#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w0y s VAL 17 N 0.00 4.97 0.00 1.39 1.01 -0.11 -4.24 120.40 123.42 1w0y s VAL 17 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1w0y s VAL 17 Cb 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 33.05 1w0y s VAL 17 CO 0.00 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.03 1w0y n GLY 18 N 4.70 0.58 0.00 4.51 0.00 -1.25 -2.14 105.19 111.59 1w0y n GLY 18 Ca -0.15 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1w0y n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w0y n GLY 19 N -2.82 2.00 3.26 -0.02 0.00 -1.26 -4.93 105.19 101.42 1w0y n GLY 19 Ca 0.00 -1.95 -0.10 0.00 0.00 0.00 0.00 46.02 43.97 1w0y n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w0y s LYS 20 N 3.56 1.10 0.22 1.61 1.02 -0.46 -4.96 119.74 121.83 1w0y s LYS 20 Ca 0.00 -1.36 -0.31 0.00 0.02 0.00 0.00 55.97 54.32 1w0y s LYS 20 Cb 0.00 0.31 -0.11 0.00 -0.52 0.00 0.00 37.83 37.52 1w0y s LYS 20 CO 0.00 -0.37 1.57 0.08 -0.92 0.00 0.00 175.35 175.72 1w0y s VAL 21 N -4.04 2.40 -0.11 3.17 1.01 -1.26 0.25 120.40 121.83 1w0y s VAL 21 Ca 0.24 0.31 -0.30 0.00 0.00 0.00 0.00 61.98 62.23 1w0y s VAL 21 Cb 0.05 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.22 1w0y s VAL 21 CO 0.03 0.03 1.05 0.00 0.00 0.00 0.00 175.10 176.22 1w0y n PRO 23 N 5.26 2.20 -1.70 0.00 -0.02 -1.26 -4.78 135.00 134.69 1w0y n PRO 23 Ca 0.10 0.78 -0.58 0.00 -2.02 0.00 0.00 63.50 61.78 1w0y n PRO 23 Cb 0.48 -2.44 -0.07 0.00 -0.02 0.00 0.00 33.50 31.44 1w0y n PRO 23 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1w0y n LYS 24 N 1.63 1.05 0.00 -0.52 4.81 -1.26 -0.82 118.16 123.05 1w0y n LYS 24 Ca 0.09 0.38 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 1w0y n LYS 24 Cb 0.34 -2.05 0.00 0.00 0.02 0.00 0.00 35.03 33.34 1w0y n LYS 24 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1w0y n GLY 25 N 3.99 1.34 0.91 3.14 0.00 -1.26 -4.92 105.19 108.39 1w0y n GLY 25 Ca 0.26 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.36 1w0y n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1w0y n GLU 26 N -2.00 2.14 -2.67 1.61 1.02 -0.00 -3.98 120.64 116.75 1w0y n GLU 26 Ca 0.00 -1.77 -0.09 0.00 -0.02 0.00 0.00 57.16 55.28 1w0y n GLU 26 Cb 0.00 -1.39 0.03 0.00 -0.02 0.00 0.00 31.44 30.06 1w0y n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1w0y h PRO 28 N 2.96 0.00 -0.02 0.00 0.13 -1.80 -1.99 132.00 131.27 1w0y h PRO 28 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1w0y h PRO 28 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1w0y h PRO 28 CO 0.48 0.00 -0.22 -2.67 -0.23 0.00 0.00 178.00 175.36 1w0y n TRP 29 N -2.64 0.00 -2.04 1.56 2.14 -1.04 -2.62 117.44 112.79 1w0y n TRP 29 Ca -0.02 0.00 -0.40 0.00 2.07 0.00 0.00 57.50 59.15 1w0y n TRP 29 Cb 0.05 -0.03 -0.01 0.00 -0.81 0.00 0.00 31.31 30.52 1w0y n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1w0y s GLN 30 N -2.28 4.00 0.07 -2.67 2.00 -0.75 -0.96 119.66 119.07 1w0y s GLN 30 Ca 0.26 2.18 0.07 0.00 -2.00 0.00 0.00 55.36 55.87 1w0y s GLN 30 Cb 0.19 -2.79 -0.03 0.00 0.80 0.00 0.00 33.01 31.18 1w0y s GLN 30 CO 0.45 -0.47 -0.19 0.08 -0.50 0.00 0.00 175.29 174.66 1w0y s VAL 31 N -1.24 1.54 -0.17 1.34 1.01 0.35 -4.47 120.40 118.76 1w0y s VAL 31 Ca 0.56 -1.32 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1w0y s VAL 31 Cb -0.39 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 1w0y s VAL 31 CO 0.50 0.02 -0.03 -0.22 0.00 0.00 0.00 175.10 175.37 1w0y s LEU 32 N -1.52 3.24 -0.15 3.92 2.96 -0.69 -1.52 118.68 124.90 1w0y s LEU 32 Ca 0.05 -0.15 -0.04 0.00 -0.22 0.00 0.00 54.13 53.77 1w0y s LEU 32 Cb -0.09 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 1w0y s LEU 32 CO 0.03 0.14 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.42 1w0y s LEU 33 N 0.53 3.34 0.03 -0.68 1.43 0.18 -0.86 118.68 122.65 1w0y s LEU 33 Ca -0.03 -0.09 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 1w0y s LEU 33 Cb -0.14 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 1w0y s LEU 33 CO 0.03 0.18 -0.17 -0.76 0.23 0.00 0.00 176.35 175.86 1w0y s LEU 34 N 0.29 2.13 -0.09 1.79 1.43 -0.41 0.31 118.68 124.14 1w0y s LEU 34 Ca -0.02 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 1w0y s LEU 34 Cb -0.14 -0.81 -0.01 0.00 0.03 0.00 0.00 46.19 45.26 1w0y s LEU 34 CO 0.03 0.13 -0.20 0.68 0.23 0.00 0.00 176.35 177.21 1w0y s VAL 35 N -0.70 2.47 -1.68 -1.59 -7.23 -0.37 -0.40 120.40 110.90 1w0y s VAL 35 Ca 0.05 -0.90 -0.15 0.00 -1.81 0.00 0.00 61.98 59.17 1w0y s VAL 35 Cb -0.08 -1.96 0.14 0.00 0.56 0.00 0.00 36.38 35.04 1w0y s VAL 35 CO 0.01 0.56 0.65 0.59 -0.31 0.00 0.00 175.10 176.60 1w0y n ASN 37 N 3.16 -2.38 0.00 4.85 5.03 -0.95 0.43 115.26 125.40 1w0y n ASN 37 Ca -0.18 -1.06 0.00 0.00 0.87 0.00 0.00 54.58 54.21 1w0y n ASN 37 Cb 0.52 -2.55 0.00 0.00 -1.02 0.00 0.00 39.78 36.73 1w0y n ASN 37 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1w0y n GLY 38 N -1.52 0.52 3.83 7.41 0.00 -1.26 -5.00 105.19 109.16 1w0y n GLY 38 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1w0y n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w0y s ALA 39 N -2.48 3.72 0.08 4.61 0.00 0.17 -5.03 121.76 122.82 1w0y s ALA 39 Ca 0.00 -0.75 -0.33 0.00 0.00 0.00 0.00 51.96 50.88 1w0y s ALA 39 Cb 0.00 -1.77 -0.12 0.00 0.00 0.00 0.00 23.12 21.22 1w0y s ALA 39 CO 0.00 0.66 1.74 0.94 0.00 0.00 0.00 175.76 179.10 1w0y n GLN 40 N 1.62 2.35 -0.03 0.00 7.27 -1.26 -1.23 117.38 126.09 1w0y n GLN 40 Ca -0.16 0.85 -0.07 0.00 0.07 0.00 0.00 57.00 57.69 1w0y n GLN 40 Cb 0.54 -2.68 -0.03 0.00 2.41 0.00 0.00 30.24 30.48 1w0y n GLN 40 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1w0y n LEU 41 N 4.99 1.19 -3.86 1.69 7.94 0.15 -4.84 117.00 124.26 1w0y n LEU 41 Ca 0.19 0.05 -0.02 0.00 -1.11 0.00 0.00 56.01 55.12 1w0y n LEU 41 Cb 0.31 -0.21 0.01 0.00 0.53 0.00 0.00 43.42 44.07 1w0y n LEU 41 CO 0.67 0.27 0.84 0.00 -1.11 0.00 0.00 177.39 178.06 1w0y s GLY 43 N -3.37 2.04 0.36 0.00 0.00 -0.36 0.51 107.32 106.51 1w0y s GLY 43 Ca 0.21 -1.79 -0.16 0.00 0.00 0.00 0.00 44.72 42.98 1w0y s GLY 43 CO 0.04 -1.68 0.75 -0.32 0.00 0.00 0.00 173.10 171.88 1w0y s GLY 44 N -4.32 0.34 -0.08 0.20 0.00 -0.58 -3.63 107.32 99.25 1w0y s GLY 44 Ca 0.51 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 44.52 1w0y s GLY 44 CO 0.30 -0.31 -0.06 -1.59 0.00 0.00 0.00 173.10 171.44 1w0y s THR 45 N -2.76 0.78 0.18 0.90 2.01 0.59 -0.50 115.64 116.84 1w0y s THR 45 Ca 0.16 -0.19 -0.30 0.00 0.31 0.00 0.00 61.69 61.67 1w0y s THR 45 Cb -0.05 -0.81 -0.08 0.00 0.01 0.00 0.00 72.50 71.57 1w0y s THR 45 CO 0.11 0.31 1.10 -0.22 -0.69 0.00 0.00 174.62 175.22 1w0y s LEU 46 N 1.37 4.50 0.00 4.42 2.96 -0.13 -0.99 118.68 130.80 1w0y s LEU 46 Ca -0.03 2.09 0.00 0.00 -0.22 0.00 0.00 54.13 55.98 1w0y s LEU 46 Cb -0.14 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.95 1w0y s LEU 46 CO -0.03 -0.21 0.34 2.30 -1.32 0.00 0.00 176.35 177.43 1w0y n ILE 47 N 2.29 0.00 -3.87 6.68 -5.35 -0.91 -0.74 119.36 117.46 1w0y n ILE 47 Ca 0.02 -0.43 0.01 0.00 -0.27 0.00 0.00 62.75 62.08 1w0y n ILE 47 Cb 0.46 1.11 0.01 0.00 -1.74 0.00 0.00 39.64 39.48 1w0y n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1w0y n ASN 48 N -0.18 -0.64 0.28 7.28 0.23 -1.25 -4.64 115.26 116.33 1w0y n ASN 48 Ca 0.00 -1.19 0.16 0.00 -0.53 0.00 0.00 54.58 53.02 1w0y n ASN 48 Cb 0.03 1.01 0.74 0.00 -2.08 0.00 0.00 39.78 39.48 1w0y n ASN 48 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1w0y h THR 49 N 1.48 0.17 0.00 5.53 1.35 -1.98 -3.31 112.91 116.15 1w0y h THR 49 Ca -0.11 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1w0y h THR 49 Cb 0.57 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 1w0y h THR 49 CO 0.16 0.05 0.00 2.30 -0.25 0.00 0.00 175.52 177.78 1w0y n ILE 50 N -3.21 0.00 -4.83 6.82 -5.35 -1.26 -1.69 119.36 109.84 1w0y n ILE 50 Ca -0.00 -0.44 -0.33 0.00 -0.27 0.00 0.00 62.75 61.71 1w0y n ILE 50 Cb 0.28 1.04 -0.13 0.00 -1.74 0.00 0.00 39.64 39.09 1w0y n ILE 50 CO 0.00 0.00 0.00 0.26 -1.76 0.00 0.00 176.55 175.05 1w0y s TRP 51 N -0.60 2.73 -0.03 4.28 0.52 -1.25 -0.52 118.94 124.07 1w0y s TRP 51 Ca 0.00 -0.14 0.03 0.00 0.02 0.00 0.00 56.10 56.02 1w0y s TRP 51 Cb 0.00 -1.63 -0.00 0.00 -1.15 0.00 0.00 33.47 30.69 1w0y s TRP 51 