#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qbo s VAL 8 N 0.00 4.38 -1.36 1.39 1.01 0.11 -4.02 120.40 121.90 1qbo s VAL 8 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.77 1qbo s VAL 8 Cb 0.00 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.50 1qbo s VAL 8 CO 0.00 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1qbo n GLY 9 N 2.65 1.37 0.00 4.51 0.00 -1.25 -1.89 105.19 110.57 1qbo n GLY 9 Ca -0.18 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1qbo n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qbo n GLY 10 N -1.39 1.45 3.36 -0.02 0.00 -1.26 -4.90 105.19 102.42 1qbo n GLY 10 Ca -0.13 -2.02 -0.18 0.00 0.00 0.00 0.00 46.02 43.69 1qbo n GLY 10 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1qbo s TYR 11 N 1.12 1.68 -0.18 1.61 -0.85 0.72 -4.91 117.35 116.53 1qbo s TYR 11 Ca 0.00 -0.80 -0.29 0.00 -0.52 0.00 0.00 57.07 55.46 1qbo s TYR 11 Cb 0.00 -0.94 -0.02 0.00 0.38 0.00 0.00 41.96 41.38 1qbo s TYR 11 CO 0.00 0.12 1.34 0.99 -1.52 0.00 0.00 175.55 176.48 1qbo s THR 12 N -3.23 4.13 0.21 -3.49 2.01 -1.26 0.05 115.64 114.07 1qbo s THR 12 Ca 0.27 1.35 -0.10 0.00 0.31 0.00 0.00 61.69 63.52 1qbo s THR 12 Cb 0.04 -3.94 0.17 0.00 0.01 0.00 0.00 72.50 68.78 1qbo s THR 12 CO 0.09 -0.20 1.89 0.00 -0.69 0.00 0.00 174.62 175.70 1qbo n GLY 14 N -1.31 2.73 3.68 0.00 0.00 -1.26 -4.79 105.19 104.24 1qbo n GLY 14 Ca 0.08 -1.57 -0.48 0.00 0.00 0.00 0.00 46.02 44.06 1qbo n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qbo n ALA 15 N 1.11 0.99 -3.67 4.61 0.00 -1.26 -2.95 120.51 119.34 1qbo n ALA 15 Ca 0.00 0.31 -0.23 0.00 0.00 0.00 0.00 53.44 53.53 1qbo n ALA 15 Cb 0.00 -2.47 0.05 0.00 0.00 0.00 0.00 19.45 17.03 1qbo n ALA 15 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1qbo n ASN 16 N 6.03 -2.96 0.04 0.00 4.13 -1.26 -4.91 115.26 116.33 1qbo n ASN 16 Ca 0.21 -0.72 0.11 0.00 1.68 0.00 0.00 54.58 55.86 1qbo n ASN 16 Cb 0.30 -4.41 -0.09 0.00 -1.54 0.00 0.00 39.78 34.03 1qbo n ASN 16 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 1qbo n THR 17 N -4.45 0.24 -3.45 3.41 -1.04 -1.15 -4.40 114.28 103.44 1qbo n THR 17 Ca -0.18 -0.48 -0.27 0.00 -2.04 0.00 0.00 64.05 61.09 1qbo n THR 17 Cb 0.63 -0.07 -0.08 0.00 -1.82 0.00 0.00 70.33 68.98 1qbo n THR 17 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1qbo n VAL 18 N -2.36 2.13 0.30 12.58 0.31 -1.26 -4.98 118.33 125.05 1qbo n VAL 18 Ca -0.02 -5.12 0.18 0.00 -0.01 0.00 0.00 64.34 59.37 1qbo n VAL 18 Cb 0.54 -2.10 1.01 0.00 -0.91 0.00 0.00 33.84 32.38 1qbo n VAL 18 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1qbo h PRO 19 N 4.27 0.00 -0.00 5.55 0.13 -1.79 -2.42 132.00 137.73 1qbo h PRO 19 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1qbo h PRO 19 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1qbo h PRO 19 CO 0.81 0.00 -0.29 2.48 -0.23 0.00 0.00 178.00 180.77 1qbo n TYR 20 N -3.50 0.00 -2.36 1.56 0.18 -1.10 -2.09 117.16 109.84 1qbo n TYR 20 Ca -0.02 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.35 1qbo n TYR 20 Cb 0.14 -0.23 -0.03 0.00 -0.38 0.00 0.00 39.34 38.84 1qbo n TYR 20 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1qbo s GLN 21 N -2.74 4.49 0.04 -3.48 2.00 -0.92 -1.50 119.66 117.56 1qbo s GLN 21 Ca 0.19 1.89 0.06 0.00 -2.00 0.00 0.00 55.36 55.50 1qbo s GLN 21 Cb 0.19 -3.23 -0.02 0.00 0.80 0.00 0.00 33.01 30.74 1qbo s GLN 21 CO 0.58 -0.09 -0.16 0.08 -0.50 0.00 0.00 175.29 175.20 1qbo s VAL 22 N -0.11 1.26 -0.17 1.34 1.01 -0.04 -4.45 120.40 119.24 1qbo s VAL 22 Ca 0.53 -1.09 -0.07 0.00 0.00 0.00 0.00 61.98 61.35 1qbo s VAL 22 Cb -0.33 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 1qbo s VAL 22 CO 0.37 0.03 0.07 -0.55 0.00 0.00 0.00 175.10 175.02 1qbo s SER 23 N -1.22 5.74 -0.24 3.32 0.15 -0.63 -1.38 113.70 119.44 1qbo s SER 23 Ca 0.03 0.14 -0.14 0.00 0.70 0.00 0.00 55.95 56.68 1qbo s SER 23 Cb -0.08 -1.95 -0.04 0.00 -1.71 0.00 0.00 66.02 62.24 1qbo s SER 23 CO 0.02 0.22 0.32 -0.76 1.20 0.00 0.00 173.24 174.23 1qbo s LEU 24 N 0.11 4.09 -0.05 3.45 1.43 0.10 -0.77 118.68 127.05 1qbo s LEU 24 Ca 0.06 0.29 0.04 0.00 -1.03 0.00 0.00 54.13 53.49 1qbo s LEU 24 Cb -0.12 -2.35 -0.00 0.00 0.03 0.00 0.00 46.19 43.75 1qbo s LEU 24 CO 0.00 -0.08 -0.17 0.21 0.23 0.00 0.00 176.35 176.54 1qbo s ASN 25 N 1.35 2.16 -0.32 2.29 3.84 -0.41 -1.36 114.94 122.50 1qbo s ASN 25 Ca 0.14 -0.36 0.16 0.00 0.21 0.00 0.00 52.86 53.01 1qbo s ASN 25 Cb -0.15 -0.65 0.47 0.00 -0.55 0.00 0.00 41.25 40.36 1qbo s ASN 25 CO 0.08 0.14 1.04 -1.54 -2.79 0.00 0.00 177.10 174.03 1qbo n SER 26 N 3.22 2.29 0.00 -4.21 3.41 -1.26 -1.61 113.62 115.46 1qbo n SER 26 Ca -0.19 -2.78 0.00 0.00 -0.26 0.00 0.00 58.87 55.65 1qbo n SER 26 Cb 0.53 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1qbo n SER 26 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qbo n GLY 27 N -0.32 0.83 3.59 5.00 0.00 -1.26 -5.02 105.19 108.00 1qbo n GLY 27 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 1qbo n GLY 27 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1qbo s TYR 28 N -2.02 -0.22 0.16 1.61 1.13 -1.26 -5.15 117.35 111.60 1qbo s TYR 28 Ca 0.00 0.07 -0.30 0.00 -1.41 0.00 0.00 57.07 55.43 1qbo s TYR 28 Cb 0.00 0.55 -0.08 0.00 -1.10 0.00 0.00 41.96 41.34 1qbo s TYR 28 CO 0.00 -0.49 1.25 -1.58 -2.51 0.00 0.00 175.55 172.23 1qbo s HIS 29 N -2.91 3.36 0.00 -3.49 5.65 -1.26 -4.23 115.29 112.41 1qbo s HIS 29 Ca 0.08 1.28 0.00 0.00 0.25 0.00 0.00 55.06 56.68 1qbo s HIS 29 Cb -0.00 -3.51 0.00 0.00 -1.18 0.00 0.00 32.58 27.88 1qbo s HIS 29 CO -0.05 -1.57 0.00 1.97 -0.65 0.00 0.00 174.74 174.44 1qbo n PHE 30 N 2.98 0.00 -3.56 3.88 1.16 -0.46 -4.96 117.46 116.50 1qbo n PHE 30 Ca 0.07 0.00 -0.07 0.00 -1.87 0.00 0.00 57.45 55.58 1qbo n PHE 30 Cb 0.44 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.29 1qbo n PHE 30 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1qbo s GLY 32 N -2.53 2.01 0.10 0.00 0.00 0.72 -0.72 107.32 106.91 1qbo s GLY 32 Ca 0.07 -1.75 -0.26 0.00 0.00 0.00 0.00 44.72 42.78 1qbo s GLY 32 CO -0.07 -1.80 1.09 -0.32 0.00 0.00 0.00 173.10 172.00 1qbo s GLY 33 N -4.50 -0.22 -0.03 0.20 0.00 -0.48 -3.66 107.32 98.63 1qbo s GLY 33 Ca 0.49 0.21 0.06 0.00 0.00 0.00 0.00 44.72 45.49 1qbo s GLY 33 CO 0.31 0.70 -0.21 -0.56 0.00 0.00 0.00 173.10 173.35 1qbo s SER 34 N -3.07 2.48 -0.20 1.64 0.01 -0.65 -0.86 113.70 113.05 1qbo s SER 34 Ca 0.15 -0.39 -0.23 0.00 1.31 0.00 0.00 55.95 56.79 1qbo s SER 34 Cb 0.00 -0.46 -0.02 0.00 0.21 0.00 0.00 66.02 65.76 1qbo s SER 34 CO 0.01 0.23 0.72 -0.22 0.41 0.00 0.00 173.24 174.39 1qbo s LEU 35 N -0.29 4.14 -0.02 2.44 2.96 -0.56 -1.00 118.68 126.35 1qbo s LEU 35 Ca 0.03 0.97 0.17 0.00 -0.22 0.00 0.00 54.13 55.08 1qbo s LEU 35 Cb -0.10 -3.04 -0.25 0.00 0.50 0.00 0.00 46.19 43.30 1qbo s LEU 35 CO 0.01 -0.35 0.48 2.30 -1.32 0.00 0.00 176.35 177.47 1qbo n ILE 36 N 4.81 0.00 -3.85 6.68 -5.35 -0.75 -0.90 119.36 120.00 1qbo n ILE 36 Ca 0.02 -0.31 -0.05 0.00 -0.27 0.00 0.00 62.75 62.13 1qbo n ILE 36 Cb 0.49 0.36 0.02 0.00 -1.74 0.00 0.00 39.64 38.76 1qbo n ILE 36 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1qbo s ASN 37 N -3.61 -0.02 0.65 7.28 2.20 -1.21 -4.62 114.94 115.62 1qbo s ASN 37 Ca -0.03 -0.80 0.41 0.00 -0.94 0.00 0.00 52.86 51.51 1qbo s ASN 37 Cb 0.12 0.62 2.29 0.00 -2.00 0.00 0.00 41.25 42.28 1qbo s ASN 37 CO 0.72 -1.22 2.34 0.77 -2.94 0.00 0.00 177.10 176.77 1qbo h SER 38 N 2.00 0.00 -0.00 3.54 4.64 -1.96 -3.04 113.55 118.73 1qbo h SER 38 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1qbo h SER 38 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1qbo h SER 38 CO 0.36 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 176.25 1qbo n GLN 39 N -3.22 2.85 -4.45 4.77 6.02 -1.26 -0.66 117.38 121.43 1qbo n GLN 39 Ca -0.03 -0.34 -0.22 0.00 -0.01 0.00 0.00 57.00 56.41 1qbo n GLN 39 Cb 0.09 -0.84 -0.14 0.00 1.02 0.00 0.00 30.24 30.37 1qbo n GLN 39 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1qbo s TRP 40 N -0.79 1.37 0.02 1.08 0.52 -1.15 -0.78 118.94 119.21 1qbo s TRP 40 Ca 0.02 -0.35 0.06 0.00 0.02 0.00 0.00 56.10 55.86 1qbo s TRP 40 Cb 0.02 -0.82 -0.02 0.00 -1.15 0.00 0.00 33.47 31.51 1qbo s TRP 40 CO 0.08 0.04 -0.18 0.08 0.02 0.00 0.00 176.95 177.00 1qbo s VAL 41 N -0.78 1.40 -0.07 4.03 1.01 0.28 -1.80 120.40 124.46 1qbo s VAL 41 Ca 0.03 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.07 1qbo s VAL 41 Cb -0.08 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 1qbo s VAL 41 CO 0.01 0.24 -0.07 -0.69 0.00 0.00 0.00 175.10 174.59 1qbo s VAL 42 N -0.64 3.66 0.00 2.92 1.01 -0.17 -0.52 120.40 126.67 1qbo s VAL 42 Ca 0.06 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.55 1qbo s VAL 42 Cb -0.08 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.80 1qbo s VAL 42 CO 0.01 0.59 0.00 -0.24 0.00 0.00 0.00 175.10 175.46 1qbo n SER 43 N 2.35 0.00 -4.83 3.32 2.88 -0.40 -1.64 113.62 115.30 1qbo n SER 43 Ca -0.18 -0.79 -0.38 0.00 -1.33 0.00 0.00 58.87 56.19 1qbo n SER 43 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1qbo n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1qbo s ALA 44 N -1.56 3.69 0.42 -1.46 0.00 -1.26 -1.01 121.76 120.59 1qbo s ALA 44 Ca 0.00 -0.23 0.14 0.00 0.00 0.00 0.00 51.96 51.86 1qbo s ALA 44 Cb 0.00 -2.39 1.01 0.00 0.00 0.00 0.00 23.12 21.74 1qbo s ALA 44 CO 0.00 0.46 1.96 0.00 0.00 0.00 0.00 175.76 178.17 1qbo h ALA 45 N 4.85 2.01 0.00 0.00 0.00 -1.69 -0.84 119.26 123.59 1qbo h ALA 45 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1qbo h ALA 45 Cb 1.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1qbo h ALA 45 CO 0.62 -0.17 0.00 -2.39 0.00 0.00 0.00 179.25 177.31 1qbo n HIS 46 N -4.48 0.00 1.29 0.00 1.44 -1.26 -1.31 115.22 110.91 1qbo n HIS 46 Ca 0.11 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.96 1qbo n HIS 46 Cb 0.41 -0.34 0.35 0.00 0.12 0.00 0.00 29.99 30.53 1qbo n HIS 46 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1qbo n TYR 48 N 0.46 2.31 -3.61 0.00 4.19 -0.43 -4.97 117.16 115.11 1qbo n TYR 48 Ca 0.16 0.38 -0.12 0.00 3.31 0.00 0.00 57.90 61.63 1qbo n TYR 48 Cb 0.44 -2.49 -0.05 0.00 0.49 0.00 0.00 39.34 37.72 1qbo n TYR 48 CO 0.00 0.00 0.00 0.21 0.91 0.00 0.00 176.86 177.98 1qbo s LYS 49 N -0.33 1.02 0.04 2.98 2.20 -1.26 -5.15 119.74 119.24 1qbo s LYS 49 Ca 0.68 -0.43 -0.14 0.00 -0.36 0.00 0.00 55.97 55.72 1qbo s LYS 49 Cb -0.62 0.46 -0.06 0.00 -1.51 0.00 0.00 37.83 36.10 1qbo s LYS 49 CO 0.49 -0.38 0.44 -1.12 -0.36 0.00 0.00 175.35 174.41 1qbo s SER 50 N -2.27 6.80 -0.18 1.43 0.01 -1.26 -4.49 113.70 113.74 1qbo s SER 50 Ca -0.03 0.97 -0.00 0.00 1.31 0.00 0.00 55.95 58.20 1qbo s SER 50 Cb -0.00 -2.25 -0.00 0.00 0.21 0.00 0.00 66.02 63.98 1qbo s SER 50 CO -0.06 0.26 0.15 0.61 0.41 0.00 0.00 173.24 174.62 1qbo n GLY 51 N 1.49 0.37 3.82 3.44 0.00 -1.26 -5.05 105.19 108.00 1qbo n GLY 51 Ca -0.11 -0.35 -0.38 0.00 0.00 0.00 0.00 46.02 45.18 1qbo n GLY 51 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qbo s ILE 52 N -3.06 4.81 -0.09 -0.61 1.01 -1.26 -4.57 121.20 117.42 1qbo s ILE 52 Ca 0.01 1.12 0.04 0.00 0.00 0.00 0.00 60.65 61.82 1qbo s ILE 52 Cb -0.00 -3.85 -0.00 0.00 0.01 0.00 0.00 42.46 38.62 1qbo s ILE 52 CO 0.11 0.55 -0.24 -1.58 0.00 0.00 0.00 174.94 173.78 1qbo s GLN 53 N -1.14 2.97 -0.16 2.79 0.74 -0.63 -2.13 119.66 122.10 1qbo s GLN 53 Ca 0.28 -0.88 -0.17 0.00 0.05 0.00 0.00 55.36 54.64 1qbo s GLN 53 Cb -0.19 -2.29 -0.04 0.00 1.10 0.00 0.00 33.01 31.60 1qbo s GLN 53 CO 0.18 0.22 0.43 0.08 -0.55 0.00 0.00 175.29 175.65 1qbo s VAL 54 N 0.25 5.20 -0.25 1.34 1.01 0.24 -1.28 120.40 126.90 1qbo s VAL 54 Ca -0.16 0.82 -0.01 0.00 0.00 0.00 0.00 61.98 62.63 1qbo s VAL 54 Cb -0.17 -3.77 0.03 0.00 0.00 0.00 0.00 36.38 32.48 1qbo s VAL 54 CO 0.08 0.29 -0.07 -0.13 0.00 0.00 0.00 175.10 175.27 1qbo s ARG 55 N 0.97 2.70 0.20 2.72 0.52 0.05 -0.63 118.95 125.48 1qbo s ARG 55 Ca 0.22 -1.06 0.06 0.00 -0.52 0.00 0.00 55.73 54.43 1qbo s ARG 55 Cb -0.15 -2.98 -0.04 0.00 0.52 0.00 0.00 34.95 32.31 1qbo s ARG 55 CO 0.08 -0.45 0.12 -0.51 0.02 0.00 0.00 175.30 174.57 1qbo s LEU 56 N 1.28 3.68 -1.88 2.53 1.02 -0.22 -1.60 118.68 123.49 1qbo s LEU 56 Ca -0.02 -0.26 0.00 0.00 0.02 0.00 0.00 54.13 53.88 1qbo s LEU 56 Cb -0.17 -2.26 0.00 0.00 0.02 0.00 0.00 46.19 43.78 1qbo s LEU 56 CO -0.05 0.03 0.00 0.61 0.02 0.00 0.00 176.35 176.96 1qbo n GLY 57 N -0.65 0.55 3.78 -3.19 0.00 -1.26 -1.98 105.19 102.45 1qbo n GLY 57 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1qbo n GLY 57 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qbo s GLU 58 N -4.45 4.47 0.00 1.61 0.41 -1.26 -4.11 118.70 115.38 1qbo s GLU 58 Ca 0.00 1.46 0.00 0.00 -0.41 0.00 0.00 54.97 56.02 1qbo s GLU 58 Cb 0.00 -2.80 0.00 0.00 -1.78 0.00 0.00 34.13 29.55 1qbo s GLU 58 CO 0.00 0.15 0.00 -3.47 -0.49 0.00 0.00 175.26 171.45 1qbo n ASP 59 N 0.50 0.00 -4.64 -0.19 2.03 -1.26 -4.60 116.55 108.39 1qbo n ASP 59 Ca 0.02 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.92 1qbo n ASP 59 Cb 0.49 -0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.84 1qbo n ASP 59 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1qbo s ASN 60 N 0.75 6.73 0.00 1.67 3.84 -1.26 -3.15 114.94 123.52 1qbo s ASN 60 Ca 0.00 0.90 0.22 0.00 0.21 0.00 0.00 52.86 54.19 1qbo s ASN 60 Cb 0.00 -2.39 1.10 0.00 -0.55 0.00 0.00 41.25 39.42 1qbo s ASN 60 CO 0.00 -0.41 1.71 2.30 -2.79 0.00 0.00 177.10 177.92 1qbo n ILE 61 N 5.07 0.32 0.08 -5.21 -5.35 -0.20 -2.93 119.36 111.14 1qbo n ILE 61 Ca 0.02 0.08 0.04 0.00 -0.27 0.00 0.00 62.75 62.62 1qbo n ILE 61 Cb 0.49 -0.72 0.08 0.00 -1.74 0.00 0.00 39.64 37.75 1qbo n ILE 61 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1qbo n ASN 62 N -1.29 2.29 -3.94 7.28 3.02 -1.26 -4.96 115.26 116.39 1qbo n ASN 62 Ca 0.10 -1.72 -0.20 0.00 -0.03 0.00 0.00 54.58 52.73 1qbo n ASN 62 Cb 0.18 -0.10 -0.16 0.00 -0.61 0.00 0.00 39.78 39.09 1qbo n ASN 62 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1qbo s VAL 63 N -0.88 0.65 -0.39 2.41 1.01 -1.15 -5.10 120.40 116.95 1qbo s VAL 63 Ca 0.15 -0.22 -0.21 0.00 0.00 0.00 0.00 61.98 61.70 1qbo s VAL 63 Cb 0.09 -0.63 0.01 0.00 0.00 0.00 0.00 36.38 35.85 1qbo s VAL 63 CO 0.12 0.24 0.65 -0.69 0.00 0.00 0.00 175.10 175.42 1qbo s VAL 64 N 0.64 4.84 -2.78 2.92 1.01 -1.26 -4.66 120.40 121.11 