#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 4.67 -0.60 1.61 0.15 -1.26 -5.06 113.70 113.22 1aje s SER -6 Ca 0.00 -0.31 -0.28 0.00 0.70 0.00 0.00 55.95 56.06 1aje s SER -6 Cb 0.00 -0.99 0.02 0.00 -1.71 0.00 0.00 66.02 63.34 1aje s SER -6 CO 0.00 0.17 1.39 -1.59 1.20 0.00 0.00 173.24 174.41 1aje s LYS -5 N -2.33 3.26 0.47 5.44 -2.85 -1.26 -4.99 119.74 117.48 1aje s LYS -5 Ca 0.24 0.32 -0.13 0.00 -1.00 0.00 0.00 55.97 55.40 1aje s LYS -5 Cb -0.11 -4.14 -0.07 0.00 -2.06 0.00 0.00 37.83 31.46 1aje s LYS -5 CO 0.16 -2.00 0.88 0.42 0.10 0.00 0.00 175.35 174.91 1aje s ILE -4 N 6.06 4.69 1.17 3.79 1.09 -1.26 -5.03 121.20 131.72 1aje s ILE -4 Ca 0.49 0.85 -0.17 0.00 -1.10 0.00 0.00 60.65 60.72 1aje s ILE -4 Cb -0.10 -3.75 0.24 0.00 -1.06 0.00 0.00 42.46 37.79 1aje s ILE -4 CO 0.23 -0.66 0.50 -0.38 -0.10 0.00 0.00 174.94 174.52 1aje n ILE -3 N -1.60 0.00 -3.79 2.92 -0.00 -1.26 -5.04 119.36 110.59 1aje n ILE -3 Ca 0.04 -0.08 -0.02 0.00 -0.00 0.00 0.00 62.75 62.69 1aje n ILE -3 Cb 0.54 -0.68 0.00 0.00 -0.00 0.00 0.00 39.64 39.50 1aje n ILE -3 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 1aje s SER -2 N -2.31 -0.08 -0.78 4.38 0.15 -1.26 -4.98 113.70 108.82 1aje s SER -2 Ca 0.49 -0.45 -0.25 0.00 0.70 0.00 0.00 55.95 56.44 1aje s SER -2 Cb -0.10 0.42 -0.04 0.00 -1.71 0.00 0.00 66.02 64.60 1aje s SER -2 CO 0.46 -0.80 1.91 0.00 1.20 0.00 0.00 173.24 176.01 1aje s ALA -1 N -2.67 1.88 -0.03 5.45 0.00 -1.25 -4.33 121.76 120.81 1aje s ALA -1 Ca 0.17 -1.15 0.04 0.00 0.00 0.00 0.00 51.96 51.02 1aje s ALA -1 Cb -0.01 -4.45 0.06 0.00 0.00 0.00 0.00 23.12 18.73 1aje s ALA -1 CO 0.02 -4.43 0.93 -1.33 0.00 0.00 0.00 175.76 170.95 1aje n MET 1 N 9.00 0.55 -0.08 0.00 2.00 -1.25 -4.89 117.12 122.46 1aje n MET 1 Ca 0.32 -1.29 -0.15 0.00 0.00 0.00 0.00 57.70 56.58 1aje n MET 1 Cb 0.49 -0.76 -0.06 0.00 0.00 0.00 0.00 33.22 32.89 1aje n MET 1 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1aje n GLN 2 N -0.36 0.33 -2.17 0.03 1.13 -1.26 -5.11 117.38 109.98 1aje n GLN 2 Ca 0.03 0.13 0.00 0.00 -1.94 0.00 0.00 57.00 55.22 1aje n GLN 2 Cb 0.61 -1.10 0.00 0.00 0.11 0.00 0.00 30.24 29.86 1aje n GLN 2 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1aje n THR 3 N -3.51-10.04 -4.12 5.09 -2.24 -1.26 -4.93 114.28 93.27 1aje n THR 3 Ca -0.29 2.43 -0.31 0.00 -2.27 0.00 0.00 64.05 63.61 1aje n THR 3 Cb 0.73 -4.69 -0.16 0.00 -2.10 0.00 0.00 70.33 64.11 1aje n THR 3 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1aje s ILE 4 N -0.42 1.76 -0.27 2.28 1.09 0.57 -4.88 121.20 121.32 1aje s ILE 4 Ca 0.00 -0.76 -0.13 0.00 -1.10 0.00 0.00 60.65 58.66 1aje s ILE 4 Cb 0.00 -1.62 -0.04 0.00 -1.06 0.00 0.00 42.46 39.73 1aje s ILE 4 CO 0.00 0.49 0.28 -0.75 -0.10 0.00 0.00 174.94 174.87 1aje s LYS 5 N 1.35 3.98 -0.07 2.79 2.47 -1.26 0.16 119.74 129.16 1aje s LYS 5 Ca 0.04 -0.13 0.04 0.00 -1.56 0.00 0.00 55.97 54.35 1aje s LYS 5 Cb -0.13 -3.66 -0.00 0.00 -1.46 0.00 0.00 37.83 32.58 1aje s LYS 5 CO -0.10 -0.23 -0.19 0.00 0.16 0.00 0.00 175.35 174.98 1aje s VAL 7 N 0.22 3.99 0.18 0.00 0.11 -0.96 -2.40 120.40 121.55 1aje s VAL 7 Ca -0.10 -0.33 -0.04 0.00 -2.93 0.00 0.00 61.98 58.57 1aje s VAL 7 Cb -0.15 -2.73 -0.05 0.00 -1.53 0.00 0.00 36.38 31.92 1aje s VAL 7 CO 0.05 0.52 0.41 -0.69 -3.33 0.00 0.00 175.10 172.06 1aje s VAL 8 N 0.07 5.14 0.11 2.04 1.01 -1.08 -0.97 120.40 126.72 1aje s VAL 8 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.01 1aje s VAL 8 Cb -0.13 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1aje s VAL 8 CO 0.02 -0.06 -0.09 0.68 0.00 0.00 0.00 175.10 175.66 1aje s VAL 9 N -1.77 0.92 0.00 2.92 -7.23 -0.83 -4.72 120.40 109.70 1aje s VAL 9 Ca 0.41 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.74 1aje s VAL 9 Cb -0.12 -1.59 0.00 0.00 0.56 0.00 0.00 36.38 35.23 1aje s VAL 9 CO 0.26 -0.71 0.00 0.61 -0.31 0.00 0.00 175.10 174.95 1aje n GLY 10 N 0.16 0.55 0.13 2.32 0.00 -1.26 -3.09 105.19 103.99 1aje n GLY 10 Ca -0.13 -1.73 0.06 0.00 0.00 0.00 0.00 46.02 44.22 1aje n GLY 10 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1aje h ASP 11 N 0.00 0.00 -3.73 1.61 2.03 -1.99 -3.48 116.42 110.86 1aje h ASP 11 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1aje h ASP 11 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1aje h ASP 11 CO 0.00 0.28 -0.06 0.61 -1.03 0.00 0.00 179.24 179.04 1aje n GLY 12 N 1.25 -3.53 0.11 7.15 0.00 -1.26 -4.30 105.19 104.60 1aje n GLY 12 Ca -0.02 -0.88 -0.03 0.00 0.00 0.00 0.00 46.02 45.09 1aje n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aje n ALA 13 N -0.27 -0.15 -1.83 4.61 0.00 -1.26 -3.56 120.51 118.04 1aje n ALA 13 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1aje n ALA 13 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.40 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 -4.34 0.00 0.00 0.00 0.31 -1.26 -5.08 118.33 107.95 1aje n VAL 14 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1aje n VAL 14 Cb 0.07 0.25 0.00 0.00 -0.91 0.00 0.00 33.84 33.25 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 0.00 -0.26 0.02 2.92 0.00 -1.23 -4.99 105.19 101.64 1aje n GLY 15 Ca 0.00 0.74 -0.02 0.00 0.00 0.00 0.00 46.02 46.74 1aje n GLY 15 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1aje n LYS 16 N 0.00 1.94 -0.07 1.61 3.00 -1.26 -2.20 118.16 121.17 1aje n LYS 16 Ca 0.00 0.01 -0.08 0.00 -0.00 0.00 0.00 58.31 58.24 1aje n LYS 16 Cb 0.00 -1.09 -0.06 0.00 0.00 0.00 0.00 35.03 33.89 1aje n LYS 16 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1aje h THR 17 N 0.00 0.00 -1.60 3.15 2.02 -1.96 0.20 112.91 114.72 1aje h THR 17 Ca -0.10 0.00 0.50 0.00 0.77 0.00 0.00 66.41 67.58 1aje h THR 17 Cb 1.18 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.50 1aje h THR 17 CO -0.00 0.00 1.11 0.00 0.37 0.00 0.00 175.52 176.99 1aje h LEU 19 N 0.00 -0.59 -1.18 0.00 7.12 -0.90 0.23 115.31 119.98 1aje h LEU 19 Ca 0.85 0.02 0.28 0.00 0.13 0.00 0.00 57.88 59.17 1aje h LEU 19 Cb 3.14 0.15 -0.12 0.00 -0.53 0.00 0.00 40.66 43.31 1aje h LEU 19 CO -0.20 -0.42 0.64 0.25 -0.13 0.00 0.00 178.44 178.59 1aje h LEU 20 N -0.70 0.52 0.71 2.25 7.12 0.25 0.69 115.31 126.14 1aje h LEU 20 Ca -0.07 0.12 -0.03 0.00 0.13 0.00 0.00 57.88 58.03 1aje h LEU 20 Cb 0.53 0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.71 1aje h LEU 20 CO 0.12 0.03 -0.47 0.40 -0.13 0.00 0.00 