#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aje n SER -6 N 0.00 1.98 -4.40 1.61 2.88 -1.26 -4.94 113.62 109.50 1aje n SER -6 Ca 0.00 0.85 -0.31 0.00 -1.33 0.00 0.00 58.87 58.08 1aje n SER -6 Cb 0.00 -1.54 0.20 0.00 -0.75 0.00 0.00 64.21 62.12 1aje n SER -6 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1aje n LYS -5 N -1.66 -1.70 -0.97 -1.46 5.02 -1.26 -4.87 118.16 111.26 1aje n LYS -5 Ca 0.15 -0.47 -0.37 0.00 -2.02 0.00 0.00 58.31 55.60 1aje n LYS -5 Cb 0.47 -1.95 0.05 0.00 -0.02 0.00 0.00 35.03 33.59 1aje n LYS -5 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1aje n ILE -4 N -4.53 0.00 -0.77 -0.18 -0.00 -1.26 -4.84 119.36 107.78 1aje n ILE -4 Ca 0.03 -0.19 -0.18 0.00 -0.00 0.00 0.00 62.75 62.41 1aje n ILE -4 Cb 0.57 -0.07 0.06 0.00 -0.00 0.00 0.00 39.64 40.20 1aje n ILE -4 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1aje n ILE -3 N -3.27 0.00 -4.54 1.39 -0.00 -1.26 -4.73 119.36 106.95 1aje n ILE -3 Ca -0.01 -0.03 0.00 0.00 -0.00 0.00 0.00 62.75 62.70 1aje n ILE -3 Cb 0.68 -0.16 0.00 0.00 -0.00 0.00 0.00 39.64 40.16 1aje n ILE -3 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 1aje n SER -2 N 1.80 -3.02 -0.33 4.38 2.88 -1.26 -5.07 113.62 113.00 1aje n SER -2 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 1aje n SER -2 Cb 0.35 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.81 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 0.25 -1.97 -1.96 -1.46 0.00 -1.26 -4.83 120.51 109.28 1aje n ALA -1 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 1aje n ALA -1 Cb 0.00 -0.32 -0.07 0.00 0.00 0.00 0.00 19.45 19.06 1aje n ALA -1 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1aje s MET 1 N -2.98 2.25 0.26 0.00 -1.94 -1.06 -4.65 119.30 111.18 1aje s MET 1 Ca 0.00 -0.71 0.11 0.00 -1.71 0.00 0.00 55.69 53.38 1aje s MET 1 Cb 0.00 -5.12 0.58 0.00 2.01 0.00 0.00 34.83 32.29 1aje s MET 1 CO 0.00 -4.08 1.20 1.04 -0.01 0.00 0.00 175.02 173.17 1aje n GLN 2 N 8.46 0.07 -1.61 2.03 3.00 -1.26 -4.69 117.38 123.38 1aje n GLN 2 Ca 0.43 0.52 0.00 0.00 -0.01 0.00 0.00 57.00 57.94 1aje n GLN 2 Cb 0.46 -2.02 0.00 0.00 0.00 0.00 0.00 30.24 28.68 1aje n GLN 2 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 1aje n THR 3 N -1.91 -7.82 -3.97 5.09 -1.04 -1.26 -4.93 114.28 98.44 1aje n THR 3 Ca -0.01 1.63 -0.31 0.00 -2.04 0.00 0.00 64.05 63.33 1aje n THR 3 Cb 0.30 -4.44 -0.15 0.00 -1.82 0.00 0.00 70.33 64.22 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 -0.30 2.03 -0.38 12.58 1.09 0.37 -4.56 121.20 132.03 1aje s ILE 4 Ca 0.00 -2.14 -0.29 0.00 -1.10 0.00 0.00 60.65 57.12 1aje s ILE 4 Cb 0.00 -2.49 0.02 0.00 -1.06 0.00 0.00 42.46 38.93 1aje s ILE 4 CO 0.00 -0.58 1.13 -0.54 -0.10 0.00 0.00 174.94 174.85 1aje s LYS 5 N 1.04 3.91 -0.17 2.79 -0.14 -1.26 0.45 119.74 126.35 1aje s LYS 5 Ca 0.10 0.89 -0.13 0.00 -1.36 0.00 0.00 55.97 55.47 1aje s LYS 5 Cb -0.19 -3.82 -0.05 0.00 -1.68 0.00 0.00 37.83 32.09 1aje s LYS 5 CO -0.11 -1.13 0.24 0.00 -0.76 0.00 0.00 175.35 173.60 1aje s VAL 7 N 0.44 5.00 -0.07 0.00 1.01 0.12 0.04 120.40 126.93 1aje s VAL 7 Ca 0.14 -1.67 -0.30 0.00 0.00 0.00 0.00 61.98 60.15 1aje s VAL 7 Cb -0.12 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.02 1aje s VAL 7 CO 0.02 -0.86 1.21 -0.69 0.00 0.00 0.00 175.10 174.77 1aje s VAL 8 N 1.40 4.27 -0.02 2.92 1.01 -0.85 -1.96 120.40 127.17 1aje s VAL 8 Ca 0.05 1.58 0.05 0.00 0.00 0.00 0.00 61.98 63.67 1aje s VAL 8 Cb -0.27 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 1aje s VAL 8 CO 0.01 -0.02 -0.17 0.68 0.00 0.00 0.00 175.10 175.60 1aje s VAL 9 N 2.41 2.83 0.00 2.92 -7.23 -0.96 -4.66 120.40 115.71 1aje s VAL 9 Ca 0.55 -0.92 0.00 0.00 -1.81 0.00 0.00 61.98 59.81 1aje s VAL 9 Cb -0.24 -2.11 0.00 0.00 0.56 0.00 0.00 36.38 34.59 1aje s VAL 9 CO 0.21 0.52 0.00 0.61 -0.31 0.00 0.00 175.10 176.12 1aje n GLY 10 N 2.10 -1.02 0.32 2.32 0.00 -1.26 -2.70 105.19 104.96 1aje n GLY 10 Ca -0.17 -1.65 -0.05 0.00 0.00 0.00 0.00 46.02 44.16 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 -1.59 2.36 -2.28 1.61 8.00 -1.26 -4.77 116.55 118.62 1aje n ASP 11 Ca 0.00 0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.51 1aje n ASP 11 Cb 0.00 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 40.97 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 2.98 -4.84 1.98 0.44 0.00 -1.26 -3.63 105.19 100.86 1aje n GLY 12 Ca -0.11 0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.89 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 1.89 -0.48 -2.64 4.61 0.00 -1.26 -1.93 120.51 120.69 1aje n ALA 13 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 53.44 53.47 1aje n ALA 13 Cb 0.00 -0.95 -0.01 0.00 0.00 0.00 0.00 19.45 18.49 1aje n ALA 13 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1aje n VAL 14 N -2.20 0.00 -2.55 0.00 0.31 -1.24 -4.77 118.33 107.88 1aje n VAL 14 Ca -0.08 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.06 1aje n VAL 14 Cb 0.39 -0.07 0.01 0.00 -0.91 0.00 0.00 33.84 33.26 1aje n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1aje n GLY 15 N -0.54 4.05 0.01 2.92 0.00 -0.81 -4.80 105.19 106.01 1aje n GLY 15 Ca 0.02 -2.12 0.12 0.00 0.00 0.00 0.00 46.02 44.04 1aje n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aje n LYS 16 N -0.31 0.04 0.37 1.61 4.76 -1.25 -4.05 118.16 119.33 1aje n LYS 16 Ca 0.26 0.01 -0.18 0.00 -2.87 0.00 0.00 58.31 55.54 1aje n LYS 16 Cb 0.73 -1.53 -0.09 0.00 -1.84 0.00 0.00 35.03 32.31 1aje n LYS 16 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1aje h THR 17 N 0.00 0.00 -1.09 -0.18 2.02 -1.93 -2.17 112.91 109.56 1aje h THR 17 Ca 0.00 0.00 0.41 0.00 0.77 0.00 0.00 66.41 67.59 1aje h THR 17 Cb 0.53 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.78 1aje h THR 17 CO 0.00 0.00 0.63 0.00 0.37 0.00 0.00 175.52 176.52 1aje h LEU 19 N 0.06 -0.13 -0.94 0.00 5.85 -1.61 -1.05 115.31 117.50 1aje h LEU 19 Ca 0.83 0.00 0.28 0.00 0.84 0.00 0.00 57.88 59.83 1aje h LEU 19 Cb 2.27 0.03 -0.16 0.00 0.37 0.00 0.00 40.66 43.17 1aje h LEU 19 CO -0.66 -0.09 0.19 0.17 -0.34 0.00 0.00 178.44 177.71 1aje h LEU 20 N -0.15 -0.15 0.05 2.25 8.10 -0.89 0.68 115.31 125.19 1aje h LEU 20 Ca -0.02 0.24 0.01 0.00 0.11 0.00 0.00 57.88 58.23 1aje h LEU 20 Cb 0.11 0.36 -0.04 0.00 -0.44 0.00 0.00 40.66 40.65 1aje h LEU 20 CO 0.02 -0.28 -0.46 0.40 -4.11 0.00 0.00 178.44 174.01 1aje h ILE 21 