#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 -0.17 0.86 1.61 1.04 -1.26 -5.16 113.70 110.62 1aje s SER -6 Ca 0.00 -0.77 -0.11 0.00 0.48 0.00 0.00 55.95 55.54 1aje s SER -6 Cb 0.00 0.64 0.11 0.00 0.10 0.00 0.00 66.02 66.86 1aje s SER -6 CO 0.00 -1.21 1.09 -0.54 0.98 0.00 0.00 173.24 173.57 1aje s LYS -5 N -3.97 1.56 -0.44 4.02 -0.14 -1.26 -4.78 119.74 114.73 1aje s LYS -5 Ca 0.17 0.83 -0.39 0.00 -1.36 0.00 0.00 55.97 55.22 1aje s LYS -5 Cb -0.03 -1.84 -0.17 0.00 -1.68 0.00 0.00 37.83 34.11 1aje s LYS -5 CO 0.07 -2.04 1.73 -0.89 -0.76 0.00 0.00 175.35 173.46 1aje n ILE -4 N -3.74 0.00 -0.37 2.17 -0.00 -1.26 -4.85 119.36 111.31 1aje n ILE -4 Ca 0.07 0.00 -0.28 0.00 -0.00 0.00 0.00 62.75 62.54 1aje n ILE -4 Cb 0.55 -0.44 0.26 0.00 -0.00 0.00 0.00 39.64 40.01 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 5.02 0.00 -0.70 1.39 -0.00 -1.26 -4.92 119.36 118.89 1aje n ILE -3 Ca 0.42 -0.17 -0.32 0.00 -0.00 0.00 0.00 62.75 62.68 1aje n ILE -3 Cb -0.04 -0.89 0.16 0.00 -0.00 0.00 0.00 39.64 38.87 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 -4.63 -1.63 -4.98 4.38 7.64 -1.26 -4.99 113.62 108.15 1aje n SER -2 Ca 0.08 0.18 -0.21 0.00 1.01 0.00 0.00 58.87 59.94 1aje n SER -2 Cb 0.55 -1.21 0.02 0.00 -1.01 0.00 0.00 64.21 62.56 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 -2.41 4.02 -0.38 -0.43 0.00 -1.26 -4.15 121.76 117.15 1aje s ALA -1 Ca 0.60 -1.33 -0.17 0.00 0.00 0.00 0.00 51.96 51.06 1aje s ALA -1 Cb -0.20 -1.95 -0.18 0.00 0.00 0.00 0.00 23.12 20.79 1aje s ALA -1 CO 0.65 -0.45 1.45 0.00 0.00 0.00 0.00 175.76 177.42 1aje n MET 1 N -2.07 0.03 -1.54 0.00 0.00 -1.09 -4.40 117.12 108.05 1aje n MET 1 Ca 0.05 -0.85 -0.50 0.00 0.00 0.00 0.00 57.70 56.40 1aje n MET 1 Cb 0.59 -2.41 -0.06 0.00 0.00 0.00 0.00 33.22 31.34 1aje n MET 1 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1aje n GLN 2 N 6.49 1.47 -1.99 3.17 6.02 -0.05 -3.53 117.38 128.96 1aje n GLN 2 Ca 0.26 0.45 -0.40 0.00 -0.01 0.00 0.00 57.00 57.31 1aje n GLN 2 Cb 0.43 -2.60 -0.03 0.00 1.02 0.00 0.00 30.24 29.06 1aje n GLN 2 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1aje s THR 3 N 6.45 3.39 -0.32 5.09 -4.23 -1.25 0.21 115.64 124.97 1aje s THR 3 Ca 1.04 0.31 -0.07 0.00 -1.18 0.00 0.00 61.69 61.79 1aje s THR 3 Cb -0.76 -3.75 0.03 0.00 1.34 0.00 0.00 72.50 69.36 1aje s THR 3 CO 0.49 -0.63 0.10 -0.63 -0.54 0.00 0.00 174.62 173.41 1aje s ILE 4 N 8.39 3.92 -0.32 2.99 1.09 0.58 -4.92 121.20 132.91 1aje s ILE 4 Ca 0.75 -0.93 -0.20 0.00 -1.10 0.00 0.00 60.65 59.17 1aje s ILE 4 Cb -0.17 -3.13 -0.01 0.00 -1.06 0.00 0.00 42.46 38.09 1aje s ILE 4 CO 0.27 -0.08 0.59 -0.54 -0.10 0.00 0.00 174.94 175.08 1aje s LYS 5 N 1.45 3.80 -0.06 2.79 -0.14 -1.26 0.22 119.74 126.54 1aje s LYS 5 Ca 0.00 0.13 0.03 0.00 -1.36 0.00 0.00 55.97 54.78 1aje s LYS 5 Cb -0.18 -3.76 -0.02 0.00 -1.68 0.00 0.00 37.83 32.18 1aje s LYS 5 CO 0.03 -0.61 -0.15 0.00 -0.76 0.00 0.00 175.35 173.86 1aje s VAL 7 N -0.52 3.47 -0.11 0.00 -7.23 -0.46 0.87 120.40 116.42 1aje s VAL 7 Ca 0.07 -0.54 -0.03 0.00 -1.81 0.00 0.00 61.98 59.67 1aje s VAL 7 Cb -0.12 -2.44 -0.03 0.00 0.56 0.00 0.00 36.38 34.35 1aje s VAL 7 CO 0.01 0.55 0.00 -0.69 -0.31 0.00 0.00 175.10 174.67 1aje s VAL 8 N -0.21 4.30 0.03 1.32 1.01 -0.78 -0.55 120.40 125.52 1aje s VAL 8 Ca 0.02 -0.24 0.09 0.00 0.00 0.00 0.00 61.98 61.85 1aje s VAL 8 Cb -0.13 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 1aje s VAL 8 CO 0.03 0.57 -0.26 0.68 0.00 0.00 0.00 175.10 176.12 1aje s VAL 9 N -0.53 2.13 0.00 2.92 -7.23 -1.01 -4.38 120.40 112.30 1aje s VAL 9 Ca 0.09 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.94 1aje s VAL 9 Cb -0.12 -1.81 0.00 0.00 0.56 0.00 0.00 36.38 35.02 1aje s VAL 9 CO 0.02 0.42 0.00 0.61 -0.31 0.00 0.00 175.10 175.84 1aje n GLY 10 N 1.94 2.83 0.23 2.32 0.00 -1.26 -2.75 105.19 108.51 1aje n GLY 10 Ca -0.17 0.17 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1aje n GLY 10 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1aje n ASP 11 N 0.00 1.76 0.00 1.61 -0.08 -1.26 -4.59 116.55 113.99 1aje n ASP 11 Ca 0.00 0.30 0.00 0.00 -1.51 0.00 0.00 54.79 53.58 1aje n ASP 11 Cb 0.00 -0.71 0.00 0.00 2.34 0.00 0.00 41.12 42.75 1aje n ASP 11 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1aje n GLY 12 N 1.57 -0.28 0.38 0.27 0.00 -1.26 -4.54 105.19 101.34 1aje n GLY 12 Ca -0.34 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.84 1aje n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aje h ALA 13 N -1.34 1.98 -0.29 4.61 0.00 -1.84 -3.11 119.26 119.28 1aje h ALA 13 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1aje h ALA 13 Cb 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1aje h ALA 13 CO 0.00 -0.83 -0.17 1.55 0.00 0.00 0.00 179.25 179.80 1aje n VAL 14 N -3.07 -0.20 -2.76 0.00 3.14 -1.25 -3.94 118.33 110.26 1aje n VAL 14 Ca 0.05 1.16 -0.18 0.00 -2.96 0.00 0.00 64.34 62.42 1aje n VAL 14 Cb 0.79 -1.48 -0.03 0.00 -1.06 0.00 0.00 33.84 32.06 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 -1.07 -0.17 0.12 7.55 0.00 -1.18 -4.62 105.19 105.83 1aje n GLY 15 Ca 0.01 0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.14 1aje n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aje n LYS 16 N -1.98 1.16 0.05 1.61 4.76 -1.26 -2.42 118.16 120.07 1aje n LYS 16 Ca 0.05 -2.44 -0.02 0.00 -2.87 0.00 0.00 58.31 53.03 1aje n LYS 16 Cb 0.19 -1.40 -0.01 0.00 -1.84 0.00 0.00 35.03 31.97 1aje n LYS 16 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1aje h THR 17 N 0.70 0.00 -0.83 -0.18 2.02 -2.00 -2.30 112.91 110.32 1aje h THR 17 Ca -0.00 0.00 0.24 0.00 0.77 0.00 0.00 66.41 67.42 1aje h THR 17 Cb 1.04 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 1aje h THR 17 CO 0.00 0.00 1.06 0.00 0.37 0.00 0.00 175.52 176.95 1aje h LEU 19 N 0.00 -0.66 -1.71 0.00 5.85 -1.71 -2.12 115.31 114.97 1aje h LEU 19 Ca 0.39 0.02 0.42 0.00 0.84 0.00 0.00 57.88 59.56 1aje h LEU 19 Cb 2.52 0.17 -0.09 0.00 0.37 0.00 0.00 40.66 43.63 1aje h LEU 19 CO -0.00 -0.39 0.96 0.25 -0.34 0.00 0.00 178.44 178.92 1aje h LEU 20 N -0.93 0.15 0.40 2.25 7.12 -0.07 0.72 115.31 124.95 1aje h LEU 20 Ca -0.08 0.06 -0.01 0.00 0.13 0.00 0.00 57.88 57.98 1aje h LEU 20 Cb 0.59 0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.76 1aje h LEU 20 CO 0.13 -0.05 -0.27 0.40 -0.13 0.00 0.00 178.44 