178.44 178.39 1aje h ILE 21 N 0.42 0.05 -0.17 4.05 1.08 0.95 -2.20 117.51 121.70 1aje h ILE 21 Ca 0.66 0.00 -0.08 0.00 -0.39 0.00 0.00 64.86 65.05 1aje h ILE 21 Cb 1.53 0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 35.33 1aje h ILE 21 CO -0.42 0.00 -0.23 0.28 -0.69 0.00 0.00 178.15 177.09 1aje h SER 22 N -1.12 0.30 -0.75 1.72 0.02 0.11 2.91 113.55 116.74 1aje h SER 22 Ca -0.09 -0.09 0.22 0.00 -0.84 0.00 0.00 61.79 60.99 1aje h SER 22 Cb 0.91 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.34 1aje h SER 22 CO 0.07 0.54 0.59 0.22 -1.14 0.00 0.00 176.83 177.10 1aje h TYR 23 N 0.28 0.00 0.00 3.45 3.20 0.84 3.20 116.97 127.93 1aje h TYR 23 Ca 0.05 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1aje h TYR 23 Cb 0.56 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.83 1aje h TYR 23 CO 0.01 0.00 -1.09 0.25 -1.64 0.00 0.00 178.16 175.70 1aje n THR 24 N -4.13 0.09 0.88 1.81 -2.24 -0.54 -4.65 114.28 105.49 1aje n THR 24 Ca 0.15 -0.04 0.10 0.00 -2.27 0.00 0.00 64.05 61.99 1aje n THR 24 Cb 0.86 -0.73 -0.02 0.00 -2.10 0.00 0.00 70.33 68.33 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 -2.33 0.00 -2.07 4.28 -2.24 0.96 -4.91 114.28 107.98 1aje n THR 25 Ca -0.02 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1aje n THR 25 Cb 0.53 1.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.95 1aje n THR 25 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1aje n ASN 26 N -0.32 -0.73 -3.21 3.42 2.85 1.06 -4.77 115.26 113.57 1aje n ASN 26 Ca 0.07 0.36 -0.01 0.00 -0.11 0.00 0.00 54.58 54.90 1aje n ASN 26 Cb 0.39 -0.84 -0.02 0.00 1.24 0.00 0.00 39.78 40.55 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1aje s LYS 27 N -4.10 0.53 0.01 1.20 2.20 -1.26 -4.83 119.74 113.48 1aje s LYS 27 Ca 0.00 0.34 -0.08 0.00 -0.36 0.00 0.00 55.97 55.88 1aje s LYS 27 Cb 0.00 0.04 -0.05 0.00 -1.51 0.00 0.00 37.83 36.31 1aje s LYS 27 CO 0.00 -1.06 0.29 -0.59 -0.36 0.00 0.00 175.35 173.63 1aje s PHE 28 N 2.66 3.59 -0.48 4.03 -0.71 -1.26 -4.71 117.98 121.11 1aje s PHE 28 Ca 0.10 0.63 -0.03 0.00 -1.04 0.00 0.00 56.93 56.59 1aje s PHE 28 Cb -0.11 -2.03 0.14 0.00 -1.21 0.00 0.00 43.02 39.82 1aje s PHE 28 CO -0.26 0.61 2.52 -0.35 -1.34 0.00 0.00 175.22 176.40 1aje n PRO 29 N 1.21 2.34 0.00 1.99 -0.04 -1.26 -4.92 135.00 134.32 1aje n PRO 29 Ca -0.12 -2.37 0.00 0.00 -0.04 0.00 0.00 63.50 60.97 1aje n PRO 29 Cb 0.53 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.92 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 -2.36 3.54 2.88 -1.26 -3.39 113.62 113.55 1aje n SER 30 Ca 0.47 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.70 1aje n SER 30 Cb 0.53 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.03 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 3.12 -1.49 -1.46 1.02 -1.26 -5.00 120.64 115.56 1aje n GLU 31 Ca 0.00 -3.81 0.00 0.00 -0.02 0.00 0.00 57.16 53.33 1aje n GLU 31 Cb 0.00 -2.28 0.00 0.00 -0.02 0.00 0.00 31.44 29.14 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 -0.71 0.00 -3.40 -0.32 4.19 -1.22 -4.95 117.16 110.75 1aje n TYR 32 Ca 0.51 0.00 -0.20 0.00 3.31 0.00 0.00 57.90 61.52 1aje n TYR 32 Cb 0.68 -0.50 -0.00 0.00 0.49 0.00 0.00 39.34 40.01 1aje n TYR 32 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 1aje s VAL 33 N -0.71 4.21 -0.97 2.97 -7.23 -1.26 -4.96 120.40 112.46 1aje s VAL 33 Ca 0.00 -0.86 -0.24 0.00 -1.81 0.00 0.00 61.98 59.07 1aje s VAL 33 Cb 0.00 -3.49 -0.04 0.00 0.56 0.00 0.00 36.38 33.41 1aje s VAL 33 CO 0.00 -0.23 1.89 -2.16 -0.31 0.00 0.00 175.10 174.29 1aje s PRO 34 N -4.25 2.69 0.31 4.82 0.04 -1.26 -4.94 135.00 132.41 1aje s PRO 34 Ca 0.44 -0.55 0.04 0.00 0.04 0.00 0.00 61.00 60.97 1aje s PRO 34 Cb -0.10 -5.13 0.05 0.00 0.04 0.00 0.00 34.50 29.36 1aje s PRO 34 CO 0.33 -3.32 0.43 0.25 0.04 0.00 0.00 177.00 174.73 1aje n THR 35 N 7.73 0.00 -2.76 1.26 -2.24 -1.26 -5.11 114.28 111.90 1aje n THR 35 Ca 0.40 -0.95 -0.03 0.00 -2.27 0.00 0.00 64.05 61.20 1aje n THR 35 Cb 0.47 -0.82 0.02 0.00 -2.10 0.00 0.00 70.33 67.90 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 -0.94 -0.76 -0.06 2.28 0.11 -1.26 -5.14 120.40 114.63 1aje s VAL 36 Ca 0.31 -0.70 0.04 0.00 -2.93 0.00 0.00 61.98 58.70 1aje s VAL 36 Cb -0.02 0.00 0.00 0.00 -1.53 0.00 0.00 36.38 34.83 1aje s VAL 36 CO 0.20 0.00 -0.17 -0.36 -3.33 0.00 0.00 175.10 171.44 1aje s PHE 37 N 0.98 1.74 0.00 1.54 0.08 -1.26 -5.14 117.98 115.92 1aje s PHE 37 Ca 0.27 -0.57 0.00 0.00 0.12 0.00 0.00 56.93 56.75 1aje s PHE 37 Cb 0.03 -1.20 0.00 0.00 -0.57 0.00 0.00 43.02 41.29 1aje s PHE 37 CO -0.07 -0.22 0.00 -3.47 -0.10 0.00 0.00 175.22 171.36 1aje n ASP 38 N 3.36 0.00 0.00 1.36 -0.08 -1.26 -4.46 116.55 115.47 1aje n ASP 38 Ca -0.19 -0.40 0.00 0.00 -1.51 0.00 0.00 54.79 52.69 1aje n ASP 38 Cb 0.53 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.99 1aje n ASP 38 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1aje n ASN 39 N -1.20 0.00 0.00 1.67 4.13 -1.26 -4.58 115.26 114.01 1aje n ASN 39 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1aje n ASN 39 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1aje n ASN 39 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1aje n TYR 40 N 0.00 0.00 -3.72 3.10 4.01 -1.26 -4.67 117.16 114.61 1aje n TYR 40 Ca 0.00 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.36 1aje n TYR 40 Cb 0.00 -1.40 -0.11 0.00 -0.31 0.00 0.00 39.34 37.52 1aje n TYR 40 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1aje s ALA 41 N -1.32 3.13 0.66 -0.72 0.00 -1.25 -2.53 121.76 119.72 1aje s ALA 41 Ca 0.00 -2.07 -0.03 0.00 0.00 0.00 0.00 51.96 49.87 1aje s ALA 41 Cb 0.00 -2.39 0.07 0.00 0.00 0.00 0.00 23.12 20.80 1aje s ALA 41 CO 0.00 -1.54 0.93 0.14 0.00 0.00 0.00 175.76 175.29 1aje s VAL 42 N 1.33 2.38 -0.22 0.00 -7.23 -0.94 -4.50 120.40 111.22 1aje s VAL 42 Ca 0.02 -0.49 -0.04 0.00 -1.81 0.00 0.00 61.98 59.65 1aje s VAL 42 Cb -0.22 -2.88 -0.01 0.00 0.56 0.00 0.00 36.38 33.83 1aje s VAL 42 CO 0.00 0.00 -0.03 -0.89 -0.31 0.00 0.00 175.10 173.88 1aje s THR 43 N -3.07 3.54 0.56 5.32 2.01 -1.26 0.42 115.64 123.17 1aje s THR 43 Ca 0.61 -0.44 0.05 0.00 0.31 0.00 0.00 61.69 62.22 1aje s THR 43 Cb -0.09 -2.62 0.04 0.00 0.01 0.00 0.00 72.50 69.85 1aje s THR 43 CO 0.43 0.42 0.37 0.68 -0.69 0.00 0.00 174.62 175.82 1aje s VAL 44 N 1.42 1.46 -0.15 3.82 -7.23 -1.09 -4.88 120.40 