#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 5.91 0.58 1.61 0.01 -1.26 -5.04 113.70 115.51 1aje s SER -6 Ca 0.00 1.48 -0.14 0.00 1.31 0.00 0.00 55.95 58.60 1aje s SER -6 Cb 0.00 -2.46 -0.05 0.00 0.21 0.00 0.00 66.02 63.71 1aje s SER -6 CO 0.00 -1.08 1.01 -0.54 0.41 0.00 0.00 173.24 173.04 1aje s LYS -5 N -5.14 3.69 0.53 12.44 1.02 -1.26 -5.04 119.74 125.98 1aje s LYS -5 Ca 0.56 0.89 -0.16 0.00 0.02 0.00 0.00 55.97 57.28 1aje s LYS -5 Cb -0.12 -2.10 -0.07 0.00 -0.52 0.00 0.00 37.83 35.02 1aje s LYS -5 CO 0.54 -0.49 0.99 0.42 -0.92 0.00 0.00 175.35 175.90 1aje s ILE -4 N -2.87 4.57 1.36 2.17 1.09 -1.26 -5.04 121.20 121.21 1aje s ILE -4 Ca 0.58 1.16 -0.20 0.00 -1.10 0.00 0.00 60.65 61.08 1aje s ILE -4 Cb -0.11 -3.75 0.35 0.00 -1.06 0.00 0.00 42.46 37.89 1aje s ILE -4 CO 0.43 -0.77 0.95 -0.63 -0.10 0.00 0.00 174.94 174.82 1aje s ILE -3 N -2.72 1.44 0.59 2.92 1.09 -1.26 -5.00 121.20 118.26 1aje s ILE -3 Ca 0.58 0.00 -0.07 0.00 -1.10 0.00 0.00 60.65 60.06 1aje s ILE -3 Cb -0.10 -2.05 -0.01 0.00 -1.06 0.00 0.00 42.46 39.24 1aje s ILE -3 CO 0.35 0.00 0.93 -0.44 -0.10 0.00 0.00 174.94 175.68 1aje s SER -2 N -2.91 5.78 0.02 3.58 0.01 -1.26 -5.07 113.70 113.84 1aje s SER -2 Ca 0.69 0.91 -0.16 0.00 1.31 0.00 0.00 55.95 58.69 1aje s SER -2 Cb -0.17 -1.94 0.05 0.00 0.21 0.00 0.00 66.02 64.17 1aje s SER -2 CO 0.60 -0.99 0.75 0.00 0.41 0.00 0.00 173.24 174.01 1aje n ALA -1 N -2.61 -2.07 -2.20 1.44 0.00 -1.26 -4.33 120.51 109.49 1aje n ALA -1 Ca 0.04 -0.54 -0.05 0.00 0.00 0.00 0.00 53.44 52.90 1aje n ALA -1 Cb 0.57 0.17 -0.01 0.00 0.00 0.00 0.00 19.45 20.18 1aje n ALA -1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aje n MET 1 N -0.53 -2.17 0.13 0.00 0.00 -0.56 -4.65 117.12 109.33 1aje n MET 1 Ca 0.02 0.02 0.19 0.00 0.00 0.00 0.00 57.70 57.92 1aje n MET 1 Cb 0.36 -3.23 0.68 0.00 0.00 0.00 0.00 33.22 31.02 1aje n MET 1 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 175.97 177.93 1aje h GLN 2 N -0.10 0.00 -5.60 3.17 1.08 -1.90 -3.46 115.11 108.30 1aje h GLN 2 Ca -0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 1aje h GLN 2 Cb 0.76 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.14 1aje h GLN 2 CO 0.10 0.00 -0.62 0.25 -0.95 0.00 0.00 178.83 177.61 1aje n THR 3 N -3.37 -5.69 -3.94 -0.54 -2.24 -1.26 -4.50 114.28 92.74 1aje n THR 3 Ca 0.07 1.12 -0.34 0.00 -2.27 0.00 0.00 64.05 62.63 1aje n THR 3 Cb 0.71 -4.05 -0.14 0.00 -2.10 0.00 0.00 70.33 64.75 1aje n THR 3 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1aje s ILE 4 N -0.26 2.70 -0.14 2.28 1.09 0.47 -3.41 121.20 123.94 1aje s ILE 4 Ca -0.11 -1.81 -0.29 0.00 -1.10 0.00 0.00 60.65 57.34 1aje s ILE 4 Cb 0.01 -2.72 -0.02 0.00 -1.06 0.00 0.00 42.46 38.67 1aje s ILE 4 CO 0.29 -0.33 1.18 -0.54 -0.10 0.00 0.00 174.94 175.45 1aje s LYS 5 N 1.11 4.29 -0.10 2.79 -0.14 -1.26 0.25 119.74 126.68 1aje s LYS 5 Ca 0.01 1.58 -0.01 0.00 -1.36 0.00 0.00 55.97 56.19 1aje s LYS 5 Cb -0.20 -3.66 -0.03 0.00 -1.68 0.00 0.00 37.83 32.26 1aje s LYS 5 CO -0.04 -0.58 -0.06 0.00 -0.76 0.00 0.00 175.35 173.91 1aje s VAL 7 N -0.38 3.15 0.32 0.00 1.01 0.18 0.22 120.40 124.90 1aje s VAL 7 Ca 0.06 -2.24 -0.15 0.00 0.00 0.00 0.00 61.98 59.65 1aje s VAL 7 Cb -0.12 -3.17 -0.09 0.00 0.00 0.00 0.00 36.38 33.00 1aje s VAL 7 CO 0.02 -0.70 0.74 0.54 0.00 0.00 0.00 175.10 175.70 1aje s VAL 8 N 0.93 4.67 0.09 2.92 0.11 -0.94 -1.25 120.40 126.94 1aje s VAL 8 Ca 0.10 0.97 0.04 0.00 -2.93 0.00 0.00 61.98 60.15 1aje s VAL 8 Cb -0.22 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 30.97 1aje s VAL 8 CO -0.05 -0.16 -0.10 0.68 -3.33 0.00 0.00 175.10 172.14 1aje s VAL 9 N -1.96 0.91 0.00 2.04 -7.23 -0.32 -4.71 120.40 109.13 1aje s VAL 9 Ca 0.53 -1.63 0.00 0.00 -1.81 0.00 0.00 61.98 59.07 1aje s VAL 9 Cb -0.11 -1.35 0.00 0.00 0.56 0.00 0.00 36.38 35.49 1aje s VAL 9 CO 0.18 -0.57 0.00 0.61 -0.31 0.00 0.00 175.10 175.01 1aje n GLY 10 N 0.56 -1.17 0.04 2.32 0.00 -1.26 -3.01 105.19 102.66 1aje n GLY 10 Ca -0.16 -1.61 -0.04 0.00 0.00 0.00 0.00 46.02 44.21 1aje n GLY 10 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1aje n ASP 11 N -1.42 3.28 -2.78 1.61 5.68 -1.26 -4.88 116.55 116.78 1aje n ASP 11 Ca 0.00 -0.00 -0.03 0.00 -0.50 0.00 0.00 54.79 54.25 1aje n ASP 11 Cb 0.00 0.62 -0.03 0.00 -1.14 0.00 0.00 41.12 40.57 1aje n ASP 11 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1aje n GLY 12 N 2.60 -3.19 1.97 6.12 0.00 -1.25 -2.44 105.19 108.99 1aje n GLY 12 Ca -0.12 1.09 -0.02 0.00 0.00 0.00 0.00 46.02 46.97 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 2.06 -0.59 -4.20 4.61 0.00 -1.26 -0.34 120.51 120.78 1aje n ALA 13 Ca -0.25 0.03 -0.34 0.00 0.00 0.00 0.00 53.44 52.87 1aje n ALA 13 Cb 0.39 -0.60 -0.04 0.00 0.00 0.00 0.00 19.45 19.21 1aje n ALA 13 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1aje n VAL 14 N -2.07 -1.39 -2.82 0.00 0.31 -1.02 -4.83 118.33 106.51 1aje n VAL 14 Ca -0.03 -0.17 -0.01 0.00 -0.01 0.00 0.00 64.34 64.12 1aje n VAL 14 Cb 0.34 -1.72 0.05 0.00 -0.91 0.00 0.00 33.84 31.60 1aje n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1aje n GLY 15 N -1.62 1.75 0.03 2.92 0.00 0.54 -4.83 105.19 103.97 1aje n GLY 15 Ca -0.05 -1.09 0.04 0.00 0.00 0.00 0.00 46.02 44.92 1aje n GLY 15 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1aje n LYS 16 N -0.54 0.77 -0.02 1.61 0.00 -1.21 -3.28 118.16 115.48 1aje n LYS 16 Ca 0.07 -0.12 -0.12 0.00 0.00 0.00 0.00 58.31 58.15 1aje n LYS 16 Cb 0.80 -1.42 -0.06 0.00 0.00 0.00 0.00 35.03 34.36 1aje n LYS 16 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1aje h THR 17 N 0.00 0.13 -0.40 3.15 2.02 -1.88 0.15 112.91 116.08 1aje h THR 17 Ca -0.13 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.17 1aje h THR 17 Cb 1.15 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1aje h THR 17 CO 0.01 0.00 0.56 0.00 0.37 0.00 0.00 175.52 176.46 1aje h LEU 19 N 0.00 -0.33 -1.02 0.00 5.85 -0.97 -1.63 115.31 117.21 1aje h LEU 19 Ca 0.19 -0.21 0.25 0.00 0.84 0.00 0.00 57.88 58.96 1aje h LEU 19 Cb 1.32 0.08 -0.13 0.00 0.37 0.00 0.00 40.66 42.31 1aje h LEU 19 CO -0.00 0.09 0.60 -0.07 -0.34 0.00 0.00 178.44 178.71 1aje h LEU 20 N -0.81 0.66 0.77 2.25 4.07 -0.80 1.82 115.31 123.27 1aje h LEU 20 Ca -0.04 0.14 -0.04 0.00 0.08 0.00 0.00 57.88 58.02 1aje h LEU 20 Cb 0.51 0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.29 1aje h LEU 