#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2btc s VAL 17 N 0.00 4.78 -0.59 1.39 1.01 0.28 -3.93 120.40 123.35 2btc s VAL 17 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.93 2btc s VAL 17 Cb 0.00 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2btc s VAL 17 CO 0.00 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2btc n GLY 18 N 2.75 0.58 1.15 4.51 0.00 -1.25 -1.78 105.19 111.16 2btc n GLY 18 Ca -0.18 -0.74 -0.06 0.00 0.00 0.00 0.00 46.02 45.05 2btc n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2btc n GLY 19 N -1.82 1.80 3.64 -0.02 0.00 -1.26 -4.91 105.19 102.61 2btc n GLY 19 Ca -0.06 -2.14 -0.29 0.00 0.00 0.00 0.00 46.02 43.53 2btc n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2btc s TYR 20 N -0.14 1.89 -0.25 1.61 1.13 -0.51 -4.93 117.35 116.16 2btc s TYR 20 Ca 0.18 -1.06 -0.19 0.00 -1.41 0.00 0.00 57.07 54.59 2btc s TYR 20 Cb -0.01 -1.43 -0.02 0.00 -1.10 0.00 0.00 41.96 39.39 2btc s TYR 20 CO 0.12 0.03 0.58 0.99 -2.51 0.00 0.00 175.55 174.76 2btc s THR 21 N -3.02 5.03 0.30 -3.49 2.01 -1.26 -0.53 115.64 114.68 2btc s THR 21 Ca 0.17 1.04 0.00 0.00 0.31 0.00 0.00 61.69 63.21 2btc s THR 21 Cb 0.03 -3.89 0.28 0.00 0.01 0.00 0.00 72.50 68.92 2btc s THR 21 CO 0.09 0.07 1.93 0.00 -0.69 0.00 0.00 174.62 176.02 2btc n GLY 23 N -1.40 2.42 3.69 0.00 0.00 -1.26 -4.76 105.19 103.88 2btc n GLY 23 Ca 0.12 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 2btc n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2btc s ALA 24 N -0.94 3.74 -1.99 4.61 0.00 -1.26 -2.40 121.76 123.53 2btc s ALA 24 Ca 0.00 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.38 2btc s ALA 24 Cb 0.00 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.35 2btc s ALA 24 CO 0.00 -1.26 0.00 0.09 0.00 0.00 0.00 175.76 174.59 2btc n ASN 25 N 5.91 -5.38 0.00 0.00 3.02 -1.26 -4.86 115.26 112.69 2btc n ASN 25 Ca 0.18 0.35 0.14 0.00 -0.03 0.00 0.00 54.58 55.21 2btc n ASN 25 Cb 0.39 -4.68 0.56 0.00 -0.61 0.00 0.00 39.78 35.44 2btc n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2btc n THR 26 N -2.81 0.00 -3.66 3.41 -2.24 -1.01 -4.10 114.28 103.87 2btc n THR 26 Ca -0.21 -0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.29 2btc n THR 26 Cb 0.66 -0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 2btc n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2btc n VAL 27 N -1.51 1.66 0.54 2.28 0.31 -1.26 -4.98 118.33 115.38 2btc n VAL 27 Ca 0.07 -4.89 0.10 0.00 -0.01 0.00 0.00 64.34 59.61 2btc n VAL 27 Cb 0.34 -2.11 0.43 0.00 -0.91 0.00 0.00 33.84 31.58 2btc n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2btc n PRO 28 N 1.56 0.10 0.00 5.55 -0.04 -1.26 -1.74 135.00 139.17 2btc n PRO 28 Ca 0.24 0.28 0.12 0.00 -0.04 0.00 0.00 63.50 64.10 2btc n PRO 28 Cb 0.39 -1.67 0.27 0.00 -0.04 0.00 0.00 33.50 32.45 2btc n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2btc n TYR 29 N -1.86 0.00 -2.43 0.54 0.18 -1.15 -2.34 117.16 110.10 2btc n TYR 29 Ca 0.04 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.40 2btc n TYR 29 Cb 0.24 -0.14 -0.03 0.00 -0.38 0.00 0.00 39.34 39.03 2btc n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 2btc s GLN 30 N -2.66 4.49 0.22 -3.48 2.00 -0.71 -0.75 119.66 118.77 2btc s GLN 30 Ca 0.19 1.78 0.08 0.00 -2.00 0.00 0.00 55.36 55.42 2btc s GLN 30 Cb 0.18 -3.30 -0.05 0.00 0.80 0.00 0.00 33.01 30.65 2btc s GLN 30 CO 0.60 -0.12 -0.15 0.14 -0.50 0.00 0.00 175.29 175.25 2btc s VAL 31 N 0.39 1.87 -0.15 1.34 -7.23 -0.67 -4.46 120.40 111.49 2btc s VAL 31 Ca 0.54 -2.24 -0.04 0.00 -1.81 0.00 0.00 61.98 58.44 2btc s VAL 31 Cb -0.30 -2.08 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 2btc s VAL 31 CO 0.33 -0.56 -0.02 -0.55 -0.31 0.00 0.00 175.10 173.99 2btc s SER 32 N -3.33 4.93 -0.17 4.85 0.15 -0.44 -2.36 113.70 117.33 2btc s SER 32 Ca 0.24 -0.07 -0.14 0.00 0.70 0.00 0.00 55.95 56.67 2btc s SER 32 Cb -0.02 -1.75 -0.04 0.00 -1.71 0.00 0.00 66.02 62.50 2btc s SER 32 CO 0.08 0.20 0.31 -0.76 1.20 0.00 0.00 173.24 174.27 2btc s LEU 33 N 0.20 4.22 -0.09 3.45 1.43 0.03 -0.73 118.68 127.19 2btc s LEU 33 Ca -0.01 0.50 0.02 0.00 -1.03 0.00 0.00 54.13 53.60 2btc s LEU 33 Cb -0.14 -2.40 0.02 0.00 0.03 0.00 0.00 46.19 43.70 2btc s LEU 33 CO 0.02 0.06 -0.13 0.21 0.23 0.00 0.00 176.35 176.75 2btc s ASN 34 N 0.63 2.07 -0.43 2.29 3.84 -0.08 -1.57 114.94 121.68 2btc s ASN 34 Ca 0.17 -0.34 0.08 0.00 0.21 0.00 0.00 52.86 52.97 2btc s ASN 34 Cb -0.13 -0.92 0.41 0.00 -0.55 0.00 0.00 41.25 40.06 2btc s ASN 34 CO 0.05 0.01 1.05 -1.54 -2.79 0.00 0.00 177.10 173.87 2btc n SER 37 N 4.10 3.94 0.00 -4.21 3.41 -1.26 -1.12 113.62 118.48 2btc n SER 37 Ca -0.20 -3.50 0.00 0.00 -0.26 0.00 0.00 58.87 54.91 2btc n SER 37 Cb 0.51 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 2btc n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2btc n GLY 38 N -0.35 3.26 3.48 5.00 0.00 -1.26 -4.99 105.19 110.34 2btc n GLY 38 Ca 0.32 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.23 2btc n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2btc s TYR 39 N -2.91 -0.36 0.12 1.61 1.13 -1.26 -5.14 117.35 110.54 2btc s TYR 39 Ca 0.00 0.08 -0.31 0.00 -1.41 0.00 0.00 57.07 55.43 2btc s TYR 39 Cb 0.00 0.50 -0.07 0.00 -1.10 0.00 0.00 41.96 41.29 2btc s TYR 39 CO 0.00 -0.89 1.29 -1.58 -2.51 0.00 0.00 175.55 171.86 2btc s HIS 40 N -3.80 3.33 0.00 -3.49 5.65 -1.26 -4.27 115.29 111.44 2btc s HIS 40 Ca 0.04 1.17 0.00 0.00 0.25 0.00 0.00 55.06 56.52 2btc s HIS 40 Cb -0.01 -3.55 0.00 0.00 -1.18 0.00 0.00 32.58 27.84 2btc s HIS 40 CO -0.08 -1.79 0.00 1.97 -0.65 0.00 0.00 174.74 174.19 2btc n PHE 41 N 3.52 0.00 -3.66 3.88 -1.74 -0.61 -4.97 117.46 113.88 2btc n PHE 41 Ca 0.09 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.88 2btc n PHE 41 Cb 0.44 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.39 2btc n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2btc n GLY 43 N -0.23 2.02 3.80 0.00 0.00 0.11 -0.79 105.19 110.09 2btc n GLY 43 Ca -0.15 -2.18 -0.01 0.00 0.00 0.00 0.00 46.02 43.67 2btc n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2btc s GLY 44 N -3.33 -0.14 -0.02 -0.02 0.00 -0.99 -3.71 107.32 99.10 2btc s GLY 44 Ca 0.30 0.09 0.03 0.00 0.00 0.00 0.00 44.72 45.14 2btc s GLY 44 CO 0.19 1.53 -0.10 -1.35 0.00 0.00 0.00 173.10 173.38 2btc s SER 45 N -3.22 1.26 -0.16 1.64 1.04 -0.07 -1.66 113.70 112.53 2btc s SER 45 Ca 0.18 -0.20 -0.29 0.00 0.48 0.00 0.00 55.95 56.12 2btc s SER 45 Cb -0.00 -0.32 -0.01 0.00 0.10 0.00 0.00 66.02 65.79 2btc s SER 45 CO 0.02 0.08 1.23 -0.22 0.98 0.00 0.00 173.24 175.32 2btc s LEU 46 N 0.15 4.19 -0.00 2.42 2.96 0.07 -0.63 118.68 127.83 2btc s LEU 46 Ca -0.02 1.68 0.14 0.00 -0.22 0.00 0.00 54.13 55.71 2btc s LEU 46 Cb -0.08 -3.54 -0.17 0.00 0.50 0.00 0.00 46.19 42.89 2btc s LEU 46 CO 0.00 -0.73 0.55 2.30 -1.32 0.00 0.00 176.35 177.16 2btc n ILE 47 N 5.26 0.00 -3.40 6.68 -5.35 -0.46 -1.29 119.36 120.79 2btc n ILE 47 Ca 0.13 -0.20 -0.02 0.00 -0.27 0.00 0.00 62.75 62.40 2btc n ILE 47 Cb 0.45 0.82 0.01 0.00 -1.74 0.00 0.00 39.64 39.18 2btc n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 