113.75 1aje s VAL 44 Ca 0.05 -1.55 -0.01 0.00 -1.81 0.00 0.00 61.98 58.66 1aje s VAL 44 Cb -0.14 -2.01 0.04 0.00 0.56 0.00 0.00 36.38 34.82 1aje s VAL 44 CO -0.02 0.00 -0.05 -0.04 -0.31 0.00 0.00 175.10 174.68 1aje s MET 45 N -4.27 1.36 -0.12 4.82 -1.94 -1.26 -1.81 119.30 116.08 1aje s MET 45 Ca 0.28 -0.40 -0.29 0.00 -1.71 0.00 0.00 55.69 53.58 1aje s MET 45 Cb -0.02 -1.83 -0.25 0.00 2.01 0.00 0.00 34.83 34.74 1aje s MET 45 CO 0.18 -0.39 0.84 0.82 -0.01 0.00 0.00 175.02 176.46 1aje h ILE 46 N 6.33 1.74 -0.02 2.53 5.03 -1.87 -3.43 117.51 127.82 1aje h ILE 46 Ca -0.25 -2.18 -0.15 0.00 -0.12 0.00 0.00 64.86 62.15 1aje h ILE 46 Cb 1.12 3.23 -0.21 0.00 -3.03 0.00 0.00 36.82 37.93 1aje h ILE 46 CO 0.39 0.57 -0.51 0.61 -0.68 0.00 0.00 178.15 178.52 1aje n GLY 47 N 1.42 0.90 0.00 5.37 0.00 -1.26 -4.91 105.19 106.70 1aje n GLY 47 Ca -0.10 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.12 1.25 3.28 -0.02 0.00 -1.26 -5.10 105.19 103.22 1aje n GLY 48 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.30 2.44 -0.18 1.61 8.01 -1.26 -4.81 118.70 124.20 1aje s GLU 49 Ca 0.00 -0.91 -0.17 0.00 0.01 0.00 0.00 54.97 53.90 1aje s GLU 49 Cb 0.00 -2.13 -0.04 0.00 -4.31 0.00 0.00 34.13 27.65 1aje s GLU 49 CO 0.00 0.43 0.45 -1.25 0.01 0.00 0.00 175.26 174.90 1aje s PRO 50 N -0.28 4.21 -0.20 0.39 0.04 -1.25 -2.50 135.00 135.40 1aje s PRO 50 Ca 0.00 0.32 -0.01 0.00 0.04 0.00 0.00 61.00 61.35 1aje s PRO 50 Cb -0.13 -3.52 0.06 0.00 0.04 0.00 0.00 34.50 30.95 1aje s PRO 50 CO 0.02 -0.03 -0.01 0.71 0.04 0.00 0.00 177.00 177.73 1aje s TYR 51 N 1.27 1.64 0.63 0.56 2.02 -0.75 -3.90 117.35 118.82 1aje s TYR 51 Ca 0.22 -1.21 -0.17 0.00 -0.37 0.00 0.00 57.07 55.55 1aje s TYR 51 Cb -0.15 -1.27 -0.02 0.00 -0.40 0.00 0.00 41.96 40.12 1aje s TYR 51 CO 0.09 -0.66 1.13 0.99 -1.57 0.00 0.00 175.55 175.52 1aje s THR 52 N 1.65 3.11 -0.18 -0.71 2.01 -1.25 -2.67 115.64 117.60 1aje s THR 52 Ca -0.02 0.58 -0.03 0.00 0.31 0.00 0.00 61.69 62.52 1aje s THR 52 Cb -0.17 -3.13 0.06 0.00 0.01 0.00 0.00 72.50 69.26 1aje s THR 52 CO -0.07 -0.26 0.04 -1.48 -0.69 0.00 0.00 174.62 172.16 1aje s LEU 53 N -4.52 0.98 -0.45 4.42 -0.00 0.17 0.21 118.68 119.50 1aje s LEU 53 Ca 0.70 -0.74 -0.17 0.00 -0.00 0.00 0.00 54.13 53.92 1aje s LEU 53 Cb -0.23 -0.52 0.04 0.00 -0.00 0.00 0.00 46.19 45.49 1aje s LEU 53 CO 0.37 -0.31 0.45 -0.83 -0.00 0.00 0.00 176.35 176.03 1aje s GLY 54 N 1.92 1.92 0.24 -3.48 0.00 0.41 -2.22 107.32 106.12 1aje s GLY 54 Ca -0.00 -1.74 0.10 0.00 0.00 0.00 0.00 44.72 43.08 1aje s GLY 54 CO -0.08 1.17 -0.09 0.48 0.00 0.00 0.00 173.10 174.58 1aje s LEU 55 N 2.06 2.95 0.10 0.66 -0.00 -1.05 -0.69 118.68 122.70 1aje s LEU 55 Ca 0.10 -0.72 -0.21 0.00 -0.00 0.00 0.00 54.13 53.29 1aje s LEU 55 Cb -0.20 -1.53 0.05 0.00 -0.00 0.00 0.00 46.19 44.51 1aje s LEU 55 CO 0.11 0.05 0.51 0.12 -0.00 0.00 0.00 176.35 177.14 1aje s PHE 56 N -2.15 -0.40 -0.42 3.48 5.36 -1.01 -4.85 117.98 117.99 1aje s PHE 56 Ca 0.29 0.29 0.25 0.00 -0.96 0.00 0.00 56.93 56.79 1aje s PHE 56 Cb -0.07 0.38 1.03 0.00 -0.34 0.00 0.00 43.02 44.02 1aje s PHE 56 CO 0.17 -0.72 1.74 0.38 -1.46 0.00 0.00 175.22 175.33 1aje h ASP 57 N 2.46 0.00 -0.97 6.13 2.03 -1.91 -2.85 116.42 121.30 1aje h ASP 57 Ca -0.32 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.98 1aje h ASP 57 Cb 1.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 1aje h ASP 57 CO 0.42 0.00 0.00 1.07 -1.03 0.00 0.00 179.24 179.70 1aje n THR 58 N -2.32 0.00 -0.19 1.15 5.66 -1.26 -4.73 114.28 112.58 1aje n THR 58 Ca 0.02 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.89 1aje n THR 58 Cb 0.23 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 68.92 1aje n THR 58 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1aje h ALA 59 N 1.50 -0.72 0.00 1.79 0.00 -1.99 -3.48 119.26 116.37 1aje h ALA 59 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1aje h ALA 59 Cb 0.00 1.17 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1aje h ALA 59 CO 0.00 -1.03 0.00 0.41 0.00 0.00 0.00 179.25 178.63 1aje n GLY 60 N -1.35 -0.06 2.78 0.00 0.00 -1.26 -4.85 105.19 100.44 1aje n GLY 60 Ca -0.02 -1.71 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 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 -1.67 1.02 0.28 1.61 0.74 -1.26 -4.99 119.66 115.39 1aje s GLN 61 Ca 0.00 -1.49 0.11 0.00 0.05 0.00 0.00 55.36 54.04 1aje s GLN 61 Cb 0.00 -2.31 0.92 0.00 1.10 0.00 0.00 33.01 32.72 1aje s GLN 61 CO 0.00 -1.03 1.28 0.39 -0.55 0.00 0.00 175.29 175.38 1aje n GLU 62 N 4.37 -0.06 -2.03 1.67 1.02 -1.26 -4.66 120.64 119.69 1aje n GLU 62 Ca 0.02 1.16 -0.06 0.00 -0.02 0.00 0.00 57.16 58.26 1aje n GLU 62 Cb 0.40 -1.99 -0.01 0.00 -0.02 0.00 0.00 31.44 29.82 1aje n GLU 62 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1aje n ASP 63 N -4.96 -2.06 -2.89 1.62 -0.08 -1.26 -2.84 116.55 104.08 1aje n ASP 63 Ca 0.26 0.28 -0.04 0.00 -1.51 0.00 0.00 54.79 53.79 1aje n ASP 63 Cb 0.89 -1.94 0.00 0.00 2.34 0.00 0.00 41.12 42.41 1aje n ASP 63 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 1aje n TYR 64 N -2.39 -3.03 -1.73 -0.67 4.01 -1.26 -4.87 117.16 107.22 1aje n TYR 64 Ca -0.06 1.31 -0.39 0.00 -0.16 0.00 0.00 57.90 58.60 1aje n TYR 64 Cb 0.43 -3.28 0.03 0.00 -0.31 0.00 0.00 39.34 36.21 1aje n TYR 64 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1aje n ASP 65 N 0.58 2.57 0.05 7.72 9.92 -1.13 -4.92 116.55 131.34 1aje n ASP 65 Ca 0.02 1.01 0.01 0.00 -0.53 0.00 0.00 54.79 55.29 1aje n ASP 65 Cb 0.23 -1.55 -0.06 0.00 -0.64 0.00 0.00 41.12 39.10 1aje n ASP 65 CO 0.00 0.00 0.00 0.08 0.13 0.00 0.00 177.20 177.41 1aje h ARG 66 N 1.58 0.00 -6.38 -1.24 0.11 -1.93 -3.46 114.38 103.06 1aje h ARG 66 Ca -0.50 0.00 -0.65 0.00 0.10 0.00 0.00 59.98 58.93 1aje h ARG 66 Cb 1.30 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 32.26 1aje h ARG 66 CO 0.58 0.31 -0.67 -0.51 0.10 0.00 0.00 179.97 179.77 1aje s LEU 67 N -5.86 3.39 -0.47 0.08 1.43 -1.26 -5.08 118.68 110.92 1aje s LEU 67 Ca -0.02 -0.21 -0.17 0.00 -1.03 0.00 0.00 54.13 52.70 1aje s LEU 67 Cb 0.09 -2.14 0.05 0.00 0.03 0.00 0.00 46.19 44.22 1aje s LEU 67 CO 0.80 0.17 0.47 -0.13 0.23 0.00 0.00 176.35 177.90 1aje s ARG 68 N -2.31 3.05 0.55 1.70 1.81 -1.26 -5.05 118.95 117.43 1aje s ARG 68 Ca 0.25 -1.04 -0.18 0.00 -1.72 0.00 0.00 55.73 53.04 1aje s ARG 68 Cb -0.12 -4.07 -0.06 0.00 -0.45 0.00 