#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 4.34 0.02 1.61 1.04 -1.26 -5.06 113.70 114.39 1aje s SER -6 Ca 0.00 1.32 0.04 0.00 0.48 0.00 0.00 55.95 57.79 1aje s SER -6 Cb 0.00 -2.04 -0.03 0.00 0.10 0.00 0.00 66.02 64.04 1aje s SER -6 CO 0.00 -2.07 -0.07 -0.54 0.98 0.00 0.00 173.24 171.54 1aje s LYS -5 N -5.13 2.50 0.94 4.02 1.02 -1.26 -5.11 119.74 116.72 1aje s LYS -5 Ca 0.61 -0.76 -0.12 0.00 0.02 0.00 0.00 55.97 55.72 1aje s LYS -5 Cb -0.15 -2.48 0.15 0.00 -0.52 0.00 0.00 37.83 34.84 1aje s LYS -5 CO 0.54 0.59 1.09 0.42 -0.92 0.00 0.00 175.35 177.07 1aje s ILE -4 N -1.03 2.48 0.95 2.17 1.09 -1.26 -4.97 121.20 120.63 1aje s ILE -4 Ca 0.18 0.16 -0.16 0.00 -1.10 0.00 0.00 60.65 59.72 1aje s ILE -4 Cb -0.11 -2.54 0.03 0.00 -1.06 0.00 0.00 42.46 38.78 1aje s ILE -4 CO 0.09 -0.20 -0.31 -0.38 -0.10 0.00 0.00 174.94 174.04 1aje n ILE -3 N -4.07 0.00 -2.53 2.92 -0.00 -1.26 -4.89 119.36 109.53 1aje n ILE -3 Ca 0.07 -0.09 -0.38 0.00 -0.00 0.00 0.00 62.75 62.35 1aje n ILE -3 Cb 0.55 -0.31 -0.04 0.00 -0.00 0.00 0.00 39.64 39.84 1aje n ILE -3 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.55 176.11 1aje s SER -2 N -1.53 6.97 -0.30 4.38 0.01 -1.26 -5.03 113.70 116.94 1aje s SER -2 Ca 0.35 2.11 -0.16 0.00 1.31 0.00 0.00 55.95 59.56 1aje s SER -2 Cb -0.02 -2.60 0.20 0.00 0.21 0.00 0.00 66.02 63.81 1aje s SER -2 CO 0.45 -0.34 1.22 0.00 0.41 0.00 0.00 173.24 174.98 1aje s ALA -1 N -1.47 -2.60 -0.52 1.44 0.00 -1.26 -4.92 121.76 112.42 1aje s ALA -1 Ca 0.52 2.00 -0.07 0.00 0.00 0.00 0.00 51.96 54.42 1aje s ALA -1 Cb -0.25 -1.94 0.07 0.00 0.00 0.00 0.00 23.12 20.99 1aje s ALA -1 CO 0.32 -0.31 0.17 -1.33 0.00 0.00 0.00 175.76 174.61 1aje n MET 1 N 3.12 -2.19 -0.33 0.00 2.81 -1.25 -4.68 117.12 114.61 1aje n MET 1 Ca -0.17 0.04 0.36 0.00 -1.81 0.00 0.00 57.70 56.12 1aje n MET 1 Cb 0.56 -4.15 0.73 0.00 -0.71 0.00 0.00 33.22 29.65 1aje n MET 1 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1aje h GLN 2 N -0.24 0.00 -4.96 0.03 1.08 -1.93 -3.47 115.11 105.63 1aje h GLN 2 Ca -0.17 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.04 1aje h GLN 2 Cb 1.02 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.41 1aje h GLN 2 CO 0.25 0.00 -0.73 2.41 -0.95 0.00 0.00 178.83 179.80 1aje n THR 3 N -3.98 -7.70 -4.43 -0.54 -1.04 -1.26 -4.92 114.28 90.41 1aje n THR 3 Ca 0.26 1.70 -0.26 0.00 -2.04 0.00 0.00 64.05 63.72 1aje n THR 3 Cb 1.34 -4.45 -0.11 0.00 -1.82 0.00 0.00 70.33 65.29 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 -0.36 2.50 -0.06 12.58 1.09 0.56 -4.75 121.20 132.77 1aje s ILE 4 Ca -0.08 -2.14 -0.02 0.00 -1.10 0.00 0.00 60.65 57.31 1aje s ILE 4 Cb 0.01 -2.25 0.03 0.00 -1.06 0.00 0.00 42.46 39.18 1aje s ILE 4 CO 0.22 -0.23 0.03 -0.54 -0.10 0.00 0.00 174.94 174.32 1aje s LYS 5 N -3.03 0.27 -0.06 2.79 -0.14 -1.26 0.16 119.74 118.47 1aje s LYS 5 Ca 0.25 0.24 -0.04 0.00 -1.36 0.00 0.00 55.97 55.05 1aje s LYS 5 Cb -0.07 -0.74 -0.04 0.00 -1.68 0.00 0.00 37.83 35.30 1aje s LYS 5 CO 0.12 -0.31 0.16 0.00 -0.76 0.00 0.00 175.35 174.56 1aje s VAL 7 N -1.19 2.94 0.02 0.00 0.11 0.99 -0.37 120.40 122.90 1aje s VAL 7 Ca 0.22 -1.12 -0.12 0.00 -2.93 0.00 0.00 61.98 58.03 1aje s VAL 7 Cb -0.12 -2.55 -0.06 0.00 -1.53 0.00 0.00 36.38 32.12 1aje s VAL 7 CO 0.12 0.11 0.39 -0.69 -3.33 0.00 0.00 175.10 171.70 1aje s VAL 8 N 1.31 5.09 0.14 2.04 1.01 -0.99 0.60 120.40 129.60 1aje s VAL 8 Ca -0.01 0.64 0.07 0.00 0.00 0.00 0.00 61.98 62.68 1aje s VAL 8 Cb -0.18 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1aje s VAL 8 CO -0.03 0.47 -0.15 0.68 0.00 0.00 0.00 175.10 176.06 1aje s VAL 9 N -1.20 1.53 0.00 2.92 -7.23 -0.80 -4.52 120.40 111.10 1aje s VAL 9 Ca 0.27 -1.84 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 1aje s VAL 9 Cb -0.15 -1.70 0.00 0.00 0.56 0.00 0.00 36.38 35.09 1aje s VAL 9 CO 0.15 -0.41 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 1aje n GLY 10 N 0.35 2.83 1.13 2.32 0.00 -1.26 -2.87 105.19 107.68 1aje n GLY 10 Ca -0.14 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 0.56 -0.08 1.61 2.03 -1.26 -4.59 116.55 114.81 1aje n ASP 11 Ca 0.00 0.10 -0.09 0.00 0.52 0.00 0.00 54.79 55.32 1aje n ASP 11 Cb 0.00 -0.15 -0.03 0.00 -0.72 0.00 0.00 41.12 40.22 1aje n ASP 11 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1aje n GLY 12 N 3.29 -0.80 0.00 0.27 0.00 -1.26 -3.88 105.19 102.82 1aje n GLY 12 Ca 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.88 1.60 0.00 4.61 0.00 -1.26 -3.19 120.51 118.39 1aje n ALA 13 Ca -0.14 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1aje n ALA 13 Cb 0.42 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 -1.02 0.95 -0.42 0.00 3.14 -1.25 -3.72 118.33 116.00 1aje n VAL 14 Ca 0.02 0.40 -0.05 0.00 -2.96 0.00 0.00 64.34 61.76 1aje n VAL 14 Cb 0.01 -1.40 -0.07 0.00 -1.06 0.00 0.00 33.84 31.32 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 -1.20 1.84 1.85 7.55 0.00 -1.19 -4.14 105.19 109.91 1aje n GLY 15 Ca 0.00 -0.50 0.05 0.00 0.00 0.00 0.00 46.02 45.57 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 2.75 4.65 0.07 1.61 4.81 -1.24 -4.42 118.16 126.39 1aje n LYS 16 Ca 0.18 -3.02 -0.03 0.00 -0.87 0.00 0.00 58.31 54.57 1aje n LYS 16 Cb 0.39 -2.24 -0.02 0.00 0.02 0.00 0.00 35.03 33.19 1aje n LYS 16 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1aje h THR 17 N 3.71 0.00 -0.67 3.15 2.02 -1.94 -2.75 112.91 116.44 1aje h THR 17 Ca 0.03 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.40 1aje h THR 17 Cb 1.96 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.34 1aje h THR 17 CO 0.50 0.00 0.57 0.00 0.37 0.00 0.00 175.52 176.95 1aje h LEU 19 N 0.00 -0.50 -0.87 0.00 7.12 -1.79 -2.41 115.31 116.87 1aje h LEU 19 Ca 0.32 0.03 0.16 0.00 0.13 0.00 0.00 57.88 58.52 1aje h LEU 19 Cb 1.44 0.15 -0.16 0.00 -0.53 0.00 0.00 40.66 41.57 1aje h LEU 19 CO -0.00 -0.28 -0.29 -0.07 -0.13 0.00 0.00 178.44 177.66 1aje h LEU 20 N -0.44 -1.08 -1.06 2.25 4.07 -1.10 0.94 115.31 118.90 1aje h LEU 20 Ca -0.04 0.27 0.40 0.00 0.08 0.00 0.00 57.88 58.60 1aje h LEU 20 Cb 0.36 0.62 -0.16 0.00 1.08 0.00 0.00 40.66 42.56 1aje h LEU 20 CO 0.02 -0.29 0.60 0.40 -1.08 0.00 0.00 178.44 178.08 1aje h ILE 21 N -0.03 0.09 -0.02 1.22 1.08 -1.20 1.55 117.51 120.20 1aje h ILE 21 Ca 0.37 -0.03 -0.19 0.00 -0.39 0.00 0.00 64.86 64.62 1aje h ILE 21 Cb 0.62 -0.01 -0.01 0.00 -3.07 0.00 0.00 36.82 34.35 1aje h ILE 21 CO -0.90 0.02 -0.82 -1.28 -0.69 0.00 0.00 178.15 174.48 1aje h SER 22 N 0.09 0.30 -0.04 1.72 0.87 0.14 1.97 113.55 118.61 1aje h SER 22 Ca 0.82 -0.22 0.01 0.00 -1.23 0.00 0.00 61.79 61.17 1aje h SER 22 Cb 2.17 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 64.03 1aje h SER 22 CO -0.68 0.99 0.11 0.10 -0.53 0.00 0.00 176.83 176.83 1aje h TYR 23 N 0.15 0.00 0.00 2.24 -0.00 0.27 0.30 116.97 119.92 1aje h TYR 23 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.69 1aje h TYR 23 Cb 1.42 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.15 1aje h TYR 23 CO 0.03 0.00 -0.85 -2.37 -0.00 0.00 0.00 178.16 174.97 1aje n THR 24 N -3.31 0.00 0.13 -0.90 5.66 -1.03 -4.80 114.28 110.03 1aje n THR 24 Ca -0.02 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 61.00 1aje n THR 24 Cb 0.19 -0.83 -0.01 0.00 -1.55 0.00 0.00 70.33 68.13 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 -1.80 0.00 -2.37 1.09 -2.24 0.66 -4.97 114.28 104.65 1aje n THR 25 Ca 0.00 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1aje n THR 25 Cb 0.42 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 1aje n THR 25 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1aje n ASN 26 N -0.88 -0.93 -3.36 3.42 5.03 0.11 -4.78 115.26 113.86 1aje n ASN 26 Ca 0.01 0.47 -0.15 0.00 0.87 0.00 0.00 54.58 55.77 1aje n ASN 26 Cb 0.05 -0.94 -0.08 0.00 -1.02 0.00 0.00 39.78 37.79 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1aje s LYS 27 N -4.71 0.51 0.26 3.52 2.20 -1.26 -4.73 119.74 115.54 1aje s LYS 27 Ca 0.00 -0.44 -0.17 0.00 -0.36 0.00 0.00 55.97 54.99 1aje s LYS 27 Cb 0.00 -0.60 -0.08 0.00 -1.51 0.00 0.00 37.83 35.64 1aje s LYS 27 CO 0.00 -1.12 0.72 -0.59 -0.36 0.00 0.00 175.35 174.00 1aje s PHE 28 N 1.93 3.52 -0.90 4.03 -0.71 -1.26 -4.82 117.98 119.76 1aje s PHE 28 Ca 0.13 1.29 -0.02 0.00 -1.04 0.00 0.00 56.93 57.29 1aje s PHE 28 Cb -0.14 -2.56 0.28 0.00 -1.21 0.00 0.00 43.02 39.39 1aje s PHE 28 CO -0.17 0.23 2.10 -0.35 -1.34 0.00 0.00 175.22 175.69 1aje n PRO 29 N 0.23 3.80 0.00 1.99 -0.04 -1.26 -4.93 135.00 134.79 1aje n PRO 29 Ca 0.00 -3.75 0.00 0.00 -0.04 0.00 0.00 63.50 59.72 1aje n PRO 29 Cb 0.52 -2.36 0.00 0.00 -0.04 0.00 0.00 33.50 31.62 1aje n PRO 29 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1aje n SER 30 N 0.03 0.00 -2.74 3.54 2.88 -1.26 -3.23 113.62 112.85 1aje n SER 30 Ca 0.52 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.85 1aje n SER 30 Cb 0.28 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.74 1aje n SER 30 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1aje n GLU 31 N 0.00 2.37 -0.63 -1.46 -0.58 -1.26 -5.00 120.64 114.08 1aje n GLU 31 Ca 0.00 -4.06 0.02 0.00 -0.42 0.00 0.00 57.16 52.71 1aje n GLU 31 Cb 0.00 -1.88 -0.01 0.00 -0.57 0.00 0.00 31.44 28.97 1aje n GLU 31 CO 0.00 0.00 0.00 2.48 -0.48 0.00 0.00 177.13 179.13 1aje n TYR 32 N -0.20 -0.51 0.01 -0.32 0.18 -1.20 -5.02 117.16 110.10 1aje n TYR 32 Ca 0.27 0.28 0.00 0.00 1.88 0.00 0.00 57.90 60.33 1aje n TYR 32 Cb 0.65 -0.47 0.00 0.00 -0.38 0.00 0.00 39.34 39.14 1aje n TYR 32 CO 0.00 0.00 0.00 1.55 -2.08 0.00 0.00 176.86 176.33 1aje n VAL 33 N -2.87 0.00 -1.10 -3.48 3.14 -1.26 -4.89 118.33 107.86 1aje n VAL 33 Ca -0.01 0.00 -0.39 0.00 -2.96 0.00 0.00 64.34 60.98 1aje n VAL 33 Cb 0.25 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 32.98 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 -2.31 1.70 -1.65 1.45 -0.04 -1.26 -4.93 135.00 127.97 1aje n PRO 34 Ca 0.00 -1.81 -0.41 0.00 -0.04 0.00 0.00 63.50 61.24 1aje n PRO 34 Cb 0.00 -2.84 0.02 0.00 -0.04 0.00 0.00 33.50 30.63 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 5.58 2.63 -4.30 0.52 -1.04 -1.26 -5.00 114.28 111.41 1aje n THR 35 Ca 0.49 -0.50 -0.20 0.00 -2.04 0.00 0.00 64.05 61.80 1aje n THR 35 Cb 0.35 -1.31 -0.11 0.00 -1.82 0.00 0.00 70.33 67.43 1aje n THR 35 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1aje s VAL 36 N -1.27 1.63 0.37 12.58 1.01 -1.26 -5.15 120.40 128.31 1aje s VAL 36 Ca 0.64 -1.85 0.05 0.00 0.00 0.00 0.00 61.98 60.81 1aje s VAL 36 Cb -0.53 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 1aje s VAL 36 CO 0.56 -0.37 0.17 2.22 0.00 0.00 0.00 175.10 177.69 1aje n PHE 37 N 0.36 -0.09 -1.25 5.22 -1.74 -1.26 -5.10 117.46 113.60 1aje n PHE 37 Ca -0.14 -2.53 0.17 0.00 -0.56 0.00 0.00 57.45 54.38 1aje n PHE 37 Cb 0.57 0.07 -0.05 0.00 1.52 0.00 0.00 39.48 41.59 1aje n PHE 37 CO 0.00 0.00 0.00 -3.47 -0.56 0.00 0.00 176.76 172.73 1aje n ASP 38 N -1.60 -7.44 -4.76 5.98 2.03 -1.26 -4.73 116.55 104.76 1aje n ASP 38 Ca -0.02 0.65 -0.37 0.00 0.52 0.00 0.00 54.79 55.57 1aje n ASP 38 Cb 0.58 -3.88 0.02 0.00 -0.72 0.00 0.00 41.12 37.13 1aje n ASP 38 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1aje s ASN 39 N -6.64 5.48 -0.47 1.67 2.47 -1.26 -4.99 114.94 111.20 1aje s ASN 39 Ca 0.00 2.47 0.04 0.00 0.42 0.00 0.00 52.86 55.79 1aje s ASN 39 Cb 0.00 -2.61 0.17 0.00 -1.45 0.00 0.00 41.25 37.36 1aje s ASN 39 CO 0.00 -1.40 0.36 -0.47 -3.72 0.00 0.00 177.10 171.87 1aje s TYR 40 N -1.50 1.60 -0.37 0.43 6.14 -1.26 -5.07 117.35 117.32 1aje s TYR 40 Ca 0.72 -2.49 -0.07 0.00 0.64 0.00 0.00 57.07 55.87 1aje s TYR 40 Cb -0.33 -1.31 0.06 0.00 0.42 0.00 0.00 41.96 40.80 1aje s TYR 40 CO 0.38 -0.77 0.17 0.00 0.64 0.00 0.00 175.55 175.96 1aje s ALA 41 N -0.17 3.14 0.71 3.97 0.00 -1.25 -2.65 121.76 125.51 1aje s ALA 41 Ca 0.30 -1.95 -0.05 0.00 0.00 0.00 0.00 51.96 50.26 1aje s ALA 41 Cb -0.01 -2.42 0.09 0.00 0.00 0.00 0.00 23.12 20.79 1aje s ALA 41 CO -0.17 -1.49 1.00 0.14 0.00 0.00 0.00 175.76 175.25 1aje s VAL 42 N 1.39 2.27 -0.31 0.00 -7.23 -0.77 -4.48 120.40 111.28 1aje s VAL 42 Ca 0.01 -0.40 -0.08 0.00 -1.81 0.00 0.00 61.98 59.71 1aje s VAL 42 Cb -0.21 -2.88 0.01 0.00 0.56 0.00 0.00 36.38 33.86 1aje s VAL 42 CO 0.02 0.00 0.10 -0.89 -0.31 0.00 0.00 175.10 174.02 1aje s THR 43 N -3.21 4.12 0.53 5.32 2.01 -1.26 -0.18 115.64 122.97 1aje s THR 43 Ca 0.63 -0.68 0.08 0.00 0.31 0.00 0.00 61.69 62.04 1aje s THR 43 Cb -0.08 -3.14 0.06 0.00 0.01 0.00 0.00 72.50 69.34 1aje s THR 43 CO 0.44 0.04 0.73 0.68 -0.69 0.00 0.00 174.62 175.82 1aje s VAL 44 N 1.52 2.44 -0.05 3.82 -7.23 -0.99 -4.80 120.40 115.11 1aje s VAL 44 Ca 0.03 -0.97 -0.02 0.00 -1.81 0.00 0.00 61.98 59.20 1aje s VAL 44 Cb -0.17 -2.47 