#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhw n SER 2 N 0.00 1.37 0.00 1.61 7.64 -1.26 -4.34 113.62 118.65 1uhw n SER 2 Ca 0.00 -0.31 0.11 0.00 1.01 0.00 0.00 58.87 59.68 1uhw n SER 2 Cb 0.00 1.40 -0.04 0.00 -1.01 0.00 0.00 64.21 64.56 1uhw n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1uhw n SER 3 N -1.74 0.73 -1.85 6.43 3.41 -1.26 -4.89 113.62 114.46 1uhw n SER 3 Ca -0.01 -0.61 0.00 0.00 -0.26 0.00 0.00 58.87 57.99 1uhw n SER 3 Cb 0.31 0.96 0.00 0.00 -0.26 0.00 0.00 64.21 65.21 1uhw n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uhw n GLY 4 N 1.45 4.26 3.39 5.00 0.00 -1.26 -4.88 105.19 113.15 1uhw n GLY 4 Ca 0.03 -2.19 -0.20 0.00 0.00 0.00 0.00 46.02 43.66 1uhw n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uhw n SER 5 N -1.08 -6.25 -4.63 1.61 7.64 -1.26 -4.54 113.62 105.10 1uhw n SER 5 Ca 0.00 -0.79 -0.53 0.00 1.01 0.00 0.00 58.87 58.56 1uhw n SER 5 Cb 0.00 -4.56 -0.06 0.00 -1.01 0.00 0.00 64.21 58.58 1uhw n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1uhw n SER 6 N -2.96 2.63 0.00 6.43 7.64 -1.26 -2.33 113.62 123.77 1uhw n SER 6 Ca -0.08 0.86 0.00 0.00 1.01 0.00 0.00 58.87 60.66 1uhw n SER 6 Cb 0.60 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 1uhw n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uhw n GLY 7 N 4.95 2.15 0.35 0.23 0.00 -1.26 -4.82 105.19 106.79 1uhw n GLY 7 Ca 0.30 -0.69 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 1uhw n GLY 7 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1uhw h LEU 8 N 0.00 -1.77 0.00 0.99 4.07 -1.90 0.30 115.31 117.01 1uhw h LEU 8 Ca 0.00 0.26 0.00 0.00 0.08 0.00 0.00 57.88 58.22 1uhw h LEU 8 Cb 0.00 0.77 0.00 0.00 1.08 0.00 0.00 40.66 42.51 1uhw h LEU 8 CO 0.00 -0.21 0.00 0.61 -1.08 0.00 0.00 178.44 177.76 1uhw n GLY 9 N -1.22 -2.52 0.33 0.83 0.00 -0.98 0.23 105.19 101.86 1uhw n GLY 9 Ca 0.01 0.49 -0.02 0.00 0.00 0.00 0.00 46.02 46.50 1uhw n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uhw h ALA 10 N -0.92 0.20 0.07 4.61 0.00 -1.61 0.82 119.26 122.42 1uhw h ALA 10 Ca 0.00 0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1uhw h ALA 10 Cb 0.00 0.75 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 1uhw h ALA 10 CO 0.00 -0.57 -0.35 1.25 0.00 0.00 0.00 179.25 179.58 1uhw h LEU 11 N -0.08 -1.05 -0.11 0.00 5.85 0.18 -1.93 115.31 118.18 1uhw h LEU 11 Ca 0.30 0.13 0.04 0.00 0.84 0.00 0.00 57.88 59.19 1uhw h LEU 11 Cb 0.57 0.41 -0.06 0.00 0.37 0.00 0.00 40.66 41.95 1uhw h LEU 11 CO -0.78 -0.43 -0.25 0.22 -0.34 0.00 0.00 178.44 176.86 1uhw h TYR 12 N -0.55 -0.67 -1.26 1.25 3.20 0.57 0.82 116.97 120.32 1uhw h TYR 12 Ca 0.04 0.03 0.40 0.00 3.14 0.00 0.00 58.73 62.34 1uhw h TYR 12 Cb 0.61 0.31 -0.12 0.00 1.54 0.00 0.00 36.73 39.07 1uhw h TYR 12 CO -0.34 -0.33 0.82 -0.07 -1.64 0.00 0.00 178.16 176.60 1uhw h LEU 13 N -0.33 0.28 0.06 2.82 3.38 0.97 0.58 115.31 123.06 1uhw h LEU 13 Ca 0.09 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1uhw h LEU 13 Cb 0.47 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1uhw h LEU 13 CO -0.30 -0.11 -0.03 0.28 0.09 0.00 0.00 178.44 178.37 1uhw h SER 14 N 0.15 -0.07 -1.52 -0.43 0.02 -0.12 -3.11 113.55 108.47 1uhw h SER 14 Ca 0.76 -0.52 0.44 0.00 -0.84 0.00 0.00 61.79 61.64 1uhw h SER 14 Cb 2.34 0.02 -0.06 0.00 0.14 0.00 0.00 62.40 64.84 1uhw h SER 14 CO -0.37 0.52 1.12 0.24 -1.14 0.00 0.00 176.83 177.20 1uhw h MET 15 N -0.70 0.00 -0.45 3.45 2.86 0.14 1.26 114.93 121.48 1uhw h MET 15 Ca -0.01 