#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aje s SER -6 N 0.00 0.10 -0.62 1.61 1.04 -1.26 -5.11 113.70 109.46 1aje s SER -6 Ca 0.00 -0.68 -0.20 0.00 0.48 0.00 0.00 55.95 55.55 1aje s SER -6 Cb 0.00 0.36 0.09 0.00 0.10 0.00 0.00 66.02 66.57 1aje s SER -6 CO 0.00 -0.75 0.81 -1.59 0.98 0.00 0.00 173.24 172.68 1aje s LYS -5 N -3.88 3.08 -0.78 4.02 -2.85 -1.26 -4.99 119.74 113.08 1aje s LYS -5 Ca 0.07 -1.16 -0.25 0.00 -1.00 0.00 0.00 55.97 53.63 1aje s LYS -5 Cb 0.05 -4.26 0.05 0.00 -2.06 0.00 0.00 37.83 31.60 1aje s LYS -5 CO -0.09 -1.65 1.24 -1.50 0.10 0.00 0.00 175.35 173.45 1aje s ILE -4 N 3.18 3.91 1.11 3.79 1.10 -1.26 -5.00 121.20 128.03 1aje s ILE -4 Ca 0.16 -0.02 -0.16 0.00 -0.51 0.00 0.00 60.65 60.12 1aje s ILE -4 Cb -0.21 -4.89 0.24 0.00 0.15 0.00 0.00 42.46 37.75 1aje s ILE -4 CO 0.07 -1.79 1.10 -0.63 -2.11 0.00 0.00 174.94 171.59 1aje s ILE -3 N 5.17 1.79 0.66 2.00 1.09 -1.26 -5.04 121.20 125.62 1aje s ILE -3 Ca 0.34 0.00 -0.05 0.00 -1.10 0.00 0.00 60.65 59.85 1aje s ILE -3 Cb -0.08 -2.49 0.05 0.00 -1.06 0.00 0.00 42.46 38.88 1aje s ILE -3 CO 0.09 0.00 0.95 -0.44 -0.10 0.00 0.00 174.94 175.44 1aje s SER -2 N -3.69 4.99 0.00 3.58 0.01 -1.26 -5.11 113.70 112.22 1aje s SER -2 Ca 0.68 0.38 0.00 0.00 1.31 0.00 0.00 55.95 58.32 1aje s SER -2 Cb -0.14 -1.11 0.00 0.00 0.21 0.00 0.00 66.02 64.98 1aje s SER -2 CO 0.57 -1.45 0.00 0.00 0.41 0.00 0.00 173.24 172.77 1aje n ALA -1 N -2.76 0.00 -0.80 1.44 0.00 -1.26 -4.78 120.51 112.34 1aje n ALA -1 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.20 1aje n ALA -1 Cb 0.60 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 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 0.00 0.02 0.12 0.00 0.00 -1.03 -4.58 117.12 111.65 1aje n MET 1 Ca 0.00 -0.98 0.07 0.00 0.00 0.00 0.00 57.70 56.79 1aje n MET 1 Cb 0.00 -2.55 0.40 0.00 0.00 0.00 0.00 33.22 31.07 1aje n MET 1 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1aje n GLN 2 N 7.33 0.10 -2.30 3.17 6.02 -1.23 -4.75 117.38 125.72 1aje n GLN 2 Ca 0.38 0.58 0.00 0.00 -0.01 0.00 0.00 57.00 57.95 1aje n GLN 2 Cb 0.41 -1.89 0.00 0.00 1.02 0.00 0.00 30.24 29.79 1aje n GLN 2 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1aje n THR 3 N -2.02-13.58 -3.99 5.09 -1.04 -1.26 -4.91 114.28 92.58 1aje n THR 3 Ca -0.01 3.28 -0.31 0.00 -2.04 0.00 0.00 64.05 64.97 1aje n THR 3 Cb 0.09 -5.97 -0.15 0.00 -1.82 0.00 0.00 70.33 62.49 1aje n THR 3 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1aje s ILE 4 N -0.58 1.83 -0.32 12.58 1.09 0.59 -4.84 121.20 131.55 1aje s ILE 4 Ca 0.00 -1.56 -0.25 0.00 -1.10 0.00 0.00 60.65 57.74 1aje s ILE 4 Cb 0.00 -2.10 0.01 0.00 -1.06 0.00 0.00 42.46 39.31 1aje s ILE 4 CO 0.00 -0.19 0.89 -0.75 -0.10 0.00 0.00 174.94 174.79 1aje s LYS 5 N 1.23 3.97 -0.11 2.79 2.47 -1.26 0.36 119.74 129.19 1aje s LYS 5 Ca -0.03 0.72 -0.04 0.00 -1.56 0.00 0.00 55.97 55.05 1aje s LYS 5 Cb -0.19 -3.74 -0.04 0.00 -1.46 0.00 0.00 37.83 32.40 1aje s LYS 5 CO -0.07 -0.78 0.05 0.00 0.16 0.00 0.00 175.35 174.71 1aje s VAL 7 N -0.70 3.35 0.49 0.00 1.01 0.84 -0.05 120.40 125.34 1aje s VAL 7 Ca 0.12 -1.80 -0.19 0.00 0.00 0.00 0.00 61.98 60.11 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 -0.52 0.99 -0.69 0.00 0.00 0.00 175.10 174.90 1aje s VAL 8 N 1.21 4.28 0.09 2.92 1.01 -0.92 -1.41 120.40 127.59 1aje s VAL 8 Ca 0.04 1.25 0.02 0.00 0.00 0.00 0.00 61.98 63.30 1aje s VAL 8 Cb -0.22 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1aje s VAL 8 CO -0.03 -0.47 -0.07 0.68 0.00 0.00 0.00 175.10 175.21 1aje s VAL 9 N -2.35 0.72 0.00 2.92 -7.23 -0.48 -4.60 120.40 109.36 1aje s VAL 9 Ca 0.62 -1.78 0.00 0.00 -1.81 0.00 0.00 61.98 59.01 1aje s VAL 9 Cb -0.11 -1.49 0.00 0.00 0.56 0.00 0.00 36.38 35.34 1aje s VAL 9 CO 0.24 -0.76 0.00 0.61 -0.31 0.00 0.00 175.10 174.88 1aje n GLY 10 N 0.24 -1.31 0.00 2.32 0.00 -1.26 -2.99 105.19 102.20 1aje n GLY 10 Ca -0.14 -1.59 0.04 0.00 0.00 0.00 0.00 46.02 44.33 1aje n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1aje n ASP 11 N -1.82 2.91 -1.09 1.61 8.00 -1.26 -4.90 116.55 120.00 1aje n ASP 11 Ca 0.00 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.47 1aje n ASP 11 Cb 0.00 1.38 0.00 0.00 -0.02 0.00 0.00 41.12 42.48 1aje n ASP 11 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aje n GLY 12 N 1.98 -4.18 0.14 0.44 0.00 -1.26 -4.31 105.19 97.99 1aje n GLY 12 Ca -0.01 -0.79 0.04 0.00 0.00 0.00 0.00 46.02 45.25 1aje n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aje n ALA 13 N -0.64 0.15 0.00 4.61 0.00 -1.26 -4.00 120.51 119.37 1aje n ALA 13 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1aje n ALA 13 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.17 1aje n ALA 13 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1aje n VAL 14 N -4.52 0.00 -3.38 0.00 3.14 -1.26 -5.09 118.33 107.21 1aje n VAL 14 Ca 0.08 0.00 -0.27 0.00 -2.96 0.00 0.00 64.34 61.19 1aje n VAL 14 Cb 0.25 0.00 -0.10 0.00 -1.06 0.00 0.00 33.84 32.93 1aje n VAL 14 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1aje n GLY 15 N 0.00 2.27 0.52 7.55 0.00 -1.26 -4.91 105.19 109.36 1aje n GLY 15 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1aje n GLY 15 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1aje n LYS 16 N 2.65 0.00 -0.08 1.61 4.81 -1.26 -3.36 118.16 122.53 1aje n LYS 16 Ca 0.29 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.67 1aje n LYS 16 Cb 0.48 -0.67 -0.04 0.00 0.02 0.00 0.00 35.03 34.82 1aje n LYS 16 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1aje h THR 17 N 0.00 0.00 -0.72 3.15 2.02 -1.92 0.38 112.91 115.82 1aje h THR 17 Ca 0.00 0.00 0.30 0.00 0.77 0.00 0.00 66.41 67.48 1aje h THR 17 Cb 0.75 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 67.03 1aje h THR 17 CO 0.00 0.00 0.38 0.00 0.37 0.00 0.00 175.52 176.27 1aje h LEU 19 N 0.00 -0.19 -0.97 0.00 7.12 -1.20 -2.70 115.31 117.36 1aje h LEU 19 Ca 0.61 0.01 0.18 0.00 0.13 0.00 0.00 57.88 58.81 1aje h LEU 19 Cb 1.60 0.05 -0.18 0.00 -0.53 0.00 0.00 40.66 41.60 1aje h LEU 19 CO -0.56 -0.13 -0.28 -0.07 -0.13 0.00 0.00 178.44 177.27 1aje h LEU 20 N -0.22 -1.04 -0.95 2.25 4.07 -0.29 0.74 115.31 119.87 1aje h LEU 20 Ca -0.02 0.30 0.27 0.00 0.08 0.00 0.00 57.88 58.50 1aje h LEU 20 Cb 0.17 0.64 -0.17 0.00 1.08 0.00 0.00 40.66 42.38 1aje h LEU 20 CO 0.03 -0.31 0.12 0.40 -1.08 0.00 0.00 178.44 177.60 1aje h ILE 21 N -0.00 0.11 -0.17 1.22 