#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 5.46 0.02 1.61 1.04 -1.26 -5.09 113.70 115.47 1aje s SER -6 Ca 0.00 -0.52 -0.20 0.00 0.48 0.00 0.00 55.95 55.71 1aje s SER -6 Cb 0.00 -0.70 -0.06 0.00 0.10 0.00 0.00 66.02 65.36 1aje s SER -6 CO 0.00 -0.67 0.59 -1.59 0.98 0.00 0.00 173.24 172.55 1aje s LYS -5 N -4.24 4.29 1.03 4.02 -2.85 -1.26 -5.05 119.74 115.69 1aje s LYS -5 Ca 0.51 0.74 -0.11 0.00 -1.00 0.00 0.00 55.97 56.11 1aje s LYS -5 Cb -0.07 -3.31 0.21 0.00 -2.06 0.00 0.00 37.83 32.59 1aje s LYS -5 CO 0.31 0.44 1.09 0.42 0.10 0.00 0.00 175.35 177.70 1aje s ILE -4 N -0.44 2.09 0.96 3.79 1.09 -1.26 -4.95 121.20 122.48 1aje s ILE -4 Ca 0.31 0.03 -0.14 0.00 -1.10 0.00 0.00 60.65 59.74 1aje s ILE -4 Cb -0.19 -2.09 0.10 0.00 -1.06 0.00 0.00 42.46 39.23 1aje s ILE -4 CO 0.18 -0.04 0.03 -0.38 -0.10 0.00 0.00 174.94 174.63 1aje n ILE -3 N -4.55 0.00 -1.07 2.92 -0.00 -1.26 -4.81 119.36 110.59 1aje n ILE -3 Ca 0.07 -0.07 -0.36 0.00 -0.00 0.00 0.00 62.75 62.39 1aje n ILE -3 Cb 0.53 -0.39 0.05 0.00 -0.00 0.00 0.00 39.64 39.83 1aje n ILE -3 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35 1aje n SER -2 N -0.26 -4.34 -0.92 4.38 7.64 -1.26 -4.98 113.62 113.89 1aje n SER -2 Ca 0.03 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.28 1aje n SER -2 Cb 0.39 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 1aje n SER -2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aje n ALA -1 N -2.38 0.00 -1.04 -0.43 0.00 -1.25 -4.69 120.51 110.71 1aje n ALA -1 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.25 1aje n ALA -1 Cb 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.89 1aje n ALA -1 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1aje n MET 1 N 0.00 0.03 0.00 0.00 2.81 -0.53 -4.26 117.12 115.18 1aje n MET 1 Ca 0.00 -1.03 0.06 0.00 -1.81 0.00 0.00 57.70 54.92 1aje n MET 1 Cb 0.00 -2.70 0.33 0.00 -0.71 0.00 0.00 33.22 30.15 1aje n MET 1 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1aje n GLN 2 N 7.07 0.47 -2.92 0.03 6.02 -1.25 -4.73 117.38 122.08 1aje n GLN 2 Ca 0.33 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 57.31 1aje n GLN 2 Cb 0.43 -1.37 -0.01 0.00 1.02 0.00 0.00 30.24 30.31 1aje n GLN 2 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1aje n THR 3 N -0.87 -6.55 -3.70 5.09 -2.24 -1.26 -4.90 114.28 99.85 1aje n THR 3 Ca 0.08 1.21 -0.39 0.00 -2.27 0.00 0.00 64.05 62.68 1aje n THR 3 Cb 0.04 -4.59 -0.11 0.00 -2.10 0.00 0.00 70.33 63.56 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 -0.81 3.91 0.18 2.28 1.09 0.49 -4.86 121.20 123.49 1aje s ILE 4 Ca -0.07 -1.29 -0.25 0.00 -1.10 0.00 0.00 60.65 57.94 1aje s ILE 4 Cb 0.00 -3.31 -0.08 0.00 -1.06 0.00 0.00 42.46 38.01 1aje s ILE 4 CO 0.36 -0.33 0.79 -0.75 -0.10 0.00 0.00 174.94 174.91 1aje s LYS 5 N 1.39 4.56 -0.04 2.79 2.47 -1.26 0.11 119.74 129.76 1aje s LYS 5 Ca 0.01 1.16 0.06 0.00 -1.56 0.00 0.00 55.97 55.63 1aje s LYS 5 Cb -0.21 -3.20 -0.01 0.00 -1.46 0.00 0.00 37.83 32.95 1aje s LYS 5 CO 0.02 0.54 -0.21 0.00 0.16 0.00 0.00 175.35 175.86 1aje s VAL 7 N -0.21 3.36 0.31 0.00 1.01 0.22 0.10 120.40 125.19 1aje s VAL 7 Ca 0.01 -1.86 -0.26 0.00 0.00 0.00 0.00 61.98 59.87 1aje s VAL 7 Cb -0.11 -3.21 -0.10 0.00 0.00 0.00 0.00 36.38 32.97 1aje s VAL 7 CO 0.02 -0.57 0.93 -0.69 0.00 0.00 0.00 175.10 174.79 1aje s VAL 8 N 1.20 4.23 0.16 2.92 1.01 -1.03 -1.15 120.40 127.73 1aje s VAL 8 Ca 0.05 1.80 0.05 0.00 0.00 0.00 0.00 61.98 63.89 1aje s VAL 8 Cb -0.22 -4.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.10 1aje s VAL 8 CO -0.03 0.16 -0.10 0.68 0.00 0.00 0.00 175.10 175.81 1aje s VAL 9 N -1.60 1.26 0.00 2.92 -7.23 -0.47 -4.66 120.40 110.62 1aje s VAL 9 Ca 0.49 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.58 1aje s VAL 9 Cb -0.19 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 34.82 1aje s VAL 9 CO 0.24 -0.68 0.00 0.61 -0.31 0.00 0.00 175.10 174.96 1aje n GLY 10 N -0.25 -1.00 0.05 2.32 0.00 -1.26 -3.22 105.19 101.83 1aje n GLY 10 Ca -0.09 -1.65 -0.01 0.00 0.00 0.00 0.00 46.02 44.27 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 -1.52 0.72 -0.76 1.61 2.03 -1.26 -4.95 116.55 112.42 1aje n ASP 11 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1aje n ASP 11 Cb 0.00 1.34 0.00 0.00 -0.72 0.00 0.00 41.12 41.74 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 1.71 -3.96 0.68 0.27 0.00 -1.26 -3.81 105.19 98.82 1aje n GLY 12 Ca -0.17 -0.80 0.48 0.00 0.00 0.00 0.00 46.02 45.53 1aje n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aje h ALA 13 N 1.12 3.69 -1.30 4.61 0.00 -1.89 -3.30 119.26 122.20 1aje h ALA 13 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1aje h ALA 13 Cb 0.00 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1aje h ALA 13 CO 0.00 -2.28 0.00 0.28 0.00 0.00 0.00 179.25 177.25 1aje n VAL 14 N -3.83 0.00 0.00 0.00 0.31 -1.26 -5.04 118.33 108.51 1aje n VAL 14 Ca 0.40 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.73 1aje n VAL 14 Cb 1.90 -0.77 0.00 0.00 -0.91 0.00 0.00 33.84 34.07 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 3.67 -0.14 0.00 2.92 0.00 -1.24 -4.99 105.19 105.40 1aje n GLY 15 Ca 0.00 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.75 1aje n GLY 15 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1aje n LYS 16 N 0.00 0.00 -0.20 1.61 0.00 -1.26 -3.75 118.16 114.56 1aje n LYS 16 Ca 0.00 0.36 -0.05 0.00 -0.00 0.00 0.00 58.31 58.62 1aje n LYS 16 Cb 0.00 -1.62 -0.05 0.00 -0.00 0.00 0.00 35.03 33.37 1aje n LYS 16 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1aje n THR 17 N -1.36 -0.32 -0.19 0.58 -1.04 -1.26 0.12 114.28 110.81 1aje n THR 17 Ca 0.00 1.48 0.20 0.00 -2.04 0.00 0.00 64.05 63.69 1aje n THR 17 Cb 0.12 -1.86 0.56 0.00 -1.82 0.00 0.00 70.33 67.33 1aje n THR 17 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1aje h LEU 19 N 0.30 -0.51 -0.54 0.00 7.12 0.69 0.16 115.31 122.53 1aje h LEU 19 Ca 0.42 0.04 0.10 0.00 0.13 0.00 0.00 57.88 58.57 1aje h LEU 19 Cb 1.17 0.17 -0.11 0.00 -0.53 0.00 0.00 40.66 41.36 1aje h LEU 19 CO -0.12 -0.22 -0.31 -0.07 -0.13 0.00 0.00 178.44 177.59 1aje h LEU 20 N -0.33 -1.06 -0.83 2.25 4.07 -1.18 0.11 115.31 118.35 1aje h LEU 20 Ca -0.02 0.21 0.14 0.00 0.08 0.00 0.00 57.88 58.30 1aje h LEU 20 Cb 0.29 0.53 -0.15 0.00 1.08 0.00 0.00 40.66 42.42 1aje h LEU 20 CO -0.04 -0.30 -0.32 0.40 -1.08 0.00 0.00 178.44 177.10 1aje h ILE 21 N -0.17 0.09 -0.61 1.22 1.08 -0.84 0.20 117.51 118.48 1aje h ILE 21 Ca 0.22 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.60 1aje h ILE 21 Cb 0.54 0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.35 1aje h ILE 21 CO -0.63 0.00 0.01 0.28 -0.69 0.00 0.00 178.15 177.12 1aje h SER 22 N -0.05 1.05 0.00 1.72 0.02 0.17 2.14 113.55 118.60 1aje h SER 22 Ca 0.33 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1aje h SER 22 Cb 0.59 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1aje h SER 22 CO -0.87 1.09 0.28 0.10 -1.14 0.00 0.00 176.83 176.30 1aje h TYR 23 N 0.97 0.00 0.00 3.45 -0.00 0.13 0.98 116.97 122.50 1aje h TYR 23 Ca 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 58.86 1aje h TYR 23 Cb 0.55 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.27 1aje h TYR 23 CO 0.04 0.00 -1.15 0.25 -0.00 0.00 0.00 178.16 177.30 1aje n THR 24 N -2.64 0.14 0.59 -0.90 -2.24 -0.65 -4.78 114.28 103.80 1aje n THR 24 Ca -0.02 -0.05 0.07 0.00 -2.27 0.00 0.00 64.05 61.78 1aje n THR 24 Cb 0.32 -1.04 -0.08 0.00 -2.10 0.00 0.00 70.33 67.43 1aje n THR 24 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1aje n THR 25 N -2.83 0.00 -2.50 4.28 -2.24 0.71 -4.95 114.28 106.75 1aje n THR 25 Ca -0.05 -0.19 -0.06 0.00 -2.27 0.00 0.00 64.05 61.49 1aje n THR 25 Cb 0.54 0.91 -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 -3.20 -0.57 0.00 0.00 175.07 171.30 1aje n ASN 26 N -1.40 -0.96 -3.90 3.42 4.05 0.34 -4.80 115.26 112.01 1aje n ASN 26 Ca 0.02 0.19 -0.30 0.00 0.45 0.00 0.00 54.58 54.94 1aje n ASN 26 Cb 0.23 -0.93 -0.14 0.00 1.23 0.00 0.00 39.78 40.17 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1aje s LYS 27 N -4.59 1.65 -0.18 1.20 2.47 -1.26 -4.89 119.74 114.14 1aje s LYS 27 Ca 0.11 -2.25 -0.18 0.00 -1.56 0.00 0.00 55.97 52.10 1aje s LYS 27 Cb -0.07 -2.99 -0.08 0.00 -1.46 0.00 0.00 37.83 33.24 1aje s LYS 27 CO 0.14 -1.08 0.59 0.34 0.16 0.00 0.00 175.35 175.50 1aje n PHE 28 N 3.53 0.64 1.04 4.03 7.35 -1.26 -4.82 117.46 127.96 1aje n PHE 28 Ca 0.05 0.43 0.12 0.00 -0.76 0.00 0.00 57.45 57.30 1aje n PHE 28 Cb 0.35 -0.84 0.20 0.00 0.35 0.00 0.00 39.48 39.54 1aje n PHE 28 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1aje n PRO 29 N 1.45 2.20 0.00 -7.13 -0.04 -1.26 -4.95 135.00 125.27 1aje n PRO 29 Ca 0.11 -1.75 0.00 0.00 -0.04 0.00 0.00 63.50 61.82 1aje n PRO 29 Cb -0.02 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 1aje n PRO 29 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1aje n SER 30 N 1.11 0.00 -2.47 3.54 3.41 -1.26 0.33 113.62 118.27 1aje n SER 30 Ca 0.16 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.46 1aje n SER 30 Cb 0.55 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1aje n SER 30 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1aje n GLU 31 N 0.00 3.20 -1.56 4.33 1.02 -1.26 -4.91 120.64 121.46 1aje n GLU 31 Ca 0.00 -4.02 -0.01 0.00 -0.02 0.00 0.00 57.16 53.11 1aje n GLU 31 Cb 0.00 -2.27 -0.00 0.00 -0.02 0.00 0.00 31.44 29.15 1aje n GLU 31 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1aje n TYR 32 N -0.61 -1.45 -4.04 -0.32 4.01 0.98 -4.80 117.16 110.93 1aje n TYR 32 Ca 0.47 -0.05 -0.38 0.00 -0.16 0.00 0.00 57.90 57.78 1aje n TYR 32 Cb 0.62 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 1aje n TYR 32 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 1aje n VAL 33 N -0.52 -1.99 0.33 -0.72 0.24 -1.26 -4.75 118.33 109.66 1aje n VAL 33 Ca -0.00 -0.49 0.05 0.00 -2.04 0.00 0.00 64.34 61.86 1aje n VAL 33 Cb 0.01 -1.71 0.20 0.00 -1.47 0.00 0.00 33.84 30.88 1aje n VAL 33 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1aje n PRO 34 N -4.41 0.00 -2.62 7.34 -0.04 -1.26 -2.97 135.00 131.05 1aje n PRO 34 Ca -0.12 0.33 -0.02 0.00 -0.04 0.00 0.00 63.50 63.66 1aje n PRO 34 Cb 0.49 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.55 1aje n PRO 34 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1aje n THR 35 N -1.50 0.31 -1.60 0.52 5.66 -1.26 -5.12 114.28 111.29 1aje n THR 35 Ca 0.02 -1.43 -0.63 0.00 -3.05 0.00 0.00 64.05 58.97 1aje n THR 35 Cb 0.11 1.05 -0.09 0.00 -1.55 0.00 0.00 70.33 69.86 1aje n THR 35 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 1aje n VAL 36 N -1.22 0.00 -0.95 1.08 3.14 -1.16 -4.84 118.33 114.38 1aje n VAL 36 Ca -0.12 0.00 0.06 0.00 -2.96 0.00 0.00 64.34 61.33 1aje n VAL 36 Cb 0.86 -0.25 0.36 0.00 -1.06 0.00 0.00 33.84 33.74 1aje n VAL 36 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 1aje n PHE 37 N 2.73 1.80 0.00 1.45 3.72 -1.26 -4.88 117.46 121.02 1aje n PHE 37 Ca 0.25 -0.81 0.00 0.00 -0.05 0.00 0.00 57.45 56.84 1aje n PHE 37 Cb 0.01 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.07 1aje n PHE 37 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1aje n ASP 38 N 0.23 0.00 -3.31 4.37 -0.08 -1.26 -4.75 116.55 111.75 1aje n ASP 38 Ca 0.27 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 53.31 1aje n ASP 38 Cb 1.13 0.00 0.04 0.00 2.34 0.00 0.00 41.12 44.63 1aje n ASP 38 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1aje n ASN 39 N 0.00 -5.69 -4.18 1.67 2.85 -1.26 -4.98 115.26 103.68 1aje n ASN 39 Ca 0.00 -0.42 -0.11 0.00 -0.11 0.00 0.00 54.58 53.94 1aje n ASN 39 Cb 0.00 -4.57 -0.10 0.00 1.24 0.00 0.00 39.78 36.35 1aje n ASN 39 CO 0.00 0.00 0.00 -0.72 -2.11 0.00 0.00 177.26 174.43 1aje s TYR 40 N -3.19 0.95 -0.13 1.20 -0.85 -1.26 -4.96 117.35 109.11 1aje s TYR 40 Ca 0.43 -1.14 0.00 0.00 -0.52 0.00 0.00 57.07 55.84 1aje s TYR 40 Cb -0.20 -0.55 0.02 0.00 0.38 0.00 0.00 41.96 41.61 1aje s TYR 40 CO 0.53 -0.39 -0.12 0.00 -1.52 0.00 0.00 175.55 174.04 1aje s ALA 41 N -3.89 1.66 0.61 9.51 0.00 -1.25 -2.71 121.76 125.68 1aje s ALA 41 Ca 0.22 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.47 1aje s ALA 41 Cb 0.07 -0.96 0.08 0.00 0.00 0.00 0.00 23.12 22.32 1aje s ALA 41 CO 0.01 -0.32 0.85 0.14 0.00 0.00 0.00 175.76 176.44 1aje s VAL 42 N 1.43 2.34 -0.16 0.00 -7.23 -0.87 -4.56 120.40 111.35 1aje s VAL 42 Ca 0.02 -0.77 -0.03 0.00 -1.81 0.00 0.00 61.98 59.40 1aje s VAL 42 Cb -0.13 -2.57 -0.02 0.00 0.56 0.00 0.00 36.38 34.21 1aje s VAL 42 CO -0.08 0.00 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.76 1aje s THR 43 N -2.84 3.62 0.53 5.32 2.01 -1.26 0.80 115.64 123.82 1aje s THR 43 Ca 0.62 -0.45 0.05 0.00 0.31 0.00 0.00 61.69 62.22 1aje s THR 43 Cb -0.07 -2.58 0.02 0.00 0.01 0.00 0.00 72.50 69.88 1aje s THR 43 CO 0.40 0.49 0.33 0.68 -0.69 0.00 0.00 174.62 175.84 1aje s VAL 44 N 0.51 1.66 -0.11 3.82 -7.23 -0.92 -4.84 120.40 113.29 1aje s VAL 44 Ca -0.05 -1.57 -0.03 0.00 -1.81 0.00 0.00 61.98 58.52 1aje s VAL 44 Cb -0.15 -2.23 0.04 0.00 0.56 0.00 0.00 36.38 34.61 1aje s VAL 44 CO 0.03 0.00 0.05 -0.04 -0.31 0.00 0.00 175.10 174.83 1aje s MET 45 N -4.20 0.21 0.01 4.82 -1.94 -1.26 -0.60 119.30 116.35 1aje s MET 45 Ca 0.31 0.08 -0.26 0.00 -1.71 0.00 0.00 55.69 54.11 1aje s MET 45 Cb -0.01 -1.21 -0.16 0.00 2.01 0.00 0.00 34.83 35.45 1aje s MET 45 CO 0.19 -0.47 1.23 0.82 -0.01 0.00 0.00 175.02 176.78 1aje h ILE 46 N 6.42 0.49 0.00 2.53 5.03 -1.89 -3.42 117.51 126.67 1aje h ILE 46 Ca -0.15 -0.47 -0.13 0.00 -0.12 0.00 0.00 64.86 63.99 1aje h ILE 46 Cb 1.13 0.69 -0.13 0.00 -3.03 0.00 0.00 36.82 35.48 1aje h ILE 46 CO 0.24 0.07 -0.27 0.61 -0.68 0.00 0.00 178.15 178.13 1aje n GLY 47 N -0.48 0.85 0.00 5.37 0.00 -1.26 -4.93 105.19 104.74 1aje n GLY 47 Ca -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.43 -0.01 3.05 -0.02 0.00 -1.26 -5.12 105.19 101.40 1aje n GLY 48 Ca -0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 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 1.89 0.22 1.61 2.02 -1.26 -5.04 118.70 118.14 1aje s GLU 49 Ca 0.00 -0.48 -0.30 0.00 0.02 0.00 0.00 54.97 54.22 1aje s GLU 49 Cb 0.00 -1.55 -0.08 0.00 0.10 0.00 0.00 34.13 32.60 1aje s GLU 49 CO 0.00 0.03 0.97 -1.25 0.02 0.00 0.00 175.26 175.03 1aje s PRO 50 N 0.67 4.79 -0.25 0.39 0.04 -1.25 -2.62 135.00 136.77 1aje s PRO 50 Ca -0.14 1.53 -0.04 0.00 0.04 0.00 0.00 61.00 62.39 1aje s PRO 50 Cb -0.16 -3.28 0.09 0.00 0.04 0.00 0.00 34.50 31.18 1aje s PRO 50 CO 0.04 0.41 0.11 0.71 0.04 0.00 0.00 177.00 178.31 1aje s TYR 51 N -0.95 0.37 0.37 0.56 2.02 0.23 -1.45 117.35 118.50 1aje s TYR 51 Ca 0.43 -0.74 -0.27 0.00 -0.37 0.00 0.00 57.07 56.11 1aje s TYR 51 Cb -0.26 -0.88 -0.09 0.00 -0.40 0.00 0.00 41.96 40.32 1aje s TYR 51 CO 0.33 -0.72 1.31 0.99 -1.57 0.00 0.00 175.55 175.88 1aje s THR 52 N 2.08 2.65 -0.19 -0.71 2.01 -1.25 -2.16 115.64 118.07 1aje s THR 52 Ca 0.06 0.61 0.01 0.00 0.31 0.00 0.00 61.69 62.69 1aje s THR 52 Cb -0.16 -3.37 0.04 0.00 0.01 0.00 0.00 72.50 69.01 1aje s THR 52 CO -0.27 0.12 -0.12 -1.48 -0.69 0.00 0.00 174.62 172.17 1aje s LEU 53 N -2.16 2.24 -0.37 4.42 0.05 0.24 0.19 118.68 123.28 1aje s LEU 53 Ca 0.53 -0.82 -0.13 0.00 0.05 0.00 0.00 54.13 53.77 1aje s LEU 53 Cb -0.39 -1.28 0.01 0.00 -2.05 0.00 0.00 46.19 42.47 1aje s LEU 53 CO 0.51 -0.11 0.24 -0.83 -0.55 0.00 0.00 176.35 175.61 1aje s GLY 54 N 1.37 1.96 0.04 -3.48 0.00 0.30 -2.05 107.32 105.46 1aje s GLY 54 Ca 0.00 -1.57 -0.25 0.00 0.00 0.00 0.00 44.72 42.90 1aje s GLY 54 CO -0.09 0.83 0.77 1.08 0.00 0.00 0.00 173.10 175.69 1aje s LEU 55 N 1.66 4.44 -0.25 0.66 2.01 -1.10 0.78 118.68 126.88 1aje s LEU 55 Ca 0.05 1.44 0.03 0.00 0.01 0.00 0.00 54.13 55.65 1aje s LEU 55 Cb -0.18 -3.23 0.06 0.00 0.01 0.00 0.00 46.19 42.84 1aje s LEU 55 CO 0.09 0.00 -0.11 0.12 1.01 0.00 0.00 176.35 177.46 1aje s PHE 56 N 0.01 3.18 0.00 0.29 5.36 0.29 -4.21 117.98 122.91 1aje s PHE 56 Ca 0.39 -2.25 0.00 0.00 -0.96 0.00 0.00 56.93 54.11 1aje s PHE 56 Cb -0.20 -1.91 0.00 0.00 -0.34 0.00 0.00 43.02 40.57 1aje s PHE 56 CO 0.23 -0.87 0.00 -3.47 -1.46 0.00 0.00 175.22 169.65 1aje n ASP 57 N 4.46 0.00 -4.36 6.13 -0.08 -1.26 -2.48 116.55 118.96 1aje n ASP 57 Ca -0.14 -0.24 -0.29 0.00 -1.51 0.00 0.00 54.79 52.61 1aje n ASP 57 Cb 0.43 0.00 0.22 0.00 2.34 0.00 0.00 41.12 44.11 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 0.62 1.86 0.16 5.18 -4.23 -1.26 -4.85 115.64 113.12 1aje s THR 58 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.48 1aje s THR 58 Cb 0.00 -2.35 0.04 0.00 1.34 0.00 0.00 72.50 71.53 1aje s THR 58 CO 0.00 0.00 0.09 0.00 -0.54 0.00 0.00 174.62 174.17 1aje n ALA 59 N -4.62 -0.56 0.00 3.99 0.00 -1.26 -4.84 120.51 113.22 1aje n ALA 59 Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1aje n ALA 59 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 -0.59 0.85 3.00 0.00 0.00 -1.26 -5.10 105.19 102.09 1aje n GLY 60 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 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 0.23 0.43 1.61 0.74 -1.26 -5.01 119.66 116.40 1aje s GLN 61 Ca 0.00 0.67 0.35 0.00 0.05 0.00 0.00 55.36 56.43 1aje s GLN 61 Cb 0.00 -0.25 1.40 0.00 1.10 0.00 0.00 33.01 35.25 1aje s GLN 61 CO 0.00 -0.42 1.38 0.39 -0.55 0.00 0.00 175.29 176.09 1aje n GLU 62 N 5.36 -0.02 -1.90 1.67 1.02 -1.26 -4.67 120.64 120.83 1aje n GLU 62 Ca -0.06 1.05 -0.08 0.00 -0.02 0.00 0.00 57.16 58.05 1aje n GLU 62 Cb 0.50 -2.20 -0.02 0.00 -0.02 0.00 0.00 31.44 29.70 1aje n GLU 62 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1aje n ASP 63 N -4.19 -2.61 -3.65 1.62 2.03 -1.26 -1.12 116.55 107.36 1aje n ASP 63 Ca 0.37 0.25 -0.21 0.00 0.52 0.00 0.00 54.79 55.72 1aje n ASP 63 Cb 1.53 -2.42 0.04 0.00 -0.72 0.00 0.00 41.12 39.56 1aje n ASP 63 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1aje n TYR 64 N -2.39 -1.96 0.57 -0.67 4.01 -1.26 -4.87 117.16 110.59 1aje n TYR 64 Ca -0.09 0.82 0.06 0.00 -0.16 0.00 0.00 57.90 58.53 1aje n TYR 64 Cb 0.44 -4.35 0.19 0.00 -0.31 0.00 0.00 39.34 35.30 1aje n TYR 64 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1aje n ASP 65 N -3.04 2.43 -4.77 7.72 9.92 -0.28 -4.95 116.55 123.59 1aje n ASP 65 Ca -0.27 -2.07 -0.40 0.00 -0.53 0.00 0.00 54.79 51.52 1aje n ASP 65 Cb 0.67 -0.32 0.01 0.00 -0.64 0.00 0.00 41.12 40.84 1aje n ASP 65 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1aje s ARG 66 N -1.52 3.75 -1.13 -1.24 1.70 -1.26 -3.24 118.95 116.01 1aje s ARG 66 Ca 0.28 2.44 -0.26 0.00 -0.47 0.00 0.00 55.73 57.72 1aje s ARG 66 Cb 0.16 -2.70 0.03 0.00 -0.57 0.00 0.00 34.95 31.86 1aje s ARG 66 CO 0.18 -0.78 0.70 1.28 -1.08 0.00 0.00 175.30 175.60 1aje n LEU 67 N -0.10 -1.21 -3.40 -1.89 4.77 -1.26 -4.94 117.00 108.97 1aje n LEU 67 Ca 0.04 -1.16 -0.26 0.00 -0.03 0.00 0.00 56.01 54.60 1aje n LEU 67 Cb 0.41 -1.83 -0.10 0.00 -2.33 0.00 0.00 43.42 39.57 1aje n LEU 67 CO 0.60 0.63 -0.29 -0.13 -1.33 0.00 0.00 177.39 176.87 1aje s ARG 68 N -6.64 0.71 0.95 3.23 1.81 -1.20 -5.13 118.95 112.67 1aje s ARG 68 Ca 0.41 -1.59 -0.12 0.00 -1.72 0.00 0.00 55.73 52.71 1aje s ARG 68 Cb -0.20 -1.25 0.16 0.00 -0.45 0.00 0.00 34.95 33.21 1aje s ARG 68 CO 0.93 -1.29 1.09 -1.25 -0.68 0.00 0.00 175.30 174.11 1aje s PRO 69 N 0.69 0.84 -1.24 3.54 0.04 -1.26 -4.88 135.00 132.72 1aje s PRO 69 Ca 0.24 0.64 -0.20 0.00 0.04 0.00 0.00 61.00 61.72 1aje s PRO 69 Cb -0.11 -1.78 -0.01 0.00 0.04 0.00 0.00 34.50 32.65 1aje s PRO 69 CO -0.08 -2.48 1.84 1.28 0.04 0.00 0.00 177.00 177.60 1aje n LEU 70 N -4.02 4.07 -1.92 -3.56 4.77 -1.26 -4.68 117.00 110.40 1aje n LEU 70 Ca 0.06 -3.56 0.04 0.00 -0.03 0.00 0.00 56.01 52.52 1aje n LEU 70 Cb 0.56 -1.73 0.39 0.00 -2.33 0.00 0.00 43.42 40.30 1aje n LEU 70 CO 0.57 -0.78 0.91 -1.54 -1.33 0.00 0.00 177.39 175.21 1aje n SER 71 N 11.20 5.56 -4.29 -1.43 3.41 -1.26 -4.84 113.62 121.97 1aje n SER 71 Ca 0.47 -2.99 -0.45 0.00 -0.26 0.00 0.00 58.87 55.65 1aje n SER 71 Cb 0.46 -0.70 -0.05 0.00 -0.26 0.00 0.00 64.21 63.66 1aje n SER 71 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1aje s TYR 72 N -2.80 3.40 0.36 7.33 2.02 -1.26 -5.06 117.35 121.34 1aje s TYR 72 Ca 0.55 -1.61 -0.26 0.00 -0.37 0.00 0.00 57.07 55.37 1aje s TYR 72 Cb 0.42 -3.72 -0.09 0.00 -0.40 0.00 0.00 41.96 38.17 1aje s TYR 72 CO 0.15 -1.00 1.12 -1.25 -1.57 0.00 0.00 175.55 173.00 1aje s PRO 73 N 1.18 4.26 -0.78 -1.71 0.04 -1.26 -4.14 135.00 132.59 1aje s PRO 73 Ca 0.07 1.74 -0.00 0.00 0.04 0.00 0.00 61.00 62.85 1aje s PRO 73 Cb -0.25 -2.79 0.00 0.00 0.04 0.00 0.00 34.50 31.50 1aje s PRO 73 CO -0.01 -0.11 0.65 1.04 0.04 0.00 0.00 177.00 178.61 1aje n GLN 74 N 0.37 -1.45 -3.90 4.56 6.02 -1.26 -4.98 117.38 116.74 1aje n GLN 74 Ca 0.03 1.10 0.03 0.00 -0.01 0.00 0.00 57.00 58.15 1aje n GLN 74 Cb 0.47 -3.87 0.01 0.00 1.02 0.00 0.00 30.24 27.87 1aje n GLN 74 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1aje s THR 75 N -2.98 0.00 -0.76 5.09 -1.32 -1.26 -4.75 115.64 109.66 1aje s THR 75 Ca 0.00 -0.13 -0.03 0.00 -1.21 0.00 0.00 61.69 60.32 1aje s THR 75 Cb -0.00 -2.72 -0.04 0.00 -1.51 0.00 0.00 72.50 68.23 1aje s THR 75 CO 0.83 0.00 0.68 -0.67 -2.21 0.00 0.00 174.62 173.25 1aje n ASP 76 N -0.91 -6.04 -3.21 8.08 2.03 -0.46 -4.89 116.55 111.15 1aje n ASP 76 Ca 0.01 -0.40 -0.19 0.00 0.52 0.00 0.00 54.79 54.73 1aje n ASP 76 Cb 0.60 -4.34 0.19 0.00 -0.72 0.00 0.00 41.12 36.85 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 -2.46 0.00 -3.83 5.18 0.31 0.39 -4.54 118.33 113.38 1aje n VAL 77 Ca -0.04 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 63.99 1aje n VAL 77 Cb 0.56 -0.63 -0.15 0.00 -0.91 0.00 0.00 33.84 32.72 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 -1.75 2.48 -0.76 3.52 0.08 -0.73 -0.61 117.98 120.20 1aje s PHE 78 Ca 0.43 -2.29 -0.21 0.00 0.12 0.00 0.00 56.93 54.97 1aje s PHE 78 Cb -0.08 -2.18 0.09 0.00 -0.57 0.00 0.00 43.02 40.28 1aje s PHE 78 CO 0.36 -0.89 1.04 -0.51 -0.10 0.00 0.00 175.22 175.12 1aje s LEU 79 N 1.16 4.54 -0.32 -0.37 1.43 -0.30 -1.59 118.68 123.23 1aje s LEU 79 Ca 0.11 -1.33 -0.25 0.00 -1.03 0.00 0.00 54.13 51.63 1aje s LEU 79 Cb -0.19 -2.42 0.01 0.00 0.03 0.00 0.00 46.19 43.62 1aje s LEU 79 CO -0.16 -1.33 0.86 -0.69 0.23 0.00 0.00 176.35 175.27 1aje s VAL 80 N 3.70 4.71 -0.32 -1.59 1.01 -0.78 -1.37 120.40 125.76 1aje s VAL 80 Ca 0.27 1.29 -0.19 0.00 0.00 0.00 0.00 61.98 63.34 1aje s VAL 80 Cb -0.12 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 1aje s VAL 80 CO 0.03 -0.34 0.57 0.00 0.00 0.00 0.00 175.10 175.36 1aje n PHE 82 N 5.79 0.40 -1.59 0.00 1.16 -0.14 -4.44 117.46 118.64 1aje n PHE 82 Ca -0.03 0.12 0.00 0.00 -1.87 0.00 0.00 57.45 55.67 1aje n PHE 82 Cb 0.49 -0.64 0.00 0.00 -1.61 0.00 0.00 39.48 37.72 1aje n PHE 82 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1aje n SER 83 N -2.34 -7.18 -0.15 5.98 2.88 -1.26 -2.92 113.62 108.63 1aje n SER 83 Ca -0.01 1.00 0.12 0.00 -1.33 0.00 0.00 58.87 58.65 1aje n SER 83 Cb 0.53 -3.87 0.19 0.00 -0.75 0.00 0.00 64.21 60.32 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 1.16 0.00 1.01 2.46 0.31 -1.26 -3.76 118.33 118.24 1aje n VAL 84 Ca 0.00 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 1aje n VAL 84 Cb 0.00 0.57 0.00 0.00 -0.91 0.00 0.00 33.84 33.50 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 -1.02 0.00 -3.61 2.52 0.24 -1.26 -3.65 118.33 111.55 1aje n VAL 85 Ca 0.08 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.26 1aje n VAL 85 Cb 0.36 -0.42 -0.05 0.00 -1.47 0.00 0.00 33.84 32.25 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 -0.16 -0.34 0.00 -1.34 1.04 -1.25 -3.02 113.70 108.62 1aje s SER 86 Ca 0.00 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.40 1aje s SER 86 Cb 0.00 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1aje s SER 86 CO 0.00 -0.76 0.00 -0.81 0.98 0.00 0.00 173.24 172.65 1aje n PRO 87 N 0.21 0.00 0.00 4.02 -0.04 -1.24 -3.78 135.00 134.17 1aje n PRO 87 Ca -0.18 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.36 1aje n PRO 87 Cb 0.61 0.00 0.38 0.00 -0.04 0.00 0.00 33.50 34.45 1aje n PRO 87 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1aje n SER 88 N 0.00 0.00 -0.22 3.54 3.41 -1.26 -3.09 113.62 115.99 1aje n SER 88 Ca 0.00 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1aje n SER 88 Cb 0.00 -0.28 0.12 0.00 -0.26 0.00 0.00 64.21 63.79 1aje n SER 88 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1aje h SER 89 N 0.00 0.37 0.00 4.04 0.02 -1.88 0.67 113.55 116.77 1aje h SER 89 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1aje h SER 89 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1aje h SER 89 CO 0.00 0.22 0.23 2.19 -1.14 0.00 0.00 176.83 178.33 1aje h PHE 90 N 0.53 0.00 0.07 3.45 -0.00 -1.46 -1.00 116.94 118.53 1aje h PHE 90 Ca 0.32 0.00 -0.34 0.00 -0.00 0.00 0.00 57.97 57.95 1aje h PHE 90 Cb 0.34 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 36.26 1aje h PHE 90 CO -0.13 0.00 -1.95 -1.91 -0.00 0.00 0.00 178.31 174.32 1aje n GLU 91 N -2.17 0.71 0.14 6.09 4.07 0.23 -3.57 120.64 126.13 1aje n GLU 91 Ca -0.01 0.25 0.11 0.00 -0.06 0.00 0.00 57.16 57.45 1aje n GLU 91 Cb 0.25 -1.72 0.52 0.00 -0.06 0.00 0.00 31.44 30.44 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 -3.28 0.55 0.24 4.31 0.23 -0.39 0.11 115.26 117.03 1aje n ASN 92 Ca -0.28 0.72 0.12 0.00 -0.53 0.00 0.00 54.58 54.61 1aje n ASN 92 Cb 1.05 -0.80 0.58 0.00 -2.08 0.00 0.00 39.78 38.53 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 0.45 0.00 3.53 2.07 -1.57 -2.93 116.25 117.80 1aje h VAL 93 Ca 0.00 -0.86 -0.06 0.00 0.82 0.00 0.00 66.70 66.61 1aje h VAL 93 Cb 0.10 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1aje h VAL 93 CO 0.00 0.16 -0.38 0.11 0.02 0.00 0.00 177.57 177.48 1aje h LYS 94 N 0.00 0.00 -0.84 1.57 1.79 0.68 -2.36 116.57 117.42 1aje h LYS 94 Ca -0.00 0.00 0.22 0.00 -2.18 0.00 0.00 60.65 58.69 1aje h LYS 94 Cb 0.59 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.20 1aje h LYS 94 CO 0.02 0.65 0.58 0.93 -1.08 0.00 0.00 179.45 180.55 1aje h GLU 95 N -1.00 0.15 0.00 3.15 5.08 -1.46 -3.05 114.58 117.44 1aje h GLU 95 Ca -0.09 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1aje h GLU 95 Cb 0.79 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1aje h GLU 95 CO -0.05 0.10 -0.67 1.63 -1.00 0.00 0.00 179.01 179.02 1aje n LYS 96 N -4.38 2.57 0.03 2.33 4.76 -1.11 -4.62 118.16 117.74 1aje n LYS 96 Ca 0.17 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.44 1aje n LYS 96 Cb 0.80 -0.83 -0.08 0.00 -1.84 0.00 0.00 35.03 33.08 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 -1.37 0.00 0.00 177.40 174.54 1aje h TRP 97 N 0.00 0.93 -0.23 2.13 4.06 -1.52 -2.82 115.95 118.51 1aje h TRP 97 Ca 0.00 -0.48 -0.17 0.00 2.06 0.00 0.00 58.89 60.30 1aje h TRP 97 Cb 0.57 -0.12 -0.00 0.00 -1.00 0.00 0.00 29.16 28.61 1aje h TRP 97 CO 0.00 1.31 -0.55 0.28 -3.56 0.00 0.00 178.44 175.91 1aje h VAL 98 N 0.39 1.30 0.00 1.49 2.07 -1.47 -0.64 116.25 119.40 1aje h VAL 98 Ca -0.10 -1.77 -0.01 0.00 0.82 0.00 0.00 66.70 65.64 1aje h VAL 98 Cb 1.58 1.71 -0.00 0.00 -1.52 0.00 0.00 31.29 33.06 1aje h VAL 98 CO 0.18 0.56 -0.06 1.55 0.02 0.00 0.00 177.57 179.83 1aje h PRO 99 N 0.53 0.00 0.00 1.57 0.13 -1.71 0.54 132.00 133.06 1aje h PRO 99 Ca 0.01 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.84 1aje h PRO 99 Cb 1.13 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.20 1aje h PRO 99 CO 0.11 0.06 -1.85 -0.85 -0.23 0.00 0.00 178.00 175.24 1aje n GLU 100 N -3.37 0.64 -0.13 0.86 0.28 -0.99 -3.35 120.64 114.58 1aje n GLU 100 Ca -0.02 0.22 -0.21 0.00 -0.16 0.00 0.00 57.16 57.00 1aje n GLU 100 Cb 0.20 -1.73 -0.12 0.00 1.43 0.00 0.00 31.44 31.23 1aje n GLU 100 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 177.13 177.41 1aje n ILE 101 N -2.96 1.50 -0.12 3.84 -5.35 -0.28 -4.04 119.36 111.96 1aje n ILE 101 Ca -0.20 -0.53 -0.24 0.00 -0.27 0.00 0.00 62.75 61.50 1aje n ILE 101 Cb 1.06 -1.53 -0.11 0.00 -1.74 0.00 0.00 39.64 37.33 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 -3.48 1.53 0.27 7.28 -2.24 0.18 1.00 114.28 118.81 1aje n THR 102 Ca -0.47 -0.15 0.17 0.00 -2.27 0.00 0.00 64.05 61.32 1aje n THR 102 Cb 0.97 -1.99 0.92 0.00 -2.10 0.00 0.00 70.33 68.12 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 -1.33 -0.97 115.15 120.49 1aje h HIS 103 Ca -0.47 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 58.63 1aje h HIS 103 Cb 1.40 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.86 1aje h HIS 103 CO 0.01 0.00 -1.33 1.58 0.86 0.00 0.00 177.93 179.06 1aje n HIS 104 N -3.68 0.00 -3.33 2.45 -0.00 -1.21 -4.78 115.22 104.67 1aje n HIS 104 Ca -0.01 0.00 -0.27 0.00 -0.00 0.00 0.00 57.72 57.43 1aje n HIS 104 Cb 0.20 -0.60 -0.07 0.00 -0.00 0.00 0.00 29.99 29.52 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 0.67 3.76 0.01 0.00 -0.04 -0.37 -4.31 135.00 134.71 1aje n PRO 106 Ca 0.30 -2.47 -0.13 0.00 -0.04 0.00 0.00 63.50 61.16 1aje n PRO 106 Cb 0.40 -2.64 -0.09 0.00 -0.04 0.00 0.00 33.50 31.12 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 4.60 -0.08 0.00 0.54 6.56 -1.87 -3.48 116.57 122.83 1aje h LYS 107 Ca 0.74 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 60.34 1aje h LYS 107 Cb 0.42 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 1aje h LYS 107 CO 1.51 0.42 0.00 2.41 -2.06 0.00 0.00 179.45 181.73 1aje n THR 108 N -4.88 0.00 -1.56 -0.16 -1.04 -1.26 -5.10 114.28 100.29 1aje n THR 108 Ca -0.09 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.55 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 -0.81 -0.64 0.00 0.00 175.07 173.62 1aje n PRO 109 N 0.00 1.17 -3.73 -2.82 -0.04 -1.25 -4.56 135.00 123.77 1aje n PRO 109 Ca 0.00 0.07 -0.29 0.00 -0.04 0.00 0.00 63.50 63.24 1aje n PRO 109 Cb 0.00 -3.42 -0.16 0.00 -0.04 0.00 0.00 33.50 29.88 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 11.72 1.33 -0.31 0.54 2.19 -1.26 -1.78 117.98 130.42 1aje s PHE 110 Ca 0.99 -1.30 -0.04 0.00 0.33 0.00 0.00 56.93 56.91 1aje s PHE 110 Cb -0.20 -1.35 0.04 0.00 -1.31 0.00 0.00 43.02 40.20 1aje s PHE 110 CO 0.27 -0.76 0.03 -0.51 1.83 0.00 0.00 175.22 176.08 1aje s LEU 111 N 1.75 3.94 -0.51 6.12 1.43 -0.62 0.42 118.68 131.20 1aje s LEU 111 Ca 0.05 -1.14 -0.18 0.00 -1.03 0.00 0.00 54.13 51.82 1aje s LEU 111 Cb -0.17 -1.77 0.07 0.00 0.03 0.00 0.00 46.19 44.35 1aje s LEU 111 CO -0.19 -0.26 0.59 -0.22 0.23 0.00 0.00 176.35 176.50 1aje s LEU 112 N 1.33 5.21 0.11 1.79 2.96 -0.21 -1.87 118.68 128.00 1aje s LEU 112 Ca -0.03 -1.11 -0.03 0.00 -0.22 0.00 0.00 54.13 52.74 1aje s LEU 112 Cb -0.19 -2.36 -0.03 0.00 0.50 0.00 0.00 46.19 44.11 1aje s LEU 112 CO 0.00 -0.87 0.08 0.68 -1.32 0.00 0.00 176.35 174.91 1aje s VAL 113 N 2.40 0.13 0.00 1.68 -7.23 -1.04 -2.26 120.40 114.07 1aje s VAL 113 Ca 0.12 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.54 1aje s VAL 113 Cb -0.21 -1.82 0.00 0.00 0.56 0.00 0.00 36.38 34.90 1aje s VAL 113 CO 0.10 -0.59 0.00 0.61 -0.31 0.00 0.00 175.10 174.90 1aje n GLY 114 N -0.06 -2.56 1.77 2.32 0.00 -0.90 -0.96 105.19 104.80 1aje n GLY 114 Ca -0.09 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.18 0.00 -1.58 2.61 -2.24 -1.25 -4.28 114.28 107.36 1aje n THR 115 Ca 0.00 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.49 1aje n THR 115 Cb 0.00 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.30 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 -2.72 2.95 0.00 -0.78 3.00 -1.26 -3.21 117.38 115.36 1aje n GLN 116 Ca 0.00 -3.59 0.00 0.00 -0.01 0.00 0.00 57.00 53.40 1aje n GLN 116 Cb 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 30.24 27.98 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 -0.87 0.00 -1.23 5.09 3.06 -1.26 -3.19 119.36 120.97 1aje n ILE 117 Ca 0.54 0.00 -0.31 0.00 -2.50 0.00 0.00 62.75 60.49 1aje n ILE 117 Cb 0.83 -0.35 0.08 0.00 0.54 0.00 0.00 39.64 40.73 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 -0.43 7.29 -2.67 9.51 5.75 -1.26 -4.72 116.55 130.02 1aje n ASP 118 Ca 0.00 -3.63 -0.11 0.00 -0.01 0.00 0.00 54.79 51.04 1aje n ASP 118 Cb 0.01 -0.99 0.05 0.00 -1.03 0.00 0.00 41.12 39.16 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 -0.68 -4.00 -0.53 -2.12 4.77 -1.25 -4.73 117.00 108.47 1aje n LEU 119 Ca 0.56 -0.45 0.44 0.00 -0.03 0.00 0.00 56.01 56.53 1aje n LEU 119 Cb 0.69 -2.31 0.70 0.00 -2.33 0.00 0.00 43.42 40.16 1aje n LEU 119 CO 0.71 0.15 1.41 -0.09 -1.33 0.00 0.00 177.39 178.24 1aje h ARG 120 N -0.97 0.00 0.00 3.23 9.65 -1.86 -3.08 114.38 121.35 1aje h ARG 120 Ca -0.41 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.43 1aje h ARG 120 Cb 1.22 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.75 1aje h ARG 120 CO 0.32 0.00 -0.09 -3.47 2.80 0.00 0.00 179.97 179.52 1aje n ASP 121 N -3.72 -0.35 0.00 -3.80 -0.08 -1.26 -4.95 116.55 102.39 1aje n ASP 121 Ca 0.37 -0.79 0.00 0.00 -1.51 0.00 0.00 54.79 52.86 1aje n ASP 121 Cb 1.82 0.12 0.00 0.00 2.34 0.00 0.00 41.12 45.40 1aje n ASP 121 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1aje n ASP 122 N -0.09 0.00 0.04 1.67 8.00 -1.17 0.05 116.55 125.05 1aje n ASP 122 Ca -0.09 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.44 1aje n ASP 122 Cb 0.44 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.68 1aje n ASP 122 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1aje n PRO 123 N 0.00 0.03 -0.29 -0.24 -0.04 -1.26 -2.97 135.00 130.23 1aje n PRO 123 Ca 0.00 0.53 0.25 0.00 -0.04 0.00 0.00 63.50 64.25 1aje n PRO 123 Cb 0.00 -1.61 0.44 0.00 -0.04 0.00 0.00 33.50 32.29 1aje n PRO 123 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1aje n SER 124 N -1.68 0.17 -0.06 3.54 3.41 0.11 0.26 113.62 119.37 1aje n SER 124 Ca -0.00 1.00 -0.16 0.00 -0.26 0.00 0.00 58.87 59.44 1aje n SER 124 Cb 0.01 -0.49 -0.14 0.00 -0.26 0.00 0.00 64.21 63.33 1aje n SER 124 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1aje n THR 125 N -4.19 1.60 0.00 6.66 -2.24 -1.16 -3.77 114.28 111.19 1aje n THR 125 Ca 0.27 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1aje n THR 125 Cb 1.00 -1.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 1aje n THR 125 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1aje n ILE 126 N -3.22 0.00 -0.08 2.28 -0.00 0.72 -1.61 119.36 117.45 1aje n ILE 126 Ca -0.33 1.04 0.24 0.00 -0.00 0.00 0.00 62.75 63.70 1aje n ILE 126 Cb 1.05 -1.92 0.71 0.00 -0.00 0.00 0.00 39.64 39.48 1aje n ILE 126 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.55 177.60 1aje h GLU 127 N 0.00 0.00 -0.83 0.38 -0.00 -1.65 0.34 114.58 112.82 1aje h GLU 127 Ca 0.00 0.00 0.20 0.00 -0.00 0.00 0.00 59.36 59.56 1aje h GLU 127 Cb 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 28.75 28.63 1aje h GLU 127 CO 0.00 0.00 0.27 -0.22 -0.00 0.00 0.00 179.01 179.06 1aje h LYS 128 N 0.00 0.30 0.00 1.06 1.63 -1.54 -3.41 116.57 114.61 1aje h LYS 128 Ca 0.33 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.11 1aje h LYS 128 Cb 1.32 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.88 1aje h LYS 128 CO -0.00 0.20 0.00 1.28 -3.45 0.00 0.00 179.45 177.48 1aje n LEU 129 N -5.13 -0.02 0.00 5.20 4.77 0.87 -4.99 117.00 117.70 1aje n LEU 129 Ca 0.18 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1aje n LEU 129 Cb 0.57 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 1aje n LEU 129 CO 0.11 -0.53 0.00 0.00 -1.33 0.00 0.00 177.39 175.65 1aje n ALA 130 N -2.60 0.00 0.20 -1.18 0.00 0.57 -4.64 120.51 112.87 1aje n ALA 130 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 1aje n ALA 130 Cb 0.00 -1.03 0.26 0.00 0.00 0.00 0.00 19.45 18.67 1aje n ALA 130 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1aje h LYS 131 N 0.00 0.00 -0.16 0.00 1.79 -1.94 -3.03 116.57 113.23 1aje h LYS 131 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1aje h LYS 131 Cb 0.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1aje h LYS 131 CO 0.00 0.25 0.00 0.09 -1.08 0.00 0.00 179.45 178.71 1aje n ASN 132 N -3.24 2.84 -3.56 0.86 3.02 -1.26 -4.93 115.26 109.00 1aje n ASN 132 Ca 0.02 -2.56 -0.26 0.00 -0.03 0.00 0.00 54.58 51.75 1aje n ASN 132 Cb 0.55 -0.32 0.04 0.00 -0.61 0.00 0.00 39.78 39.44 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 -0.49 -5.75 0.00 3.52 4.76 -1.15 -4.84 118.16 114.21 1aje n LYS 133 Ca 0.13 0.71 0.00 0.00 -2.87 0.00 0.00 58.31 56.28 1aje n LYS 133 Cb 0.57 -5.62 0.00 0.00 -1.84 0.00 0.00 35.03 28.15 1aje n LYS 133 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1aje n GLN 134 N -4.50 0.00 -0.64 1.97 3.00 -1.26 -4.95 117.38 111.00 1aje n GLN 134 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 1aje n GLN 134 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.80 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 -1.72 -1.20 -1.09 4.76 -1.26 -4.57 118.16 113.08 1aje n LYS 135 Ca 0.00 1.32 -0.33 0.00 -2.87 0.00 0.00 58.31 56.43 1aje n LYS 135 Cb 0.00 -1.60 0.11 0.00 -1.84 0.00 0.00 35.03 31.71 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 -4.71 1.84 -0.40 1.97 0.04 -1.26 -3.73 135.00 128.75 1aje s PRO 136 Ca 0.00 1.61 -0.39 0.00 0.04 0.00 0.00 61.00 62.26 1aje s PRO 136 Cb 0.00 -1.81 -0.14 0.00 0.04 0.00 0.00 34.50 32.58 1aje s PRO 136 CO 0.00 -2.03 2.13 -0.89 0.04 0.00 0.00 177.00 176.25 1aje n ILE 137 N -3.27 0.13 -1.40 0.56 -0.00 -1.24 -4.90 119.36 109.24 1aje n ILE 137 Ca 0.12 -0.15 -0.30 0.00 -0.00 0.00 0.00 62.75 62.42 1aje n ILE 137 Cb 0.51 -1.19 0.11 0.00 -0.00 0.00 0.00 39.64 39.06 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 6.52 3.00 -0.68 1.39 2.01 -1.26 -4.80 115.64 121.81 1aje s THR 138 Ca 1.12 0.33 0.13 0.00 0.31 0.00 0.00 61.69 63.58 1aje s THR 138 Cb -1.11 -2.95 0.13 0.00 0.01 0.00 0.00 72.50 68.57 1aje s THR 138 CO 0.57 -0.42 1.40 -0.81 -0.69 0.00 0.00 174.62 174.66 1aje n PRO 139 N -3.58 0.07 -0.00 4.92 -0.04 -1.26 -0.82 135.00 134.28 1aje n PRO 139 Ca 0.07 0.48 0.10 0.00 -0.04 0.00 0.00 63.50 64.11 1aje n PRO 139 Cb 0.55 -1.69 -0.14 0.00 -0.04 0.00 0.00 33.50 32.18 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 -1.84 0.29 0.00 0.54 1.02 -1.26 -3.87 120.64 115.52 1aje n GLU 140 Ca 0.01 