#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1taw s VAL 17 N 0.00 5.37 -0.09 1.39 1.01 0.56 -4.07 120.40 124.58 1taw s VAL 17 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1taw s VAL 17 Cb 0.00 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1taw s VAL 17 CO 0.00 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.09 1taw n GLY 18 N 3.92 0.48 0.00 4.51 0.00 -1.25 -1.52 105.19 111.33 1taw n GLY 18 Ca -0.15 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1taw n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1taw n GLY 19 N -2.76 1.15 3.23 -0.02 0.00 -1.26 -4.90 105.19 100.63 1taw n GLY 19 Ca -0.01 -1.81 -0.09 0.00 0.00 0.00 0.00 46.02 44.11 1taw n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1taw s TYR 20 N 1.48 0.11 -0.05 1.61 1.13 0.32 -4.92 117.35 117.02 1taw s TYR 20 Ca 0.00 -0.52 -0.30 0.00 -1.41 0.00 0.00 57.07 54.84 1taw s TYR 20 Cb 0.00 -0.01 -0.06 0.00 -1.10 0.00 0.00 41.96 40.79 1taw s TYR 20 CO 0.00 -0.58 1.70 0.99 -2.51 0.00 0.00 175.55 175.15 1taw s THR 21 N -3.86 3.52 0.12 -3.49 2.01 -1.26 0.10 115.64 112.77 1taw s THR 21 Ca 0.05 0.62 -0.20 0.00 0.31 0.00 0.00 61.69 62.47 1taw s THR 21 Cb 0.04 -3.41 -0.08 0.00 0.01 0.00 0.00 72.50 69.06 1taw s THR 21 CO -0.11 -0.07 1.76 0.00 -0.69 0.00 0.00 174.62 175.51 1taw n GLY 23 N -1.14 3.40 3.69 0.00 0.00 -1.26 -4.82 105.19 105.06 1taw n GLY 23 Ca -0.04 -1.49 -0.54 0.00 0.00 0.00 0.00 46.02 43.96 1taw n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1taw n ALA 24 N 0.32 0.29 -1.86 4.61 0.00 -1.26 -2.22 120.51 120.39 1taw n ALA 24 Ca 0.00 0.33 -0.16 0.00 0.00 0.00 0.00 53.44 53.61 1taw n ALA 24 Cb 0.00 -2.35 -0.04 0.00 0.00 0.00 0.00 19.45 17.06 1taw n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1taw n ASN 25 N 6.06 -4.92 0.00 0.00 3.02 -1.26 -4.89 115.26 113.28 1taw n ASN 25 Ca 0.25 0.21 0.13 0.00 -0.03 0.00 0.00 54.58 55.14 1taw n ASN 25 Cb 0.20 -3.94 0.39 0.00 -0.61 0.00 0.00 39.78 35.82 1taw n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1taw n THR 26 N -3.22 0.01 -3.29 3.41 -2.24 -0.94 -3.97 114.28 104.04 1taw n THR 26 Ca -0.18 -0.01 -0.26 0.00 -2.27 0.00 0.00 64.05 61.34 1taw n THR 26 Cb 0.59 -0.04 -0.07 0.00 -2.10 0.00 0.00 70.33 68.71 1taw n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1taw n VAL 27 N -1.52 1.28 0.17 2.28 0.31 -1.26 -4.97 118.33 114.62 1taw n VAL 27 Ca 0.06 -4.82 0.10 0.00 -0.01 0.00 0.00 64.34 59.67 1taw n VAL 27 Cb 0.34 -1.91 0.55 0.00 -0.91 0.00 0.00 33.84 31.91 1taw n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1taw n PRO 28 N 0.92 0.13 0.00 5.55 -0.04 -1.25 -1.72 135.00 138.58 1taw n PRO 28 Ca 0.27 0.63 0.12 0.00 -0.04 0.00 0.00 63.50 64.47 1taw n PRO 28 Cb 0.46 -2.01 0.18 0.00 -0.04 0.00 0.00 33.50 32.09 1taw n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1taw n TYR 29 N -2.23 0.00 -2.41 0.54 0.18 -1.17 -1.94 117.16 110.13 1taw n TYR 29 Ca -0.01 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.35 1taw n TYR 29 Cb 0.11 -0.15 -0.03 0.00 -0.38 0.00 0.00 39.34 38.88 1taw n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1taw s GLN 30 N -2.86 4.40 0.23 -3.48 2.00 -0.70 -0.75 119.66 118.50 1taw s GLN 30 Ca 0.14 1.77 0.10 0.00 -2.00 0.00 0.00 55.36 55.37 1taw s GLN 30 Cb 0.18 -3.40 -0.05 0.00 0.80 0.00 0.00 33.01 30.54 1taw s GLN 30 CO 0.69 -0.32 -0.19 0.14 -0.50 0.00 0.00 175.29 175.11 1taw s VAL 31 N 1.39 2.19 -0.13 1.34 -7.23 -0.49 -4.55 120.40 112.92 1taw s VAL 31 Ca 0.59 -2.22 -0.01 0.00 -1.81 0.00 0.00 61.98 58.52 1taw s VAL 31 Cb -0.29 -2.14 -0.02 0.00 0.56 0.00 0.00 36.38 34.49 1taw s VAL 31 CO 0.28 -0.38 -0.09 -0.55 -0.31 0.00 0.00 175.10 174.04 1taw s SER 32 N -3.18 4.33 -0.16 4.85 0.15 -0.60 -2.15 113.70 116.94 1taw s SER 32 Ca 0.24 -0.23 -0.17 0.00 0.70 0.00 0.00 55.95 56.49 1taw s SER 32 Cb -0.05 -1.63 -0.04 0.00 -1.71 0.00 0.00 66.02 62.60 1taw s SER 32 CO 0.11 0.18 0.44 -0.76 1.20 0.00 0.00 173.24 174.41 1taw s LEU 33 N 0.25 4.21 -0.03 3.45 1.43 0.58 -0.86 118.68 127.73 1taw s LEU 33 Ca -0.07 0.66 0.04 0.00 -1.03 0.00 0.00 54.13 53.73 1taw s LEU 33 Cb -0.15 -2.60 -0.00 0.00 0.03 0.00 0.00 46.19 43.47 1taw s LEU 33 CO 0.04 -0.04 -0.13 0.21 0.23 0.00 0.00 176.35 176.67 1taw s ASN 34 N 0.81 1.61 -0.35 2.29 3.84 0.17 -1.40 114.94 121.90 1taw s ASN 34 Ca 0.22 -0.25 0.15 0.00 0.21 0.00 0.00 52.86 53.19 1taw s ASN 34 Cb -0.15 -0.35 0.41 0.00 -0.55 0.00 0.00 41.25 40.62 1taw s ASN 34 CO 0.09 0.12 0.87 -1.54 -2.79 0.00 0.00 177.10 173.85 1taw n SER 37 N 3.06 1.36 0.00 -4.21 3.41 -1.26 -0.65 113.62 115.34 1taw n SER 37 Ca -0.17 -2.88 0.00 0.00 -0.26 0.00 0.00 58.87 55.56 1taw n SER 37 Cb 0.54 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 1taw n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1taw n GLY 38 N 0.06 3.25 3.43 5.00 0.00 -1.26 -4.97 105.19 110.70 1taw n GLY 38 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1taw n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1taw s TYR 39 N -2.88 -0.55 0.00 1.61 1.13 -1.26 -5.13 117.35 110.28 1taw s TYR 39 Ca 0.00 0.46 -0.30 0.00 -1.41 0.00 0.00 57.07 55.82 1taw s TYR 39 Cb 0.00 0.52 -0.05 0.00 -1.10 0.00 0.00 41.96 41.33 1taw s TYR 39 CO 0.00 -0.80 1.36 -1.58 -2.51 0.00 0.00 175.55 172.02 1taw s HIS 40 N -3.26 2.96 -0.00 -3.49 5.65 -1.26 -4.35 115.29 111.54 1taw s HIS 40 Ca -0.01 0.91 0.00 0.00 0.25 0.00 0.00 55.06 56.21 1taw s HIS 40 Cb -0.01 -3.62 -0.01 0.00 -1.18 0.00 0.00 32.58 27.77 1taw s HIS 40 CO -0.09 -2.21 0.01 1.97 -0.65 0.00 0.00 174.74 173.77 1taw n PHE 41 N 5.16 0.00 -3.57 3.88 -1.74 -0.49 -4.99 117.46 115.71 1taw n PHE 41 Ca 0.12 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.91 1taw n PHE 41 Cb 0.44 -0.01 -0.03 0.00 1.52 0.00 0.00 39.48 41.40 1taw n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1taw n GLY 43 N -0.36 2.39 3.83 0.00 0.00 0.10 -0.30 105.19 110.85 1taw n GLY 43 Ca -0.14 -2.19 0.02 0.00 0.00 0.00 0.00 46.02 43.71 1taw n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1taw s GLY 44 N -2.74 -0.23 -0.03 -0.02 0.00 -0.91 -3.98 107.32 99.42 1taw s GLY 44 Ca 0.17 0.28 0.03 0.00 0.00 0.00 0.00 44.72 45.20 1taw s GLY 44 CO 0.11 3.25 -0.13 -0.56 0.00 0.00 0.00 173.10 175.77 1taw s SER 45 N -3.46 1.58 -0.31 1.64 0.01 -0.07 -1.40 113.70 111.68 1taw s SER 45 Ca 0.23 -0.25 -0.27 0.00 1.31 0.00 0.00 55.95 56.98 1taw s SER 45 Cb 0.02 -0.35 0.01 0.00 0.21 0.00 0.00 66.02 65.91 1taw s SER 45 CO -0.02 0.12 0.95 -0.22 0.41 0.00 0.00 173.24 174.48 1taw s LEU 46 N -0.01 4.01 0.03 2.44 2.96 0.07 -0.62 118.68 127.57 1taw s LEU 46 Ca -0.01 0.90 0.22 0.00 -0.22 0.00 0.00 54.13 55.03 1taw s LEU 46 Cb -0.08 -3.34 -0.09 0.00 0.50 0.00 0.00 46.19 43.18 1taw s LEU 46 CO 0.01 -0.75 0.88 2.30 -1.32 0.00 0.00 176.35 177.47 1taw n ILE 47 N 5.69 0.13 -3.77 6.68 -5.35 -0.20 -1.17 119.36 121.36 1taw n ILE 47 Ca 0.08 -0.28 -0.02 0.00 -0.27 0.00 0.00 62.75 62.27 1taw n ILE 47 Cb 0.47 0.26 -0.00 0.00 -1.74 0.00 0.00 39.64 38.63 1taw n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1taw s ASN 48 N -3.99 -0.10 0.00 7.28 2.20 -1.20 -4.55 114.94 114.58 1taw s ASN 48 Ca 0.02 -0.41 0.00 0.00 -0.94 0.00 0.00 52.86 51.53 1taw s ASN 48 Cb 0.14 0.41 0.00 0.00 -2.00 0.00 0.00 41.25 39.80 1taw s ASN 48 CO 0.84 -0.77 0.79 -1.54 -2.94 0.00 0.00 177.10 173.47 1taw n SER 49 N -0.68 0.00 0.00 3.54 3.41 -1.26 -2.54 113.62 116.09 1taw n SER 49 Ca -0.05 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 1taw n SER 49 Cb 0.61 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 1taw n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1taw n GLN 50 N -1.29 -0.04 -4.57 4.33 7.27 -1.26 0.91 117.38 122.73 1taw n GLN 50 Ca 0.00 -0.19 -0.22 0.00 0.07 0.00 0.00 57.00 56.67 1taw n GLN 50 Cb 0.08 -0.58 -0.15 0.00 2.41 0.00 0.00 30.24 32.00 1taw n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1taw s TRP 51 N -0.03 1.17 -0.03 3.69 0.52 -1.05 -1.37 118.94 121.84 1taw s TRP 51 Ca 0.00 -0.25 0.06 0.00 0.02 0.00 0.00 56.10 55.93 1taw s TRP 51 Cb 0.00 -0.78 -0.01 0.00 -1.15 0.00 0.00 33.47 31.53 1taw s TRP 51 CO 0.00 -0.06 -0.21 0.08 0.02 0.00 0.00 176.95 176.79 1taw s VAL 52 N -0.15 1.67 -0.12 4.03 1.01 -0.24 -1.04 120.40 125.56 1taw s VAL 52 Ca 0.02 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.07 1taw s VAL 52 Cb -0.07 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 1taw s VAL 52 CO 0.00 0.47 0.04 -0.69 0.00 0.00 0.00 175.10 174.92 1taw s VAL 53 N -0.35 4.63 0.02 2.92 1.01 0.21 -0.42 120.40 128.42 1taw s VAL 53 Ca 0.04 -0.11 -0.00 0.00 0.00 0.00 0.00 61.98 61.91 1taw s VAL 53 Cb -0.09 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.28 1taw s VAL 53 CO 0.00 0.57 0.04 -0.24 0.00 0.00 0.00 175.10 175.47 1taw n SER 54 N 2.51 -0.10 -4.87 3.32 2.88 -0.36 -0.90 113.62 116.10 1taw n SER 54 Ca -0.18 -1.13 -0.33 0.00 -1.33 0.00 0.00 58.87 55.89 1taw n SER 54 Cb 0.53 0.18 -0.05 0.00 -0.75 0.00 0.00 64.21 64.12 1taw n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1taw s ALA 55 N -1.63 3.63 0.26 -1.46 0.00 -1.26 -1.43 121.76 119.86 1taw s ALA 55 Ca 0.02 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 51.63 1taw s ALA 55 Cb -0.00 -2.38 0.30 0.00 0.00 0.00 0.00 23.12 21.04 1taw s ALA 55 CO 0.01 0.53 1.85 0.00 0.00 0.00 0.00 175.76 178.16 1taw h ALA 56 N 3.01 1.20 0.00 0.00 0.00 -1.72 -2.03 119.26 119.73 1taw h ALA 56 Ca -0.47 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1taw h ALA 56 Cb 1.18 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1taw h ALA 56 CO 0.68 0.60 0.00 -2.39 0.00 0.00 0.00 179.25 178.15 1taw n HIS 57 N -4.31 0.00 1.31 0.00 1.44 -1.26 -1.53 115.22 110.86 1taw n HIS 57 Ca 0.07 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.91 1taw n HIS 57 Cb 0.15 -0.17 0.40 0.00 0.12 0.00 0.00 29.99 30.48 1taw n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1taw n TYR 59 N 0.52 2.03 -3.52 0.00 9.36 -0.58 -4.99 117.16 119.98 1taw n TYR 59 Ca 0.18 0.45 -0.11 0.00 3.32 0.00 0.00 57.90 61.74 1taw n TYR 59 Cb 0.42 -2.44 -0.03 0.00 -0.63 0.00 0.00 39.34 36.66 1taw n TYR 59 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1taw s LYS 60 N -0.19 1.20 0.06 2.98 1.02 -1.26 -5.16 119.74 118.39 1taw s LYS 60 Ca 0.71 -0.58 -0.13 0.00 0.02 0.00 0.00 55.97 55.99 1taw s LYS 60 Cb -0.69 0.54 -0.06 0.00 -0.52 0.00 0.00 37.83 37.10 1taw s LYS 60 CO 0.48 -0.50 0.44 -1.54 -0.92 0.00 0.00 175.35 173.31 1taw s SER 61 N -2.78 6.76 -0.85 2.83 1.04 -1.26 -4.53 113.70 114.92 1taw s SER 61 Ca 0.02 0.94 -0.03 0.00 0.48 0.00 0.00 55.95 57.36 1taw s SER 61 Cb 0.00 -2.24 -0.03 0.00 0.10 0.00 0.00 66.02 63.85 1taw s SER 61 CO -0.12 0.22 0.77 0.61 0.98 0.00 0.00 173.24 175.69 1taw n GLY 62 N 1.25 -1.14 3.82 7.32 0.00 -1.26 -5.01 105.19 110.18 1taw n GLY 62 Ca -0.10 0.49 -0.37 0.00 0.00 0.00 0.00 46.02 46.05 1taw n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1taw s ILE 63 N -3.18 5.41 -0.20 -0.61 1.01 -1.26 -4.75 121.20 117.62 1taw s ILE 63 Ca 0.21 0.31 -0.05 0.00 0.00 0.00 0.00 60.65 61.11 1taw s ILE 63 Cb -0.03 -3.48 -0.03 0.00 0.01 0.00 0.00 42.46 38.94 1taw s ILE 63 CO 0.71 0.55 0.01 -1.58 0.00 0.00 0.00 174.94 174.63 1taw s GLN 64 N -0.53 3.66 -0.13 2.79 0.74 0.18 -1.07 119.66 125.30 1taw s GLN 64 Ca 0.14 -0.50 -0.16 0.00 0.05 0.00 0.00 55.36 54.89 1taw s GLN 64 Cb -0.12 -3.11 -0.04 0.00 1.10 0.00 0.00 33.01 30.83 1taw s GLN 64 CO 0.03 0.02 0.41 0.08 -0.55 0.00 0.00 175.29 175.29 1taw s VAL 65 N 0.98 5.22 -0.23 1.34 1.01 0.12 -0.66 120.40 128.18 1taw s VAL 65 Ca 0.02 0.80 -0.03 0.00 0.00 0.00 0.00 61.98 62.77 1taw s VAL 65 Cb -0.14 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.50 1taw s VAL 65 CO 0.02 0.37 -0.05 -0.13 0.00 0.00 0.00 175.10 175.30 1taw s ARG 66 N 0.45 3.17 0.19 2.72 0.52 -0.04 -1.12 118.95 124.84 1taw s ARG 66 Ca 0.22 -0.76 0.08 0.00 -0.52 0.00 0.00 55.73 54.76 1taw s ARG 66 Cb -0.14 -2.98 -0.04 0.00 0.52 0.00 0.00 34.95 32.30 1taw s ARG 66 CO 0.08 -0.27 -0.02 -0.51 0.02 0.00 0.00 175.30 174.60 1taw s LEU 67 N 1.42 3.22 -1.04 2.53 1.02 -0.00 -1.56 118.68 124.26 1taw s LEU 67 Ca 0.04 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 53.72 1taw s LEU 67 Cb -0.15 -1.86 0.00 0.00 0.02 0.00 0.00 46.19 44.20 1taw s LEU 67 CO -0.04 0.08 0.00 0.61 0.02 0.00 0.00 176.35 177.02 1taw n GLY 69 N -0.19 0.90 3.81 -3.19 0.00 -1.26 -1.04 105.19 104.22 1taw n GLY 69 Ca -0.09 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.02 1taw n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1taw s GLU 70 N -3.23 4.24 0.11 1.61 2.56 -1.26 -4.47 118.70 118.25 1taw s GLU 70 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 54.97 55.79 1taw s GLU 70 Cb 0.00 -2.99 0.00 0.00 2.00 0.00 0.00 34.13 33.14 1taw s GLU 70 CO 0.00 0.47 0.00 -3.47 -0.56 0.00 0.00 175.26 171.70 1taw n ASP 71 N 1.00 0.15 -4.49 -1.70 2.03 -1.26 -4.68 116.55 107.60 1taw n ASP 71 Ca -0.04 0.18 -0.43 0.00 0.52 0.00 0.00 54.79 55.01 1taw n ASP 71 Cb 0.51 0.06 -0.07 0.00 -0.72 0.00 0.00 41.12 40.91 1taw n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1taw s ASN 72 N -4.87 6.27 0.07 1.67 3.84 -1.25 -2.50 114.94 118.17 1taw s ASN 72 Ca 0.00 -0.61 0.18 0.00 0.21 0.00 0.00 52.86 52.64 1taw s ASN 72 Cb 0.00 -2.30 0.76 0.00 -0.55 0.00 0.00 41.25 39.15 1taw s ASN 72 CO 0.00 -0.83 1.57 2.30 -2.79 0.00 0.00 177.10 177.35 1taw n ILE 73 N 5.73 0.87 0.65 -5.21 -5.35 0.01 -3.07 119.36 112.99 1taw n ILE 73 Ca -0.04 0.21 0.11 0.00 -0.27 0.00 0.00 62.75 62.76 1taw n ILE 73 Cb 0.47 -0.99 -0.04 0.00 -1.74 0.00 0.00 39.64 37.34 1taw n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1taw n ASN 74 N -1.69 0.64 -4.07 7.28 3.02 -1.26 -4.87 115.26 114.30 1taw n ASN 74 Ca 0.03 -0.45 -0.29 0.00 -0.03 0.00 0.00 54.58 53.85 1taw n ASN 74 Cb 0.20 1.03 -0.17 0.00 -0.61 0.00 0.00 39.78 40.24 1taw n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1taw s VAL 75 N -3.17 1.57 -0.41 2.41 1.01 -1.18 -5.09 120.40 115.54 1taw s VAL 75 Ca 0.04 -0.69 -0.25 0.00 0.00 0.00 0.00 61.98 61.08 1taw s VAL 75 Cb 0.15 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 35.13 1taw s VAL 75 CO 0.84 0.45 0.88 -0.69 0.00 0.00 0.00 175.10 176.58 1taw s VAL 76 N 0.95 4.57 -1.27 2.92 1.01 -1.26 -4.71 120.40 122.61 1taw s VAL 76 Ca -0.07 0.87 0.27 