20 CO 0.06 0.08 -0.42 0.40 -1.08 0.00 0.00 178.44 177.49 1aje h ILE 21 N 0.56 0.00 0.00 1.22 1.08 -1.15 -0.39 117.51 118.83 1aje h ILE 21 Ca 0.65 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.12 1aje h ILE 21 Cb 1.27 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.02 1aje h ILE 21 CO -0.48 0.00 0.00 -0.24 -0.69 0.00 0.00 178.15 176.74 1aje n SER 22 N -5.10 0.69 0.22 1.72 2.88 -0.50 0.29 113.62 113.81 1aje n SER 22 Ca -0.14 0.67 0.14 0.00 -1.33 0.00 0.00 58.87 58.21 1aje n SER 22 Cb 0.44 -0.81 0.40 0.00 -0.75 0.00 0.00 64.21 63.49 1aje n SER 22 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1aje h TYR 23 N 0.00 0.00 0.00 0.66 3.20 0.36 0.26 116.97 121.45 1aje h TYR 23 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1aje h TYR 23 Cb 0.37 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.64 1aje h TYR 23 CO 0.00 0.00 -0.89 -2.37 -1.64 0.00 0.00 178.16 173.26 1aje n THR 24 N -2.91 0.00 0.54 1.81 5.66 -0.21 -4.72 114.28 114.44 1aje n THR 24 Ca 0.03 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.08 1aje n THR 24 Cb 0.42 -0.67 -0.06 0.00 -1.55 0.00 0.00 70.33 68.46 1aje n THR 24 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1aje n THR 25 N -2.11 0.00 -1.49 1.09 -2.24 0.83 -4.85 114.28 105.52 1aje n THR 25 Ca 0.00 -0.24 -0.04 0.00 -2.27 0.00 0.00 64.05 61.50 1aje n THR 25 Cb 0.45 1.01 -0.01 0.00 -2.10 0.00 0.00 70.33 69.67 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 -1.20 -1.31 -3.40 3.42 4.13 0.92 -4.78 115.26 113.04 1aje n ASN 26 Ca 0.02 0.18 -0.20 0.00 1.68 0.00 0.00 54.58 56.26 1aje n ASN 26 Cb 0.18 -1.46 -0.10 0.00 -1.54 0.00 0.00 39.78 36.87 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1aje s LYS 27 N -3.07 0.50 -0.03 3.52 2.20 -1.26 -4.85 119.74 116.75 1aje s LYS 27 Ca 0.00 -0.71 -0.04 0.00 -0.36 0.00 0.00 55.97 54.86 1aje s LYS 27 Cb 0.00 -0.84 -0.04 0.00 -1.51 0.00 0.00 37.83 35.44 1aje s LYS 27 CO 0.00 -1.14 0.19 -0.59 -0.36 0.00 0.00 175.35 173.45 1aje s PHE 28 N 1.69 3.56 -0.33 4.03 -0.71 -1.26 -4.77 117.98 120.19 1aje s PHE 28 Ca 0.14 0.42 0.01 0.00 -1.04 0.00 0.00 56.93 56.46 1aje s PHE 28 Cb -0.16 -1.87 0.35 0.00 -1.21 0.00 0.00 43.02 40.12 1aje s PHE 28 CO -0.14 0.66 1.76 -0.35 -1.34 0.00 0.00 175.22 175.81 1aje n PRO 29 N 1.14 1.87 0.00 1.99 -0.04 -1.26 -4.92 135.00 133.79 1aje n PRO 29 Ca -0.12 -1.89 0.00 0.00 -0.04 0.00 0.00 63.50 61.45 1aje n PRO 29 Cb 0.53 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 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 -0.26 0.00 -2.67 3.54 2.88 -1.26 -3.99 113.62 111.86 1aje n SER 30 Ca 0.37 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.67 1aje n SER 30 Cb 0.94 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.39 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 2.87 0.00 -1.46 1.02 -1.26 -5.05 120.64 116.76 1aje n GLU 31 Ca 0.00 -4.33 0.00 0.00 -0.02 0.00 0.00 57.16 52.81 1aje n GLU 31 Cb 0.00 -2.06 0.00 0.00 -0.02 0.00 0.00 31.44 29.36 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 0.00 0.33 -0.32 9.36 -1.26 -4.90 117.16 120.07 1aje n TYR 32 Ca 0.32 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.57 1aje n TYR 32 Cb 0.62 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.29 1aje n TYR 32 CO 0.00 0.00 0.00 1.55 0.22 0.00 0.00 176.86 178.63 1aje n VAL 33 N 1.08 0.00 -2.04 2.97 3.14 -1.26 -4.94 118.33 117.28 1aje n VAL 33 Ca 0.00 -0.35 -0.41 0.00 -2.96 0.00 0.00 64.34 60.62 1aje n VAL 33 Cb 0.00 1.01 -0.03 0.00 -1.06 0.00 0.00 33.84 33.76 1aje n VAL 33 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1aje s PRO 34 N -1.59 3.09 0.45 1.45 0.04 -1.26 -4.82 135.00 132.36 1aje s PRO 34 Ca 0.03 1.10 0.30 0.00 0.04 0.00 0.00 61.00 62.47 1aje s PRO 34 Cb 0.05 -4.25 1.24 0.00 0.04 0.00 0.00 34.50 31.58 1aje s PRO 34 CO 0.27 -2.16 1.89 1.79 0.04 0.00 0.00 177.00 178.84 1aje h THR 35 N 6.82 0.00 -0.86 1.26 1.35 -2.02 -3.34 112.91 116.12 1aje h THR 35 Ca -0.30 -0.42 -0.74 0.00 -0.55 0.00 0.00 66.41 64.40 1aje h THR 35 Cb 1.16 1.34 -0.10 0.00 -1.73 0.00 0.00 68.15 68.82 1aje h THR 35 CO 1.10 0.00 2.53 0.52 -0.25 0.00 0.00 175.52 179.42 1aje n VAL 36 N -2.81 4.21 -2.45 6.82 0.31 -1.26 -4.97 118.33 118.18 1aje n VAL 36 Ca 0.01 -3.86 -0.41 0.00 -0.01 0.00 0.00 64.34 60.06 1aje n VAL 36 Cb 0.28 -2.41 -0.04 0.00 -0.91 0.00 0.00 33.84 30.77 1aje n VAL 36 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1aje s PHE 37 N 1.11 3.50 0.13 3.52 5.36 -1.26 -5.03 117.98 125.31 1aje s PHE 37 Ca 0.46 1.47 -0.07 0.00 -0.96 0.00 0.00 56.93 57.83 1aje s PHE 37 Cb 0.13 -3.36 -0.01 0.00 -0.34 0.00 0.00 43.02 39.43 1aje s PHE 37 CO -0.04 -0.96 0.20 0.34 -1.46 0.00 0.00 175.22 173.30 1aje s ASP 38 N 0.23 0.14 -0.21 6.13 2.15 -1.26 -5.14 116.67 118.70 1aje s ASP 38 Ca 0.53 -0.88 -0.06 0.00 0.43 0.00 0.00 52.55 52.56 1aje s ASP 38 Cb -0.30 0.37 -0.03 0.00 -0.30 0.00 0.00 42.92 42.66 1aje s ASP 38 CO 0.34 -0.80 0.03 0.21 -0.17 0.00 0.00 175.17 174.78 1aje s ASN 39 N -2.95 5.04 0.36 -0.34 2.47 -1.26 -5.07 114.94 113.19 1aje s ASN 39 Ca 0.15 -0.16 -0.16 0.00 0.42 0.00 0.00 52.86 53.10 1aje s ASN 39 Cb 0.05 -1.88 0.06 0.00 -1.45 0.00 0.00 41.25 38.03 1aje s ASN 39 CO -0.03 0.05 0.84 -0.72 -3.72 0.00 0.00 177.10 173.52 1aje s TYR 40 N 1.11 0.14 -0.13 0.43 -0.85 -1.26 -5.03 117.35 111.76 1aje s TYR 40 Ca 0.03 -0.79 0.02 0.00 -0.52 0.00 0.00 57.07 55.81 1aje s TYR 40 Cb -0.14 0.83 0.00 0.00 0.38 0.00 0.00 41.96 43.03 1aje s TYR 40 CO 0.02 -1.49 -0.21 0.00 -1.52 0.00 0.00 175.55 172.35 1aje s ALA 41 N -2.12 2.30 0.74 9.51 0.00 -1.25 -2.60 121.76 128.34 1aje s ALA 41 Ca 0.17 -1.01 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 1aje s ALA 41 Cb -0.05 -0.98 0.14 0.00 0.00 0.00 0.00 23.12 22.23 1aje s ALA 41 CO 0.11 0.13 1.02 0.14 0.00 0.00 0.00 175.76 177.15 1aje s VAL 42 N 0.57 2.07 -0.13 0.00 -7.23 -0.95 -4.61 120.40 110.13 1aje s VAL 42 Ca -0.12 -0.60 0.01 0.00 -1.81 0.00 0.00 61.98 59.46 1aje s VAL 42 Cb -0.17 -2.47 0.02 0.00 0.56 0.00 0.00 36.38 34.32 1aje s VAL 42 CO 0.04 0.00 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.78 1aje s THR 43 N -3.18 1.61 0.53 5.32 2.01 -1.26 0.56 115.64 121.22 1aje s THR 43 Ca 0.67 -0.68 0.06 0.00 0.31 0.00 0.00 61.69 62.05 1aje s THR 43 Cb -0.05 -1.48 0.03 0.00 0.01 0.00 0.00 72.50 71.01 1aje s THR 43 CO 0.45 0.46 0.39 0.68 -0.69 0.00 0.00 174.62 175.91 1aje s