#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 6.64 0.57 1.61 0.01 -1.26 -5.01 113.70 116.26 1aje s SER -6 Ca 0.00 2.08 -0.18 0.00 1.31 0.00 0.00 55.95 59.16 1aje s SER -6 Cb 0.00 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 1aje s SER -6 CO 0.00 -0.58 1.11 -1.59 0.41 0.00 0.00 173.24 172.59 1aje s LYS -5 N -2.58 3.26 1.00 12.44 -2.85 -1.26 -4.95 119.74 124.80 1aje s LYS -5 Ca 0.59 1.48 -0.17 0.00 -1.00 0.00 0.00 55.97 56.87 1aje s LYS -5 Cb -0.23 -2.00 -0.13 0.00 -2.06 0.00 0.00 37.83 33.41 1aje s LYS -5 CO 0.28 -0.90 -0.75 -0.89 0.10 0.00 0.00 175.35 173.19 1aje n ILE -4 N -1.64 0.00 -0.27 3.79 -0.00 -1.26 -4.89 119.36 115.09 1aje n ILE -4 Ca 0.11 -0.43 -0.21 0.00 -0.00 0.00 0.00 62.75 62.21 1aje n ILE -4 Cb 0.52 -0.06 0.21 0.00 -0.00 0.00 0.00 39.64 40.30 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 -2.70 0.00 -4.16 1.39 -0.00 -1.25 -5.05 119.36 107.59 1aje n ILE -3 Ca -0.01 0.00 -0.14 0.00 -0.00 0.00 0.00 62.75 62.60 1aje n ILE -3 Cb 0.57 -0.69 -0.07 0.00 -0.00 0.00 0.00 39.64 39.45 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 -2.58 0.65 -0.81 4.38 0.15 -1.26 -4.76 113.70 109.47 1aje s SER -2 Ca 0.47 -1.43 -0.25 0.00 0.70 0.00 0.00 55.95 55.44 1aje s SER -2 Cb -0.08 0.52 -0.06 0.00 -1.71 0.00 0.00 66.02 64.69 1aje s SER -2 CO 0.39 -1.05 2.06 0.00 1.20 0.00 0.00 173.24 175.84 1aje s ALA -1 N -3.71 1.54 -0.00 5.45 0.00 -1.26 -4.26 121.76 119.52 1aje s ALA -1 Ca 0.35 -1.14 0.25 0.00 0.00 0.00 0.00 51.96 51.42 1aje s ALA -1 Cb 0.03 -4.51 0.42 0.00 0.00 0.00 0.00 23.12 19.06 1aje s ALA -1 CO 0.17 -4.88 1.17 0.00 0.00 0.00 0.00 175.76 172.22 1aje n MET 1 N 8.91 0.01 0.03 0.00 0.00 -1.25 -4.93 117.12 119.89 1aje n MET 1 Ca 0.38 -1.98 -0.01 0.00 0.00 0.00 0.00 57.70 56.09 1aje n MET 1 Cb 0.47 -0.03 -0.00 0.00 0.00 0.00 0.00 33.22 33.66 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 0.47 0.05 -2.48 3.17 1.13 -1.26 -5.05 117.38 113.41 1aje n GLN 2 Ca 0.06 0.02 -0.03 0.00 -1.94 0.00 0.00 57.00 55.11 1aje n GLN 2 Cb 1.13 -0.59 -0.02 0.00 0.11 0.00 0.00 30.24 30.87 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 -3.49-12.27 -3.99 5.09 -1.04 -1.26 -4.92 114.28 92.39 1aje n THR 3 Ca -0.02 2.78 -0.32 0.00 -2.04 0.00 0.00 64.05 64.45 1aje n THR 3 Cb 0.15 -5.99 -0.14 0.00 -1.82 0.00 0.00 70.33 62.52 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 -0.58 2.44 -0.65 12.58 1.09 0.34 -4.83 121.20 131.60 1aje s ILE 4 Ca -0.13 -2.01 -0.27 0.00 -1.10 0.00 0.00 60.65 57.14 1aje s ILE 4 Cb 0.01 -2.65 0.03 0.00 -1.06 0.00 0.00 42.46 38.80 1aje s ILE 4 CO 0.35 -0.40 1.19 -0.75 -0.10 0.00 0.00 174.94 175.23 1aje s LYS 5 N 1.02 3.34 -0.07 2.79 2.47 -1.26 0.64 119.74 128.67 1aje s LYS 5 Ca 0.03 -0.07 -0.20 0.00 -1.56 0.00 0.00 55.97 54.18 1aje s LYS 5 Cb -0.20 -4.10 -0.04 0.00 -1.46 0.00 0.00 37.83 32.03 1aje s LYS 5 CO -0.06 -1.87 0.57 0.00 0.16 0.00 0.00 175.35 174.15 1aje s VAL 7 N 0.39 4.95 0.45 0.00 1.01 0.90 -2.59 120.40 125.51 1aje s VAL 7 Ca 0.30 -1.02 -0.20 0.00 0.00 0.00 0.00 61.98 61.06 1aje s VAL 7 Cb -0.17 -3.91 -0.10 0.00 0.00 0.00 0.00 36.38 32.20 1aje s VAL 7 CO 0.14 -0.47 0.96 -0.69 0.00 0.00 0.00 175.10 175.04 1aje s VAL 8 N 1.59 4.41 0.02 2.92 1.01 -0.92 -1.20 120.40 128.24 1aje s VAL 8 Ca 0.04 1.44 -0.01 0.00 0.00 0.00 0.00 61.98 63.45 1aje s VAL 8 Cb -0.22 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 1aje s VAL 8 CO 0.06 -0.39 -0.02 0.68 0.00 0.00 0.00 175.10 175.44 1aje s VAL 9 N -2.26 0.13 0.00 2.92 -7.23 -0.77 -4.34 120.40 108.85 1aje s VAL 9 Ca 0.61 -1.05 0.00 0.00 -1.81 0.00 0.00 61.98 59.74 1aje s VAL 9 Cb -0.09 -0.49 0.00 0.00 0.56 0.00 0.00 36.38 36.36 1aje s VAL 9 CO 0.16 -0.58 0.00 0.61 -0.31 0.00 0.00 175.10 174.99 1aje n GLY 10 N 1.32 -0.55 0.01 2.32 0.00 -1.26 -2.94 105.19 104.09 1aje n GLY 10 Ca -0.22 -1.72 0.04 0.00 0.00 0.00 0.00 46.02 44.12 1aje n GLY 10 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1aje n ASP 11 N -1.33 2.75 -0.53 1.61 5.68 -1.26 -4.89 116.55 118.58 1aje n ASP 11 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1aje n ASP 11 Cb 0.00 1.40 0.00 0.00 -1.14 0.00 0.00 41.12 41.38 1aje n ASP 11 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1aje n GLY 12 N 1.98 -3.65 0.57 6.12 0.00 -1.26 -2.97 105.19 105.98 1aje n GLY 12 Ca -0.03 -0.93 0.43 0.00 0.00 0.00 0.00 46.02 45.49 1aje n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aje n ALA 13 N -0.65 1.53 -0.22 4.61 0.00 -1.26 -3.35 120.51 121.17 1aje n ALA 13 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 53.44 54.02 1aje n ALA 13 Cb 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1aje n ALA 13 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1aje n VAL 14 N -3.73 0.00 0.00 0.00 0.31 -1.26 -4.93 118.33 108.72 1aje n VAL 14 Ca 0.37 0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.76 1aje n VAL 14 Cb 1.64 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 33.61 1aje n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1aje n GLY 15 N 3.33 -0.55 0.00 2.92 0.00 -1.16 -4.98 105.19 104.75 1aje n GLY 15 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 46.02 46.84 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 0.00 0.00 -0.28 1.61 -0.00 -1.19 -3.15 118.16 115.15 1aje n LYS 16 Ca 0.00 0.47 -0.04 0.00 -0.00 0.00 0.00 58.31 58.74 1aje n LYS 16 Cb 0.00 -1.52 0.01 0.00 -0.00 0.00 0.00 35.03 33.53 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 0.09 -0.71 0.58 2.02 -1.94 1.07 112.91 114.02 1aje h THR 17 Ca 0.00 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.39 1aje h THR 17 Cb 0.03 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 66.50 1aje h THR 17 CO 0.00 0.00 0.65 0.00 0.37 0.00 0.00 175.52 176.54 1aje h LEU 19 N 0.00 -0.74 -0.72 0.00 5.85 0.94 -2.49 115.31 118.16 1aje h LEU 19 Ca 0.34 -0.00 0.16 0.00 0.84 0.00 0.00 57.88 59.21 1aje h LEU 19 Cb 1.63 0.19 -0.12 0.00 0.37 0.00 0.00 40.66 42.74 1aje h LEU 19 CO -0.00 -0.37 0.08 -0.07 -0.34 0.00 0.00 178.44 177.73 1aje h LEU 20 N -1.16 -0.18 -0.55 2.25 4.07 -0.93 0.68 115.31 119.48 1aje h LEU 20 Ca -0.09 0.17 0.10 0.00 0.08 0.00 0.00 57.88 58.13 1aje h LEU 20 Cb 0.70 0.27 -0.11 0.00 1.08 0.00 0.00 40.66 42.60 1aje h LEU 20 CO 0.15 -0.11 -0.35 0.40 -1.08 0.00 0.00 178.44 177.44 1aje h ILE 21 N 0.17 0.16 0.00 1.22 1.08 -1.22 0.36 117.51 119.28 1aje h ILE 21 Ca 0.40 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.83 