1.08 -1.10 0.38 117.51 119.03 1aje h ILE 21 Ca 0.43 -0.02 -0.13 0.00 -0.39 0.00 0.00 64.86 64.75 1aje h ILE 21 Cb 0.68 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.48 1aje h ILE 21 CO -1.00 0.01 -0.41 -1.28 -0.69 0.00 0.00 178.15 174.78 1aje h SER 22 N 0.06 0.67 -0.97 1.72 0.87 0.79 2.91 113.55 119.60 1aje h SER 22 Ca 0.60 -0.57 0.28 0.00 -1.23 0.00 0.00 61.79 60.87 1aje h SER 22 Cb 1.26 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.99 1aje h SER 22 CO -0.83 1.11 0.97 0.10 -0.53 0.00 0.00 176.83 177.66 1aje h TYR 23 N 0.25 0.00 0.00 2.24 -0.00 0.52 0.45 116.97 120.43 1aje h TYR 23 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1aje h TYR 23 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.75 1aje h TYR 23 CO 0.10 0.00 -0.45 2.41 -0.00 0.00 0.00 178.16 180.21 1aje n THR 24 N -3.55 0.00 0.40 -0.90 -1.04 -1.05 -4.83 114.28 103.30 1aje n THR 24 Ca 0.21 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.26 1aje n THR 24 Cb 1.28 -0.29 -0.03 0.00 -1.82 0.00 0.00 70.33 69.48 1aje n THR 24 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1aje n THR 25 N -1.06 0.00 -1.60 12.58 -2.24 0.96 -4.96 114.28 117.97 1aje n THR 25 Ca 0.00 -0.35 -0.08 0.00 -2.27 0.00 0.00 64.05 61.35 1aje n THR 25 Cb 0.17 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.42 1aje n THR 25 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1aje n ASN 26 N -0.79 -2.45 -3.38 3.42 4.13 0.13 -4.81 115.26 111.51 1aje n ASN 26 Ca 0.03 0.23 -0.20 0.00 1.68 0.00 0.00 54.58 56.32 1aje n ASN 26 Cb 0.16 -2.36 -0.09 0.00 -1.54 0.00 0.00 39.78 35.95 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 -3.39 0.63 0.00 3.52 2.20 -1.25 -4.67 119.74 116.77 1aje s LYS 27 Ca 0.00 -1.01 0.00 0.00 -0.36 0.00 0.00 55.97 54.60 1aje s LYS 27 Cb 0.00 -0.87 0.00 0.00 -1.51 0.00 0.00 37.83 35.45 1aje s LYS 27 CO 0.00 -1.21 0.00 1.97 -0.36 0.00 0.00 175.35 175.75 1aje n PHE 28 N 4.15 -1.73 0.00 4.03 -1.74 -1.26 -4.66 117.46 116.25 1aje n PHE 28 Ca 0.12 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.01 1aje n PHE 28 Cb 0.43 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.43 1aje n PHE 28 CO 0.00 0.00 0.00 -0.35 -0.56 0.00 0.00 176.76 175.85 1aje n PRO 29 N -1.55 0.00 0.03 3.97 -0.04 -1.26 -2.74 135.00 133.41 1aje n PRO 29 Ca 0.00 0.00 0.21 0.00 -0.04 0.00 0.00 63.50 63.67 1aje n PRO 29 Cb 0.00 -1.34 0.73 0.00 -0.04 0.00 0.00 33.50 32.85 1aje n PRO 29 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1aje h SER 30 N 0.00 0.00 -0.86 3.54 4.64 -2.00 -2.86 113.55 116.01 1aje h SER 30 Ca 0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 1aje h SER 30 Cb 0.00 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 61.79 1aje h SER 30 CO 0.00 0.00 -0.87 -0.62 -0.87 0.00 0.00 176.83 174.47 1aje n GLU 31 N -3.99 1.08 -3.54 4.77 1.02 -1.11 -5.12 120.64 113.75 1aje n GLU 31 Ca 0.10 -2.72 -0.11 0.00 -0.02 0.00 0.00 57.16 54.41 1aje n GLU 31 Cb 0.66 -1.07 -0.02 0.00 -0.02 0.00 0.00 31.44 31.00 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 -0.00 -1.48 0.00 -0.32 4.01 -1.08 -4.96 117.16 113.32 1aje n TYR 32 Ca 0.10 -1.89 0.00 0.00 -0.16 0.00 0.00 57.90 55.95 1aje n TYR 32 Cb 0.76 0.53 0.00 0.00 -0.31 0.00 0.00 39.34 40.32 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 -0.48 0.00 1.28 -0.72 0.24 -1.26 -4.82 118.33 112.57 1aje n VAL 33 Ca -0.01 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.40 1aje n VAL 33 Cb 0.50 0.00 0.62 0.00 -1.47 0.00 0.00 33.84 33.48 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 -1.54 0.60 -0.69 7.34 -0.04 -1.26 -4.75 135.00 134.65 1aje n PRO 34 Ca 0.00 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1aje n PRO 34 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1aje n PRO 34 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1aje n THR 35 N -1.06 0.00 -1.77 0.52 -2.24 -1.26 -5.13 114.28 103.34 1aje n THR 35 Ca 0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1aje n THR 35 Cb 0.09 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 67.29 1aje n THR 35 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1aje n VAL 36 N -0.74 0.00 -3.94 2.28 0.24 -1.26 -5.10 118.33 109.82 1aje n VAL 36 Ca 0.00 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.05 1aje n VAL 36 Cb 0.00 -1.42 -0.17 0.00 -1.47 0.00 0.00 33.84 30.78 1aje n VAL 36 CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 1aje s PHE 37 N 0.57 1.22 0.33 6.34 -0.71 -1.26 -4.99 117.98 119.48 1aje s PHE 37 Ca 0.00 -0.54 -0.12 0.00 -1.04 0.00 0.00 56.93 55.23 1aje s PHE 37 Cb 0.00 -1.07 0.02 0.00 -1.21 0.00 0.00 43.02 40.76 1aje s PHE 37 CO 0.00 -0.43 0.61 0.16 -1.34 0.00 0.00 175.22 174.22 1aje s ASP 38 N 1.65 0.23 0.23 1.98 -4.77 -1.26 -5.18 116.67 109.56 1aje s ASP 38 Ca 0.03 -1.13 0.10 0.00 -3.30 0.00 0.00 52.55 48.24 1aje s ASP 38 Cb -0.13 0.72 -0.04 0.00 -1.09 0.00 0.00 42.92 42.37 1aje s ASP 38 CO -0.06 -1.40 -0.08 0.20 0.70 0.00 0.00 175.17 174.53 1aje s ASN 39 N -3.09 4.22 0.26 2.11 0.02 -1.26 -5.08 114.94 112.11 1aje s ASN 39 Ca 0.21 -0.70 -0.19 0.00 -1.02 0.00 0.00 52.86 51.16 1aje s ASN 39 Cb -0.03 -0.68 0.02 0.00 0.02 0.00 0.00 41.25 40.59 1aje s ASN 39 CO 0.13 0.05 0.64 -0.72 0.02 0.00 0.00 177.10 177.22 1aje s TYR 40 N -2.10 -0.09 -0.22 2.20 1.13 -1.26 -4.99 117.35 112.02 1aje s TYR 40 Ca 0.28 -0.32 0.01 0.00 -1.41 0.00 0.00 57.07 55.63 1aje s TYR 40 Cb -0.07 0.56 0.05 0.00 -1.10 0.00 0.00 41.96 41.40 1aje s TYR 40 CO 0.17 -1.13 -0.07 0.00 -2.51 0.00 0.00 175.55 172.00 1aje s ALA 41 N -3.93 2.00 0.62 9.51 0.00 -1.25 -2.83 121.76 125.88 1aje s ALA 41 Ca 0.13 -1.31 0.06 0.00 0.00 0.00 0.00 51.96 50.83 1aje s ALA 41 Cb -0.04 -1.38 0.10 0.00 0.00 0.00 0.00 23.12 21.80 1aje s ALA 41 CO 0.05 -1.05 0.86 0.14 0.00 0.00 0.00 175.76 175.76 1aje s VAL 42 N 1.38 2.19 -0.18 0.00 -7.23 -0.96 -4.51 120.40 111.10 1aje s VAL 42 Ca -0.04 -0.85 -0.04 0.00 -1.81 0.00 0.00 61.98 59.24 1aje s VAL 42 Cb -0.18 -2.34 -0.02 0.00 0.56 0.00 0.00 36.38 34.40 1aje s VAL 42 CO -0.07 0.00 -0.03 -0.89 -0.31 0.00 0.00 175.10 173.80 1aje s THR 43 N -2.83 3.77 0.46 5.32 2.01 -1.26 0.96 115.64 124.07 1aje s THR 43 Ca 0.63 -0.39 0.07 0.00 0.31 0.00 0.00 61.69 62.31 1aje s THR 43 Cb -0.06 -2.67 -0.01 0.00 0.01 0.00 0.00 72.50 69.77 1aje s THR 43 CO 0.41 0.46 0.37 0.68 -0.69 0.00 0.00 174.62 175.85 1aje s VAL 44 N 0.72 2.32 -0.23 3.82 -7.23 -0.93 -4.83 120.40 114.03 1aje s VAL 44 