178.52 1aje h ILE 21 N 0.09 0.43 -0.39 4.05 1.08 -1.04 -2.60 117.51 119.14 1aje h ILE 21 Ca 0.75 0.00 -0.16 0.00 -0.39 0.00 0.00 64.86 65.06 1aje h ILE 21 Cb 2.62 0.43 -0.01 0.00 -3.07 0.00 0.00 36.82 36.80 1aje h ILE 21 CO -0.19 0.00 -0.38 0.28 -0.69 0.00 0.00 178.15 177.17 1aje h SER 22 N -0.66 1.00 -1.48 1.72 0.02 0.74 2.10 113.55 116.99 1aje h SER 22 Ca -0.04 -0.46 0.43 0.00 -0.84 0.00 0.00 61.79 60.88 1aje h SER 22 Cb 0.55 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 62.75 1aje h SER 22 CO 0.02 1.26 1.07 0.22 -1.14 0.00 0.00 176.83 178.25 1aje h TYR 23 N 0.76 0.00 0.00 3.45 3.20 -0.07 0.74 116.97 125.05 1aje h TYR 23 Ca 0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1aje h TYR 23 Cb 0.98 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.25 1aje h TYR 23 CO 0.06 0.00 -0.79 -2.37 -1.64 0.00 0.00 178.16 173.42 1aje n THR 24 N -4.09 0.00 0.45 1.81 5.66 -1.00 -4.77 114.28 112.34 1aje n THR 24 Ca 0.33 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.37 1aje n THR 24 Cb 1.53 -0.63 -0.05 0.00 -1.55 0.00 0.00 70.33 69.63 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 -1.62 0.00 -1.66 1.09 -2.24 0.70 -4.95 114.28 105.60 1aje n THR 25 Ca 0.00 -0.28 -0.03 0.00 -2.27 0.00 0.00 64.05 61.48 1aje n THR 25 Cb 0.34 1.00 -0.01 0.00 -2.10 0.00 0.00 70.33 69.57 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 -1.22 -1.08 -3.32 3.42 5.15 0.25 -4.78 115.26 113.69 1aje n ASN 26 Ca 0.02 0.22 -0.11 0.00 -0.60 0.00 0.00 54.58 54.10 1aje n ASN 26 Cb 0.15 -1.23 -0.06 0.00 -0.53 0.00 0.00 39.78 38.10 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1aje s LYS 27 N -3.37 0.51 0.17 1.20 2.20 -1.26 -4.84 119.74 114.35 1aje s LYS 27 Ca 0.00 -0.25 -0.06 0.00 -0.36 0.00 0.00 55.97 55.30 1aje s LYS 27 Cb 0.00 -0.44 -0.06 0.00 -1.51 0.00 0.00 37.83 35.83 1aje s LYS 27 CO 0.00 -1.10 0.43 -0.59 -0.36 0.00 0.00 175.35 173.72 1aje s PHE 28 N 2.11 3.46 -0.83 4.03 -0.71 -1.26 -4.79 117.98 119.98 1aje s PHE 28 Ca 0.12 0.63 -0.03 0.00 -1.04 0.00 0.00 56.93 56.61 1aje s PHE 28 Cb -0.13 -2.07 0.20 0.00 -1.21 0.00 0.00 43.02 39.82 1aje s PHE 28 CO -0.20 0.38 2.33 -0.35 -1.34 0.00 0.00 175.22 176.04 1aje n PRO 29 N -0.04 3.46 0.00 1.99 -0.04 -1.26 -4.92 135.00 134.19 1aje n PRO 29 Ca -0.02 -3.29 0.00 0.00 -0.04 0.00 0.00 63.50 60.15 1aje n PRO 29 Cb 0.52 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 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 0.48 0.00 -2.60 3.54 3.41 -1.26 -3.51 113.62 113.68 1aje n SER 30 Ca 0.53 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.92 1aje n SER 30 Cb 0.35 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 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 2.66 -1.50 4.33 1.02 -1.26 -5.01 120.64 120.87 1aje n GLU 31 Ca 0.00 -4.13 0.00 0.00 -0.02 0.00 0.00 57.16 53.01 1aje n GLU 31 Cb 0.00 -1.94 0.00 0.00 -0.02 0.00 0.00 31.44 29.48 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 -0.31 -0.03 -2.70 -0.32 9.36 -1.23 -4.94 117.16 116.99 1aje n TYR 32 Ca 0.29 0.02 -0.23 0.00 3.32 0.00 0.00 57.90 61.30 1aje n TYR 32 Cb 0.68 -0.52 0.03 0.00 -0.63 0.00 0.00 39.34 38.90 1aje n TYR 32 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1aje s VAL 33 N -0.67 3.25 -1.19 2.97 -7.23 -1.26 -4.95 120.40 111.32 1aje s VAL 33 Ca 0.00 -0.49 -0.21 0.00 -1.81 0.00 0.00 61.98 59.48 1aje s VAL 33 Cb 0.00 -3.23 -0.05 0.00 0.56 0.00 0.00 36.38 33.66 1aje s VAL 33 CO 0.00 -0.18 1.89 -0.81 -0.31 0.00 0.00 175.10 175.69 1aje n PRO 34 N -2.33 2.10 -3.69 4.82 -0.04 -1.26 -4.84 135.00 129.76 1aje n PRO 34 Ca 0.05 -2.65 -0.12 0.00 -0.04 0.00 0.00 63.50 60.74 1aje n PRO 34 Cb 0.59 -3.57 -0.13 0.00 -0.04 0.00 0.00 33.50 30.35 1aje n PRO 34 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1aje s THR 35 N 8.21 -0.29 0.00 0.52 -1.32 -1.26 -5.14 115.64 116.37 1aje s THR 35 Ca 0.62 0.21 0.00 0.00 -1.21 0.00 0.00 61.69 61.32 1aje s THR 35 Cb 0.03 -0.46 0.00 0.00 -1.51 0.00 0.00 72.50 70.56 1aje s THR 35 CO 0.11 0.09 0.00 0.55 -2.21 0.00 0.00 174.62 173.16 1aje n VAL 36 N 4.91 0.00 0.01 5.08 3.14 -1.26 -5.12 118.33 125.08 1aje n VAL 36 Ca -0.14 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.24 1aje n VAL 36 Cb 0.51 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.29 1aje n VAL 36 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 1aje n PHE 37 N -0.06 -0.09 -4.19 1.45 -0.00 -1.26 -5.13 117.46 108.18 1aje n PHE 37 Ca 0.00 0.02 -0.17 0.00 -0.00 0.00 0.00 57.45 57.30 1aje n PHE 37 Cb 0.00 0.24 -0.11 0.00 -0.00 0.00 0.00 39.48 39.61 1aje n PHE 37 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1aje s ASP 38 N -4.59 1.66 1.13 -2.13 1.01 -1.26 -5.13 116.67 107.36 1aje s ASP 38 Ca 0.00 -0.73 -0.13 0.00 0.71 0.00 0.00 52.55 52.40 1aje s ASP 38 Cb 0.00 -0.03 0.26 0.00 1.01 0.00 0.00 42.92 44.15 1aje s ASP 38 CO 0.00 -0.16 0.97 0.59 0.21 0.00 0.00 175.17 176.79 1aje n ASN 39 N 0.85 -1.44 -3.45 0.27 4.13 -1.26 -5.03 115.26 109.33 1aje n ASN 39 Ca -0.18 -0.06 -0.12 0.00 1.68 0.00 0.00 54.58 55.91 1aje n ASN 39 Cb 0.56 -1.28 -0.02 0.00 -1.54 0.00 0.00 39.78 37.50 1aje n ASN 39 CO 0.00 0.00 0.00 -0.72 0.28 0.00 0.00 177.26 176.82 1aje s TYR 40 N -2.43 -0.51 -0.37 3.10 -0.85 -1.26 -5.04 117.35 109.98 1aje s TYR 40 Ca 0.68 0.29 -0.01 0.00 -0.52 0.00 0.00 57.07 57.50 1aje s TYR 40 Cb -0.24 0.57 0.09 0.00 0.38 0.00 0.00 41.96 42.76 1aje s TYR 40 CO 0.64 -0.86 0.13 0.00 -1.52 0.00 0.00 175.55 173.93 1aje s ALA 41 N -3.74 3.03 0.93 9.51 0.00 -1.25 -2.51 121.76 127.72 1aje s ALA 41 Ca 0.02 -2.37 -0.14 0.00 0.00 0.00 0.00 51.96 49.47 1aje s ALA 41 Cb -0.01 -2.22 0.15 0.00 0.00 0.00 0.00 23.12 21.04 1aje s ALA 41 CO -0.12 -1.66 1.17 0.14 0.00 0.00 0.00 175.76 175.29 1aje s VAL 42 N 1.11 1.96 -0.25 0.00 -7.23 -0.89 -4.26 120.40 110.84 1aje s VAL 42 Ca 0.06 0.00 -0.06 0.00 -1.81 0.00 0.00 61.98 60.17 1aje s VAL 42 Cb -0.21 -2.81 -0.01 0.00 0.56 0.00 0.00 36.38 33.90 1aje s VAL 42 CO -0.04 0.00 0.03 -0.89 -0.31 0.00 0.00 175.10 173.89 1aje s THR 43 N -3.41 3.86 0.49 5.32 2.01 -1.26 0.82 115.64 123.47 1aje s THR 43 Ca 0.66 -0.45 0.07 0.00 0.31 0.00 0.00 61.69 62.29 1aje s THR 43 Cb -0.12 -2.85 0.02 0.00 0.01 0.00 0.00 72.50 69.57 1aje s THR 43 CO 0.53 0.29 0.49 0.68 -0.69 0.00 0.00 174.62 175.92 1aje s VAL 44 N 1.53 2.25 -0.16 3.82 -7.23 -1.05 -4.85 120.40 