#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajo n HIS 4 N 0.00 3.34 -1.95 1.61 8.25 -1.25 -5.05 115.22 120.18 1ajo n HIS 4 Ca 0.00 -3.01 -0.42 0.00 -0.26 0.00 0.00 57.72 54.03 1ajo n HIS 4 Cb 0.00 -0.13 -0.03 0.00 1.12 0.00 0.00 29.99 30.95 1ajo n HIS 4 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1ajo s GLU 5 N -3.56 4.23 -0.09 -0.41 8.01 -1.26 -4.51 118.70 121.11 1ajo s GLU 5 Ca 0.48 2.36 -0.01 0.00 0.01 0.00 0.00 54.97 57.81 1ajo s GLU 5 Cb 0.40 -3.13 0.03 0.00 -4.31 0.00 0.00 34.13 27.12 1ajo s GLU 5 CO -0.17 -0.54 -0.04 0.21 0.01 0.00 0.00 175.26 174.73 1ajo s LYS 6 N 0.50 1.06 -0.27 1.61 2.47 0.24 -4.99 119.74 120.36 1ajo s LYS 6 Ca 0.66 -0.08 -0.10 0.00 -1.56 0.00 0.00 55.97 54.89 1ajo s LYS 6 Cb -0.43 -1.30 -0.04 0.00 -1.46 0.00 0.00 37.83 34.59 1ajo s LYS 6 CO 0.37 -0.29 0.15 0.08 0.16 0.00 0.00 175.35 175.82 1ajo s VAL 7 N 1.84 5.00 -0.14 4.02 1.01 -1.26 -0.69 120.40 130.18 1ajo s VAL 7 Ca 0.05 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.06 1ajo s VAL 7 Cb -0.12 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 1ajo s VAL 7 CO -0.07 0.28 -0.04 -0.63 0.00 0.00 0.00 175.10 174.65 1ajo s ILE 8 N 1.70 3.92 0.08 2.22 -1.09 -0.31 -4.95 121.20 122.77 1ajo s ILE 8 Ca 0.07 -0.36 -0.31 0.00 -2.23 0.00 0.00 60.65 57.82 1ajo s ILE 8 Cb -0.16 -2.70 -0.08 0.00 -1.58 0.00 0.00 42.46 37.95 1ajo s ILE 8 CO 0.09 0.52 1.48 -0.55 -1.23 0.00 0.00 174.94 175.24 1ajo s SER 9 N 0.10 6.74 0.17 3.58 0.15 -1.26 -1.71 113.70 121.47 1ajo s SER 9 Ca -0.01 2.35 0.12 0.00 0.70 0.00 0.00 55.95 59.11 1ajo s SER 9 Cb -0.14 -2.57 -0.09 0.00 -1.71 0.00 0.00 66.02 61.51 1ajo s SER 9 CO 0.03 -0.75 1.24 -0.07 1.20 0.00 0.00 173.24 174.89 1ajo h LEU 10 N 7.65 0.00 0.01 3.45 3.38 -1.43 -3.48 115.31 124.89 1ajo h LEU 10 Ca -0.41 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.56 1ajo h LEU 10 Cb 1.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1ajo h LEU 10 CO 0.90 0.74 -0.00 0.61 0.09 0.00 0.00 178.44 180.77 1ajo n GLY 11 N 1.32 0.32 3.43 0.83 0.00 -1.26 -4.98 105.19 104.86 1ajo n GLY 11 Ca -0.02 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 1ajo n GLY 11 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ajo s PHE 12 N -1.63 0.03 -0.50 1.61 -0.12 -1.26 -5.12 117.98 110.99 1ajo s PHE 12 Ca 0.00 -0.38 -0.22 0.00 -0.05 0.00 0.00 56.93 56.28 1ajo s PHE 12 Cb 0.00 0.23 0.04 0.00 -0.63 0.00 0.00 43.02 42.66 1ajo s PHE 12 CO 0.00 -0.82 0.76 0.34 -0.05 0.00 0.00 175.22 175.45 1ajo s ASP 13 N -2.89 6.32 0.63 1.98 -1.08 -1.26 -4.26 116.67 116.11 1ajo s ASP 13 Ca 0.10 -0.46 0.39 0.00 -0.52 0.00 0.00 52.55 52.06 1ajo s ASP 13 Cb 0.01 -2.36 2.15 0.00 -1.46 0.00 0.00 42.92 41.26 1ajo s ASP 13 CO -0.04 -0.98 2.31 0.00 0.52 0.00 0.00 175.17 176.98 1ajo h ALA 14 N 9.07 1.19 0.00 3.66 0.00 -1.10 -2.44 119.26 129.64 1ajo h ALA 14 Ca -0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1ajo h ALA 14 Cb 1.09 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1ajo h ALA 14 CO 0.99 0.01 0.00 -1.13 0.00 0.00 0.00 179.25 179.12 1ajo n SER 15 N -3.36 0.00 -0.03 0.00 3.41 -1.26 -3.61 113.62 108.76 1ajo n SER 15 Ca -0.03 0.28 0.13 0.00 -0.26 0.00 0.00 58.87 59.00 1ajo n SER 15 Cb 0.09 -0.42 0.44 0.00 -0.26 0.00 0.00 64.21 64.06 1ajo n SER 15 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ajo n LYS 16 N -1.42 0.15 0.00 4.33 4.76 -0.92 -4.85 118.16 120.21 1ajo n LYS 16 Ca 0.08 -0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1ajo n LYS 16 Cb 0.26 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 1ajo n LYS 16 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ajo n GLY 17 N 1.46 -1.02 3.73 0.72 0.00 -1.24 -5.15 105.19 103.69 1ajo n GLY 17 Ca 0.08 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.62 1ajo n GLY 17 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ajo s PHE 18 N -2.00 3.83 0.15 1.61 0.40 -1.26 -4.56 117.98 116.15 1ajo s PHE 18 Ca 0.00 1.77 0.02 0.00 -0.60 0.00 0.00 56.93 58.12 1ajo s PHE 18 Cb 0.00 -3.01 -0.04 0.00 0.51 0.00 0.00 43.02 40.48 1ajo s PHE 18 CO 0.00 0.26 -0.01 -1.01 0.70 0.00 0.00 175.22 175.16 1ajo s HIS 19 N -0.21 1.11 -0.21 0.36 3.76 -1.15 -4.95 115.29 114.00 1ajo s HIS 19 Ca 0.45 -1.00 -0.07 0.00 -0.15 0.00 0.00 55.06 54.29 1ajo s HIS 19 Cb -0.23 -0.63 -0.03 0.00 1.11 0.00 0.00 32.58 32.79 1ajo s HIS 19 CO 0.29 -0.21 0.05 0.99 -0.85 0.00 0.00 174.74 175.01 1ajo s THR 20 N -3.67 4.43 0.14 1.30 2.01 -1.26 -2.17 115.64 116.42 1ajo s THR 20 Ca 0.21 -0.15 0.09 0.00 0.31 0.00 0.00 61.69 62.15 1ajo s THR 20 Cb 0.06 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 1ajo s THR 20 CO 0.02 0.40 -0.18 -0.31 -0.69 0.00 0.00 174.62 173.86 1ajo s TYR 21 N 0.97 2.52 0.05 4.92 2.02 0.49 -0.87 117.35 127.45 1ajo s TYR 21 Ca 0.03 -0.27 -0.27 0.00 -0.37 0.00 0.00 57.07 56.20 1ajo s TYR 21 Cb -0.14 -1.31 0.08 0.00 -0.40 0.00 0.00 41.96 40.19 1ajo s TYR 21 CO 0.03 0.42 0.71 0.00 -1.57 0.00 0.00 175.55 175.14 1ajo s ALA 22 N -1.29 -1.71 -0.01 3.71 0.00 -0.69 -1.09 121.76 120.67 1ajo s ALA 22 Ca 0.19 0.88 -0.00 0.00 0.00 0.00 0.00 51.96 53.03 1ajo s ALA 22 Cb -0.10 0.46 0.01 0.00 0.00 0.00 0.00 23.12 23.49 1ajo s ALA 22 CO 0.11 -0.63 0.03 -0.59 0.00 0.00 0.00 175.76 174.68 1ajo s PHE 23 N -2.83 -0.01 -0.31 0.00 -0.12 -0.59 -0.86 117.98 113.26 1ajo s PHE 23 Ca -0.01 0.10 -0.13 0.00 -0.05 0.00 0.00 56.93 56.83 1ajo s PHE 23 Cb -0.01 -0.09 -0.03 0.00 -0.63 0.00 0.00 43.02 42.27 1ajo s PHE 23 CO -0.06 -0.05 0.28 0.34 -0.05 0.00 0.00 175.22 175.69 1ajo s ASP 24 N 0.45 6.11 -0.29 1.98 -1.08 0.25 -0.88 116.67 123.22 1ajo s ASP 24 Ca -0.04 -0.14 -0.06 0.00 -0.52 0.00 0.00 52.55 51.80 1ajo s ASP 24 Cb -0.05 -2.16 0.02 0.00 -1.46 0.00 0.00 42.92 39.26 1ajo s ASP 24 CO -0.01 -0.20 0.06 0.86 0.52 0.00 0.00 175.17 176.39 1ajo s TRP 25 N 1.87 3.15 0.24 -5.34 -0.00 0.64 -1.70 118.94 117.81 1ajo s TRP 25 Ca 0.09 -1.16 0.05 0.00 -0.00 0.00 0.00 56.10 55.09 1ajo s TRP 25 Cb -0.16 -2.22 -0.05 0.00 -0.00 0.00 0.00 33.47 31.03 1ajo s TRP 25 CO 0.11 -0.63 -0.05 -0.65 -0.00 0.00 0.00 176.95 175.73 1ajo s GLN 26 N 1.45 1.41 0.28 5.86 -1.52 -0.99 0.12 119.66 126.27 1ajo s GLN 26 Ca 0.01 -1.70 0.01 0.00 -1.95 0.00 0.00 55.36 51.73 1ajo s GLN 26 Cb -0.17 -0.90 0.54 0.00 -0.22 0.00 0.00 33.01 32.25 1ajo s GLN 26 CO 0.01 0.00 1.84 -1.35 -0.25 0.00 0.00 175.29 175.54 1ajo h PRO 27 N 2.41 0.98 -0.30 2.91 0.11 -1.98 -2.87 132.00 133.27 1ajo h PRO 27 Ca -0.39 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1ajo h PRO 27 Cb 1.22 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1ajo h PRO 27 CO 0.65 0.65 0.00 0.41 -0.21 0.00 0.00 178.00 179.50 1ajo n GLY 28 N -1.35 1.52 3.81 -0.55 0.00 -1.26 -4.77 105.19 102.59 1ajo n GLY 28 Ca 0.19 -0.56 -0.07 0.00 0.00 0.00 0.00 46.02 45.58 1ajo n GLY 28 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ajo s TYR 29 N -1.24 -0.20 -0.07 1.61 -0.85 -1.08 -4.62 117.35 110.89 1ajo s TYR 29 Ca 0.29 -0.21 0.01 0.00 -0.52 0.00 0.00 57.07 56.65 1ajo s TYR 29 Cb 0.17 0.68 0.02 0.00 0.38 0.00 0.00 41.96 43.22 1ajo s TYR 29 CO 0.24 -1.12 -0.08 0.42 -1.52 0.00 0.00 175.55 173.48 1ajo