Ca -0.02 -1.42 -0.00 0.00 -1.81 0.00 0.00 61.98 58.73 1aje s VAL 44 Cb -0.14 -2.74 0.06 0.00 0.56 0.00 0.00 36.38 34.12 1aje s VAL 44 CO 0.02 0.00 -0.02 -0.04 -0.31 0.00 0.00 175.10 174.75 1aje s MET 45 N -4.16 1.28 -0.09 4.82 -1.94 -1.26 -1.15 119.30 116.81 1aje s MET 45 Ca 0.44 -0.83 -0.27 0.00 -1.71 0.00 0.00 55.69 53.31 1aje s MET 45 Cb -0.02 -2.43 -0.24 0.00 2.01 0.00 0.00 34.83 34.16 1aje s MET 45 CO 0.26 -0.64 0.98 0.82 -0.01 0.00 0.00 175.02 176.43 1aje h ILE 46 N 6.61 1.62 -0.04 2.53 5.03 -1.89 -3.42 117.51 127.95 1aje h ILE 46 Ca -0.17 -1.88 -0.16 0.00 -0.12 0.00 0.00 64.86 62.54 1aje h ILE 46 Cb 1.08 2.89 -0.20 0.00 -3.03 0.00 0.00 36.82 37.56 1aje h ILE 46 CO 0.39 0.49 -0.48 0.61 -0.68 0.00 0.00 178.15 178.48 1aje n GLY 47 N 1.05 1.11 0.00 5.37 0.00 -1.26 -4.91 105.19 106.55 1aje n GLY 47 Ca -0.09 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.38 1.35 3.14 -0.02 0.00 -1.26 -5.10 105.19 102.91 1aje n GLY 48 Ca -0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.27 1.68 0.17 1.61 0.41 -1.26 -5.08 118.70 115.96 1aje s GLU 49 Ca 0.00 -0.60 -0.30 0.00 -0.41 0.00 0.00 54.97 53.66 1aje s GLU 49 Cb 0.00 -1.49 -0.07 0.00 -1.78 0.00 0.00 34.13 30.78 1aje s GLU 49 CO 0.00 0.27 0.94 -1.25 -0.49 0.00 0.00 175.26 174.73 1aje s PRO 50 N -0.06 4.77 -0.29 0.39 0.04 -1.25 -2.68 135.00 135.92 1aje s PRO 50 Ca -0.01 1.45 -0.04 0.00 0.04 0.00 0.00 61.00 62.44 1aje s PRO 50 Cb -0.10 -3.33 0.10 0.00 0.04 0.00 0.00 34.50 31.21 1aje s PRO 50 CO 0.01 0.37 0.13 0.71 0.04 0.00 0.00 177.00 178.27 1aje s TYR 51 N -0.60 0.30 0.68 0.56 1.51 -0.30 -2.45 117.35 117.04 1aje s TYR 51 Ca 0.44 -0.85 -0.17 0.00 -1.01 0.00 0.00 57.07 55.48 1aje s TYR 51 Cb -0.25 -0.88 0.01 0.00 -0.11 0.00 0.00 41.96 40.73 1aje s TYR 51 CO 0.31 -0.82 1.25 0.99 -1.11 0.00 0.00 175.55 176.16 1aje s THR 52 N 2.11 2.19 -0.18 -0.71 2.01 -1.25 -2.19 115.64 117.61 1aje s THR 52 Ca 0.09 0.11 -0.04 0.00 0.31 0.00 0.00 61.69 62.15 1aje s THR 52 Cb -0.16 -2.89 0.06 0.00 0.01 0.00 0.00 72.50 69.52 1aje s THR 52 CO -0.36 -0.04 0.08 -1.48 -0.69 0.00 0.00 174.62 172.14 1aje s LEU 53 N -4.67 0.53 -0.35 4.42 -0.00 0.27 0.22 118.68 119.09 1aje s LEU 53 Ca 0.79 -0.70 -0.08 0.00 -0.00 0.00 0.00 54.13 54.14 1aje s LEU 53 Cb -0.33 -0.32 0.04 0.00 -0.00 0.00 0.00 46.19 45.58 1aje s LEU 53 CO 0.41 -0.35 0.14 -0.83 -0.00 0.00 0.00 176.35 175.73 1aje s GLY 54 N 2.08 1.88 0.10 -3.48 0.00 0.16 -2.27 107.32 105.78 1aje s GLY 54 Ca 0.02 -1.77 0.05 0.00 0.00 0.00 0.00 44.72 43.02 1aje s GLY 54 CO -0.11 0.81 0.03 0.48 0.00 0.00 0.00 173.10 174.31 1aje s LEU 55 N 1.44 3.56 -0.01 0.66 2.34 -1.13 0.26 118.68 125.80 1aje s LEU 55 Ca -0.00 -0.15 0.03 0.00 0.06 0.00 0.00 54.13 54.07 1aje s LEU 55 Cb -0.20 -2.26 -0.00 0.00 -0.56 0.00 0.00 46.19 43.17 1aje s LEU 55 CO 0.04 0.16 -0.09 -0.36 -1.06 0.00 0.00 176.35 175.04 1aje s PHE 56 N -1.39 0.88 0.28 3.48 0.40 0.93 -4.20 117.98 118.36 1aje s PHE 56 Ca 0.27 -0.18 0.06 0.00 -0.60 0.00 0.00 56.93 56.47 1aje s PHE 56 Cb -0.12 -0.59 0.42 0.00 0.51 0.00 0.00 43.02 43.25 1aje s PHE 56 CO 0.20 -0.04 1.68 -0.44 0.70 0.00 0.00 175.22 177.32 1aje h ASP 57 N 6.05 0.29 -4.68 1.36 5.19 -1.86 -2.43 116.42 120.34 1aje h ASP 57 Ca -0.32 -0.12 -0.03 0.00 -0.62 0.00 0.00 57.03 55.94 1aje h ASP 57 Cb 1.18 -0.08 -0.20 0.00 0.18 0.00 0.00 39.33 40.40 1aje h ASP 57 CO 0.49 0.68 0.26 0.28 -3.12 0.00 0.00 179.24 177.84 1aje s THR 58 N -4.14 0.00 0.00 0.35 -1.32 -1.26 -4.52 115.64 104.75 1aje s THR 58 Ca -0.05 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.43 1aje s THR 58 Cb 0.13 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.12 1aje s THR 58 CO 0.78 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 173.19 1aje n ALA 59 N 1.08 0.00 0.00 11.08 0.00 -1.26 -4.94 120.51 126.47 1aje n ALA 59 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1aje n ALA 59 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 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 0.00 0.34 2.74 0.00 0.00 -1.26 -4.89 105.19 102.12 1aje n GLY 60 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1aje n GLY 60 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1aje n GLN 61 N 0.00 -3.41 -0.34 1.61 7.27 -1.26 -4.42 117.38 116.83 1aje n GLN 61 Ca 0.00 2.74 0.08 0.00 0.07 0.00 0.00 57.00 59.89 1aje n GLN 61 Cb 0.00 -5.28 0.17 0.00 2.41 0.00 0.00 30.24 27.54 1aje n GLN 61 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1aje h GLU 62 N 3.06 0.00 -0.96 3.69 5.08 -2.02 0.78 114.58 124.21 1aje h GLU 62 Ca -0.00 -0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.52 1aje h GLU 62 Cb 0.06 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.22 1aje h GLU 62 CO 0.10 0.00 0.61 -0.44 -1.00 0.00 0.00 179.01 178.28 1aje h ASP 63 N 0.00 0.74 -4.91 1.42 5.19 -2.01 -3.44 116.42 113.42 1aje h ASP 63 Ca 0.50 0.06 -0.18 0.00 -0.62 0.00 0.00 57.03 56.79 1aje h ASP 63 Cb 0.84 -0.08 -0.11 0.00 0.18 0.00 0.00 39.33 40.16 1aje h ASP 63 CO -0.97 0.34 -0.26 0.00 -3.12 0.00 0.00 179.24 175.22 1aje n TYR 64 N -4.63 -1.31 -2.30 4.55 4.11 0.27 -4.86 117.16 112.99 1aje n TYR 64 Ca 0.20 0.20 0.00 0.00 -0.00 0.00 0.00 57.90 58.30 1aje n TYR 64 Cb 0.50 -1.02 0.00 0.00 -0.00 0.00 0.00 39.34 38.81 1aje n TYR 64 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.86 176.46 1aje n ASP 65 N -1.37 0.00 0.00 9.48 5.68 -1.26 -5.08 116.55 123.99 1aje n ASP 65 Ca 0.03 -0.56 0.00 0.00 -0.50 0.00 0.00 54.79 53.76 1aje n ASP 65 Cb 0.37 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.35 1aje n ASP 65 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1aje n ARG 66 N -0.56 0.00 -0.10 0.11 1.74 -1.26 -4.96 116.66 111.62 1aje n ARG 66 Ca 0.00 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.13 1aje n ARG 66 Cb 0.00 0.00 0.10 0.00 -1.02 0.00 0.00 32.46 31.54 1aje n ARG 66 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1aje n LEU 67 N -0.68 2.47 -4.92 0.55 4.32 -1.26 -5.01 117.00 112.48 1aje n LEU 67 Ca 0.00 -1.66 -0.24 0.00 -0.02 0.00 0.00 56.01 54.09 1aje n LEU 67 Cb 0.00 -0.13 -0.03 0.00 -1.62 0.00 0.00 43.42 41.64 1aje n LEU 67 CO 0.00 0.58 -0.10 -0.13 -1.22 0.00 0.00 177.39 176.53 1aje s ARG 68 N -0.94 3.32 0.65 3.23 1.81 -1.26 -5.09 118.95 120.67 1aje s ARG 68 Ca 0.17 -0.74 -0.16 0.00 -1.72 0.00 0.00 55.73 53.28 1aje s ARG 68 Cb 0.10 -2.85 -0.01 0.00 -0.45 0.00 0.00 34.95 31.74 1aje s ARG 68 CO 0.13 0.47 1.12 -1.25 -0.68 0.00 0.00 175.30 175.09 1aje s PRO 69 N -3.58 2.85 -0.93 3.54 0.04 -1.26 -4.95 135.00 130.71 1aje s PRO 69 Ca 0.34 1.45 -0.21 0.00 0.04 0.00 0.00 61.00 62.61 1aje s PRO 69 Cb -0.10 -1.95 0.09 0.00 0.04 0.00 0.00 34.50 32.58 1aje s PRO 69 CO 0.28 -1.22 1.25 -0.51 0.04 0.00 0.00 177.00 176.83 1aje s LEU 70 N -4.72 4.29 0.00 -3.56 1.43 -1.26 -4.89 118.68 109.97 1aje s LEU 70 Ca 0.68 -1.