114.70 1aje s VAL 44 Ca 0.05 -1.29 -0.01 0.00 -1.81 0.00 0.00 61.98 58.92 1aje s VAL 44 Cb -0.15 -2.53 0.05 0.00 0.56 0.00 0.00 36.38 34.30 1aje s VAL 44 CO 0.01 0.00 -0.02 -0.04 -0.31 0.00 0.00 175.10 174.74 1aje s MET 45 N -4.31 1.10 -0.18 4.82 -1.94 -1.26 -1.47 119.30 116.06 1aje s MET 45 Ca 0.47 -0.42 -0.20 0.00 -1.71 0.00 0.00 55.69 53.83 1aje s MET 45 Cb -0.04 -1.91 -0.17 0.00 2.01 0.00 0.00 34.83 34.73 1aje s MET 45 CO 0.29 -0.48 0.25 0.82 -0.01 0.00 0.00 175.02 175.89 1aje h ILE 46 N 6.42 0.89 -0.23 2.53 5.03 -1.89 -3.43 117.51 126.84 1aje h ILE 46 Ca -0.21 -1.95 -0.21 0.00 -0.12 0.00 0.00 64.86 62.37 1aje h ILE 46 Cb 1.11 1.96 -0.38 0.00 -3.03 0.00 0.00 36.82 36.48 1aje h ILE 46 CO 0.36 0.30 -1.04 0.61 -0.68 0.00 0.00 178.15 177.70 1aje n GLY 47 N 1.52 1.43 0.04 5.37 0.00 -1.26 -4.89 105.19 107.40 1aje n GLY 47 Ca -0.21 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.15 0.94 3.32 -0.02 0.00 -1.26 -5.07 105.19 102.95 1aje n GLY 48 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.98 2.51 0.13 1.61 8.01 -1.26 -4.86 118.70 123.86 1aje s GLU 49 Ca 0.00 -0.86 -0.24 0.00 0.01 0.00 0.00 54.97 53.88 1aje s GLU 49 Cb 0.00 -2.20 -0.07 0.00 -4.31 0.00 0.00 34.13 27.54 1aje s GLU 49 CO 0.00 0.45 0.73 -1.25 0.01 0.00 0.00 175.26 175.19 1aje s PRO 50 N -0.31 4.48 -0.28 0.39 0.04 -1.25 -2.64 135.00 135.42 1aje s PRO 50 Ca 0.01 1.05 -0.02 0.00 0.04 0.00 0.00 61.00 62.08 1aje s PRO 50 Cb -0.13 -3.27 0.09 0.00 0.04 0.00 0.00 34.50 31.23 1aje s PRO 50 CO 0.02 0.55 0.09 0.71 0.04 0.00 0.00 177.00 178.41 1aje s TYR 51 N -0.98 1.19 0.56 0.56 1.51 -0.54 -0.87 117.35 118.77 1aje s TYR 51 Ca 0.35 -1.32 -0.21 0.00 -1.01 0.00 0.00 57.07 54.87 1aje s TYR 51 Cb -0.22 -1.35 -0.04 0.00 -0.11 0.00 0.00 41.96 40.23 1aje s TYR 51 CO 0.24 -0.81 1.34 0.99 -1.11 0.00 0.00 175.55 176.20 1aje s THR 52 N 1.80 2.14 -0.20 -0.71 2.01 0.56 -2.54 115.64 118.69 1aje s THR 52 Ca 0.07 0.10 -0.03 0.00 0.31 0.00 0.00 61.69 62.14 1aje s THR 52 Cb -0.17 -3.05 0.06 0.00 0.01 0.00 0.00 72.50 69.36 1aje s THR 52 CO -0.25 -0.00 0.05 -1.48 -0.69 0.00 0.00 174.62 172.24 1aje s LEU 53 N -3.63 1.10 -0.66 4.42 0.05 0.24 0.21 118.68 120.41 1aje s LEU 53 Ca 0.73 -0.84 -0.23 0.00 0.05 0.00 0.00 54.13 53.83 1aje s LEU 53 Cb -0.39 -0.55 0.06 0.00 -2.05 0.00 0.00 46.19 43.26 1aje s LEU 53 CO 0.46 -0.32 1.00 -0.83 -0.55 0.00 0.00 176.35 176.11 1aje s GLY 54 N 1.89 1.31 0.14 -3.48 0.00 0.60 -2.10 107.32 105.68 1aje s GLY 54 Ca 0.00 -1.75 -0.21 0.00 0.00 0.00 0.00 44.72 42.76 1aje s GLY 54 CO -0.10 2.14 0.67 -2.27 0.00 0.00 0.00 173.10 173.54 1aje s LEU 55 N 4.27 4.50 -0.27 0.66 2.96 -1.04 0.29 118.68 130.05 1aje s LEU 55 Ca 0.24 1.41 0.01 0.00 -0.22 0.00 0.00 54.13 55.56 1aje s LEU 55 Cb -0.16 -3.19 0.08 0.00 0.50 0.00 0.00 46.19 43.43 1aje s LEU 55 CO 0.11 0.19 0.01 0.12 -1.32 0.00 0.00 176.35 175.47 1aje s PHE 56 N -1.23 2.30 0.25 5.38 2.19 0.25 -4.36 117.98 122.76 1aje s PHE 56 Ca 0.35 -1.87 -0.04 0.00 0.33 0.00 0.00 56.93 55.69 1aje s PHE 56 Cb -0.20 -1.79 0.47 0.00 -1.31 0.00 0.00 43.02 40.20 1aje s PHE 56 CO 0.22 -0.82 1.71 -0.44 1.83 0.00 0.00 175.22 177.72 1aje h ASP 57 N 7.96 0.17 -5.45 6.13 5.19 -1.86 -2.07 116.42 126.49 1aje h ASP 57 Ca -0.14 0.13 -0.18 0.00 -0.62 0.00 0.00 57.03 56.22 1aje h ASP 57 Cb 1.05 0.14 -0.14 0.00 0.18 0.00 0.00 39.33 40.56 1aje h ASP 57 CO 0.44 0.04 -0.49 0.42 -3.12 0.00 0.00 179.24 176.52 1aje s THR 58 N -6.02 0.03 0.01 0.35 -4.23 -1.26 -3.93 115.64 100.58 1aje s THR 58 Ca -0.12 -1.79 0.11 0.00 -1.18 0.00 0.00 61.69 58.70 1aje s THR 58 Cb 0.21 -2.26 -0.22 0.00 1.34 0.00 0.00 72.50 71.56 1aje s THR 58 CO 0.76 -0.13 0.86 0.00 -0.54 0.00 0.00 174.62 175.57 1aje h ALA 59 N 2.59 0.63 -0.26 3.99 0.00 -1.89 -3.49 119.26 120.84 1aje h ALA 59 Ca -0.33 -1.29 0.00 0.00 0.00 0.00 0.00 54.91 53.29 1aje h ALA 59 Cb 1.24 0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1aje h ALA 59 CO 0.50 1.48 0.00 0.41 0.00 0.00 0.00 179.25 181.64 1aje n GLY 60 N 1.49 1.64 2.88 0.00 0.00 -1.26 -4.37 105.19 105.56 1aje n GLY 60 Ca -0.11 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 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 1.24 0.38 1.61 -0.44 -1.26 -4.99 119.66 116.20 1aje s GLN 61 Ca 0.00 -1.16 0.29 0.00 -2.50 0.00 0.00 55.36 52.00 1aje s GLN 61 Cb 0.00 -2.50 1.27 0.00 -1.64 0.00 0.00 33.01 30.14 1aje s GLN 61 CO 0.00 -0.79 1.30 0.39 0.50 0.00 0.00 175.29 176.69 1aje n GLU 62 N 4.67 -0.03 -1.60 1.67 1.02 -1.26 -4.67 120.64 120.44 1aje n GLU 62 Ca -0.05 1.02 -0.12 0.00 -0.02 0.00 0.00 57.16 57.99 1aje n GLU 62 Cb 0.43 -2.06 -0.04 0.00 -0.02 0.00 0.00 31.44 29.75 1aje n GLU 62 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1aje n ASP 63 N -4.25 -3.26 -3.78 1.62 2.03 -1.26 -4.76 116.55 102.89 1aje n ASP 63 Ca 0.34 0.27 -0.51 0.00 0.52 0.00 0.00 54.79 55.42 1aje n ASP 63 Cb 1.36 -3.02 -0.07 0.00 -0.72 0.00 0.00 41.12 38.67 1aje n ASP 63 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1aje n TYR 64 N -2.14 0.75 -3.34 -0.67 4.01 -1.26 -4.87 117.16 109.64 1aje n TYR 64 Ca -0.12 0.90 -0.40 0.00 -0.16 0.00 0.00 57.90 58.11 1aje n TYR 64 Cb 0.44 -1.76 -0.09 0.00 -0.31 0.00 0.00 39.34 37.62 1aje n TYR 64 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1aje s ASP 65 N 0.60 6.26 0.31 7.72 2.15 -1.26 -4.92 116.67 127.53 1aje s ASP 65 Ca 0.78 0.02 0.26 0.00 0.43 0.00 0.00 52.55 54.04 1aje s ASP 65 Cb -1.10 -2.23 1.03 0.00 -0.30 0.00 0.00 42.92 40.32 1aje s ASP 65 CO 0.52 -0.34 1.77 0.03 -0.17 0.00 0.00 175.17 176.98 1aje h ARG 66 N 8.36 0.00 -5.36 4.34 -0.00 -2.03 -3.43 114.38 116.27 1aje h ARG 66 Ca -0.30 0.00 -0.62 0.00 -0.50 0.00 0.00 59.98 58.57 1aje h ARG 66 Cb 1.14 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 30.99 1aje h ARG 66 CO 0.71 0.00 -0.52 -0.51 0.00 0.00 0.00 179.97 179.65 1aje s LEU 67 N -4.84 4.09 0.62 3.04 1.43 -1.26 -4.97 118.68 116.79 1aje s LEU 67 Ca 0.04 0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 1aje s LEU 67 Cb 0.09 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.28 1aje s LEU 67 CO 0.44 0.22 0.00 -1.14 0.23 0.00 0.00 176.35 176.11 1aje n ARG 68 N 3.24 -3.65 -0.06 1.70 0.63 -1.26 -4.43 116.66 112.83 1aje n ARG 68 Ca -0.17 2.94 0.03 0.00 -0.92 0.00 0.00 57.85 59.73 1aje n ARG 68 Cb 0.53 -4.00 0.13 0.00 0.45 0.00 0.00 32.46 29.57 1aje n ARG 68 