#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 4.86 0.17 1.61 1.04 -1.26 -5.06 113.70 115.06 1aje s SER -6 Ca 0.00 1.81 0.05 0.00 0.48 0.00 0.00 55.95 58.29 1aje s SER -6 Cb 0.00 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 63.55 1aje s SER -6 CO 0.00 -1.79 -0.10 -0.54 0.98 0.00 0.00 173.24 171.78 1aje s LYS -5 N -4.75 1.15 1.00 4.02 1.02 -1.26 -5.12 119.74 115.79 1aje s LYS -5 Ca 0.62 -1.50 -0.21 0.00 0.02 0.00 0.00 55.97 54.89 1aje s LYS -5 Cb -0.17 -0.74 -0.17 0.00 -0.52 0.00 0.00 37.83 36.23 1aje s LYS -5 CO 0.52 0.09 -1.08 -0.89 -0.92 0.00 0.00 175.35 173.07 1aje n ILE -4 N -0.26 0.00 -0.73 2.17 -0.00 -1.26 -4.84 119.36 114.45 1aje n ILE -4 Ca -0.09 -0.32 -0.30 0.00 -0.00 0.00 0.00 62.75 62.04 1aje n ILE -4 Cb 0.61 -0.00 0.12 0.00 -0.00 0.00 0.00 39.64 40.37 1aje n ILE -4 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1aje n ILE -3 N -2.86 0.00 -0.49 1.39 -0.00 -1.26 -5.00 119.36 111.14 1aje n ILE -3 Ca -0.02 -0.16 0.00 0.00 -0.00 0.00 0.00 62.75 62.57 1aje n ILE -3 Cb 0.63 -0.40 0.00 0.00 -0.00 0.00 0.00 39.64 39.87 1aje n ILE -3 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 1aje n SER -2 N -0.06 0.00 -3.23 4.38 2.88 -1.26 -4.98 113.62 111.35 1aje n SER -2 Ca 0.01 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.27 1aje n SER -2 Cb 0.58 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.02 1aje n SER -2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aje n ALA -1 N 0.00 5.73 -1.71 -1.46 0.00 -1.24 -4.09 120.51 117.74 1aje n ALA -1 Ca 0.00 -2.55 -0.22 0.00 0.00 0.00 0.00 53.44 50.67 1aje n ALA -1 Cb 0.00 -3.14 0.08 0.00 0.00 0.00 0.00 19.45 16.39 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 4.00 2.95 -0.01 0.00 3.85 -1.26 -4.57 117.12 122.08 1aje n MET 1 Ca 0.57 -3.71 -0.01 0.00 -1.00 0.00 0.00 57.70 53.55 1aje n MET 1 Cb 0.17 -2.17 -0.01 0.00 -1.05 0.00 0.00 33.22 30.16 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 -0.86 1.89 -3.00 3.17 1.13 -1.26 -4.93 117.38 113.52 1aje n GLN 2 Ca 0.46 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.52 1aje n GLN 2 Cb 0.90 -1.03 -0.00 0.00 0.11 0.00 0.00 30.24 30.22 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 -2.30 -1.91 -3.84 5.09 -2.24 -1.26 -4.84 114.28 103.00 1aje n THR 3 Ca -0.02 0.22 -0.36 0.00 -2.27 0.00 0.00 64.05 61.62 1aje n THR 3 Cb 0.53 -2.78 -0.13 0.00 -2.10 0.00 0.00 70.33 65.85 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 -0.05 3.59 -0.34 2.28 1.09 0.42 -4.67 121.20 123.51 1aje s ILE 4 Ca -0.02 -0.75 -0.15 0.00 -1.10 0.00 0.00 60.65 58.63 1aje s ILE 4 Cb 0.00 -2.81 -0.01 0.00 -1.06 0.00 0.00 42.46 38.57 1aje s ILE 4 CO 0.06 0.16 0.34 -0.54 -0.10 0.00 0.00 174.94 174.87 1aje s LYS 5 N 1.45 3.54 -0.11 2.79 -0.14 -1.25 0.16 119.74 126.18 1aje s LYS 5 Ca 0.02 -0.46 -0.13 0.00 -1.36 0.00 0.00 55.97 54.04 1aje s LYS 5 Cb -0.17 -3.81 -0.05 0.00 -1.68 0.00 0.00 37.83 32.13 1aje s LYS 5 CO -0.00 -0.52 0.29 0.00 -0.76 0.00 0.00 175.35 174.36 1aje s VAL 7 N -0.23 4.21 0.12 0.00 1.01 -0.19 -0.52 120.40 124.80 1aje s VAL 7 Ca 0.18 -1.78 -0.30 0.00 0.00 0.00 0.00 61.98 60.08 1aje s VAL 7 Cb -0.14 -3.77 -0.06 0.00 0.00 0.00 0.00 36.38 32.41 1aje s VAL 7 CO 0.06 -0.77 1.03 -0.69 0.00 0.00 0.00 175.10 174.73 1aje s VAL 8 N 1.36 4.27 0.21 2.92 1.01 -1.03 -1.37 120.40 127.77 1aje s VAL 8 Ca 0.06 1.87 0.11 0.00 0.00 0.00 0.00 61.98 64.02 1aje s VAL 8 Cb -0.26 -4.19 -0.05 0.00 0.00 0.00 0.00 36.38 31.88 1aje s VAL 8 CO -0.01 0.28 -0.21 0.68 0.00 0.00 0.00 175.10 175.84 1aje s VAL 9 N 0.06 2.51 0.06 2.92 -7.23 -0.44 -4.58 120.40 113.70 1aje s VAL 9 Ca 0.49 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 1aje s VAL 9 Cb -0.26 -2.24 0.00 0.00 0.56 0.00 0.00 36.38 34.44 1aje s VAL 9 CO 0.31 -0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.53 1aje n GLY 10 N 0.01 -1.91 0.87 2.32 0.00 -1.26 -2.93 105.19 102.29 1aje n GLY 10 Ca -0.11 -1.34 -0.04 0.00 0.00 0.00 0.00 46.02 44.54 1aje n GLY 10 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1aje n ASP 11 N -1.28 0.58 -2.22 1.61 -0.08 -1.26 -4.85 116.55 109.05 1aje n ASP 11 Ca 0.00 0.09 -0.02 0.00 -1.51 0.00 0.00 54.79 53.35 1aje n ASP 11 Cb 0.12 -0.21 -0.02 0.00 2.34 0.00 0.00 41.12 43.35 1aje n ASP 11 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1aje n GLY 12 N 2.85 -5.13 2.09 0.27 0.00 -1.24 -3.70 105.19 100.32 1aje n GLY 12 Ca -0.07 0.58 -0.00 0.00 0.00 0.00 0.00 46.02 46.53 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 1.45 -0.72 -2.09 4.61 0.00 -1.26 -0.76 120.51 121.74 1aje n ALA 13 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.29 1aje n ALA 13 Cb 0.23 -0.46 -0.00 0.00 0.00 0.00 0.00 19.45 19.22 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 -2.11 -0.02 -1.92 0.00 3.14 -1.24 -4.73 118.33 111.45 1aje n VAL 14 Ca -0.00 0.00 -0.20 0.00 -2.96 0.00 0.00 64.34 61.17 1aje n VAL 14 Cb 0.37 -0.08 0.05 0.00 -1.06 0.00 0.00 33.84 33.12 1aje n VAL 14 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1aje n GLY 15 N -0.38 6.19 0.01 7.55 0.00 0.06 -4.62 105.19 114.00 1aje n GLY 15 Ca -0.01 -2.44 0.06 0.00 0.00 0.00 0.00 46.02 43.63 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 -0.78 0.48 0.33 1.61 2.85 -1.24 -1.99 118.16 119.41 1aje n LYS 16 Ca 0.42 -0.12 -0.18 0.00 -1.05 0.00 0.00 58.31 57.38 1aje n LYS 16 Cb 0.92 -1.32 -0.09 0.00 -0.65 0.00 0.00 35.03 33.89 1aje n LYS 16 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1aje h THR 17 N 0.00 0.17 -0.03 0.58 2.02 -1.87 -1.14 112.91 112.63 1aje h THR 17 Ca -0.02 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.17 1aje h THR 17 Cb 0.67 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1aje h THR 17 CO 0.00 0.00 0.07 0.00 0.37 0.00 0.00 175.52 175.96 1aje h LEU 19 N 0.00 -0.73 -0.50 0.00 5.85 -1.43 0.25 115.31 118.75 1aje h LEU 19 Ca 0.01 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.86 1aje h LEU 19 Cb 0.16 0.20 -0.09 0.00 0.37 0.00 0.00 40.66 41.30 1aje h LEU 19 CO -0.00 -0.50 -0.11 -0.07 -0.34 0.00 0.00 178.44 177.42 1aje h LEU 20 N -0.82 -0.43 0.14 2.25 3.38 -1.09 2.04 115.31 120.77 1aje h LEU 20 Ca -0.08 0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1aje h LEU 20 Cb 0.64 0.30 -0.04 0.00 0.09 0.00 0.00 40.66 41.65 1aje h LEU 20 CO 0.12 -0.15 -0.43 0.40 0.09 0.00 0.00 178.44 178.47 1aje h ILE 21 N 0.01 0.00 0.00 1.22 1.08 -1.21 0.19 117.51 