0.03 0.00 0.56 0.00 0.00 36.38 34.33 1aje s VAL 44 CO 0.03 0.00 0.06 -0.04 -0.31 0.00 0.00 175.10 174.84 1aje s MET 45 N -4.59 -0.05 -0.12 4.82 -1.94 -1.26 -0.58 119.30 115.59 1aje s MET 45 Ca 0.60 0.34 -0.28 0.00 -1.71 0.00 0.00 55.69 54.63 1aje s MET 45 Cb -0.07 -0.62 -0.25 0.00 2.01 0.00 0.00 34.83 35.90 1aje s MET 45 CO 0.37 -0.35 0.87 0.82 -0.01 0.00 0.00 175.02 176.72 1aje h ILE 46 N 6.44 1.72 0.00 2.53 5.03 -1.87 -3.44 117.51 127.92 1aje h ILE 46 Ca -0.12 -2.12 -0.15 0.00 -0.12 0.00 0.00 64.86 62.34 1aje h ILE 46 Cb 1.12 3.16 -0.14 0.00 -3.03 0.00 0.00 36.82 37.94 1aje h ILE 46 CO 0.16 0.55 -0.25 0.61 -0.68 0.00 0.00 178.15 178.54 1aje n GLY 47 N 1.35 1.63 0.00 5.37 0.00 -1.26 -4.93 105.19 107.35 1aje n GLY 47 Ca -0.10 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.23 1.43 3.03 -0.02 0.00 -1.26 -5.11 105.19 102.03 1aje n GLY 48 Ca -0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.17 1.74 0.06 1.61 8.01 -1.26 -5.11 118.70 123.58 1aje s GLU 49 Ca 0.00 -0.43 -0.24 0.00 0.01 0.00 0.00 54.97 54.31 1aje s GLU 49 Cb 0.00 -1.43 -0.06 0.00 -4.31 0.00 0.00 34.13 28.33 1aje s GLU 49 CO 0.00 0.04 0.74 -1.25 0.01 0.00 0.00 175.26 174.80 1aje s PRO 50 N 0.63 4.47 -0.28 0.39 0.04 -1.25 -2.67 135.00 136.32 1aje s PRO 50 Ca -0.14 1.02 -0.02 0.00 0.04 0.00 0.00 61.00 61.90 1aje s PRO 50 Cb -0.16 -3.34 0.09 0.00 0.04 0.00 0.00 34.50 31.14 1aje s PRO 50 CO 0.04 0.36 0.08 0.71 0.04 0.00 0.00 177.00 178.23 1aje s TYR 51 N -0.30 1.37 0.62 0.56 1.51 0.25 -3.93 117.35 117.43 1aje s TYR 51 Ca 0.37 -1.42 -0.19 0.00 -1.01 0.00 0.00 57.07 54.82 1aje s TYR 51 Cb -0.21 -1.44 -0.02 0.00 -0.11 0.00 0.00 41.96 40.18 1aje s TYR 51 CO 0.23 -0.81 1.30 0.99 -1.11 0.00 0.00 175.55 176.15 1aje s THR 52 N 1.74 2.09 -0.08 -0.71 2.01 -1.25 -2.33 115.64 117.11 1aje s THR 52 Ca 0.07 0.06 -0.03 0.00 0.31 0.00 0.00 61.69 62.09 1aje s THR 52 Cb -0.17 -3.03 0.04 0.00 0.01 0.00 0.00 72.50 69.36 1aje s THR 52 CO -0.23 -0.01 0.17 -1.48 -0.69 0.00 0.00 174.62 172.38 1aje s LEU 53 N -4.13 0.36 -0.47 4.42 -0.00 0.75 0.21 118.68 119.82 1aje s LEU 53 Ca 0.80 0.36 -0.17 0.00 -0.00 0.00 0.00 54.13 55.12 1aje s LEU 53 Cb -0.38 0.41 0.06 0.00 -0.00 0.00 0.00 46.19 46.27 1aje s LEU 53 CO 0.41 -0.19 0.46 -0.83 -0.00 0.00 0.00 176.35 176.20 1aje s GLY 54 N 1.62 1.94 -0.57 -3.48 0.00 0.41 -1.85 107.32 105.40 1aje s GLY 54 Ca -0.05 -1.88 -0.28 0.00 0.00 0.00 0.00 44.72 42.51 1aje s GLY 54 CO -0.06 1.18 1.21 -2.27 0.00 0.00 0.00 173.10 173.15 1aje s LEU 55 N 2.00 3.47 -0.01 0.66 1.98 -1.09 0.12 118.68 125.82 1aje s LEU 55 Ca 0.08 0.17 -0.06 0.00 -2.89 0.00 0.00 54.13 51.43 1aje s LEU 55 Cb -0.21 -3.20 -0.04 0.00 0.66 0.00 0.00 46.19 43.39 1aje s LEU 55 CO 0.09 -1.48 0.23 -0.36 -1.89 0.00 0.00 176.35 172.95 1aje s PHE 56 N 4.99 3.57 -0.18 5.38 0.40 0.50 -4.78 117.98 127.87 1aje s PHE 56 Ca 0.44 0.52 -0.04 0.00 -0.60 0.00 0.00 56.93 57.25 1aje s PHE 56 Cb -0.08 -1.95 0.09 0.00 0.51 0.00 0.00 43.02 41.59 1aje s PHE 56 CO 0.26 0.64 0.27 0.34 0.70 0.00 0.00 175.22 177.42 1aje s ASP 57 N -1.68 0.74 0.09 1.36 2.15 -1.26 -2.35 116.67 115.72 1aje s ASP 57 Ca 0.26 0.21 0.08 0.00 0.43 0.00 0.00 52.55 53.54 1aje s ASP 57 Cb -0.13 0.65 -0.04 0.00 -0.30 0.00 0.00 42.92 43.10 1aje s ASP 57 CO 0.15 -0.28 -0.18 -0.89 -0.17 0.00 0.00 175.17 173.80 1aje s THR 58 N 2.40 2.85 0.00 1.71 2.01 -1.26 -5.01 115.64 118.34 1aje s THR 58 Ca 0.05 -1.40 0.00 0.00 0.31 0.00 0.00 61.69 60.65 1aje s THR 58 Cb -0.14 -2.28 0.00 0.00 0.01 0.00 0.00 72.50 70.09 1aje s THR 58 CO -0.11 0.17 0.00 0.00 -0.69 0.00 0.00 174.62 173.99 1aje n ALA 59 N 1.01 1.29 -1.00 7.40 0.00 -1.26 -4.86 120.51 123.09 1aje n ALA 59 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1aje n ALA 59 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1aje n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aje n GLY 60 N 1.03 -0.01 3.24 0.00 0.00 -1.26 -4.74 105.19 103.46 1aje n GLY 60 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 2.66 0.41 1.61 0.74 -1.26 -4.93 119.66 118.89 1aje s GLN 61 Ca 0.00 -1.77 0.10 0.00 0.05 0.00 0.00 55.36 53.74 1aje s GLN 61 Cb 0.00 -4.05 0.91 0.00 1.10 0.00 0.00 33.01 30.97 1aje s GLN 61 CO 0.00 -1.24 1.99 0.93 -0.55 0.00 0.00 175.29 176.42 1aje h GLU 62 N 8.56 0.52 -0.31 1.67 3.07 -1.89 -2.70 114.58 123.49 1aje h GLU 62 Ca -0.23 -0.03 0.07 0.00 -0.50 0.00 0.00 59.36 58.67 1aje h GLU 62 Cb 1.08 -0.12 -0.08 0.00 -0.84 0.00 0.00 28.75 28.79 1aje h GLU 62 CO 0.91 0.34 -0.24 -0.44 -1.40 0.00 0.00 179.01 178.19 1aje h ASP 63 N 0.53 -0.79 0.00 1.42 5.19 -1.99 -3.42 116.42 117.37 1aje h ASP 63 Ca 0.26 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.82 1aje h ASP 63 Cb 0.33 0.39 0.00 0.00 0.18 0.00 0.00 39.33 40.22 1aje h ASP 63 CO -0.07 -0.27 0.00 0.00 -3.12 0.00 0.00 179.24 175.77 1aje n TYR 64 N -5.38 0.00 -2.74 4.55 4.19 -1.02 -4.85 117.16 111.90 1aje n TYR 64 Ca 0.00 0.00 -0.10 0.00 3.31 0.00 0.00 57.90 61.11 1aje n TYR 64 Cb 0.30 0.00 0.05 0.00 0.49 0.00 0.00 39.34 40.18 1aje n TYR 64 CO 0.00 0.00 0.00 -3.47 0.91 0.00 0.00 176.86 174.30 1aje n ASP 65 N 0.70 -5.33 0.01 2.98 -0.08 -1.26 -4.93 116.55 108.63 1aje n ASP 65 Ca 0.00 -0.50 0.13 0.00 -1.51 0.00 0.00 54.79 52.91 1aje n ASP 65 Cb 0.00 -3.86 0.37 0.00 2.34 0.00 0.00 41.12 39.97 1aje n ASP 65 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 1aje n ARG 66 N -2.71 0.04 -2.54 -0.67 3.00 -1.26 -4.83 116.66 107.70 1aje n ARG 66 Ca -0.05 0.02 -0.43 0.00 -0.00 0.00 0.00 57.85 57.40 1aje n ARG 66 Cb 0.58 -1.53 -0.02 0.00 0.00 0.00 0.00 32.46 31.48 1aje n ARG 66 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1aje s LEU 67 N -3.21 4.23 0.02 6.15 2.96 -1.26 -4.95 118.68 122.63 1aje s LEU 67 Ca 0.11 1.67 -0.27 0.00 -0.22 0.00 0.00 54.13 55.43 1aje s LEU 67 Cb 0.17 -3.55 -0.16 0.00 0.50 0.00 0.00 46.19 43.15 1aje s LEU 67 CO 0.64 -0.59 1.29 0.03 -1.32 0.00 0.00 176.35 176.41 1aje h ARG 68 N 7.49 -0.56 -7.12 1.98 2.47 -2.04 -3.44 114.38 113.16 1aje h ARG 68 Ca -0.30 0.04 -0.51 0.00 -1.26 0.00 0.00 59.98 57.94 1aje h ARG 68 Cb 1.14 0.13 0.10 0.00 -1.65 0.00 0.00 29.97 29.68 1aje h ARG 68 CO 0.90 -0.26 0.43 -1.25 0.56 0.00 0.00 179.97 180.35 1aje s PRO 69 N -4.95 3.02 -0.17 0.04 0.04 -1.26 -4.90 135.00 126.82 1aje s PRO 69 Ca -0.15 1.63 -0.00 0.00 0.04 0.00 0.00 61.00 62.52 1aje s PRO 69 Cb 0.02 -1.96 