1aje h ILE 21 Cb 0.69 0.16 -0.00 0.00 -3.07 0.00 0.00 36.82 34.59 1aje h ILE 21 CO -0.57 0.00 -0.15 -1.28 -0.69 0.00 0.00 178.15 175.45 1aje h SER 22 N -0.19 0.00 0.26 1.72 0.87 -0.62 2.44 113.55 118.02 1aje h SER 22 Ca 0.21 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.76 1aje h SER 22 Cb 0.55 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.51 1aje h SER 22 CO -0.66 0.15 -0.03 0.22 -0.53 0.00 0.00 176.83 175.98 1aje h TYR 23 N 0.00 0.00 0.00 2.24 3.20 0.44 0.16 116.97 123.01 1aje h TYR 23 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1aje h TYR 23 Cb 0.98 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.25 1aje h TYR 23 CO 0.00 0.03 -0.71 2.41 -1.64 0.00 0.00 178.16 178.25 1aje n THR 24 N -3.38 0.00 0.93 1.81 -1.04 -0.48 -4.76 114.28 107.36 1aje n THR 24 Ca -0.02 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.08 1aje n THR 24 Cb 0.15 -0.43 -0.11 0.00 -1.82 0.00 0.00 70.33 68.13 1aje n THR 24 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1aje n THR 25 N -2.08 0.00 -1.44 12.58 -2.24 0.82 -4.93 114.28 116.99 1aje n THR 25 Ca 0.00 -0.04 -0.08 0.00 -2.27 0.00 0.00 64.05 61.66 1aje n THR 25 Cb 0.35 1.01 -0.03 0.00 -2.10 0.00 0.00 70.33 69.56 1aje n THR 25 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1aje n ASN 26 N -1.42 -2.20 -3.33 3.42 4.13 0.56 -4.80 115.26 111.62 1aje n ASN 26 Ca 0.04 0.21 -0.13 0.00 1.68 0.00 0.00 54.58 56.39 1aje n ASN 26 Cb 0.31 -2.20 -0.07 0.00 -1.54 0.00 0.00 39.78 36.29 1aje n ASN 26 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1aje s LYS 27 N -3.07 0.58 0.09 3.52 2.20 -1.26 -4.80 119.74 117.01 1aje s LYS 27 Ca 0.00 -0.48 -0.11 0.00 -0.36 0.00 0.00 55.97 55.03 1aje s LYS 27 Cb 0.00 -0.51 -0.06 0.00 -1.51 0.00 0.00 37.83 35.75 1aje s LYS 27 CO 0.00 -1.14 0.43 -0.59 -0.36 0.00 0.00 175.35 173.69 1aje s PHE 28 N 1.84 3.59 -0.25 4.03 -0.71 -1.26 -4.74 117.98 120.48 1aje s PHE 28 Ca 0.14 0.85 -0.03 0.00 -1.04 0.00 0.00 56.93 56.85 1aje s PHE 28 Cb -0.13 -2.21 0.02 0.00 -1.21 0.00 0.00 43.02 39.49 1aje s PHE 28 CO -0.13 0.50 2.68 -0.35 -1.34 0.00 0.00 175.22 176.58 1aje n PRO 29 N 0.92 1.97 0.00 1.99 -0.04 -1.26 -4.88 135.00 133.70 1aje n PRO 29 Ca -0.08 -1.52 0.00 0.00 -0.04 0.00 0.00 63.50 61.86 1aje n PRO 29 Cb 0.52 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 1aje n PRO 29 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1aje n SER 30 N 1.20 0.00 -2.77 3.54 3.41 -1.26 -3.68 113.62 114.06 1aje n SER 30 Ca 0.36 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.70 1aje n SER 30 Cb 0.64 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.56 1aje n SER 30 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1aje n GLU 31 N 0.00 3.28 -0.21 4.33 1.02 -1.26 -4.99 120.64 122.82 1aje n GLU 31 Ca 0.00 -4.71 0.00 0.00 -0.02 0.00 0.00 57.16 52.43 1aje n GLU 31 Cb 0.00 -2.23 0.00 0.00 -0.02 0.00 0.00 31.44 29.19 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 -0.33 0.00 -3.61 -0.32 9.36 -1.24 -4.92 117.16 116.10 1aje n TYR 32 Ca 0.34 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 61.27 1aje n TYR 32 Cb 0.50 -0.07 -0.04 0.00 -0.63 0.00 0.00 39.34 39.10 1aje n TYR 32 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1aje s VAL 33 N -0.04 5.15 -0.56 2.97 -7.23 -1.26 -4.97 120.40 114.45 1aje s VAL 33 Ca 0.00 -0.16 -0.27 0.00 -1.81 0.00 0.00 61.98 59.73 1aje s VAL 33 Cb 0.00 -3.70 -0.00 0.00 0.56 0.00 0.00 36.38 33.24 1aje s VAL 33 CO 0.00 -0.15 1.59 -2.16 -0.31 0.00 0.00 175.10 174.07 1aje s PRO 34 N -3.20 3.09 0.34 4.82 0.04 -1.26 -4.63 135.00 134.19 1aje s PRO 34 Ca 0.40 0.58 0.00 0.00 0.04 0.00 0.00 61.00 62.02 1aje s PRO 34 Cb -0.11 -4.22 0.00 0.00 0.04 0.00 0.00 34.50 30.21 1aje s PRO 34 CO 0.28 -2.19 0.00 2.41 0.04 0.00 0.00 177.00 177.54 1aje n THR 35 N 7.00 0.00 -4.40 1.26 -1.04 -1.26 -5.13 114.28 110.71 1aje n THR 35 Ca 0.15 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.92 1aje n THR 35 Cb 0.50 -0.40 -0.11 0.00 -1.82 0.00 0.00 70.33 68.50 1aje n THR 35 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1aje s VAL 36 N -2.00 2.18 0.00 12.58 1.01 -1.26 -5.01 120.40 127.89 1aje s VAL 36 Ca 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 61.98 59.92 1aje s VAL 36 Cb 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.32 1aje s VAL 36 CO 0.00 -0.24 0.00 0.33 0.00 0.00 0.00 175.10 175.19 1aje n PHE 37 N 0.11 -0.04 -0.52 5.22 7.35 -1.26 -5.12 117.46 123.20 1aje n PHE 37 Ca -0.11 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.38 1aje n PHE 37 Cb 0.57 0.01 0.16 0.00 0.35 0.00 0.00 39.48 40.57 1aje n PHE 37 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1aje n ASP 38 N -1.45 -3.05 -4.50 -2.13 8.00 -1.26 -4.83 116.55 107.34 1aje n ASP 38 Ca 0.00 -0.40 -0.37 0.00 0.71 0.00 0.00 54.79 54.72 1aje n ASP 38 Cb 0.00 -0.80 0.05 0.00 -0.02 0.00 0.00 41.12 40.35 1aje n ASP 38 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1aje n ASN 39 N -1.62 -0.69 -3.53 -2.24 2.85 -1.26 -5.00 115.26 103.77 1aje n ASN 39 Ca 0.06 0.71 -0.00 0.00 -0.11 0.00 0.00 54.58 55.24 1aje n ASN 39 Cb 0.39 -1.23 -0.05 0.00 1.24 0.00 0.00 39.78 40.13 1aje n ASN 39 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 1aje s TYR 40 N -1.72 -0.63 -0.16 1.20 6.14 -1.26 -5.08 117.35 115.83 1aje s TYR 40 Ca 0.70 1.17 -0.01 0.00 0.64 0.00 0.00 57.07 59.57 1aje s TYR 40 Cb -0.41 0.38 0.04 0.00 0.42 0.00 0.00 41.96 42.38 1aje s TYR 40 CO 0.53 -0.31 -0.05 0.00 0.64 0.00 0.00 175.55 176.36 1aje s ALA 41 N 1.87 1.45 0.73 3.97 0.00 -1.25 -2.25 121.76 126.28 1aje s ALA 41 Ca -0.06 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.07 1aje s ALA 41 Cb -0.05 -1.11 0.13 0.00 0.00 0.00 0.00 23.12 22.09 1aje s ALA 41 CO -0.16 -0.79 1.01 0.14 0.00 0.00 0.00 175.76 175.97 1aje s VAL 42 N 1.65 2.13 -0.13 0.00 -7.23 -1.01 -4.55 120.40 111.27 1aje s VAL 42 Ca 0.01 -0.55 0.02 0.00 -1.81 0.00 0.00 61.98 59.65 1aje s VAL 42 Cb -0.15 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.21 1aje s VAL 42 CO -0.08 0.00 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.62 1aje s THR 43 N -3.19 2.29 0.39 5.32 2.01 -1.26 0.92 115.64 122.12 1aje s THR 43 Ca 0.67 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.78 1aje s THR 43 Cb -0.05 -1.92 0.03 0.00 0.01 0.00 0.00 72.50 70.56 1aje s THR 43 CO 0.45 0.54 0.25 1.33 -0.69 0.00 0.00 174.62 176.50 1aje n VAL 44 N 3.85 0.00 -3.65 3.82 0.24 -1.07 -4.89 118.33 116.63 1aje n VAL 44 Ca -0.19 -1.59 -0.23 0.00 -2.04 0.00 0.00 64.34 60.29 1aje n VAL 44 Cb 0.52 -0.08 -0.18 0.00 -1.47 0.00 0.00 33.84 32.63 1aje n VAL 44 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1aje s MET 45 N -3.57 0.01 -0.10 7.34 -1.94 -1.26 -1.79 119.30 117.99 1aje s MET 45 Ca 0.19 0.16 -0.26 0.00 -1.71 0.00 0.00 55.69 54.08 1aje s MET 45 Cb -0.01 -1.11 -0.22 0.00 2.01 0.00 0.00 34.83 35.49 1aje s MET 45 CO 0.12 -0.48 0.85 0.82 -0.01 0.00 0.00 175.02 176.32 1aje h ILE 46 N 6.43 1.48 -0.07 2.53 5.03 -1.87 -3.42 117.51 127.61 1aje h ILE 46 Ca -0.14 -1.84 -0.17 0.00 -0.12 0.00 0.00 64.86 62.59 1aje h ILE 46 Cb 1.13 2.67 -0.25 0.00 -3.03 0.00 0.00 36.82 37.35 1aje h ILE 46 CO 0.22 0.45 -0.62 0.61 -0.68 0.00 0.00 178.15 178.13 1aje n GLY 47 N 1.18 1.21 0.00 5.37 0.00 -1.26 -4.91 105.19 106.78 1aje n GLY 47 Ca -0.09 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.34 1.19 3.16 -0.02 0.00 -1.26 -5.00 105.19 102.93 1aje n GLY 48 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 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 2.83 -0.22 1.61 8.01 -1.26 -3.94 118.70 125.50 1aje s GLU 49 Ca 0.00 -0.79 -0.21 0.00 0.01 0.00 0.00 54.97 53.98 1aje s GLU 49 Cb 0.00 -2.24 -0.02 0.00 -4.31 0.00 0.00 34.13 27.56 1aje s GLU 49 CO 0.00 0.05 0.64 -1.25 0.01 0.00 0.00 175.26 174.72 1aje s PRO 50 N 0.65 4.17 -0.21 0.39 0.04 -1.25 -2.57 135.00 136.22 1aje s PRO 50 Ca -0.12 0.61 0.01 0.00 0.04 0.00 0.00 61.00 61.54 1aje s PRO 50 Cb -0.16 -3.61 0.05 0.00 0.04 0.00 0.00 34.50 30.81 1aje s PRO 50 CO 0.03 -0.33 -0.08 0.71 0.04 0.00 0.00 177.00 177.37 1aje s TYR 51 N 2.21 2.33 0.66 0.56 2.02 -0.74 -3.93 117.35 120.47 1aje s TYR 51 Ca 0.28 -1.60 -0.15 0.00 -0.37 0.00 0.00 57.07 55.23 1aje s TYR 51 Cb -0.16 -1.58 0.00 0.00 -0.40 0.00 0.00 41.96 39.83 1aje s TYR 51 CO 0.09 -0.74 1.11 0.99 -1.57 0.00 0.00 175.55 175.44 1aje s THR 52 N 1.42 3.19 -0.21 -0.71 2.01 -1.25 -2.59 115.64 117.51 1aje s THR 52 Ca -0.03 0.56 -0.00 0.00 0.31 0.00 0.00 61.69 62.53 1aje s THR 52 Cb -0.17 -3.08 0.05 0.00 0.01 0.00 0.00 72.50 69.31 1aje s THR 52 CO -0.07 -0.34 -0.05 -0.76 -0.69 0.00 0.00 174.62 172.71 1aje s LEU 53 N -4.89 2.13 -0.67 4.42 2.01 0.26 0.13 118.68 122.08 1aje s LEU 53 Ca 0.67 -0.98 -0.21 0.00 0.01 0.00 0.00 54.13 53.63 1aje s LEU 53 Cb -0.21 -1.05 0.09 0.00 0.01 0.00 0.00 46.19 45.04 1aje s LEU 53 CO 0.42 -0.22 0.88 -0.83 1.01 0.00 0.00 176.35 177.60 1aje s GLY 54 N 1.51 1.61 -0.18 -3.19 0.00 0.21 -2.40 107.32 104.87 1aje s GLY 54 Ca -0.03 -2.12 -0.08 0.00 0.00 0.00 0.00 44.72 42.49 1aje s GLY 54 CO -0.07 1.86 0.10 1.08 0.00 0.00 0.00 173.10 176.07 1aje s LEU 55 N 3.32 4.05 -0.01 0.66 1.02 -0.95 0.13 118.68 126.90 1aje s LEU 55 Ca 0.19 0.19 -0.29 0.00 0.02 0.00 0.00 54.13 54.24 1aje s LEU 55 Cb -0.18 -2.03 0.08 0.00 0.02 0.00 0.00 46.19 44.08 1aje s LEU 55 CO 0.06 0.20 0.73 0.72 0.02 0.00 0.00 176.35 178.08 1aje s PHE 56 N 0.20 -0.56 0.50 0.29 -0.71 -1.07 -4.48 117.98 112.15 1aje s PHE 56 Ca 0.07 0.77 -0.08 0.00 -1.04 0.00 0.00 56.93 56.65 1aje s PHE 56 Cb -0.12 0.47 0.11 0.00 -1.21 0.00 0.00 43.02 42.27 1aje s PHE 56 CO -0.01 -0.62 0.68 -3.47 -1.34 0.00 0.00 175.22 170.46 1aje n ASP 57 N 0.45 0.13 -4.79 1.98 -0.08 -1.26 -2.18 116.55 110.81 1aje n ASP 57 Ca -0.16 -1.29 -0.35 0.00 -1.51 0.00 0.00 54.79 51.47 1aje n ASP 57 Cb 0.60 -0.52 -0.02 0.00 2.34 0.00 0.00 41.12 43.52 1aje n ASP 57 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1aje s THR 58 N -2.42 3.55 0.00 5.18 2.01 -1.26 -4.72 115.64 117.97 1aje s THR 58 Ca 0.39 1.04 0.00 0.00 0.31 0.00 0.00 61.69 63.43 1aje s THR 58 Cb -0.01 -3.47 0.00 0.00 0.01 0.00 0.00 72.50 69.03 1aje s THR 58 CO 0.27 -0.13 0.00 0.00 -0.69 0.00 0.00 174.62 174.07 1aje n ALA 59 N -0.75 0.00 0.00 7.40 0.00 -1.26 -5.15 120.51 120.75 1aje n ALA 59 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1aje n ALA 59 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1aje n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aje n GLY 60 N 0.00 -0.80 2.65 0.00 0.00 -1.26 -5.13 105.19 100.65 1aje n GLY 60 Ca 0.00 -1.17 -0.24 0.00 0.00 0.00 0.00 46.02 44.62 1aje n GLY 60 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1aje s GLN 61 N -2.00 0.19 0.62 1.61 0.74 -1.26 -4.99 119.66 114.58 1aje s GLN 61 Ca 0.00 -0.20 0.27 0.00 0.05 0.00 0.00 55.36 55.48 1aje s GLN 61 Cb 0.00 -1.20 1.34 0.00 1.10 0.00 0.00 33.01 34.26 1aje s GLN 61 CO 0.00 -0.87 1.77 0.93 -0.55 0.00 0.00 175.29 176.56 1aje h GLU 62 N 8.36 0.00 -1.45 1.67 4.39 -2.00 -2.33 114.58 123.21 1aje h GLU 62 Ca -0.17 0.00 0.48 0.00 0.34 0.00 0.00 59.36 60.01 1aje h GLU 62 Cb 1.08 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.61 1aje h GLU 62 CO 0.35 0.00 0.96 -0.25 -1.16 0.00 0.00 179.01 178.91 1aje n ASP 63 N -3.30 0.17 0.00 1.42 8.00 -1.26 -4.65 116.55 116.93 1aje n ASP 63 Ca 0.06 1.27 0.00 0.00 0.71 0.00 0.00 54.79 56.83 1aje n ASP 63 Cb 0.70 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 1aje n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1aje n TYR 64 N -4.50 0.00 -1.89 1.24 9.36 -0.88 -4.66 117.16 115.83 1aje n TYR 64 Ca 0.40 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 61.33 1aje n TYR 64 Cb 1.61 0.00 0.11 0.00 -0.63 0.00 0.00 39.34 40.42 1aje n TYR 64 CO 0.00 0.00 0.00 0.16 0.22 0.00 0.00 176.86 177.24 1aje s ASP 65 N -4.00 4.21 0.00 2.98 1.47 -1.26 -5.01 116.67 115.06 1aje s ASP 65 Ca 0.00 0.70 0.00 0.00 1.18 0.00 0.00 52.55 54.43 1aje s ASP 65 Cb 0.00 -1.11 0.00 0.00 -0.34 0.00 0.00 42.92 41.47 1aje s ASP 65 CO 0.00 -2.09 0.00 0.54 0.68 0.00 0.00 175.17 174.30 1aje n ARG 66 N -3.42 4.87 -3.41 2.11 1.74 -1.26 -4.98 116.66 112.30 1aje n ARG 66 Ca 0.09 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.75 1aje n ARG 66 Cb 0.61 -0.39 -0.10 0.00 -1.02 0.00 0.00 32.46 31.56 1aje n ARG 66 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1aje s LEU 67 N -1.50 4.80 0.04 0.55 2.01 -1.26 -5.06 118.68 118.26 1aje s LEU 67 Ca 0.00 -0.61 0.09 0.00 0.01 0.00 0.00 54.13 53.62 1aje s LEU 67 Cb 0.00 -2.27 -0.03 0.00 0.01 0.00 0.00 46.19 43.91 1aje s LEU 67 CO 0.00 -0.43 -0.25 -0.13 1.01 0.00 0.00 176.35 176.55 1aje s ARG 68 N 1.90 1.73 0.49 1.70 0.52 -1.26 -5.01 118.95 119.02 1aje s ARG 68 Ca 0.09 -1.06 0.31 0.00 -0.52 0.00 0.00 55.73 54.55 1aje s ARG 68 Cb -0.18 -1.88 1.25 0.00 0.52 0.00 0.00 34.95 34.67 1aje s ARG 68 CO 0.12 0.49 1.92 -1.00 