118.80 1aje h ILE 21 Ca 0.24 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.71 1aje h ILE 21 Cb 0.37 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.12 1aje h ILE 21 CO -0.50 0.00 0.00 0.77 -0.69 0.00 0.00 178.15 177.73 1aje h SER 22 N -0.64 0.00 -0.77 1.72 4.64 0.23 1.52 113.55 120.25 1aje h SER 22 Ca -0.01 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.43 1aje h SER 22 Cb 0.63 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.66 1aje h SER 22 CO -0.21 0.00 0.51 0.22 -0.87 0.00 0.00 176.83 176.48 1aje h TYR 23 N 0.00 0.66 0.00 4.77 5.03 0.64 1.71 116.97 129.78 1aje h TYR 23 Ca 0.00 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.26 1aje h TYR 23 Cb 0.25 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.31 1aje h TYR 23 CO 0.00 0.29 -1.27 0.25 -1.32 0.00 0.00 178.16 176.10 1aje n THR 24 N -4.50 0.28 1.06 1.81 -2.24 -0.42 -4.58 114.28 105.68 1aje n THR 24 Ca 0.14 -0.11 0.12 0.00 -2.27 0.00 0.00 64.05 61.92 1aje n THR 24 Cb 0.40 -0.69 0.23 0.00 -2.10 0.00 0.00 70.33 68.17 1aje n THR 24 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1aje n THR 25 N -2.59 0.00 -1.96 4.28 -2.24 0.51 -4.89 114.28 107.38 1aje n THR 25 Ca -0.08 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1aje n THR 25 Cb 0.59 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 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 -1.23 -0.70 -3.44 3.42 2.85 0.58 -4.77 115.26 111.97 1aje n ASN 26 Ca 0.07 0.35 -0.23 0.00 -0.11 0.00 0.00 54.58 54.66 1aje n ASN 26 Cb 0.34 -0.77 -0.11 0.00 1.24 0.00 0.00 39.78 40.48 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 -3.79 0.42 -0.12 1.20 2.20 -1.26 -4.76 119.74 113.62 1aje s LYS 27 Ca 0.00 -0.71 -0.14 0.00 -0.36 0.00 0.00 55.97 54.75 1aje s LYS 27 Cb 0.00 -0.96 -0.05 0.00 -1.51 0.00 0.00 37.83 35.31 1aje s LYS 27 CO 0.00 -1.11 0.34 -0.59 -0.36 0.00 0.00 175.35 173.63 1aje s PHE 28 N 1.75 3.53 -0.48 4.03 -0.71 -1.26 -4.69 117.98 120.15 1aje s PHE 28 Ca 0.13 0.72 -0.03 0.00 -1.04 0.00 0.00 56.93 56.71 1aje s PHE 28 Cb -0.17 -2.35 0.13 0.00 -1.21 0.00 0.00 43.02 39.42 1aje s PHE 28 CO -0.18 0.32 2.55 -0.35 -1.34 0.00 0.00 175.22 176.22 1aje n PRO 29 N 3.20 2.36 0.00 1.99 -0.04 -1.26 -4.89 135.00 136.35 1aje n PRO 29 Ca -0.12 -2.38 0.00 0.00 -0.04 0.00 0.00 63.50 60.96 1aje n PRO 29 Cb 0.52 -2.08 0.00 0.00 -0.04 0.00 0.00 33.50 31.90 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 0.57 0.00 -2.86 3.54 2.88 -1.26 -3.68 113.62 112.82 1aje n SER 30 Ca 0.47 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.81 1aje n SER 30 Cb 0.53 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.98 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 2.13 -1.07 -1.46 1.02 -1.26 -5.04 120.64 114.95 1aje n GLU 31 Ca 0.00 -3.98 0.00 0.00 -0.02 0.00 0.00 57.16 53.16 1aje n GLU 31 Cb 0.00 -1.86 0.00 0.00 -0.02 0.00 0.00 31.44 29.56 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 -0.10 0.00 -2.23 -0.32 4.19 -1.24 -4.93 117.16 112.53 1aje n TYR 32 Ca 0.26 0.00 -0.26 0.00 3.31 0.00 0.00 57.90 61.21 1aje n TYR 32 Cb 0.62 -0.48 0.09 0.00 0.49 0.00 0.00 39.34 40.06 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 0.00 2.24 -1.36 2.97 -7.23 -1.26 -4.92 120.40 110.83 1aje s VAL 33 Ca 0.00 -0.29 -0.10 0.00 -1.81 0.00 0.00 61.98 59.77 1aje s VAL 33 Cb 0.00 -2.94 -0.06 0.00 0.56 0.00 0.00 36.38 33.93 1aje s VAL 33 CO 0.00 0.00 2.56 -0.81 -0.31 0.00 0.00 175.10 176.54 1aje n PRO 34 N -2.99 3.00 -2.48 4.82 -0.04 -1.26 -4.84 135.00 131.20 1aje n PRO 34 Ca 0.10 -2.04 -0.05 0.00 -0.04 0.00 0.00 63.50 61.47 1aje n PRO 34 Cb 0.60 -2.80 -0.02 0.00 -0.04 0.00 0.00 33.50 31.25 1aje n PRO 34 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1aje n THR 35 N 4.15 0.00 -3.28 0.52 5.66 -1.26 -5.15 114.28 114.92 1aje n THR 35 Ca 0.64 -0.50 -0.05 0.00 -3.05 0.00 0.00 64.05 61.09 1aje n THR 35 Cb 0.24 0.22 -0.05 0.00 -1.55 0.00 0.00 70.33 69.18 1aje n THR 35 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1aje s VAL 36 N -2.08 -0.74 -0.53 1.08 -7.23 -1.26 -5.10 120.40 104.54 1aje s VAL 36 Ca 0.06 -0.06 0.04 0.00 -1.81 0.00 0.00 61.98 60.22 1aje s VAL 36 Cb 0.00 -0.89 0.16 0.00 0.56 0.00 0.00 36.38 36.22 1aje s VAL 36 CO 0.05 -0.09 0.37 0.12 -0.31 0.00 0.00 175.10 175.24 1aje s PHE 37 N 2.65 2.29 -1.32 2.82 2.19 -1.26 -4.90 117.98 120.46 1aje s PHE 37 Ca 0.15 -2.74 -0.03 0.00 0.33 0.00 0.00 56.93 54.64 1aje s PHE 37 Cb -0.15 -1.88 0.01 0.00 -1.31 0.00 0.00 43.02 39.70 1aje s PHE 37 CO -0.18 -0.71 0.86 -0.25 1.83 0.00 0.00 175.22 176.77 1aje n ASP 38 N 2.71 -2.41 -3.77 6.13 8.00 -1.26 -4.27 116.55 121.68 1aje n ASP 38 Ca 0.20 -0.74 -0.42 0.00 0.71 0.00 0.00 54.79 54.54 1aje n ASP 38 Cb 0.39 -4.37 0.00 0.00 -0.02 0.00 0.00 41.12 37.12 1aje n ASP 38 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1aje n ASN 39 N -3.04 5.25 0.00 -2.24 4.13 -1.26 -4.14 115.26 113.96 1aje n ASN 39 Ca -0.22 -3.03 0.00 0.00 1.68 0.00 0.00 54.58 53.01 1aje n ASN 39 Cb 0.64 -1.51 0.00 0.00 -1.54 0.00 0.00 39.78 37.37 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 4.13 0.00 -3.87 3.10 4.01 -1.26 -5.00 117.16 118.27 1aje n TYR 40 Ca 0.46 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.85 1aje n TYR 40 Cb 0.35 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.25 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 -1.54 2.86 0.70 -0.72 0.00 -1.25 -2.72 121.76 119.10 1aje s ALA 41 Ca 0.00 -1.69 -0.05 0.00 0.00 0.00 0.00 51.96 50.22 1aje s ALA 41 Cb 0.00 -1.99 0.08 0.00 0.00 0.00 0.00 23.12 21.21 1aje s ALA 41 CO 0.00 -1.19 0.99 0.14 0.00 0.00 0.00 175.76 175.70 1aje s VAL 42 N 1.31 2.30 -0.23 0.00 -7.23 -0.88 -4.40 120.40 111.27 1aje s VAL 42 Ca -0.03 -0.37 -0.05 0.00 -1.81 0.00 0.00 61.98 59.72 1aje s VAL 42 Cb -0.19 -2.93 -0.02 0.00 0.56 0.00 0.00 36.38 33.80 1aje s VAL 42 CO -0.00 0.00 0.01 -0.89 -0.31 0.00 0.00 175.10 173.90 1aje s THR 43 N -3.19 3.79 0.09 5.32 2.01 -1.26 0.13 115.64 122.53 1aje s THR 43 Ca 0.62 -0.35 0.01 0.00 0.31 0.00 0.00 61.69 62.28 1aje s THR 43 Cb -0.09 -2.75 0.01 0.00 0.01 0.00 0.00 72.50 69.68 1aje s THR 43 CO 0.44 0.39 0.11 0.52 -0.69 0.00 0.00 174.62 175.39 1aje n VAL 44 N 4.85 0.00 -3.66 3.82 0.31 -0.93 -4.83 118.33 117.89 1aje n VAL 44 Ca -0.17 -0.31 -0.07 0.00 -0.01 0.00 0.00 64.34 63.78 1aje n VAL 44 Cb 0.51 -0.81 -0.08 0.00 -0.91 0.00 0.00 33.84 32.55 1aje n VAL 44 