s ILE 30 N -3.77 0.88 -0.10 -3.49 1.01 -0.15 -2.35 121.20 113.23 1ajo s ILE 30 Ca 0.10 -0.29 0.03 0.00 0.00 0.00 0.00 60.65 60.50 1ajo s ILE 30 Cb -0.05 -0.87 -0.00 0.00 0.01 0.00 0.00 42.46 41.55 1ajo s ILE 30 CO 0.05 0.31 -0.22 -0.54 0.00 0.00 0.00 174.94 174.54 1ajo s LYS 31 N 1.09 3.05 -0.08 2.79 1.02 -0.69 -0.69 119.74 126.23 1ajo s LYS 31 Ca -0.07 -0.84 -0.00 0.00 0.02 0.00 0.00 55.97 55.07 1ajo s LYS 31 Cb -0.14 -2.35 -0.03 0.00 -0.52 0.00 0.00 37.83 34.79 1ajo s LYS 31 CO -0.01 0.22 -0.04 -1.58 -0.92 0.00 0.00 175.35 173.02 1ajo s TRP 32 N 0.27 3.03 0.06 3.18 0.51 -0.54 0.88 118.94 126.34 1ajo s TRP 32 Ca -0.15 0.10 0.07 0.00 -2.12 0.00 0.00 56.10 54.00 1ajo s TRP 32 Cb -0.17 -1.74 -0.03 0.00 -0.81 0.00 0.00 33.47 30.72 1ajo s TRP 32 CO 0.08 0.39 -0.20 0.71 -0.51 0.00 0.00 176.95 177.42 1ajo s TYR 33 N -0.84 1.73 -0.15 -1.98 1.51 -0.04 -0.72 117.35 116.85 1ajo s TYR 33 Ca 0.13 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 1ajo s TYR 33 Cb -0.11 -1.00 0.02 0.00 -0.11 0.00 0.00 41.96 40.76 1ajo s TYR 33 CO 0.02 0.12 -0.17 0.08 -1.11 0.00 0.00 175.55 174.49 1ajo s VAL 34 N -0.94 1.76 -1.44 0.71 1.01 -0.54 -1.71 120.40 119.25 1ajo s VAL 34 Ca 0.06 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 1ajo s VAL 34 Cb -0.09 -1.61 0.03 0.00 0.00 0.00 0.00 36.38 34.71 1ajo s VAL 34 CO 0.03 0.49 0.64 0.47 0.00 0.00 0.00 175.10 176.72 1ajo n ASP 35 N 4.59 -1.66 0.00 3.32 8.00 -0.05 -2.17 116.55 128.57 1ajo n ASP 35 Ca -0.19 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.40 1ajo n ASP 35 Cb 0.50 -3.44 0.00 0.00 -0.02 0.00 0.00 41.12 38.16 1ajo n ASP 35 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ajo n GLY 36 N -1.75 2.41 3.74 0.44 0.00 -1.26 -5.01 105.19 103.76 1ajo n GLY 36 Ca -0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 1ajo n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ajo s VAL 37 N -3.27 5.39 0.02 1.61 1.01 -0.92 -5.04 120.40 119.19 1ajo s VAL 37 Ca 0.00 0.29 -0.30 0.00 0.00 0.00 0.00 61.98 61.96 1ajo s VAL 37 Cb 0.00 -3.51 -0.06 0.00 0.00 0.00 0.00 36.38 32.81 1ajo s VAL 37 CO 0.00 0.44 1.39 -0.22 0.00 0.00 0.00 175.10 176.71 1ajo s LEU 38 N 0.30 4.33 -0.06 3.92 2.96 -1.26 -1.47 118.68 127.40 1ajo s LEU 38 Ca 0.11 2.14 0.07 0.00 -0.22 0.00 0.00 54.13 56.23 1ajo s LEU 38 Cb -0.12 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 42.91 1ajo s LEU 38 CO -0.00 -0.69 0.05 0.29 -1.32 0.00 0.00 176.35 174.68 1ajo n LYS 39 N 5.05 2.31 -3.62 1.98 4.76 0.10 -4.95 118.16 123.79 1ajo n LYS 39 Ca 0.13 -0.02 -0.13 0.00 -2.87 0.00 0.00 58.31 55.42 1ajo n LYS 39 Cb 0.44 -1.19 -0.07 0.00 -1.84 0.00 0.00 35.03 32.37 1ajo n LYS 39 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1ajo s HIS 40 N -2.25 -0.69 -0.03 2.13 2.46 -1.18 -5.01 115.29 110.71 1ajo s HIS 40 Ca -0.03 1.63 0.05 0.00 0.47 0.00 0.00 55.06 57.18 1ajo s HIS 40 Cb 0.03 0.31 -0.01 0.00 -0.13 0.00 0.00 32.58 32.78 1ajo s HIS 40 CO 0.31 -0.37 -0.18 0.99 -2.47 0.00 0.00 174.74 173.01 1ajo s THR 41 N 0.13 1.50 -0.03 0.89 2.01 -1.26 -1.46 115.64 117.42 1ajo s THR 41 Ca -0.01 -0.78 0.06 0.00 0.31 0.00 0.00 61.69 61.28 1ajo s THR 41 Cb -0.04 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.18 1ajo s THR 41 CO 0.00 0.43 -0.21 0.00 -0.69 0.00 0.00 174.62 174.15 1ajo s ALA 42 N -0.17 1.78 0.00 7.40 0.00 0.13 -4.98 121.76 125.92 1ajo s ALA 42 Ca 0.01 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1ajo s ALA 42 Cb -0.10 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.53 1ajo s ALA 42 CO 0.01 0.41 0.00 0.25 0.00 0.00 0.00 175.76 176.43 1ajo n THR 43 N 2.70 0.00 -2.90 0.00 -2.24 -1.26 -0.97 114.28 109.60 1ajo n THR 43 Ca -0.16 -0.31 -0.41 0.00 -2.27 0.00 0.00 64.05 60.91 1ajo n THR 43 Cb 0.53 0.94 -0.04 0.00 -2.10 0.00 0.00 70.33 69.65 1ajo n THR 43 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajo s ALA 44 N -0.75 3.29 -0.40 6.98 0.00 -1.26 -4.53 121.76 125.08 1ajo s ALA 44 Ca 0.00 0.35 -0.28 0.00 0.00 0.00 0.00 51.96 52.03 1ajo s ALA 44 Cb 0.00 -3.11 0.04 0.00 0.00 0.00 0.00 23.12 20.05 1ajo s ALA 44 CO 0.00 -0.07 0.53 0.09 0.00 0.00 0.00 175.76 176.32 1ajo n ASN 45 N 3.34 -4.32 -4.71 0.00 3.02 -1.26 -4.90 115.26 106.43 1ajo n ASN 45 Ca 0.01 -0.23 -0.39 0.00 -0.03 0.00 0.00 54.58 53.94 1ajo n ASN 45 Cb 0.51 -1.28 -0.05 0.00 -0.61 0.00 0.00 39.78 38.34 1ajo n ASN 45 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ajo s ILE 46 N -1.39 5.11 0.89 2.41 -1.09 -1.26 -4.71 121.20 121.16 1ajo s ILE 46 Ca 0.27 1.18 -0.15 0.00 -2.23 0.00 0.00 60.65 59.72 1ajo s ILE 46 Cb -0.03 -3.92 -0.06 0.00 -1.58 0.00 0.00 42.46 36.87 1ajo s ILE 46 CO 0.71 0.27 -0.05 -2.65 -1.23 0.00 0.00 174.94 171.99 1ajo n PRO 47 N 3.90 -0.06 0.00 2.79 -0.02 -1.26 -4.97 135.00 135.38 1ajo n PRO 47 Ca -0.04 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 1ajo n PRO 47 Cb 0.51 -1.48 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 1ajo n PRO 47 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ajo n SER 48 N 0.89 0.01 -4.73 2.55 3.41 -1.26 -4.93 113.62 109.56 1ajo n SER 48 Ca 0.04 -0.71 -0.37 0.00 -0.26 0.00 0.00 58.87 57.56 1ajo n SER 48 Cb 0.53 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.42 1ajo n SER 48 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ajo s THR 49 N -0.00 5.22 0.37 6.66 2.01 -1.26 -5.00 115.64 123.63 1ajo s THR 49 Ca 0.00 0.84 -0.27 0.00 0.31 0.00 0.00 61.69 62.57 1ajo s THR 49 Cb 0.00 -3.76 -0.11 0.00 0.01 0.00 0.00 72.50 68.63 1ajo s THR 49 CO 0.00 0.35 1.20 -0.81 -0.69 0.00 0.00 174.62 174.67 1ajo n PRO 50 N 3.62 1.85 -4.36 4.92 -0.04 -1.26 -4.89 135.00 134.84 1ajo n PRO 50 Ca -0.09 0.65 -0.20 0.00 -0.04 0.00 0.00 63.50 63.83 1ajo n PRO 50 Cb 0.52 -2.24 -0.09 0.00 -0.04 0.00 0.00 33.50 31.65 1ajo n PRO 50 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1ajo s GLY 51 N -0.47 2.14 0.38 0.55 0.00 -0.73 -4.75 107.32 104.43 1ajo s GLY 51 Ca 0.59 -1.72 -0.16 0.00 0.00 0.00 0.00 44.72 43.43 1ajo s GLY 51 CO 0.60 -1.62 0.81 0.54 0.00 0.00 0.00 173.10 173.43 1ajo s LYS 52 N -3.79 4.01 -0.10 2.90 1.02 0.10 -0.80 119.74 123.08 1ajo s LYS 52 Ca 0.35 0.76 -0.20 0.00 0.02 0.00 0.00 55.97 56.89 1ajo s LYS 52 Cb 0.05 -2.34 -0.04 0.00 -0.52 0.00 0.00 37.83 34.98 1ajo s LYS 52 CO 0.18 0.04 0.56 0.42 -0.92 0.00 0.00 175.35 175.63 1ajo s ILE 53 N -2.15 5.13 0.07 2.17 1.01 -1.26 -1.01 121.20 125.16 1ajo s ILE 53 Ca 0.56 1.14 0.04 0.00 0.00 0.00 0.00 60.65 62.39 1ajo s ILE 53 Cb -0.10 -3.90 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 1ajo s ILE 53 CO 0.20 0.29 -0.11 -0.04 0.00 0.00 0.00 174.94 175.29 1ajo s MET 54 N 0.71 0.73 -0.01 2.79 -1.94 0.13 -0.57 119.30 121.14 1ajo s MET 54 Ca 0.30 -0.95 0.00 0.00 -1.71 0.00 0.00 55.69 53.34 1ajo s MET 54 Cb -0.16 -0.56 0.01 0.00 2.01 0.00 0.00 34.83 36.13 1ajo s MET 54 CO 0.13 0.11 0.00 -1.64 -0.01 0.00 0.00 175.02 173.61 1ajo s MET 55 N -1.98 0.14 0.31 2.03 -1.94 -0.41 -0.99 119.30 116.46 1ajo s MET 55 Ca -0.03 0.04 -0.05 0.00 -1.71 0.00 0.00 55.69 53.95 1ajo s MET 55 Cb -0.08 -0.27 -0.00 0.00 2.01 0.00 0.00 34.83 36.50 1ajo s MET 55 CO 0.01 -0.07 0.46 0.54 -0.01 0.00 0.00 175.02 175.95 1ajo s ASN 56 N 0.55 0.61 -0.10 3.03 2.20 -1.23 -0.57 114.94 119.44 1ajo s ASN 56 Ca -0.05 -1.35 -0.04 0.00 -0.94 0.00 0.00 52.86 50.48 1ajo s ASN 56 Cb -0.08 0.63 0.05 0.00 -2.00 0.00 0.00 41.25 39.86 1ajo s ASN 56 CO -0.01 -1.24 0.20 -0.22 -2.94 0.00 0.00 177.10 172.89 1ajo s LEU 57 N -3.18 0.11 0.20 3.54 2.96 -0.88 -1.82 118.68 119.62 1ajo s LEU 57 Ca 0.29 0.44 -0.15 0.00 -0.22 0.00 0.00 54.13 54.49 1ajo s LEU 57 Cb -0.00 0.51 0.01 0.00 0.50 0.00 0.00 46.19 47.21 1ajo s LEU 57 CO 0.17 -0.21 0.46 -1.66 -1.32 0.00 0.00 176.35 173.79 1ajo s TRP 58 N 1.90 0.07 -0.00 5.38 1.48 -0.64 -3.06 118.94 124.06 1ajo s TRP 58 Ca -0.02 -0.42 0.02 0.00 -1.06 0.00 0.00 56.10 54.61 1ajo s TRP 58 Cb -0.12 0.26 -0.04 0.00 -1.16 0.00 0.00 33.47 32.42 1ajo s TRP 58 CO -0.07 -0.88 -0.01 0.54 -4.06 0.00 0.00 176.95 172.46 1ajo s ASN 59 N -2.91 5.03 0.36 -2.66 4.22 -1.26 -1.70 114.94 116.02 1ajo s ASN 59 Ca 0.13 -0.03 0.08 0.00 -2.14 0.00 0.00 52.86 50.89 1ajo s ASN 59 Cb 0.00 -1.29 -0.03 0.00 1.28 0.00 0.00 41.25 41.21 1ajo s ASN 59 CO -0.01 0.28 0.29 -0.83 -2.04 0.00 0.00 177.10 174.80 1ajo s GLY 60 N -1.54 1.93 0.00 0.45 0.00 -0.83 -1.32 107.32 106.03 1ajo s GLY 60 Ca 0.19 -1.77 -0.01 0.00 0.00 0.00 0.00 44.72 43.13 1ajo s GLY 60 CO 0.10 -1.65 0.01 -1.08 0.00 0.00 0.00 173.10 170.47 1ajo s THR 61 N -2.39 0.05 -0.00 0.90 -1.32 0.08 -4.61 115.64 108.35 1ajo s THR 61 Ca 0.43 -0.39 0.00 0.00 -1.21 0.00 0.00 61.69 60.51 1ajo s THR 61 Cb -0.04 -0.14 0.00 0.00 -1.51 0.00 0.00 72.50 70.80 1ajo s THR 61 CO 0.26 -0.22 0.00 0.61 -2.21 0.00 0.00 174.62 173.07 1ajo n GLY 62 N 2.41 0.43 2.43 6.08 0.00 -1.26 -4.51 105.19 110.77 1ajo n GLY 62 Ca -0.17 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 1ajo n GLY 62 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ajo n VAL 63 N -2.86 1.90 -0.20 1.61 0.24 -1.26 -4.89 118.33 112.87 1ajo n VAL 63 Ca -0.00 -3.62 0.08 0.00 -2.04 0.00 0.00 64.34 58.76 1ajo n VAL 63 Cb 0.07 0.02 0.37 0.00 -1.47 0.00 0.00 33.84 32.83 1ajo n VAL 63 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1ajo h ASP 64 N 2.42 0.65 -0.21 -1.34 5.19 -1.90 -0.43 116.42 120.80 1ajo h ASP 64 Ca 0.12 0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 56.44 1ajo h ASP 64 Cb 1.38 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 40.75 1ajo h ASP 64 CO 0.49 0.40 -0.18 0.44 -3.12 0.00 0.00 179.24 177.27 1ajo h ASP 65 N 0.73 0.64 0.10 6.45 3.32 -1.90 -0.82 116.42 124.95 1ajo h ASP 65 Ca 0.34 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1ajo h ASP 65 Cb 0.38 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1ajo h ASP 65 CO -0.12 0.83 -0.05 -0.25 -1.72 0.00 0.00 179.24 177.93 1ajo h TRP 66 N 0.58 -0.13 -0.00 4.55 7.01 -1.73 -3.40 115.95 122.82 1ajo h TRP 66 Ca 0.09 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.09 1ajo h TRP 66 Cb 0.64 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.74 1ajo h TRP 66 CO 0.03 0.06 -0.74 1.28 -2.79 0.00 0.00 178.44 176.28 1ajo n LEU 67 N -4.85 0.92 -0.00 0.65 4.77 -0.26 -5.04 117.00 113.19 1ajo n LEU 67 Ca -0.03 -0.34 0.00 0.00 -0.03 0.00 0.00 56.01 55.61 1ajo n LEU 67 Cb 0.12 -0.09 -0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1ajo n LEU 67 CO 0.10 0.21 -0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1ajo n GLY 68 N 1.48 -2.51 3.77 -0.72 0.00 -0.31 -1.42 105.19 105.48 1ajo n GLY 68 Ca 0.05 -1.46 -0.38 0.00 0.00 0.00 0.00 46.02 44.24 1ajo n GLY 68 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ajo s SER 69 N -4.17 7.30 0.11 1.61 1.04 -1.26 -3.53 113.70 114.80 1ajo s SER 69 Ca 0.00 1.96 -0.30 0.00 0.48 0.00 0.00 55.95 58.09 1ajo s SER 69 Cb 0.00 -2.59 -0.06 0.00 0.10 0.00 0.00 66.02 63.47 1ajo s SER 69 CO 0.00 -0.10 1.00 -0.47 0.98 0.00 0.00 173.24 174.65 1ajo s TYR 70 N -1.46 3.73 -0.46 5.02 5.04 -1.26 -3.43 117.35 124.54 1ajo s TYR 70 Ca 0.49 1.72 0.16 0.00 -2.44 0.00 0.00 57.07 57.00 1ajo s TYR 70 Cb -0.23 -3.12 0.62 0.00 0.35 0.00 0.00 41.96 39.58 1ajo s TYR 70 CO 0.29 -0.05 1.53 0.27 -1.34 0.00 0.00 175.55 176.25 1ajo n ASN 71 N 2.89 4.46 0.00 4.32 6.94 -1.26 -4.97 115.26 127.64 1ajo n ASN 71 Ca 0.03 -2.78 0.00 0.00 -0.02 0.00 0.00 54.58 51.81 1ajo n ASN 71 Cb 0.49 -0.56 0.00 0.00 -2.36 0.00 0.00 39.78 37.35 1ajo n ASN 71 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ajo n GLY 72 N 0.22 1.10 3.64 4.83 0.00 -1.26 -5.00 105.19 108.72 1ajo n GLY 72 Ca 0.23 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.77 1ajo n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajo n ALA 73 N 0.87 0.48 -3.51 4.61 0.00 -1.26 -4.96 120.51 116.73 1ajo n ALA 73 Ca 0.00 0.46 -0.11 0.00 0.00 0.00 0.00 53.44 53.78 1ajo n ALA 73 Cb 0.00 -2.22 -0.04 0.00 0.00 0.00 0.00 19.45 17.19 1ajo n ALA 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ajo s ASN 74 N 0.53 -0.46 0.48 0.00 2.20 -1.26 -4.67 114.94 111.76 1ajo s ASN 74 Ca 0.77 0.23 -0.19 0.00 -0.94 0.00 0.00 52.86 52.73 1ajo s ASN 74 Cb -0.76 0.43 -0.09 0.00 -2.00 0.00 0.00 41.25 38.83 1ajo s ASN 74 CO 0.45 -0.61 0.97 -2.16 -2.94 0.00 0.00 177.10 172.81 1ajo s PRO 75 N -2.37 4.06 0.03 3.55 0.04 -1.26 -5.02 135.00 134.02 1ajo s PRO 75 Ca -0.00 1.06 0.06 0.00 0.04 0.00 0.00 61.00 62.16 1ajo s PRO 75 Cb -0.01 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 1ajo s PRO 75 CO -0.04 -0.18 -0.19 -0.51 0.04 0.00 0.00 177.00 176.13 1ajo s LEU 76 N -3.64 2.13 0.00 -3.56 1.43 -0.53 -4.97 118.68 109.54 1ajo s LEU 76 Ca 0.61 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 1ajo s LEU 76 Cb -0.10 -0.89 -0.01 0.00 0.03 0.00 0.00 46.19 45.22 1ajo s LEU 76 CO 0.22 0.15 -0.06 -0.31 0.23 0.00 0.00 176.35 176.59 1ajo s TYR 77 N -0.71 0.50 -0.07 0.29 2.02 -1.26 -1.14 117.35 116.99 1ajo s TYR 77 Ca 0.06 -0.14 0.05 0.00 -0.37 0.00 0.00 57.07 56.67 1ajo s TYR 77 Cb -0.08 -0.32 -0.01 0.00 -0.40 0.00 0.00 41.96 41.15 1ajo s TYR 77 CO 0.01 -0.02 -0.22 0.00 -1.57 0.00 0.00 175.55 173.75 1ajo s ALA 78 N -0.29 2.30 0.09 3.71 0.00 -0.74 -3.58 121.76 123.25 1ajo s ALA 78 Ca 0.00 -1.01 0.08 0.00 0.00 0.00 0.00 51.96 51.03 1ajo s ALA 78 Cb -0.03 -0.79 -0.03 0.00 0.00 0.00 0.00 23.12 22.26 1ajo s ALA 78 CO -0.00 0.41 -0.22 -1.21 0.00 0.00 0.00 175.76 174.74 1ajo s GLU 79 N -0.15 1.24 -0.09 0.00 2.02 0.05 -1.15 118.70 120.62 1ajo s GLU 79 Ca -0.03 -1.12 0.00 0.00 0.02 0.00 0.00 54.97 53.84 1ajo s GLU 79 Cb -0.14 -1.49 0.02 0.00 0.10 0.00 0.00 34.13 32.63 1ajo s GLU 79 CO 0.04 0.36 -0.07 0.71 0.02 0.00 0.00 175.26 176.31 1ajo s TYR 80 N -1.04 1.33 -0.08 1.61 1.51 0.29 -0.77 117.35 120.19 1ajo s TYR 80 Ca 0.08 -0.59 0.11 0.00 -1.01 0.00 0.00 57.07 55.65 1ajo s TYR 80 Cb -0.10 -1.10 -0.24 0.00 -0.11 0.00 0.00 41.96 40.41 1ajo s TYR 80 CO 0.04 -0.42 0.50 -3.47 -1.11 0.00 0.00 175.55 171.10 1ajo n ASP 81 N 4.65 0.93 -3.61 2.29 2.03 -0.23 0.19 116.55 122.80 1ajo n ASP 81 Ca -0.15 0.31 -0.06 0.00 0.52 0.00 0.00 54.79 55.41 1ajo n ASP 81 Cb 0.50 -0.01 -0.02 0.00 -0.72 0.00 0.00 41.12 40.88 1ajo n ASP 81 CO 0.00 0.00 0.00 -1.66 -1.92 0.00 0.00 177.20 173.62 1ajo s TRP 82 N -2.57 -0.24 -0.01 -0.67 1.48 -1.24 -4.44 118.94 