#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 0.97 -0.28 1.61 1.04 -1.26 -5.08 113.70 110.69 1aje s SER -6 Ca 0.00 -0.98 -0.32 0.00 0.48 0.00 0.00 55.95 55.13 1aje s SER -6 Cb 0.00 0.12 -0.09 0.00 0.10 0.00 0.00 66.02 66.15 1aje s SER -6 CO 0.00 -0.48 2.19 1.17 0.98 0.00 0.00 173.24 177.10 1aje n LYS -5 N 0.08 1.48 -3.38 4.02 4.81 -1.26 -4.94 118.16 118.98 1aje n LYS -5 Ca -0.13 0.41 -0.32 0.00 -0.87 0.00 0.00 58.31 57.40 1aje n LYS -5 Cb 0.60 -2.79 -0.05 0.00 0.02 0.00 0.00 35.03 32.81 1aje n LYS -5 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1aje s ILE -4 N 7.61 4.90 1.12 3.15 1.10 -1.26 -5.06 121.20 132.76 1aje s ILE -4 Ca 1.05 0.52 -0.14 0.00 -0.51 0.00 0.00 60.65 61.57 1aje s ILE -4 Cb -0.64 -3.62 0.25 0.00 0.15 0.00 0.00 42.46 38.61 1aje s ILE -4 CO 0.43 -0.09 1.06 -0.63 -2.11 0.00 0.00 174.94 173.61 1aje s ILE -3 N -1.84 1.89 0.00 2.00 1.09 -1.26 -5.03 121.20 118.04 1aje s ILE -3 Ca 0.48 0.00 0.00 0.00 -1.10 0.00 0.00 60.65 60.03 1aje s ILE -3 Cb -0.11 -2.34 0.00 0.00 -1.06 0.00 0.00 42.46 38.95 1aje s ILE -3 CO 0.21 0.00 0.00 -0.24 -0.10 0.00 0.00 174.94 174.81 1aje n SER -2 N -4.62 0.00 -0.60 3.58 2.88 -1.26 -5.02 113.62 108.58 1aje n SER -2 Ca 0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.60 1aje n SER -2 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1aje n SER -2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aje n ALA -1 N -0.81 -2.75 -2.05 -1.46 0.00 -1.23 -4.52 120.51 107.68 1aje n ALA -1 Ca 0.00 0.13 -0.08 0.00 0.00 0.00 0.00 53.44 53.49 1aje n ALA -1 Cb 0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 19.45 18.68 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 -0.03 -0.95 -0.43 0.00 2.81 -1.22 -4.64 117.12 112.66 1aje n MET 1 Ca 0.00 0.03 0.39 0.00 -1.81 0.00 0.00 57.70 56.30 1aje n MET 1 Cb 0.00 -0.88 0.74 0.00 -0.71 0.00 0.00 33.22 32.36 1aje n MET 1 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1aje h GLN 2 N -0.16 0.04 -4.65 0.03 1.08 -1.78 -3.45 115.11 106.23 1aje h GLN 2 Ca -0.11 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1aje h GLN 2 Cb 0.26 -0.01 -0.07 0.00 -0.05 0.00 0.00 27.48 27.61 1aje h GLN 2 CO 0.17 0.03 -1.11 2.41 -0.95 0.00 0.00 178.83 179.37 1aje n THR 3 N -4.21-10.71 -3.91 -0.54 -1.04 -1.26 -4.87 114.28 87.74 1aje n THR 3 Ca 0.31 1.98 -0.33 0.00 -2.04 0.00 0.00 64.05 63.97 1aje n THR 3 Cb 1.41 -6.14 -0.13 0.00 -1.82 0.00 0.00 70.33 63.65 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 -0.84 2.74 0.48 12.58 1.09 0.47 -4.62 121.20 133.09 1aje s ILE 4 Ca -0.15 -2.36 -0.21 0.00 -1.10 0.00 0.00 60.65 56.83 1aje s ILE 4 Cb 0.01 -2.94 -0.08 0.00 -1.06 0.00 0.00 42.46 38.39 1aje s ILE 4 CO 0.64 -0.66 1.08 -0.75 -0.10 0.00 0.00 174.94 175.15 1aje s LYS 5 N 0.84 3.77 -0.00 2.79 2.47 -1.26 -0.75 119.74 127.60 1aje s LYS 5 Ca 0.11 1.53 0.03 0.00 -1.56 0.00 0.00 55.97 56.08 1aje s LYS 5 Cb -0.21 -2.23 -0.01 0.00 -1.46 0.00 0.00 37.83 33.92 1aje s LYS 5 CO -0.06 -0.49 -0.10 0.00 0.16 0.00 0.00 175.35 174.86 1aje s VAL 7 N -0.33 3.65 -0.02 0.00 1.01 0.17 -0.42 120.40 124.47 1aje s VAL 7 Ca 0.03 -1.96 -0.26 0.00 0.00 0.00 0.00 61.98 59.79 1aje s VAL 7 Cb -0.04 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1aje s VAL 7 CO -0.00 -0.73 0.82 -0.69 0.00 0.00 0.00 175.10 174.51 1aje s VAL 8 N 1.22 4.91 0.19 2.92 1.01 -0.99 0.30 120.40 129.96 1aje s VAL 8 Ca 0.07 1.73 0.08 0.00 0.00 0.00 0.00 61.98 63.86 1aje s VAL 8 Cb -0.24 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 1aje s VAL 8 CO -0.03 0.24 -0.17 0.68 0.00 0.00 0.00 175.10 175.82 1aje s VAL 9 N 0.71 1.83 0.00 2.92 -7.23 -0.27 -2.43 120.40 115.93 1aje s VAL 9 Ca 0.43 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 1aje s VAL 9 Cb -0.20 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 34.81 1aje s VAL 9 CO 0.23 -0.41 0.00 0.61 -0.31 0.00 0.00 175.10 175.22 1aje n GLY 10 N 0.01 -1.34 0.06 2.32 0.00 -1.24 -2.90 105.19 102.12 1aje n GLY 10 Ca -0.11 -1.59 0.01 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 -1.78 0.18 -2.79 1.61 9.92 -1.26 -4.81 116.55 117.61 1aje n ASP 11 Ca 0.00 0.08 -0.03 0.00 -0.53 0.00 0.00 54.79 54.30 1aje n ASP 11 Cb 0.00 1.24 -0.03 0.00 -0.64 0.00 0.00 41.12 41.70 1aje n ASP 11 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1aje n GLY 12 N 1.47 -3.27 3.15 0.44 0.00 -1.26 -2.50 105.19 103.21 1aje n GLY 12 Ca -0.16 1.07 -0.23 0.00 0.00 0.00 0.00 46.02 46.70 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 1.90 -0.67 -3.66 4.61 0.00 -1.26 0.23 120.51 121.67 1aje n ALA 13 Ca -0.24 -0.12 -0.27 0.00 0.00 0.00 0.00 53.44 52.82 1aje n ALA 13 Cb 0.40 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 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 -2.42 -0.59 -3.09 0.00 3.14 -1.12 -4.84 118.33 109.40 1aje n VAL 14 Ca 0.06 0.00 -0.18 0.00 -2.96 0.00 0.00 64.34 61.26 1aje n VAL 14 Cb 0.24 -1.19 -0.02 0.00 -1.06 0.00 0.00 33.84 31.82 1aje n VAL 14 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1aje n GLY 15 N -1.07 2.55 0.00 7.55 0.00 0.64 -4.90 105.19 109.96 1aje n GLY 15 Ca 0.04 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.83 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 0.90 1.18 0.20 1.61 2.85 -1.23 -3.01 118.16 120.65 1aje n LYS 16 Ca 0.19 -0.01 -0.09 0.00 -1.05 0.00 0.00 58.31 57.36 1aje n LYS 16 Cb 0.61 -0.94 -0.04 0.00 -0.65 0.00 0.00 35.03 34.01 1aje n LYS 16 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1aje h THR 17 N 0.00 0.00 -1.40 0.58 2.02 -1.90 -2.40 112.91 109.80 1aje h THR 17 Ca 0.00 0.00 0.47 0.00 0.77 0.00 0.00 66.41 67.65 1aje h THR 17 Cb 0.04 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.32 1aje h THR 17 CO 0.00 0.00 0.91 0.00 0.37 0.00 0.00 175.52 176.80 1aje n LEU 19 N -4.66 0.00 -0.38 0.00 -0.00 -0.91 -2.25 117.00 108.80 1aje n LEU 19 Ca 0.39 1.00 -0.02 0.00 -0.00 0.00 0.00 56.01 57.38 1aje n LEU 19 Cb 1.55 -0.50 0.03 0.00 -0.00 0.00 0.00 43.42 44.50 1aje n LEU 19 CO 0.21 -0.50 0.58 -0.07 -0.00 0.00 0.00 177.39 177.62 1aje h LEU 20 N 0.00 -1.49 -0.86 -1.96 4.07 -0.49 0.50 115.31 115.08 1aje h LEU 20 Ca 0.00 0.31 0.19 0.00 0.08 0.00 0.00 57.88 58.47 1aje h LEU 20 Cb 0.00 0.77 -0.16 0.00 1.08 0.00 0.00 40.66 42.35 1aje h LEU 20 CO 0.00 -0.29 -0.14 -0.38 -1.08 0.00 0.00 178.44 176.56 1aje n ILE 21 N -5.46 -0.36 -0.03 1.22 2.08 -0.87 0.24 119.36 116.18 1aje n ILE 21 Ca 0.09 1.95 -0.17 0.00 0.56 0.00 0.00 62.75 65.19 1aje n ILE 21 Cb 0.39 -2.75 -0.06 0.00 -0.75 0.00 0.00 39.64 36.47 1aje n ILE 21 CO 0.00 0.00 0.00 -1.28 0.56 0.00 0.00 176.55 175.83 1aje h SER 22 N 0.00 0.94 -0.43 4.38 0.87 0.39 1.62 113.55 121.33 1aje h SER 22 Ca 0.45 -0.59 0.12 0.00 -1.23 0.00 0.00 61.79 60.54 1aje h SER 22 Cb 0.78 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.45 1aje h SER 22 CO -0.86 1.39 0.84 0.22 -0.53 0.00 0.00 176.83 177.89 1aje h TYR 23 N 0.57 0.00 0.00 2.24 3.20 0.46 0.44 116.97 123.88 1aje h TYR 23 Ca -0.04 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.83 1aje h TYR 23 Cb 1.35 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.62 1aje h TYR 23 CO 0.08 0.00 -0.46 0.25 -1.64 0.00 0.00 178.16 176.40 1aje n THR 24 N -3.06 0.00 0.63 1.81 -2.24 -0.83 -4.82 114.28 105.78 1aje n THR 24 Ca 0.09 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.93 1aje n THR 24 Cb 0.99 -0.40 -0.07 0.00 -2.10 0.00 0.00 70.33 68.74 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 -1.36 0.00 -2.12 4.28 -2.24 0.55 -4.94 114.28 108.45 1aje n THR 25 Ca 0.00 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1aje n THR 25 Cb 0.23 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 1aje n THR 25 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1aje n ASN 26 N -1.27 -0.78 -3.34 3.42 3.02 0.15 -4.76 115.26 111.70 1aje n ASN 26 Ca 0.03 0.39 -0.13 0.00 -0.03 0.00 0.00 54.58 54.84 1aje n ASN 26 Cb 0.21 -0.84 -0.07 0.00 -0.61 0.00 0.00 39.78 38.47 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1aje s LYS 27 N -4.16 0.44 -0.12 3.52 2.20 -1.26 -4.87 119.74 115.50 1aje s LYS 27 Ca 0.00 -0.17 -0.06 0.00 -0.36 0.00 0.00 55.97 55.38 1aje s LYS 27 Cb 0.00 -0.49 -0.04 0.00 -1.51 0.00 0.00 37.83 35.79 1aje s LYS 27 CO 0.00 -1.07 0.11 -0.59 -0.36 0.00 0.00 175.35 173.44 1aje s PHE 28 N 2.24 3.49 -0.43 4.03 -0.71 -1.26 -4.81 117.98 120.53 1aje s PHE 28 Ca 0.11 0.44 -0.03 0.00 -1.04 0.00 0.00 56.93 56.41 1aje s PHE 28 Cb -0.13 -1.92 0.15 0.00 -1.21 0.00 0.00 43.02 39.91 1aje s PHE 28 CO -0.25 0.65 2.43 -0.35 -1.34 0.00 0.00 175.22 176.36 1aje n PRO 29 N 2.13 2.21 0.00 1.99 -0.04 -1.26 -4.89 135.00 135.14 1aje n PRO 29 Ca -0.19 -2.15 0.00 0.00 -0.04 0.00 0.00 63.50 61.11 1aje n PRO 29 Cb 0.54 -1.96 0.00 0.00 -0.04 0.00 0.00 33.50 32.04 1aje n PRO 29 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1aje n SER 30 N 0.53 0.00 -2.96 3.54 2.88 -1.26 -3.74 113.62 112.61 1aje n SER 30 Ca 0.43 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.81 1aje n SER 30 Cb 0.56 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.01 1aje n SER 30 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1aje n GLU 31 N 0.00 1.30 -1.70 -1.46 1.02 -1.26 -5.00 120.64 113.54 1aje n GLU 31 Ca 0.00 -3.49 0.00 0.00 -0.02 0.00 0.00 57.16 53.65 1aje n GLU 31 Cb 0.00 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.81 1aje n GLU 31 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1aje n TYR 32 N 0.09 0.00 -1.38 -0.32 9.36 -1.25 -4.87 117.16 118.80 1aje n TYR 32 Ca 0.21 0.00 -0.31 0.00 3.32 0.00 0.00 57.90 61.12 1aje n TYR 32 Cb 0.70 -0.85 0.08 0.00 -0.63 0.00 0.00 39.34 38.64 1aje n TYR 32 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1aje s VAL 33 N 0.00 3.49 -1.05 2.97 -7.23 -1.26 -4.86 120.40 112.46 1aje s VAL 33 Ca 0.00 0.48 -0.22 0.00 -1.81 0.00 0.00 61.98 60.43 1aje s VAL 33 Cb 0.00 -3.07 -0.11 0.00 0.56 0.00 0.00 36.38 33.76 1aje s VAL 33 CO 0.00 -0.63 1.92 -0.81 -0.31 0.00 0.00 175.10 175.27 1aje n PRO 34 N -3.42 1.58 0.00 4.82 -0.04 -1.26 -4.22 135.00 132.47 1aje n PRO 34 Ca 0.08 -2.29 0.00 0.00 -0.04 0.00 0.00 63.50 61.26 1aje n PRO 34 Cb 0.54 -3.48 0.00 0.00 -0.04 0.00 0.00 33.50 30.52 1aje n PRO 34 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1aje n THR 35 N 7.25 0.16 -2.60 0.52 -1.04 -1.26 -5.09 114.28 112.22 1aje n THR 35 Ca 0.46 -0.17 -0.04 0.00 -2.04 0.00 0.00 64.05 62.27 1aje n THR 35 Cb 0.45 0.93 -0.03 0.00 -1.82 0.00 0.00 70.33 69.85 1aje n THR 35 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1aje n VAL 36 N -0.08-11.19 -3.76 12.58 0.31 -1.26 -4.95 118.33 109.98 1aje n VAL 36 Ca 0.00 2.45 -0.37 0.00 -0.01 0.00 0.00 64.34 66.41 1aje n VAL 36 Cb 0.46 -5.82 -0.12 0.00 -0.91 0.00 0.00 33.84 27.45 1aje n VAL 36 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1aje s PHE 37 N -0.55 3.39 0.74 3.52 0.08 -1.26 -5.09 117.98 118.81 1aje s PHE 37 Ca -0.20 -1.89 -0.00 0.00 0.12 0.00 0.00 56.93 54.96 1aje s PHE 37 Cb 0.01 -2.75 0.15 0.00 -0.57 0.00 0.00 43.02 39.86 1aje s PHE 37 CO 0.53 -0.86 1.01 -0.25 -0.10 0.00 0.00 175.22 175.55 1aje n ASP 38 N 4.72 1.37 -4.95 1.36 9.92 -1.26 -5.10 116.55 122.61 1aje n ASP 38 Ca -0.08 -2.15 -0.23 0.00 -0.53 0.00 0.00 54.79 51.79 1aje n ASP 38 Cb 0.43 -0.65 -0.02 0.00 -0.64 0.00 0.00 41.12 40.24 1aje n ASP 38 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 1aje s ASN 39 N -5.11 6.31 0.09 -2.24 0.01 -1.26 -5.10 114.94 107.64 1aje s ASN 39 Ca 0.67 0.33 -0.16 0.00 -0.71 0.00 0.00 52.86 52.98 1aje s ASN 39 Cb -0.04 -1.98 0.06 0.00 0.41 0.00 0.00 41.25 39.70 1aje s ASN 39 CO 0.44 -0.20 0.78 0.00 -1.51 0.00 0.00 177.10 176.61 1aje n TYR 40 N -1.57 -0.91 -4.03 2.20 0.18 -1.26 -5.03 117.16 106.74 1aje n TYR 40 Ca -0.06 -0.80 -0.31 0.00 1.88 0.00 0.00 57.90 58.61 1aje n TYR 40 Cb 0.56 0.38 -0.15 0.00 -0.38 0.00 0.00 39.34 39.76 1aje n TYR 40 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1aje s ALA 41 N -1.73 2.81 0.77 -3.48 0.00 -1.26 -2.71 121.76 116.17 1aje s ALA 41 Ca 0.18 -2.32 -0.09 0.00 0.00 0.00 0.00 51.96 49.73 1aje s ALA 41 Cb -0.02 -1.87 0.10 0.00 0.00 0.00 0.00 23.12 21.34 1aje s ALA 41 CO 0.03 -1.55 1.10 0.14 0.00 0.00 0.00 175.76 175.48 1aje s VAL 42 N 0.96 2.16 -0.21 0.00 -7.23 -1.01 -4.45 120.40 110.62 1aje s VAL 42 Ca 0.05 -0.22 -0.04 0.00 -1.81 0.00 0.00 61.98 59.96 1aje s VAL 42 Cb -0.19 -2.94 -0.02 0.00 0.56 0.00 0.00 36.38 33.78 1aje s VAL 42 CO -0.07 0.00 -0.02 -0.89 -0.31 0.00 0.00 175.10 173.81 1aje s THR 43 N -3.41 3.73 0.49 5.32 2.01 -1.26 0.48 115.64 122.98 1aje s THR 43 Ca 0.64 -0.39 0.07 0.00 0.31 0.00 0.00 61.69 62.32 1aje s THR 43 Cb -0.09 -2.68 0.01 0.00 0.01 0.00 0.00 72.50 69.75 1aje s THR 43 CO 0.47 0.43 0.40 0.68 -0.69 0.00 0.00 174.62 175.91 1aje s VAL 44 N 1.15 2.13 -0.18 3.82 -7.23 -1.08 -4.86 120.40 114.16 1aje s VAL 44 Ca 0.02 -1.42 -0.01 