17 0.00 -0.12 0.00 0.00 64.86 62.79 1aje h ILE 46 Cb 1.11 1.45 -0.27 0.00 -3.03 0.00 0.00 36.82 36.08 1aje h ILE 46 CO 0.12 0.25 -0.69 0.61 -0.68 0.00 0.00 178.15 177.76 1aje n GLY 47 N 1.65 1.19 0.00 5.37 0.00 -1.26 -4.92 105.19 107.23 1aje n GLY 47 Ca -0.09 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1aje n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aje n GLY 48 N -0.23 1.29 3.16 -0.02 0.00 -1.26 -5.10 105.19 103.03 1aje n GLY 48 Ca -0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1aje n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1aje s GLU 49 N 0.00 2.83 0.23 1.61 8.01 -1.26 -5.05 118.70 125.07 1aje s GLU 49 Ca 0.00 -0.79 -0.29 0.00 0.01 0.00 0.00 54.97 53.90 1aje s GLU 49 Cb 0.00 -2.24 -0.09 0.00 -4.31 0.00 0.00 34.13 27.49 1aje s GLU 49 CO 0.00 0.05 0.91 -1.25 0.01 0.00 0.00 175.26 174.99 1aje s PRO 50 N 0.65 4.80 -0.28 0.39 0.04 -1.25 -2.76 135.00 136.59 1aje s PRO 50 Ca -0.12 1.43 -0.03 0.00 0.04 0.00 0.00 61.00 62.32 1aje s PRO 50 Cb -0.16 -3.26 0.10 0.00 0.04 0.00 0.00 34.50 31.23 1aje s PRO 50 CO 0.03 0.52 0.17 0.71 0.04 0.00 0.00 177.00 178.46 1aje s TYR 51 N -1.20 0.10 0.69 0.56 2.02 -0.73 -2.39 117.35 116.40 1aje s TYR 51 Ca 0.41 -0.62 -0.17 0.00 -0.37 0.00 0.00 57.07 56.33 1aje s TYR 51 Cb -0.25 -0.75 -0.01 0.00 -0.40 0.00 0.00 41.96 40.55 1aje s TYR 51 CO 0.31 -0.81 1.00 2.41 -1.57 0.00 0.00 175.55 176.89 1aje n THR 52 N 5.27 3.26 -3.66 -0.71 -1.04 -1.24 -2.38 114.28 113.78 1aje n THR 52 Ca -0.05 -0.41 -0.27 0.00 -2.04 0.00 0.00 64.05 61.28 1aje n THR 52 Cb 0.44 -1.15 -0.17 0.00 -1.82 0.00 0.00 70.33 67.63 1aje n THR 52 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1aje s LEU 53 N -3.03 0.65 -0.54 -4.42 0.20 0.34 0.15 118.68 112.03 1aje s LEU 53 Ca 0.75 -0.69 -0.17 0.00 0.69 0.00 0.00 54.13 54.71 1aje s LEU 53 Cb -0.36 -0.37 0.10 0.00 -0.43 0.00 0.00 46.19 45.12 1aje s LEU 53 CO 0.48 -0.33 0.57 -0.83 -0.29 0.00 0.00 176.35 175.95 1aje s GLY 54 N 2.04 1.92 0.11 7.98 0.00 0.41 -1.76 107.32 118.01 1aje s GLY 54 Ca 0.01 -2.20 -0.22 0.00 0.00 0.00 0.00 44.72 42.31 1aje s GLY 54 CO -0.09 1.35 0.65 1.08 0.00 0.00 0.00 173.10 176.09 1aje s LEU 55 N 2.16 4.55 -0.04 0.66 1.43 -1.03 0.87 118.68 127.27 1aje s LEU 55 Ca 0.08 1.41 -0.03 0.00 -1.03 0.00 0.00 54.13 54.57 1aje s LEU 55 Cb -0.25 -3.06 0.02 0.00 0.03 0.00 0.00 46.19 42.93 1aje s LEU 55 CO 0.06 0.25 0.10 0.12 0.23 0.00 0.00 176.35 177.11 1aje s PHE 56 N -1.13 -0.10 0.58 0.29 5.36 0.14 -4.40 117.98 118.72 1aje s PHE 56 Ca 0.32 0.31 -0.10 0.00 -0.96 0.00 0.00 56.93 56.50 1aje s PHE 56 Cb -0.21 -0.05 0.13 0.00 -0.34 0.00 0.00 43.02 42.55 1aje s PHE 56 CO 0.22 -0.10 0.77 -0.40 -1.46 0.00 0.00 175.22 174.25 1aje n ASP 57 N 3.65 -0.07 0.00 6.13 5.68 -1.26 -1.39 116.55 129.28 1aje n ASP 57 Ca -0.20 -1.25 0.00 0.00 -0.50 0.00 0.00 54.79 52.84 1aje n ASP 57 Cb 0.55 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 1aje n ASP 57 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1aje n THR 58 N -3.14 0.00 -2.14 2.12 -2.24 -1.25 -4.66 114.28 102.98 1aje n THR 58 Ca 0.10 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.47 1aje n THR 58 Cb 0.34 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.32 1aje n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aje s ALA 59 N -1.48 3.54 0.00 6.98 0.00 -1.26 -4.39 121.76 125.15 1aje s ALA 59 Ca 0.00 1.20 0.00 0.00 0.00 0.00 0.00 51.96 53.16 1aje s ALA 59 Cb 0.00 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1aje s ALA 59 CO 0.00 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 175.57 1aje n GLY 60 N 1.80 1.02 3.56 0.00 0.00 -1.26 -4.87 105.19 105.44 1aje n GLY 60 Ca 0.04 -0.96 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 1aje n GLY 60 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1aje s GLN 61 N 0.00 2.04 0.55 1.61 0.74 -1.26 -4.75 119.66 118.60 1aje s GLN 61 Ca 0.00 -0.08 0.47 0.00 0.05 0.00 0.00 55.36 55.80 1aje s GLN 61 Cb 0.00 -4.96 1.70 0.00 1.10 0.00 0.00 33.01 30.85 1aje s GLN 61 CO 0.00 -4.06 1.62 0.93 -0.55 0.00 0.00 175.29 173.22 1aje h GLU 62 N 11.71 0.00 -3.36 1.67 4.39 -1.90 -3.43 114.58 123.66 1aje h GLU 62 Ca 0.06 -0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.56 1aje h GLU 62 Cb 1.00 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.62 1aje h GLU 62 CO 1.11 0.00 -0.25 -3.47 -1.16 0.00 0.00 179.01 175.25 1aje n ASP 63 N -4.00 -3.25 -3.22 1.42 -0.08 -1.26 -4.64 116.55 101.51 1aje n ASP 63 Ca 0.41 0.25 -0.34 0.00 -1.51 0.00 0.00 54.79 53.60 1aje n ASP 63 Cb 1.86 -2.87 -0.10 0.00 2.34 0.00 0.00 41.12 42.35 1aje n ASP 63 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1aje n TYR 64 N -2.84 0.53 -3.42 -0.67 4.19 -1.26 -4.84 117.16 108.84 1aje n TYR 64 Ca -0.12 0.35 -0.25 0.00 3.31 0.00 0.00 57.90 61.20 1aje n TYR 64 Cb 0.53 -1.71 -0.10 0.00 0.49 0.00 