0.00 34.95 30.25 1aje s ARG 68 CO 0.18 -1.03 1.05 -1.25 -0.68 0.00 0.00 175.30 173.57 1aje s PRO 69 N 2.08 3.53 0.34 3.54 0.04 -1.26 -4.94 135.00 138.33 1aje s PRO 69 Ca 0.10 1.28 0.04 0.00 0.04 0.00 0.00 61.00 62.45 1aje s PRO 69 Cb -0.21 -2.06 0.62 0.00 0.04 0.00 0.00 34.50 32.89 1aje s PRO 69 CO 0.10 -0.65 1.92 -0.07 0.04 0.00 0.00 177.00 178.34 1aje h LEU 70 N 0.94 0.57 -7.02 -3.56 3.38 -2.07 -3.40 115.31 104.15 1aje h LEU 70 Ca -0.48 -0.08 -0.27 0.00 0.09 0.00 0.00 57.88 57.15 1aje h LEU 70 Cb 1.22 -0.15 -0.34 0.00 0.09 0.00 0.00 40.66 41.48 1aje h LEU 70 CO 0.58 0.55 -0.58 -0.44 0.09 0.00 0.00 178.44 178.64 1aje s SER 71 N -6.66 0.82 -0.19 -0.43 0.01 -1.26 -5.11 113.70 100.88 1aje s SER 71 Ca -0.08 0.21 -0.35 0.00 1.31 0.00 0.00 55.95 57.04 1aje s SER 71 Cb 0.16 0.52 -0.12 0.00 0.21 0.00 0.00 66.02 66.79 1aje s SER 71 CO 0.76 -0.28 1.96 0.00 0.41 0.00 0.00 173.24 176.10 1aje n TYR 72 N 5.33 2.10 -1.23 2.43 4.19 -1.26 -4.94 117.16 123.78 1aje n TYR 72 Ca -0.05 0.13 -0.29 0.00 3.31 0.00 0.00 57.90 61.00 1aje n TYR 72 Cb 0.50 -2.61 0.16 0.00 0.49 0.00 0.00 39.34 37.88 1aje n TYR 72 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 1aje s PRO 73 N 4.68 0.65 -0.44 2.98 0.04 -1.26 -5.06 135.00 136.59 1aje s PRO 73 Ca 0.98 0.52 0.01 0.00 0.04 0.00 0.00 61.00 62.55 1aje s PRO 73 Cb -0.76 -1.76 0.20 0.00 0.04 0.00 0.00 34.50 32.22 1aje s PRO 73 CO 0.52 -2.58 0.90 0.94 0.04 0.00 0.00 177.00 176.82 1aje n GLN 74 N -4.07 0.35 -1.84 4.56 7.27 -1.26 -5.12 117.38 117.26 1aje n GLN 74 Ca 0.06 -1.47 0.00 0.00 0.07 0.00 0.00 57.00 55.66 1aje n GLN 74 Cb 0.57 -0.76 0.00 0.00 2.41 0.00 0.00 30.24 32.46 1aje n GLN 74 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1aje n THR 75 N 2.74 -4.64 -0.24 1.69 -2.24 -1.26 -4.96 114.28 105.38 1aje n THR 75 Ca 0.15 2.15 0.00 0.00 -2.27 0.00 0.00 64.05 64.08 1aje n THR 75 Cb 0.60 -2.78 0.00 0.00 -2.10 0.00 0.00 70.33 66.05 1aje n THR 75 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1aje n ASP 76 N 0.49 0.40 -3.80 3.42 9.92 0.81 -4.94 116.55 122.85 1aje n ASP 76 Ca 0.00 -0.75 -0.14 0.00 -0.53 0.00 0.00 54.79 53.37 1aje n ASP 76 Cb 0.00 0.23 -0.08 0.00 -0.64 0.00 0.00 41.12 40.63 1aje n ASP 76 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1aje s VAL 77 N -0.23 0.00 -0.12 2.53 0.11 -0.32 -4.59 120.40 117.78 1aje s VAL 77 Ca 0.00 -1.89 -0.01 0.00 -2.93 0.00 0.00 61.98 57.15 1aje s VAL 77 Cb 0.00 -2.49 0.03 0.00 -1.53 0.00 0.00 36.38 32.40 1aje s VAL 77 CO 0.00 0.00 -0.02 -0.36 -3.33 0.00 0.00 175.10 171.39 1aje s PHE 78 N -3.78 1.12 -0.71 1.54 0.08 -0.91 -2.26 117.98 113.06 1aje s PHE 78 Ca 0.37 -0.58 -0.17 0.00 0.12 0.00 0.00 56.93 56.67 1aje s PHE 78 Cb 0.04 -1.04 0.15 0.00 -0.57 0.00 0.00 43.02 41.60 1aje s PHE 78 CO 0.18 -0.47 0.74 -0.51 -0.10 0.00 0.00 175.22 175.06 1aje s LEU 79 N 1.83 5.98 -0.34 -0.37 2.01 -0.14 -1.03 118.68 126.62 1aje s LEU 79 Ca 0.03 -2.02 -0.25 0.00 0.01 0.00 0.00 54.13 51.91 1aje s LEU 79 Cb -0.14 -2.27 0.01 0.00 0.01 0.00 0.00 46.19 43.81 1aje s LEU 79 CO -0.07 -0.87 0.87 -0.69 1.01 0.00 0.00 176.35 176.60 1aje s VAL 80 N 1.61 4.68 -0.62 -1.59 1.01 -0.31 -1.96 120.40 123.23 1aje s VAL 80 Ca 0.15 1.22 -0.25 0.00 0.00 0.00 0.00 61.98 63.10 1aje s VAL 80 Cb -0.18 -4.25 0.05 0.00 0.00 0.00 0.00 36.38 31.99 1aje s VAL 80 CO -0.02 -0.40 1.04 0.00 0.00 0.00 0.00 175.10 175.73 1aje h PHE 82 N 9.53 0.00 -3.30 0.00 -5.15 0.13 -3.42 116.94 114.74 1aje h PHE 82 Ca -0.27 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.50 1aje h PHE 82 Cb 1.07 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.24 1aje h PHE 82 CO 0.98 0.00 -0.77 -1.13 -2.00 0.00 0.00 178.31 175.39 1aje n SER 83 N -2.70 -8.01 -0.38 -0.68 3.41 -0.25 -1.11 113.62 103.91 1aje n SER 83 Ca 0.02 1.09 0.07 0.00 -0.26 0.00 0.00 58.87 59.79 1aje n SER 83 Cb 0.52 -3.89 0.01 0.00 -0.26 0.00 0.00 64.21 60.59 1aje n SER 83 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1aje n VAL 84 N 0.24 0.00 1.14 -3.33 0.31 -1.26 -4.11 118.33 111.32 1aje n VAL 84 Ca 0.00 -0.39 0.02 0.00 -0.01 0.00 0.00 64.34 63.95 1aje n VAL 84 Cb 0.00 1.20 0.06 0.00 -0.91 0.00 0.00 33.84 34.19 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 0.07 0.31 -4.18 2.52 0.24 -1.26 -1.30 118.33 114.73 1aje n VAL 85 Ca 0.06 -0.20 -0.14 0.00 -2.04 0.00 0.00 64.34 62.02 1aje n VAL 85 Cb 0.31 -0.19 -0.11 0.00 -1.47 0.00 0.00 33.84 32.38 1aje n VAL 85 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1aje s SER 86 N -0.56 1.47 0.54 -1.34 1.04 -1.26 -4.76 113.70 108.83 1aje s SER 86 Ca 0.09 -0.81 0.33 0.00 0.48 0.00 0.00 55.95 56.04 1aje s SER 86 Cb 0.06 0.01 1.32 0.00 0.10 0.00 0.00 66.02 67.50 1aje s SER 86 CO 0.04 -0.26 1.97 1.55 0.98 0.00 0.00 173.24 177.52 1aje h PRO 87 N 3.58 0.00 0.00 4.02 0.13 -1.63 -3.07 132.00 135.02 1aje h PRO 87 Ca -0.37 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.75 1aje h PRO 87 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1aje h PRO 87 CO 0.53 0.00 -0.02 0.45 -0.23 0.00 0.00 178.00 178.73 1aje n SER 88 N -3.08 -0.07 -0.27 1.44 2.88 -1.26 -4.87 113.62 108.39 1aje n SER 88 Ca 0.01 -0.43 -0.06 0.00 -1.33 0.00 0.00 58.87 57.05 1aje n SER 88 Cb 0.31 0.02 0.06 0.00 -0.75 0.00 0.00 64.21 63.85 1aje n SER 88 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1aje h SER 89 N 0.00 1.10 0.00 -3.46 4.64 -1.83 -1.38 113.55 112.61 1aje h SER 89 Ca -0.04 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1aje h SER 89 Cb 0.45 -0.29 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1aje h SER 89 CO -0.02 1.01 0.36 2.22 -0.87 0.00 0.00 176.83 179.53 1aje n PHE 90 N -4.25 0.39 0.02 4.77 -1.74 -0.27 -1.25 117.46 115.14 1aje n PHE 90 Ca 0.06 0.20 -0.22 0.00 -0.56 0.00 0.00 57.45 56.94 1aje n PHE 90 Cb 0.22 -0.59 -0.14 0.00 1.52 0.00 0.00 39.48 40.50 1aje n PHE 90 CO 0.00 0.00 0.00 1.49 -0.56 0.00 0.00 176.76 177.69 1aje h GLU 91 N 0.00 0.27 0.00 3.97 4.57 -1.52 -3.21 114.58 118.66 1aje h GLU 91 Ca 0.00 -0.46 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 1aje h GLU 91 Cb 0.72 0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.48 1aje h GLU 91 CO 0.00 1.22 0.00 -2.95 -1.18 0.00 0.00 179.01 176.10 1aje h ASN 92 N -0.25 0.00 0.59 1.04 7.08 -1.28 1.25 115.58 124.01 1aje h ASN 92 Ca -0.30 0.00 -0.02 0.00 -3.08 0.00 0.00 56.30 52.90 1aje h ASN 92 Cb 1.80 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 38.04 1aje h ASN 92 CO 0.08 0.00 -0.09 0.58 -2.08 0.00 0.00 177.43 175.92 1aje h VAL 93 N 0.00 0.34 0.00 6.14 2.07 -1.52 -2.47 116.25 120.81 1aje h VAL 93 Ca 0.00 -0.57 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 1aje h VAL 93 Cb 0.04 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1aje h VAL 93 CO 0.00 0.09 -0.28 0.11 0.02 0.00 0.00 177.57 177.52 1aje h LYS 94 N 0.00 0.00 0.00 1.57 1.79 0.15 -2.14 116.57 117.94 1aje h LYS 94 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1aje h LYS 94 Cb 0.