VAL 44 N 1.20 1.77 -0.10 3.82 -7.23 -1.07 -4.88 120.40 113.92 1aje s VAL 44 Ca -0.01 -1.49 -0.01 0.00 -1.81 0.00 0.00 61.98 58.66 1aje s VAL 44 Cb -0.14 -2.27 0.03 0.00 0.56 0.00 0.00 36.38 34.56 1aje s VAL 44 CO -0.06 0.00 -0.03 -0.04 -0.31 0.00 0.00 175.10 174.66 1aje s MET 45 N -4.25 1.05 -0.08 4.82 -1.94 -1.26 -1.12 119.30 116.52 1aje s MET 45 Ca 0.36 -0.09 -0.14 0.00 -1.71 0.00 0.00 55.69 54.10 1aje s MET 45 Cb -0.02 -1.31 -0.11 0.00 2.01 0.00 0.00 34.83 35.40 1aje s MET 45 CO 0.22 -0.30 0.52 0.82 -0.01 0.00 0.00 175.02 176.27 1aje h ILE 46 N 6.27 0.59 0.00 2.53 5.03 -1.89 -3.43 117.51 126.61 1aje h ILE 46 Ca -0.24 -1.21 -0.15 0.00 -0.12 0.00 0.00 64.86 63.14 1aje h ILE 46 Cb 1.13 1.06 -0.25 0.00 -3.03 0.00 0.00 36.82 35.73 1aje h ILE 46 CO 0.33 0.18 -0.65 0.61 -0.68 0.00 0.00 178.15 177.94 1aje n GLY 47 N 1.14 0.76 0.00 5.37 0.00 -1.26 -4.91 105.19 106.28 1aje n GLY 47 Ca -0.05 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 0.24 1.40 3.02 -0.02 0.00 -1.26 -5.10 105.19 103.47 1aje n GLY 48 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1aje n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1aje s GLU 49 N 0.00 2.29 -0.08 1.61 2.02 -1.26 -4.93 118.70 118.35 1aje s GLU 49 Ca 0.00 -0.65 -0.30 0.00 0.02 0.00 0.00 54.97 54.04 1aje s GLU 49 Cb 0.00 -2.22 -0.03 0.00 0.10 0.00 0.00 34.13 31.98 1aje s GLU 49 CO 0.00 -0.28 1.26 -1.25 0.02 0.00 0.00 175.26 175.00 1aje s PRO 50 N 1.45 4.30 -0.27 0.39 0.04 -1.25 -2.74 135.00 136.91 1aje s PRO 50 Ca 0.03 1.72 0.02 0.00 0.04 0.00 0.00 61.00 62.81 1aje s PRO 50 Cb -0.14 -3.63 0.07 0.00 0.04 0.00 0.00 34.50 30.84 1aje s PRO 50 CO -0.10 -0.55 -0.02 0.71 0.04 0.00 0.00 177.00 177.07 1aje s TYR 51 N 2.68 2.72 0.71 0.56 2.02 -0.28 -1.49 117.35 124.27 1aje s TYR 51 Ca 0.57 -2.10 -0.13 0.00 -0.37 0.00 0.00 57.07 55.04 1aje s TYR 51 Cb -0.25 -1.93 0.03 0.00 -0.40 0.00 0.00 41.96 39.41 1aje s TYR 51 CO 0.20 -0.84 1.11 0.99 -1.57 0.00 0.00 175.55 175.45 1aje s THR 52 N 1.28 3.15 -0.23 -0.71 2.01 -1.25 -2.60 115.64 117.30 1aje s THR 52 Ca -0.01 0.47 0.01 0.00 0.31 0.00 0.00 61.69 62.48 1aje s THR 52 Cb -0.19 -2.97 0.05 0.00 0.01 0.00 0.00 72.50 69.41 1aje s THR 52 CO -0.09 -0.39 -0.08 -0.76 -0.69 0.00 0.00 174.62 172.61 1aje s LEU 53 N -5.31 2.63 -0.66 4.42 2.01 0.19 0.18 118.68 122.14 1aje s LEU 53 Ca 0.66 -1.13 -0.23 0.00 0.01 0.00 0.00 54.13 53.43 1aje s LEU 53 Cb -0.20 -1.26 0.06 0.00 0.01 0.00 0.00 46.19 44.81 1aje s LEU 53 CO 0.47 -0.20 1.00 -0.83 1.01 0.00 0.00 176.35 177.80 1aje s GLY 54 N 1.35 1.31 0.26 -3.19 0.00 0.14 -2.23 107.32 104.95 1aje s GLY 54 Ca -0.05 -1.76 -0.30 0.00 0.00 0.00 0.00 44.72 42.62 1aje s GLY 54 CO -0.07 2.14 1.14 -0.10 0.00 0.00 0.00 173.10 176.22 1aje n LEU 55 N 7.91 2.12 -3.52 0.66 -0.00 -1.07 -1.13 117.00 121.97 1aje n LEU 55 Ca -0.03 1.17 -0.11 0.00 -0.00 0.00 0.00 56.01 57.04 1aje n LEU 55 Cb 0.46 -1.31 -0.02 0.00 -0.00 0.00 0.00 43.42 42.54 1aje n LEU 55 CO 0.65 -1.13 0.39 0.12 -0.00 0.00 0.00 177.39 177.43 1aje s PHE 56 N -0.67 -0.45 0.00 1.96 5.36 0.13 -4.75 117.98 119.57 1aje s PHE 56 Ca 0.64 0.19 0.00 0.00 -0.96 0.00 0.00 56.93 56.79 1aje s PHE 56 Cb -0.72 0.56 0.00 0.00 -0.34 0.00 0.00 43.02 42.52 1aje s PHE 56 CO 0.56 -0.91 0.83 -3.47 -1.46 0.00 0.00 175.22 170.77 1aje n ASP 57 N -0.38 0.00 -3.85 6.13 -0.08 -1.26 -2.21 116.55 114.90 1aje n ASP 57 Ca -0.15 -1.66 -0.24 0.00 -1.51 0.00 0.00 54.79 51.23 1aje n ASP 57 Cb 0.64 -0.13 -0.08 0.00 2.34 0.00 0.00 41.12 43.89 1aje n ASP 57 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1aje s THR 58 N 0.00 0.37 -0.07 5.18 -4.23 -1.26 -4.92 115.64 110.71 1aje s THR 58 Ca 0.00 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.43 1aje s THR 58 Cb 0.00 -2.35 0.02 0.00 1.34 0.00 0.00 72.50 71.51 1aje s THR 58 CO 0.00 0.00 0.21 0.00 -0.54 0.00 0.00 174.62 174.29 1aje s ALA 59 N -3.26 -0.53 0.00 3.99 0.00 -1.26 -4.93 121.76 115.78 1aje s ALA 59 Ca 0.28 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.75 1aje s ALA 59 Cb 0.02 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.85 1aje s ALA 59 CO 0.19 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.23 1aje n GLY 60 N 2.72 -0.58 2.67 0.00 0.00 -1.26 -5.13 105.19 103.61 1aje n GLY 60 Ca -0.14 0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 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 1.12 0.19 1.61 0.74 -1.26 -5.01 119.66 117.05 1aje s GLN 61 Ca 0.00 -1.83 -0.14 0.00 0.05 0.00 0.00 55.36 53.45 1aje s GLN 61 Cb 0.00 -2.13 0.21 0.00 1.10 0.00 0.00 33.01 32.20 1aje s GLN 61 CO 0.00 -1.16 1.27 0.39 -0.55 0.00 0.00 175.29 175.24 1aje n GLU 62 N 3.71 -0.18 -2.18 1.67 1.02 -1.26 -4.71 120.64 118.70 1aje n GLU 62 Ca 0.09 1.27 -0.10 0.00 -0.02 0.00 0.00 57.16 58.39 1aje n GLU 62 Cb 0.35 -1.88 -0.01 0.00 -0.02 0.00 0.00 31.44 29.88 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 -5.22 -3.23 -0.33 1.62 -0.08 -1.26 -4.78 116.55 103.27 1aje n ASP 63 Ca 0.09 0.25 0.22 0.00 -1.51 0.00 0.00 54.79 53.83 1aje n ASP 63 Cb 0.34 -2.84 0.47 0.00 2.34 0.00 0.00 41.12 41.43 1aje n ASP 63 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1aje h TYR 64 N 0.00 0.76 0.00 -0.67 3.20 -2.03 -3.39 116.97 114.84 1aje h TYR 64 Ca -0.23 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.66 1aje h TYR 64 Cb 1.06 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.11 1aje h TYR 64 CO 0.63 0.05 0.00 -0.40 -1.64 0.00 0.00 178.16 176.81 1aje n ASP 65 N -4.71 0.00 -1.45 -2.11 5.75 -1.26 -5.12 116.55 107.66 1aje n ASP 65 Ca 0.26 0.00 0.08 0.00 -0.01 0.00 0.00 54.79 55.12 1aje n ASP 65 Cb 0.85 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.90 1aje n ASP 65 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1aje n ARG 66 N -0.46 -3.59 -0.09 0.11 5.12 -1.26 -4.37 116.66 112.12 1aje n ARG 66 Ca 0.00 2.86 -0.18 0.00 -1.93 0.00 0.00 57.85 58.60 1aje n ARG 66 Cb 0.00 -3.80 -0.06 0.00 -1.16 0.00 0.00 32.46 27.44 1aje n ARG 66 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1aje n LEU 67 N -3.39 1.31 0.12 0.55 4.32 -1.26 -4.81 117.00 113.84 1aje n LEU 67 Ca -0.05 0.19 -0.06 0.00 -0.02 0.00 0.00 56.01 56.08 1aje n LEU 67 Cb 0.56 -0.51 -0.03 0.00 -1.62 0.00 0.00 43.42 41.83 1aje n LEU 67 CO 0.02 0.38 0.17 0.03 -1.22 0.00 0.00 177.39 176.77 1aje h ARG 68 N -0.58 -0.36 -7.31 3.23 2.47 -2.08 -3.46 114.38 106.29 1aje h ARG 68 Ca -0.43 0.02 -0.51 0.00 -1.26 0.00 0.00 59.98 57.80 1aje h ARG 68 Cb 1.39 0.08 0.13 0.00 -1.65 0.00 0.00 29.97 29.92 1aje h ARG 68 CO -0.25 -0.24 0.32 -1.25 0.56 0.00 0.00 179.97 179.11 1aje s PRO 69 N -2.77 2.27 -0.15 0.04 0.04 -1.26 -4.93 135.00 128.24 1aje s PRO 69 Ca -0.05 1.18 0.07 0.00 0.04 0.00 0.00 61.00 62.23 1aje s PRO 69 Cb 0.01 -1.90 0.44 0.00 0.04 0.00 0.00 34.50 33.08 1aje s PRO 69 CO 0.16 -1.63 1.23 1.28 0.04 0.00 0.00 177.00 178.08 1aje n LEU 70 N -3.48 3.79 0.00 -3.56 4.77 -1.26 -4.80 117.00 112.46 1aje n LEU 70 Ca 0.09 -1.93 0.00 0.00 -0.03 0.00 0.00 56.01 54.14 1aje n LEU 70 Cb 0.53 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1aje n LEU 70 CO 0.53 0.50 0.00 -1.54 -1.33 0.00 0.00 177.39 175.55 1aje n SER 71 N 0.24 -0.47 -0.01 -1.43 3.41 -1.26 -4.86 113.62 109.23 1aje n SER 71 Ca 0.18 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.66 1aje n SER 71 Cb 0.82 -0.85 -0.10 0.00 -0.26 0.00 0.00 64.21 63.82 1aje n SER 71 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1aje h TYR 72 N 0.00 -0.00 -2.09 7.33 -1.99 -1.96 -3.45 116.97 114.81 1aje h TYR 72 Ca 0.00 -0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.64 1aje h TYR 72 Cb 0.04 0.00 0.04 0.00 2.00 0.00 0.00 36.73 38.81 1aje h TYR 72 CO 0.02 0.48 0.05 -0.35 -0.00 0.00 0.00 178.16 178.37 1aje n PRO 73 N -4.86 -0.98 -2.84 4.88 -0.04 -1.26 -4.74 135.00 125.16 1aje n PRO 73 Ca -0.08 -0.39 -0.03 0.00 -0.04 0.00 0.00 63.50 62.96 1aje n PRO 73 Cb 0.25 -0.32 0.00 0.00 -0.04 0.00 0.00 33.50 33.39 1aje n PRO 73 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1aje n GLN 74 N -1.96 -1.55 -0.11 0.54 1.13 -1.22 -4.99 117.38 109.22 1aje n GLN 74 Ca 0.03 1.62 -0.12 0.00 -1.94 0.00 0.00 57.00 56.59 1aje n GLN 74 Cb 0.12 -5.34 -0.14 0.00 0.11 0.00 0.00 30.24 24.99 1aje n GLN 74 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1aje n THR 75 N -1.19 1.38 -2.86 5.09 -2.24 -1.26 -4.93 114.28 108.27 1aje n THR 75 Ca 0.04 -0.76 -0.11 0.00 -2.27 0.00 0.00 64.05 60.95 1aje n THR 75 Cb 0.47 -0.73 0.06 0.00 -2.10 0.00 0.00 70.33 68.02 1aje n THR 75 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1aje n ASP 76 N -2.87 -4.64 -3.16 3.42 2.03 0.74 -4.92 116.55 107.14 1aje n ASP 76 Ca -0.36 -0.51 -0.23 0.00 0.52 0.00 0.00 54.79 54.21 1aje n ASP 76 Cb 1.10 -3.99 0.22 0.00 -0.72 0.00 0.00 41.12 37.73 1aje n ASP 76 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1aje n VAL 77 N -2.91 0.00 -3.75 5.18 0.31 0.42 -4.45 118.33 113.12 1aje n VAL 77 Ca -0.09 -0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 63.95 1aje n VAL 77 Cb 0.60 -0.74 -0.16 0.00 -0.91 0.00 0.00 33.84 32.62 1aje n VAL 77 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1aje s PHE 78 N -1.83 1.30 -0.69 3.52 0.40 -0.91 0.52 117.98 120.28 1aje s PHE 78 Ca 0.51 -1.16 -0.19 0.00 -0.60 0.00 0.00 56.93 55.49 1aje s PHE 78 Cb -0.09 -1.24 0.12 0.00 0.51 0.00 0.00 43.02 42.33 1aje s PHE 78 CO 0.42 -0.70 0.81 -0.51 0.70 0.00 0.00 175.22 175.95 1aje s LEU 79 N 1.76 5.43 -0.39 -0.37 1.43 -0.38 -1.12 118.68 125.04 1aje s LEU 79 Ca 0.01 -1.68 -0.27 0.00 -1.03 0.00 0.00 54.13 51.17 1aje s LEU 79 Cb -0.17 -2.32 0.02 0.00 0.03 0.00 0.00 46.19 43.75 1aje s LEU 79 CO -0.13 -1.06 0.97 -0.69 0.23 0.00 0.00 176.35 175.67 1aje s VAL 80 N 2.47 4.51 -0.64 -1.59 1.01 -0.01 -1.17 120.40 124.97 1aje s VAL 80 Ca 0.17 1.19 -0.22 0.00 0.00 0.00 0.00 61.98 63.12 1aje s VAL 80 Cb -0.18 -4.40 0.08 0.00 0.00 0.00 0.00 36.38 31.88 1aje s VAL 80 CO 0.02 -0.64 0.90 0.00 0.00 0.00 0.00 175.10 175.37 1aje n PHE 82 N 7.36 0.00 -1.86 0.00 1.16 0.22 -3.97 117.46 120.38 1aje n PHE 82 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.53 1aje n PHE 82 Cb 0.45 -0.30 0.00 0.00 -1.61 0.00 0.00 39.48 38.01 1aje n PHE 82 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 1aje n SER 83 N -1.26 -8.40 -0.34 5.98 3.41 -1.12 -0.13 113.62 111.76 1aje n SER 83 Ca 0.12 1.33 0.04 0.00 -0.26 0.00 0.00 58.87 60.10 1aje n SER 83 Cb 0.28 -4.80 0.04 0.00 -0.26 0.00 0.00 64.21 59.47 1aje n SER 83 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1aje n VAL 84 N 0.38 0.06 -0.72 -3.33 0.31 -1.26 -4.06 118.33 109.71 1aje n VAL 84 Ca 0.00 -0.53 0.09 0.00 -0.01 0.00 0.00 64.34 63.88 1aje n VAL 84 Cb 0.00 1.13 0.37 0.00 -0.91 0.00 0.00 33.84 34.43 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 0.45 2.13 -4.07 2.52 0.24 -1.26 -2.88 118.33 115.46 1aje n VAL 85 Ca 0.05 -1.29 -0.10 0.00 -2.04 0.00 0.00 64.34 60.96 1aje n VAL 85 Cb 0.22 -0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.50 1aje n VAL 85 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1aje s SER 86 N -0.92 0.17 -0.52 -1.34 1.04 -1.26 -4.64 113.70 106.23 1aje s SER 86 Ca 0.52 -1.07 -0.29 0.00 0.48 0.00 0.00 55.95 55.59 1aje s SER 86 Cb 0.36 0.37 0.03 0.00 0.10 0.00 0.00 66.02 66.88 1aje s SER 86 CO 0.21 -0.82 1.22 -2.16 0.98 0.00 0.00 173.24 172.67 1aje s PRO 87 N -4.02 3.58 -0.97 4.02 0.04 -0.66 -3.97 135.00 133.01 1aje s PRO 87 Ca 0.22 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.72 1aje s PRO 87 Cb 0.05 -3.98 0.00 0.00 0.04 0.00 0.00 34.50 30.61 1aje s PRO 87 CO 0.02 -1.58 0.00 0.45 0.04 0.00 0.00 177.00 175.93 1aje n SER 88 N 8.36 -3.08 -0.32 6.66 2.88 -1.26 -4.74 113.62 122.12 1aje n SER 88 Ca 0.11 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.88 1aje n SER 88 Cb 0.49 -2.74 0.18 0.00 -0.75 0.00 0.00 64.21 61.38 1aje n SER 88 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1aje h SER 89 N 0.00 1.02 0.00 -3.46 0.87 -1.81 0.16 113.55 110.32 1aje h SER 89 Ca -0.19 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1aje h SER 89 Cb 0.71 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.42 1aje h SER 89 CO 0.28 0.72 0.22 2.19 -0.53 0.00 0.00 176.83 179.70 1aje h PHE 90 N 1.19 0.00 0.13 2.24 -0.00 -0.67 -2.04 116.94 117.80 1aje h PHE 90 Ca 0.35 0.00 -0.34 0.00 -0.00 0.00 0.00 57.97 57.98 1aje h PHE 90 Cb -0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 35.87 1aje h PHE 90 CO -0.00 0.00 -1.79 1.49 -0.00 0.00 0.00 178.31 178.01 1aje h GLU 91 N 0.00 0.28 -0.04 6.09 4.57 -0.94 -3.28 114.58 121.26 1aje h GLU 91 Ca 0.00 -0.48 0.01 0.00 -1.18 0.00 0.00 59.36 57.71 1aje h GLU 91 Cb 0.43 0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.20 1aje h GLU 91 CO 0.00 1.23 0.09 -2.95 -1.18 0.00 0.00 179.01 176.20 1aje h ASN 92 N -0.05 0.00 -0.02 1.04 