0.00 39.34 38.54 1aje n TYR 64 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1aje s ASP 65 N 5.95 2.30 0.17 2.98 2.15 -1.26 -5.11 116.67 123.85 1aje s ASP 65 Ca 0.96 -2.02 -0.32 0.00 0.43 0.00 0.00 52.55 51.59 1aje s ASP 65 Cb -0.96 -0.07 -0.12 0.00 -0.30 0.00 0.00 42.92 41.46 1aje s ASP 65 CO 0.39 -0.29 1.71 -1.14 -0.17 0.00 0.00 175.17 175.67 1aje n ARG 66 N 4.06 2.59 -1.90 4.34 0.00 -1.26 -4.85 116.66 119.63 1aje n ARG 66 Ca 0.12 0.93 -0.40 0.00 -0.00 0.00 0.00 57.85 58.51 1aje n ARG 66 Cb 0.40 -2.77 -0.03 0.00 0.00 0.00 0.00 32.46 30.06 1aje n ARG 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1aje s LEU 67 N 1.46 3.41 0.13 6.15 2.01 -1.26 -4.85 118.68 125.73 1aje s LEU 67 Ca 0.78 0.99 -0.17 0.00 0.01 0.00 0.00 54.13 55.73 1aje s LEU 67 Cb -0.56 -3.00 -0.03 0.00 0.01 0.00 0.00 46.19 42.62 1aje s LEU 67 CO 0.35 -2.17 1.72 -0.09 1.01 0.00 0.00 176.35 177.18 1aje h ARG 68 N 14.99 0.47 -7.47 1.70 2.43 -2.06 -3.43 114.38 121.00 1aje h ARG 68 Ca -0.30 -0.06 -0.46 0.00 -0.81 0.00 0.00 59.98 58.36 1aje h ARG 68 Cb 1.19 -0.09 0.14 0.00 -0.42 0.00 0.00 29.97 30.79 1aje h ARG 68 CO 1.11 0.40 0.27 -1.25 -1.51 0.00 0.00 179.97 179.00 1aje s PRO 69 N -5.82 0.85 0.00 0.20 0.04 -1.26 -5.04 135.00 123.97 1aje s PRO 69 Ca -0.13 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.20 1aje s PRO 69 Cb 0.09 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.83 1aje s PRO 69 CO 0.73 -2.40 0.00 1.28 0.04 0.00 0.00 177.00 176.65 1aje n LEU 70 N -3.90 0.00 -3.65 -3.56 4.77 -1.26 -5.04 117.00 104.36 1aje n LEU 70 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1aje n LEU 70 Cb 0.59 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.62 1aje n LEU 70 CO 0.56 0.00 1.01 -0.55 -1.33 0.00 0.00 177.39 177.08 1aje s SER 71 N -2.09 -0.11 -0.17 -1.43 0.15 -1.26 -4.97 113.70 103.82 1aje s SER 71 Ca 0.00 0.18 -0.06 0.00 0.70 0.00 0.00 55.95 56.77 1aje s SER 71 Cb 0.00 0.82 -0.04 0.00 -1.71 0.00 0.00 66.02 65.09 1aje s SER 71 CO 0.00 -0.03 0.04 -0.31 1.20 0.00 0.00 173.24 174.14 1aje s TYR 72 N 0.81 3.20 0.99 3.44 2.02 -1.26 -5.10 117.35 121.46 1aje s TYR 72 Ca -0.04 -0.00 -0.13 0.00 -0.37 0.00 0.00 57.07 56.53 1aje s TYR 72 Cb -0.03 -2.03 0.19 0.00 -0.40 0.00 0.00 41.96 39.69 1aje s TYR 72 CO -0.12 0.14 1.11 -1.25 -1.57 0.00 0.00 175.55 173.86 1aje s PRO 73 N 0.26 0.46 -0.60 -1.71 0.04 -1.26 -4.47 135.00 127.73 1aje s PRO 73 Ca 0.02 0.38 -0.03 0.00 0.04 0.00 0.00 61.00 61.41 1aje s PRO 73 Cb -0.13 -1.75 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1aje s PRO 73 CO 0.01 -2.68 0.52 0.94 0.04 0.00 0.00 177.00 175.83 1aje n GLN 74 N -4.12 -1.30 0.00 4.56 7.27 -1.26 -5.04 117.38 117.50 1aje n GLN 74 Ca 0.06 0.49 0.00 0.00 0.07 0.00 0.00 57.00 57.62 1aje n GLN 74 Cb 0.58 -3.97 0.00 0.00 2.41 0.00 0.00 30.24 29.27 1aje n GLN 74 CO 0.00 0.00 0.00 -2.37 0.07 0.00 0.00 177.06 174.76 1aje n THR 75 N -2.48 0.00 -2.64 1.69 5.66 -1.26 -4.85 114.28 110.40 1aje n THR 75 Ca -0.04 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.86 1aje n THR 75 Cb 0.57 0.00 0.05 0.00 -1.55 0.00 0.00 70.33 69.39 1aje n THR 75 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1aje n ASP 76 N 0.00 -4.92 -2.69 1.09 8.00 0.50 -4.73 116.55 113.80 1aje n ASP 76 Ca 0.00 -0.46 0.00 0.00 0.71 0.00 0.00 54.79 55.04 1aje n ASP 76 Cb 0.00 -3.55 0.00 0.00 -0.02 0.00 0.00 41.12 37.55 1aje n ASP 76 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1aje n VAL 77 N -2.63 0.00 -3.61 2.53 0.31 0.18 -4.53 118.33 110.59 1aje n VAL 77 Ca -0.05 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 63.99 1aje n VAL 77 Cb 0.58 -0.71 -0.15 0.00 -0.91 0.00 0.00 33.84 32.65 1aje n VAL 77 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1aje s PHE 78 N -0.95 0.76 -0.84 3.52 0.08 -0.94 -0.24 117.98 119.36 1aje s PHE 78 Ca 0.00 -1.12 -0.22 0.00 0.12 0.00 0.00 56.93 55.71 1aje s PHE 78 Cb 0.00 -1.14 0.07 0.00 -0.57 0.00 0.00 43.02 41.38 1aje s PHE 78 CO 0.00 -0.83 1.20 -0.51 -0.10 0.00 0.00 175.22 174.98 1aje s LEU 79 N 1.95 4.11 -0.30 -0.37 1.43 0.28 -1.74 118.68 124.04 1aje s LEU 79 Ca 0.09 -1.31 -0.29 0.00 -1.03 0.00 0.00 54.13 51.59 1aje s LEU 79 Cb -0.16 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.59 1aje s LEU 79 CO -0.32 -1.43 1.12 -0.69 0.23 0.00 0.00 176.35 175.26 1aje s VAL 80 N 4.23 4.45 -0.70 -1.59 1.01 -0.54 -2.54 120.40 124.72 1aje s VAL 80 Ca 0.34 1.68 -0.24 0.00 0.00 0.00 0.00 61.98 63.75 1aje s VAL 80 Cb -0.07 -4.35 0.05 0.00 0.00 0.00 0.00 36.38 32.01 1aje s VAL 80 CO 0.00 -0.45 1.11 0.00 0.00 0.00 0.00 175.10 175.77 1aje s PHE 82 N 4.80 3.47 0.16 0.00 -0.12 0.74 -4.29 117.98 122.74 1aje s PHE 82 Ca 0.28 1.03 0.10 0.00 -0.05 0.00 0.00 56.93 58.29 1aje s PHE 82 Cb -0.13 -2.75 -0.04 0.00 -0.63 0.00 0.00 43.02 39.47 1aje s PHE 82 CO 0.12 -0.78 -0.18 0.45 -0.05 0.00 0.00 175.22 174.78 