1qbo s VAL 64 Ca -0.09 0.42 0.23 0.00 0.00 0.00 0.00 61.98 62.54 1qbo s VAL 64 Cb -0.12 -4.14 0.23 0.00 0.00 0.00 0.00 36.38 32.35 1qbo s VAL 64 CO 0.01 -0.45 1.27 -0.62 0.00 0.00 0.00 175.10 175.31 1qbo n GLU 65 N 6.19 2.27 0.00 2.72 1.02 -1.26 -5.01 120.64 126.56 1qbo n GLU 65 Ca -0.01 -1.96 0.00 0.00 -0.02 0.00 0.00 57.16 55.17 1qbo n GLU 65 Cb 0.48 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 1qbo n GLU 65 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qbo n GLY 66 N 1.34 2.18 1.13 0.62 0.00 -1.26 -4.95 105.19 104.25 1qbo n GLY 66 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1qbo n GLY 66 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qbo n ASN 67 N 0.00 3.40 -4.82 1.61 3.02 -1.26 -4.99 115.26 112.22 1qbo n ASN 67 Ca 0.00 -1.99 -0.34 0.00 -0.03 0.00 0.00 54.58 52.22 1qbo n ASN 67 Cb 0.00 -0.22 -0.07 0.00 -0.61 0.00 0.00 39.78 38.88 1qbo n ASN 67 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1qbo s GLU 68 N -1.56 4.24 -0.14 3.52 8.01 -1.26 -4.51 118.70 127.00 1qbo s GLU 68 Ca 0.38 1.04 -0.00 0.00 0.01 0.00 0.00 54.97 56.39 1qbo s GLU 68 Cb 0.23 -2.39 0.03 0.00 -4.31 0.00 0.00 34.13 27.69 1qbo s GLU 68 CO 0.32 0.09 -0.09 -0.65 0.01 0.00 0.00 175.26 174.94 1qbo s GLN 69 N -2.87 1.73 -0.33 1.61 -0.21 -0.84 -5.00 119.66 113.76 1qbo s GLN 69 Ca 0.57 -0.45 -0.06 0.00 0.02 0.00 0.00 55.36 55.44 1qbo s GLN 69 Cb -0.11 -1.90 0.03 0.00 1.00 0.00 0.00 33.01 32.03 1qbo s GLN 69 CO 0.16 -0.32 0.10 -0.06 -2.12 0.00 0.00 175.29 173.05 1qbo s PHE 70 N 1.61 3.23 -0.04 0.91 2.99 -1.26 -1.05 117.98 124.37 1qbo s PHE 70 Ca 0.03 -1.36 0.05 0.00 0.00 0.00 0.00 56.93 55.66 1qbo s PHE 70 Cb -0.14 -2.27 -0.01 0.00 0.00 0.00 0.00 43.02 40.61 1qbo s PHE 70 CO -0.09 -0.71 -0.19 0.42 -0.00 0.00 0.00 175.22 174.66 1qbo s ILE 71 N 1.42 1.53 0.55 0.64 1.01 0.19 -4.95 121.20 121.60 1qbo s ILE 71 Ca -0.01 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 59.68 1qbo s ILE 71 Cb -0.19 -1.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.92 1qbo s ILE 71 CO 0.03 0.44 1.04 -0.44 0.00 0.00 0.00 174.94 176.01 1qbo s SER 72 N -0.09 6.05 0.07 3.58 0.01 -1.26 0.81 113.70 122.87 1qbo s SER 72 Ca -0.01 1.81 -0.20 0.00 1.31 0.00 0.00 55.95 58.86 1qbo s SER 72 Cb -0.11 -2.54 -0.07 0.00 0.21 0.00 0.00 66.02 63.52 1qbo s SER 72 CO 0.02 -0.98 0.59 0.00 0.41 0.00 0.00 173.24 173.28 1qbo s ALA 73 N -2.35 3.56 -0.16 1.44 0.00 -0.90 -0.97 121.76 122.38 1qbo s ALA 73 Ca 0.64 0.07 0.17 0.00 0.00 0.00 0.00 51.96 52.84 1qbo s ALA 73 Cb -0.15 -2.68 -0.25 0.00 0.00 0.00 0.00 23.12 20.04 1qbo s ALA 73 CO 0.32 0.36 0.24 -1.13 0.00 0.00 0.00 175.76 175.55 1qbo n SER 74 N 1.82 0.22 -3.77 0.00 3.41 -0.15 -4.75 113.62 110.41 1qbo n SER 74 Ca -0.09 0.11 -0.13 0.00 -0.26 0.00 0.00 58.87 58.49 1qbo n SER 74 Cb 0.51 0.77 -0.10 0.00 -0.26 0.00 0.00 64.21 65.13 1qbo n SER 74 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1qbo s LYS 75 N -2.57 0.50 -0.04 4.33 2.20 -1.23 -5.02 119.74 117.92 1qbo s LYS 75 Ca -0.08 0.12 0.03 0.00 -0.36 0.00 0.00 55.97 55.68 1qbo s LYS 75 Cb 0.07 0.23 0.00 0.00 -1.51 0.00 0.00 37.83 36.62 1qbo s LYS 75 CO 0.83 -0.11 -0.12 -1.12 -0.36 0.00 0.00 175.35 174.48 1qbo s SER 76 N -0.55 1.59 -0.21 1.43 0.01 -1.26 -1.58 113.70 113.13 1qbo s SER 76 Ca -0.07 -0.25 -0.01 0.00 1.31 0.00 0.00 55.95 56.93 1qbo s SER 76 Cb -0.04 -0.48 0.06 0.00 0.21 0.00 0.00 66.02 65.77 1qbo s SER 76 CO 0.02 0.09 -0.02 -0.63 0.41 0.00 0.00 173.24 173.11 1qbo s ILE 77 N 0.22 1.13 0.14 1.44 1.01 -0.05 -5.00 121.20 120.09 1qbo s ILE 77 Ca -0.05 -0.93 -0.21 0.00 0.00 0.00 0.00 60.65 59.46 1qbo s ILE 77 Cb -0.11 -1.47 -0.07 0.00 0.01 0.00 0.00 42.46 40.82 1qbo s ILE 77 CO 0.01 -0.12 0.67 -0.69 0.00 0.00 0.00 174.94 174.81 1qbo s VAL 78 N 1.58 4.59 0.22 2.92 1.01 -1.26 -0.82 120.40 128.64 1qbo s VAL 78 Ca -0.04 1.35 -0.30 0.00 0.00 0.00 0.00 61.98 62.99 1qbo s VAL 78 Cb -0.18 -3.95 -0.15 0.00 0.00 0.00 0.00 36.38 32.10 1qbo s VAL 78 CO -0.07 0.44 0.98 1.57 0.00 0.00 0.00 175.10 178.02 1qbo n HIS 79 N 1.36 0.94 0.22 5.22 -0.00 -0.97 -4.85 115.22 117.15 1qbo n HIS 79 Ca -0.07 0.76 0.14 0.00 0.46 0.00 0.00 57.72 59.01 1qbo n HIS 79 Cb 0.50 -2.20 0.77 0.00 -0.12 0.00 0.00 29.99 28.94 1qbo n HIS 79 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1qbo h PRO 80 N 2.38 0.00 -0.35 1.57 0.13 -1.93 -2.45 132.00 131.34 1qbo h PRO 80 Ca -0.39 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.69 1qbo h PRO 80 Cb 1.36 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.47 1qbo h PRO 80 CO 0.64 0.00 0.02 0.43 -0.23 0.00 0.00 178.00 178.86 1qbo n SER 81 N -4.16 4.01 -4.75 1.44 7.64 -1.26 -5.02 113.62 111.52 1qbo n SER 81 Ca -0.00 -3.12 -0.41 0.00 1.01 0.00 0.00 58.87 56.34 1qbo n SER 81 Cb 0.21 -0.59 -0.02 0.00 -1.01 0.00 0.00 64.21 62.80 1qbo n SER 81 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1qbo s TYR 82 N -2.90 2.98 -0.22 1.43 6.14 -0.93 -4.66 117.35 119.20 1qbo s TYR 82 Ca 0.45 1.11 0.01 0.00 0.64 0.00 0.00 57.07 59.28 1qbo s TYR 82 Cb 0.37 -3.82 0.05 0.00 0.42 0.00 0.00 41.96 38.98 1qbo s TYR 82 CO 0.09 -2.57 -0.08 1.21 0.64 0.00 0.00 175.55 174.85 1qbo s ASN 83 N 0.16 3.71 0.52 4.32 3.84 -0.93 -5.00 114.94 121.57 1qbo s ASN 83 Ca 0.57 -1.08 0.34 0.00 0.21 0.00 0.00 52.86 52.90 1qbo s ASN 83 Cb -0.42 -1.22 1.49 0.00 -0.55 0.00 0.00 41.25 40.55 1qbo s ASN 83 CO 0.47 -0.20 2.00 0.77 -2.79 0.00 0.00 177.10 177.35 1qbo h SER 84 N 7.95 0.00 -0.07 -4.21 4.64 -1.94 0.25 113.55 120.17 1qbo h SER 84 Ca -0.22 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.90 1qbo h SER 84 Cb 1.08 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1qbo h SER 84 CO 0.44 0.00 -0.77 0.78 -0.87 0.00 0.00 176.83 176.41 1qbo h ASN 85 N 0.00 0.80 0.00 4.97 -0.26 -1.97 -3.35 115.58 115.76 1qbo h ASN 85 Ca 0.00 -0.69 -0.07 0.00 -0.56 0.00 0.00 56.30 54.98 1qbo h ASN 85 Cb 0.39 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.40 1qbo h ASN 85 CO 0.00 1.37 -2.07 0.35 -1.06 0.00 0.00 177.43 176.01 1qbo n THR 86 N -4.03 0.27 -1.40 2.81 -2.24 -1.19 -4.98 114.28 103.52 1qbo n THR 86 Ca -0.09 -0.57 -0.09 0.00 -2.27 0.00 0.00 64.05 61.03 1qbo n THR 86 Cb 0.74 -0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 1qbo n THR 86 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1qbo n LEU 87 N -2.35 -0.78 -4.75 3.22 4.77 0.87 -5.00 117.00 112.98 1qbo n LEU 87 Ca -0.10 0.20 -0.41 0.00 -0.03 0.00 0.00 56.01 55.67 1qbo n LEU 87 Cb 0.68 -1.56 -0.04 0.00 -2.33 0.00 0.00 43.42 40.18 1qbo n LEU 87 CO 0.45 -0.43 0.83 0.21 -1.33 0.00 0.00 177.39 177.12 1qbo s ASN 88 N -2.86 7.19 -0.95 -1.43 2.47 -1.20 -3.30 114.94 114.86 1qbo s ASN 88 Ca 0.00 2.22 -0.01 0.00 0.42 0.00 0.00 52.86 55.49 1qbo s ASN 88 Cb 0.00 -2.61 -0.01 0.00 -1.45 0.00 0.00 41.25 37.18 1qbo s ASN 88 CO 0.00 -0.25 0.80 0.59 -3.72 0.00 0.00 177.10 174.52 1qbo n ASN 89 N 1.96 -2.64 -4.52 -4.21 4.13 -1.26 -2.18 115.26 106.54 1qbo n ASN 89 Ca 0.02 -0.51 -0.43 0.00 1.68 0.00 0.00 54.58 55.33 1qbo n ASN 89 Cb 0.45 -4.27 -0.00 0.00 -1.54 0.00 0.00 39.78 34.42 1qbo n ASN 89 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1qbo s ASP 90 N -3.98 6.92 -0.22 6.41 2.15 -1.21 -4.29 116.67 122.45 1qbo s ASP 90 Ca 0.06 -2.62 -0.23 0.00 0.43 0.00 0.00 52.55 50.19 1qbo s ASP 90 Cb -0.01 -2.49 0.06 0.00 -0.30 0.00 0.00 42.92 40.19 1qbo s ASP 90 CO 0.59 -0.99 0.64 -0.51 -0.17 0.00 0.00 175.17 174.73 1qbo s ILE 91 N 2.95 0.00 0.03 4.11 2.07 -1.26 -3.95 121.20 125.16 1qbo s ILE 91 Ca 0.47 -0.01 -0.09 0.00 -1.41 0.00 0.00 60.65 59.61 1qbo s ILE 91 Cb 0.00 -0.89 0.00 0.00 0.13 0.00 0.00 42.46 41.70 1qbo s ILE 91 CO 0.02 -0.01 0.18 -0.32 -1.91 0.00 0.00 174.94 172.90 1qbo s MET 92 N 0.18 0.65 0.03 3.50 -2.45 -0.18 -2.29 119.30 118.73 1qbo s MET 92 Ca -0.01 -0.60 0.07 0.00 -1.25 0.00 0.00 55.69 53.90 1qbo s MET 92 Cb -0.04 0.27 -0.03 0.00 1.25 0.00 0.00 34.83 36.28 1qbo s MET 92 CO 0.02 -0.18 -0.18 -0.51 1.05 0.00 0.00 175.02 175.21 1qbo s LEU 93 N -1.96 2.57 -0.10 4.11 1.43 -0.00 -1.28 118.68 123.45 1qbo s LEU 93 Ca -0.07 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 1qbo s LEU 93 Cb -0.02 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.72 1qbo s LEU 93 CO -0.03 0.27 -0.09 -0.63 0.23 0.00 0.00 176.35 176.10 1qbo s ILE 94 N -0.88 1.04 -0.13 -0.59 1.01 0.32 -0.87 121.20 121.10 1qbo s ILE 94 Ca 0.14 -0.34 -0.13 0.00 0.00 0.00 0.00 60.65 60.32 1qbo s ILE 94 Cb -0.10 -1.03 -0.05 0.00 0.01 0.00 0.00 42.46 41.29 1qbo s ILE 94 CO 0.04 0.36 0.29 -0.75 0.00 0.00 0.00 174.94 174.88 1qbo s LYS 95 N 1.38 4.10 0.29 2.79 2.20 -0.61 -0.55 119.74 129.34 1qbo s LYS 95 Ca -0.01 0.11 -0.23 0.00 -0.36 0.00 0.00 55.97 55.48 1qbo s LYS 95 Cb -0.14 -3.37 -0.09 0.00 -1.51 0.00 0.00 37.83 32.73 1qbo s LYS 95 CO -0.05 0.37 0.85 -0.51 -0.36 0.00 0.00 175.35 175.66 1qbo s LEU 96 N 0.05 4.30 0.34 5.43 1.43 0.04 -0.97 118.68 129.30 1qbo s LEU 96 Ca 0.17 1.65 0.03 0.00 -1.03 0.00 0.00 54.13 54.95 1qbo s LEU 96 Cb -0.13 -3.90 0.64 0.00 0.03 0.00 0.00 46.19 42.83 1qbo s LEU 96 CO 0.05 -0.06 1.98 0.11 0.23 0.00 0.00 176.35 178.66 1qbo h LYS 97 N 3.14 0.85 -4.39 1.70 6.56 -1.35 -3.43 116.57 119.66 1qbo h LYS 97 Ca -0.47 -0.05 -0.16 0.00 -1.06 0.00 0.00 60.65 58.90 1qbo h LYS 97 Cb 1.19 -0.19 -0.15 0.00 -0.57 0.00 0.00 32.23 32.51 1qbo h LYS 97 CO 0.65 0.56 -0.69 -1.54 -2.06 0.00 0.00 179.45 176.37 1qbo s SER 98 N -6.30 0.72 0.32 0.86 1.04 -1.26 -5.00 113.70 104.08 1qbo s SER 98 Ca -0.10 -0.98 -0.28 0.00 0.48 0.00 0.00 55.95 55.06 1qbo s SER 98 Cb 0.19 0.16 -0.10 0.00 0.10 0.00 0.00 66.02 66.37 1qbo s SER 98 CO 0.77 -0.54 1.18 0.00 0.98 0.00 0.00 173.24 175.64 1qbo s ALA 99 N -3.71 3.39 0.59 5.32 0.00 -1.26 -4.88 121.76 121.21 1qbo s ALA 99 Ca 0.08 1.03 -0.14 0.00 0.00 0.00 0.00 51.96 52.93 1qbo s ALA 99 Cb 0.06 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 1qbo s ALA 99 CO -0.08 -0.39 1.03 0.00 0.00 0.00 0.00 175.76 176.33 1qbo s ALA 100 N -1.21 2.89 -0.37 0.00 0.00 0.16 -5.01 121.76 118.24 1qbo s ALA 100 Ca 0.48 0.19 -0.15 0.00 0.00 0.00 0.00 51.96 52.48 1qbo s ALA 100 Cb -0.34 -3.16 -0.00 0.00 0.00 0.00 0.00 23.12 19.62 1qbo s ALA 100 CO 0.45 -0.69 0.34 -1.12 0.00 0.00 0.00 175.76 174.74 1qbo s SER 101 N -3.30 6.15 0.20 0.00 0.01 -1.26 -4.86 113.70 110.63 1qbo s SER 101 Ca 0.60 -0.48 -0.30 0.00 1.31 0.00 0.00 55.95 57.08 1qbo s SER 101 Cb -0.13 -2.18 -0.08 0.00 0.21 0.00 0.00 66.02 63.84 1qbo s SER 101 CO 0.41 -0.39 1.02 -0.76 0.41 0.00 0.00 173.24 173.94 1qbo s LEU 102 N 1.92 4.55 0.00 2.44 1.43 -1.26 -4.86 118.68 122.90 1qbo s LEU 102 Ca 0.09 2.02 0.00 0.00 -1.03 0.00 0.00 54.13 55.21 1qbo s LEU 102 Cb -0.17 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.44 1qbo s LEU 102 CO 0.12 -0.05 0.00 -0.46 0.23 0.00 0.00 176.35 176.18 1qbo n ASN 103 N 1.96 0.00 0.14 2.29 0.23 0.11 -4.98 115.26 115.01 1qbo n ASN 103 Ca 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1qbo n ASN 103 Cb 0.47 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.35 1qbo n ASN 103 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1qbo h SER 104 N 0.00 0.00 -0.00 0.53 4.64 -1.98 -3.24 113.55 113.50 1qbo h SER 104 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qbo h SER 104 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1qbo h SER 104 CO 0.00 0.59 -0.73 0.54 -0.87 0.00 0.00 176.83 176.36 1qbo n ARG 105 N -3.75 0.61 -3.57 4.77 1.74 -1.26 -4.79 116.66 110.41 1qbo n ARG 105 Ca -0.01 -0.50 -0.28 0.00 -0.77 0.00 0.00 57.85 56.28 1qbo n ARG 105 Cb 0.61 -1.49 -0.15 0.00 -1.02 0.00 0.00 32.46 30.41 1qbo n ARG 105 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1qbo s VAL 106 N -2.74 0.00 0.04 1.55 1.01 -1.22 -4.09 120.40 114.96 1qbo s VAL 106 Ca 0.13 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 1qbo s VAL 106 Cb 0.17 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.58 1qbo s VAL 106 CO 0.72 -0.62 0.01 0.00 0.00 0.00 0.00 175.10 175.20 1qbo s ALA 107 N 2.07 0.27 0.36 5.51 0.00 -0.89 0.07 121.76 129.15 1qbo s ALA 107 Ca 0.07 -0.91 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 1qbo s ALA 107 Cb -0.16 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.17 1qbo s ALA 107 CO -0.30 -0.32 0.60 -1.54 0.00 0.00 0.00 175.76 174.20 1qbo s SER 108 N -2.43 6.33 -0.05 0.00 1.04 -1.26 -2.72 113.70 114.61 1qbo s SER 108 Ca -0.01 0.63 0.01 0.00 0.48 0.00 0.00 55.95 57.07 1qbo s SER 108 Cb 0.02 -2.11 -0.03 0.00 0.10 0.00 0.00 66.02 64.00 1qbo s SER 108 CO -0.07 -0.33 -0.06 -0.51 0.98 0.00 0.00 173.24 173.25 1qbo s ILE 109 N -2.35 3.80 0.52 -1.02 1.10 -0.08 -4.89 121.20 118.29 1qbo s ILE 109 Ca 0.43 -0.51 -0.18 0.00 -0.51 0.00 0.00 60.65 59.88 1qbo s ILE 109 Cb -0.10 -2.58 -0.07 0.00 0.15 0.00 0.00 42.46 39.85 1qbo s ILE 109 CO 0.36 0.55 1.02 -0.94 -2.11 0.00 0.00 174.94 173.82 1qbo s SER 110 N -0.97 6.32 0.40 4.50 1.04 -1.26 -4.60 113.70 119.14 1qbo s SER 110 Ca 0.14 1.77 -0.15 0.00 0.48 0.00 0.00 55.95 58.19 1qbo s SER 110 Cb -0.11 -2.54 -0.08 0.00 0.10 0.00 0.00 66.02 63.39 1qbo s SER 110 CO 0.03 -0.80 0.83 -0.76 0.98 0.00 0.00 173.24 173.53 1qbo s LEU 111 N -3.91 3.89 0.52 2.42 1.43 -1.26 -1.52 118.68 120.25 1qbo s LEU 111 Ca 0.63 1.37 -0.18 0.00 -1.03 0.00 0.00 54.13 54.92 1qbo s LEU 111 Cb -0.14 -4.23 -0.07 0.00 0.03 0.00 0.00 46.19 41.79 1qbo s LEU 111 CO 0.27 -0.36 1.02 -2.16 0.23 0.00 0.00 176.35 175.35 1qbo s PRO 112 N -3.48 3.71 0.02 1.29 0.04 -1.26 -4.81 135.00 130.51 1qbo s PRO 112 Ca 0.56 1.20 0.23 0.00 0.04 0.00 0.00 61.00 63.03 1qbo s PRO 112 Cb -0.10 -2.09 0.19 0.00 0.04 0.00 0.00 34.50 32.54 1qbo s PRO 112 CO 0.23 -0.49 1.17 0.25 0.04 0.00 0.00 177.00 178.21 1qbo n THR 113 N -1.41 0.05 -3.68 1.26 -2.24 -1.26 -4.97 114.28 102.03 1qbo n THR 113 Ca 0.08 -0.07 -0.08 0.00 -2.27 0.00 0.00 64.05 61.72 1qbo n THR 113 Cb 0.53 0.43 -0.02 0.00 -2.10 0.00 0.00 70.33 69.18 1qbo n THR 113 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1qbo s SER 114 N -3.26 -0.33 0.73 3.42 1.04 -1.26 -5.17 113.70 108.87 1qbo s SER 114 Ca 0.08 -0.33 -0.11 0.00 0.48 0.00 0.00 55.95 56.07 1qbo s SER 114 Cb 0.16 0.60 0.03 0.00 0.10 0.00 0.00 66.02 66.91 1qbo s SER 114 CO 0.77 -1.05 1.08 0.00 0.98 0.00 0.00 173.24 175.02 1qbo s ALA 116 N -2.85 3.83 0.40 0.00 0.00 -1.26 -5.10 121.76 116.78 1qbo s ALA 116 Ca 0.61 -0.61 -0.22 