7.08 -1.36 1.39 115.58 123.66 1aje h ASN 92 Ca -0.38 0.00 0.01 0.00 -3.08 0.00 0.00 56.30 52.85 1aje h ASN 92 Cb 1.96 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 38.20 1aje h ASN 92 CO 0.09 0.00 0.02 0.58 -2.08 0.00 0.00 177.43 176.04 1aje h VAL 93 N 0.00 0.66 0.04 6.14 2.07 -1.59 -2.36 116.25 121.21 1aje h VAL 93 Ca 0.02 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 1aje h VAL 93 Cb 0.21 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1aje h VAL 93 CO -0.00 0.00 -0.02 0.11 0.02 0.00 0.00 177.57 177.68 1aje h LYS 94 N 0.00 -0.05 -0.98 1.57 1.79 0.17 -1.61 116.57 117.47 1aje h LYS 94 Ca 0.01 0.00 0.23 0.00 -2.18 0.00 0.00 60.65 58.72 1aje h LYS 94 Cb 0.05 0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 30.63 1aje h LYS 94 CO -0.00 0.40 0.64 0.93 -1.08 0.00 0.00 179.45 180.34 1aje h GLU 95 N -0.98 0.40 0.00 3.15 4.39 -1.24 -3.11 114.58 117.19 1aje h GLU 95 Ca -0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1aje h GLU 95 Cb 0.46 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1aje h GLU 95 CO 0.01 0.27 -0.66 1.63 -1.16 0.00 0.00 179.01 179.09 1aje n LYS 96 N -4.56 2.51 0.05 2.33 5.02 -0.93 -4.63 118.16 117.94 1aje n LYS 96 Ca 0.22 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.31 1aje n LYS 96 Cb 0.79 -0.83 -0.11 0.00 -0.02 0.00 0.00 35.03 34.86 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 1.02 -0.53 2.13 4.06 -1.41 -2.39 115.95 118.84 1aje h TRP 97 Ca 0.00 -0.57 -0.10 0.00 2.06 0.00 0.00 58.89 60.28 1aje h TRP 97 Cb 0.51 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 28.54 1aje h TRP 97 CO 0.00 1.41 -0.05 0.28 -3.56 0.00 0.00 178.44 176.52 1aje h VAL 98 N 0.37 1.27 0.00 1.49 2.07 -1.40 0.12 116.25 120.17 1aje h VAL 98 Ca -0.14 -1.17 0.00 0.00 0.82 0.00 0.00 66.70 66.21 1aje h VAL 98 Cb 1.73 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 1aje h VAL 98 CO 0.21 0.41 0.00 1.55 0.02 0.00 0.00 177.57 179.76 1aje h PRO 99 N 0.83 0.00 0.00 1.57 0.13 -1.72 0.18 132.00 132.99 1aje h PRO 99 Ca 0.14 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 65.04 1aje h PRO 99 Cb 0.59 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.68 1aje h PRO 99 CO 0.04 0.00 -1.91 0.39 -0.23 0.00 0.00 178.00 176.29 1aje n GLU 100 N -2.41 0.65 -0.10 0.86 -0.58 -0.29 -3.87 120.64 114.90 1aje n GLU 100 Ca -0.00 0.08 -0.19 0.00 -0.42 0.00 0.00 57.16 56.63 1aje n GLU 100 Cb 0.14 -1.66 -0.08 0.00 -0.57 0.00 0.00 31.44 29.28 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 -2.77 1.10 -0.09 -3.67 -5.35 0.26 -4.27 119.36 104.58 1aje n ILE 101 Ca -0.19 -0.32 -0.22 0.00 -0.27 0.00 0.00 62.75 61.75 1aje n ILE 101 Cb 0.95 -1.59 -0.12 0.00 -1.74 0.00 0.00 39.64 37.14 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 -3.65 1.58 0.20 7.28 -2.24 0.52 0.28 114.28 118.25 1aje n THR 102 Ca -0.38 -0.14 0.18 0.00 -2.27 0.00 0.00 64.05 61.44 1aje n THR 102 Cb 0.80 -1.99 0.82 0.00 -2.10 0.00 0.00 70.33 67.87 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 -0.82 0.00 0.00 4.78 3.86 -1.46 0.12 115.15 121.63 1aje h HIS 103 Ca -0.37 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.84 1aje h HIS 103 Cb 1.44 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.91 1aje h HIS 103 CO 0.09 0.00 -0.84 0.72 0.86 0.00 0.00 177.93 178.76 1aje n HIS 104 N -3.57 0.11 -3.49 2.45 -0.00 -1.23 -4.77 115.22 104.71 1aje n HIS 104 Ca 0.03 0.05 -0.29 0.00 -0.00 0.00 0.00 57.72 57.50 1aje n HIS 104 Cb 0.42 -0.48 -0.08 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 1.18 3.50 -0.01 0.00 -0.04 0.01 -4.22 135.00 135.43 1aje n PRO 106 Ca 0.27 -2.25 -0.21 0.00 -0.04 0.00 0.00 63.50 61.28 1aje n PRO 106 Cb 0.39 -2.58 -0.14 0.00 -0.04 0.00 0.00 33.50 31.14 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 4.42 0.20 0.00 0.54 6.56 -1.87 -3.49 116.57 122.93 1aje h LYS 107 Ca 0.69 -0.34 0.00 0.00 -1.06 0.00 0.00 60.65 59.93 1aje h LYS 107 Cb 0.54 0.13 0.00 0.00 -0.57 0.00 0.00 32.23 32.33 1aje h LYS 107 CO 1.38 1.16 0.00 2.41 -2.06 0.00 0.00 179.45 182.35 1aje n THR 108 N -4.08 0.00 -1.55 -0.16 -1.04 -1.26 -5.09 114.28 101.11 1aje n THR 108 Ca -0.22 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.50 1aje n THR 108 Cb 0.82 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 69.27 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 0.73 -3.59 -2.82 -0.04 -1.26 -4.43 135.00 123.60 1aje n PRO 109 Ca 0.00 -0.27 -0.29 0.00 -0.04 0.00 0.00 63.50 62.90 1aje n PRO 109 Cb 0.00 -3.21 -0.13 0.00 -0.04 0.00 0.00 33.50 30.12 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 12.10 1.15 -0.37 0.54 2.19 -1.26 -2.15 117.98 130.17 1aje s PHE 110 Ca 1.02 -1.70 -0.11 0.00 0.33 0.00 0.00 56.93 56.48 1aje s PHE 110 Cb -0.30 -1.31 0.03 0.00 -1.31 0.00 0.00 43.02 40.13 1aje s PHE 110 CO 0.24 -0.83 0.20 -0.51 1.83 0.00 0.00 175.22 176.16 1aje s LEU 111 N 1.20 4.71 -0.64 6.12 1.43 -0.28 0.38 118.68 131.60 1aje s LEU 111 Ca 0.15 -1.02 -0.18 0.00 -1.03 0.00 0.00 54.13 52.05 1aje s LEU 111 Cb -0.21 -2.01 0.13 0.00 0.03 0.00 0.00 46.19 44.13 1aje s LEU 111 CO -0.12 -0.39 0.71 -0.22 0.23 0.00 0.00 176.35 176.57 1aje s LEU 112 N 1.54 5.70 0.21 1.79 2.96 -0.01 -0.83 118.68 130.03 1aje s LEU 112 Ca 0.02 -1.72 0.05 0.00 -0.22 0.00 0.00 54.13 52.26 1aje s LEU 112 Cb -0.19 -2.28 -0.05 0.00 0.50 0.00 0.00 46.19 44.17 1aje s LEU 112 CO 0.06 -0.99 -0.06 0.68 -1.32 0.00 0.00 176.35 174.72 1aje s VAL 113 N 2.15 1.25 0.00 1.68 -7.23 -0.66 -2.35 120.40 115.25 1aje s VAL 113 Ca 0.12 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.21 1aje s VAL 113 Cb -0.22 -2.16 0.00 0.00 0.56 0.00 0.00 36.38 34.56 1aje s VAL 113 CO 0.02 -0.49 0.00 0.61 -0.31 0.00 0.00 175.10 174.93 1aje n GLY 114 N -0.36 -2.99 0.00 2.32 0.00 -0.98 0.73 105.19 103.91 1aje n GLY 114 Ca -0.07 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1aje n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1aje n THR 115 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -2.79 114.28 110.60 1aje n THR 115 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1aje n THR 115 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 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 -0.89 0.93 0.00 -0.78 3.00 -1.21 -4.02 117.38 114.41 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 0.12 5.09 5.41 -1.26 -2.61 119.36 126.11 1aje n ILE 117 Ca 0.00 0.00 -0.24 0.00 1.00 