2btc n ASN 48 N -1.48 -0.63 0.32 7.28 2.04 -1.18 -4.58 115.26 117.01 2btc n ASN 48 Ca 0.02 -1.40 0.19 0.00 -0.44 0.00 0.00 54.58 52.95 2btc n ASN 48 Cb 0.26 1.05 1.06 0.00 -2.53 0.00 0.00 39.78 39.62 2btc n ASN 48 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 2btc h SER 49 N 0.62 0.00 -0.00 0.53 4.64 -1.96 -3.03 113.55 114.34 2btc h SER 49 Ca -0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 2btc h SER 49 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2btc h SER 49 CO 0.12 0.01 -0.13 0.00 -0.87 0.00 0.00 176.83 175.96 2btc n GLN 50 N -3.36 3.10 -4.34 4.77 6.02 -1.26 0.07 117.38 122.38 2btc n GLN 50 Ca -0.03 -0.34 -0.19 0.00 -0.01 0.00 0.00 57.00 56.44 2btc n GLN 50 Cb 0.10 -0.88 -0.15 0.00 1.02 0.00 0.00 30.24 30.33 2btc n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2btc s TRP 51 N -1.04 0.81 -0.01 1.08 0.52 -1.15 -0.39 118.94 118.77 2btc s TRP 51 Ca 0.04 -0.17 0.08 0.00 0.02 0.00 0.00 56.10 56.07 2btc s TRP 51 Cb 0.04 -0.55 -0.02 0.00 -1.15 0.00 0.00 33.47 31.78 2btc s TRP 51 CO 0.14 -0.05 -0.26 0.08 0.02 0.00 0.00 176.95 176.89 2btc s VAL 52 N -0.02 2.09 -0.02 4.03 1.01 -0.13 -1.36 120.40 126.00 2btc s VAL 52 Ca 0.01 -1.17 0.03 0.00 0.00 0.00 0.00 61.98 60.85 2btc s VAL 52 Cb -0.05 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2btc s VAL 52 CO -0.00 0.53 -0.08 0.54 0.00 0.00 0.00 175.10 176.09 2btc s VAL 53 N -0.66 3.54 0.00 2.92 0.11 0.20 -0.56 120.40 125.95 2btc s VAL 53 Ca 0.10 -0.71 -0.00 0.00 -2.93 0.00 0.00 61.98 58.45 2btc s VAL 53 Cb -0.10 -2.49 0.00 0.00 -1.53 0.00 0.00 36.38 32.26 2btc s VAL 53 CO -0.00 0.47 0.00 -0.24 -3.33 0.00 0.00 175.10 172.00 2btc n SER 54 N 1.83 -0.01 -4.82 3.54 2.88 -0.17 -0.89 113.62 115.99 2btc n SER 54 Ca -0.16 -1.01 -0.37 0.00 -1.33 0.00 0.00 58.87 56.00 2btc n SER 54 Cb 0.53 0.01 -0.06 0.00 -0.75 0.00 0.00 64.21 63.94 2btc n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2btc s ALA 55 N -1.47 3.56 0.48 -1.46 0.00 -1.26 -0.66 121.76 120.95 2btc s ALA 55 Ca 0.00 0.02 0.15 0.00 0.00 0.00 0.00 51.96 52.12 2btc s ALA 55 Cb -0.00 -2.64 1.12 0.00 0.00 0.00 0.00 23.12 21.60 2btc s ALA 55 CO 0.00 0.40 2.07 0.00 0.00 0.00 0.00 175.76 178.23 2btc h ALA 56 N 4.09 1.84 0.00 0.00 0.00 -1.72 -1.20 119.26 122.27 2btc h ALA 56 Ca -0.49 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2btc h ALA 56 Cb 1.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2btc h ALA 56 CO 0.64 0.12 0.00 -2.39 0.00 0.00 0.00 179.25 177.63 2btc n HIS 57 N -4.43 0.00 1.49 0.00 1.44 -1.26 -1.93 115.22 110.53 2btc n HIS 57 Ca -0.03 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.81 2btc n HIS 57 Cb 0.17 -0.28 0.52 0.00 0.12 0.00 0.00 29.99 30.52 2btc n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2btc s TYR 59 N -1.93 2.80 -0.02 0.00 5.04 -0.81 -4.99 117.35 117.44 2btc s TYR 59 Ca 0.37 0.64 -0.21 0.00 -2.44 0.00 0.00 57.07 55.43 2btc s TYR 59 Cb 0.19 -4.09 0.04 0.00 0.35 0.00 0.00 41.96 38.45 2btc s TYR 59 CO 0.31 -3.82 0.45 0.15 -1.34 0.00 0.00 175.55 171.29 2btc s LYS 60 N 0.02 0.83 0.35 4.97 1.02 -1.26 -5.15 119.74 120.52 2btc s LYS 60 Ca 0.67 -0.06 -0.26 0.00 0.02 0.00 0.00 55.97 56.34 2btc s LYS 60 Cb -0.48 0.38 -0.09 0.00 -0.52 0.00 0.00 37.83 37.11 2btc s LYS 60 CO 0.43 -0.25 1.01 -1.54 -0.92 0.00 0.00 175.35 174.08 2btc s SER 61 N -1.37 7.07 -0.36 2.83 1.04 -1.26 -4.22 113.70 117.43 2btc s SER 61 Ca -0.12 1.99 -0.02 0.00 0.48 0.00 0.00 55.95 58.29 2btc s SER 61 Cb -0.03 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.50 2btc s SER 61 CO 0.05 -0.27 0.31 0.61 0.98 0.00 0.00 173.24 174.93 2btc n GLY 62 N 0.56 0.41 3.76 7.32 0.00 -1.26 -5.00 105.19 110.97 2btc n GLY 62 Ca 0.03 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 2btc n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2btc s ILE 63 N -3.09 4.49 -0.17 -0.61 1.01 -1.26 -4.71 121.20 116.86 2btc s ILE 63 Ca 0.10 1.75 -0.04 0.00 0.00 0.00 0.00 60.65 62.46 2btc s ILE 63 Cb -0.04 -4.17 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 2btc s ILE 63 CO 0.20 0.44 -0.03 -1.58 0.00 0.00 0.00 174.94 173.97 2btc s GLN 64 N -0.63 3.64 -0.19 2.79 0.74 -0.28 -1.77 119.66 123.97 2btc s GLN 64 Ca 0.38 -0.53 -0.13 0.00 0.05 0.00 0.00 55.36 55.14 2btc s GLN 64 Cb -0.22 -2.94 -0.05 0.00 1.10 0.00 0.00 33.01 30.90 2btc s GLN 64 CO 0.26 0.18 0.26 0.08 -0.55 0.00 0.00 175.29 175.52 2btc s VAL 65 N 0.52 5.31 -0.23 1.34 1.01 0.36 -0.90 120.40 127.82 2btc s VAL 65 Ca -0.03 0.44 -0.01 0.00 0.00 0.00 0.00 61.98 62.38 2btc s VAL 65 Cb -0.14 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.66 2btc s VAL 65 CO 0.03 0.36 -0.09 -0.13 0.00 0.00 0.00 175.10 175.27 2btc s ARG 66 N 0.75 2.94 0.22 2.72 0.52 0.10 -1.02 118.95 125.17 2btc s ARG 66 Ca 0.14 -0.90 0.07 0.00 -0.52 0.00 0.00 55.73 54.52 2btc s ARG 66 Cb -0.13 -2.90 -0.04 0.00 0.52 0.00 0.00 34.95 32.40 2btc s ARG 66 CO 0.04 -0.33 0.08 -0.51 0.02 0.00 0.00 175.30 174.60 2btc s LEU 67 N 1.34 3.53 -0.76 2.53 1.02 0.20 -1.33 118.68 125.21 2btc s LEU 67 Ca 0.02 -0.36 0.00 0.00 0.02 0.00 0.00 54.13 53.81 2btc s LEU 67 Cb -0.16 -2.11 0.00 0.00 0.02 0.00 0.00 46.19 43.94 2btc s LEU 67 CO -0.06 0.03 0.00 0.61 0.02 0.00 0.00 176.35 176.95 2btc n GLY 69 N -0.65 0.93 3.80 -3.19 0.00 -1.26 -1.20 105.19 103.62 2btc n GLY 69 Ca -0.08 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.84 2btc n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2btc s GLU 70 N -2.60 4.32 0.00 1.61 0.41 -1.26 -3.88 118.70 117.29 2btc s GLU 70 Ca 0.00 0.90 0.00 0.00 -0.41 0.00 0.00 54.97 55.46 2btc s GLU 70 Cb 0.00 -3.07 0.00 0.00 -1.78 0.00 0.00 34.13 29.28 2btc s GLU 70 CO 0.00 0.50 0.00 -3.47 -0.49 0.00 0.00 175.26 171.80 2btc n ASP 71 N 1.19 0.00 -4.61 -0.19 2.03 -1.26 -4.58 116.55 109.14 2btc n ASP 71 Ca -0.05 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.83 2btc n ASP 71 Cb 0.50 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.88 2btc n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2btc s ASN 72 N -0.14 6.47 0.00 1.67 3.84 -1.26 -3.42 114.94 122.11 2btc s ASN 72 Ca 0.00 0.79 0.22 0.00 0.21 0.00 0.00 52.86 54.08 2btc s ASN 72 Cb 0.00 -2.54 1.18 0.00 -0.55 0.00 0.00 41.25 39.33 2btc s ASN 72 CO 0.00 -1.33 1.72 2.30 -2.79 0.00 0.00 177.10 177.00 2btc n ILE 73 N 6.88 0.24 0.14 -5.21 -5.35 -0.40 -3.23 119.36 112.43 2btc n ILE 73 Ca 0.15 0.06 0.07 0.00 -0.27 0.00 0.00 62.75 62.76 2btc n ILE 73 Cb 0.48 -0.70 -0.10 0.00 -1.74 0.00 0.00 39.64 37.58 2btc n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2btc n ASN 74 N -1.22 1.48 -4.52 7.28 3.02 -1.26 -4.98 115.26 115.06 2btc n ASN 74 Ca 0.12 -0.19 -0.33 0.00 -0.03 0.00 0.00 54.58 54.15 2btc n ASN 74 Cb 0.15 1.51 -0.12 0.00 -0.61 0.00 0.00 39.78 40.71 2btc n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2btc s VAL 75 N -2.84 3.46 -0.20 2.41 1.01 -1.20 -5.09 120.40 117.94 2btc s VAL 75 Ca -0.03 -0.56 -0.28 0.00 0.00 0.00 0.00 61.98 61.11 2btc s VAL 75 Cb 0.09 -2.41 0.00 0.00 0.00 0.00 0.00 36.38 34.06 2btc s VAL 75 CO 0.59 0.58 0.97 -0.69 0.00 0.00 0.00 175.10 176.55 2btc s VAL 76 N -0.53 4.75 -0.70 2.92 1.01 -1.26 -4.76 120.40 121.82 2btc s VAL 76 Ca 0.08 1.89 0.07 0.00 0.00 0.00 0.00 61.98 64.02 2btc s VAL 76 Cb -0.12 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 32.02 2btc s VAL 76 CO 0.02 -0.10 0.56 -0.62 0.00 0.00 0.00 175.10 174.96 2btc n GLU 77 N 5.91 1.95 0.00 2.72 1.02 -1.26 -5.03 120.64 125.95 2btc n GLU 77 Ca 0.09 -0.57 0.00 0.00 -0.02 0.00 0.00 57.16 56.66 2btc n GLU 77 Cb 0.47 -1.02 0.00 0.00 -0.02 0.00 0.00 31.44 30.87 2btc n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2btc n GLY 78 N 0.72 3.16 1.22 0.62 0.00 -1.26 -4.94 105.19 104.71 2btc n GLY 78 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.14 2btc n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2btc n ASN 79 N 0.00 4.04 -4.84 1.61 3.02 -1.26 -4.99 115.26 112.84 2btc n ASN 79 Ca 0.00 -2.32 -0.33 0.00 -0.03 0.00 0.00 54.58 51.90 2btc n ASN 79 Cb 0.00 -0.47 -0.06 0.00 -0.61 0.00 0.00 39.78 38.64 2btc n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2btc s GLU 80 N -1.59 4.08 -0.09 3.52 8.01 -1.25 -4.39 118.70 126.99 2btc s GLU 80 Ca 0.43 0.79 0.01 0.00 0.01 0.00 0.00 54.97 56.20 2btc s GLU 80 Cb 0.26 -2.42 0.02 0.00 -4.31 0.00 0.00 34.13 27.69 2btc s GLU 80 CO 0.22 0.14 -0.08 -0.65 0.01 0.00 0.00 175.26 174.90 2btc s GLN 81 N -2.93 1.44 -0.22 1.61 -0.21 -0.34 -4.97 119.66 114.03 2btc s GLN 81 Ca 0.55 -0.26 -0.05 0.00 0.02 0.00 0.00 55.36 55.62 2btc s GLN 81 Cb -0.11 -1.40 -0.02 0.00 1.00 0.00 0.00 33.01 32.49 2btc s GLN 81 CO 0.17 -0.15 -0.01 -0.06 -2.12 0.00 0.00 175.29 173.12 2btc s PHE 82 N 1.29 3.00 -0.03 0.91 0.08 -1.26 -0.63 117.98 121.33 2btc s PHE 82 Ca -0.03 -0.72 0.01 0.00 0.12 0.00 0.00 56.93 56.30 2btc s PHE 82 Cb -0.14 -2.13 0.02 0.00 -0.57 0.00 0.00 43.02 40.20 2btc s PHE 82 CO -0.03 -0.44 -0.04 0.42 -0.10 0.00 0.00 175.22 175.03 2btc s ILE 83 N 1.40 0.45 0.60 0.64 1.01 -0.19 -4.97 121.20 120.13 2btc s ILE 83 Ca 0.05 -0.11 -0.16 0.00 0.00 0.00 0.00 60.65 60.43 2btc s ILE 83 Cb -0.14 -0.47 -0.03 0.00 0.01 0.00 0.00 42.46 41.82 2btc s ILE 83 CO -0.01 0.19 1.08 -0.44 0.00 0.00 0.00 174.94 175.76 2btc s SER 84 N 0.72 5.64 0.04 3.58 0.01 -1.26 -0.48 113.70 121.95 2btc s SER 84 Ca -0.09 1.90 -0.30 0.00 1.31 0.00 0.00 55.95 58.77 2btc s SER 84 Cb -0.12 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 2btc s SER 84 CO -0.00 -1.26 1.03 0.00 0.41 0.00 0.00 173.24 173.42 2btc s ALA 85 N -2.34 3.24 -0.12 1.44 0.00 -0.73 -1.01 121.76 122.25 2btc s ALA 85 Ca 0.65 0.63 0.18 0.00 0.00 0.00 0.00 51.96 53.42 2btc s ALA 85 Cb -0.18 -3.35 -0.21 0.00 0.00 0.00 0.00 23.12 19.37 2btc s ALA 85 CO 0.36 -0.24 0.51 -1.13 0.00 0.00 0.00 175.76 175.26 2btc n SER 86 N 3.62 0.45 -3.73 0.00 3.41 0.86 -4.75 113.62 113.48 2btc n SER 86 Ca 0.06 0.20 -0.12 0.00 -0.26 0.00 0.00 58.87 58.75 2btc n SER 86 Cb 0.49 0.70 -0.11 0.00 -0.26 0.00 0.00 64.21 65.03 2btc n SER 86 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2btc s LYS 87 N -2.85 0.41 -0.09 4.33 2.20 -1.19 -4.99 119.74 117.57 2btc s LYS 87 Ca -0.06 0.57 0.04 0.00 -0.36 0.00 0.00 55.97 56.17 2btc s LYS 87 Cb 0.09 0.14 -0.00 0.00 -1.51 0.00 0.00 37.83 36.54 2btc s LYS 87 CO 0.83 -0.08 -0.24 -1.12 -0.36 0.00 0.00 175.35 174.39 2btc s SER 88 N 0.52 3.01 -0.30 1.43 0.01 -1.26 -0.76 113.70 116.35 2btc s SER 88 Ca -0.03 -0.53 0.03 0.00 1.31 0.00 0.00 55.95 56.73 2btc s SER 88 Cb -0.04 -1.24 0.08 0.00 0.21 0.00 0.00 66.02 65.03 2btc s SER 88 CO -0.03 0.17 -0.03 -0.63 0.41 0.00 0.00 173.24 173.14 2btc s ILE 89 N 0.23 2.32 0.31 1.44 1.01 0.67 -4.97 121.20 122.20 2btc s ILE 89 Ca -0.15 -1.90 -0.27 0.00 0.00 0.00 0.00 60.65 58.32 2btc s ILE 89 Cb -0.17 -2.50 -0.09 0.00 0.01 0.00 0.00 42.46 39.70 2btc s ILE 89 CO 0.07 -0.28 1.01 -0.69 0.00 0.00 0.00 174.94 175.05 2btc s VAL 90 N 1.04 3.89 0.28 2.92 1.01 -1.26 -1.16 120.40 127.10 2btc s VAL 90 Ca -0.01 1.70 -0.30 0.00 0.00 0.00 0.00 61.98 63.37 2btc s VAL 90 Cb -0.20 -4.00 -0.12 0.00 0.00 0.00 0.00 36.38 32.06 2btc s VAL 90 CO -0.06 0.25 1.61 1.57 0.00 0.00 0.00 175.10 178.48 2btc n HIS 91 N 0.81 2.81 -0.34 5.22 -0.00 -0.74 -4.88 115.22 118.09 2btc n HIS 91 Ca 0.01 0.23 0.21 0.00 0.46 0.00 0.00 57.72 58.63 2btc n HIS 91 Cb 0.48 -2.60 0.44 0.00 -0.12 0.00 0.00 29.99 28.19 2btc n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2btc h PRO 92 N 5.08 0.45 -0.65 1.57 0.13 -1.93 0.25 132.00 136.89 2btc h PRO 92 Ca -0.46 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2btc h PRO 92 Cb 1.22 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2btc h PRO 92 CO 0.82 0.30 0.00 0.43 -0.23 0.00 0.00 178.00 179.31 2btc n SER 93 N -4.87 4.49 -4.75 1.44 7.64 -1.26 -4.97 113.62 111.35 2btc n SER 93 Ca 0.28 -2.60 -0.41 0.00 1.01 0.00 0.00 58.87 57.14 2btc n SER 93 Cb 0.86 -0.60 -0.02 0.00 -1.01 0.00 0.00 64.21 63.44 2btc n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2btc s TYR 94 N -2.18 2.86 -0.27 1.43 5.04 0.07 -4.68 117.35 119.62 2btc s TYR 94 Ca 0.43 0.91 0.01 0.00 -2.44 0.00 0.00 57.07 55.98 2btc s TYR 94 Cb 0.31 -3.96 0.05 0.00 0.35 0.00 0.00 41.96 38.71 2btc s TYR 94 CO 0.15 -3.14 -0.07 1.21 -1.34 0.00 0.00 175.55 172.36 2btc s ASN 95 N 0.38 4.48 0.34 4.32 3.84 -0.84 -4.98 114.94 122.48 2btc s ASN 95 Ca 0.61 -1.22 0.27 0.00 0.21 0.00 0.00 52.86 52.72 2btc s ASN 95 Cb -0.45 -1.61 0.99 0.00 -0.55 0.00 0.00 41.25 39.63 2btc s ASN 95 CO 0.47 -0.19 1.79 0.77 -2.79 0.00 0.00 177.10 177.15 2btc h SER 96 N 7.89 0.00 0.21 -4.21 4.64 -1.93 0.36 113.55 120.51 2btc h SER 96 Ca -0.24 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.74 2btc h SER 96 Cb 1.06 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.17 2btc h SER 96 CO 0.51 0.00 -1.64 0.78 -0.87 0.00 0.00 176.83 175.61 2btc h ASN 97 N 0.00 0.69 -0.00 4.97 -0.26 -1.97 -3.38 115.58 115.62 2btc h ASN 97 Ca 0.00 -0.93 0.00 0.00 -0.56 0.00 0.00 56.30 54.81 2btc h ASN 97 Cb 0.53 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 37.57 2btc h ASN 97 CO 0.00 1.76 -0.76 0.35 -1.06 0.00 0.00 177.43 177.72 2btc n THR 98 N -3.66 0.00 -1.88 2.81 -2.24 -1.14 -4.97 114.28 103.19 2btc n THR 98 Ca -0.22 -0.12 -0.18 0.00 -2.27 0.00 0.00 64.05 61.26 2btc n THR 98 Cb 1.08 1.05 -0.04 0.00 -2.10 0.00 0.00 70.33 70.32 2btc n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2btc n LEU 99 N -1.11 -1.51 -4.74 3.22 4.77 0.12 -4.98 117.00 112.77 2btc n LEU 99 Ca 0.05 0.23 -0.41 0.00 -0.03 0.00 0.00 56.01 55.85 2btc n LEU 99 Cb 0.32 -2.52 -0.05 0.00 -2.33 0.00 0.00 43.42 38.85 2btc n LEU 99 CO 0.34 -0.58 0.74 0.21 -1.33 0.00 0.00 177.39 176.77 2btc s ASN 100 N -2.54 7.38 -1.13 -1.43 3.04 -1.20 -3.14 114.94 115.93 2btc s ASN 100 Ca 0.00 2.05 -0.05 0.00 0.04 0.00 0.00 52.86 54.90 2btc s ASN 100 Cb 0.00 -2.61 0.01 0.00 -1.54 0.00 0.00 41.25 37.11 2btc s ASN 100 CO 0.00 -0.10 0.97 0.59 -3.04 0.00 0.00 177.10 175.52 2btc n ASN 101 N 2.00 -4.37 -4.52 -4.21 3.02 -1.26 -1.99 115.26 103.94 2btc n ASN 101 Ca 0.01 -0.49 -0.43 0.00 -0.03 0.00 0.00 54.58 53.64 2btc n ASN 101 Cb 0.46 -4.47 -0.00 0.00 -0.61 0.00 0.00 39.78 35.17 2btc n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2btc n ASP 102 N -2.58 4.85 -3.74 6.41 2.03 -1.19 -4.33 116.55 118.00 2btc n ASP 102 Ca -0.09 -2.91 -0.13 0.00 0.52 0.00 0.00 54.79 52.17 2btc n ASP 102 Cb 0.59 -1.74 -0.10 0.00 -0.72 0.00 0.00 41.12 39.15 2btc n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2btc s ILE 103 N 4.19 0.01 -0.03 5.18 2.07 -1.26 -3.96 121.20 127.40 2btc s ILE 103 Ca 0.54 -0.07 -0.06 0.00 -1.41 0.00 0.00 60.65 59.65 2btc s ILE 103 Cb 0.05 -0.55 0.01 0.00 0.13 0.00 0.00 42.46 42.09 2btc s ILE 103 CO 0.07 -0.04 0.14 -0.32 -1.91 0.00 0.00 174.94 172.88 2btc s MET 104 N -0.04 0.32 -0.09 3.50 -2.45 0.17 -1.80 119.30 118.90 2btc s MET 104 Ca -0.02 -0.10 -0.01 0.00 -1.25 0.00 0.00 55.69 54.31 2btc s MET 104 Cb -0.03 0.14 -0.03 0.00 1.25 0.00 0.00 34.83 36.16 2btc s MET 104 CO 0.01 -0.07 -0.06 -0.51 1.05 0.00 0.00 175.02 175.45 2btc s LEU 105 N -0.65 3.21 -0.11 4.11 1.43 -0.31 -1.00 118.68 125.37 2btc s LEU 105 Ca -0.07 -0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 2btc s LEU 105 Cb -0.04 -1.72 -0.00 0.00 0.03 0.00 0.00 46.19 44.45 2btc s LEU 105 CO 0.01 0.31 -0.22 -0.63 0.23 0.00 0.00 176.35 176.05 2btc s ILE 106 N -0.47 2.25 -0.14 -0.59 1.01 0.27 -0.24 121.20 123.29 2btc s ILE 106 Ca 0.07 -0.95 -0.09 0.00 0.00 0.00 0.00 60.65 59.68 2btc s ILE 106 Cb -0.12 -1.88 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 2btc s ILE 106 CO 0.02 0.55 0.17 -0.75 0.00 0.00 0.00 174.94 174.94 2btc s LYS 107 N 0.38 3.83 0.29 2.79 2.20 0.06 -0.95 119.74 128.33 2btc s LYS 107 Ca -0.17 -0.10 -0.19 0.00 -0.36 0.00 0.00 55.97 55.16 2btc s LYS 107 Cb -0.17 -3.30 -0.09 0.00 -1.51 0.00 0.00 37.83 32.76 2btc s LYS 107 CO 0.08 0.55 0.77 -0.51 -0.36 0.00 0.00 175.35 175.87 2btc s LEU 108 N -0.38 4.20 0.24 5.43 1.43 0.48 -0.10 118.68 129.98 2btc s LEU 108 Ca 0.13 1.43 -0.06 0.00 -1.03 0.00 0.00 54.13 54.60 2btc s LEU 108 Cb -0.12 -3.90 0.26 0.00 0.03 0.00 0.00 46.19 42.45 2btc s LEU 108 CO 0.03 -0.10 1.92 0.50 0.23 0.00 0.00 176.35 178.92 2btc h LYS 109 N 2.82 1.26 -4.87 1.70 3.64 -1.37 -3.42 116.57 116.33 2btc h LYS 109 Ca -0.48 -0.08 -0.28 0.00 -1.27 0.00 0.00 60.65 58.55 2btc h LYS 109 Cb 1.18 -0.28 -0.15 0.00 -0.41 0.00 0.00 32.23 32.57 2btc h LYS 109 CO 0.65 0.83 -0.71 -1.54 -2.27 0.00 0.00 179.45 176.41 2btc s SER 110 N -6.06 1.47 0.28 4.20 1.04 -1.26 -4.99 113.70 108.38 2btc s SER 110 Ca -0.13 -1.00 -0.29 0.00 0.48 0.00 0.00 55.95 55.01 2btc s SER 110 Cb 0.18 0.04 -0.10 0.00 0.10 0.00 0.00 66.02 66.24 2btc s SER 110 CO 0.81 -0.39 1.17 0.00 0.98 0.00 0.00 173.24 175.82 2btc s ALA 111 N -3.41 3.44 0.56 5.32 0.00 -1.26 -4.87 121.76 121.53 2btc s ALA 111 Ca 0.14 1.01 -0.19 0.00 0.00 0.00 0.00 51.96 52.91 2btc s ALA 111 Cb 0.03 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 2btc s ALA 111 CO -0.02 -0.32 1.14 0.00 0.00 0.00 0.00 175.76 176.56 2btc s ALA 112 N -0.96 2.65 -0.47 0.00 0.00 0.11 -4.99 121.76 118.10 2btc s ALA 112 Ca 0.47 0.85 -0.24 0.00 0.00 0.00 0.00 51.96 53.04 2btc s ALA 112 Cb -0.34 -3.38 0.03 0.00 0.00 0.00 0.00 23.12 19.43 2btc s ALA 112 CO 0.43 -0.89 0.85 0.45 0.00 0.00 0.00 175.76 176.61 2btc s SER 113 N -1.79 6.43 0.32 0.00 0.15 -1.26 -4.85 113.70 112.70 2btc s SER 113 Ca 0.73 -0.08 -0.28 0.00 0.70 0.00 0.00 55.95 57.03 2btc s SER 113 Cb -0.25 -2.41 -0.09 0.00 -1.71 0.00 0.00 66.02 61.55 2btc s SER 113 CO 0.29 -1.01 1.09 -0.76 1.20 0.00 0.00 173.24 174.05 2btc s LEU 114 N 3.54 4.42 0.00 3.45 1.43 -1.26 -4.77 118.68 125.48 2btc s LEU 114 Ca 0.32 2.21 0.00 0.00 -1.03 0.00 0.00 54.13 55.63 2btc s LEU 114 Cb -0.12 -3.81 0.00 0.00 0.03 0.00 0.00 46.19 42.30 2btc s LEU 114 CO 0.23 -0.27 0.00 -0.46 0.23 0.00 0.00 176.35 176.08 2btc n ASN 115 N 0.77 0.00 0.22 2.29 0.23 -0.56 -4.97 115.26 113.24 2btc n ASN 115 Ca 0.01 -0.05 0.12 0.00 -0.53 0.00 0.00 54.58 54.12 2btc n ASN 115 Cb 0.46 0.00 0.31 0.00 -2.08 0.00 0.00 39.78 38.47 2btc n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2btc h SER 116 N 0.00 0.00 0.39 0.53 4.64 -2.00 -3.22 113.55 113.90 2btc h SER 116 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 2btc h SER 116 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2btc h SER 116 CO 0.00 0.10 -1.65 0.54 -0.87 0.00 0.00 176.83 174.95 2btc n ARG 117 N -3.15 0.64 -3.92 4.77 5.12 -1.26 -4.86 116.66 113.99 2btc n ARG 117 Ca 0.02 -0.03 -0.29 0.00 -1.93 0.00 0.00 57.85 55.62 2btc n ARG 117 Cb 0.49 -1.65 -0.16 0.00 -1.16 0.00 0.00 32.46 29.98 2btc n ARG 117 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2btc s VAL 118 N -3.32 1.34 0.05 1.55 1.01 -1.21 -4.50 120.40 115.31 2btc s VAL 118 Ca -0.05 -0.91 -0.12 0.00 0.00 0.00 0.00 61.98 60.90 2btc s VAL 118 Cb 0.11 -1.54 0.02 0.00 0.00 0.00 0.00 36.38 34.97 2btc s VAL 118 CO 0.85 0.04 0.28 0.00 0.00 0.00 0.00 175.10 176.27 2btc s ALA 119 N 1.51 -0.58 0.53 5.51 0.00 -0.99 -1.50 121.76 126.24 2btc s ALA 119 Ca -0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 51.96 51.80 2btc s ALA 119 Cb -0.17 0.35 0.01 0.00 0.00 0.00 0.00 23.12 23.32 2btc s ALA 119 CO -0.07 -0.43 0.78 -1.54 0.00 0.00 0.00 175.76 174.50 2btc s SER 120 N -2.20 5.58 0.02 0.00 1.04 -1.26 -2.95 113.70 113.93 2btc s SER 120 Ca -0.03 0.36 0.04 0.00 0.48 0.00 0.00 55.95 56.80 2btc s SER 120 Cb -0.00 -1.42 -0.03 0.00 0.10 0.00 0.00 66.02 64.67 2btc s SER 120 CO -0.05 -0.95 -0.09 -0.51 0.98 0.00 0.00 173.24 172.62 2btc s ILE 121 N -2.77 3.45 0.42 -1.02 1.10 -0.41 -4.86 121.20 117.12 2btc s ILE 121 Ca 0.52 -0.91 -0.23 0.00 -0.51 0.00 0.00 60.65 59.52 2btc s ILE 121 Cb -0.10 -2.51 -0.09 0.00 0.15 0.00 0.00 42.46 39.91 2btc s ILE 121 CO 0.40 0.35 1.04 -0.44 -2.11 0.00 0.00 174.94 174.18 2btc s SER 122 N -1.52 6.66 0.32 4.50 0.01 -1.26 -4.65 113.70 117.77 2btc s SER 122 Ca 0.17 1.97 -0.21 0.00 1.31 0.00 0.00 55.95 59.20 2btc s SER 122 Cb -0.11 -2.57 -0.09 0.00 0.21 0.00 0.00 66.02 63.45 2btc s SER 122 CO 0.08 -0.56 0.84 -0.76 0.41 0.00 0.00 173.24 173.26 2btc s LEU 123 N -2.91 4.20 0.40 2.44 1.43 -1.26 -0.75 118.68 122.22 2btc s LEU 123 Ca 0.61 1.57 -0.25 0.00 -1.03 0.00 0.00 54.13 55.03 2btc s LEU 123 Cb -0.19 -4.03 -0.08 0.00 0.03 0.00 0.00 46.19 41.92 2btc s LEU 123 CO 0.24 -0.13 1.12 -2.16 0.23 0.00 0.00 176.35 175.65 2btc s PRO 124 N -2.47 4.08 0.11 1.29 0.04 -1.26 -4.81 135.00 131.99 2btc s PRO 124 Ca 0.52 1.71 0.24 0.00 0.04 0.00 0.00 61.00 63.50 2btc s PRO 124 Cb -0.14 -2.61 0.24 0.00 0.04 0.00 0.00 34.50 32.02 2btc s PRO 124 CO 0.19 -0.26 1.22 1.79 0.04 0.00 0.00 177.00 179.99 2btc h THR 125 N 2.25 0.00 -3.79 1.26 1.35 -1.97 -3.48 112.91 108.53 2btc h THR 125 Ca -0.49 -0.55 -0.08 0.00 -0.55 0.00 0.00 66.41 64.74 2btc h THR 125 Cb 1.23 1.06 -0.14 0.00 -1.73 0.00 0.00 68.15 68.57 2btc h THR 125 CO 0.62 0.00 -0.35 -0.44 -0.25 0.00 0.00 175.52 175.11 2btc s SER 127 N -4.30 0.09 0.51 5.36 0.01 -1.26 -5.16 113.70 108.95 2btc s SER 127 Ca 0.05 -0.64 -0.19 0.00 1.31 0.00 0.00 55.95 56.47 2btc s SER 127 Cb 0.13 0.35 -0.07 0.00 0.21 0.00 0.00 66.02 66.64 2btc s SER 127 CO 0.75 -0.75 1.05 0.00 0.41 0.00 0.00 173.24 174.70 2btc s ALA 129 N -2.09 3.48 0.39 0.00 0.00 -1.26 -5.06 121.76 117.23 2btc s ALA 129 Ca 0.67 -0.15 -0.04 0.00 0.00 0.00 0.00 51.96 52.43 2btc s ALA 