0.00 0.00 0.00 0.00 51.96 51.75 1qbo s ALA 116 Cb -0.17 -2.07 -0.11 0.00 0.00 0.00 0.00 23.12 20.77 1qbo s ALA 116 CO 0.53 0.70 0.93 -1.12 0.00 0.00 0.00 175.76 176.80 1qbo s SER 117 N -2.38 7.01 0.56 0.00 0.01 -1.26 -5.02 113.70 112.62 1qbo s SER 117 Ca 0.39 1.69 -0.21 0.00 1.31 0.00 0.00 55.95 59.12 1qbo s SER 117 Cb -0.12 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.53 1qbo s SER 117 CO 0.24 -0.28 1.35 0.00 0.41 0.00 0.00 173.24 174.96 1qbo s ALA 118 N -2.04 2.76 0.00 1.44 0.00 -1.26 -1.94 121.76 120.72 1qbo s ALA 118 Ca 0.59 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.86 1qbo s ALA 118 Cb -0.11 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1qbo s ALA 118 CO 0.16 -1.40 0.00 0.41 0.00 0.00 0.00 175.76 174.93 1qbo n GLY 119 N 0.74 2.13 3.73 0.00 0.00 0.29 -4.92 105.19 107.15 1qbo n GLY 119 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1qbo n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qbo s THR 120 N -2.31 3.30 0.12 2.61 2.01 -0.82 -4.66 115.64 115.89 1qbo s THR 120 Ca 0.00 1.01 -0.30 0.00 0.31 0.00 0.00 61.69 62.71 1qbo s THR 120 Cb 0.00 -3.65 -0.06 0.00 0.01 0.00 0.00 72.50 68.80 1qbo s THR 120 CO 0.00 0.12 1.02 -1.58 -0.69 0.00 0.00 174.62 173.49 1qbo s GLN 121 N 0.36 4.65 0.21 4.92 2.00 -1.26 -0.98 119.66 129.56 1qbo s GLN 121 Ca 0.59 1.55 0.05 0.00 -2.00 0.00 0.00 55.36 55.55 1qbo s GLN 121 Cb -0.36 -3.35 -0.05 0.00 0.80 0.00 0.00 33.01 30.05 1qbo s GLN 121 CO 0.35 0.13 -0.06 0.00 -0.50 0.00 0.00 175.29 175.22 1qbo s LEU 123 N -3.28 2.69 -0.03 0.00 2.96 0.16 -0.62 118.68 120.55 1qbo s LEU 123 Ca 0.24 -0.43 0.05 0.00 -0.22 0.00 0.00 54.13 53.77 1qbo s LEU 123 Cb 0.04 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 45.05 1qbo s LEU 123 CO 0.06 0.03 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.34 1qbo s ILE 124 N 1.15 2.91 0.05 6.68 1.01 0.20 -1.50 121.20 131.69 1qbo s ILE 124 Ca 0.01 -0.83 -0.07 0.00 0.00 0.00 0.00 60.65 59.76 1qbo s ILE 124 Cb -0.14 -2.14 -0.01 0.00 0.01 0.00 0.00 42.46 40.18 1qbo s ILE 124 CO -0.03 0.55 0.14 -0.94 0.00 0.00 0.00 174.94 174.66 1qbo s SER 125 N -0.82 0.15 0.00 3.58 1.04 -1.21 -0.85 113.70 115.58 1qbo s SER 125 Ca 0.12 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.01 1qbo s SER 125 Cb -0.11 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.28 1qbo s SER 125 CO 0.01 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.27 1qbo n GLY 126 N 0.53 -0.27 0.78 7.32 0.00 -0.95 -4.46 105.19 108.13 1qbo n GLY 126 Ca -0.18 -1.11 0.08 0.00 0.00 0.00 0.00 46.02 44.81 1qbo n GLY 126 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1qbo n TRP 127 N -0.53 0.80 -1.51 1.61 8.01 -1.26 -2.04 117.44 122.52 1qbo n TRP 127 Ca 0.00 -0.95 -0.30 0.00 -1.31 0.00 0.00 57.50 54.94 1qbo n TRP 127 Cb 0.00 -0.30 0.20 0.00 -2.01 0.00 0.00 31.31 29.19 1qbo n TRP 127 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1qbo s GLY 128 N -2.14 1.66 0.39 6.99 0.00 -1.23 -4.34 107.32 108.64 1qbo s GLY 128 Ca 0.41 -0.96 -0.25 0.00 0.00 0.00 0.00 44.72 43.92 1qbo s GLY 128 CO 0.07 -0.19 0.99 -2.01 0.00 0.00 0.00 173.10 171.96 1qbo n ASN 129 N -4.16 1.18 -0.72 1.64 5.15 -0.03 -2.80 115.26 115.53 1qbo n ASN 129 Ca 0.13 1.07 0.07 0.00 -0.60 0.00 0.00 54.58 55.24 1qbo n ASN 129 Cb 0.59 -1.33 0.16 0.00 -0.53 0.00 0.00 39.78 38.68 1qbo n ASN 129 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1qbo n THR 130 N -0.32 0.85 -4.61 -0.44 -2.24 0.04 -0.65 114.28 106.90 1qbo n THR 130 Ca 0.09 -0.92 -0.34 0.00 -2.27 0.00 0.00 64.05 60.61 1qbo n THR 130 Cb 0.37 0.62 -0.12 0.00 -2.10 0.00 0.00 70.33 69.11 1qbo n THR 130 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1qbo s LYS 131 N -1.01 2.92 0.03 -0.78 -0.14 -1.26 -4.50 119.74 114.99 1qbo s LYS 131 Ca 0.25 -0.55 -0.18 0.00 -1.36 0.00 0.00 55.97 54.14 1qbo s LYS 131 Cb 0.14 -2.64 -0.10 0.00 -1.68 0.00 0.00 37.83 33.55 1qbo s LYS 131 CO 0.18 0.58 1.22 1.03 -0.76 0.00 0.00 175.35 177.60 1qbo h SER 132 N 5.55 -0.54 -2.97 2.83 0.87 -1.94 -3.40 113.55 113.95 1qbo h SER 132 Ca -0.45 0.02 -0.55 0.00 -1.23 0.00 0.00 61.79 59.58 1qbo h SER 132 Cb 1.18 0.14 -0.40 0.00 -0.44 0.00 0.00 62.40 62.88 1qbo h SER 132 CO 0.54 -0.37 -0.77 -0.55 -0.53 0.00 0.00 176.83 175.15 1qbo s SER 133 N -3.01 3.76 0.00 6.23 0.15 -1.26 -4.37 113.70 115.20 1qbo s SER 133 Ca -0.09 -1.45 0.00 0.00 0.70 0.00 0.00 55.95 55.11 1qbo s SER 133 Cb 0.01 -0.60 0.00 0.00 -1.71 0.00 0.00 66.02 63.72 1qbo s SER 133 CO 0.28 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.90 1qbo n GLY 134 N 5.06 -1.66 2.88 9.45 0.00 -1.26 -5.14 105.19 114.51 1qbo n GLY 134 Ca -0.04 -1.46 -0.20 0.00 0.00 0.00 0.00 46.02 44.31 1qbo n GLY 134 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qbo s THR 135 N -2.02 0.52 -0.27 2.61 2.01 -1.26 -4.57 115.64 112.66 1qbo s THR 135 Ca 0.00 -0.09 -0.04 0.00 0.31 0.00 0.00 61.69 61.87 1qbo s THR 135 Cb 0.00 -0.56 0.15 0.00 0.01 0.00 0.00 72.50 72.10 1qbo s THR 135 CO 0.00 0.23 0.53 -0.55 -0.69 0.00 0.00 174.62 174.14 1qbo s SER 136 N 1.08 -0.82 -0.21 3.53 0.15 -1.26 -4.99 113.70 111.18 1qbo s SER 136 Ca -0.09 0.86 -0.09 0.00 0.70 0.00 0.00 55.95 57.33 1qbo s SER 136 Cb -0.14 1.84 -0.05 0.00 -1.71 0.00 0.00 66.02 65.97 1qbo s SER 136 CO -0.01 -0.26 0.12 -0.31 1.20 0.00 0.00 173.24 173.98 1qbo s TYR 137 N 2.76 3.32 0.60 3.44 2.02 -1.26 -0.78 117.35 127.45 1qbo s TYR 137 Ca 0.11 0.19 -0.13 0.00 -0.37 0.00 0.00 57.07 56.88 1qbo s TYR 137 Cb -0.14 -2.18 -0.04 0.00 -0.40 0.00 0.00 41.96 39.19 1qbo s TYR 137 CO -0.18 0.14 1.02 -1.25 -1.57 0.00 0.00 175.55 173.71 1qbo s PRO 138 N 0.68 3.58 -0.11 -1.71 0.04 -1.26 -4.99 135.00 131.23 1qbo s PRO 138 Ca 0.06 0.87 0.16 0.00 0.04 0.00 0.00 61.00 62.13 1qbo s PRO 138 Cb -0.12 -2.08 -0.24 0.00 0.04 0.00 0.00 34.50 32.10 1qbo s PRO 138 CO 0.01 -0.58 0.39 -0.25 0.04 0.00 0.00 177.00 176.61 1qbo n ASP 139 N -2.42 0.44 -4.88 6.66 8.00 -1.26 -4.91 116.55 118.18 1qbo n ASP 139 Ca 0.07 0.21 -0.26 0.00 0.71 0.00 0.00 54.79 55.52 1qbo n ASP 139 Cb 0.54 0.50 -0.04 0.00 -0.02 0.00 0.00 41.12 42.10 1qbo n ASP 139 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1qbo s VAL 140 N -2.59 4.93 0.27 2.53 -7.23 -1.26 -1.04 120.40 116.01 1qbo s VAL 140 Ca -0.07 -0.91 -0.30 0.00 -1.81 0.00 0.00 61.98 58.89 1qbo s VAL 140 Cb 0.07 -3.55 -0.10 0.00 0.56 0.00 0.00 36.38 33.36 1qbo s VAL 140 CO 0.83 -0.13 1.43 -0.22 -0.31 0.00 0.00 175.10 176.70 1qbo s LEU 141 N -3.27 4.39 0.01 1.32 0.20 -1.19 -4.81 118.68 115.33 1qbo s LEU 141 Ca 0.33 2.69 0.04 0.00 0.69 0.00 0.00 54.13 57.88 1qbo s LEU 141 Cb -0.10 -3.63 -0.03 0.00 -0.43 0.00 0.00 46.19 42.00 1qbo s LEU 141 CO 0.26 -0.69 -0.10 -0.54 -0.29 0.00 0.00 176.35 174.99 1qbo s LYS 142 N -0.66 2.43 0.14 1.98 -0.14 -0.87 -2.28 119.74 120.35 1qbo s LYS 142 Ca 0.58 -0.79 0.08 0.00 -1.36 0.00 0.00 55.97 54.48 1qbo s LYS 142 Cb -0.42 -2.41 -0.04 0.00 -1.68 0.00 0.00 37.83 33.28 1qbo s LYS 142 CO 0.46 0.59 -0.19 0.00 -0.76 0.00 0.00 175.35 175.45 1qbo s LEU 144 N -2.43 -0.20 -0.17 0.00 2.96 -0.03 -0.20 118.68 118.60 1qbo s LEU 144 Ca 0.12 0.95 -0.19 0.00 -0.22 0.00 0.00 54.13 54.80 1qbo s LEU 144 Cb -0.07 1.43 -0.03 0.00 0.50 0.00 0.00 46.19 48.01 1qbo s LEU 144 CO 0.06 -0.20 0.52 -0.54 -1.32 0.00 0.00 176.35 174.87 1qbo s LYS 145 N 1.52 4.24 -0.12 1.98 1.02 -1.26 -0.63 119.74 126.48 1qbo s LYS 145 Ca -0.09 0.45 -0.17 0.00 0.02 0.00 0.00 55.97 56.18 1qbo s LYS 145 Cb -0.08 -3.53 0.04 0.00 -0.52 0.00 0.00 37.83 33.74 1qbo s LYS 145 CO -0.13 -0.07 0.44 0.00 -0.92 0.00 0.00 175.35 174.67 1qbo s ALA 146 N 1.37 -1.11 0.39 5.17 0.00 0.21 -4.95 121.76 122.84 1qbo s ALA 146 Ca 0.25 1.08 -0.07 0.00 0.00 0.00 0.00 51.96 53.21 1qbo s ALA 146 Cb -0.15 -0.49 -0.05 0.00 0.00 0.00 0.00 23.12 22.42 1qbo s ALA 146 CO 0.10 -0.24 0.71 -1.25 0.00 0.00 0.00 175.76 175.09 1qbo s PRO 147 N -0.24 3.67 0.09 0.00 0.04 -1.26 0.05 135.00 137.35 1qbo s PRO 147 Ca -0.04 0.26 -0.30 0.00 0.04 0.00 0.00 61.00 60.96 1qbo s PRO 147 Cb -0.03 -2.46 -0.05 0.00 0.04 0.00 0.00 34.50 31.99 1qbo s PRO 147 CO 0.02 -0.01 1.01 0.42 0.04 0.00 0.00 177.00 178.48 1qbo s ILE 148 N -2.39 4.43 0.46 0.56 1.01 -0.15 -1.92 121.20 123.20 1qbo s ILE 148 Ca 0.48 1.93 -0.09 0.00 0.00 0.00 0.00 60.65 62.98 1qbo s ILE 148 Cb -0.10 -4.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.08 1qbo s ILE 148 CO 0.35 0.25 0.81 -0.76 0.00 0.00 0.00 174.94 175.59 1qbo s LEU 149 N 0.28 3.68 0.62 2.97 1.43 -0.50 0.11 118.68 127.27 1qbo s LEU 149 Ca 0.50 1.09 -0.18 0.00 -1.03 0.00 0.00 54.13 54.51 1qbo s LEU 149 Cb -0.24 -4.02 -0.02 0.00 0.03 0.00 0.00 46.19 41.94 1qbo s LEU 149 CO 0.30 -0.52 1.17 -0.94 0.23 0.00 0.00 176.35 176.59 1qbo s SER 150 N -3.64 5.11 0.28 2.29 1.04 -1.26 -4.65 113.70 112.87 1qbo s SER 150 Ca 0.50 2.27 -0.03 0.00 0.48 0.00 0.00 55.95 59.17 1qbo s SER 150 Cb -0.10 -2.58 0.39 0.00 0.10 0.00 0.00 66.02 63.82 1qbo s SER 150 CO 0.39 -1.64 1.90 0.44 0.98 0.00 0.00 173.24 175.30 1qbo h ASP 151 N 0.58 0.92 -0.58 7.02 3.32 -1.97 -2.47 116.42 123.24 1qbo h ASP 151 Ca -0.49 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 56.43 1qbo h ASP 151 Cb 1.28 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.57 1qbo h ASP 151 CO 0.54 0.75 0.19 0.77 -1.72 0.00 0.00 179.24 179.77 1qbo h SER 152 N 1.02 0.85 -0.88 6.45 4.64 -1.99 -1.28 113.55 122.36 1qbo h SER 152 Ca 0.26 -0.20 0.01 0.00 -0.47 0.00 0.00 61.79 61.38 1qbo h SER 152 Cb 0.06 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 61.88 1qbo h SER 152 CO -0.04 0.83 0.57 0.28 -0.87 0.00 0.00 176.83 177.60 1qbo h SER 153 N 0.82 1.02 -0.07 4.97 0.02 -1.84 -1.75 113.55 116.73 1qbo h SER 153 Ca 0.19 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1qbo h SER 153 Cb 0.28 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 1qbo h SER 153 CO -0.01 0.75 0.02 0.00 -1.14 0.00 0.00 176.83 176.45 1qbo h LYS 155 N -0.09 0.00 -0.14 0.00 1.57 -1.18 -2.59 116.57 114.14 1qbo h LYS 155 Ca 0.02 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.63 1qbo h LYS 155 Cb 0.23 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 1qbo h LYS 155 CO -0.00 0.44 -0.64 0.77 -0.57 0.00 0.00 179.45 179.45 1qbo h SER 156 N 0.00 0.61 -0.15 0.86 0.02 -1.30 -2.68 113.55 110.91 1qbo h SER 156 Ca -0.00 -0.36 -0.13 0.00 -0.84 0.00 0.00 61.79 60.46 1qbo h SER 156 Cb 0.81 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 1qbo h SER 156 CO 0.06 1.10 -0.34 0.00 -1.14 0.00 0.00 176.83 176.51 1qbo h ALA 157 N 0.90 0.86 -2.53 3.77 0.00 -1.14 -3.37 119.26 117.75 1qbo h ALA 157 Ca -0.01 -0.41 -0.60 0.00 0.00 0.00 0.00 54.91 53.89 1qbo h ALA 157 Cb 1.21 -0.12 -0.40 0.00 0.00 0.00 0.00 17.79 18.48 1qbo h ALA 157 CO 0.12 0.64 -0.82 0.66 0.00 0.00 0.00 179.25 179.85 1qbo n TYR 158 N -4.06 1.09 -1.78 0.00 4.02 -1.00 -4.96 117.16 110.47 1qbo n TYR 158 Ca -0.01 -3.78 -0.42 0.00 -0.01 0.00 0.00 57.90 53.68 1qbo n TYR 158 Cb 0.48 -0.22 -0.03 0.00 -0.02 0.00 0.00 39.34 39.56 1qbo n TYR 158 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 1qbo s PRO 159 N -0.94 4.15 0.00 -0.72 0.02 -1.02 -2.42 135.00 134.08 1qbo s PRO 159 Ca 0.31 2.54 0.00 0.00 0.02 0.00 0.00 61.00 63.87 1qbo s PRO 159 Cb 0.04 -3.20 0.00 0.00 0.02 0.00 0.00 34.50 31.36 1qbo s PRO 159 CO -0.15 -0.73 0.00 0.41 -0.33 0.00 0.00 177.00 176.19 1qbo n GLY 160 N 3.97 0.73 0.00 0.52 0.00 -1.26 -4.86 105.19 104.29 1qbo n GLY 160 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1qbo n GLY 160 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1qbo n GLN 161 N -2.00 2.61 -3.62 1.61 6.02 -1.01 -4.98 117.38 116.00 1qbo n GLN 161 Ca 0.00 -0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.62 1qbo n GLN 161 Cb 0.01 -1.12 -0.08 0.00 1.02 0.00 0.00 30.24 30.06 1qbo n GLN 161 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1qbo s ILE 162 N -2.26 5.34 0.49 5.09 -1.09 -1.25 -5.04 121.20 122.49 1qbo s ILE 162 Ca 0.05 0.32 0.07 0.00 -2.23 0.00 0.00 60.65 58.86 1qbo s ILE 162 Cb 0.10 -3.55 0.02 0.00 -1.58 0.00 0.00 42.46 37.45 1qbo s ILE 162 CO 0.54 0.37 0.44 0.42 -1.23 0.00 0.00 174.94 175.47 1qbo s THR 163 N 0.77 2.18 -1.24 2.92 -4.23 -1.26 -5.00 115.64 109.78 1qbo s THR 163 Ca 0.11 -1.37 0.14 0.00 -1.18 0.00 0.00 61.69 59.39 1qbo s THR 163 Cb -0.13 -2.55 0.18 0.00 1.34 0.00 0.00 72.50 71.35 1qbo s THR 163 CO 0.03 0.00 1.39 -1.54 -0.54 0.00 0.00 174.62 173.96 1qbo n SER 164 N -1.72 0.00 -1.81 3.99 3.41 -1.26 -2.56 113.62 113.68 1qbo n SER 164 Ca 0.03 0.27 0.07 0.00 -0.26 0.00 0.00 58.87 58.98 1qbo n SER 164 Cb 0.63 -0.38 0.38 0.00 -0.26 0.00 0.00 64.21 64.58 1qbo n SER 164 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1qbo n ASN 165 N -1.38 5.45 -4.15 4.04 3.02 -1.26 -4.94 115.26 116.04 1qbo n ASN 165 Ca 0.05 -2.86 -0.13 0.00 -0.03 0.00 0.00 54.58 51.62 1qbo n ASN 165 Cb 0.13 -0.67 -0.11 0.00 -0.61 0.00 0.00 39.78 38.52 1qbo n ASN 165 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1qbo s MET 166 N -2.62 0.77 0.07 3.52 -1.94 -1.06 -1.54 119.30 116.50 1qbo s MET 166 Ca 0.52 -1.13 -0.07 0.00 -1.71 0.00 0.00 55.69 53.30 1qbo s MET 166 Cb 0.39 -0.37 -0.01 0.00 2.01 0.00 0.00 34.83 36.85 1qbo s MET 166 CO 0.16 0.04 0.13 -0.59 -0.01 0.00 0.00 175.02 174.75 1qbo s PHE 167 N -2.61 0.22 0.03 -0.03 -0.12 -0.78 -4.82 117.98 109.87 1qbo s PHE 167 Ca 0.04 -0.62 0.03 0.00 -0.05 0.00 0.00 56.93 56.34 1qbo s PHE 167 Cb -0.02 -0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.20 1qbo s PHE 167 CO -0.01 -0.47 -0.03 0.00 -0.05 0.00 0.00 175.22 174.66 1qbo s ALA 169 N -1.13 -0.06 0.00 0.00 0.00 -0.95 -1.41 121.76 118.21 1qbo s ALA 169 Ca 0.21 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.87 1qbo s ALA 169 Cb -0.11 0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1qbo s ALA 169 CO 0.12 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1qbo n GLY 170 N 1.88 0.52 2.84 0.00 0.00 -0.81 -2.37 105.19 107.25 1qbo n GLY 170 Ca -0.21 -1.63 -0.26 0.00 0.00 0.00 0.00 46.02 43.91 1qbo n GLY 170 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qbo s TYR 171 N -2.90 1.28 0.43 1.61 1.51 -1.26 -4.39 117.35 113.63 1qbo s TYR 171 Ca 0.00 -0.72 0.12 0.00 -1.01 0.00 0.00 57.07 55.46 1qbo s TYR 171 Cb 0.00 -1.12 0.99 0.00 -0.11 0.00 0.00 41.96 41.72 1qbo s TYR 171 CO 0.00 -0.51 2.00 -0.07 -1.11 0.00 0.00 175.55 175.86 1qbo h LEU 