0.00 0.00 62.75 63.51 1aje n ILE 117 Cb 0.00 0.00 -0.16 0.00 -0.71 0.00 0.00 39.64 38.77 1aje n ILE 117 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1aje h ASP 118 N 0.00 0.78 0.00 4.38 3.58 -1.94 -3.37 116.42 119.85 1aje h ASP 118 Ca 0.00 -0.93 0.00 0.00 0.42 0.00 0.00 57.03 56.52 1aje h ASP 118 Cb 0.00 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 40.80 1aje h ASP 118 CO 0.00 1.74 -0.37 0.18 -2.88 0.00 0.00 179.24 177.92 1aje n LEU 119 N -3.68 1.10 0.08 2.28 7.99 -1.26 -4.58 117.00 118.93 1aje n LEU 119 Ca -0.20 0.00 0.21 0.00 -0.01 0.00 0.00 56.01 56.01 1aje n LEU 119 Cb 1.10 0.00 0.73 0.00 -0.11 0.00 0.00 43.42 45.13 1aje n LEU 119 CO 0.58 0.18 1.18 0.03 -1.51 0.00 0.00 177.39 177.85 1aje h ARG 120 N 0.00 0.00 0.00 3.23 -0.00 -1.95 2.64 114.38 118.31 1aje h ARG 120 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1aje h ARG 120 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.34 1aje h ARG 120 CO 0.00 0.00 -0.18 -0.40 0.00 0.00 0.00 179.97 179.39 1aje n ASP 121 N -3.66 0.57 -2.66 7.04 5.75 -1.26 -3.80 116.55 118.52 1aje n ASP 121 Ca 0.08 0.38 -0.09 0.00 -0.01 0.00 0.00 54.79 55.16 1aje n ASP 121 Cb 0.68 -0.43 0.06 0.00 -1.03 0.00 0.00 41.12 40.40 1aje n ASP 121 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1aje n ASP 122 N -1.98 0.16 0.12 -1.12 5.75 0.89 -4.88 116.55 115.48 1aje n ASP 122 Ca 0.05 -1.22 0.09 0.00 -0.01 0.00 0.00 54.79 53.70 1aje n ASP 122 Cb 0.40 -0.28 0.44 0.00 -1.03 0.00 0.00 41.12 40.65 1aje n ASP 122 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 1aje n PRO 123 N -1.78 0.11 -0.30 0.11 -0.04 -1.26 -2.96 135.00 128.88 1aje n PRO 123 Ca 0.05 0.56 0.13 0.00 -0.04 0.00 0.00 63.50 64.20 1aje n PRO 123 Cb 0.18 -1.83 0.38 0.00 -0.04 0.00 0.00 33.50 32.19 1aje n PRO 123 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1aje h SER 124 N 0.00 0.67 0.23 3.54 0.87 -1.85 0.04 113.55 117.05 1aje h SER 124 Ca 0.00 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1aje h SER 124 Cb 0.07 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1aje h SER 124 CO 0.00 0.30 -0.17 1.07 -0.53 0.00 0.00 176.83 177.50 1aje n THR 125 N -4.61 0.00 -0.03 2.23 5.66 -1.16 -4.09 114.28 112.28 1aje n THR 125 Ca 0.20 -0.12 -0.15 0.00 -3.05 0.00 0.00 64.05 60.93 1aje n THR 125 Cb 0.54 0.24 -0.11 0.00 -1.55 0.00 0.00 70.33 69.45 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 1.14 1.54 -0.11 1.09 1.08 -1.17 -2.95 117.51 118.13 1aje h ILE 126 Ca 0.00 -1.86 0.03 0.00 -0.39 0.00 0.00 64.86 62.64 1aje h ILE 126 Cb 0.45 2.70 -0.00 0.00 -3.07 0.00 0.00 36.82 36.89 1aje h ILE 126 CO 0.00 0.51 0.20 -0.08 -0.69 0.00 0.00 178.15 178.09 1aje h GLU 127 N -0.50 0.00 -0.03 2.37 4.57 -1.70 2.01 114.58 121.30 1aje h GLU 127 Ca -0.02 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1aje h GLU 127 Cb 0.94 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.53 1aje h GLU 127 CO 0.04 0.00 -0.03 0.87 -1.18 0.00 0.00 179.01 178.71 1aje h LYS 128 N 0.00 0.08 0.00 1.92 6.56 -1.70 -3.39 116.57 120.03 1aje h LYS 128 Ca 0.05 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 1aje h LYS 128 Cb 0.45 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.11 1aje h LYS 128 CO -0.00 0.53 0.00 1.28 -2.06 0.00 0.00 179.45 179.20 1aje n LEU 129 N -4.80 0.60 0.30 2.94 4.32 -0.77 -4.80 117.00 114.78 1aje n LEU 129 Ca -0.08 -0.60 0.02 0.00 -0.02 0.00 0.00 56.01 55.33 1aje n LEU 129 Cb 0.27 0.00 0.09 0.00 -1.62 0.00 0.00 43.42 42.15 1aje n LEU 129 CO 0.35 0.15 0.96 0.00 -1.22 0.00 0.00 177.39 177.63 1aje h ALA 130 N 0.00 1.83 0.00 -1.18 0.00 0.30 3.02 119.26 123.23 1aje h ALA 130 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aje h ALA 130 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1aje h ALA 130 CO 0.00 -0.83 0.00 0.87 0.00 0.00 0.00 179.25 179.29 1aje h LYS 131 N 0.00 0.00 -0.36 0.00 6.56 -1.87 0.42 116.57 121.31 1aje h LYS 131 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1aje h LYS 131 Cb 1.75 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.41 1aje h LYS 131 CO 0.00 0.00 0.00 0.09 -2.06 0.00 0.00 179.45 177.48 1aje n ASN 132 N -2.63 3.73 -2.86 0.86 3.02 1.01 -4.92 115.26 113.47 1aje n ASN 132 Ca -0.00 -2.54 -0.22 0.00 -0.03 0.00 0.00 54.58 51.78 1aje n ASN 132 Cb 0.16 -0.44 0.02 0.00 -0.61 0.00 0.00 39.78 38.91 1aje n ASN 132 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1aje n LYS 133 N 0.17 -4.06 0.00 3.52 2.85 0.15 -4.78 118.16 116.00 1aje n LYS 133 Ca 0.19 0.94 0.00 0.00 -1.05 0.00 0.00 58.31 58.38 1aje n LYS 133 Cb 0.73 -5.75 0.00 0.00 -0.65 0.00 0.00 35.03 29.36 1aje n LYS 133 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1aje n GLN 134 N -3.77 0.00 -1.72 -1.58 -0.00 -1.23 -4.83 117.38 104.25 1aje n GLN 134 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.85 1aje n GLN 134 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.88 1aje n GLN 134 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1aje n LYS 135 N 0.00 -2.41 -1.35 2.61 4.76 -1.26 -1.66 118.16 118.85 1aje n LYS 135 Ca 0.00 1.73 -0.31 0.00 -2.87 0.00 0.00 58.31 56.86 1aje n LYS 135 Cb 0.00 -2.17 0.08 0.00 -1.84 0.00 0.00 35.03 31.10 1aje n LYS 135 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1aje s PRO 136 N -1.09 2.44 -0.15 1.97 0.04 -1.26 -3.90 135.00 133.07 1aje s PRO 136 Ca 0.00 1.12 -0.33 0.00 0.04 0.00 0.00 61.00 61.82 1aje s PRO 136 Cb 0.00 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.51 1aje s PRO 136 CO 0.00 -1.50 1.99 -0.89 0.04 0.00 0.00 177.00 176.64 1aje n ILE 137 N -3.40 0.50 -2.11 0.56 -0.00 -1.14 -4.94 119.36 108.83 1aje n ILE 137 Ca 0.09 -0.18 -0.24 0.00 -0.00 0.00 0.00 62.75 62.42 1aje n ILE 137 Cb 0.53 -1.96 0.15 0.00 -0.00 0.00 0.00 39.64 38.37 1aje n ILE 137 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.55 176.96 1aje n THR 138 N 5.87 0.00 0.54 1.39 -1.04 -1.26 -4.82 114.28 114.96 1aje n THR 138 Ca 0.27 -1.07 0.12 0.00 -2.04 0.00 0.00 64.05 61.32 1aje n THR 138 Cb 0.31 -1.32 0.45 0.00 -1.82 0.00 0.00 70.33 67.95 1aje n THR 138 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1aje n PRO 139 N -3.13 0.15 0.00 -2.82 -0.04 -1.26 -2.35 135.00 125.55 1aje n PRO 139 Ca 0.15 0.29 0.11 0.00 -0.04 0.00 0.00 63.50 64.01 1aje n PRO 139 Cb 0.51 -1.75 0.04 0.00 -0.04 0.00 0.00 33.50 32.27 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 -2.03 1.69 -0.02 