CO 0.00 0.22 -0.13 0.08 0.02 0.00 0.00 176.95 177.14 1w0y s VAL 52 N -0.77 1.07 -0.15 4.03 1.01 0.13 -2.15 120.40 123.57 1w0y s VAL 52 Ca 0.12 -0.53 -0.05 0.00 0.00 0.00 0.00 61.98 61.52 1w0y s VAL 52 Cb -0.11 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 1w0y s VAL 52 CO 0.01 0.31 0.02 -0.69 0.00 0.00 0.00 175.10 174.75 1w0y s VAL 53 N 0.03 4.38 0.00 2.92 1.01 -0.16 0.58 120.40 129.16 1w0y s VAL 53 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1w0y s VAL 53 Cb -0.09 -2.93 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1w0y s VAL 53 CO 0.01 0.50 0.00 -0.24 0.00 0.00 0.00 175.10 175.37 1w0y n SER 54 N 3.26 0.00 -4.65 3.32 2.88 0.09 -0.30 113.62 118.21 1w0y n SER 54 Ca -0.17 -0.40 -0.35 0.00 -1.33 0.00 0.00 58.87 56.62 1w0y n SER 54 Cb 0.53 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.89 1w0y n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1w0y s ALA 55 N -1.92 3.31 0.42 -1.46 0.00 -1.26 -1.70 121.76 119.15 1w0y s ALA 55 Ca 0.00 -0.78 0.08 0.00 0.00 0.00 0.00 51.96 51.26 1w0y s ALA 55 Cb 0.00 -1.65 0.88 0.00 0.00 0.00 0.00 23.12 22.36 1w0y s ALA 55 CO 0.00 0.42 2.06 0.00 0.00 0.00 0.00 175.76 178.24 1w0y h ALA 56 N 5.81 1.73 0.00 0.00 0.00 -1.70 -1.78 119.26 123.31 1w0y h ALA 56 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1w0y h ALA 56 Cb 1.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1w0y h ALA 56 CO 0.60 0.25 0.00 -2.39 0.00 0.00 0.00 179.25 177.71 1w0y n HIS 57 N -4.48 0.61 0.30 0.00 1.44 -1.26 -1.39 115.22 110.45 1w0y n HIS 57 Ca 0.03 0.26 0.19 0.00 -2.01 0.00 0.00 57.72 56.18 1w0y n HIS 57 Cb 0.07 -0.91 0.90 0.00 0.12 0.00 0.00 29.99 30.17 1w0y n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1w0y n PHE 59 N -2.90 0.51 -0.04 0.00 3.72 -0.48 -4.66 117.46 113.62 1w0y n PHE 59 Ca -0.01 -0.43 0.17 0.00 -0.05 0.00 0.00 57.45 57.12 1w0y n PHE 59 Cb 0.16 -0.02 0.61 0.00 -0.94 0.00 0.00 39.48 39.29 1w0y n PHE 59 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1w0y h ASP 60 N 2.61 0.16 -0.08 4.37 3.32 -1.62 -3.00 116.42 122.19 1w0y h ASP 60 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1w0y h ASP 60 Cb 0.77 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 1w0y h ASP 60 CO 0.00 0.09 -0.04 0.29 -1.72 0.00 0.00 179.24 177.86 1w0y n LYS 60 N -4.43 1.73 -2.44 3.56 5.02 -1.26 -5.02 118.16 115.32 1w0y n LYS 60 Ca 0.10 -2.72 -0.41 0.00 -2.02 0.00 0.00 58.31 53.26 1w0y n LYS 60 Cb 0.50 -1.61 -0.04 0.00 -0.02 0.00 0.00 35.03 33.87 1w0y n LYS 60 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1w0y s ILE 60 N -2.91 3.48 -0.01 -0.18 -1.09 -1.14 -4.93 121.20 114.42 1w0y s ILE 60 Ca 0.35 1.42 -0.00 0.00 -2.23 0.00 0.00 60.65 60.20 1w0y s ILE 60 Cb 0.31 -3.91 -0.00 0.00 -1.58 0.00 0.00 42.46 37.28 1w0y s ILE 60 CO 0.04 0.31 -0.01 0.29 -1.23 0.00 0.00 174.94 174.34 1w0y n LYS 60 N 1.47 0.02 -3.07 2.79 4.76 -1.26 -4.88 118.16 117.99 1w0y n LYS 60 Ca 0.00 0.01 -0.44 0.00 -2.87 0.00 0.00 58.31 55.00 1w0y n LYS 60 Cb 0.45 -0.58 -0.01 0.00 -1.84 0.00 0.00 35.03 33.05 1w0y n LYS 60 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1w0y s ASN 60 N -4.97 7.02 0.53 4.39 0.01 -1.26 -4.84 114.94 115.81 1w0y s ASN 60 Ca -0.01 -2.93 0.35 0.00 -0.71 0.00 0.00 52.86 49.56 1w0y s ASN 60 Cb 0.00 -2.34 1.84 0.00 0.41 0.00 0.00 41.25 41.17 1w0y s ASN 60 CO 0.02 -0.68 2.08 -0.50 -1.51 0.00 0.00 177.10 176.50 1w0y h TRP 61 N 7.41 0.00 -0.11 2.20 4.06 -2.02 0.71 115.95 128.20 1w0y h TRP 61 Ca 0.23 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.18 1w0y h TRP 61 Cb 0.92 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.08 1w0y h TRP 61 CO 1.03 0.00 0.00 0.54 -3.56 0.00 0.00 178.44 176.45 1w0y n ARG 62 N -2.78 1.57 -0.32 0.49 5.12 -1.26 -3.90 116.66 115.57 1w0y n ARG 62 Ca -0.02 -0.85 0.08 0.00 -1.93 0.00 0.00 57.85 55.13 1w0y n ARG 62 Cb 0.10 -1.39 0.21 0.00 -1.16 0.00 0.00 32.46 30.22 1w0y n ARG 62 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1w0y n ASN 63 N 0.07 3.40 -4.74 0.55 5.03 0.24 -4.99 115.26 114.83 1w0y n ASN 63 Ca 0.16 -2.78 -0.41 0.00 0.87 0.00 0.00 54.58 52.43 1w0y n ASN 63 Cb 0.28 -0.44 -0.05 0.00 -1.02 0.00 0.00 39.78 38.55 1w0y n ASN 63 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1w0y s LEU 64 N -2.39 4.47 -0.02 3.41 2.01 -1.25 -2.24 118.68 122.67 1w0y s LEU 64 Ca 0.35 1.63 0.04 0.00 0.01 0.00 0.00 54.13 56.17 1w0y s LEU 64 Cb 0.27 -3.42 -0.01 0.00 0.01 0.00 0.00 46.19 43.04 1w0y s LEU 64 CO 0.09 -0.03 -0.15 -0.63 1.01 0.00 0.00 176.35 176.64 1w0y s ILE 65 N 0.00 1.16 -0.15 -0.59 -1.09 0.46 -2.49 121.20 118.50 1w0y s ILE 65 Ca 0.43 -0.62 -0.01 0.00 -2.23 0.00 0.00 60.65 58.22 1w0y s ILE 65 Cb -0.22 -0.98 -0.01 0.00 -1.58 0.00 0.00 42.46 39.67 1w0y s ILE 65 CO 0.27 0.33 -0.11 0.00 -1.23 0.00 0.00 174.94 174.20 1w0y s ALA 66 N -0.24 2.69 -0.16 9.38 0.00 0.32 -1.29 121.76 132.46 1w0y s ALA 66 Ca 0.04 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 51.03 1w0y s ALA 66 Cb -0.07 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.69 1w0y s ALA 66 CO -0.00 0.07 -0.11 0.08 0.00 0.00 0.00 175.76 175.80 1w0y s VAL 67 N 0.64 3.11 0.23 0.00 1.01 -0.04 -1.12 120.40 124.24 1w0y s VAL 67 Ca -0.06 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.38 1w0y s VAL 67 Cb -0.15 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 1w0y s VAL 67 CO 0.03 0.50 0.03 -0.76 0.00 0.00 0.00 175.10 174.90 1w0y s LEU 68 N 0.66 3.34 -1.37 3.92 1.02 0.64 -1.71 118.68 125.18 1w0y s LEU 68 Ca -0.06 -0.48 0.00 0.00 0.02 0.00 0.00 54.13 53.61 1w0y s LEU 68 Cb -0.15 -1.92 0.00 0.00 0.02 0.00 0.00 46.19 44.14 1w0y s LEU 68 CO 0.02 0.03 0.00 0.61 0.02 0.00 0.00 176.35 177.03 1w0y n GLY 69 N -0.63 1.05 3.88 -3.19 0.00 -1.26 -1.10 105.19 103.95 1w0y n GLY 69 Ca -0.08 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 1w0y n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1w0y s GLU 70 N -3.50 3.65 0.34 1.61 2.56 -1.26 -3.81 118.70 118.29 1w0y s GLU 70 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 54.97 55.48 1w0y s GLU 70 Cb 0.00 -2.26 0.00 0.00 2.00 0.00 0.00 34.13 33.87 1w0y s GLU 70 CO 0.00 -0.30 0.00 1.58 -0.56 0.00 0.00 175.26 175.98 1w0y n HIS 71 N -2.16 -3.53 -3.83 5.30 -0.00 -1.26 -4.93 115.22 104.80 1w0y n HIS 71 Ca 0.03 0.99 -0.36 0.00 -0.00 0.00 0.00 57.72 58.38 1w0y n HIS 71 Cb 0.54 2.36 -0.13 0.00 -0.00 0.00 0.00 29.99 32.76 1w0y n HIS 71 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1w0y s ASP 72 N -3.04 4.94 0.00 0.26 -1.08 -1.26 -0.74 116.67 115.75 1w0y s ASP 72 Ca 0.00 -0.95 0.02 0.00 -0.52 0.00 0.00 52.55 51.10 1w0y s ASP 72 Cb 0.00 -1.80 0.13 0.00 -1.46 0.00 0.00 42.92 39.79 1w0y s ASP 72 CO 0.00 -0.22 0.82 0.18 0.52 0.00 0.00 175.17 176.46 1w0y n LEU 73 N 4.76 0.00 -0.37 -1.34 4.77 0.22 -2.57 117.00 122.47 1w0y n LEU 73 Ca -0.14 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 55.88 1w0y n LEU 73 Cb 0.46 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.59 1w0y n LEU 73 CO 0.29 0.00 0.40 -1.54 -1.33 0.00 0.00 177.39 175.21 1w0y n SER 74 N -0.55 1.77 -4.11 -1.43 3.41 -1.26 -4.99 113.62 106.46 1w0y n SER 74 Ca 0.02 -1.38 -0.14 0.00 -0.26 0.00 0.00 58.87 57.10 1w0y n SER 74 Cb 0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.85 1w0y n SER 74 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1w0y s GLU 75 N -0.77 0.65 -0.05 4.33 0.41 -1.06 -5.14 118.70 117.06 1w0y s GLU 75 Ca 0.11 -0.88 0.03 0.00 -0.41 0.00 0.00 54.97 53.82 1w0y s GLU 75 Cb 0.08 -0.46 -0.03 0.00 -1.78 0.00 0.00 34.13 31.95 1w0y s GLU 75 CO 0.12 0.09 -0.13 -1.01 -0.49 0.00 0.00 175.26 173.83 1w0y s HIS 76 N -1.57 2.74 0.24 1.61 3.76 -1.26 -4.78 115.29 116.03 1w0y s HIS 76 Ca -0.05 -0.13 -0.10 0.00 -0.15 0.00 0.00 55.06 54.63 1w0y s HIS 76 Cb -0.09 -1.64 -0.01 0.00 1.11 0.00 0.00 32.58 31.95 1w0y s HIS 76 CO 0.01 0.21 0.39 0.16 -0.85 0.00 0.00 174.74 174.66 1w0y s ASP 77 N -0.74 -0.03 0.00 1.40 3.84 -1.26 -5.04 116.67 114.84 1w0y s ASP 77 Ca 0.12 -1.05 0.12 0.00 -0.00 0.00 0.00 52.55 51.74 1w0y s ASP 77 Cb -0.11 0.54 0.73 0.00 -1.38 0.00 0.00 42.92 42.70 1w0y s ASP 77 CO 0.01 -1.07 1.15 0.61 -0.00 0.00 0.00 175.17 175.87 1w0y n GLY 78 N -0.36 -0.43 0.04 2.12 0.00 -1.26 -2.57 105.19 102.73 1w0y n GLY 78 Ca -0.01 