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1aje n PRO 69 N -3.79 1.27 0.19 -0.14 -0.04 -1.26 -4.21 135.00 127.03 1aje n PRO 69 Ca -0.06 -0.43 0.09 0.00 -0.04 0.00 0.00 63.50 63.06 1aje n PRO 69 Cb 0.62 -1.13 0.49 0.00 -0.04 0.00 0.00 33.50 33.44 1aje n PRO 69 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1aje h LEU 70 N 0.72 0.00 -2.77 1.53 3.38 -1.92 -2.40 115.31 113.86 1aje h LEU 70 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1aje h LEU 70 Cb 0.16 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 1aje h LEU 70 CO 0.00 0.00 0.15 -1.54 0.09 0.00 0.00 178.44 177.14 1aje n SER 71 N -2.24 4.40 -4.44 -0.43 3.41 -1.26 -4.96 113.62 108.10 1aje n SER 71 Ca -0.01 -2.48 -0.40 0.00 -0.26 0.00 0.00 58.87 55.72 1aje n SER 71 Cb 0.28 -0.82 0.02 0.00 -0.26 0.00 0.00 64.21 63.43 1aje n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aje n TYR 72 N 0.58 -0.84 -1.96 7.33 0.18 -0.90 -4.88 117.16 116.67 1aje n TYR 72 Ca 0.12 0.51 -0.33 0.00 1.88 0.00 0.00 57.90 60.08 1aje n TYR 72 Cb 0.64 -1.94 0.02 0.00 -0.38 0.00 0.00 39.34 37.67 1aje n TYR 72 CO 0.00 0.00 0.00 -1.25 -2.08 0.00 0.00 176.86 173.53 1aje s PRO 73 N -1.76 3.17 -0.22 -3.48 0.04 -1.26 -4.99 135.00 126.50 1aje s PRO 73 Ca 0.65 1.25 0.13 0.00 0.04 0.00 0.00 61.00 63.07 1aje s PRO 73 Cb -0.51 -2.01 0.45 0.00 0.04 0.00 0.00 34.50 32.47 1aje s PRO 73 CO 0.57 -0.93 1.19 1.04 0.04 0.00 0.00 177.00 178.91 1aje n GLN 74 N -2.15 2.16 -3.67 4.56 1.13 -1.26 -5.02 117.38 113.13 1aje n GLN 74 Ca 0.09 -3.49 -0.09 0.00 -1.94 0.00 0.00 57.00 51.58 1aje n GLN 74 Cb 0.53 -1.66 -0.10 0.00 0.11 0.00 0.00 30.24 29.12 1aje n GLN 74 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1aje s THR 75 N -3.40 -0.32 -0.02 5.09 -4.23 -1.26 -4.65 115.64 106.84 1aje s THR 75 Ca 0.41 0.11 0.03 0.00 -1.18 0.00 0.00 61.69 61.06 1aje s THR 75 Cb 0.38 -0.68 0.04 0.00 1.34 0.00 0.00 72.50 73.58 1aje s THR 75 CO -0.04 0.05 0.90 0.47 -0.54 0.00 0.00 174.62 175.46 1aje n ASP 76 N 4.79 1.42 -4.19 3.99 8.00 0.92 -4.94 116.55 126.54 1aje n ASP 76 Ca -0.16 -1.91 -0.14 0.00 0.71 0.00 0.00 54.79 53.29 1aje n ASP 76 Cb 0.53 -0.08 -0.11 0.00 -0.02 0.00 0.00 41.12 41.45 1aje n ASP 76 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1aje s VAL 77 N -0.96 0.95 -0.32 2.53 1.01 -0.28 -4.55 120.40 118.79 1aje s VAL 77 Ca 0.05 -1.77 -0.01 0.00 0.00 0.00 0.00 61.98 60.24 1aje s VAL 77 Cb 0.04 -1.51 0.11 0.00 0.00 0.00 0.00 36.38 35.02 1aje s VAL 77 CO 0.00 -0.64 0.13 -0.36 0.00 0.00 0.00 175.10 174.23 1aje s PHE 78 N -2.79 1.22 -0.87 5.22 0.08 -0.68 -1.36 117.98 118.80 1aje s PHE 78 Ca 0.09 -1.53 -0.23 0.00 0.12 0.00 0.00 56.93 55.38 1aje s PHE 78 Cb -0.01 -1.41 0.07 0.00 -0.57 0.00 0.00 43.02 41.10 1aje s PHE 78 CO -0.01 -0.85 1.25 -0.51 -0.10 0.00 0.00 175.22 175.00 1aje s LEU 79 N 1.60 3.95 -0.36 -0.37 1.43 0.28 -1.43 118.68 123.78 1aje s LEU 79 Ca 0.11 -1.28 -0.29 0.00 -1.03 0.00 0.00 54.13 51.64 1aje s LEU 79 Cb -0.18 -2.50 0.02 0.00 0.03 0.00 0.00 46.19 43.56 1aje s LEU 79 CO -0.24 -1.47 1.09 -0.69 0.23 0.00 0.00 176.35 175.27 1aje s VAL 80 N 4.45 4.42 -0.20 -1.59 1.01 -0.54 -2.40 120.40 125.55 1aje s VAL 80 Ca 0.36 1.59 -0.26 0.00 0.00 0.00 0.00 61.98 63.67 1aje s VAL 80 Cb -0.06 -4.47 -0.01 0.00 0.00 0.00 0.00 36.38 31.84 1aje s VAL 80 CO -0.01 -0.63 0.87 0.00 0.00 0.00 0.00 175.10 175.33 1aje n PHE 82 N 5.64 -0.15 -3.12 0.00 3.01 0.26 -4.16 117.46 118.94 1aje n PHE 82 Ca 0.06 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.56 1aje n PHE 82 Cb 0.48 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.95 1aje n PHE 82 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1aje s SER 83 N -1.41 -0.96 0.41 4.37 0.15 -1.25 -3.89 113.70 111.11 1aje s SER 83 Ca 0.00 -0.00 0.26 0.00 0.70 0.00 0.00 55.95 56.91 1aje s SER 83 Cb 0.00 1.53 0.70 0.00 -1.71 0.00 0.00 66.02 66.54 1aje s SER 83 CO 0.00 -0.16 1.73 0.58 1.20 0.00 0.00 173.24 176.59 1aje h VAL 84 N 4.98 0.00 0.00 4.45 2.07 -1.86 -3.15 116.25 122.74 1aje h VAL 84 Ca -0.04 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1aje h VAL 84 Cb 1.19 1.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.67 1aje h VAL 84 CO 0.01 0.00 0.24 0.58 0.02 0.00 0.00 177.57 178.43 1aje h VAL 85 N 0.00 0.00 -2.41 2.57 2.07 -1.89 -3.35 116.25 113.24 1aje h VAL 85 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1aje h VAL 85 Cb 0.80 0.65 -0.14 0.00 -1.52 0.00 0.00 31.29 31.07 1aje h VAL 85 CO 0.00 0.00 0.44 -0.94 0.02 0.00 0.00 177.57 177.09 1aje s SER 86 N -4.37 -0.40 -0.04 0.57 1.04 -1.19 -4.50 113.70 104.81 1aje s SER 86 Ca -0.03 -0.01 -0.30 0.00 0.48 0.00 0.00 55.95 56.09 1aje s SER 86 Cb 0.08 0.43 -0.05 0.00 0.10 0.00 0.00 66.02 66.58 1aje s SER 86 CO 0.27 -0.69 1.46 -2.16 0.98 0.00 0.00 173.24 173.10 1aje s PRO 87 N -3.24 4.24 -1.02 4.02 0.04 -1.21 -3.07 135.00 134.75 1aje s PRO 87 Ca 0.04 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1aje s PRO 87 Cb -0.01 -3.73 0.00 0.00 0.04 0.00 0.00 34.50 30.80 1aje s PRO 87 CO -0.09 -0.69 0.00 0.45 0.04 0.00 0.00 177.00 176.71 1aje n SER 88 N 6.12 -4.06 -0.04 6.66 2.88 -1.26 -4.91 113.62 119.01 1aje n SER 88 Ca 0.15 0.20 -0.08 0.00 -1.33 0.00 0.00 58.87 57.81 1aje n SER 88 Cb 0.43 -2.59 -0.07 0.00 -0.75 0.00 0.00 64.21 61.23 1aje n SER 88 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1aje h SER 89 N 0.00 -0.03 0.00 -3.46 0.02 -1.76 -3.04 113.55 105.28 1aje h SER 89 Ca -0.21 -0.52 0.00 0.00 -0.84 0.00 0.00 61.79 60.22 1aje h SER 89 Cb 0.74 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1aje h SER 89 CO 0.30 0.72 0.24 2.22 -1.14 0.00 0.00 176.83 179.16 1aje n PHE 90 N -4.72 0.18 0.01 3.45 -1.74 -1.26 -1.36 117.46 112.02 1aje n PHE 90 Ca -0.06 0.09 -0.19 0.00 -0.56 0.00 0.00 57.45 56.73 1aje n PHE 90 Cb 0.27 -0.45 -0.14 0.00 1.52 0.00 0.00 39.48 40.68 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 0.24 0.00 3.97 4.57 -1.92 -3.22 114.58 118.23 1aje h GLU 91 Ca 0.00 -0.41 0.00 0.00 -1.18 0.00 0.00 59.36 57.77 1aje h GLU 91 Cb 0.48 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 1aje h GLU 91 CO 0.00 1.12 0.00 0.27 -1.18 0.00 0.00 179.01 179.22 1aje n ASN 92 N -3.43 0.23 0.12 1.04 6.94 -0.47 -0.89 115.26 118.81 1aje n ASN 92 Ca -0.28 0.59 -0.13 0.00 -0.02 0.00 0.00 54.58 54.74 1aje n ASN 92 Cb 1.05 -0.63 -0.07 0.00 -2.36 0.00 0.00 39.78 