0.00 -1.81 0.00 0.00 61.98 58.76 1aje s VAL 44 Cb -0.14 -2.55 0.05 0.00 0.56 0.00 0.00 36.38 34.30 1aje s VAL 44 CO 0.01 0.00 -0.01 -0.04 -0.31 0.00 0.00 175.10 174.74 1aje s MET 45 N -4.22 1.10 -0.15 4.82 -1.94 -1.26 -0.98 119.30 116.68 1aje s MET 45 Ca 0.42 -0.50 -0.21 0.00 -1.71 0.00 0.00 55.69 53.69 1aje s MET 45 Cb -0.02 -2.05 -0.18 0.00 2.01 0.00 0.00 34.83 34.59 1aje s MET 45 CO 0.25 -0.53 0.44 0.82 -0.01 0.00 0.00 175.02 176.00 1aje h ILE 46 N 6.47 1.16 -0.24 2.53 5.03 -1.91 -3.43 117.51 127.11 1aje h ILE 46 Ca -0.20 -1.97 -0.21 0.00 -0.12 0.00 0.00 64.86 62.36 1aje h ILE 46 Cb 1.11 2.29 -0.29 0.00 -3.03 0.00 0.00 36.82 36.90 1aje h ILE 46 CO 0.37 0.39 -0.74 0.61 -0.68 0.00 0.00 178.15 178.10 1aje n GLY 47 N 1.60 1.89 0.00 5.37 0.00 -1.26 -4.91 105.19 107.89 1aje n GLY 47 Ca -0.13 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.23 1aje n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aje n GLY 48 N -1.01 1.13 2.91 -0.02 0.00 -1.26 -5.08 105.19 101.85 1aje n GLY 48 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.51 0.94 0.11 1.61 2.02 -1.26 -4.97 118.70 116.64 1aje s GLU 49 Ca 0.00 -0.14 -0.30 0.00 0.02 0.00 0.00 54.97 54.55 1aje s GLU 49 Cb 0.00 -0.92 -0.06 0.00 0.10 0.00 0.00 34.13 33.25 1aje s GLU 49 CO 0.00 -0.07 1.07 -1.25 0.02 0.00 0.00 175.26 175.03 1aje s PRO 50 N 0.91 4.58 -0.33 0.39 0.04 -1.25 -2.79 135.00 136.55 1aje s PRO 50 Ca -0.11 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.55 1aje s PRO 50 Cb -0.14 -3.34 0.10 0.00 0.04 0.00 0.00 34.50 31.16 1aje s PRO 50 CO 0.00 0.02 0.11 0.71 0.04 0.00 0.00 177.00 177.88 1aje s TYR 51 N 0.26 2.03 0.62 0.56 1.51 -0.15 -3.23 117.35 118.95 1aje s TYR 51 Ca 0.51 -2.00 -0.19 0.00 -1.01 0.00 0.00 57.07 54.38 1aje s TYR 51 Cb -0.27 -1.91 -0.02 0.00 -0.11 0.00 0.00 41.96 39.65 1aje s TYR 51 CO 0.31 -0.88 1.30 0.99 -1.11 0.00 0.00 175.55 176.17 1aje s THR 52 N 1.37 2.11 -0.18 -0.71 2.01 -1.25 -2.63 115.64 116.36 1aje s THR 52 Ca 0.11 0.07 -0.05 0.00 0.31 0.00 0.00 61.69 62.13 1aje s THR 52 Cb -0.18 -3.03 0.06 0.00 0.01 0.00 0.00 72.50 69.36 1aje s THR 52 CO -0.20 -0.01 0.09 -1.48 -0.69 0.00 0.00 174.62 172.33 1aje s LEU 53 N -4.12 0.42 -0.35 4.42 -0.00 0.18 0.18 118.68 119.40 1aje s LEU 53 Ca 0.79 -0.66 -0.12 0.00 -0.00 0.00 0.00 54.13 54.15 1aje s LEU 53 Cb -0.38 -0.28 0.00 0.00 -0.00 0.00 0.00 46.19 45.54 1aje s LEU 53 CO 0.41 -0.35 0.22 -0.83 -0.00 0.00 0.00 176.35 175.80 1aje s GLY 54 N 2.11 1.94 0.12 -3.48 0.00 0.07 -2.42 107.32 105.66 1aje s GLY 54 Ca 0.02 -1.52 -0.17 0.00 0.00 0.00 0.00 44.72 43.05 1aje s GLY 54 CO -0.10 0.79 0.56 1.08 0.00 0.00 0.00 173.10 175.44 1aje s LEU 55 N 1.64 4.42 -0.04 0.66 1.02 -1.10 0.11 118.68 125.39 1aje s LEU 55 Ca 0.05 1.17 0.04 0.00 0.02 0.00 0.00 54.13 55.40 1aje s LEU 55 Cb -0.18 -3.12 -0.00 0.00 0.02 0.00 0.00 46.19 42.91 1aje s LEU 55 CO 0.08 0.17 -0.15 0.12 0.02 0.00 0.00 176.35 176.60 1aje s PHE 56 N -1.32 1.51 0.71 0.29 5.36 0.45 -4.37 117.98 120.61 1aje s PHE 56 Ca 0.34 -0.42 -0.12 0.00 -0.96 0.00 0.00 56.93 55.76 1aje s PHE 56 Cb -0.17 -1.03 0.02 0.00 -0.34 0.00 0.00 43.02 41.50 1aje s PHE 56 CO 0.19 -0.15 1.09 0.16 -1.46 0.00 0.00 175.22 175.05 1aje s ASP 57 N 0.08 4.92 -0.43 6.13 -4.77 -1.26 -2.33 116.67 119.01 1aje s ASP 57 Ca -0.04 1.85 0.03 0.00 -3.30 0.00 0.00 52.55 51.09 1aje s ASP 57 Cb -0.11 -2.53 0.25 0.00 -1.09 0.00 0.00 42.92 39.44 1aje s ASP 57 CO 0.02 -1.75 1.00 0.41 0.70 0.00 0.00 175.17 175.54 1aje n THR 58 N -2.99 0.00 -2.58 2.11 -1.04 -1.02 -4.82 114.28 103.94 1aje n THR 58 Ca 0.09 -1.14 -0.16 0.00 -2.04 0.00 0.00 64.05 60.81 1aje n THR 58 Cb 0.53 1.29 0.08 0.00 -1.82 0.00 0.00 70.33 70.41 1aje n THR 58 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1aje n ALA 59 N 1.73 0.24 -0.60 2.41 0.00 -1.26 -3.58 120.51 119.45 1aje n ALA 59 Ca 0.07 -1.38 0.00 0.00 0.00 0.00 0.00 53.44 52.13 1aje n ALA 59 Cb 0.65 0.25 0.00 0.00 0.00 0.00 0.00 19.45 20.35 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 -0.28 3.29 3.01 0.00 0.00 -1.26 -4.13 105.19 105.82 1aje n GLY 60 Ca 0.11 0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 1aje n GLY 60 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1aje s GLN 61 N 0.00 1.99 0.29 1.61 0.74 -1.26 -4.94 119.66 118.09 1aje s GLN 61 Ca 0.00 -1.13 0.09 0.00 0.05 0.00 0.00 55.36 54.36 1aje s GLN 61 Cb 0.00 -2.71 0.89 0.00 1.10 0.00 0.00 33.01 32.29 1aje s GLN 61 CO 0.00 -0.56 1.38 -0.85 -0.55 0.00 0.00 175.29 174.71 1aje n GLU 62 N 4.56 -0.06 -0.34 1.67 0.28 -1.26 0.15 120.64 125.64 1aje n GLU 62 Ca -0.13 1.27 0.16 0.00 -0.16 0.00 0.00 57.16 58.29 1aje n GLU 62 Cb 0.44 -2.12 0.36 0.00 1.43 0.00 0.00 31.44 31.54 1aje n GLU 62 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1aje h ASP 63 N 0.00 0.63 -0.96 -1.84 5.19 -1.86 0.62 116.42 118.20 1aje h ASP 63 Ca 0.62 0.13 0.28 0.00 -0.62 0.00 0.00 57.03 57.44 1aje h ASP 63 Cb 1.47 0.04 -0.17 0.00 0.18 0.00 0.00 39.33 40.85 1aje h ASP 63 CO -0.76 0.11 0.13 0.22 -3.12 0.00 0.00 179.24 175.83 1aje h TYR 64 N 0.58 0.14 0.00 4.55 3.20 0.10 -2.26 116.97 123.28 1aje h TYR 64 Ca 0.62 0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.55 1aje h TYR 64 Cb 1.13 0.09 0.00 0.00 1.54 0.00 0.00 36.73 39.49 1aje h TYR 64 CO -0.03 -0.38 0.00 -0.40 -1.64 0.00 0.00 178.16 175.71 1aje n ASP 65 N -5.40 1.28 0.00 -2.11 5.75 -0.37 -5.03 116.55 110.68 1aje n ASP 65 Ca 0.24 -1.46 0.00 0.00 -0.01 0.00 0.00 54.79 53.56 1aje n ASP 65 Cb 0.80 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.89 1aje n ASP 65 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1aje n ARG 66 N -0.23 0.00 -3.24 0.11 0.00 0.20 -5.13 116.66 108.38 1aje n ARG 66 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.61 1aje n ARG 66 Cb 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 32.46 32.63 1aje n ARG 66 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 1aje s LEU 67 N 0.00 3.94 0.24 6.15 2.34 -1.26 -2.41 118.68 127.68 1aje s LEU 67 Ca 0.00 0.54 -0.27 0.00 0.06 0.00 0.00 54.13 54.46 1aje s LEU 67 Cb 0.00 -3.42 -0.16 0.00 -0.56 0.00 0.00 46.19 42.05 1aje s LEU 67 CO 0.00 -0.35 0.58 -2.11 -1.06 0.00 0.00 176.35 173.41 1aje n ARG 68 N -1.88 0.27 -1.32 1.48 0.00 -1.26 -4.90 116.66 109.05 1aje n ARG 68 Ca -0.04 0.09 -0.31 0.00 -0.00 0.00 0.00 57.85 57.60 1aje n ARG 68 Cb 0.56 -1.17 0.10 0.00 -0.00 0.00 0.00 32.46 31.94 1aje n ARG 68 