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 1aje h LYS 94 CO 0.01 0.46 0.00 -0.85 -1.08 0.00 0.00 179.45 177.99 1aje n GLU 95 N -4.65 0.09 0.00 3.15 0.28 -1.12 -2.85 120.64 115.53 1aje n GLU 95 Ca -0.09 0.51 0.00 0.00 -0.16 0.00 0.00 57.16 57.42 1aje n GLU 95 Cb 0.30 -1.74 0.00 0.00 1.43 0.00 0.00 31.44 31.43 1aje n GLU 95 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1aje n LYS 96 N -1.92 0.27 0.05 3.44 5.02 -0.94 -4.71 118.16 119.37 1aje n LYS 96 Ca 0.00 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.09 1aje n LYS 96 Cb 0.07 -0.75 -0.12 0.00 -0.02 0.00 0.00 35.03 34.21 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 0.87 -0.55 2.13 4.06 -1.50 -2.42 115.95 118.53 1aje h TRP 97 Ca 0.00 -0.51 -0.05 0.00 2.06 0.00 0.00 58.89 60.39 1aje h TRP 97 Cb 0.51 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.56 1aje h TRP 97 CO 0.00 1.35 0.14 0.28 -3.56 0.00 0.00 178.44 176.65 1aje h VAL 98 N 0.14 1.24 0.00 1.49 2.07 -1.37 0.66 116.25 120.49 1aje h VAL 98 Ca -0.14 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1aje h VAL 98 Cb 1.66 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1aje h VAL 98 CO 0.19 0.32 0.00 1.55 0.02 0.00 0.00 177.57 179.65 1aje h PRO 99 N 0.78 0.00 0.00 1.57 0.13 -1.71 0.54 132.00 133.32 1aje h PRO 99 Ca 0.17 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 65.08 1aje h PRO 99 Cb 0.33 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.43 1aje h PRO 99 CO 0.00 0.00 -1.60 0.39 -0.23 0.00 0.00 178.00 176.56 1aje n GLU 100 N -2.90 0.63 -0.07 0.86 -0.58 0.15 -3.72 120.64 115.01 1aje n GLU 100 Ca -0.01 0.22 -0.09 0.00 -0.42 0.00 0.00 57.16 56.86 1aje n GLU 100 Cb 0.18 -1.77 -0.06 0.00 -0.57 0.00 0.00 31.44 29.21 1aje n GLU 100 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1aje n ILE 101 N -2.91 0.78 -0.11 -3.67 -5.35 0.21 -4.38 119.36 103.93 1aje n ILE 101 Ca -0.14 -0.30 -0.21 0.00 -0.27 0.00 0.00 62.75 61.83 1aje n ILE 101 Cb 0.93 -0.98 -0.09 0.00 -1.74 0.00 0.00 39.64 37.75 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 -2.90 1.52 0.13 7.28 -2.24 0.18 0.14 114.28 118.39 1aje n THR 102 Ca -0.24 -0.10 0.19 0.00 -2.27 0.00 0.00 64.05 61.63 1aje n THR 102 Cb 0.76 -2.06 0.77 0.00 -2.10 0.00 0.00 70.33 67.70 1aje n THR 102 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1aje h HIS 103 N -1.00 0.00 0.00 4.78 2.76 -1.51 -0.58 115.15 119.60 1aje h HIS 103 Ca -0.39 0.00 -0.34 0.00 -2.20 0.00 0.00 60.37 57.44 1aje h HIS 103 Cb 1.28 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.19 1aje h HIS 103 CO -0.04 0.00 -2.10 0.72 -1.30 0.00 0.00 177.93 175.21 1aje n HIS 104 N -3.81 0.00 -3.50 5.26 8.25 -1.24 -4.79 115.22 115.39 1aje n HIS 104 Ca 0.05 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.24 1aje n HIS 104 Cb 0.50 -0.81 -0.09 0.00 1.12 0.00 0.00 29.99 30.71 1aje n HIS 104 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1aje n PRO 106 N 1.27 4.16 0.07 0.00 -0.04 -0.25 -4.15 135.00 136.06 1aje n PRO 106 Ca 0.27 -3.13 -0.10 0.00 -0.04 0.00 0.00 63.50 60.49 1aje n PRO 106 Cb 0.41 -2.75 -0.07 0.00 -0.04 0.00 0.00 33.50 31.06 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 4.93 -0.25 0.00 0.54 6.56 -1.88 -3.49 116.57 122.99 1aje h LYS 107 Ca 0.69 0.02 0.00 0.00 -1.06 0.00 0.00 60.65 60.30 1aje h LYS 107 Cb 0.36 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.08 1aje h LYS 107 CO 1.59 0.14 0.00 2.41 -2.06 0.00 0.00 179.45 181.53 1aje n THR 108 N -4.95 0.00 -1.93 -0.16 -1.04 -1.26 -5.11 114.28 99.83 1aje n THR 108 Ca -0.07 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.51 1aje n THR 108 Cb 0.25 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.73 1aje n THR 108 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1aje s PRO 109 N 0.00 3.91 -0.21 -2.82 0.04 -1.23 -4.72 135.00 129.96 1aje s PRO 109 Ca 0.00 2.06 -0.03 0.00 0.04 0.00 0.00 61.00 63.07 1aje s PRO 109 Cb 0.00 -4.08 0.06 0.00 0.04 0.00 0.00 34.50 30.52 1aje s PRO 109 CO 0.00 -1.18 0.05 0.12 0.04 0.00 0.00 177.00 176.03 1aje s PHE 110 N 5.05 1.00 -0.26 0.56 2.19 -1.26 -2.15 117.98 123.11 1aje s PHE 110 Ca 0.79 -0.89 -0.01 0.00 0.33 0.00 0.00 56.93 57.15 1aje s PHE 110 Cb -0.32 -1.05 0.04 0.00 -1.31 0.00 0.00 43.02 40.38 1aje s PHE 110 CO 0.32 -0.63 -0.06 -0.51 1.83 0.00 0.00 175.22 176.17 1aje s LEU 111 N 1.87 3.39 -0.66 6.12 1.43 -0.20 0.36 118.68 130.99 1aje s LEU 111 Ca 0.00 -1.08 -0.23 0.00 -1.03 0.00 0.00 54.13 51.79 1aje s LEU 111 Cb -0.17 -1.65 0.06 0.00 0.03 0.00 0.00 46.19 44.47 1aje s LEU 111 CO -0.11 -0.17 0.99 -0.22 0.23 0.00 0.00 176.35 177.08 1aje s LEU 112 N 1.26 4.25 0.03 1.79 2.96 0.13 -1.16 118.68 127.94 1aje s LEU 112 Ca -0.03 -0.91 0.06 0.00 -0.22 0.00 0.00 54.13 53.03 1aje s LEU 112 Cb -0.18 -2.45 -0.03 0.00 0.50 0.00 0.00 46.19 44.02 1aje s LEU 112 CO -0.04 -1.47 -0.13 -0.69 -1.32 0.00 0.00 176.35 172.70 1aje s VAL 113 N 4.22 3.19 0.00 1.68 1.01 -0.49 -0.92 120.40 129.09 1aje s VAL 113 Ca 0.24 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.18 1aje s VAL 113 Cb -0.16 -2.38 0.00 0.00 0.00 0.00 0.00 36.38 33.84 1aje s VAL 113 CO 0.11 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.15 1aje n GLY 114 N 1.46 -3.07 0.00 4.51 0.00 0.14 0.15 105.19 108.37 1aje n GLY 114 Ca -0.15 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1aje n GLY 114 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1aje n THR 115 N 0.00 0.00 -2.00 2.61 5.66 -1.26 -1.08 114.28 118.20 1aje n THR 115 Ca 0.00 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 1aje n THR 115 Cb 0.00 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 68.78 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 3.53 0.00 1.09 3.00 -0.94 -2.62 117.38 121.44 1aje n GLN 116 Ca 0.00 -3.10 0.00 0.00 -0.01 0.00 0.00 