37.78 1aje n ASN 92 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 1aje h VAL 93 N 0.00 0.72 -0.27 3.53 2.07 -1.55 -2.23 116.25 118.52 1aje h VAL 93 Ca 0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1aje h VAL 93 Cb 0.07 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 1aje h VAL 93 CO 0.00 0.00 0.07 0.11 0.02 0.00 0.00 177.57 177.77 1aje h LYS 94 N -0.29 0.17 -0.98 1.57 6.56 -1.18 0.83 116.57 123.25 1aje h LYS 94 Ca -0.00 -0.01 0.23 0.00 -1.06 0.00 0.00 60.65 59.81 1aje h LYS 94 Cb 0.27 -0.04 -0.19 0.00 -0.57 0.00 0.00 32.23 31.70 1aje h LYS 94 CO -0.01 0.11 -0.12 0.93 -2.06 0.00 0.00 179.45 178.29 1aje h GLU 95 N 0.18 0.00 0.00 3.15 5.08 -1.31 -3.12 114.58 118.55 1aje h GLU 95 Ca 0.13 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1aje h GLU 95 Cb 0.12 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1aje h GLU 95 CO -0.15 0.00 -0.19 0.36 -1.00 0.00 0.00 179.01 178.03 1aje n LYS 96 N -5.56 3.21 -0.01 2.33 0.00 -1.11 -4.72 118.16 112.30 1aje n LYS 96 Ca 0.19 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.37 1aje n LYS 96 Cb 0.61 -0.43 -0.00 0.00 -0.00 0.00 0.00 35.03 35.21 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.40 175.91 1aje h TRP 97 N 0.00 0.84 -0.20 5.58 4.06 0.64 -0.52 115.95 126.35 1aje h TRP 97 Ca 0.00 -0.33 -0.02 0.00 2.06 0.00 0.00 58.89 60.60 1aje h TRP 97 Cb 0.00 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.01 1aje h TRP 97 CO 0.00 1.12 0.04 0.28 -3.56 0.00 0.00 178.44 176.32 1aje h VAL 98 N 0.48 1.21 0.00 1.49 2.07 -1.53 0.13 116.25 120.10 1aje h VAL 98 Ca -0.01 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1aje h VAL 98 Cb 1.23 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 1aje h VAL 98 CO 0.13 0.21 0.00 -0.81 0.02 0.00 0.00 177.57 177.12 1aje n PRO 99 N -4.76 0.02 0.08 1.57 -0.04 -1.19 0.20 135.00 130.88 1aje n PRO 99 Ca -0.04 0.37 -0.21 0.00 -0.04 0.00 0.00 63.50 63.57 1aje n PRO 99 Cb 0.17 -1.56 -0.14 0.00 -0.04 0.00 0.00 33.50 31.94 1aje n PRO 99 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1aje h GLU 100 N 0.00 0.48 0.00 0.54 4.81 0.89 -3.40 114.58 117.90 1aje h GLU 100 Ca 0.00 -0.70 0.00 0.00 -0.13 0.00 0.00 59.36 58.53 1aje h GLU 100 Cb 0.16 0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1aje h GLU 100 CO 0.00 1.31 0.00 0.44 -0.73 0.00 0.00 179.01 180.03 1aje n ILE 101 N -3.95 0.00 -2.65 2.32 -5.35 0.06 -4.89 119.36 104.91 1aje n ILE 101 Ca -0.14 0.00 0.01 0.00 -0.27 0.00 0.00 62.75 62.35 1aje n ILE 101 Cb 0.91 -0.03 0.04 0.00 -1.74 0.00 0.00 39.64 38.82 1aje n ILE 101 CO 0.00 0.00 0.00 1.07 -1.76 0.00 0.00 176.55 175.86 1aje n THR 102 N -0.10 0.62 -1.04 7.28 5.66 0.16 -4.92 114.28 121.93 1aje n THR 102 Ca 0.00 -1.87 -0.07 0.00 -3.05 0.00 0.00 64.05 59.06 1aje n THR 102 Cb 0.00 1.12 -0.03 0.00 -1.55 0.00 0.00 70.33 69.86 1aje n THR 102 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 1aje n HIS 103 N -0.30 -0.20 0.00 1.09 -0.00 0.55 -4.39 115.22 111.97 1aje n HIS 103 Ca 0.01 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.19 1aje n HIS 103 Cb 0.92 -2.07 0.00 0.00 -0.12 0.00 0.00 29.99 28.72 1aje n HIS 103 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 1aje n HIS 104 N -1.60 0.00 -0.92 1.57 1.44 -1.25 -4.77 115.22 109.69 1aje n HIS 104 Ca -0.07 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.42 1aje n HIS 104 Cb 0.38 0.00 0.14 0.00 0.12 0.00 0.00 29.99 30.63 1aje n HIS 104 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1aje n PRO 106 N -0.82 1.00 0.08 0.00 -0.04 -1.26 -3.75 135.00 130.22 1aje n PRO 106 Ca 0.50 -0.01 0.21 0.00 -0.04 0.00 0.00 63.50 64.16 1aje n PRO 106 Cb 1.34 -1.04 0.74 0.00 -0.04 0.00 0.00 33.50 34.50 1aje n PRO 106 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1aje h LYS 107 N 0.01 0.00 0.00 0.54 1.79 -1.95 -3.43 116.57 113.54 1aje h LYS 107 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1aje h LYS 107 Cb 0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 1aje h LYS 107 CO 0.00 0.00 0.00 2.41 -1.08 0.00 0.00 179.45 180.78 1aje n THR 108 N -3.72 0.00 -2.94 -0.16 -1.04 -1.25 -5.06 114.28 100.12 1aje n THR 108 Ca 0.08 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.65 1aje n THR 108 Cb 0.64 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.15 1aje n THR 108 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1aje n PRO 109 N 0.00 3.48 -3.77 -2.82 -0.04 -1.25 -4.74 135.00 125.86 1aje n PRO 109 Ca 0.00 -3.94 -0.28 0.00 -0.04 0.00 0.00 63.50 59.24 1aje n PRO 109 Cb 0.00 -2.92 -0.16 0.00 -0.04 0.00 0.00 33.50 30.38 1aje n PRO 109 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1aje s PHE 110 N 0.73 1.29 -0.21 0.54 2.19 -1.25 -1.69 117.98 119.58 1aje s PHE 110 Ca 0.40 -1.06 0.01 0.00 0.33 0.00 0.00 56.93 56.61 1aje s PHE 110 Cb -0.02 -1.16 0.05 0.00 -1.31 0.00 0.00 43.02 40.58 1aje s PHE 110 CO -0.01 -0.66 -0.09 -0.51 1.83 0.00 0.00 175.22 175.79 1aje s LEU 111 N 1.77 2.41 -0.32 6.12 1.43 -0.51 0.35 118.68 129.93 1aje s LEU 111 Ca -0.01 -0.99 -0.19 0.00 -1.03 0.00 0.00 54.13 51.91 1aje s LEU 111 Cb -0.17 -1.24 -0.01 0.00 0.03 0.00 0.00 46.19 44.80 1aje s LEU 111 CO -0.09 -0.17 0.58 -0.22 0.23 0.00 0.00 176.35 176.68 1aje s LEU 112 N 1.38 4.20 -0.04 1.79 2.96 0.53 -1.47 118.68 128.02 1aje s LEU 112 Ca -0.03 0.27 0.02 0.00 -0.22 0.00 0.00 54.13 54.18 1aje s LEU 112 Cb -0.17 -2.72 0.01 0.00 0.50 0.00 0.00 46.19 43.82 1aje s LEU 112 CO -0.07 -0.46 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.72 1aje s VAL 113 N 2.51 0.78 0.80 1.68 1.01 -1.08 -0.28 120.40 125.83 1aje s VAL 113 Ca 0.22 -0.30 -0.13 0.00 0.00 0.00 0.00 61.98 61.77 1aje s VAL 113 Cb -0.15 -0.73 0.08 0.00 0.00 0.00 0.00 36.38 35.58 1aje s VAL 113 CO 0.12 0.26 1.19 -0.83 0.00 0.00 0.00 175.10 175.84 1aje s GLY 114 N 0.56 2.08 0.00 4.51 0.00 0.17 0.91 107.32 115.54 1aje s GLY 114 Ca -0.09 0.76 0.00 0.00 0.00 0.00 0.00 44.72 45.39 1aje s GLY 114 CO 0.01 1.18 0.00 -1.30 0.00 0.00 0.00 173.10 172.99 1aje n THR 115 N -3.34 0.00 0.00 0.90 -2.24 -1.25 -4.42 114.28 103.93 1aje n THR 115 Ca 0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 1aje n THR 115 Cb 0.51 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 1aje n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aje n GLN 116 N 0.00 0.00 0.00 -0.78 3.00 -1.02 -3.98 117.38 114.60 