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1aje s MET 45 N -2.39 0.40 -0.19 5.55 -1.94 -1.26 -1.88 119.30 117.60 1aje s MET 45 Ca 0.08 1.13 -0.23 0.00 -1.71 0.00 0.00 55.69 54.96 1aje s MET 45 Cb -0.01 0.44 -0.20 0.00 2.01 0.00 0.00 34.83 37.07 1aje s MET 45 CO 0.05 -0.23 0.35 0.82 -0.01 0.00 0.00 175.02 176.01 1aje h ILE 46 N 6.06 1.12 -0.04 2.53 5.03 -1.86 -3.45 117.51 126.91 1aje h ILE 46 Ca -0.18 -2.17 -0.18 0.00 -0.12 0.00 0.00 64.86 62.22 1aje h ILE 46 Cb 1.11 2.44 -0.17 0.00 -3.03 0.00 0.00 36.82 37.17 1aje h ILE 46 CO 0.13 0.38 -0.35 0.61 -0.68 0.00 0.00 178.15 178.23 1aje n GLY 47 N 1.49 2.02 0.00 5.37 0.00 -1.26 -4.93 105.19 107.89 1aje n GLY 47 Ca -0.25 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1aje n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aje n GLY 48 N -1.45 1.19 3.08 -0.02 0.00 -1.26 -5.10 105.19 101.63 1aje n GLY 48 Ca -0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.22 2.11 -0.08 1.61 8.01 -1.26 -4.82 118.70 124.05 1aje s GLU 49 Ca 0.00 -0.55 -0.18 0.00 0.01 0.00 0.00 54.97 54.25 1aje s GLU 49 Cb 0.00 -1.68 -0.05 0.00 -4.31 0.00 0.00 34.13 28.09 1aje s GLU 49 CO 0.00 0.07 0.47 -1.25 0.01 0.00 0.00 175.26 174.56 1aje s PRO 50 N 0.58 4.25 -0.28 0.39 0.04 -1.25 -2.60 135.00 136.13 1aje s PRO 50 Ca -0.16 0.47 0.01 0.00 0.04 0.00 0.00 61.00 61.37 1aje s PRO 50 Cb -0.16 -3.38 0.08 0.00 0.04 0.00 0.00 34.50 31.08 1aje s PRO 50 CO 0.05 0.30 0.01 0.71 0.04 0.00 0.00 177.00 178.11 1aje s TYR 51 N 0.14 2.65 0.74 0.56 1.51 -0.78 -3.71 117.35 118.46 1aje s TYR 51 Ca 0.26 -2.12 -0.15 0.00 -1.01 0.00 0.00 57.07 54.05 1aje s TYR 51 Cb -0.16 -2.00 0.05 0.00 -0.11 0.00 0.00 41.96 39.74 1aje s TYR 51 CO 0.12 -0.85 1.24 2.41 -1.11 0.00 0.00 175.55 177.36 1aje n THR 52 N 4.59 3.22 -3.54 -0.71 -1.04 -1.25 -2.18 114.28 113.37 1aje n THR 52 Ca -0.05 -0.32 -0.29 0.00 -2.04 0.00 0.00 64.05 61.34 1aje n THR 52 Cb 0.43 -1.32 -0.15 0.00 -1.82 0.00 0.00 70.33 67.47 1aje n THR 52 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1aje s LEU 53 N -5.12 0.62 -0.61 -4.42 0.20 0.36 0.16 118.68 109.87 1aje s LEU 53 Ca 0.77 -1.36 -0.20 0.00 0.69 0.00 0.00 54.13 54.03 1aje s LEU 53 Cb -0.33 -0.37 0.09 0.00 -0.43 0.00 0.00 46.19 45.15 1aje s LEU 53 CO 0.46 -0.43 0.80 -0.83 -0.29 0.00 0.00 176.35 176.06 1aje s GLY 54 N 2.02 1.62 0.42 7.98 0.00 0.43 -2.08 107.32 117.70 1aje s GLY 54 Ca 0.10 -2.02 -0.13 0.00 0.00 0.00 0.00 44.72 42.66 1aje s GLY 54 CO -0.34 1.76 0.83 0.48 0.00 0.00 0.00 173.10 175.82 1aje s LEU 55 N 3.21 3.82 -0.17 0.66 -0.00 -1.10 -1.93 118.68 123.17 1aje s LEU 55 Ca 0.16 1.29 -0.20 0.00 -0.00 0.00 0.00 54.13 55.39 1aje s LEU 55 Cb -0.21 -4.17 0.05 0.00 -0.00 0.00 0.00 46.19 41.86 1aje s LEU 55 CO 0.08 -0.41 0.54 0.12 -0.00 0.00 0.00 176.35 176.68 1aje s PHE 56 N -2.36 -0.57 0.52 3.48 2.19 0.32 -4.83 117.98 116.73 1aje s PHE 56 Ca 0.54 1.31 0.19 0.00 0.33 0.00 0.00 56.93 59.31 1aje s PHE 56 Cb -0.10 0.22 1.30 0.00 -1.31 0.00 0.00 43.02 43.12 1aje s PHE 56 CO 0.28 -0.33 2.09 0.22 1.83 0.00 0.00 175.22 179.31 1aje h ASP 57 N 4.91 0.02 -5.07 6.13 3.58 -1.84 -2.74 116.42 121.40 1aje h ASP 57 Ca -0.28 -0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.04 1aje h ASP 57 Cb 1.17 -0.00 -0.18 0.00 1.72 0.00 0.00 39.33 42.04 1aje h ASP 57 CO 0.21 0.01 -0.50 0.42 -2.88 0.00 0.00 179.24 176.50 1aje s THR 58 N -5.07 0.12 0.00 2.25 -4.23 -1.26 -3.96 115.64 103.49 1aje s THR 58 Ca -0.05 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.45 1aje s THR 58 Cb 0.18 -0.83 0.00 0.00 1.34 0.00 0.00 72.50 73.19 1aje s THR 58 CO 0.69 -0.56 0.00 0.00 -0.54 0.00 0.00 174.62 174.22 1aje n ALA 59 N 0.84 0.00 0.00 3.99 0.00 -1.26 -4.97 120.51 119.12 1aje n ALA 59 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1aje n ALA 59 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1aje n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aje n GLY 60 N -0.23 3.40 3.58 0.00 0.00 -1.26 -4.99 105.19 105.69 1aje n GLY 60 Ca 0.00 -1.84 -0.01 0.00 0.00 0.00 0.00 46.02 44.17 1aje n GLY 60 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1aje s GLN 61 N -3.45 0.33 0.53 1.61 -2.07 -1.26 -5.01 119.66 110.34 1aje s GLN 61 Ca 0.00 0.62 0.40 0.00 -1.82 0.00 0.00 55.36 54.56 1aje s GLN 61 Cb 0.00 0.15 1.58 0.00 -1.09 0.00 0.00 33.01 33.65 1aje s GLN 61 CO 0.00 -0.08 1.69 0.93 -1.32 0.00 0.00 175.29 176.52 1aje h GLU 62 N 6.34 0.04 -2.42 9.60 4.39 -2.05 -3.43 114.58 127.04 1aje h GLU 62 Ca -0.25 -0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.23 1aje h GLU 62 Cb 1.17 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.75 1aje h GLU 62 CO 0.17 0.02 -0.24 -3.47 -1.16 0.00 0.00 179.01 174.34 1aje n ASP 63 N -4.19 -3.17 0.00 1.42 -0.08 -1.26 -4.63 116.55 104.65 1aje n ASP 63 Ca 0.34 0.26 0.00 0.00 -1.51 0.00 0.00 54.79 53.88 1aje n ASP 63 Cb 1.53 -2.91 0.00 0.00 2.34 0.00 0.00 41.12 42.09 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 -2.33 -0.47 -2.82 -0.67 4.01 -1.26 -3.99 117.16 109.63 1aje n TYR 64 Ca -0.12 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.35 1aje n TYR 64 Cb 0.45 0.10 -0.03 0.00 -0.31 0.00 0.00 39.34 39.55 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 -3.46 4.56 -3.61 7.72 8.00 -1.26 -5.06 116.55 123.43 1aje n ASP 65 Ca 0.00 -3.70 -0.13 0.00 0.71 0.00 0.00 54.79 51.68 1aje n ASP 65 Cb 0.00 -0.54 0.06 0.00 -0.02 0.00 0.00 41.12 40.62 1aje n ASP 65 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1aje n ARG 66 N -0.31 0.46 -0.66 -1.24 3.00 -1.26 -5.01 116.66 111.64 1aje n ARG 66 Ca 0.33 -1.72 0.08 0.00 -0.01 0.00 0.00 57.85 56.53 1aje n ARG 66 Cb 0.46 -0.27 0.35 0.00 0.00 0.00 0.00 32.46 32.99 1aje n ARG 66 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1aje n LEU 67 N 0.00 4.85 -0.14 0.55 4.77 -1.26 -4.59 117.00 121.18 1aje n LEU 67 Ca 0.10 -2.70 -0.08 0.00 -0.03 0.00 0.00 56.01 53.30 1aje n LEU 67 Cb 0.35 -0.59 0.01 0.00 -2.33 0.00 0.00 43.42 40.86 1aje n LEU 67 CO 0.23 0.72 1.06 -0.09 -1.33 0.00 0.00 177.39 177.98 1aje h ARG 68 N 3.52 0.58 0.00 3.23 9.65 -1.95 -1.99 114.38 127.41 1aje h ARG 68 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1aje h ARG 68 Cb 1.60 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 30.05 1aje h ARG 68 CO 0.31 0.38 0.00 -0.35 2.80 0.00 0.00 179.97 183.11 1aje n PRO 69 N -4.78 0.35 -0.22 0.20 -0.04 -1.26 -3.44 135.00 125.81 1aje n