#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3btf s VAL 17 N 0.00 5.33 -0.61 1.39 1.01 0.52 -4.07 120.40 123.98 3btf s VAL 17 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.44 3btf s VAL 17 Cb 0.00 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.79 3btf s VAL 17 CO 0.00 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.11 3btf n GLY 18 N 3.40 0.52 0.00 4.51 0.00 -1.24 -1.46 105.19 110.92 3btf n GLY 18 Ca -0.13 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.19 3btf n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3btf n GLY 19 N -1.66 2.63 3.14 -0.02 0.00 -1.26 -4.85 105.19 103.17 3btf n GLY 19 Ca -0.07 -2.06 -0.09 0.00 0.00 0.00 0.00 46.02 43.80 3btf n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3btf s TYR 20 N 1.68 0.77 -0.04 1.61 1.13 0.40 -4.91 117.35 117.99 3btf s TYR 20 Ca 0.00 -0.96 -0.30 0.00 -1.41 0.00 0.00 57.07 54.41 3btf s TYR 20 Cb 0.00 -0.47 -0.05 0.00 -1.10 0.00 0.00 41.96 40.33 3btf s TYR 20 CO 0.00 -0.22 1.58 0.99 -2.51 0.00 0.00 175.55 175.39 3btf s THR 21 N -3.67 3.60 0.18 -3.49 2.01 -1.26 0.72 115.64 113.74 3btf s THR 21 Ca 0.10 0.81 -0.12 0.00 0.31 0.00 0.00 61.69 62.78 3btf s THR 21 Cb 0.06 -3.52 0.10 0.00 0.01 0.00 0.00 72.50 69.14 3btf s THR 21 CO -0.06 -0.06 1.82 0.00 -0.69 0.00 0.00 174.62 175.63 3btf n GLY 23 N -1.15 2.90 3.69 0.00 0.00 -1.26 -4.80 105.19 104.58 3btf n GLY 23 Ca 0.04 -1.56 -0.55 0.00 0.00 0.00 0.00 46.02 43.96 3btf n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3btf n ALA 24 N 0.87 0.18 -2.97 4.61 0.00 -1.26 -2.51 120.51 119.43 3btf n ALA 24 Ca 0.00 0.34 -0.21 0.00 0.00 0.00 0.00 53.44 53.57 3btf n ALA 24 Cb 0.00 -2.32 0.01 0.00 0.00 0.00 0.00 19.45 17.15 3btf n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3btf n ASN 25 N 5.96 -5.10 -0.03 0.00 3.02 -1.26 -4.86 115.26 112.98 3btf n ASN 25 Ca 0.26 -0.22 0.12 0.00 -0.03 0.00 0.00 54.58 54.72 3btf n ASN 25 Cb 0.18 -4.18 0.29 0.00 -0.61 0.00 0.00 39.78 35.45 3btf n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3btf n THR 26 N -4.14 0.00 -3.43 3.41 -2.24 -1.04 -4.07 114.28 102.76 3btf n THR 26 Ca -0.11 -0.02 -0.26 0.00 -2.27 0.00 0.00 64.05 61.39 3btf n THR 26 Cb 0.60 0.24 -0.08 0.00 -2.10 0.00 0.00 70.33 68.99 3btf n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3btf n VAL 27 N -1.38 1.29 0.22 2.28 0.31 -1.26 -4.97 118.33 114.82 3btf n VAL 27 Ca 0.07 -4.77 0.14 0.00 -0.01 0.00 0.00 64.34 59.77 3btf n VAL 27 Cb 0.34 -2.05 0.77 0.00 -0.91 0.00 0.00 33.84 31.98 3btf n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3btf h PRO 28 N 4.39 0.00 -0.01 5.55 0.13 -1.79 -2.17 132.00 138.11 3btf h PRO 28 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3btf h PRO 28 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 3btf h PRO 28 CO 0.70 0.00 -0.39 2.48 -0.23 0.00 0.00 178.00 180.56 3btf n TYR 29 N -2.51 0.00 -2.49 1.56 0.18 -1.16 -2.08 117.16 110.66 3btf n TYR 29 Ca -0.02 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.34 3btf n TYR 29 Cb 0.09 -0.08 -0.03 0.00 -0.38 0.00 0.00 39.34 38.94 3btf n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 3btf s GLN 30 N -2.55 4.46 0.24 -3.48 2.00 -0.82 -1.21 119.66 118.31 3btf s GLN 30 Ca 0.21 1.68 0.10 0.00 -2.00 0.00 0.00 55.36 55.35 3btf s GLN 30 Cb 0.19 -3.39 -0.05 0.00 0.80 0.00 0.00 33.01 30.56 3btf s GLN 30 CO 0.57 -0.22 -0.18 0.14 -0.50 0.00 0.00 175.29 175.10 3btf s VAL 31 N 1.13 2.14 -0.11 1.34 -7.23 -0.31 -4.54 120.40 112.82 3btf s VAL 31 Ca 0.57 -2.31 0.01 0.00 -1.81 0.00 0.00 61.98 58.43 3btf s VAL 31 Cb -0.27 -2.18 -0.02 0.00 0.56 0.00 0.00 36.38 34.47 3btf s VAL 31 CO 0.28 -0.48 -0.12 -0.55 -0.31 0.00 0.00 175.10 173.92 3btf s SER 32 N -3.40 4.09 -0.22 4.85 0.15 -0.62 -2.25 113.70 116.30 3btf s SER 32 Ca 0.26 -0.27 -0.15 0.00 0.70 0.00 0.00 55.95 56.49 3btf s SER 32 Cb -0.03 -1.43 -0.04 0.00 -1.71 0.00 0.00 66.02 62.81 3btf s SER 32 CO 0.11 0.22 0.38 -0.76 1.20 0.00 0.00 173.24 174.39 3btf s LEU 33 N 0.05 4.12 -0.08 3.45 1.43 0.39 -0.73 118.68 127.32 3btf s LEU 33 Ca -0.04 0.44 0.04 0.00 -1.03 0.00 0.00 54.13 53.54 3btf s LEU 33 Cb -0.14 -2.47 -0.00 0.00 0.03 0.00 0.00 46.19 43.60 3btf s LEU 33 CO 0.04 -0.10 -0.22 0.21 0.23 0.00 0.00 176.35 176.52 3btf s ASN 34 N 1.18 2.78 -0.33 2.29 3.84 0.12 -1.82 114.94 123.00 3btf s ASN 34 Ca 0.17 -0.48 0.14 0.00 0.21 0.00 0.00 52.86 52.90 3btf s ASN 34 Cb -0.15 -1.05 0.46 0.00 -0.55 0.00 0.00 41.25 39.96 3btf s ASN 34 CO 0.08 0.17 1.07 -0.24 -2.79 0.00 0.00 177.10 175.38 3btf n SER 37 N 3.34 2.86 0.00 -4.21 2.88 -1.26 -1.15 113.62 116.08 3btf n SER 37 Ca -0.19 -2.98 0.00 0.00 -1.33 0.00 0.00 58.87 54.38 3btf n SER 37 Cb 0.53 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 3btf n SER 37 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3btf n GLY 38 N -0.39 0.44 3.57 0.46 0.00 -1.26 -5.00 105.19 103.00 3btf n GLY 38 Ca 0.22 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.18 3btf n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3btf s TYR 39 N -2.02 -0.20 0.01 1.61 1.13 -1.26 -5.13 117.35 111.49 3btf s TYR 39 Ca 0.00 0.12 -0.30 0.00 -1.41 0.00 0.00 57.07 55.48 3btf s TYR 39 Cb 0.00 0.52 -0.06 0.00 -1.10 0.00 0.00 41.96 41.32 3btf s TYR 39 CO 0.00 -0.31 1.50 -1.58 -2.51 0.00 0.00 175.55 172.65 3btf s HIS 40 N -2.64 2.64 0.00 -3.49 5.65 -1.26 -4.30 115.29 111.89 3btf s HIS 40 Ca 0.08 0.61 0.00 0.00 0.25 0.00 0.00 55.06 56.00 3btf s HIS 40 Cb -0.01 -3.78 0.00 0.00 -1.18 0.00 0.00 32.58 27.61 3btf s HIS 40 CO -0.06 -3.00 0.00 1.97 -0.65 0.00 0.00 174.74 173.00 3btf n PHE 41 N 5.61 0.00 -3.60 3.88 -1.74 -0.75 -4.99 117.46 115.87 3btf n PHE 41 Ca 0.14 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.95 3btf n PHE 41 Cb 0.43 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.41 3btf n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3btf n GLY 43 N -0.38 2.44 3.63 0.00 0.00 0.95 -0.46 105.19 111.38 3btf n GLY 43 Ca -0.10 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.71 3btf n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3btf s GLY 44 N -3.25 -0.38 -0.03 -0.02 0.00 -0.95 -3.94 107.32 98.75 3btf s GLY 44 Ca 0.25 0.68 0.05 0.00 0.00 0.00 0.00 44.72 45.70 3btf s GLY 44 CO 0.16 0.13 -0.19 -0.56 0.00 0.00 0.00 173.10 172.64 3btf s SER 45 N -2.92 2.32 -0.29 1.64 0.01 0.15 -1.16 113.70 113.45 3btf s SER 45 Ca 0.13 -0.37 -0.25 0.00 1.31 0.00 0.00 55.95 56.77 3btf s SER 45 Cb 0.04 -0.46 0.00 0.00 0.21 0.00 0.00 66.02 65.81 3btf s SER 45 CO -0.03 0.20 0.86 -0.22 0.41 0.00 0.00 173.24 174.47 3btf s LEU 46 N -0.22 4.06 -0.02 2.44 2.96 -0.35 -0.13 118.68 127.43 3btf s LEU 46 Ca 0.02 0.83 0.20 0.00 -0.22 0.00 0.00 54.13 54.96 3btf s LEU 46 Cb -0.10 -3.21 -0.27 0.00 0.50 0.00 0.00 46.19 43.11 3btf s LEU 46 CO 0.01 -0.65 0.64 2.30 -1.32 0.00 0.00 176.35 177.33 3btf n ILE 47 N 5.54 0.00 -3.65 6.68 -5.35 -0.49 -0.93 119.36 121.16 3btf n ILE 47 Ca 0.06 -0.26 0.02 0.00 -0.27 0.00 0.00 62.75 62.29 3btf n ILE 47 Cb 0.48 0.48 -0.00 0.00 -1.74 0.00 0.00 39.64 38.86 3btf n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3btf s ASN 48 N -3.68 -0.05 0.12 7.28 6.03 -1.18 -4.60 114.94 118.87 3btf s ASN 48 Ca -0.00 -0.13 0.16 0.00 -1.03 0.00 0.00 52.86 51.86 3btf s ASN 48 Cb 0.14 0.15 0.72 0.00 -3.03 0.00 0.00 41.25 39.22 3btf s ASN 48 CO 0.84 -0.27 1.51 -1.54 -2.03 0.00 0.00 177.10 175.61 3btf n SER 49 N -0.55 0.28 0.00 3.54 3.41 -1.26 -0.63 113.62 118.41 3btf n SER 49 Ca -0.08 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.12 3btf n SER 49 Cb 0.63 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 3btf n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 3btf n GLN 50 N -1.82 0.46 -4.36 4.33 7.27 -1.26 -0.29 117.38 121.71 3btf n GLN 50 Ca 0.02 -0.65 -0.19 0.00 0.07 0.00 0.00 57.00 56.26 3btf n GLN 50 Cb 0.16 -0.79 -0.14 0.00 2.41 0.00 0.00 30.24 31.87 3btf n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 3btf s TRP 51 N -0.26 0.86 -0.01 3.69 0.52 0.20 -0.44 118.94 123.50 3btf s TRP 51 Ca 0.00 -0.20 0.06 0.00 0.02 0.00 0.00 56.10 55.98 3btf s TRP 51 Cb 0.00 -0.55 -0.01 0.00 -1.15 0.00 0.00 33.47 31.76 3btf s TRP 51 CO 0.00 -0.01 -0.18 0.08 0.02 0.00 0.00 176.95 176.86 3btf s VAL 52 N -0.36 1.44 -0.09 4.03 1.01 -0.34 -1.40 120.40 124.68 3btf s VAL 52 Ca 0.02 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 3btf s VAL 52 Cb -0.04 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 3btf s VAL 52 CO -0.00 0.38 -0.02 0.54 0.00 0.00 0.00 175.10 176.01 3btf s VAL 53 N -0.46 4.14 0.00 2.92 0.11 0.82 -0.64 120.40 127.29 3btf s VAL 53 Ca 0.07 -0.31 0.00 0.00 -2.93 0.00 0.00 61.98 58.81 3btf s VAL 53 Cb -0.07 -2.74 0.00 0.00 -1.53 0.00 0.00 36.38 32.04 3btf s VAL 53 CO -0.01 0.59 0.00 -0.24 -3.33 0.00 0.00 175.10 172.11 3btf n SER 54 N 2.36 0.00 -4.87 3.54 2.88 -0.16 -0.67 113.62 116.69 3btf n SER 54 Ca -0.18 -0.66 -0.33 0.00 -1.33 0.00 0.00 58.87 56.36 3btf n SER 54 Cb 0.53 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.94 3btf n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3btf s ALA 55 N -1.50 3.68 0.40 -1.46 0.00 -1.26 -1.22 121.76 120.39 3btf s ALA 55 Ca 0.00 -0.37 0.10 0.00 0.00 0.00 0.00 51.96 51.70 3btf s ALA 55 Cb 0.00 -2.31 0.82 0.00 0.00 0.00 0.00 23.12 21.63 3btf s ALA 55 CO 0.00 0.56 1.93 0.00 0.00 0.00 0.00 175.76 178.25 3btf h ALA 56 N 3.15 1.54 0.00 0.00 0.00 -1.71 -1.83 119.26 120.41 3btf h ALA 56 Ca -0.48 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.24 3btf h ALA 56 Cb 1.18 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3btf h ALA 56 CO 0.69 0.33 0.00 -2.39 0.00 0.00 0.00 179.25 177.88 3btf n HIS 57 N -4.29 0.00 1.13 0.00 1.44 -1.26 -1.92 115.22 110.32 3btf n HIS 57 Ca -0.01 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.80 3btf n HIS 57 Cb 0.26 -0.32 0.34 0.00 0.12 0.00 0.00 29.99 30.39 3btf n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3btf s TYR 59 N -1.74 2.91 0.06 0.00 5.04 -0.81 -4.98 117.35 117.83 3btf s TYR 59 Ca 0.31 0.66 -0.26 0.00 -2.44 0.00 0.00 57.07 55.34 3btf s TYR 59 Cb 0.17 -4.02 0.07 0.00 0.35 0.00 0.00 41.96 38.53 3btf s TYR 59 CO 0.25 -3.62 0.62 0.21 -1.34 0.00 0.00 175.55 171.67 3btf s LYS 60 N 0.38 1.16 0.43 4.97 2.20 -1.26 -5.15 119.74 122.46 3btf s LYS 60 Ca 0.68 -0.14 -0.07 0.00 -0.36 0.00 0.00 55.97 56.07 3btf s LYS 60 Cb -0.47 0.54 -0.05 0.00 -1.51 0.00 0.00 37.83 36.34 3btf s LYS 60 CO 0.39 -0.44 0.75 -1.54 -0.36 0.00 0.00 175.35 174.15 3btf s SER 61 N -2.01 6.38 -1.05 1.43 1.04 -1.26 -4.33 113.70 113.89 3btf s SER 61 Ca -0.05 0.97 -0.03 0.00 0.48 0.00 0.00 55.95 57.33 3btf s SER 61 Cb -0.01 -2.26 0.00 0.00 0.10 0.00 0.00 66.02 63.86 3btf s SER 61 CO -0.02 -0.47 0.38 0.61 0.98 0.00 0.00 173.24 174.72 3btf n GLY 62 N -1.76 -0.12 3.72 7.32 0.00 -1.26 -4.98 105.19 108.10 3btf n GLY 62 Ca 0.01 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3btf n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3btf s ILE 63 N -2.94 4.25 -0.16 -0.61 1.01 -1.26 -4.69 121.20 116.80 3btf s ILE 63 Ca 0.19 1.69 -0.01 0.00 0.00 0.00 0.00 60.65 62.51 3btf s ILE 63 Cb -0.08 -4.08 -0.01 0.00 0.01 0.00 0.00 42.46 38.30 3btf s ILE 63 CO 0.23 0.17 -0.11 -1.58 0.00 0.00 0.00 174.94 173.65 3btf s GLN 64 N 0.69 3.37 -0.13 2.79 0.74 -0.30 -1.84 119.66 124.98 3btf s GLN 64 Ca 0.54 -0.67 -0.16 0.00 0.05 0.00 0.00 55.36 55.12 3btf s GLN 64 Cb -0.27 -2.73 -0.04 0.00 1.10 0.00 0.00 33.01 31.07 3btf s GLN 64 CO 0.30 0.09 0.40 0.08 -0.55 0.00 0.00 175.29 175.61 3btf s VAL 65 N 0.68 5.23 -0.24 1.34 1.01 0.94 -0.70 120.40 128.65 3btf s VAL 65 Ca -0.06 0.79 -0.02 0.00 0.00 0.00 0.00 61.98 62.69 3btf s VAL 65 Cb -0.15 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.50 3btf s VAL 65 CO 0.02 0.37 -0.06 -0.13 0.00 0.00 0.00 175.10 175.30 3btf s ARG 66 N 0.46 3.04 0.25 2.72 0.52 0.09 -0.72 118.95 125.32 3btf s ARG 66 Ca 0.22 -0.84 0.08 0.00 -0.52 0.00 0.00 55.73 54.67 3btf s ARG 66 Cb -0.14 -2.98 -0.04 0.00 0.52 0.00 0.00 34.95 32.31 3btf s ARG 66 CO 0.08 -0.32 0.13 -0.51 0.02 0.00 0.00 175.30 174.70 3btf s LEU 67 N 1.38 3.62 -1.40 2.53 1.02 0.05 -1.59 118.68 124.28 3btf s LEU 67 Ca 0.03 -0.37 0.00 0.00 0.02 0.00 0.00 54.13 53.81 3btf s LEU 67 Cb -0.16 -2.15 0.00 0.00 0.02 0.00 0.00 46.19 43.90 3btf s LEU 67 CO -0.04 -0.02 0.00 0.61 0.02 0.00 0.00 176.35 176.92 3btf n GLY 69 N -1.03 0.87 3.80 -3.19 0.00 -1.26 -1.71 105.19 102.67 3btf n GLY 69 Ca -0.07 -0.33 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 3btf n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3btf s GLU 70 N -3.75 4.33 0.00 1.61 0.41 -1.26 -3.95 118.70 116.09 3btf s GLU 70 Ca 0.00 0.93 0.00 0.00 -0.41 0.00 0.00 54.97 55.49 3btf s GLU 70 Cb 0.00 -3.04 0.00 0.00 -1.78 0.00 0.00 34.13 29.31 3btf s GLU 70 CO 0.00 0.48 0.00 -3.47 -0.49 0.00 0.00 175.26 171.78 3btf n ASP 71 N 1.11 0.00 -4.56 -0.19 2.03 -1.26 -4.63 116.55 109.06 3btf n ASP 71 Ca -0.04 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.84 3btf n ASP 71 Cb 0.50 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.87 3btf n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 3btf s ASN 72 N -2.00 6.48 0.00 1.67 3.84 -1.26 -3.21 114.94 120.46 3btf s ASN 72 Ca 0.00 0.06 0.17 0.00 0.21 0.00 0.00 52.86 53.30 3btf s ASN 72 Cb 0.00 -2.47 0.83 0.00 -0.55 0.00 0.00 41.25 39.06 3btf s ASN 72 CO 0.00 -1.14 1.51 2.30 -2.79 0.00 0.00 177.10 176.98 3btf n ILE 73 N 6.45 0.58 0.63 -5.21 -5.35 -0.07 -3.13 119.36 113.25 3btf n ILE 73 Ca 0.06 0.14 0.10 0.00 -0.27 0.00 0.00 62.75 62.79 3btf n ILE 73 Cb 0.48 -0.86 -0.13 0.00 -1.74 0.00 0.00 39.64 37.39 3btf n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3btf n ASN 74 N -1.33 0.68 -4.05 7.28 3.02 -1.26 -4.97 115.26 114.63 3btf n ASN 74 Ca 0.07 -0.64 -0.16 0.00 -0.03 0.00 0.00 54.58 53.82 3btf n ASN 74 Cb 0.15 1.34 -0.13 0.00 -0.61 0.00 0.00 39.78 40.53 3btf n ASN 74 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3btf s VAL 75 N -3.14 0.67 -0.44 2.41 -7.23 -1.18 -5.10 120.40 106.39 3btf s VAL 75 Ca 0.02 -0.74 -0.29 0.00 -1.81 0.00 0.00 61.98 59.17 3btf s VAL 75 Cb 0.15 -0.64 0.02 0.00 0.56 0.00 0.00 36.38 36.47 3btf s VAL 75 CO 0.86 -0.08 1.22 -0.69 -0.31 0.00 0.00 175.10 176.10 3btf s VAL 76 N -0.75 4.14 -2.12 1.32 1.01 -1.26 -4.74 120.40 117.99 3btf