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.14 1aje s LEU 70 Cb -0.22 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.53 1aje s LEU 70 CO 0.39 -1.31 0.41 -0.24 0.23 0.00 0.00 176.35 175.84 1aje n SER 71 N 7.72 0.00 0.00 2.29 2.88 -1.26 -4.99 113.62 120.26 1aje n SER 71 Ca 0.24 0.64 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 1aje n SER 71 Cb 0.50 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 1aje n SER 71 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aje n TYR 72 N -1.73 0.00 -2.56 0.66 4.19 -1.26 -5.08 117.16 111.38 1aje n TYR 72 Ca 0.00 0.00 -0.42 0.00 3.31 0.00 0.00 57.90 60.79 1aje n TYR 72 Cb 0.00 0.00 -0.01 0.00 0.49 0.00 0.00 39.34 39.82 1aje n TYR 72 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 1aje s PRO 73 N 0.00 3.87 -0.15 2.98 0.04 -1.26 -4.84 135.00 135.63 1aje s PRO 73 Ca 0.00 -1.81 -0.05 0.00 0.04 0.00 0.00 61.00 59.19 1aje s PRO 73 Cb 0.00 -5.50 -0.13 0.00 0.04 0.00 0.00 34.50 28.91 1aje s PRO 73 CO 0.00 -2.31 3.21 1.04 0.04 0.00 0.00 177.00 178.98 1aje n GLN 74 N 8.49 2.06 0.00 4.56 1.13 -1.26 -4.74 117.38 127.61 1aje n GLN 74 Ca 0.46 -1.38 0.00 0.00 -1.94 0.00 0.00 57.00 54.13 1aje n GLN 74 Cb 0.47 -1.97 0.00 0.00 0.11 0.00 0.00 30.24 28.85 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 1.85 0.00 -2.52 5.09 -2.24 -1.26 -4.61 114.28 110.59 1aje n THR 75 Ca 0.42 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 62.19 1aje n THR 75 Cb 0.77 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 1aje n THR 75 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1aje n ASP 76 N 0.00 -5.75 -3.83 3.42 8.00 0.15 -4.90 116.55 113.65 1aje n ASP 76 Ca 0.00 -0.06 -0.27 0.00 0.71 0.00 0.00 54.79 55.17 1aje n ASP 76 Cb 0.00 -3.80 0.18 0.00 -0.02 0.00 0.00 41.12 37.48 1aje n ASP 76 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1aje n VAL 77 N -1.54 0.00 -3.88 2.53 0.31 0.97 -4.74 118.33 111.98 1aje n VAL 77 Ca -0.00 -0.97 -0.30 0.00 -0.01 0.00 0.00 64.34 63.06 1aje n VAL 77 Cb 0.50 -1.48 -0.16 0.00 -0.91 0.00 0.00 33.84 31.79 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 -3.62 2.22 -0.69 3.52 0.08 -0.68 -0.11 117.98 118.70 1aje s PHE 78 Ca 0.69 -1.78 -0.20 0.00 0.12 0.00 0.00 56.93 55.77 1aje s PHE 78 Cb -0.02 -1.69 0.11 0.00 -0.57 0.00 0.00 43.02 40.84 1aje s PHE 78 CO 0.48 -0.79 0.86 -0.51 -0.10 0.00 0.00 175.22 175.16 1aje s LEU 79 N 1.45 5.13 -0.31 -0.37 2.01 -0.50 -0.32 118.68 125.77 1aje s LEU 79 Ca 0.00 -1.50 -0.29 0.00 0.01 0.00 0.00 54.13 52.35 1aje s LEU 79 Cb -0.18 -2.35 0.01 0.00 0.01 0.00 0.00 46.19 43.68 1aje s LEU 79 CO -0.11 -1.16 1.10 -0.69 1.01 0.00 0.00 176.35 176.50 1aje s VAL 80 N 2.92 4.47 -0.18 -1.59 1.01 0.23 -1.39 120.40 125.87 1aje s VAL 80 Ca 0.19 1.70 -0.25 0.00 0.00 0.00 0.00 61.98 63.62 1aje s VAL 80 Cb -0.18 -4.38 -0.01 0.00 0.00 0.00 0.00 36.38 31.81 1aje s VAL 80 CO 0.03 -0.46 0.82 0.00 0.00 0.00 0.00 175.10 175.50 1aje n PHE 82 N 5.34 -2.46 -3.26 0.00 3.01 0.27 -4.64 117.46 115.72 1aje n PHE 82 Ca 0.04 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.37 1aje n PHE 82 Cb 0.49 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.90 1aje n PHE 82 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1aje s SER 83 N -1.00 0.34 0.00 4.37 0.15 -1.26 -3.20 113.70 113.10 1aje s SER 83 Ca 0.00 -1.62 0.20 0.00 0.70 0.00 0.00 55.95 55.23 1aje s SER 83 Cb 0.00 0.89 -0.03 0.00 -1.71 0.00 0.00 66.02 65.17 1aje s SER 83 CO 0.00 -0.20 0.99 0.52 1.20 0.00 0.00 173.24 175.75 1aje n VAL 84 N 3.94 0.00 0.32 4.45 0.31 -1.26 -3.84 118.33 122.24 1aje n VAL 84 Ca 0.14 -0.26 0.18 0.00 -0.01 0.00 0.00 64.34 64.39 1aje n VAL 84 Cb 0.49 1.21 0.92 0.00 -0.91 0.00 0.00 33.84 35.55 1aje n VAL 84 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1aje h VAL 85 N 1.99 0.05 0.00 2.52 -1.51 -1.93 -3.06 116.25 114.31 1aje h VAL 85 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1aje h VAL 85 Cb 0.66 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 30.59 1aje h VAL 85 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 177.57 176.10 1aje n SER 86 N -3.05 0.00 -4.67 4.19 2.88 -1.26 -4.27 113.62 107.44 1aje n SER 86 Ca -0.02 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.12 1aje n SER 86 Cb 0.31 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.71 1aje n SER 86 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1aje s PRO 87 N 0.00 4.26 0.00 -1.46 0.04 -1.26 -2.85 135.00 133.73 1aje s PRO 87 Ca 0.00 0.70 0.00 0.00 0.04 0.00 0.00 61.00 61.74 1aje s PRO 87 Cb 0.00 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.99 1aje s PRO 87 CO 0.00 -0.18 0.06 0.43 0.04 0.00 0.00 177.00 177.35 1aje n SER 88 N 4.80 0.17 0.31 6.66 7.64 -1.26 -3.72 113.62 128.21 1aje n SER 88 Ca -0.01 -0.18 0.20 0.00 1.01 0.00 0.00 58.87 59.88 1aje n SER 88 Cb 0.50 -0.03 1.05 0.00 -1.01 0.00 0.00 64.21 64.72 1aje n SER 88 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1aje h SER 89 N 2.05 0.00 0.00 6.43 0.02 -1.91 0.49 113.55 120.63 1aje h SER 89 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1aje h SER 89 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1aje h SER 89 CO 0.00 0.00 0.21 2.22 -1.14 0.00 0.00 176.83 178.12 1aje n PHE 90 N -2.90 0.51 -0.09 3.45 -1.74 -1.24 -2.33 117.46 113.11 1aje n PHE 90 Ca -0.03 0.26 -0.22 0.00 -0.56 0.00 0.00 57.45 56.91 1aje n PHE 90 Cb 0.13 -0.78 -0.12 0.00 1.52 0.00 0.00 39.48 40.23 1aje n PHE 90 CO 0.00 0.00 0.00 -1.91 -0.56 0.00 0.00 176.76 174.29 1aje n GLU 91 N -2.08 0.59 0.28 3.97 2.13 0.16 -3.75 120.64 121.95 1aje n GLU 91 Ca -0.01 0.53 0.17 0.00 0.66 0.00 0.00 57.16 58.50 1aje n GLU 91 Cb 0.23 -1.74 0.89 0.00 0.27 0.00 0.00 31.44 31.10 1aje n GLU 91 CO 0.00 0.00 0.00 -2.95 -0.41 0.00 0.00 177.13 173.77 1aje h ASN 92 N -0.85 0.00 -0.59 4.31 7.08 -1.64 0.27 115.58 124.15 1aje h ASN 92 Ca -0.37 0.00 0.07 0.00 -3.08 0.00 0.00 56.30 52.92 1aje h ASN 92 Cb 1.41 0.00 -0.04 0.00 -2.08 0.00 0.00 38.32 37.62 1aje h ASN 92 CO -0.18 0.00 0.39 0.58 -2.08 0.00 0.00 