0.12 0.00 0.04 0.00 0.00 34.50 32.73 1aje s PRO 69 CO 0.54 -1.12 1.94 1.28 0.04 0.00 0.00 177.00 179.68 1aje n LEU 70 N -1.75 5.78 -2.95 -3.56 4.77 -1.26 -4.84 117.00 113.19 1aje n LEU 70 Ca 0.12 -2.82 -0.10 0.00 -0.03 0.00 0.00 56.01 53.19 1aje n LEU 70 Cb 0.51 -1.05 0.01 0.00 -2.33 0.00 0.00 43.42 40.56 1aje n LEU 70 CO 0.44 1.08 0.07 -1.20 -1.33 0.00 0.00 177.39 176.46 1aje n SER 71 N 0.80 -7.70 -0.26 -1.43 7.64 -1.26 -4.86 113.62 106.55 1aje n SER 71 Ca 0.16 0.37 0.06 0.00 1.01 0.00 0.00 58.87 60.46 1aje n SER 71 Cb 0.56 -5.04 0.19 0.00 -1.01 0.00 0.00 64.21 58.92 1aje n SER 71 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1aje h TYR 72 N 1.73 0.51 -4.30 1.43 3.20 -1.99 -3.42 116.97 114.13 1aje h TYR 72 Ca -0.06 0.04 -0.52 0.00 3.14 0.00 0.00 58.73 61.34 1aje h TYR 72 Cb 1.04 -0.11 0.14 0.00 1.54 0.00 0.00 36.73 39.34 1aje h TYR 72 CO 0.11 0.05 0.30 -1.25 -1.64 0.00 0.00 178.16 175.73 1aje s PRO 73 N -6.01 2.00 -1.10 1.82 0.04 -1.26 -4.91 135.00 125.57 1aje s PRO 73 Ca -0.12 1.25 -0.19 0.00 0.04 0.00 0.00 61.00 61.98 1aje s PRO 73 Cb 0.21 -1.86 0.10 0.00 0.04 0.00 0.00 34.50 32.98 1aje s PRO 73 CO 0.76 -1.85 1.44 -0.65 0.04 0.00 0.00 177.00 176.74 1aje s GLN 74 N -4.84 3.78 0.28 4.56 -0.21 -1.26 -4.91 119.66 117.07 1aje s GLN 74 Ca 0.62 -1.76 0.01 0.00 0.02 0.00 0.00 55.36 54.26 1aje s GLN 74 Cb -0.18 -5.24 -0.00 0.00 1.00 0.00 0.00 33.01 28.58 1aje s GLN 74 CO 0.56 -2.03 0.35 -2.37 -2.12 0.00 0.00 175.29 169.68 1aje n THR 75 N 6.01 0.00 -2.31 -0.19 5.66 -1.26 -4.64 114.28 117.55 1aje n THR 75 Ca 0.35 -1.64 -0.04 0.00 -3.05 0.00 0.00 64.05 59.67 1aje n THR 75 Cb 0.48 0.94 0.00 0.00 -1.55 0.00 0.00 70.33 70.20 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 -1.78 -5.47 -4.20 1.09 8.00 0.14 -4.84 116.55 109.49 1aje n ASP 76 Ca 0.02 0.26 -0.29 0.00 0.71 0.00 0.00 54.79 55.50 1aje n ASP 76 Cb 0.49 -3.57 0.18 0.00 -0.02 0.00 0.00 41.12 38.20 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 -2.09 2.02 -0.35 2.53 1.01 0.40 -4.76 120.40 119.15 1aje s VAL 77 Ca 0.12 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 61.99 1aje s VAL 77 Cb -0.03 -2.89 0.11 0.00 0.00 0.00 0.00 36.38 33.56 1aje s VAL 77 CO 0.45 0.00 0.12 -0.36 0.00 0.00 0.00 175.10 175.30 1aje s PHE 78 N -3.76 2.39 -0.78 5.22 0.08 -0.71 -0.00 117.98 120.42 1aje s PHE 78 Ca 0.73 -2.27 -0.21 0.00 0.12 0.00 0.00 56.93 55.30 1aje s PHE 78 Cb -0.04 -2.13 0.09 0.00 -0.57 0.00 0.00 43.02 40.37 1aje s PHE 78 CO 0.51 -0.88 1.06 -0.51 -0.10 0.00 0.00 175.22 175.31 1aje s LEU 79 N 1.12 4.56 -0.43 -0.37 2.01 0.20 -1.44 118.68 124.33 1aje s LEU 79 Ca 0.12 -1.40 -0.29 0.00 0.01 0.00 0.00 54.13 52.57 1aje s LEU 79 Cb -0.19 -2.42 0.03 0.00 0.01 0.00 0.00 46.19 43.61 1aje s LEU 79 CO -0.15 -1.31 1.09 -0.69 1.01 0.00 0.00 176.35 176.30 1aje s VAL 80 N 3.63 4.33 0.06 -1.59 1.01 -0.60 -1.91 120.40 125.33 1aje s VAL 80 Ca 0.28 1.34 -0.28 0.00 0.00 0.00 0.00 61.98 63.31 1aje s VAL 80 Cb -0.11 -4.52 -0.05 0.00 0.00 0.00 0.00 36.38 31.69 1aje s VAL 80 CO 0.02 -0.82 0.89 0.00 0.00 0.00 0.00 175.10 175.19 1aje n PHE 82 N 3.07 0.08 -3.03 0.00 3.01 0.18 -4.65 117.46 116.11 1aje n PHE 82 Ca 0.01 0.03 -0.07 0.00 1.01 0.00 0.00 57.45 58.43 1aje n PHE 82 Cb 0.50 -0.77 0.01 0.00 -0.01 0.00 0.00 39.48 39.20 1aje n PHE 82 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1aje n SER 83 N -2.53 -7.10 0.06 4.37 2.88 -1.25 -3.87 113.62 106.17 1aje n SER 83 Ca -0.17 0.70 0.05 0.00 -1.33 0.00 0.00 58.87 58.12 1aje n SER 83 Cb 0.85 -3.36 0.26 0.00 -0.75 0.00 0.00 64.21 61.21 1aje n SER 83 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1aje n VAL 84 N 0.68 1.48 1.28 2.46 0.31 0.05 0.22 118.33 124.80 1aje n VAL 84 Ca 0.00 0.51 0.10 0.00 -0.01 0.00 0.00 64.34 64.95 1aje n VAL 84 Cb 0.35 -1.47 0.61 0.00 -0.91 0.00 0.00 33.84 32.42 1aje n VAL 84 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1aje n VAL 85 N -1.79 0.03 -3.69 2.52 0.24 -0.99 -3.49 118.33 111.16 1aje n VAL 85 Ca 0.00 0.01 -0.17 0.00 -2.04 0.00 0.00 64.34 62.14 1aje n VAL 85 Cb 0.05 -0.68 -0.16 0.00 -1.47 0.00 0.00 33.84 31.58 1aje n VAL 85 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1aje s SER 86 N -2.05 0.60 0.00 -1.34 0.15 0.13 -4.13 113.70 107.07 1aje s SER 86 Ca 0.30 0.23 0.00 0.00 0.70 0.00 0.00 55.95 57.19 1aje s SER 86 Cb 0.14 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 1aje s SER 86 CO 0.25 -0.21 0.00 -0.81 1.20 0.00 0.00 173.24 173.66 1aje n PRO 87 N 4.98 0.00 0.10 5.44 -0.04 -1.25 -3.95 135.00 140.28 1aje n PRO 87 Ca -0.11 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.39 1aje n PRO 87 Cb 0.50 -0.04 0.21 0.00 -0.04 0.00 0.00 33.50 34.14 1aje n PRO 87 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1aje n SER 88 N 0.00 0.20 -0.21 3.54 7.64 -1.26 -1.08 113.62 122.44 1aje n SER 88 Ca 0.00 0.44 0.01 0.00 1.01 0.00 0.00 58.87 60.33 1aje n SER 88 Cb 0.00 -0.40 0.12 0.00 -1.01 0.00 0.00 64.21 62.92 1aje n SER 88 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1aje h SER 89 N 0.00 0.26 0.00 6.43 0.87 -1.90 0.57 113.55 119.78 1aje h SER 89 Ca 0.00 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1aje h SER 89 Cb 0.58 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 1aje h SER 89 CO 0.00 0.15 0.07 2.22 -0.53 0.00 0.00 176.83 178.74 1aje n PHE 90 N -4.98 0.29 -0.05 2.24 -1.74 -0.24 -2.30 117.46 110.68 1aje n PHE 90 Ca 0.10 0.15 -0.19 0.00 -0.56 0.00 0.00 57.45 56.94 1aje n PHE 90 Cb 0.29 -0.68 -0.13 0.00 1.52 0.00 0.00 39.48 40.47 1aje n PHE 90 CO 0.00 0.00 0.00 -1.91 -0.56 0.00 0.00 176.76 174.29 1aje n GLU 91 N -1.78 0.71 0.04 3.97 4.07 0.20 -3.70 120.64 124.14 1aje n GLU 91 Ca -0.01 0.21 0.04 0.00 -0.06 0.00 0.00 57.16 57.35 1aje n GLU 91 Cb 0.08 -1.63 0.19 0.00 -0.06 0.00 0.00 31.44 30.02 1aje n GLU 91 CO 0.00 0.00 0.00 0.27 -0.06 0.00 0.00 177.13 177.34 1aje n ASN 92 N -3.36 0.13 -0.07 4.31 0.23 -0.97 0.02 115.26 115.55 1aje n ASN 92 Ca -0.37 0.55 -0.05 0.00 -0.53 0.00 0.00 54.58 54.19 1aje n ASN 92 Cb 1.03 -0.58 0.16 0.00 -2.08 0.00 0.00 39.78 38.31 1aje n ASN 92 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1aje h VAL 93 N 0.00 1.25 0.00 3.53 2.07 -1.61 -2.54 116.25 118.95 1aje h VAL 93 Ca 0.00 -1.15 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 1aje h VAL 93 Cb 0.07 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1aje