s VAL 76 Ca -0.02 1.17 0.24 0.00 0.00 0.00 0.00 61.98 63.37 3btf s VAL 76 Cb -0.06 -4.47 0.08 0.00 0.00 0.00 0.00 36.38 31.93 3btf s VAL 76 CO 0.00 -0.89 1.21 -0.62 0.00 0.00 0.00 175.10 174.80 3btf n GLU 77 N 7.84 1.29 0.00 2.72 1.02 -1.26 -5.00 120.64 127.25 3btf n GLU 77 Ca 0.13 -1.02 0.00 0.00 -0.02 0.00 0.00 57.16 56.25 3btf n GLU 77 Cb 0.49 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 3btf n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3btf n GLY 78 N 1.39 0.28 0.80 0.62 0.00 -1.26 -4.92 105.19 102.11 3btf n GLY 78 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.22 3btf n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3btf n ASN 79 N 0.00 2.73 -4.81 1.61 3.02 -1.26 -5.01 115.26 111.54 3btf n ASN 79 Ca 0.00 -1.81 -0.32 0.00 -0.03 0.00 0.00 54.58 52.42 3btf n ASN 79 Cb 0.00 -0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.11 3btf n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3btf s GLU 80 N -1.42 3.25 -0.13 3.52 8.01 -1.25 -4.40 118.70 126.27 3btf s GLU 80 Ca 0.25 1.10 -0.04 0.00 0.01 0.00 0.00 54.97 56.29 3btf s GLU 80 Cb 0.16 -2.03 0.06 0.00 -4.31 0.00 0.00 34.13 28.01 3btf s GLU 80 CO 0.24 -0.85 0.13 -0.65 0.01 0.00 0.00 175.26 174.14 3btf s GLN 81 N -4.39 0.06 -0.28 1.61 -0.21 -0.69 -4.97 119.66 110.78 3btf s GLN 81 Ca 0.61 0.24 -0.10 0.00 0.02 0.00 0.00 55.36 56.13 3btf s GLN 81 Cb -0.15 -1.05 -0.04 0.00 1.00 0.00 0.00 33.01 32.78 3btf s GLN 81 CO 0.42 -0.51 0.15 -0.06 -2.12 0.00 0.00 175.29 173.17 3btf s PHE 82 N 2.23 3.17 -0.04 0.91 0.08 -1.26 -0.77 117.98 122.29 3btf s PHE 82 Ca 0.04 -0.16 0.01 0.00 0.12 0.00 0.00 56.93 56.94 3btf s PHE 82 Cb -0.14 -2.34 0.02 0.00 -0.57 0.00 0.00 43.02 39.99 3btf s PHE 82 CO -0.08 -0.27 -0.04 0.42 -0.10 0.00 0.00 175.22 175.15 3btf s ILE 83 N 1.69 0.51 0.58 0.64 1.01 0.11 -4.97 121.20 120.77 3btf s ILE 83 Ca 0.06 -0.10 -0.17 0.00 0.00 0.00 0.00 60.65 60.44 3btf s ILE 83 Cb -0.16 -0.55 -0.04 0.00 0.01 0.00 0.00 42.46 41.72 3btf s ILE 83 CO 0.08 0.22 1.09 -0.44 0.00 0.00 0.00 174.94 175.90 3btf s SER 84 N 0.98 5.65 0.18 3.58 0.01 -1.26 -0.04 113.70 122.79 3btf s SER 84 Ca -0.10 2.01 -0.26 0.00 1.31 0.00 0.00 55.95 58.90 3btf s SER 84 Cb -0.14 -2.56 -0.08 0.00 0.21 0.00 0.00 66.02 63.45 3btf s SER 84 CO -0.00 -1.26 0.81 0.00 0.41 0.00 0.00 173.24 173.20 3btf s ALA 85 N -2.12 3.42 -0.18 1.44 0.00 -0.77 -0.58 121.76 122.98 3btf s ALA 85 Ca 0.68 0.42 0.11 0.00 0.00 0.00 0.00 51.96 53.17 3btf s ALA 85 Cb -0.20 -3.02 -0.23 0.00 0.00 0.00 0.00 23.12 19.68 3btf s ALA 85 CO 0.32 0.27 0.14 -1.13 0.00 0.00 0.00 175.76 175.36 3btf n SER 86 N 1.59 0.84 -3.90 0.00 3.41 0.74 -4.68 113.62 111.62 3btf n SER 86 Ca -0.05 0.06 -0.11 0.00 -0.26 0.00 0.00 58.87 58.52 3btf n SER 86 Cb 0.48 0.29 -0.11 0.00 -0.26 0.00 0.00 64.21 64.62 3btf n SER 86 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3btf s LYS 87 N -2.52 0.39 -0.19 4.33 1.02 -1.19 -4.99 119.74 116.58 3btf s LYS 87 Ca -0.16 -0.39 -0.02 0.00 0.02 0.00 0.00 55.97 55.42 3btf s LYS 87 Cb 0.07 0.16 0.06 0.00 -0.52 0.00 0.00 37.83 37.60 3btf s LYS 87 CO 0.77 -0.09 0.00 -1.12 -0.92 0.00 0.00 175.35 174.00 3btf s SER 88 N -1.23 3.02 -0.34 2.83 0.01 -1.26 -0.60 113.70 116.13 3btf s SER 88 Ca -0.13 -0.83 -0.05 0.00 1.31 0.00 0.00 55.95 56.24 3btf s SER 88 Cb -0.07 -0.75 0.05 0.00 0.21 0.00 0.00 66.02 65.45 3btf s SER 88 CO 0.01 -0.27 0.11 -0.63 0.41 0.00 0.00 173.24 172.87 3btf s ILE 89 N 1.73 3.62 0.18 1.44 1.01 0.14 -4.97 121.20 124.35 3btf s ILE 89 Ca -0.01 -1.29 -0.21 0.00 0.00 0.00 0.00 60.65 59.13 3btf s ILE 89 Cb -0.17 -3.11 -0.08 0.00 0.01 0.00 0.00 42.46 39.11 3btf s ILE 89 CO -0.07 -0.24 0.71 -0.69 0.00 0.00 0.00 174.94 174.65 3btf s VAL 90 N 1.35 4.53 0.18 2.92 1.01 -1.26 -0.44 120.40 128.68 3btf s VAL 90 Ca -0.01 1.41 -0.33 0.00 0.00 0.00 0.00 61.98 63.04 3btf s VAL 90 Cb -0.20 -3.96 -0.14 0.00 0.00 0.00 0.00 36.38 32.08 3btf s VAL 90 CO 0.01 0.37 1.42 1.57 0.00 0.00 0.00 175.10 178.48 3btf n HIS 91 N 1.18 1.97 0.24 5.22 -0.00 -0.60 -4.83 115.22 118.40 3btf n HIS 91 Ca -0.05 0.44 0.18 0.00 0.46 0.00 0.00 57.72 58.76 3btf n HIS 91 Cb 0.50 -2.44 0.87 0.00 -0.12 0.00 0.00 29.99 28.80 3btf n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3btf h PRO 92 N 4.76 0.00 -0.40 1.57 0.13 -1.93 -1.33 132.00 134.79 3btf h PRO 92 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3btf h PRO 92 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3btf h PRO 92 CO 0.80 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 179.00 3btf n SER 93 N -3.45 3.96 -4.73 1.44 7.64 -1.26 -4.99 113.62 112.22 3btf n SER 93 Ca 0.01 -2.58 -0.42 0.00 1.01 0.00 0.00 58.87 56.88 3btf n SER 93 Cb 0.35 -0.47 -0.02 0.00 -1.01 0.00 0.00 64.21 63.06 3btf n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3btf n TYR 94 N 0.26 2.77 -3.96 1.43 9.36 -0.51 -4.69 117.16 121.82 3btf n TYR 94 Ca 0.20 0.17 -0.34 0.00 3.32 0.00 0.00 57.90 61.25 3btf n TYR 94 Cb 0.78 -2.62 -0.14 0.00 -0.63 0.00 0.00 39.34 36.73 3btf n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3btf s ASN 95 N 0.78 4.48 0.33 2.98 3.84 -0.58 -4.99 114.94 121.79 3btf s ASN 95 Ca 0.69 -1.04 0.26 0.00 0.21 0.00 0.00 52.86 52.98 3btf s ASN 95 Cb -0.51 -1.66 1.12 0.00 -0.55 0.00 0.00 41.25 39.64 3btf s ASN 95 CO 0.41 -0.17 1.78 0.77 -2.79 0.00 0.00 177.10 177.10 3btf h SER 96 N 7.98 0.00 0.00 -4.21 4.64 -1.93 0.28 113.55 120.31 3btf h SER 96 Ca -0.28 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.88 3btf h SER 96 Cb 1.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 3btf h SER 96 CO 0.55 0.00 -0.92 0.78 -0.87 0.00 0.00 176.83 176.38 3btf h ASN 97 N 0.00 0.00 0.97 4.97 2.35 -1.97 -3.39 115.58 118.51 3btf h ASN 97 Ca 0.00 -0.50 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 3btf h ASN 97 Cb 0.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.71 3btf h ASN 97 CO 0.00 1.28 -0.56 0.71 -1.65 0.00 0.00 177.43 177.20 3btf h THR 98 N -1.00 0.00 -0.20 2.81 1.35 -1.99 -3.47 112.91 110.40 3btf h THR 98 Ca -0.23 -0.54 -0.09 0.00 -0.55 0.00 0.00 66.41 65.00 3btf h THR 98 Cb 1.10 1.17 -0.03 0.00 -1.73 0.00 0.00 68.15 68.65 3btf h THR 98 CO -0.14 0.00 -0.08 0.18 -0.25 0.00 0.00 175.52 175.23 3btf n LEU 99 N -2.19 -0.09 -4.76 3.87 4.77 0.96 -4.99 117.00 114.57 3btf n LEU 99 Ca 0.03 0.11 -0.40 0.00 -0.03 0.00 0.00 56.01 55.72 3btf n LEU 99 Cb 0.45 -1.42 -0.04 0.00 -2.33 0.00 0.00 43.42 40.08 3btf n LEU 99 CO 0.36 -0.44 0.81 0.21 -1.33 0.00 0.00 177.39 177.00 3btf s ASN 100 N -2.44 7.15 -0.84 -1.43 3.04 -1.22 -3.40 114.94 115.80 3btf s ASN 100 Ca 0.00 2.30 -0.06 0.00 0.04 0.00 0.00 52.86 55.15 3btf s ASN 100 Cb 0.00 -2.63 0.01 0.00 -1.54 0.00 0.00 41.25 37.09 3btf s ASN 100 CO 0.00 -0.23 0.74 0.59 -3.04 0.00 0.00 177.10 175.16 3btf n ASN 101 N 1.02 -4.71 -4.18 -4.21 3.02 -1.26 -1.53 115.26 103.41 3btf n ASN 101 Ca -0.00 -0.34 -0.42 0.00 -0.03 0.00 0.00 54.58 53.79 3btf n ASN 101 Cb 0.45 -3.33 -0.01 0.00 -0.61 0.00 0.00 39.78 36.28 3btf n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3btf n ASP 102 N -1.33 4.23 -3.82 6.41 2.03 -1.22 -4.28 116.55 118.58 3btf n ASP 102 Ca 