177.43 176.14 1aje h VAL 93 N 0.00 0.97 0.07 6.14 2.07 -1.59 -2.47 116.25 121.44 1aje h VAL 93 Ca 0.00 -0.18 -0.33 0.00 0.82 0.00 0.00 66.70 67.01 1aje h VAL 93 Cb 0.23 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 1aje h VAL 93 CO 0.00 0.10 -1.87 0.29 0.02 0.00 0.00 177.57 176.11 1aje n LYS 94 N -4.48 0.70 -0.24 1.57 4.76 0.92 -2.13 118.16 119.27 1aje n LYS 94 Ca 0.09 0.28 0.18 0.00 -2.87 0.00 0.00 58.31 55.98 1aje n LYS 94 Cb 0.27 -1.75 0.50 0.00 -1.84 0.00 0.00 35.03 32.21 1aje n LYS 94 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1aje h GLU 95 N 0.04 0.42 0.00 1.97 5.08 -1.27 -3.04 114.58 117.78 1aje h GLU 95 Ca -0.36 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 1aje h GLU 95 Cb 2.03 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 31.18 1aje h GLU 95 CO 0.08 0.28 -0.54 1.17 -1.00 0.00 0.00 179.01 179.00 1aje n LYS 96 N -4.52 2.55 0.05 2.33 3.00 -1.08 -4.65 118.16 115.84 1aje n LYS 96 Ca 0.19 0.00 -0.16 0.00 -0.00 0.00 0.00 58.31 58.34 1aje n LYS 96 Cb 0.67 -0.77 -0.06 0.00 0.00 0.00 0.00 35.03 34.86 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.40 175.91 1aje h TRP 97 N 0.00 0.80 -0.31 5.64 4.06 -1.52 -2.69 115.95 121.92 1aje h TRP 97 Ca 0.00 -0.42 -0.08 0.00 2.06 0.00 0.00 58.89 60.45 1aje h TRP 97 Cb 0.19 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.24 1aje h TRP 97 CO 0.00 1.25 -0.11 0.28 -3.56 0.00 0.00 178.44 176.29 1aje h VAL 98 N 0.31 1.29 0.00 1.49 2.07 -1.58 0.74 116.25 120.56 1aje h VAL 98 Ca -0.09 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.23 1aje h VAL 98 Cb 1.60 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1aje h VAL 98 CO 0.18 0.38 0.00 1.55 0.02 0.00 0.00 177.57 179.70 1aje h PRO 99 N 0.39 0.00 0.03 1.57 0.13 -1.73 0.59 132.00 132.97 1aje h PRO 99 Ca 0.07 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.90 1aje h PRO 99 Cb 0.62 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.71 1aje h PRO 99 CO 0.04 0.00 -1.71 1.49 -0.23 0.00 0.00 178.00 177.59 1aje h GLU 100 N 0.00 0.06 0.00 0.86 4.81 -0.98 -3.22 114.58 116.11 1aje h GLU 100 Ca 0.00 -0.11 -0.36 0.00 -0.13 0.00 0.00 59.36 58.76 1aje h GLU 100 Cb 0.12 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.48 1aje h GLU 100 CO 0.00 0.69 -2.25 0.44 -0.73 0.00 0.00 179.01 177.16 1aje n ILE 101 N -3.17 1.24 -0.09 2.32 -5.35 0.17 -4.07 119.36 110.41 1aje n ILE 101 Ca -0.18 -0.36 -0.19 0.00 -0.27 0.00 0.00 62.75 61.74 1aje n ILE 101 Cb 1.04 -1.64 -0.12 0.00 -1.74 0.00 0.00 39.64 37.19 1aje n ILE 101 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1aje h THR 102 N -0.56 1.23 -0.38 7.28 1.35 -0.07 1.41 112.91 123.17 1aje h THR 102 Ca -0.55 -2.25 0.03 0.00 -0.55 0.00 0.00 66.41 63.09 1aje h THR 102 Cb 1.58 2.66 -0.02 0.00 -1.73 0.00 0.00 68.15 70.63 1aje h THR 102 CO -0.26 0.44 0.25 0.45 -0.25 0.00 0.00 175.52 176.15 1aje h HIS 103 N -0.96 0.38 0.00 4.73 3.86 -1.54 0.32 115.15 121.94 1aje h HIS 103 Ca -0.23 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 58.91 1aje h HIS 103 Cb 1.23 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 29.56 1aje h HIS 103 CO 0.16 0.22 -0.66 1.25 0.86 0.00 0.00 177.93 179.77 1aje h HIS 104 N 0.39 0.00 -2.28 2.45 6.17 -1.63 -3.42 115.15 116.83 1aje h HIS 104 Ca 0.15 0.00 -0.60 0.00 0.71 0.00 0.00 60.37 60.63 1aje h HIS 104 Cb 0.13 0.00 -0.42 0.00 2.52 0.00 0.00 27.41 29.64 1aje h HIS 104 CO -0.00 0.67 -0.58 0.00 0.71 0.00 0.00 177.93 178.73 1aje n PRO 106 N 0.94 2.16 0.09 0.00 -0.04 0.11 -4.25 135.00 134.02 1aje n PRO 106 Ca 0.29 -1.18 -0.22 0.00 -0.04 0.00 0.00 63.50 62.35 1aje n PRO 106 Cb 0.40 -2.07 -0.15 0.00 -0.04 0.00 0.00 33.50 31.64 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 3.16 0.40 0.00 0.54 6.56 -1.86 -3.49 116.57 121.88 1aje h LYS 107 Ca 0.25 -0.69 0.00 0.00 -1.06 0.00 0.00 60.65 59.16 1aje h LYS 107 Cb 1.38 0.26 0.00 0.00 -0.57 0.00 0.00 32.23 33.29 1aje h LYS 107 CO 0.39 1.33 0.00 2.41 -2.06 0.00 0.00 179.45 181.52 1aje n THR 108 N -3.93 0.00 -1.63 -0.16 -1.04 -1.26 -5.11 114.28 101.15 1aje n THR 108 Ca -0.16 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.47 1aje n THR 108 Cb 0.95 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.43 1aje n THR 108 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1aje s PRO 109 N 0.00 2.33 -0.22 -2.82 0.04 -1.25 -4.54 135.00 128.54 1aje s PRO 109 Ca 0.00 1.42 -0.03 0.00 0.04 0.00 0.00 61.00 62.43 1aje s PRO 109 Cb 0.00 -4.52 0.07 0.00 0.04 0.00 0.00 34.50 30.09 1aje s PRO 109 CO 0.00 -3.02 0.07 0.12 0.04 0.00 0.00 177.00 174.21 1aje s PHE 110 N 11.20 0.78 -0.23 0.56 2.19 -1.26 -1.68 117.98 129.54 1aje s PHE 110 Ca 0.94 -0.84 -0.00 0.00 0.33 0.00 0.00 56.93 57.37 1aje s PHE 110 Cb -0.19 -1.01 0.03 0.00 -1.31 0.00 0.00 43.02 40.54 1aje s PHE 110 CO 0.27 -0.66 -0.11 -0.51 1.83 0.00 0.00 175.22 176.04 1aje s LEU 111 N 1.94 2.86 -0.64 6.12 1.43 0.57 0.34 118.68 131.30 1aje s LEU 111 Ca 0.03 -0.85 -0.23 0.00 -1.03 0.00 0.00 54.13 52.05 1aje s LEU 111 Cb -0.17 -1.59 0.06 0.00 0.03 0.00 0.00 46.19 44.52 1aje s LEU 111 CO -0.16 -0.09 0.97 -0.22 0.23 0.00 0.00 176.35 177.09 1aje s LEU 112 N 1.29 4.26 -0.10 1.79 2.96 0.15 -0.60 118.68 128.43 1aje s LEU 112 Ca 0.01 -0.82 0.00 0.00 -0.22 0.00 0.00 54.13 53.11 1aje s LEU 112 Cb -0.16 -2.52 -0.02 0.00 0.50 0.00 0.00 46.19 43.99 1aje s LEU 112 CO -0.07 -1.41 -0.11 -0.69 -1.32 0.00 0.00 176.35 172.75 1aje s VAL 113 N 4.11 3.26 0.81 1.68 1.01 -0.78 0.34 120.40 130.82 1aje s VAL 113 Ca 0.24 -0.61 -0.12 0.00 0.00 0.00 0.00 61.98 61.49 1aje s VAL 113 Cb -0.15 -2.35 0.08 0.00 0.00 0.00 0.00 36.38 33.96 1aje s VAL 113 CO 0.12 0.55 1.16 -0.83 0.00 0.00 0.00 175.10 176.10 1aje s GLY 114 N -0.09 1.98 0.00 4.51 0.00 0.32 0.95 107.32 114.98 1aje s GLY 114 Ca -0.01 0.66 0.00 0.00 0.00 0.00 0.00 44.72 45.37 1aje s GLY 114 CO 0.03 1.06 0.00 -0.37 0.00 0.00 0.00 173.10 173.82 1aje n THR 115 N -3.44 0.00 -3.16 0.90 5.66 -1.19 -4.58 114.28 108.47 1aje n THR 115 Ca 0.12 0.00 -0.44 0.00 -3.05 0.00 0.00 64.05 60.68 1aje n THR 115 Cb 0.51 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.30 1aje n THR 115 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1aje n GLN 116 N 0.00 4.04 0.00 1.09 1.13 -1.21 -3.61 117.38 118.82 1aje n GLN 116 Ca 0.00 -4.51 0.00 0.00 -1.94 0.00 0.00 57.00 50.55 1aje n GLN 116 Cb 0.00 -2.53 0.00 0.00 0.11 0.00 0.00 30.24 27.82 1aje n GLN 116 