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1w0y n GLY 78 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w0y n ASP 79 N -0.95 0.59 -4.74 1.61 8.00 -1.26 -4.88 116.55 114.92 1w0y n ASP 79 Ca 0.09 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.19 1w0y n ASP 79 Cb 0.04 0.18 -0.05 0.00 -0.02 0.00 0.00 41.12 41.28 1w0y n ASP 79 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1w0y s GLU 80 N -3.10 4.70 -0.03 -1.24 2.02 -1.06 -4.22 118.70 115.77 1w0y s GLU 80 Ca 0.08 1.61 -0.00 0.00 0.02 0.00 0.00 54.97 56.68 1w0y s GLU 80 Cb 0.15 -3.28 0.03 0.00 0.10 0.00 0.00 34.13 31.12 1w0y s GLU 80 CO 0.71 0.26 0.01 -0.65 0.02 0.00 0.00 175.26 175.61 1w0y s GLN 81 N -0.71 0.22 0.04 1.61 -0.21 -0.26 -4.97 119.66 115.38 1w0y s GLN 81 Ca 0.46 0.14 0.04 0.00 0.02 0.00 0.00 55.36 56.02 1w0y s GLN 81 Cb -0.28 -0.48 -0.04 0.00 1.00 0.00 0.00 33.01 33.22 1w0y s GLN 81 CO 0.34 -0.18 -0.07 -1.12 -2.12 0.00 0.00 175.29 172.14 1w0y s SER 82 N 1.25 4.56 -0.09 5.90 0.01 -1.26 -0.26 113.70 123.80 1w0y s SER 82 Ca -0.07 -0.22 -0.09 0.00 1.31 0.00 0.00 55.95 56.89 1w0y s SER 82 Cb -0.13 -1.01 0.02 0.00 0.21 0.00 0.00 66.02 65.12 1w0y s SER 82 CO -0.02 0.25 0.24 -0.13 0.41 0.00 0.00 173.24 173.99 1w0y s ARG 83 N -1.69 0.29 0.40 12.44 1.81 -0.27 -4.98 118.95 126.95 1w0y s ARG 83 Ca 0.19 0.32 -0.24 0.00 -1.72 0.00 0.00 55.73 54.28 1w0y s ARG 83 Cb -0.11 0.14 -0.09 0.00 -0.45 0.00 0.00 34.95 34.44 1w0y s ARG 83 CO 0.10 -0.04 1.03 1.03 -0.68 0.00 0.00 175.30 176.74 1w0y s ARG 84 N 0.09 4.19 -0.34 3.54 0.52 -1.26 -0.52 118.95 125.17 1w0y s ARG 84 Ca -0.00 1.45 -0.22 0.00 -0.52 0.00 0.00 55.73 56.44 1w0y s ARG 84 Cb -0.02 -2.51 0.00 0.00 0.52 0.00 0.00 34.95 32.94 1w0y s ARG 84 CO 0.00 -0.11 0.71 0.08 0.02 0.00 0.00 175.30 176.01 1w0y s VAL 85 N -1.71 4.83 -0.14 3.52 1.01 -1.04 0.11 120.40 126.97 1w0y s VAL 85 Ca 0.58 0.85 0.16 0.00 0.00 0.00 0.00 61.98 63.56 1w0y s VAL 85 Cb -0.20 -4.12 0.09 0.00 0.00 0.00 0.00 36.38 32.14 1w0y s VAL 85 CO 0.26 -0.31 1.48 0.00 0.00 0.00 0.00 175.10 176.53 1w0y h ALA 86 N 8.35 0.72 -2.35 5.51 0.00 -0.68 -3.46 119.26 127.35 1w0y h ALA 86 Ca -0.25 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.15 1w0y h ALA 86 Cb 1.10 -0.07 -0.22 0.00 0.00 0.00 0.00 17.79 18.60 1w0y h ALA 86 CO 0.86 0.58 -0.05 -1.14 0.00 0.00 0.00 179.25 179.50 1w0y s GLN 87 N -3.03 0.71 -0.26 0.00 0.74 -1.07 -4.45 119.66 112.29 1w0y s GLN 87 Ca 0.04 0.59 0.01 0.00 0.05 0.00 0.00 55.36 56.05 1w0y s GLN 87 Cb 0.08 0.34 0.07 0.00 1.10 0.00 0.00 33.01 34.60 1w0y s GLN 87 CO 0.73 -0.13 -0.01 0.08 -0.55 0.00 0.00 175.29 175.42 1w0y s VAL 88 N -0.10 1.51 -0.19 1.34 1.01 -0.41 -1.65 120.40 121.90 1w0y s VAL 88 Ca -0.03 -1.40 -0.09 0.00 0.00 0.00 0.00 61.98 60.46 1w0y s VAL 88 Cb -0.03 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 1w0y s VAL 88 CO 0.02 -0.27 0.10 -0.63 0.00 0.00 0.00 175.10 174.33 1w0y s ILE 89 N 1.37 5.15 0.06 2.22 1.01 -0.11 -1.41 121.20 129.49 1w0y s ILE 89 Ca -0.01 0.09 0.06 0.00 0.00 0.00 0.00 60.65 60.79 1w0y s ILE 89 Cb -0.19 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 38.92 1w0y s ILE 89 CO -0.09 0.45 -0.16 -0.63 0.00 0.00 0.00 174.94 174.51 1w0y s ILE 90 N 0.37 1.23 0.48 2.92 1.01 -0.83 -0.31 121.20 126.08 1w0y s ILE 90 Ca 0.06 -1.18 -0.23 0.00 0.00 0.00 0.00 60.65 59.30 1w0y s ILE 90 Cb -0.12 -1.13 -0.07 0.00 0.01 0.00 0.00 42.46 41.16 1w0y s ILE 90 CO -0.01 -0.06 1.30 -2.84 0.00 0.00 0.00 174.94 173.34 1w0y s PRO 91 N -1.42 3.53 0.00 2.79 0.02 -1.26 -1.75 135.00 136.91 1w0y s PRO 91 Ca 0.02 2.11 0.20 0.00 0.02 0.00 0.00 61.00 63.35 1w0y s PRO 91 Cb -0.09 -2.44 1.20 0.00 0.02 0.00 0.00 34.50 33.19 1w0y s PRO 91 CO 0.02 -0.84 1.61 -1.13 -0.33 0.00 0.00 177.00 176.34 1w0y n SER 92 N -0.56 0.00 -0.17 2.53 3.41 0.03 -2.08 113.62 116.78 1w0y n SER 92 Ca 0.08 -0.79 0.11 0.00 -0.26 0.00 0.00 58.87 58.01 1w0y n SER 92 Cb 0.45 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.48 1w0y n SER 92 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1w0y n THR 93 N -0.94 0.00 -2.61 6.66 -2.24 -1.26 -4.92 114.28 108.96 1w0y n THR 93 Ca 0.15 -0.09 -0.40 0.00 -2.27 0.00 0.00 64.05 61.44 1w0y n THR 93 Cb 0.07 0.80 -0.05 0.00 -2.10 0.00 0.00 70.33 69.04 1w0y n THR 93 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1w0y s TYR 94 N -2.78 3.78 -0.21 4.78 5.04 -0.89 -4.94 117.35 122.13 1w0y s TYR 94 Ca 0.14 1.80 0.02 0.00 -2.44 0.00 0.00 57.07 56.59 1w0y s TYR 94 Cb 0.17 -3.13 0.03 0.00 0.35 0.00 0.00 41.96 39.38 1w0y s TYR 94 CO 0.70 -0.05 -0.17 0.08 -1.34 0.00 0.00 175.55 174.77 1w0y s VAL 95 N -1.12 2.12 0.23 3.14 1.01 -1.26 -5.00 120.40 119.51 1w0y s VAL 95 Ca 0.43 -1.15 -0.31 0.00 0.00 0.00 0.00 61.98 60.95 1w0y s VAL 95 Cb -0.29 -2.00 -0.15 0.00 0.00 0.00 0.00 36.38 33.94 1w0y s VAL 95 CO 0.36 0.36 1.09 -2.65 0.00 0.00 0.00 175.10 174.26 1w0y n PRO 96 N 4.56 1.25 -0.76 2.72 -0.02 -1.26 -0.91 135.00 140.58 1w0y n PRO 96 Ca -0.19 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1w0y n PRO 96 Cb 0.48 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1w0y n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w0y n GLY 97 N 1.69 0.69 3.42 -1.23 0.00 -1.26 -5.03 105.19 103.47 1w0y n GLY 97 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 1w0y n GLY 97 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1w0y s THR 98 N -2.44 0.98 -0.12 2.61 -4.23 -0.09 -5.11 115.64 107.24 1w0y s THR 98 Ca 0.00 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.67 1w0y s THR 98 Cb 0.00 -2.73 -0.23 0.00 1.34 0.00 0.00 72.50 70.88 1w0y s THR 98 CO 0.00 0.00 0.41 0.35 -0.54 0.00 0.00 174.62 174.84 1w0y n THR 99 N -0.64 1.38 -2.08 3.99 -2.24 -1.26 -4.83 114.28 108.60 1w0y n THR 99 Ca -0.02 -0.80 -0.37 0.00 -2.27 0.00 0.00 64.05 60.59 1w0y n THR 99 Cb 0.66 -0.69 0.01 0.00 -2.10 0.00 0.00 70.33 68.22 1w0y n THR 99 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1w0y s ASN 100 N -5.70 5.70 -1.42 3.42 3.04 -1.26 -3.42 114.94 115.30 1w0y s ASN 100 Ca -0.07 2.45 -0.11 0.00 0.04 0.00 0.00 52.86 55.17 1w0y s ASN 100 Cb 0.07 -2.61 0.04 0.00 -1.54 0.00 0.00 41.25 37.21 1w0y s ASN 100 CO 0.83 -1.25 1.12 1.41 -3.04 0.00 0.00 177.10 176.17 1w0y n HIS 101 N -0.90 -2.69 -1.84 0.43 8.25 -1.26 -4.58 115.22 112.63 1w0y n HIS 101 Ca 0.10 0.98 -0.39 0.00 -0.26 0.00 0.00 57.72 58.15 1w0y n HIS 101 Cb 0.48 -4.68 -0.03 0.00 1.12 0.00 0.00 29.99 26.87 1w0y n HIS 101 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1w0y n ASP 102 N -2.96 3.52 -3.79 0.41 -0.08 -1.22 -4.76 116.55 107.68 1w0y n ASP 102 Ca 0.02 -2.78 -0.12 0.00 -1.51 0.00 0.00 54.79 50.40 1w0y n ASP 102 Cb 0.55 -1.54 -0.09 0.00 2.34 0.00 0.00 41.12 42.38 1w0y n ASP 102 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1w0y s ILE 103 N 5.99 0.08 -0.11 5.18 2.07 -1.26 -4.06 121.20 129.09 1w0y s ILE 103 Ca 0.57 -0.62 -0.14 0.00 -1.41 0.00 0.00 60.65 59.05 1w0y s ILE 103 Cb 0.08 -0.70 0.03 0.00 0.13 0.00 0.00 42.46 42.00 1w0y s ILE 103 CO 0.07 -0.34 0.36 0.00 -1.91 0.00 0.00 174.94 173.12 1w0y s ALA 104 N -1.79 -0.91 -0.25 1.50 0.00 -0.69 -3.72 121.76 115.91 1w0y s ALA 104 Ca -0.11 0.88 -0.04 0.00 0.00 0.00 0.00 51.96 52.70 1w0y s ALA 104 Cb -0.04 -0.43 0.01 0.00 0.00 0.00 0.00 23.12 22.66 1w0y s ALA 104 CO 0.01 -0.20 -0.02 -1.17 0.00 0.00 0.00 175.76 174.38 1w0y s LEU 105 N -0.20 3.23 -0.16 0.00 2.96 0.58 -0.74 118.68 124.36 1w0y s LEU 105 Ca -0.04 -0.67 -0.04 0.00 -0.22 0.00 0.00 54.13 53.17 1w0y s LEU 105 Cb -0.03 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 1w0y s LEU 105 CO 0.02 -0.11 -0.04 -0.76 -1.32 0.00 0.00 176.35 174.15 1w0y s LEU 106 N 1.42 3.25 -0.22 -0.68 1.02 0.20 -0.93 118.68 122.73 1w0y s LEU 106 Ca 0.03 -0.13 -0.14 0.00 0.02 0.00 0.00 54.13 53.90 1w0y s LEU 106 Cb -0.16 -1.78 -0.04 0.00 0.02 0.00 0.00 46.19 44.23 1w0y s LEU 106 CO -0.03 0.16 0.34 -0.60 0.02 0.00 0.00 176.35 176.25 1w0y s ARG 107 N 0.39 4.13 0.33 1.70 3.52 -0.66 -0.69 118.95 127.67 1w0y s ARG 107 Ca -0.04 0.07 -0.23 0.00 -0.13 0.00 0.00 55.73 55.40 1w0y s ARG 107 Cb -0.14 -3.55 -0.10 0.00 -1.56 0.00 0.00 34.95 29.60 1w0y s ARG 107 CO 0.03 -0.04 0.90 -0.51 -0.81 0.00 0.00 175.30 174.87 1w0y s LEU 108 N 1.32 4.23 0.40 -0.88 1.43 0.32 0.00 118.68 125.51 1w0y s LEU 108 Ca 0.16 1.71 0.06 