0.00 0.00 0.00 0.00 61.98 63.05 1taw s VAL 76 Cb -0.15 -4.35 0.18 0.00 0.00 0.00 0.00 36.38 32.06 1taw s VAL 76 CO -0.01 -0.66 1.62 -0.62 0.00 0.00 0.00 175.10 175.43 1taw n GLU 77 N 6.86 0.30 -0.53 2.72 1.02 -1.26 -4.95 120.64 124.79 1taw n GLU 77 Ca 0.05 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 1taw n GLU 77 Cb 0.48 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 1taw n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1taw n GLY 78 N 1.43 1.15 0.85 0.62 0.00 -1.26 -4.88 105.19 103.11 1taw n GLY 78 Ca 0.09 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.18 1taw n GLY 78 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1taw n ASN 79 N 0.00 3.25 -4.81 1.61 6.94 -1.26 -5.00 115.26 115.98 1taw n ASN 79 Ca 0.00 -2.01 -0.23 0.00 -0.02 0.00 0.00 54.58 52.32 1taw n ASN 79 Cb 0.00 -0.31 0.08 0.00 -2.36 0.00 0.00 39.78 37.19 1taw n ASN 79 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1taw s GLU 80 N -1.02 2.05 -0.09 -3.83 8.01 -1.26 -4.83 118.70 117.73 1taw s GLU 80 Ca 0.31 -0.98 -0.01 0.00 0.01 0.00 0.00 54.97 54.30 1taw s GLU 80 Cb 0.16 -2.40 0.03 0.00 -4.31 0.00 0.00 34.13 27.61 1taw s GLU 80 CO 0.21 -1.14 -0.02 -0.65 0.01 0.00 0.00 175.26 173.67 1taw s GLN 81 N -4.98 0.88 -0.33 1.61 -0.21 -0.20 -4.98 119.66 111.44 1taw s GLN 81 Ca 0.62 -0.03 -0.09 0.00 0.02 0.00 0.00 55.36 55.89 1taw s GLN 81 Cb -0.07 -1.21 0.01 0.00 1.00 0.00 0.00 33.01 32.74 1taw s GLN 81 CO 0.42 -0.31 0.15 -0.06 -2.12 0.00 0.00 175.29 173.37 1taw s PHE 82 N 1.89 3.20 -0.04 0.91 0.08 -1.26 -0.82 117.98 121.94 1taw s PHE 82 Ca 0.05 -0.86 0.03 0.00 0.12 0.00 0.00 56.93 56.27 1taw s PHE 82 Cb -0.13 -2.35 0.00 0.00 -0.57 0.00 0.00 43.02 39.97 1taw s PHE 82 CO -0.06 -0.57 -0.13 0.42 -0.10 0.00 0.00 175.22 174.78 1taw s ILE 83 N 1.55 1.11 0.39 0.64 1.01 -0.27 -4.97 121.20 120.66 1taw s ILE 83 Ca 0.03 -0.53 -0.23 0.00 0.00 0.00 0.00 60.65 59.91 1taw s ILE 83 Cb -0.18 -0.97 -0.10 0.00 0.01 0.00 0.00 42.46 41.22 1taw s ILE 83 CO 0.05 0.33 0.96 -0.44 0.00 0.00 0.00 174.94 175.85 1taw s SER 84 N 0.15 7.02 0.10 3.58 0.01 -1.26 0.14 113.70 123.43 1taw s SER 84 Ca -0.04 1.79 -0.30 0.00 1.31 0.00 0.00 55.95 58.71 1taw s SER 84 Cb -0.10 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.51 1taw s SER 84 CO 0.01 -0.30 1.04 0.00 0.41 0.00 0.00 173.24 174.41 1taw s ALA 85 N -1.92 3.29 -0.09 1.44 0.00 -0.23 -0.29 121.76 123.95 1taw s ALA 85 Ca 0.58 0.68 0.00 0.00 0.00 0.00 0.00 51.96 53.23 1taw s ALA 85 Cb -0.14 -3.34 -0.25 0.00 0.00 0.00 0.00 23.12 19.39 1taw s ALA 85 CO 0.19 -0.18 0.48 -1.13 0.00 0.00 0.00 175.76 175.11 1taw n SER 86 N 3.06 1.66 -3.69 0.00 3.41 0.14 -4.72 113.62 113.48 1taw n SER 86 Ca 0.04 0.29 -0.13 0.00 -0.26 0.00 0.00 58.87 58.81 1taw n SER 86 Cb 0.48 -0.57 -0.09 0.00 -0.26 0.00 0.00 64.21 63.77 1taw n SER 86 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1taw s LYS 87 N -2.57 0.59 -0.29 4.33 -2.85 -1.15 -4.99 119.74 112.81 1taw s LYS 87 Ca -0.16 0.76 -0.01 0.00 -1.00 0.00 0.00 55.97 55.57 1taw s LYS 87 Cb 0.07 0.25 0.05 0.00 -2.06 0.00 0.00 37.83 36.15 1taw s LYS 87 CO 0.79 -0.09 -0.03 -1.12 0.10 0.00 0.00 175.35 175.00 1taw s SER 88 N 0.47 4.73 -0.47 0.03 0.01 -1.26 0.04 113.70 117.25 1taw s SER 88 Ca -0.02 -1.27 -0.15 0.00 1.31 0.00 0.00 55.95 55.82 1taw s SER 88 Cb -0.04 -1.67 0.07 0.00 0.21 0.00 0.00 66.02 64.60 1taw s SER 88 CO -0.02 -0.23 0.40 -0.63 0.41 0.00 0.00 173.24 173.17 1taw s ILE 89 N 1.22 5.22 0.49 1.44 1.01 0.19 -4.93 121.20 125.84 1taw s ILE 89 Ca -0.06 -1.08 -0.19 0.00 0.00 0.00 0.00 60.65 59.33 1taw s ILE 89 Cb -0.20 -4.12 -0.09 0.00 0.01 0.00 0.00 42.46 38.07 1taw s ILE 89 CO -0.02 -0.58 0.99 -0.69 0.00 0.00 0.00 174.94 174.64 1taw s VAL 90 N 1.64 4.26 0.08 2.92 1.01 -1.26 -0.35 120.40 128.69 1taw s VAL 90 Ca 0.04 1.25 -0.31 0.00 0.00 0.00 0.00 61.98 62.96 1taw s VAL 90 Cb -0.24 -3.59 -0.08 0.00 0.00 0.00 0.00 36.38 32.46 1taw s VAL 90 CO 0.07 -0.46 1.62 -2.28 0.00 0.00 0.00 175.10 174.05 1taw s HIS 91 N -2.33 2.56 0.66 5.22 2.46 -0.39 -4.88 115.29 118.59 1taw s HIS 91 Ca 0.62 0.41 0.23 0.00 0.47 0.00 0.00 55.06 56.79 1taw s HIS 91 Cb -0.11 -3.94 1.27 0.00 -0.13 0.00 0.00 32.58 29.66 1taw s HIS 91 CO 0.23 -3.70 1.71 -1.00 -2.47 0.00 0.00 174.74 169.52 1taw h PRO 92 N 8.02 0.00 -0.23 2.88 0.13 -1.92 0.42 132.00 141.30 1taw h PRO 92 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1taw h PRO 92 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1taw h PRO 92 CO 0.92 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 179.12 1taw n SER 93 N -2.83 3.68 -4.72 1.44 7.64 -1.26 -5.00 113.62 112.57 1taw n SER 93 Ca -0.01 -3.01 -0.42 0.00 1.01 0.00 0.00 58.87 56.43 1taw n SER 93 Cb 0.53 -0.53 -0.03 0.00 -1.01 0.00 0.00 64.21 63.18 1taw n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1taw s TYR 94 N -2.81 2.97 -0.30 1.43 5.04 0.14 -4.61 117.35 119.21 1taw s TYR 94 Ca 0.41 0.54 0.00 0.00 -2.44 0.00 0.00 57.07 55.58 1taw s TYR 94 Cb 0.33 -3.98 0.06 0.00 0.35 0.00 0.00 41.96 38.73 1taw s TYR 94 CO 0.08 -3.65 -0.02 1.21 -1.34 0.00 0.00 175.55 171.83 1taw s ASN 95 N 1.26 4.77 0.52 4.32 3.84 -0.74 -4.97 114.94 123.94 1taw s ASN 95 Ca 0.71 -1.42 0.35 0.00 0.21 0.00 0.00 52.86 52.72 1taw s ASN 95 Cb -0.45 -1.66 1.87 0.00 -0.55 0.00 0.00 41.25 40.46 1taw s ASN 95 CO 0.31 -0.26 2.07 0.77 -2.79 0.00 0.00 177.10 177.21 1taw h SER 96 N 7.90 0.00 0.17 -4.21 4.64 -1.93 0.81 113.55 120.92 1taw h SER 96 Ca -0.19 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.77 1taw h SER 96 Cb 1.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 1taw h SER 96 CO 0.52 0.00 -1.88 0.78 -0.87 0.00 0.00 176.83 175.38 1taw h ASN 97 N 0.00 0.50 0.39 4.97 2.35 -1.97 -3.38 115.58 118.43 1taw h ASN 97 Ca 0.00 -0.92 -0.09 0.00 -0.55 0.00 0.00 56.30 54.74 1taw h ASN 97 Cb 0.05 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 1taw h ASN 97 CO 0.00 1.81 -1.70 0.35 -1.65 0.00 0.00 177.43 176.24 1taw n THR 98 N -3.52 0.61 -1.09 2.81 -2.24 -0.92 -4.97 114.28 104.95 1taw n THR 98 Ca -0.28 -0.61 -0.03 0.00 -2.27 0.00 0.00 64.05 60.86 1taw n THR 98 Cb 1.06 -0.31 -0.01 0.00 -2.10 0.00 0.00 70.33 68.97 1taw n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1taw n LEU 99 N -2.57 -0.09 -4.74 3.22 4.77 0.28 -5.00 117.00 112.86 1taw n LEU 99 Ca -0.09 0.08 -0.41 0.00 -0.03 0.00 0.00 56.01 55.57 1taw n LEU 99 Cb 0.71 -1.13 -0.05 0.00 -2.33 0.00 0.00 43.42 40.62 1taw n LEU 99 CO 0.43 -0.30 0.73 0.21 -1.33 0.00 0.00 177.39 177.13 1taw s ASN 100 N -2.49 7.42 -0.91 -1.43 3.04 -1.23 -3.38 114.94 115.97 1taw s ASN 100 Ca 0.00 2.02 -0.06 0.00 0.04 0.00 0.00 52.86 54.87 1taw s ASN 100 Cb 0.00 -2.61 0.01 0.00 -1.54 0.00 0.00 41.25 37.11 1taw s ASN 100 CO 0.00 -0.07 0.79 0.59 -3.04 0.00 0.00 177.10 175.38 1taw n ASN 101 N 1.98 -4.70 -4.18 -4.21 3.02 -1.26 -1.79 115.26 104.12 1taw n ASN 101 Ca 0.01 -0.37 -0.43 0.00 -0.03 0.00 0.00 54.58 53.76 1taw n ASN 101 Cb 0.47 -3.58 0.00 0.00 -0.61 0.00 0.00 39.78 36.05 1taw n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1taw n ASP 102 N -1.65 4.45 -3.80 6.41 2.03 -1.22 -4.20 116.55 