PRO 69 Ca 0.01 0.08 -0.02 0.00 -0.04 0.00 0.00 63.50 63.53 1aje n PRO 69 Cb 0.03 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.17 1aje n PRO 69 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1aje h LEU 70 N 0.00 0.91 -1.80 1.53 -0.00 -1.68 -2.09 115.31 112.19 1aje h LEU 70 Ca 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.79 1aje h LEU 70 Cb 0.15 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.58 1aje h LEU 70 CO 0.00 0.75 0.00 -1.54 -0.00 0.00 0.00 178.44 177.65 1aje n SER 71 N -4.34 2.71 -4.26 -0.43 3.41 -1.22 -4.93 113.62 104.55 1aje n SER 71 Ca 0.07 -1.88 -0.16 0.00 -0.26 0.00 0.00 58.87 56.65 1aje n SER 71 Cb 0.12 -0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 63.81 1aje n SER 71 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1aje s TYR 72 N -1.70 1.35 0.27 7.33 2.02 -0.78 -5.15 117.35 120.68 1aje s TYR 72 Ca 0.35 -0.68 -0.04 0.00 -0.37 0.00 0.00 57.07 56.32 1aje s TYR 72 Cb 0.21 -0.68 0.07 0.00 -0.40 0.00 0.00 41.96 41.15 1aje s TYR 72 CO 0.30 0.14 0.26 -0.35 -1.57 0.00 0.00 175.55 174.32 1aje n PRO 73 N -0.04 -1.25 -3.57 -1.71 -0.04 -1.26 -4.79 135.00 122.34 1aje n PRO 73 Ca -0.11 -0.41 -0.41 0.00 -0.04 0.00 0.00 63.50 62.53 1aje n PRO 73 Cb 0.60 -0.36 -0.07 0.00 -0.04 0.00 0.00 33.50 33.63 1aje n PRO 73 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1aje s GLN 74 N -3.58 2.91 0.25 0.54 0.74 -1.26 -4.97 119.66 114.29 1aje s GLN 74 Ca 0.16 -2.42 -0.04 0.00 0.05 0.00 0.00 55.36 53.11 1aje s GLN 74 Cb -0.01 -3.99 0.06 0.00 1.10 0.00 0.00 33.01 30.17 1aje s GLN 74 CO 0.12 -1.22 0.22 0.25 -0.55 0.00 0.00 175.29 174.12 1aje n THR 75 N 3.81 0.00 -2.35 -0.34 -2.24 -1.26 -4.66 114.28 107.24 1aje n THR 75 Ca 0.08 -0.10 -0.04 0.00 -2.27 0.00 0.00 64.05 61.72 1aje n THR 75 Cb 0.41 -1.07 0.02 0.00 -2.10 0.00 0.00 70.33 67.59 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 -3.37 -4.65 -2.58 3.42 8.00 0.17 -4.83 116.55 112.70 1aje n ASP 76 Ca 0.03 -0.21 -0.05 0.00 0.71 0.00 0.00 54.79 55.27 1aje n ASP 76 Cb 0.12 -3.05 0.04 0.00 -0.02 0.00 0.00 41.12 38.21 1aje n ASP 76 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1aje n VAL 77 N -1.93 0.00 -3.72 2.53 0.31 0.39 -4.68 118.33 111.23 1aje n VAL 77 Ca -0.02 -0.10 -0.29 0.00 -0.01 0.00 0.00 64.34 63.91 1aje n VAL 77 Cb 0.53 -1.27 -0.15 0.00 -0.91 0.00 0.00 33.84 32.05 1aje n VAL 77 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1aje s PHE 78 N -1.37 1.50 -0.67 3.52 0.08 -0.38 -1.02 117.98 119.64 1aje s PHE 78 Ca 0.12 -1.55 -0.18 0.00 0.12 0.00 0.00 56.93 55.44 1aje s PHE 78 Cb -0.01 -1.55 0.13 0.00 -0.57 0.00 0.00 43.02 41.02 1aje s PHE 78 CO 0.09 -0.84 0.76 -0.51 -0.10 0.00 0.00 175.22 174.62 1aje s LEU 79 N 1.69 5.64 -0.38 -0.37 1.43 -0.47 -1.11 118.68 125.11 1aje s LEU 79 Ca 0.08 -1.76 -0.28 0.00 -1.03 0.00 0.00 54.13 51.14 1aje s LEU 79 Cb -0.17 -2.29 0.02 0.00 0.03 0.00 0.00 46.19 43.78 1aje s LEU 79 CO -0.24 -1.00 1.03 -0.69 0.23 0.00 0.00 176.35 175.68 1aje s VAL 80 N 2.17 4.47 -0.65 -1.59 1.01 -0.63 -1.33 120.40 123.84 1aje s VAL 80 Ca 0.15 1.37 -0.22 0.00 0.00 0.00 0.00 61.98 63.28 1aje s VAL 80 Cb -0.20 -4.43 0.08 0.00 0.00 0.00 0.00 36.38 31.83 1aje s VAL 80 CO 0.01 -0.64 0.92 0.00 0.00 0.00 0.00 175.10 175.40 1aje n PHE 82 N 7.43 0.43 -2.01 0.00 1.16 0.52 -3.68 117.46 121.31 1aje n PHE 82 Ca -0.04 0.13 0.00 0.00 -1.87 0.00 0.00 57.45 55.66 1aje n PHE 82 Cb 0.45 -0.59 0.00 0.00 -1.61 0.00 0.00 39.48 37.73 1aje n PHE 82 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 1aje n SER 83 N -1.95 -8.73 0.01 5.98 3.41 -1.21 -2.44 113.62 108.69 1aje n SER 83 Ca 0.04 1.33 0.11 0.00 -0.26 0.00 0.00 58.87 60.09 1aje n SER 83 Cb 0.41 -4.93 -0.01 0.00 -0.26 0.00 0.00 64.21 59.41 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 1.84 0.07 0.16 -3.33 0.31 -1.26 -4.07 118.33 112.05 1aje n VAL 84 Ca 0.00 -0.15 0.07 0.00 -0.01 0.00 0.00 64.34 64.25 1aje n VAL 84 Cb 0.00 0.46 0.07 0.00 -0.91 0.00 0.00 33.84 33.46 1aje n VAL 84 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1aje h VAL 85 N 0.00 0.40 -4.50 2.52 -1.51 -1.90 0.63 116.25 111.90 1aje h VAL 85 Ca 0.00 -1.59 -0.47 0.00 -1.23 0.00 0.00 66.70 63.41 1aje h VAL 85 Cb 0.65 2.12 0.09 0.00 -2.13 0.00 0.00 31.29 32.02 1aje h VAL 85 CO 0.00 0.23 0.39 -0.44 -1.23 0.00 0.00 177.57 176.52 1aje s SER 86 N -6.18 4.80 -0.72 4.19 0.01 -1.26 -4.64 113.70 109.90 1aje s SER 86 Ca 0.04 0.85 -0.25 0.00 1.31 0.00 0.00 55.95 57.90 1aje s SER 86 Cb 0.07 -1.44 0.05 0.00 0.21 0.00 0.00 66.02 64.91 1aje s SER 86 CO 0.73 -1.72 1.16 -2.16 0.41 0.00 0.00 173.24 171.66 1aje s PRO 87 N -5.48 3.18 0.00 12.44 0.04 -1.26 -4.25 135.00 139.67 1aje s PRO 87 Ca 0.61 -0.53 0.00 0.00 0.04 0.00 0.00 61.00 61.12 1aje s PRO 87 Cb -0.11 -4.25 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1aje s PRO 87 CO 0.49 -2.02 0.00 0.43 0.04 0.00 0.00 177.00 175.95 1aje n SER 88 N 8.66 -0.59 0.04 6.66 7.64 -1.26 -4.67 113.62 130.10 1aje n SER 88 Ca 0.02 0.30 -0.05 0.00 1.01 0.00 0.00 58.87 60.15 1aje n SER 88 Cb 0.48 -0.77 0.16 0.00 -1.01 0.00 0.00 64.21 63.07 1aje n SER 88 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1aje h SER 89 N 0.00 0.42 0.00 6.43 4.64 -1.85 -2.39 113.55 120.79 1aje h SER 89 Ca 0.00 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1aje h SER 89 Cb 0.59 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1aje h SER 89 CO 0.00 0.78 0.59 2.19 -0.87 0.00 0.00 176.83 179.52 1aje h PHE 90 N 0.33 0.00 0.16 4.77 -0.00 -1.64 0.67 116.94 121.23 1aje h PHE 90 Ca 0.03 0.00 -0.30 0.00 -0.00 0.00 0.00 57.97 57.70 1aje h PHE 90 Cb 0.86 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 36.82 1aje h PHE 90 CO 0.02 0.00 -1.36 1.49 -0.00 0.00 0.00 178.31 178.47 1aje h GLU 91 N 0.00 0.34 0.00 6.09 4.22 -1.72 -3.06 114.58 120.44 1aje h GLU 91 Ca 0.00 -0.58 -0.00 0.00 0.08 0.00 0.00 59.36 58.86 1aje h GLU 91 Cb 1.17 0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.64 1aje h GLU 91 CO 0.00 1.26 -0.02 -2.95 -2.18 0.00 0.00 179.01 175.13 1aje h ASN 92 N 0.09 0.00 0.26 1.04 7.08 0.18 0.64 115.58 124.87 1aje h ASN 92 Ca -0.19 0.00 -0.02 0.00 -3.08 0.00 0.00 56.30 53.02 1aje h ASN 92 Cb 2.03 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 38.27 1aje h ASN 92 CO 0.22 0.02 -0.09 0.58 -2.08 0.00 0.00 177.43 176.07 1aje h VAL 93 N 0.00 0.59 0.00 6.14 2.07 -1.48 -2.69 116.25 120.89 1aje h