h VAL 93 CO 0.00 0.39 -0.00 0.11 0.02 0.00 0.00 177.57 178.08 1aje h LYS 94 N 0.64 -0.00 -1.04 1.57 6.56 -0.58 -0.46 116.57 123.26 1aje h LYS 94 Ca 0.11 0.00 0.30 0.00 -1.06 0.00 0.00 60.65 60.00 1aje h LYS 94 Cb 0.57 0.00 -0.13 0.00 -0.57 0.00 0.00 32.23 32.11 1aje h LYS 94 CO 0.04 0.64 0.62 0.93 -2.06 0.00 0.00 179.45 179.62 1aje h GLU 95 N -0.65 0.38 0.00 3.15 5.08 -1.35 -3.11 114.58 118.08 1aje h GLU 95 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1aje h GLU 95 Cb 0.64 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1aje h GLU 95 CO 0.00 0.25 -0.54 1.63 -1.00 0.00 0.00 179.01 179.35 1aje n LYS 96 N -4.89 2.27 -0.05 2.33 5.02 -0.97 -4.64 118.16 117.22 1aje n LYS 96 Ca 0.30 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.45 1aje n LYS 96 Cb 0.93 -0.77 -0.07 0.00 -0.02 0.00 0.00 35.03 35.10 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 1aje h TRP 97 N 0.00 0.52 -0.50 2.13 4.06 -1.19 -2.14 115.95 118.84 1aje h TRP 97 Ca 0.00 -0.18 -0.05 0.00 2.06 0.00 0.00 58.89 60.72 1aje h TRP 97 Cb 0.45 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 28.49 1aje h TRP 97 CO 0.00 0.87 0.13 0.28 -3.56 0.00 0.00 178.44 176.16 1aje h VAL 98 N 0.02 1.24 0.00 1.49 2.07 -1.44 0.55 116.25 120.18 1aje h VAL 98 Ca 0.01 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.70 1aje h VAL 98 Cb 0.83 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1aje h VAL 98 CO 0.06 0.30 0.00 1.55 0.02 0.00 0.00 177.57 179.50 1aje h PRO 99 N 0.68 0.00 0.00 1.57 0.13 -1.70 0.20 132.00 132.89 1aje h PRO 99 Ca 0.16 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.93 1aje h PRO 99 Cb 0.32 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.39 1aje h PRO 99 CO 0.00 0.00 -2.25 0.39 -0.23 0.00 0.00 178.00 175.91 1aje n GLU 100 N -2.42 0.68 -0.12 0.86 -0.58 -0.07 -3.53 120.64 115.45 1aje n GLU 100 Ca -0.01 0.07 -0.25 0.00 -0.42 0.00 0.00 57.16 56.55 1aje n GLU 100 Cb 0.11 -1.58 -0.11 0.00 -0.57 0.00 0.00 31.44 29.29 1aje n GLU 100 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1aje n ILE 101 N -2.86 1.54 -0.11 -3.67 -5.35 0.17 -3.98 119.36 105.11 1aje n ILE 101 Ca -0.31 -0.41 -0.21 0.00 -0.27 0.00 0.00 62.75 61.56 1aje n ILE 101 Cb 1.12 -1.77 -0.10 0.00 -1.74 0.00 0.00 39.64 37.15 1aje n ILE 101 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1aje n THR 102 N -3.97 1.52 0.07 7.28 -2.24 0.61 0.11 114.28 117.67 1aje n THR 102 Ca -0.48 -0.05 0.19 0.00 -2.27 0.00 0.00 64.05 61.44 1aje n THR 102 Cb 0.90 -2.06 0.73 0.00 -2.10 0.00 0.00 70.33 67.80 1aje n THR 102 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1aje h HIS 103 N -1.00 0.00 0.00 4.78 3.86 -1.46 0.28 115.15 121.61 1aje h HIS 103 Ca -0.36 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.85 1aje h HIS 103 Cb 1.26 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.73 1aje h HIS 103 CO 0.02 0.00 -0.83 1.58 0.86 0.00 0.00 177.93 179.56 1aje n HIS 104 N -4.08 0.33 -3.64 2.45 -0.00 -1.23 -4.76 115.22 104.28 1aje n HIS 104 Ca 0.07 0.14 -0.28 0.00 -0.00 0.00 0.00 57.72 57.66 1aje n HIS 104 Cb 0.54 -0.60 -0.10 0.00 -0.00 0.00 0.00 29.99 29.84 1aje n HIS 104 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1aje n PRO 106 N 1.37 4.03 0.04 0.00 -0.04 0.08 -4.15 135.00 136.33 1aje n PRO 106 Ca 0.25 -2.92 -0.12 0.00 -0.04 0.00 0.00 63.50 60.68 1aje n PRO 106 Cb 0.38 -2.77 -0.08 0.00 -0.04 0.00 0.00 33.50 30.98 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 4.97 -0.17 0.00 0.54 1.79 -1.87 -3.49 116.57 118.34 1aje h LYS 107 Ca 0.73 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 59.21 1aje h LYS 107 Cb 0.35 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 1aje h LYS 107 CO 1.64 0.29 0.00 2.41 -1.08 0.00 0.00 179.45 182.71 1aje n THR 108 N -4.91 0.00 -1.66 -0.16 -1.04 -1.26 -5.10 114.28 100.15 1aje n THR 108 Ca -0.08 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.54 1aje n THR 108 Cb 0.27 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.75 1aje n THR 108 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1aje s PRO 109 N 0.00 2.48 -0.22 -2.82 0.04 -1.22 -4.69 135.00 128.58 1aje s PRO 109 Ca 0.00 1.45 -0.01 0.00 0.04 0.00 0.00 61.00 62.48 1aje s PRO 109 Cb 0.00 -4.49 0.06 0.00 0.04 0.00 0.00 34.50 30.11 1aje s PRO 109 CO 0.00 -2.85 -0.00 0.12 0.04 0.00 0.00 177.00 174.30 1aje s PHE 110 N 10.59 1.71 -0.24 0.56 2.19 -1.26 -1.73 117.98 129.79 1aje s PHE 110 Ca 0.93 -1.33 0.02 0.00 0.33 0.00 0.00 56.93 56.88 1aje s PHE 110 Cb -0.20 -1.32 0.04 0.00 -1.31 0.00 0.00 43.02 40.22 1aje s PHE 110 CO 0.28 -0.70 -0.12 -0.51 1.83 0.00 0.00 175.22 176.00 1aje s LEU 111 N 1.63 3.06 -0.35 6.12 1.43 -0.52 0.33 118.68 130.36 1aje s LEU 111 Ca -0.03 -1.10 -0.18 0.00 -1.03 0.00 0.00 54.13 51.79 1aje s LEU 111 Cb -0.18 -1.55 -0.00 0.00 0.03 0.00 0.00 46.19 44.48 1aje s LEU 111 CO -0.08 -0.13 0.52 -0.22 0.23 0.00 0.00 176.35 176.67 1aje s LEU 112 N 1.19 4.36 -0.07 1.79 2.96 -0.35 -1.56 118.68 127.00 1aje s LEU 112 Ca -0.03 -0.04 -0.07 0.00 -0.22 0.00 0.00 54.13 53.76 1aje s LEU 112 Cb -0.18 -2.59 0.02 0.00 0.50 0.00 0.00 46.19 43.95 1aje s LEU 112 CO -0.07 -0.49 0.21 0.68 -1.32 0.00 0.00 176.35 175.36 1aje s VAL 113 N 2.40 0.01 0.12 1.68 -7.23 -1.01 -2.17 120.40 114.20 1aje s VAL 113 Ca 0.19 -0.06 -0.25 0.00 -1.81 0.00 0.00 61.98 60.06 1aje s VAL 113 Cb -0.15 -0.31 -0.07 0.00 0.56 0.00 0.00 36.38 36.40 1aje s VAL 113 CO 0.13 -0.03 0.75 -0.83 -0.31 0.00 0.00 175.10 174.81 1aje s GLY 114 N -0.02 2.86 0.41 2.32 0.00 -0.89 0.49 107.32 112.49 1aje s GLY 114 Ca -0.01 0.30 0.07 0.00 0.00 0.00 0.00 44.72 45.08 1aje s GLY 114 CO 0.00 0.88 0.16 -1.08 0.00 0.00 0.00 173.10 173.07 1aje s THR 115 N -0.84 2.29 -0.46 0.90 -1.32 -1.26 -2.68 115.64 112.27 1aje s THR 115 Ca 0.36 -1.73 -0.29 0.00 -1.21 0.00 0.00 61.69 58.82 1aje s THR 115 Cb -0.22 -3.00 0.04 0.00 -1.51 0.00 0.00 72.50 67.81 1aje s THR 115 CO 0.25 -0.00 0.64 0.00 -2.21 0.00 0.00 174.62 173.29 1aje n GLN 116 N -1.21 -2.09 0.00 7.08 3.00 -1.25 -0.77 117.38 122.14 1aje n GLN 116 Ca -0.01 1.68 0.00 0.00 -0.01 0.00 0.00 57.00 58.66 1aje n GLN 116 Cb 0.65 -3.53 0.00 0.00 0.00 0.00 0.00 30.24 27.35 1aje n GLN 116 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.06 178.57 1aje n ILE 117 N -0.33 0.20 -3.19 5.09 3.06 -1.26 -2.35 119.36 120.57 1aje n ILE 117 Ca -0.01 -0.23 -0.23 0.00 -2.50 0.00 0.00 62.75 59.77 1aje n ILE 117 Cb 0.60 1.08 -0.05 0.00 0.54 0.00 0.00 39.64 41.80 1aje n ILE 117 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 1aje n ASP 118 N -0.10 1.89 -0.90 9.51 5.75 -1.26 -4.77 116.55 126.66 1aje n ASP 118 Ca 0.00 -3.12 -0.02 0.00 -0.01 0.00 0.00 54.79 51.64 1aje n ASP 118 Cb 0.37 -0.62 0.01 0.00 -1.03 0.00 0.00 41.12 39.85 1aje n ASP 118 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1aje n LEU 119 N 0.65 -2.14 -0.46 -2.12 7.99 -1.26 -4.86 117.00 114.79 1aje n LEU 119 Ca 0.26 -0.05 0.38 0.00 -0.01 0.00 0.00 56.01 56.59 1aje n LEU 119 Cb 0.52 -0.73 0.66 0.00 -0.11 0.00 0.00 43.42 43.76 1aje n LEU 119 CO 0.26 0.05 1.26 0.03 -1.51 0.00 0.00 177.39 177.49 1aje h ARG 120 N -0.23 0.08 0.00 3.23 -0.00 -1.88 -3.32 114.38 112.27 1aje h ARG 120 Ca -0.05 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.42 1aje h ARG 120 Cb 1.03 -0.02 0.00 0.00 0.00 0.00 0.00 29.97 30.98 1aje h ARG 120 CO 0.05 0.06 0.00 -3.47 0.00 0.00 0.00 179.97 176.61 1aje n ASP 121 N -4.60 0.00 0.00 7.04 2.03 -1.26 -4.90 116.55 114.86 1aje n ASP 121 Ca 0.37 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.68 1aje n ASP 121 Cb 1.46 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.86 1aje n ASP 121 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1aje n ASP 122 N 0.00 0.00 0.00 1.67 2.03 -1.25 -1.78 116.55 117.21 1aje n ASP 122 Ca 0.00 0.00 0.03 0.00 0.52 0.00 0.00 54.79 55.34 1aje n ASP 122 Cb 0.00 0.00 0.14 0.00 -0.72 0.00 0.00 41.12 40.54 1aje n ASP 122 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1aje n PRO 123 N 0.00 0.04 -0.49 -0.67 -0.04 -1.26 -3.52 135.00 129.07 1aje n PRO 123 Ca 0.00 0.31 0.37 0.00 -0.04 0.00 0.00 63.50 64.15 1aje n PRO 123 Cb 0.00 -1.50 0.58 0.00 -0.04 0.00 0.00 33.50 32.54 1aje n PRO 123 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1aje n SER 124 N -1.39 0.04 -0.06 3.54 2.88 -0.74 0.17 113.62 118.06 1aje n SER 124 Ca 0.02 0.80 0.02 0.00 -1.33 0.00 0.00 58.87 58.38 1aje n SER 124 Cb 0.06 -0.40 -0.01 0.00 -0.75 0.00 0.00 64.21 63.11 1aje n SER 124 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1aje n THR 125 N -3.59 0.00 -0.00 2.46 -2.24 -1.23 -4.50 114.28 105.18 1aje n THR 125 Ca 0.32 -0.44 -0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1aje n THR 125 Cb 1.42 1.03 -0.00 0.00 -2.10 0.00 0.00 70.33 70.68 1aje n THR 125 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1aje h ILE 126 N 0.29 0.00 -0.94 2.28 1.08 0.15 -3.27 117.51 117.10 1aje h ILE 126 Ca 0.00 -0.19 0.27 0.00 -0.39 0.00 0.00 64.86 64.55 1aje h ILE 126 Cb 0.13 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 33.84 1aje h ILE 126 CO 0.00 0.00 0.70 -0.08 -0.69 0.00 0.00 178.15 178.08 1aje h GLU 127 N -0.21 0.00 -1.13 2.37 4.57 -1.83 2.14 114.58 120.50 1aje h GLU 127 Ca -0.00 0.00 0.32 0.00 -1.18 0.00 0.00 59.36 58.50 1aje h GLU 127 Cb 0.01 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.55 1aje h GLU 127 CO 0.00 0.00 0.80 0.87 -1.18 0.00 0.00 179.01 179.50 1aje h LYS 128 N 0.00 0.06 0.00 1.92 1.79 -1.76 -3.37 116.57 115.21 1aje h LYS 128 Ca 0.45 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.91 1aje h LYS 128 Cb 1.83 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.47 1aje h LYS 128 CO -0.00 0.04 0.00 1.28 -1.08 0.00 0.00 179.45 179.68 1aje n LEU 129 N -4.26 0.00 -1.40 2.94 4.32 0.27 -5.01 117.00 113.86 1aje n LEU 129 Ca 0.25 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 56.16 1aje n LEU 129 Cb 1.16 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.93 1aje n LEU 129 CO 0.38 0.00 -0.08 0.00 -1.22 0.00 0.00 177.39 176.47 1aje n ALA 130 N -1.39 -0.22 0.10 -1.18 0.00 0.65 -4.69 120.51 113.78 1aje n ALA 130 Ca 0.00 0.11 -0.04 0.00 0.00 0.00 0.00 53.44 53.51 1aje n ALA 130 Cb 0.00 -0.93 0.05 0.00 0.00 0.00 0.00 19.45 18.57 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 0.03 -0.23 0.00 1.79 -1.93 -3.05 116.57 113.17 1aje h LYS 131 Ca -0.16 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.28 1aje h LYS 131 Cb 0.58 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1aje h LYS 131 CO 0.22 0.79 0.00 0.09 -1.08 0.00 0.00 179.45 179.47 1aje n ASN 132 N -3.63 3.38 -2.86 0.86 3.02 -1.26 -4.91 115.26 109.86 1aje n ASN 132 Ca -0.01 -2.74 -0.18 0.00 -0.03 0.00 0.00 54.58 51.62 1aje n ASN 132 Cb 0.75 -0.43 -0.00 0.00 -0.61 0.00 0.00 39.78 39.49 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 -0.39 -2.98 0.00 3.52 4.76 -1.15 -4.56 118.16 117.35 1aje n LYS 133 Ca 0.17 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 56.21 1aje n LYS 133 Cb 0.72 -5.27 0.00 0.00 -1.84 0.00 0.00 35.03 28.65 1aje n LYS 133 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1aje n GLN 134 N -3.30 0.00 -2.66 1.97 -0.00 -1.26 -5.02 117.38 107.11 1aje n GLN 134 Ca -0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 57.00 56.87 1aje n GLN 134 Cb 0.59 0.00 0.07 0.00 -0.00 0.00 0.00 30.24 30.90 1aje n GLN 134 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1aje n LYS 135 N 0.51 0.05 -1.20 2.61 0.00 -1.26 -4.96 118.16 113.89 1aje n LYS 135 Ca 0.00 -0.58 -0.33 0.00 -0.00 0.00 0.00 58.31 57.40 1aje n LYS 135 Cb 0.00 0.02 0.11 0.00 -0.00 0.00 0.00 35.03 35.16 1aje n LYS 135 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1aje s PRO 136 N 0.27 1.83 -0.49 -1.58 0.04 -1.26 -3.82 135.00 129.98 1aje s PRO 136 Ca 0.25 1.64 -0.40 0.00 0.04 0.00 0.00 61.00 62.53 1aje s PRO 136 Cb 0.19 -1.81 -0.17 0.00 0.04 0.00 0.00 34.50 32.75 1aje s PRO 136 CO -0.08 -2.05 2.21 -0.89 0.04 0.00 0.00 177.00 176.24 1aje n ILE 137 N -3.24 0.06 -1.64 0.56 -0.00 -1.23 -4.88 119.36 108.99 1aje n ILE 137 Ca 0.13 -0.10 -0.29 0.00 -0.00 0.00 0.00 62.75 62.49 1aje n ILE 137 Cb 0.51 -0.91 0.12 0.00 -0.00 0.00 0.00 39.64 39.36 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 6.80 2.04 -0.89 1.39 2.01 -1.26 -4.78 115.64 120.95 1aje s THR 138 Ca 1.18 0.01 0.15 0.00 0.31 0.00 0.00 61.69 63.34 1aje s THR 138 Cb -1.25 -2.84 0.13 0.00 0.01 0.00 0.00 72.50 68.56 1aje s THR 138 CO 0.58 -0.02 1.47 -0.81 -0.69 0.00 0.00 174.62 175.15 1aje n PRO 139 N -3.62 0.04 -0.00 4.92 -0.04 -1.26 -1.38 135.00 133.65 1aje n PRO 139 Ca 0.07 0.31 0.09 0.00 -0.04 0.00 0.00 63.50 63.94 1aje n PRO 139 Cb 0.60 -1.58 -0.12 0.00 -0.04 0.00 0.00 33.50 32.36 