#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aje s SER -6 N 0.00 5.98 -0.97 1.61 0.01 -1.26 -5.02 113.70 114.05 1aje s SER -6 Ca 0.00 -0.02 -0.20 0.00 1.31 0.00 0.00 55.95 57.04 1aje s SER -6 Cb 0.00 -1.40 0.10 0.00 0.21 0.00 0.00 66.02 64.94 1aje s SER -6 CO 0.00 -0.46 1.25 -0.54 0.41 0.00 0.00 173.24 173.90 1aje s LYS -5 N -4.26 3.60 0.11 12.44 3.01 -1.26 -4.99 119.74 128.39 1aje s LYS -5 Ca 0.45 -1.53 -0.08 0.00 -1.01 0.00 0.00 55.97 53.80 1aje s LYS -5 Cb -0.10 -5.09 -0.06 0.00 -1.01 0.00 0.00 37.83 31.58 1aje s LYS -5 CO 0.33 -1.94 0.40 -1.50 0.51 0.00 0.00 175.35 173.15 1aje s ILE -4 N 3.54 5.12 1.26 2.17 1.10 -1.26 -5.07 121.20 128.06 1aje s ILE -4 Ca 0.38 0.28 -0.16 0.00 -0.51 0.00 0.00 60.65 60.63 1aje s ILE -4 Cb -0.03 -3.63 0.31 0.00 0.15 0.00 0.00 42.46 39.26 1aje s ILE -4 CO -0.10 0.17 0.90 -0.38 -2.11 0.00 0.00 174.94 173.42 1aje n ILE -3 N 0.52 0.00 -3.86 2.00 -0.00 -1.26 -5.03 119.36 111.72 1aje n ILE -3 Ca -0.05 -0.37 0.02 0.00 -0.00 0.00 0.00 62.75 62.35 1aje n ILE -3 Cb 0.52 -0.96 0.01 0.00 -0.00 0.00 0.00 39.64 39.21 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 -2.49 -0.01 -1.40 4.38 0.15 -1.26 -5.03 113.70 108.03 1aje s SER -2 Ca 0.67 -0.20 -0.15 0.00 0.70 0.00 0.00 55.95 56.97 1aje s SER -2 Cb -0.22 0.16 0.04 0.00 -1.71 0.00 0.00 66.02 64.30 1aje s SER -2 CO 0.63 -0.32 2.10 0.00 1.20 0.00 0.00 173.24 176.85 1aje n ALA -1 N -0.75 4.95 -1.73 5.45 0.00 -1.26 -4.22 120.51 122.95 1aje n ALA -1 Ca -0.01 -3.85 -0.19 0.00 0.00 0.00 0.00 53.44 49.39 1aje n ALA -1 Cb 0.60 -3.56 0.09 0.00 0.00 0.00 0.00 19.45 16.58 1aje n ALA -1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aje n MET 1 N 6.72 2.86 0.02 0.00 0.00 -1.26 -4.76 117.12 120.71 1aje n MET 1 Ca 0.51 -3.71 0.00 0.00 0.00 0.00 0.00 57.70 54.50 1aje n MET 1 Cb 0.41 -2.12 0.00 0.00 0.00 0.00 0.00 33.22 31.51 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 -0.88 0.00 -2.41 3.17 1.13 -1.26 -5.11 117.38 112.02 1aje n GLN 2 Ca 0.43 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.48 1aje n GLN 2 Cb 0.91 -0.45 -0.01 0.00 0.11 0.00 0.00 30.24 30.80 1aje n GLN 2 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1aje n THR 3 N -3.12-13.09 -3.96 5.09 -1.04 -1.26 -4.81 114.28 92.08 1aje n THR 3 Ca 0.00 3.05 -0.31 0.00 -2.04 0.00 0.00 64.05 64.75 1aje n THR 3 Cb 0.31 -6.09 -0.15 0.00 -1.82 0.00 0.00 70.33 62.58 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 -0.60 1.97 -0.44 12.58 1.09 0.49 -4.49 121.20 131.80 1aje s ILE 4 Ca -0.05 -2.07 -0.28 0.00 -1.10 0.00 0.00 60.65 57.14 1aje s ILE 4 Cb 0.00 -2.43 0.03 0.00 -1.06 0.00 0.00 42.46 39.00 1aje s ILE 4 CO 0.15 -0.56 1.06 -0.54 -0.10 0.00 0.00 174.94 174.95 1aje s LYS 5 N 1.07 3.76 -0.17 2.79 -0.14 -1.26 0.84 119.74 126.62 1aje s LYS 5 Ca 0.09 0.57 -0.15 0.00 -1.36 0.00 0.00 55.97 55.12 1aje s LYS 5 Cb -0.19 -3.87 -0.04 0.00 -1.68 0.00 0.00 37.83 32.05 1aje s LYS 5 CO -0.11 -1.22 0.34 0.00 -0.76 0.00 0.00 175.35 173.60 1aje s VAL 7 N 0.78 5.00 -0.48 0.00 1.01 0.18 0.16 120.40 127.05 1aje s VAL 7 Ca 0.18 -0.46 -0.25 0.00 0.00 0.00 0.00 61.98 61.45 1aje s VAL 7 Cb -0.14 -4.17 0.03 0.00 0.00 0.00 0.00 36.38 32.11 1aje s VAL 7 CO 0.06 -0.61 0.94 -0.69 0.00 0.00 0.00 175.10 174.81 1aje s VAL 8 N 2.32 4.44 0.00 2.92 1.01 0.16 0.61 120.40 131.85 1aje s VAL 8 Ca 0.13 0.70 0.00 0.00 0.00 0.00 0.00 61.98 62.81 1aje s VAL 8 Cb -0.19 -4.46 0.00 0.00 0.00 0.00 0.00 36.38 31.73 1aje s VAL 8 CO 0.12 -0.90 0.00 1.33 0.00 0.00 0.00 175.10 175.66 1aje n VAL 9 N 6.42 0.00 -3.63 2.92 0.24 -0.07 -4.66 118.33 119.55 1aje n VAL 9 Ca 0.06 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.09 1aje n VAL 9 Cb 0.48 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.86 1aje n VAL 9 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1aje n GLY 10 N 5.00 -0.85 0.32 7.63 0.00 -1.26 -2.54 105.19 113.50 1aje n GLY 10 Ca 0.00 0.72 0.18 0.00 0.00 0.00 0.00 46.02 46.92 1aje n GLY 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1aje h ASP 11 N 0.38 0.35 -4.67 1.61 5.19 -1.91 -3.13 116.42 114.25 1aje h ASP 11 Ca -0.59 0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.00 1aje h ASP 11 Cb 1.33 0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.98 1aje h ASP 11 CO 0.31 -0.09 -0.78 0.61 -3.12 0.00 0.00 179.24 176.17 1aje n GLY 12 N -1.33 -4.08 2.11 2.75 0.00 -1.23 -3.09 105.19 100.33 1aje n GLY 12 Ca 0.26 0.28 -0.03 0.00 0.00 0.00 0.00 46.02 46.54 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 1.91 -0.67 -4.20 4.61 0.00 -1.26 -1.04 120.51 119.87 1aje n ALA 13 Ca -0.05 0.04 -0.36 0.00 0.00 0.00 0.00 53.44 53.07 1aje n ALA 13 Cb 0.08 -0.71 -0.08 0.00 0.00 0.00 0.00 19.45 18.75 1aje n ALA 13 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1aje n VAL 14 N -2.28 -0.24 -3.14 0.00 3.14 -1.20 -4.81 118.33 109.80 1aje n VAL 14 Ca -0.04 -0.12 -0.22 0.00 -2.96 0.00 0.00 64.34 61.00 1aje n VAL 14 Cb 0.40 -0.57 -0.04 0.00 -1.06 0.00 0.00 33.84 32.58 1aje n VAL 14 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1aje n GLY 15 N -1.38 4.13 0.00 7.55 0.00 -0.21 -4.82 105.19 110.46 1aje n GLY 15 Ca -0.00 -2.04 0.03 0.00 0.00 0.00 0.00 46.02 44.01 1aje n GLY 15 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1aje n LYS 16 N 0.34 3.99 -0.00 1.61 -0.00 -1.26 -4.28 118.16 118.56 1aje n LYS 16 Ca 0.26 -0.01 -0.04 0.00 -0.00 0.00 0.00 58.31 58.52 1aje n LYS 16 Cb 0.55 -0.88 -0.03 0.00 -0.00 0.00 0.00 35.03 34.68 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 -1.06 0.58 2.02 -1.93 -0.65 112.91 111.86 1aje h THR 17 Ca 0.00 0.00 0.38 0.00 0.77 0.00 0.00 66.41 67.56 1aje h THR 17 Cb 0.19 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.48 1aje h THR 17 CO 0.00 0.00 0.67 0.00 0.37 0.00 0.00 175.52 176.56 1aje h LEU 19 N 0.00 -0.48 -0.85 0.00 5.85 -1.43 -1.47 115.31 116.94 1aje h LEU 19 Ca 0.70 0.02 0.18 0.00 0.84 0.00 0.00 57.88 59.62 1aje h LEU 19 Cb 2.20 0.12 -0.16 0.00 0.37 0.00 0.00 40.66 43.20 1aje h LEU 19 CO -0.41 -0.29 -0.19 -0.07 -0.34 0.00 0.00 178.44 177.14 1aje h LEU 20 N -0.67 -0.74 -0.19 2.25 4.07 -0.26 0.38 115.31 120.14 1aje h LEU 20 Ca -0.06 0.25 0.02 0.00 0.08 0.00 0.00 57.88 58.17 1aje h LEU 20 Cb 0.43 0.51 -0.03 0.00 1.08 0.00 0.00 40.66 42.66 1aje h LEU 20 CO 0.10 -0.28 -0.18 0.40 -1.08 0.00 0.00 178.44 177.39 1aje h ILE 21 N 0.01 0.00 -0.92 1.22 5.03 -1.20 0.32 117.51 121.98 1aje h ILE 21 Ca 0.42 0.00 0.18 0.00 -0.12 