N 0.09 0.00 0.00 0.15 1.08 -0.86 -0.78 117.51 117.19 1aje h ILE 21 Ca 0.61 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 65.03 1aje h ILE 21 Cb 1.32 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.07 1aje h ILE 21 CO -0.78 0.00 -0.25 0.77 -0.69 0.00 0.00 178.15 177.20 1aje h SER 22 N -0.62 0.00 -0.12 1.72 4.64 0.39 1.75 113.55 121.31 1aje h SER 22 Ca 0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 1aje h SER 22 Cb 0.64 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1aje h SER 22 CO -0.28 0.25 0.14 0.22 -0.87 0.00 0.00 176.83 176.29 1aje h TYR 23 N 0.00 0.00 0.00 4.77 3.20 0.17 0.31 116.97 125.42 1aje h TYR 23 Ca -0.00 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 1aje h TYR 23 Cb 0.53 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 1aje h TYR 23 CO 0.00 0.00 -1.21 0.25 -1.64 0.00 0.00 178.16 175.56 1aje n THR 24 N -3.83 0.21 0.13 1.81 -2.24 -0.35 -4.77 114.28 105.24 1aje n THR 24 Ca 0.00 -0.08 0.03 0.00 -2.27 0.00 0.00 64.05 61.73 1aje n THR 24 Cb 0.24 -0.64 0.04 0.00 -2.10 0.00 0.00 70.33 67.87 1aje n THR 24 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1aje n THR 25 N -2.59 0.34 -1.58 4.28 -2.24 0.58 -4.96 114.28 108.12 1aje n THR 25 Ca -0.07 -0.67 -0.06 0.00 -2.27 0.00 0.00 64.05 60.98 1aje n THR 25 Cb 0.57 0.91 -0.02 0.00 -2.10 0.00 0.00 70.33 69.69 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 0.22 -1.96 -3.58 3.42 4.13 0.11 -4.78 115.26 112.81 1aje n ASN 26 Ca 0.04 0.22 -0.29 0.00 1.68 0.00 0.00 54.58 56.23 1aje n ASN 26 Cb 0.21 -1.97 -0.12 0.00 -1.54 0.00 0.00 39.78 36.36 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 -3.30 0.95 0.23 3.52 2.20 -1.26 -4.70 119.74 117.37 1aje s LYS 27 Ca 0.00 -1.72 -0.04 0.00 -0.36 0.00 0.00 55.97 53.85 1aje s LYS 27 Cb 0.00 -1.83 0.06 0.00 -1.51 0.00 0.00 37.83 34.55 1aje s LYS 27 CO 0.00 -1.20 0.16 1.97 -0.36 0.00 0.00 175.35 175.92 1aje n PHE 28 N 3.72 -2.58 0.00 4.03 -1.74 -1.26 -4.41 117.46 115.22 1aje n PHE 28 Ca 0.11 -0.15 0.00 0.00 -0.56 0.00 0.00 57.45 56.86 1aje n PHE 28 Cb 0.36 -0.20 0.00 0.00 1.52 0.00 0.00 39.48 41.16 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 -2.45 0.00 -0.16 3.97 -0.04 -1.26 -1.83 135.00 133.23 1aje n PRO 29 Ca 0.02 0.13 0.14 0.00 -0.04 0.00 0.00 63.50 63.76 1aje n PRO 29 Cb 0.10 -1.57 0.49 0.00 -0.04 0.00 0.00 33.50 32.48 1aje n PRO 29 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1aje h SER 30 N 0.00 0.41 -0.64 3.54 0.02 -2.00 -2.97 113.55 111.91 1aje h SER 30 Ca 0.00 0.02 -0.30 0.00 -0.84 0.00 0.00 61.79 60.67 1aje h SER 30 Cb 0.14 -0.06 -0.35 0.00 0.14 0.00 0.00 62.40 62.26 1aje h SER 30 CO 0.00 0.22 -1.00 -0.62 -1.14 0.00 0.00 176.83 174.29 1aje n GLU 31 N -4.48 1.32 -3.73 3.45 1.02 -0.76 -5.09 120.64 112.37 1aje n GLU 31 Ca 0.14 -2.98 -0.13 0.00 -0.02 0.00 0.00 57.16 54.16 1aje n GLU 31 Cb 0.49 -1.06 -0.10 0.00 -0.02 0.00 0.00 31.44 30.76 1aje n GLU 31 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1aje s TYR 32 N -2.62 -0.41 0.04 -0.32 1.51 -1.12 -4.94 117.35 109.48 1aje s TYR 32 Ca 0.25 0.98 -0.22 0.00 -1.01 0.00 0.00 57.07 57.07 1aje s TYR 32 Cb 0.41 0.15 0.05 0.00 -0.11 0.00 0.00 41.96 42.46 1aje s TYR 32 CO -0.01 -0.24 0.51 0.14 -1.11 0.00 0.00 175.55 174.84 1aje s VAL 33 N 0.00 0.03 -1.19 0.71 -7.23 -1.26 -4.24 120.40 107.22 1aje s VAL 33 Ca -0.02 -0.25 -0.22 0.00 -1.81 0.00 0.00 61.98 59.68 1aje s VAL 33 Cb -0.03 -0.96 -0.06 0.00 0.56 0.00 0.00 36.38 35.89 1aje s VAL 33 CO 0.01 -0.14 1.89 -2.16 -0.31 0.00 0.00 175.10 174.40 1aje s PRO 34 N -2.33 2.77 0.00 4.82 0.04 -1.26 -4.50 135.00 134.54 1aje s PRO 34 Ca -0.06 -1.26 0.00 0.00 0.04 0.00 0.00 61.00 59.72 1aje s PRO 34 Cb -0.01 -5.29 0.00 0.00 0.04 0.00 0.00 34.50 29.25 1aje s PRO 34 CO -0.01 -3.63 0.75 0.25 0.04 0.00 0.00 177.00 174.40 1aje n THR 35 N 7.55 0.53 -3.90 1.26 -2.24 -1.26 -5.05 114.28 111.17 1aje n THR 35 Ca 0.45 -0.73 -0.09 0.00 -2.27 0.00 0.00 64.05 61.40 1aje n THR 35 Cb 0.47 0.76 -0.07 0.00 -2.10 0.00 0.00 70.33 69.39 1aje n THR 35 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1aje s VAL 36 N -0.53 0.07 0.35 2.28 0.11 -1.26 -5.13 120.40 116.30 1aje s VAL 36 Ca 0.00 -1.25 -0.26 0.00 -2.93 0.00 0.00 61.98 57.54 1aje s VAL 36 Cb 0.00 -1.69 -0.12 0.00 -1.53 0.00 0.00 36.38 33.03 1aje s VAL 36 CO 0.00 -0.34 1.03 0.33 -3.33 0.00 0.00 175.10 172.79 1aje n PHE 37 N -0.20 1.30 -2.88 1.54 7.35 -1.26 -4.98 117.46 118.32 1aje n PHE 37 Ca -0.09 0.63 0.00 0.00 -0.76 0.00 0.00 57.45 57.22 1aje n PHE 37 Cb 0.63 -2.25 0.00 0.00 0.35 0.00 0.00 39.48 38.20 1aje n PHE 37 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1aje n ASP 38 N 0.91 1.32 -2.02 -2.13 8.00 -1.26 -5.04 116.55 116.33 1aje n ASP 38 Ca 0.09 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.58 1aje n ASP 38 Cb 0.35 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.45 1aje n ASP 38 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1aje n ASN 39 N 0.00 -3.91 -3.76 -2.24 4.05 -1.26 -5.10 115.26 103.04 1aje n ASN 39 Ca 0.00 0.62 -0.07 0.00 0.45 0.00 0.00 54.58 55.58 1aje n ASN 39 Cb 0.00 -2.89 -0.02 0.00 1.23 0.00 0.00 39.78 38.10 1aje n ASN 39 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 177.26 173.49 1aje s TYR 40 N -0.62 -0.16 -0.13 1.20 1.13 -1.26 -5.02 117.35 112.49 1aje s TYR 40 Ca -0.03 -0.32 0.02 0.00 -1.41 0.00 0.00 57.07 55.33 1aje s TYR 40 Cb 0.00 0.72 0.01 0.00 -1.10 0.00 0.00 41.96 41.59 1aje s TYR 40 CO 0.34 -1.26 -0.19 0.00 -2.51 0.00 0.00 175.55 171.93 1aje s ALA 41 N -3.73 2.05 0.46 9.51 0.00 -1.24 -2.72 121.76 126.09 1aje s ALA 41 Ca 0.12 -0.96 0.08 0.00 0.00 0.00 0.00 51.96 51.19 1aje s ALA 41 Cb -0.06 -0.94 0.02 0.00 0.00 0.00 0.00 23.12 22.14 1aje s ALA 41 CO 0.07 -0.06 0.57 0.14 0.00 0.00 0.00 175.76 176.49 1aje s VAL 42 N 0.90 2.70 -0.23 0.00 -7.23 -0.85 -4.58 120.40 111.11 1aje s VAL 42 Ca -0.06 -1.09 -0.05 0.00 -1.81 0.00 0.00 61.98 58.97 1aje s VAL 42 Cb -0.15 -2.78 -0.02 0.00 0.56 0.00 0.00 36.38 33.99 1aje s VAL 42 CO -0.02 0.00 -0.00 -0.89 -0.31 0.00 0.00 175.10 173.88 1aje s THR 43 N -2.46 3.71 0.33 5.32 2.01 -1.26 0.12 115.64 123.41 1aje s THR 43 Ca 0.54 -0.38 0.05 0.00 0.31 0.00 0.00 61.69 62.22 1aje s THR 43 Cb -0.07 -2.71 0.05 0.00 0.01 0.00 0.00 72.50 69.78 1aje s THR 43 CO 0.33 0.39 0.43 1.33 -0.69 0.00 0.00 174.62 176.41 1aje n VAL 44 N 4.82 0.00 -3.59 3.82 0.24 -0.81 -4.80 118.33 