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 -0.07 5.09 5.41 -1.26 -2.87 119.36 125.65 1aje n ILE 117 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.80 1aje n ILE 117 Cb 0.00 0.00 0.24 0.00 -0.71 0.00 0.00 39.64 39.17 1aje n ILE 117 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1aje n ASP 118 N 0.00 3.73 0.00 4.38 5.68 -1.26 -4.42 116.55 124.66 1aje n ASP 118 Ca 0.00 -2.50 0.00 0.00 -0.50 0.00 0.00 54.79 51.79 1aje n ASP 118 Cb 0.00 -0.58 0.00 0.00 -1.14 0.00 0.00 41.12 39.40 1aje n ASP 118 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 1aje n LEU 119 N 0.44 0.00 0.26 -2.12 -0.00 -1.26 -4.92 117.00 109.39 1aje n LEU 119 Ca 0.17 0.00 0.12 0.00 -0.00 0.00 0.00 56.01 56.30 1aje n LEU 119 Cb 0.78 0.00 0.65 0.00 -0.00 0.00 0.00 43.42 44.85 1aje n LEU 119 CO 0.19 0.00 0.98 -0.09 -0.00 0.00 0.00 177.39 178.47 1aje h ARG 120 N 0.00 0.00 -0.34 1.96 9.65 -1.92 1.75 114.38 125.48 1aje h ARG 120 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1aje h ARG 120 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1aje h ARG 120 CO 0.00 0.00 0.00 -0.25 2.80 0.00 0.00 179.97 182.52 1aje n ASP 121 N -2.53 2.92 -4.76 -3.80 9.92 -1.26 -3.41 116.55 113.63 1aje n ASP 121 Ca -0.02 -1.93 -0.23 0.00 -0.53 0.00 0.00 54.79 52.09 1aje n ASP 121 Cb 0.30 -0.23 0.10 0.00 -0.64 0.00 0.00 41.12 40.66 1aje n ASP 121 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1aje s ASP 122 N -1.01 4.46 0.65 -2.24 1.01 0.60 -4.94 116.67 115.20 1aje s ASP 122 Ca 0.25 -0.60 0.43 0.00 0.71 0.00 0.00 52.55 53.34 1aje s ASP 122 Cb 0.13 0.25 2.28 0.00 1.01 0.00 0.00 42.92 46.59 1aje s ASP 122 CO 0.18 -1.80 2.32 1.55 0.21 0.00 0.00 175.17 177.62 1aje h PRO 123 N -0.38 0.00 -0.83 8.23 0.13 -1.94 -1.24 132.00 135.97 1aje h PRO 123 Ca -0.33 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.81 1aje h PRO 123 Cb 1.27 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.36 1aje h PRO 123 CO 0.38 0.00 0.55 1.03 -0.23 0.00 0.00 178.00 179.73 1aje h SER 124 N 0.00 0.96 0.71 1.44 0.87 -1.92 0.08 113.55 115.69 1aje h SER 124 Ca -0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1aje h SER 124 Cb 0.08 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.80 1aje h SER 124 CO 0.00 0.70 0.00 1.07 -0.53 0.00 0.00 176.83 178.07 1aje n THR 125 N -4.41 0.70 -0.11 2.23 5.66 -0.47 -3.32 114.28 114.57 1aje n THR 125 Ca 0.09 0.15 -0.14 0.00 -3.05 0.00 0.00 64.05 61.11 1aje n THR 125 Cb 0.03 -0.87 -0.03 0.00 -1.55 0.00 0.00 70.33 67.91 1aje n THR 125 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 1aje h ILE 126 N 0.00 1.28 -0.17 1.09 1.08 -1.04 -2.88 117.51 116.85 1aje h ILE 126 Ca 0.00 -1.60 0.05 0.00 -0.39 0.00 0.00 64.86 62.92 1aje h ILE 126 Cb 0.36 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 1aje h ILE 126 CO 0.00 0.53 0.16 1.05 -0.69 0.00 0.00 178.15 179.20 1aje h GLU 127 N 0.70 0.00 -0.07 2.37 -0.00 -1.64 0.76 114.58 116.70 1aje h GLU 127 Ca 0.05 0.00 0.02 0.00 -0.00 0.00 0.00 59.36 59.43 1aje h GLU 127 Cb 1.02 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.77 1aje h GLU 127 CO 0.10 0.00 0.06 0.87 -0.00 0.00 0.00 179.01 180.04 1aje h LYS 128 N 0.00 0.00 0.00 1.06 6.56 -1.70 -3.40 116.57 119.09 1aje h LYS 128 Ca 0.08 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.67 1aje h LYS 128 Cb 0.40 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.06 1aje h LYS 128 CO -0.00 0.00 0.00 1.28 -2.06 0.00 0.00 179.45 178.67 1aje n LEU 129 N -4.37 -0.38 -2.49 2.94 4.32 -0.23 -4.99 117.00 111.79 1aje n LEU 129 Ca -0.01 0.27 -0.05 0.00 -0.02 0.00 0.00 56.01 56.20 1aje n LEU 129 Cb 0.16 0.49 -0.00 0.00 -1.62 0.00 0.00 43.42 42.45 1aje n LEU 129 CO 0.33 -0.56 -0.06 0.00 -1.22 0.00 0.00 177.39 175.88 1aje n ALA 130 N -2.96 -0.92 0.02 -1.18 0.00 0.25 -4.68 120.51 111.03 1aje n ALA 130 Ca 0.00 0.03 -0.08 0.00 0.00 0.00 0.00 53.44 53.39 1aje n ALA 130 Cb 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.01 0.49 -0.32 0.00 1.79 -1.85 -2.34 116.57 114.33 1aje h LYS 131 Ca -0.11 -0.30 0.00 0.00 -2.18 0.00 0.00 60.65 58.07 1aje h LYS 131 Cb 1.08 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1aje h LYS 131 CO 0.13 0.89 0.00 0.09 -1.08 0.00 0.00 179.45 179.48 1aje n ASN 132 N -3.96 4.21 -2.25 0.86 3.02 -1.26 -4.91 115.26 110.97 1aje n ASN 132 Ca -0.03 -2.98 -0.12 0.00 -0.03 0.00 0.00 54.58 51.42 1aje n ASN 132 Cb 0.58 -0.56 -0.01 0.00 -0.61 0.00 0.00 39.78 39.17 1aje n ASN 132 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1aje n LYS 133 N -0.27 -2.05 0.00 3.52 4.76 -0.88 -4.43 118.16 118.81 1aje n LYS 133 Ca 0.22 0.63 0.00 0.00 -2.87 0.00 0.00 58.31 56.29 1aje n LYS 133 Cb 0.94 -5.16 0.00 0.00 -1.84 0.00 0.00 35.03 28.97 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 -2.64 0.00 -1.94 1.97 1.13 -1.26 -5.00 117.38 109.65 1aje n GLN 134 Ca -0.14 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 54.91 1aje n GLN 134 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.93 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 -1.17 -2.17 -1.09 4.76 -1.26 -4.72 118.16 112.51 1aje n LYS 135 Ca 0.00 1.27 -0.27 0.00 -2.87 0.00 0.00 58.31 56.44 1aje n LYS 135 Cb 0.00 -2.64 0.17 0.00 -1.84 0.00 0.00 35.03 30.73 1aje n LYS 135 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1aje n PRO 136 N 0.12 -0.86 -1.51 1.97 -0.04 -1.26 -3.36 135.00 130.06 1aje n PRO 136 Ca 0.01 -2.33 -0.53 0.00 -0.04 0.00 0.00 63.50 60.61 1aje n PRO 136 Cb 0.03 -1.11 -0.07 0.00 -0.04 0.00 0.00 33.50 32.30 1aje n PRO 136 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1aje n ILE 137 N -3.49 0.23 -2.04 0.52 -0.00 -1.26 -4.80 119.36 108.52 1aje n ILE 137 Ca 0.17 -0.18 -0.28 0.00 -0.00 0.00 0.00 62.75 62.45 1aje n ILE 137 Cb 0.59 -1.49 0.07 0.00 -0.00 0.00 0.00 39.64 38.81 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 6.16 2.54 -0.98 1.39 2.01 -1.26 -4.82 115.64 120.68 1aje s THR 138 Ca 1.07 0.00 0.08 0.00 0.31 0.00 0.00 61.69 63.15 1aje s THR 138 Cb -0.94 -3.14 0.07 0.00 0.01 0.00 0.00 72.50 68.51 1aje s THR 138 CO 0.54 -0.17 1.27 -0.81 -0.69 0.00 0.00 174.62 174.76 1aje n PRO 139 N -3.06 0.01 0.00 4.92 -0.04 -1.26 -0.61 135.00 134.95 1aje n PRO 139 Ca 0.07 0.37 0.09 0.00 -0.04 0.00 0.00 63.50 63.99 1aje n PRO 139 Cb 0.60 -1.51 0.02 0.00 -0.04 0.00 0.00 33.50 32.57 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 -1.52 1.58 -0.07 0.54 1.02 -1.26 -4.24 120.64 116.68 1aje n GLU 140 Ca 0.02 -1.08 -0.06 0.00 -0.02 0.00 0.00 57.16 56.02 1aje n GLU 140 Cb 0.09 -1.32 -0.02 0.00 -0.02 0.00 0.00 31.44 30.17 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 0.25 1.36 0.28 2.62 -1.04 0.22 -3.63 114.28 114.35 1aje n THR 141 Ca 0.08 0.21 -0.13 0.00 -2.04 0.00 0.00 64.05 62.17 1aje n THR 141 Cb 0.39 -2.32 -0.06 0.00 -1.82 0.00 0.00 70.33 66.52 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 -1.06 -1.14 -0.45 2.41 0.00 -1.75 -0.67 119.26 116.60 1aje h ALA 142 Ca 0.00 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 54.88 1aje h ALA 142 Cb 0.67 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1aje h ALA 142 CO 0.00 -1.11 0.46 0.93 0.00 0.00 0.00 179.25 179.53 1aje h GLU 143 N -0.79 0.00 -0.29 0.00 4.39 -1.82 0.25 114.58 116.32 1aje h GLU 143 Ca -0.07 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.68 1aje h GLU 143 Cb 0.63 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.23 1aje h GLU 143 CO 0.07 0.00 0.00 -0.22 -1.16 0.00 0.00 179.01 177.70 1aje h LYS 144 N 0.00 0.09 0.00 2.33 3.11 -1.19 -1.74 116.57 119.17 1aje h LYS 144 Ca 0.21 -0.01 -0.25 0.00 -2.81 0.00 0.00 60.65 57.80 1aje h LYS 144 Cb 1.14 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 32.30 1aje h LYS 144 CO -0.00 0.06 -1.69 1.47 -2.81 0.00 0.00 179.45 176.47 1aje n LEU 145 N -5.16 0.74 0.32 5.20 -0.00 -0.06 -3.64 117.00 114.40 1aje n LEU 145 Ca -0.00 0.34 0.20 0.00 -0.00 0.00 0.00 56.01 56.55 1aje n LEU 145 Cb 0.15 0.17 1.11 0.00 -0.00 0.00 0.00 43.42 44.85 1aje n LEU 145 CO 0.23 0.30 1.17 0.00 -0.00 0.00 0.00 177.39 179.09 1aje h ALA 146 N 1.18 1.20 0.00 1.47 0.00 -1.06 2.06 119.26 124.11 1aje h ALA 146 Ca -0.27 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.50 1aje h ALA 146 Cb 1.86 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.63 1aje h ALA 146 CO 0.06 -0.03 -0.68 -0.09 0.00 0.00 0.00 179.25 178.51 1aje h ARG 147 N 0.00 0.00 0.00 0.00 2.43 -1.38 1.62 114.38 117.05 1aje h ARG 147 Ca 0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 1aje h ARG 147 Cb 0.05 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1aje h ARG 147 CO -0.00 0.68 -0.51 -0.44 -1.51 0.00 0.00 179.97 178.19 1aje h ASP 148 N 0.00 0.00 0.00 -3.80 5.19 0.32 -3.36 116.42 114.77 1aje h ASP 148 Ca -0.01 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.29 1aje h ASP 148 Cb 1.23 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.72 1aje h ASP 148 CO 0.09 0.51 -1.42 0.18 -3.12 0.00 0.00 179.24 175.48 1aje n LEU 149 N -3.39 0.87 -3.17 1.55 4.77 -0.49 -5.03 117.00 112.10 1aje n LEU 149 Ca 0.01 -0.01 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 1aje n LEU 149 Cb 0.66 0.03 0.07 0.00 -2.33 0.00 0.00 43.42 41.85 1aje n LEU 149 CO 0.40 0.29 0.06 0.29 -1.33 0.00 0.00 177.39 177.10 1aje n LYS 150 N -2.37 -4.02 0.00 3.23 4.01 0.55 -4.73 118.16 114.83 1aje n LYS 150 Ca -0.11 0.79 0.00 0.00 -0.51 0.00 0.00 58.31 58.48 1aje n LYS 150 Cb 0.68 -5.55 0.00 0.00 -0.51 0.00 0.00 35.03 29.65 1aje n LYS 150 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1aje n ALA 151 N -3.47 0.00 0.04 7.82 0.00 -1.25 -4.79 120.51 118.85 1aje n ALA 151 Ca -0.16 0.00 -0.22 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 0.28 0.00 0.00 0.00 177.50 177.78 1aje h VAL 152 N -0.87 0.79 -2.11 0.00 2.07 0.58 -3.47 116.25 113.23 1aje h VAL 152 Ca 0.00 -2.43 -0.06 0.00 0.82 0.00 0.00 66.70 65.03 1aje h VAL 152 Cb 0.00 2.65 -0.20 0.00 -1.52 0.00 0.00 31.29 32.21 1aje h VAL 152 CO 0.00 0.88 0.11 -0.75 0.02 0.00 0.00 177.57 177.83 1aje s LYS 153 N -2.57 0.90 -0.21 1.57 2.47 -1.08 -5.03 119.74 115.79 1aje s LYS 153 Ca -0.19 0.57 0.01 0.00 -1.56 0.00 0.00 55.97 54.81 1aje s LYS 153 Cb 0.06 0.43 0.04 0.00 -1.46 0.00 0.00 37.83 36.90 1aje s LYS 153 CO 0.81 -0.20 -0.12 -0.47 0.16 0.00 0.00 175.35 175.53 1aje s TYR 154 N -0.43 2.68 0.30 4.03 5.04 -1.25 -0.35 117.35 127.38 1aje s TYR 154 Ca -0.06 -1.77 0.05 0.00 -2.44 0.00 0.00 57.07 52.85 1aje s TYR 154 Cb -0.03 -1.76 -0.02 0.00 0.35 0.00 0.00 41.96 40.51 1aje s TYR 154 CO 0.05 -0.79 0.30 1.33 -1.34 0.00 0.00 175.55 175.10 1aje n VAL 155 N 4.61 0.00 -4.25 3.14 0.24 0.62 -4.97 118.33 117.72 1aje n VAL 155 Ca -0.16 -2.03 -0.15 0.00 -2.04 0.00 0.00 64.34 59.96 1aje n VAL 155 Cb 0.46 1.06 -0.09 0.00 -1.47 0.00 0.00 33.84 33.80 1aje n VAL 155 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1aje s GLU 156 N -3.08 1.40 0.00 7.34 2.02 -1.26 0.41 118.70 125.53 1aje s GLU 156 Ca 0.33 -1.77 0.00 0.00 0.02 0.00 0.00 54.97 53.55 1aje s GLU 156 Cb 0.01 0.19 0.00 0.00 0.10 0.00 0.00 34.13 34.43 1aje s GLU 156 CO 0.24 -0.45 0.00 0.00 0.02 0.00 0.00 175.26 175.06 1aje n SER 158 N 0.00 1.13 0.00 0.00 2.88 -1.14 -4.49 113.62 112.00 1aje n SER 158 Ca 0.00 -1.53 0.00 0.00 -1.33 0.00 0.00 58.87 56.01 1aje n SER 158 Cb 0.00 -0.28 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 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 2.45 0.00 -0.01 -1.46 0.00 -1.26 -3.45 120.51 116.78 1aje n ALA 159 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.54 1aje n ALA 159 Cb 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.47 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 0.22 0.27 0.00 -0.00 -1.26 -4.53 117.00 111.70 1aje n LEU 160 Ca 0.00 0.09 -0.17 0.00 -0.00 0.00 0.00 56.01 55.93 1aje n LEU 160 Cb 0.00 0.12 -0.09 0.00 -0.00 0.00 0.00 43.42 43.45 1aje n LEU 160 CO 0.00 0.12 0.52 0.74 -0.00 0.00 0.00 177.39 178.77 1aje h THR 161 N 0.00 0.00 -1.89 1.47 2.02 -1.88 -3.48 112.91 109.15 1aje h THR 161 Ca -0.16 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1aje h THR 161 Cb 1.39 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1aje h THR 161 CO 0.01 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.90 1aje n GLN 162 N -5.37 0.00 -0.00 6.66 3.00 -1.26 -4.99 117.38 115.41 1aje n GLN 162 Ca -0.11 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 56.94 1aje n GLN 162 Cb 0.44 -1.55 -0.09 0.00 0.00 0.00 0.00 30.24 29.04 1aje n GLN 162 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1aje n LYS 163 N -0.94 1.52 0.00 -1.09 2.85 -1.26 -4.89 118.16 114.35 1aje n LYS 163 Ca 0.00 -0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 1aje n LYS 163 Cb 0.38 -1.24 0.00 0.00 -0.65 0.00 