0.00 0.00 64.86 65.34 1aje h ILE 21 Cb 0.66 0.00 -0.08 0.00 -3.03 0.00 0.00 36.82 34.37 1aje h ILE 21 CO -0.86 0.00 0.59 0.77 -0.68 0.00 0.00 178.15 177.97 1aje h SER 22 N -0.09 0.57 -0.53 1.72 4.64 0.45 2.29 113.55 122.59 1aje h SER 22 Ca 0.03 0.05 0.15 0.00 -0.47 0.00 0.00 61.79 61.56 1aje h SER 22 Cb 0.17 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 1aje h SER 22 CO -0.23 0.24 0.55 0.10 -0.87 0.00 0.00 176.83 176.63 1aje h TYR 23 N 0.58 0.00 0.00 4.77 -0.00 0.35 -1.25 116.97 121.42 1aje h TYR 23 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.21 1aje h TYR 23 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.69 1aje h TYR 23 CO -0.00 0.00 -0.55 -2.37 -0.00 0.00 0.00 178.16 175.24 1aje n THR 24 N -3.71 0.00 0.29 -0.90 5.66 0.14 -4.83 114.28 110.93 1aje n THR 24 Ca 0.10 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.14 1aje n THR 24 Cb 0.76 -0.55 0.01 0.00 -1.55 0.00 0.00 70.33 69.00 1aje n THR 24 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1aje n THR 25 N -1.33 0.00 -1.95 1.09 -2.24 0.73 -4.95 114.28 105.63 1aje n THR 25 Ca 0.00 -0.46 -0.04 0.00 -2.27 0.00 0.00 64.05 61.28 1aje n THR 25 Cb 0.27 1.10 -0.01 0.00 -2.10 0.00 0.00 70.33 69.60 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 -0.06 -1.57 -3.38 3.42 5.15 -0.47 -4.79 115.26 113.56 1aje n ASN 26 Ca 0.03 0.28 -0.24 0.00 -0.60 0.00 0.00 54.58 54.06 1aje n ASN 26 Cb 0.15 -1.57 -0.10 0.00 -0.53 0.00 0.00 39.78 37.74 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1aje s LYS 27 N -3.96 0.68 0.00 1.20 2.20 -1.26 -4.76 119.74 113.83 1aje s LYS 27 Ca 0.00 -1.37 0.00 0.00 -0.36 0.00 0.00 55.97 54.24 1aje s LYS 27 Cb 0.00 -1.10 0.00 0.00 -1.51 0.00 0.00 37.83 35.22 1aje s LYS 27 CO 0.00 -1.25 0.00 1.97 -0.36 0.00 0.00 175.35 175.71 1aje n PHE 28 N 3.77 -1.98 0.00 4.03 -1.74 -1.26 -4.60 117.46 115.67 1aje n PHE 28 Ca 0.16 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.05 1aje n PHE 28 Cb 0.43 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.43 1aje n PHE 28 CO 0.00 0.00 0.00 -0.35 -0.56 0.00 0.00 176.76 175.85 1aje n PRO 29 N -1.14 0.00 -0.36 3.97 -0.04 -1.26 -2.09 135.00 134.07 1aje n PRO 29 Ca 0.00 0.10 0.27 0.00 -0.04 0.00 0.00 63.50 63.83 1aje n PRO 29 Cb 0.00 -1.56 0.54 0.00 -0.04 0.00 0.00 33.50 32.44 1aje n PRO 29 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1aje h SER 30 N 0.00 0.41 -0.40 3.54 4.64 -2.01 -2.42 113.55 117.31 1aje h SER 30 Ca 0.00 0.13 -0.24 0.00 -0.47 0.00 0.00 61.79 61.20 1aje h SER 30 Cb 0.13 0.08 -0.32 0.00 -0.31 0.00 0.00 62.40 61.97 1aje h SER 30 CO 0.00 -0.05 -0.87 -0.62 -0.87 0.00 0.00 176.83 174.43 1aje n GLU 31 N -4.75 1.49 -3.99 4.77 1.02 -0.89 -5.09 120.64 113.21 1aje n GLU 31 Ca 0.31 -2.77 -0.18 0.00 -0.02 0.00 0.00 57.16 54.49 1aje n GLU 31 Cb 1.07 -0.93 -0.16 0.00 -0.02 0.00 0.00 31.44 31.40 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 -2.41 0.44 -0.35 -0.32 1.51 -0.91 -5.00 117.35 110.31 1aje s TYR 32 Ca 0.22 -0.06 0.14 0.00 -1.01 0.00 0.00 57.07 56.36 1aje s TYR 32 Cb 0.38 -0.49 0.42 0.00 -0.11 0.00 0.00 41.96 42.17 1aje s TYR 32 CO -0.05 -0.15 1.28 1.33 -1.11 0.00 0.00 175.55 176.85 1aje n VAL 33 N 4.14 0.37 -2.01 0.71 0.24 -1.26 -4.24 118.33 116.29 1aje n VAL 33 Ca -0.25 -1.91 -0.33 0.00 -2.04 0.00 0.00 64.34 59.81 1aje n VAL 33 Cb 0.50 0.96 -0.04 0.00 -1.47 0.00 0.00 33.84 33.80 1aje n VAL 33 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1aje s PRO 34 N -1.04 2.54 0.32 7.34 0.04 -1.26 -4.82 135.00 138.13 1aje s PRO 34 Ca 0.21 0.30 0.09 0.00 0.04 0.00 0.00 61.00 61.64 1aje s PRO 34 Cb 0.42 -4.67 0.85 0.00 0.04 0.00 0.00 34.50 31.14 1aje s PRO 34 CO -0.06 -3.06 1.76 1.15 0.04 0.00 0.00 177.00 176.83 1aje h THR 35 N 7.09 0.61 -1.73 1.26 2.02 -2.07 -3.41 112.91 116.69 1aje h THR 35 Ca -0.12 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.85 1aje h THR 35 Cb 1.10 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1aje h THR 35 CO 1.21 0.12 0.00 1.33 0.37 0.00 0.00 175.52 178.54 1aje n VAL 36 N -4.79 0.00 -4.25 3.16 0.24 -1.26 -5.10 118.33 106.33 1aje n VAL 36 Ca 0.25 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.36 1aje n VAL 36 Cb 0.68 -1.95 -0.13 0.00 -1.47 0.00 0.00 33.84 30.98 1aje n VAL 36 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1aje s PHE 37 N -0.51 1.20 0.21 6.34 0.08 -1.26 -5.15 117.98 118.89 1aje s PHE 37 Ca 0.00 -0.41 -0.00 0.00 0.12 0.00 0.00 56.93 56.64 1aje s PHE 37 Cb 0.00 -0.69 -0.04 0.00 -0.57 0.00 0.00 43.02 41.72 1aje s PHE 37 CO 0.00 0.04 0.15 0.16 -0.10 0.00 0.00 175.22 175.47 1aje s ASP 38 N -1.45 0.33 -0.29 1.36 -4.77 -1.26 -5.16 116.67 105.43 1aje s ASP 38 Ca -0.01 -1.43 -0.24 0.00 -3.30 0.00 0.00 52.55 47.57 1aje s ASP 38 Cb -0.09 0.40 0.15 0.00 -1.09 0.00 0.00 42.92 42.28 1aje s ASP 38 CO 0.02 -0.86 1.17 0.21 0.70 0.00 0.00 175.17 176.41 1aje s ASN 39 N -3.19 -0.31 0.00 2.11 3.04 -1.26 -4.95 114.94 110.39 1aje s ASN 39 Ca 0.39 0.59 0.00 0.00 0.04 0.00 0.00 52.86 53.89 1aje s ASN 39 Cb 0.07 0.64 0.00 0.00 -1.54 0.00 0.00 41.25 40.42 1aje s ASN 39 CO 0.14 -0.10 0.00 0.00 -3.04 0.00 0.00 177.10 174.10 1aje n TYR 40 N 2.10 -0.82 -3.77 0.43 4.11 -1.26 -5.03 117.16 112.92 1aje n TYR 40 Ca -0.12 0.00 -0.26 0.00 -0.00 0.00 0.00 57.90 57.52 1aje n TYR 40 Cb 0.56 0.00 -0.17 0.00 -0.00 0.00 0.00 39.34 39.73 1aje n TYR 40 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1aje s ALA 41 N -1.00 0.97 0.65 -3.48 0.00 -1.25 -2.39 121.76 115.25 1aje s ALA 41 Ca 0.00 -0.51 -0.03 0.00 0.00 0.00 0.00 51.96 51.42 1aje s ALA 41 Cb 0.00 -1.01 0.06 0.00 0.00 0.00 0.00 23.12 22.17 1aje s ALA 41 CO 0.00 -0.86 0.92 0.14 0.00 0.00 0.00 175.76 175.96 1aje s VAL 42 N 1.87 2.41 -0.23 0.00 -7.23 -0.91 -4.50 120.40 111.80 1aje s VAL 42 Ca 0.02 -0.48 -0.06 0.00 -1.81 0.00 0.00 61.98 59.64 1aje s VAL 42 Cb -0.15 -2.93 -0.03 0.00 0.56 0.00 0.00 36.38 33.84 1aje s VAL 42 CO -0.07 0.00 0.04 -0.89 -0.31 0.00 0.00 175.10 173.87 1aje s THR 43 N -3.05 4.12 0.44 5.32 2.01 -1.26 0.31 115.64 123.53 1aje s THR 43 Ca 0.60 -0.24 0.07 0.00 0.31 0.00 0.00 61.69 62.43 1aje s THR 43 Cb -0.09 -2.90 -0.01 0.00 0.01 0.00 0.00 72.50 69.50 1aje s THR 43 CO 0.42 0.38 0.35 0.68 -0.69 0.00 0.00 174.62 175.76 1aje s VAL 44 N 1.39 2.41 -0.18 3.82 -7.23 -1.03 -4.84 120.40 114.75 1aje s VAL 44 Ca 0.05 -1.43 0.01 0.00 -1.81 0.00 0.00 61.98 58.80 1aje s VAL 44 Cb -0.15 -2.84 0.03 0.00 0.56 0.00 0.00 36.38 33.99 1aje