129 Cb -0.17 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 2btc s ALA 129 CO 0.24 0.44 0.67 -1.54 0.00 0.00 0.00 175.76 175.58 2btc s SER 130 N -2.29 6.34 0.27 0.00 1.04 -1.26 -5.01 113.70 112.79 2btc s SER 130 Ca 0.49 0.78 -0.30 0.00 0.48 0.00 0.00 55.95 57.40 2btc s SER 130 Cb -0.11 -2.18 -0.13 0.00 0.10 0.00 0.00 66.02 63.70 2btc s SER 130 CO 0.20 -0.39 1.30 0.00 0.98 0.00 0.00 173.24 175.32 2btc n ALA 132 N -1.72 0.81 0.00 5.32 0.00 -1.26 -1.98 120.51 121.68 2btc n ALA 132 Ca -0.01 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.83 2btc n ALA 132 Cb 0.55 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.79 2btc n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2btc n GLY 133 N 1.61 2.34 3.73 0.00 0.00 0.38 -4.96 105.19 108.30 2btc n GLY 133 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2btc n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2btc s THR 134 N -2.59 3.03 0.04 2.61 2.01 -0.84 -4.67 115.64 115.24 2btc s THR 134 Ca 0.00 0.82 -0.24 0.00 0.31 0.00 0.00 61.69 62.57 2btc s THR 134 Cb 0.00 -3.52 -0.06 0.00 0.01 0.00 0.00 72.50 68.93 2btc s THR 134 CO 0.00 0.11 0.74 -1.58 -0.69 0.00 0.00 174.62 173.20 2btc s GLN 135 N 0.18 4.47 0.24 4.92 0.74 -1.26 -1.41 119.66 127.55 2btc s GLN 135 Ca 0.60 1.02 0.06 0.00 0.05 0.00 0.00 55.36 57.09 2btc s GLN 135 Cb -0.39 -3.35 -0.05 0.00 1.10 0.00 0.00 33.01 30.32 2btc s GLN 135 CO 0.37 0.32 -0.06 0.00 -0.55 0.00 0.00 175.29 175.37 2btc s LEU 137 N -3.37 3.02 -0.05 0.00 2.96 0.57 -1.19 118.68 120.62 2btc s LEU 137 Ca 0.27 -0.26 0.06 0.00 -0.22 0.00 0.00 54.13 53.98 2btc s LEU 137 Cb 0.03 -1.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.98 2btc s LEU 137 CO 0.09 0.11 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.36 2btc s ILE 138 N 0.73 2.21 0.05 6.68 1.01 0.15 -1.08 121.20 130.95 2btc s ILE 138 Ca -0.03 -1.02 -0.02 0.00 0.00 0.00 0.00 60.65 59.59 2btc s ILE 138 Cb -0.15 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 2btc s ILE 138 CO 0.02 0.57 -0.01 -0.94 0.00 0.00 0.00 174.94 174.58 2btc s SER 139 N -0.29 0.40 0.00 3.58 1.04 -1.22 -0.59 113.70 116.62 2btc s SER 139 Ca 0.01 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.59 2btc s SER 139 Cb -0.13 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2btc s SER 139 CO 0.02 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.31 2btc n GLY 140 N 0.44 0.42 1.61 7.32 0.00 -0.59 -4.42 105.19 109.97 2btc n GLY 140 Ca -0.16 -1.05 -0.07 0.00 0.00 0.00 0.00 46.02 44.74 2btc n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2btc n TRP 141 N -0.52 1.93 -1.88 1.61 8.01 -1.26 -2.05 117.44 123.28 2btc n TRP 141 Ca 0.00 -1.43 -0.22 0.00 -1.31 0.00 0.00 57.50 54.54 2btc n TRP 141 Cb 0.00 -0.63 0.15 0.00 -2.01 0.00 0.00 31.31 28.82 2btc n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2btc n GLY 142 N -0.75 -1.05 3.68 6.99 0.00 -1.25 -4.33 105.19 108.48 2btc n GLY 142 Ca 0.40 -1.76 -0.44 0.00 0.00 0.00 0.00 46.02 44.22 2btc n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2btc n ASN 143 N -3.54 2.74 -0.93 1.61 2.85 0.53 -2.45 115.26 116.07 2btc n ASN 143 Ca 0.13 1.17 0.10 0.00 -0.11 0.00 0.00 54.58 55.87 2btc n ASN 143 Cb 0.46 -1.45 0.15 0.00 1.24 0.00 0.00 39.78 40.18 2btc n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2btc n THR 144 N 1.33 0.31 -5.02 -0.44 -2.24 -0.15 -0.32 114.28 107.75 2btc n THR 144 Ca 0.09 -0.66 -0.32 0.00 -2.27 0.00 0.00 64.05 60.90 2btc n THR 144 Cb 0.33 1.14 -0.14 0.00 -2.10 0.00 0.00 70.33 69.56 2btc n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2btc s LYS 145 N -1.48 2.25 0.27 -0.78 1.02 -1.26 -4.36 119.74 115.40 2btc s LYS 145 Ca 0.30 -0.85 0.15 0.00 0.02 0.00 0.00 55.97 55.58 2btc s LYS 145 Cb 0.19 -2.20 0.06 0.00 -0.52 0.00 0.00 37.83 35.36 2btc s LYS 145 CO 0.27 0.58 1.44 0.66 -0.92 0.00 0.00 175.35 177.38 2btc h SER 146 N 5.25 0.00 -3.34 2.83 4.64 -1.93 -3.43 113.55 117.57 2btc h SER 146 Ca -0.45 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.41 2btc h SER 146 Cb 1.14 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.87 2btc h SER 146 CO 0.48 0.52 -0.78 -0.44 -0.87 0.00 0.00 176.83 175.74 2btc s SER 147 N -6.47 1.47 0.00 4.97 0.01 -1.26 -4.68 113.70 107.75 2btc s SER 147 Ca 0.04 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2btc s SER 147 Cb 0.08 -0.57 0.00 0.00 0.21 0.00 0.00 66.02 65.73 2btc s SER 147 CO 0.75 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.91 2btc n GLY 148 N 4.49 -3.22 2.96 3.44 0.00 -1.26 -4.99 105.19 106.61 2btc n GLY 148 Ca -0.17 -2.00 -0.20 0.00 0.00 0.00 0.00 46.02 43.65 2btc n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2btc s THR 149 N -0.64 0.66 -0.26 2.61 -4.23 -1.26 -4.65 115.64 107.87 2btc s THR 149 Ca 0.00 -0.26 -0.01 0.00 -1.18 0.00 0.00 61.69 60.24 2btc s THR 149 Cb 0.00 -0.62 0.14 0.00 1.34 0.00 0.00 72.50 73.36 2btc s THR 149 CO 0.00 0.23 0.38 -0.55 -0.54 0.00 0.00 174.62 174.14 2btc s SER 150 N 0.45 0.32 -0.24 3.99 0.15 -1.26 -4.95 113.70 112.16 2btc s SER 150 Ca -0.06 0.04 -0.10 0.00 0.70 0.00 0.00 55.95 56.53 2btc s SER 150 Cb -0.10 1.10 -0.05 0.00 -1.71 0.00 0.00 66.02 65.25 2btc s SER 150 CO 0.00 -0.32 0.15 -0.31 1.20 0.00 0.00 173.24 173.97 2btc s TYR 151 N 2.54 3.28 0.56 3.44 2.02 -1.26 -0.97 117.35 126.95 2btc s TYR 151 Ca 0.12 0.16 -0.15 0.00 -0.37 0.00 0.00 57.07 56.83 2btc s TYR 151 Cb -0.15 -2.27 -0.06 0.00 -0.40 0.00 0.00 41.96 39.08 2btc s TYR 151 CO -0.20 0.01 1.00 -1.25 -1.57 0.00 0.00 175.55 173.55 2btc s PRO 152 N 1.15 3.80 0.01 -1.71 0.04 -1.26 -5.00 135.00 132.03 2btc s PRO 152 Ca 0.07 0.89 -0.04 0.00 0.04 0.00 0.00 61.00 61.96 2btc s PRO 152 Cb -0.14 -2.11 -0.28 0.00 0.04 0.00 0.00 34.50 32.01 2btc s PRO 152 CO 0.05 -0.40 0.90 -0.44 0.04 0.00 0.00 177.00 177.16 2btc h ASP 153 N 0.45 0.42 -2.01 6.66 3.32 -1.93 -3.47 116.42 119.86 2btc h ASP 153 Ca -0.46 -0.56 -0.55 0.00 0.02 0.00 0.00 57.03 55.49 2btc h ASP 153 Cb 1.19 -0.14 -0.08 0.00 0.22 0.00 0.00 39.33 40.52 2btc h ASP 153 CO 0.61 1.46 -0.58 0.68 -1.72 0.00 0.00 179.24 179.69 2btc s VAL 154 N -2.62 3.20 0.22 -1.35 -7.23 -1.26 -1.27 120.40 110.08 2btc s VAL 154 Ca -0.08 -1.78 -0.30 0.00 -1.81 0.00 0.00 61.98 58.00 2btc s VAL 154 Cb 0.07 -2.93 -0.09 0.00 0.56 0.00 0.00 36.38 33.98 2btc s VAL 154 CO 0.86 -0.26 1.27 -0.22 -0.31 0.00 0.00 175.10 176.44 2btc s LEU 155 N -3.77 4.44 0.19 1.32 2.96 -1.22 -4.83 118.68 117.77 2btc s LEU 155 Ca 0.35 2.39 0.08 0.00 -0.22 0.00 0.00 54.13 56.73 2btc s LEU 155 Cb -0.04 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 2btc s LEU 155 CO 0.21 -0.46 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.22 2btc s LYS 156 N -0.45 2.29 0.09 1.98 -0.14 -0.87 -2.10 119.74 120.53 2btc s LYS 156 Ca 0.54 -1.21 0.04 0.00 -1.36 0.00 0.00 55.97 53.98 2btc s LYS 156 Cb -0.36 -2.27 -0.03 0.00 -1.68 0.00 0.00 37.83 33.49 2btc s LYS 156 CO 0.40 0.43 -0.11 0.00 -0.76 0.00 0.00 175.35 175.31 2btc s LEU 158 N -2.23 0.55 -0.18 0.00 2.96 0.25 -1.42 118.68 118.60 2btc s LEU 158 Ca 0.03 0.56 -0.12 0.00 -0.22 0.00 0.00 54.13 54.38 2btc s LEU 158 Cb -0.05 0.86 -0.05 0.00 0.50 