0.00 -1.03 0.00 0.00 54.13 55.03 1w0y s LEU 108 Cb -0.15 -4.08 0.83 0.00 0.03 0.00 0.00 46.19 42.82 1w0y s LEU 108 CO 0.07 -0.13 2.05 -0.74 0.23 0.00 0.00 176.35 177.83 1w0y h HIS 109 N 2.87 0.55 -3.61 0.29 -0.00 -0.65 -3.43 115.15 111.17 1w0y h HIS 109 Ca -0.47 0.01 -0.23 0.00 -0.00 0.00 0.00 60.37 59.68 1w0y h HIS 109 Cb 1.19 -0.18 -0.28 0.00 -0.00 0.00 0.00 27.41 28.13 1w0y h HIS 109 CO 0.62 0.35 -0.67 -1.14 -0.00 0.00 0.00 177.93 177.09 1w0y s GLN 110 N -5.50 0.04 0.59 5.26 0.74 -1.26 -5.01 119.66 114.52 1w0y s GLN 110 Ca -0.08 0.08 -0.19 0.00 0.05 0.00 0.00 55.36 55.21 1w0y s GLN 110 Cb 0.17 -0.00 -0.03 0.00 1.10 0.00 0.00 33.01 34.25 1w0y s GLN 110 CO 0.74 -0.02 1.26 -1.25 -0.55 0.00 0.00 175.29 175.46 1w0y s PRO 111 N 0.15 2.94 0.56 1.67 0.04 -1.26 -4.92 135.00 134.17 1w0y s PRO 111 Ca -0.01 1.98 -0.06 0.00 0.04 0.00 0.00 61.00 62.94 1w0y s PRO 111 Cb -0.02 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 1w0y s PRO 111 CO -0.00 -1.27 0.88 0.14 0.04 0.00 0.00 177.00 176.79 1w0y s VAL 112 N -1.47 4.27 -0.16 -0.36 -7.23 -0.68 -5.02 120.40 109.74 1w0y s VAL 112 Ca 0.77 0.21 -0.14 0.00 -1.81 0.00 0.00 61.98 61.00 1w0y s VAL 112 Cb -0.34 -3.67 -0.05 0.00 0.56 0.00 0.00 36.38 32.88 1w0y s VAL 112 CO 0.38 -0.71 0.32 -0.69 -0.31 0.00 0.00 175.10 174.09 1w0y s VAL 113 N -2.93 5.28 -0.08 1.32 1.01 -1.26 -4.86 120.40 118.88 1w0y s VAL 113 Ca 0.52 0.60 -0.30 0.00 0.00 0.00 0.00 61.98 62.80 1w0y s VAL 113 Cb -0.11 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 1w0y s VAL 113 CO 0.46 0.37 1.07 -0.76 0.00 0.00 0.00 175.10 176.24 1w0y s LEU 114 N 0.59 4.27 0.00 3.92 1.43 -1.26 -4.81 118.68 122.81 1w0y s LEU 114 Ca 0.18 1.64 0.02 0.00 -1.03 0.00 0.00 54.13 54.94 1w0y s LEU 114 Cb -0.13 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 1w0y s LEU 114 CO 0.05 -0.48 0.08 0.35 0.23 0.00 0.00 176.35 176.58 1w0y n THR 115 N 4.52 0.00 0.30 5.49 -2.24 -0.70 -4.98 114.28 116.68 1w0y n THR 115 Ca 0.09 -0.91 0.18 0.00 -2.27 0.00 0.00 64.05 61.14 1w0y n THR 115 Cb 0.48 0.39 0.83 0.00 -2.10 0.00 0.00 70.33 69.92 1w0y n THR 115 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1w0y h ASP 116 N 0.69 0.00 -0.01 3.42 3.45 -2.00 -2.77 116.42 119.19 1w0y h ASP 116 Ca -0.11 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.35 1w0y h ASP 116 Cb 0.46 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1w0y h ASP 116 CO 0.16 0.00 -0.05 1.41 -1.57 0.00 0.00 179.24 179.20 1w0y n HIS 117 N -2.93 0.00 -3.61 4.55 8.25 -1.26 -4.87 115.22 115.34 1w0y n HIS 117 Ca -0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 1w0y n HIS 117 Cb 0.21 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.16 1w0y n HIS 117 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1w0y s VAL 118 N -1.16 0.12 -0.02 1.59 1.01 -1.05 -4.06 120.40 116.83 1w0y s VAL 118 Ca 0.14 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 1w0y s VAL 118 Cb 0.11 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.55 1w0y s VAL 118 CO 0.19 -0.51 0.06 -0.69 0.00 0.00 0.00 175.10 174.15 1w0y s VAL 119 N 2.02 0.02 0.38 2.92 1.01 -1.08 -1.72 120.40 123.95 1w0y s VAL 119 Ca 0.05 -0.14 -0.24 0.00 0.00 0.00 0.00 61.98 61.65 1w0y s VAL 119 Cb -0.16 -0.13 -0.09 0.00 0.00 0.00 0.00 36.38 35.99 1w0y s VAL 119 CO -0.23 -0.08 1.01 -2.16 0.00 0.00 0.00 175.10 173.64 1w0y s PRO 120 N -0.21 4.31 0.06 2.72 0.04 -1.26 -2.49 135.00 138.17 1w0y s PRO 120 Ca -0.03 1.41 -0.18 0.00 0.04 0.00 0.00 61.00 62.25 1w0y s PRO 120 Cb -0.02 -2.59 -0.06 0.00 0.04 0.00 0.00 34.50 31.86 1w0y s PRO 120 CO 0.00 0.01 0.53 -1.17 0.04 0.00 0.00 177.00 176.41 1w0y s LEU 121 N -2.49 4.51 0.20 -3.56 2.96 0.08 -4.93 118.68 115.45 1w0y s LEU 121 Ca 0.56 1.18 -0.30 0.00 -0.22 0.00 0.00 54.13 55.35 1w0y s LEU 121 Cb -0.20 -2.84 -0.09 0.00 0.50 0.00 0.00 46.19 43.57 1w0y s LEU 121 CO 0.25 0.28 1.36 0.00 -1.32 0.00 0.00 176.35 176.91 1w0y s LEU 123 N -0.03 4.16 0.77 0.00 2.96 -1.26 -0.47 118.68 124.81 1w0y s LEU 123 Ca 0.58 0.40 -0.10 0.00 -0.22 0.00 0.00 54.13 54.79 1w0y s LEU 123 Cb -0.38 -2.81 0.07 0.00 0.50 0.00 0.00 46.19 43.57 1w0y s LEU 123 CO 0.38 -0.49 1.12 -2.16 -1.32 0.00 0.00 176.35 173.88 1w0y s PRO 124 N 2.62 2.04 0.58 0.98 0.04 -1.26 -4.98 135.00 135.02 1w0y s PRO 124 Ca 0.25 -0.02 -0.16 0.00 0.04 0.00 0.00 61.00 61.11 1w0y s PRO 124 Cb -0.15 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1w0y s PRO 124 CO 0.12 -1.48 1.05 -1.21 0.04 0.00 0.00 177.00 175.52 1w0y s GLU 125 N -5.46 3.41 0.09 4.56 2.02 -1.26 -4.91 118.70 117.15 1w0y s GLU 125 Ca 0.61 1.16 -0.30 0.00 0.02 0.00 0.00 54.97 56.46 1w0y s GLU 125 Cb -0.11 -2.05 -0.13 0.00 0.10 0.00 0.00 34.13 31.94 1w0y s GLU 125 CO 0.47 -0.73 1.63 -0.09 0.02 0.00 0.00 175.26 176.56 1w0y h ARG 126 N 0.48 -0.65 -0.73 1.61 2.43 -1.97 -2.01 114.38 113.54 1w0y h ARG 126 Ca -0.47 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.73 1w0y h ARG 126 Cb 1.21 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.88 1w0y h ARG 126 CO 0.58 -0.43 0.37 1.79 -1.51 0.00 0.00 179.97 180.77 1w0y h THR 127 N -0.67 1.23 -0.60 0.20 1.35 -1.93 0.11 112.91 112.60 1w0y h THR 127 Ca -0.02 -0.62 0.04 0.00 -0.55 0.00 0.00 66.41 65.26 1w0y h THR 127 Cb 0.60 0.30 -0.04 0.00 -1.73 0.00 0.00 68.15 67.27 1w0y h THR 127 CO -0.04 0.26 0.35 0.15 -0.25 0.00 0.00 175.52 175.99 1w0y h PHE 128 N 1.02 0.64 -0.64 4.73 3.57 -1.95 0.23 116.94 124.55 1w0y h PHE 128 Ca 0.25 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.70 1w0y h PHE 128 Cb 0.08 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 1w0y h PHE 128 CO 0.00 0.34 0.09 1.03 -2.23 0.00 0.00 178.31 177.55 1w0y h SER 129 N 0.67 1.01 -0.03 0.41 0.87 -0.76 -0.07 113.55 115.64 1w0y h SER 129 Ca 0.25 -0.24 -0.10 0.00 -1.23 0.00 0.00 61.79 60.47 1w0y h SER 129 Cb 0.09 -0.27 0.01 0.00 -0.44 0.00 0.00 62.40 61.79 1w0y h SER 129 CO -0.13 1.01 -0.38 -0.33 -0.53 0.00 0.00 176.83 176.47 1w0y h GLU 129 N 0.99 0.31 0.00 2.24 5.08 -0.14 -0.29 114.58 122.76 1w0y h GLU 129 Ca 0.19 -0.29 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 1w0y h GLU 129 Cb 0.44 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1w0y h GLU 129 CO 0.01 0.97 -0.98 -0.09 -1.00 0.00 0.00 179.01 177.92 1w0y h ARG 129 N -0.25 0.00 0.00 2.33 2.43 -0.62 -3.38 114.38 114.89 1w0y h ARG 129 Ca -0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1w0y h ARG 129 Cb 1.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1w0y h ARG 129 CO 0.08 0.15 -0.05 2.41 -1.51 0.00 0.00 179.97 181.04 1w0y n THR 129 N -2.85 0.52 -0.25 0.20 -1.04 -0.11 -4.76 114.28 106.00 1w0y n THR 129 Ca -0.03 0.19 0.15 0.00 -2.04 0.00 0.00 64.05 62.32 1w0y n THR 129 Cb 0.66 -1.31 0.44 0.00 -1.82 0.00 0.00 70.33 68.30 1w0y n THR 129 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1w0y h LEU 129 N -0.05 0.54 -1.47 -4.42 3.38 -1.39 0.11 115.31 112.02 1w0y h LEU 129 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1w0y h LEU 129 Cb 0.05 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1w0y h LEU 129 CO 0.00 0.25 0.00 0.00 0.09 0.00 0.00 178.44 178.78 1w0y n ALA 129 N -2.47 1.06 0.19 1.53 0.00 -0.12 -1.92 120.51 118.79 1w0y n ALA 129 Ca 0.18 0.20 0.06 0.00 0.00 0.00 0.00 53.44 53.88 1w0y n ALA 129 Cb 0.56 -1.33 0.09 0.00 0.00 0.00 0.00 19.45 18.77 1w0y n ALA 129 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1w0y n PHE 129 N -2.28 0.20 -2.56 0.00 0.99 0.03 -4.88 117.46 108.96 1w0y n PHE 129 Ca -0.01 -0.21 -0.43 0.00 -0.00 0.00 0.00 57.45 56.80 1w0y n PHE 129 Cb 0.04 -0.01 -0.02 0.00 -1.00 0.00 0.00 39.48 38.49 1w0y n PHE 129 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1w0y s VAL 129 N -0.97 4.49 0.20 -4.37 1.01 -0.81 -4.95 120.40 115.01 1w0y s VAL 129 Ca 0.18 1.80 -0.08 0.00 0.00 0.00 0.00 61.98 63.88 1w0y s VAL 129 Cb 0.11 -4.16 0.09 0.00 0.00 0.00 0.00 36.38 32.42 1w0y s VAL 129 CO 0.15 -0.07 1.69 -0.09 0.00 0.00 0.00 175.10 176.77 1w0y h ARG 134 N 7.53 1.07 -6.34 2.72 2.43 -1.89 -3.44 114.38 116.45 1w0y h ARG 134 Ca -0.28 -0.30 -0.66 0.00 -0.81 0.00 0.00 59.98 57.93 1w0y h ARG 134 Cb 1.12 -0.12 -0.14 0.00 -0.42 0.00 0.00 29.97 30.41 1w0y h ARG 134 CO 0.92 1.00 -0.68 -0.06 -1.51 0.00 0.00 179.97 179.64 1w0y s PHE 135 N -5.12 2.93 0.12 2.20 0.40 -1.26 -0.18 