s VAL 44 CO 0.02 0.00 -0.12 -0.04 -0.31 0.00 0.00 175.10 174.65 1aje s MET 45 N -4.12 2.14 -0.13 4.82 -1.94 -1.26 -0.72 119.30 118.09 1aje s MET 45 Ca 0.45 -0.71 -0.17 0.00 -1.71 0.00 0.00 55.69 53.54 1aje s MET 45 Cb -0.02 -2.27 -0.15 0.00 2.01 0.00 0.00 34.83 34.40 1aje s MET 45 CO 0.26 -0.34 0.41 0.82 -0.01 0.00 0.00 175.02 176.16 1aje h ILE 46 N 6.24 1.02 -0.13 2.53 5.03 -1.88 -3.43 117.51 126.89 1aje h ILE 46 Ca -0.32 -1.80 -0.19 0.00 -0.12 0.00 0.00 64.86 62.43 1aje h ILE 46 Cb 1.11 1.97 -0.26 0.00 -3.03 0.00 0.00 36.82 36.61 1aje h ILE 46 CO 0.50 0.35 -0.67 0.61 -0.68 0.00 0.00 178.15 178.25 1aje n GLY 47 N 1.65 1.49 0.00 5.37 0.00 -1.26 -4.91 105.19 107.54 1aje n GLY 47 Ca -0.08 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.60 1.34 3.10 -0.02 0.00 -1.26 -5.10 105.19 102.65 1aje n GLY 48 Ca -0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.34 1.47 -0.13 1.61 2.02 -1.26 -4.85 118.70 117.22 1aje s GLU 49 Ca 0.00 -0.51 -0.21 0.00 0.02 0.00 0.00 54.97 54.27 1aje s GLU 49 Cb 0.00 -1.32 -0.03 0.00 0.10 0.00 0.00 34.13 32.88 1aje s GLU 49 CO 0.00 0.22 0.61 -1.25 0.02 0.00 0.00 175.26 174.85 1aje s PRO 50 N 0.03 4.32 -0.24 0.39 0.04 -1.25 -2.45 135.00 135.83 1aje s PRO 50 Ca -0.02 0.65 -0.02 0.00 0.04 0.00 0.00 61.00 61.65 1aje s PRO 50 Cb -0.10 -3.50 0.07 0.00 0.04 0.00 0.00 34.50 31.02 1aje s PRO 50 CO 0.01 -0.03 0.04 0.71 0.04 0.00 0.00 177.00 177.77 1aje s TYR 51 N 1.20 1.50 0.67 0.56 2.02 0.10 -4.02 117.35 119.38 1aje s TYR 51 Ca 0.31 -1.31 -0.17 0.00 -0.37 0.00 0.00 57.07 55.53 1aje s TYR 51 Cb -0.16 -1.35 0.01 0.00 -0.40 0.00 0.00 41.96 40.05 1aje s TYR 51 CO 0.13 -0.73 1.25 0.99 -1.57 0.00 0.00 175.55 175.61 1aje s THR 52 N 1.69 2.24 -0.10 -0.71 2.01 -1.25 -2.46 115.64 117.06 1aje s THR 52 Ca 0.02 0.13 -0.02 0.00 0.31 0.00 0.00 61.69 62.13 1aje s THR 52 Cb -0.17 -2.91 0.04 0.00 0.01 0.00 0.00 72.50 69.46 1aje s THR 52 CO -0.13 -0.04 0.04 -1.48 -0.69 0.00 0.00 174.62 172.31 1aje s LEU 53 N -4.63 0.53 -0.42 4.42 -0.00 0.15 0.18 118.68 118.91 1aje s LEU 53 Ca 0.78 -0.25 -0.13 0.00 -0.00 0.00 0.00 54.13 54.53 1aje s LEU 53 Cb -0.33 -0.35 0.05 0.00 -0.00 0.00 0.00 46.19 45.55 1aje s LEU 53 CO 0.41 -0.25 0.29 -0.83 -0.00 0.00 0.00 176.35 175.97 1aje s GLY 54 N 2.03 1.99 0.48 -3.48 0.00 0.25 -2.14 107.32 106.45 1aje s GLY 54 Ca 0.04 -1.90 -0.22 0.00 0.00 0.00 0.00 44.72 42.63 1aje s GLY 54 CO -0.06 0.94 1.18 1.08 0.00 0.00 0.00 173.10 176.24 1aje s LEU 55 N 1.59 3.95 -0.23 0.66 2.01 -1.01 0.16 118.68 125.82 1aje s LEU 55 Ca 0.03 2.32 -0.00 0.00 0.01 0.00 0.00 54.13 56.49 1aje s LEU 55 Cb -0.21 -4.30 0.06 0.00 0.01 0.00 0.00 46.19 41.75 1aje s LEU 55 CO 0.07 -1.02 -0.01 0.12 1.01 0.00 0.00 176.35 176.51 1aje s PHE 56 N -1.56 1.92 0.00 0.29 5.36 0.43 -4.57 117.98 119.85 1aje s PHE 56 Ca 0.66 -1.48 0.00 0.00 -0.96 0.00 0.00 56.93 55.15 1aje s PHE 56 Cb -0.29 -1.43 0.00 0.00 -0.34 0.00 0.00 43.02 40.96 1aje s PHE 56 CO 0.34 -0.73 0.00 -0.40 -1.46 0.00 0.00 175.22 172.97 1aje n ASP 57 N 4.80 1.01 -0.00 6.13 5.68 -1.26 -0.67 116.55 132.24 1aje n ASP 57 Ca -0.10 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.22 1aje n ASP 57 Cb 0.45 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.38 1aje n ASP 57 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1aje n THR 58 N -1.99 0.00 0.19 2.12 -2.24 -1.26 -4.72 114.28 106.37 1aje n THR 58 Ca 0.00 -0.29 -0.07 0.00 -2.27 0.00 0.00 64.05 61.42 1aje n THR 58 Cb 0.16 0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 1aje n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aje h ALA 59 N 0.91 -1.05 -5.68 6.98 0.00 -1.93 -3.48 119.26 115.01 1aje h ALA 59 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1aje h ALA 59 Cb 0.21 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1aje h ALA 59 CO 0.00 -1.01 -0.83 0.41 0.00 0.00 0.00 179.25 177.81 1aje n GLY 60 N -1.00 -2.33 0.88 0.00 0.00 -1.26 -4.96 105.19 96.52 1aje n GLY 60 Ca -0.06 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.63 1aje n GLY 60 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1aje n GLN 61 N 1.81 0.00 -0.69 1.61 7.27 -1.26 -4.91 117.38 121.22 1aje n GLN 61 Ca -0.14 -1.15 0.52 0.00 0.07 0.00 0.00 57.00 56.30 1aje n GLN 61 Cb 0.30 -0.13 0.81 0.00 2.41 0.00 0.00 30.24 33.64 1aje n GLN 61 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1aje h GLU 62 N 0.32 0.00 -1.51 3.69 5.08 -2.04 -3.42 114.58 116.69 1aje h GLU 62 Ca -0.15 -0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.98 1aje h GLU 62 Cb 1.49 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.65 1aje h GLU 62 CO -0.01 0.00 -0.21 -3.47 -1.00 0.00 0.00 179.01 174.32 1aje n ASP 63 N -4.03 -2.98 0.00 1.42 2.03 -1.26 -4.68 116.55 107.06 1aje n ASP 63 Ca 0.44 0.28 0.00 0.00 0.52 0.00 0.00 54.79 56.03 1aje n ASP 63 Cb 1.97 -2.85 0.00 0.00 -0.72 0.00 0.00 41.12 39.52 1aje n ASP 63 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1aje n TYR 64 N -1.78 0.00 -3.28 -0.67 4.02 -1.26 -4.85 117.16 109.35 1aje n TYR 64 Ca -0.11 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.61 1aje n TYR 64 Cb 0.37 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.77 1aje n TYR 64 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1aje n ASP 65 N -1.98 -4.00 -2.16 7.72 -0.08 -1.26 -4.91 116.55 109.87 1aje n ASP 65 Ca 0.00 -0.46 -0.23 0.00 -1.51 0.00 0.00 54.79 52.59 1aje n ASP 65 Cb 0.00 -4.16 0.16 0.00 2.34 0.00 0.00 41.12 39.46 1aje n ASP 65 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1aje n ARG 66 N -3.85 2.20 -3.34 -0.67 1.85 -1.26 -4.93 116.66 106.66 1aje n ARG 66 Ca -0.10 -2.84 -0.38 0.00 -1.00 0.00 0.00 57.85 53.53 1aje n ARG 66 Cb 0.59 -2.11 -0.07 0.00 -1.05 0.00 0.00 32.46 29.81 1aje n ARG 66 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1aje s LEU 67 N -3.13 4.20 -0.27 2.89 0.20 -1.26 -4.58 118.68 116.73 1aje s LEU 67 Ca 0.54 0.66 -0.06 0.00 0.69 0.00 0.00 54.13 55.95 1aje s LEU 67 Cb 0.45 -2.62 0.01 0.00 -0.43 0.00 0.00 46.19 43.60 1aje s LEU 67 CO 0.10 -0.07 0.23 -1.14 -0.29 0.00 0.00 176.35 175.19 1aje n ARG 68 N 4.22 -2.15 -2.25 1.98 0.63 -1.26 -4.91 116.66 112.93 1aje n ARG 68 Ca -0.07 1.93 -0.42 0.00 -0.92 0.00 0.00 57.85 58.37 1aje n ARG 68 Cb 0.51 -4.42 -0.03 0.00 0.45 0.00 0.00 32.46 28.97 1aje n ARG 68 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1aje s PRO 69 N -1.72 4.26 0.01 -0.14 0.04 -1.26 -4.92 135.00 131.27 1aje s PRO 69 Ca 0.10 