0.02 0.00 0.00 175.30 176.84 1aje h PRO 69 N 4.86 0.00 -0.06 3.54 0.13 -2.05 -2.94 132.00 135.48 1aje h PRO 69 Ca -0.45 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.49 1aje h PRO 69 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 1aje h PRO 69 CO 0.44 0.00 -0.75 -0.07 -0.23 0.00 0.00 178.00 177.38 1aje h LEU 70 N 0.00 0.46 -1.89 1.56 3.38 -2.02 -3.47 115.31 113.32 1aje h LEU 70 Ca 0.00 -0.31 -0.31 0.00 0.09 0.00 0.00 57.88 57.35 1aje h LEU 70 Cb 0.51 -0.14 0.18 0.00 0.09 0.00 0.00 40.66 41.29 1aje h LEU 70 CO 0.00 1.06 -0.80 -1.20 0.09 0.00 0.00 178.44 177.59 1aje n SER 71 N -3.82 -3.38 -4.35 -0.43 7.64 -1.11 -4.87 113.62 103.29 1aje n SER 71 Ca -0.04 -0.65 -0.40 0.00 1.01 0.00 0.00 58.87 58.79 1aje n SER 71 Cb 0.72 -5.12 0.01 0.00 -1.01 0.00 0.00 64.21 58.81 1aje n SER 71 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aje n TYR 72 N -3.87 -1.72 0.08 1.43 0.18 -1.26 -4.90 117.16 107.10 1aje n TYR 72 Ca -0.23 0.51 -0.09 0.00 1.88 0.00 0.00 57.90 59.97 1aje n TYR 72 Cb 0.66 -1.83 -0.06 0.00 -0.38 0.00 0.00 39.34 37.72 1aje n TYR 72 CO 0.00 0.00 0.00 -1.00 -2.08 0.00 0.00 176.86 173.78 1aje h PRO 73 N 0.27 -0.29 -2.27 -3.48 0.13 -1.90 -3.46 132.00 121.00 1aje h PRO 73 Ca -0.41 0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.71 1aje h PRO 73 Cb 1.43 0.07 -0.25 0.00 0.13 0.00 0.00 31.00 32.38 1aje h PRO 73 CO 0.46 0.04 -0.28 -0.65 -0.23 0.00 0.00 178.00 177.33 1aje s GLN 74 N -3.20 0.42 0.11 0.86 -0.21 -1.21 -5.06 119.66 111.37 1aje s GLN 74 Ca -0.10 1.17 0.02 0.00 0.02 0.00 0.00 55.36 56.47 1aje s GLN 74 Cb 0.00 0.51 -0.01 0.00 1.00 0.00 0.00 33.01 34.52 1aje s GLN 74 CO 0.36 -0.25 0.06 -2.37 -2.12 0.00 0.00 175.29 170.97 1aje n THR 75 N 5.41 0.00 -2.94 -0.19 5.66 -1.26 -4.36 114.28 116.60 1aje n THR 75 Ca -0.09 -0.70 -0.01 0.00 -3.05 0.00 0.00 64.05 60.20 1aje n THR 75 Cb 0.49 0.29 0.00 0.00 -1.55 0.00 0.00 70.33 69.57 1aje n THR 75 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1aje n ASP 76 N -2.19 -7.31 -2.36 1.09 9.92 0.23 -4.86 116.55 111.07 1aje n ASP 76 Ca -0.00 -0.09 -0.05 0.00 -0.53 0.00 0.00 54.79 54.12 1aje n ASP 76 Cb 0.18 -4.97 0.04 0.00 -0.64 0.00 0.00 41.12 35.72 1aje n ASP 76 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1aje n VAL 77 N -1.76 0.00 -3.48 2.53 0.31 0.28 -4.70 118.33 111.51 1aje n VAL 77 Ca -0.00 -0.19 -0.25 0.00 -0.01 0.00 0.00 64.34 63.89 1aje n VAL 77 Cb 0.50 -1.85 -0.13 0.00 -0.91 0.00 0.00 33.84 31.46 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 -1.42 0.07 -0.75 3.52 0.08 -0.39 -0.07 117.98 119.02 1aje s PHE 78 Ca 0.14 -0.72 -0.20 0.00 0.12 0.00 0.00 56.93 56.26 1aje s PHE 78 Cb -0.00 -0.73 0.10 0.00 -0.57 0.00 0.00 43.02 41.81 1aje s PHE 78 CO 0.09 -0.87 0.98 -0.51 -0.10 0.00 0.00 175.22 174.82 1aje s LEU 79 N 2.05 4.82 -0.46 -0.37 1.43 -0.34 -1.17 118.68 124.64 1aje s LEU 79 Ca 0.10 -1.47 -0.27 0.00 -1.03 0.00 0.00 54.13 51.46 1aje s LEU 79 Cb -0.16 -2.39 0.03 0.00 0.03 0.00 0.00 46.19 43.70 1aje s LEU 79 CO -0.30 -1.24 1.04 -0.69 0.23 0.00 0.00 176.35 175.39 1aje s VAL 80 N 3.29 4.35 -0.33 -1.59 1.01 -0.44 -1.84 120.40 124.86 1aje s VAL 80 Ca 0.24 1.06 -0.27 0.00 0.00 0.00 0.00 61.98 63.01 1aje s VAL 80 Cb -0.13 -4.51 -0.05 0.00 0.00 0.00 0.00 36.38 31.68 1aje s VAL 80 CO 0.02 -0.89 2.20 0.00 0.00 0.00 0.00 175.10 176.43 1aje h PHE 82 N 16.04 -0.20 -3.22 0.00 3.04 0.14 -3.43 116.94 129.31 1aje h PHE 82 Ca -0.35 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.61 1aje h PHE 82 Cb 1.23 0.08 -0.02 0.00 2.56 0.00 0.00 35.95 39.81 1aje h PHE 82 CO 0.95 -0.12 -0.36 0.43 -2.02 0.00 0.00 178.31 177.19 1aje n SER 83 N -5.20 -2.41 -0.03 0.41 7.64 -1.24 -2.79 113.62 110.01 1aje n SER 83 Ca -0.07 0.39 0.03 0.00 1.01 0.00 0.00 58.87 60.24 1aje n SER 83 Cb 0.12 -2.09 -0.03 0.00 -1.01 0.00 0.00 64.21 61.20 1aje n SER 83 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1aje n VAL 84 N 0.45 0.00 0.99 0.44 0.31 -1.26 -3.17 118.33 116.10 1aje n VAL 84 Ca -0.07 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 1aje n VAL 84 Cb 0.11 1.02 0.00 0.00 -0.91 0.00 0.00 33.84 34.06 1aje n VAL 84 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1aje n VAL 85 N -0.98 0.00 -3.92 2.52 0.24 -1.26 -3.18 118.33 111.75 1aje n VAL 85 Ca 0.02 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.23 1aje n VAL 85 Cb 0.11 -0.32 -0.04 0.00 -1.47 0.00 0.00 33.84 32.12 1aje n VAL 85 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1aje s SER 86 N -0.49 -0.16 -0.34 -1.34 1.04 -1.26 -4.80 113.70 106.35 1aje s SER 86 Ca 0.00 -0.77 -0.29 0.00 0.48 0.00 0.00 55.95 55.37 1aje s SER 86 Cb 0.00 0.62 0.01 0.00 0.10 0.00 0.00 66.02 66.74 1aje s SER 86 CO 0.00 -1.17 1.30 -2.16 0.98 0.00 0.00 173.24 172.19 1aje s PRO 87 N -3.97 3.83 -0.90 4.02 0.04 -0.38 -3.68 135.00 133.97 1aje s PRO 87 Ca 0.17 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.32 1aje s PRO 87 Cb -0.02 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.61 1aje s PRO 87 CO 0.06 -1.23 0.00 0.45 0.04 0.00 0.00 177.00 176.32 1aje n SER 88 N 7.88 -2.83 -0.32 6.66 2.88 -1.26 -4.77 113.62 121.87 1aje n SER 88 Ca 0.15 0.25 -0.03 0.00 -1.33 0.00 0.00 58.87 57.90 1aje n SER 88 Cb 0.47 -2.60 0.08 0.00 -0.75 0.00 0.00 64.21 61.41 1aje n SER 88 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1aje h SER 89 N 0.00 0.98 0.00 -3.46 0.87 -1.79 -0.11 113.55 110.04 1aje h SER 89 Ca -0.21 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 1aje h SER 89 Cb 0.88 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 1aje h SER 89 CO 0.27 0.71 0.11 2.22 -0.53 0.00 0.00 176.83 179.61 1aje n PHE 90 N -4.49 0.00 0.12 2.24 -1.74 -1.12 -1.84 117.46 110.63 1aje n PHE 90 Ca 0.09 0.00 -0.24 0.00 -0.56 0.00 0.00 57.45 56.74 1aje n PHE 90 Cb 0.02 -0.37 -0.16 0.00 1.52 0.00 0.00 39.48 40.49 1aje n PHE 90 CO 0.00 0.00 0.00 1.49 -0.56 0.00 0.00 176.76 177.69 1aje h GLU 91 N 0.00 0.50 0.00 3.97 4.22 -1.29 -3.12 114.58 118.86 1aje h GLU 91 Ca 0.00 -0.85 -0.03 0.00 0.08 0.00 0.00 59.36 58.56 1aje h GLU 91 Cb 0.21 0.32 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1aje h GLU 91 CO 0.00 1.41 -0.12 -2.95 -2.18 0.00 0.00 179.01 175.17 1aje h ASN 92 N 0.14 0.00 -0.29 1.04 -1.07 -1.50 -0.66 115.58 113.23 1aje h ASN 92 Ca -0.29 0.00 0.08 0.00 0.07 0.00 0.00 56.30 56.17 1aje h ASN 92 Cb 2.15 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 38.39 1aje h ASN 92 CO 