118.57 1taw n ASP 102 Ca -0.01 -2.89 -0.12 0.00 0.52 0.00 0.00 54.79 52.29 1taw n ASP 102 Cb 0.55 -1.70 -0.11 0.00 -0.72 0.00 0.00 41.12 39.13 1taw n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1taw s ILE 103 N 3.69 0.02 -0.02 5.18 2.07 -1.26 -3.76 121.20 127.12 1taw s ILE 103 Ca 0.50 -0.18 -0.06 0.00 -1.41 0.00 0.00 60.65 59.50 1taw s ILE 103 Cb 0.09 -0.39 0.01 0.00 0.13 0.00 0.00 42.46 42.30 1taw s ILE 103 CO -0.00 -0.10 0.14 -0.32 -1.91 0.00 0.00 174.94 172.75 1taw s MET 104 N -0.31 0.36 -0.07 3.50 -2.45 -0.52 -1.26 119.30 118.55 1taw s MET 104 Ca -0.04 -0.15 0.03 0.00 -1.25 0.00 0.00 55.69 54.27 1taw s MET 104 Cb -0.03 0.15 -0.02 0.00 1.25 0.00 0.00 34.83 36.18 1taw s MET 104 CO 0.01 -0.07 -0.13 -0.51 1.05 0.00 0.00 175.02 175.37 1taw s LEU 105 N -0.78 2.80 -0.11 4.11 1.43 0.52 -1.23 118.68 125.43 1taw s LEU 105 Ca -0.09 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 52.85 1taw s LEU 105 Cb -0.05 -1.58 0.01 0.00 0.03 0.00 0.00 46.19 44.59 1taw s LEU 105 CO 0.01 0.32 -0.19 -0.63 0.23 0.00 0.00 176.35 176.09 1taw s ILE 106 N -0.56 1.75 -0.16 -0.59 1.01 0.44 0.57 121.20 123.65 1taw s ILE 106 Ca 0.08 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.80 1taw s ILE 106 Cb -0.11 -1.55 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 1taw s ILE 106 CO 0.01 0.49 0.22 -0.75 0.00 0.00 0.00 174.94 174.92 1taw s LYS 107 N 0.69 4.13 0.28 2.79 2.20 0.11 -1.08 119.74 128.85 1taw s LYS 107 Ca -0.12 -0.03 -0.24 0.00 -0.36 0.00 0.00 55.97 55.23 1taw s LYS 107 Cb -0.16 -3.39 -0.09 0.00 -1.51 0.00 0.00 37.83 32.68 1taw s LYS 107 CO 0.03 0.34 0.86 -0.51 -0.36 0.00 0.00 175.35 175.70 1taw s LEU 108 N 0.19 4.35 0.36 5.43 1.43 -0.47 0.25 118.68 130.22 1taw s LEU 108 Ca 0.14 1.67 0.04 0.00 -1.03 0.00 0.00 54.13 54.95 1taw s LEU 108 Cb -0.12 -3.83 0.71 0.00 0.03 0.00 0.00 46.19 42.97 1taw s LEU 108 CO 0.02 -0.02 2.00 0.11 0.23 0.00 0.00 176.35 178.69 1taw h LYS 109 N 3.30 0.75 -4.41 1.70 1.57 -0.94 -3.42 116.57 115.13 1taw h LYS 109 Ca -0.47 -0.05 -0.20 0.00 -1.87 0.00 0.00 60.65 58.06 1taw h LYS 109 Cb 1.19 -0.17 -0.18 0.00 0.08 0.00 0.00 32.23 33.15 1taw h LYS 109 CO 0.65 0.50 -0.70 -1.54 -0.57 0.00 0.00 179.45 177.79 1taw s SER 110 N -6.40 0.75 0.26 0.86 1.04 -1.26 -4.99 113.70 103.96 1taw s SER 110 Ca -0.10 -0.78 -0.29 0.00 0.48 0.00 0.00 55.95 55.26 1taw s SER 110 Cb 0.18 0.10 -0.09 0.00 0.10 0.00 0.00 66.02 66.31 1taw s SER 110 CO 0.76 -0.39 1.22 0.00 0.98 0.00 0.00 173.24 175.81 1taw s ALA 111 N -2.65 3.46 0.59 5.32 0.00 -1.26 -4.86 121.76 122.37 1taw s ALA 111 Ca -0.01 1.05 -0.18 0.00 0.00 0.00 0.00 51.96 52.83 1taw s ALA 111 Cb -0.01 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1taw s ALA 111 CO -0.04 -0.41 1.14 0.00 0.00 0.00 0.00 175.76 176.45 1taw s ALA 112 N -0.72 2.58 -0.48 0.00 0.00 0.26 -4.97 121.76 118.43 1taw s ALA 112 Ca 0.50 0.77 -0.21 0.00 0.00 0.00 0.00 51.96 53.01 1taw s ALA 112 Cb -0.35 -3.36 0.04 0.00 0.00 0.00 0.00 23.12 19.44 1taw s ALA 112 CO 0.43 -1.03 0.69 0.45 0.00 0.00 0.00 175.76 176.31 1taw s SER 113 N -2.01 6.30 0.04 0.00 0.15 -1.26 -4.84 113.70 112.07 1taw s SER 113 Ca 0.72 -0.51 -0.30 0.00 0.70 0.00 0.00 55.95 56.56 1taw s SER 113 Cb -0.24 -2.33 -0.05 0.00 -1.71 0.00 0.00 66.02 61.69 1taw s SER 113 CO 0.33 -0.90 1.14 -0.76 1.20 0.00 0.00 173.24 174.25 1taw s LEU 114 N 2.97 4.37 0.00 3.45 1.43 -1.26 -4.72 118.68 124.92 1taw s LEU 114 Ca 0.22 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 55.22 1taw s LEU 114 Cb -0.15 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.49 1taw s LEU 114 CO 0.17 -0.42 0.00 -0.46 0.23 0.00 0.00 176.35 175.87 1taw n ASN 115 N 3.98 0.00 0.30 2.29 0.23 0.40 -4.95 115.26 117.51 1taw n ASN 115 Ca 0.08 -0.02 0.17 0.00 -0.53 0.00 0.00 54.58 54.28 1taw n ASN 115 Cb 0.48 0.00 0.91 0.00 -2.08 0.00 0.00 39.78 39.09 1taw n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1taw h SER 116 N 0.00 0.00 0.00 0.53 4.64 -2.00 -2.93 113.55 113.79 1taw h SER 116 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1taw h SER 116 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1taw h SER 116 CO 0.00 0.04 -1.91 0.54 -0.87 0.00 0.00 176.83 174.64 1taw n ARG 117 N -3.37 0.68 -4.03 4.77 1.74 -1.26 -4.90 116.66 110.29 1taw n ARG 117 Ca -0.02 -0.14 -0.31 0.00 -0.77 0.00 0.00 57.85 56.61 1taw n ARG 117 Cb 0.18 -1.44 -0.16 0.00 -1.02 0.00 0.00 32.46 30.02 1taw n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1taw s VAL 118 N -3.13 1.77 0.05 1.55 1.01 -1.11 -4.16 120.40 116.39 1taw s VAL 118 Ca -0.07 -1.04 -0.07 0.00 0.00 0.00 0.00 61.98 60.80 1taw s VAL 118 Cb 0.11 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 1taw s VAL 118 CO 0.76 0.24 0.13 0.00 0.00 0.00 0.00 175.10 176.22 1taw s ALA 119 N 1.35 -0.13 0.41 5.51 0.00 -0.82 -0.45 121.76 127.63 1taw s ALA 119 Ca -0.01 -0.53 -0.02 0.00 0.00 0.00 0.00 51.96 51.40 1taw s ALA 119 Cb -0.16 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 1taw s ALA 119 CO -0.09 -0.36 0.66 -1.54 0.00 0.00 0.00 175.76 174.43 1taw s SER 120 N -2.29 6.25 -0.01 0.00 1.04 -1.26 -3.03 113.70 114.40 1taw s SER 120 Ca -0.03 0.64 0.04 0.00 0.48 0.00 0.00 55.95 57.09 1taw s SER 120 Cb 0.00 -2.09 -0.03 0.00 0.10 0.00 0.00 66.02 64.00 1taw s SER 120 CO -0.06 -0.45 -0.12 -0.51 0.98 0.00 0.00 173.24 173.09 1taw s ILE 121 N -2.52 3.28 0.31 -1.02 1.10 -0.32 -4.85 121.20 117.18 1taw s ILE 121 Ca 0.44 -0.82 -0.28 0.00 -0.51 0.00 0.00 60.65 59.48 1taw s ILE 121 Cb -0.10 -2.36 -0.09 0.00 0.15 0.00 0.00 42.46 40.05 1taw s ILE 121 CO 0.40 0.47 1.09 -0.44 -2.11 0.00 0.00 174.94 174.34 1taw s SER 122 N -1.14 7.13 0.41 4.50 0.01 -1.26 -4.61 113.70 118.74 1taw s SER 122 Ca 0.14 2.22 -0.16 0.00 1.31 0.00 0.00 55.95 59.46 1taw s SER 122 Cb -0.11 -2.62 -0.09 0.00 0.21 0.00 0.00 66.02 63.42 1taw s SER 122 CO 0.04 -0.24 0.84 -0.76 0.41 0.00 0.00 173.24 173.54 1taw s LEU 123 N -1.76 3.89 0.52 2.44 1.43 -1.26 -0.43 118.68 123.51 1taw s LEU 123 Ca 0.48 1.40 -0.16 0.00 -1.03 0.00 0.00 54.13 54.82 1taw s LEU 123 Cb -0.30 -4.26 -0.08 0.00 0.03 0.00 0.00 46.19 41.59 1taw s LEU 123 CO 0.38 -0.37 0.99 -2.16 0.23 0.00 0.00 176.35 175.42 1taw s PRO 124 N -3.45 3.92 -0.09 1.29 0.04 -1.26 -4.78 135.00 130.68 1taw s PRO 124 Ca 0.56 0.95 0.10 0.00 0.04 0.00 0.00 61.00 62.66 1taw s PRO 124 Cb -0.10 -2.13 -0.15 0.00 0.04 0.00 0.00 34.50 32.16 1taw s PRO 124 CO 0.22 -0.30 0.09 0.25 0.04 0.00 0.00 177.00 177.31 1taw n THR 125 N -1.64 0.57 -4.32 1.26 -2.24 -1.26 -4.93 114.28 101.72 1taw n THR 125 Ca 0.07 -0.42 -0.24 0.00 -2.27 0.00 0.00 64.05 61.19 1taw n THR 125 Cb 0.54 -0.48 -0.12 0.00 -2.10 0.00 0.00 70.33 68.17 1taw n THR 125 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1taw s SER 127 N -4.11 2.74 0.80 3.42 0.01 -1.26 -5.12 113.70 110.18 1taw s SER 127 Ca -0.05 -0.77 -0.11 0.00 1.31 0.00 0.00 55.95 56.32 1taw s SER 127 Cb 0.04 -0.16 0.08 0.00 0.21 0.00 0.00 66.02 66.19 1taw s SER 127 CO 0.46 0.04 1.16 0.00 0.41 0.00 0.00 173.24 175.31 1taw s ALA 129 N -3.53 3.95 0.44 0.00 0.00 -1.26 -5.11 121.76 116.25 1taw s ALA 129 Ca 0.62 -0.90 0.02 0.00 0.00 0.00 