1.92 -0.09 0.00 0.04 0.00 0.00 61.00 62.96 1aje s PRO 69 Cb -0.03 -3.67 -0.31 0.00 0.04 0.00 0.00 34.50 30.53 1aje s PRO 69 CO 0.57 -0.63 0.89 -0.07 0.04 0.00 0.00 177.00 177.80 1aje h LEU 70 N 8.89 0.60 0.00 -3.56 3.38 -1.99 -3.48 115.31 119.14 1aje h LEU 70 Ca -0.36 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 56.87 1aje h LEU 70 Cb 1.16 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1aje h LEU 70 CO 0.92 1.61 0.00 -0.24 0.09 0.00 0.00 178.44 180.82 1aje n SER 71 N -3.58 0.00 -3.92 -0.43 2.88 -1.26 -5.16 113.62 102.15 1aje n SER 71 Ca -0.18 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.16 1aje n SER 71 Cb 1.07 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 64.37 1aje n SER 71 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1aje s TYR 72 N -1.30 0.79 1.02 0.66 1.13 -1.26 -5.15 117.35 113.24 1aje s TYR 72 Ca 0.00 -0.22 -0.15 0.00 -1.41 0.00 0.00 57.07 55.30 1aje s TYR 72 Cb 0.00 -0.66 0.20 0.00 -1.10 0.00 0.00 41.96 40.40 1aje s TYR 72 CO 0.00 -0.17 1.14 -1.25 -2.51 0.00 0.00 175.55 172.76 1aje s PRO 73 N 0.73 0.22 -1.31 -3.49 0.04 -1.26 -4.91 135.00 125.03 1aje s PRO 73 Ca -0.10 0.14 -0.18 0.00 0.04 0.00 0.00 61.00 60.90 1aje s PRO 73 Cb -0.13 -1.75 0.07 0.00 0.04 0.00 0.00 34.50 32.74 1aje s PRO 73 CO 0.01 -2.79 1.76 1.04 0.04 0.00 0.00 177.00 177.05 1aje n GLN 74 N -4.15 3.19 -0.81 4.56 6.02 -1.26 -4.84 117.38 120.08 1aje n GLN 74 Ca 0.09 -3.27 0.00 0.00 -0.01 0.00 0.00 57.00 53.81 1aje n GLN 74 Cb 0.59 -3.47 0.00 0.00 1.02 0.00 0.00 30.24 28.38 1aje n GLN 74 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 1aje n THR 75 N 6.25 0.00 -2.48 5.09 5.66 -1.24 -4.60 114.28 122.97 1aje n THR 75 Ca 0.49 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 61.47 1aje n THR 75 Cb 0.45 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.24 1aje n THR 75 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1aje n ASP 76 N -0.72 -5.86 -4.57 1.09 -0.08 0.03 -4.82 116.55 101.61 1aje n ASP 76 Ca 0.00 0.10 -0.24 0.00 -1.51 0.00 0.00 54.79 53.14 1aje n ASP 76 Cb 0.00 -3.87 0.13 0.00 2.34 0.00 0.00 41.12 39.72 1aje n ASP 76 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1aje s VAL 77 N -2.66 2.01 -0.33 5.18 1.01 0.30 -4.83 120.40 121.09 1aje s VAL 77 Ca 0.06 -0.57 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 1aje s VAL 77 Cb -0.02 -2.44 0.11 0.00 0.00 0.00 0.00 36.38 34.03 1aje s VAL 77 CO 0.50 0.00 0.13 -0.36 0.00 0.00 0.00 175.10 175.36 1aje s PHE 78 N -3.26 1.57 -0.78 5.22 0.40 -0.88 0.48 117.98 120.74 1aje s PHE 78 Ca 0.69 -1.75 -0.22 0.00 -0.60 0.00 0.00 56.93 55.04 1aje s PHE 78 Cb -0.04 -1.63 0.08 0.00 0.51 0.00 0.00 43.02 41.94 1aje s PHE 78 CO 0.46 -0.86 1.11 -0.51 0.70 0.00 0.00 175.22 176.12 1aje s LEU 79 N 1.45 4.26 -0.49 -0.37 1.43 0.20 -1.02 118.68 124.15 1aje s LEU 79 Ca 0.11 -1.22 -0.28 0.00 -1.03 0.00 0.00 54.13 51.72 1aje s LEU 79 Cb -0.18 -2.45 0.03 0.00 0.03 0.00 0.00 46.19 43.61 1aje s LEU 79 CO -0.21 -1.42 1.10 -0.69 0.23 0.00 0.00 176.35 175.36 1aje s VAL 80 N 4.09 4.24 -0.45 -1.59 1.01 0.21 -0.89 120.40 127.01 1aje s VAL 80 Ca 0.29 1.06 -0.27 0.00 0.00 0.00 0.00 61.98 63.06 1aje s VAL 80 Cb -0.11 -4.59 0.03 0.00 0.00 0.00 0.00 36.38 31.71 1aje s VAL 80 CO 0.04 -1.02 1.04 0.00 0.00 0.00 0.00 175.10 175.16 1aje n PHE 82 N 7.47 -0.61 -2.91 0.00 3.72 0.35 -3.51 117.46 121.97 1aje n PHE 82 Ca 0.10 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.38 1aje n PHE 82 Cb 0.49 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.02 1aje n PHE 82 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1aje n SER 83 N 0.00 -2.34 0.00 4.37 3.41 -1.26 -3.59 113.62 114.21 1aje n SER 83 Ca 0.00 -2.93 0.08 0.00 -0.26 0.00 0.00 58.87 55.76 1aje n SER 83 Cb 0.00 1.11 0.37 0.00 -0.26 0.00 0.00 64.21 65.43 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 2.29 0.78 0.29 -3.33 0.31 -1.26 -1.66 118.33 115.74 1aje n VAL 84 Ca 0.17 0.19 0.05 0.00 -0.01 0.00 0.00 64.34 64.75 1aje n VAL 84 Cb 0.57 -0.91 0.20 0.00 -0.91 0.00 0.00 33.84 32.79 1aje n VAL 84 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1aje n VAL 85 N -1.45 1.09 -4.09 2.52 0.24 -1.25 -3.54 118.33 111.85 1aje n VAL 85 Ca 0.05 -0.67 -0.10 0.00 -2.04 0.00 0.00 64.34 61.58 1aje n VAL 85 Cb 0.18 -0.10 -0.08 0.00 -1.47 0.00 0.00 33.84 32.38 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 -0.67 0.03 -0.47 -1.34 0.01 -0.67 -4.67 113.70 105.92 1aje s SER 86 Ca 0.29 -1.14 -0.28 0.00 1.31 0.00 0.00 55.95 56.13 1aje s SER 86 Cb 0.19 0.48 0.03 0.00 0.21 0.00 0.00 66.02 66.93 1aje s SER 86 CO 0.13 -0.99 1.10 -2.16 0.41 0.00 0.00 173.24 171.73 1aje s PRO 87 N -4.08 3.70 -0.05 12.44 0.04 -1.26 -4.01 135.00 141.78 1aje s PRO 87 Ca 0.30 0.50 0.00 0.00 0.04 0.00 0.00 61.00 61.84 1aje s PRO 87 Cb 0.03 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.66 1aje s PRO 87 CO 0.10 -1.35 0.00 0.43 0.04 0.00 0.00 177.00 176.22 1aje n SER 88 N 7.71 -0.89 -0.18 6.66 7.64 -1.26 -4.71 113.62 128.60 1aje n SER 88 Ca 0.11 0.37 -0.10 0.00 1.01 0.00 0.00 58.87 60.26 1aje n SER 88 Cb 0.49 -0.98 0.01 0.00 -1.01 0.00 0.00 64.21 62.72 1aje n SER 88 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1aje h SER 89 N 0.00 0.89 -0.41 6.43 0.02 -1.77 -2.05 113.55 116.66 1aje h SER 89 Ca -0.01 -0.30 0.12 0.00 -0.84 0.00 0.00 61.79 60.75 1aje h SER 89 Cb 0.77 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1aje h SER 89 CO 0.02 0.98 0.95 2.19 -1.14 0.00 0.00 176.83 179.82 1aje h PHE 90 N 0.78 0.00 -0.06 3.45 -0.00 -1.84 0.82 116.94 120.08 1aje h PHE 90 Ca 0.15 0.00 -0.15 0.00 -0.00 0.00 0.00 57.97 57.97 1aje h PHE 90 Cb 0.52 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.46 1aje h PHE 90 CO 0.04 0.00 -0.62 1.49 -0.00 0.00 0.00 178.31 179.22 1aje h GLU 91 N 0.00 0.22 0.00 6.09 4.57 -1.73 -2.58 114.58 121.15 1aje h GLU 91 Ca 0.19 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1aje h GLU 91 Cb 2.08 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 30.70 1aje h GLU 91 CO -0.00 0.77 0.00 -2.95 -1.18 0.00 0.00 179.01 175.65 1aje h ASN 92 N 0.16 0.00 -0.31 1.04 -1.07 0.50 -1.88 115.58 114.03 1aje h ASN 92 Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 56.30 56.36 1aje h ASN 92 Cb 1.13 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 37.36 1aje h ASN 92 CO 0.09 0.00 0.19 0.58 0.07 0.00 0.00 177.43 178.37 1aje h VAL 93 N 0.00 1.09 0.31 6.14 2.07 -1.43 -2.67 116.25 121.76 