111.24 1ajo s TRP 82 Ca -0.09 0.05 0.01 0.00 -1.06 0.00 0.00 56.10 55.01 1ajo s TRP 82 Cb 0.07 0.57 0.01 0.00 -1.16 0.00 0.00 33.47 32.96 1ajo s TRP 82 CO 0.81 -0.62 -0.03 0.08 -4.06 0.00 0.00 176.95 173.13 1ajo s VAL 83 N -3.11 0.31 -0.03 -0.66 1.01 -0.46 -1.83 120.40 115.62 1ajo s VAL 83 Ca 0.08 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 61.97 1ajo s VAL 83 Cb -0.01 -0.30 0.01 0.00 0.00 0.00 0.00 36.38 36.08 1ajo s VAL 83 CO -0.04 0.11 -0.09 -0.75 0.00 0.00 0.00 175.10 174.33 1ajo s LYS 84 N 0.22 1.04 -0.14 2.72 2.20 0.48 -1.01 119.74 125.25 1ajo s LYS 84 Ca -0.02 -0.29 0.01 0.00 -0.36 0.00 0.00 55.97 55.31 1ajo s LYS 84 Cb -0.05 -0.95 0.02 0.00 -1.51 0.00 0.00 37.83 35.33 1ajo s LYS 84 CO -0.00 0.08 -0.16 -0.47 -0.36 0.00 0.00 175.35 174.43 1ajo s TYR 85 N 0.34 2.22 -0.37 4.03 5.04 -0.83 0.02 117.35 127.81 1ajo s TYR 85 Ca -0.06 -1.18 -0.09 0.00 -2.44 0.00 0.00 57.07 53.31 1ajo s TYR 85 Cb -0.10 -1.60 0.05 0.00 0.35 0.00 0.00 41.96 40.66 1ajo s TYR 85 CO 0.01 -0.62 0.18 0.99 -1.34 0.00 0.00 175.55 174.77 1ajo s THR 86 N 1.24 4.14 0.51 4.34 2.01 0.10 -1.82 115.64 126.16 1ajo s THR 86 Ca 0.00 -1.12 -0.20 0.00 0.31 0.00 0.00 61.69 60.68 1ajo s THR 86 Cb -0.14 -3.39 -0.07 0.00 0.01 0.00 0.00 72.50 68.91 1ajo s THR 86 CO -0.07 -0.28 1.09 -0.55 -0.69 0.00 0.00 174.62 174.11 1ajo s SER 87 N 1.62 6.06 0.37 3.53 0.15 -1.26 -1.64 113.70 122.53 1ajo s SER 87 Ca 0.01 2.07 0.20 0.00 0.70 0.00 0.00 55.95 58.93 1ajo s SER 87 Cb -0.20 -2.57 0.49 0.00 -1.71 0.00 0.00 66.02 62.02 1ajo s SER 87 CO 0.04 -0.98 1.64 0.78 1.20 0.00 0.00 173.24 175.92 1ajo h ASN 88 N 1.46 0.00 -2.95 5.45 4.21 -1.92 -3.45 115.58 118.38 1ajo h ASN 88 Ca -0.50 0.00 -0.64 0.00 1.21 0.00 0.00 56.30 56.37 1ajo h ASN 88 Cb 1.24 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 38.37 1ajo h ASN 88 CO 0.58 0.33 -0.53 0.00 -1.29 0.00 0.00 177.43 176.52 1ajo s GLN 89 N -3.31 3.28 0.53 0.81 -2.07 -1.26 -5.09 119.66 112.54 1ajo s GLN 89 Ca 0.03 -0.43 -0.22 0.00 -1.82 0.00 0.00 55.36 52.92 1ajo s GLN 89 Cb 0.09 -2.98 -0.05 0.00 -1.09 0.00 0.00 33.01 28.97 1ajo s GLN 89 CO 0.69 0.64 1.31 0.99 -1.32 0.00 0.00 175.29 177.60 1ajo s THR 90 N -1.33 2.33 -0.96 3.63 2.01 -1.26 -3.19 115.64 116.87 1ajo s THR 90 Ca 0.28 0.24 0.00 0.00 0.31 0.00 0.00 61.69 62.52 1ajo s THR 90 Cb -0.12 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.26 1ajo s THR 90 CO 0.19 -0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.73 1ajo n GLY 91 N 0.66 0.86 0.00 4.40 0.00 -1.26 -4.87 105.19 104.98 1ajo n GLY 91 Ca 0.10 -0.58 0.02 0.00 0.00 0.00 0.00 46.02 45.55 1ajo n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajo n GLY 92 N -1.65 -0.20 3.78 -0.02 0.00 -1.19 -5.07 105.19 100.83 1ajo n GLY 92 Ca -0.10 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1ajo n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ajo s SER 93 N -2.63 5.65 0.14 1.61 0.01 -1.26 -4.65 113.70 112.57 1ajo s SER 93 Ca -0.02 1.98 -0.21 0.00 1.31 0.00 0.00 55.95 59.01 1ajo s SER 93 Cb 0.03 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.76 1ajo s SER 93 CO 0.18 -1.26 0.55 0.72 0.41 0.00 0.00 173.24 173.84 1ajo s PHE 94 N -2.16 -0.45 -0.09 2.43 -0.12 -0.75 -4.96 117.98 111.87 1ajo s PHE 94 Ca 0.68 0.23 0.01 0.00 -0.05 0.00 0.00 56.93 57.79 1ajo s PHE 94 Cb -0.19 0.47 0.02 0.00 -0.63 0.00 0.00 43.02 42.69 1ajo s PHE 94 CO 0.33 -0.80 -0.08 0.12 -0.05 0.00 0.00 175.22 174.74 1ajo s PHE 95 N -3.67 1.36 -0.28 3.49 5.36 -1.26 -1.96 117.98 121.02 1ajo s PHE 95 Ca 0.01 -0.59 0.01 0.00 -0.96 0.00 0.00 56.93 55.40 1ajo s PHE 95 Cb -0.00 -1.10 0.06 0.00 -0.34 0.00 0.00 43.02 41.63 1ajo s PHE 95 CO -0.12 -0.40 -0.06 -2.00 -1.46 0.00 0.00 175.22 171.18 1ajo s GLU 96 N 1.31 2.28 0.26 10.12 2.56 -0.18 -5.00 118.70 130.05 1ajo s GLU 96 Ca -0.03 -1.34 0.25 0.00 0.00 0.00 0.00 54.97 53.85 1ajo s GLU 96 Cb -0.14 -3.01 0.58 0.00 2.00 0.00 0.00 34.13 33.57 1ajo s GLU 96 CO -0.03 -0.61 1.64 -1.00 -0.56 0.00 0.00 175.26 174.70 1ajo h PRO 97 N 7.85 0.00 -4.49 4.30 0.13 -1.84 -1.22 132.00 136.72 1ajo h PRO 97 Ca -0.19 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.68 1ajo h PRO 97 Cb 1.05 0.00 0.11 0.00 0.13 0.00 0.00 31.00 32.29 1ajo h PRO 97 CO 0.49 0.00 -0.51 1.19 -0.23 0.00 0.00 178.00 178.94 1ajo n PHE 98 N -2.50 -1.78 0.10 1.56 3.72 -1.26 -4.66 117.46 112.64 1ajo n PHE 98 Ca 0.05 0.69 -0.21 0.00 -0.05 0.00 0.00 57.45 57.93 1ajo n PHE 98 Cb 0.47 -4.02 -0.13 0.00 -0.94 0.00 0.00 39.48 34.86 1ajo n PHE 98 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1ajo h ASN 99 N -1.61 0.75 -5.15 4.37 2.35 -1.93 -3.26 115.58 111.10 1ajo h ASN 99 Ca -0.41 -0.73 0.08 0.00 -0.55 0.00 0.00 56.30 54.70 1ajo h ASN 99 Cb 1.25 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 39.34 1ajo h ASN 99 CO 0.37 1.55 0.37 -0.94 -1.65 0.00 0.00 177.43 177.12 1ajo s SER 100 N -7.38 -0.10 0.04 5.81 1.04 -1.26 -4.80 113.70 107.06 1ajo s SER 100 Ca -0.08 -0.76 -0.31 0.00 0.48 0.00 0.00 55.95 55.29 1ajo s SER 100 Cb 0.06 0.67 -0.06 0.00 0.10 0.00 0.00 66.02 66.79 1ajo s SER 100 CO 0.92 -1.30 1.42 -0.47 0.98 0.00 0.00 173.24 174.79 1ajo s TYR 101 N -2.92 2.93 -0.40 5.02 5.04 -1.26 -4.99 117.35 120.77 1ajo s TYR 101 Ca 0.15 0.81 0.02 0.00 -2.44 0.00 0.00 57.07 55.61 1ajo s TYR 101 Cb -0.04 -3.70 0.11 0.00 0.35 0.00 0.00 41.96 38.69 1ajo s TYR 101 CO 0.07 -2.55 0.14 1.21 -1.34 0.00 0.00 175.55 173.08 1ajo s ASN 102 N 1.70 4.84 0.43 4.32 3.84 -1.26 -4.97 114.94 123.83 1ajo s ASN 102 Ca 0.65 -2.31 0.30 0.00 0.21 0.00 0.00 52.86 51.70 1ajo s ASN 102 Cb -0.34 -1.69 1.31 0.00 -0.55 0.00 0.00 41.25 39.98 1ajo s ASN 102 CO 0.28 -0.39 1.89 0.77 -2.79 0.00 0.00 177.10 176.86 1ajo h SER 103 N 7.49 0.00 0.17 -4.21 4.64 -1.94 -1.29 113.55 118.41 1ajo h SER 103 Ca -0.07 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.16 1ajo h SER 103 Cb 1.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 1ajo h SER 103 CO 0.60 0.00 -0.35 1.23 -0.87 0.00 0.00 176.83 177.44 1ajo h GLY 104 N 1.72 0.28 0.00 -0.77 0.00 -2.03 -3.37 103.07 98.90 1ajo h GLY 104 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 1ajo h GLY 104 CO 0.00 0.22 -1.16 -1.30 0.00 0.00 0.00 176.54 174.31 1ajo n THR 105 N -4.07 0.00 -4.29 4.70 -2.24 -0.89 -4.82 114.28 102.66 1ajo n THR 105 Ca -0.01 -0.17 -0.16 0.00 -2.27 0.00 0.00 64.05 61.44 1ajo n THR 105 Cb 0.44 0.44 -0.10 0.00 -2.10 0.00 0.00 70.33 69.01 1ajo n THR 105 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1ajo s TRP 106 N -2.33 1.41 0.02 4.78 0.52 -0.54 -0.83 118.94 121.98 1ajo s TRP 106 Ca -0.02 -0.82 0.01 0.00 0.02 0.00 0.00 56.10 55.29 1ajo s TRP 106 Cb 0.04 -0.76 -0.02 0.00 -1.15 0.00 0.00 33.47 31.58 1ajo s TRP 106 CO 0.26 0.04 -0.04 -1.83 0.02 0.00 0.00 176.95 175.40 1ajo s GLU 107 N -3.79 0.34 -0.10 4.98 -1.05 0.36 -4.36 118.70 115.07 1ajo s GLU 107 Ca 0.22 -0.51 -0.13 0.00 -0.15 0.00 0.00 54.97 54.41 1ajo s GLU 107 Cb 0.04 -0.09 -0.05 0.00 -0.44 0.00 0.00 34.13 33.59 1ajo s GLU 107 CO 0.04 0.01 0.30 0.15 0.95 0.00 0.00 175.26 176.71 1ajo s LYS 108 N -1.11 3.99 0.49 -4.83 1.02 -1.26 -1.81 119.74 116.23 1ajo