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 -1.65 0.62 0.00 0.54 1.02 -1.26 -3.96 120.64 115.95 1aje n GLU 140 Ca 0.03 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 1aje n GLU 140 Cb 0.16 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 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 -1.69 0.00 0.26 2.62 -1.04 -0.48 -3.24 114.28 110.71 1aje n THR 141 Ca 0.01 0.44 -0.16 0.00 -2.04 0.00 0.00 64.05 62.30 1aje n THR 141 Cb 0.37 -1.35 -0.08 0.00 -1.82 0.00 0.00 70.33 67.45 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 -2.00 -0.84 -0.91 2.41 0.00 -1.77 -1.33 119.26 114.82 1aje h ALA 142 Ca 0.00 -0.14 0.24 0.00 0.00 0.00 0.00 54.91 55.01 1aje h ALA 142 Cb 0.00 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1aje h ALA 142 CO 0.00 -1.01 0.63 0.93 0.00 0.00 0.00 179.25 179.81 1aje h GLU 143 N -0.81 0.15 -0.52 0.00 5.08 -1.78 0.41 114.58 117.12 1aje h GLU 143 Ca -0.04 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1aje h GLU 143 Cb 0.71 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 1aje h GLU 143 CO -0.04 0.10 0.23 -0.22 -1.00 0.00 0.00 179.01 178.09 1aje h LYS 144 N 0.16 0.76 0.00 2.33 1.63 -1.22 -1.95 116.57 118.28 1aje h LYS 144 Ca 0.45 -0.12 -0.25 0.00 -0.85 0.00 0.00 60.65 59.88 1aje h LYS 144 Cb 1.53 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 32.98 1aje h LYS 144 CO -0.08 0.65 -1.61 1.47 -3.45 0.00 0.00 179.45 176.42 1aje n LEU 145 N -4.57 0.87 0.28 5.20 -0.00 0.08 -3.20 117.00 115.66 1aje n LEU 145 Ca 0.02 0.40 0.14 0.00 -0.00 0.00 0.00 56.01 56.57 1aje n LEU 145 Cb 0.13 0.14 0.83 0.00 -0.00 0.00 0.00 43.42 44.52 1aje n LEU 145 CO 0.38 0.30 1.06 0.00 -0.00 0.00 0.00 177.39 179.13 1aje h ALA 146 N 1.14 1.47 0.00 1.47 0.00 -0.25 1.69 119.26 124.77 1aje h ALA 146 Ca -0.24 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.50 1aje h ALA 146 Cb 1.87 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.63 1aje h ALA 146 CO 0.07 0.06 -0.60 -0.09 0.00 0.00 0.00 179.25 178.69 1aje h ARG 147 N 0.00 0.00 0.00 0.00 9.65 -1.40 2.13 114.38 124.76 1aje h ARG 147 Ca -0.00 0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 58.76 1aje h ARG 147 Cb 0.12 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 1aje h ARG 147 CO 0.01 0.60 -0.59 -0.44 2.80 0.00 0.00 179.97 182.35 1aje h ASP 148 N 0.00 0.00 0.00 -3.80 5.19 0.25 -3.35 116.42 114.71 1aje h ASP 148 Ca -0.01 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.22 1aje h ASP 148 Cb 1.09 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.57 1aje h ASP 148 CO 0.08 0.59 -1.70 0.18 -3.12 0.00 0.00 179.24 175.27 1aje n LEU 149 N -3.62 2.28 -2.87 1.55 4.77 -0.15 -5.02 117.00 113.93 1aje n LEU 149 Ca -0.00 -0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.80 1aje n LEU 149 Cb 0.64 -0.28 0.06 0.00 -2.33 0.00 0.00 43.42 41.52 1aje n LEU 149 CO 0.41 0.60 0.06 0.29 -1.33 0.00 0.00 177.39 177.42 1aje n LYS 150 N -2.74 -3.80 0.00 3.23 4.76 0.72 -4.99 118.16 115.33 1aje n LYS 150 Ca -0.21 0.66 0.00 0.00 -2.87 0.00 0.00 58.31 55.90 1aje n LYS 150 Cb 0.75 -5.00 0.00 0.00 -1.84 0.00 0.00 35.03 28.94 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 -3.19 0.00 0.09 7.82 0.00 -1.25 -4.87 120.51 119.11 1aje n ALA 151 Ca -0.16 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.07 1aje n ALA 151 Cb 0.62 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.92 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 -0.69 1.15 -1.82 0.00 2.07 0.50 -3.47 116.25 113.99 1aje h VAL 152 Ca 0.00 -2.71 -0.00 0.00 0.82 0.00 0.00 66.70 64.81 1aje h VAL 152 Cb 0.00 2.86 -0.22 0.00 -1.52 0.00 0.00 31.29 32.41 1aje h VAL 152 CO 0.00 0.84 0.31 -0.75 0.02 0.00 0.00 177.57 177.99 1aje s LYS 153 N -2.60 0.80 -0.17 1.57 2.47 -1.08 -5.01 119.74 115.72 1aje s LYS 153 Ca -0.11 0.45 0.00 0.00 -1.56 0.00 0.00 55.97 54.76 1aje s LYS 153 Cb 0.06 0.38 0.03 0.00 -1.46 0.00 0.00 37.83 36.84 1aje s LYS 153 CO 0.88 -0.20 -0.12 -0.47 0.16 0.00 0.00 175.35 175.60 1aje s TYR 154 N -0.58 2.23 0.30 4.03 5.04 -1.26 -1.21 117.35 125.90 1aje s TYR 154 Ca -0.04 -1.34 0.02 0.00 -2.44 0.00 0.00 57.07 53.27 1aje s TYR 154 Cb -0.02 -1.59 -0.02 0.00 0.35 0.00 0.00 41.96 40.67 1aje s TYR 154 CO 0.03 -0.69 0.30 0.14 -1.34 0.00 0.00 175.55 173.99 1aje s VAL 155 N 1.46 0.00 0.31 3.14 -7.23 -0.92 -5.02 120.40 112.15 1aje s VAL 155 Ca 0.03 -1.87 0.05 0.00 -1.81 0.00 0.00 61.98 58.38 1aje s VAL 155 Cb -0.14 -2.52 -0.06 0.00 0.56 0.00 0.00 36.38 34.22 1aje s VAL 155 CO -0.10 0.00 0.02 -1.61 -0.31 0.00 0.00 175.10 173.11 1aje s GLU 156 N -3.56 1.63 0.00 4.82 8.01 -1.26 -2.10 118.70 126.23 1aje s GLU 156 Ca 0.37 -1.88 0.00 0.00 0.01 0.00 0.00 54.97 53.47 1aje s GLU 156 Cb 0.03 -0.97 0.00 0.00 -4.31 0.00 0.00 34.13 28.87 1aje s GLU 156 CO 0.21 -0.12 0.00 0.00 0.01 0.00 0.00 175.26 175.36 1aje n SER 158 N 0.00 4.77 0.00 0.00 2.88 -1.26 -3.92 113.62 116.09 1aje n SER 158 Ca 0.00 -2.35 0.00 0.00 -1.33 0.00 0.00 58.87 55.19 1aje n SER 158 Cb 0.00 -0.96 0.00 0.00 -0.75 0.00 0.00 64.21 62.50 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 1.14 0.00 0.08 -1.46 0.00 -1.26 -3.64 120.51 115.37 1aje n ALA 159 Ca 0.02 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.55 1aje n ALA 159 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 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 0.86 0.41 0.00 -0.00 -1.26 -4.36 117.00 112.64 1aje n LEU 160 Ca 0.00 0.34 -0.17 0.00 -0.00 0.00 0.00 56.01 56.18 1aje n LEU 160 Cb 0.00 -0.02 -0.09 0.00 -0.00 0.00 0.00 43.42 43.31 1aje n LEU 160 CO 0.00 -0.09 0.53 0.74 -0.00 0.00 0.00 177.39 178.57 1aje h THR 161 N 0.00 0.00 -2.24 1.47 2.02 -1.91 -3.48 112.91 108.77 1aje h THR 161 Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.13 1aje h THR 161 Cb 1.17 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 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 -5.14 0.00 0.00 6.66 3.00 -1.26 -4.98 117.38 115.66 1aje n GLN 162 Ca -0.14 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 56.89 1aje n GLN 162 Cb 0.45 -1.56 -0.03 0.00 0.00 0.00 0.00 30.24 29.09 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 -1.12 4.59 0.00 -1.09 2.85 -1.26 -4.91 118.16 117.22 1aje n LYS 163 Ca 0.00 -0.05 0.00 0.00 -1.05 0.00 0.00 58.31 57.21 1aje n LYS 163 Cb 0.42 -0.83 0.00 0.00 -0.65 0.00 0.00 35.03 33.98 