1aje h VAL 93 Ca 0.00 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1aje h VAL 93 Cb 0.66 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1aje h VAL 93 CO 0.00 0.09 -0.15 0.11 0.02 0.00 0.00 177.57 177.65 1aje h LYS 94 N 0.43 -0.40 0.00 1.57 6.56 -1.38 -2.66 116.57 120.69 1aje h LYS 94 Ca 0.12 0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.73 1aje h LYS 94 Cb -0.02 0.09 0.00 0.00 -0.57 0.00 0.00 32.23 31.73 1aje h LYS 94 CO -0.02 -0.22 0.19 0.93 -2.06 0.00 0.00 179.45 178.26 1aje h GLU 95 N -1.09 0.00 0.00 3.15 5.08 -1.33 -2.96 114.58 117.43 1aje h GLU 95 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1aje h GLU 95 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1aje h GLU 95 CO 0.07 0.00 -0.67 1.17 -1.00 0.00 0.00 179.01 178.58 1aje n LYS 96 N -2.97 0.00 0.10 2.33 4.81 -1.02 -4.64 118.16 116.76 1aje n LYS 96 Ca -0.02 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.19 1aje n LYS 96 Cb 0.24 -0.80 -0.13 0.00 0.02 0.00 0.00 35.03 34.36 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 1.17 0.00 0.00 177.40 177.08 1aje h TRP 97 N 0.00 0.99 -0.41 5.64 4.06 -1.59 -2.71 115.95 121.93 1aje h TRP 97 Ca 0.00 -0.64 -0.14 0.00 2.06 0.00 0.00 58.89 60.17 1aje h TRP 97 Cb 0.67 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 28.75 1aje h TRP 97 CO 0.00 1.48 -0.28 0.28 -3.56 0.00 0.00 178.44 176.37 1aje h VAL 98 N 0.25 1.28 0.00 1.49 2.07 -1.38 0.96 116.25 120.91 1aje h VAL 98 Ca -0.20 -1.44 -0.01 0.00 0.82 0.00 0.00 66.70 65.87 1aje h VAL 98 Cb 1.97 1.30 -0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1aje h VAL 98 CO 0.24 0.49 -0.03 1.55 0.02 0.00 0.00 177.57 179.84 1aje h PRO 99 N 0.73 0.00 0.02 1.57 0.13 -1.65 0.94 132.00 133.73 1aje h PRO 99 Ca 0.08 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.93 1aje h PRO 99 Cb 0.86 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.95 1aje h PRO 99 CO 0.08 0.03 -1.60 0.93 -0.23 0.00 0.00 178.00 177.20 1aje h GLU 100 N 0.00 0.03 0.00 0.86 4.39 -1.02 -3.07 114.58 115.78 1aje h GLU 100 Ca -0.00 -0.06 -0.35 0.00 0.34 0.00 0.00 59.36 59.30 1aje h GLU 100 Cb 0.28 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.89 1aje h GLU 100 CO 0.00 0.66 -2.29 0.44 -1.16 0.00 0.00 179.01 176.66 1aje n ILE 101 N -3.15 1.30 -0.10 3.13 -5.35 0.26 -4.12 119.36 111.32 1aje n ILE 101 Ca -0.15 -0.47 -0.18 0.00 -0.27 0.00 0.00 62.75 61.67 1aje n ILE 101 Cb 1.03 -1.37 -0.08 0.00 -1.74 0.00 0.00 39.64 37.49 1aje n ILE 101 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1aje n THR 102 N -3.28 1.50 -0.19 7.28 -2.24 0.32 0.16 114.28 117.83 1aje n THR 102 Ca -0.41 -0.03 0.17 0.00 -2.27 0.00 0.00 64.05 61.51 1aje n THR 102 Cb 0.91 -2.12 0.51 0.00 -2.10 0.00 0.00 70.33 67.53 1aje n THR 102 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1aje h HIS 103 N -1.00 0.49 0.00 4.78 3.86 -1.41 0.53 115.15 122.40 1aje h HIS 103 Ca -0.31 0.01 -0.16 0.00 -1.16 0.00 0.00 60.37 58.76 1aje h HIS 103 Cb 1.15 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 29.45 1aje h HIS 103 CO -0.08 0.17 -1.06 0.72 0.86 0.00 0.00 177.93 178.54 1aje n HIS 104 N -4.48 0.92 -3.43 2.45 -0.00 -1.16 -4.63 115.22 104.88 1aje n HIS 104 Ca 0.16 0.40 -0.28 0.00 -0.00 0.00 0.00 57.72 58.00 1aje n HIS 104 Cb 0.60 -0.97 -0.08 0.00 -0.00 0.00 0.00 29.99 29.54 1aje n HIS 104 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1aje n PRO 106 N 0.90 3.68 -0.04 0.00 -0.04 0.18 -4.03 135.00 135.66 1aje n PRO 106 Ca 0.29 -2.24 -0.13 0.00 -0.04 0.00 0.00 63.50 61.38 1aje n PRO 106 Cb 0.41 -2.73 -0.11 0.00 -0.04 0.00 0.00 33.50 31.02 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 4.83 -0.01 0.00 0.54 1.79 -1.85 -3.49 116.57 118.39 1aje h LYS 107 Ca 0.82 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.29 1aje h LYS 107 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1aje h LYS 107 CO 1.66 0.74 0.00 2.41 -1.08 0.00 0.00 179.45 183.18 1aje n THR 108 N -4.73 0.00 -1.60 -0.16 -1.04 -1.26 -5.10 114.28 100.39 1aje n THR 108 Ca -0.09 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.54 1aje n THR 108 Cb 0.37 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.85 1aje n THR 108 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1aje s PRO 109 N 0.00 2.33 -0.25 -2.82 0.04 -1.20 -4.50 135.00 128.59 1aje s PRO 109 Ca 0.00 1.47 -0.03 0.00 0.04 0.00 0.00 61.00 62.48 1aje s PRO 109 Cb 0.00 -4.53 0.08 0.00 0.04 0.00 0.00 34.50 30.09 1aje s PRO 109 CO 0.00 -3.02 0.10 0.12 0.04 0.00 0.00 177.00 174.23 1aje s PHE 110 N 11.27 0.74 -0.26 0.56 2.19 -1.26 -2.08 117.98 129.15 1aje s PHE 110 Ca 0.96 -0.96 -0.02 0.00 0.33 0.00 0.00 56.93 57.25 1aje s PHE 110 Cb -0.20 -1.06 0.03 0.00 -1.31 0.00 0.00 43.02 40.48 1aje s PHE 110 CO 0.27 -0.74 -0.05 -0.51 1.83 0.00 0.00 175.22 176.03 1aje s LEU 111 N 1.95 3.29 -0.58 6.12 1.43 -0.19 0.35 118.68 131.06 1aje s LEU 111 Ca 0.06 -0.91 -0.22 0.00 -1.03 0.00 0.00 54.13 52.03 1aje s LEU 111 Cb -0.16 -1.68 0.06 0.00 0.03 0.00 0.00 46.19 44.44 1aje s LEU 111 CO -0.23 -0.14 0.85 -0.22 0.23 0.00 0.00 176.35 176.83 1aje s LEU 112 N 1.32 4.52 -0.03 1.79 2.96 -0.58 -0.62 118.68 128.05 1aje s LEU 112 Ca -0.00 -0.78 0.06 0.00 -0.22 0.00 0.00 54.13 53.18 1aje s LEU 112 Cb -0.17 -2.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.95 1aje s LEU 112 CO -0.04 -1.20 -0.20 -0.69 -1.32 0.00 0.00 176.35 172.90 1aje s VAL 113 N 3.54 1.62 0.83 1.68 1.01 -0.94 0.21 120.40 128.35 1aje s VAL 113 Ca 0.22 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 1aje s VAL 113 Cb -0.17 -1.36 0.10 0.00 0.00 0.00 0.00 36.38 34.95 1aje s VAL 113 CO 0.13 0.46 1.18 -0.83 0.00 0.00 0.00 175.10 176.05 1aje s GLY 114 N -0.33 2.02 0.00 4.51 0.00 -0.82 0.13 107.32 112.82 1aje s GLY 114 Ca 0.04 0.75 0.00 0.00 0.00 0.00 0.00 44.72 45.51 1aje s GLY 114 CO 0.00 1.17 0.00 -1.30 0.00 0.00 0.00 173.10 172.97 1aje n THR 115 N -3.54 0.00 -3.64 0.90 -2.24 -1.24 -4.54 114.28 99.98 1aje n THR 115 Ca 0.13 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.63 1aje n THR 115 Cb 0.51 -0.78 -0.10 0.00 -2.10 0.00 0.00 70.33 67.86 1aje n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aje n GLN 116 N 0.00 1.90 0.00 -0.78 3.00 -1.26 -3.82 117.38 116.42 1aje n GLN 116 Ca 0.00 -4.38 0.00 0.00 -0.01 0.00 0.00 57.00 52.61 1aje n GLN 116 Cb 0.00 -2.17 0.00 0.00 0.00 0.00 0.00 30.24 28.07 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 1.58 0.00 -3.26 