118.01 1aje n VAL 44 Ca -0.17 -1.13 -0.19 0.00 -2.04 0.00 0.00 64.34 60.80 1aje n VAL 44 Cb 0.51 -0.65 -0.15 0.00 -1.47 0.00 0.00 33.84 32.08 1aje n VAL 44 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1aje s MET 45 N -3.49 0.10 -0.01 7.34 -1.94 -1.25 -1.82 119.30 118.22 1aje s MET 45 Ca 0.33 0.33 -0.05 0.00 -1.71 0.00 0.00 55.69 54.59 1aje s MET 45 Cb -0.03 -0.86 -0.03 0.00 2.01 0.00 0.00 34.83 35.92 1aje s MET 45 CO 0.21 -0.49 0.47 0.82 -0.01 0.00 0.00 175.02 176.01 1aje h ILE 46 N 6.35 0.00 -0.02 2.53 5.03 -1.88 -3.42 117.51 126.11 1aje h ILE 46 Ca -0.15 -0.21 -0.14 0.00 -0.12 0.00 0.00 64.86 64.24 1aje h ILE 46 Cb 1.14 0.00 -0.30 0.00 -3.03 0.00 0.00 36.82 34.63 1aje h ILE 46 CO 0.22 0.00 -0.91 0.61 -0.68 0.00 0.00 178.15 177.38 1aje n GLY 47 N 0.69 2.04 0.00 5.37 0.00 -1.26 -4.88 105.19 107.16 1aje n GLY 47 Ca -0.02 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 0.08 1.40 3.38 -0.02 0.00 -1.26 -5.11 105.19 103.66 1aje n GLY 48 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.10 2.96 0.09 1.61 0.41 -1.26 -4.86 118.70 117.55 1aje s GLU 49 Ca 0.00 -0.73 -0.21 0.00 -0.41 0.00 0.00 54.97 53.61 1aje s GLU 49 Cb 0.00 -2.46 -0.07 0.00 -1.78 0.00 0.00 34.13 29.82 1aje s GLU 49 CO 0.00 0.37 0.63 -1.25 -0.49 0.00 0.00 175.26 174.52 1aje s PRO 50 N -0.07 4.31 -0.19 0.39 0.04 -1.25 -2.62 135.00 135.61 1aje s PRO 50 Ca -0.03 0.86 -0.04 0.00 0.04 0.00 0.00 61.00 61.82 1aje s PRO 50 Cb -0.14 -3.25 0.08 0.00 0.04 0.00 0.00 34.50 31.22 1aje s PRO 50 CO 0.04 0.60 0.16 0.71 0.04 0.00 0.00 177.00 178.55 1aje s TYR 51 N -1.04 -0.06 0.57 0.56 2.02 -0.76 -2.57 117.35 116.07 1aje s TYR 51 Ca 0.31 -0.04 -0.19 0.00 -0.37 0.00 0.00 57.07 56.78 1aje s TYR 51 Cb -0.20 -0.52 -0.05 0.00 -0.40 0.00 0.00 41.96 40.79 1aje s TYR 51 CO 0.21 -0.57 1.17 0.99 -1.57 0.00 0.00 175.55 175.78 1aje s THR 52 N 2.24 2.90 -0.21 -0.71 2.01 -1.24 -1.93 115.64 118.69 1aje s THR 52 Ca 0.05 0.56 0.01 0.00 0.31 0.00 0.00 61.69 62.62 1aje s THR 52 Cb -0.16 -3.23 0.05 0.00 0.01 0.00 0.00 72.50 69.17 1aje s THR 52 CO -0.11 -0.12 -0.08 -0.76 -0.69 0.00 0.00 174.62 172.86 1aje s LEU 53 N -3.91 2.36 -0.54 4.42 2.01 0.32 0.14 118.68 123.48 1aje s LEU 53 Ca 0.75 -1.00 -0.17 0.00 0.01 0.00 0.00 54.13 53.72 1aje s LEU 53 Cb -0.27 -1.19 0.10 0.00 0.01 0.00 0.00 46.19 44.84 1aje s LEU 53 CO 0.30 -0.19 0.57 -0.83 1.01 0.00 0.00 176.35 177.21 1aje s GLY 54 N 1.41 1.92 0.14 -3.19 0.00 0.17 -2.00 107.32 105.77 1aje s GLY 54 Ca -0.03 -2.21 -0.30 0.00 0.00 0.00 0.00 44.72 42.18 1aje s GLY 54 CO -0.07 1.34 1.02 1.08 0.00 0.00 0.00 173.10 176.47 1aje s LEU 55 N 2.14 4.50 -0.09 0.66 2.01 -1.10 0.15 118.68 126.94 1aje s LEU 55 Ca 0.08 1.91 -0.02 0.00 0.01 0.00 0.00 54.13 56.11 1aje s LEU 55 Cb -0.25 -3.59 0.04 0.00 0.01 0.00 0.00 46.19 42.39 1aje s LEU 55 CO 0.06 -0.13 0.02 -0.36 1.01 0.00 0.00 176.35 176.96 1aje s PHE 56 N -0.09 0.62 0.00 0.29 0.08 0.11 -4.39 117.98 114.59 1aje s PHE 56 Ca 0.48 -0.23 0.00 0.00 0.12 0.00 0.00 56.93 57.30 1aje s PHE 56 Cb -0.26 -0.79 0.00 0.00 -0.57 0.00 0.00 43.02 41.40 1aje s PHE 56 CO 0.32 -0.37 0.00 -0.40 -0.10 0.00 0.00 175.22 174.67 1aje n ASP 57 N 5.16 0.22 -4.10 1.36 5.75 -1.26 -2.02 116.55 121.66 1aje n ASP 57 Ca -0.07 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.42 1aje n ASP 57 Cb 0.49 0.00 0.28 0.00 -1.03 0.00 0.00 41.12 40.86 1aje n ASP 57 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1aje s THR 58 N 2.23 1.71 0.00 2.12 -4.23 -1.26 -4.94 115.64 111.27 1aje s THR 58 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 1aje s THR 58 Cb 0.00 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.83 1aje s THR 58 CO 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.08 1aje n ALA 59 N -5.31 0.00 0.00 3.99 0.00 -1.26 -4.97 120.51 112.96 1aje n ALA 59 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1aje n ALA 59 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1aje n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aje n GLY 60 N 0.00 0.64 2.69 0.00 0.00 -1.26 -5.14 105.19 102.12 1aje n GLY 60 Ca 0.00 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 1aje n GLY 60 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1aje s GLN 61 N 0.00 0.07 0.33 1.61 0.74 -1.26 -5.01 119.66 116.13 1aje s GLN 61 Ca 0.00 0.16 0.11 0.00 0.05 0.00 0.00 55.36 55.68 1aje s GLN 61 Cb 0.00 -1.23 0.95 0.00 1.10 0.00 0.00 33.01 33.83 1aje s GLN 61 CO 0.00 -0.56 1.70 0.93 -0.55 0.00 0.00 175.29 176.82 1aje h GLU 62 N 8.39 0.47 -0.89 1.67 4.39 -2.04 0.30 114.58 126.86 1aje h GLU 62 Ca -0.15 -0.03 0.26 0.00 0.34 0.00 0.00 59.36 59.78 1aje h GLU 62 Cb 1.14 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.65 1aje h GLU 62 CO 0.24 0.31 0.75 0.22 -1.16 0.00 0.00 179.01 179.37 1aje h ASP 63 N 0.48 0.00 -4.85 1.42 3.58 -2.07 -3.46 116.42 111.53 1aje h ASP 63 Ca 0.67 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.12 1aje h ASP 63 Cb 1.38 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.43 1aje h ASP 63 CO -0.52 0.00 -0.71 0.00 -2.88 0.00 0.00 179.24 175.12 1aje n TYR 64 N -3.92 -3.28 -1.18 0.28 4.19 0.10 -4.97 117.16 108.38 1aje n TYR 64 Ca 0.19 1.41 -0.30 0.00 3.31 0.00 0.00 57.90 62.51 1aje n TYR 64 Cb 1.05 -3.67 0.14 0.00 0.49 0.00 0.00 39.34 37.35 1aje n TYR 64 CO 0.00 0.00 0.00 -0.51 0.91 0.00 0.00 176.86 177.26 1aje s ASP 65 N -1.70 3.46 0.56 2.98 1.01 -1.26 -4.99 116.67 116.74 1aje s ASP 65 Ca 0.07 1.52 -0.17 0.00 0.71 0.00 0.00 52.55 54.67 1aje s ASP 65 Cb -0.02 -2.20 -0.05 0.00 1.01 0.00 0.00 42.92 41.66 1aje s ASP 65 CO 0.66 -2.65 1.07 -0.60 0.21 0.00 0.00 175.17 173.86 1aje s ARG 66 N -4.91 3.40 0.45 8.23 6.06 -1.26 -4.89 118.95 126.02 1aje s ARG 66 Ca 0.63 1.33 0.24 0.00 -2.50 0.00 0.00 55.73 55.43 1aje s ARG 66 Cb -0.18 -2.04 1.24 0.00 0.06 0.00 0.00 34.95 34.04 1aje s ARG 66 CO 0.57 -0.76 1.82 -0.07 -2.50 0.00 0.00 175.30 174.36 1aje h LEU 67 N 0.82 0.28 -7.91 -0.88 3.38 -2.05 -3.32 115.31 105.62 1aje h LEU 67 Ca -0.48 0.04 -0.68 0.00 0.09 0.00 0.00 57.88 56.86 1aje h LEU 67 Cb 1.23 -0.00 -0.35 0.00 0.09 0.00 0.00 40.66 41.62 1aje h LEU 67 CO 0.57 0.08 -0.71 -0.13 0.09 0.00 0.00 178.44 178.34 1aje s ARG 68 N -5.29 2.18 0.74 1.13 0.52 -1.26 -5.10 118.95 111.88 1aje s ARG 68 Ca -0.07 -1.45 -0.12 0.00 -0.52 0.00 0.00 55.73 53.57 1aje s ARG 68 Cb 0.24 -3.16 0.04 0.00 0.52 0.00 0.00 34.95 32.59 1aje s ARG 