1aje s SER 83 N -4.24 3.82 0.00 1.98 0.15 -1.26 0.29 113.70 114.44 1aje s SER 83 Ca 0.54 -0.67 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1aje s SER 83 Cb -0.11 -0.49 0.00 0.00 -1.71 0.00 0.00 66.02 63.72 1aje s SER 83 CO 0.50 0.14 0.91 0.52 1.20 0.00 0.00 173.24 176.52 1aje n VAL 84 N 0.43 0.82 0.51 4.45 0.31 -1.26 -3.08 118.33 120.51 1aje n VAL 84 Ca -0.13 -0.91 0.05 0.00 -0.01 0.00 0.00 64.34 63.34 1aje n VAL 84 Cb 0.54 0.59 -0.02 0.00 -0.91 0.00 0.00 33.84 34.05 1aje n VAL 84 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1aje n VAL 85 N -0.40 0.00 -4.41 2.52 0.31 -1.26 -4.44 118.33 110.64 1aje n VAL 85 Ca 0.00 -0.34 -0.21 0.00 -0.01 0.00 0.00 64.34 63.78 1aje n VAL 85 Cb 0.21 1.10 -0.10 0.00 -0.91 0.00 0.00 33.84 34.13 1aje n VAL 85 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1aje s SER 86 N -1.64 2.73 -0.22 4.52 0.15 -1.26 -3.71 113.70 114.26 1aje s SER 86 Ca 0.08 -1.16 -0.28 0.00 0.70 0.00 0.00 55.95 55.29 1aje s SER 86 Cb 0.09 -0.16 -0.05 0.00 -1.71 0.00 0.00 66.02 64.19 1aje s SER 86 CO 0.33 -0.31 2.12 -2.16 1.20 0.00 0.00 173.24 174.42 1aje s PRO 87 N -3.71 3.24 -1.14 5.44 0.04 -1.26 -0.33 135.00 137.28 1aje s PRO 87 Ca 0.28 1.96 0.00 0.00 0.04 0.00 0.00 61.00 63.28 1aje s PRO 87 Cb 0.03 -4.32 0.00 0.00 0.04 0.00 0.00 34.50 30.25 1aje s PRO 87 CO 0.11 -1.98 0.00 0.45 0.04 0.00 0.00 177.00 175.62 1aje n SER 88 N 11.13 -4.01 -0.24 6.66 2.88 -1.26 -4.77 113.62 124.01 1aje n SER 88 Ca 0.28 0.19 -0.04 0.00 -1.33 0.00 0.00 58.87 57.97 1aje n SER 88 Cb 0.45 -3.43 0.02 0.00 -0.75 0.00 0.00 64.21 60.50 1aje n SER 88 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1aje h SER 89 N 0.00 -1.17 0.00 -3.46 0.87 -0.92 0.80 113.55 109.68 1aje h SER 89 Ca -0.31 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 1aje h SER 89 Cb 1.19 0.60 0.00 0.00 -0.44 0.00 0.00 62.40 63.75 1aje h SER 89 CO 0.37 -0.30 0.04 2.22 -0.53 0.00 0.00 176.83 178.63 1aje n PHE 90 N -5.45 0.00 0.06 2.24 -1.74 -1.18 -2.91 117.46 108.48 1aje n PHE 90 Ca 0.06 0.00 -0.21 0.00 -0.56 0.00 0.00 57.45 56.73 1aje n PHE 90 Cb 0.37 -0.37 -0.15 0.00 1.52 0.00 0.00 39.48 40.85 1aje n PHE 90 CO 0.00 0.00 0.00 1.49 -0.56 0.00 0.00 176.76 177.69 1aje h GLU 91 N 0.00 0.34 0.00 3.97 4.57 0.30 -3.22 114.58 120.54 1aje h GLU 91 Ca 0.00 -0.58 0.00 0.00 -1.18 0.00 0.00 59.36 57.60 1aje h GLU 91 Cb 0.08 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.89 1aje h GLU 91 CO 0.00 1.25 0.00 -2.95 -1.18 0.00 0.00 179.01 176.13 1aje h ASN 92 N 0.09 0.00 0.11 1.04 -1.07 -1.62 0.36 115.58 114.49 1aje h ASN 92 Ca -0.35 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.01 1aje h ASN 92 Cb 2.08 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 38.32 1aje h ASN 92 CO 0.16 0.00 -0.06 0.58 0.07 0.00 0.00 177.43 178.18 1aje h VAL 93 N 0.00 0.71 0.01 6.14 2.07 -1.66 -2.63 116.25 120.89 1aje h VAL 93 Ca 0.00 -0.22 -0.09 0.00 0.82 0.00 0.00 66.70 67.21 1aje h VAL 93 Cb 0.21 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1aje h VAL 93 CO 0.00 0.05 -0.49 0.11 0.02 0.00 0.00 177.57 177.26 1aje h LYS 94 N 0.00 0.02 -1.01 1.57 1.79 -0.42 -2.45 116.57 116.05 1aje h LYS 94 Ca -0.00 -0.03 0.28 0.00 -2.18 0.00 0.00 60.65 58.72 1aje h LYS 94 Cb 0.13 0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 30.73 1aje h LYS 94 CO 0.01 1.01 0.70 0.93 -1.08 0.00 0.00 179.45 181.02 1aje h GLU 95 N -0.96 0.16 0.00 3.15 5.08 -1.32 -3.01 114.58 117.66 1aje h GLU 95 Ca -0.13 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1aje h GLU 95 Cb 1.14 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1aje h GLU 95 CO -0.07 0.10 -0.59 1.63 -1.00 0.00 0.00 179.01 179.09 1aje n LYS 96 N -4.37 2.45 -0.07 2.33 4.76 -1.10 -4.66 118.16 117.50 1aje n LYS 96 Ca 0.22 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.52 1aje n LYS 96 Cb 0.98 -0.79 -0.13 0.00 -1.84 0.00 0.00 35.03 33.25 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 -1.37 0.00 0.00 177.40 174.54 1aje h TRP 97 N 0.00 0.00 -0.91 2.13 4.06 -1.48 -2.34 115.95 117.41 1aje h TRP 97 Ca 0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 1aje h TRP 97 Cb 0.15 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.26 1aje h TRP 97 CO 0.00 0.99 0.55 0.28 -3.56 0.00 0.00 178.44 176.70 1aje h VAL 98 N -1.00 1.25 0.00 1.49 2.07 -1.51 0.16 116.25 118.71 1aje h VAL 98 Ca -0.00 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 1aje h VAL 98 Cb 0.99 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1aje h VAL 98 CO -0.00 0.26 -0.02 1.55 0.02 0.00 0.00 177.57 179.38 1aje h PRO 99 N 1.26 0.00 0.00 1.57 0.13 -1.69 0.13 132.00 133.40 1aje h PRO 99 Ca 0.33 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.31 1aje h PRO 99 Cb -0.05 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.06 1aje h PRO 99 CO -0.06 0.02 -1.24 1.49 -0.23 0.00 