5.09 5.41 -1.26 -1.13 119.36 125.79 1aje n ILE 117 Ca 0.25 0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.77 1aje n ILE 117 Cb 0.39 -0.04 -0.08 0.00 -0.71 0.00 0.00 39.64 39.21 1aje n ILE 117 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1aje s ASP 118 N -0.19 0.83 -0.89 4.38 2.15 -1.26 -4.60 116.67 117.08 1aje s ASP 118 Ca 0.00 -2.75 0.00 0.00 0.43 0.00 0.00 52.55 50.23 1aje s ASP 118 Cb 0.00 0.07 0.00 0.00 -0.30 0.00 0.00 42.92 42.69 1aje s ASP 118 CO 0.00 -0.15 0.00 0.18 -0.17 0.00 0.00 175.17 175.03 1aje n LEU 119 N 2.91 -0.48 -0.28 -1.34 7.99 -1.24 -4.80 117.00 119.75 1aje n LEU 119 Ca 0.27 0.21 0.28 0.00 -0.01 0.00 0.00 56.01 56.76 1aje n LEU 119 Cb 0.49 -1.71 0.52 0.00 -0.11 0.00 0.00 43.42 42.61 1aje n LEU 119 CO 0.06 -0.57 0.93 -2.11 -1.51 0.00 0.00 177.39 174.19 1aje n ARG 120 N -2.24 -0.05 0.00 3.23 1.85 -0.28 -3.84 116.66 115.33 1aje n ARG 120 Ca -0.08 1.21 0.00 0.00 -1.00 0.00 0.00 57.85 57.97 1aje n ARG 120 Cb 0.34 -2.17 0.00 0.00 -1.05 0.00 0.00 32.46 29.58 1aje n ARG 120 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1aje n ASP 121 N -4.97 0.00 0.00 2.89 2.03 -1.26 -4.91 116.55 110.32 1aje n ASP 121 Ca 0.33 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.64 1aje n ASP 121 Cb 1.13 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.53 1aje n ASP 121 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1aje n ASP 122 N 0.00 0.00 0.20 1.67 9.92 -1.25 0.84 116.55 127.93 1aje n ASP 122 Ca 0.00 0.00 0.14 0.00 -0.53 0.00 0.00 54.79 54.40 1aje n ASP 122 Cb 0.00 0.00 0.54 0.00 -0.64 0.00 0.00 41.12 41.02 1aje n ASP 122 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1aje h PRO 123 N 0.00 0.00 0.74 -0.24 0.13 -1.94 -3.24 132.00 127.45 1aje h PRO 123 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1aje h PRO 123 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1aje h PRO 123 CO 0.00 0.00 -0.40 1.03 -0.23 0.00 0.00 178.00 178.40 1aje h SER 124 N 0.00 -0.98 0.80 1.44 0.87 -1.90 -3.02 113.55 110.77 1aje h SER 124 Ca 0.00 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 1aje h SER 124 Cb 0.51 0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.74 1aje h SER 124 CO 0.00 -0.64 -0.06 0.00 -0.53 0.00 0.00 176.83 175.59 1aje h THR 125 N -1.05 0.19 -0.85 2.23 1.03 0.41 -3.26 112.91 111.62 1aje h THR 125 Ca -0.10 -0.59 0.16 0.00 -0.01 0.00 0.00 66.41 65.88 1aje h THR 125 Cb 0.82 1.49 -0.16 0.00 -1.07 0.00 0.00 68.15 69.23 1aje h THR 125 CO 0.13 0.06 -0.26 0.40 -0.01 0.00 0.00 175.52 175.85 1aje h ILE 126 N 0.00 0.12 -0.92 0.00 1.08 -1.55 1.46 117.51 117.70 1aje h ILE 126 Ca -0.00 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.49 1aje h ILE 126 Cb 0.48 0.12 -0.05 0.00 -3.07 0.00 0.00 36.82 34.30 1aje h ILE 126 CO 0.01 0.00 0.61 -0.33 -0.69 0.00 0.00 178.15 177.74 1aje h GLU 127 N -0.02 1.17 -0.91 2.37 5.08 -1.70 1.65 114.58 122.22 1aje h GLU 127 Ca 0.38 -0.07 0.24 0.00 -1.00 0.00 0.00 59.36 58.91 1aje h GLU 127 Cb 0.62 -0.26 -0.13 0.00 0.50 0.00 0.00 28.75 29.47 1aje h GLU 127 CO -0.88 0.77 0.40 -0.22 -1.00 0.00 0.00 179.01 178.09 1aje h LYS 128 N 1.20 0.36 0.00 2.33 1.63 0.18 -3.38 116.57 118.90 1aje h LYS 128 Ca 0.35 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.13 1aje h LYS 128 Cb -0.07 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.48 1aje h LYS 128 CO -0.09 0.24 0.00 1.28 -3.45 0.00 0.00 179.45 177.43 1aje n LEU 129 N -5.07 0.30 0.00 5.20 4.32 -0.60 -5.02 117.00 116.13 1aje n LEU 129 Ca 0.23 0.12 0.00 0.00 -0.02 0.00 0.00 56.01 56.34 1aje n LEU 129 Cb 0.71 -0.03 0.00 0.00 -1.62 0.00 0.00 43.42 42.47 1aje n LEU 129 CO 0.11 -0.62 0.00 0.00 -1.22 0.00 0.00 177.39 175.66 1aje n ALA 130 N -2.95 0.00 0.70 -1.18 0.00 0.55 -4.77 120.51 112.87 1aje n ALA 130 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1aje n ALA 130 Cb 0.00 -1.17 0.48 0.00 0.00 0.00 0.00 19.45 18.76 1aje n ALA 130 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1aje n LYS 131 N 0.07 0.14 -0.10 0.00 4.01 -1.26 -2.04 118.16 118.98 1aje n LYS 131 Ca 0.00 0.18 0.03 0.00 -0.51 0.00 0.00 58.31 58.02 1aje n LYS 131 Cb 0.38 -1.69 0.09 0.00 -0.51 0.00 0.00 35.03 33.30 1aje n LYS 131 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1aje n ASN 132 N -1.95 2.52 -2.25 4.39 3.02 -1.26 -4.96 115.26 114.77 1aje n ASN 132 Ca 0.05 -1.97 -0.10 0.00 -0.03 0.00 0.00 54.58 52.54 1aje n ASN 132 Cb 0.35 -0.13 -0.01 0.00 -0.61 0.00 0.00 39.78 39.37 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 0.13 -2.19 0.00 3.52 4.76 -0.86 -4.10 118.16 119.41 1aje n LYS 133 Ca 0.07 0.48 0.00 0.00 -2.87 0.00 0.00 58.31 55.99 1aje n LYS 133 Cb 0.35 -4.99 0.00 0.00 -1.84 0.00 0.00 35.03 28.55 1aje n LYS 133 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1aje n GLN 134 N -2.55 0.00 -3.66 1.97 1.13 -1.26 -5.02 117.38 107.99 1aje n GLN 134 Ca -0.11 0.00 -0.24 0.00 -1.94 0.00 0.00 57.00 54.71 1aje n GLN 134 Cb 0.54 0.00 0.06 0.00 0.11 0.00 0.00 30.24 30.95 1aje n GLN 134 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1aje n LYS 135 N 0.00 -6.61 -3.23 -1.09 4.01 -1.26 -4.68 118.16 105.30 1aje n LYS 135 Ca 0.00 0.74 -0.46 0.00 -0.51 0.00 0.00 58.31 58.08 1aje n LYS 135 Cb 0.00 -5.67 -0.03 0.00 -0.51 0.00 0.00 35.03 28.82 1aje n LYS 135 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1aje s PRO 136 N -6.13 3.39 -0.46 1.97 0.04 -1.26 -2.62 135.00 129.93 1aje s PRO 136 Ca 0.39 -2.03 -0.42 0.00 0.04 0.00 0.00 61.00 58.97 1aje s PRO 136 Cb -0.18 -4.45 -0.17 0.00 0.04 0.00 0.00 34.50 29.74 1aje s PRO 136 CO 0.77 -1.41 2.07 -0.89 0.04 0.00 0.00 177.00 177.58 1aje n ILE 137 N 4.69 0.05 -1.03 0.56 -0.00 -1.23 -4.84 119.36 117.56 1aje n ILE 137 Ca 0.06 -0.05 -0.31 0.00 -0.00 0.00 0.00 62.75 62.45 1aje n ILE 137 Cb 0.45 -0.75 0.13 0.00 -0.00 0.00 0.00 39.64 39.46 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 5.82 2.79 -1.04 1.39 2.01 -1.26 -4.83 115.64 120.52 1aje s THR 138 Ca 1.15 0.26 0.07 0.00 0.31 0.00 0.00 61.69 63.49 1aje s THR 138 Cb -1.36 -2.56 0.07 0.00 0.01 0.00 0.00 72.50 68.66 1aje s THR 138 CO 0.64 -0.33 1.23 -0.81 -0.69 0.00 0.00 174.62 174.66 1aje n PRO 139 N -3.84 0.01 -0.01 4.92 -0.04 -1.26 -0.80 135.00 133.97 1aje n PRO 139 Ca 0.10 0.36 0.09 0.00 -0.04 0.00 0.00 63.50 64.01 1aje n PRO 139 Cb 0.53 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.33 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 -1.48 0.63 0.02 0.54 -0.58 -1.26 -3.99 120.64 114.53 1aje n GLU 140 Ca 0.02 -0.18 -0.01 0.00 -0.42 0.00 0.00 57.16 56.57 1aje n GLU 140 Cb 0.08 -1.48 -0.00 0.00 -0.57 0.00 0.00 31.44 29.47 1aje n GLU 140 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1aje h THR 141 N 0.00 0.00 -0.36 2.62 2.02 -1.29 0.64 112.91 116.54 1aje h THR 141 Ca -0.03 -0.02 0.07 0.00 0.77 0.00 0.00 66.41 67.21 1aje h THR 141 Cb 0.99 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.33 1aje h THR 141 CO 0.00 0.00 -0.09 0.00 0.37 0.00 0.00 175.52 175.80 1aje h ALA 142 N -1.95 0.23 -0.72 6.16 0.00 -1.80 0.10 119.26 121.28 1aje h ALA 142 Ca -0.01 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1aje h ALA 142 Cb 0.05 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1aje h ALA 142 CO 0.01 -0.46 0.48 0.93 0.00 0.00 0.00 179.25 180.21 1aje h GLU 143 N -0.01 0.94 -0.86 0.00 5.08 -1.69 0.13 114.58 118.18 1aje h GLU 143 Ca 0.17 -0.06 0.15 0.00 -1.00 0.00 0.00 59.36 58.63 1aje h GLU 143 Cb 0.27 -0.21 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 1aje h GLU 143 CO -0.37 0.62 0.56 -0.22 -1.00 0.00 0.00 179.01 178.60 1aje h LYS 144 N 0.97 0.56 0.00 2.33 3.64 0.29 -2.08 116.57 122.29 1aje h LYS 144 Ca 0.27 -0.03 -0.38 0.00 -1.27 0.00 0.00 60.65 59.24 1aje h LYS 144 Cb -0.10 -0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 31.53 1aje h LYS 144 CO -0.06 0.37 -2.41 1.47 -2.27 0.00 0.00 179.45 176.55 1aje n LEU 145 N -4.54 1.02 0.28 5.20 -0.00 -0.57 -3.79 117.00 114.61 1aje n LEU 145 Ca 0.17 -0.04 0.15 0.00 -0.00 0.00 0.00 56.01 56.29 1aje n LEU 145 Cb 0.52 0.01 0.90 0.00 -0.00 0.00 0.00 43.42 44.85 1aje n LEU 145 CO 0.30 0.65 1.13 0.00 -0.00 0.00 0.00 177.39 179.47 1aje h ALA 146 N 0.66 1.58 0.00 1.47 0.00 -0.64 2.26 119.26 124.59 1aje h ALA 146 Ca -0.56 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.25 1aje h ALA 146 Cb 2.13 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 1aje h ALA 146 CO -0.01 -0.05 -0.50 -0.09 0.00 0.00 0.00 179.25 178.60 1aje h ARG 147 N 0.00 0.00 0.00 0.00 2.43 -1.54 1.43 114.38 116.70 1aje h ARG 147 Ca 0.01 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 1aje h ARG 147 Cb 0.08 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1aje h ARG 147 CO -0.00 0.50 -0.35 -0.44 -1.51 0.00 0.00 179.97 178.17 1aje h ASP 148 N 0.00 0.00 0.00 -3.80 3.32 0.36 -3.36 116.42 112.94 1aje h ASP 148 Ca -0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1aje h ASP 148 Cb 1.03 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 1aje h ASP 148 CO 0.06 0.35 -1.41 0.18 -1.72 0.00 0.00 179.24 176.70 1aje n LEU 149 N -3.27 1.57 -2.86 1.55 4.77 -0.38 -5.04 117.00 113.34 1aje n LEU 149 Ca 0.02 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.85 1aje n LEU 149 Cb 0.61 -0.07 0.06 0.00 -2.33 0.00 0.00 43.42 41.69 1aje n LEU 149 CO 0.37 0.40 0.05 0.29 -1.33 0.00 0.00 177.39 177.17 1aje n LYS 150 N -2.48 -3.19 0.00 3.23 4.01 0.49 -5.00 118.16 115.22 1aje n LYS 150 Ca -0.11 0.67 0.00 0.00 -0.51 0.00 0.00 58.31 58.35 1aje n LYS 150 Cb 0.66 -4.96 0.00 0.00 -0.51 0.00 0.00 35.03 30.23 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 -3.09 0.00 0.02 7.82 0.00 -1.26 -4.87 120.51 119.15 1aje n ALA 151 Ca -0.13 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.09 1aje n ALA 151 Cb 0.61 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.92 1aje n ALA 151 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1aje h VAL 152 N 0.00 0.85 -1.50 0.00 2.07 0.58 -3.46 116.25 114.79 1aje h VAL 152 Ca 0.00 -2.41 0.10 0.00 0.82 0.00 0.00 66.70 65.21 1aje h VAL 152 Cb 0.00 2.64 -0.28 0.00 -1.52 0.00 0.00 31.29 32.13 1aje h VAL 152 CO 0.00 0.80 0.50 -0.75 0.02 0.00 0.00 177.57 178.14 1aje s LYS 153 N -2.53 0.40 -0.16 1.57 2.36 -1.09 -5.00 119.74 115.29 1aje s LYS 153 Ca -0.20 0.53 -0.04 0.00 -2.55 0.00 0.00 55.97 53.71 1aje s LYS 153 Cb 0.06 0.17 -0.03 0.00 -1.05 0.00 0.00 37.83 36.98 1aje s LYS 153 CO 0.79 -0.06 -0.04 -0.47 1.55 0.00 0.00 175.35 177.12 1aje s TYR 154 N 0.51 3.01 0.33 4.03 5.04 -1.26 -1.52 117.35 127.48 1aje s TYR 154 Ca 0.00 -0.37 0.04 0.00 -2.44 0.00 0.00 57.07 54.31 1aje s TYR 154 Cb -0.05 -1.97 -0.02 0.00 0.35 0.00 0.00 41.96 40.27 1aje s TYR 154 CO -0.10 -0.10 0.33 0.14 -1.34 0.00 0.00 175.55 174.49 1aje s VAL 155 N 0.49 0.00 -0.02 3.14 -7.23 0.13 -4.97 120.40 111.94 1aje s VAL 155 Ca -0.03 -1.87 -0.01 0.00 -1.81 0.00 0.00 61.98 58.25 1aje s VAL 155 Cb -0.14 -2.55 0.01 0.00 0.56 0.00 0.00 36.38 34.26 1aje s VAL 155 CO 0.03 0.00 0.05 -1.83 -0.31 0.00 0.00 175.10 173.03 1aje s GLU 156 N -3.34 0.03 0.00 4.82 -1.05 -1.26 -1.95 118.70 115.95 1aje s GLU 156 Ca 0.38 0.11 0.00 0.00 -0.15 0.00 0.00 54.97 55.30 1aje s GLU 156 Cb 0.02 -0.05 0.00 0.00 -0.44 0.00 0.00 34.13 33.66 1aje s GLU 156 CO 0.25 -0.05 0.00 0.00 0.95 0.00 0.00 175.26 176.41 1aje n SER 158 N 0.00 -0.45 -0.24 0.00 2.88 -1.26 -4.56 113.62 109.99 1aje n SER 158 Ca 0.00 1.14 0.08 0.00 -1.33 0.00 0.00 58.87 58.77 1aje n SER 158 Cb 0.00 -1.04 0.17 0.00 -0.75 0.00 0.00 64.21 62.59 1aje n SER 158 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aje n ALA 159 N 0.23 0.29 0.08 -1.46 0.00 -1.25 0.25 120.51 118.65 1aje n ALA 159 Ca 0.16 0.75 0.11 0.00 0.00 0.00 0.00 53.44 54.46 1aje n ALA 159 Cb 0.25 -0.51 -0.07 0.00 0.00 0.00 0.00 19.45 19.12 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 -5.00 0.48 0.08 0.00 -0.00 -1.26 -4.50 117.00 106.81 1aje n LEU 160 Ca 0.15 0.17 -0.06 0.00 -0.00 0.00 0.00 56.01 56.26 1aje n LEU 160 Cb 0.47 -0.04 -0.04 0.00 -0.00 0.00 0.00 43.42 43.82 1aje n LEU 160 CO -0.06 -0.10 0.51 0.74 -0.00 0.00 0.00 177.39 178.48 1aje h THR 161 N 0.00 0.00 -0.32 1.47 2.02 -0.49 -3.47 112.91 112.12 1aje h THR 161 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1aje h THR 161 Cb 0.98 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1aje h THR 161 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89 1aje n GLN 162 N -3.50 0.00 0.18 6.66 1.13 -1.19 -4.96 117.38 115.70 1aje n GLN 162 Ca -0.04 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.15 1aje n GLN 162 Cb 0.16 -2.31 0.40 0.00 0.11 0.00 0.00 30.24 28.60 1aje n GLN 162 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 1aje h LYS 163 N 0.00 0.00 0.00 -1.09 2.10 -1.87 -3.39 116.57 112.32 1aje h LYS 163 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1aje h LYS 163 Cb 0.75 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.08 1aje h LYS 