57.00 53.89 1aje n GLN 116 Cb 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 30.24 27.26 1aje n GLN 116 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1aje n ILE 117 N 3.67 0.00 0.95 5.09 5.41 -1.26 -1.40 119.36 131.82 1aje n ILE 117 Ca 0.50 0.00 0.12 0.00 1.00 0.00 0.00 62.75 64.38 1aje n ILE 117 Cb 0.34 -0.63 0.22 0.00 -0.71 0.00 0.00 39.64 38.86 1aje n ILE 117 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1aje n ASP 118 N -0.58 2.74 0.00 4.38 2.03 -1.26 -4.40 116.55 119.47 1aje n ASP 118 Ca 0.00 -1.89 0.00 0.00 0.52 0.00 0.00 54.79 53.42 1aje n ASP 118 Cb 0.00 -0.07 0.00 0.00 -0.72 0.00 0.00 41.12 40.33 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 1.10 0.00 0.27 -2.67 4.77 -0.84 -4.84 117.00 114.79 1aje n LEU 119 Ca 0.16 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.32 1aje n LEU 119 Cb 0.54 0.15 0.92 0.00 -2.33 0.00 0.00 43.42 42.70 1aje n LEU 119 CO 0.15 -0.15 1.15 0.03 -1.33 0.00 0.00 177.39 177.25 1aje h ARG 120 N 0.00 0.00 -0.01 3.23 -0.00 -1.52 2.38 114.38 118.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.97 1aje h ARG 120 CO 0.00 0.00 -0.05 -0.40 0.00 0.00 0.00 179.97 179.52 1aje n ASP 121 N -3.41 0.98 -2.79 7.04 5.75 -1.24 -3.90 116.55 118.99 1aje n ASP 121 Ca -0.00 -1.18 -0.07 0.00 -0.01 0.00 0.00 54.79 53.52 1aje n ASP 121 Cb 0.28 0.01 0.04 0.00 -1.03 0.00 0.00 41.12 40.41 1aje n ASP 121 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1aje n ASP 122 N -0.34 0.41 0.28 -1.12 8.00 0.80 -4.92 116.55 119.67 1aje n ASP 122 Ca 0.18 -1.35 0.19 0.00 0.71 0.00 0.00 54.79 54.52 1aje n ASP 122 Cb 0.29 -0.20 0.91 0.00 -0.02 0.00 0.00 41.12 42.10 1aje n ASP 122 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1aje h PRO 123 N 0.00 0.00 -1.11 -0.24 0.13 -1.88 -2.90 132.00 126.00 1aje h PRO 123 Ca -0.10 0.00 0.31 0.00 -0.87 0.00 0.00 66.00 65.34 1aje h PRO 123 Cb 0.38 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.45 1aje h PRO 123 CO 0.11 0.00 0.78 0.77 -0.23 0.00 0.00 178.00 179.43 1aje h SER 124 N 0.00 0.12 -0.02 1.44 0.02 -1.87 -0.21 113.55 113.05 1aje h SER 124 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1aje h SER 124 Cb 0.20 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.74 1aje h SER 124 CO 0.00 0.02 -0.03 1.07 -1.14 0.00 0.00 176.83 176.75 1aje n THR 125 N -4.32 0.00 -0.05 -2.27 5.66 -1.09 -4.62 114.28 107.58 1aje n THR 125 Ca 0.25 -0.48 -0.14 0.00 -3.05 0.00 0.00 64.05 60.63 1aje n THR 125 Cb 1.11 1.28 -0.07 0.00 -1.55 0.00 0.00 70.33 71.10 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 2.59 1.36 0.00 1.09 1.08 -1.15 -2.92 117.51 119.56 1aje h ILE 126 Ca 0.00 -1.44 0.00 0.00 -0.39 0.00 0.00 64.86 63.03 1aje h ILE 126 Cb 0.57 1.96 0.00 0.00 -3.07 0.00 0.00 36.82 36.28 1aje h ILE 126 CO 0.00 0.43 0.12 -0.33 -0.69 0.00 0.00 178.15 177.68 1aje h GLU 127 N 0.01 0.00 0.00 2.37 5.08 -1.82 0.27 114.58 120.49 1aje h GLU 127 Ca 0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1aje h GLU 127 Cb 0.78 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1aje h GLU 127 CO 0.05 0.00 -0.08 -0.22 -1.00 0.00 0.00 179.01 177.76 1aje h LYS 128 N 0.00 0.00 0.00 2.33 3.11 -1.81 -3.42 116.57 116.78 1aje h LYS 128 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1aje h LYS 128 Cb 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.47 1aje h LYS 128 CO 0.00 0.08 0.00 1.28 -2.81 0.00 0.00 179.45 178.00 1aje n LEU 129 N -4.04 0.00 0.00 5.20 4.32 0.90 -4.97 117.00 118.41 1aje n LEU 129 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.96 1aje n LEU 129 Cb 0.16 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.96 1aje n LEU 129 CO 0.31 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.48 1aje n ALA 130 N -1.94 0.00 0.30 -1.18 0.00 -0.76 -4.64 120.51 112.28 1aje n ALA 130 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 1aje n ALA 130 Cb 0.00 -0.37 0.89 0.00 0.00 0.00 0.00 19.45 19.97 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 0.54 0.00 -0.34 0.00 1.79 -1.93 0.49 116.57 117.12 1aje h LYS 131 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1aje h LYS 131 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1aje h LYS 131 CO 0.00 0.03 0.00 0.09 -1.08 0.00 0.00 179.45 178.49 1aje n ASN 132 N -3.22 3.46 -2.01 0.86 3.02 -1.26 -4.91 115.26 111.21 1aje n ASN 132 Ca -0.01 -2.42 -0.18 0.00 -0.03 0.00 0.00 54.58 51.93 1aje n ASN 132 Cb 0.20 -0.38 -0.04 0.00 -0.61 0.00 0.00 39.78 38.95 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 0.19 -1.65 -0.67 3.52 4.76 0.16 -4.65 118.16 119.83 1aje n LYS 133 Ca 0.17 0.96 0.03 0.00 -2.87 0.00 0.00 58.31 56.60 1aje n LYS 133 Cb 0.65 -5.47 -0.02 0.00 -1.84 0.00 0.00 35.03 28.35 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 -2.61 -0.57 0.00 1.97 -0.00 -1.26 -4.95 117.38 109.96 1aje n GLN 134 Ca -0.20 0.45 0.00 0.00 -0.00 0.00 0.00 57.00 57.26 1aje n GLN 134 Cb 0.63 -1.09 0.00 0.00 -0.00 0.00 0.00 30.24 29.78 1aje n GLN 134 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1aje n LYS 135 N -2.93 0.00 -1.81 2.61 0.00 -1.26 -4.95 118.16 109.82 1aje n LYS 135 Ca -0.01 0.00 -0.32 0.00 -0.00 0.00 0.00 58.31 57.98 1aje n LYS 135 Cb 0.27 0.00 0.03 0.00 -0.00 0.00 0.00 35.03 35.33 1aje n LYS 135 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1aje s PRO 136 N -0.44 3.20 -0.39 -1.58 0.04 -1.25 -1.65 135.00 132.94 1aje s PRO 136 Ca 0.00 1.00 -0.44 0.00 0.04 0.00 0.00 61.00 61.60 1aje s PRO 136 Cb 0.00 -2.02 -0.19 0.00 0.04 0.00 0.00 34.50 32.33 1aje s PRO 136 CO 0.00 -0.89 1.59 -0.89 0.04 0.00 0.00 177.00 176.85 1aje n ILE 137 N -2.65 0.08 -2.26 0.56 -0.00 -0.42 -4.86 119.36 109.82 1aje n ILE 137 Ca 0.08 -0.02 -0.26 0.00 -0.00 0.00 0.00 62.75 62.55 1aje n ILE 137 Cb 0.53 -0.67 0.06 0.00 -0.00 0.00 0.00 39.64 39.56 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 2.87 2.64 -0.60 1.39 2.01 -1.26 -4.82 115.64 117.86 1aje s THR 138 Ca 1.02 -0.21 0.18 0.00 0.31 0.00 0.00 61.69 62.98 1aje s THR 138 Cb -1.35 -3.12 0.18 0.00 0.01 0.00 0.00 72.50 68.22 1aje s THR 138 CO 0.75 -0.12 1.54 -0.81 -0.69 0.00 0.00 174.62 175.29 1aje n PRO 139 N -2.82 0.11 0.00 4.92 -0.04 -1.26 -1.19 135.00 134.72 1aje n PRO 139 Ca 0.07 0.45 0.08 0.00 -0.04 0.00 0.00 63.50 64.06 1aje n PRO 139 Cb 0.60 -1.76 -0.05 0.00 -0.04 0.00 0.00 33.50 32.25 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 -1.97 1.56 -0.07 0.54 1.02 -1.26 -4.24 120.64 116.22 1aje n GLU 140 Ca 0.01 -0.39 -0.04 0.00 -0.02 0.00 0.00 57.16 56.71 1aje n GLU 140 Cb 0.14 -1.30 -0.02 0.00 -0.02 0.00 0.00 31.44 30.24 1aje n GLU 140 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1aje h THR 141 N 0.90 0.01 0.09 2.62 2.02 -1.50 -3.19 112.91 113.85 1aje h THR 141 Ca 0.00 -1.01 0.02 0.00 0.77 0.00 0.00 66.41 66.19 1aje h THR 141 Cb 0.48 0.01 -0.05 0.00 -1.74 0.00 0.00 68.15 66.86 1aje h THR 141 CO 0.00 0.00 -0.41 0.00 0.37 0.00 0.00 175.52 175.48 1aje h ALA 142 N -1.00 -0.71 -0.19 6.16 0.00 -1.68 0.31 119.26 122.14 1aje h ALA 142 Ca -0.00 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1aje h ALA 142 Cb 0.49 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1aje h ALA 142 CO -0.00 -0.97 0.17 0.93 0.00 0.00 0.00 179.25 179.38 1aje h GLU 143 N -0.63 0.00 -0.29 0.00 5.08 -1.79 0.66 114.58 117.62 1aje h GLU 143 Ca 0.03 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.43 1aje h GLU 143 Cb 0.67 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.88 1aje h GLU 143 CO -0.26 0.00 0.06 -0.22 -1.00 0.00 0.00 179.01 177.59 1aje h LYS 144 N 0.00 0.17 0.00 2.33 3.64 -0.38 -1.84 116.57 120.48 1aje h LYS 144 Ca 0.09 -0.01 -0.29 0.00 -1.27 0.00 0.00 60.65 59.17 1aje h LYS 144 Cb 0.43 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.16 1aje h LYS 144 CO -0.00 0.11 -1.90 1.47 -2.27 0.00 0.00 179.45 176.86 1aje n LEU 145 N -5.08 0.55 0.32 5.20 -0.00 -0.64 -3.54 117.00 113.80 1aje n LEU 145 Ca -0.00 0.26 0.21 0.00 -0.00 0.00 0.00 56.01 56.47 1aje n LEU 145 Cb 0.12 0.26 1.05 0.00 -0.00 0.00 0.00 43.42 44.85 1aje n LEU 145 CO 0.26 0.37 1.12 0.00 -0.00 0.00 0.00 177.39 179.15 1aje h ALA 146 N 1.10 1.01 0.00 1.47 0.00 -0.88 1.81 119.26 123.78 1aje h ALA 146 Ca -0.34 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.38 1aje h ALA 146 Cb 1.99 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.76 1aje h ALA 146 CO 0.05 0.00 -0.86 -0.09 0.00 0.00 0.00 179.25 178.36 1aje h ARG 147 N 0.00 0.04 0.00 0.00 2.43 -1.44 1.73 114.38 117.14 1aje h ARG 147 Ca -0.00 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.06 1aje h ARG 147 Cb 0.17 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1aje h ARG 147 CO 0.00 0.87 -0.31 0.22 -1.51 0.00 0.00 179.97 179.25 1aje h ASP 148 N 0.02 0.00 0.00 -3.80 3.58 0.27 -3.33 116.42 113.16 1aje h ASP 148 Ca -0.02 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.28 1aje h ASP 148 Cb 1.51 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.53 1aje h ASP 148 CO 0.12 0.31 -1.59 0.18 -2.88 0.00 0.00 179.24 175.37 1aje n LEU 149 N -3.55 2.52 -2.70 2.28 4.77 -0.30 -5.02 117.00 114.99 1aje n LEU 149 Ca -0.00 -0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 55.80 1aje n LEU 149 Cb 0.45 -0.28 0.06 0.00 -2.33 0.00 0.00 43.42 41.32 1aje n LEU 149 CO 0.35 0.60 0.08 0.29 -1.33 0.00 0.00 177.39 177.39 1aje n LYS 150 N -2.73 -4.73 0.00 3.23 4.76 0.59 -5.01 118.16 114.27 1aje n LYS 150 Ca -0.18 0.60 0.00 0.00 -2.87 0.00 0.00 58.31 55.86 1aje n LYS 150 Cb 0.71 -4.87 0.00 0.00 -1.84 0.00 0.00 35.03 29.03 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 -3.28 0.00 -0.12 7.82 0.00 -1.25 -4.96 120.51 118.72 1aje n ALA 151 Ca -0.19 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.08 1aje n ALA 151 Cb 0.61 0.00 -0.10 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 n VAL 152 N 0.00 1.31 -3.53 0.00 0.31 1.14 -4.80 118.33 112.77 1aje n VAL 152 Ca 0.00 -0.48 -0.17 0.00 -0.01 0.00 0.00 64.34 63.68 1aje n VAL 152 Cb 0.00 -1.38 -0.06 0.00 -0.91 0.00 0.00 33.84 31.49 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 -2.46 1.00 -0.18 5.55 2.36 -1.04 -5.00 119.74 119.96 1aje s LYS 153 Ca -0.31 0.25 0.01 0.00 -2.55 0.00 0.00 55.97 53.36 1aje s LYS 153 Cb 0.09 0.47 0.02 0.00 -1.05 0.00 0.00 37.83 37.36 1aje s LYS 153 CO 0.51 -0.31 -0.18 -0.47 1.55 0.00 0.00 175.35 176.46 1aje s TYR 154 N -1.18 2.69 0.25 4.03 6.14 -1.25 0.20 117.35 128.23 1aje s TYR 154 Ca -0.10 -1.62 -0.01 0.00 0.64 0.00 0.00 57.07 55.98 1aje s TYR 154 Cb -0.00 -1.85 -0.03 0.00 0.42 0.00 0.00 41.96 40.50 1aje s TYR 154 CO 0.09 -0.79 0.24 0.14 0.64 0.00 0.00 175.55 175.87 1aje s VAL 155 N 1.32 0.00 0.05 3.14 -7.23 -0.10 -5.00 120.40 112.58 1aje s VAL 155 Ca 0.04 -1.89 0.05 0.00 -1.81 0.00 0.00 61.98 58.36 1aje s VAL 155 Cb -0.14 -2.48 -0.02 0.00 0.56 0.00 0.00 36.38 34.30 1aje s VAL 155 CO -0.12 0.00 -0.14 -1.61 -0.31 0.00 0.00 175.10 172.92 1aje s GLU 156 N -3.87 0.88 0.00 4.82 8.01 -1.26 0.23 118.70 127.51 1aje s GLU 156 Ca 0.37 -0.82 0.00 0.00 0.01 0.00 0.00 54.97 54.53 1aje s GLU 156 Cb 0.04 -0.88 0.00 0.00 -4.31 0.00 0.00 34.13 28.98 1aje s GLU 156 CO 0.16 0.21 0.00 0.00 0.01 0.00 0.00 175.26 175.64 1aje n SER 158 N 0.00 3.02 0.00 0.00 3.41 -1.08 -4.43 113.62 114.55 1aje n SER 158 Ca 0.00 -1.87 0.00 0.00 -0.26 0.00 0.00 58.87 56.74 1aje n SER 158 Cb 0.00 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.26 1aje n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aje n ALA 159 N 1.99 0.00 -0.00 7.33 0.00 -1.26 -3.62 120.51 124.95 1aje n ALA 159 Ca 0.07 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.57 1aje n ALA 159 Cb 0.35 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.67 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 0.25 0.33 0.00 -0.00 -1.26 -4.53 117.00 111.79 1aje n LEU 160 Ca 0.00 0.10 -0.13 0.00 -0.00 0.00 0.00 56.01 55.98 1aje n LEU 160 Cb 0.00 0.08 -0.06 0.00 -0.00 0.00 0.00 43.42 43.44 1aje n LEU 160 CO 0.00 0.07 0.52 0.74 -0.00 0.00 0.00 177.39 178.72 1aje h THR 161 N 0.00 0.00 -1.58 1.47 2.02 -1.91 -3.49 112.91 109.42 1aje h THR 161 Ca -0.11 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.06 1aje h THR 161 Cb 1.28 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1aje h THR 161 CO 0.01 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.90 1aje n GLN 162 N -4.27 0.00 -0.03 6.66 3.00 -1.26 -4.99 117.38 116.49 1aje n GLN 162 Ca -0.10 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.82 1aje n GLN 162 Cb 0.33 -1.11 -0.13 0.00 0.00 0.00 0.00 30.24 29.33 1aje n GLN 162 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1aje n LYS 163 N -0.79 0.64 0.00 -1.09 5.02 -1.26 -4.84 118.16 115.84 1aje n LYS 163 Ca 0.00 0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1aje n LYS 