VAL 93 Ca -0.00 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 1aje h VAL 93 Cb 0.16 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1aje h VAL 93 CO 0.00 0.09 -0.00 0.11 0.02 0.00 0.00 177.57 177.79 1aje h LYS 94 N 0.00 -0.00 -1.01 1.57 1.79 0.18 -1.96 116.57 117.14 1aje h LYS 94 Ca -0.00 0.00 0.24 0.00 -2.18 0.00 0.00 60.65 58.70 1aje h LYS 94 Cb 0.25 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 30.79 1aje h LYS 94 CO 0.01 0.78 0.63 0.93 -1.08 0.00 0.00 179.45 180.72 1aje h GLU 95 N -0.99 0.53 0.00 3.15 5.08 -1.27 -3.08 114.58 117.99 1aje h GLU 95 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1aje h GLU 95 Cb 0.78 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1aje h GLU 95 CO 0.00 0.35 -0.68 1.63 -1.00 0.00 0.00 179.01 179.31 1aje n LYS 96 N -4.73 2.57 -0.01 2.33 4.76 -1.07 -4.59 118.16 117.42 1aje n LYS 96 Ca 0.25 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.53 1aje n LYS 96 Cb 0.75 -0.84 -0.05 0.00 -1.84 0.00 0.00 35.03 33.05 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 -1.37 0.00 0.00 177.40 174.54 1aje h TRP 97 N 0.00 0.96 -0.30 2.13 4.06 -1.47 -2.26 115.95 119.06 1aje h TRP 97 Ca 0.00 -0.42 -0.08 0.00 2.06 0.00 0.00 58.89 60.45 1aje h TRP 97 Cb 0.55 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.55 1aje h TRP 97 CO 0.00 1.24 -0.11 0.28 -3.56 0.00 0.00 178.44 176.29 1aje h VAL 98 N 0.49 1.29 0.00 1.49 2.07 -1.41 0.12 116.25 120.30 1aje h VAL 98 Ca -0.05 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.30 1aje h VAL 98 Cb 1.38 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.57 1aje h VAL 98 CO 0.15 0.38 0.00 1.55 0.02 0.00 0.00 177.57 179.67 1aje h PRO 99 N 0.37 0.00 0.06 1.57 0.13 -1.72 0.94 132.00 133.35 1aje h PRO 99 Ca 0.07 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.87 1aje h PRO 99 Cb 0.61 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.71 1aje h PRO 99 CO 0.04 0.00 -1.93 0.39 -0.23 0.00 0.00 178.00 176.27 1aje n GLU 100 N -2.48 0.70 -0.12 0.86 -0.58 -0.61 -3.66 120.64 114.75 1aje n GLU 100 Ca -0.01 0.26 -0.19 0.00 -0.42 0.00 0.00 57.16 56.80 1aje n GLU 100 Cb 0.11 -1.72 -0.11 0.00 -0.57 0.00 0.00 31.44 29.15 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 -3.25 1.38 -0.10 -3.67 -5.35 0.33 -4.23 119.36 104.46 1aje n ILE 101 Ca -0.27 -0.49 -0.17 0.00 -0.27 0.00 0.00 62.75 61.55 1aje n ILE 101 Cb 1.05 -1.45 -0.08 0.00 -1.74 0.00 0.00 39.64 37.42 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 -3.40 1.50 -0.25 7.28 -2.24 0.32 0.17 114.28 117.66 1aje n THR 102 Ca -0.44 -0.00 0.27 0.00 -2.27 0.00 0.00 64.05 61.61 1aje n THR 102 Cb 0.93 -2.14 0.65 0.00 -2.10 0.00 0.00 70.33 67.68 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 0.22 0.00 4.78 -0.00 -1.39 -0.23 115.15 117.53 1aje h HIS 103 Ca -0.28 0.01 -0.15 0.00 -0.00 0.00 0.00 60.37 59.95 1aje h HIS 103 Cb 1.11 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 28.43 1aje h HIS 103 CO -0.05 0.04 -1.34 1.58 -0.00 0.00 0.00 177.93 178.15 1aje n HIS 104 N -4.36 0.28 -3.48 5.26 -0.00 -1.24 -4.76 115.22 106.92 1aje n HIS 104 Ca 0.21 0.12 -0.27 0.00 -0.00 0.00 0.00 57.72 57.78 1aje n HIS 104 Cb 0.96 -0.74 -0.09 0.00 -0.00 0.00 0.00 29.99 30.12 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 1.00 4.34 -0.08 0.00 -0.04 -0.12 -4.12 135.00 135.97 1aje n PRO 106 Ca 0.29 -3.30 -0.14 0.00 -0.04 0.00 0.00 63.50 60.31 1aje n PRO 106 Cb 0.40 -2.58 -0.08 0.00 -0.04 0.00 0.00 33.50 31.20 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 4.44 0.00 0.00 0.54 6.56 -1.87 -3.50 116.57 122.74 1aje h LYS 107 Ca 0.68 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.27 1aje h LYS 107 Cb 0.35 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.01 1aje h LYS 107 CO 1.42 0.68 0.00 2.41 -2.06 0.00 0.00 179.45 181.90 1aje n THR 108 N -4.56 0.00 -1.51 -0.16 -1.04 -1.26 -5.06 114.28 100.69 1aje n THR 108 Ca -0.18 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.70 1aje n THR 108 Cb 0.47 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.88 1aje n THR 108 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1aje n PRO 109 N 0.00 0.28 -3.75 -2.82 -0.04 -1.25 -4.23 135.00 123.19 1aje n PRO 109 Ca 0.00 -1.01 -0.29 0.00 -0.04 0.00 0.00 63.50 62.16 1aje n PRO 109 Cb 0.00 -3.29 -0.16 0.00 -0.04 0.00 0.00 33.50 30.02 1aje n PRO 109 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1aje s PHE 110 N 13.07 1.36 -0.26 0.54 2.19 -1.26 -1.25 117.98 132.37 1aje s PHE 110 Ca 0.85 -1.24 -0.01 0.00 0.33 0.00 0.00 56.93 56.85 1aje s PHE 110 Cb -0.16 -1.30 0.03 0.00 -1.31 0.00 0.00 43.02 40.28 1aje s PHE 110 CO 0.16 -0.73 -0.06 -0.51 1.83 0.00 0.00 175.22 175.92 1aje s LEU 111 N 1.74 3.29 -0.56 6.12 1.43 -0.26 0.40 118.68 130.85 1aje s LEU 111 Ca 0.02 -0.96 -0.18 0.00 -1.03 0.00 0.00 54.13 51.98 1aje s LEU 111 Cb -0.17 -1.66 0.10 0.00 0.03 0.00 0.00 46.19 44.48 1aje s LEU 111 CO -0.15 -0.15 0.64 -0.22 0.23 0.00 0.00 176.35 176.71 1aje s LEU 112 N 1.30 5.42 0.20 1.79 2.96 -0.50 -1.61 118.68 128.24 1aje s LEU 112 Ca -0.01 -1.36 0.04 0.00 -0.22 0.00 0.00 54.13 52.57 1aje s LEU 112 Cb -0.17 -2.31 -0.05 0.00 0.50 0.00 0.00 46.19 44.16 1aje s LEU 112 CO -0.04 -1.01 -0.05 0.68 -1.32 0.00 0.00 176.35 174.61 1aje s VAL 113 N 2.48 1.11 0.00 1.68 -7.23 -1.03 -1.62 120.40 115.79 1aje s VAL 113 Ca 0.11 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 58.23 1aje s VAL 113 Cb -0.24 -2.15 0.00 0.00 0.56 0.00 0.00 36.38 34.55 1aje s VAL 113 CO 0.07 -0.49 0.00 0.61 -0.31 0.00 0.00 175.10 174.98 1aje n GLY 114 N -0.33 -2.69 0.00 2.32 0.00 -0.64 -0.36 105.19 103.49 1aje n GLY 114 Ca -0.07 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1aje n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1aje n THR 115 N 0.00 0.00 -3.19 2.61 -2.24 -1.26 -3.35 114.28 106.85 1aje n THR 115 Ca 0.00 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 1aje n THR 115 Cb 0.00 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 1aje n THR 115 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1aje n GLN 116 N 0.00 3.74 0.00 -0.78 -0.06 -0.84 -2.46 117.38 116.98 1aje n GLN 116 Ca 0.00 -4.58 0.00 0.00 -2.00 0.00 0.00 57.00 50.42 1aje n GLN 116 Cb 0.00 -2.43 0.01 0.00 -4.06 0.00 0.00 30.24 23.76 1aje n GLN 116 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 1aje n ILE 117 N 1.33 0.68 1.29 1.69 5.41 -1.26 -2.20 