68 CO 0.79 -0.71 1.10 -1.25 0.02 0.00 0.00 175.30 175.25 1aje s PRO 69 N 1.15 2.40 -0.07 3.54 0.04 -1.25 -4.93 135.00 135.87 1aje s PRO 69 Ca -0.02 1.26 0.09 0.00 0.04 0.00 0.00 61.00 62.37 1aje s PRO 69 Cb -0.20 -1.91 0.39 0.00 0.04 0.00 0.00 34.50 32.82 1aje s PRO 69 CO -0.04 -1.55 1.20 1.28 0.04 0.00 0.00 177.00 177.94 1aje n LEU 70 N -3.17 2.85 -0.54 -3.56 4.77 -1.26 -4.06 117.00 112.04 1aje n LEU 70 Ca 0.10 -1.44 0.03 0.00 -0.03 0.00 0.00 56.01 54.67 1aje n LEU 70 Cb 0.53 -0.45 0.10 0.00 -2.33 0.00 0.00 43.42 41.26 1aje n LEU 70 CO 0.51 0.47 0.54 -1.54 -1.33 0.00 0.00 177.39 176.04 1aje n SER 71 N 0.44 1.49 -0.17 -1.43 3.41 -1.26 -4.28 113.62 111.81 1aje n SER 71 Ca 0.14 -2.08 -0.01 0.00 -0.26 0.00 0.00 58.87 56.66 1aje n SER 71 Cb 0.56 -0.26 0.07 0.00 -0.26 0.00 0.00 64.21 64.32 1aje n SER 71 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1aje h TYR 72 N 1.21 -0.08 -0.79 7.33 -1.99 -1.99 -3.09 116.97 117.58 1aje h TYR 72 Ca 0.00 0.04 -0.71 0.00 2.00 0.00 0.00 58.73 60.06 1aje h TYR 72 Cb 0.47 0.12 -0.09 0.00 2.00 0.00 0.00 36.73 39.23 1aje h TYR 72 CO 0.19 -0.15 2.41 -0.35 -0.00 0.00 0.00 178.16 180.27 1aje n PRO 73 N -5.27 3.15 0.00 4.88 -0.04 -1.26 -4.82 135.00 131.64 1aje n PRO 73 Ca 0.06 -3.14 0.00 0.00 -0.04 0.00 0.00 63.50 60.39 1aje n PRO 73 Cb 0.30 -3.29 0.00 0.00 -0.04 0.00 0.00 33.50 30.47 1aje n PRO 73 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1aje n GLN 74 N 6.61 0.00 0.00 0.54 1.13 -1.17 -5.11 117.38 119.38 1aje n GLN 74 Ca 0.47 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.53 1aje n GLN 74 Cb 0.42 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.77 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 0.00 0.00 -2.92 5.09 -2.24 -1.26 -5.03 114.28 107.92 1aje n THR 75 Ca 0.00 0.18 -0.01 0.00 -2.27 0.00 0.00 64.05 61.94 1aje n THR 75 Cb 0.00 -0.87 0.01 0.00 -2.10 0.00 0.00 70.33 67.37 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 -1.46 -7.12 -4.05 3.42 8.00 0.13 -4.87 116.55 110.60 1aje n ASP 76 Ca 0.00 -0.12 -0.30 0.00 0.71 0.00 0.00 54.79 55.08 1aje n ASP 76 Cb 0.00 -4.87 0.20 0.00 -0.02 0.00 0.00 41.12 36.43 1aje n ASP 76 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1aje s VAL 77 N -3.04 1.87 -0.33 2.53 1.01 0.33 -4.71 120.40 118.06 1aje s VAL 77 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1aje s VAL 77 Cb -0.01 -2.83 0.10 0.00 0.00 0.00 0.00 36.38 33.65 1aje s VAL 77 CO 0.67 0.00 0.09 -0.36 0.00 0.00 0.00 175.10 175.50 1aje s PHE 78 N -3.59 2.55 -0.85 5.22 0.08 -0.82 0.11 117.98 120.68 1aje s PHE 78 Ca 0.73 -2.30 -0.22 0.00 0.12 0.00 0.00 56.93 55.26 1aje s PHE 78 Cb -0.06 -2.22 0.07 0.00 -0.57 0.00 0.00 43.02 40.25 1aje s PHE 78 CO 0.54 -0.90 1.21 -0.51 -0.10 0.00 0.00 175.22 175.46 1aje s LEU 79 N 1.23 4.09 -0.45 -0.37 1.43 -0.83 -1.34 118.68 122.44 1aje s LEU 79 Ca 0.11 -1.31 -0.28 0.00 -1.03 0.00 0.00 54.13 51.61 1aje s LEU 79 Cb -0.18 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.56 1aje s LEU 79 CO -0.17 -1.43 1.43 -0.69 0.23 0.00 0.00 176.35 175.72 1aje s VAL 80 N 4.26 3.85 -0.34 -1.59 1.01 -0.22 -2.27 120.40 125.09 1aje s VAL 80 Ca 0.34 0.83 -0.28 0.00 0.00 0.00 0.00 61.98 62.87 1aje s VAL 80 Cb -0.07 -4.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 1aje s VAL 80 CO -0.00 -0.86 1.95 0.00 0.00 0.00 0.00 175.10 176.18 1aje s PHE 82 N 7.83 3.39 -0.29 0.00 2.19 0.36 -4.34 117.98 127.12 1aje s PHE 82 Ca 0.85 1.48 0.03 0.00 0.33 0.00 0.00 56.93 59.61 1aje s PHE 82 Cb -0.24 -2.77 0.08 0.00 -1.31 0.00 0.00 43.02 38.78 1aje s PHE 82 CO 0.32 -0.21 -0.04 0.45 1.83 0.00 0.00 175.22 177.57 1aje s SER 83 N -2.65 4.45 0.00 6.13 0.15 -1.26 0.05 113.70 120.57 1aje s SER 83 Ca 0.59 -1.63 0.23 0.00 0.70 0.00 0.00 55.95 55.84 1aje s SER 83 Cb -0.10 -1.49 0.09 0.00 -1.71 0.00 0.00 66.02 62.82 1aje s SER 83 CO 0.23 -0.27 1.17 0.52 1.20 0.00 0.00 173.24 176.09 1aje n VAL 84 N 4.43 0.00 -0.81 4.45 0.31 -1.26 -3.64 118.33 121.80 1aje n VAL 84 Ca -0.07 -0.34 0.08 0.00 -0.01 0.00 0.00 64.34 63.99 1aje n VAL 84 Cb 0.42 1.32 0.30 0.00 -0.91 0.00 0.00 33.84 34.97 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 0.47 2.19 -4.09 2.52 0.24 -1.26 -2.21 118.33 116.18 1aje n VAL 85 Ca 0.11 -1.54 -0.09 0.00 -2.04 0.00 0.00 64.34 60.78 1aje n VAL 85 Cb 0.51 -0.11 -0.09 0.00 -1.47 0.00 0.00 33.84 32.68 1aje n VAL 85 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1aje s SER 86 N -1.36 0.31 -0.50 -1.34 0.01 -1.22 -4.76 113.70 104.85 1aje s SER 86 Ca 0.45 -1.07 -0.28 0.00 1.31 0.00 0.00 55.95 56.36 1aje s SER 86 Cb 0.33 0.29 -0.01 0.00 0.21 0.00 0.00 66.02 66.84 1aje s SER 86 CO 0.14 -0.71 1.73 -2.16 0.41 0.00 0.00 173.24 172.65 1aje s PRO 87 N -3.99 3.04 -0.40 12.44 0.04 -1.22 -3.66 135.00 141.25 1aje s PRO 87 Ca 0.17 0.88 0.00 0.00 0.04 0.00 0.00 61.00 62.09 1aje s PRO 87 Cb 0.07 -4.25 0.00 0.00 0.04 0.00 0.00 34.50 30.36 1aje s PRO 87 CO -0.03 -2.22 0.00 0.45 0.04 0.00 0.00 177.00 175.24 1aje n SER 88 N 11.11 -1.69 -0.12 6.66 2.88 -1.26 -4.73 113.62 126.47 1aje n SER 88 Ca 0.20 0.29 0.02 0.00 -1.33 0.00 0.00 58.87 58.04 1aje n SER 88 Cb 0.50 -1.66 0.31 0.00 -0.75 0.00 0.00 64.21 62.60 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 0.70 0.00 -3.46 0.87 -1.77 0.90 113.55 110.79 1aje h SER 89 Ca -0.10 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1aje h SER 89 Cb 0.78 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 1aje h SER 89 CO 0.12 0.53 0.08 2.22 -0.53 0.00 0.00 176.83 179.25 1aje n PHE 90 N -4.42 0.13 0.02 2.24 -1.74 -1.24 -2.00 117.46 110.45 1aje n PHE 90 Ca 0.06 0.07 -0.16 0.00 -0.56 0.00 0.00 57.45 56.85 1aje n PHE 90 Cb 0.06 -0.54 -0.14 0.00 1.52 0.00 0.00 39.48 40.39 1aje n PHE 90 CO 0.00 0.00 0.00 0.93 -0.56 0.00 0.00 176.76 177.13 1aje h GLU 91 N 0.00 0.19 0.00 3.97 4.39 -1.17 -3.21 114.58 118.75 1aje h GLU 91 Ca 0.00 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.37 1aje h GLU 91 Cb 0.16 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1aje h GLU 91 CO 0.00 0.99 0.03 -2.95 -1.16 0.00 0.00 179.01 175.92 1aje h ASN 92 N 0.05 0.00 -0.28 1.42 7.08 -1.51 0.28 115.58 122.62 1aje h ASN 92 Ca -0.32 0.00 -0.00 0.00 -3.08 0.00 0.00 56.30 52.90 1aje h ASN 92 Cb 2.02 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 38.25 1aje h ASN 92 CO 0.11 0.00 0.17 0.58 -2.08 0.00 0.00 177.43 176.21 1aje h VAL 93 N 0.00 1.10 -0.11 