0.00 51.96 51.70 1taw s ALA 129 Cb -0.11 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.24 1taw s ALA 129 CO 0.48 0.77 0.65 -1.54 0.00 0.00 0.00 175.76 176.12 1taw s SER 130 N -2.63 5.77 0.41 0.00 1.04 -1.26 -5.04 113.70 112.00 1taw s SER 130 Ca 0.34 0.14 -0.27 0.00 0.48 0.00 0.00 55.95 56.65 1taw s SER 130 Cb -0.13 -1.36 -0.09 0.00 0.10 0.00 0.00 66.02 64.54 1taw s SER 130 CO 0.27 -0.72 1.44 0.00 0.98 0.00 0.00 173.24 175.21 1taw s ALA 132 N -2.52 3.39 0.00 5.32 0.00 -1.26 -2.39 121.76 124.31 1taw s ALA 132 Ca 0.49 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.94 1taw s ALA 132 Cb -0.10 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1taw s ALA 132 CO 0.37 -1.09 0.00 0.41 0.00 0.00 0.00 175.76 175.45 1taw n GLY 133 N 0.54 2.55 3.76 0.00 0.00 0.39 -4.95 105.19 107.47 1taw n GLY 133 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1taw n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1taw s THR 134 N -2.55 2.58 -0.10 2.61 2.01 -1.00 -4.63 115.64 114.55 1taw s THR 134 Ca 0.00 0.52 -0.20 0.00 0.31 0.00 0.00 61.69 62.32 1taw s THR 134 Cb 0.00 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 1taw s THR 134 CO 0.00 0.10 0.57 -1.58 -0.69 0.00 0.00 174.62 173.02 1taw s GLN 135 N -1.06 4.37 0.23 4.92 2.00 -1.26 -0.88 119.66 127.97 1taw s GLN 135 Ca 0.55 0.62 0.07 0.00 -2.00 0.00 0.00 55.36 54.61 1taw s GLN 135 Cb -0.42 -3.45 -0.05 0.00 0.80 0.00 0.00 33.01 29.89 1taw s GLN 135 CO 0.49 0.10 -0.11 0.00 -0.50 0.00 0.00 175.29 175.26 1taw s LEU 137 N -3.35 3.47 -0.05 0.00 2.96 0.85 -1.56 118.68 121.00 1taw s LEU 137 Ca 0.25 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 54.07 1taw s LEU 137 Cb 0.01 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 1taw s LEU 137 CO 0.08 0.06 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.38 1taw s ILE 138 N 1.03 2.85 0.05 6.68 1.01 -0.22 -1.10 121.20 131.50 1taw s ILE 138 Ca 0.03 -0.79 -0.03 0.00 0.00 0.00 0.00 60.65 59.86 1taw s ILE 138 Cb -0.14 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 1taw s ILE 138 CO 0.02 0.58 0.02 -0.94 0.00 0.00 0.00 174.94 174.63 1taw s SER 139 N -0.56 0.34 0.00 3.58 1.04 -1.21 -0.88 113.70 116.01 1taw s SER 139 Ca 0.08 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.74 1taw s SER 139 Cb -0.11 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.21 1taw s SER 139 CO 0.01 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.30 1taw n GLY 140 N 0.51 -0.04 1.10 7.32 0.00 -0.92 -4.44 105.19 108.72 1taw n GLY 140 Ca -0.17 -1.06 -0.01 0.00 0.00 0.00 0.00 46.02 44.78 1taw n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1taw n TRP 141 N -0.46 1.10 -1.72 1.61 8.01 -1.26 -2.07 117.44 122.64 1taw n TRP 141 Ca 0.00 -1.38 -0.30 0.00 -1.31 0.00 0.00 57.50 54.51 1taw n TRP 141 Cb 0.00 -0.45 0.19 0.00 -2.01 0.00 0.00 31.31 29.04 1taw n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1taw s GLY 142 N -2.32 1.72 0.25 6.99 0.00 -1.25 -4.39 107.32 108.32 1taw s GLY 142 Ca 0.44 -1.08 -0.30 0.00 0.00 0.00 0.00 44.72 43.78 1taw s GLY 142 CO 0.03 -0.31 1.19 -2.01 0.00 0.00 0.00 173.10 172.00 1taw n ASN 143 N -3.96 1.87 -0.96 1.64 5.15 0.42 -2.86 115.26 116.56 1taw n ASN 143 Ca 0.14 1.16 0.12 0.00 -0.60 0.00 0.00 54.58 55.40 1taw n ASN 143 Cb 0.60 -1.33 0.11 0.00 -0.53 0.00 0.00 39.78 38.63 1taw n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1taw n THR 144 N 1.07 0.07 -4.74 -0.44 -2.24 0.34 -1.58 114.28 106.76 1taw n THR 144 Ca 0.11 -0.54 -0.33 0.00 -2.27 0.00 0.00 64.05 61.02 1taw n THR 144 Cb 0.30 1.41 -0.13 0.00 -2.10 0.00 0.00 70.33 69.82 1taw n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1taw s LYS 145 N -1.87 2.83 0.04 -0.78 -0.14 -1.26 -4.41 119.74 114.16 1taw s LYS 145 Ca 0.29 -0.63 0.26 0.00 -1.36 0.00 0.00 55.97 54.53 1taw s LYS 145 Cb 0.20 -2.54 0.69 0.00 -1.68 0.00 0.00 37.83 34.50 1taw s LYS 145 CO 0.29 0.54 1.56 -1.13 -0.76 0.00 0.00 175.35 175.85 1taw n SER 146 N 2.58 0.43 -3.77 2.83 3.41 -1.26 -4.65 113.62 113.19 1taw n SER 146 Ca -0.18 0.09 -0.23 0.00 -0.26 0.00 0.00 58.87 58.29 1taw n SER 146 Cb 0.53 -0.05 -0.18 0.00 -0.26 0.00 0.00 64.21 64.25 1taw n SER 146 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1taw s SER 147 N -3.36 1.60 0.00 4.04 1.04 -1.26 -4.63 113.70 111.13 1taw s SER 147 Ca 0.11 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.44 1taw s SER 147 Cb 0.17 -0.44 0.00 0.00 0.10 0.00 0.00 66.02 65.85 1taw s SER 147 CO 0.65 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 175.28 1taw n GLY 148 N 5.15 -1.71 3.08 7.32 0.00 -1.26 -4.95 105.19 112.82 1taw n GLY 148 Ca -0.07 -1.48 -0.15 0.00 0.00 0.00 0.00 46.02 44.32 1taw n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1taw s THR 149 N 0.00 0.70 -0.30 2.61 -4.23 -1.26 -4.67 115.64 108.50 1taw s THR 149 Ca 0.00 -1.04 -0.06 0.00 -1.18 0.00 0.00 61.69 59.41 1taw s THR 149 Cb 0.00 -0.72 0.19 0.00 1.34 0.00 0.00 72.50 73.31 1taw s THR 149 CO 0.00 -0.27 0.89 -0.55 -0.54 0.00 0.00 174.62 174.16 1taw s SER 150 N -1.44 -0.82 -0.16 3.99 0.15 -1.26 -4.90 113.70 109.25 1taw s SER 150 Ca -0.06 0.11 -0.14 0.00 0.70 0.00 0.00 55.95 56.55 1taw s SER 150 Cb -0.09 1.53 -0.05 0.00 -1.71 0.00 0.00 66.02 65.70 1taw s SER 150 CO 0.01 -0.15 0.31 -0.31 1.20 0.00 0.00 173.24 174.30 1taw s TYR 151 N 2.91 3.45 0.69 3.44 2.02 -1.26 -0.50 117.35 128.10 1taw s TYR 151 Ca 0.21 0.61 -0.11 0.00 -0.37 0.00 0.00 57.07 57.41 1taw s TYR 151 Cb -0.05 -2.38 0.00 0.00 -0.40 0.00 0.00 41.96 39.14 1taw s TYR 151 CO -0.24 0.20 1.06 -1.25 -1.57 0.00 0.00 175.55 173.76 1taw s PRO 152 N 0.58 3.02 -0.13 -1.71 0.04 -1.26 -5.01 135.00 130.53 1taw s PRO 152 Ca 0.17 0.79 -0.15 0.00 0.04 0.00 0.00 61.00 61.86 1taw s PRO 152 Cb -0.13 -2.01 -0.25 0.00 0.04 0.00 0.00 34.50 32.14 1taw s PRO 152 CO 0.05 -1.00 0.44 -0.44 0.04 0.00 0.00 177.00 176.09 1taw h ASP 153 N -0.64 0.31 -2.36 6.66 3.32 -1.93 -3.47 116.42 118.31 1taw h ASP 153 Ca -0.44 -0.81 -0.50 0.00 0.02 0.00 0.00 57.03 55.30 1taw h ASP 153 Cb 1.22 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.65 1taw h ASP 153 CO 0.60 1.65 -0.45 0.68 -1.72 0.00 0.00 179.24 179.99 1taw s VAL 154 N -2.47 5.27 0.14 -1.35 -7.23 -1.25 -0.81 120.40 112.69 1taw s VAL 154 Ca -0.22 -0.86 -0.31 0.00 -1.81 0.00 0.00 61.98 58.77 1taw s VAL 154 Cb 0.05 -3.80 -0.10 0.00 0.56 0.00 0.00 36.38 33.10 1taw s VAL 154 CO 0.73 -0.22 1.61 -0.22 -0.31 0.00 0.00 175.10 176.69 1taw s LEU 155 N -3.64 4.37 0.11 1.32 2.96 -1.04 -4.86 118.68 117.89 1taw s LEU 155 Ca 0.34 2.60 0.03 0.00 -0.22 0.00 0.00 54.13 56.88 1taw s LEU 155 Cb -0.10 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1taw s LEU 155 CO 0.29 -0.86 0.13 -0.54 -1.32 0.00 0.00 176.35 174.05 1taw s LYS 156 N 1.67 3.02 0.16 1.98 -0.14 -0.88 -1.94 119.74 123.61 1taw s LYS 156 Ca 0.72 -0.69 0.07 0.00 -1.36 0.00 0.00 55.97 54.70 1taw s LYS 156 Cb -0.43 -2.77 -0.04 0.00 -1.68 0.00 0.00 37.83 32.91 1taw s LYS 156 CO 0.32 0.55 -0.15 0.00 -0.76 0.00 0.00 175.35 175.30 1taw s LEU 158 N -2.86 0.10 -0.21 0.00 2.96 -0.06 -0.52 118.68 118.09 1taw s LEU 158 Ca 0.16 0.81 -0.12 0.00 -0.22 0.00 