0.00 0.00 46.19 47.45 2btc s LEU 158 CO 0.01 -0.14 0.22 -0.54 -1.32 0.00 0.00 176.35 174.58 2btc s LYS 159 N 0.90 4.22 -0.07 1.98 1.02 -1.26 -0.67 119.74 125.86 2btc s LYS 159 Ca -0.06 -0.04 -0.12 0.00 0.02 0.00 0.00 55.97 55.77 2btc s LYS 159 Cb -0.07 -3.42 0.02 0.00 -0.52 0.00 0.00 37.83 33.84 2btc s LYS 159 CO -0.06 0.27 0.29 0.00 -0.92 0.00 0.00 175.35 174.93 2btc s ALA 160 N 0.40 -0.73 0.35 5.17 0.00 -0.34 -4.95 121.76 121.67 2btc s ALA 160 Ca 0.13 0.57 -0.17 0.00 0.00 0.00 0.00 51.96 52.49 2btc s ALA 160 Cb -0.12 -0.23 -0.10 0.00 0.00 0.00 0.00 23.12 22.67 2btc s ALA 160 CO 0.01 -0.19 0.80 -1.25 0.00 0.00 0.00 175.76 175.13 2btc s PRO 161 N -0.53 4.08 0.20 0.00 0.04 -1.26 -0.58 135.00 136.95 2btc s PRO 161 Ca -0.06 0.81 -0.30 0.00 0.04 0.00 0.00 61.00 61.48 2btc s PRO 161 Cb -0.04 -2.38 -0.09 0.00 0.04 0.00 0.00 34.50 32.04 2btc s PRO 161 CO 0.02 0.11 1.27 0.42 0.04 0.00 0.00 177.00 178.87 2btc s ILE 162 N -2.02 3.30 0.28 0.56 1.01 -0.50 -1.63 121.20 122.20 2btc s ILE 162 Ca 0.56 1.09 0.04 0.00 0.00 0.00 0.00 60.65 62.33 2btc s ILE 162 Cb -0.10 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.64 2btc s ILE 162 CO 0.16 0.17 0.43 -0.76 0.00 0.00 0.00 174.94 174.94 2btc s LEU 163 N -0.24 4.19 0.66 2.97 1.43 -0.06 -0.47 118.68 127.17 2btc s LEU 163 Ca 0.55 0.16 -0.15 0.00 -1.03 0.00 0.00 54.13 53.66 2btc s LEU 163 Cb -0.35 -2.99 -0.00 0.00 0.03 0.00 0.00 46.19 42.88 2btc s LEU 163 CO 0.38 -0.18 1.12 -0.94 0.23 0.00 0.00 176.35 176.97 2btc s SER 164 N -4.02 5.04 0.40 2.29 1.04 -1.26 -4.61 113.70 112.59 2btc s SER 164 Ca 0.37 2.06 0.09 0.00 0.48 0.00 0.00 55.95 58.95 2btc s SER 164 Cb -0.09 -2.56 0.88 0.00 0.10 0.00 0.00 66.02 64.35 2btc s SER 164 CO 0.31 -1.68 1.99 0.44 0.98 0.00 0.00 173.24 175.28 2btc h ASP 165 N 0.08 0.51 -0.25 7.02 3.32 -1.97 -1.20 116.42 123.94 2btc h ASP 165 Ca -0.47 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.56 2btc h ASP 165 Cb 1.25 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 2btc h ASP 165 CO 0.54 0.33 0.07 0.28 -1.72 0.00 0.00 179.24 178.74 2btc h SER 166 N 0.58 0.36 -0.83 6.45 0.02 -1.98 0.50 113.55 118.65 2btc h SER 166 Ca 0.27 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 2btc h SER 166 Cb 0.31 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 2btc h SER 166 CO -0.08 0.47 0.48 0.28 -1.14 0.00 0.00 176.83 176.85 2btc h SER 167 N 0.23 1.01 -0.06 3.07 0.02 -1.82 0.23 113.55 116.23 2btc h SER 167 Ca 0.08 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2btc h SER 167 Cb 0.24 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 2btc h SER 167 CO -0.00 0.79 0.01 0.00 -1.14 0.00 0.00 176.83 176.48 2btc h LYS 169 N -0.16 0.53 -0.43 0.00 1.57 -0.73 -1.40 116.57 115.95 2btc h LYS 169 Ca 0.02 -0.13 -0.08 0.00 -1.87 0.00 0.00 60.65 58.59 2btc h LYS 169 Cb 0.29 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2btc h LYS 169 CO 0.00 0.59 -0.03 1.03 -0.57 0.00 0.00 179.45 180.47 2btc h SER 170 N 0.50 0.77 0.38 0.86 0.87 -0.31 -2.89 113.55 113.73 2btc h SER 170 Ca 0.10 -0.32 -0.12 0.00 -1.23 0.00 0.00 61.79 60.22 2btc h SER 170 Cb 0.39 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 2btc h SER 170 CO 0.02 0.91 -0.50 0.00 -0.53 0.00 0.00 176.83 176.72 2btc h ALA 171 N 0.89 1.05 -2.31 6.23 0.00 -0.33 -3.36 119.26 121.43 2btc h ALA 171 Ca 0.12 -0.47 -0.59 0.00 0.00 0.00 0.00 54.91 53.97 2btc h ALA 171 Cb 0.53 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 17.83 2btc h ALA 171 CO 0.03 0.65 -0.82 0.66 0.00 0.00 0.00 179.25 179.77 2btc n TYR 172 N -3.94 1.54 -1.64 0.00 4.01 -0.59 -4.93 117.16 111.61 2btc n TYR 172 Ca -0.02 -3.85 -0.55 0.00 -0.16 0.00 0.00 57.90 53.32 2btc n TYR 172 Cb 0.54 -0.37 -0.07 0.00 -0.31 0.00 0.00 39.34 39.13 2btc n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2btc n PRO 173 N 1.53 1.24 -0.90 -0.72 -0.02 -1.10 -1.24 135.00 133.79 2btc n PRO 173 Ca 0.25 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2btc n PRO 173 Cb 0.45 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2btc n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2btc n GLY 174 N 4.82 0.71 0.17 -1.23 0.00 -1.26 -4.85 105.19 103.55 2btc n GLY 174 Ca 0.30 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.39 2btc n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2btc n GLN 175 N -2.01 2.09 -3.64 1.61 6.02 -0.38 -4.95 117.38 116.12 2btc n GLN 175 Ca 0.00 -0.39 -0.36 0.00 -0.01 0.00 0.00 57.00 56.24 2btc n GLN 175 Cb 0.02 -1.19 -0.09 0.00 1.02 0.00 0.00 30.24 29.99 2btc n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2btc s ILE 176 N -2.04 5.35 0.57 5.09 -1.09 -1.25 -5.04 121.20 122.79 2btc s ILE 176 Ca 0.09 0.24 0.09 0.00 -2.23 0.00 0.00 60.65 58.84 2btc s ILE 176 Cb 0.11 -3.52 0.07 0.00 -1.58 0.00 0.00 42.46 37.54 2btc s ILE 176 CO 0.47 0.35 0.69 0.42 -1.23 0.00 0.00 174.94 175.64 2btc s THR 177 N 0.96 2.03 -1.00 2.92 -4.23 -1.26 -4.98 115.64 110.07 2btc s THR 177 Ca 0.09 -1.12 0.14 0.00 -1.18 0.00 0.00 61.69 59.61 2btc s THR 177 Cb -0.13 -2.15 0.11 0.00 1.34 0.00 0.00 72.50 71.67 2btc s THR 177 CO 0.04 0.00 1.44 -1.54 -0.54 0.00 0.00 174.62 174.01 2btc n SER 178 N -2.12 0.00 -1.64 3.99 3.41 -1.26 -2.28 113.62 113.72 2btc n SER 178 Ca 0.11 0.50 0.07 0.00 -0.26 0.00 0.00 58.87 59.29 2btc n SER 178 Cb 0.62 -0.50 0.35 0.00 -0.26 0.00 0.00 64.21 64.43 2btc n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2btc n ASN 179 N -1.50 4.90 -4.09 4.04 3.02 -1.26 -4.92 115.26 115.45 2btc n ASN 179 Ca 0.03 -2.65 -0.13 0.00 -0.03 0.00 0.00 54.58 51.80 2btc n ASN 179 Cb 0.16 -0.62 -0.11 0.00 -0.61 0.00 0.00 39.78 38.60 2btc n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2btc s MET 180 N -2.25 0.61 0.10 3.52 -1.94 -0.97 -1.16 119.30 117.21 2btc s MET 180 Ca 0.48 -0.88 -0.04 0.00 -1.71 0.00 0.00 55.69 53.54 2btc s MET 180 Cb 0.34 -0.33 -0.03 0.00 2.01 0.00 0.00 34.83 36.83 2btc s MET 180 CO 0.18 0.05 0.09 -0.59 -0.01 0.00 0.00 175.02 174.74 2btc s PHE 181 N -1.78 0.51 -0.03 -0.03 -0.71 -0.47 -4.81 117.98 110.65 2btc s PHE 181 Ca -0.05 -0.96 -0.02 0.00 -1.04 0.00 0.00 56.93 54.85 2btc s PHE 181 Cb -0.07 -0.29 -0.04 0.00 -1.21 0.00 0.00 43.02 41.41 2btc s PHE 181 CO -0.00 -0.50 0.11 0.00 -1.34 0.00 0.00 175.22 173.49 2btc s ALA 183 N -1.17 -0.15 0.00 0.00 0.00 -0.77 -0.88 121.76 118.79 2btc s ALA 183 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2btc s ALA 183 Cb -0.12 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 22.97 2btc s ALA 183 CO 0.12 -0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.20 2btc n GLY 184 N 2.45 0.61 2.84 0.00 0.00 -0.65 -2.95 105.19 107.50 2btc n GLY 184 Ca -0.17 -1.55 -0.25 0.00 0.00 0.00 0.00 46.02 44.05 2btc n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2btc s TYR 184 N -3.63 1.16 0.43 1.61 2.02 -1.26 -4.34 117.35 113.34 2btc s TYR 184 Ca 0.00 -0.55 0.31 0.00 -0.37 0.00 0.00 57.07 56.45 2btc s TYR 184 Cb 0.00 -1.06 1.61 0.00 -0.40 0.00 0.00 41.96 42.11 2btc s TYR 184 CO 0.00 -0.46 2.12 -0.07 -1.57 0.00 0.00 175.55 175.57 2btc h LEU 185 N 8.24 0.00 -0.26 -1.29 3.38 -1.96 -0.60 115.31 122.82 2btc h