s LYS 108 Ca -0.10 0.16 -0.22 0.00 0.02 0.00 0.00 55.97 55.83 1ajo s LYS 108 Cb -0.07 -3.31 -0.06 0.00 -0.52 0.00 0.00 37.83 33.86 1ajo s LYS 108 CO -0.00 0.49 1.20 0.00 -0.92 0.00 0.00 175.35 176.12 1ajo s ALA 109 N -0.32 2.89 -0.24 5.17 0.00 -0.56 -4.85 121.76 123.86 1ajo s ALA 109 Ca 0.19 1.01 -0.12 0.00 0.00 0.00 0.00 51.96 53.04 1ajo s ALA 109 Cb -0.14 -3.42 0.08 0.00 0.00 0.00 0.00 23.12 19.64 1ajo s ALA 109 CO 0.07 -0.84 0.58 0.34 0.00 0.00 0.00 175.76 175.90 1ajo s ASP 110 N -1.32 -0.78 0.00 0.00 2.15 -1.26 -3.15 116.67 112.30 1ajo s ASP 110 Ca 0.67 1.29 0.00 0.00 0.43 0.00 0.00 52.55 54.94 1ajo s ASP 110 Cb -0.31 1.30 0.00 0.00 -0.30 0.00 0.00 42.92 43.62 1ajo s ASP 110 CO 0.37 -0.22 0.00 0.61 -0.17 0.00 0.00 175.17 175.75 1ajo n GLY 111 N 4.53 0.72 3.21 2.66 0.00 0.82 -4.95 105.19 112.18 1ajo n GLY 111 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 1ajo n GLY 111 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ajo s TYR 112 N -2.39 1.20 0.14 1.61 1.13 -1.26 -4.95 117.35 112.82 1ajo s TYR 112 Ca 0.00 -1.40 0.09 0.00 -1.41 0.00 0.00 57.07 54.36 1ajo s TYR 112 Cb 0.00 -0.57 -0.04 0.00 -1.10 0.00 0.00 41.96 40.25 1ajo s TYR 112 CO 0.00 -0.66 -0.17 0.45 -2.51 0.00 0.00 175.55 172.66 1ajo s SER 113 N -3.17 3.89 0.44 -0.18 0.15 -1.26 -1.79 113.70 111.78 1ajo s SER 113 Ca 0.39 -0.60 0.25 0.00 0.70 0.00 0.00 55.95 56.69 1ajo s SER 113 Cb 0.07 -0.54 0.70 0.00 -1.71 0.00 0.00 66.02 64.54 1ajo s SER 113 CO 0.13 0.16 1.73 0.78 1.20 0.00 0.00 173.24 177.24 1ajo h ASN 114 N 3.53 0.00 -2.80 5.45 4.21 -1.85 -3.49 115.58 120.63 1ajo h ASN 114 Ca -0.49 0.00 0.10 0.00 1.21 0.00 0.00 56.30 57.12 1ajo h ASN 114 Cb 1.18 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.35 1ajo h ASN 114 CO 0.47 0.13 -0.13 0.61 -1.29 0.00 0.00 177.43 177.23 1ajo n GLY 115 N 0.62 -1.68 7.00 2.83 0.00 -1.26 -4.93 105.19 107.77 1ajo n GLY 115 Ca 0.02 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1ajo n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajo n GLY 116 N -1.22 2.31 0.13 -0.02 0.00 -1.26 -2.87 105.19 102.25 1ajo n GLY 116 Ca 0.00 -0.44 0.12 0.00 0.00 0.00 0.00 46.02 45.71 1ajo n GLY 116 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1ajo h VAL 117 N 0.00 0.00 -2.90 1.61 -1.51 -1.92 -3.45 116.25 108.08 1ajo h VAL 117 Ca 0.00 -0.74 -0.56 0.00 -1.23 0.00 0.00 66.70 64.16 1ajo h VAL 117 Cb 0.00 1.51 -0.04 0.00 -2.13 0.00 0.00 31.29 30.63 1ajo h VAL 117 CO 0.00 0.00 0.97 -0.36 -1.23 0.00 0.00 177.57 176.95 1ajo s PHE 118 N -3.21 2.61 -0.53 5.19 0.40 -1.14 -0.74 117.98 120.56 1ajo s PHE 118 Ca 0.06 0.82 0.02 0.00 -0.60 0.00 0.00 56.93 57.23 1ajo s PHE 118 Cb 0.10 -3.70 0.43 0.00 0.51 0.00 0.00 43.02 40.36 1ajo s PHE 118 CO 0.70 -2.13 1.59 -1.71 0.70 0.00 0.00 175.22 174.37 1ajo n ASN 119 N 7.10 6.23 -3.57 1.36 5.15 -0.43 -4.01 115.26 127.09 1ajo n ASN 119 Ca 0.15 -3.77 -0.11 0.00 -0.60 0.00 0.00 54.58 50.25 1ajo n ASN 119 Cb 0.45 -0.69 -0.04 0.00 -0.53 0.00 0.00 39.78 38.97 1ajo n ASN 119 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ajo s THR 121 N -3.79 4.82 0.20 0.00 2.01 -0.35 -4.51 115.64 114.01 1ajo s THR 121 Ca 0.03 -0.04 -0.30 0.00 0.31 0.00 0.00 61.69 61.69 1ajo s THR 121 Cb 0.00 -3.12 -0.08 0.00 0.01 0.00 0.00 72.50 69.31 1ajo s THR 121 CO -0.11 0.53 1.25 0.26 -0.69 0.00 0.00 174.62 175.86 1ajo s TRP 122 N -0.23 3.34 -0.04 4.92 0.52 -0.74 -0.05 118.94 126.65 1ajo s TRP 122 Ca 0.08 1.34 0.03 0.00 0.02 0.00 0.00 56.10 57.56 1ajo s TRP 122 Cb -0.12 -3.52 0.01 0.00 -1.15 0.00 0.00 33.47 28.69 1ajo s TRP 122 CO 0.01 -1.53 -0.11 1.03 0.02 0.00 0.00 176.95 176.38 1ajo s ARG 123 N -0.26 1.32 0.46 4.98 1.81 -0.54 -0.13 118.95 126.59 1ajo s ARG 123 Ca 0.54 -0.36 0.13 0.00 -1.72 0.00 0.00 55.73 54.32 1ajo s ARG 123 Cb -0.35 -1.16 1.05 0.00 -0.45 0.00 0.00 34.95 34.04 1ajo s ARG 123 CO 0.38 0.08 2.06 0.00 -0.68 0.00 0.00 175.30 177.14 1ajo h ALA 124 N 6.66 1.79 0.00 2.13 0.00 -1.87 -1.32 119.26 126.66 1ajo h ALA 124 Ca -0.33 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 1ajo h ALA 124 Cb 1.17 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1ajo h ALA 124 CO 0.48 0.16 -0.08 -0.91 0.00 0.00 0.00 179.25 178.90 1ajo h ASN 125 N 0.15 0.00 -0.16 0.00 2.35 -1.95 -2.65 115.58 113.33 1ajo h ASN 125 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1ajo h ASN 125 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1ajo h ASN 125 CO 0.00 0.08 0.00 0.59 -1.65 0.00 0.00 177.43 176.45 1ajo n ASN 126 N -3.42 0.97 -4.13 5.81 4.13 -0.50 -4.68 115.26 113.44 1ajo n ASN 126 Ca -0.01 -1.89 -0.35 0.00 1.68 0.00 0.00 54.58 54.00 1ajo n ASN 126 Cb 0.23 -0.11 -0.13 0.00 -1.54 0.00 0.00 39.78 38.24 1ajo n ASN 126 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1ajo s VAL 127 N -1.78 3.01 0.28 2.41 1.01 -1.00 -0.51 120.40 123.82 1ajo s VAL 127 Ca 0.17 -1.80 0.06 0.00 0.00 0.00 0.00 61.98 60.41 1ajo s VAL 127 Cb 0.09 -2.94 -0.06 0.00 0.00 0.00 0.00 36.38 33.47 1ajo s VAL 127 CO 0.12 -0.42 -0.04 0.20 0.00 0.00 0.00 175.10 174.96 1ajo s ASN 128 N 1.45 2.60 -0.18 3.32 0.01 -0.68 -5.01 114.94 116.45 1ajo s ASN 128 Ca 0.03 -1.21 -0.00 0.00 -0.71 0.00 0.00 52.86 50.96 1ajo s ASN 128 Cb -0.21 -0.14 0.01 0.00 0.41 0.00 0.00 41.25 41.32 1ajo s ASN 128 CO -0.03 -0.39 -0.15 -0.36 -1.51 0.00 0.00 177.10 174.66 1ajo s PHE 129 N -3.09 2.82 0.94 2.20 0.40 -1.26 -0.51 117.98 119.48 1ajo s PHE 129 Ca 0.30 -1.30 -0.12 0.00 -0.60 0.00 0.00 56.93 55.20 1ajo s PHE 129 Cb 0.04 -1.96 0.15 0.00 0.51 0.00 0.00 43.02 41.77 1ajo s PHE 129 CO 0.12 -0.65 1.11 0.95 0.70 0.00 0.00 175.22 177.45 1ajo s THR 130 N 1.21 2.16 -0.03 0.64 -4.23 -0.36 -4.90 115.64 110.12 1ajo s THR 130 Ca 0.02 0.05 0.13 0.00 -1.18 0.00 0.00 61.69 60.72 1ajo s THR 130 Cb -0.14 -2.68 -0.00 0.00 1.34 0.00 0.00 72.50 71.02 1ajo s THR 130 CO -0.07 -0.07 1.44 0.78 -0.54 0.00 0.00 174.62 176.17 1ajo h ASN 131 N -1.64 0.00 -0.39 3.99 2.35 -1.94 -2.96 115.58 115.00 1ajo h ASN 131 Ca -0.52 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.13 1ajo h ASN 131 Cb 1.32 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.64 1ajo h ASN 131 CO 0.60 0.63 0.12 -0.90 -1.65 0.00 0.00 177.43 176.22 1ajo n ASP 132 N -3.31 3.50 -1.71 5.81 5.75 -1.26 -4.91 116.55 120.41 1ajo n ASP 132 Ca 0.01 -2.63 -0.04 0.00 -0.01 0.00 0.00 54.79 52.12 1ajo n ASP 132 Cb 0.76 -0.63 0.02 0.00 -1.03 0.00 0.00 41.12 40.24 1ajo n ASP 132 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ajo n GLY 133 N 0.08 0.30 3.24 6.12 0.00 -1.12 -5.07 105.19 108.76 1ajo n GLY 133 Ca 0.21 -0.24 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 1ajo n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ajo s LYS 134 N -3.98 1.64 0.06 1.61 1.02 -1.23 -4.62 119.74 114.23 1ajo s LYS 134 Ca 0.04 -0.83 -0.30 0.00 0.02 0.00 0.00 55.97 54.90 1ajo s LYS 134 Cb -0.01 -1.64 -0.05 0.00 -0.52 0.00 0.00 37.83 35.61 1ajo s LYS 134 CO 0.18 0.44 1.10 -1.17 -0.92 0.00 0.00 175.35 174.98 1ajo s LEU 135 N -0.73 4.39 -0.18 3.17 0.20 0.13 -1.23 118.68 124.44 1ajo s LEU 135 Ca 0.08 1.89 -0.00 0.00 0.69 0.00 0.00 54.13 56.79 1ajo s LEU 135 