0.00 -2.86 -0.12 0.00 0.52 0.00 0.00 54.79 52.33 3btf n ASP 102 Cb 0.54 -1.67 -0.11 0.00 -0.72 0.00 0.00 41.12 39.16 3btf n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3btf s ILE 103 N 4.37 0.04 -0.04 5.18 2.07 -1.26 -3.88 121.20 127.67 3btf s ILE 103 Ca 0.53 -0.31 -0.12 0.00 -1.41 0.00 0.00 60.65 59.34 3btf s ILE 103 Cb 0.08 -0.40 0.02 0.00 0.13 0.00 0.00 42.46 42.29 3btf s ILE 103 CO 0.02 -0.17 0.27 -0.32 -1.91 0.00 0.00 174.94 172.83 3btf s MET 104 N -0.61 0.52 -0.09 3.50 -2.45 -0.36 -1.56 119.30 118.25 3btf s MET 104 Ca -0.07 -0.02 0.02 0.00 -1.25 0.00 0.00 55.69 54.37 3btf s MET 104 Cb -0.04 0.23 -0.02 0.00 1.25 0.00 0.00 34.83 36.25 3btf s MET 104 CO 0.01 -0.12 -0.14 -0.51 1.05 0.00 0.00 175.02 175.31 3btf s LEU 105 N -0.82 2.68 -0.14 4.11 1.43 0.41 -0.99 118.68 125.37 3btf s LEU 105 Ca -0.09 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.76 3btf s LEU 105 Cb -0.05 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.62 3btf s LEU 105 CO 0.02 0.25 -0.21 -0.63 0.23 0.00 0.00 176.35 176.01 3btf s ILE 106 N -0.18 2.00 -0.11 -0.59 1.01 0.18 0.28 121.20 123.80 3btf s ILE 106 Ca -0.00 -0.95 -0.15 0.00 0.00 0.00 0.00 60.65 59.55 3btf s ILE 106 Cb -0.13 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 3btf s ILE 106 CO 0.03 0.54 0.38 -0.75 0.00 0.00 0.00 174.94 175.14 3btf s LYS 107 N 0.82 4.18 0.32 2.79 2.20 0.23 -1.20 119.74 129.08 3btf s LYS 107 Ca -0.07 0.29 -0.25 0.00 -0.36 0.00 0.00 55.97 55.58 3btf s LYS 107 Cb -0.16 -3.37 -0.10 0.00 -1.51 0.00 0.00 37.83 32.70 3btf s LYS 107 CO -0.02 0.34 0.92 -0.51 -0.36 0.00 0.00 175.35 175.72 3btf s LEU 108 N 0.10 4.30 0.41 5.43 1.43 0.42 -0.19 118.68 130.58 3btf s LEU 108 Ca 0.21 1.78 0.07 0.00 -1.03 0.00 0.00 54.13 55.16 3btf s LEU 108 Cb -0.15 -4.03 0.87 0.00 0.03 0.00 0.00 46.19 42.92 3btf s LEU 108 CO 0.08 -0.09 2.06 0.50 0.23 0.00 0.00 176.35 179.14 3btf h LYS 109 N 3.06 0.53 -4.35 1.70 3.64 -1.12 -3.41 116.57 116.62 3btf h LYS 109 Ca -0.47 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 58.72 3btf h LYS 109 Cb 1.19 -0.12 -0.15 0.00 -0.41 0.00 0.00 32.23 32.74 3btf h LYS 109 CO 0.65 0.35 -0.69 -1.54 -2.27 0.00 0.00 179.45 175.95 3btf s SER 110 N -6.68 0.67 0.32 4.20 1.04 -1.26 -4.97 113.70 107.02 3btf s SER 110 Ca -0.08 -0.97 -0.27 0.00 0.48 0.00 0.00 55.95 55.11 3btf s SER 110 Cb 0.17 0.16 -0.09 0.00 0.10 0.00 0.00 66.02 66.36 3btf s SER 110 CO 0.73 -0.54 1.02 0.00 0.98 0.00 0.00 173.24 175.43 3btf s ALA 111 N -3.65 3.25 0.61 5.32 0.00 -1.26 -4.84 121.76 121.19 3btf s ALA 111 Ca 0.07 0.70 -0.14 0.00 0.00 0.00 0.00 51.96 52.59 3btf s ALA 111 Cb 0.06 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 3btf s ALA 111 CO -0.08 -0.04 1.04 0.00 0.00 0.00 0.00 175.76 176.68 3btf s ALA 112 N -1.43 2.84 -0.38 0.00 0.00 0.61 -5.00 121.76 118.39 3btf s ALA 112 Ca 0.49 0.20 -0.20 0.00 0.00 0.00 0.00 51.96 52.46 3btf s ALA 112 Cb -0.25 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.71 3btf s ALA 112 CO 0.31 -0.79 0.59 0.45 0.00 0.00 0.00 175.76 176.32 3btf s SER 113 N -3.32 6.35 0.13 0.00 0.15 -1.26 -4.90 113.70 110.84 3btf s SER 113 Ca 0.60 -0.11 -0.20 0.00 0.70 0.00 0.00 55.95 56.94 3btf s SER 113 Cb -0.13 -2.30 -0.07 0.00 -1.71 0.00 0.00 66.02 61.80 3btf s SER 113 CO 0.43 -0.61 0.64 -0.76 1.20 0.00 0.00 173.24 174.13 3btf s LEU 114 N 2.61 4.49 0.00 3.45 1.43 -1.26 -4.81 118.68 124.59 3btf s LEU 114 Ca 0.21 1.35 0.00 0.00 -1.03 0.00 0.00 54.13 54.66 3btf s LEU 114 Cb -0.15 -3.14 0.00 0.00 0.03 0.00 0.00 46.19 42.94 3btf s LEU 114 CO 0.16 0.20 0.00 0.59 0.23 0.00 0.00 176.35 177.53 3btf n ASN 115 N 1.43 1.83 0.08 2.29 5.03 0.17 -5.00 115.26 121.09 3btf n ASN 115 Ca -0.07 0.00 0.08 0.00 0.87 0.00 0.00 54.58 55.46 3btf n ASN 115 Cb 0.50 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.24 3btf n ASN 115 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 3btf n SER 116 N 0.00 0.86 0.09 6.41 3.41 -1.26 -3.94 113.62 119.18 3btf n SER 116 Ca 0.00 0.34 0.11 0.00 -0.26 0.00 0.00 58.87 59.07 3btf n SER 116 Cb 0.00 0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 3btf n SER 116 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3btf n ARG 117 N -2.74 0.57 -3.76 4.33 1.74 -1.26 -4.78 116.66 110.77 3btf n ARG 117 Ca -0.03 0.10 -0.23 0.00 -0.77 0.00 0.00 57.85 56.92 3btf n ARG 117 Cb 0.63 -1.79 -0.18 0.00 -1.02 0.00 0.00 32.46 30.10 3btf n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3btf s VAL 118 N -3.35 0.35 0.08 1.55 1.01 -1.25 -4.46 120.40 114.32 3btf s VAL 118 Ca -0.00 0.12 -0.20 0.00 0.00 0.00 0.00 61.98 61.90 3btf s VAL 118 Cb 0.10 -0.52 0.05 0.00 0.00 0.00 0.00 36.38 36.00 3btf s VAL 118 CO 0.79 0.24 0.47 0.00 0.00 0.00 0.00 175.10 176.61 3btf s ALA 119 N 1.98 -1.17 0.53 5.51 0.00 -0.88 -0.66 121.76 127.06 3btf s ALA 119 Ca 0.05 0.33 -0.05 0.00 0.00 0.00 0.00 51.96 52.29 3btf s ALA 119 Cb -0.12 0.53 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 3btf s ALA 119 CO -0.05 -0.57 0.83 -1.54 0.00 0.00 0.00 175.76 174.43 3btf s SER 120 N -2.32 5.96 -0.00 0.00 1.04 -1.26 -2.99 113.70 114.12 3btf s SER 120 Ca -0.02 0.80 0.04 0.00 0.48 0.00 0.00 55.95 57.25 3btf s SER 120 Cb 0.00 -1.98 -0.03 0.00 0.10 0.00 0.00 66.02 64.11 3btf s SER 120 CO -0.06 -0.79 -0.11 -0.51 0.98 0.00 0.00 173.24 172.75 3btf s ILE 121 N -2.84 3.36 0.35 -1.02 1.10 -0.11 -4.87 121.20 117.18 3btf s ILE 121 Ca 0.50 -0.84 -0.26 0.00 -0.51 0.00 0.00 60.65 59.55 3btf s ILE 121 Cb -0.10 -2.42 -0.09 0.00 0.15 0.00 0.00 42.46 39.99 3btf s ILE 121 CO 0.45 0.43 1.03 -0.44 -2.11 0.00 0.00 174.94 174.29 3btf s SER 122 N -1.26 7.02 0.48 4.50 0.01 -1.26 -4.60 113.70 118.60 3btf s SER 122 Ca 0.15 2.03 -0.19 0.00 1.31 0.00 0.00 55.95 59.24 3btf s SER 122 Cb -0.11 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.44 3btf s SER 122 CO 0.05 -0.30 0.99 -0.76 0.41 0.00 0.00 173.24 173.64 3btf s LEU 123 N -2.24 3.80 0.45 2.44 1.43 -1.26 -0.55 118.68 122.75 3btf s LEU 123 Ca 0.53 1.75 -0.22 0.00 -1.03 0.00 0.00 54.13 55.15 3btf s LEU 123 Cb -0.23 -4.54 -0.08 0.00 0.03 0.00 0.00 46.19 41.37 3btf s LEU 123 CO 0.29 -0.61 1.08 -2.16 0.23 0.00 0.00 176.35 175.18 3btf s PRO 124 N -3.47 3.90 0.11 1.29 0.04 -1.26 -4.75 135.00 130.86 3btf s PRO 124 Ca 0.63 1.55 0.17 0.00 0.04 0.00 0.00 61.00 63.39 3btf s PRO 124 Cb -0.12 -2.35 -0.09 0.00 0.04 0.00 0.00 34.50 31.98 3btf s PRO 124 CO 0.21 -0.38 0.94 1.15 0.04 0.00 0.00 177.00 178.97 3btf h THR 125 N 1.86 0.51 -3.28 1.26 2.02 -1.96 -3.48 112.91 109.84 3btf h THR 125 Ca -0.49 -1.93 -0.01 0.00 0.77 0.00 0.00 66.41 64.75 3btf h THR 125 Cb 1.23 2.04 -0.10 0.00 -1.74 0.00 0.00 68.15 69.58 3btf h THR 125 CO 0.60 0.29 0.05 -0.94 0.37 0.00 0.00 175.52 175.89 3btf s SER 127 N -5.85 -0.27 0.48 4.18 1.04 -1.26 -5.15 113.70 106.88 3btf s SER 127 Ca -0.02 -0.50 -0.21 0.00 0.48 0.00 0.00 55.95 55.71 3btf s SER 127 Cb 0.09 0.60 -0.08 0.00 0.10 0.00 0.00 66.02 66.72 3btf s SER 127 CO 0.80 -1.09 1.08 0.00 0.98 0.00 0.00 173.24 175.01 3btf s ALA 129 N -1.84 3.44 0.27 0.00 0.00 -1.26 -5.09 121.76 117.29 3btf s ALA 129 Ca 0.67 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.44 