0.25 0.12 0.21 0.58 0.07 0.00 0.00 177.43 178.66 1aje h VAL 93 N 0.00 0.83 0.11 6.14 2.07 -1.48 -2.33 116.25 121.59 1aje h VAL 93 Ca -0.00 0.00 -0.37 0.00 0.82 0.00 0.00 66.70 67.15 1aje h VAL 93 Cb 0.48 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1aje h VAL 93 CO 0.02 0.00 -2.03 0.29 0.02 0.00 0.00 177.57 175.87 1aje n LYS 94 N -4.41 0.75 -0.28 1.57 4.76 -0.29 -2.31 118.16 117.96 1aje n LYS 94 Ca 0.04 0.25 0.23 0.00 -2.87 0.00 0.00 58.31 55.96 1aje n LYS 94 Cb 0.38 -1.70 0.56 0.00 -1.84 0.00 0.00 35.03 32.43 1aje n LYS 94 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1aje h GLU 95 N 0.06 0.31 0.00 1.97 4.39 -1.07 -3.00 114.58 117.25 1aje h GLU 95 Ca -0.43 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.25 1aje h GLU 95 Cb 2.02 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 30.61 1aje h GLU 95 CO 0.07 0.20 -0.22 1.63 -1.16 0.00 0.00 179.01 179.54 1aje n LYS 96 N -4.50 3.31 -0.02 2.33 5.02 -1.10 -4.63 118.16 118.58 1aje n LYS 96 Ca 0.22 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.31 1aje n LYS 96 Cb 0.86 -0.47 -0.13 0.00 -0.02 0.00 0.00 35.03 35.26 1aje n LYS 96 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 1aje h TRP 97 N 0.00 0.32 -0.69 2.13 4.06 -1.49 -2.61 115.95 117.68 1aje h TRP 97 Ca 0.00 -0.24 -0.05 0.00 2.06 0.00 0.00 58.89 60.66 1aje h TRP 97 Cb 0.00 -0.01 -0.03 0.00 -1.00 0.00 0.00 29.16 28.12 1aje h TRP 97 CO 0.00 1.44 0.23 0.28 -3.56 0.00 0.00 178.44 176.83 1aje h VAL 98 N -0.52 1.25 0.00 1.49 2.07 -1.57 0.14 116.25 119.11 1aje h VAL 98 Ca -0.25 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 66.41 1aje h VAL 98 Cb 1.57 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1aje h VAL 98 CO 0.02 0.33 -0.12 1.55 0.02 0.00 0.00 177.57 179.37 1aje h PRO 99 N 1.01 0.00 0.00 1.57 0.13 -1.70 1.01 132.00 134.02 1aje h PRO 99 Ca 0.23 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 65.13 1aje h PRO 99 Cb 0.26 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.36 1aje h PRO 99 CO -0.01 0.12 -1.14 1.49 -0.23 0.00 0.00 178.00 178.22 1aje h GLU 100 N 0.00 0.01 0.00 0.86 4.57 -0.54 -3.28 114.58 116.20 1aje h GLU 100 Ca -0.00 -0.01 -0.29 0.00 -1.18 0.00 0.00 59.36 57.87 1aje h GLU 100 Cb 0.43 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.98 1aje h GLU 100 CO 0.01 0.91 -1.97 0.44 -1.18 0.00 0.00 179.01 177.22 1aje n ILE 101 N -3.30 0.96 -0.04 2.32 -5.35 0.27 -4.35 119.36 109.87 1aje n ILE 101 Ca -0.04 -0.25 -0.20 0.00 -0.27 0.00 0.00 62.75 61.99 1aje n ILE 101 Cb 0.96 -1.71 -0.13 0.00 -1.74 0.00 0.00 39.64 37.03 1aje n ILE 101 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1aje h THR 102 N -0.60 1.12 0.00 7.28 1.35 0.81 1.88 112.91 124.75 1aje h THR 102 Ca -0.44 -2.33 0.00 0.00 -0.55 0.00 0.00 66.41 63.09 1aje h THR 102 Cb 1.40 2.68 0.00 0.00 -1.73 0.00 0.00 68.15 70.50 1aje h THR 102 CO -0.26 0.58 0.07 0.45 -0.25 0.00 0.00 175.52 176.11 1aje h HIS 103 N -0.61 0.00 0.00 4.73 3.86 -1.39 -3.18 115.15 118.56 1aje h HIS 103 Ca -0.27 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.94 1aje h HIS 103 Cb 1.51 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.98 1aje h HIS 103 CO 0.14 0.00 -0.79 0.72 0.86 0.00 0.00 177.93 178.86 1aje n HIS 104 N -3.03 0.00 -3.11 2.45 8.25 -1.22 -5.01 115.22 113.55 1aje n HIS 104 Ca -0.03 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.45 1aje n HIS 104 Cb 0.13 -0.40 -0.00 0.00 1.12 0.00 0.00 29.99 30.84 1aje n HIS 104 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1aje h PRO 106 N 6.98 0.00 -0.20 0.00 0.13 -1.19 -3.41 132.00 134.30 1aje h PRO 106 Ca 0.01 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.05 1aje h PRO 106 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 1aje h PRO 106 CO 0.06 0.09 -0.08 1.17 -0.23 0.00 0.00 178.00 179.02 1aje n LYS 107 N -4.67 -1.05 0.00 0.86 3.00 -1.26 -3.54 118.16 111.50 1aje n LYS 107 Ca -0.06 0.51 0.00 0.00 -0.00 0.00 0.00 58.31 58.76 1aje n LYS 107 Cb 0.19 -4.43 0.00 0.00 0.00 0.00 0.00 35.03 30.79 1aje n LYS 107 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1aje n THR 108 N -2.50 0.00 -2.07 3.15 5.66 -1.26 -4.99 114.28 112.27 1aje n THR 108 Ca -0.04 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.68 1aje n THR 108 Cb 0.33 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.06 1aje n THR 108 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1aje s PRO 109 N 0.00 2.59 -0.20 1.09 0.04 -1.23 -4.53 135.00 132.77 1aje s PRO 109 Ca 0.00 -0.47 0.01 0.00 0.04 0.00 0.00 61.00 60.57 1aje s PRO 109 Cb 0.00 -5.11 0.04 0.00 0.04 0.00 0.00 34.50 29.48 1aje s PRO 109 CO 0.00 -3.43 -0.09 0.12 0.04 0.00 0.00 177.00 173.65 1aje s PHE 110 N 10.01 2.28 -0.19 0.56 2.19 -1.26 -1.26 117.98 130.31 1aje s PHE 110 Ca 0.69 -1.52 0.00 0.00 0.33 0.00 0.00 56.93 56.43 1aje s PHE 110 Cb -0.05 -1.57 0.04 0.00 -1.31 0.00 0.00 43.02 40.13 1aje s PHE 110 CO 0.01 -0.72 -0.08 -0.51 1.83 0.00 0.00 175.22 175.74 1aje s LEU 111 N 1.44 2.06 -0.65 6.12 1.43 -0.31 0.32 118.68 129.09 1aje s LEU 111 Ca -0.01 -0.82 -0.23 0.00 -1.03 0.00 0.00 54.13 52.04 1aje s LEU 111 Cb -0.16 -1.12 0.06 0.00 0.03 0.00 0.00 46.19 45.00 1aje s LEU 111 CO -0.08 -0.16 0.97 -0.22 0.23 0.00 0.00 176.35 177.09 1aje s LEU 112 N 1.48 4.29 -0.08 1.79 2.96 -0.41 -1.32 118.68 127.38 1aje s LEU 112 Ca -0.01 -0.88 0.04 0.00 -0.22 0.00 0.00 54.13 53.06 1aje s LEU 112 Cb -0.16 -2.48 -0.01 0.00 0.50 0.00 0.00 46.19 44.04 1aje s LEU 112 CO -0.08 -1.42 -0.20 -0.69 -1.32 0.00 0.00 176.35 172.64 1aje s VAL 113 N 4.11 2.49 0.44 1.68 1.01 -1.05 -0.70 120.40 128.37 1aje s VAL 113 Ca 0.24 -0.89 -0.25 0.00 0.00 0.00 0.00 61.98 61.08 1aje s VAL 113 Cb -0.16 -1.97 -0.09 0.00 0.00 0.00 0.00 36.38 34.16 1aje s VAL 113 CO 0.12 0.56 1.26 0.61 0.00 0.00 0.00 175.10 177.64 1aje n GLY 114 N 3.11 0.50 0.00 4.51 0.00 0.74 0.17 105.19 114.22 1aje n GLY 114 Ca -0.18 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1aje n GLY 114 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1aje n THR 115 N -0.34 0.00 0.00 2.61 5.66 -1.26 -4.33 114.28 116.61 1aje n THR 115 Ca 0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 1aje n THR 115 Cb 0.40 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.18 1aje n THR 115 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1aje n GLN 116 N 0.00 0.00 0.00 1.09 3.00 -1.26 -4.22 117.38 115.99 1aje n GLN 116 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1aje