0.00 54.13 54.76 1taw s LEU 158 Cb -0.03 1.25 -0.05 0.00 0.50 0.00 0.00 46.19 47.86 1taw s LEU 158 CO 0.05 -0.18 0.24 -0.54 -1.32 0.00 0.00 176.35 174.61 1taw s LYS 159 N 1.14 4.15 -0.09 1.98 3.01 -1.26 -1.06 119.74 127.62 1taw s LYS 159 Ca -0.08 -0.07 -0.11 0.00 -1.01 0.00 0.00 55.97 54.70 1taw s LYS 159 Cb -0.08 -3.50 0.03 0.00 -1.01 0.00 0.00 37.83 33.27 1taw s LYS 159 CO -0.10 0.10 0.30 0.00 0.51 0.00 0.00 175.35 176.16 1taw s ALA 160 N 0.92 -0.75 0.37 5.17 0.00 -0.60 -4.96 121.76 121.92 1taw s ALA 160 Ca 0.12 0.70 -0.08 0.00 0.00 0.00 0.00 51.96 52.70 1taw s ALA 160 Cb -0.13 -0.35 -0.06 0.00 0.00 0.00 0.00 23.12 22.58 1taw s ALA 160 CO 0.04 -0.17 0.70 -1.25 0.00 0.00 0.00 175.76 175.08 1taw s PRO 161 N -0.24 3.72 0.07 0.00 0.04 -1.26 -0.57 135.00 136.76 1taw s PRO 161 Ca -0.04 0.30 -0.30 0.00 0.04 0.00 0.00 61.00 61.00 1taw s PRO 161 Cb -0.03 -2.47 -0.05 0.00 0.04 0.00 0.00 34.50 31.98 1taw s PRO 161 CO 0.01 0.03 1.09 0.42 0.04 0.00 0.00 177.00 178.60 1taw s ILE 162 N -2.30 4.29 0.53 0.56 1.01 -0.06 -1.36 121.20 123.87 1taw s ILE 162 Ca 0.49 1.73 -0.06 0.00 0.00 0.00 0.00 60.65 62.81 1taw s ILE 162 Cb -0.10 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.24 1taw s ILE 162 CO 0.32 0.18 0.84 -0.76 0.00 0.00 0.00 174.94 175.52 1taw s LEU 163 N 0.63 3.47 0.44 2.97 1.43 0.60 -0.47 118.68 127.75 1taw s LEU 163 Ca 0.54 0.87 -0.22 0.00 -1.03 0.00 0.00 54.13 54.28 1taw s LEU 163 Cb -0.26 -3.78 -0.09 0.00 0.03 0.00 0.00 46.19 42.09 1taw s LEU 163 CO 0.30 -0.77 1.05 -0.94 0.23 0.00 0.00 176.35 176.23 1taw s SER 164 N -4.18 6.53 0.41 2.29 1.04 -1.26 -4.63 113.70 113.89 1taw s SER 164 Ca 0.50 2.01 0.14 0.00 0.48 0.00 0.00 55.95 59.09 1taw s SER 164 Cb -0.10 -2.58 1.00 0.00 0.10 0.00 0.00 66.02 64.44 1taw s SER 164 CO 0.45 -0.65 1.89 0.74 0.98 0.00 0.00 173.24 176.65 1taw h THR 165 N 1.89 0.77 -0.42 2.02 2.02 -1.96 -0.95 112.91 116.28 1taw h THR 165 Ca -0.49 -0.17 -0.08 0.00 0.77 0.00 0.00 66.41 66.45 1taw h THR 165 Cb 1.22 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 1taw h THR 165 CO 0.61 0.09 -0.05 0.77 0.37 0.00 0.00 175.52 177.30 1taw h SER 166 N 0.48 0.77 -0.57 4.18 4.64 -1.99 0.20 113.55 121.27 1taw h SER 166 Ca 0.42 -0.34 -0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1taw h SER 166 Cb 0.91 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 1taw h SER 166 CO -0.16 0.92 0.34 0.28 -0.87 0.00 0.00 176.83 177.35 1taw h SER 167 N 0.60 0.68 0.45 4.97 0.02 -1.61 -0.70 113.55 117.96 1taw h SER 167 Ca 0.11 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1taw h SER 167 Cb 0.56 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1taw h SER 167 CO 0.03 0.54 -0.22 0.00 -1.14 0.00 0.00 176.83 176.05 1taw h LYS 169 N -0.66 0.97 -0.08 0.00 1.79 -0.47 -1.06 116.57 117.05 1taw h LYS 169 Ca -0.06 -0.06 -0.11 0.00 -2.18 0.00 0.00 60.65 58.24 1taw h LYS 169 Cb 0.50 -0.22 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1taw h LYS 169 CO 0.10 0.64 -0.46 0.66 -1.08 0.00 0.00 179.45 179.31 1taw h SER 170 N 1.00 0.21 0.79 0.86 4.64 -0.97 -1.37 113.55 118.71 1taw h SER 170 Ca 0.44 -0.10 -0.12 0.00 -0.47 0.00 0.00 61.79 61.54 1taw h SER 170 Cb 0.32 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 1taw h SER 170 CO -0.22 0.65 -0.57 0.00 -0.87 0.00 0.00 176.83 175.82 1taw h ALA 171 N 1.36 0.90 -2.05 5.18 0.00 -0.25 -3.36 119.26 121.04 1taw h ALA 171 Ca 0.01 -0.52 -0.55 0.00 0.00 0.00 0.00 54.91 53.85 1taw h ALA 171 Cb 0.89 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 18.19 1taw h ALA 171 CO 0.07 0.71 -1.01 0.66 0.00 0.00 0.00 179.25 179.69 1taw n TYR 172 N -3.63 0.71 -1.68 0.00 4.01 -0.55 -4.91 117.16 111.12 1taw n TYR 172 Ca -0.01 -3.74 -0.54 0.00 -0.16 0.00 0.00 57.90 53.45 1taw n TYR 172 Cb 0.62 -0.41 -0.06 0.00 -0.31 0.00 0.00 39.34 39.18 1taw n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1taw n PRO 173 N 1.01 1.39 -0.55 -0.72 -0.02 -0.54 -1.10 135.00 134.46 1taw n PRO 173 Ca 0.24 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1taw n PRO 173 Cb 0.52 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1taw n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1taw n GLY 174 N 3.87 1.60 0.01 -1.23 0.00 -1.26 -4.86 105.19 103.32 1taw n GLY 174 Ca 0.24 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.36 1taw n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1taw n GLN 175 N -2.00 0.66 -3.13 1.61 6.02 -0.26 -4.95 117.38 115.32 1taw n GLN 175 Ca 0.00 -0.19 -0.40 0.00 -0.01 0.00 0.00 57.00 56.40 1taw n GLN 175 Cb 0.00 -1.51 -0.06 0.00 1.02 0.00 0.00 30.24 29.69 1taw n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1taw s ILE 176 N -3.47 5.04 0.56 5.09 -1.09 -1.24 -5.02 121.20 121.07 1taw s ILE 176 Ca -0.08 1.18 0.09 0.00 -2.23 0.00 0.00 60.65 59.61 1taw s ILE 176 Cb 0.14 -3.94 0.07 0.00 -1.58 0.00 0.00 42.46 37.15 1taw s ILE 176 CO 0.90 0.14 0.69 0.42 -1.23 0.00 0.00 174.94 175.85 1taw s THR 177 N 1.74 2.07 -1.28 2.92 -4.23 -1.26 -4.99 115.64 110.61 1taw s THR 177 Ca 0.29 -1.12 0.16 0.00 -1.18 0.00 0.00 61.69 59.84 1taw s THR 177 Cb -0.16 -2.18 0.23 0.00 1.34 0.00 0.00 72.50 71.73 1taw s THR 177 CO 0.11 0.00 1.48 -1.54 -0.54 0.00 0.00 174.62 174.13 1taw n SER 178 N -2.11 0.00 -1.35 3.99 3.41 -1.26 -2.26 113.62 114.03 1taw n SER 178 Ca 0.11 0.21 0.08 0.00 -0.26 0.00 0.00 58.87 59.01 1taw n SER 178 Cb 0.62 -0.36 0.32 0.00 -0.26 0.00 0.00 64.21 64.53 1taw n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1taw n ASN 179 N -1.36 4.60 -4.12 4.04 3.02 -1.26 -4.93 115.26 115.25 1taw n ASN 179 Ca 0.06 -2.76 -0.14 0.00 -0.03 0.00 0.00 54.58 51.71 1taw n ASN 179 Cb 0.15 -0.57 -0.11 0.00 -0.61 0.00 0.00 39.78 38.64 1taw n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1taw s MET 180 N -2.40 0.68 0.03 3.52 -1.94 -0.96 -0.63 119.30 117.61 1taw s MET 180 Ca 0.47 -0.92 -0.03 0.00 -1.71 0.00 0.00 55.69 53.49 1taw s MET 180 Cb 0.34 -0.47 -0.02 0.00 2.01 0.00 0.00 34.83 36.69 1taw s MET 180 CO 0.16 0.09 0.05 -0.59 -0.01 0.00 0.00 175.02 174.71 1taw s PHE 181 N -1.69 0.24 -0.01 -0.03 -0.12 -0.51 -4.78 117.98 111.06 1taw s PHE 181 Ca -0.04 -0.53 -0.02 0.00 -0.05 0.00 0.00 56.93 56.30 1taw s PHE 181 Cb -0.08 -0.18 -0.04 0.00 -0.63 0.00 0.00 43.02 42.10 1taw s PHE 181 CO 0.00 -0.30 0.12 0.00 -0.05 0.00 0.00 175.22 174.99 1taw s ALA 183 N -1.22 -0.44 0.00 0.00 0.00 -0.84 -0.29 121.76 118.96 1taw s ALA 183 Ca 0.24 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.46 1taw s ALA 183 Cb -0.12 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.88 1taw s ALA 183 CO 0.15 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1taw n GLY 184 N 2.24 0.45 2.95 0.00 0.00 -0.46 -2.78 105.19 107.58 1taw n GLY 184 Ca -0.17 -1.73 -0.23 0.00 0.00 0.00 0.00 46.02 43.88 1taw n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1taw s TYR 184 N -2.19 1.16 -0.29 1.61 1.51 -1.26 -4.39 117.35 113.50 1taw s TYR 184 Ca 0.00 -0.43 0.27 0.00 -1.01 0.00 0.00 57.07 55.90 1taw s TYR 184 Cb 0.00 -0.93 1.11 0.00 -0.11 0.00 0.00 41.96 42.03 1taw s TYR 184 CO 0.00 -0.28 1.80 -0.07 -1.11 0.00 0.00 175.55 175.89 1taw