0.00 35.03 33.52 1aje n LYS 163 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1aje n GLY 164 N 1.49 0.00 0.05 2.58 0.00 -0.60 -4.77 105.19 103.94 1aje n GLY 164 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 0.64 0.06 0.99 -0.00 -1.22 -0.54 117.00 116.94 1aje n LEU 165 Ca 0.00 0.20 0.11 0.00 -0.00 0.00 0.00 56.01 56.33 1aje n LEU 165 Cb 0.00 -0.21 0.02 0.00 -0.00 0.00 0.00 43.42 43.23 1aje n LEU 165 CO 0.00 -0.02 -0.01 1.17 -0.00 0.00 0.00 177.39 178.52 1aje n LYS 166 N -1.99 0.44 0.04 1.47 4.81 -1.26 -1.95 118.16 119.72 1aje n LYS 166 Ca 0.04 0.04 -0.22 0.00 -0.87 0.00 0.00 58.31 57.29 1aje n LYS 166 Cb 0.42 -1.69 -0.14 0.00 0.02 0.00 0.00 35.03 33.64 1aje n LYS 166 CO 0.00 0.00 0.00 -2.95 1.17 0.00 0.00 177.40 175.62 1aje h ASN 167 N 0.00 0.52 -0.27 3.14 7.08 -1.91 -2.73 115.58 121.41 1aje h ASN 167 Ca 0.00 -0.95 0.05 0.00 -3.08 0.00 0.00 56.30 52.32 1aje h ASN 167 Cb 0.86 -0.17 -0.05 0.00 -2.08 0.00 0.00 38.32 36.88 1aje h ASN 167 CO 0.00 1.83 -0.05 1.62 -2.08 0.00 0.00 177.43 178.74 1aje h VAL 168 N 0.09 0.74 -0.66 6.14 3.04 -0.88 0.92 116.25 125.65 1aje h VAL 168 Ca -0.38 -0.01 0.14 0.00 -1.01 0.00 0.00 66.70 65.44 1aje h VAL 168 Cb 2.07 0.72 -0.12 0.00 -2.01 0.00 0.00 31.29 31.96 1aje h VAL 168 CO 0.14 0.00 -0.07 -0.26 -1.01 0.00 0.00 177.57 176.37 1aje h PHE 169 N 0.02 -0.18 -0.51 3.17 0.04 -1.43 3.25 116.94 121.30 1aje h PHE 169 Ca 0.13 0.05 0.02 0.00 2.80 0.00 0.00 57.97 60.98 1aje h PHE 169 Cb 0.20 0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.50 1aje h PHE 169 CO -0.26 -0.23 0.34 0.22 -0.60 0.00 0.00 178.31 177.78 1aje h ASP 170 N 0.06 0.54 0.30 2.17 3.58 0.32 0.21 116.42 123.59 1aje h ASP 170 Ca 0.34 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.76 1aje h ASP 170 Cb 0.54 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.47 1aje h ASP 170 CO -0.62 0.38 -0.14 -0.33 -2.88 0.00 0.00 179.24 175.65 1aje h GLU 171 N 0.63 -0.39 -1.04 0.28 4.39 1.15 0.40 114.58 119.99 1aje h GLU 171 Ca 0.20 0.03 0.31 0.00 0.34 0.00 0.00 59.36 60.23 1aje h GLU 171 Cb 0.03 0.09 -0.13 0.00 -0.10 0.00 0.00 28.75 28.63 1aje h GLU 171 CO -0.05 -0.26 0.62 0.00 -1.16 0.00 0.00 179.01 178.16 1aje h ALA 172 N -1.17 2.04 0.29 3.43 0.00 0.48 2.34 119.26 126.66 1aje h ALA 172 Ca -0.04 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1aje h ALA 172 Cb 0.31 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1aje h ALA 172 CO 0.07 -0.60 -0.14 0.82 0.00 0.00 0.00 179.25 179.40 1aje h ILE 173 N 0.37 0.20 0.00 0.00 5.03 -0.59 0.09 117.51 122.60 1aje h ILE 173 Ca 0.71 -0.79 0.00 0.00 -0.12 0.00 0.00 64.86 64.65 1aje h ILE 173 Cb 1.65 0.33 0.00 0.00 -3.03 0.00 0.00 36.82 35.77 1aje h ILE 173 CO -0.52 0.05 0.00 0.17 -0.68 0.00 0.00 178.15 177.18 1aje h LEU 174 N -1.06 0.00 0.00 1.44 -0.00 0.81 1.29 115.31 117.79 1aje h LEU 174 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 1aje h LEU 174 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.04 1aje h LEU 174 CO 0.07 0.00 -0.53 0.00 -0.00 0.00 0.00 178.44 177.97 1aje h ALA 175 N 2.03 0.70 -0.01 0.17 0.00 0.40 -3.30 119.26 119.25 1aje h ALA 175 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aje h ALA 175 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1aje h ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1aje n ALA 176 N -2.01 2.12 0.13 0.00 0.00 0.39 -3.97 120.51 117.18 1aje n ALA 176 Ca 0.03 -1.67 0.03 0.00 0.00 0.00 0.00 53.44 51.82 1aje n ALA 176 Cb 0.50 -0.17 -0.04 0.00 0.00 0.00 0.00 19.45 19.74 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 -0.86 0.14 0.00 0.00 -0.00 0.18 -4.77 117.00 111.68 1aje n LEU 177 Ca 0.07 -0.27 0.00 0.00 -0.00 0.00 0.00 56.01 55.81 1aje n LEU 177 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.84 1aje n LEU 177 CO 0.01 0.03 0.00 1.21 -0.00 0.00 0.00 177.39 178.64 1aje n GLU 178 N -1.39 0.00 -2.25 1.47 2.13 -1.24 -4.70 120.64 114.65 1aje n GLU 178 Ca 0.00 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.39 1aje n GLU 178 Cb 0.11 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.80 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 3.78 0.48 5.31 0.04 -1.26 -5.00 135.00 138.35 1aje s PRO 179 Ca 0.00 1.39 -0.22 0.00 0.04 0.00 0.00 61.00 62.21 1aje s PRO 179 Cb 0.00 -3.99 -0.07 0.00 0.04 0.00 0.00 34.50 30.48 1aje s PRO 179 CO 0.00 -1.30 1.11 -1.25 0.04 0.00 0.00 177.00 175.60 1aje s PRO 180 N 4.58 3.73 0.14 0.56 0.04 -1.26 -4.97 135.00 137.82 1aje s PRO 180 Ca 0.65 1.60 -0.11 0.00 0.04 0.00 0.00 61.00 63.17 1aje s PRO 180 Cb -0.20 -2.25 -0.06 0.00 0.04 0.00 0.00 34.50 32.03 1aje s PRO 180 CO 0.28 -0.54 1.45 0.93 0.04 0.00 0.00 177.00 179.16 1aje h GLU 181 N 1.79 0.92 -3.15 4.56 3.07 -2.03 -3.31 114.58 116.43 1aje h GLU 181 Ca -0.49 -0.51 -0.52 0.00 -0.50 0.00 0.00 59.36 57.33 1aje h GLU 181 Cb 1.24 0.03 0.02 0.00 -0.84 0.00 0.00 28.75 29.20 1aje h GLU 181 CO 0.59 1.16 3.17 -0.35 -1.40 0.00 0.00 179.01 182.19 1aje n PRO 182 N -4.05 2.94 -4.20 2.33 -0.04 -1.26 -4.87 135.00 125.85 1aje n PRO 182 Ca -0.03 -1.83 -0.22 0.00 -0.04 0.00 0.00 63.50 61.38 1aje n PRO 182 Cb 0.57 -2.61 -0.06 0.00 -0.04 0.00 0.00 33.50 31.36 1aje n PRO 182 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1aje s LYS 183 N 2.66 2.64 -0.35 0.54 -0.14 -1.25 -5.10 119.74 118.74 1aje s LYS 183 Ca 0.56 -1.22 -0.02 0.00 -1.36 0.00 0.00 55.97 53.94 1aje s LYS 183 Cb 0.15 -2.38 0.08 0.00 -1.68 0.00 0.00 37.83 34.00 1aje s LYS 183 CO -0.05 0.38 0.08 0.15 -0.76 0.00 0.00 175.35 175.16 1aje s LYS 184 N -3.77 2.17 0.10 1.68 1.02 -1.26 -5.09 119.74 114.59 1aje s LYS 184 Ca 0.32 -1.54 0.06 0.00 0.02 0.00 0.00 55.97 54.83 1aje s LYS 184 Cb -0.07 -3.34 -0.03 0.00 -0.52 0.00 0.00 37.83 33.86 1aje s LYS 184 CO 0.23 -0.83 -0.14 -1.12 -0.92 0.00 0.00 175.35 172.57 1aje s SER 185 N 1.44 1.85 -0.47 2.83 0.01 -1.26 -5.11 113.70 112.99 1aje s SER 185 Ca 0.02 -0.72 -0.07 0.00 1.31 0.00 0.00 55.95 56.49 1aje s SER 185 Cb -0.21 -0.06 0.12 0.00 0.21 0.00 0.00 66.02 66.09 1aje s SER 185 CO -0.03 -0.11 0.32 -0.60 0.41 0.00 0.00 173.24 173.23 1aje s ARG 186 N -2.24 2.36 0.00 12.44 6.06 -1.26 -5.31 118.95 131.00 1aje s ARG 186 Ca 0.04 -1.85 0.29 0.00 -2.50 0.00 0.00 55.73 51.71 1aje s ARG 186 Cb -0.07 -3.82 1.32 0.00 0.06 0.00 0.00 34.95 32.44 1aje s ARG 186 CO 0.03 -1.16 1.90 2.89 -2.50 0.00 0.00 175.30 176.45