n GLN 116 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 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 0.00 0.00 -0.07 5.09 5.41 -1.26 -2.45 119.36 126.08 1aje n ILE 117 Ca 0.00 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.61 1aje n ILE 117 Cb 0.00 0.00 -0.13 0.00 -0.71 0.00 0.00 39.64 38.80 1aje n ILE 117 CO 0.00 0.00 0.00 -2.24 0.00 0.00 0.00 176.55 174.31 1aje h ASP 118 N 0.00 -0.00 0.00 4.38 2.03 -1.95 -3.34 116.42 117.55 1aje h ASP 118 Ca 0.00 -0.96 0.00 0.00 -0.73 0.00 0.00 57.03 55.34 1aje h ASP 118 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1aje h ASP 118 CO 0.00 0.97 -0.96 0.18 -1.03 0.00 0.00 179.24 178.40 1aje n LEU 119 N -4.63 2.30 0.30 0.15 7.99 -1.26 -4.29 117.00 117.56 1aje n LEU 119 Ca -0.10 0.00 0.19 0.00 -0.01 0.00 0.00 56.01 56.09 1aje n LEU 119 Cb 0.46 0.00 0.97 0.00 -0.11 0.00 0.00 43.42 44.74 1aje n LEU 119 CO 0.34 0.38 1.16 0.03 -1.51 0.00 0.00 177.39 177.79 1aje h ARG 120 N 0.00 0.00 0.00 3.23 2.47 -1.93 2.19 114.38 120.34 1aje h ARG 120 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1aje h ARG 120 Cb 0.96 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.28 1aje h ARG 120 CO 0.00 0.00 -0.44 -3.47 0.56 0.00 0.00 179.97 176.62 1aje n ASP 121 N -3.22 0.64 -3.48 7.04 2.03 -1.25 -3.95 116.55 114.37 1aje n ASP 121 Ca -0.01 0.19 -0.16 0.00 0.52 0.00 0.00 54.79 55.32 1aje n ASP 121 Cb 0.26 -0.06 0.10 0.00 -0.72 0.00 0.00 41.12 40.69 1aje n ASP 121 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1aje n ASP 122 N -2.01 0.58 0.22 1.67 5.68 0.74 -4.90 116.55 118.53 1aje n ASP 122 Ca 0.04 -1.58 0.14 0.00 -0.50 0.00 0.00 54.79 52.90 1aje n ASP 122 Cb 0.42 -0.50 0.75 0.00 -1.14 0.00 0.00 41.12 40.64 1aje n ASP 122 CO 0.00 0.00 0.00 1.55 -1.33 0.00 0.00 177.20 177.42 1aje h PRO 123 N 0.00 0.00 -0.75 0.11 0.13 -1.89 -2.69 132.00 126.91 1aje h PRO 123 Ca -0.23 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 65.10 1aje h PRO 123 Cb 0.77 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.86 1aje h PRO 123 CO 0.21 0.00 0.53 0.77 -0.23 0.00 0.00 178.00 179.28 1aje h SER 124 N 0.00 0.12 0.19 1.44 0.02 -1.87 0.34 113.55 113.79 1aje h SER 124 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1aje h SER 124 Cb 0.13 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.66 1aje h SER 124 CO 0.00 0.05 -0.25 1.07 -1.14 0.00 0.00 176.83 176.56 1aje n THR 125 N -4.37 0.00 0.19 -2.27 5.66 -1.01 -4.31 114.28 108.17 1aje n THR 125 Ca 0.15 -0.15 -0.13 0.00 -3.05 0.00 0.00 64.05 60.87 1aje n THR 125 Cb 0.74 0.48 -0.08 0.00 -1.55 0.00 0.00 70.33 69.93 1aje n THR 125 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 1aje h ILE 126 N 1.42 0.53 0.00 1.09 1.08 -0.49 -2.63 117.51 118.51 1aje h ILE 126 Ca 0.00 -0.56 0.00 0.00 -0.39 0.00 0.00 64.86 63.91 1aje h ILE 126 Cb 0.53 0.76 0.00 0.00 -3.07 0.00 0.00 36.82 35.04 1aje h ILE 126 CO 0.00 0.09 0.00 -0.33 -0.69 0.00 0.00 178.15 177.22 1aje h GLU 127 N -0.88 0.00 0.00 2.37 5.08 -1.75 3.29 114.58 122.70 1aje h GLU 127 Ca -0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1aje h GLU 127 Cb 0.54 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1aje h GLU 127 CO 0.09 0.00 -0.05 0.87 -1.00 0.00 0.00 179.01 178.92 1aje h LYS 128 N 0.00 0.00 0.00 2.33 6.56 -1.67 -3.39 116.57 120.40 1aje h LYS 128 Ca 0.00 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.56 1aje h LYS 128 Cb 0.05 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 31.68 1aje h LYS 128 CO 0.00 0.05 -0.07 -0.11 -2.06 0.00 0.00 179.45 177.26 1aje n LEU 129 N -3.11 -0.23 0.00 2.94 0.00 0.05 -4.95 117.00 111.70 1aje n LEU 129 Ca 0.03 -1.13 0.00 0.00 0.00 0.00 0.00 56.01 54.92 1aje n LEU 129 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.95 1aje n LEU 129 CO 0.34 1.06 0.35 0.00 0.00 0.00 0.00 177.39 179.14 1aje n ALA 130 N 0.00 1.12 0.33 1.96 0.00 1.08 -0.82 120.51 124.18 1aje n ALA 130 Ca -0.06 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.42 1aje n ALA 130 Cb 0.50 -0.88 0.21 0.00 0.00 0.00 0.00 19.45 19.28 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 -1.17 0.00 -0.14 0.00 4.01 -1.26 -0.92 118.16 118.68 1aje n LYS 131 Ca 0.00 0.33 0.06 0.00 -0.51 0.00 0.00 58.31 58.19 1aje n LYS 131 Cb 0.03 -1.50 0.13 0.00 -0.51 0.00 0.00 35.03 33.18 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 -1.51 2.74 -2.51 4.39 3.02 0.00 -4.93 115.26 116.46 1aje n ASN 132 Ca 0.02 -1.87 -0.18 0.00 -0.03 0.00 0.00 54.58 52.52 1aje n ASN 132 Cb 0.11 -0.19 -0.00 0.00 -0.61 0.00 0.00 39.78 39.09 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 0.60 -2.24 0.00 3.52 4.76 -0.10 -4.65 118.16 120.04 1aje n LYS 133 Ca 0.11 0.84 0.00 0.00 -2.87 0.00 0.00 58.31 56.39 1aje n LYS 133 Cb 0.40 -5.50 0.00 0.00 -1.84 0.00 0.00 35.03 28.09 1aje n LYS 133 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1aje n GLN 134 N -3.06 0.00 -2.56 1.97 0.00 -1.26 -4.91 117.38 107.55 1aje n GLN 134 Ca -0.19 0.00 -0.06 0.00 0.00 0.00 0.00 57.00 56.75 1aje n GLN 134 Cb 0.65 0.00 -0.05 0.00 0.00 0.00 0.00 30.24 30.84 1aje n GLN 134 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1aje n LYS 135 N 0.00 -4.65 -0.95 2.61 4.76 -1.26 -1.25 118.16 117.43 1aje n LYS 135 Ca 0.00 3.49 -0.31 0.00 -2.87 0.00 0.00 58.31 58.62 1aje n LYS 135 Cb 0.00 -5.03 0.26 0.00 -1.84 0.00 0.00 35.03 28.42 1aje n LYS 135 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1aje s PRO 136 N -0.67 -1.85 0.44 1.97 0.04 -1.26 -1.70 135.00 131.97 1aje s PRO 136 Ca -0.28 -0.16 -0.24 0.00 0.04 0.00 0.00 61.00 60.37 1aje s PRO 136 Cb 0.02 -1.53 -0.08 0.00 0.04 0.00 0.00 34.50 32.95 1aje s PRO 136 CO 0.74 -4.11 1.20 0.42 0.04 0.00 0.00 177.00 175.29 1aje s ILE 137 N -2.89 2.98 0.51 0.56 1.09 -1.19 -4.76 121.20 117.50 1aje s ILE 137 Ca 0.72 0.78 0.00 0.00 -1.10 0.00 0.00 60.65 61.05 1aje s ILE 137 Cb -0.08 -3.41 0.10 0.00 -1.06 0.00 0.00 42.46 38.00 1aje s ILE 137 CO 0.56 0.03 0.70 0.41 -0.10 0.00 0.00 174.94 176.54 1aje n THR 138 N -0.30 0.00 1.32 2.92 -1.04 -1.26 -4.91 114.28 111.00 1aje n THR 138 Ca 0.06 -1.14 0.12 0.00 -2.04 0.00 0.00 64.05 61.06 1aje n THR 138 Cb 0.47 -1.01 0.66 0.00 -1.82 0.00 0.00 70.33 68.64 1aje n THR 138 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1aje n PRO 139 N -2.28 0.52 -0.01 -2.82 -0.04 -1.26 -3.42 135.00 125.69 1aje n PRO 139 Ca 0.12 0.04 -0.01 0.00 -0.04 0.00 0.00 63.50 63.60 1aje n