163 CO 0.00 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 177.86 1aje n GLY 164 N 0.78 0.68 0.32 0.07 0.00 -1.26 -4.97 105.19 100.82 1aje n GLY 164 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 1aje n GLY 164 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1aje h LEU 165 N 0.00 0.95 -0.55 0.99 3.38 -1.86 0.61 115.31 118.83 1aje h LEU 165 Ca 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1aje h LEU 165 Cb 0.68 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1aje h LEU 165 CO 0.00 0.89 0.00 1.17 0.09 0.00 0.00 178.44 180.59 1aje n LYS 166 N -4.27 0.10 -0.10 1.13 4.81 -1.26 0.19 118.16 118.76 1aje n LYS 166 Ca 0.05 0.43 -0.21 0.00 -0.87 0.00 0.00 58.31 57.71 1aje n LYS 166 Cb 0.22 -1.73 -0.11 0.00 0.02 0.00 0.00 35.03 33.43 1aje n LYS 166 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1aje n ASN 167 N -1.94 1.86 0.27 3.14 5.15 0.12 -1.84 115.26 122.01 1aje n ASN 167 Ca 0.02 0.44 -0.16 0.00 -0.60 0.00 0.00 54.58 54.27 1aje n ASN 167 Cb 0.14 -0.96 -0.08 0.00 -0.53 0.00 0.00 39.78 38.36 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 -1.00 0.34 -1.01 3.44 2.07 0.65 1.32 116.25 122.06 1aje h VAL 168 Ca -0.33 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.49 1aje h VAL 168 Cb 1.24 0.34 -0.14 0.00 -1.52 0.00 0.00 31.29 31.21 1aje h VAL 168 CO -0.20 0.00 0.59 -0.26 0.02 0.00 0.00 177.57 177.72 1aje h PHE 169 N -0.76 0.95 -0.02 1.57 0.04 0.19 3.98 116.94 122.88 1aje h PHE 169 Ca -0.05 0.04 -0.15 0.00 2.80 0.00 0.00 57.97 60.61 1aje h PHE 169 Cb 0.64 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 1aje h PHE 169 CO -0.13 -0.08 -0.68 0.38 -0.60 0.00 0.00 178.31 177.19 1aje h ASP 170 N 0.41 0.12 0.26 2.17 3.04 0.02 -2.86 116.42 119.59 1aje h ASP 170 Ca 0.70 -0.08 -0.01 0.00 -3.24 0.00 0.00 57.03 54.40 1aje h ASP 170 Cb 1.53 -0.03 0.00 0.00 -1.04 0.00 0.00 39.33 39.79 1aje h ASP 170 CO -0.55 0.76 -0.13 -0.33 -2.04 0.00 0.00 179.24 176.96 1aje h GLU 171 N 0.07 -0.34 -0.94 4.15 4.39 1.62 0.91 114.58 124.43 1aje h GLU 171 Ca -0.01 0.02 0.25 0.00 0.34 0.00 0.00 59.36 59.96 1aje h GLU 171 Cb 1.21 0.08 -0.17 0.00 -0.10 0.00 0.00 28.75 29.77 1aje h GLU 171 CO 0.10 0.00 0.03 0.00 -1.16 0.00 0.00 179.01 177.98 1aje h ALA 172 N -0.52 1.09 -0.18 3.43 0.00 0.42 3.18 119.26 126.69 1aje h ALA 172 Ca -0.04 0.32 -0.15 0.00 0.00 0.00 0.00 54.91 55.04 1aje h ALA 172 Cb 0.50 0.55 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1aje h ALA 172 CO 0.06 -0.53 -0.46 0.82 0.00 0.00 0.00 179.25 179.13 1aje h ILE 173 N 0.04 1.33 0.00 0.00 5.03 -1.45 -0.59 117.51 121.87 1aje h ILE 173 Ca 0.56 -1.71 0.00 0.00 -0.12 0.00 0.00 64.86 63.59 1aje h ILE 173 Cb 1.12 1.94 0.00 0.00 -3.03 0.00 0.00 36.82 36.85 1aje h ILE 173 CO -0.86 0.53 0.00 -0.11 -0.68 0.00 0.00 178.15 177.03 1aje n LEU 174 N -4.20 0.19 -0.01 1.44 -0.00 0.36 -0.19 117.00 114.59 1aje n LEU 174 Ca -0.06 0.56 0.11 0.00 -0.00 0.00 0.00 56.01 56.61 1aje n LEU 174 Cb 0.57 -0.55 -0.16 0.00 -0.00 0.00 0.00 43.42 43.29 1aje n LEU 174 CO 0.47 -0.43 -0.63 0.00 -0.00 0.00 0.00 177.39 176.79 1aje n ALA 175 N -1.58 3.11 0.20 1.96 0.00 0.97 0.09 120.51 125.25 1aje n ALA 175 Ca 0.02 -0.52 0.11 0.00 0.00 0.00 0.00 53.44 53.05 1aje n ALA 175 Cb 0.13 -0.73 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 1aje n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aje n ALA 176 N -2.11 2.83 0.00 0.00 0.00 0.43 -3.26 120.51 118.41 1aje n ALA 176 Ca -0.03 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1aje n ALA 176 Cb 0.51 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 -2.37 0.00 -0.06 0.00 -0.00 0.74 -3.62 117.00 111.69 1aje n LEU 177 Ca -0.01 -0.15 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 1aje n LEU 177 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.95 1aje n LEU 177 CO 0.42 0.00 0.00 -1.84 -0.00 0.00 0.00 177.39 175.97 1aje n GLU 178 N -0.40 0.00 -3.09 1.47 0.28 0.11 -4.83 120.64 114.19 1aje n GLU 178 Ca 0.00 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.65 1aje n GLU 178 Cb 0.00 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 32.81 1aje n GLU 178 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1aje s PRO 179 N 0.00 4.18 -1.15 3.44 0.04 -1.26 -4.95 135.00 135.30 1aje s PRO 179 Ca 0.00 0.83 -0.23 0.00 0.04 0.00 0.00 61.00 61.65 1aje s PRO 179 Cb 0.00 -2.70 -0.10 0.00 0.04 0.00 0.00 34.50 31.74 1aje s PRO 179 CO 0.00 0.30 1.93 -0.35 0.04 0.00 0.00 177.00 178.92 1aje n PRO 180 N 0.31 1.59 -3.81 0.56 -0.04 -1.26 -4.79 135.00 127.55 1aje n PRO 180 Ca 0.00 -2.41 -0.28 0.00 -0.04 0.00 0.00 63.50 60.76 1aje n PRO 180 Cb 0.52 -3.66 -0.11 0.00 -0.04 0.00 0.00 33.50 30.20 1aje n PRO 180 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1aje n GLU 181 N 8.16 2.01 0.00 0.54 -0.00 -1.26 -5.05 120.64 125.04 1aje n GLU 181 Ca 0.45 -4.53 0.00 0.00 -0.00 0.00 0.00 57.16 53.09 1aje n GLU 181 Cb 0.46 -2.29 0.00 0.00 -0.00 0.00 0.00 31.44 29.61 1aje n GLU 181 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 1aje n PRO 182 N 1.79 3.05 -3.12 3.44 -0.04 -1.26 -5.01 135.00 133.86 1aje n PRO 182 Ca 0.22 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.23 1aje n PRO 182 Cb 0.36 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.82 1aje n PRO 182 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1aje n LYS 183 N 0.00 3.47 -3.74 0.54 4.76 -1.26 -4.96 118.16 116.97 1aje n LYS 183 Ca 0.00 -4.13 -0.14 0.00 -2.87 0.00 0.00 58.31 51.17 1aje n LYS 183 Cb 0.00 -2.81 -0.09 0.00 -1.84 0.00 0.00 35.03 30.29 1aje n LYS 183 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1aje s LYS 184 N 0.17 0.66 -0.02 1.97 2.47 -1.26 -5.16 119.74 118.57 1aje s LYS 184 Ca 0.37 -0.01 0.08 0.00 -1.56 0.00 0.00 55.97 54.85 1aje s LYS 184 Cb -0.06 0.30 -0.02 0.00 -1.46 0.00 0.00 37.83 36.59 1aje s LYS 184 CO -0.03 -0.17 -0.25 0.45 0.16 0.00 0.00 175.35 175.50 1aje s SER 185 N -1.00 3.00 -0.70 1.43 0.15 -1.26 -5.08 113.70 110.24 1aje s SER 185 Ca -0.11 -0.47 0.05 0.00 0.70 0.00 0.00 55.95 56.13 1aje s SER 185 Cb -0.04 -0.38 0.19 0.00 -1.71 0.00 0.00 66.02 64.07 1aje s SER 185 CO 0.04 0.31 0.55 0.54 1.20 0.00 0.00 173.24 175.88 1aje n ARG 186 N 2.50 1.99 0.00 5.44 1.74 -1.26 -5.28 116.66 121.79 1aje n ARG 186 Ca -0.16 -4.54 0.16 0.00 -0.77 0.00 0.00 57.85 52.54 1aje n ARG 186 Cb 0.51 -2.28 0.93 0.00 -1.02 0.00 0.00 32.46 30.60 1aje n ARG 186 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65