h LEU 185 N 7.29 0.00 -0.04 -1.29 3.38 -1.95 -0.86 115.31 121.84 1taw h LEU 185 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1taw h LEU 185 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1taw h LEU 185 CO 0.45 0.00 0.00 -0.33 0.09 0.00 0.00 178.44 178.65 1taw h GLU 186 N 0.00 0.00 0.00 1.13 3.07 -1.94 0.80 114.58 117.64 1taw h GLU 186 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1taw h GLU 186 Cb 0.40 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1taw h GLU 186 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 1taw n GLY 187 N 1.21 -2.17 0.97 -3.84 0.00 -0.33 -4.33 105.19 96.70 1taw n GLY 187 Ca 0.05 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1taw n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1taw n GLY 188 N -0.23 3.01 2.82 -0.02 0.00 -0.56 -4.90 105.19 105.31 1taw n GLY 188 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1taw n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1taw s LYS 188 N -0.19 0.62 0.09 1.61 1.02 -1.26 -3.87 119.74 117.76 1taw s LYS 188 Ca 0.00 0.03 -0.27 0.00 0.02 0.00 0.00 55.97 55.75 1taw s LYS 188 Cb 0.00 -0.82 0.08 0.00 -0.52 0.00 0.00 37.83 36.57 1taw s LYS 188 CO 0.00 -0.19 1.08 0.34 -0.92 0.00 0.00 175.35 175.66 1taw s ASP 189 N 1.40 -0.13 0.72 2.83 2.15 -0.58 -4.24 116.67 118.83 1taw s ASP 189 Ca -0.04 -0.30 -0.06 0.00 0.43 0.00 0.00 52.55 52.58 1taw s ASP 189 Cb -0.13 0.37 0.09 0.00 -0.30 0.00 0.00 42.92 42.94 1taw s ASP 189 CO -0.03 -0.68 1.02 -0.94 -0.17 0.00 0.00 175.17 174.38 1taw s SER 190 N -2.95 4.55 0.27 -0.34 1.04 -1.26 -0.32 113.70 114.69 1taw s SER 190 Ca 0.13 0.22 -0.08 0.00 0.48 0.00 0.00 55.95 56.70 1taw s SER 190 Cb 0.01 -0.76 0.03 0.00 0.10 0.00 0.00 66.02 65.40 1taw s SER 190 CO -0.00 -1.75 0.50 0.00 0.98 0.00 0.00 173.24 172.97 1taw n GLN 192 N -0.39 1.84 0.00 0.00 3.00 -1.26 -1.12 117.38 119.45 1taw n GLN 192 Ca -0.04 0.67 0.00 0.00 -0.01 0.00 0.00 57.00 57.61 1taw n GLN 192 Cb 0.42 -2.43 0.00 0.00 0.00 0.00 0.00 30.24 28.23 1taw n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1taw n GLY 193 N 3.68 1.40 0.05 1.08 0.00 -1.26 -0.44 105.19 109.70 1taw n GLY 193 Ca 0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.34 1taw n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1taw n ASP 194 N 0.00 0.45 -4.47 1.61 8.00 -0.28 -3.79 116.55 118.07 1taw n ASP 194 Ca 0.00 0.01 -0.49 0.00 0.71 0.00 0.00 54.79 55.02 1taw n ASP 194 Cb 0.00 1.19 -0.04 0.00 -0.02 0.00 0.00 41.12 42.25 1taw n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1taw n SER 195 N -2.28 -0.27 0.00 -2.24 7.64 -1.26 -1.39 113.62 113.82 1taw n SER 195 Ca -0.01 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.01 1taw n SER 195 Cb 0.52 -1.04 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 1taw n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1taw n GLY 196 N 1.79 2.68 3.68 0.23 0.00 -0.52 0.03 105.19 113.06 1taw n GLY 196 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1taw n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1taw s GLY 197 N -1.81 1.62 0.32 -0.02 0.00 -0.48 -3.26 107.32 103.68 1taw s GLY 197 Ca 0.00 0.04 -0.25 0.00 0.00 0.00 0.00 44.72 44.51 1taw s GLY 197 CO 0.00 0.55 0.93 2.56 0.00 0.00 0.00 173.10 177.14 1taw s PRO 198 N -4.81 4.55 -0.31 2.90 0.04 -1.26 -1.55 135.00 134.56 1taw s PRO 198 Ca 0.65 1.29 0.02 0.00 0.04 0.00 0.00 61.00 62.99 1taw s PRO 198 Cb -0.20 -2.77 0.09 0.00 0.04 0.00 0.00 34.50 31.66 1taw s PRO 198 CO 0.58 0.27 0.04 0.08 0.04 0.00 0.00 177.00 178.01 1taw s VAL 199 N -1.64 1.71 -0.18 -0.36 1.01 -0.54 -3.33 120.40 117.07 1taw s VAL 199 Ca 0.50 -1.82 -0.05 0.00 0.00 0.00 0.00 61.98 60.61 1taw s VAL 199 Cb -0.18 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 1taw s VAL 199 CO 0.23 -0.51 0.01 -0.69 0.00 0.00 0.00 175.10 174.14 1taw s VAL 200 N 1.22 4.18 -0.11 2.92 1.01 -0.26 -0.86 120.40 128.50 1taw s VAL 200 Ca 0.07 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1taw s VAL 200 Cb -0.18 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.33 1taw s VAL 200 CO -0.13 0.45 -0.17 0.00 0.00 0.00 0.00 175.10 175.25 1taw n SER 202 N 4.07 -1.48 -0.22 0.00 7.64 -1.26 -1.26 113.62 121.10 1taw n SER 202 Ca -0.20 -0.94 -0.03 0.00 1.01 0.00 0.00 58.87 58.72 1taw n SER 202 Cb 0.51 -3.33 -0.01 0.00 -1.01 0.00 0.00 64.21 60.38 1taw n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1taw n GLY 203 N -1.78 0.54 3.29 0.23 0.00 -1.26 -5.00 105.19 101.20 1taw n GLY 203 Ca -0.21 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 1taw n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1taw s LYS 204 N -1.48 1.50 -0.55 1.61 -0.14 -0.39 -4.11 119.74 116.19 1taw s LYS 204 Ca 0.00 -1.02 -0.27 0.00 -1.36 0.00 0.00 55.97 53.32 1taw s LYS 204 Cb 0.00 -1.66 0.03 0.00 -1.68 0.00 0.00 37.83 34.52 1taw s LYS 204 CO 0.00 0.42 1.07 -1.17 -0.76 0.00 0.00 175.35 174.92 1taw s LEU 209 N -1.27 3.75 -0.02 3.17 2.96 0.42 -0.48 118.68 127.21 1taw s LEU 209 Ca 0.09 -0.00 0.15 0.00 -0.22 0.00 0.00 54.13 54.15 1taw s LEU 209 Cb -0.09 -3.10 -0.21 0.00 0.50 0.00 0.00 46.19 43.28 1taw s LEU 209 CO 0.02 -1.32 0.40 0.00 -1.32 0.00 0.00 176.35 174.12 1taw n GLN 210 N 7.91 0.90 -3.97 1.98 1.13 -0.04 -4.00 117.38 121.29 1taw n GLN 210 Ca 0.06 -0.10 -0.10 0.00 -1.94 0.00 0.00 57.00 54.93 1taw n GLN 210 Cb 0.48 -1.31 -0.07 0.00 0.11 0.00 0.00 30.24 29.46 1taw n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1taw s GLY 211 N -3.37 0.53 -0.06 1.08 0.00 -0.75 -2.22 107.32 102.54 1taw s GLY 211 Ca -0.03 -0.91 0.02 0.00 0.00 0.00 0.00 44.72 43.79 1taw s GLY 211 CO 0.61 -0.82 -0.09 -0.42 0.00 0.00 0.00 173.10 172.38 1taw s ILE 212 N -3.99 0.91 0.26 0.90 1.01 -1.16 -1.47 121.20 117.67 1taw s ILE 212 Ca 0.19 -0.33 -0.31 0.00 0.00 0.00 0.00 60.65 60.20 1taw s ILE 212 Cb 0.03 -0.87 -0.12 0.00 0.01 0.00 0.00 42.46 41.51 1taw s ILE 212 CO 0.02 0.31 1.65 0.52 0.00 0.00 0.00 174.94 177.44 1taw n VAL 213 N 4.02 0.66 0.00 2.92 0.31 -0.60 -1.70 118.33 123.94 1taw n VAL 213 Ca -0.22 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1taw n VAL 213 Cb 0.51 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 1taw n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1taw n SER 214 N 2.80 0.00 -2.46 4.52 2.88 -1.13 -1.44 113.62 118.79 1taw n SER 214 Ca 0.11 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.56 1taw n SER 214 Cb 0.36 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.81 1taw n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1taw n TRP 215 N -2.14 -1.54 0.00 0.66 4.27 -1.05 -4.87 117.44 112.76 1taw n TRP 215 Ca 0.00 -1.65 0.00 0.00 -3.89 0.00 0.00 57.50 51.96 1taw n TRP 215 Cb 0.00 0.53 0.00 0.00 -1.36 0.00 0.00 31.31 30.48 1taw n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1taw n GLY 216 N -0.43 1.29 3.49 -1.67 0.00 -1.26 -1.04 105.19 105.57 1taw n GLY 216 Ca -0.02 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.67 1taw n GLY 216 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1taw s SER 217 N 0.00 6.28 0.53 1.61 0.01 -1.26 -4.88 113.70 115.99 1taw s SER 217 Ca 0.00 