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1aje n ILE 117 N 1.96 0.00 -3.27 5.09 -0.00 -1.26 -2.70 119.36 119.18 1aje n ILE 117 Ca 0.25 0.00 -0.30 0.00 -0.00 0.00 0.00 62.75 62.70 1aje n ILE 117 Cb 0.36 -0.14 -0.06 0.00 -0.00 0.00 0.00 39.64 39.80 1aje n ILE 117 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1aje n ASP 118 N 0.18 4.43 -0.12 4.38 -0.08 -1.26 -4.74 116.55 119.33 1aje n ASP 118 Ca 0.00 -3.48 -0.02 0.00 -1.51 0.00 0.00 54.79 49.79 1aje n ASP 118 Cb 0.00 -0.78 -0.01 0.00 2.34 0.00 0.00 41.12 42.68 1aje n ASP 118 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1aje n LEU 119 N 0.77 -0.04 -0.24 -2.67 7.99 -1.25 -4.90 117.00 116.66 1aje n LEU 119 Ca 0.30 0.04 -0.06 0.00 -0.01 0.00 0.00 56.01 56.28 1aje n LEU 119 Cb 0.39 -0.82 0.08 0.00 -0.11 0.00 0.00 43.42 42.96 1aje n LEU 119 CO 0.46 -0.15 0.98 -0.09 -1.51 0.00 0.00 177.39 177.08 1aje h ARG 120 N 0.42 1.10 -0.13 3.23 1.12 -1.82 -3.22 114.38 115.09 1aje h ARG 120 Ca -0.03 -0.24 -0.15 0.00 -1.11 0.00 0.00 59.98 58.45 1aje h ARG 120 Cb 0.17 -0.16 -0.23 0.00 -0.01 0.00 0.00 29.97 29.75 1aje h ARG 120 CO 0.05 0.94 -0.79 -3.47 -3.11 0.00 0.00 179.97 173.60 1aje n ASP 121 N -4.25 1.83 0.00 -3.80 -0.08 -1.26 0.90 116.55 109.89 1aje n ASP 121 Ca 0.06 -3.04 0.00 0.00 -1.51 0.00 0.00 54.79 50.29 1aje n ASP 121 Cb 0.23 -0.42 0.00 0.00 2.34 0.00 0.00 41.12 43.27 1aje n ASP 121 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1aje n ASP 122 N -0.45 0.00 -0.37 1.67 -0.08 -1.22 -4.27 116.55 111.83 1aje n ASP 122 Ca 0.16 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.56 1aje n ASP 122 Cb 0.89 0.00 0.16 0.00 2.34 0.00 0.00 41.12 44.52 1aje n ASP 122 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1aje n PRO 123 N 0.00 1.00 0.00 -0.67 -0.04 -1.26 -4.44 135.00 129.59 1aje n PRO 123 Ca 0.00 -0.74 0.00 0.00 -0.04 0.00 0.00 63.50 62.72 1aje n PRO 123 Cb 0.00 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 1aje n PRO 123 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1aje n SER 124 N -0.36 0.00 0.00 3.54 2.88 -1.26 -4.00 113.62 114.42 1aje n SER 124 Ca 0.10 0.11 0.01 0.00 -1.33 0.00 0.00 58.87 57.76 1aje n SER 124 Cb 0.41 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.91 1aje n SER 124 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1aje n THR 125 N -0.37 0.00 0.00 2.46 -1.04 0.26 -4.10 114.28 111.49 1aje n THR 125 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1aje n THR 125 Cb 0.00 -0.73 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 1aje n THR 125 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1aje n ILE 126 N -0.77 0.00 -0.47 12.58 2.08 -1.26 -3.19 119.36 128.33 1aje n ILE 126 Ca 0.01 0.69 0.40 0.00 0.56 0.00 0.00 62.75 64.41 1aje n ILE 126 Cb 0.00 -1.60 0.72 0.00 -0.75 0.00 0.00 39.64 38.01 1aje n ILE 126 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1aje h GLU 127 N 0.00 0.06 -1.11 0.38 5.08 -1.81 1.24 114.58 118.42 1aje h GLU 127 Ca 0.00 -0.00 0.33 0.00 -1.00 0.00 0.00 59.36 58.68 1aje h GLU 127 Cb 0.00 -0.01 -0.12 0.00 0.50 0.00 0.00 28.75 29.12 1aje h GLU 127 CO 0.00 0.04 0.69 -0.22 -1.00 0.00 0.00 179.01 178.52 1aje h LYS 128 N 0.07 0.29 0.00 2.33 1.63 -1.75 -3.38 116.57 115.76 1aje h LYS 128 Ca 0.75 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.53 1aje h LYS 128 Cb 2.72 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 34.29 1aje h LYS 128 CO -0.15 0.19 0.00 1.28 -3.45 0.00 0.00 179.45 177.33 1aje n LEU 129 N -4.76 0.00 0.00 5.20 4.32 0.42 -4.95 117.00 117.23 1aje n LEU 129 Ca 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.29 1aje n LEU 129 Cb 1.05 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.85 1aje n LEU 129 CO 0.20 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.37 1aje n ALA 130 N -2.24 0.00 0.31 -1.18 0.00 -0.94 -4.66 120.51 111.80 1aje n ALA 130 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 1aje n ALA 130 Cb 0.00 -0.23 0.95 0.00 0.00 0.00 0.00 19.45 20.16 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 0.85 0.00 -0.39 0.00 1.79 -1.91 0.20 116.57 117.10 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 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1aje h LYS 131 CO 0.00 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.46 1aje n ASN 132 N -3.01 3.17 -1.99 0.86 3.02 -1.26 -4.90 115.26 111.15 1aje n ASN 132 Ca -0.01 -1.92 -0.16 0.00 -0.03 0.00 0.00 54.58 52.45 1aje n ASN 132 Cb 0.17 -0.26 -0.04 0.00 -0.61 0.00 0.00 39.78 39.05 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 1.06 -1.70 0.00 3.52 4.76 0.69 -4.56 118.16 121.93 1aje n LYS 133 Ca 0.16 0.86 0.00 0.00 -2.87 0.00 0.00 58.31 56.46 1aje n LYS 133 Cb 0.50 -5.34 0.00 0.00 -1.84 0.00 0.00 35.03 28.35 1aje n LYS 133 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1aje n GLN 134 N -2.52 0.00 -1.06 1.97 1.13 -1.26 -5.00 117.38 110.64 1aje n GLN 134 Ca -0.18 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.88 1aje n GLN 134 Cb 0.59 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.94 1aje n GLN 134 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1aje n LYS 135 N 11.68 -1.68 -1.44 -1.09 4.76 -1.13 -4.61 118.16 124.65 1aje n LYS 135 Ca 0.00 1.54 -0.34 0.00 -2.87 0.00 0.00 58.31 56.65 1aje n LYS 135 Cb 0.00 -1.39 0.09 0.00 -1.84 0.00 0.00 35.03 31.89 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 -2.15 2.20 -0.37 1.97 0.04 -1.25 -4.13 135.00 131.32 1aje s PRO 136 Ca 0.00 1.64 -0.36 0.00 0.04 0.00 0.00 61.00 62.31 1aje s PRO 136 Cb 0.00 -1.85 -0.12 0.00 0.04 0.00 0.00 34.50 32.56 1aje s PRO 136 CO 0.00 -1.76 2.18 -0.89 0.04 0.00 0.00 177.00 176.57 1aje n ILE 137 N -2.80 0.16 -1.84 0.56 -0.00 -1.16 -4.84 119.36 109.44 1aje n ILE 137 Ca 0.12 -0.22 -0.29 0.00 -0.00 0.00 0.00 62.75 62.36 1aje n ILE 137 Cb 0.51 -1.49 0.11 0.00 -0.00 0.00 0.00 39.64 38.77 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 7.13 2.00 -1.15 1.39 2.01 -1.26 -4.70 115.64 121.05 1aje s THR 138 Ca 1.11 0.00 0.13 0.00 0.31 0.00 0.00 61.69 63.24 1aje s THR 138 Cb -0.94 -2.96 0.15 0.00 0.01 0.00 0.00 72.50 68.75 1aje s THR 138 CO 0.51 0.00 1.37 -0.81 -0.69 0.00 0.00 174.62 175.01 1aje n PRO 139 N -3.43 0.06 0.01 4.92 -0.04 -1.26 -1.21 135.00 134.06 1aje n PRO 139 Ca 0.08 0.24 0.11 0.00 -0.04 0.00 0.00 63.50 63.90 1aje n PRO 139 Cb 0.61 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.48 1aje n PRO 139 