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 1aje n GLU 140 Cb 0.08 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 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 -1.78 0.00 0.13 2.62 -1.04 -0.00 -2.86 114.28 111.34 1aje n THR 141 Ca 0.01 0.60 -0.13 0.00 -2.04 0.00 0.00 64.05 62.48 1aje n THR 141 Cb 0.42 -1.55 -0.06 0.00 -1.82 0.00 0.00 70.33 67.32 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 -0.51 -1.03 2.41 0.00 -1.79 -1.28 119.26 115.06 1aje h ALA 142 Ca 0.00 -0.05 0.27 0.00 0.00 0.00 0.00 54.91 55.13 1aje h ALA 142 Cb 0.00 0.45 -0.12 0.00 0.00 0.00 0.00 17.79 18.13 1aje h ALA 142 CO 0.00 -0.83 0.63 0.93 0.00 0.00 0.00 179.25 179.98 1aje h GLU 143 N -0.52 0.45 -0.70 0.00 5.08 -1.76 0.58 114.58 117.70 1aje h GLU 143 Ca 0.02 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1aje h GLU 143 Cb 0.54 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 1aje h GLU 143 CO -0.14 0.30 0.44 -0.22 -1.00 0.00 0.00 179.01 178.38 1aje h LYS 144 N 0.46 0.94 0.00 2.33 3.64 -1.09 -2.30 116.57 120.55 1aje h LYS 144 Ca 0.65 -0.08 -0.27 0.00 -1.27 0.00 0.00 60.65 59.68 1aje h LYS 144 Cb 1.45 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 33.02 1aje h LYS 144 CO -0.43 0.66 -1.51 1.37 -2.27 0.00 0.00 179.45 177.27 1aje h LEU 145 N 0.95 0.00 -2.47 5.20 8.10 -0.15 -3.21 115.31 123.73 1aje h LEU 145 Ca 0.25 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 58.24 1aje h LEU 145 Cb -0.06 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.16 1aje h LEU 145 CO -0.05 1.00 -0.01 0.00 -4.11 0.00 0.00 178.44 175.27 1aje h ALA 146 N 1.00 1.50 0.00 0.17 0.00 0.06 2.09 119.26 124.09 1aje h ALA 146 Ca -0.21 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 1aje h ALA 146 Cb 1.94 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.72 1aje h ALA 146 CO 0.09 0.01 -0.55 0.00 0.00 0.00 0.00 179.25 178.80 1aje h ARG 147 N 0.00 0.00 0.00 0.00 3.08 -1.45 1.66 114.38 117.67 1aje h ARG 147 Ca -0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 1aje h ARG 147 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1aje h ARG 147 CO 0.00 0.55 -0.18 -0.44 -1.07 0.00 0.00 179.97 178.84 1aje h ASP 148 N 0.00 0.00 0.00 7.04 5.19 0.33 -3.34 116.42 125.65 1aje h ASP 148 Ca -0.01 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.19 1aje h ASP 148 Cb 1.07 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.55 1aje h ASP 148 CO 0.07 0.18 -1.80 0.18 -3.12 0.00 0.00 179.24 174.75 1aje n LEU 149 N -3.18 2.09 -2.68 1.55 4.77 -0.20 -5.02 117.00 114.33 1aje n LEU 149 Ca 0.02 -0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 1aje n LEU 149 Cb 0.55 -0.27 0.06 0.00 -2.33 0.00 0.00 43.42 41.43 1aje n LEU 149 CO 0.35 0.60 0.08 0.29 -1.33 0.00 0.00 177.39 177.38 1aje n LYS 150 N -2.77 -4.62 0.00 3.23 4.76 0.56 -5.00 118.16 114.33 1aje n LYS 150 Ca -0.23 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 55.80 1aje n LYS 150 Cb 0.80 -4.84 0.00 0.00 -1.84 0.00 0.00 35.03 29.15 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 -3.20 0.00 0.03 7.82 0.00 -1.25 -4.92 120.51 119.00 1aje n ALA 151 Ca -0.20 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.03 1aje n ALA 151 Cb 0.62 0.00 -0.14 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 -1.15 0.77 -1.75 0.00 2.07 0.81 -3.46 116.25 113.55 1aje h VAL 152 Ca 0.00 -2.44 0.02 0.00 0.82 0.00 0.00 66.70 65.11 1aje h VAL 152 Cb 0.00 2.62 -0.23 0.00 -1.52 0.00 0.00 31.29 32.16 1aje h VAL 152 CO 0.00 0.87 0.37 -0.75 0.02 0.00 0.00 177.57 178.08 1aje s LYS 153 N -2.57 0.71 -0.14 1.57 2.47 -1.06 -5.00 119.74 115.72 1aje s LYS 153 Ca -0.19 0.47 0.01 0.00 -1.56 0.00 0.00 55.97 54.70 1aje s LYS 153 Cb 0.06 0.34 0.02 0.00 -1.46 0.00 0.00 37.83 36.79 1aje s LYS 153 CO 0.81 -0.16 -0.16 -0.47 0.16 0.00 0.00 175.35 175.53 1aje s TYR 154 N -0.43 2.23 0.31 4.03 5.04 -1.25 -1.05 117.35 126.23 1aje s TYR 154 Ca -0.02 -1.19 0.05 0.00 -2.44 0.00 0.00 57.07 53.47 1aje s TYR 154 Cb -0.03 -1.60 -0.03 0.00 0.35 0.00 0.00 41.96 40.65 1aje s TYR 154 CO 0.01 -0.62 0.27 0.14 -1.34 0.00 0.00 175.55 174.01 1aje s VAL 155 N 1.26 0.00 0.27 3.14 -7.23 -0.96 -4.98 120.40 111.90 1aje s VAL 155 Ca 0.00 -1.96 0.09 0.00 -1.81 0.00 0.00 61.98 58.30 1aje s VAL 155 Cb -0.14 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.24 1aje s VAL 155 CO -0.07 0.00 -0.13 -1.61 -0.31 0.00 0.00 175.10 172.98 1aje s GLU 156 N -3.52 1.57 0.00 4.82 2.02 -1.26 -2.11 118.70 120.22 1aje s GLU 156 Ca 0.40 -1.76 0.00 0.00 0.02 0.00 0.00 54.97 53.63 1aje s GLU 156 Cb 0.03 -1.40 0.00 0.00 0.10 0.00 0.00 34.13 32.85 1aje s GLU 156 CO 0.25 0.17 0.00 0.00 0.02 0.00 0.00 175.26 175.70 1aje n SER 158 N 0.00 6.03 0.00 0.00 3.41 -1.25 -3.80 113.62 118.01 1aje n SER 158 Ca 0.00 -2.87 0.00 0.00 -0.26 0.00 0.00 58.87 55.74 1aje n SER 158 Cb 0.00 -1.19 0.00 0.00 -0.26 0.00 0.00 64.21 62.76 1aje n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aje n ALA 159 N 1.14 0.00 -0.01 7.33 0.00 -1.20 -3.65 120.51 124.11 1aje n ALA 159 Ca 0.33 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.78 1aje n ALA 159 Cb 0.63 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.95 1aje n ALA 159 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 160 N 0.00 0.34 0.44 0.00 -0.00 -1.26 -4.51 117.00 112.01 1aje n LEU 160 Ca 0.00 0.14 -0.18 0.00 -0.00 0.00 0.00 56.01 55.97 1aje n LEU 160 Cb 0.00 0.16 -0.09 0.00 -0.00 0.00 0.00 43.42 43.49 1aje n LEU 160 CO 0.00 0.17 0.53 0.74 -0.00 0.00 0.00 177.39 178.84 1aje h THR 161 N 0.00 0.00 -2.16 1.47 2.02 -1.92 -3.48 112.91 108.84 1aje h THR 161 Ca -0.21 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.97 1aje h THR 161 Cb 1.54 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 1aje h THR 161 CO 0.02 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.91 1aje n GLN 162 N -5.23 0.00 -0.00 6.66 3.00 -1.26 -4.98 117.38 115.57 1aje n GLN 162 Ca -0.14 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 56.89 1aje n GLN 162 Cb 0.46 -1.62 -0.05 0.00 0.00 0.00 0.00 30.24 29.03 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 -1.08 4.11 0.00 -1.09 2.85 -1.26 -4.89 118.16 116.80 1aje n LYS 163 Ca 0.00 -0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1aje n LYS 163 Cb 0.42 -0.90 0.00 0.00 -0.65 0.00 0.00 35.03 33.90 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 