6.14 2.07 -1.61 -2.41 116.25 121.43 1aje h VAL 93 Ca 0.00 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.30 1aje h VAL 93 Cb 0.06 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1aje h VAL 93 CO 0.00 0.10 -0.02 0.11 0.02 0.00 0.00 177.57 177.77 1aje h LYS 94 N 0.36 0.00 -0.86 1.57 1.79 -0.59 0.46 116.57 119.29 1aje h LYS 94 Ca 0.10 -0.00 0.23 0.00 -2.18 0.00 0.00 60.65 58.80 1aje h LYS 94 Cb 0.01 -0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 30.52 1aje h LYS 94 CO -0.02 0.00 0.22 0.93 -1.08 0.00 0.00 179.45 179.50 1aje h GLU 95 N 0.00 0.20 0.00 3.15 5.08 -1.32 -3.18 114.58 118.52 1aje h GLU 95 Ca 0.05 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1aje h GLU 95 Cb 0.08 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1aje h GLU 95 CO -0.11 0.13 -0.41 1.63 -1.00 0.00 0.00 179.01 179.25 1aje n LYS 96 N -5.23 3.19 0.00 2.33 5.02 -1.09 -4.70 118.16 117.69 1aje n LYS 96 Ca 0.20 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.31 1aje n LYS 96 Cb 0.66 -0.67 -0.09 0.00 -0.02 0.00 0.00 35.03 34.90 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 1aje h TRP 97 N 0.00 1.00 -0.54 2.13 4.06 -0.18 -2.20 115.95 120.21 1aje h TRP 97 Ca 0.00 -0.49 -0.12 0.00 2.06 0.00 0.00 58.89 60.35 1aje h TRP 97 Cb 0.00 -0.14 -0.02 0.00 -1.00 0.00 0.00 29.16 28.01 1aje h TRP 97 CO 0.00 1.32 -0.12 0.28 -3.56 0.00 0.00 178.44 176.36 1aje h VAL 98 N 0.40 1.27 0.00 1.49 2.07 -1.50 0.19 116.25 120.17 1aje h VAL 98 Ca -0.08 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.16 1aje h VAL 98 Cb 1.48 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1aje h VAL 98 CO 0.17 0.45 0.00 1.55 0.02 0.00 0.00 177.57 179.76 1aje h PRO 99 N 0.90 0.00 0.00 1.57 0.13 -1.75 0.30 132.00 133.15 1aje h PRO 99 Ca 0.14 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 65.04 1aje h PRO 99 Cb 0.69 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.78 1aje h PRO 99 CO 0.05 0.00 -1.81 0.39 -0.23 0.00 0.00 178.00 176.40 1aje n GLU 100 N -2.46 0.65 -0.06 0.86 1.02 -0.34 -3.69 120.64 116.62 1aje n GLU 100 Ca 0.00 0.12 -0.11 0.00 -0.02 0.00 0.00 57.16 57.15 1aje n GLU 100 Cb 0.17 -1.69 -0.04 0.00 -0.02 0.00 0.00 31.44 29.86 1aje n GLU 100 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1aje n ILE 101 N -2.80 1.16 -0.02 -3.67 -5.35 0.53 -4.37 119.36 104.84 1aje n ILE 101 Ca -0.17 0.02 -0.21 0.00 -0.27 0.00 0.00 62.75 62.12 1aje n ILE 101 Cb 0.94 -1.89 -0.13 0.00 -1.74 0.00 0.00 39.64 36.81 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 -0.59 1.03 -0.08 7.28 1.35 -1.20 1.62 112.91 122.32 1aje h THR 102 Ca -0.20 -2.35 0.02 0.00 -0.55 0.00 0.00 66.41 63.33 1aje h THR 102 Cb 0.96 2.65 -0.00 0.00 -1.73 0.00 0.00 68.15 70.03 1aje h THR 102 CO -0.12 0.64 0.07 -0.74 -0.25 0.00 0.00 175.52 175.11 1aje h HIS 103 N -0.46 0.00 0.00 4.73 6.17 -1.36 -0.70 115.15 123.53 1aje h HIS 103 Ca -0.30 0.00 0.00 0.00 0.71 0.00 0.00 60.37 60.78 1aje h HIS 103 Cb 1.64 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.57 1aje h HIS 103 CO 0.13 0.00 -0.17 0.45 0.71 0.00 0.00 177.93 179.05 1aje h HIS 104 N 0.00 0.00 -2.69 5.26 -0.00 -1.63 -3.44 115.15 112.65 1aje h HIS 104 Ca 0.04 0.00 -0.61 0.00 -0.00 0.00 0.00 60.37 59.80 1aje h HIS 104 Cb 0.18 0.00 -0.42 0.00 -0.00 0.00 0.00 27.41 27.17 1aje h HIS 104 CO 0.00 0.00 -0.62 0.00 -0.00 0.00 0.00 177.93 177.31 1aje n PRO 106 N 1.59 3.75 -0.08 0.00 -0.04 -0.27 -4.32 135.00 135.63 1aje n PRO 106 Ca 0.24 -2.47 -0.21 0.00 -0.04 0.00 0.00 63.50 61.03 1aje n PRO 106 Cb 0.39 -2.64 -0.12 0.00 -0.04 0.00 0.00 33.50 31.08 1aje n PRO 106 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1aje h LYS 107 N 4.60 0.04 0.00 0.54 1.79 -1.87 -3.50 116.57 118.17 1aje h LYS 107 Ca 0.74 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 59.13 1aje h LYS 107 Cb 0.42 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 1aje h LYS 107 CO 1.51 1.04 0.00 2.41 -1.08 0.00 0.00 179.45 183.32 1aje n THR 108 N -4.33 0.00 -1.55 -0.16 -1.04 -1.26 -5.08 114.28 100.86 1aje n THR 108 Ca -0.29 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.52 1aje n THR 108 Cb 0.71 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 69.14 1aje n THR 108 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1aje n PRO 109 N 0.00 0.60 -3.71 -2.82 -0.04 -1.25 -4.37 135.00 123.41 1aje n PRO 109 Ca 0.00 -0.55 -0.28 0.00 -0.04 0.00 0.00 63.50 62.62 1aje n PRO 109 Cb 0.00 -3.33 -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 12.76 1.09 -0.23 0.54 2.19 -1.26 -1.94 117.98 131.13 1aje s PHE 110 Ca 0.99 -1.05 0.02 0.00 0.33 0.00 0.00 56.93 57.22 1aje s PHE 110 Cb -0.24 -1.16 0.05 0.00 -1.31 0.00 0.00 43.02 40.35 1aje s PHE 110 CO 0.18 -0.69 -0.14 -0.51 1.83 0.00 0.00 175.22 175.89 1aje s LEU 111 N 1.83 2.90 -0.70 6.12 1.43 -0.45 0.39 118.68 130.21 1aje s LEU 111 Ca 0.03 -1.11 -0.25 0.00 -1.03 0.00 0.00 54.13 51.77 1aje s LEU 111 Cb -0.17 -1.49 0.05 0.00 0.03 0.00 0.00 46.19 44.61 1aje s LEU 111 CO -0.15 -0.13 1.14 -0.22 0.23 0.00 0.00 176.35 177.22 1aje s LEU 112 N 1.20 3.68 -0.19 1.79 2.96 -0.35 -1.06 118.68 126.71 1aje s LEU 112 Ca -0.04 -0.65 -0.04 0.00 -0.22 0.00 0.00 54.13 53.18 1aje s LEU 112 Cb -0.17 -2.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.97 1aje s LEU 112 CO -0.08 -1.66 -0.04 -0.69 -1.32 0.00 0.00 176.35 172.57 1aje s VAL 113 N 5.00 3.63 0.29 1.68 1.01 -0.88 -0.63 120.40 130.50 1aje s VAL 113 Ca 0.30 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.56 1aje s VAL 113 Cb -0.12 -2.63 -0.11 0.00 0.00 0.00 0.00 36.38 33.53 1aje s VAL 113 CO 0.13 0.45 1.48 -0.83 0.00 0.00 0.00 175.10 176.33 1aje s GLY 114 N 1.00 2.41 0.53 4.51 0.00 0.84 0.14 107.32 116.76 1aje s GLY 114 Ca 0.01 1.44 0.05 0.00 0.00 0.00 0.00 44.72 46.21 1aje s GLY 114 CO 0.01 2.33 0.32 -1.08 0.00 0.00 0.00 173.10 174.68 1aje s THR 115 N -0.28 1.58 -0.54 0.90 -1.32 0.11 -3.29 115.64 112.80 1aje s THR 115 Ca 0.59 -1.59 -0.07 0.00 -1.21 0.00 0.00 61.69 59.40 1aje s THR 115 Cb -0.44 -2.18 0.07 0.00 -1.51 0.00 0.00 72.50 68.44 1aje s THR 115 CO 0.49 0.00 0.17 0.00 -2.21 0.00 0.00 174.62 173.07 1aje n GLN 116 N -1.65 -1.49 0.00 7.08 1.13 -1.26 -4.23 117.38 116.96 1aje n GLN 116 Ca -0.05 0.04 0.06 0.00 -1.94 0.00 0.00 57.00 55.10 1aje n GLN 116 Cb 0.65 -2.64 0.25 0.00 0.11 0.00 0.00 30.24 28.61 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 -1.98 1.16 