119.36 126.30 1aje n ILE 117 Ca 0.27 0.17 0.11 0.00 1.00 0.00 0.00 62.75 64.29 1aje n ILE 117 Cb 0.36 -1.16 0.62 0.00 -0.71 0.00 0.00 39.64 38.75 1aje n ILE 117 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1aje n ASP 118 N -1.17 0.00 0.00 4.38 5.75 -1.26 -2.22 116.55 122.02 1aje n ASP 118 Ca 0.00 -0.55 0.00 0.00 -0.01 0.00 0.00 54.79 54.23 1aje n ASP 118 Cb 0.00 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 1aje n ASP 118 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1aje n LEU 119 N -1.05 0.17 -0.33 -2.12 -0.00 -0.93 -4.65 117.00 108.08 1aje n LEU 119 Ca 0.15 -0.35 0.36 0.00 -0.00 0.00 0.00 56.01 56.17 1aje n LEU 119 Cb 0.09 0.00 0.74 0.00 -0.00 0.00 0.00 43.42 44.25 1aje n LEU 119 CO 0.13 0.04 1.33 -0.09 -0.00 0.00 0.00 177.39 178.80 1aje h ARG 120 N 0.00 0.00 -0.32 1.47 2.43 -1.55 4.40 114.38 120.81 1aje h ARG 120 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1aje h ARG 120 Cb 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1aje h ARG 120 CO 0.00 0.00 0.00 -0.25 -1.51 0.00 0.00 179.97 178.21 1aje n ASP 121 N -4.04 3.21 -4.80 -3.80 9.92 -1.26 -4.73 116.55 111.06 1aje n ASP 121 Ca 0.26 -1.93 -0.32 0.00 -0.53 0.00 0.00 54.79 52.27 1aje n ASP 121 Cb 1.32 -0.20 -0.06 0.00 -0.64 0.00 0.00 41.12 41.53 1aje n ASP 121 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1aje s ASP 122 N -1.40 5.73 0.00 -2.24 1.11 1.45 -4.95 116.67 116.36 1aje s ASP 122 Ca 0.33 0.12 0.12 0.00 0.18 0.00 0.00 52.55 53.31 1aje s ASP 122 Cb 0.20 -1.64 0.60 0.00 1.07 0.00 0.00 42.92 43.16 1aje s ASP 122 CO 0.28 0.23 1.31 -0.81 1.18 0.00 0.00 175.17 177.36 1aje n PRO 123 N 0.89 0.15 -0.33 8.23 -0.04 -1.26 -3.67 135.00 138.97 1aje n PRO 123 Ca -0.11 0.18 0.35 0.00 -0.04 0.00 0.00 63.50 63.89 1aje n PRO 123 Cb 0.52 -1.50 0.64 0.00 -0.04 0.00 0.00 33.50 33.13 1aje n PRO 123 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1aje h SER 124 N 0.00 0.00 -0.32 3.54 0.87 -1.93 0.13 113.55 115.85 1aje h SER 124 Ca 0.00 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.31 1aje h SER 124 Cb 0.13 0.00 -0.24 0.00 -0.44 0.00 0.00 62.40 61.85 1aje h SER 124 CO 0.00 0.00 -0.74 1.07 -0.53 0.00 0.00 176.83 176.63 1aje n THR 125 N -3.66 1.99 -0.10 2.23 5.66 -1.24 -4.85 114.28 114.32 1aje n THR 125 Ca 0.27 -3.33 -0.15 0.00 -3.05 0.00 0.00 64.05 57.80 1aje n THR 125 Cb 1.50 -0.29 -0.05 0.00 -1.55 0.00 0.00 70.33 69.94 1aje n THR 125 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 1aje n ILE 126 N -0.74 1.50 -0.30 1.09 2.08 0.46 -4.23 119.36 119.23 1aje n ILE 126 Ca 0.26 0.00 0.34 0.00 0.56 0.00 0.00 62.75 63.91 1aje n ILE 126 Cb 0.85 -2.22 0.74 0.00 -0.75 0.00 0.00 39.64 38.26 1aje n ILE 126 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 1aje h GLU 127 N -1.00 0.00 -0.96 0.38 4.81 -1.89 0.38 114.58 116.30 1aje h GLU 127 Ca -0.20 0.00 0.38 0.00 -0.13 0.00 0.00 59.36 59.41 1aje h GLU 127 Cb 1.12 0.00 -0.17 0.00 0.63 0.00 0.00 28.75 30.33 1aje h GLU 127 CO -0.12 0.00 0.43 1.17 -0.73 0.00 0.00 179.01 179.75 1aje n LYS 128 N -4.07 -0.06 0.00 1.92 3.00 -1.26 -4.44 118.16 113.26 1aje n LYS 128 Ca 0.25 1.35 0.00 0.00 -0.00 0.00 0.00 58.31 59.90 1aje n LYS 128 Cb 1.24 -2.36 0.00 0.00 0.00 0.00 0.00 35.03 33.91 1aje n LYS 128 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1aje n LEU 129 N -5.22 0.00 0.00 3.14 4.32 0.13 -5.02 117.00 114.35 1aje n LEU 129 Ca 0.34 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.33 1aje n LEU 129 Cb 1.15 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.95 1aje n LEU 129 CO -0.01 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.16 1aje n ALA 130 N -1.48 0.00 0.29 -1.18 0.00 -0.98 -4.72 120.51 112.44 1aje n ALA 130 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1aje n ALA 130 Cb 0.00 -0.04 0.86 0.00 0.00 0.00 0.00 19.45 20.27 1aje n ALA 130 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1aje h LYS 131 N 1.12 0.00 -0.56 0.00 3.11 -1.93 0.34 116.57 118.64 1aje h LYS 131 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1aje h LYS 131 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.23 1aje h LYS 131 CO 0.00 0.05 0.00 0.09 -2.81 0.00 0.00 179.45 176.78 1aje n ASN 132 N -3.73 3.74 -1.56 4.20 3.02 -1.26 -4.89 115.26 114.78 1aje n ASN 132 Ca -0.03 -2.13 -0.18 0.00 -0.03 0.00 0.00 54.58 52.21 1aje n ASN 132 Cb 0.14 -0.42 -0.08 0.00 -0.61 0.00 0.00 39.78 38.81 1aje n ASN 132 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1aje n LYS 133 N 1.06 -1.42 0.00 3.52 4.76 0.12 -4.40 118.16 121.80 1aje n LYS 133 Ca 0.20 1.08 0.00 0.00 -2.87 0.00 0.00 58.31 56.72 1aje n LYS 133 Cb 0.62 -5.43 0.00 0.00 -1.84 0.00 0.00 35.03 28.37 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 -2.24 0.00 -1.88 1.97 1.13 -1.26 -4.90 117.38 110.20 1aje n GLN 134 Ca -0.19 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.87 1aje n GLN 134 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.96 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 -4.78 -1.12 -1.09 4.01 -1.26 -4.45 118.16 109.47 1aje n LYS 135 Ca 0.00 3.46 -0.29 0.00 -0.51 0.00 0.00 58.31 60.98 1aje n LYS 135 Cb 0.00 -3.71 0.18 0.00 -0.51 0.00 0.00 35.03 30.99 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 -0.97 0.27 -0.25 1.97 0.04 -1.25 -4.22 135.00 130.59 1aje s PRO 136 Ca 0.00 0.52 -0.28 0.00 0.04 0.00 0.00 61.00 61.28 1aje s PRO 136 Cb 0.00 -1.72 -0.05 0.00 0.04 0.00 0.00 34.50 32.77 1aje s PRO 136 CO 0.00 -2.84 2.24 0.42 0.04 0.00 0.00 177.00 176.86 1aje s ILE 137 N -2.93 3.01 0.52 0.56 1.09 0.21 -4.90 121.20 118.76 1aje s ILE 137 Ca 0.66 0.01 -0.03 0.00 -1.10 0.00 0.00 60.65 60.18 1aje s ILE 137 Cb -0.19 -3.02 0.11 0.00 -1.06 0.00 0.00 42.46 38.30 1aje s ILE 137 CO 0.58 -0.01 0.70 0.35 -0.10 0.00 0.00 174.94 176.47 1aje n THR 138 N 7.79 0.00 0.44 2.92 -2.24 -1.26 -4.72 114.28 117.21 1aje n THR 138 Ca 0.31 -0.89 0.07 0.00 -2.27 0.00 0.00 64.05 61.27 1aje n THR 138 Cb 0.46 -1.26 0.32 0.00 -2.10 0.00 0.00 70.33 67.75 1aje n THR 138 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1aje n PRO 139 N -2.37 0.03 0.00 -0.78 -0.04 -1.26 -1.97 135.00 128.61 1aje n PRO 139 Ca 0.11 0.30 0.07 0.00 -0.04 0.00 0.00 63.50 63.94 1aje n PRO 139 Cb 0.38 -1.57 -0.03 0.00 -0.04 0.00 0.00 33.50 32.24 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 -1.63 1.92 -0.03 0.54 1.02 -1.26 -4.15 120.64 117.05 1aje n GLU 140 Ca 0.03 -0.53 -0.03 0.00 -0.02 0.00 0.00 57.16 56.61 1aje n GLU 140 Cb 0.16 -1.22 -0.01 0.00 -0.02 0.00 0.00 31.44 30.36 1aje n GLU 140 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1aje n THR 141 N -0.51 0.58 0.11 2.62 -1.04 -0.83 -3.75 114.28 111.45 1aje n THR 141 Ca 0.05 0.37 -0.13 0.00 -2.04 0.00 0.00 64.05 62.30 1aje n THR 141 Cb 0.29 -1.84 -0.06 0.00 -1.82 0.00 0.00 70.33 66.89 1aje n THR 141 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1aje h ALA 142 N -1.61 -0.60 -1.00 2.41 0.00 -1.72 0.12 119.26 116.86 1aje h ALA 142 Ca 0.00 -0.05 0.23 0.00 0.00 0.00 0.00 54.91 55.08 1aje h ALA 142 Cb 0.32 0.59 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 1aje h ALA 142 CO 0.00 -0.90 0.63 0.93 0.00 0.00 0.00 179.25 179.91 1aje h GLU 143 N -0.57 0.51 -0.54 0.00 4.39 -1.77 0.35 114.58 116.95 1aje h GLU 143 Ca 0.03 -0.03 0.08 0.00 0.34 0.00 0.00 59.36 59.79 1aje h GLU 143 Cb 0.61 -0.11 -0.07 0.00 -0.10 0.00 0.00 28.75 29.08 1aje h GLU 143 CO -0.22 0.34 0.16 -0.22 -1.16 0.00 0.00 179.01 177.91 1aje h LYS 144 N 0.52 0.31 0.01 2.33 3.11 -0.86 -1.42 116.57 120.57 1aje h LYS 144 Ca 0.57 -0.02 -0.31 0.00 -2.81 0.00 0.00 60.65 58.08 1aje h LYS 144 Cb 1.23 -0.07 -0.05 0.00 -1.00 0.00 0.00 32.23 32.34 1aje h LYS 144 CO -0.31 0.21 -1.82 1.47 -2.81 0.00 0.00 179.45 176.18 1aje n LEU 145 N -5.05 0.95 0.29 5.20 -0.00 0.36 -3.61 117.00 115.15 1aje n LEU 145 Ca 0.07 0.35 0.18 0.00 -0.00 0.00 0.00 56.01 56.60 1aje n LEU 145 Cb 0.24 0.09 0.99 0.00 -0.00 0.00 0.00 43.42 44.74 1aje n LEU 145 CO 0.22 0.45 1.15 0.00 -0.00 0.00 0.00 177.39 179.21 1aje h ALA 146 N 0.91 1.40 0.00 1.47 0.00 -0.32 3.00 119.26 125.72 1aje h ALA 146 Ca -0.33 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 1aje h ALA 146 Cb 2.04 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 1aje h ALA 146 CO 0.07 -0.09 -0.39 0.00 0.00 0.00 0.00 179.25 178.85 1aje h ARG 147 N 0.00 0.00 0.00 0.00 2.47 -1.33 2.05 114.38 117.58 1aje h ARG 147 Ca 0.02 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.68 1aje h ARG 147 Cb 0.16 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.47 1aje h ARG 147 CO -0.00 0.39 -0.28 0.22 0.56 0.00 0.00 179.97 180.86 1aje h ASP 148 N 0.00 0.00 0.00 7.04 3.58 0.53 -3.36 116.42 124.21 1aje h ASP 148 Ca -0.00 0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.29 1aje h ASP 148 Cb 0.93 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.95 1aje h ASP 148 CO 0.05 0.28 -1.58 0.18 -2.88 0.00 0.00 179.24 175.29 1aje n LEU 149 N -3.19 2.05 -3.41 2.28 4.77 -0.48 -5.01 117.00 114.00 1aje n LEU 149 Ca 0.03 -0.04 -0.17 0.00 -0.03 0.00 0.00 56.01 55.80 1aje n LEU 149 Cb 0.62 -0.19 0.09 0.00 -2.33 0.00 0.00 43.42 41.62 1aje n LEU 149 CO 0.37 0.53 0.11 0.29 -1.33 0.00 0.00 177.39 177.36 1aje n LYS 150 N -2.64 -6.62 0.00 3.23 4.01 0.69 -4.97 118.16 111.85 1aje n LYS 150 Ca -0.17 0.84 0.00 0.00 -0.51 0.00 0.00 58.31 58.47 1aje n LYS 150 Cb 0.72 -5.84 0.00 0.00 -0.51 0.00 0.00 35.03 29.40 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 -4.14 0.00 0.05 7.82 0.00 -1.26 -4.89 120.51 118.09 1aje n ALA 151 Ca -0.27 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 52.94 1aje n ALA 151 Cb 0.66 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.97 1aje n ALA 151 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1aje h VAL 152 N -0.50 0.86 -1.67 0.00 2.07 0.77 -3.47 116.25 114.31 1aje h VAL 152 Ca 0.00 -2.46 0.05 0.00 0.82 0.00 0.00 66.70 65.11 1aje h VAL 152 Cb 0.00 2.69 -0.23 0.00 -1.52 0.00 0.00 31.29 32.23 1aje h VAL 152 CO 0.00 0.86 0.44 -0.75 0.02 0.00 0.00 177.57 178.14 1aje s LYS 153 N -2.56 0.68 0.02 1.57 2.47 -1.05 -5.00 119.74 115.86 1aje s LYS 153 Ca -0.18 0.28 0.02 0.00 -1.56 0.00 0.00 55.97 54.54 1aje s LYS 153 Cb 0.06 0.32 -0.04 0.00 -1.46 0.00 0.00 37.83 36.71 1aje s LYS 153 CO 0.82 -0.19 -0.00 -0.47 0.16 0.00 0.00 175.35 175.68 1aje s TYR 154 N -0.82 3.05 0.27 4.03 6.14 -1.26 -1.41 117.35 127.35 1aje s TYR 154 Ca -0.03 0.05 -0.19 0.00 0.64 0.00 0.00 57.07 57.54 1aje s TYR 154 Cb -0.01 -1.64 0.07 0.00 0.42 0.00 0.00 41.96 40.79 1aje s TYR 154 CO 0.02 0.46 0.94 0.08 0.64 0.00 0.00 175.55 177.68 1aje s VAL 155 N -1.12 0.00 -0.07 3.14 1.01 -0.64 -4.98 120.40 117.74 1aje s VAL 155 Ca 0.21 -0.76 -0.15 0.00 0.00 0.00 0.00 61.98 61.28 1aje s VAL 155 Cb -0.12 -2.89 0.03 0.00 0.00 0.00 0.00 36.38 33.40 1aje s VAL 155 CO 0.12 0.00 0.35 -1.61 0.00 0.00 0.00 175.10 173.96 1aje s GLU 156 N -2.22 0.58 0.00 2.72 2.02 -1.26 -1.61 118.70 118.92 1aje s GLU 156 Ca 0.19 0.15 0.00 0.00 0.02 0.00 0.00 54.97 55.33 1aje s GLU 156 Cb -0.04 0.27 0.00 0.00 0.10 0.00 0.00 34.13 34.46 1aje s GLU 156 CO 0.08 -0.13 0.00 0.00 0.02 0.00 0.00 175.26 175.23 1aje n SER 158 N 0.00 0.48 -0.19 0.00 7.64 -1.23 -4.60 113.62 115.71 1aje n SER 158 Ca 0.00 1.15 0.11 0.00 1.01 0.00 0.00 58.87 61.14 1aje n SER 158 Cb 0.00 -1.13 0.22 0.00 -1.01 0.00 0.00 64.21 62.29 1aje n SER 158 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aje n ALA 159 N 0.77 0.38 0.02 -0.43 0.00 -1.03 0.13 120.51 120.35 1aje n ALA 159 Ca 0.15 0.60 0.09 0.00 0.00 0.00 0.00 53.44 54.28 1aje n ALA 159 Cb 0.25 -0.49 -0.11 0.00 0.00 0.00 0.00 19.45 19.10 1aje n ALA 159 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 160 N -4.59 0.31 0.08 0.00 -0.00 -1.26 -4.55 117.00 106.99 1aje n LEU 160 Ca 0.16 0.12 -0.05 0.00 -0.00 0.00 0.00 56.01 56.24 1aje n LEU 160 Cb 0.53 0.02 -0.03 0.00 -0.00 0.00 0.00 43.42 43.94 1aje n LEU 160 CO -0.03 -0.01 0.51 0.74 -0.00 0.00 0.00 177.39 178.59 1aje h THR 161 N 0.00 0.00 -0.43 1.47 2.02 0.75 -3.48 112.91 113.25 1aje h THR 161 Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.13 1aje h THR 161 Cb 1.12 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 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 -3.08 0.00 0.05 6.66 1.13 -1.17 -4.95 117.38 116.01 1aje n GLN 162 Ca -0.03 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.15 1aje n GLN 162 Cb 0.12 -2.51 0.17 0.00 0.11 0.00 0.00 30.24 28.14 1aje n GLN 162 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1aje n LYS 163 N -0.70 0.24 0.00 -1.09 2.85 -1.26 -4.48 118.16 113.72 1aje n LYS 163 Ca 0.00 0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.32 1aje n LYS 163 Cb 0.42 -1.64 0.00 0.00 -0.65 0.00 0.00 35.03 33.16 1aje n LYS 163 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1aje n GLY 