172 N 8.21 0.39 0.00 -1.29 3.38 -1.95 -0.17 115.31 123.88 1qbo h LEU 172 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1qbo h LEU 172 Cb 1.12 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1qbo h LEU 172 CO 0.36 0.25 0.00 -1.84 0.09 0.00 0.00 178.44 177.29 1qbo n GLU 173 N -4.47 0.48 0.00 1.13 0.00 -1.26 0.15 120.64 116.67 1qbo n GLU 173 Ca 0.08 0.04 0.00 0.00 0.00 0.00 0.00 57.16 57.28 1qbo n GLU 173 Cb 0.28 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.22 1qbo n GLU 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1qbo n GLY 174 N 0.28 -1.31 3.09 -1.84 0.00 -0.08 -4.57 105.19 100.78 1qbo n GLY 174 Ca 0.13 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1qbo n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qbo n GLY 175 N 0.00 2.67 2.85 -0.02 0.00 0.75 -4.87 105.19 106.57 1qbo n GLY 175 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1qbo n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qbo s LYS 176 N -0.03 0.90 0.12 1.61 1.02 -1.26 -3.84 119.74 118.27 1qbo s LYS 176 Ca 0.00 -0.05 -0.25 0.00 0.02 0.00 0.00 55.97 55.69 1qbo s LYS 176 Cb 0.00 -1.07 0.08 0.00 -0.52 0.00 0.00 37.83 36.33 1qbo s LYS 176 CO 0.00 -0.21 1.08 0.34 -0.92 0.00 0.00 175.35 175.64 1qbo s ASP 177 N 1.52 -0.07 0.65 2.83 3.68 -0.79 -4.29 116.67 120.21 1qbo s ASP 177 Ca -0.01 -0.45 -0.02 0.00 2.13 0.00 0.00 52.55 54.19 1qbo s ASP 177 Cb -0.13 0.41 0.07 0.00 -1.45 0.00 0.00 42.92 41.82 1qbo s ASP 177 CO -0.04 -0.78 0.92 -0.94 0.13 0.00 0.00 175.17 174.46 1qbo s SER 178 N -3.21 4.83 0.16 -0.34 1.04 -1.26 0.03 113.70 114.95 1qbo s SER 178 Ca 0.18 0.07 -0.02 0.00 0.48 0.00 0.00 55.95 56.66 1qbo s SER 178 Cb -0.01 -0.73 0.01 0.00 0.10 0.00 0.00 66.02 65.39 1qbo s SER 178 CO 0.02 -1.51 0.25 0.00 0.98 0.00 0.00 173.24 172.98 1qbo s GLN 180 N -2.26 4.25 0.00 0.00 -2.07 -1.26 -1.61 119.66 116.71 1qbo s GLN 180 Ca 0.11 2.33 0.00 0.00 -1.82 0.00 0.00 55.36 55.98 1qbo s GLN 180 Cb -0.01 -3.10 0.00 0.00 -1.09 0.00 0.00 33.01 28.81 1qbo s GLN 180 CO 0.08 -0.44 0.00 0.41 -1.32 0.00 0.00 175.29 174.01 1qbo n GLY 181 N 2.24 2.53 0.09 2.60 0.00 -1.26 -0.85 105.19 110.54 1qbo n GLY 181 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.21 1qbo n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qbo n ASP 182 N 0.00 0.74 -4.55 1.61 8.00 -0.64 -3.57 116.55 118.15 1qbo n ASP 182 Ca 0.00 0.22 -0.59 0.00 0.71 0.00 0.00 54.79 55.14 1qbo n ASP 182 Cb 0.00 0.58 -0.08 0.00 -0.02 0.00 0.00 41.12 41.61 1qbo n ASP 182 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1qbo n SER 183 N -2.51 0.45 0.00 -2.24 7.64 -1.26 -2.02 113.62 113.69 1qbo n SER 183 Ca 0.00 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1qbo n SER 183 Cb 0.53 -0.97 0.00 0.00 -1.01 0.00 0.00 64.21 62.76 1qbo n SER 183 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qbo n GLY 184 N 1.99 1.42 3.76 0.23 0.00 -0.56 -0.20 105.19 111.84 1qbo n GLY 184 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 1qbo n GLY 184 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qbo s GLY 185 N -1.90 1.69 0.42 -0.02 0.00 -0.86 -3.40 107.32 103.27 1qbo s GLY 185 Ca 0.00 0.30 -0.21 0.00 0.00 0.00 0.00 44.72 44.81 1qbo s GLY 185 CO 0.00 0.65 0.94 2.56 0.00 0.00 0.00 173.10 177.25 1qbo s PRO 186 N -4.86 4.22 -0.26 2.90 0.04 -1.26 -1.45 135.00 134.33 1qbo s PRO 186 Ca 0.62 1.09 -0.00 0.00 0.04 0.00 0.00 61.00 62.75 1qbo s PRO 186 Cb -0.18 -2.20 0.08 0.00 0.04 0.00 0.00 34.50 32.24 1qbo s PRO 186 CO 0.56 -0.02 0.02 0.08 0.04 0.00 0.00 177.00 177.68 1qbo s VAL 187 N -2.16 1.21 -0.17 -0.36 1.01 -0.33 -3.34 120.40 116.25 1qbo s VAL 187 Ca 0.61 -1.27 -0.03 0.00 0.00 0.00 0.00 61.98 61.30 1qbo s VAL 187 Cb -0.09 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 1qbo s VAL 187 CO 0.13 -0.36 -0.06 -0.69 0.00 0.00 0.00 175.10 174.13 1qbo s VAL 188 N 1.50 3.53 -0.06 2.92 1.01 -0.56 -0.82 120.40 127.91 1qbo s VAL 188 Ca 0.02 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.54 1qbo s VAL 188 Cb -0.18 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.67 1qbo s VAL 188 CO -0.13 0.48 -0.08 0.00 0.00 0.00 0.00 175.10 175.37 1qbo n SER 190 N 4.07 -2.40 -1.14 0.00 7.64 -1.26 -1.97 113.62 118.56 1qbo n SER 190 Ca -0.22 -0.91 -0.14 0.00 1.01 0.00 0.00 58.87 58.61 1qbo n SER 190 Cb 0.51 -3.43 -0.06 0.00 -1.01 0.00 0.00 64.21 60.22 1qbo n SER 190 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qbo n GLY 191 N -1.70 1.35 3.16 0.23 0.00 -1.26 -5.01 105.19 101.96 1qbo n GLY 191 Ca -0.13 -0.35 -0.17 0.00 0.00 0.00 0.00 46.02 45.38 1qbo n GLY 191 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qbo s LYS 192 N -3.33 0.78 -0.50 1.61 -0.14 -0.83 -4.29 119.74 113.04 1qbo s LYS 192 Ca 0.00 -0.97 -0.27 0.00 -1.36 0.00 0.00 55.97 53.36 1qbo s LYS 192 Cb 0.00 -0.68 0.03 0.00 -1.68 0.00 0.00 37.83 35.50 1qbo s LYS 192 CO 0.00 0.14 1.07 -1.17 -0.76 0.00 0.00 175.35 174.63 1qbo s LEU 193 N -1.89 3.74 -0.04 3.17 2.96 -0.57 -0.59 118.68 125.45 1qbo s LEU 193 Ca -0.01 0.23 0.16 0.00 -0.22 0.00 0.00 54.13 54.29 1qbo s LEU 193 Cb -0.08 -3.32 -0.24 0.00 0.50 0.00 0.00 46.19 43.04 1qbo s LEU 193 CO 0.02 -1.24 0.31 0.00 -1.32 0.00 0.00 176.35 174.11 1qbo n GLN 194 N 7.75 0.68 -3.97 1.98 1.13 -0.00 -4.17 117.38 120.77 1qbo n GLN 194 Ca 0.09 -0.12 -0.10 0.00 -1.94 0.00 0.00 57.00 54.93 1qbo n GLN 194 Cb 0.49 -1.39 -0.07 0.00 0.11 0.00 0.00 30.24 29.38 1qbo n GLN 194 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1qbo s GLY 195 N -4.06 0.51 -0.06 1.08 0.00 -0.85 -1.68 107.32 102.27 1qbo s GLY 195 Ca -0.06 -0.92 0.04 0.00 0.00 0.00 0.00 44.72 43.77 1qbo s GLY 195 CO 0.67 -0.87 -0.17 -0.42 0.00 0.00 0.00 173.10 172.31 1qbo s ILE 196 N -3.97 1.48 -0.00 0.90 1.01 -1.10 -1.18 121.20 118.33 1qbo s ILE 196 Ca 0.18 -0.71 -0.30 0.00 0.00 0.00 0.00 60.65 59.82 1qbo s ILE 196 Cb 0.04 -1.29 -0.08 0.00 0.01 0.00 0.00 42.46 41.13 1qbo s ILE 196 CO 0.00 0.43 1.94 -0.69 0.00 0.00 0.00 174.94 176.62 1qbo s VAL 197 N 0.28 3.11 0.01 2.92 1.01 -0.53 -0.96 120.40 126.25 1qbo s VAL 197 Ca -0.10 0.14 -0.00 0.00 0.00 0.00 0.00 61.98 62.01 1qbo s VAL 197 Cb -0.14 -3.09 -0.00 0.00 0.00 0.00 0.00 36.38 33.14 1qbo s VAL 197 CO 0.04 -0.02 -0.01 -0.24 0.00 0.00 0.00 175.10 174.87 1qbo n SER 198 N 7.88 0.15 -1.82 3.32 2.88 -0.90 -1.50 113.62 123.63 1qbo n SER 198 Ca 0.20 0.02 -0.05 0.00 -1.33 0.00 0.00 58.87 57.71 1qbo n SER 198 Cb 0.42 -0.12 -0.00 0.00 -0.75 0.00 0.00 64.21 63.75 1qbo n SER 198 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1qbo n TRP 199 N -2.64 -1.14 -1.75 0.66 4.27 -0.78 -4.94 117.44 111.13 1qbo n TRP 199 Ca -0.00 -0.92 0.00 0.00 -3.89 0.00 0.00 57.50 52.68 1qbo n TRP 199 Cb 0.01 0.30 0.00 0.00 -1.36 0.00 0.00 31.31 30.26 1qbo n TRP 199 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1qbo n GLY 200 N -0.24 -1.45 3.02 -1.67 0.00 -1.26 -1.35 105.19 102.23 1qbo n GLY 200 Ca -0.01 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.68 1qbo n GLY 200 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1qbo s SER 201 N -2.12 4.33 0.74 1.61 0.15 -1.26 -5.01 113.70 112.13 1qbo s SER 201 Ca 0.00 -1.47 0.00 0.00 0.70 0.00 