163 Cb 0.30 -1.74 0.00 0.00 -0.02 0.00 0.00 35.03 33.57 1aje n LYS 163 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1aje n GLY 164 N 1.55 0.27 0.01 0.72 0.00 -1.15 -4.92 105.19 101.67 1aje n GLY 164 Ca -0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 0.06 0.08 0.99 -0.00 -1.26 0.31 117.00 117.17 1aje n LEU 165 Ca 0.00 0.51 0.12 0.00 -0.00 0.00 0.00 56.01 56.64 1aje n LEU 165 Cb 0.06 -0.50 0.06 0.00 -0.00 0.00 0.00 43.42 43.03 1aje n LEU 165 CO 0.00 -0.25 0.11 1.17 -0.00 0.00 0.00 177.39 178.42 1aje n LYS 166 N -1.56 0.45 0.01 1.47 3.00 -1.26 -2.41 118.16 117.86 1aje n LYS 166 Ca 0.04 0.09 -0.21 0.00 -0.00 0.00 0.00 58.31 58.22 1aje n LYS 166 Cb 0.19 -1.74 -0.14 0.00 0.00 0.00 0.00 35.03 33.35 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 0.37 -0.70 3.14 7.08 -0.93 -2.83 115.58 121.71 1aje h ASN 167 Ca 0.00 -0.86 0.14 0.00 -3.08 0.00 0.00 56.30 52.51 1aje h ASN 167 Cb 0.87 -0.12 -0.10 0.00 -2.08 0.00 0.00 38.32 36.89 1aje h ASN 167 CO 0.00 1.58 0.19 1.62 -2.08 0.00 0.00 177.43 178.74 1aje h VAL 168 N -0.34 0.59 -0.38 6.14 3.04 -0.21 0.88 116.25 125.97 1aje h VAL 168 Ca -0.28 -0.11 0.08 0.00 -1.01 0.00 0.00 66.70 65.38 1aje h VAL 168 Cb 1.72 0.25 -0.07 0.00 -2.01 0.00 0.00 31.29 31.19 1aje h VAL 168 CO 0.06 0.06 -0.08 -0.26 -1.01 0.00 0.00 177.57 176.33 1aje h PHE 169 N 0.31 -0.18 0.00 3.17 0.04 -1.48 2.27 116.94 121.07 1aje h PHE 169 Ca 0.38 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 61.18 1aje h PHE 169 Cb 0.61 0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.90 1aje h PHE 169 CO -0.24 -0.15 -0.03 0.38 -0.60 0.00 0.00 178.31 177.67 1aje h ASP 170 N 0.01 0.00 0.23 2.17 3.04 0.68 -2.40 116.42 120.16 1aje h ASP 170 Ca 0.18 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.96 1aje h ASP 170 Cb 0.28 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.57 1aje h ASP 170 CO -0.38 0.03 -0.11 -0.08 -2.04 0.00 0.00 179.24 176.66 1aje h GLU 171 N 0.00 -0.30 -0.91 4.15 4.57 0.77 0.15 114.58 123.01 1aje h GLU 171 Ca -0.00 0.02 0.33 0.00 -1.18 0.00 0.00 59.36 58.53 1aje h GLU 171 Cb 0.07 0.07 -0.17 0.00 -0.16 0.00 0.00 28.75 28.56 1aje h GLU 171 CO 0.00 -0.20 0.30 0.00 -1.18 0.00 0.00 179.01 177.94 1aje n ALA 172 N -2.50 0.75 0.01 2.92 0.00 0.66 0.30 120.51 122.66 1aje n ALA 172 Ca -0.04 0.95 -0.18 0.00 0.00 0.00 0.00 53.44 54.17 1aje n ALA 172 Cb 0.12 -0.84 -0.10 0.00 0.00 0.00 0.00 19.45 18.63 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 1.36 0.00 0.00 5.03 -1.47 0.80 117.51 123.23 1aje h ILE 173 Ca 0.69 -2.12 0.00 0.00 -0.12 0.00 0.00 64.86 63.31 1aje h ILE 173 Cb 1.69 2.47 0.00 0.00 -3.03 0.00 0.00 36.82 37.94 1aje h ILE 173 CO -0.76 0.64 0.00 0.25 -0.68 0.00 0.00 178.15 177.59 1aje h LEU 174 N 0.13 0.00 0.00 1.44 7.12 0.54 1.12 115.31 125.66 1aje h LEU 174 Ca -0.09 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.92 1aje h LEU 174 Cb 1.45 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.58 1aje h LEU 174 CO 0.15 0.00 -1.47 0.00 -0.13 0.00 0.00 178.44 176.99 1aje n ALA 175 N -1.83 3.01 0.42 1.25 0.00 0.89 -0.60 120.51 123.66 1aje n ALA 175 Ca 0.00 -0.43 0.10 0.00 0.00 0.00 0.00 53.44 53.11 1aje n ALA 175 Cb 0.14 -0.89 -0.14 0.00 0.00 0.00 0.00 19.45 18.57 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 -2.09 3.58 -0.26 0.00 0.00 0.11 -3.58 120.51 118.27 1aje n ALA 176 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1aje n ALA 176 Cb 0.52 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1aje n ALA 176 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 177 N -1.86 0.17 0.00 0.00 -0.00 0.35 -5.00 117.00 110.65 1aje n LEU 177 Ca -0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 56.01 55.73 1aje n LEU 177 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.84 1aje n LEU 177 CO 0.41 0.04 0.00 -0.62 -0.00 0.00 0.00 177.39 177.22 1aje n GLU 178 N -0.22 0.00 -1.82 1.47 1.02 0.23 -4.18 120.64 117.14 1aje n GLU 178 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 1aje n GLU 178 Cb 0.07 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.46 1aje n GLU 178 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1aje s PRO 179 N 0.00 4.16 -0.90 3.49 0.04 -1.26 -4.93 135.00 135.60 1aje s PRO 179 Ca 0.00 2.44 -0.25 0.00 0.04 0.00 0.00 61.00 63.24 1aje s PRO 179 Cb 0.00 -3.93 0.04 0.00 0.04 0.00 0.00 34.50 30.65 1aje s PRO 179 CO 0.00 -0.87 1.40 -1.25 0.04 0.00 0.00 177.00 176.32 1aje s PRO 180 N 3.77 3.40 -0.04 0.56 0.04 -1.26 -4.81 135.00 136.66 1aje s PRO 180 Ca 0.81 -0.74 0.12 0.00 0.04 0.00 0.00 61.00 61.22 1aje s PRO 180 Cb -0.40 -4.89 -0.23 0.00 0.04 0.00 0.00 34.50 29.02 1aje s PRO 180 CO 0.36 -2.21 0.67 0.93 0.04 0.00 0.00 177.00 176.79 1aje h GLU 181 N 9.98 0.01 -3.36 4.56 4.39 -1.91 -3.39 114.58 124.86 1aje h GLU 181 Ca 0.01 -0.01 -0.54 0.00 0.34 0.00 0.00 59.36 59.15 1aje h GLU 181 Cb 1.03 0.01 0.02 0.00 -0.10 0.00 0.00 28.75 29.70 1aje h GLU 181 CO 1.37 0.53 3.16 -0.35 -1.16 0.00 0.00 179.01 182.56 1aje n PRO 182 N -3.07 2.79 -4.18 2.33 -0.04 -1.26 -4.88 135.00 126.69 1aje n PRO 182 Ca -0.17 -1.87 -0.33 0.00 -0.04 0.00 0.00 63.50 61.09 1aje n PRO 182 Cb 1.05 -2.68 -0.08 0.00 -0.04 0.00 0.00 33.50 31.75 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 2.97 2.98 0.20 0.54 -0.14 -1.26 -4.90 119.74 120.12 1aje s LYS 183 Ca 0.54 -0.51 -0.05 0.00 -1.36 0.00 0.00 55.97 54.59 1aje s LYS 183 Cb 0.14 -2.80 -0.06 0.00 -1.68 0.00 0.00 37.83 33.43 1aje s LYS 183 CO -0.04 0.65 0.45 0.15 -0.76 0.00 0.00 175.35 175.80 1aje s LYS 184 N -1.58 3.64 2.70 1.68 1.02 -1.26 -4.95 119.74 120.98 1aje s LYS 184 Ca 0.21 -0.04 0.00 0.00 0.02 0.00 0.00 55.97 56.15 1aje s LYS 184 Cb -0.12 -2.77 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 1aje s LYS 184 CO 0.11 0.38 0.00 0.45 -0.92 0.00 0.00 175.35 175.37 1aje n SER 185 N -0.29 -3.52 -3.29 2.83 2.88 -1.26 -4.49 113.62 106.48 1aje n SER 185 Ca -0.02 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.27 1aje n SER 185 Cb 0.53 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.91 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 -0.46 1.13 0.00 -1.46 5.12 -1.26 -5.22 116.66 114.51 1aje n ARG 186 Ca 0.00 -3.61 0.00 0.00 -1.93 0.00 0.00 57.85 52.31 1aje n ARG 186 Cb 0.00 -1.54 0.00 0.00 -1.16 0.00 0.00 32.46 29.76 1aje n ARG 186 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24