3btf s ALA 129 Cb -0.20 -2.58 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 3btf s ALA 129 CO 0.24 0.25 0.42 -1.54 0.00 0.00 0.00 175.76 175.13 3btf s SER 130 N -2.74 6.31 0.26 0.00 1.04 -1.26 -5.03 113.70 112.29 3btf s SER 130 Ca 0.50 0.18 -0.30 0.00 0.48 0.00 0.00 55.95 56.81 3btf s SER 130 Cb -0.11 -1.91 -0.14 0.00 0.10 0.00 0.00 66.02 63.96 3btf s SER 130 CO 0.25 -0.14 1.16 0.00 0.98 0.00 0.00 173.24 175.50 3btf n ALA 132 N -1.52 0.16 0.00 5.32 0.00 -1.26 -1.56 120.51 121.65 3btf n ALA 132 Ca -0.08 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.77 3btf n ALA 132 Cb 0.57 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.91 3btf n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3btf n GLY 133 N 1.50 3.08 3.73 0.00 0.00 0.12 -4.94 105.19 108.68 3btf n GLY 133 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3btf n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3btf s THR 134 N -2.58 2.36 0.02 2.61 2.01 -0.60 -4.62 115.64 114.83 3btf s THR 134 Ca 0.00 0.27 -0.23 0.00 0.31 0.00 0.00 61.69 62.04 3btf s THR 134 Cb 0.00 -3.17 -0.05 0.00 0.01 0.00 0.00 72.50 69.28 3btf s THR 134 CO 0.00 0.03 0.69 0.00 -0.69 0.00 0.00 174.62 174.65 3btf s GLN 135 N 0.64 4.42 0.20 4.92 1.03 -1.26 -0.67 119.66 128.94 3btf s GLN 135 Ca 0.69 0.92 0.04 0.00 0.04 0.00 0.00 55.36 57.05 3btf s GLN 135 Cb -0.46 -3.36 -0.05 0.00 0.03 0.00 0.00 33.01 29.17 3btf s GLN 135 CO 0.36 0.31 -0.04 0.00 -2.54 0.00 0.00 175.29 173.38 3btf s LEU 137 N -3.25 3.15 -0.08 0.00 2.96 0.02 -1.46 118.68 120.02 3btf s LEU 137 Ca 0.24 -0.28 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 3btf s LEU 137 Cb 0.04 -1.81 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 3btf s LEU 137 CO 0.06 0.01 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.39 3btf s ILE 138 N 1.34 3.63 0.04 6.68 1.01 0.57 -1.45 121.20 133.02 3btf s ILE 138 Ca 0.04 -0.50 -0.02 0.00 0.00 0.00 0.00 60.65 60.17 3btf s ILE 138 Cb -0.15 -2.49 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 3btf s ILE 138 CO 0.00 0.58 0.01 -0.94 0.00 0.00 0.00 174.94 174.59 3btf s SER 139 N -0.61 0.32 0.00 3.58 1.04 -1.22 -0.77 113.70 116.04 3btf s SER 139 Ca 0.09 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.82 3btf s SER 139 Cb -0.12 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.18 3btf s SER 139 CO 0.02 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.37 3btf n GLY 140 N 0.77 0.73 1.36 7.32 0.00 -0.74 -4.46 105.19 110.17 3btf n GLY 140 Ca -0.19 -0.99 0.02 0.00 0.00 0.00 0.00 46.02 44.87 3btf n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3btf n TRP 141 N -0.46 1.53 -1.57 1.61 8.01 -1.26 -2.08 117.44 123.22 3btf n TRP 141 Ca 0.00 -1.07 -0.30 0.00 -1.31 0.00 0.00 57.50 54.82 3btf n TRP 141 Cb 0.00 -0.47 0.21 0.00 -2.01 0.00 0.00 31.31 29.04 3btf n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 3btf s GLY 142 N -1.66 1.70 0.26 6.99 0.00 -1.25 -4.33 107.32 109.03 3btf s GLY 142 Ca 0.48 -1.10 -0.30 0.00 0.00 0.00 0.00 44.72 43.79 3btf s GLY 142 CO 0.09 -0.28 1.24 -2.01 0.00 0.00 0.00 173.10 172.15 3btf n ASN 143 N -4.20 2.13 -0.91 1.64 5.15 0.19 -2.92 115.26 116.34 3btf n ASN 143 Ca 0.14 1.16 0.10 0.00 -0.60 0.00 0.00 54.58 55.38 3btf n ASN 143 Cb 0.59 -1.36 0.15 0.00 -0.53 0.00 0.00 39.78 38.64 3btf n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 3btf n THR 144 N 1.15 0.39 -5.08 -0.44 -2.24 -0.26 -1.28 114.28 106.52 3btf n THR 144 Ca 0.11 -0.69 -0.32 0.00 -2.27 0.00 0.00 64.05 60.87 3btf n THR 144 Cb 0.31 1.06 -0.15 0.00 -2.10 0.00 0.00 70.33 69.44 3btf n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3btf s LYS 145 N -1.38 2.61 0.06 -0.78 3.01 -1.26 -4.33 119.74 117.66 3btf s LYS 145 Ca 0.30 -0.81 -0.08 0.00 -1.01 0.00 0.00 55.97 54.36 3btf s LYS 145 Cb 0.18 -2.28 -0.31 0.00 -1.01 0.00 0.00 37.83 34.41 3btf s LYS 145 CO 0.26 0.45 1.08 0.66 0.51 0.00 0.00 175.35 178.31 3btf h SER 146 N 5.87 0.56 -3.83 2.83 4.64 -1.93 -3.40 113.55 118.29 3btf h SER 146 Ca -0.37 -0.61 -0.65 0.00 -0.47 0.00 0.00 61.79 59.70 3btf h SER 146 Cb 1.17 -0.18 -0.40 0.00 -0.31 0.00 0.00 62.40 62.67 3btf h SER 146 CO 0.49 1.48 -0.70 -0.94 -0.87 0.00 0.00 176.83 176.29 3btf s SER 147 N -7.28 4.56 0.00 4.97 1.04 -1.26 -4.66 113.70 111.06 3btf s SER 147 Ca -0.06 -2.37 0.00 0.00 0.48 0.00 0.00 55.95 54.00 3btf s SER 147 Cb 0.06 -1.56 0.00 0.00 0.10 0.00 0.00 66.02 64.62 3btf s SER 147 CO 0.90 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 175.39 3btf n GLY 148 N 3.96 0.68 2.90 7.32 0.00 -1.26 -5.06 105.19 113.72 3btf n GLY 148 Ca 0.04 -2.14 -0.15 0.00 0.00 0.00 0.00 46.02 43.77 3btf n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3btf s THR 149 N -1.04 -0.12 -0.29 2.61 2.01 -1.26 -4.71 115.64 112.83 3btf s THR 149 Ca 0.00 0.24 0.06 0.00 0.31 0.00 0.00 61.69 62.30 3btf s THR 149 Cb 0.00 -0.26 0.20 0.00 0.01 0.00 0.00 72.50 72.44 3btf s THR 149 CO 0.00 0.10 0.58 -0.55 -0.69 0.00 0.00 174.62 174.06 3btf s SER 150 N 1.56 -1.52 -0.16 3.53 0.15 -1.26 -4.96 113.70 111.04 3btf s SER 150 Ca -0.05 0.17 -0.19 0.00 0.70 0.00 0.00 55.95 56.58 3btf s SER 150 Cb -0.12 1.99 -0.04 0.00 -1.71 0.00 0.00 66.02 66.15 3btf s SER 150 CO -0.06 -0.30 0.53 -0.31 1.20 0.00 0.00 173.24 174.29 3btf s TYR 151 N 2.81 3.44 0.66 3.44 2.02 -1.26 -1.10 117.35 127.36 3btf s TYR 151 Ca 0.10 0.86 -0.11 0.00 -0.37 0.00 0.00 57.07 57.56 3btf s TYR 151 Cb -0.10 -2.65 -0.02 0.00 -0.40 0.00 0.00 41.96 38.80 3btf s TYR 151 CO -0.26 0.01 1.05 -1.25 -1.57 0.00 0.00 175.55 173.52 3btf s PRO 152 N 1.22 3.25 -0.10 -1.71 0.04 -1.26 -5.00 135.00 131.45 3btf s PRO 152 Ca 0.26 0.86 -0.14 0.00 0.04 0.00 0.00 61.00 62.02 3btf s PRO 152 Cb -0.15 -2.03 -0.27 0.00 0.04 0.00 0.00 34.50 32.08 3btf s PRO 152 CO 0.10 -0.85 0.53 -0.44 0.04 0.00 0.00 177.00 176.39 3btf h ASP 153 N -0.52 0.41 -2.37 6.66 3.32 -1.93 -3.47 116.42 118.51 3btf h ASP 153 Ca -0.44 -0.87 -0.47 0.00 0.02 0.00 0.00 57.03 55.27 3btf h ASP 153 Cb 1.20 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 3btf h ASP 153 CO 0.59 1.68 -0.37 0.68 -1.72 0.00 0.00 179.24 180.09 3btf s VAL 154 N -2.50 5.23 0.19 -1.35 -7.23 -1.26 -0.89 120.40 112.59 3btf s VAL 154 Ca -0.20 -0.83 -0.31 0.00 -1.81 0.00 0.00 61.98 58.83 3btf s VAL 154 Cb 0.05 -3.85 -0.09 0.00 0.56 0.00 0.00 36.38 33.05 3btf s VAL 154 CO 0.77 -0.36 1.42 -0.22 -0.31 0.00 0.00 175.10 176.40 3btf s LEU 155 N -3.99 4.39 0.10 1.32 2.96 -1.20 -4.84 118.68 117.43 3btf s LEU 155 Ca 0.36 2.51 0.04 0.00 -0.22 0.00 0.00 54.13 56.81 3btf s LEU 155 Cb -0.09 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 3btf s LEU 155 CO 0.31 -0.66 0.08 -0.54 -1.32 0.00 0.00 176.35 174.22 3btf s LYS 156 N 0.28 2.85 0.12 1.98 -0.14 -0.88 -1.87 119.74 122.08 3btf s LYS 156 Ca 0.62 -0.76 0.06 0.00 -1.36 0.00 0.00 55.97 54.53 3btf s LYS 156 Cb -0.40 -2.68 -0.04 0.00 -1.68 0.00 0.00 37.83 33.03 3btf s LYS 156 CO 0.37 0.54 -0.15 0.00 -0.76 0.00 0.00 175.35 175.35 3btf s LEU 158 N -2.36 0.14 -0.23 0.00 2.96 0.05 -0.45 118.68 118.78 3btf s LEU 158 Ca 0.09 0.78 -0.11 0.00 -0.22 0.00 0.00 54.13 54.67 3btf s LEU 158 Cb -0.06 1.18 -0.05 