Cb -0.08 -3.58 0.04 0.00 -0.43 0.00 0.00 46.19 42.14 1ajo s LEU 135 CO 0.00 -0.34 -0.07 -0.75 -0.29 0.00 0.00 176.35 174.90 1ajo s LYS 136 N 0.81 1.62 -0.07 1.98 2.20 0.33 -0.55 119.74 126.07 1ajo s LYS 136 Ca 0.55 -0.65 -0.11 0.00 -0.36 0.00 0.00 55.97 55.40 1ajo s LYS 136 Cb -0.26 -2.18 -0.05 0.00 -1.51 0.00 0.00 37.83 33.83 1ajo s LYS 136 CO 0.29 -0.44 0.27 -0.51 -0.36 0.00 0.00 175.35 174.60 1ajo s LEU 137 N 1.55 4.42 0.09 5.43 1.43 -0.30 -1.68 118.68 129.61 1ajo s LEU 137 Ca -0.00 0.69 0.07 0.00 -1.03 0.00 0.00 54.13 53.86 1ajo s LEU 137 Cb -0.16 -2.33 -0.03 0.00 0.03 0.00 0.00 46.19 43.70 1ajo s LEU 137 CO -0.08 0.35 -0.18 -0.83 0.23 0.00 0.00 176.35 175.84 1ajo s GLY 138 N -0.93 1.07 -0.43 -3.19 0.00 0.33 -1.79 107.32 102.38 1ajo s GLY 138 Ca 0.19 -1.13 -0.00 0.00 0.00 0.00 0.00 44.72 43.78 1ajo s GLY 138 CO 0.08 -1.14 0.19 -2.27 0.00 0.00 0.00 173.10 169.97 1ajo s LEU 139 N -1.80 5.02 0.00 0.66 2.96 -0.29 -3.80 118.68 121.42 1ajo s LEU 139 Ca 0.03 -2.27 0.02 0.00 -0.22 0.00 0.00 54.13 51.69 1ajo s LEU 139 Cb -0.10 -1.76 0.02 0.00 0.50 0.00 0.00 46.19 44.86 1ajo s LEU 139 CO 0.03 -0.44 0.17 0.35 -1.32 0.00 0.00 176.35 175.14 1ajo n THR 140 N 4.21 0.00 -4.19 3.68 -2.24 -0.51 -1.45 114.28 113.78 1ajo n THR 140 Ca 0.02 -1.82 -0.19 0.00 -2.27 0.00 0.00 64.05 59.78 1ajo n THR 140 Cb 0.40 0.11 -0.16 0.00 -2.10 0.00 0.00 70.33 68.59 1ajo n THR 140 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ajo s SER 141 N -3.41 0.89 0.00 3.42 0.15 -1.26 -1.44 113.70 112.06 1ajo s SER 141 Ca 0.13 -0.13 0.22 0.00 0.70 0.00 0.00 55.95 56.87 1ajo s SER 141 Cb -0.01 -0.37 -0.18 0.00 -1.71 0.00 0.00 66.02 63.76 1ajo s SER 141 CO 0.08 -0.02 0.82 -1.54 1.20 0.00 0.00 173.24 173.78 1ajo n SER 142 N 3.76 0.60 -3.76 5.45 3.41 -1.15 -5.00 113.62 116.94 1ajo n SER 142 Ca -0.23 -0.50 -0.04 0.00 -0.26 0.00 0.00 58.87 57.84 1ajo n SER 142 Cb 0.52 1.22 -0.01 0.00 -0.26 0.00 0.00 64.21 65.68 1ajo n SER 142 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ajo s ALA 143 N -3.20 -1.59 0.21 7.33 0.00 -1.26 -5.04 121.76 118.21 1ajo s ALA 143 Ca 0.02 0.09 -0.32 0.00 0.00 0.00 0.00 51.96 51.75 1ajo s ALA 143 Cb 0.15 0.67 -0.13 0.00 0.00 0.00 0.00 23.12 23.81 1ajo s ALA 143 CO 0.86 -1.03 1.54 0.98 0.00 0.00 0.00 175.76 178.11 1ajo n TYR 144 N -0.46 2.36 -3.26 0.00 9.36 -1.26 -1.95 117.16 121.96 1ajo n TYR 144 Ca -0.06 0.30 -0.18 0.00 3.32 0.00 0.00 57.90 61.28 1ajo n TYR 144 Cb 0.60 -2.54 -0.02 0.00 -0.63 0.00 0.00 39.34 36.75 1ajo n TYR 144 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1ajo n ASN 145 N 2.90 -1.95 -4.07 2.98 5.03 -1.26 -4.97 115.26 113.91 1ajo n ASN 145 Ca 0.14 -0.20 -0.32 0.00 0.87 0.00 0.00 54.58 55.07 1ajo n ASN 145 Cb 0.31 -1.72 -0.16 0.00 -1.02 0.00 0.00 39.78 37.19 1ajo n ASN 145 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1ajo s LYS 146 N -5.85 2.55 0.03 3.52 1.02 -0.82 -5.12 119.74 115.06 1ajo s LYS 146 Ca 0.32 -0.91 0.06 0.00 0.02 0.00 0.00 55.97 55.46 1ajo s LYS 146 Cb -0.18 -2.55 -0.03 0.00 -0.52 0.00 0.00 37.83 34.54 1ajo s LYS 146 CO 0.39 -0.33 -0.17 -0.06 -0.92 0.00 0.00 175.35 174.26 1ajo s PHE 147 N 1.29 2.59 -0.09 3.18 0.08 -1.26 -2.92 117.98 120.85 1ajo s PHE 147 Ca 0.01 -0.24 0.03 0.00 0.12 0.00 0.00 56.93 56.85 1ajo s PHE 147 Cb -0.15 -1.49 -0.01 0.00 -0.57 0.00 0.00 43.02 40.79 1ajo s PHE 147 CO -0.10 0.24 -0.18 -0.51 -0.10 0.00 0.00 175.22 174.57 1ajo s ASP 148 N -1.32 3.60 0.04 1.36 1.01 -0.52 -1.21 116.67 119.63 1ajo s ASP 148 Ca 0.14 -0.39 0.01 0.00 0.71 0.00 0.00 52.55 53.01 1ajo s ASP 148 Cb -0.11 -1.23 -0.00 0.00 1.01 0.00 0.00 42.92 42.59 1ajo s ASP 148 CO 0.05 0.22 0.02 0.00 0.21 0.00 0.00 175.17 175.67 1ajo s ALA 150 N -2.14 -0.33 -0.14 0.00 0.00 -1.17 -1.46 121.76 116.52 1ajo s ALA 150 Ca 0.03 0.14 -0.04 0.00 0.00 0.00 0.00 51.96 52.09 1ajo s ALA 150 Cb 0.00 -0.08 0.07 0.00 0.00 0.00 0.00 23.12 23.11 1ajo s ALA 150 CO 0.02 -0.13 0.25 -2.00 0.00 0.00 0.00 175.76 173.90 1ajo s GLU 151 N -0.61 0.15 -0.08 0.00 2.12 -1.26 -2.06 118.70 116.96 1ajo s GLU 151 Ca -0.07 0.67 0.01 0.00 0.36 0.00 0.00 54.97 55.94 1ajo s GLU 151 Cb -0.04 -0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.12 1ajo s GLU 151 CO 0.01 -0.34 -0.08 -0.47 -0.54 0.00 0.00 175.26 173.83 1ajo s TYR 152 N 2.40 2.89 -0.08 5.30 5.04 0.27 -1.49 117.35 131.69 1ajo s TYR 152 Ca 0.02 -0.08 -0.19 0.00 -2.44 0.00 0.00 57.07 54.38 1ajo s TYR 152 Cb -0.13 -1.73 0.04 0.00 0.35 0.00 0.00 41.96 40.50 1ajo s TYR 152 CO -0.09 0.24 0.45 -0.98 -1.34 0.00 0.00 175.55 173.83 1ajo s ARG 153 N -0.61 0.72 0.60 4.97 1.70 -0.75 -1.29 118.95 124.28 1ajo s ARG 153 Ca 0.09 0.21 -0.18 0.00 -0.47 0.00 0.00 55.73 55.38 1ajo s ARG 153 Cb -0.12 0.33 -0.03 0.00 -0.57 0.00 0.00 34.95 34.57 1ajo s ARG 153 CO 0.02 -0.17 1.14 -1.54 -1.08 0.00 0.00 175.30 173.66 1ajo s SER 154 N -0.74 5.36 0.04 -2.89 1.04 0.26 -0.49 113.70 116.28 1ajo s SER 154 Ca -0.08 2.16 0.11 0.00 0.48 0.00 0.00 55.95 58.61 1ajo s SER 154 Cb -0.03 -2.57 -0.20 0.00 0.10 0.00 0.00 66.02 63.31 1ajo s SER 154 CO 0.04 -1.46 0.95 0.71 0.98 0.00 0.00 173.24 174.46 1ajo h THR 155 N 0.69 1.16 -2.90 2.02 1.35 -1.30 -3.44 112.91 110.49 1ajo h THR 155 Ca -0.49 -2.91 -0.47 0.00 -0.55 0.00 0.00 66.41 61.99 1ajo h THR 155 Cb 1.26 2.56 0.03 0.00 -1.73 0.00 0.00 68.15 70.27 1ajo h THR 155 CO 0.55 0.66 -0.07 0.20 -0.25 0.00 0.00 175.52 176.62 1ajo s ASN 156 N -6.33 5.92 0.06 5.36 0.02 -1.26 -5.08 114.94 113.64 1ajo s ASN 156 Ca -0.02 0.40 0.02 0.00 -1.02 0.00 0.00 52.86 52.24 1ajo s ASN 156 Cb 0.09 -1.68 -0.04 0.00 0.02 0.00 0.00 41.25 39.64 1ajo s ASN 156 CO 0.82 -0.66 0.10 0.27 0.02 0.00 0.00 177.10 177.65 1ajo s ILE 157 N -2.57 4.73 0.03 0.60 -4.36 -1.26 -4.51 121.20 113.85 1ajo s ILE 157 Ca 0.47 -0.64 0.04 0.00 -0.26 0.00 0.00 60.65 60.26 1ajo s ILE 157 Cb -0.10 -3.27 -0.02 0.00 1.25 0.00 0.00 42.46 40.32 1ajo s ILE 157 CO 0.39 0.16 -0.11 -0.31 0.24 0.00 0.00 174.94 175.31 1ajo s TYR 158 N -1.38 0.96 0.00 1.37 2.02 0.02 -4.86 117.35 115.48 1ajo s TYR 158 Ca 0.29 -0.33 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 1ajo s TYR 158 Cb -0.12 -0.58 0.00 0.00 -0.40 0.00 0.00 41.96 40.86 1ajo s TYR 158 CO 0.22 -0.00 0.00 0.41 -1.57 0.00 0.00 175.55 174.61 1ajo n GLY 159 N 2.02 2.74 3.66 0.71 0.00 -1.26 -1.78 105.19 111.29 1ajo n GLY 159 Ca -0.18 -1.84 -0.37 0.00 0.00 0.00 0.00 46.02 43.63 1ajo n GLY 159 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ajo n TYR 160 N 0.00 1.20 -0.08 1.61 4.01 -1.26 -4.90 117.16 117.74 1ajo n TYR 160 Ca 0.00 0.42 0.00 0.00 -0.16 0.00 0.00 57.90 58.16 1ajo n TYR 160 Cb 0.00 -2.17 0.00 0.00 -0.31 0.00 0.00 39.34 36.86 1ajo n TYR 160 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ajo n GLY 161 N 1.11 0.66 3.61 2.72 0.00 0.32 -3.23 105.19 110.38 1ajo n GLY 161 Ca 0.15 -1.88 -0.39 0.00 0.00 0.00 0.00 46.02 43.90 1ajo n GLY 161 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ajo s LEU 162 N 0.00 4.04 -0.22 0.99 2.96 -0.65 -0.26 118.68 125.53 1ajo s LEU 162 Ca 0.00 0.27 -0.06 0.00 -0.22 0.00 0.00 54.13 54.13 1ajo s LEU 162 Cb 0.00 -2.40 -0.02 0.00 0.50 0.00 0.00 