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1aje s PRO 69 N -1.13 2.07 0.00 2.89 0.04 -1.26 -4.93 135.00 132.69 1aje s PRO 69 Ca 0.63 1.00 0.23 0.00 0.04 0.00 0.00 61.00 62.89 1aje s PRO 69 Cb -0.85 -1.89 1.18 0.00 0.04 0.00 0.00 34.50 32.98 1aje s PRO 69 CO 0.57 -1.72 1.79 1.28 0.04 0.00 0.00 177.00 178.96 1aje n LEU 70 N -3.55 0.56 0.00 -3.56 4.77 -1.26 -4.89 117.00 109.06 1aje n LEU 70 Ca 0.08 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1aje n LEU 70 Cb 0.54 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1aje n LEU 70 CO 0.55 0.11 0.00 -0.24 -1.33 0.00 0.00 177.39 176.47 1aje n SER 71 N -0.47 2.33 -3.76 -1.43 2.88 -1.26 -5.15 113.62 106.76 1aje n SER 71 Ca 0.17 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.48 1aje n SER 71 Cb 0.17 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.45 1aje n SER 71 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1aje s TYR 72 N 0.17 0.67 -0.08 0.66 5.04 -1.26 -5.04 117.35 117.52 1aje s TYR 72 Ca 0.00 -0.23 -0.26 0.00 -2.44 0.00 0.00 57.07 54.14 1aje s TYR 72 Cb 0.00 -0.81 -0.22 0.00 0.35 0.00 0.00 41.96 41.28 1aje s TYR 72 CO 0.00 -0.36 0.98 -1.00 -1.34 0.00 0.00 175.55 173.83 1aje h PRO 73 N 8.33 -0.03 0.00 4.97 0.13 -2.01 -3.50 132.00 139.89 1aje h PRO 73 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1aje h PRO 73 Cb 1.12 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1aje h PRO 73 CO 0.27 0.65 0.00 0.00 -0.23 0.00 0.00 178.00 178.68 1aje n GLN 74 N -4.76 0.00 0.00 0.86 10.64 -1.26 -5.08 117.38 117.78 1aje n GLN 74 Ca -0.09 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.08 1aje n GLN 74 Cb 0.34 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.72 1aje n GLN 74 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1aje n THR 75 N 0.00 0.00 -3.24 -0.39 -2.24 -1.26 -4.95 114.28 102.20 1aje n THR 75 Ca 0.00 0.90 -0.15 0.00 -2.27 0.00 0.00 64.05 62.53 1aje n THR 75 Cb 0.00 -1.71 0.07 0.00 -2.10 0.00 0.00 70.33 66.59 1aje n THR 75 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1aje n ASP 76 N -1.12 -4.72 -3.32 3.42 2.03 0.52 -4.86 116.55 108.48 1aje n ASP 76 Ca 0.00 -0.64 -0.07 0.00 0.52 0.00 0.00 54.79 54.60 1aje n ASP 76 Cb 0.00 -4.94 0.07 0.00 -0.72 0.00 0.00 41.12 35.53 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 -3.46 0.00 -3.92 5.18 0.31 0.39 -4.21 118.33 112.62 1aje n VAL 77 Ca -0.15 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 63.88 1aje n VAL 77 Cb 0.63 -0.24 -0.15 0.00 -0.91 0.00 0.00 33.84 33.18 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 -1.38 2.84 -0.77 3.52 0.08 -0.70 0.43 117.98 122.00 1aje s PHE 78 Ca 0.16 -2.35 -0.20 0.00 0.12 0.00 0.00 56.93 54.66 1aje s PHE 78 Cb -0.03 -2.25 0.10 0.00 -0.57 0.00 0.00 43.02 40.27 1aje s PHE 78 CO 0.13 -0.89 1.00 -0.51 -0.10 0.00 0.00 175.22 174.85 1aje s LEU 79 N 1.23 4.84 -0.43 -0.37 2.01 0.15 -0.62 118.68 125.49 1aje s LEU 79 Ca 0.07 -1.54 -0.27 0.00 0.01 0.00 0.00 54.13 52.40 1aje s LEU 79 Cb -0.18 -2.39 0.02 0.00 0.01 0.00 0.00 46.19 43.65 1aje s LEU 79 CO -0.13 -1.22 1.03 -0.69 1.01 0.00 0.00 176.35 176.35 1aje s VAL 80 N 3.23 4.39 -0.18 -1.59 1.01 -0.41 -1.11 120.40 125.73 1aje s VAL 80 Ca 0.25 1.13 -0.29 0.00 0.00 0.00 0.00 61.98 63.07 1aje s VAL 80 Cb -0.12 -4.48 -0.03 0.00 0.00 0.00 0.00 36.38 31.75 1aje s VAL 80 CO 0.01 -0.81 1.55 0.00 0.00 0.00 0.00 175.10 175.85 1aje s PHE 82 N 4.65 3.45 -0.16 0.00 2.19 0.35 -4.51 117.98 123.96 1aje s PHE 82 Ca 0.68 1.31 0.00 0.00 0.33 0.00 0.00 56.93 59.26 1aje s PHE 82 Cb -0.26 -2.59 0.02 0.00 -1.31 0.00 0.00 43.02 38.88 1aje s PHE 82 CO 0.27 0.15 -0.15 -1.12 1.83 0.00 0.00 175.22 176.20 1aje s SER 83 N -2.08 2.81 0.00 6.13 0.01 -1.26 0.11 113.70 119.43 1aje s SER 83 Ca 0.52 -0.54 0.10 0.00 1.31 0.00 0.00 55.95 57.34 1aje s SER 83 Cb -0.12 -1.23 0.05 0.00 0.21 0.00 0.00 66.02 64.92 1aje s SER 83 CO 0.18 -0.05 0.75 0.52 0.41 0.00 0.00 173.24 175.05 1aje n VAL 84 N 4.74 0.00 -0.02 3.43 0.31 -1.26 -2.34 118.33 123.20 1aje n VAL 84 Ca -0.17 -0.45 0.08 0.00 -0.01 0.00 0.00 64.34 63.79 1aje n VAL 84 Cb 0.50 1.18 0.27 0.00 -0.91 0.00 0.00 33.84 34.88 1aje n VAL 84 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1aje n VAL 85 N 0.22 1.17 -3.77 2.52 0.24 -1.26 -2.49 118.33 114.95 1aje n VAL 85 Ca 0.05 -0.86 -0.09 0.00 -2.04 0.00 0.00 64.34 61.40 1aje n VAL 85 Cb 0.24 0.18 -0.06 0.00 -1.47 0.00 0.00 33.84 32.73 1aje n VAL 85 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1aje s SER 86 N -0.88 -0.02 -0.31 -1.34 0.15 -1.26 -4.73 113.70 105.30 1aje s SER 86 Ca 0.40 -0.51 -0.28 0.00 0.70 0.00 0.00 55.95 56.25 1aje s SER 86 Cb 0.24 0.39 -0.02 0.00 -1.71 0.00 0.00 66.02 64.92 1aje s SER 86 CO 0.22 -0.77 1.84 -2.16 1.20 0.00 0.00 173.24 173.56 1aje s PRO 87 N -3.81 3.33 -1.83 5.44 0.04 -1.09 -2.90 135.00 134.17 1aje s PRO 87 Ca 0.04 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.58 1aje s PRO 87 Cb 0.04 -4.21 0.00 0.00 0.04 0.00 0.00 34.50 30.37 1aje s PRO 87 CO -0.11 -1.86 0.00 0.45 0.04 0.00 0.00 177.00 175.51 1aje n SER 88 N 10.37 -4.73 0.01 6.66 2.88 -1.26 -4.83 113.62 122.72 1aje n SER 88 Ca 0.23 0.39 -0.11 0.00 -1.33 0.00 0.00 58.87 58.05 1aje n SER 88 Cb 0.46 -4.21 -0.06 0.00 -0.75 0.00 0.00 64.21 59.66 1aje n SER 88 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1aje h SER 89 N 0.00 0.08 0.00 -3.46 0.87 -1.73 -0.18 113.55 109.13 1aje h SER 89 Ca -0.37 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1aje h SER 89 Cb 1.18 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 1aje h SER 89 CO 0.53 0.06 0.30 2.19 -0.53 0.00 0.00 176.83 179.38 1aje h PHE 90 N 0.09 0.00 0.15 2.24 -0.00 -1.72 -2.39 116.94 115.31 1aje h PHE 90 Ca 0.03 0.00 -0.30 0.00 -0.00 0.00 0.00 57.97 57.70 1aje h PHE 90 Cb -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 35.95 1aje h PHE 90 CO -0.07 0.00 -1.47 0.93 -0.00 0.00 0.00 178.31 177.70 1aje h GLU 91 N 0.00 0.32 -0.01 6.09 4.39 -1.35 -3.24 114.58 120.78 1aje h GLU 91 Ca 0.00 -0.54 0.00 0.00 0.34 0.00 0.00 59.36 59.16 1aje h GLU 91 Cb 0.61 0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1aje h GLU 91 CO 0.00 1.26 0.03 -2.95 -1.16 0.00 0.00 179.01 176.19 1aje h ASN 92 N -0.15 0.00 -0.09 1.42 -1.07 -1.26 0.97 115.58 115.40 1aje h ASN 92 Ca -0.30 0.00 0.03 0.00 0.07 0.00 0.00 56.30 56.10 1aje h ASN 92 Cb 1.88 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 38.13 1aje h ASN 92 CO 0.12 0.00 0.10 0.58 0.07 0.00 0.00 177.43 178.30 1aje h VAL 93 N 0.00 0.53 0.02 6.14 2.07 -1.56 -2.63 116.25 120.82 1aje h VAL 93 Ca 0.01 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 67.23 1aje h VAL 93 Cb 0.07 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 1aje h VAL 93 CO -0.00 0.00 -1.63 0.29 0.02 0.00 0.00 177.57 176.25 1aje n LYS 94 N -3.87 0.60 -0.26 1.57 4.01 0.33 -2.10 118.16 118.44 1aje n LYS 94 Ca -0.01 0.46 0.33 0.00 -0.51 0.00 0.00 58.31 58.58 1aje n LYS 94 Cb 0.20 -1.69 0.74 0.00 -0.51 0.00 0.00 35.03 33.76 1aje n LYS 94 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 1aje h GLU 95 N -0.79 0.00 0.00 1.97 4.39 -1.17 -2.91 114.58 116.08 1aje h GLU 95 Ca -0.43 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.27 1aje h GLU 95 Cb 1.