PRO 139 Cb 0.42 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.36 1aje n PRO 139 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1aje n GLU 140 N -1.17 3.10 0.40 0.54 0.28 -1.26 -4.45 120.64 118.07 1aje n GLU 140 Ca 0.14 -0.00 -0.15 0.00 -0.16 0.00 0.00 57.16 56.99 1aje n GLU 140 Cb 0.15 -1.06 -0.07 0.00 1.43 0.00 0.00 31.44 31.89 1aje n GLU 140 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 177.13 178.12 1aje h THR 141 N 0.00 0.00 -0.23 3.84 2.02 -1.93 0.43 112.91 117.04 1aje h THR 141 Ca -0.05 -0.04 0.06 0.00 0.77 0.00 0.00 66.41 67.15 1aje h THR 141 Cb 0.99 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.34 1aje h THR 141 CO 0.00 0.00 -0.23 0.00 0.37 0.00 0.00 175.52 175.66 1aje h ALA 142 N -1.50 -0.12 0.00 6.16 0.00 -1.85 0.78 119.26 122.74 1aje h ALA 142 Ca -0.10 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1aje h ALA 142 Cb 0.77 0.48 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1aje h ALA 142 CO 0.17 -0.66 -0.00 0.93 0.00 0.00 0.00 179.25 179.69 1aje h GLU 143 N -0.24 0.00 -0.50 0.00 5.08 -1.76 -0.03 114.58 117.12 1aje h GLU 143 Ca 0.13 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1aje h GLU 143 Cb 0.45 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1aje h GLU 143 CO -0.37 0.00 0.31 -0.22 -1.00 0.00 0.00 179.01 177.73 1aje h LYS 144 N 0.00 0.68 0.03 2.33 3.64 0.53 -1.58 116.57 122.19 1aje h LYS 144 Ca -0.00 -0.06 -0.33 0.00 -1.27 0.00 0.00 60.65 58.99 1aje h LYS 144 Cb 0.01 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 31.64 1aje h LYS 144 CO 0.00 0.48 -1.98 1.47 -2.27 0.00 0.00 179.45 177.15 1aje n LEU 145 N -4.70 1.33 0.33 5.20 -0.00 -0.64 -2.98 117.00 115.53 1aje n LEU 145 Ca 0.02 0.23 0.22 0.00 -0.00 0.00 0.00 56.01 56.49 1aje n LEU 145 Cb 0.05 -0.18 1.16 0.00 -0.00 0.00 0.00 43.42 44.45 1aje n LEU 145 CO 0.36 0.57 1.17 0.00 -0.00 0.00 0.00 177.39 179.48 1aje h ALA 146 N 0.68 1.02 0.00 1.47 0.00 -1.07 2.32 119.26 123.68 1aje h ALA 146 Ca -0.40 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.39 1aje h ALA 146 Cb 2.05 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.83 1aje h ALA 146 CO 0.06 0.00 -0.59 -0.09 0.00 0.00 0.00 179.25 178.63 1aje h ARG 147 N 0.00 0.00 0.00 0.00 2.43 -1.35 1.55 114.38 117.01 1aje h ARG 147 Ca -0.00 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1aje h ARG 147 Cb 0.06 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1aje h ARG 147 CO 0.00 0.59 -0.50 0.22 -1.51 0.00 0.00 179.97 178.77 1aje h ASP 148 N 0.00 0.00 0.00 -3.80 3.58 0.39 -3.36 116.42 113.23 1aje h ASP 148 Ca -0.01 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.33 1aje h ASP 148 Cb 1.42 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.45 1aje h ASP 148 CO 0.08 0.50 -1.43 0.18 -2.88 0.00 0.00 179.24 175.69 1aje n LEU 149 N -3.28 0.89 -3.15 2.28 4.77 0.11 -5.03 117.00 113.59 1aje n LEU 149 Ca 0.02 -0.01 -0.15 0.00 -0.03 0.00 0.00 56.01 55.84 1aje n LEU 149 Cb 0.70 0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.89 1aje n LEU 149 CO 0.40 0.29 0.07 0.29 -1.33 0.00 0.00 177.39 177.11 1aje n LYS 150 N -2.38 -4.32 0.00 3.23 4.01 0.53 -4.99 118.16 114.24 1aje n LYS 150 Ca -0.11 0.78 0.00 0.00 -0.51 0.00 0.00 58.31 58.47 1aje n LYS 150 Cb 0.68 -5.50 0.00 0.00 -0.51 0.00 0.00 35.03 29.71 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 -3.51 0.00 -0.04 7.82 0.00 -1.25 -4.92 120.51 118.62 1aje n ALA 151 Ca -0.18 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.05 1aje n ALA 151 Cb 0.63 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.95 1aje n ALA 151 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1aje n VAL 152 N -0.40 1.69 -3.64 0.00 3.14 0.96 -4.89 118.33 115.19 1aje n VAL 152 Ca 0.00 -0.58 -0.09 0.00 -2.96 0.00 0.00 64.34 60.71 1aje n VAL 152 Cb 0.00 -1.70 -0.07 0.00 -1.06 0.00 0.00 33.84 31.01 1aje n VAL 152 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1aje s LYS 153 N -2.53 0.72 -0.17 1.45 1.02 -1.06 -5.01 119.74 114.15 1aje s LYS 153 Ca -0.26 1.07 -0.05 0.00 0.02 0.00 0.00 55.97 56.75 1aje s LYS 153 Cb 0.07 0.23 -0.03 0.00 -0.52 0.00 0.00 37.83 37.58 1aje s LYS 153 CO 0.71 -0.12 -0.01 -0.47 -0.92 0.00 0.00 175.35 174.54 1aje s TYR 154 N 1.11 3.08 0.21 3.18 5.04 -1.26 -1.29 117.35 127.42 1aje s TYR 154 Ca -0.06 -0.22 -0.01 0.00 -2.44 0.00 0.00 57.07 54.35 1aje s TYR 154 Cb -0.05 -2.00 0.00 0.00 0.35 0.00 0.00 41.96 40.26 1aje s TYR 154 CO -0.12 -0.01 0.28 1.33 -1.34 0.00 0.00 175.55 175.69 1aje n VAL 155 N 3.61 0.00 -3.81 3.14 0.24 0.13 -5.00 118.33 116.64 1aje n VAL 155 Ca -0.17 -1.07 -0.13 0.00 -2.04 0.00 0.00 64.34 60.93 1aje n VAL 155 Cb 0.52 0.65 -0.13 0.00 -1.47 0.00 0.00 33.84 33.41 1aje n VAL 155 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1aje s GLU 156 N -2.49 0.15 0.00 7.34 1.03 -1.26 -0.18 118.70 123.29 1aje s GLU 156 Ca 0.17 0.24 0.00 0.00 0.03 0.00 0.00 54.97 55.41 1aje s GLU 156 Cb -0.00 0.02 0.00 0.00 -0.80 0.00 0.00 34.13 33.35 1aje s GLU 156 CO 0.12 -0.05 0.00 0.00 -1.33 0.00 0.00 175.26 174.00 1aje n SER 158 N 0.00 1.38 -0.13 0.00 2.88 -1.03 -4.68 113.62 112.04 1aje n SER 158 Ca 0.00 1.13 0.05 0.00 -1.33 0.00 0.00 58.87 58.73 1aje n SER 158 Cb 0.00 -1.19 0.11 0.00 -0.75 0.00 0.00 64.21 62.37 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 1.88 0.18 0.05 -1.46 0.00 -1.26 0.15 120.51 120.05 1aje n ALA 159 Ca 0.17 0.41 0.07 0.00 0.00 0.00 0.00 53.44 54.08 1aje n ALA 159 Cb 0.22 -0.29 -0.07 0.00 0.00 0.00 0.00 19.45 19.31 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 -4.39 0.63 0.25 0.00 -0.00 -1.26 -4.49 117.00 107.73 1aje n LEU 160 Ca 0.09 0.25 -0.14 0.00 -0.00 0.00 0.00 56.01 56.22 1aje n LEU 160 Cb 0.28 0.02 -0.07 0.00 -0.00 0.00 0.00 43.42 43.65 1aje n LEU 160 CO -0.03 -0.02 0.52 0.74 -0.00 0.00 0.00 177.39 178.60 1aje h THR 161 N 0.00 0.00 -1.83 1.47 2.02 0.11 -3.48 112.91 111.20 1aje h THR 161 Ca -0.08 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.07 1aje h THR 161 Cb 1.24 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1aje h THR 161 CO 0.01 0.00 -0.06 0.00 0.37 0.00 0.00 175.52 175.84 1aje n GLN 162 N -4.64 -0.66 0.03 6.66 3.00 -1.19 -4.94 117.38 115.63 1aje n GLN 162 Ca -0.09 0.08 0.13 0.00 -0.01 0.00 0.00 57.00 57.10 1aje n GLN 162 Cb 0.35 -2.80 0.43 0.00 0.00 0.00 0.00 30.24 28.21 1aje n GLN 162 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1aje n LYS 163 N -1.07 0.09 0.00 -1.09 2.85 -1.26 -4.44 118.16 113.24 1aje n LYS 163 Ca -0.01 0.05 0.00 0.00 -1.05 0.00 0.00 58.31 57.30 1aje n LYS 163 Cb 0.51 -1.58 0.00 0.00 -0.65 0.00 0.00 35.03 33.31 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 1.44 0.73 0.36 2.58 0.00 -1.26 -4.95 105.19 104.10 1aje n GLY 164 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 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 0.80 0.00 0.99 5.85 -1.87 1.94 115.31 123.01 1aje h LEU 165 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1aje h LEU 165 Cb 0.56 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1aje h LEU 165 CO 0.00 0.47 0.00 1.17 -0.34 0.00 0.00 178.44 179.74 1aje n LYS 166 N -4.52 0.04 -0.09 1.25 4.81 -1.26 0.13 118.16 118.52 1aje n LYS 166 Ca 0.15 0.18 -0.23 0.00 -0.87 0.00 0.00 58.31 57.53 1aje n LYS 166 Cb 0.30 -1.50 -0.12 0.00 0.02 0.00 0.00 35.03 33.73 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 -1.47 1.97 0.30 3.14 5.15 0.57 -1.41 115.26 123.51 1aje n ASN 167 Ca 0.05 0.26 -0.16 0.00 -0.60 0.00 0.00 54.58 54.13 1aje n ASN 167 Cb 0.20 -0.82 -0.08 0.00 -0.53 0.00 0.00 39.78 38.56 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 -0.58 0.36 -1.00 3.44 2.07 0.14 1.62 116.25 122.31 1aje h VAL 168 Ca -0.50 -0.28 0.19 0.00 0.82 0.00 0.00 66.70 66.94 1aje h VAL 168 Cb 1.66 0.46 -0.10 0.00 -1.52 0.00 0.00 31.29 31.78 1aje h VAL 168 CO -0.17 0.04 0.61 -0.26 0.02 0.00 0.00 177.57 177.81 1aje h PHE 169 N -0.95 1.02 0.00 1.57 -1.00 0.96 3.35 116.94 121.89 1aje h PHE 169 Ca -0.08 0.03 -0.07 0.00 2.81 0.00 0.00 57.97 60.66 1aje h PHE 169 Cb 0.64 -0.31 -0.01 0.00 3.61 0.00 0.00 35.95 39.88 1aje h PHE 169 CO -0.00 0.23 -0.33 0.22 -1.61 0.00 0.00 178.31 176.81 1aje h ASP 170 N 0.73 0.00 0.00 2.17 3.58 -0.14 -2.79 116.42 119.97 1aje h ASP 170 Ca 0.57 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.02 1aje h ASP 170 Cb 0.94 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.99 1aje h ASP 170 CO -0.36 0.33 -0.00 -0.33 -2.88 0.00 0.00 179.24 176.00 1aje h GLU 171 N 0.00 0.00 -0.68 0.28 3.07 1.68 0.51 114.58 119.45 1aje h GLU 171 Ca -0.00 0.00 0.23 0.00 -0.50 0.00 0.00 59.36 59.09 1aje h GLU 171 Cb 0.73 0.00 -0.12 0.00 -0.84 0.00 0.00 28.75 28.51 1aje h GLU 171 CO 0.04 0.00 0.17 0.00 -1.40 0.00 0.00 179.01 177.82 1aje n ALA 172 N -2.35 0.50 -0.01 3.43 0.00 0.90 0.30 120.51 123.28 1aje n ALA 172 Ca -0.00 0.71 -0.16 0.00 0.00 0.00 0.00 53.44 53.99 1aje n ALA 172 Cb 0.00 -0.60 -0.11 0.00 0.00 0.00 0.00 19.45 18.74 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 1.46 0.00 0.00 5.03 -1.58 -0.72 117.51 121.70 1aje h ILE 173 Ca 0.48 -1.99 0.00 0.00 -0.12 0.00 0.00 64.86 63.23 1aje h ILE 173 Cb 1.14 2.60 0.00 0.00 -3.03 0.00 0.00 36.82 37.53 1aje h ILE 173 CO -0.59 0.57 0.10 0.25 -0.68 0.00 0.00 178.15 177.80 1aje h LEU 174 N -0.23 0.00 0.00 1.44 7.12 0.69 1.56 115.31 125.89 1aje h LEU 174 Ca -0.05 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.96 1aje h LEU 174 Cb 1.17 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.30 1aje h LEU 174 CO 0.09 0.00 -1.31 0.00 -0.13 0.00 0.00 178.44 177.09 1aje n ALA 175 N -2.00 3.13 0.73 1.25 0.00 0.47 -1.65 120.51 122.43 1aje n ALA 175 Ca -0.03 -0.42 0.07 0.00 0.00 0.00 0.00 53.44 53.07 1aje n ALA 175 Cb 0.16 -0.92 -0.08 0.00 0.00 0.00 0.00 19.45 18.61 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 -2.01 3.97 0.00 0.00 0.00 0.36 -3.51 120.51 119.33 1aje n ALA 176 Ca -0.00 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1aje n ALA 176 Cb 0.49 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.38 1aje n ALA 176 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1aje n LEU 177 N -1.30 0.00 -3.11 0.00 -0.00 0.44 -3.34 117.00 109.70 1aje n LEU 177 Ca 0.03 -0.11 -0.00 0.00 -0.00 0.00 0.00 56.01 55.93 1aje n LEU 177 Cb 0.25 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.66 1aje n LEU 177 CO 0.31 0.00 -0.39 1.21 -0.00 0.00 0.00 177.39 178.52 1aje n GLU 178 N -0.38 -0.91 -2.01 1.47 2.13 -0.66 -4.92 120.64 115.35 1aje n GLU 178 Ca 0.00 1.13 -0.29 0.00 0.66 0.00 0.00 57.16 58.66 1aje n GLU 178 Cb 0.00 -1.43 0.04 0.00 0.27 0.00 0.00 31.44 30.31 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 -0.80 3.00 0.41 5.31 0.04 -1.26 -5.03 135.00 136.67 1aje s PRO 179 Ca -0.01 0.40 -0.25 0.00 0.04 0.00 0.00 61.00 61.18 1aje s PRO 179 Cb 0.00 -2.09 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 1aje s PRO 179 CO 0.09 -0.87 1.18 -1.25 0.04 0.00 0.00 177.00 176.19 1aje s PRO 180 N -5.24 4.00 0.02 0.56 0.04 -1.26 -4.97 135.00 128.16 1aje s PRO 180 Ca 0.56 1.85 -0.18 0.00 0.04 0.00 0.00 61.00 63.28 1aje s PRO 180 Cb -0.11 -2.64 -0.25 0.00 0.04 0.00 0.00 34.50 31.55 1aje s PRO 180 CO 0.50 -0.37 1.11 0.93 0.04 0.00 0.00 177.00 179.21 1aje h GLU 181 N 2.54 0.50 -3.37 4.56 4.39 -2.05 -3.34 114.58 117.82 1aje h GLU 181 Ca -0.49 -0.57 -0.49 0.00 0.34 0.00 0.00 59.36 58.15 1aje h GLU 181 Cb 1.24 0.17 0.02 0.00 -0.10 0.00 0.00 28.75 30.08 1aje h GLU 181 CO 0.62 1.20 3.01 -0.35 -1.16 0.00 0.00 179.01 182.33 1aje n PRO 182 N -4.07 2.60 -3.29 2.33 -0.04 -1.26 -4.76 135.00 126.50 1aje n PRO 182 Ca -0.11 -1.74 -0.44 0.00 -0.04 0.00 0.00 63.50 61.16 1aje n PRO 182 Cb 0.77 -2.61 -0.00 0.00 -0.04 0.00 0.00 33.50 31.62 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 4.20 3.69 -3.59 0.54 4.76 -1.26 -4.96 118.16 121.53 1aje n LYS 183 Ca 0.56 -4.48 0.01 0.00 -2.87 0.00 0.00 58.31 51.53 1aje n LYS 183 Cb 0.18 -2.53 -0.01 0.00 -1.84 0.00 0.00 35.03 30.83 1aje n LYS 183 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1aje s LYS 184 N -1.60 0.07 1.19 1.97 -2.85 -1.26 -5.16 119.74 112.10 1aje s LYS 184 Ca 0.31 -0.04 -0.14 0.00 -1.00 0.00 0.00 55.97 55.10 1aje s LYS 184 Cb -0.07 0.03 0.27 0.00 -2.06 0.00 0.00 37.83 36.00 1aje s LYS 184 CO -0.05 -0.03 0.83 -1.13 0.10 0.00 0.00 175.35 175.07 1aje n SER 185 N -0.31 -1.99 -3.93 0.03 3.41 -1.26 -4.97 113.62 104.59 1aje n SER 185 Ca -0.04 -0.20 -0.29 0.00 -0.26 0.00 0.00 58.87 58.08 1aje n SER 185 Cb 0.61 -1.19 -0.12 0.00 -0.26 0.00 0.00 64.21 63.25 1aje n SER 185 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1aje s ARG 186 N -4.21 2.52 0.00 4.33 1.81 -1.26 -5.19 118.95 116.94 1aje s ARG 186 Ca 0.67 -3.26 0.17 0.00 -1.72 0.00 0.00 55.73 51.58 1aje s ARG 186 Cb -0.23 -3.48 0.99 0.00 -0.45 0.00 0.00 34.95 31.77 1aje s ARG 186 CO 0.66 -1.27 1.40 0.54 -0.68 0.00 0.00 175.30 175.95