46.19 44.27 1ajo s LEU 162 CO 0.00 -0.16 0.02 -0.31 -1.32 0.00 0.00 176.35 174.58 1ajo s TYR 163 N 1.98 3.04 0.05 5.38 1.51 -0.06 0.03 117.35 129.29 1ajo s TYR 163 Ca 0.14 -0.54 0.05 0.00 -1.01 0.00 0.00 57.07 55.72 1ajo s TYR 163 Cb -0.16 -2.15 -0.02 0.00 -0.11 0.00 0.00 41.96 39.52 1ajo s TYR 163 CO 0.10 -0.35 -0.15 -1.21 -1.11 0.00 0.00 175.55 172.83 1ajo s GLU 164 N 1.33 0.95 -0.09 -0.62 2.02 0.10 -1.54 118.70 120.85 1ajo s GLU 164 Ca 0.04 -0.84 -0.07 0.00 0.02 0.00 0.00 54.97 54.13 1ajo s GLU 164 Cb -0.15 -0.98 0.03 0.00 0.10 0.00 0.00 34.13 33.13 1ajo s GLU 164 CO 0.01 0.24 0.22 0.54 0.02 0.00 0.00 175.26 176.29 1ajo s VAL 165 N -0.96 -0.01 -0.36 2.63 0.11 -0.25 -0.39 120.40 121.17 1ajo s VAL 165 Ca 0.01 0.05 -0.13 0.00 -2.93 0.00 0.00 61.98 58.98 1ajo s VAL 165 Cb -0.09 -0.32 -0.01 0.00 -1.53 0.00 0.00 36.38 34.44 1ajo s VAL 165 CO 0.02 0.02 0.26 -0.55 -3.33 0.00 0.00 175.10 171.51 1ajo s SER 166 N 0.49 6.06 0.27 3.54 0.15 -0.76 -0.38 113.70 123.06 1ajo s SER 166 Ca -0.03 -0.57 -0.04 0.00 0.70 0.00 0.00 55.95 56.01 1ajo s SER 166 Cb -0.04 -2.14 -0.02 0.00 -1.71 0.00 0.00 66.02 62.11 1ajo s SER 166 CO -0.02 -0.30 0.35 0.00 1.20 0.00 0.00 173.24 174.47 1ajo s MET 167 N 1.71 1.56 -0.20 5.44 0.23 -0.92 -1.07 119.30 126.05 1ajo s MET 167 Ca 0.06 -1.58 -0.05 0.00 -1.03 0.00 0.00 55.69 53.09 1ajo s MET 167 Cb -0.18 0.39 0.07 0.00 -1.53 0.00 0.00 34.83 33.58 1ajo s MET 167 CO 0.10 -0.61 0.12 0.21 -2.03 0.00 0.00 175.02 172.82 1ajo s LYS 168 N -3.74 0.11 0.72 3.16 2.20 0.05 -2.92 119.74 119.32 1ajo s LYS 168 Ca 0.31 -0.13 -0.11 0.00 -0.36 0.00 0.00 55.97 55.69 1ajo s LYS 168 Cb 0.02 -1.58 0.02 0.00 -1.51 0.00 0.00 37.83 34.78 1ajo s LYS 168 CO 0.15 -0.74 1.07 -1.25 -0.36 0.00 0.00 175.35 174.21 1ajo s PRO 169 N 2.17 2.77 0.43 4.03 0.04 -1.26 -0.77 135.00 142.40 1ajo s PRO 169 Ca 0.04 0.91 -0.22 0.00 0.04 0.00 0.00 61.00 61.77 1ajo s PRO 169 Cb -0.16 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 1ajo s PRO 169 CO -0.15 -1.21 1.00 0.00 0.04 0.00 0.00 177.00 176.68 1ajo s ALA 170 N -3.06 3.02 -0.20 8.56 0.00 -1.23 -4.42 121.76 124.43 1ajo s ALA 170 Ca 0.59 0.55 -0.04 0.00 0.00 0.00 0.00 51.96 53.06 1ajo s ALA 170 Cb -0.14 -3.22 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 1ajo s ALA 170 CO 0.55 -0.09 -0.04 0.21 0.00 0.00 0.00 175.76 176.39 1ajo s LYS 171 N -2.89 3.45 0.00 0.00 2.20 -1.26 -4.44 119.74 116.80 1ajo s LYS 171 Ca 0.61 -0.60 0.00 0.00 -0.36 0.00 0.00 55.97 55.62 1ajo s LYS 171 Cb -0.16 -2.99 0.00 0.00 -1.51 0.00 0.00 37.83 33.17 1ajo s LYS 171 CO 0.20 -0.09 0.00 -1.71 -0.36 0.00 0.00 175.35 173.39 1ajo n ASN 172 N 4.49 0.00 -4.59 1.43 5.15 -0.54 -5.03 115.26 116.18 1ajo n ASN 172 Ca -0.18 0.00 -0.38 0.00 -0.60 0.00 0.00 54.58 53.42 1ajo n ASN 172 Cb 0.51 0.00 0.05 0.00 -0.53 0.00 0.00 39.78 39.81 1ajo n ASN 172 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 1ajo n THR 173 N -0.15 3.41 -0.94 -0.44 5.66 -1.26 -3.01 114.28 117.56 1ajo n THR 173 Ca 0.00 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.50 1ajo n THR 173 Cb 0.00 -1.05 0.00 0.00 -1.55 0.00 0.00 70.33 67.73 1ajo n THR 173 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ajo n GLY 174 N 1.38 0.84 3.53 1.09 0.00 -0.51 -4.52 105.19 107.00 1ajo n GLY 174 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 1ajo n GLY 174 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ajo s ILE 175 N -3.51 1.43 -0.02 -0.61 -4.36 -1.23 -1.95 121.20 110.95 1ajo s ILE 175 Ca 0.00 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.38 1ajo s ILE 175 Cb 0.00 -2.81 0.01 0.00 1.25 0.00 0.00 42.46 40.91 1ajo s ILE 175 CO 0.00 0.00 0.04 -0.69 0.24 0.00 0.00 174.94 174.53 1ajo s VAL 176 N -3.07 -0.02 -0.09 8.37 1.01 -0.69 -0.81 120.40 125.11 1ajo s VAL 176 Ca 0.34 0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.42 1ajo s VAL 176 Cb 0.08 -0.07 -0.00 0.00 0.00 0.00 0.00 36.38 36.40 1ajo s VAL 176 CO 0.16 0.02 -0.23 -0.44 0.00 0.00 0.00 175.10 174.61 1ajo s SER 177 N 0.32 2.96 0.17 3.32 0.01 -0.89 -1.62 113.70 117.96 1ajo s SER 177 Ca -0.03 -0.53 -0.03 0.00 1.31 0.00 0.00 55.95 56.67 1ajo s SER 177 Cb -0.04 -1.28 -0.03 0.00 0.21 0.00 0.00 66.02 64.88 1ajo s SER 177 CO -0.01 0.16 0.16 -0.94 0.41 0.00 0.00 173.24 173.01 1ajo s SER 178 N 0.31 0.17 -0.03 2.44 1.04 -0.76 -0.67 113.70 116.21 1ajo s SER 178 Ca -0.17 -1.18 -0.01 0.00 0.48 0.00 0.00 55.95 55.07 1ajo s SER 178 Cb -0.17 0.37 0.03 0.00 0.10 0.00 0.00 66.02 66.35 1ajo s SER 178 CO 0.08 -0.83 0.04 0.12 0.98 0.00 0.00 173.24 173.63 1ajo s PHE 179 N -4.07 0.04 0.09 5.02 5.36 -0.25 -3.51 117.98 120.67 1ajo s PHE 179 Ca 0.28 0.18 -0.25 0.00 -0.96 0.00 0.00 56.93 56.18 1ajo s PHE 179 Cb 0.06 -0.34 0.08 0.00 -0.34 0.00 0.00 43.02 42.48 1ajo s PHE 179 CO 0.05 -0.13 0.72 -0.59 -1.46 0.00 0.00 175.22 173.82 1ajo s PHE 180 N 1.53 -0.45 0.02 10.12 -0.71 -0.16 -1.26 117.98 127.06 1ajo s PHE 180 Ca -0.03 0.27 0.02 0.00 -1.04 0.00 0.00 56.93 56.15 1ajo s PHE 180 Cb -0.13 0.55 -0.04 0.00 -1.21 0.00 0.00 43.02 42.20 1ajo s PHE 180 CO -0.03 -0.73 0.02 0.95 -1.34 0.00 0.00 175.22 174.10 1ajo s THR 181 N -3.48 4.26 -0.11 -4.49 -4.23 -0.82 0.22 115.64 106.99 1ajo s THR 181 Ca 0.03 -0.66 -0.20 0.00 -1.18 0.00 0.00 61.69 59.68 1ajo s THR 181 Cb -0.01 -2.95 0.05 0.00 1.34 0.00 0.00 72.50 70.93 1ajo s THR 181 CO -0.11 0.30 0.48 -0.47 -0.54 0.00 0.00 174.62 174.28 1ajo s TYR 182 N -1.18 -0.46 -0.01 3.99 5.04 -0.18 -2.58 117.35 121.97 1ajo s TYR 182 Ca 0.22 0.98 -0.16 0.00 -2.44 0.00 0.00 57.07 55.67 1ajo s TYR 182 Cb -0.12 0.21 0.03 0.00 0.35 0.00 0.00 41.96 42.43 1ajo s TYR 182 CO 0.14 -0.38 0.35 -0.08 -1.34 0.00 0.00 175.55 174.24 1ajo s THR 183 N -0.52 0.06 0.00 4.34 -1.32 -0.83 0.01 115.64 117.39 1ajo s THR 183 Ca -0.06 -0.46 -0.02 0.00 -1.21 0.00 0.00 61.69 59.93 1ajo s THR 183 Cb -0.03 -0.70 0.01 0.00 -1.51 0.00 0.00 72.50 70.26 1ajo s THR 183 CO 0.04 -0.25 0.11 0.61 -2.21 0.00 0.00 174.62 172.92 1ajo n GLY 184 N 1.12 0.82 0.40 6.08 0.00 -1.23 -2.47 105.19 109.90 1ajo n GLY 184 Ca -0.21 -0.88 0.19 0.00 0.00 0.00 0.00 46.02 45.11 1ajo n GLY 184 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ajo h PRO 185 N 0.00 0.31 0.00 1.61 0.10 -1.75 0.21 132.00 132.48 1ajo h PRO 185 Ca -0.02 -0.02 -0.00 0.00 0.10 0.00 0.00 66.00 66.06 1ajo h PRO 185 Cb 0.11 -0.07 -0.00 0.00 0.10 0.00 0.00 31.00 31.14 1ajo h PRO 185 CO 0.03 0.20 -0.01 0.00 0.10 0.00 0.00 178.00 178.33 1ajo h ALA 186 N 1.63 1.02 -0.41 -0.75 0.00 -1.96 -2.14 119.26 116.65 1ajo h ALA 186 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1ajo h ALA 186 Cb 1.