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 1.12 0.02 0.15 2.58 0.00 -0.82 -4.71 105.19 103.54 1aje n GLY 164 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 1aje n GLY 164 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1aje h LEU 165 N 0.00 0.00 0.00 0.99 -0.00 -1.87 0.35 115.31 114.78 1aje h LEU 165 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1aje h LEU 165 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1aje h LEU 165 CO 0.00 0.00 -0.70 1.17 -0.00 0.00 0.00 178.44 178.91 1aje n LYS 166 N -2.53 0.25 -0.02 0.17 0.00 -1.26 -1.96 118.16 112.82 1aje n LYS 166 Ca 0.04 0.05 -0.21 0.00 0.00 0.00 0.00 58.31 58.19 1aje n LYS 166 Cb 0.40 -1.64 -0.14 0.00 0.00 0.00 0.00 35.03 33.65 1aje n LYS 166 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1aje n ASN 167 N -2.00 2.10 -0.19 3.14 0.23 -0.85 -2.60 115.26 115.10 1aje n ASN 167 Ca 0.03 0.16 -0.05 0.00 -0.53 0.00 0.00 54.58 54.20 1aje n ASN 167 Cb 0.43 -0.80 0.05 0.00 -2.08 0.00 0.00 39.78 37.37 1aje n ASN 167 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 1aje h VAL 168 N 0.04 1.04 -0.57 3.53 3.04 -0.39 0.57 116.25 123.51 1aje h VAL 168 Ca -0.45 -0.22 0.09 0.00 -1.01 0.00 0.00 66.70 65.11 1aje h VAL 168 Cb 2.00 0.34 -0.07 0.00 -2.01 0.00 0.00 31.29 31.55 1aje h VAL 168 CO 0.06 0.12 0.17 -0.26 -1.01 0.00 0.00 177.57 176.65 1aje h PHE 169 N 0.64 0.30 -0.36 3.17 0.04 -1.47 2.38 116.94 121.63 1aje h PHE 169 Ca 0.23 0.03 0.01 0.00 2.80 0.00 0.00 57.97 61.04 1aje h PHE 169 Cb 0.05 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.13 1aje h PHE 169 CO -0.07 0.05 0.24 -0.44 -0.60 0.00 0.00 178.31 177.49 1aje h ASP 170 N 0.33 0.39 0.41 2.17 3.32 -0.50 -2.26 116.42 120.28 1aje h ASP 170 Ca 0.29 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.31 1aje h ASP 170 Cb 0.37 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1aje h ASP 170 CO -0.32 0.28 -0.20 -0.33 -1.72 0.00 0.00 179.24 176.95 1aje h GLU 171 N 0.46 -0.53 -0.91 3.56 3.07 0.69 0.22 114.58 121.14 1aje h GLU 171 Ca 0.13 0.04 0.36 0.00 -0.50 0.00 0.00 59.36 59.39 1aje h GLU 171 Cb -0.02 0.12 -0.16 0.00 -0.84 0.00 0.00 28.75 27.85 1aje h GLU 171 CO -0.03 -0.35 0.41 0.00 -1.40 0.00 0.00 179.01 177.64 1aje n ALA 172 N -2.65 0.86 -0.03 3.43 0.00 0.69 0.36 120.51 123.16 1aje n ALA 172 Ca -0.07 0.94 -0.14 0.00 0.00 0.00 0.00 53.44 54.16 1aje n ALA 172 Cb 0.22 -0.89 -0.11 0.00 0.00 0.00 0.00 19.45 18.67 1aje n ALA 172 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1aje h ILE 173 N 0.00 1.52 0.00 0.00 5.03 -1.39 0.12 117.51 122.78 1aje h ILE 173 Ca 0.73 -1.76 0.00 0.00 -0.12 0.00 0.00 64.86 63.72 1aje h ILE 173 Cb 1.89 2.60 0.00 0.00 -3.03 0.00 0.00 36.82 38.28 1aje h ILE 173 CO -0.73 0.48 0.00 -0.11 -0.68 0.00 0.00 178.15 177.11 1aje n LEU 174 N -4.59 0.34 0.01 1.44 -0.00 0.53 0.52 117.00 115.26 1aje n LEU 174 Ca -0.09 0.62 0.11 0.00 -0.00 0.00 0.00 56.01 56.65 1aje n LEU 174 Cb 0.44 -0.61 -0.11 0.00 -0.00 0.00 0.00 43.42 43.14 1aje n LEU 174 CO 0.38 -0.58 -0.41 0.00 -0.00 0.00 0.00 177.39 176.77 1aje n ALA 175 N -1.65 3.19 0.37 1.96 0.00 1.11 -2.92 120.51 122.57 1aje n ALA 175 Ca 0.01 -0.47 0.10 0.00 0.00 0.00 0.00 53.44 53.07 1aje n ALA 175 Cb 0.11 -0.84 0.16 0.00 0.00 0.00 0.00 19.45 18.88 1aje n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aje n ALA 176 N -2.05 2.41 0.00 0.00 0.00 0.19 -3.36 120.51 117.68 1aje n ALA 176 Ca -0.01 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.53 1aje n ALA 176 Cb 0.51 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 19.24 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 1.20 0.00 -3.07 0.00 -0.00 0.63 -4.46 117.00 111.29 1aje n LEU 177 Ca 0.15 -0.22 -0.00 0.00 -0.00 0.00 0.00 56.01 55.94 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 0.13 0.00 -0.33 1.21 -0.00 0.00 0.00 177.39 178.40 1aje n GLU 178 N -0.73 -1.18 -1.88 1.47 2.13 -1.15 -4.90 120.64 114.41 1aje n GLU 178 Ca 0.00 1.28 -0.32 0.00 0.66 0.00 0.00 57.16 58.78 1aje n GLU 178 Cb 0.00 -1.53 0.02 0.00 0.27 0.00 0.00 31.44 30.20 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 -0.66 3.18 0.83 5.31 0.04 -1.26 -5.03 135.00 137.40 1aje s PRO 179 Ca -0.02 1.12 -0.11 0.00 0.04 0.00 0.00 61.00 62.03 1aje s PRO 179 Cb 0.00 -2.02 0.09 0.00 0.04 0.00 0.00 34.50 32.61 1aje s PRO 179 CO 0.11 -0.92 1.09 -1.25 0.04 0.00 0.00 177.00 176.08 1aje s PRO 180 N -4.41 1.81 -0.78 0.56 0.04 -1.26 -5.00 135.00 125.96 1aje s PRO 180 Ca 0.62 0.97 0.03 0.00 0.04 0.00 0.00 61.00 62.65 1aje s PRO 180 Cb -0.15 -1.86 0.19 0.00 0.04 0.00 0.00 34.50 32.72 1aje s PRO 180 CO 0.43 -1.90 0.62 0.39 0.04 0.00 0.00 177.00 176.58 1aje n GLU 181 N -3.67 2.17 -1.40 4.56 -0.58 -1.26 -4.97 120.64 115.49 1aje n GLU 181 Ca 0.08 -4.50 -0.39 0.00 -0.42 0.00 0.00 57.16 51.93 1aje n GLU 181 Cb 0.54 -2.33 -0.02 0.00 -0.57 0.00 0.00 31.44 29.06 1aje n GLU 181 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1aje n PRO 182 N 2.03 2.85 -2.38 3.49 -0.04 -1.26 -4.93 135.00 134.76 1aje n PRO 182 Ca 0.21 -2.23 -0.41 0.00 -0.04 0.00 0.00 63.50 61.03 1aje n PRO 182 Cb 0.36 -2.98 -0.03 0.00 -0.04 0.00 0.00 33.50 30.80 1aje n PRO 182 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1aje s LYS 183 N 3.14 4.49 -0.01 0.54 2.20 -1.26 -5.00 119.74 123.84 1aje s LYS 183 Ca 0.55 1.86 -0.28 0.00 -0.36 0.00 0.00 55.97 57.75 1aje s LYS 183 Cb 0.15 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 33.18 1aje s LYS 183 CO -0.04 -0.11 0.88 0.15 -0.36 0.00 0.00 175.35 175.87 1aje s LYS 184 N -0.09 4.53 -0.40 4.03 1.02 -1.26 -5.02 119.74 122.55 1aje s LYS 184 Ca 0.54 1.23 -0.09 0.00 0.02 0.00 0.00 55.97 57.67 1aje s LYS 184 Cb -0.32 -3.44 0.06 0.00 -0.52 0.00 0.00 37.83 33.60 1aje s LYS 184 CO 0.36 0.03 0.22 -1.12 -0.92 0.00 0.00 175.35 173.92 1aje s SER 185 N 0.81 5.61 -0.67 2.83 0.01 -1.26 -5.03 113.70 116.00 1aje s SER 185 Ca 0.46 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 56.39 1aje s SER 185 Cb -0.20 -1.98 0.17 0.00 0.21 0.00 0.00 66.02 64.22 1aje s SER 185 CO 0.25 -0.47 0.48 -0.13 0.41 0.00 0.00 173.24 173.78 1aje s ARG 186 N 1.45 2.57 0.00 12.44 1.81 -1.26 -5.35 118.95 130.60 1aje s ARG 186 Ca 0.02 -2.86 0.22 0.00 -1.72 0.00 0.00 55.73 51.39 1aje s ARG 186 Cb -0.22 -3.63 1.31 0.00 -0.45 0.00 0.00 34.95 31.97 1aje s ARG 186 CO 0.03 -1.20 1.69 0.54 -0.68 0.00 0.00 175.30 175.68