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1aje n GLU 140 N -1.42 0.41 -0.06 0.54 0.28 -1.26 -3.82 120.64 115.30 1aje n GLU 140 Ca 0.04 -0.07 -0.05 0.00 -0.16 0.00 0.00 57.16 56.92 1aje n GLU 140 Cb 0.13 -1.56 -0.02 0.00 1.43 0.00 0.00 31.44 31.42 1aje n GLU 140 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1aje n THR 141 N -2.04 1.13 0.21 3.84 -1.04 -0.35 -3.57 114.28 112.46 1aje n THR 141 Ca -0.00 0.26 -0.12 0.00 -2.04 0.00 0.00 64.05 62.14 1aje n THR 141 Cb 0.48 -2.19 -0.07 0.00 -1.82 0.00 0.00 70.33 66.74 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 -1.22 -1.04 -0.48 2.41 0.00 -1.53 -0.09 119.26 117.32 1aje h ALA 142 Ca 0.00 -0.13 0.14 0.00 0.00 0.00 0.00 54.91 54.92 1aje h ALA 142 Cb 0.54 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1aje h ALA 142 CO 0.00 -1.05 0.49 0.93 0.00 0.00 0.00 179.25 179.62 1aje h GLU 143 N -0.69 0.00 -0.77 0.00 4.39 -1.76 0.28 114.58 116.03 1aje h GLU 143 Ca -0.05 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 1aje h GLU 143 Cb 0.59 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.20 1aje h GLU 143 CO -0.02 0.00 0.45 -0.22 -1.16 0.00 0.00 179.01 178.05 1aje h LYS 144 N 0.00 1.06 0.05 2.33 3.64 -1.07 -0.94 116.57 121.65 1aje h LYS 144 Ca 0.23 -0.11 -0.34 0.00 -1.27 0.00 0.00 60.65 59.16 1aje h LYS 144 Cb 1.20 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.77 1aje h LYS 144 CO -0.00 0.77 -1.98 1.47 -2.27 0.00 0.00 179.45 177.44 1aje n LEU 145 N -4.46 1.74 0.24 5.20 -0.00 0.81 -3.18 117.00 117.35 1aje n LEU 145 Ca 0.07 0.23 0.17 0.00 -0.00 0.00 0.00 56.01 56.48 1aje n LEU 145 Cb 0.07 -0.45 0.84 0.00 -0.00 0.00 0.00 43.42 43.89 1aje n LEU 145 CO 0.38 0.65 0.99 0.00 -0.00 0.00 0.00 177.39 179.41 1aje h ALA 146 N 0.51 1.00 0.00 1.47 0.00 -1.04 1.91 119.26 123.10 1aje h ALA 146 Ca -0.40 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.37 1aje h ALA 146 Cb 2.03 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.80 1aje h ALA 146 CO 0.06 0.00 -0.66 -0.09 0.00 0.00 0.00 179.25 178.56 1aje h ARG 147 N 0.00 0.00 0.00 0.00 2.43 -1.24 1.05 114.38 116.63 1aje h ARG 147 Ca 0.00 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1aje h ARG 147 Cb 0.10 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1aje h ARG 147 CO 0.00 0.66 -0.20 -0.44 -1.51 0.00 0.00 179.97 178.48 1aje h ASP 148 N 0.00 0.00 0.00 -3.80 3.32 0.30 -3.37 116.42 112.87 1aje h ASP 148 Ca -0.01 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1aje h ASP 148 Cb 1.51 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.04 1aje h ASP 148 CO 0.09 0.12 -1.40 0.18 -1.72 0.00 0.00 179.24 176.51 1aje n LEU 149 N -3.10 1.74 -3.22 1.55 4.77 -0.23 -5.03 117.00 113.49 1aje n LEU 149 Ca 0.03 -0.02 -0.15 0.00 -0.03 0.00 0.00 56.01 55.84 1aje n LEU 149 Cb 0.58 -0.09 0.08 0.00 -2.33 0.00 0.00 43.42 41.66 1aje n LEU 149 CO 0.36 0.42 0.08 0.29 -1.33 0.00 0.00 177.39 177.21 1aje n LYS 150 N -2.50 -4.86 0.00 3.23 4.01 0.36 -4.99 118.16 113.41 1aje n LYS 150 Ca -0.11 0.80 0.00 0.00 -0.51 0.00 0.00 58.31 58.49 1aje n LYS 150 Cb 0.66 -5.61 0.00 0.00 -0.51 0.00 0.00 35.03 29.56 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 -3.66 0.00 -0.09 7.82 0.00 -1.26 -4.90 120.51 118.43 1aje n ALA 151 Ca -0.20 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.05 1aje n ALA 151 Cb 0.64 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.97 1aje n ALA 151 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1aje n VAL 152 N 0.00 1.57 -3.55 0.00 0.31 1.04 -4.84 118.33 112.86 1aje n VAL 152 Ca 0.00 -0.62 -0.14 0.00 -0.01 0.00 0.00 64.34 63.57 1aje n VAL 152 Cb 0.00 -1.45 -0.06 0.00 -0.91 0.00 0.00 33.84 31.42 1aje n VAL 152 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1aje s LYS 153 N -2.53 0.82 -0.01 5.55 2.47 -1.02 -5.00 119.74 120.02 1aje s LYS 153 Ca -0.29 0.24 0.06 0.00 -1.56 0.00 0.00 55.97 54.42 1aje s LYS 153 Cb 0.08 0.39 -0.02 0.00 -1.46 0.00 0.00 37.83 36.82 1aje s LYS 153 CO 0.67 -0.25 -0.20 -0.47 0.16 0.00 0.00 175.35 175.26 1aje s TYR 154 N -1.05 1.83 0.30 4.03 5.04 -1.26 0.31 117.35 126.55 1aje s TYR 154 Ca -0.06 -0.35 -0.19 0.00 -2.44 0.00 0.00 57.07 54.03 1aje s TYR 154 Cb -0.01 -1.17 0.05 0.00 0.35 0.00 0.00 41.96 41.18 1aje s TYR 154 CO 0.05 -0.02 0.82 0.14 -1.34 0.00 0.00 175.55 175.20 1aje s VAL 155 N -0.50 0.00 0.00 3.14 -7.23 0.15 -4.97 120.40 110.99 1aje s VAL 155 Ca 0.08 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.34 1aje s VAL 155 Cb -0.08 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.36 1aje s VAL 155 CO -0.01 0.00 0.00 -0.62 -0.31 0.00 0.00 175.10 174.16 1aje n GLU 156 N -0.52 2.22 -0.09 4.82 1.02 -1.26 0.12 120.64 126.95 1aje n GLU 156 Ca -0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 1aje n GLU 156 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.02 1aje n GLU 156 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1aje n SER 158 N -0.05 4.97 0.00 0.00 7.64 -1.24 -4.32 113.62 120.62 1aje n SER 158 Ca 0.00 -2.32 0.00 0.00 1.01 0.00 0.00 58.87 57.56 1aje n SER 158 Cb 0.00 -1.04 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 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 1.44 0.00 0.02 -0.43 0.00 -1.26 -3.82 120.51 116.46 1aje n ALA 159 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1aje n ALA 159 Cb 0.48 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.84 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 0.69 0.34 0.00 -0.00 -1.26 -4.40 117.00 112.36 1aje n LEU 160 Ca 0.00 0.30 -0.18 0.00 -0.00 0.00 0.00 56.01 56.13 1aje n LEU 160 Cb 0.00 0.09 -0.09 0.00 -0.00 0.00 0.00 43.42 43.42 1aje n LEU 160 CO 0.00 0.12 0.53 0.74 -0.00 0.00 0.00 177.39 178.77 1aje h THR 161 N 0.00 0.00 -1.28 1.47 2.02 -1.92 -3.48 112.91 109.72 1aje h THR 161 Ca -0.16 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1aje h THR 161 Cb 1.51 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1aje h THR 161 CO 0.03 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.92 1aje n GLN 162 N -5.32 0.00 -0.00 6.66 1.13 -1.26 -5.00 117.38 113.58 1aje n GLN 162 Ca -0.12 0.00 0.11 0.00 -1.94 0.00 0.00 57.00 55.04 1aje n GLN 162 Cb 0.45 -1.50 -0.16 0.00 0.11 0.00 0.00 30.24 29.14 1aje n GLN 162 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1aje n LYS 163 N -0.64 0.60 0.00 -1.09 4.81 -1.26 -4.90 118.16 115.68 1aje n LYS 163 Ca 0.00 -0.17 0.00 0.00 -0.87 0.00 0.00 58.31 57.27 1aje n LYS 163 Cb 