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.15 1aje h GLU 95 CO -0.19 0.00 -0.47 1.63 -1.16 0.00 0.00 179.01 178.82 1aje n LYS 96 N -4.15 2.45 0.04 2.33 5.02 -1.02 -4.62 118.16 118.21 1aje n LYS 96 Ca 0.23 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.32 1aje n LYS 96 Cb 1.15 -0.74 -0.11 0.00 -0.02 0.00 0.00 35.03 35.31 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 1aje h TRP 97 N 0.00 0.92 -0.47 2.13 4.06 -1.45 -2.52 115.95 118.62 1aje h TRP 97 Ca 0.00 -0.52 -0.08 0.00 2.06 0.00 0.00 58.89 60.35 1aje h TRP 97 Cb 0.27 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 28.31 1aje h TRP 97 CO 0.00 1.36 -0.02 0.28 -3.56 0.00 0.00 178.44 176.50 1aje h VAL 98 N 0.23 1.26 0.00 1.49 2.07 -1.51 0.25 116.25 120.04 1aje h VAL 98 Ca -0.13 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.30 1aje h VAL 98 Cb 1.64 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 32.45 1aje h VAL 98 CO 0.19 0.38 0.00 1.55 0.02 0.00 0.00 177.57 179.71 1aje h PRO 99 N 0.69 0.00 0.01 1.57 0.13 -1.69 0.49 132.00 133.19 1aje h PRO 99 Ca 0.13 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.94 1aje h PRO 99 Cb 0.54 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.61 1aje h PRO 99 CO 0.03 0.00 -1.91 0.39 -0.23 0.00 0.00 178.00 176.27 1aje n GLU 100 N -2.77 0.66 -0.10 0.86 4.71 -0.30 -3.74 120.64 119.95 1aje n GLU 100 Ca -0.02 0.22 -0.20 0.00 -0.01 0.00 0.00 57.16 57.15 1aje n GLU 100 Cb 0.10 -1.71 -0.08 0.00 -1.01 0.00 0.00 31.44 28.74 1aje n GLU 100 CO 0.00 0.00 0.00 0.44 0.09 0.00 0.00 177.13 177.66 1aje n ILE 101 N -3.01 1.15 -0.06 -3.67 -5.35 0.73 -4.35 119.36 104.80 1aje n ILE 101 Ca -0.23 -0.34 -0.20 0.00 -0.27 0.00 0.00 62.75 61.72 1aje n ILE 101 Cb 1.08 -1.59 -0.13 0.00 -1.74 0.00 0.00 39.64 37.26 1aje n ILE 101 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1aje n THR 102 N -3.65 1.64 0.04 7.28 -2.24 0.16 0.26 114.28 117.76 1aje n THR 102 Ca -0.39 -0.62 0.05 0.00 -2.27 0.00 0.00 64.05 60.82 1aje n THR 102 Cb 0.82 -1.56 0.46 0.00 -2.10 0.00 0.00 70.33 67.95 1aje n THR 102 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1aje h HIS 103 N 0.04 0.42 0.00 4.78 3.86 -1.35 0.48 115.15 123.38 1aje h HIS 103 Ca -0.50 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 58.58 1aje h HIS 103 Cb 1.97 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 30.28 1aje h HIS 103 CO 0.05 0.26 -0.95 0.45 0.86 0.00 0.00 177.93 178.61 1aje h HIS 104 N 0.45 0.00 -2.46 2.45 3.86 -1.67 -3.42 115.15 114.37 1aje h HIS 104 Ca 0.13 0.00 -0.62 0.00 -1.16 0.00 0.00 60.37 58.71 1aje h HIS 104 Cb -0.04 0.00 -0.41 0.00 1.06 0.00 0.00 27.41 28.03 1aje h HIS 104 CO -0.00 0.93 -0.46 0.00 0.86 0.00 0.00 177.93 179.26 1aje n PRO 106 N 1.14 3.62 -0.07 0.00 -0.04 0.17 -4.03 135.00 135.78 1aje n PRO 106 Ca 0.28 -2.40 -0.09 0.00 -0.04 0.00 0.00 63.50 61.24 1aje n PRO 106 Cb 0.39 -2.88 -0.05 0.00 -0.04 0.00 0.00 33.50 30.92 1aje n PRO 106 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1aje h LYS 107 N 5.17 0.00 0.00 0.54 1.63 -1.86 -3.50 116.57 118.55 1aje h LYS 107 Ca 0.80 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.60 1aje h LYS 107 Cb 0.36 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 1aje h LYS 107 CO 1.78 0.34 0.00 2.41 -3.45 0.00 0.00 179.45 180.53 1aje n THR 108 N -4.61 0.00 -1.55 1.00 -1.04 -1.26 -5.10 114.28 101.72 1aje n THR 108 Ca -0.12 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.52 1aje n THR 108 Cb 0.33 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.81 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 1.10 -3.72 -2.82 -0.04 -1.26 -4.51 135.00 123.74 1aje n PRO 109 Ca 0.00 0.05 -0.29 0.00 -0.04 0.00 0.00 63.50 63.22 1aje n PRO 109 Cb 0.00 -3.34 -0.16 0.00 -0.04 0.00 0.00 33.50 29.97 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 11.66 1.37 -0.25 0.54 2.19 -1.26 -1.72 117.98 130.50 1aje s PHE 110 Ca 1.00 -1.36 -0.02 0.00 0.33 0.00 0.00 56.93 56.89 1aje s PHE 110 Cb -0.24 -1.39 0.03 0.00 -1.31 0.00 0.00 43.02 40.10 1aje s PHE 110 CO 0.28 -0.78 -0.05 -0.51 1.83 0.00 0.00 175.22 175.99 1aje s LEU 111 N 1.74 3.25 -0.59 6.12 1.43 0.21 0.39 118.68 131.23 1aje s LEU 111 Ca 0.05 -0.88 -0.23 0.00 -1.03 0.00 0.00 54.13 52.04 1aje s LEU 111 Cb -0.17 -1.68 0.05 0.00 0.03 0.00 0.00 46.19 44.43 1aje s LEU 111 CO -0.20 -0.14 0.93 -0.22 0.23 0.00 0.00 176.35 176.96 1aje s LEU 112 N 1.33 4.26 -0.12 1.79 2.96 0.39 -1.29 118.68 128.00 1aje s LEU 112 Ca -0.00 -0.64 -0.02 0.00 -0.22 0.00 0.00 54.13 53.25 1aje s LEU 112 Cb -0.17 -2.64 -0.03 0.00 0.50 0.00 0.00 46.19 43.86 1aje s LEU 112 CO -0.04 -1.29 -0.05 -0.69 -1.32 0.00 0.00 176.35 172.95 1aje s VAL 113 N 3.92 3.78 0.47 1.68 1.01 -1.02 -0.73 120.40 129.51 1aje s VAL 113 Ca 0.26 -0.42 -0.24 0.00 0.00 0.00 0.00 61.98 61.58 1aje s VAL 113 Cb -0.15 -2.61 -0.07 0.00 0.00 0.00 0.00 36.38 33.55 1aje s VAL 113 CO 0.15 0.54 1.39 -0.83 0.00 0.00 0.00 175.10 176.35 1aje s GLY 114 N -0.11 2.91 0.00 4.51 0.00 0.29 0.13 107.32 115.05 1aje s GLY 114 Ca 0.02 1.39 0.00 0.00 0.00 0.00 0.00 44.72 46.12 1aje s GLY 114 CO 0.03 1.97 0.00 -0.37 0.00 0.00 0.00 173.10 174.72 1aje n THR 115 N -0.37 0.00 -2.30 0.90 5.66 0.31 -4.06 114.28 114.42 1aje n THR 115 Ca 0.06 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.64 1aje n THR 115 Cb 0.43 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.21 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 3.40 0.00 1.09 6.02 -1.17 -2.98 117.38 123.75 1aje n GLN 116 Ca 0.00 -3.36 0.01 0.00 -0.01 0.00 0.00 57.00 53.64 1aje n GLN 116 Cb 0.00 -3.05 0.05 0.00 1.02 