LEU 185 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2btc h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2btc h LEU 185 CO 0.34 0.08 0.00 -1.84 0.09 0.00 0.00 178.44 177.11 2btc n GLU 186 N -3.51 0.08 -0.02 1.13 0.00 -1.26 -0.17 120.64 116.90 2btc n GLU 186 Ca -0.02 0.29 0.00 0.00 0.00 0.00 0.00 57.16 57.44 2btc n GLU 186 Cb 0.21 -1.65 -0.00 0.00 0.00 0.00 0.00 31.44 30.00 2btc n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2btc n GLY 187 N 0.18 -1.99 1.93 -1.84 0.00 -0.23 -4.41 105.19 98.82 2btc n GLY 187 Ca 0.03 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2btc n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2btc n GLY 188 N -0.16 3.04 2.81 -0.02 0.00 -0.11 -4.87 105.19 105.89 2btc n GLY 188 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2btc n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2btc s LYS 188 N -0.30 0.25 -0.01 1.61 1.02 -1.26 -3.86 119.74 117.19 2btc s LYS 188 Ca 0.00 0.09 -0.30 0.00 0.02 0.00 0.00 55.97 55.78 2btc s LYS 188 Cb 0.00 -0.44 0.11 0.00 -0.52 0.00 0.00 37.83 36.99 2btc s LYS 188 CO 0.00 -0.13 1.20 0.34 -0.92 0.00 0.00 175.35 175.84 2btc s ASP 189 N 0.99 -0.10 0.65 2.83 -1.08 -0.73 -4.34 116.67 114.88 2btc s ASP 189 Ca -0.10 -0.16 -0.09 0.00 -0.52 0.00 0.00 52.55 51.68 2btc s ASP 189 Cb -0.13 0.23 0.01 0.00 -1.46 0.00 0.00 42.92 41.57 2btc s ASP 189 CO -0.02 -0.42 1.01 -0.94 0.52 0.00 0.00 175.17 175.32 2btc s SER 190 N -2.84 5.51 0.36 -0.34 1.04 -1.26 -0.56 113.70 115.61 2btc s SER 190 Ca 0.13 0.93 -0.11 0.00 0.48 0.00 0.00 55.95 57.38 2btc s SER 190 Cb 0.03 -1.82 0.03 0.00 0.10 0.00 0.00 66.02 64.36 2btc s SER 190 CO -0.03 -1.22 0.66 0.00 0.98 0.00 0.00 173.24 173.63 2btc n GLN 192 N -0.53 1.67 0.00 0.00 3.00 -1.26 -0.89 117.38 119.36 2btc n GLN 192 Ca -0.05 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.55 2btc n GLN 192 Cb 0.61 -2.32 0.00 0.00 0.00 0.00 0.00 30.24 28.53 2btc n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2btc n GLY 193 N 3.13 0.61 0.02 1.08 0.00 -1.26 -0.34 105.19 108.42 2btc n GLY 193 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 2btc n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2btc n ASP 194 N 0.00 0.65 -4.56 1.61 8.00 -0.07 -3.93 116.55 118.26 2btc n ASP 194 Ca 0.00 -0.37 -0.45 0.00 0.71 0.00 0.00 54.79 54.68 2btc n ASP 194 Cb 0.00 0.63 -0.02 0.00 -0.02 0.00 0.00 41.12 41.71 2btc n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2btc n SER 195 N -1.72 0.83 0.00 -2.24 7.64 -1.26 -1.99 113.62 114.88 2btc n SER 195 Ca 0.04 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.08 2btc n SER 195 Cb 0.38 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.35 2btc n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2btc n GLY 196 N 1.36 2.49 3.90 0.23 0.00 0.13 0.04 105.19 113.34 2btc n GLY 196 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2btc n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2btc s GLY 197 N -1.88 1.68 0.29 -0.02 0.00 -0.84 -3.29 107.32 103.26 2btc s GLY 197 Ca 0.00 -0.92 -0.18 0.00 0.00 0.00 0.00 44.72 43.62 2btc s GLY 197 CO 0.00 -0.28 0.75 2.56 0.00 0.00 0.00 173.10 176.13 2btc s PRO 198 N -5.71 4.15 -0.23 2.90 0.04 -1.26 -1.17 135.00 133.72 2btc s PRO 198 Ca 0.68 0.82 0.02 0.00 0.04 0.00 0.00 61.00 62.56 2btc s PRO 198 Cb -0.08 -2.63 0.05 0.00 0.04 0.00 0.00 34.50 31.89 2btc s PRO 198 CO 0.51 0.25 -0.11 0.08 0.04 0.00 0.00 177.00 177.78 2btc s VAL 199 N -1.78 1.90 -0.13 -0.36 1.01 -0.49 -3.37 120.40 117.19 2btc s VAL 199 Ca 0.50 -1.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 2btc s VAL 199 Cb -0.13 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 2btc s VAL 199 CO 0.19 0.06 -0.11 -0.69 0.00 0.00 0.00 175.10 174.55 2btc s VAL 200 N 1.25 3.25 -0.04 2.92 1.01 -0.24 -1.02 120.40 127.52 2btc s VAL 200 Ca -0.05 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.35 2btc s VAL 200 Cb -0.18 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 33.85 2btc s VAL 200 CO -0.07 0.53 -0.07 0.00 0.00 0.00 0.00 175.10 175.49 2btc n SER 202 N 3.77 -4.28 0.00 0.00 7.64 -1.26 -0.83 113.62 118.65 2btc n SER 202 Ca -0.23 0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.90 2btc n SER 202 Cb 0.52 -3.75 0.00 0.00 -1.01 0.00 0.00 64.21 59.97 2btc n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2btc n GLY 203 N -0.59 0.55 3.35 0.23 0.00 -1.26 -5.03 105.19 102.44 2btc n GLY 203 Ca -0.17 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.38 2btc n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2btc s LYS 204 N -0.48 1.29 -0.46 1.61 -0.14 -0.01 -4.09 119.74 117.46 2btc s LYS 204 Ca 0.00 -1.28 -0.29 0.00 -1.36 0.00 0.00 55.97 53.04 2btc s LYS 204 Cb 0.00 -1.70 0.02 0.00 -1.68 0.00 0.00 37.83 34.47 2btc s LYS 204 CO 0.00 0.40 1.33 -1.17 -0.76 0.00 0.00 175.35 175.15 2btc s LEU 209 N -2.02 3.56 -0.04 3.17 2.96 0.07 -1.32 118.68 125.06 2btc s LEU 209 Ca 0.11 0.60 0.15 0.00 -0.22 0.00 0.00 54.13 54.78 2btc s LEU 209 Cb -0.10 -3.44 -0.23 0.00 0.50 0.00 0.00 46.19 42.91 2btc s LEU 209 CO 0.05 -1.44 0.29 0.00 -1.32 0.00 0.00 176.35 173.94 2btc n GLN 210 N 8.14 0.68 -3.94 1.98 1.13 -0.19 -4.13 117.38 121.05 2btc n GLN 210 Ca 0.14 -0.12 -0.09 0.00 -1.94 0.00 0.00 57.00 54.99 2btc n GLN 210 Cb 0.49 -1.38 -0.08 0.00 0.11 0.00 0.00 30.24 29.38 2btc n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2btc s GLY 211 N -4.00 0.34 -0.06 1.08 0.00 -0.88 -1.59 107.32 102.21 2btc s GLY 211 Ca -0.06 -0.84 0.04 0.00 0.00 0.00 0.00 44.72 43.86 2btc s GLY 211 CO 0.65 -0.91 -0.18 -0.42 0.00 0.00 0.00 173.10 172.23 2btc s ILE 212 N -3.92 1.55 0.07 0.90 1.01 -1.07 -1.40 121.20 118.34 2btc s ILE 212 Ca 0.11 -0.75 -0.31 0.00 0.00 0.00 0.00 60.65 59.71 2btc s ILE 212 Cb 0.05 -1.35 -0.09 0.00 0.01 0.00 0.00 42.46 41.08 2btc s ILE 212 CO -0.06 0.44 1.81 -0.69 0.00 0.00 0.00 174.94 176.44 2btc s VAL 213 N 0.28 2.88 0.01 2.92 1.01 -0.31 -1.44 120.40 125.75 2btc s VAL 213 Ca -0.11 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.08 2btc s VAL 213 Cb -0.15 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2btc s VAL 213 CO 0.04 -0.01 0.00 -0.24 0.00 0.00 0.00 175.10 174.90 2btc n SER 214 N 6.30 0.12 -3.31 3.32 2.88 -1.03 -0.69 113.62 121.21 2btc n SER 214 Ca 0.18 0.02 -0.10 0.00 -1.33 0.00 0.00 58.87 57.64 2btc n SER 214 Cb 0.40 -0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 63.82 2btc n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2btc s TRP 215 N -1.12 0.35 -0.01 0.66 1.48 -0.95 -4.89 118.94 114.47 2btc s TRP 215 Ca 0.00 -0.84 -0.28 0.00 -1.06 0.00 0.00 56.10 53.92 2btc s TRP 215 Cb 0.00 0.49 0.10 0.00 -1.16 0.00 0.00 33.47 32.90 2btc s TRP 215 CO 0.00 -1.33 1.28 0.20 -4.06 0.00 0.00 176.95 173.04 2btc s GLY 216 N -3.08 -0.15 -0.82 3.67 0.00 -1.26 -0.58 107.32 105.10 2btc s GLY 216 Ca 0.20 0.10 -0.16 0.00 0.00 0.00 0.00 44.72 44.85 2btc s GLY 216 CO 0.13 4.89 0.86 -0.45 0.00 0.00 0.00 173.10 178.52 2btc s SER 217 N -3.70 6.62 0.45 1.64 0.15 -1.26 -4.91 113.70 112.69 2btc s SER 217 Ca 0.27 -2.29 0.00 0.00 0.70 0.00 0.00 55.95 54.63 2btc s SER 217 Cb 0.00 -2.28 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 2btc s SER 217 CO -0.01 -0.81 0.00 0.61 1.20 0.00 0.00 173.24 174.23 2btc n GLY 219 N 4.67 0.20 2.86 9.45 0.00 -1.26 -4.68 105.19 116.43 2btc n GLY 219 Ca 0.13 -0.90 -0.14 0.00 0.00 0.00 0.00 46.02 45.11 2btc n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2btc n ALA 221 N 3.48 -0.71 -2.07 0.00 0.00 -1.26 -4.67 120.51 115.27 2btc n ALA 221 Ca -0.18 0.14 -0.35 0.00 0.00 0.00 0.00 53.44 53.05 2btc n ALA 221 Cb 0.56 -1.