0.00 55.95 55.18 1qbo s SER 201 Cb 0.00 -1.44 0.00 0.00 -1.71 0.00 0.00 66.02 62.87 1qbo s SER 201 CO 0.00 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.81 1qbo n GLY 202 N 4.48 0.41 3.05 9.45 0.00 -1.26 -4.68 105.19 116.64 1qbo n GLY 202 Ca -0.10 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 1qbo n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qbo n ALA 204 N 3.40 -0.58 -1.98 0.00 0.00 -1.26 -4.58 120.51 115.51 1qbo n ALA 204 Ca -0.17 0.17 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 1qbo n ALA 204 Cb 0.57 -1.82 -0.07 0.00 0.00 0.00 0.00 19.45 18.13 1qbo n ALA 204 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1qbo s GLN 205 N -4.61 4.14 0.39 0.00 -1.52 -1.26 -0.18 119.66 116.62 1qbo s GLN 205 Ca 0.00 0.91 -0.27 0.00 -1.95 0.00 0.00 55.36 54.06 1qbo s GLN 205 Cb 0.00 -2.36 -0.09 0.00 -0.22 0.00 0.00 33.01 30.34 1qbo s GLN 205 CO 0.00 0.09 1.30 0.21 -0.25 0.00 0.00 175.29 176.64 1qbo s LYS 206 N -2.98 4.05 -1.84 2.91 2.20 -1.26 -2.73 119.74 120.09 1qbo s LYS 206 Ca 0.57 2.15 0.00 0.00 -0.36 0.00 0.00 55.97 58.33 1qbo s LYS 206 Cb -0.10 -2.82 0.00 0.00 -1.51 0.00 0.00 37.83 33.40 1qbo s LYS 206 CO 0.16 -0.42 0.00 0.09 -0.36 0.00 0.00 175.35 174.82 1qbo n ASN 207 N 0.27 -5.51 -3.43 1.43 3.02 0.40 -4.90 115.26 106.53 1qbo n ASN 207 Ca 0.03 0.43 -0.26 0.00 -0.03 0.00 0.00 54.58 54.74 1qbo n ASN 207 Cb 0.43 -4.54 -0.09 0.00 -0.61 0.00 0.00 39.78 34.97 1qbo n ASN 207 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1qbo n LYS 208 N -1.94 0.75 -1.45 3.52 5.02 -1.11 -4.71 118.16 118.25 1qbo n LYS 208 Ca -0.17 -3.51 -0.29 0.00 -2.02 0.00 0.00 58.31 52.31 1qbo n LYS 208 Cb 0.64 -1.71 0.12 0.00 -0.02 0.00 0.00 35.03 34.06 1qbo n LYS 208 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1qbo s PRO 209 N -0.67 1.45 0.54 1.97 0.04 -1.26 -4.36 135.00 132.70 1qbo s PRO 209 Ca 0.33 0.53 -0.19 0.00 0.04 0.00 0.00 61.00 61.71 1qbo s PRO 209 Cb 0.07 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.69 1qbo s PRO 209 CO -0.16 -2.04 1.07 0.20 0.04 0.00 0.00 177.00 176.11 1qbo s GLY 210 N -3.82 2.44 -0.16 0.56 0.00 -1.00 -4.63 107.32 100.71 1qbo s GLY 210 Ca 0.63 0.62 -0.01 0.00 0.00 0.00 0.00 44.72 45.96 1qbo s GLY 210 CO 0.55 0.95 -0.11 0.14 0.00 0.00 0.00 173.10 174.63 1qbo s VAL 211 N -2.04 3.11 0.07 1.40 1.01 -0.46 -2.24 120.40 121.25 1qbo s VAL 211 Ca 0.68 -0.62 0.09 0.00 0.00 0.00 0.00 61.98 62.13 1qbo s VAL 211 Cb -0.19 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1qbo s VAL 211 CO 0.27 0.50 -0.24 -0.31 0.00 0.00 0.00 175.10 175.32 1qbo s TYR 212 N 0.67 2.10 0.13 5.22 2.02 0.08 -1.86 117.35 125.70 1qbo s TYR 212 Ca -0.06 -0.40 -0.30 0.00 -0.37 0.00 0.00 57.07 55.94 1qbo s TYR 212 Cb -0.15 -1.21 -0.07 0.00 -0.40 0.00 0.00 41.96 40.12 1qbo s TYR 212 CO 0.02 0.17 1.25 0.99 -1.57 0.00 0.00 175.55 176.42 1qbo s THR 213 N -0.90 3.62 -0.99 -0.71 2.01 -0.13 -1.87 115.64 116.66 1qbo s THR 213 Ca 0.10 1.24 -0.21 0.00 0.31 0.00 0.00 61.69 63.14 1qbo s THR 213 Cb -0.10 -3.79 0.09 0.00 0.01 0.00 0.00 72.50 68.71 1qbo s THR 213 CO 0.03 0.14 1.32 -0.75 -0.69 0.00 0.00 174.62 174.67 1qbo s LYS 214 N 0.51 3.61 0.31 4.92 2.20 -0.59 -2.69 119.74 128.02 1qbo s LYS 214 Ca 0.58 -1.45 0.05 0.00 -0.36 0.00 0.00 55.97 54.78 1qbo s LYS 214 Cb -0.33 -5.17 0.67 0.00 -1.51 0.00 0.00 37.83 31.50 1qbo s LYS 214 CO 0.33 -2.01 1.84 0.28 -0.36 0.00 0.00 175.35 175.43 1qbo h VAL 215 N 6.30 0.87 0.00 4.02 2.07 -1.63 -2.58 116.25 125.30 1qbo h VAL 215 Ca 0.19 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1qbo h VAL 215 Cb 1.01 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1qbo h VAL 215 CO 1.29 0.16 0.29 0.00 0.02 0.00 0.00 177.57 179.32 1qbo n ASN 217 N -2.91 0.34 -0.40 0.00 3.02 -0.97 -4.20 115.26 110.13 1qbo n ASN 217 Ca -0.02 0.16 0.04 0.00 -0.03 0.00 0.00 54.58 54.73 1qbo n ASN 217 Cb 0.34 -0.15 0.08 0.00 -0.61 0.00 0.00 39.78 39.44 1qbo n ASN 217 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1qbo n TYR 218 N -1.63 0.21 -0.13 3.10 4.01 0.42 -4.77 117.16 118.38 1qbo n TYR 218 Ca 0.06 -0.33 -0.06 0.00 -0.16 0.00 0.00 57.90 57.41 1qbo n TYR 218 Cb 0.36 -0.02 0.03 0.00 -0.31 0.00 0.00 39.34 39.39 1qbo n TYR 218 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1qbo h VAL 219 N 1.45 0.98 -0.48 -0.72 2.07 -1.72 0.12 116.25 117.95 1qbo h VAL 219 Ca 0.00 -0.15 -0.12 0.00 0.82 0.00 0.00 66.70 67.26 1qbo h VAL 219 Cb 0.55 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1qbo h VAL 219 CO 0.00 0.08 -0.16 0.77 0.02 0.00 0.00 177.57 178.28 1qbo h SER 220 N 0.43 0.93 -0.41 0.57 4.64 -1.91 -0.98 113.55 116.83 1qbo h SER 220 Ca 0.18 -0.32 -0.04 0.00 -0.47 0.00 0.00 61.79 61.15 1qbo h SER 220 Cb 0.09 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 61.90 1qbo h SER 220 CO -0.13 1.08 0.12 -0.25 -0.87 0.00 0.00 176.83 176.78 1qbo h TRP 221 N 0.81 0.67 -0.06 4.77 7.01 -1.81 -1.09 115.95 126.27 1qbo h TRP 221 Ca 0.12 -0.07 0.00 0.00 2.11 0.00 0.00 58.89 61.05 1qbo h TRP 221 Cb 0.70 -0.19 -0.00 0.00 -2.10 0.00 0.00 29.16 27.57 1qbo h TRP 221 CO 0.04 0.63 0.03 0.82 -2.79 0.00 0.00 178.44 177.17 1qbo h ILE 222 N 0.52 1.00 -0.41 2.65 2.04 -0.52 -1.23 117.51 121.56 1qbo h ILE 222 Ca 0.13 -0.02 -0.10 0.00 1.00 0.00 0.00 64.86 65.87 1qbo h ILE 222 Cb 0.28 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 1qbo h ILE 222 CO -0.00 0.01 -0.16 0.11 0.00 0.00 0.00 178.15 178.11 1qbo h LYS 223 N 0.07 0.77 -0.14 2.37 1.57 -1.12 -2.03 116.57 118.06 1qbo h LYS 223 Ca 0.02 -0.28 -0.20 0.00 -1.87 0.00 0.00 60.65 58.32 1qbo h LYS 223 Cb 0.00 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1qbo h LYS 223 CO -0.02 0.88 -0.74 1.96 -0.57 0.00 0.00 179.45 180.97 1qbo h GLN 224 N 0.69 0.66 -0.27 3.15 7.50 -1.09 -2.71 115.11 123.04 1qbo h GLN 224 Ca 0.11 -0.52 -0.04 0.00 0.50 0.00 0.00 58.65 58.69 1qbo h GLN 224 Cb 0.65 0.10 -0.01 0.00 0.05 0.00 0.00 27.48 28.28 1qbo h GLN 224 CO 0.05 1.14 0.00 1.15 -1.50 0.00 0.00 178.83 179.67 1qbo h THR 225 N 0.45 1.25 -0.56 -0.54 2.02 -1.15 -2.80 112.91 111.58 1qbo h THR 225 Ca -0.04 -0.91 -0.03 0.00 0.77 0.00 0.00 66.41 66.20 1qbo h THR 225 Cb 1.34 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 69.05 1qbo h THR 225 CO 0.14 0.29 0.24 0.40 0.37 0.00 0.00 175.52 176.96 1qbo h ILE 226 N 0.26 1.22 0.00 3.11 2.04 -1.44 -2.72 117.51 119.97 1qbo h ILE 226 Ca 0.08 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 1qbo h ILE 226 Cb 0.42 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1qbo h ILE 226 CO 0.01 0.26 -0.09 0.00 0.00 0.00 0.00 178.15 178.34 1qbo h ALA 227 N 1.08 1.02 -0.49 1.87 0.00 -1.42 -3.11 119.26 118.21 1qbo h ALA 227 Ca 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1qbo h ALA 227 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1qbo h ALA 227 CO -0.02 0.11 0.00 0.43 0.00 0.00 0.00 179.25 179.77 1qbo n SER 228 N -3.23 3.49 0.00 0.00 7.64 -1.05 -5.10 113.62 115.37 1qbo n SER 228 Ca 0.00 -2.11 0.00 0.00 1.01 0.00 0.00 58.87 57.77 1qbo n SER 228 Cb 0.35 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1qbo n SER 228 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62