0.54 1.02 -1.26 -4.28 120.64 116.30 1aje n GLU 140 Ca 0.04 -1.37 -0.02 0.00 -0.02 0.00 0.00 57.16 55.79 1aje n GLU 140 Cb 0.28 -1.44 -0.01 0.00 -0.02 0.00 0.00 31.44 30.25 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 0.56 0.32 0.19 2.62 -1.04 -0.99 -4.11 114.28 111.83 1aje n THR 141 Ca 0.11 0.42 -0.12 0.00 -2.04 0.00 0.00 64.05 62.42 1aje n THR 141 Cb 0.51 -1.68 -0.06 0.00 -1.82 0.00 0.00 70.33 67.27 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 -1.78 -1.01 -0.97 2.41 0.00 -1.80 -1.01 119.26 115.10 1aje h ALA 142 Ca 0.00 -0.12 0.27 0.00 0.00 0.00 0.00 54.91 55.05 1aje h ALA 142 Cb 0.20 0.57 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1aje h ALA 142 CO 0.00 -1.03 0.68 0.93 0.00 0.00 0.00 179.25 179.82 1aje h GLU 143 N -0.66 0.11 -0.83 0.00 4.39 -1.81 0.49 114.58 116.28 1aje h GLU 143 Ca -0.04 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.72 1aje h GLU 143 Cb 0.57 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 29.13 1aje h GLU 143 CO -0.04 0.07 0.50 -0.22 -1.16 0.00 0.00 179.01 178.16 1aje h LYS 144 N 0.11 0.88 0.01 2.33 3.64 -1.34 -2.33 116.57 119.87 1aje h LYS 144 Ca 0.48 -0.05 -0.32 0.00 -1.27 0.00 0.00 60.65 59.48 1aje h LYS 144 Cb 1.70 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 33.26 1aje h LYS 144 CO -0.07 0.58 -1.95 1.47 -2.27 0.00 0.00 179.45 177.22 1aje n LEU 145 N -4.66 0.80 0.29 5.20 -0.00 0.15 -3.59 117.00 115.18 1aje n LEU 145 Ca 0.12 0.27 0.18 0.00 -0.00 0.00 0.00 56.01 56.58 1aje n LEU 145 Cb 0.19 0.15 0.97 0.00 -0.00 0.00 0.00 43.42 44.74 1aje n LEU 145 CO 0.30 0.47 1.15 0.00 -0.00 0.00 0.00 177.39 179.31 1aje h ALA 146 N 0.91 1.42 0.00 1.47 0.00 -0.79 3.02 119.26 125.29 1aje h ALA 146 Ca -0.38 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.39 1aje h ALA 146 Cb 2.08 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.85 1aje h ALA 146 CO 0.06 -0.15 -0.68 -0.09 0.00 0.00 0.00 179.25 178.39 1aje h ARG 147 N 0.00 0.00 0.00 0.00 9.65 -1.51 1.43 114.38 123.95 1aje h ARG 147 Ca 0.03 0.00 -0.13 0.00 -1.10 0.00 0.00 59.98 58.77 1aje h ARG 147 Cb 0.27 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.83 1aje h ARG 147 CO -0.00 0.68 -0.64 0.22 2.80 0.00 0.00 179.97 183.03 1aje h ASP 148 N 0.00 0.00 0.00 -3.80 3.58 0.53 -3.34 116.42 113.39 1aje h ASP 148 Ca -0.01 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.23 1aje h ASP 148 Cb 1.22 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.23 1aje h ASP 148 CO 0.09 0.64 -1.80 0.18 -2.88 0.00 0.00 179.24 175.46 1aje n LEU 149 N -3.61 1.01 -3.08 2.28 4.77 -0.16 -5.01 117.00 113.19 1aje n LEU 149 Ca -0.00 -0.03 -0.15 0.00 -0.03 0.00 0.00 56.01 55.80 1aje n LEU 149 Cb 0.67 0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.85 1aje n LEU 149 CO 0.42 0.44 0.10 0.29 -1.33 0.00 0.00 177.39 177.31 1aje n LYS 150 N -2.59 -5.72 0.00 3.23 4.01 0.49 -4.98 118.16 112.59 1aje n LYS 150 Ca -0.21 0.73 0.00 0.00 -0.51 0.00 0.00 58.31 58.32 1aje n LYS 150 Cb 0.84 -5.38 0.00 0.00 -0.51 0.00 0.00 35.03 29.98 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 -3.72 0.00 -0.01 7.82 0.00 -1.25 -4.93 120.51 118.43 1aje n ALA 151 Ca -0.24 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 52.99 1aje n ALA 151 Cb 0.64 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.96 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 -0.85 0.70 -1.83 0.00 2.07 0.67 -3.46 116.25 113.55 1aje h VAL 152 Ca 0.00 -2.32 0.00 0.00 0.82 0.00 0.00 66.70 65.20 1aje h VAL 152 Cb 0.00 2.48 -0.23 0.00 -1.52 0.00 0.00 31.29 32.02 1aje h VAL 152 CO 0.00 0.79 0.28 -0.75 0.02 0.00 0.00 177.57 177.92 1aje s LYS 153 N -2.52 0.74 -0.12 1.57 2.36 -1.08 -5.00 119.74 115.69 1aje s LYS 153 Ca -0.23 0.68 0.00 0.00 -2.55 0.00 0.00 55.97 53.87 1aje s LYS 153 Cb 0.06 0.36 -0.02 0.00 -1.05 0.00 0.00 37.83 37.18 1aje s LYS 153 CO 0.74 -0.13 -0.13 -0.47 1.55 0.00 0.00 175.35 176.92 1aje s TYR 154 N -0.05 2.80 0.10 4.03 6.14 -1.25 -0.83 117.35 128.29 1aje s TYR 154 Ca -0.01 -0.53 -0.02 0.00 0.64 0.00 0.00 57.07 57.15 1aje s TYR 154 Cb -0.04 -1.81 0.01 0.00 0.42 0.00 0.00 41.96 40.54 1aje s TYR 154 CO 0.00 -0.12 0.17 1.33 0.64 0.00 0.00 175.55 177.57 1aje n VAL 155 N 3.28 0.00 -3.83 3.14 0.24 -0.99 -4.98 118.33 115.20 1aje n VAL 155 Ca -0.18 -0.38 -0.12 0.00 -2.04 0.00 0.00 64.34 61.62 1aje n VAL 155 Cb 0.53 0.28 -0.09 0.00 -1.47 0.00 0.00 33.84 33.09 1aje n VAL 155 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1aje s GLU 156 N -2.13 0.58 0.00 7.34 -1.05 -1.26 -2.32 118.70 119.87 1aje s GLU 156 Ca 0.06 -0.36 0.00 0.00 -0.15 0.00 0.00 54.97 54.52 1aje s GLU 156 Cb -0.01 0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.93 1aje s GLU 156 CO 0.04 -0.15 0.00 0.00 0.95 0.00 0.00 175.26 176.10 1aje n SER 158 N 0.00 1.50 -0.23 0.00 7.64 -1.07 -4.58 113.62 116.88 1aje n SER 158 Ca 0.00 1.16 0.10 0.00 1.01 0.00 0.00 58.87 61.14 1aje n SER 158 Cb 0.00 -1.33 0.20 0.00 -1.01 0.00 0.00 64.21 62.07 1aje n SER 158 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aje n ALA 159 N 0.12 0.34 -0.02 -0.43 0.00 -1.26 -0.17 120.51 119.10 1aje n ALA 159 Ca 0.09 0.72 0.02 0.00 0.00 0.00 0.00 53.44 54.27 1aje n ALA 159 Cb 0.34 -0.53 -0.13 0.00 0.00 0.00 0.00 19.45 19.13 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 -4.89 0.29 0.08 0.00 -0.00 -1.26 -4.55 117.00 106.67 1aje n LEU 160 Ca 0.16 0.12 -0.10 0.00 -0.00 0.00 0.00 56.01 56.19 1aje n LEU 160 Cb 0.52 0.16 -0.06 0.00 -0.00 0.00 0.00 43.42 44.03 1aje n LEU 160 CO -0.05 0.16 0.51 0.74 -0.00 0.00 0.00 177.39 178.75 1aje h THR 161 N 0.00 0.00 -1.93 1.47 2.02 -0.87 -3.47 112.91 110.13 1aje h THR 161 Ca -0.20 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 1aje h THR 161 Cb 1.50 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1aje h THR 161 CO 0.02 0.00 -0.06 0.00 0.37 0.00 0.00 175.52 175.85 1aje n GLN 162 N -4.34 -0.54 0.00 6.66 3.00 -1.18 -4.95 117.38 116.03 1aje n GLN 162 Ca -0.05 0.06 0.12 0.00 -0.01 0.00 0.00 57.00 57.12 1aje n GLN 162 Cb 0.26 -2.75 0.22 0.00 0.00 0.00 0.00 30.24 27.97 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 -1.09 0.07 0.00 -1.09 2.85 -1.26 -4.46 118.16 113.19 1aje n LYS 163 Ca -0.01 -0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 1aje n LYS 163 Cb 0.51 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.39 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 