117.98 117.08 1w0y s PHE 135 Ca -0.12 -0.04 -0.08 0.00 -0.60 0.00 0.00 56.93 56.10 1w0y s PHE 135 Cb 0.14 -1.56 -0.01 0.00 0.51 0.00 0.00 43.02 42.11 1w0y s PHE 135 CO 0.85 0.44 0.21 -1.12 0.70 0.00 0.00 175.22 176.30 1w0y s SER 136 N -1.97 0.12 -0.09 1.36 0.01 -0.59 -4.61 113.70 107.93 1w0y s SER 136 Ca 0.22 -0.81 -0.06 0.00 1.31 0.00 0.00 55.95 56.61 1w0y s SER 136 Cb -0.11 0.37 -0.04 0.00 0.21 0.00 0.00 66.02 66.45 1w0y s SER 136 CO 0.14 -0.79 0.13 -0.76 0.41 0.00 0.00 173.24 172.37 1w0y s LEU 137 N -2.93 4.30 0.12 2.44 1.43 -0.11 -0.44 118.68 123.50 1w0y s LEU 137 Ca 0.12 0.41 0.10 0.00 -1.03 0.00 0.00 54.13 53.73 1w0y s LEU 137 Cb 0.05 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1w0y s LEU 137 CO -0.05 0.38 -0.24 0.68 0.23 0.00 0.00 176.35 177.34 1w0y s VAL 138 N -1.08 2.03 0.18 -1.59 -7.23 0.47 -0.31 120.40 112.88 1w0y s VAL 138 Ca 0.17 -1.67 -0.17 0.00 -1.81 0.00 0.00 61.98 58.50 1w0y s VAL 138 Cb -0.12 -1.81 0.03 0.00 0.56 0.00 0.00 36.38 35.03 1w0y s VAL 138 CO 0.07 0.02 0.49 -0.94 -0.31 0.00 0.00 175.10 174.43 1w0y s SER 139 N -2.00 -0.24 0.00 4.85 1.04 -1.22 -0.67 113.70 115.46 1w0y s SER 139 Ca 0.11 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 56.05 1w0y s SER 139 Cb -0.10 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1w0y s SER 139 CO 0.05 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 173.87 1w0y n GLY 140 N -0.32 -0.16 1.45 7.32 0.00 -0.83 -4.50 105.19 108.15 1w0y n GLY 140 Ca -0.11 -1.27 0.03 0.00 0.00 0.00 0.00 46.02 44.68 1w0y n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1w0y n TRP 141 N -0.99 1.63 -0.63 1.61 8.01 -1.26 -1.75 117.44 124.06 1w0y n TRP 141 Ca 0.00 -1.00 -0.14 0.00 -1.31 0.00 0.00 57.50 55.05 1w0y n TRP 141 Cb 0.00 -0.48 0.12 0.00 -2.01 0.00 0.00 31.31 28.95 1w0y n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1w0y n GLY 142 N -0.21 -2.86 3.70 6.99 0.00 -1.25 -2.08 105.19 109.48 1w0y n GLY 142 Ca 0.29 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 1w0y n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1w0y n GLN 143 N -3.26 2.14 0.12 1.61 3.00 -1.26 -2.39 117.38 117.33 1w0y n GLN 143 Ca 0.07 0.75 0.07 0.00 -0.01 0.00 0.00 57.00 57.88 1w0y n GLN 143 Cb 0.28 -2.33 0.02 0.00 0.00 0.00 0.00 30.24 28.21 1w0y n GLN 143 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1w0y h LEU 144 N 2.56 0.00 -8.06 1.08 3.38 -1.66 -0.13 115.31 112.48 1w0y h LEU 144 Ca -0.46 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.31 1w0y h LEU 144 Cb 1.28 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.83 1w0y h LEU 144 CO 0.63 0.26 -0.71 -0.76 0.09 0.00 0.00 178.44 177.94 1w0y s LEU 145 N -5.87 2.27 0.20 1.67 1.43 -1.26 -4.18 118.68 112.94 1w0y s LEU 145 Ca 0.01 -0.56 -0.15 0.00 -1.03 0.00 0.00 54.13 52.40 1w0y s LEU 145 Cb 0.08 0.03 0.20 0.00 0.03 0.00 0.00 46.19 46.53 1w0y s LEU 145 CO 0.76 -0.30 1.62 -0.78 0.23 0.00 0.00 176.35 177.88 1w0y h ASP 146 N 4.47 -0.73 0.03 2.29 -0.00 -1.90 -1.68 116.42 118.90 1w0y h ASP 146 Ca -0.33 0.20 -0.24 0.00 -0.00 0.00 0.00 57.03 56.65 1w0y h ASP 146 Cb 1.20 0.44 0.02 0.00 -0.00 0.00 0.00 39.33 40.99 1w0y h ASP 146 CO 0.43 -0.24 -0.97 -0.09 -0.00 0.00 0.00 179.24 178.38 1w0y h ARG 147 N -0.05 0.60 0.00 0.28 2.43 -1.97 -3.47 114.38 112.20 1w0y h ARG 147 Ca 0.28 -0.69 -0.07 0.00 -0.81 0.00 0.00 59.98 58.70 1w0y h ARG 147 Cb 0.49 0.20 0.04 0.00 -0.42 0.00 0.00 29.97 30.28 1w0y h ARG 147 CO -0.65 1.28 -0.03 0.41 -1.51 0.00 0.00 179.97 179.47 1w0y n GLY 149 N 1.16 -0.78 3.98 2.80 0.00 -0.63 -5.07 105.19 106.66 1w0y n GLY 149 Ca -0.12 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 1w0y n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w0y s ALA 150 N -2.02 4.06 0.78 4.61 0.00 -1.26 -4.78 121.76 123.16 1w0y s ALA 150 Ca 0.12 -1.46 -0.12 0.00 0.00 0.00 0.00 51.96 50.51 1w0y s ALA 150 Cb -0.02 -1.95 0.06 0.00 0.00 0.00 0.00 23.12 21.21 1w0y s ALA 150 CO 0.10 -0.69 1.16 0.95 0.00 0.00 0.00 175.76 177.28 1w0y s THR 151 N -2.69 2.42 0.13 0.00 -4.23 -1.26 -2.45 115.64 107.56 1w0y s THR 151 Ca 0.57 0.14 -0.08 0.00 -1.18 0.00 0.00 61.69 61.14 1w0y s THR 151 Cb -0.10 -3.13 -0.06 0.00 1.34 0.00 0.00 72.50 70.55 1w0y s THR 151 CO 0.37 -0.18 0.43 0.00 -0.54 0.00 0.00 174.62 174.70 1w0y s ALA 152 N -3.51 3.71 -0.01 3.99 0.00 -0.88 -4.83 121.76 120.23 1w0y s ALA 152 Ca 0.61 -0.40 0.11 0.00 0.00 0.00 0.00 51.96 52.28 1w0y s ALA 152 Cb -0.11 -2.27 -0.21 0.00 0.00 0.00 0.00 23.12 20.53 1w0y s ALA 152 CO 0.50 0.58 0.87 -0.07 0.00 0.00 0.00 175.76 177.64 1w0y h LEU 153 N 3.23 0.00 -9.17 0.00 3.38 -1.93 -3.45 115.31 107.37 1w0y h LEU 153 Ca -0.48 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 56.81 1w0y h LEU 153 Cb 1.18 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.76 1w0y h LEU 153 CO 0.69 0.96 -0.66 -1.61 0.09 0.00 0.00 178.44 177.90 1w0y s GLU 154 N -2.66 2.90 -0.13 1.13 2.02 -1.26 -0.61 118.70 120.09 1w0y s GLU 154 Ca -0.03 -0.48 -0.37 0.00 0.02 0.00 0.00 54.97 54.11 1w0y s GLU 154 Cb 0.09 -2.70 -0.14 0.00 0.10 0.00 0.00 34.13 31.47 1w0y s GLU 154 CO 0.82 0.66 1.71 -0.11 0.02 0.00 0.00 175.26 178.36 1w0y n LEU 155 N 2.25 2.65 -4.80 1.80 7.94 0.09 -4.83 117.00 122.10 1w0y n LEU 155 Ca -0.18 1.05 -0.32 0.00 -1.11 0.00 0.00 56.01 55.45 1w0y n LEU 155 Cb 0.53 -1.24 -0.06 0.00 0.53 0.00 0.00 43.42 43.18 1w0y n LEU 155 CO 0.28 -0.40 -0.24 -0.04 -1.11 0.00 0.00 177.39 175.88 1w0y s MET 156 N 3.04 3.04 0.08 1.96 -1.94 -0.72 0.02 119.30 124.79 1w0y s MET 156 Ca 0.93 -0.55 0.05 0.00 -1.71 0.00 0.00 55.69 54.40 1w0y s MET 156 Cb -0.91 -2.83 -0.03 0.00 2.01 0.00 0.00 34.83 33.06 1w0y s MET 156 CO 0.56 0.61 -0.12 0.54 -0.01 0.00 0.00 175.02 176.60 1w0y s VAL 157 N -1.30 1.05 -0.15 -6.03 0.11 0.14 -1.96 120.40 112.26 1w0y s VAL 157 Ca 0.27 -1.45 -0.09 0.00 -2.93 0.00 0.00 61.98 57.78 1w0y s VAL 157 Cb -0.12 -1.18 0.05 0.00 -1.53 0.00 0.00 36.38 33.60 1w0y s VAL 157 CO 0.19 -0.36 0.36 -0.22 -3.33 0.00 0.00 175.10 171.73 1w0y s LEU 158 N -2.04 0.18 -0.17 2.54 2.96 0.15 -1.36 118.68 120.95 1w0y s LEU 158 Ca 0.01 0.76 -0.21 0.00 -0.22 0.00 0.00 54.13 54.48 1w0y s LEU 158 Cb -0.07 1.16 -0.03 0.00 0.50 0.00 0.00 46.19 47.75 1w0y s LEU 158 CO 0.02 -0.17 0.61 0.21 -1.32 0.00 0.00 176.35 175.69 1w0y s ASN 159 N 1.13 6.72 0.00 3.68 3.04 -1.26 -0.39 114.94 127.86 1w0y s ASN 159 Ca -0.08 0.87 0.04 0.00 0.04 0.00 0.00 52.86 53.74 1w0y s ASN 159 Cb -0.08 -2.34 -0.01 0.00 -1.54 0.00 0.00 41.25 37.28 1w0y s ASN 159 CO -0.09 -0.20 -0.13 0.68 -3.04 0.00 0.00 177.10 174.31 1w0y s VAL 160 N 1.54 1.04 0.19 -5.21 -7.23 0.42 -4.93 120.40 106.22 1w0y s VAL 160 Ca 0.29 -0.66 -0.21 0.00 -1.81 0.00 0.00 61.98 59.59 1w0y s VAL 160 Cb -0.16 -0.89 -0.08 0.00 0.56 0.00 0.00 36.38 35.81 1w0y s VAL 160 CO 0.11 0.22 0.72 -2.16 -0.31 0.00 0.00 175.10 173.68 1w0y s PRO 161 N -0.51 4.33 0.24 4.82 0.04 -1.26 -1.54 135.00 141.12 1w0y s PRO 161 Ca 0.04 0.93 -0.11 0.00 0.04 0.00 0.00 61.00 61.90 1w0y s PRO 161 Cb -0.06 -3.02 -0.07 0.00 0.04 0.00 0.00 34.50 31.38 1w0y s PRO 161 CO -0.00 0.47 0.58 0.50 0.04 0.00 0.00 177.00 178.59 1w0y s ARG 162 N -1.65 3.86 0.01 4.56 3.52 0.75 -1.00 118.95 129.00 1w0y s ARG 162 Ca 0.39 0.37 0.05 0.00 -0.13 0.00 0.00 55.73 56.41 1w0y s ARG 162 Cb -0.19 -2.64 -0.02 0.00 -1.56 0.00 0.00 34.95 30.54 1w0y s ARG 162 CO 0.22 0.31 -0.15 -0.51 -0.81 0.00 0.00 175.30 174.36 1w0y s LEU 163 N -2.74 2.09 0.55 -0.88 1.02 -0.21 -4.97 118.68 113.54 1w0y s LEU 163 Ca 0.47 -0.36 -0.19 0.00 0.02 0.00 0.00 54.13 54.08 1w0y s LEU 163 Cb -0.11 -0.73 -0.05 0.00 0.02 0.00 0.00 46.19 45.31 1w0y s LEU 163 CO 0.20 0.13 1.10 -0.04 0.02 0.00 0.00 176.35 177.76 1w0y s MET 164 N -0.70 3.36 0.26 1.70 -1.94 -1.26 -3.91 119.30 116.80 1w0y s MET 164 Ca 0.05 1.48 -0.03 0.00 -1.71 0.00 0.00 55.69 55.47 1w0y s MET 164 Cb -0.07 -2.02 0.36 0.00 2.01 0.00 0.00 34.83 35.12 1w0y s MET 164 CO 0.00 -0.82 1.90 1.15 -0.01 0.00 0.00 175.02 177.24 1w0y h THR 165 N 1.01 1.15 -0.96 2.05 2.02 -1.94 -0.91 112.91 115.34 1w0y h THR 165 Ca -0.49 -0.43 0.08 0.00 0.77 0.00 0.00 66.41 66.35 1w0y h THR 165 Cb 1.25 -0.20 -0.07 0.00 -1.74 0.00 0.00 68.15 67.39 1w0y h THR 165 CO 0.57 0.23 0.62 -0.61 0.37 0.00 0.00 175.52 176.69 1w0y h GLN 166 N 1.24 1.01 -0.21 6.66 4.15 -2.00 -1.28 115.11 124.68 1w0y h GLN 166 Ca 0.41 -0.06 -0.20 0.00 0.77 0.00 0.00 58.65 59.57 1w0y h GLN 166 Cb 0.05 -0.23 0.01 0.00 0.21 0.00 0.00 27.48 27.52 1w0y h GLN 166 CO -0.14 0.67 -0.66 -0.44 -1.93 0.00 0.00 178.83 176.33 1w0y h ASP 167 N 1.04 0.95 -0.02 -0.69 3.32 -1.72 -3.25 116.42 116.06 1w0y h ASP 167 Ca 0.43 -0.58 0.02 0.00 0.02 0.00 0.00 57.03 56.92 1w0y h ASP 167 Cb 0.29 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1w0y h ASP 167 CO -0.18 1.37 -0.12 0.00 -1.72 0.00 0.00 179.24 178.58 1w0y n LEU 169 N -5.26 0.00 0.00 0.00 4.77 -0.58 -1.91 117.00 114.03 1w0y n LEU 169 Ca -0.05 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1w0y n LEU 169 Cb 0.18 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1w0y n LEU 169 CO 0.27 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.33 1w0y n GLN 170 N 0.79 0.00 -4.25 3.23 6.02 0.10 -4.74 117.38 118.53 1w0y n GLN 170 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.73 1w0y n GLN 170 Cb 0.00 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.18 1w0y n GLN 170 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1w0y s SER 170 N 0.00 4.54 0.54 1.08 0.01 -0.80 -4.77 113.70 114.30 1w0y s SER 170 Ca 0.00 -0.51 -0.14 0.00 1.31 0.00 0.00 55.95 56.61 1w0y s SER 170 Cb 0.00 -0.88 -0.06 0.00 0.21 0.00 0.00 66.02 65.29 1w0y s SER 170 CO 0.00 0.08 0.98 -0.13 0.41 0.00 0.00 173.24 174.58 1w0y s ARG 170 N -3.02 3.81 0.08 12.44 0.52 -0.77 -5.05 118.95 126.95 1w0y s ARG 170 Ca 0.27 0.84 -0.30 0.00 -0.52 0.00 0.00 55.73 56.02 1w0y s ARG 170 Cb -0.09 -2.14 -0.05 0.00 0.52 0.00 0.00 34.95 33.20 1w0y s ARG 170 CO 0.17 -0.35 0.99 0.21 0.02 0.00 0.00 175.30 176.34 1w0y s LYS 170 N -4.44 4.63 0.00 3.54 2.20 -1.26 -5.01 119.74 119.40 1w0y s LYS 170 Ca 0.57 1.48 0.00 0.00 -0.36 0.00 0.00 55.97 57.66 1w0y s LYS 170 Cb -0.10 -3.40 0.00 0.00 -1.51 0.00 0.00 37.83 32.82 1w0y s LYS 170 CO 0.39 0.09 0.00 -1.13 -0.36 0.00 0.00 175.35 174.34 1w0y n SER 170 N 3.19 0.00 -4.68 1.43 3.41 -1.26 -5.21 113.62 110.50 1w0y n SER 170 Ca 0.04 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.33 1w0y n SER 170 Cb 0.49 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.59 1w0y n SER 170 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1w0y n PRO 170 N 0.00 -0.17 -3.41 4.33 -0.02 -1.26 -4.98 135.00 129.49 1w0y n PRO 170 Ca 0.00 0.03 -0.33 0.00 -2.02 0.00 0.00 63.50 61.17 1w0y n PRO 170 Cb 0.00 -2.40 -0.05 0.00 -0.02 0.00 0.00 33.50 31.02 1w0y n PRO 170 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1w0y s ASN 175 N -2.39 6.69 -0.45 2.55 0.01 -1.26 -5.02 114.94 115.07 1w0y s ASN 175 Ca 0.70 0.95 -0.29 0.00 -0.71 0.00 0.00 52.86 53.51 1w0y s ASN 175 Cb -0.26 -2.24 0.03 0.00 0.41 0.00 0.00 41.25 39.19 1w0y s ASN 175 CO 0.55 0.01 1.15 -0.63 -1.51 0.00 0.00 177.10 176.66 1w0y s ILE 176 N -1.66 4.22 0.66 0.60 -1.09 -1.26 -4.97 121.20 117.70 1w0y s ILE 176 Ca 0.43 1.27 -0.02 0.00 -2.23 0.00 0.00 60.65 60.10 1w0y s ILE 176 Cb -0.13 -4.56 0.14 0.00 -1.58 0.00 0.00 42.46 36.33 1w0y s ILE 176 CO 0.20 -0.93 0.91 0.35 -1.23 0.00 0.00 174.94 174.24 1w0y n THR 177 N 6.73 0.00 0.75 2.92 -2.24 -1.26 -4.94 114.28 116.25 1w0y n THR 177 Ca 0.12 -1.29 0.10 0.00 -2.27 0.00 0.00 64.05 60.72 1w0y n THR 177 Cb 0.49 -1.05 0.46 0.00 -2.10 0.00 0.00 70.33 68.13 1w0y n THR 177 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1w0y n GLU 178 N -2.73 0.03 -0.59 -0.78 0.00 -1.26 -2.07 120.64 113.24 1w0y n GLU 178 Ca 0.14 0.13 0.06 0.00 0.00 0.00 0.00 57.16 57.49 1w0y n GLU 178 Cb 0.51 -1.50 0.29 0.00 0.00 0.00 0.00 31.44 30.74 1w0y n GLU 178 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1w0y n TYR 179 N -1.48 1.39 -4.21 -1.84 4.02 -1.26 -4.88 117.16 108.89 1w0y n TYR 179 Ca 0.06 -0.50 -0.15 0.00 -0.01 0.00 0.00 57.90 57.30 1w0y n TYR 179 Cb 0.24 -0.33 -0.09 0.00 -0.02 0.00 0.00 39.34 39.15 1w0y n TYR 179 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 1w0y s MET 180 N -2.10 1.46 -0.14 -0.72 -1.94 -0.88 -1.19 119.30 113.80 1w0y s MET 180 Ca 0.40 -1.75 -0.30 0.00 -1.71 0.00 0.00 55.69 52.33 1w0y s MET 180 Cb 0.29 0.31 0.10 0.00 2.01 0.00 0.00 34.83 37.54 1w0y s MET 180 CO 0.15 -0.52 0.87 -0.59 -0.01 0.00 0.00 175.02 174.92 1w0y s PHE 181 N -3.83 -0.50 0.19 -0.03 -0.71 -0.91 -4.68 117.98 107.51 1w0y s PHE 181 Ca 0.38 0.91 -0.04 0.00 -1.04 0.00 0.00 56.93 57.15 1w0y s PHE 181 Cb 0.04 0.42 -0.05 0.00 -1.21 0.00 0.00 43.02 42.22 1w0y s PHE 181 CO 0.18 -0.43 0.42 0.00 -1.34 0.00 0.00 175.22 174.04 1w0y s ALA 183 N -1.80 -1.34 0.00 0.00 0.00 -0.85 -1.05 121.76 116.72 1w0y s ALA 183 Ca 0.41 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.63 1w0y s ALA 183 Cb -0.11 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.50 1w0y s ALA 183 CO 0.27 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.15 1w0y n GLY 184 N 2.06 0.55 3.12 0.00 0.00 -0.17 -1.82 105.19 108.94 1w0y n GLY 184 Ca -0.16 -1.84 -0.18 0.00 0.00 0.00 0.00 46.02 43.84 1w0y n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1w0y s TYR 184 N -2.11 1.04 -1.78 1.61 1.51 -1.25 -4.47 117.35 111.91 1w0y s TYR 184 Ca 0.00 -0.39 0.17 0.00 -1.01 0.00 0.00 57.07 55.84 1w0y s TYR 184 Cb 0.00 -0.61 0.36 0.00 -0.11 0.00 0.00 41.96 41.60 1w0y s TYR 184 CO 0.00 0.01 1.28 -1.13 -1.11 0.00 0.00 175.55 174.60 1w0y n SER 185 N 1.73 3.11 -0.26 2.29 3.41 -1.25 -4.30 113.62 118.34 1w0y n SER 185 Ca -0.19 -1.90 0.14 0.00 -0.26 0.00 0.00 58.87 56.65 1w0y n SER 185 Cb 0.55 -0.23 0.67 0.00 -0.26 0.00 0.00 64.21 64.94 1w0y n SER 185 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1w0y n ASP 186 N 1.09 0.79 0.00 4.04 5.75 -1.26 -0.27 116.55 126.68 1w0y n ASP 186 Ca 0.15 -1.33 0.00 0.00 -0.01 0.00 0.00 54.79 53.61 1w0y n ASP 186 Cb 0.50 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1w0y n ASP 186 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1w0y n GLY 187 N 1.06 0.56 0.06 6.12 0.00 -1.26 -4.80 105.19 106.92 1w0y n GLY 187 Ca 0.20 -0.42 -0.03 0.00 0.00 0.00 0.00 46.02 45.77 1w0y n GLY 187 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1w0y n SER 188 N 0.76 1.33 -3.83 1.61 3.41 -1.26 -4.79 113.62 110.85 1w0y n SER 188 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 1w0y n SER 188 Cb 0.00 1.10 -0.12 0.00 -0.26 0.00 0.00 64.21 64.93 1w0y n SER 188 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1w0y s LYS 188 N -2.57 0.20 -0.07 4.33 1.02 -1.26 -3.96 119.74 117.43 1w0y s LYS 188 Ca -0.07 0.15 -0.32 0.00 0.02 0.00 0.00 55.97 55.75 1w0y s LYS 188 Cb 0.06 0.09 0.13 0.00 -0.52 0.00 0.00 37.83 37.59 1w0y s LYS 188 CO 0.63 -0.03 1.30 0.34 -0.92 0.00 0.00 175.35 176.66 1w0y s ASP 189 N -0.06 -0.06 0.66 2.83 3.68 -0.91 -3.77 116.67 119.04 1w0y s ASP 189 Ca -0.01 -0.09 -0.00 0.00 2.13 0.00 0.00 52.55 54.57 1w0y s ASP 189 Cb -0.02 0.13 0.11 0.00 -1.45 0.00 0.00 42.92 41.70 1w0y s ASP 189 CO 0.00 -0.24 0.77 -1.54 0.13 0.00 0.00 175.17 174.29 1w0y n SER 190 N -0.39 1.01 -3.59 -0.34 3.41 -1.26 -0.93 113.62 111.53 1w0y n SER 190 Ca -0.06 -1.86 -0.14 0.00 -0.26 0.00 0.00 58.87 56.55 1w0y n SER 190 Cb 0.62 -0.50 -0.06 0.00 -0.26 0.00 0.00 64.21 64.01 1w0y n SER 190 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w0y n LYS 192 N -0.48 -0.30 0.00 0.00 4.81 -1.26 0.29 118.16 121.21 1w0y n LYS 192 Ca 0.02 1.44 0.03 0.00 -0.87 0.00 0.00 58.31 58.93 1w0y n LYS 192 Cb 0.63 -2.13 0.16 0.00 0.02 0.00 0.00 35.03 33.71 1w0y n LYS 192 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1w0y n GLY 193 N -1.36 -0.61 0.01 3.14 0.00 -1.26 -1.13 105.19 103.99 1w0y n GLY 193 Ca 0.06 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.18 1w0y n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w0y n ASP 194 N -1.38 0.52 -4.29 1.61 8.00 0.14 -3.96 116.55 117.19 1w0y n ASP 194 Ca 0.03 -0.27 -0.52 0.00 0.71 0.00 0.00 54.79 54.73 1w0y n ASP 194 Cb 0.06 0.24 -0.05 0.00 -0.02 0.00 0.00 41.12 41.35 1w0y n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1w0y n SER 195 N -1.46 -0.57 0.00 -2.24 7.64 -0.28 -1.00 113.62 115.72 1w0y n SER 195 Ca 0.06 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1w0y n SER 195 Cb 0.34 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.63 1w0y n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1w0y