0.00 0.00 30.24 28.26 1aje n GLN 116 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1aje n ILE 117 N 4.05 0.00 0.00 5.09 5.41 -1.26 -2.74 119.36 129.90 1aje n ILE 117 Ca 0.42 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 64.16 1aje n ILE 117 Cb 0.38 -0.62 -0.01 0.00 -0.71 0.00 0.00 39.64 38.68 1aje n ILE 117 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1aje h ASP 118 N 0.00 -0.08 0.00 4.38 3.58 -1.87 -3.41 116.42 119.02 1aje h ASP 118 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1aje h ASP 118 Cb 0.00 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.07 1aje h ASP 118 CO 0.00 0.31 -0.60 0.18 -2.88 0.00 0.00 179.24 176.25 1aje n LEU 119 N -4.32 0.00 0.17 2.28 7.99 -1.23 -4.50 117.00 117.38 1aje n LEU 119 Ca -0.01 0.00 0.17 0.00 -0.01 0.00 0.00 56.01 56.15 1aje n LEU 119 Cb 0.04 0.00 0.77 0.00 -0.11 0.00 0.00 43.42 44.12 1aje n LEU 119 CO 0.03 0.00 1.15 0.03 -1.51 0.00 0.00 177.39 177.09 1aje h ARG 120 N 0.00 0.00 0.00 3.23 -0.00 -1.82 2.43 114.38 118.22 1aje h ARG 120 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1aje h ARG 120 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.38 1aje h ARG 120 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 179.97 180.35 1aje h ASP 121 N 0.00 0.00 -2.35 7.04 2.03 -1.78 -3.21 116.42 118.15 1aje h ASP 121 Ca 0.11 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.36 1aje h ASP 121 Cb 0.55 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.07 1aje h ASP 121 CO -0.00 0.00 0.05 -0.67 -1.03 0.00 0.00 179.24 177.59 1aje n ASP 122 N -2.34 0.03 0.24 4.15 -0.08 0.82 -4.87 116.55 114.50 1aje n ASP 122 Ca 0.04 -1.07 0.17 0.00 -1.51 0.00 0.00 54.79 52.43 1aje n ASP 122 Cb 0.38 -0.12 0.86 0.00 2.34 0.00 0.00 41.12 44.58 1aje n ASP 122 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1aje h PRO 123 N 0.00 0.00 -1.00 -0.67 0.13 -1.85 -3.02 132.00 125.58 1aje h PRO 123 Ca -0.05 0.00 0.29 0.00 -0.87 0.00 0.00 66.00 65.37 1aje h PRO 123 Cb 0.15 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.14 1aje h PRO 123 CO 0.04 0.00 0.58 1.03 -0.23 0.00 0.00 178.00 179.41 1aje h SER 124 N 0.00 0.57 -0.04 1.44 0.87 -1.82 0.81 113.55 115.38 1aje h SER 124 Ca 0.00 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1aje h SER 124 Cb 0.08 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1aje h SER 124 CO 0.00 -0.05 0.00 1.07 -0.53 0.00 0.00 176.83 177.32 1aje n THR 125 N -4.99 0.04 -0.03 2.23 5.66 -1.14 -4.07 114.28 111.98 1aje n THR 125 Ca 0.30 -0.17 -0.13 0.00 -3.05 0.00 0.00 64.05 61.00 1aje n THR 125 Cb 0.89 0.10 -0.09 0.00 -1.55 0.00 0.00 70.33 69.68 1aje n THR 125 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 1aje h ILE 126 N 1.38 1.39 -0.02 1.09 1.08 0.47 -2.65 117.51 120.26 1aje h ILE 126 Ca 0.00 -1.26 0.01 0.00 -0.39 0.00 0.00 64.86 63.22 1aje h ILE 126 Cb 0.30 2.13 -0.00 0.00 -3.07 0.00 0.00 36.82 36.18 1aje h ILE 126 CO 0.00 0.34 0.07 -0.33 -0.69 0.00 0.00 178.15 177.54 1aje h GLU 127 N -0.35 0.00 0.08 2.37 5.08 -1.71 2.13 114.58 122.18 1aje h GLU 127 Ca 0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1aje h GLU 127 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1aje h GLU 127 CO 0.01 0.00 -0.04 0.87 -1.00 0.00 0.00 179.01 178.86 1aje h LYS 128 N 0.00 -0.10 0.00 2.33 6.56 -1.69 -3.38 116.57 120.29 1aje h LYS 128 Ca 0.01 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1aje h LYS 128 Cb 0.14 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.82 1aje h LYS 128 CO -0.00 0.35 -0.08 1.28 -2.06 0.00 0.00 179.45 178.94 1aje n LEU 129 N -4.91 1.52 -0.01 2.94 4.32 -0.90 -4.81 117.00 115.14 1aje n LEU 129 Ca -0.09 -1.94 0.17 0.00 -0.02 0.00 0.00 56.01 54.13 1aje n LEU 129 Cb 0.26 -0.16 0.26 0.00 -1.62 0.00 0.00 43.42 42.16 1aje n LEU 129 CO 0.32 0.46 1.12 0.00 -1.22 0.00 0.00 177.39 178.07 1aje n ALA 130 N -0.69 0.61 0.25 -1.18 0.00 0.72 0.25 120.51 120.47 1aje n ALA 130 Ca 0.06 0.21 0.18 0.00 0.00 0.00 0.00 53.44 53.89 1aje n ALA 130 Cb 0.50 -0.36 0.87 0.00 0.00 0.00 0.00 19.45 20.46 1aje n ALA 130 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1aje h LYS 131 N 0.00 0.00 -0.51 0.00 3.11 -1.87 1.17 116.57 118.46 1aje h LYS 131 Ca 0.30 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.14 1aje h LYS 131 Cb 2.51 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 33.74 1aje h LYS 131 CO -0.00 0.00 0.00 0.09 -2.81 0.00 0.00 179.45 176.73 1aje n ASN 132 N -3.34 3.38 -3.56 4.20 3.02 0.71 -4.91 115.26 114.77 1aje n ASN 132 Ca 0.01 -1.99 -0.26 0.00 -0.03 0.00 0.00 54.58 52.30 1aje n ASN 132 Cb 0.36 -0.34 0.01 0.00 -0.61 0.00 0.00 39.78 39.20 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 1.04 -4.46 0.00 3.52 4.76 0.40 -4.41 118.16 119.02 1aje n LYS 133 Ca 0.17 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 56.20 1aje n LYS 133 Cb 0.52 -5.40 0.00 0.00 -1.84 0.00 0.00 35.03 28.31 1aje n LYS 133 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1aje n GLN 134 N -4.18 0.00 -1.88 1.97 0.00 -1.25 -4.86 117.38 107.19 1aje n GLN 134 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 57.00 56.99 1aje n GLN 134 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.79 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 -0.94 -1.15 2.61 4.76 -1.26 -2.66 118.16 119.52 1aje n LYS 135 Ca 0.00 1.12 -0.29 0.00 -2.87 0.00 0.00 58.31 56.27 1aje n LYS 135 Cb 0.00 -2.46 0.18 0.00 -1.84 0.00 0.00 35.03 30.91 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 -0.82 0.25 0.04 1.97 0.04 -1.26 -3.32 135.00 131.91 1aje s PRO 136 Ca 0.03 0.47 -0.31 0.00 0.04 0.00 0.00 61.00 61.23 1aje s PRO 136 Cb -0.01 -1.72 -0.07 0.00 0.04 0.00 0.00 34.50 32.75 1aje s PRO 136 CO 0.23 -2.84 1.42 0.42 0.04 0.00 0.00 177.00 176.27 1aje s ILE 137 N -2.96 3.53 0.69 0.56 1.09 -1.04 -4.92 121.20 118.15 1aje s ILE 137 Ca 0.66 1.00 -0.03 0.00 -1.10 0.00 0.00 60.65 61.17 1aje s ILE 137 Cb -0.18 -3.64 0.14 0.00 -1.06 0.00 0.00 42.46 37.72 1aje s ILE 137 CO 0.58 0.02 0.95 0.41 -0.10 0.00 0.00 174.94 176.80 1aje n THR 138 N 4.43 0.00 0.70 2.92 -1.04 -1.26 -4.85 114.28 115.17 1aje n THR 138 Ca 0.13 -1.29 0.08 0.00 -2.04 0.00 0.00 64.05 60.92 1aje n THR 138 Cb 0.43 -1.07 0.38 0.00 -1.82 0.00 0.00 70.33 68.25 1aje n THR 138 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1aje n PRO 139 N -2.81 0.17 0.00 -2.82 -0.04 -1.26 -2.13 135.00 126.11 1aje n PRO 139 Ca 0.15 