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.00 2btc n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2btc s GLN 221 N -5.08 4.19 0.14 0.00 -1.52 -1.26 -0.93 119.66 115.20 2btc s GLN 221 Ca 0.02 0.85 -0.34 0.00 -1.95 0.00 0.00 55.36 53.93 2btc s GLN 221 Cb -0.01 -2.68 -0.14 0.00 -0.22 0.00 0.00 33.01 29.96 2btc s GLN 221 CO 0.02 0.28 1.54 1.63 -0.25 0.00 0.00 175.29 178.51 2btc n LYS 222 N 0.25 1.95 -1.39 2.91 5.02 -1.26 -1.73 118.16 123.92 2btc n LYS 222 Ca 0.01 0.71 -0.13 0.00 -2.02 0.00 0.00 58.31 56.87 2btc n LYS 222 Cb 0.52 -2.45 -0.06 0.00 -0.02 0.00 0.00 35.03 33.02 2btc n LYS 222 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2btc n ASN 223 N 3.32 -5.37 -3.32 4.39 3.02 0.77 -4.91 115.26 113.15 2btc n ASN 223 Ca 0.17 0.33 -0.25 0.00 -0.03 0.00 0.00 54.58 54.80 2btc n ASN 223 Cb 0.27 -4.06 -0.08 0.00 -0.61 0.00 0.00 39.78 35.30 2btc n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2btc n LYS 224 N -1.61 1.22 -0.96 3.52 4.76 -0.70 -4.74 118.16 119.65 2btc n LYS 224 Ca -0.13 -3.69 -0.31 0.00 -2.87 0.00 0.00 58.31 51.31 2btc n LYS 224 Cb 0.57 -1.61 0.14 0.00 -1.84 0.00 0.00 35.03 32.28 2btc n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2btc s PRO 225 N -1.42 1.51 0.57 1.97 0.04 -1.26 -4.21 135.00 132.19 2btc s PRO 225 Ca 0.36 1.33 -0.18 0.00 0.04 0.00 0.00 61.00 62.54 2btc s PRO 225 Cb 0.14 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.83 2btc s PRO 225 CO -0.10 -2.22 1.12 0.20 0.04 0.00 0.00 177.00 176.04 2btc s GLY 226 N -3.01 2.51 -0.06 0.56 0.00 -1.15 -4.72 107.32 101.44 2btc s GLY 226 Ca 0.64 0.74 0.02 0.00 0.00 0.00 0.00 44.72 46.12 2btc s GLY 226 CO 0.57 1.09 -0.12 0.14 0.00 0.00 0.00 173.10 174.79 2btc s VAL 227 N -1.93 3.28 0.03 1.40 1.01 0.25 -1.85 120.40 122.60 2btc s VAL 227 Ca 0.71 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 62.09 2btc s VAL 227 Cb -0.22 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 2btc s VAL 227 CO 0.30 0.59 -0.12 -0.31 0.00 0.00 0.00 175.10 175.56 2btc s TYR 228 N -0.66 1.06 0.16 5.22 2.02 0.13 -2.24 117.35 123.05 2btc s TYR 228 Ca 0.10 -0.34 -0.30 0.00 -0.37 0.00 0.00 57.07 56.15 2btc s TYR 228 Cb -0.11 -0.64 -0.08 0.00 -0.40 0.00 0.00 41.96 40.73 2btc s TYR 228 CO 0.01 0.01 1.30 0.99 -1.57 0.00 0.00 175.55 176.29 2btc s THR 229 N -0.83 3.37 -0.96 -0.71 2.01 -0.52 -1.37 115.64 116.62 2btc s THR 229 Ca 0.00 1.08 -0.22 0.00 0.31 0.00 0.00 61.69 62.86 2btc s THR 229 Cb -0.07 -3.69 0.07 0.00 0.01 0.00 0.00 72.50 68.82 2btc s THR 229 CO 0.01 0.14 1.32 -0.75 -0.69 0.00 0.00 174.62 174.65 2btc s LYS 230 N 0.25 3.54 0.53 4.92 2.20 -0.31 -2.59 119.74 128.29 2btc s LYS 230 Ca 0.58 -1.24 0.19 0.00 -0.36 0.00 0.00 55.97 55.14 2btc s LYS 230 Cb -0.35 -5.09 1.36 0.00 -1.51 0.00 0.00 37.83 32.24 2btc s LYS 230 CO 0.35 -2.06 2.15 0.28 -0.36 0.00 0.00 175.35 175.71 2btc h VAL 231 N 6.42 0.90 0.00 4.02 2.07 -1.60 -2.23 116.25 125.83 2btc h VAL 231 Ca 0.13 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.65 2btc h VAL 231 Cb 1.02 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2btc h VAL 231 CO 1.31 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.90 2btc n ASN 233 N -2.89 0.16 -0.19 0.00 3.02 -0.84 -3.72 115.26 110.81 2btc n ASN 233 Ca -0.01 0.52 0.02 0.00 -0.03 0.00 0.00 54.58 55.08 2btc n ASN 233 Cb 0.15 -0.56 0.03 0.00 -0.61 0.00 0.00 39.78 38.78 2btc n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2btc n TYR 234 N -1.66 0.05 -0.36 3.10 4.01 0.02 -4.78 117.16 117.54 2btc n TYR 234 Ca 0.06 -0.15 -0.01 0.00 -0.16 0.00 0.00 57.90 57.64 2btc n TYR 234 Cb 0.31 -0.01 0.12 0.00 -0.31 0.00 0.00 39.34 39.45 2btc n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2btc h VAL 235 N 0.79 1.20 -0.29 -0.72 2.07 -1.63 0.17 116.25 117.84 2btc h VAL 235 Ca 0.00 -0.43 -0.13 0.00 0.82 0.00 0.00 66.70 66.95 2btc h VAL 235 Cb 0.29 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 2btc h VAL 235 CO 0.00 0.23 -0.36 0.77 0.02 0.00 0.00 177.57 178.23 2btc h SER 236 N 1.26 0.69 -0.09 0.57 4.64 -1.88 -1.40 113.55 117.34 2btc h SER 236 Ca 0.37 -0.29 -0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2btc h SER 236 Cb -0.06 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 61.83 2btc h SER 236 CO -0.10 0.99 0.05 -0.25 -0.87 0.00 0.00 176.83 176.64 2btc h TRP 237 N 0.55 0.13 -0.06 4.77 7.01 -1.67 -0.57 115.95 126.11 2btc h TRP 237 Ca 0.06 -0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.09 2btc h TRP 237 Cb 0.87 -0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 27.85 2btc h TRP 237 CO 0.04 0.17 -0.17 0.82 -2.79 0.00 0.00 178.44 176.51 2btc h ILE 238 N 0.05 0.58 -0.74 2.65 2.04 -0.85 -0.53 117.51 120.71 2btc h ILE 238 Ca 0.03 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 2btc h ILE 238 Cb 0.08 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 2btc h ILE 238 CO -0.00 0.00 0.34 0.11 0.00 0.00 0.00 178.15 178.60 2btc h LYS 239 N -0.25 1.07 0.23 2.37 1.57 -1.02 -0.48 116.57 120.07 2btc h LYS 239 Ca 0.07 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2btc h LYS 239 Cb 0.35 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2btc h LYS 239 CO -0.20 0.85 -0.11 0.37 -0.57 0.00 0.00 179.45 179.78 2btc h GLN 240 N 1.04 -0.29 -0.33 3.15 -0.00 -0.99 -1.96 115.11 115.72 2btc h GLN 240 Ca 0.25 0.02 0.03 0.00 -0.00 0.00 0.00 58.65 58.95 2btc h GLN 240 Cb 0.14 0.07 -0.03 0.00 0.00 0.00 0.00 27.48 27.65 2btc h GLN 240 CO -0.03 -0.16 0.15 1.15 0.00 0.00 0.00 178.83 179.94 2btc h THR 241 N -0.35 0.96 -0.90 2.39 2.02 -0.69 -1.88 112.91 114.47 2btc h THR 241 Ca -0.03 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 2btc h THR 241 Cb 0.27 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 2btc h THR 241 CO 0.05 0.06 0.50 0.40 0.37 0.00 0.00 175.52 176.90 2btc h ILE 242 N 0.32 1.26 0.00 3.11 5.03 -1.03 -2.49 117.51 123.71 2btc h ILE 242 Ca 0.14 -0.64 0.00 0.00 -0.12 0.00 0.00 64.86 64.24 2btc h ILE 242 Cb 0.08 0.03 0.00 0.00 -3.03 0.00 0.00 36.82 33.90 2btc h ILE 242 CO -0.12 0.29 0.00 0.00 -0.68 0.00 0.00 178.15 177.65 2btc h ALA 243 N 1.28 1.00 -0.42 1.87 0.00 -0.93 -3.28 119.26 118.77 2btc h ALA 243 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2btc h ALA 243 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2btc h ALA 243 CO -0.05 0.00 0.00 0.43 0.00 0.00 0.00 179.25 179.63 2btc n SER 244 N -2.46 3.66 0.00 0.00 7.64 -0.74 -5.10 113.62 116.62 2btc n SER 244 Ca 0.05 -2.36 0.00 0.00 1.01 0.00 0.00 58.87 57.57 2btc n SER 244 Cb 0.43 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 2btc n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62