0.00 178.00 177.98 1aje h GLU 100 N 0.00 0.00 0.00 0.86 4.81 -0.25 -3.22 114.58 116.78 1aje h GLU 100 Ca -0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1aje h GLU 100 Cb 0.45 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1aje h GLU 100 CO 0.00 0.31 -0.94 0.44 -0.73 0.00 0.00 179.01 178.09 1aje n ILE 101 N -2.93 1.40 -0.06 2.32 -5.35 0.31 -4.36 119.36 110.69 1aje n ILE 101 Ca -0.07 0.14 -0.06 0.00 -0.27 0.00 0.00 62.75 62.49 1aje n ILE 101 Cb 0.81 -2.12 -0.04 0.00 -1.74 0.00 0.00 39.64 36.55 1aje n ILE 101 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1aje h THR 102 N -0.76 0.49 -1.16 7.28 1.35 -0.97 2.02 112.91 121.17 1aje h THR 102 Ca -0.07 -1.41 0.34 0.00 -0.55 0.00 0.00 66.41 64.72 1aje h THR 102 Cb 0.85 0.97 -0.05 0.00 -1.73 0.00 0.00 68.15 68.19 1aje h THR 102 CO -0.04 0.17 0.88 -0.74 -0.25 0.00 0.00 175.52 175.54 1aje h HIS 103 N -1.00 0.00 0.00 4.73 6.17 -1.50 -2.34 115.15 121.21 1aje h HIS 103 Ca -0.03 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.05 1aje h HIS 103 Cb 0.42 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.35 1aje h HIS 103 CO 0.04 0.00 -0.12 1.25 0.71 0.00 0.00 177.93 179.81 1aje h HIS 104 N 0.00 0.00 -2.71 5.26 6.17 -1.56 -3.46 115.15 118.85 1aje h HIS 104 Ca 0.55 0.00 -0.60 0.00 0.71 0.00 0.00 60.37 61.03 1aje h HIS 104 Cb 2.31 0.00 -0.39 0.00 2.52 0.00 0.00 27.41 31.85 1aje h HIS 104 CO 0.00 0.00 -0.82 0.00 0.71 0.00 0.00 177.93 177.82 1aje n PRO 106 N 3.33 2.35 0.00 0.00 -0.04 -0.92 -4.36 135.00 135.37 1aje n PRO 106 Ca 0.17 -2.65 0.11 0.00 -0.04 0.00 0.00 63.50 61.09 1aje n PRO 106 Cb 0.39 -2.04 0.12 0.00 -0.04 0.00 0.00 33.50 31.93 1aje n PRO 106 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1aje n LYS 107 N -0.47 0.48 0.00 0.54 4.76 -1.26 -4.96 118.16 117.24 1aje n LYS 107 Ca 0.51 -0.35 0.00 0.00 -2.87 0.00 0.00 58.31 55.60 1aje n LYS 107 Cb 0.66 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.36 1aje n LYS 107 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 1aje n THR 108 N -0.96 0.00 -1.47 -0.18 5.66 -1.26 -4.49 114.28 111.58 1aje n THR 108 Ca 0.07 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.77 1aje n THR 108 Cb 0.37 0.00 0.08 0.00 -1.55 0.00 0.00 70.33 69.22 1aje n THR 108 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1aje s PRO 109 N 1.00 2.46 -0.06 1.09 0.04 -1.25 -4.96 135.00 133.33 1aje s PRO 109 Ca 0.00 0.91 -0.01 0.00 0.04 0.00 0.00 61.00 61.94 1aje s PRO 109 Cb 0.00 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.63 1aje s PRO 109 CO 0.00 -1.42 -0.00 0.12 0.04 0.00 0.00 177.00 175.74 1aje s PHE 110 N -3.03 0.62 -0.18 0.56 2.19 -1.26 -2.21 117.98 114.67 1aje s PHE 110 Ca 0.60 -0.14 -0.00 0.00 0.33 0.00 0.00 56.93 57.72 1aje s PHE 110 Cb -0.15 -0.74 0.04 0.00 -1.31 0.00 0.00 43.02 40.87 1aje s PHE 110 CO 0.55 -0.29 -0.06 -0.51 1.83 0.00 0.00 175.22 176.74 1aje s LEU 111 N 1.79 1.82 -0.57 6.12 1.43 -0.71 0.36 118.68 128.92 1aje s LEU 111 Ca 0.02 -0.76 -0.19 0.00 -1.03 0.00 0.00 54.13 52.17 1aje s LEU 111 Cb -0.13 -1.00 0.09 0.00 0.03 0.00 0.00 46.19 45.18 1aje s LEU 111 CO -0.04 -0.18 0.69 -0.22 0.23 0.00 0.00 176.35 176.83 1aje s LEU 112 N 1.57 5.19 0.47 1.79 2.96 0.55 -1.46 118.68 129.75 1aje s LEU 112 Ca -0.00 -1.23 0.07 0.00 -0.22 0.00 0.00 54.13 52.75 1aje s LEU 112 Cb -0.16 -2.36 0.01 0.00 0.50 0.00 0.00 46.19 44.18 1aje s LEU 112 CO -0.08 -1.06 0.42 -0.69 -1.32 0.00 0.00 176.35 173.63 1aje s VAL 113 N 2.74 2.26 0.30 1.68 1.01 -0.70 -0.98 120.40 126.72 1aje s VAL 113 Ca 0.13 -1.37 0.08 0.00 0.00 0.00 0.00 61.98 60.82 1aje s VAL 113 Cb -0.22 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.49 1aje s VAL 113 CO 0.08 0.00 0.23 -0.83 0.00 0.00 0.00 175.10 174.58 1aje s GLY 114 N -4.23 1.66 0.00 4.51 0.00 0.82 0.26 107.32 110.35 1aje s GLY 114 Ca 0.45 -1.59 0.00 0.00 0.00 0.00 0.00 44.72 43.58 1aje s GLY 114 CO 0.27 -1.56 0.00 -0.37 0.00 0.00 0.00 173.10 171.43 1aje n THR 115 N -1.26 0.00 0.00 0.90 5.66 0.84 -4.60 114.28 115.82 1aje n THR 115 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 1aje n THR 115 Cb 0.59 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.37 1aje n THR 115 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1aje n GLN 116 N -0.45 0.00 0.00 1.09 3.00 -1.26 -4.18 117.38 115.58 1aje n GLN 116 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1aje n GLN 116 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1aje n GLN 116 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1aje n ILE 117 N 0.00 0.00 -0.32 5.09 5.41 -1.26 -2.77 119.36 125.51 1aje n ILE 117 Ca 0.00 0.00 0.16 0.00 1.00 0.00 0.00 62.75 63.91 1aje n ILE 117 Cb 0.00 0.00 0.40 0.00 -0.71 0.00 0.00 39.64 39.33 1aje n ILE 117 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1aje h ASP 118 N 0.00 0.63 0.00 4.38 1.82 -1.96 -3.24 116.42 