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ajo h ALA 186 CO -0.11 0.01 0.00 0.72 0.00 0.00 0.00 179.25 179.86 1ajo n HIS 187 N -3.12 0.55 -0.78 0.00 8.25 0.73 -4.97 115.22 115.88 1ajo n HIS 187 Ca -0.02 -0.39 0.00 0.00 -0.26 0.00 0.00 57.72 57.05 1ajo n HIS 187 Cb 0.16 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.26 1ajo n HIS 187 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ajo n GLY 188 N 1.01 0.53 3.23 -1.41 0.00 -0.80 -4.94 105.19 102.80 1ajo n GLY 188 Ca 0.16 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.18 1ajo n GLY 188 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ajo n THR 189 N -2.78 0.00 -1.62 2.61 -2.24 -1.13 -5.00 114.28 104.12 1ajo n THR 189 Ca 0.00 -2.35 -0.29 0.00 -2.27 0.00 0.00 64.05 59.14 1ajo n THR 189 Cb 0.00 0.96 0.11 0.00 -2.10 0.00 0.00 70.33 69.31 1ajo n THR 189 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajo s GLN 190 N -3.45 1.58 -0.56 -0.78 -2.07 -1.26 -2.62 119.66 110.50 1ajo s GLN 190 Ca 0.27 0.35 -0.21 0.00 -1.82 0.00 0.00 55.36 53.94 1ajo s GLN 190 Cb 0.01 -1.88 0.06 0.00 -1.09 0.00 0.00 33.01 30.11 1ajo s GLN 190 CO 0.19 -1.91 0.80 -0.46 -1.32 0.00 0.00 175.29 172.60 1ajo s TRP 191 N -3.31 2.89 -0.12 9.60 -0.00 -1.26 -3.49 118.94 123.24 1ajo s TRP 191 Ca 0.63 -0.41 0.02 0.00 -0.00 0.00 0.00 56.10 56.34 1ajo s TRP 191 Cb -0.14 -3.91 -0.00 0.00 -0.00 0.00 0.00 33.47 29.42 1ajo s TRP 191 CO 0.53 -1.29 -0.20 -0.51 -0.00 0.00 0.00 176.95 175.48 1ajo s ASP 192 N 3.03 3.35 -0.04 5.86 1.01 -1.03 -1.19 116.67 127.66 1ajo s ASP 192 Ca 0.21 -0.51 -0.15 0.00 0.71 0.00 0.00 52.55 52.81 1ajo s ASP 192 Cb -0.17 -1.48 0.03 0.00 1.01 0.00 0.00 42.92 42.31 1ajo s ASP 192 CO 0.13 0.13 0.33 -0.70 0.21 0.00 0.00 175.17 175.28 1ajo s GLU 193 N 0.52 0.64 -0.07 8.23 2.12 -0.55 -1.96 118.70 127.64 1ajo s GLU 193 Ca -0.13 -0.06 0.02 0.00 0.36 0.00 0.00 54.97 55.16 1ajo s GLU 193 Cb -0.17 0.29 0.02 0.00 0.26 0.00 0.00 34.13 34.53 1ajo s GLU 193 CO 0.05 -0.17 -0.10 0.42 -0.54 0.00 0.00 175.26 174.92 1ajo s ILE 194 N -1.06 1.01 0.14 -3.70 1.01 -1.07 -0.53 121.20 117.00 1ajo s ILE 194 Ca -0.11 -0.39 0.11 0.00 0.00 0.00 0.00 60.65 60.25 1ajo s ILE 194 Cb -0.05 -0.94 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 1ajo s ILE 194 CO 0.04 0.33 -0.25 -1.81 0.00 0.00 0.00 174.94 173.25 1ajo s ASP 195 N 0.81 3.44 -0.26 3.58 1.01 1.00 -1.95 116.67 124.30 1ajo s ASP 195 Ca -0.12 -0.74 0.02 0.00 0.71 0.00 0.00 52.55 52.42 1ajo s ASP 195 Cb -0.15 -0.28 0.06 0.00 1.01 0.00 0.00 42.92 43.55 1ajo s ASP 195 CO 0.02 0.17 -0.10 -0.63 0.21 0.00 0.00 175.17 174.84 1ajo s ILE 196 N -1.18 2.30 -0.06 0.77 1.01 -0.39 -2.74 121.20 120.90 1ajo s ILE 196 Ca 0.16 -1.55 0.04 0.00 0.00 0.00 0.00 60.65 59.30 1ajo s ILE 196 Cb -0.10 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 40.05 1ajo s ILE 196 CO 0.07 -0.01 -0.18 -1.61 0.00 0.00 0.00 174.94 173.21 1ajo s GLU 197 N 1.14 2.13 -0.34 2.79 2.02 -0.12 -1.09 118.70 125.23 1ajo s GLU 197 Ca -0.08 -0.66 -0.11 0.00 0.02 0.00 0.00 54.97 54.14 1ajo s GLU 197 Cb -0.20 -1.75 -0.00 0.00 0.10 0.00 0.00 34.13 32.28 1ajo s GLU 197 CO -0.05 0.20 0.20 -0.06 0.02 0.00 0.00 175.26 175.57 1ajo s PHE 198 N 0.22 3.21 -0.28 1.61 0.08 0.16 -0.53 117.98 122.45 1ajo s PHE 198 Ca -0.10 -0.54 -0.27 0.00 0.12 0.00 0.00 56.93 56.15 1ajo s PHE 198 Cb -0.14 -2.43 0.01 0.00 -0.57 0.00 0.00 43.02 39.88 1ajo s PHE 198 CO 0.04 -0.48 0.94 -0.51 -0.10 0.00 0.00 175.22 175.11 1ajo s LEU 199 N 1.64 4.05 0.62 -0.37 1.43 -1.26 -2.09 118.68 122.70 1ajo s LEU 199 Ca 0.05 1.03 0.35 0.00 -1.03 0.00 0.00 54.13 54.52 1ajo s LEU 199 Cb -0.18 -3.34 2.00 0.00 0.03 0.00 0.00 46.19 44.70 1ajo s LEU 199 CO 0.08 -0.67 2.26 1.23 0.23 0.00 0.00 176.35 179.47 1ajo h GLY 200 N 9.56 0.00 2.00 -3.19 0.00 -1.13 -1.73 103.07 108.58 1ajo h GLY 200 Ca -0.22 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 1ajo h GLY 200 CO 0.94 0.00 -0.08 0.07 0.00 0.00 0.00 176.54 177.47 1ajo h LYS 201 N 0.00 0.00 -1.64 4.80 2.10 -1.75 -1.44 116.57 118.64 1ajo h LYS 201 Ca 0.01 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 58.47 1ajo h LYS 201 Cb 0.10 0.00 -0.28 0.00 -0.90 0.00 0.00 32.23 31.16 1ajo h LYS 201 CO -0.00 0.08 -0.55 0.34 -2.00 0.00 0.00 179.45 177.33 1ajo s ASP 202 N -5.90 0.24 -0.03 7.07 -1.08 -0.65 -4.84 116.67 111.48 1ajo s ASP 202 Ca -0.02 -0.59 0.04 0.00 -0.52 0.00 0.00 52.55 51.46 1ajo s ASP 202 Cb 0.12 1.14 0.16 0.00 -1.46 0.00 0.00 42.92 42.88 1ajo s ASP 202 CO 0.55 -0.32 0.93 0.35 0.52 0.00 0.00 175.17 177.20 1ajo n THR 203 N 5.09 0.40 0.43 1.71 -2.24 -1.25 -2.99 114.28 115.43 1ajo n THR 203 Ca 0.03 -0.25 0.12 0.00 -2.27 0.00 0.00 64.05 61.68 1ajo n THR 203 Cb 0.50 -0.19 0.24 0.00 -2.10 0.00 0.00 70.33 68.78 1ajo n THR 203 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ajo n THR 204 N 0.05 0.48 -4.21 4.28 -2.24 -1.26 -0.43 114.28 110.95 1ajo n THR 204 Ca 0.06 -0.70 -0.12 0.00 -2.27 0.00 0.00 64.05 61.02 1ajo n THR 204 Cb 0.30 0.86 -0.10 0.00 -2.10 0.00 0.00 70.33 69.29 1ajo n THR 204 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ajo s LYS 205 N -1.52 1.00 0.03 -0.78 1.02 -1.16 -1.06 119.74 117.26 1ajo s LYS 205 Ca 0.38 -1.46 0.02 0.00 0.02 0.00 0.00 55.97 54.93 1ajo s LYS 205 Cb 0.22 -0.23 -0.02 0.00 -0.52 0.00 0.00 37.83 37.29 1ajo s LYS 205 CO 0.31 -0.09 -0.07 0.54 -0.92 0.00 0.00 175.35 175.12 1ajo s VAL 206 N -3.66 0.47 -0.11 3.17 0.11 -0.70 -4.70 120.40 114.98 1ajo s VAL 206 Ca 0.19 -0.77 0.00 0.00 -2.93 0.00 0.00 61.98 58.48 1ajo s VAL 206 Cb 0.06 -0.50 -0.02 0.00 -1.53 0.00 0.00 36.38 34.39 1ajo s VAL 206 CO 0.01 -0.21 -0.11 -1.58 -3.33 0.00 0.00 175.10 169.87 1ajo s GLN 207 N -1.06 3.22 -0.03 1.54 0.74 0.31 -1.16 119.66 123.22 1ajo s GLN 207 Ca -0.06 -0.65 0.05 0.00 0.05 0.00 0.00 55.36 54.75 1ajo s GLN 207 Cb -0.07 -2.63 -0.03 0.00 1.10 0.00 0.00 33.01 31.38 1ajo s GLN 207 CO 0.00 0.33 -0.17 -0.06 -0.55 0.00 0.00 175.29 174.84 1ajo s PHE 208 N 0.05 2.61 0.21 1.67 0.08 0.13 -0.94 117.98 121.79 1ajo s PHE 208 Ca -0.04 -0.22 -0.20 0.00 0.12 0.00 0.00 56.93 56.59 1ajo s PHE 208 Cb -0.14 -1.58 0.04 0.00 -0.57 0.00 0.00 43.02 40.77 1ajo s PHE 208 CO 0.04 0.16 0.59 1.21 -0.10 0.00 0.00 175.22 177.12 1ajo s ASN 209 N -0.84 -0.33 0.06 1.36 2.47 -1.11 -0.59 114.94 115.95 1ajo s ASN 209 Ca 0.12 -0.41 -0.27 0.00 0.42 0.00 0.00 52.86 52.72 1ajo s ASN 209 Cb -0.10 0.62 0.07 0.00 -1.45 0.00 0.00 41.25 40.39 1ajo s ASN 209 CO 0.01 -1.11 0.66 -0.72 -3.72 0.00 0.00 177.10 172.22 1ajo s TYR 210 N -3.86 -0.57 -0.01 0.43 1.13 -1.26 -0.00 117.35 113.21 1ajo s TYR 210 Ca 0.08 0.66 0.03 0.00 -1.41 0.00 0.00 57.07 56.43 1ajo s TYR 210 Cb -0.02 0.49 -0.01 0.00 -1.10 0.00 0.00 41.96 41.32 1ajo s TYR 210 CO -0.02 -0.72 -0.10 0.71 -2.51 0.00 0.00 175.55 172.91 1ajo s TYR 211 N -2.59 0.91 -0.16 -3.49 2.02 0.31 -3.49 117.35 110.86 1ajo s TYR 211 Ca -0.04 -0.18 -0.01 0.00 -0.37 0.00 0.00 57.07 56.48 1ajo s TYR 211 Cb -0.01 -0.59 0.04 0.00 -0.40 0.00 0.00 41.96 41.01 1ajo s TYR 211 CO -0.03 -0.02 -0.04 0.99 -1.57 0.00 0.00 175.55 174.88 1ajo s THR 212 N -0.21 0.97 -1.20 -0.71 2.01 -1.26 -1.48 115.64 113.77 1ajo s THR 212 Ca 0.03 -0.53 -0.10 0.00 0.31 0.00 0.00 61.69 61.41 1ajo s THR 212 Cb -0.04 -1.18 -0.02 0.00 0.01 0.00 0.00 72.50 71.28 1ajo s THR 212 CO -0.00 0.12 0.76 -3.20 -0.69 0.00 0.00 174.62 171.61 1ajo n ASN 213 N 4.92 -3.79 0.00 3.53 5.15 -0.33 -4.97 115.26 119.77 1ajo n ASN 213 Ca -0.11 -0.89 0.14 0.00 -0.60 0.00 0.00 54.58 53.12 1ajo n ASN 213 Cb 0.48 -3.94 0.84 0.00 -0.53 0.00 0.00 39.78 36.63 1ajo n ASN 213 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27