0.83 5.09 5.41 -1.26 -1.53 119.36 127.07 1aje n ILE 117 Ca 0.03 0.29 0.13 0.00 1.00 0.00 0.00 62.75 64.20 1aje n ILE 117 Cb 0.27 -1.09 0.53 0.00 -0.71 0.00 0.00 39.64 38.64 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 -1.48 0.18 -0.02 4.38 2.03 -1.26 -2.42 116.55 117.97 1aje n ASP 118 Ca 0.03 0.52 0.04 0.00 0.52 0.00 0.00 54.79 55.90 1aje n ASP 118 Cb 0.13 -0.57 -0.04 0.00 -0.72 0.00 0.00 41.12 39.92 1aje n ASP 118 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1aje n LEU 119 N -1.68 0.47 -0.05 -2.67 7.99 -0.59 -4.18 117.00 116.30 1aje n LEU 119 Ca 0.06 -0.53 0.24 0.00 -0.01 0.00 0.00 56.01 55.77 1aje n LEU 119 Cb 0.33 0.00 0.71 0.00 -0.11 0.00 0.00 43.42 44.35 1aje n LEU 119 CO 0.25 0.11 1.21 -0.09 -1.51 0.00 0.00 177.39 177.37 1aje h ARG 120 N 0.10 0.00 -0.02 3.23 1.12 -1.21 1.04 114.38 118.64 1aje h ARG 120 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1aje h ARG 120 Cb 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.17 1aje h ARG 120 CO 0.00 0.00 -0.17 -3.47 -3.11 0.00 0.00 179.97 173.22 1aje n ASP 121 N -4.21 2.10 -4.55 -3.80 -0.08 -1.26 -4.89 116.55 99.86 1aje n ASP 121 Ca 0.13 -1.55 -0.28 0.00 -1.51 0.00 0.00 54.79 51.57 1aje n ASP 121 Cb 0.75 0.22 -0.10 0.00 2.34 0.00 0.00 41.12 44.33 1aje n ASP 121 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1aje s ASP 122 N -1.71 4.21 0.00 1.67 2.15 0.36 -4.98 116.67 118.37 1aje s ASP 122 Ca 0.18 -0.51 0.10 0.00 0.43 0.00 0.00 52.55 52.74 1aje s ASP 122 Cb 0.14 -0.72 0.48 0.00 -0.30 0.00 0.00 42.92 42.53 1aje s ASP 122 CO 0.32 0.14 1.25 -0.81 -0.17 0.00 0.00 175.17 175.90 1aje n PRO 123 N 0.42 0.09 -0.17 4.34 -0.04 -1.26 -3.40 135.00 134.99 1aje n PRO 123 Ca -0.13 0.24 -0.02 0.00 -0.04 0.00 0.00 63.50 63.55 1aje n PRO 123 Cb 0.54 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.56 1aje n PRO 123 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1aje h SER 124 N 0.00 -0.31 0.00 3.54 0.87 -1.94 0.30 113.55 116.02 1aje h SER 124 Ca 0.00 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 1aje h SER 124 Cb 0.12 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1aje h SER 124 CO 0.00 -0.11 0.00 1.07 -0.53 0.00 0.00 176.83 177.26 1aje n THR 125 N -5.28 0.00 -0.02 2.23 5.66 -1.22 -3.84 114.28 111.80 1aje n THR 125 Ca 0.06 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.95 1aje n THR 125 Cb 0.28 -0.30 -0.09 0.00 -1.55 0.00 0.00 70.33 68.67 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 0.00 1.22 -1.01 1.09 1.08 -0.60 -3.18 117.51 116.11 1aje h ILE 126 Ca 0.00 -1.63 0.27 0.00 -0.39 0.00 0.00 64.86 63.11 1aje h ILE 126 Cb 0.00 2.18 -0.07 0.00 -3.07 0.00 0.00 36.82 35.86 1aje h ILE 126 CO 0.00 0.37 0.68 -0.33 -0.69 0.00 0.00 178.15 178.18 1aje h GLU 127 N -0.88 0.24 -1.04 2.37 5.08 -1.67 2.95 114.58 121.64 1aje h GLU 127 Ca -0.01 -0.01 0.27 0.00 -1.00 0.00 0.00 59.36 58.60 1aje h GLU 127 Cb 0.65 -0.05 -0.09 0.00 0.50 0.00 0.00 28.75 29.76 1aje h GLU 127 CO 0.01 0.16 0.67 0.87 -1.00 0.00 0.00 179.01 179.72 1aje h LYS 128 N 0.25 0.37 0.00 2.33 1.79 -1.74 -3.39 116.57 116.18 1aje h LYS 128 Ca 0.53 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.98 1aje h LYS 128 Cb 1.62 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 32.18 1aje h LYS 128 CO -0.16 0.25 0.00 1.28 -1.08 0.00 0.00 179.45 179.73 1aje n LEU 129 N -4.61 -0.78 -1.99 2.94 4.32 0.23 -5.00 117.00 112.12 1aje n LEU 129 Ca 0.25 0.33 -0.06 0.00 -0.02 0.00 0.00 56.01 56.51 1aje n LEU 129 Cb 0.88 0.88 -0.01 0.00 -1.62 0.00 0.00 43.42 43.55 1aje n LEU 129 CO 0.26 -0.47 -0.07 0.00 -1.22 0.00 0.00 177.39 175.89 1aje n ALA 130 N -3.00 -0.59 0.12 -1.18 0.00 0.92 -4.67 120.51 112.10 1aje n ALA 130 Ca 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 53.44 53.48 1aje n ALA 130 Cb 0.00 -0.90 0.11 0.00 0.00 0.00 0.00 19.45 18.66 1aje n ALA 130 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1aje h LYS 131 N 0.00 0.01 -0.20 0.00 1.79 -1.93 -2.81 116.57 113.43 1aje h LYS 131 Ca -0.13 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1aje h LYS 131 Cb 0.84 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.49 1aje h LYS 131 CO 0.17 0.70 0.00 0.09 -1.08 0.00 0.00 179.45 179.33 1aje n ASN 132 N -3.72 3.20 -3.17 0.86 3.02 -1.26 -4.93 115.26 109.27 1aje n ASN 132 Ca -0.01 -2.72 -0.20 0.00 -0.03 0.00 0.00 54.58 51.62 1aje n ASN 132 Cb 0.68 -0.41 -0.01 0.00 -0.61 0.00 0.00 39.78 39.44 1aje n ASN 132 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1aje n LYS 133 N -0.48 -3.06 0.00 3.52 4.76 -1.06 -4.58 118.16 117.26 1aje n LYS 133 Ca 0.16 0.45 0.00 0.00 -2.87 0.00 0.00 58.31 56.05 1aje n LYS 133 Cb 0.68 -5.12 0.00 0.00 -1.84 0.00 0.00 35.03 28.76 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 -3.47 0.00 -2.67 1.97 1.13 -1.26 -5.04 117.38 108.03 1aje n GLN 134 Ca -0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.03 1aje n GLN 134 Cb 0.55 0.00 0.02 0.00 0.11 0.00 0.00 30.24 30.92 1aje n GLN 134 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 1aje s LYS 135 N -4.74 0.05 0.40 -1.09 0.00 -1.26 -4.96 119.74 108.14 1aje s LYS 135 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 55.97 55.80 1aje s LYS 135 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 37.83 37.76 1aje s LYS 135 CO 0.00 -0.07 0.81 -1.25 0.00 0.00 0.00 175.35 174.84 1aje s PRO 136 N 1.63 3.89 0.49 1.78 0.04 -1.26 -3.42 135.00 138.17 1aje s PRO 136 Ca 0.17 0.64 -0.23 0.00 0.04 0.00 0.00 61.00 61.62 1aje s PRO 136 Cb 0.08 -2.35 -0.07 0.00 0.04 0.00 0.00 34.50 32.21 1aje s PRO 136 CO -0.15 -0.02 1.29 -0.89 0.04 0.00 0.00 177.00 177.27 1aje n ILE 137 N -1.05 3.22 -3.05 0.56 -0.00 -0.94 -4.93 119.36 113.16 1aje n ILE 137 Ca 0.04 -0.50 -0.19 0.00 -0.00 0.00 0.00 62.75 62.10 1aje n ILE 137 Cb 0.54 -1.60 0.03 0.00 -0.00 0.00 0.00 39.64 38.62 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 -1.27 2.55 -0.72 1.39 2.01 -1.26 -4.93 115.64 113.41 1aje s THR 138 Ca 0.67 -1.02 0.20 0.00 0.31 0.00 0.00 61.69 61.85 1aje s THR 138 Cb -0.45 -2.56 0.19 0.00 0.01 0.00 0.00 72.50 69.69 1aje s THR 138 CO 0.53 0.00 1.61 -0.81 -0.69 0.00 0.00 174.62 175.26 1aje n PRO 139 N -2.04 0.11 0.00 4.92 -0.04 -1.26 -2.08 135.00 134.61 1aje n PRO 139 Ca 0.12 0.34 0.08 0.00 -0.04 0.00 0.00 63.50 64.00 1aje n PRO 139 Cb 0.60 -1.70 0.01 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.91 1.59 -0.05 0.54 1.02 -1.26 -4.27 120.64 116.30 1aje n GLU 140 Ca 0.03 -1.00 -0.04 0.00 -0.02 0.00 0.00 57.16 56.13 1aje n GLU 140 Cb 0.21 -1.31 -0.01 0.00 -0.02 0.00 0.00 31.44 30.31 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 0.14 0.89 0.43 2.62 -1.04 -0.89 -3.70 114.28 112.73 1aje n THR 141 Ca 0.08 0.31 -0.20 0.00 -2.04 0.00 0.00 64.05 62.20 1aje n THR 141 Cb 0.38 -2.04 -0.10 0.00 -1.82 0.00 0.00 70.33 66.75 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 -1.38 -1.27 -0.45 2.41 0.00 -1.78 -0.58 119.26 116.20 1aje h ALA 142 Ca 0.00 -0.25 0.13 0.00 0.00 0.00 0.00 54.91 54.79 1aje h ALA 142 Cb 0.41 0.61 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1aje h ALA 142 CO 0.00 -1.23 0.42 0.93 0.00 0.00 0.00 179.25 179.37 1aje h GLU 143 N -1.20 0.00 -0.44 0.00 5.08 -1.82 0.56 114.58 116.76 1aje h GLU 143 Ca -0.11 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1aje h GLU 143 Cb 0.96 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 1aje h GLU 143 CO 0.10 0.00 0.23 -0.22 -1.00 0.00 0.00 179.01 178.12 1aje h LYS 144 N 0.00 0.45 0.02 2.33 3.64 -1.19 -1.27 116.57 120.55 1aje h LYS 144 Ca 0.22 -0.03 -0.34 0.00 -1.27 0.00 0.00 60.65 59.23 1aje h LYS 144 Cb 1.05 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.72 1aje h LYS 144 CO -0.00 0.29 -2.03 1.47 -2.27 0.00 0.00 179.45 176.91 1aje n LEU 145 N -4.89 1.16 0.29 5.20 -0.00 0.02 -3.37 117.00 115.41 1aje n LEU 145 Ca 0.03 0.20 0.15 0.00 -0.00 0.00 0.00 56.01 56.39 1aje n LEU 145 Cb 0.10 -0.08 0.90 0.00 -0.00 0.00 0.00 43.42 44.35 1aje n LEU 145 CO 0.30 0.56 1.09 0.00 -0.00 0.00 0.00 177.39 179.35 1aje h ALA 146 N 0.73 1.39 0.00 1.47 0.00 -1.09 2.26 119.26 124.02 1aje h ALA 146 Ca -0.42 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 1aje h ALA 146 Cb 2.07 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.85 1aje h ALA 146 CO 0.05 0.04 -0.34 -0.09 0.00 0.00 0.00 179.25 178.91 1aje h ARG 147 N 0.00 0.00 0.00 0.00 2.43 -1.33 1.42 114.38 116.90 1aje h ARG 147 Ca -0.00 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1aje h ARG 147 Cb 0.09 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1aje h ARG 147 CO 0.00 0.34 -0.73 0.22 -1.51 0.00 0.00 179.97 178.30 1aje h ASP 148 N 0.00 0.00 0.00 -3.80 1.82 0.37 -3.36 116.42 111.44 1aje h ASP 148 Ca -0.00 0.00 -0.21 0.00 -0.39 0.00 0.00 57.03 56.43 1aje h ASP 148 Cb 0.94 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.91 1aje h ASP 148 CO 0.04 0.42 -1.79 0.18 -1.61 0.00 0.00 179.24 176.49 1aje n LEU 149 N -3.08 0.79 -3.42 2.28 4.77 0.04 -5.01 117.00 113.38 1aje n LEU 149 Ca -0.01 -0.02 -0.17 0.00 -0.03 0.00 0.00 56.01 55.78 1aje n LEU 149 Cb 0.72 0.07 0.08 0.00 -2.33 0.00 0.00 43.42 41.96 1aje n LEU 149 CO 0.40 0.40 0.07 0.29 -1.33 0.00 0.00 177.39 177.23 1aje n LYS 150 N -2.55 -5.41 0.00 3.23 4.01 0.48 -4.96 118.16 112.96 1aje n LYS 150 Ca -0.20 0.82 0.00 0.00 -0.51 0.00 0.00 58.31 58.42 1aje n LYS 150 Cb 0.84 -5.76 0.00 0.00 -0.51 0.00 0.00 35.03 29.60 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 -3.95 0.00 0.05 7.82 0.00 -1.25 -4.87 120.51 118.31 1aje n ALA 151 Ca -0.24 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.01 1aje n ALA 151 Cb 0.66 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.96 1aje n ALA 151 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1aje h VAL 152 N -0.46 0.96 -1.50 0.00 2.07 0.72 -3.47 116.25 114.57 1aje h VAL 152 Ca 0.00 -2.60 0.09 0.00 0.82 0.00 0.00 66.70 65.00 1aje h VAL 152 Cb 0.00 2.70 -0.26 0.00 -1.52 0.00 0.00 31.29 32.21 1aje h VAL 152 CO 0.00 0.82 0.55 -0.75 0.02 0.00 0.00 177.57 178.22 1aje s LYS 153 N -2.59 0.46 -0.13 1.57 2.47 -1.10 -5.01 119.74 115.42 1aje s LYS 153 Ca -0.14 0.37 -0.01 0.00 -1.56 0.00 0.00 55.97 54.63 1aje s LYS 153 Cb 0.06 0.22 -0.02 0.00 -1.46 0.00 0.00 37.83 36.64 1aje s LYS 153 CO 0.84 -0.09 -0.10 -0.47 0.16 0.00 0.00 175.35 175.68 1aje s TYR 154 N -0.28 2.87 0.11 4.03 5.04 -1.26 -1.21 117.35 126.65 1aje s TYR 154 Ca 0.02 -0.49 -0.00 0.00 -2.44 0.00 0.00 57.07 54.16 1aje s TYR 154 Cb -0.03 -1.86 0.00 0.00 0.35 0.00 0.00 41.96 40.42 1aje s TYR 154 CO -0.05 -0.12 0.14 1.33 -1.34 0.00 0.00 175.55 175.52 1aje n VAL 155 N 3.41 0.00 -3.74 3.14 0.24 0.20 -5.00 118.33 116.57 1aje n VAL 155 Ca -0.18 -0.59 -0.13 0.00 -2.04 0.00 0.00 64.34 61.40 1aje n VAL 155 Cb 0.53 0.35 -0.14 0.00 -1.47 0.00 0.00 33.84 33.11 1aje n VAL 155 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1aje s GLU 156 N -2.28 0.13 -0.30 7.34 2.02 -1.26 -0.11 118.70 124.24 1aje s GLU 156 Ca 0.10 0.41 -0.15 0.00 0.02 0.00 0.00 54.97 55.35 1aje s GLU 156 Cb -0.00 -0.15 0.18 0.00 0.10 0.00 0.00 34.13 34.25 1aje s GLU 156 CO 0.07 -0.16 1.15 0.00 0.02 0.00 0.00 175.26 176.34 1aje n SER 158 N 5.28 2.24 -0.16 0.00 7.64 -1.26 -4.70 113.62 122.66 1aje n SER 158 Ca 0.00 1.15 0.02 0.00 1.01 0.00 0.00 58.87 61.06 1aje n SER 158 Cb 0.56 -1.37 0.06 0.00 -1.01 0.00 0.00 64.21 62.46 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 0.10 0.05 -0.43 0.00 -1.26 0.95 120.51 121.35 1aje n ALA 159 Ca 0.11 0.48 0.07 0.00 0.00 0.00 0.00 53.44 54.09 1aje n ALA 159 Cb 0.30 -0.28 -0.07 0.00 0.00 0.00 0.00 19.45 19.40 1aje n ALA 159 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 160 N -4.70 0.63 0.21 0.00 -0.00 -1.26 -4.47 117.00 107.40 1aje n LEU 160 Ca 0.07 0.26 -0.10 0.00 -0.00 0.00 0.00 56.01 56.24 1aje n LEU 160 Cb 0.22 0.03 -0.05 0.00 -0.00 0.00 0.00 43.42 43.61 1aje n LEU 160 CO -0.05 -0.01 0.52 0.74 -0.00 0.00 0.00 177.39 178.59 1aje h THR 161 N 0.00 0.00 -0.49 1.47 2.02 0.26 -3.48 112.91 112.70 1aje h THR 161 Ca -0.08 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1aje h THR 161 Cb 1.26 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1aje h THR 161 CO 0.02 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.91 1aje n GLN 162 N -3.90 0.00 0.09 6.66 1.13 -1.14 -4.95 117.38 115.28 1aje n GLN 162 Ca -0.07 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.12 1aje n GLN 162 Cb 0.25 -2.54 0.44 0.00 0.11 0.00 0.00 30.24 28.50 1aje n GLN 162 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1aje n LYS 163 N -0.68 0.22 0.00 -1.09 -0.00 -1.26 -4.29 118.16 111.07 1aje n LYS 163 Ca 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 58.31 58.52 1aje n LYS 163 Cb 0.43 -1.78 0.00 0.00 -0.00 0.00 0.00 35.03 33.69 1aje n LYS 163 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1aje