118.05 1aje h ASP 118 Ca 0.00 0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.72 1aje h ASP 118 Cb 0.00 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 39.97 1aje h ASP 118 CO 0.00 0.22 -0.00 0.00 -1.61 0.00 0.00 179.24 177.85 1aje n LEU 119 N -4.66 0.00 0.21 2.28 -0.00 -1.26 -4.62 117.00 108.94 1aje n LEU 119 Ca 0.22 -0.01 0.13 0.00 -0.00 0.00 0.00 56.01 56.36 1aje n LEU 119 Cb 0.65 0.00 0.71 0.00 -0.00 0.00 0.00 43.42 44.78 1aje n LEU 119 CO 0.25 0.00 0.92 0.03 -0.00 0.00 0.00 177.39 178.59 1aje h ARG 120 N 0.00 0.00 -0.13 1.47 -0.00 -1.90 1.06 114.38 114.89 1aje h ARG 120 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1aje h ARG 120 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.97 1aje h ARG 120 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 179.97 179.57 1aje n ASP 121 N -2.45 2.20 -3.66 7.04 5.75 -1.23 -4.49 116.55 119.70 1aje n ASP 121 Ca -0.02 -1.81 -0.23 0.00 -0.01 0.00 0.00 54.79 52.72 1aje n ASP 121 Cb 0.10 -0.08 0.15 0.00 -1.03 0.00 0.00 41.12 40.26 1aje n ASP 121 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1aje n ASP 122 N 0.06 0.29 0.30 -1.12 9.92 0.37 -4.90 116.55 121.46 1aje n ASP 122 Ca 0.05 -1.50 0.20 0.00 -0.53 0.00 0.00 54.79 53.00 1aje n ASP 122 Cb 0.29 -0.77 0.95 0.00 -0.64 0.00 0.00 41.12 40.95 1aje n ASP 122 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1aje h PRO 123 N 0.00 0.00 0.63 -0.24 0.13 -1.96 -2.69 132.00 127.87 1aje h PRO 123 Ca -0.34 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.77 1aje h PRO 123 Cb 0.98 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.09 1aje h PRO 123 CO 0.26 0.00 -0.48 0.77 -0.23 0.00 0.00 178.00 178.32 1aje h SER 124 N 0.00 -1.27 -1.00 1.44 0.02 -1.91 -2.30 113.55 108.52 1aje h SER 124 Ca 0.00 0.09 0.22 0.00 -0.84 0.00 0.00 61.79 61.25 1aje h SER 124 Cb 0.21 0.40 -0.11 0.00 0.14 0.00 0.00 62.40 63.04 1aje h SER 124 CO 0.00 -0.69 0.61 0.74 -1.14 0.00 0.00 176.83 176.35 1aje h THR 125 N -1.07 0.63 -0.49 -2.27 2.02 -1.52 -2.85 112.91 107.36 1aje h THR 125 Ca -0.08 -0.23 0.05 0.00 0.77 0.00 0.00 66.41 66.92 1aje h THR 125 Cb 0.89 -0.10 -0.06 0.00 -1.74 0.00 0.00 68.15 67.14 1aje h THR 125 CO 0.02 0.12 -0.34 0.40 0.37 0.00 0.00 175.52 176.09 1aje h ILE 126 N 0.67 0.00 -0.76 3.11 1.08 -1.44 1.33 117.51 121.51 1aje h ILE 126 Ca 0.61 0.00 0.16 0.00 -0.39 0.00 0.00 64.86 65.23 1aje h ILE 126 Cb 1.06 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.70 1aje h ILE 126 CO -0.41 0.00 0.26 -0.08 -0.69 0.00 0.00 178.15 177.22 1aje h GLU 127 N -0.07 0.35 -0.54 2.37 4.57 -1.55 1.43 114.58 121.14 1aje h GLU 127 Ca 0.08 -0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.12 1aje h GLU 127 Cb 0.28 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 1aje h GLU 127 CO -0.50 0.23 -0.11 0.87 -1.18 0.00 0.00 179.01 178.32 1aje h LYS 128 N 0.36 1.03 0.00 1.92 6.56 -0.80 -3.41 116.57 122.24 1aje h LYS 128 Ca 0.43 -0.39 0.00 0.00 -1.06 0.00 0.00 60.65 59.63 1aje h LYS 128 Cb 0.71 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.31 1aje h LYS 128 CO -0.46 1.08 0.00 -0.11 -2.06 0.00 0.00 179.45 177.89 1aje n LEU 129 N -4.15 0.06 -0.50 2.94 7.94 0.43 -4.51 117.00 119.20 1aje n LEU 129 Ca 0.01 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.88 1aje n LEU 129 Cb 0.41 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.34 1aje n LEU 129 CO 0.46 0.00 -0.03 0.00 -1.11 0.00 0.00 177.39 176.70 1aje n ALA 130 N -2.11 -0.05 0.21 1.96 0.00 0.47 -4.63 120.51 116.35 1aje n ALA 130 Ca 0.00 0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.59 1aje n ALA 130 Cb 0.00 -0.77 0.33 0.00 0.00 0.00 0.00 19.45 19.01 1aje n ALA 130 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1aje h LYS 131 N 0.00 0.00 -0.18 0.00 6.56 -1.88 -2.39 116.57 118.68 1aje h LYS 131 Ca -0.07 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 1aje h LYS 131 Cb 0.48 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.14 1aje h LYS 131 CO 0.10 0.22 0.00 0.09 -2.06 0.00 0.00 179.45 177.80 1aje n ASN 132 N -3.26 3.18 -1.76 0.86 5.03 -1.26 -4.93 115.26 113.12 1aje n ASN 132 Ca 0.01 -2.83 -0.16 0.00 0.87 0.00 0.00 54.58 52.47 1aje n ASN 132 Cb 0.50 -0.43 -0.05 0.00 -1.02 0.00 0.00 39.78 38.78 1aje n ASN 132 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1aje n LYS 133 N -0.65 -1.55 0.00 3.52 4.76 -0.90 -4.58 118.16 118.77 1aje n LYS 133 Ca 0.17 0.90 0.00 0.00 -2.87 0.00 0.00 58.31 56.51 1aje n LYS 133 Cb 0.71 -5.30 0.00 0.00 -1.84 0.00 0.00 35.03 28.60 1aje n LYS 133 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1aje n GLN 134 N -2.32 0.00 -1.85 1.97 1.13 -1.26 -4.97 117.38 110.08 1aje n GLN 134 Ca -0.17 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 54.88 1aje n GLN 134 Cb 0.56 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.91 1aje n GLN 134 