0.16 0.04 0.00 -0.04 0.00 0.00 63.50 63.81 1aje n PRO 139 Cb 0.52 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.33 1.90 -0.05 0.54 1.02 -1.26 -4.46 120.64 116.98 1aje n GLU 140 Ca 0.07 -0.61 -0.04 0.00 -0.02 0.00 0.00 57.16 56.56 1aje n GLU 140 Cb 0.14 -1.05 -0.01 0.00 -0.02 0.00 0.00 31.44 30.50 1aje n GLU 140 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1aje n THR 141 N -0.17 1.11 0.14 2.62 -1.04 -0.90 -3.49 114.28 112.54 1aje n THR 141 Ca 0.04 0.28 -0.15 0.00 -2.04 0.00 0.00 64.05 62.17 1aje n THR 141 Cb 0.18 -2.20 -0.09 0.00 -1.82 0.00 0.00 70.33 66.40 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 -1.00 -0.98 2.41 0.00 -1.82 0.22 119.26 116.87 1aje h ALA 142 Ca 0.00 -0.12 0.27 0.00 0.00 0.00 0.00 54.91 55.06 1aje h ALA 142 Cb 0.39 0.82 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 1aje h ALA 142 CO 0.00 -1.10 0.69 0.93 0.00 0.00 0.00 179.25 179.77 1aje h GLU 143 N -0.74 0.10 -0.61 0.00 5.08 -1.80 0.27 114.58 116.88 1aje h GLU 143 Ca -0.02 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1aje h GLU 143 Cb 0.72 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.91 1aje h GLU 143 CO -0.21 0.07 0.41 -0.22 -1.00 0.00 0.00 179.01 178.05 1aje h LYS 144 N 0.11 0.81 0.05 2.33 3.64 -0.61 -1.19 116.57 121.70 1aje h LYS 144 Ca 0.49 -0.05 -0.28 0.00 -1.27 0.00 0.00 60.65 59.54 1aje h LYS 144 Cb 1.74 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 33.35 1aje h LYS 144 CO -0.07 0.53 -1.45 1.37 -2.27 0.00 0.00 179.45 177.57 1aje h LEU 145 N 0.83 0.15 -1.78 5.20 8.10 -0.12 -3.02 115.31 124.68 1aje h LEU 145 Ca 0.23 -0.23 0.00 0.00 0.11 0.00 0.00 57.88 57.99 1aje h LEU 145 Cb -0.09 -0.05 0.00 0.00 -0.44 0.00 0.00 40.66 40.08 1aje h LEU 145 CO -0.05 1.19 0.00 0.00 -4.11 0.00 0.00 178.44 175.47 1aje h ALA 146 N 0.79 1.00 0.00 0.17 0.00 -0.94 2.32 119.26 122.60 1aje h ALA 146 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 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 0.12 0.00 -0.63 -0.09 0.00 0.00 0.00 179.25 178.65 1aje h ARG 147 N 0.00 0.00 0.00 0.00 2.43 -1.17 1.07 114.38 116.70 1aje h ARG 147 Ca 0.00 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1aje h ARG 147 Cb 0.13 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1aje h ARG 147 CO 0.00 0.53 -0.41 -0.44 -1.51 0.00 0.00 179.97 178.15 1aje h ASP 148 N 0.00 0.00 0.00 -3.80 3.32 0.40 -3.35 116.42 112.98 1aje h ASP 148 Ca -0.02 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.87 1aje h ASP 148 Cb 1.44 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.96 1aje h ASP 148 CO 0.07 0.41 -1.59 0.18 -1.72 0.00 0.00 179.24 176.59 1aje n LEU 149 N -3.26 1.46 -3.39 1.55 4.77 -0.18 -5.02 117.00 112.93 1aje n LEU 149 Ca 0.02 -0.03 -0.17 0.00 -0.03 0.00 0.00 56.01 55.80 1aje n LEU 149 Cb 0.66 -0.08 0.09 0.00 -2.33 0.00 0.00 43.42 41.76 1aje n LEU 149 CO 0.39 0.44 0.10 0.29 -1.33 0.00 0.00 177.39 177.27 1aje n LYS 150 N -2.56 -5.92 0.00 3.23 4.76 0.37 -4.97 118.16 113.07 1aje n LYS 150 Ca -0.16 0.85 0.00 0.00 -2.87 0.00 0.00 58.31 56.13 1aje n LYS 150 Cb 0.74 -5.85 0.00 0.00 -1.84 0.00 0.00 35.03 28.08 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 -3.98 0.00 -0.13 7.82 0.00 -1.25 -4.93 120.51 118.04 1aje n ALA 151 Ca -0.25 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 52.98 1aje n ALA 151 Cb 0.66 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.00 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 1.51 -3.59 0.00 0.31 1.28 -4.80 118.33 113.04 1aje n VAL 152 Ca 0.00 -0.53 -0.16 0.00 -0.01 0.00 0.00 64.34 63.64 1aje n VAL 152 Cb 0.00 -1.55 -0.07 0.00 -0.91 0.00 0.00 33.84 31.32 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 -2.52 0.93 -0.04 5.55 2.20 -1.05 -5.00 119.74 119.82 1aje s LYS 153 Ca -0.35 0.56 0.07 0.00 -0.36 0.00 0.00 55.97 55.89 1aje s LYS 153 Cb 0.10 0.44 -0.01 0.00 -1.51 0.00 0.00 37.83 36.85 1aje s LYS 153 CO 0.58 -0.22 -0.24 -0.47 -0.36 0.00 0.00 175.35 174.65 1aje s TYR 154 N -0.48 2.23 0.29 4.03 5.04 -1.26 -0.47 117.35 126.74 1aje s TYR 154 Ca -0.06 -0.55 -0.12 0.00 -2.44 0.00 0.00 57.07 53.90 1aje s TYR 154 Cb -0.02 -1.45 0.01 0.00 0.35 0.00 0.00 41.96 40.84 1aje s TYR 154 CO 0.06 -0.13 0.55 0.14 -1.34 0.00 0.00 175.55 174.83 1aje s VAL 155 N -0.33 0.00 -0.02 3.14 -7.23 0.09 -4.99 120.40 111.06 1aje s VAL 155 Ca 0.02 -1.35 0.02 0.00 -1.81 0.00 0.00 61.98 58.87 1aje s VAL 155 Cb -0.11 -2.39 -0.00 0.00 0.56 0.00 0.00 36.38 34.44 1aje s VAL 155 CO 0.01 0.00 -0.08 -1.61 -0.31 0.00 0.00 175.10 173.11 1aje s GLU 156 N -3.52 0.80 0.00 4.82 2.02 -1.26 0.11 118.70 121.67 1aje s GLU 156 Ca 0.22 -0.28 0.00 0.00 0.02 0.00 0.00 54.97 54.93 1aje s GLU 156 Cb -0.02 -0.77 0.00 0.00 0.10 0.00 0.00 34.13 33.45 1aje s GLU 156 CO 0.12 0.13 0.00 0.00 0.02 0.00 0.00 175.26 175.53 1aje n SER 158 N 0.00 0.35 0.00 0.00 2.88 -1.16 -4.57 113.62 111.13 1aje n SER 158 Ca 0.00 -1.30 0.00 0.00 -1.33 0.00 0.00 58.87 56.24 1aje n SER 158 Cb 0.00 -0.08 0.00 0.00 -0.75 0.00 0.00 64.21 63.38 1aje n SER 158 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aje n ALA 159 N 2.39 0.00 -0.01 -1.46 0.00 -1.26 -3.71 120.51 116.46 1aje n ALA 159 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1aje n ALA 159 Cb 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.38 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 0.43 0.11 0.00 -0.00 -1.26 -4.47 117.00 111.80 1aje n LEU 160 Ca 0.00 0.19 -0.08 0.00 -0.00 0.00 0.00 56.01 56.12 1aje n LEU 160 Cb 0.00 0.16 -0.04 0.00 -0.00 0.00 0.00 43.42 43.54 1aje n LEU 160 CO 0.00 0.19 0.51 0.74 -0.00 0.00 0.00 177.39 178.83 1aje h THR 161 N 0.00 0.00 -0.21 1.47 2.02 -1.88 -3.48 112.91 110.83 1aje h THR 161 Ca -0.22 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1aje h THR 161 Cb 1.60 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.01 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 -3.73 0.00 -0.04 6.66 1.13 -1.26 -4.98 117.38 115.15 1aje n GLN 162 Ca -0.05 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.92 1aje n GLN 162 Cb 0.20 -1.23 0.07 0.00 0.11 0.00 0.00 30.24 29.39 1aje n GLN 162 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1aje h LYS 163 N 0.00 0.68 0.00 -1.09 1.57 -1.92 -3.44 116.57 112.38 1aje h LYS 163 Ca 0.00 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 1aje h LYS 163 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1aje h LYS 163 CO 