0.98 0.17 2.58 0.00 -1.25 -4.92 105.19 104.23 1aje n GLY 164 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.99 1aje n GLY 164 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1aje h LEU 165 N 0.00 0.46 -1.52 0.99 5.85 -1.83 1.41 115.31 120.66 1aje h LEU 165 Ca 0.00 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1aje h LEU 165 Cb 0.56 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1aje h LEU 165 CO 0.00 0.47 0.00 0.11 -0.34 0.00 0.00 178.44 178.68 1aje h LYS 166 N 0.41 0.00 0.00 1.25 1.57 -1.93 1.74 116.57 119.61 1aje h LYS 166 Ca 0.12 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.78 1aje h LYS 166 Cb 0.14 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1aje h LYS 166 CO -0.01 0.00 -0.72 -0.97 -0.57 0.00 0.00 179.45 177.17 1aje h ASN 167 N 0.00 0.00 0.58 0.86 -1.24 -0.48 -0.36 115.58 114.94 1aje h ASN 167 Ca 0.00 -0.52 -0.01 0.00 0.71 0.00 0.00 56.30 56.48 1aje h ASN 167 Cb 0.09 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.14 1aje h ASN 167 CO 0.00 1.18 -0.03 0.58 -1.29 0.00 0.00 177.43 177.87 1aje h VAL 168 N -1.00 0.14 0.00 2.57 2.07 0.26 1.03 116.25 121.31 1aje h VAL 168 Ca -0.18 -0.39 -0.24 0.00 0.82 0.00 0.00 66.70 66.71 1aje h VAL 168 Cb 1.01 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 32.08 1aje h VAL 168 CO -0.11 0.03 -1.28 -0.26 0.02 0.00 0.00 177.57 175.97 1aje h PHE 169 N 0.00 0.02 0.06 1.57 -1.00 0.25 1.71 116.94 119.55 1aje h PHE 169 Ca -0.00 -0.01 -0.24 0.00 2.81 0.00 0.00 57.97 60.53 1aje h PHE 169 Cb 0.33 -0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.88 1aje h PHE 169 CO 0.00 1.01 -1.09 0.38 -1.61 0.00 0.00 178.31 177.00 1aje h ASP 170 N 0.00 0.25 0.03 2.17 3.04 1.00 -2.84 116.42 120.07 1aje h ASP 170 Ca -0.12 -0.25 -0.00 0.00 -3.24 0.00 0.00 57.03 53.41 1aje h ASP 170 Cb 1.87 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 40.08 1aje h ASP 170 CO 0.11 1.17 -0.02 -0.08 -2.04 0.00 0.00 179.24 178.39 1aje h GLU 171 N 0.05 -0.04 -0.77 4.15 4.57 0.96 0.18 114.58 123.68 1aje h GLU 171 Ca -0.07 0.00 0.14 0.00 -1.18 0.00 0.00 59.36 58.25 1aje h GLU 171 Cb 1.82 0.01 -0.14 0.00 -0.16 0.00 0.00 28.75 30.28 1aje h GLU 171 CO 0.17 0.58 -0.27 0.00 -1.18 0.00 0.00 179.01 178.31 1aje h ALA 172 N -0.26 0.30 -0.31 2.92 0.00 0.25 2.52 119.26 124.67 1aje h ALA 172 Ca -0.00 0.26 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 1aje h ALA 172 Cb 0.65 0.72 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1aje h ALA 172 CO 0.01 -0.52 -0.10 0.82 0.00 0.00 0.00 179.25 179.46 1aje h ILE 173 N -0.05 1.28 0.00 0.00 5.03 -1.57 -1.30 117.51 120.90 1aje h ILE 173 Ca 0.33 -1.17 0.00 0.00 -0.12 0.00 0.00 64.86 63.90 1aje h ILE 173 Cb 0.58 1.40 0.00 0.00 -3.03 0.00 0.00 36.82 35.76 1aje h ILE 173 CO -0.81 0.38 0.00 0.25 -0.68 0.00 0.00 178.15 177.29 1aje h LEU 174 N 0.39 0.00 0.00 1.44 7.12 0.29 2.75 115.31 127.30 1aje h LEU 174 Ca 0.08 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.09 1aje h LEU 174 Cb 0.61 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.74 1aje h LEU 174 CO 0.04 0.00 -0.48 0.00 -0.13 0.00 0.00 178.44 177.87 1aje h ALA 175 N 2.00 0.74 -0.26 1.25 0.00 0.51 -2.36 119.26 121.14 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 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 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 -2.06 2.21 -1.62 0.00 0.00 0.60 -3.99 120.51 115.65 1aje n ALA 176 Ca 0.03 -1.04 0.05 0.00 0.00 0.00 0.00 53.44 52.48 1aje n ALA 176 Cb 0.51 -0.37 0.07 0.00 0.00 0.00 0.00 19.45 19.66 1aje n ALA 176 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1aje n LEU 177 N 0.41 1.20 0.00 0.00 -0.00 0.78 -4.88 117.00 114.52 1aje n LEU 177 Ca 0.09 -2.10 0.00 0.00 -0.00 0.00 0.00 56.01 54.00 1aje n LEU 177 Cb 0.38 -0.21 0.00 0.00 -0.00 0.00 0.00 43.42 43.59 1aje n LEU 177 CO 0.07 0.52 0.00 -0.62 -0.00 0.00 0.00 177.39 177.36 1aje n GLU 178 N -0.63 0.00 -1.55 1.96 4.71 -0.90 -3.85 120.64 120.38 1aje n GLU 178 Ca 0.08 0.00 -0.39 0.00 -0.01 0.00 0.00 57.16 56.85 1aje n GLU 178 Cb 0.70 0.00 -0.04 0.00 -1.01 0.00 0.00 31.44 31.09 1aje n GLU 178 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 1aje n PRO 179 N -3.71 1.16 -2.59 3.49 -0.04 -1.26 -4.94 135.00 127.11 1aje n PRO 179 Ca 0.00 0.12 -0.21 0.00 -0.04 0.00 0.00 63.50 63.37 1aje n PRO 179 Cb 0.00 -3.23 0.10 0.00 -0.04 0.00 0.00 33.50 30.33 1aje n PRO 179 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1aje n PRO 180 N 8.88 0.10 -0.32 0.54 -0.04 -1.25 -4.88 135.00 138.03 1aje n PRO 180 Ca 0.38 -2.70 -0.10 0.00 -0.04 0.00 0.00 63.50 61.04 1aje n PRO 180 Cb 0.48 -0.53 -0.03 0.00 -0.04 0.00 0.00 33.50 33.38 1aje n PRO 180 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1aje n GLU 181 N -2.62 0.00 -0.43 0.54 -0.58 -1.26 -4.57 120.64 111.71 1aje n GLU 181 Ca 0.16 0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.74 1aje n GLU 181 Cb 0.57 -0.33 -0.02 0.00 -0.57 0.00 0.00 31.44 31.09 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 1.82 0.99 -3.23 3.49 -0.04 -1.26 -4.86 135.00 131.91 1aje n PRO 182 Ca 0.14 -1.04 -0.28 0.00 -0.04 0.00 0.00 63.50 62.28 1aje n PRO 182 Cb 0.00 -2.30 -0.02 0.00 -0.04 0.00 0.00 33.50 31.14 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 4.48 3.61 -0.76 0.54 1.02 -1.26 -4.53 119.74 122.84 1aje s LYS 183 Ca 0.26 0.00 -0.02 0.00 0.02 0.00 0.00 55.97 56.23 1aje s LYS 183 Cb 0.06 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.78 1aje s LYS 183 CO 0.02 0.13 0.65 1.63 -0.92 0.00 0.00 175.35 176.86 1aje n LYS 184 N -1.27 -1.49 -4.67 1.68 5.02 -1.26 -4.99 118.16 111.18 1aje n LYS 184 Ca -0.02 1.18 -0.23 0.00 -2.02 0.00 0.00 58.31 57.23 1aje n LYS 184 Cb 0.54 -4.00 -0.15 0.00 -0.02 0.00 0.00 35.03 31.40 1aje n LYS 184 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1aje s SER 185 N -2.92 1.69 -1.03 4.39 0.15 -1.26 -5.04 113.70 109.69 1aje s SER 185 Ca 0.03 -0.26 -0.21 0.00 0.70 0.00 0.00 55.95 56.21 1aje s SER 185 Cb -0.00 -0.19 -0.09 0.00 -1.71 0.00 0.00 66.02 64.03 1aje s SER 185 CO 0.82 0.18 1.95 0.54 1.20 0.00 0.00 173.24 177.93 1aje n ARG 186 N 2.72 1.88 0.00 5.44 3.00 -1.26 -5.24 116.66 123.20 1aje n ARG 186 Ca -0.14 -2.25 0.00 0.00 -0.01 0.00 0.00 57.85 55.45 1aje n ARG 186 Cb 0.55 -3.24 0.00 0.00 0.00 0.00 0.00 32.46 29.78 1aje n ARG 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17