0.00 0.50 0.00 0.00 46.19 47.76 3btf s LEU 158 CO 0.04 -0.18 0.17 -0.54 -1.32 0.00 0.00 176.35 174.52 3btf s LYS 159 N 1.17 4.10 -0.02 1.98 1.02 -1.26 -0.32 119.74 126.42 3btf s LYS 159 Ca -0.08 -0.22 -0.05 0.00 0.02 0.00 0.00 55.97 55.63 3btf s LYS 159 Cb -0.08 -3.52 0.00 0.00 -0.52 0.00 0.00 37.83 33.72 3btf s LYS 159 CO -0.10 0.10 0.12 0.00 -0.92 0.00 0.00 175.35 174.55 3btf s ALA 160 N 0.95 -0.28 0.31 5.17 0.00 -0.54 -4.95 121.76 122.43 3btf s ALA 160 Ca 0.09 0.00 -0.07 0.00 0.00 0.00 0.00 51.96 51.98 3btf s ALA 160 Cb -0.13 -0.01 -0.06 0.00 0.00 0.00 0.00 23.12 22.92 3btf s ALA 160 CO 0.04 -0.15 0.61 -1.25 0.00 0.00 0.00 175.76 175.01 3btf s PRO 161 N -0.85 3.70 0.25 0.00 0.04 -1.26 -0.47 135.00 136.40 3btf s PRO 161 Ca -0.09 0.17 -0.30 0.00 0.04 0.00 0.00 61.00 60.82 3btf s PRO 161 Cb -0.05 -2.58 -0.09 0.00 0.04 0.00 0.00 34.50 31.82 3btf s PRO 161 CO 0.01 0.17 1.09 0.42 0.04 0.00 0.00 177.00 178.72 3btf s ILE 162 N -2.12 3.63 0.22 0.56 1.01 0.16 -1.69 121.20 122.98 3btf s ILE 162 Ca 0.46 1.58 0.05 0.00 0.00 0.00 0.00 60.65 62.74 3btf s ILE 162 Cb -0.11 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 3btf s ILE 162 CO 0.29 0.35 0.28 -0.76 0.00 0.00 0.00 174.94 175.10 3btf s LEU 163 N -1.13 4.13 0.60 2.97 1.43 0.17 0.15 118.68 127.00 3btf s LEU 163 Ca 0.45 -0.02 -0.18 0.00 -1.03 0.00 0.00 54.13 53.35 3btf s LEU 163 Cb -0.31 -2.68 -0.03 0.00 0.03 0.00 0.00 46.19 43.20 3btf s LEU 163 CO 0.39 -0.03 1.18 -0.94 0.23 0.00 0.00 176.35 177.18 3btf s SER 164 N -3.74 5.20 0.35 2.29 1.04 -1.26 -4.53 113.70 113.06 3btf s SER 164 Ca 0.33 2.29 0.05 0.00 0.48 0.00 0.00 55.95 59.10 3btf s SER 164 Cb -0.09 -2.59 0.70 0.00 0.10 0.00 0.00 66.02 64.14 3btf s SER 164 CO 0.27 -1.58 1.96 -0.78 0.98 0.00 0.00 173.24 174.09 3btf h ASP 165 N 0.75 0.71 -0.07 7.02 3.58 -1.97 -1.65 116.42 124.78 3btf h ASP 165 Ca -0.50 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.95 3btf h ASP 165 Cb 1.28 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 42.18 3btf h ASP 165 CO 0.55 0.46 0.04 0.77 -2.88 0.00 0.00 179.24 178.19 3btf h SER 166 N 0.81 0.08 -0.08 2.28 4.64 -1.99 -0.58 113.55 118.70 3btf h SER 166 Ca 0.31 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.48 3btf h SER 166 Cb 0.20 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 3btf h SER 166 CO -0.10 0.07 -0.40 0.77 -0.87 0.00 0.00 176.83 176.30 3btf h SER 167 N 0.08 0.64 -0.36 4.97 4.64 -1.84 -1.97 113.55 119.70 3btf h SER 167 Ca 0.02 -0.29 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3btf h SER 167 Cb 0.00 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 61.90 3btf h SER 167 CO -0.01 0.97 0.24 0.00 -0.87 0.00 0.00 176.83 177.16 3btf h LYS 169 N 0.49 0.00 -0.10 0.00 1.57 -0.95 -1.81 116.57 115.77 3btf h LYS 169 Ca 0.13 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.71 3btf h LYS 169 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3btf h LYS 169 CO -0.03 0.27 -0.76 0.77 -0.57 0.00 0.00 179.45 179.13 3btf h SER 170 N 0.00 0.65 0.17 0.86 0.02 -0.61 -2.76 113.55 111.88 3btf h SER 170 Ca -0.00 -0.43 -0.13 0.00 -0.84 0.00 0.00 61.79 60.39 3btf h SER 170 Cb 0.61 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 3btf h SER 170 CO 0.04 1.19 -0.47 0.00 -1.14 0.00 0.00 176.83 176.45 3btf h ALA 171 N 0.79 0.94 -2.42 3.77 0.00 -0.63 -3.37 119.26 118.33 3btf h ALA 171 Ca -0.04 -0.46 -0.59 0.00 0.00 0.00 0.00 54.91 53.82 3btf h ALA 171 Cb 1.36 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 18.66 3btf h ALA 171 CO 0.14 0.65 -0.86 0.66 0.00 0.00 0.00 179.25 179.84 3btf n TYR 172 N -3.98 0.80 -1.67 0.00 4.01 -0.72 -4.96 117.16 110.64 3btf n TYR 172 Ca -0.02 -3.72 -0.50 0.00 -0.16 0.00 0.00 57.90 53.51 3btf n TYR 172 Cb 0.53 -0.20 -0.05 0.00 -0.31 0.00 0.00 39.34 39.32 3btf n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 3btf n PRO 173 N 2.03 1.83 -1.31 -0.72 -0.02 -1.05 -2.05 135.00 133.72 3btf n PRO 173 Ca 0.26 0.67 -0.11 0.00 -2.02 0.00 0.00 63.50 62.30 3btf n PRO 173 Cb 0.45 -2.43 -0.05 0.00 -0.02 0.00 0.00 33.50 31.46 3btf n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3btf n GLY 174 N 3.77 1.16 0.00 -1.23 0.00 -1.26 -4.85 105.19 102.79 3btf n GLY 174 Ca 0.21 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3btf n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3btf n GLN 175 N -2.18 2.92 -3.16 1.61 6.02 -0.87 -5.01 117.38 116.71 3btf n GLN 175 Ca -0.11 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.49 3btf n GLN 175 Cb 0.41 -0.77 -0.06 0.00 1.02 0.00 0.00 30.24 30.84 3btf n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3btf s ILE 176 N -1.52 5.07 0.52 5.09 -1.09 -1.24 -5.03 121.20 123.00 3btf s ILE 176 Ca 0.00 1.16 0.08 0.00 -2.23 0.00 0.00 60.65 59.66 3btf s ILE 176 Cb 0.00 -3.92 0.04 0.00 -1.58 0.00 0.00 42.46 37.00 3btf s ILE 176 CO 0.00 0.18 0.56 0.42 -1.23 0.00 0.00 174.94 174.87 3btf s THR 177 N 1.47 2.14 -0.94 2.92 -4.23 -1.26 -4.99 115.64 110.76 3btf s THR 177 Ca 0.29 -1.23 0.13 0.00 -1.18 0.00 0.00 61.69 59.70 3btf s THR 177 Cb -0.16 -2.38 0.11 0.00 1.34 0.00 0.00 72.50 71.42 3btf s THR 177 CO 0.11 0.00 1.41 -1.54 -0.54 0.00 0.00 174.62 174.06 3btf n SER 178 N -1.92 0.07 -1.77 3.99 3.41 -1.26 -2.36 113.62 113.78 3btf n SER 178 Ca 0.07 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.28 3btf n SER 178 Cb 0.62 -0.54 0.39 0.00 -0.26 0.00 0.00 64.21 64.43 3btf n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3btf n ASN 179 N -1.58 5.39 -4.08 4.04 3.02 -1.26 -4.93 115.26 115.86 3btf n ASN 179 Ca 0.03 -2.78 -0.13 0.00 -0.03 0.00 0.00 54.58 51.66 3btf n ASN 179 Cb 0.14 -0.65 -0.11 0.00 -0.61 0.00 0.00 39.78 38.55 3btf n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3btf s MET 180 N -2.47 0.57 0.03 3.52 -1.94 -0.99 -1.16 119.30 116.85 3btf s MET 180 Ca 0.53 -0.81 -0.03 0.00 -1.71 0.00 0.00 55.69 53.68 3btf s MET 180 Cb 0.39 -0.35 -0.02 0.00 2.01 0.00 0.00 34.83 36.86 3btf s MET 180 CO 0.19 0.06 0.03 -0.59 -0.01 0.00 0.00 175.02 174.70 3btf s PHE 181 N -1.48 0.25 0.04 -0.03 -0.12 -0.31 -4.78 117.98 111.56 3btf s PHE 181 Ca -0.08 -0.55 -0.00 0.00 -0.05 0.00 0.00 56.93 56.25 3btf s PHE 181 Cb -0.09 -0.19 -0.04 0.00 -0.63 0.00 0.00 43.02 42.07 3btf s PHE 181 CO 0.00 -0.28 0.18 0.00 -0.05 0.00 0.00 175.22 175.07 3btf s ALA 183 N -1.42 -0.61 0.00 0.00 0.00 -1.01 -0.66 121.76 118.06 3btf s ALA 183 Ca 0.31 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.65 3btf s ALA 183 Cb -0.13 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.87 3btf s ALA 183 CO 0.24 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.22 3btf n GLY 184 N 2.00 0.68 2.96 0.00 0.00 -0.68 -3.00 105.19 107.15 3btf n GLY 184 Ca -0.18 -1.73 -0.25 0.00 0.00 0.00 0.00 46.02 43.86 3btf n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3btf s TYR 184 N -3.07 1.35 0.37 1.61 1.51 -1.26 -4.37 117.35 113.48 3btf s TYR 184 Ca 0.00 -0.54 0.34 0.00 -1.01 0.00 0.00 57.07 55.85 3btf s TYR 184 Cb 0.00 -1.06 1.66 0.00 -0.11 0.00 0.00 41.96 42.45 3btf s TYR 184 CO 0.00 -0.34 2.11 -0.07 -1.11 0.00 0.00 175.55 176.14 3btf h LEU 185 N 7.40 0.00 -1.20 -1.29 3.38 -1.96 -1.66 115.31 119.98 3btf h LEU 185 Ca -0.31 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 3btf h LEU 185 Cb 1.