n GLY 196 N 1.67 2.43 3.81 0.23 0.00 0.67 -1.22 105.19 112.78 1w0y n GLY 196 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1w0y n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1w0y s GLY 197 N -1.88 1.61 0.46 -0.02 0.00 -0.17 -3.40 107.32 103.92 1w0y s GLY 197 Ca 0.00 -0.35 -0.22 0.00 0.00 0.00 0.00 44.72 44.14 1w0y s GLY 197 CO 0.00 0.12 1.11 2.56 0.00 0.00 0.00 173.10 176.89 1w0y s PRO 198 N -5.24 3.81 -0.35 2.90 0.04 -1.26 -0.84 135.00 134.05 1w0y s PRO 198 Ca 0.62 1.63 0.03 0.00 0.04 0.00 0.00 61.00 63.31 1w0y s PRO 198 Cb -0.14 -2.34 0.10 0.00 0.04 0.00 0.00 34.50 32.16 1w0y s PRO 198 CO 0.53 -0.47 0.08 -1.58 0.04 0.00 0.00 177.00 175.61 1w0y s HIS 199 N -1.67 3.24 -0.17 0.56 2.46 -0.73 -3.38 115.29 115.60 1w0y s HIS 199 Ca 0.64 -2.75 -0.07 0.00 0.47 0.00 0.00 55.06 53.35 1w0y s HIS 199 Cb -0.24 -2.64 -0.04 0.00 -0.13 0.00 0.00 32.58 29.53 1w0y s HIS 199 CO 0.30 -0.91 0.06 0.00 -2.47 0.00 0.00 174.74 171.71 1w0y s ALA 200 N 0.92 3.41 -0.18 1.58 0.00 0.58 -1.83 121.76 126.24 1w0y s ALA 200 Ca 0.12 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.28 1w0y s ALA 200 Cb -0.19 -1.87 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 1w0y s ALA 200 CO -0.11 0.24 0.00 0.99 0.00 0.00 0.00 175.76 176.89 1w0y s THR 201 N 0.18 4.12 -0.19 0.00 2.01 -0.58 -0.93 115.64 120.25 1w0y s THR 201 Ca 0.04 -0.27 -0.18 0.00 0.31 0.00 0.00 61.69 61.60 1w0y s THR 201 Cb -0.12 -2.84 -0.03 0.00 0.01 0.00 0.00 72.50 69.51 1w0y s THR 201 CO 0.01 0.46 0.50 -2.28 -0.69 0.00 0.00 174.62 172.61 1w0y s HIS 202 N 0.62 3.38 -0.06 4.92 2.46 -1.26 -0.99 115.29 124.36 1w0y s HIS 202 Ca -0.00 0.76 -0.02 0.00 0.47 0.00 0.00 55.06 56.26 1w0y s HIS 202 Cb -0.14 -2.64 0.04 0.00 -0.13 0.00 0.00 32.58 29.71 1w0y s HIS 202 CO 0.02 -0.07 0.12 -0.47 -2.47 0.00 0.00 174.74 171.87 1w0y s TYR 203 N 1.51 -0.11 -1.28 3.88 6.14 0.80 -4.93 117.35 123.36 1w0y s TYR 203 Ca 0.23 0.42 -0.03 0.00 0.64 0.00 0.00 57.07 58.33 1w0y s TYR 203 Cb -0.15 -0.20 0.00 0.00 0.42 0.00 0.00 41.96 42.03 1w0y s TYR 203 CO 0.09 -0.18 0.07 0.54 0.64 0.00 0.00 175.55 176.71 1w0y n ARG 204 N 4.59 -0.88 -0.38 4.97 1.74 -1.26 -0.48 116.66 124.97 1w0y n ARG 204 Ca -0.19 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1w0y n ARG 204 Cb 0.51 -2.90 0.00 0.00 -1.02 0.00 0.00 32.46 29.05 1w0y n ARG 204 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1w0y n GLY 205 N -2.30 0.88 2.98 -0.13 0.00 -1.26 -5.05 105.19 100.31 1w0y n GLY 205 Ca -0.26 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.62 1w0y n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1w0y s THR 206 N -2.85 0.39 -0.04 2.61 2.01 0.37 -5.14 115.64 112.98 1w0y s THR 206 Ca 0.00 -0.49 -0.10 0.00 0.31 0.00 0.00 61.69 61.41 1w0y s THR 206 Cb 0.00 -0.38 -0.05 0.00 0.01 0.00 0.00 72.50 72.08 1w0y s THR 206 CO 0.00 -0.08 0.28 0.26 -0.69 0.00 0.00 174.62 174.40 1w0y s TRP 207 N -0.55 3.65 0.11 4.92 0.52 -1.26 -0.14 118.94 126.19 1w0y s TRP 207 Ca -0.03 0.75 0.05 0.00 0.02 0.00 0.00 56.10 56.89 1w0y s TRP 207 Cb -0.05 -2.10 -0.04 0.00 -1.15 0.00 0.00 33.47 30.13 1w0y s TRP 207 CO -0.00 0.67 -0.14 0.71 0.02 0.00 0.00 176.95 178.22 1w0y s TYR 208 N -1.10 1.31 -0.28 -1.98 2.02 -0.16 -3.11 117.35 114.04 1w0y s TYR 208 Ca 0.21 -0.54 -0.23 0.00 -0.37 0.00 0.00 57.07 56.13 1w0y s TYR 208 Cb -0.14 -0.70 -0.00 0.00 -0.40 0.00 0.00 41.96 40.71 1w0y s TYR 208 CO 0.10 0.10 0.79 -1.17 -1.57 0.00 0.00 175.55 173.80 1w0y s LEU 209 N -2.26 4.08 -0.02 -1.29 2.96 0.38 -1.53 118.68 120.99 1w0y s LEU 209 Ca 0.06 0.81 0.05 0.00 -0.22 0.00 0.00 54.13 54.83 1w0y s LEU 209 Cb -0.06 -3.09 -0.08 0.00 0.50 0.00 0.00 46.19 43.46 1w0y s LEU 209 CO 0.02 -0.55 0.09 0.35 -1.32 0.00 0.00 176.35 174.94 1w0y n THR 210 N 5.39 0.11 -4.08 3.68 -2.24 -0.89 -4.54 114.28 111.72 1w0y n THR 210 Ca 0.04 -0.16 -0.10 0.00 -2.27 0.00 0.00 64.05 61.56 1w0y n THR 210 Cb 0.48 -0.02 -0.08 0.00 -2.10 0.00 0.00 70.33 68.61 1w0y n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1w0y s GLY 211 N -2.96 0.91 -0.06 3.38 0.00 -0.76 -2.50 107.32 105.33 1w0y s GLY 211 Ca -0.02 -1.24 0.01 0.00 0.00 0.00 0.00 44.72 43.47 1w0y s GLY 211 CO 0.23 -1.01 -0.07 -0.42 0.00 0.00 0.00 173.10 171.83 1w0y s ILE 212 N -4.07 0.77 0.04 0.90 1.01 -1.17 -1.78 121.20 116.91 1w0y s ILE 212 Ca 0.28 -0.24 -0.32 0.00 0.00 0.00 0.00 60.65 60.37 1w0y s ILE 212 Cb 0.04 -0.76 -0.11 0.00 0.01 0.00 0.00 42.46 41.63 1w0y s ILE 212 CO 0.08 0.28 1.84 0.52 0.00 0.00 0.00 174.94 177.67 1w0y n VAL 213 N 4.14 0.46 0.03 2.92 0.31 -0.02 -1.52 118.33 124.66 1w0y n VAL 213 Ca -0.22 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1w0y n VAL 213 Cb 0.51 -2.00 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 1w0y n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1w0y n SER 214 N 6.02 0.34 -0.93 4.52 2.88 -1.09 -0.24 113.62 125.13 1w0y n SER 214 Ca 0.20 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.85 1w0y n SER 214 Cb 0.34 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 1w0y n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1w0y n TRP 215 N -2.95 -0.52 0.00 0.66 4.27 -1.09 -4.93 117.44 112.88 1w0y n TRP 215 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1w0y n TRP 215 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 1w0y n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1w0y n GLY 216 N 0.00 2.55 3.62 -1.67 0.00 -1.26 -1.73 105.19 106.71 1w0y n GLY 216 Ca 0.00 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 1w0y n GLY 216 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w0y s GLN 217 N -2.01 4.00 2.86 1.61 -1.52 -1.26 -4.87 119.66 118.46 1w0y s GLN 217 Ca 0.00 0.71 0.00 0.00 -1.95 0.00 0.00 55.36 54.12 1w0y s GLN 217 Cb 0.00 -3.72 0.00 0.00 -0.22 0.00 0.00 33.01 29.07 1w0y s GLN 217 CO 0.00 -0.72 0.00 0.41 -0.25 0.00 0.00 175.29 174.73 1w0y n GLY 219 N 4.10 1.44 2.68 3.09 0.00 -1.26 -4.20 105.19 111.03 1w0y n GLY 219 Ca 0.06 -0.50 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 1w0y n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w0y n ALA 221 N 5.23 -1.68 -2.12 0.00 0.00 -1.26 -4.51 120.51 116.17 1w0y n ALA 221 Ca -0.06 0.16 -0.40 0.00 0.00 0.00 0.00 53.44 53.14 1w0y n ALA 221 Cb 0.49 -3.90 -0.05 0.00 0.00 0.00 0.00 19.45 15.99 1w0y n ALA 221 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1w0y s THR 221 N -3.34 4.44 0.23 0.00 2.01 -1.26 -4.24 115.64 113.47 1w0y s THR 221 Ca 0.28 1.85 -0.31 0.00 0.31 0.00 0.00 61.69 63.82 1w0y s THR 221 Cb -0.13 -4.21 -0.11 0.00 0.01 0.00 0.00 72.50 68.06 1w0y s THR 221 CO 0.73 0.43 1.63 -0.69 -0.69 0.00 0.00 174.62 176.03 1w0y s VAL 222 N -0.58 2.22 0.00 3.82 1.01 -1.26 -1.79 120.40 123.82 1w0y s VAL 222 Ca 0.40 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.55 1w0y s VAL 222 Cb -0.23 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.04 1w0y s VAL 222 CO 0.27 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1w0y n GLY 223 N 3.28 0.71 3.07 4.51 0.00 0.62 -4.93 105.19 112.46 1w0y n GLY 223 Ca 0.13 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.06 1w0y n GLY 223 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1w0y s HIS 224 N -2.33 0.52 0.29 1.61 4.02 -0.74 -1.85 115.29 116.81 1w0y s HIS 224 Ca 0.00 -0.88 0.10 0.00 1.02 0.00 0.00 55.06 55.30 1w0y s HIS 224 Cb 0.00 -0.36 -0.05 0.00 -1.02 0.00 0.00 32.58 31.15 1w0y s HIS 224 CO 0.00 -0.28 -0.15 -0.06 1.02 0.00 0.00 174.74 175.26 1w0y s PHE 225 N -3.12 2.23 0.65 1.40 0.40 -1.26 -3.94 117.98 114.34 1w0y s PHE 225 Ca 0.01 -0.43 -0.12 0.00 -0.60 0.00 0.00 56.93 55.79 1w0y s PHE 225 Cb 0.02 -1.09 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 1w0y s PHE 225 CO -0.06 0.61 1.05 0.20 0.70 0.00 0.00 175.22 177.71 1w0y s GLY 226 N -3.51 1.77 0.02 4.36 0.00 -0.75 -4.60 107.32 104.61 1w0y s GLY 226 Ca 0.30 0.10 0.07 0.00 0.00 0.00 0.00 44.72 45.19 1w0y s GLY 226 CO 0.14 0.40 -0.20 0.14 0.00 0.00 0.00 173.10 173.59 1w0y s VAL 227 N -2.95 1.57 0.04 1.40 1.01 -0.70 -2.01 120.40 118.75 1w0y s VAL 227 Ca 0.58 -1.06 0.04 0.00 0.00 0.00 0.00 61.98 61.54 1w0y s VAL 227 Cb -0.13 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 1w0y s VAL 227 CO 0.50 0.26 -0.11 -0.31 0.00 0.00 0.00 175.10 175.44 1w0y s TYR 228 N -0.69 0.95 