164 N 1.37 0.23 0.28 2.58 0.00 -1.22 -4.92 105.19 103.51 1aje n GLY 164 Ca 0.03 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.12 1aje n GLY 164 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1aje h LEU 165 N 0.00 -0.01 -1.51 0.99 5.85 -1.79 2.27 115.31 121.11 1aje h LEU 165 Ca 0.00 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1aje h LEU 165 Cb 0.00 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.25 1aje h LEU 165 CO 0.00 -0.06 0.00 0.50 -0.34 0.00 0.00 178.44 178.54 1aje h LYS 166 N 0.25 0.00 0.04 1.25 1.63 -1.91 0.73 116.57 118.56 1aje h LYS 166 Ca 0.44 0.00 -0.32 0.00 -0.85 0.00 0.00 60.65 59.92 1aje h LYS 166 Cb 0.78 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.38 1aje h LYS 166 CO -0.55 0.00 -1.79 -1.71 -3.45 0.00 0.00 179.45 171.96 1aje n ASN 167 N -2.44 1.96 0.26 4.20 5.15 0.71 -2.09 115.26 123.02 1aje n ASN 167 Ca -0.01 0.30 0.14 0.00 -0.60 0.00 0.00 54.58 54.41 1aje n ASN 167 Cb 0.10 -0.87 0.71 0.00 -0.53 0.00 0.00 39.78 39.20 1aje n ASN 167 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1aje h VAL 168 N -0.61 0.44 0.18 3.44 2.07 0.97 0.76 116.25 123.50 1aje h VAL 168 Ca -0.45 -0.60 -0.31 0.00 0.82 0.00 0.00 66.70 66.17 1aje h VAL 168 Cb 1.62 1.42 0.02 0.00 -1.52 0.00 0.00 31.29 32.82 1aje h VAL 168 CO -0.15 0.11 -1.38 -0.26 0.02 0.00 0.00 177.57 175.91 1aje h PHE 169 N 0.00 0.69 -0.06 1.57 -1.00 0.34 1.81 116.94 120.29 1aje h PHE 169 Ca -0.00 -0.51 -0.17 0.00 2.81 0.00 0.00 57.97 60.10 1aje h PHE 169 Cb 0.41 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.93 1aje h PHE 169 CO 0.00 1.42 -0.72 -0.44 -1.61 0.00 0.00 178.31 176.96 1aje h ASP 170 N 0.10 0.38 0.33 2.17 3.32 -0.70 -2.76 116.42 119.26 1aje h ASP 170 Ca -0.20 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.59 1aje h ASP 170 Cb 2.06 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 41.50 1aje h ASP 170 CO 0.23 0.97 -0.16 -0.33 -1.72 0.00 0.00 179.24 178.23 1aje h GLU 171 N 0.21 -0.42 -0.94 3.56 3.07 0.53 0.64 114.58 121.23 1aje h GLU 171 Ca -0.03 0.03 0.24 0.00 -0.50 0.00 0.00 59.36 59.11 1aje h GLU 171 Cb 1.28 0.10 -0.18 0.00 -0.84 0.00 0.00 28.75 29.11 1aje h GLU 171 CO 0.12 -0.28 -0.03 0.00 -1.40 0.00 0.00 179.01 177.41 1aje n ALA 172 N -2.74 0.43 -0.04 3.43 0.00 0.61 0.23 120.51 122.43 1aje n ALA 172 Ca -0.05 1.01 -0.14 0.00 0.00 0.00 0.00 53.44 54.26 1aje n ALA 172 Cb 0.17 -0.71 -0.09 0.00 0.00 0.00 0.00 19.45 18.83 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 1.40 0.00 0.00 5.03 -1.50 -1.18 117.51 121.26 1aje h ILE 173 Ca 0.54 -1.40 0.00 0.00 -0.12 0.00 0.00 64.86 63.89 1aje h ILE 173 Cb 1.07 2.14 0.00 0.00 -3.03 0.00 0.00 36.82 37.00 1aje h ILE 173 CO -0.90 0.39 0.07 0.25 -0.68 0.00 0.00 178.15 177.28 1aje h LEU 174 N -0.24 0.00 0.00 1.44 7.12 0.69 1.45 115.31 125.78 1aje h LEU 174 Ca 0.01 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.00 1aje h LEU 174 Cb 0.70 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.83 1aje h LEU 174 CO 0.03 0.00 -1.10 0.00 -0.13 0.00 0.00 178.44 177.24 1aje n ALA 175 N -1.96 2.49 -0.47 1.25 0.00 0.63 -3.82 120.51 118.62 1aje n ALA 175 Ca -0.02 -0.28 0.06 0.00 0.00 0.00 0.00 53.44 53.20 1aje n ALA 175 Cb 0.12 -1.07 0.16 0.00 0.00 0.00 0.00 19.45 18.66 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 -2.20 2.41 0.05 0.00 0.00 0.42 -3.81 120.51 117.38 1aje n ALA 176 Ca -0.01 -1.59 0.01 0.00 0.00 0.00 0.00 53.44 51.84 1aje n ALA 176 Cb 0.58 -0.46 -0.01 0.00 0.00 0.00 0.00 19.45 19.56 1aje n ALA 176 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 177 N -0.08 0.05 -3.03 0.00 -0.00 0.28 -4.39 117.00 109.82 1aje n LEU 177 Ca 0.13 -0.48 -0.01 0.00 -0.00 0.00 0.00 56.01 55.66 1aje n LEU 177 Cb 0.56 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.98 1aje n LEU 177 CO 0.09 0.01 -0.38 1.21 -0.00 0.00 0.00 177.39 178.32 1aje n GLU 178 N -1.05 -1.47 -2.35 1.47 2.13 -1.25 -4.91 120.64 113.21 1aje n GLU 178 Ca 0.00 1.47 -0.33 0.00 0.66 0.00 0.00 57.16 58.97 1aje n GLU 178 Cb 0.02 -2.03 -0.02 0.00 0.27 0.00 0.00 31.44 29.68 1aje n GLU 178 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1aje s PRO 179 N -0.81 3.70 0.21 5.31 0.04 -1.26 -4.99 135.00 137.19 1aje s PRO 179 Ca -0.03 1.18 -0.30 0.00 0.04 0.00 0.00 61.00 61.89 1aje s PRO 179 Cb 0.00 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 1aje s PRO 179 CO 0.20 -0.50 1.38 -1.25 0.04 0.00 0.00 177.00 176.87 1aje s PRO 180 N -3.75 4.33 -0.02 0.56 0.04 -1.26 -4.95 135.00 129.95 1aje s PRO 180 Ca 0.63 2.16 -0.24 0.00 0.04 0.00 0.00 61.00 63.60 1aje s PRO 180 Cb -0.14 -3.17 -0.20 0.00 0.04 0.00 0.00 34.50 31.03 1aje s PRO 180 CO 0.28 -0.35 1.16 0.93 0.04 0.00 0.00 177.00 179.07 1aje h GLU 181 N 5.45 0.18 -3.53 4.56 5.08 -2.04 -3.33 114.58 120.94 1aje h GLU 181 Ca -0.45 -0.14 -0.59 0.00 -1.00 0.00 0.00 59.36 57.18 1aje h GLU 181 Cb 1.21 0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.51 1aje h GLU 181 CO 0.79 0.78 3.15 -0.35 -1.00 0.00 0.00 179.01 182.37 1aje n PRO 182 N -4.60 2.77 -1.37 2.33 -0.04 -1.26 -4.93 135.00 127.90 1aje n PRO 182 Ca -0.08 -2.02 -0.30 0.00 -0.04 0.00 0.00 63.50 61.05 1aje n PRO 182 Cb 0.41 -2.82 0.10 0.00 -0.04 0.00 0.00 33.50 31.15 1aje n PRO 182 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1aje s LYS 183 N 3.12 1.99 -0.09 0.54 -2.85 -1.25 -4.87 119.74 116.32 1aje s LYS 183 Ca 0.55 0.88 -0.40 0.00 -1.00 0.00 0.00 55.97 56.00 1aje s LYS 183 Cb 0.14 -1.89 -0.18 0.00 -2.06 0.00 0.00 37.83 33.85 1aje s LYS 183 CO -0.03 -1.75 1.37 1.17 0.10 0.00 0.00 175.35 176.20 1aje n LYS 184 N -3.56 0.63 -2.19 1.78 0.00 -1.26 -4.92 118.16 108.64 1aje n LYS 184 Ca 0.08 0.23 -0.26 0.00 0.00 0.00 0.00 58.31 58.35 1aje n LYS 184 Cb 0.55 -1.81 0.07 0.00 0.00 0.00 0.00 35.03 33.83 1aje n LYS 184 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1aje s SER 185 N 1.26 4.84 -1.31 3.14 1.04 -1.26 -4.96 113.70 116.45 1aje s SER 185 Ca 0.92 0.49 -0.16 0.00 0.48 0.00 0.00 55.95 57.68 1aje s SER 185 Cb -1.15 -1.15 0.09 0.00 0.10 0.00 0.00 66.02 63.90 1aje s SER 185 CO 0.59 -1.59 1.77 0.54 0.98 0.00 0.00 173.24 175.53 1aje n ARG 186 N -2.93 3.19 0.00 4.02 3.00 -1.26 -5.31 116.66 117.38 1aje n ARG 186 Ca 0.08 -3.28 0.00 0.00 -0.01 0.00 0.00 57.85 54.64 1aje n ARG 186 Cb 0.60 -3.36 0.00 0.00 0.00 0.00 0.00 32.46 29.70 1aje n ARG 186 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50