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 3btf h LEU 185 CO 0.45 0.06 -0.16 -0.33 0.09 0.00 0.00 178.44 178.54 3btf h GLU 186 N 0.00 0.00 0.00 1.13 5.08 -1.94 0.65 114.58 119.50 3btf h GLU 186 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3btf h GLU 186 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3btf h GLU 186 CO 0.01 0.16 0.00 0.41 -1.00 0.00 0.00 179.01 178.59 3btf n GLY 187 N 0.12 -2.37 2.60 -3.84 0.00 -0.63 -4.13 105.19 96.95 3btf n GLY 187 Ca 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.20 3btf n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3btf n GLY 188 N -0.13 3.11 2.77 -0.02 0.00 0.27 -4.89 105.19 106.31 3btf n GLY 188 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3btf n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3btf s LYS 188 N -0.31 0.65 0.10 1.61 1.02 -1.26 -3.59 119.74 117.96 3btf s LYS 188 Ca 0.00 -0.02 -0.26 0.00 0.02 0.00 0.00 55.97 55.72 3btf s LYS 188 Cb 0.00 -1.24 0.09 0.00 -0.52 0.00 0.00 37.83 36.15 3btf s LYS 188 CO 0.00 -0.38 1.11 0.34 -0.92 0.00 0.00 175.35 175.50 3btf s ASP 189 N 1.94 -0.06 0.57 2.83 2.15 -0.54 -4.39 116.67 119.18 3btf s ASP 189 Ca 0.04 -0.41 -0.05 0.00 0.43 0.00 0.00 52.55 52.56 3btf s ASP 189 Cb -0.13 0.37 0.00 0.00 -0.30 0.00 0.00 42.92 42.86 3btf s ASP 189 CO -0.06 -0.71 0.88 -0.44 -0.17 0.00 0.00 175.17 174.67 3btf s SER 190 N -3.23 5.66 0.34 -0.34 0.01 -1.26 -0.36 113.70 114.53 3btf s SER 190 Ca 0.18 0.70 -0.07 0.00 1.31 0.00 0.00 55.95 58.08 3btf s SER 190 Cb -0.00 -1.74 0.03 0.00 0.21 0.00 0.00 66.02 64.52 3btf s SER 190 CO 0.01 -1.00 0.57 0.00 0.41 0.00 0.00 173.24 173.24 3btf n GLN 192 N -0.52 1.80 0.00 0.00 3.00 -1.26 -1.52 117.38 118.88 3btf n GLN 192 Ca -0.03 0.66 0.00 0.00 -0.01 0.00 0.00 57.00 57.61 3btf n GLN 192 Cb 0.55 -2.41 0.00 0.00 0.00 0.00 0.00 30.24 28.38 3btf n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3btf n GLY 193 N 3.60 0.57 0.04 1.08 0.00 -1.26 -0.63 105.19 108.58 3btf n GLY 193 Ca 0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.33 3btf n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3btf n ASP 194 N 0.00 0.50 -4.50 1.61 8.00 -0.58 -3.82 116.55 117.76 3btf n ASP 194 Ca 0.00 -0.11 -0.46 0.00 0.71 0.00 0.00 54.79 54.93 3btf n ASP 194 Cb 0.00 1.12 -0.02 0.00 -0.02 0.00 0.00 41.12 42.20 3btf n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3btf n SER 195 N -2.15 0.09 0.00 -2.24 7.64 -1.26 -1.69 113.62 114.01 3btf n SER 195 Ca -0.00 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.03 3btf n SER 195 Cb 0.49 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 3btf n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3btf n GLY 196 N 1.59 2.63 3.72 0.23 0.00 -0.28 -0.03 105.19 113.05 3btf n GLY 196 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3btf n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3btf s GLY 197 N -1.78 1.60 0.37 -0.02 0.00 -0.68 -3.15 107.32 103.66 3btf s GLY 197 Ca 0.00 -0.18 -0.20 0.00 0.00 0.00 0.00 44.72 44.34 3btf s GLY 197 CO 0.00 0.34 0.87 2.56 0.00 0.00 0.00 173.10 176.87 3btf s PRO 198 N -4.98 4.21 -0.31 2.90 0.04 -1.26 -1.42 135.00 134.17 3btf s PRO 198 Ca 0.64 0.99 0.01 0.00 0.04 0.00 0.00 61.00 62.68 3btf s PRO 198 Cb -0.18 -2.38 0.10 0.00 0.04 0.00 0.00 34.50 32.08 3btf s PRO 198 CO 0.57 0.09 0.07 0.08 0.04 0.00 0.00 177.00 177.85 3btf s VAL 199 N -2.01 1.45 -0.21 -0.36 1.01 -0.90 -3.37 120.40 116.00 3btf s VAL 199 Ca 0.57 -1.73 -0.07 0.00 0.00 0.00 0.00 61.98 60.75 3btf s VAL 199 Cb -0.11 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 3btf s VAL 199 CO 0.16 -0.59 0.05 -0.69 0.00 0.00 0.00 175.10 174.03 3btf s VAL 200 N 1.34 4.42 -0.10 2.92 1.01 -0.52 -1.00 120.40 128.47 3btf s VAL 200 Ca 0.09 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 61.93 3btf s VAL 200 Cb -0.18 -3.02 0.02 0.00 0.00 0.00 0.00 36.38 33.19 3btf s VAL 200 CO -0.17 0.40 -0.13 0.00 0.00 0.00 0.00 175.10 175.20 3btf n SER 202 N 4.23 -2.93 0.00 0.00 7.64 -1.26 -1.48 113.62 119.83 3btf n SER 202 Ca -0.19 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 58.88 3btf n SER 202 Cb 0.51 -3.92 0.00 0.00 -1.01 0.00 0.00 64.21 59.79 3btf n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3btf n GLY 203 N -1.66 0.24 3.33 0.23 0.00 -1.26 -5.00 105.19 101.07 3btf n GLY 203 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 3btf n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3btf s LYS 204 N -1.05 1.79 -0.52 1.61 -0.14 -0.55 -4.05 119.74 116.84 3btf s LYS 204 Ca 0.00 -1.07 -0.28 0.00 -1.36 0.00 0.00 55.97 53.26 3btf s LYS 204 Cb 0.00 -1.93 0.02 0.00 -1.68 0.00 0.00 37.83 34.24 3btf s LYS 204 CO 0.00 0.50 1.33 -1.17 -0.76 0.00 0.00 175.35 175.25 3btf s LEU 209 N -1.14 3.49 -0.09 3.17 2.96 0.29 -0.97 118.68 126.37 3btf s LEU 209 Ca 0.11 0.40 0.18 0.00 -0.22 0.00 0.00 54.13 54.60 3btf s LEU 209 Cb -0.10 -3.26 -0.27 0.00 0.50 0.00 0.00 46.19 43.06 3btf s LEU 209 CO 0.02 -1.54 0.26 0.00 -1.32 0.00 0.00 176.35 173.78 3btf n GLN 210 N 8.37 0.80 -4.07 1.98 1.13 -0.17 -3.98 117.38 121.43 3btf n GLN 210 Ca 0.12 -0.10 -0.10 0.00 -1.94 0.00 0.00 57.00 54.98 3btf n GLN 210 Cb 0.49 -1.46 -0.08 0.00 0.11 0.00 0.00 30.24 29.30 3btf n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 3btf s GLY 211 N -4.67 0.87 -0.09 1.08 0.00 -0.89 -1.40 107.32 102.23 3btf s GLY 211 Ca -0.08 -1.23 0.01 0.00 0.00 0.00 0.00 44.72 43.43 3btf s GLY 211 CO 0.78 -1.04 -0.10 -0.42 0.00 0.00 0.00 173.10 172.31 3btf s ILE 212 N -4.05 1.09 -0.02 0.90 1.01 -1.00 -2.13 121.20 117.00 3btf s ILE 212 Ca 0.26 -0.39 -0.34 0.00 0.00 0.00 0.00 60.65 60.18 3btf s ILE 212 Cb 0.04 -1.04 -0.12 0.00 0.01 0.00 0.00 42.46 41.35 3btf s ILE 212 CO 0.06 0.36 1.79 0.52 0.00 0.00 0.00 174.94 177.67 3btf n VAL 213 N 4.32 0.41 0.00 2.92 0.31 -0.50 -1.15 118.33 124.63 3btf n VAL 213 Ca -0.18 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 3btf n VAL 213 Cb 0.51 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.67 3btf n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3btf n SER 214 N 5.68 0.00 -3.17 4.52 2.88 -1.00 -1.12 113.62 121.40 3btf n SER 214 Ca 0.21 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.62 3btf n SER 214 Cb 0.29 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.73 3btf n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 3btf s TRP 215 N -0.84 0.74 0.00 0.66 1.48 -0.89 -4.92 118.94 115.17 3btf s TRP 215 Ca 0.00 -1.11 0.00 0.00 -1.06 0.00 0.00 56.10 53.93 3btf s TRP 215 Cb 0.00 0.22 0.00 0.00 -1.16 0.00 0.00 33.47 32.53 3btf s TRP 215 CO 0.00 -1.27 0.00 0.41 -4.06 0.00 0.00 176.95 172.03 3btf n GLY 216 N -0.55 1.24 2.70 3.67 0.00 -1.26 -0.24 105.19 110.75 3btf n GLY 216 Ca -0.02 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 3btf n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3btf s SER 217 N 2.00 3.75 0.42 1.61 0.15 -1.26 -5.02 113.70 115.34 3btf s SER 217 Ca 0.00 -2.15 0.00 0.00 0.70 0.00 0.00 55.95 54.50 3btf s SER 217 Cb 0.00 -0.90 0.00 0.00 -1.71 0.00 0.00 66.02 63.41 3btf s SER 217 CO 0.00 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.71 3btf n GLY 219 N 4.16 -0.60 3.05 9.45 0.00 -1.26 -4.57 105.19 115.42 3btf n GLY 219 Ca 0.04 -1.13 -0.24 0.00 0.00 0.00 0.00 46.02 44.70 3btf n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3btf n ALA 221 N 3.47 -0.66 -1.80 0.00 0.00 -1.26 -4.68 120.51 115.58 3btf n ALA 221 Ca -0.20 0.14 -0.35 0.00 0.00 0.00 0.00 53.44 53.03 3btf n ALA 221 Cb 0.53 -1.76 -0.07 0.00 0.00 0.00 0.00 19.45 18.15 3btf n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3btf s GLN 221 N -4.83 4.38 0.42 0.00 -1.52 -1.26 -0.56 119.66 116.28 3btf s GLN 221 Ca 0.00 1.24 -0.26 0.00 -1.95 0.00 0.00 55.36 54.40 3btf s GLN 221 Cb 0.00 -2.48 -0.08 0.00 -0.22 0.00 0.00 33.01 30.23 3btf s GLN 221 CO 0.00 0.10 1.29 -1.59 -0.25 0.00 0.00 175.29 174.84 3btf s LYS 222 N -2.63 3.91 0.00 2.91 0.00 -1.26 -2.63 119.74 120.03 3btf s LYS 222 Ca 0.57 2.12 0.00 0.00 0.00 0.00 0.00 55.97 58.66 3btf s LYS 222 Cb -0.14 -2.70 0.00 0.00 0.00 0.00 0.00 37.83 34.99 3btf s LYS 222 CO 0.19 -0.53 0.00 0.09 0.00 0.00 0.00 175.35 175.10 3btf n ASN 223 N 0.02 -4.11 -3.46 0.03 3.02 0.23 -4.91 115.26 106.06 3btf n ASN 223 Ca 0.04 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.33 3btf n ASN 223 Cb 0.44 -2.19 -0.09 0.00 -0.61 0.00 0.00 39.78 37.32 3btf n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3btf n LYS 224 N -0.79 1.03 -1.33 3.52 4.76 -1.08 -4.76 118.16 119.50 3btf n LYS 224 Ca 0.00 -3.70 -0.31 0.00 -2.87 0.00 0.00 58.31 51.43 3btf n LYS 224 Cb 0.26 -1.79 0.09 0.00 -1.84 0.00 0.00 35.03 31.75 3btf n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3btf s PRO 225 N -0.96 2.13 0.59 1.97 0.04 -1.26 -4.37 135.00 133.14 3btf s PRO 225 Ca 0.33 1.00 -0.17 0.00 0.04 0.00 0.00 61.00 62.20 3btf s PRO 225 Cb 0.07 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.68 3btf s PRO 225 CO -0.14 -1.68 1.09 0.20 0.04 0.00 0.00 177.00 176.51 3btf s GLY 226 N -3.52 2.31 -0.10 0.56 0.00 -1.16 -4.70 107.32 100.70 3btf s GLY 226 Ca 0.61 0.58 -0.01 0.00 0.00 0.00 0.00 44.72 45.90 3btf s GLY 226 CO 0.56 0.92 -0.05 0.14 0.00 0.00 0.00 173.10 174.67 3btf s VAL 227 N -2.18 3.80 0.09 1.40 1.01 0.67 -2.40 120.40 122.79 3btf s VAL 227 Ca 0.68 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 62.31 3btf s VAL 227 Cb -0.20 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 3btf s VAL 227 CO 0.34 0.56 -0.19 -0.31 0.00 0.00 0.00 175.10 175.50 3btf s TYR 228 N -0.33 1.59 0.03 5.22 1.51 0.56 -2.09 117.35 123.83 3btf s TYR 228 Ca 0.05 -0.43 -0.30 0.00 -1.01 0.00 0.00 57.07 55.38 3btf s TYR 228 Cb -0.12 -0.88 -0.05 0.00 -0.11 0.00 0.00 41.96 40.79 3btf s TYR 228 CO 0.02 0.15 1.25 0.99 -1.11 0.00 0.00 175.55 176.85 3btf s THR 229 N -1.17 3.97 -0.98 -0.71 2.01 -0.30 -1.16 115.64 117.30 3btf s THR 229 Ca 0.04 1.38 -0.24 0.00 0.31 0.00 0.00 61.69 63.18 3btf s THR 229 Cb -0.10 -3.89 0.05 0.00 0.01 0.00 0.00 72.50 68.57 3btf s THR 229 CO 0.03 0.06 1.42 -0.75 -0.69 0.00 0.00 174.62 174.70 3btf s LYS 230 N 1.57 3.53 0.39 4.92 2.20 -0.31 -2.36 119.74 129.68 3btf s LYS 230 Ca 0.59 -1.00 0.11 0.00 -0.36 0.00 0.00 55.97 55.31 3btf s LYS 230 Cb -0.29 -5.18 0.90 0.00 -1.51 0.00 0.00 37.83 31.74 3btf s LYS 230 CO 0.27 -2.20 1.94 0.28 -0.36 0.00 0.00 175.35 175.29 3btf h VAL 231 N 6.68 0.91 -0.12 4.02 2.07 -1.54 -2.64 116.25 125.64 3btf h VAL 231 Ca 0.13 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.49 3btf h VAL 231 Cb 1.02 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3btf h VAL 231 CO 1.41 0.11 0.20 0.00 0.02 0.00 0.00 177.57 179.30 3btf n ASN 233 N -3.47 0.11 0.00 0.00 3.02 -0.99 -3.93 115.26 110.00 3btf n ASN 233 Ca 0.00 -0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 3btf n ASN 233 Cb 0.30 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 3btf n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3btf n TYR 234 N -1.28 0.00 -0.27 3.10 4.01 0.20 -4.79 117.16 118.12 3btf n TYR 234 Ca 0.12 -0.30 0.01 0.00 -0.16 0.00 0.00 57.90 57.57 3btf n TYR 234 Cb 0.27 -0.03 0.14 0.00 -0.31 0.00 0.00 39.34 39.42 3btf n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3btf h VAL 235 N 0.11 0.93 -0.17 -0.72 2.07 -1.66 0.15 116.25 116.95 3btf h VAL 235 Ca 0.00 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 3btf h VAL 235 Cb 0.34 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 3btf h VAL 235 CO 0.00 0.14 0.07 0.28 0.02 0.00 0.00 177.57 178.08 3btf h SER 236 N 0.76 0.23 -0.72 0.57 0.02 -1.89 -1.26 113.55 111.27 3btf h SER 236 Ca 0.36 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 3btf h SER 236 Cb 0.30 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 3btf h SER 236 CO -0.23 0.34 0.40 -0.25 -1.14 0.00 0.00 176.83 175.95 3btf h TRP 237 N 0.12 0.97 0.31 3.45 7.01 -1.77 -2.00 115.95 124.04 3btf h TRP 237 Ca 0.06 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.02 3btf h TRP 237 Cb 0.17 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 26.92 3btf h TRP 237 CO -0.01 0.68 -0.15 0.82 -2.79 0.00 0.00 178.44 176.99 3btf h ILE 238 N 0.98 0.72 -0.58 2.65 2.04 -0.49 -0.75 117.51 122.08 3btf h ILE 238 Ca 0.25 -0.19 0.04 0.00 1.00 0.00 0.00 64.86 65.96 3btf h ILE 238 Cb 0.02 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 3btf h ILE 238 CO -0.04 0.04 0.32 0.11 0.00 0.00 0.00 178.15 178.58 3btf h LYS 239 N -0.52 0.61 -0.28 2.37 1.57 -1.15 -0.84 116.57 118.33 3btf h LYS 239 Ca -0.04 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.55 3btf h LYS 239 Cb 0.38 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 3btf h LYS 239 CO 0.07 0.40 -0.43 0.37 -0.57 0.00 0.00 179.45 179.29 3btf h GLN 240 N 0.62 0.79 -0.60 3.15 5.75 -1.36 -2.41 115.11 121.05 3btf h GLN 240 Ca 0.25 -0.47 -0.04 0.00 -0.15 0.00 0.00 58.65 58.24 3btf h GLN 240 Cb 0.11 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.67 3btf h GLN 240 CO -0.14 1.10 0.23 1.15 -2.65 0.00 0.00 178.83 178.52 3btf h THR 241 N 0.55 1.23 -0.79 2.39 2.02 -0.86 -1.84 112.91 115.61 3btf h THR 241 Ca 0.03 -0.73 -0.05 0.00 0.77 0.00 0.00 66.41 66.43 3btf h THR 241 Cb 1.03 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 3btf h THR 241 CO 0.10 0.28 0.30 0.40 0.37 0.00 0.00 175.52 176.97 3btf h ILE 242 N 0.84 1.26 0.00 3.11 5.03 -1.16 -2.95 117.51 123.64 3btf h ILE 242 Ca 0.20 -0.84 -0.04 0.00 -0.12 0.00 0.00 64.86 64.05 3btf h ILE 242 Cb 0.21 0.34 -0.01 0.00 -3.03 0.00 0.00 36.82 34.33 3btf h ILE 242 CO -0.02 0.34 -0.20 0.00 -0.68 0.00 0.00 178.15 177.60 3btf h ALA 243 N 1.16 1.01 -0.54 1.87 0.00 -1.00 -3.17 119.26 118.59 3btf h ALA 243 Ca 0.26 -0.18 -0.25 0.00 0.00 0.00 0.00 54.91 54.73 3btf h ALA 243 Cb 0.24 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 17.84 3btf h ALA 243 CO -0.02 0.25 0.15 -1.13 0.00 0.00 0.00 179.25 178.50 3btf n SER 244 N -3.34 3.15 0.00 0.00 3.41 -0.73 -5.10 113.62 111.01 3btf n SER 244 Ca 0.00 -3.61 0.00 0.00 -0.26 0.00 0.00 58.87 55.00 3btf n SER 244 Cb 0.43 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 3btf n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47