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1aje n LYS 135 N 0.00 -2.94 -1.11 -1.09 4.76 -1.26 -4.80 118.16 111.71 1aje n LYS 135 Ca 0.00 2.36 -0.30 0.00 -2.87 0.00 0.00 58.31 57.50 1aje n LYS 135 Cb 0.00 -3.03 0.22 0.00 -1.84 0.00 0.00 35.03 30.39 1aje n LYS 135 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1aje s PRO 136 N -1.13 -0.82 0.03 1.97 0.04 -1.26 -4.82 135.00 129.00 1aje s PRO 136 Ca -0.03 0.07 -0.18 0.00 0.04 0.00 0.00 61.00 60.89 1aje s PRO 136 Cb 0.00 -1.63 -0.09 0.00 0.04 0.00 0.00 34.50 32.82 1aje s PRO 136 CO 0.09 -3.47 0.44 -0.89 0.04 0.00 0.00 177.00 173.22 1aje n ILE 137 N -4.61 0.25 -2.86 0.56 -0.00 -1.26 -4.89 119.36 106.55 1aje n ILE 137 Ca 0.11 -0.06 -0.19 0.00 -0.00 0.00 0.00 62.75 62.61 1aje n ILE 137 Cb 0.59 0.00 0.02 0.00 -0.00 0.00 0.00 39.64 40.25 1aje n ILE 137 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.55 175.66 1aje s THR 138 N -0.13 2.82 -0.90 1.39 2.01 -1.26 -4.87 115.64 114.70 1aje s THR 138 Ca 0.40 -0.86 0.11 0.00 0.31 0.00 0.00 61.69 61.65 1aje s THR 138 Cb -0.57 -2.96 0.10 0.00 0.01 0.00 0.00 72.50 69.08 1aje s THR 138 CO 0.27 0.00 1.35 -0.81 -0.69 0.00 0.00 174.62 174.74 1aje n PRO 139 N -2.08 0.03 0.00 4.92 -0.04 -1.26 -1.00 135.00 135.57 1aje n PRO 139 Ca 0.08 0.37 0.10 0.00 -0.04 0.00 0.00 63.50 64.01 1aje n PRO 139 Cb 0.59 -1.56 -0.04 0.00 -0.04 0.00 0.00 33.50 32.45 1aje n PRO 139 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1aje n GLU 140 N -1.62 1.20 -0.00 0.54 1.02 -1.26 -4.05 120.64 116.48 1aje n GLU 140 Ca 0.02 -0.63 -0.00 0.00 -0.02 0.00 0.00 57.16 56.53 1aje n GLU 140 Cb 0.11 -1.39 -0.00 0.00 -0.02 0.00 0.00 31.44 30.14 1aje n GLU 140 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1aje n THR 141 N -0.50 0.02 0.26 2.62 -1.04 -0.17 -3.98 114.28 111.49 1aje n THR 141 Ca 0.07 0.50 -0.14 0.00 -2.04 0.00 0.00 64.05 62.43 1aje n THR 141 Cb 0.38 -1.51 -0.07 0.00 -1.82 0.00 0.00 70.33 67.30 1aje n THR 141 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1aje h ALA 142 N -1.99 -1.11 -1.07 2.41 0.00 -1.71 -1.57 119.26 114.23 1aje h ALA 142 Ca 0.00 -0.16 0.29 0.00 0.00 0.00 0.00 54.91 55.04 1aje h ALA 142 Cb 0.01 0.55 -0.07 0.00 0.00 0.00 0.00 17.79 18.28 1aje h ALA 142 CO 0.00 -1.11 0.73 0.93 0.00 0.00 0.00 179.25 179.81 1aje h GLU 143 N -0.81 0.18 -0.75 0.00 4.39 -1.76 0.44 114.58 116.26 1aje h GLU 143 Ca -0.06 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 1aje h GLU 143 Cb 0.68 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.25 1aje h GLU 143 CO 0.01 0.12 0.41 -0.22 -1.16 0.00 0.00 179.01 178.17 1aje h LYS 144 N 0.18 1.04 0.06 2.33 3.64 -1.43 -1.69 116.57 120.71 1aje h LYS 144 Ca 0.56 -0.12 -0.31 0.00 -1.27 0.00 0.00 60.65 59.50 1aje h LYS 144 Cb 1.82 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 33.41 1aje h LYS 144 CO -0.14 0.77 -1.71 1.37 -2.27 0.00 0.00 179.45 177.47 1aje h LEU 145 N 1.03 0.20 -2.67 5.20 8.10 0.13 -3.20 115.31 124.10 1aje h LEU 145 Ca 0.26 -0.39 0.01 0.00 0.11 0.00 0.00 57.88 57.87 1aje h LEU 145 Cb 0.03 -0.07 -0.00 0.00 -0.44 0.00 0.00 40.66 40.19 1aje h LEU 145 CO -0.04 1.34 0.06 0.00 -4.11 0.00 0.00 178.44 175.69 1aje h ALA 146 N 0.63 1.26 -0.03 0.17 0.00 -0.61 2.43 119.26 123.12 1aje h ALA 146 Ca -0.30 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 1aje h ALA 146 Cb 2.01 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.78 1aje h ALA 146 CO 0.10 -0.07 -0.66 -0.09 0.00 0.00 0.00 179.25 178.53 1aje h ARG 147 N 0.00 0.12 0.00 0.00 1.12 -1.33 1.97 114.38 116.25 1aje h ARG 147 Ca 0.01 -0.09 -0.05 0.00 -1.11 0.00 0.00 59.98 58.74 1aje h ARG 147 Cb 0.13 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 30.10 1aje h ARG 147 CO -0.00 0.73 -0.25 0.22 -3.11 0.00 0.00 179.97 177.57 1aje h ASP 148 N 0.08 0.00 0.00 -3.80 1.82 0.41 -3.32 116.42 111.61 1aje h ASP 148 Ca -0.01 0.00 -0.23 0.00 -0.39 0.00 0.00 57.03 56.40 1aje h ASP 148 Cb 1.18 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 41.15 1aje h ASP 148 CO 0.09 0.25 -1.88 0.18 -1.61 0.00 0.00 179.24 176.27 1aje n LEU 149 N -3.31 2.32 -3.13 2.28 4.77 -0.40 -5.01 117.00 114.53 1aje n LEU 149 Ca 0.01 -0.07 -0.16 0.00 -0.03 0.00 0.00 56.01 55.76 1aje n LEU 149 Cb 0.50 -0.36 0.08 0.00 -2.33 0.00 0.00 43.42 41.31 1aje n LEU 149 CO 0.34 0.66 0.12 0.29 -1.33 0.00 0.00 177.39 177.48 1aje n LYS 150 N -2.84 -6.03 0.00 3.23 4.76 0.66 -4.98 118.16 112.96 1aje n LYS 150 Ca -0.26 0.73 0.00 0.00 -2.87 0.00 0.00 58.31 55.92 1aje n LYS 150 Cb 0.82 -5.43 0.00 0.00 -1.84 0.00 0.00 35.03 28.58 1aje n LYS 150 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1aje n ALA 151 N -3.94 0.00 0.01 7.82 0.00 -1.25 -4.91 120.51 118.24 1aje n ALA 151 Ca -0.19 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.05 1aje n ALA 151 Cb 0.63 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.94 1aje n