0.00 0.95 0.00 0.41 -0.57 0.00 0.00 179.45 180.24 1aje n GLY 164 N 0.01 0.36 0.09 3.86 0.00 -1.23 -4.95 105.19 103.32 1aje n GLY 164 Ca -0.02 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.06 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 0.28 0.04 0.99 -0.00 -1.26 0.22 117.00 117.26 1aje n LEU 165 Ca 0.00 0.61 0.12 0.00 -0.00 0.00 0.00 56.01 56.74 1aje n LEU 165 Cb 0.04 -0.64 0.18 0.00 -0.00 0.00 0.00 43.42 42.99 1aje n LEU 165 CO 0.00 -0.71 0.34 1.17 -0.00 0.00 0.00 177.39 178.19 1aje n LYS 166 N -1.87 0.22 0.07 1.47 0.00 -1.26 -2.24 118.16 114.55 1aje n LYS 166 Ca -0.01 0.05 -0.23 0.00 0.00 0.00 0.00 58.31 58.13 1aje n LYS 166 Cb 0.05 -1.63 -0.15 0.00 0.00 0.00 0.00 35.03 33.30 1aje n LYS 166 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.40 174.45 1aje h ASN 167 N 0.00 0.62 -0.30 3.14 7.08 0.22 -2.84 115.58 123.50 1aje h ASN 167 Ca 0.00 -0.93 0.05 0.00 -3.08 0.00 0.00 56.30 52.34 1aje h ASN 167 Cb 0.68 -0.20 -0.05 0.00 -2.08 0.00 0.00 38.32 36.67 1aje h ASN 167 CO 0.00 1.78 -0.02 1.62 -2.08 0.00 0.00 177.43 178.73 1aje h VAL 168 N 0.08 0.76 -0.72 6.14 3.04 -1.00 0.50 116.25 125.05 1aje h VAL 168 Ca -0.34 -0.02 0.16 0.00 -1.01 0.00 0.00 66.70 65.49 1aje h VAL 168 Cb 2.08 0.69 -0.11 0.00 -2.01 0.00 0.00 31.29 31.93 1aje h VAL 168 CO 0.18 0.01 0.11 -0.26 -1.01 0.00 0.00 177.57 176.60 1aje h PHE 169 N 0.07 0.15 -0.44 3.17 0.04 -1.46 3.21 116.94 121.68 1aje h PHE 169 Ca 0.15 0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.95 1aje h PHE 169 Cb 0.20 0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 1aje h PHE 169 CO -0.24 -0.14 0.22 -0.44 -0.60 0.00 0.00 178.31 177.11 1aje h ASP 170 N 0.20 0.54 0.44 2.17 3.32 0.01 -1.91 116.42 121.18 1aje h ASP 170 Ca 0.40 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.39 1aje h ASP 170 Cb 0.70 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1aje h ASP 170 CO -0.55 0.46 -0.21 -0.33 -1.72 0.00 0.00 179.24 176.89 1aje h GLU 171 N 0.61 -0.57 -0.97 3.56 4.39 0.91 0.34 114.58 122.85 1aje h GLU 171 Ca 0.16 0.04 0.39 0.00 0.34 0.00 0.00 59.36 60.28 1aje h GLU 171 Cb 0.05 0.13 -0.18 0.00 -0.10 0.00 0.00 28.75 28.66 1aje h GLU 171 CO -0.02 -0.31 0.46 0.00 -1.16 0.00 0.00 179.01 177.98 1aje n ALA 172 N -2.68 0.93 0.02 3.43 0.00 0.69 0.29 120.51 123.20 1aje n ALA 172 Ca -0.08 1.00 -0.10 0.00 0.00 0.00 0.00 53.44 54.26 1aje n ALA 172 Cb 0.27 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.68 1aje n ALA 172 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1aje h ILE 173 N 0.00 0.86 0.00 0.00 5.03 -1.22 -0.04 117.51 122.14 1aje h ILE 173 Ca 0.79 -1.31 0.00 0.00 -0.12 0.00 0.00 64.86 64.23 1aje h ILE 173 Cb 2.05 1.52 0.00 0.00 -3.03 0.00 0.00 36.82 37.36 1aje h ILE 173 CO -0.77 0.25 0.00 -0.11 -0.68 0.00 0.00 178.15 176.84 1aje n LEU 174 N -4.85 0.49 0.06 1.44 -0.00 0.12 0.14 117.00 114.40 1aje n LEU 174 Ca -0.07 0.71 0.11 0.00 -0.00 0.00 0.00 56.01 56.76 1aje n LEU 174 Cb 0.26 -0.75 -0.03 0.00 -0.00 0.00 0.00 43.42 42.90 1aje n LEU 174 CO 0.23 -0.82 -0.15 0.00 -0.00 0.00 0.00 177.39 176.64 1aje n ALA 175 N -1.74 2.74 -0.23 1.96 0.00 0.85 -3.72 120.51 120.38 1aje n ALA 175 Ca -0.01 -0.33 0.06 0.00 0.00 0.00 0.00 53.44 53.17 1aje n ALA 175 Cb 0.06 -1.00 0.16 0.00 0.00 0.00 0.00 19.45 18.67 1aje n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aje n ALA 176 N -2.13 2.23 -0.00 0.00 0.00 0.37 -4.09 120.51 116.89 1aje n ALA 176 Ca -0.01 -1.21 0.00 0.00 0.00 0.00 0.00 53.44 52.22 1aje n ALA 176 Cb 0.53 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.52 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 0.49 0.06 -0.42 0.00 -0.00 0.13 -4.79 117.00 112.47 1aje n LEU 177 Ca 0.12 -0.53 -0.03 0.00 -0.00 0.00 0.00 56.01 55.57 1aje n LEU 177 Cb 0.46 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.86 1aje n LEU 177 CO 0.09 0.02 0.20 -1.84 -0.00 0.00 0.00 177.39 175.86 1aje n GLU 178 N -0.93 0.00 -3.06 1.47 0.28 -1.24 -4.81 120.64 112.35 1aje n GLU 178 Ca 0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.68 1aje n GLU 178 Cb 0.00 -0.12 -0.06 0.00 1.43 0.00 0.00 31.44 32.69 1aje n GLU 178 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1aje s PRO 179 N 0.78 3.97 0.61 3.44 0.04 -1.26 -5.05 135.00 137.52 1aje s PRO 179 Ca 0.13 0.65 -0.18 0.00 0.04 0.00 0.00 61.00 61.64 1aje s PRO 179 Cb -0.10 -2.41 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 1aje s PRO 179 CO 0.05 0.11 1.18 -1.25 0.04 0.00 0.00 177.00 177.13 1aje s PRO 180 N -3.17 2.91 -0.61 0.56 0.04 -1.26 -3.82 135.00 129.66 1aje s PRO 180 Ca 0.54 1.72 -0.13 0.00 0.04 0.00 0.00 61.00 63.17 1aje s PRO 180 Cb -0.10 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.52 1aje s PRO 180 CO 0.20 -1.23 0.37 0.39 0.04 0.00 0.00 177.00 176.77 1aje n GLU 181 N -1.79 -0.68 -1.09 4.56 1.02 -1.26 -4.68 120.64 116.73 1aje n GLU 181 Ca 0.13 0.01 -0.32 0.00 -0.02 0.00 0.00 57.16 56.96 1aje n GLU 181 Cb 0.50 -1.05 -0.02 0.00 -0.02 0.00 0.00 31.44 30.84 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 -2.73 2.64 -1.48 3.49 -0.04 -1.25 -4.90 135.00 130.72 1aje n PRO 182 Ca -0.11 -1.88 -0.48 0.00 -0.04 0.00 0.00 63.50 61.00 1aje n PRO 182 Cb 0.34 -2.72 -0.06 0.00 -0.04 0.00 0.00 33.50 31.02 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 4.55 1.21 -2.41 0.54 4.81 -1.26 -4.89 118.16 120.71 1aje n LYS 183 Ca 0.57 0.31 -0.39 0.00 -0.87 0.00 0.00 58.31 57.93 1aje n LYS 183 Cb 0.23 -2.63 -0.03 0.00 0.02 0.00 0.00 35.03 32.61 1aje n LYS 183 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1aje s LYS 184 N 6.45 4.40 0.75 1.64 2.47 -1.26 -4.83 119.74 129.36 1aje s LYS 184 Ca 1.08 1.81 -0.15 0.00 -1.56 0.00 0.00 55.97 57.15 1aje s LYS 184 Cb -0.73 -2.96 0.00 0.00 -1.46 0.00 0.00 37.83 32.68 1aje s LYS 184 CO 0.45 -0.01 0.78 0.45 0.16 0.00 0.00 175.35 177.19 1aje n SER 185 N 0.69 -0.31 -4.17 1.43 2.88 -1.26 -4.85 113.62 108.02 1aje n SER 185 Ca 0.01 0.60 -0.43 0.00 -1.33 0.00 0.00 58.87 57.72 1aje n SER 185 Cb 0.46 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.59 1aje n SER 185 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1aje n ARG 186 N -1.58 3.50 0.00 -1.46 1.74 -1.26 -5.18 116.66 112.41 1aje n ARG 186 Ca 0.11 -3.70 0.00 0.00 -0.77 0.00 0.00 57.85 53.50 1aje n ARG 186 Cb 0.50 -2.98 0.00 0.00 -1.02 0.00 0.00 32.46 28.96 1aje n ARG 186 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65