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.67 1taw s SER 217 Cb 0.00 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.82 1taw s SER 217 CO 0.00 -1.21 0.00 0.61 0.41 0.00 0.00 173.24 173.05 1taw n GLY 219 N 5.17 0.67 3.21 3.44 0.00 -1.26 -4.62 105.19 111.81 1taw n GLY 219 Ca -0.01 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 45.09 1taw n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1taw n ALA 221 N 3.46 -0.55 -2.16 0.00 0.00 -1.26 -4.62 120.51 115.38 1taw n ALA 221 Ca -0.18 0.19 -0.39 0.00 0.00 0.00 0.00 53.44 53.06 1taw n ALA 221 Cb 0.56 -1.88 -0.06 0.00 0.00 0.00 0.00 19.45 18.07 1taw n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1taw s GLN 221 N -4.54 4.44 0.19 0.00 -1.52 -1.26 -1.49 119.66 115.48 1taw s GLN 221 Ca 0.00 1.01 -0.33 0.00 -1.95 0.00 0.00 55.36 54.09 1taw s GLN 221 Cb 0.00 -3.28 -0.13 0.00 -0.22 0.00 0.00 33.01 29.39 1taw s GLN 221 CO 0.00 0.53 1.67 1.17 -0.25 0.00 0.00 175.29 178.41 1taw n LYS 222 N 1.89 2.53 -1.18 2.91 4.81 -1.26 -1.45 118.16 126.41 1taw n LYS 222 Ca -0.06 0.91 -0.06 0.00 -0.87 0.00 0.00 58.31 58.23 1taw n LYS 222 Cb 0.50 -2.73 -0.03 0.00 0.02 0.00 0.00 35.03 32.79 1taw n LYS 222 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1taw n ASN 223 N 3.78 -4.65 -3.41 3.14 4.13 0.28 -4.92 115.26 113.61 1taw n ASN 223 Ca 0.16 0.15 -0.26 0.00 1.68 0.00 0.00 54.58 56.32 1taw n ASN 223 Cb 0.32 -2.70 -0.09 0.00 -1.54 0.00 0.00 39.78 35.78 1taw n ASN 223 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1taw n LYS 224 N -1.62 1.20 -1.58 3.52 4.76 -0.53 -4.73 118.16 119.18 1taw n LYS 224 Ca -0.06 -3.77 -0.29 0.00 -2.87 0.00 0.00 58.31 51.32 1taw n LYS 224 Cb 0.35 -1.75 0.15 0.00 -1.84 0.00 0.00 35.03 31.94 1taw n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1taw s PRO 225 N -1.23 0.82 0.44 1.97 0.04 -1.26 -4.15 135.00 131.63 1taw s PRO 225 Ca 0.34 0.11 -0.22 0.00 0.04 0.00 0.00 61.00 61.27 1taw s PRO 225 Cb 0.10 -1.82 -0.09 0.00 0.04 0.00 0.00 34.50 32.73 1taw s PRO 225 CO -0.12 -2.38 1.03 0.20 0.04 0.00 0.00 177.00 175.77 1taw s GLY 226 N -4.21 2.60 -0.13 0.56 0.00 -1.12 -4.64 107.32 100.38 1taw s GLY 226 Ca 0.66 0.63 -0.01 0.00 0.00 0.00 0.00 44.72 46.00 1taw s GLY 226 CO 0.53 0.99 -0.11 0.14 0.00 0.00 0.00 173.10 174.65 1taw s VAL 227 N -1.86 3.26 0.15 1.40 1.01 -0.21 -1.99 120.40 122.16 1taw s VAL 227 Ca 0.63 -0.59 0.09 0.00 0.00 0.00 0.00 61.98 62.11 1taw s VAL 227 Cb -0.18 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 1taw s VAL 227 CO 0.22 0.52 -0.20 -0.31 0.00 0.00 0.00 175.10 175.33 1taw s TYR 228 N 0.29 1.90 0.01 5.22 1.51 0.53 -2.54 117.35 124.27 1taw s TYR 228 Ca -0.08 -0.43 -0.30 0.00 -1.01 0.00 0.00 57.07 55.24 1taw s TYR 228 Cb -0.15 -0.98 -0.05 0.00 -0.11 0.00 0.00 41.96 40.67 1taw s TYR 228 CO 0.05 0.31 1.18 0.99 -1.11 0.00 0.00 175.55 176.98 1taw s THR 229 N -1.66 4.18 -0.95 -0.71 2.01 -0.69 -1.43 115.64 116.39 1taw s THR 229 Ca 0.13 1.55 -0.24 0.00 0.31 0.00 0.00 61.69 63.45 1taw s THR 229 Cb -0.08 -3.99 0.03 0.00 0.01 0.00 0.00 72.50 68.47 1taw s THR 229 CO 0.06 0.07 1.51 -0.75 -0.69 0.00 0.00 174.62 174.82 1taw s LYS 230 N 1.50 3.36 0.32 4.92 2.20 0.20 -3.00 119.74 129.25 1taw s LYS 230 Ca 0.57 -0.83 0.02 0.00 -0.36 0.00 0.00 55.97 55.37 1taw s LYS 230 Cb -0.27 -5.13 0.60 0.00 -1.51 0.00 0.00 37.83 31.53 1taw s LYS 230 CO 0.26 -2.38 1.93 0.28 -0.36 0.00 0.00 175.35 175.09 1taw h VAL 231 N 6.76 1.05 -0.13 4.02 2.07 -1.76 -2.69 116.25 125.57 1taw h VAL 231 Ca 0.11 -0.32 0.04 0.00 0.82 0.00 0.00 66.70 67.34 1taw h VAL 231 Cb 1.02 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1taw h VAL 231 CO 1.37 0.17 0.21 0.00 0.02 0.00 0.00 177.57 179.35 1taw n ASN 233 N -3.46 0.22 -0.29 0.00 3.02 -1.02 -3.78 115.26 109.97 1taw n ASN 233 Ca 0.00 0.52 0.03 0.00 -0.03 0.00 0.00 54.58 55.10 1taw n ASN 233 Cb 0.31 -0.58 0.06 0.00 -0.61 0.00 0.00 39.78 38.96 1taw n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1taw n TYR 234 N -1.71 0.14 -0.27 3.10 4.01 0.46 -4.75 117.16 118.14 1taw n TYR 234 Ca 0.06 -0.29 0.08 0.00 -0.16 0.00 0.00 57.90 57.60 1taw n TYR 234 Cb 0.36 -0.02 0.32 0.00 -0.31 0.00 0.00 39.34 39.68 1taw n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1taw h VAL 235 N 1.08 0.95 0.06 -0.72 2.07 -1.64 -0.26 116.25 117.80 1taw h VAL 235 Ca 0.00 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 1taw h VAL 235 Cb 0.46 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1taw h VAL 235 CO 0.00 0.15 -0.03 0.28 0.02 0.00 0.00 177.57 177.99 1taw h SER 236 N 0.83 -0.07 -0.51 0.57 0.02 -1.88 -0.65 113.55 111.85 1taw h SER 236 Ca 0.40 -0.28 0.09 0.00 -0.84 0.00 0.00 61.79 61.16 1taw h SER 236 Cb 0.44 0.02 -0.07 0.00 0.14 0.00 0.00 62.40 62.93 1taw h SER 236 CO -0.17 0.25 0.11 -0.25 -1.14 0.00 0.00 176.83 175.63 1taw h TRP 237 N -0.40 0.19 -0.36 3.45 7.01 -1.72 0.32 115.95 124.43 1taw h TRP 237 Ca -0.01 0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.06 1taw h TRP 237 Cb 0.35 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 27.37 1taw h TRP 237 CO 0.03 0.01 0.12 0.82 -2.79 0.00 0.00 178.44 176.63 1taw h ILE 238 N 0.25 0.89 -0.53 2.65 2.04 -0.87 0.11 117.51 122.06 1taw h ILE 238 Ca 0.26 -0.09 -0.07 0.00 1.00 0.00 0.00 64.86 65.95 1taw h ILE 238 Cb 0.34 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1taw h ILE 238 CO -0.32 0.05 0.05 0.11 0.00 0.00 0.00 178.15 178.04 1taw h LYS 239 N 0.27 0.89 -0.40 2.37 1.57 0.24 -0.69 116.57 120.83 1taw h LYS 239 Ca 0.16 -0.26 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1taw h LYS 239 Cb 0.14 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1taw h LYS 239 CO -0.17 0.89 0.16 1.96 -0.57 0.00 0.00 179.45 181.72 1taw h GLN 240 N 0.77 0.59 -0.27 3.15 7.50 0.13 -1.43 115.11 125.55 1taw h GLN 240 Ca 0.16 -0.11 -0.03 0.00 0.50 0.00 0.00 58.65 59.16 1taw h GLN 240 Cb 0.45 -0.10 -0.01 0.00 0.05 0.00 0.00 27.48 27.88 1taw h GLN 240 CO 0.02 0.56 0.04 1.15 -1.50 0.00 0.00 178.83 179.10 1taw h THR 241 N 0.50 1.24 -0.36 -0.54 2.02 -0.66 -0.82 112.91 114.28 1taw h THR 241 Ca 0.13 -0.81 -0.00 0.00 0.77 0.00 0.00 66.41 66.50 1taw h THR 241 Cb 0.19 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 1taw h THR 241 CO -0.01 0.26 0.22 0.40 0.37 0.00 0.00 175.52 176.76 1taw h ILE 242 N 0.27 1.12 0.00 3.11 2.04 -1.03 -1.93 117.51 121.08 1taw h ILE 242 Ca 0.08 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 1taw h ILE 242 Cb 0.35 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1taw h ILE 242 CO 0.01 0.12 -0.30 0.00 0.00 0.00 0.00 178.15 177.98 1taw h ALA 243 N 1.09 1.38 -0.43 1.87 0.00 -1.13 -2.87 119.26 119.17 1taw h ALA 243 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1taw h ALA 243 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1taw h ALA 243 CO -0.02 0.37 0.00 0.43 0.00 0.00 0.00 179.25 180.03 1taw n SER 244 N -4.01 2.83 0.00 0.00 7.64 -0.32 -5.10 113.62 114.67 1taw n SER 244 Ca -0.02 -1.94 0.00 0.00 1.01 0.00 0.00 58.87 57.92 1taw n SER 244 Cb 0.36 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 1taw n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62