ALA 151 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1aje h VAL 152 N -0.89 0.72 -2.92 0.00 3.04 0.61 -3.47 116.25 113.34 1aje h VAL 152 Ca 0.00 -2.44 0.03 0.00 -1.01 0.00 0.00 66.70 63.28 1aje h VAL 152 Cb 0.00 2.53 -0.10 0.00 -2.01 0.00 0.00 31.29 31.72 1aje h VAL 152 CO 0.00 0.83 0.25 -0.54 -1.01 0.00 0.00 177.57 177.10 1aje s LYS 153 N -2.57 1.43 -0.01 4.17 -0.14 -1.07 -5.02 119.74 116.53 1aje s LYS 153 Ca -0.18 -0.65 0.04 0.00 -1.36 0.00 0.00 55.97 53.82 1aje s LYS 153 Cb 0.07 0.57 -0.01 0.00 -1.68 0.00 0.00 37.83 36.78 1aje s LYS 153 CO 0.79 -0.64 -0.14 -0.47 -0.76 0.00 0.00 175.35 174.14 1aje s TYR 154 N -3.74 1.22 0.05 3.18 6.14 -1.25 -0.33 117.35 122.61 1aje s TYR 154 Ca 0.05 -0.23 -0.08 0.00 0.64 0.00 0.00 57.07 57.46 1aje s TYR 154 Cb -0.03 -0.78 0.03 0.00 0.42 0.00 0.00 41.96 41.60 1aje s TYR 154 CO -0.05 -0.02 0.36 1.33 0.64 0.00 0.00 175.55 177.81 1aje n VAL 155 N 2.74 0.00 0.00 3.14 0.24 -0.15 -4.96 118.33 119.33 1aje n VAL 155 Ca -0.14 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 61.98 1aje n VAL 155 Cb 0.55 0.26 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 1aje n VAL 155 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1aje n GLU 156 N -0.25 0.00 -1.21 7.34 0.00 -1.26 0.29 120.64 125.54 1aje n GLU 156 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 57.16 57.15 1aje n GLU 156 Cb 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 31.44 31.64 1aje n GLU 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1aje n SER 158 N 0.24 0.00 0.00 0.00 2.88 -1.11 -4.64 113.62 110.98 1aje n SER 158 Ca -0.00 -0.76 0.00 0.00 -1.33 0.00 0.00 58.87 56.78 1aje n SER 158 Cb 0.01 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 1aje n SER 158 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aje n ALA 159 N 1.78 0.00 -0.01 -1.46 0.00 -1.26 -3.43 120.51 116.14 1aje n ALA 159 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1aje n ALA 159 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 1aje n ALA 159 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 160 N 0.00 0.34 0.24 0.00 -0.00 -1.26 -4.45 117.00 111.87 1aje n LEU 160 Ca 0.00 0.15 -0.12 0.00 -0.00 0.00 0.00 56.01 56.04 1aje n LEU 160 Cb 0.00 0.14 -0.06 0.00 -0.00 0.00 0.00 43.42 43.50 1aje n LEU 160 CO 0.00 0.14 0.52 0.74 -0.00 0.00 0.00 177.39 178.79 1aje h THR 161 N 0.00 0.00 -0.87 1.47 2.02 -1.87 -3.48 112.91 110.18 1aje h THR 161 Ca -0.18 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1aje h THR 161 Cb 1.47 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1aje h THR 161 CO 0.02 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.91 1aje n GLN 162 N -4.21 0.00 0.15 6.66 1.13 -1.26 -4.98 117.38 114.87 1aje n GLN 162 Ca -0.08 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.09 1aje n GLN 162 Cb 0.30 -1.73 0.08 0.00 0.11 0.00 0.00 30.24 28.99 1aje n GLN 162 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1aje h LYS 163 N 0.00 0.00 0.00 -1.09 1.63 -1.91 -3.45 116.57 111.75 1aje h LYS 163 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1aje h LYS 163 Cb 0.69 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.32 1aje h LYS 163 CO 0.00 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 176.41 1aje n GLY 164 N 1.16 0.00 0.00 5.01 0.00 -1.26 -4.95 105.19 105.14 1aje n GLY 164 Ca 0.02 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.08 1aje n GLY 164 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1aje n LEU 165 N 0.00 0.00 0.04 0.99 -0.00 -1.23 0.14 117.00 116.94 1aje n LEU 165 Ca 0.00 0.47 0.12 0.00 -0.00 0.00 0.00 56.01 56.59 1aje n LEU 165 Cb 0.00 -0.47 0.15 0.00 -0.00 0.00 0.00 43.42 43.10 1aje n LEU 165 CO 0.00 -0.34 0.28 0.29 -0.00 0.00 0.00 177.39 177.62 1aje n LYS 166 N -1.47 0.22 0.03 1.47 5.02 -1.26 -2.25 118.16 119.92 1aje n LYS 166 Ca 0.02 0.04 -0.22 0.00 -2.02 0.00 0.00 58.31 56.13 1aje n LYS 166 Cb 0.09 -1.61 -0.14 0.00 -0.02 0.00 0.00 35.03 33.34 1aje n LYS 166 CO 0.00 0.00 0.00 -2.95 -0.52 0.00 0.00 177.40 173.93 1aje h ASN 167 N 0.00 0.47 -0.60 4.39 7.08 0.89 -2.78 115.58 125.02 1aje h ASN 167 Ca 0.00 -0.90 0.07 0.00 -3.08 0.00 0.00 56.30 52.39 1aje h ASN 167 Cb 0.68 -0.15 -0.06 0.00 -2.08 0.00 0.00 38.32 36.71 1aje h ASN 167 CO 0.00 1.74 0.28 1.62 -2.08 0.00 0.00 177.43 178.99 1aje h VAL 168 N -0.08 0.87 -0.42 6.14 3.04 -0.94 0.59 116.25 125.44 1aje h VAL 168 Ca -0.35 -0.17 0.08 0.00 -1.01 0.00 0.00 66.70 65.25 1aje h VAL 168 Cb 1.94 0.32 -0.08 0.00 -2.01 0.00 0.00 31.29 31.46 1aje h VAL 168 CO 0.10 0.09 -0.11 -0.26 -1.01 0.00 0.00 177.57 176.38 1aje h PHE 169 N 0.51 -0.24 -0.06 3.17 0.04 -1.47 2.28 116.94 121.16 1aje h PHE 169 Ca 0.29 0.04 -0.01 0.00 2.80 0.00 0.00 57.97 61.08 1aje h PHE 169 Cb 0.27 0.17 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 1aje h PHE 169 CO -0.12 -0.19 -0.02 -0.44 -0.60 0.00 0.00 178.31 176.94 1aje h ASP 170 N -0.01 0.08 0.37 2.17 3.32 -0.45 -2.45 116.42 119.45 1aje h ASP 170 Ca 0.20 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 1aje h ASP 170 Cb 0.31 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1aje h ASP 170 CO -0.43 0.12 -0.18 -0.33 -1.72 0.00 0.00 179.24 176.70 1aje h GLU 171 N 0.09 -0.48 -1.18 3.56 5.08 0.69 0.32 114.58 122.66 1aje h GLU 171 Ca 0.02 0.03 0.44 0.00 -1.00 0.00 0.00 59.36 58.85 1aje h GLU 171 Cb 0.11 0.11 -0.16 0.00 0.50 0.00 0.00 28.75 29.31 1aje h GLU 171 CO 0.00 -0.32 0.70 0.00 -1.00 0.00 0.00 179.01 178.40 1aje h ALA 172 N -1.31 2.46 0.07 3.43 0.00 0.33 1.66 119.26 125.91 1aje h ALA 172 Ca -0.05 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1aje h ALA 172 Cb 0.38 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1aje h ALA 172 CO 0.08 -1.19 -0.03 0.82 0.00 0.00 0.00 179.25 178.93 1aje h ILE 173 N 0.03 0.23 0.00 0.00 5.03 -1.41 -0.99 117.51 120.40 1aje h ILE 173 Ca 0.85 -1.09 0.00 0.00 -0.12 0.00 0.00 64.86 64.50 1aje h ILE 173 Cb 2.46 0.43 0.00 0.00 -3.03 0.00 0.00 36.82 36.68 1aje h ILE 173 CO -0.61 0.07 0.04 0.17 -0.68 0.00 0.00 178.15 177.15 1aje h LEU 174 N -1.01 0.00 0.00 1.44 -0.00 0.13 1.39 115.31 117.25 1aje h LEU 174 Ca -0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.74 1aje h LEU 174 Cb 0.19 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.83 1aje h LEU 174 CO 0.02 0.00 -1.16 0.00 -0.00 0.00 0.00 178.44 177.29 1aje h ALA 175 N 1.89 0.64 -0.45 0.17 0.00 0.24 -3.28 119.26 118.47 1aje h ALA 175 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1aje h ALA 175 Cb 0.09 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1aje h ALA 175 CO 0.00 0.70 0.00 0.00 0.00 0.00 0.00 179.25 179.95 1aje n ALA 176 N -2.33 2.30 0.19 0.00 0.00 0.41 -3.81 120.51 117.28 1aje n ALA 176 Ca -0.06 -1.26 0.03 0.00 0.00 0.00 0.00 53.44 52.16 1aje n ALA 176 Cb 0.77 -0.59 -0.04 0.00 0.00 0.00 0.00 19.45 19.58 1aje n ALA 176 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 177 N 0.77 0.19 -1.41 0.00 -0.00 0.22 -4.53 117.00 112.24 1aje n LEU 177 Ca 0.16 -0.30 0.00 0.00 -0.00 0.00 0.00 56.01 55.87 1aje n LEU 177 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1aje n LEU 177 CO 0.11 0.05 0.00 1.21 -0.00 0.00 0.00 177.39 178.76 1aje n GLU 178 N -1.39 -0.55 -1.20 1.47 2.13 -1.24 -4.88 120.64 114.98 1aje n GLU 178 Ca 0.00 0.53 -0.30 0.00 0.66 0.00 0.00 57.16 58.05 1aje n GLU 178 Cb 0.13 -0.37 0.14 0.00 0.27 0.00 0.00 31.44 31.61 1aje n GLU 178 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1aje s PRO 179 N 0.00 1.15 0.12 5.31 0.04 -1.26 -4.96 135.00 135.39 1aje s PRO 179 Ca 0.00 0.77 -0.31 0.00 0.04 0.00 0.00 61.00 61.50 1aje s PRO 179 Cb 0.00 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.66 1aje s PRO 179 CO 0.00 -2.30 1.40 -1.25 0.04 0.00 0.00 177.00 174.88 1aje s PRO 180 N -4.94 4.32 -0.60 0.56 0.04 -1.26 -4.98 135.00 128.13 1aje s PRO 180 Ca 0.64 2.09 0.04 0.00 0.04 0.00 0.00 61.00 63.81 1aje s PRO 180 Cb -0.18 -3.24 0.17 0.00 0.04 0.00 0.00 34.50 31.28 1aje s PRO 180 CO 0.57 -0.44 0.43 -1.21 0.04 0.00 0.00 177.00 176.39 1aje s GLU 181 N 1.07 1.96 -1.28 4.56 2.02 -1.26 -4.99 118.70 120.78 1aje s GLU 181 Ca 0.65 -2.91 -0.13 0.00 0.02 0.00 0.00 54.97 52.60 1aje s GLU 181 Cb -0.37 -2.82 -0.05 0.00 0.10 0.00 0.00 34.13 30.98 1aje s GLU 181 CO 0.30 -1.30 2.38 -0.35 0.02 0.00 0.00 175.26 176.31 1aje n PRO 182 N 2.35 2.72 -2.25 0.39 -0.04 -1.26 -4.85 135.00 132.05 1aje n PRO 182 Ca 0.21 -2.12 -0.36 0.00 -0.04 0.00 0.00 63.50 61.19 1aje n PRO 182 Cb 0.38 -2.91 -0.03 0.00 -0.04 0.00 0.00 33.50 30.90 1aje n PRO 182 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1aje n LYS 183 N 5.13 2.38 -3.80 0.54 5.02 -1.26 -4.86 118.16 121.30 1aje n LYS 183 Ca 0.58 -2.82 -0.10 0.00 -2.02 0.00 0.00 58.31 53.95 1aje n LYS 183 Cb 0.29 -3.58 -0.05 0.00 -0.02 0.00 0.00 35.03 31.68 1aje n LYS 183 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1aje s LYS 184 N 5.26 1.32 0.09 1.97 -2.85 -1.26 -5.18 119.74 119.10 1aje s LYS 184 Ca 0.61 -0.95 0.05 0.00 -1.00 0.00 0.00 55.97 54.68 1aje s LYS 184 Cb 0.03 0.48 -0.03 0.00 -2.06 0.00 0.00 37.83 36.24 1aje s LYS 184 CO 0.10 -0.54 -0.14 -1.54 0.10 0.00 0.00 175.35 173.33 1aje s SER 185 N -2.90 1.82 -0.58 0.03 1.04 -1.26 -5.10 113.70 106.75 1aje s SER 185 Ca 0.11 -0.71 0.05 0.00 0.48 0.00 0.00 55.95 55.88 1aje s SER 185 Cb 0.00 -0.06 0.17 0.00 0.10 0.00 0.00 66.02 66.24 1aje s SER 185 CO -0.02 -0.11 0.43 0.54 0.98 0.00 0.00 173.24 175.06 1aje n ARG 186 N 0.92 1.15 -0.03 4.02 1.74 -1.26 -5.32 116.66 117.88 1aje n ARG 186 Ca -0.18 -3.94 0.00 0.00 -0.77 0.00 0.00 57.85 52.95 1aje n ARG 186 Cb 0.55 -2.03 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 1aje n ARG 186 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65