n GLY 164 N 1.18 0.99 0.35 2.58 0.00 -1.26 -4.94 105.19 104.10 1aje n GLY 164 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 1aje n GLY 164 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1aje h LEU 165 N 0.00 1.00 -0.91 0.99 5.85 -1.87 1.50 115.31 121.87 1aje h LEU 165 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1aje h LEU 165 Cb 0.71 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1aje h LEU 165 CO 0.00 0.68 0.00 0.29 -0.34 0.00 0.00 178.44 179.07 1aje n LYS 166 N -4.50 0.14 -0.08 1.25 4.76 -1.26 0.21 118.16 118.67 1aje n LYS 166 Ca 0.13 0.51 -0.23 0.00 -2.87 0.00 0.00 58.31 55.85 1aje n LYS 166 Cb 0.11 -1.85 -0.12 0.00 -1.84 0.00 0.00 35.03 31.33 1aje n LYS 166 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1aje n ASN 167 N -2.12 1.99 0.20 4.39 5.15 0.42 -0.99 115.26 124.28 1aje n ASN 167 Ca 0.00 0.23 0.06 0.00 -0.60 0.00 0.00 54.58 54.28 1aje n ASN 167 Cb 0.12 -0.80 0.39 0.00 -0.53 0.00 0.00 39.78 38.95 1aje n ASN 167 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1aje h VAL 168 N -0.47 0.90 0.23 3.44 2.07 0.21 1.10 116.25 123.74 1aje h VAL 168 Ca -0.49 -1.37 -0.34 0.00 0.82 0.00 0.00 66.70 65.32 1aje h VAL 168 Cb 1.71 1.82 0.03 0.00 -1.52 0.00 0.00 31.29 33.34 1aje h VAL 168 CO -0.14 0.34 -1.55 -0.26 0.02 0.00 0.00 177.57 175.98 1aje h PHE 169 N 0.00 0.90 -0.33 1.57 -1.00 0.23 2.09 116.94 120.40 1aje h PHE 169 Ca -0.00 -0.66 -0.08 0.00 2.81 0.00 0.00 57.97 60.04 1aje h PHE 169 Cb 0.80 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.30 1aje h PHE 169 CO 0.00 1.58 -0.13 0.22 -1.61 0.00 0.00 178.31 178.38 1aje h ASP 170 N 0.14 0.56 0.06 2.17 3.58 -0.37 -1.26 116.42 121.29 1aje h ASP 170 Ca -0.28 -0.15 -0.00 0.00 0.42 0.00 0.00 57.03 57.02 1aje h ASP 170 Cb 2.15 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 43.05 1aje h ASP 170 CO 0.25 0.71 -0.03 -0.33 -2.88 0.00 0.00 179.24 176.97 1aje h GLU 171 N 0.52 -0.08 -0.74 0.28 3.07 0.13 0.42 114.58 118.18 1aje h GLU 171 Ca 0.09 0.01 0.28 0.00 -0.50 0.00 0.00 59.36 59.24 1aje h GLU 171 Cb 0.53 0.02 -0.13 0.00 -0.84 0.00 0.00 28.75 28.32 1aje h GLU 171 CO 0.03 -0.05 0.30 0.00 -1.40 0.00 0.00 179.01 177.89 1aje n ALA 172 N -2.19 0.66 -0.02 3.43 0.00 0.71 0.28 120.51 123.37 1aje n ALA 172 Ca -0.01 0.77 -0.15 0.00 0.00 0.00 0.00 53.44 54.04 1aje n ALA 172 Cb 0.03 -0.71 -0.11 0.00 0.00 0.00 0.00 19.45 18.66 1aje n ALA 172 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1aje h ILE 173 N 0.00 1.51 0.00 0.00 5.03 -1.26 -1.24 117.51 121.55 1aje h ILE 173 Ca 0.58 -1.92 0.00 0.00 -0.12 0.00 0.00 64.86 63.40 1aje h ILE 173 Cb 1.47 2.67 0.00 0.00 -3.03 0.00 0.00 36.82 37.93 1aje h ILE 173 CO -0.60 0.53 0.00 0.25 -0.68 0.00 0.00 178.15 177.65 1aje h LEU 174 N -0.40 0.00 0.00 1.44 7.12 0.86 1.83 115.31 126.17 1aje h LEU 174 Ca -0.04 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.94 1aje h LEU 174 Cb 1.04 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.16 1aje h LEU 174 CO 0.06 0.00 -1.44 0.00 -0.13 0.00 0.00 178.44 176.93 1aje n ALA 175 N -1.84 2.51 0.09 1.25 0.00 0.68 -3.18 120.51 120.02 1aje n ALA 175 Ca -0.01 -0.41 0.01 0.00 0.00 0.00 0.00 53.44 53.04 1aje n ALA 175 Cb 0.10 -0.93 0.01 0.00 0.00 0.00 0.00 19.45 18.63 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 -2.25 2.45 0.00 0.00 0.00 0.87 -3.83 120.51 117.75 1aje n ALA 176 Ca -0.04 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.83 1aje n ALA 176 Cb 0.61 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.98 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 0.09 0.00 0.00 0.00 -0.00 0.59 -4.80 117.00 112.88 1aje n LEU 177 Ca 0.02 -0.33 0.00 0.00 -0.00 0.00 0.00 56.01 55.69 1aje n LEU 177 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.50 1aje n LEU 177 CO 0.02 0.00 0.00 1.21 -0.00 0.00 0.00 177.39 178.62 1aje n GLU 178 N -0.72 0.00 -1.53 1.47 2.13 -1.19 -4.84 120.64 115.96 1aje n GLU 178 Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 1aje n GLU 178 Cb 0.00 0.00 0.10 0.00 0.27 0.00 0.00 31.44 31.81 1aje n GLU 178 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1aje s PRO 179 N 0.00 1.95 0.77 5.31 0.04 -1.26 -5.01 135.00 136.79 1aje s PRO 179 Ca 0.00 0.62 -0.11 0.00 0.04 0.00 0.00 61.00 61.55 1aje s PRO 179 Cb 0.00 -1.90 0.06 0.00 0.04 0.00 0.00 34.50 32.69 1aje s PRO 179 CO 0.00 -1.71 1.10 -1.25 0.04 0.00 0.00 177.00 175.18 1aje s PRO 180 N -5.15 2.21 -0.21 0.56 0.04 -1.26 -4.98 135.00 126.20 1aje s PRO 180 Ca 0.61 1.25 0.15 0.00 0.04 0.00 0.00 61.00 63.05 1aje s PRO 180 Cb -0.15 -1.89 0.53 0.00 0.04 0.00 0.00 34.50 33.04 1aje s PRO 180 CO 0.54 -1.69 1.44 0.39 0.04 0.00 0.00 177.00 177.72 1aje n GLU 181 N -3.42 2.64 -1.46 4.56 1.02 -1.26 -4.81 120.64 117.92 1aje n GLU 181 Ca 0.10 -2.92 -0.40 0.00 -0.02 0.00 0.00 57.16 53.91 1aje n GLU 181 Cb 0.53 -1.85 -0.02 0.00 -0.02 0.00 0.00 31.44 30.08 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 -0.68 3.36 -1.99 3.49 -0.04 -1.26 -4.93 135.00 132.95 1aje n PRO 182 Ca 0.25 -2.34 -0.31 0.00 -0.04 0.00 0.00 63.50 61.06 1aje n PRO 182 Cb 0.95 -2.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 1aje n PRO 182 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1aje s LYS 183 N 2.58 3.65 -0.19 0.54 1.02 -1.26 -5.04 119.74 121.04 1aje s LYS 183 Ca 0.61 0.82 -0.14 0.00 0.02 0.00 0.00 55.97 57.28 1aje s LYS 183 Cb 0.16 -2.09 -0.04 0.00 -0.52 0.00 0.00 37.83 35.34 1aje s LYS 183 CO -0.07 -0.53 0.30 0.21 -0.92 0.00 0.00 175.35 174.34 1aje s LYS 184 N -4.89 4.21 0.00 1.68 2.20 -1.26 -5.08 119.74 116.60 1aje s LYS 184 Ca 0.56 0.06 0.00 0.00 -0.36 0.00 0.00 55.97 56.23 1aje s LYS 184 Cb -0.11 -3.47 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1aje s LYS 184 CO 0.48 0.13 0.00 0.43 -0.36 0.00 0.00 175.35 176.04 1aje n SER 185 N 3.94 0.00 -2.42 1.43 7.64 -1.26 -4.87 113.62 118.07 1aje n SER 185 Ca -0.11 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.74 1aje n SER 185 Cb 0.52 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.73 1aje n SER 185 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1aje n ARG 186 N 0.00 -0.93 0.00 1.43 5.12 -1.26 -5.34 116.66 115.68 1aje n ARG 186 Ca 0.00 0.86 0.00 0.00 -1.93 0.00 0.00 57.85 56.78 1aje n ARG 186 Cb 0.00 -3.92 0.00 0.00 -1.16 0.00 0.00 32.46 27.38 1aje n ARG 186 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59