1.22 0.00 0.08 2.58 0.00 -0.80 -4.78 105.19 103.50 1aje n GLY 164 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.17 1aje n GLY 164 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1aje n LEU 165 N 0.00 0.63 0.07 0.99 -0.00 -1.25 0.24 117.00 117.68 1aje n LEU 165 Ca 0.00 0.56 0.12 0.00 -0.00 0.00 0.00 56.01 56.69 1aje n LEU 165 Cb 0.00 -0.36 0.04 0.00 -0.00 0.00 0.00 43.42 43.10 1aje n LEU 165 CO 0.00 -0.15 0.07 1.17 -0.00 0.00 0.00 177.39 178.48 1aje n LYS 166 N -2.09 0.45 0.04 1.47 4.81 -1.26 -2.39 118.16 119.19 1aje n LYS 166 Ca 0.06 0.07 -0.22 0.00 -0.87 0.00 0.00 58.31 57.34 1aje n LYS 166 Cb 0.41 -1.72 -0.14 0.00 0.02 0.00 0.00 35.03 33.59 1aje n LYS 166 CO 0.00 0.00 0.00 -2.95 1.17 0.00 0.00 177.40 175.62 1aje h ASN 167 N 0.00 0.50 -0.40 3.14 7.08 -1.77 -2.93 115.58 121.20 1aje h ASN 167 Ca 0.00 -0.92 0.07 0.00 -3.08 0.00 0.00 56.30 52.37 1aje h ASN 167 Cb 0.87 -0.16 -0.06 0.00 -2.08 0.00 0.00 38.32 36.88 1aje h ASN 167 CO 0.00 1.79 0.01 1.62 -2.08 0.00 0.00 177.43 178.77 1aje h VAL 168 N 0.01 0.71 -0.61 6.14 3.04 -0.29 0.60 116.25 125.85 1aje h VAL 168 Ca -0.37 -0.04 0.13 0.00 -1.01 0.00 0.00 66.70 65.41 1aje h VAL 168 Cb 2.01 0.58 -0.11 0.00 -2.01 0.00 0.00 31.29 31.76 1aje h VAL 168 CO 0.12 0.02 -0.04 -0.26 -1.01 0.00 0.00 177.57 176.40 1aje h PHE 169 N 0.12 -0.12 -0.48 3.17 0.04 -1.51 3.16 116.94 121.32 1aje h PHE 169 Ca 0.20 0.05 0.05 0.00 2.80 0.00 0.00 57.97 61.07 1aje h PHE 169 Cb 0.28 0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.55 1aje h PHE 169 CO -0.26 -0.19 0.32 -0.44 -0.60 0.00 0.00 178.31 177.14 1aje h ASP 170 N 0.08 0.39 0.29 2.17 3.32 0.14 0.18 116.42 123.00 1aje h ASP 170 Ca 0.32 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 1aje h ASP 170 Cb 0.51 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1aje h ASP 170 CO -0.56 0.26 -0.14 -0.33 -1.72 0.00 0.00 179.24 176.76 1aje h GLU 171 N 0.45 -0.38 -1.14 3.56 4.39 0.92 0.11 114.58 122.49 1aje h GLU 171 Ca 0.20 0.03 0.33 0.00 0.34 0.00 0.00 59.36 60.26 1aje h GLU 171 Cb 0.24 0.09 -0.10 0.00 -0.10 0.00 0.00 28.75 28.87 1aje h GLU 171 CO -0.05 -0.25 0.74 0.00 -1.16 0.00 0.00 179.01 178.29 1aje h ALA 172 N -1.11 2.45 0.22 3.43 0.00 0.36 2.33 119.26 126.94 1aje h ALA 172 Ca -0.04 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1aje h ALA 172 Cb 0.30 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1aje h ALA 172 CO 0.07 -0.93 -0.10 0.82 0.00 0.00 0.00 179.25 179.10 1aje h ILE 173 N 0.27 0.23 0.00 0.00 5.03 -0.98 0.22 117.51 122.28 1aje h ILE 173 Ca 0.67 -0.90 0.00 0.00 -0.12 0.00 0.00 64.86 64.51 1aje h ILE 173 Cb 1.91 0.40 0.00 0.00 -3.03 0.00 0.00 36.82 36.10 1aje h ILE 173 CO -0.32 0.06 0.00 0.17 -0.68 0.00 0.00 178.15 177.38 1aje h LEU 174 N -1.04 0.00 0.00 1.44 -0.00 0.38 1.32 115.31 117.41 1aje h LEU 174 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.85 1aje h LEU 174 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.99 1aje h LEU 174 CO 0.05 0.00 -0.82 0.00 -0.00 0.00 0.00 178.44 177.67 1aje n ALA 175 N -1.85 2.90 -0.26 0.17 0.00 0.78 -3.88 120.51 118.36 1aje n ALA 175 Ca -0.01 -0.27 0.03 0.00 0.00 0.00 0.00 53.44 53.19 1aje n ALA 175 Cb 0.09 -1.11 0.06 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.93 2.12 0.15 0.00 0.00 0.39 -3.95 120.51 117.29 1aje n ALA 176 Ca 0.02 -1.37 0.02 0.00 0.00 0.00 0.00 53.44 52.10 1aje n ALA 176 Cb 0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 19.45 19.73 1aje n ALA 176 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 177 N -0.51 0.15 0.00 0.00 -0.00 0.23 -4.45 117.00 112.43 1aje n LEU 177 Ca 0.06 -0.49 0.00 0.00 -0.00 0.00 0.00 56.01 55.58 1aje n LEU 177 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.80 1aje n LEU 177 CO 0.02 0.04 0.00 1.21 -0.00 0.00 0.00 177.39 178.66 1aje n GLU 178 N -1.09 0.00 -1.98 1.47 2.13 -1.25 -4.93 120.64 114.99 1aje n GLU 178 Ca 0.01 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.40 1aje n GLU 178 Cb 0.05 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.73 1aje n GLU 178 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1aje s PRO 179 N 0.00 3.34 0.32 5.31 0.04 -1.26 -4.91 135.00 137.83 1aje s PRO 179 Ca 0.00 1.47 -0.28 0.00 0.04 0.00 0.00 61.00 62.23 1aje s PRO 179 Cb 0.00 -4.20 -0.10 0.00 0.04 0.00 0.00 34.50 30.24 1aje s PRO 179 CO 0.00 -1.86 1.18 -1.25 0.04 0.00 0.00 177.00 175.12 1aje s PRO 180 N 5.67 4.42 -0.31 0.56 0.04 -1.26 -4.98 135.00 139.14 1aje s PRO 180 Ca 0.81 1.95 0.11 0.00 0.04 0.00 0.00 61.00 63.90 1aje s PRO 180 Cb -0.23 -3.03 0.46 0.00 0.04 0.00 0.00 34.50 31.74 1aje s PRO 180 CO 0.34 -0.04 1.14 -0.85 0.04 0.00 0.00 177.00 177.63 1aje n GLU 181 N 0.81 3.03 -1.08 4.56 0.28 -1.26 -4.94 120.64 122.04 1aje n GLU 181 Ca 0.00 -4.04 -0.33 0.00 -0.16 0.00 0.00 57.16 52.64 1aje n GLU 181 Cb 0.44 -2.07 -0.03 0.00 1.43 0.00 0.00 31.44 31.22 1aje n GLU 181 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 1aje n PRO 182 N -0.60 2.45 -1.51 3.44 -0.04 -1.26 -4.93 135.00 132.55 1aje n PRO 182 Ca 0.33 -1.85 -0.37 0.00 -0.04 0.00 0.00 63.50 61.57 1aje n PRO 182 Cb 0.87 -2.73 0.06 0.00 -0.04 0.00 0.00 33.50 31.66 1aje n PRO 182 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1aje n LYS 183 N 4.83 0.70 -3.83 0.54 -0.00 -1.26 -5.01 118.16 114.13 1aje n LYS 183 Ca 0.55 0.29 -0.07 0.00 -0.00 0.00 0.00 58.31 59.07 1aje n LYS 183 Cb 0.24 -2.13 0.01 0.00 -0.00 0.00 0.00 35.03 33.14 1aje n LYS 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1aje s LYS 184 N -2.91 1.90 0.90 -1.58 -2.85 -1.26 -5.15 119.74 108.78 1aje s LYS 184 Ca 0.75 -1.18 -0.11 0.00 -1.00 0.00 0.00 55.97 54.43 1aje s LYS 184 Cb -0.39 0.57 0.13 0.00 -2.06 0.00 0.00 37.83 36.08 1aje s LYS 184 CO 0.49 -0.89 1.16 -1.54 0.10 0.00 0.00 175.35 174.67 1aje s SER 185 N -3.07 3.03 -0.86 0.03 1.04 -1.26 -4.94 113.70 107.68 1aje s SER 185 Ca 0.15 2.22 0.01 0.00 0.48 0.00 0.00 55.95 58.81 1aje s SER 185 Cb -0.05 -2.57 0.30 0.00 0.10 0.00 0.00 66.02 63.81 1aje s SER 185 CO 0.09 -3.03 1.29 -2.11 0.98 0.00 0.00 173.24 170.45 1aje n ARG 186 N -4.08 4.02 0.00 4.02 1.85 -1.26 -5.30 116.66 115.91 1aje n ARG 186 Ca 0.12 -4.68 0.13 0.00 -1.00 0.00 0.00 57.85 52.42 1aje n ARG 186 Cb 0.52 -2.38 0.33 0.00 -1.05 0.00 0.00 32.46 29.88 1aje n ARG 186 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49