0.31 -1.54 0.00 0.00 0.02 0.00 0.00 35.03 33.82 1aje n LYS 163 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1aje n GLY 164 N 1.27 0.00 0.05 3.14 0.00 -1.26 -4.85 105.19 103.54 1aje n GLY 164 Ca -0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.04 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 0.19 0.06 0.99 -0.00 -1.16 0.64 117.00 117.73 1aje n LEU 165 Ca 0.00 0.57 0.11 0.00 -0.00 0.00 0.00 56.01 56.69 1aje n LEU 165 Cb 0.00 -0.57 0.03 0.00 -0.00 0.00 0.00 43.42 42.87 1aje n LEU 165 CO 0.00 -0.52 0.01 1.17 -0.00 0.00 0.00 177.39 178.05 1aje n LYS 166 N -1.74 0.45 0.02 1.47 4.81 -1.26 -2.13 118.16 119.78 1aje n LYS 166 Ca 0.01 0.05 -0.22 0.00 -0.87 0.00 0.00 58.31 57.28 1aje n LYS 166 Cb 0.08 -1.70 -0.14 0.00 0.02 0.00 0.00 35.03 33.30 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 0.43 -0.45 3.14 7.08 -0.17 -2.84 115.58 122.77 1aje h ASN 167 Ca 0.00 -0.88 0.07 0.00 -3.08 0.00 0.00 56.30 52.42 1aje h ASN 167 Cb 0.86 -0.14 -0.06 0.00 -2.08 0.00 0.00 38.32 36.90 1aje h ASN 167 CO 0.00 1.69 0.08 1.62 -2.08 0.00 0.00 177.43 178.74 1aje h VAL 168 N -0.18 0.75 -0.66 6.14 3.04 0.08 0.53 116.25 125.95 1aje h VAL 168 Ca -0.33 -0.07 0.14 0.00 -1.01 0.00 0.00 66.70 65.43 1aje h VAL 168 Cb 1.86 0.52 -0.11 0.00 -2.01 0.00 0.00 31.29 31.55 1aje h VAL 168 CO 0.08 0.04 0.06 -0.26 -1.01 0.00 0.00 177.57 176.48 1aje h PHE 169 N 0.21 0.06 -0.58 3.17 0.04 -1.46 2.61 116.94 120.99 1aje h PHE 169 Ca 0.22 0.05 0.01 0.00 2.80 0.00 0.00 57.97 61.04 1aje h PHE 169 Cb 0.29 0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.48 1aje h PHE 169 CO -0.22 -0.14 0.39 -0.44 -0.60 0.00 0.00 178.31 177.29 1aje h ASP 170 N 0.17 0.67 0.22 2.17 3.32 0.10 -1.50 116.42 121.57 1aje h ASP 170 Ca 0.36 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 1aje h ASP 170 Cb 0.59 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1aje h ASP 170 CO -0.53 0.48 -0.11 -0.33 -1.72 0.00 0.00 179.24 177.04 1aje h GLU 171 N 0.79 -0.29 -0.97 3.56 4.39 0.70 0.25 114.58 123.00 1aje h GLU 171 Ca 0.21 0.02 0.31 0.00 0.34 0.00 0.00 59.36 60.25 1aje h GLU 171 Cb -0.09 0.07 -0.16 0.00 -0.10 0.00 0.00 28.75 28.47 1aje h GLU 171 CO -0.05 0.09 0.43 0.00 -1.16 0.00 0.00 179.01 178.32 1aje h ALA 172 N -0.24 1.76 -0.11 3.43 0.00 0.40 3.34 119.26 127.83 1aje h ALA 172 Ca -0.03 0.22 -0.18 0.00 0.00 0.00 0.00 54.91 54.92 1aje h ALA 172 Cb 0.51 0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.57 1aje h ALA 172 CO 0.05 -0.61 -0.63 0.82 0.00 0.00 0.00 179.25 178.88 1aje h ILE 173 N 0.21 1.33 0.00 0.00 5.03 -1.20 0.18 117.51 123.07 1aje h ILE 173 Ca 0.70 -1.91 0.00 0.00 -0.12 0.00 0.00 64.86 63.53 1aje h ILE 173 Cb 1.60 2.15 0.00 0.00 -3.03 0.00 0.00 36.82 37.54 1aje h ILE 173 CO -0.67 0.59 0.00 -0.11 -0.68 0.00 0.00 178.15 177.27 1aje n LEU 174 N -4.11 0.42 -0.00 1.44 -0.00 0.38 0.11 117.00 115.23 1aje n LEU 174 Ca -0.08 0.61 0.10 0.00 -0.00 0.00 0.00 56.01 56.64 1aje n LEU 174 Cb 0.67 -0.57 -0.13 0.00 -0.00 0.00 0.00 43.42 43.39 1aje n LEU 174 CO 0.49 -0.49 -0.35 0.00 -0.00 0.00 0.00 177.39 177.05 1aje n ALA 175 N -1.68 3.82 0.50 1.96 0.00 1.02 -2.32 120.51 123.82 1aje n ALA 175 Ca 0.02 -0.54 0.08 0.00 0.00 0.00 0.00 53.44 53.01 1aje n ALA 175 Cb 0.19 -0.72 -0.11 0.00 0.00 0.00 0.00 19.45 18.81 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 -1.79 3.62 -0.08 0.00 0.00 0.59 -3.90 120.51 118.95 1aje n ALA 176 Ca 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1aje n ALA 176 Cb 0.41 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1aje n ALA 176 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 177 N -1.63 0.14 0.00 0.00 -0.00 0.12 -4.35 117.00 111.27 1aje n LEU 177 Ca 0.01 -0.39 0.00 0.00 -0.00 0.00 0.00 56.01 55.63 1aje n LEU 177 Cb 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.74 1aje n LEU 177 CO 0.34 0.04 0.00 1.21 -0.00 0.00 0.00 177.39 178.98 1aje n GLU 178 N -0.50 0.00 -1.46 1.47 0.00 -0.98 -4.84 120.64 114.33 1aje n GLU 178 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 57.16 56.85 1aje n GLU 178 Cb 0.02 0.00 0.07 0.00 0.00 0.00 0.00 31.44 31.53 1aje n GLU 178 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.13 175.88 1aje s PRO 179 N 0.00 2.59 0.82 5.31 0.04 -1.26 -5.02 135.00 137.48 1aje s PRO 179 Ca 0.00 1.13 -0.11 0.00 0.04 0.00 0.00 61.00 62.07 1aje s PRO 179 Cb 0.00 -1.94 0.09 0.00 0.04 0.00 0.00 34.50 32.69 1aje s PRO 179 CO 0.00 -1.38 1.09 -1.25 0.04 0.00 0.00 177.00 175.50 1aje s PRO 180 N -4.79 1.85 -0.91 0.56 0.04 -1.26 -5.00 135.00 125.49 1aje s PRO 180 Ca 0.61 1.01 -0.02 0.00 0.04 0.00 0.00 61.00 62.65 1aje s PRO 180 Cb -0.17 -1.86 0.22 0.00 0.04 0.00 0.00 34.50 32.74 1aje s PRO 180 CO 0.53 -1.89 0.81 0.39 0.04 0.00 0.00 177.00 176.88 1aje n GLU 181 N -3.67 2.69 -1.24 4.56 1.02 -1.26 -4.96 120.64 117.78 1aje n GLU 181 Ca 0.08 -4.48 -0.38 0.00 -0.02 0.00 0.00 57.16 52.35 1aje n GLU 181 Cb 0.54 -2.41 -0.03 0.00 -0.02 0.00 0.00 31.44 29.51 1aje n GLU 181 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1aje n PRO 182 N 2.26 2.18 -0.17 3.49 -0.04 -1.26 -4.91 135.00 136.54 1aje n PRO 182 Ca 0.22 -2.00 -0.07 0.00 -0.04 0.00 0.00 63.50 61.61 1aje n PRO 182 Cb 0.37 -2.91 -0.01 0.00 -0.04 0.00 0.00 33.50 30.91 1aje n PRO 182 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1aje n LYS 183 N 5.90 0.00 -2.21 0.54 0.00 -1.26 -4.75 118.16 116.38 1aje n LYS 183 Ca 0.52 0.00 -0.42 0.00 0.00 0.00 0.00 58.31 58.41 1aje n LYS 183 Cb 0.33 -0.15 -0.03 0.00 0.00 0.00 0.00 35.03 35.18 1aje n LYS 183 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1aje s LYS 184 N 0.26 4.35 1.12 1.64 2.47 -1.26 -5.00 119.74 123.32 1aje s LYS 184 Ca 0.10 2.04 -0.13 0.00 -1.56 0.00 0.00 55.97 56.42 1aje s LYS 184 Cb -0.15 -3.25 0.26 0.00 -1.46 0.00 0.00 37.83 33.23 1aje s LYS 184 CO 0.08 -0.38 1.05 -1.54 0.16 0.00 0.00 175.35 174.72 1aje s SER 185 N 0.95 1.43 -1.02 1.43 1.04 -1.26 -4.95 113.70 111.33 1aje s SER 185 Ca 0.62 1.28 -0.06 0.00 0.48 0.00 0.00 55.95 58.27 1aje s SER 185 Cb -0.36 -1.99 0.25 0.00 0.10 0.00 0.00 66.02 64.02 1aje s SER 185 CO 0.32 -3.89 0.97 -0.13 0.98 0.00 0.00 173.24 171.49 1aje s ARG 186 N -4.73 3.82 0.00 4.02 1.81 -1.26 -5.31 118.95 117.30 1aje s ARG 186 Ca 0.67 -3.21 0.15 0.00 -1.72 0.00 0.00 55.73 51.63 1aje s ARG 186 Cb -0.21 -4.32 0.12 0.00 -0.45 0.00 0.00 34.95 30.08 1aje s ARG 186 CO 0.61 -1.25 0.97 0.54 -0.68 0.00 0.00 175.30 175.50