0.24 5.22 1.51 -0.44 -2.66 117.35 121.49 1w0y s TYR 228 Ca 0.07 -0.38 -0.30 0.00 -1.01 0.00 0.00 57.07 55.45 1w0y s TYR 228 Cb -0.08 -0.56 -0.10 0.00 -0.11 0.00 0.00 41.96 41.10 1w0y s TYR 228 CO 0.01 -0.00 1.52 0.99 -1.11 0.00 0.00 175.55 176.96 1w0y s THR 229 N -0.98 2.46 -0.89 -0.71 2.01 -0.58 -2.15 115.64 114.81 1w0y s THR 229 Ca -0.02 0.37 -0.22 0.00 0.31 0.00 0.00 61.69 62.13 1w0y s THR 229 Cb -0.08 -3.24 0.08 0.00 0.01 0.00 0.00 72.50 69.28 1w0y s THR 229 CO 0.01 0.05 1.22 -0.60 -0.69 0.00 0.00 174.62 174.61 1w0y s ARG 230 N 0.01 3.47 0.57 4.92 3.52 -0.33 -3.01 118.95 128.10 1w0y s ARG 230 Ca 0.64 -1.25 0.28 0.00 -0.13 0.00 0.00 55.73 55.26 1w0y s ARG 230 Cb -0.44 -4.87 1.51 0.00 -1.56 0.00 0.00 34.95 29.58 1w0y s ARG 230 CO 0.41 -1.96 1.98 0.28 -0.81 0.00 0.00 175.30 175.21 1w0y h VAL 231 N 6.19 0.50 0.00 7.11 2.07 -1.81 -2.17 116.25 128.13 1w0y h VAL 231 Ca 0.05 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1w0y h VAL 231 Cb 1.03 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1w0y h VAL 231 CO 1.24 0.00 -0.01 0.77 0.02 0.00 0.00 177.57 179.59 1w0y h SER 232 N 0.00 0.00 1.15 0.57 4.64 -1.89 -0.42 113.55 117.61 1w0y h SER 232 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1w0y h SER 232 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1w0y h SER 232 CO -0.00 0.01 -0.01 0.00 -0.87 0.00 0.00 176.83 175.96 1w0y n GLN 233 N -3.64 0.09 -0.07 4.77 1.13 -0.82 -3.83 117.38 115.01 1w0y n GLN 233 Ca -0.03 0.07 0.03 0.00 -1.94 0.00 0.00 57.00 55.14 1w0y n GLN 233 Cb 0.09 -1.60 0.07 0.00 0.11 0.00 0.00 30.24 28.91 1w0y n GLN 233 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1w0y n TYR 234 N -1.75 0.19 -0.10 1.08 4.02 -0.17 -4.77 117.16 115.65 1w0y n TYR 234 Ca 0.07 -0.35 -0.06 0.00 -0.01 0.00 0.00 57.90 57.55 1w0y n TYR 234 Cb 0.37 -0.03 0.02 0.00 -0.02 0.00 0.00 39.34 39.68 1w0y n TYR 234 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 1w0y h ILE 235 N 1.23 0.81 -0.36 -0.72 2.04 -1.64 0.25 117.51 119.12 1w0y h ILE 235 Ca 0.00 -0.06 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 1w0y h ILE 235 Cb 0.53 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1w0y h ILE 235 CO 0.00 0.03 0.07 -0.33 0.00 0.00 0.00 178.15 177.92 1w0y h GLU 236 N 0.18 0.58 -0.05 2.37 5.08 -1.88 -0.51 114.58 120.35 1w0y h GLU 236 Ca 0.17 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1w0y h GLU 236 Cb 0.20 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1w0y h GLU 236 CO -0.23 0.64 -0.17 2.35 -1.00 0.00 0.00 179.01 180.60 1w0y h TRP 237 N 0.42 -0.43 -0.89 4.33 7.01 -1.73 -0.04 115.95 124.61 1w0y h TRP 237 Ca 0.11 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 1w0y h TRP 237 Cb 0.33 0.20 -0.04 0.00 -2.10 0.00 0.00 29.16 27.55 1w0y h TRP 237 CO 0.02 -0.24 0.52 -0.07 -2.79 0.00 0.00 178.44 175.88 1w0y h LEU 238 N -0.25 1.09 -0.55 0.65 3.38 -0.31 -2.66 115.31 116.67 1w0y h LEU 238 Ca 0.07 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 1w0y h LEU 238 Cb 0.34 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1w0y h LEU 238 CO -0.19 0.85 -0.47 1.56 0.09 0.00 0.00 178.44 180.27 1w0y h GLN 239 N 1.24 0.63 -0.31 1.13 4.20 -0.56 -1.24 115.11 120.20 1w0y h GLN 239 Ca 0.32 -0.36 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 1w0y h GLN 239 Cb -0.03 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1w0y h GLN 239 CO -0.06 0.97 0.09 -0.22 -0.67 0.00 0.00 178.83 178.94 1w0y h LYS 240 N 0.50 0.49 -0.77 1.46 3.64 -0.90 -3.04 116.57 117.95 1w0y h LYS 240 Ca 0.03 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1w0y h LYS 240 Cb 1.01 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.73 1w0y h LYS 240 CO 0.09 0.55 0.39 -0.07 -2.27 0.00 0.00 179.45 178.14 1w0y h LEU 241 N 0.35 1.00 -2.34 5.20 3.38 -1.38 -2.23 115.31 119.29 1w0y h LEU 241 Ca 0.10 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1w0y h LEU 241 Cb 0.27 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1w0y h LEU 241 CO -0.00 0.84 -0.04 0.24 0.09 0.00 0.00 178.44 179.56 1w0y h MET 242 N 1.08 0.00 -0.64 1.13 2.86 -1.16 -0.42 114.93 117.79 1w0y h MET 242 Ca 0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.91 1w0y h MET 242 Cb 0.09 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1w0y h MET 242 CO -0.04 0.04 0.00 0.54 1.06 0.00 0.00 176.91 178.51 1w0y n ARG 243 N -3.54 2.62 -3.46 1.72 1.74 -0.85 -4.96 116.66 109.94 1w0y n ARG 243 Ca -0.02 -2.33 -0.26 0.00 -0.77 0.00 0.00 57.85 54.47 1w0y n ARG 243 Cb 0.15 -1.55 -0.02 0.00 -1.02 0.00 0.00 32.46 30.02 1w0y n ARG 243 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1w0y s SER 244 N -0.98 6.35 0.34 0.55 1.04 -0.17 -5.08 113.70 115.76 1w0y s SER 244 Ca 0.43 0.49 -0.26 0.00 0.48 0.00 0.00 55.95 57.09 1w0y s SER 244 Cb 0.23 -2.05 -0.09 0.00 0.10 0.00 0.00 66.02 64.21 1w0y s SER 244 CO 0.28 -0.21 1.01 -1.61 0.98 0.00 0.00 173.24 173.69 1w0y s GLU 245 N -3.89 4.44 -0.08 4.02 2.02 -1.26 -4.97 118.70 118.97 1w0y s GLU 245 Ca 0.40 1.49 -0.29 0.00 0.02 0.00 0.00 54.97 56.59 1w0y s GLU 245 Cb -0.10 -2.78 -0.07 0.00 0.10 0.00 0.00 34.13 31.28 1w0y s GLU 245 CO 0.33 0.11 2.02 -2.14 0.02 0.00 0.00 175.26 175.60 1w0y s PRO 246 N -2.09 3.75 0.30 0.39 0.02 -1.26 -5.00 135.00 131.11 1w0y s PRO 246 Ca 0.52 2.31 -0.11 0.00 0.02 0.00 0.00 61.00 63.74 1w0y s PRO 246 Cb -0.22 -4.22 -0.07 0.00 0.02 0.00 0.00 34.50 30.00 1w0y s PRO 246 CO 0.28 -1.39 0.65 1.03 -0.33 0.00 0.00 177.00 177.24 1w0y s ARG 247 N 5.14 3.84 0.71 5.54 0.52 -1.26 -5.05 118.95 128.40 1w0y s ARG 247 Ca 0.91 0.40 -0.16 0.00 -0.52 0.00 0.00 55.73 56.36 1w0y s ARG 247 Cb -0.37 -2.53 -0.00 0.00 0.52 0.00 0.00 34.95 32.56 1w0y s ARG 247 CO 0.38 0.19 0.90 -2.30 0.02 0.00 0.00 175.30 174.49 1w0y n PRO 248 N -0.51 0.49 -0.26 3.54 -0.02 -1.26 -4.77 135.00 132.22 1w0y n PRO 248 Ca 0.02 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1w0y n PRO 248 Cb 0.53 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1w0y n PRO 248 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w0y n GLY 249 N 1.19 -3.14 0.20 -1.23 0.00 -1.26 -4.85 105.19 96.10 1w0y n GLY 249 Ca 0.13 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 1w0y n GLY 249 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1w0y h VAL 250 N 0.17 0.68 -3.31 1.61 2.07 -1.86 -3.44 116.25 112.16 1w0y h VAL 250 Ca 0.00 -0.59 -0.56 0.00 0.82 0.00 0.00 66.70 66.37 1w0y h VAL 250 Cb 0.07 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 1w0y h VAL 250 CO 0.00 0.11 0.42 -0.22 0.02 0.00 0.00 177.57 177.90 1w0y s LEU 251 N -9.50 4.26 -0.02 2.57 2.96 -1.26 -1.28 118.68 116.41 1w0y s LEU 251 Ca -0.14 1.42 0.04 0.00 -0.22 0.00 0.00 54.13 55.23 1w0y s LEU 251 Cb 0.02 -3.42 -0.01 0.00 0.50 0.00 0.00 46.19 43.29 1w0y s LEU 251 CO 0.54 -0.35 -0.14 -0.22 -1.32 0.00 0.00 176.35 174.85 1w0y s LEU 252 N 1.68 1.95 -0.23 -0.68 2.96 -0.50 -4.95 118.68 118.91 1w0y s LEU 252 Ca 0.45 -0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 54.06 1w0y s LEU 252 Cb -0.18 -0.78 0.01 0.00 0.50 0.00 0.00 46.19 45.73 1w0y s LEU 252 CO 0.19 0.15 -0.05 -0.13 -1.32 0.00 0.00 176.35 175.19 1w0y s ARG 253 N -0.15 3.13 -0.12 1.98 3.00 -1.26 -1.96 118.95 123.58 1w0y s ARG 253 Ca 0.02 -0.79 -0.03 0.00 0.00 0.00 0.00 55.73 54.93 1w0y s ARG 253 Cb -0.08 -3.01 -0.03 0.00 0.00 0.00 0.00 34.95 31.83 1w0y s ARG 253 CO 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 175.30 175.01 1w0y s ALA 254 N 1.41 3.24 0.57 2.13 0.00 -0.72 -4.72 121.76 123.68 1w0y s ALA 254 Ca 0.03 -0.80 -0.20 0.00 0.00 0.00 0.00 51.96 51.00 1w0y s ALA 254 Cb -0.15 -1.57 -0.05 0.00 0.00 0.00 0.00 23.12 21.35 1w0y s ALA 254 CO -0.04 0.44 1.10 -0.35 0.00 0.00 0.00 175.76 176.91 1w0y n PRO 255 N 2.67 1.17 -3.73 0.00 -0.04 -1.26 -0.79 135.00 133.01 1w0y n PRO 255 Ca -0.18 0.44 -0.15 0.00 -0.04 0.00 0.00 63.50 63.57 1w0y n PRO 255 Cb 0.53 -2.28 -0.15 0.00 -0.04 0.00 0.00 33.50 31.55 1w0y n PRO 255 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1w0y s PHE 256 N -1.42 -0.10 -1.45 0.54 5.36 -1.26 -4.76 117.98 114.89 1w0y s PHE 256 Ca 0.74 0.41 0.00 0.00 -0.96 0.00 0.00 56.93 57.11 1w0y s PHE 256 Cb -0.43 -0.19 0.00 0.00 -0.34 0.00 0.00 43.02 42.06 1w0y s PHE 256 CO 0.48 -0.17 0.36 -2.30 -1.46 0.00 0.00 175.22 172.13