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1uhw h MET 15 Cb 0.58 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 1uhw h MET 15 CO 0.01 0.00 0.19 0.87 1.06 0.00 0.00 176.91 179.05 1uhw h LYS 16 N 0.00 0.67 -6.12 1.72 1.57 -1.27 -2.59 116.57 110.55 1uhw h LYS 16 Ca 0.72 -0.11 -0.63 0.00 -1.87 0.00 0.00 60.65 58.76 1uhw h LYS 16 Cb 2.96 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 35.16 1uhw h LYS 16 CO -0.01 0.60 1.29 -3.47 -0.57 0.00 0.00 179.45 177.29 1uhw n ASP 17 N -4.61 3.01 0.00 0.86 -0.08 0.43 -4.79 116.55 111.37 1uhw n ASP 17 Ca 0.01 0.62 0.12 0.00 -1.51 0.00 0.00 54.79 54.02 1uhw n ASP 17 Cb 0.14 -1.38 0.66 0.00 2.34 0.00 0.00 41.12 42.88 1uhw n ASP 17 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1uhw n PRO 18 N 7.64 0.60 0.01 -0.67 -0.04 -1.26 0.75 135.00 142.03 1uhw n PRO 18 Ca 0.30 0.03 -0.02 0.00 -0.04 0.00 0.00 63.50 63.77 1uhw n PRO 18 Cb 0.31 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.26 1uhw n PRO 18 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1uhw n GLU 19 N -1.10 0.05 -0.40 0.54 1.02 -1.26 -4.67 120.64 114.82 1uhw n GLU 19 Ca 0.15 0.02 0.07 0.00 -0.02 0.00 0.00 57.16 57.39 1uhw n GLU 19 Cb 0.12 -0.59 0.26 0.00 -0.02 0.00 0.00 31.44 31.20 1uhw n GLU 19 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1uhw n LYS 20 N -3.33 2.79 0.00 3.49 4.76 -1.25 -4.90 118.16 119.72 1uhw n LYS 20 Ca -0.03 -2.06 0.00 0.00 -2.87 0.00 0.00 58.31 53.35 1uhw n LYS 20 Cb 0.32 -1.64 0.00 0.00 -1.84 0.00 0.00 35.03 31.87 1uhw n LYS 20 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1uhw n GLY 21 N 1.05 5.44 3.78 0.72 0.00 0.23 -4.79 105.19 111.62 1uhw n GLY 21 Ca 0.19 -1.36 -0.32 0.00 0.00 0.00 0.00 46.02 44.53 1uhw n GLY 21 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uhw s ILE 22 N 0.15 3.38 0.44 -0.61 1.01 -0.98 -4.74 121.20 119.85 1uhw s ILE 22 Ca 0.00 0.58 -0.03 0.00 0.00 0.00 0.00 60.65 61.21 1uhw s ILE 22 Cb 0.00 -3.11 0.09 0.00 0.01 0.00 0.00 42.46 39.45 1uhw s ILE 22 CO 0.00 -0.45 0.60 0.29 0.00 0.00 0.00 174.94 175.38 1uhw n LYS 23 N -2.66 -0.06 -3.38 2.79 5.02 -1.26 -4.03 118.16 114.58 1uhw n LYS 23 Ca 0.10 -1.39 -0.12 0.00 -2.02 0.00 0.00 58.31 54.88 1uhw n LYS 23 Cb 0.52 -0.48 -0.09 0.00 -0.02 0.00 0.00 35.03 34.97 1uhw n LYS 23 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1uhw s GLU 24 N -4.09 0.32 0.44 1.97 2.02 -1.26 -4.82 118.70 113.28 1uhw s GLU 24 Ca 0.38 0.27 0.06 0.00 0.02 0.00 0.00 54.97 55.70 1uhw s GLU 24 Cb -0.02 -0.63 -0.04 0.00 0.10 0.00 0.00 34.13 33.54 1uhw s GLU 24 CO 0.26 -0.79 0.17 -0.51 0.02 0.00 0.00 175.26 174.40 1uhw s LEU 25 N 2.47 2.96 -0.41 1.80 1.43 -1.22 -4.79 118.68 120.92 1uhw s LEU 25 Ca 0.10 -1.19 -0.06 0.00 -1.03 0.00 0.00 54.13 51.96 1uhw s LEU 25 Cb -0.15 -1.28 0.09 0.00 0.03 0.00 0.00 46.19 44.89 1uhw s LEU 25 CO -0.21 -0.62 0.22 0.54 0.23 0.00 0.00 176.35 176.50 1uhw s ASN 26 N -3.92 5.39 0.35 2.29 4.22 -1.26 -3.41 114.94 118.60 1uhw s ASN 26 Ca 0.36 -1.76 0.03 0.00 -2.14 0.00 0.00 52.86 49.35 1uhw s ASN 26 Cb 0.04 -1.89 -0.02 0.00 1.28 0.00 0.00 41.25 40.66 1uhw s ASN 26 CO 0.20 -0.53 0.52 -0.76 -2.04 0.00 0.00 177.10 174.49 1uhw s LEU 27 N 1.27 3.96 0.32 3.54 1.43 -1.01 -4.83 118.68 123.36 1uhw s LEU 27 Ca 0.05 0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.31 1uhw s LEU 27 Cb -0.23 -3.01 -0.06 0.00 0.03 0.00 0.00 46.19 42.92 1uhw s LEU 27 CO -0.01 -0.41 0.07 -0.70 0.23 0.00 0.00 176.35 175.52 1uhw s GLU 28 N -4.27 1.65 -0.30 1.70 2.12 -1.26 -0.13 118.70 118.20 1uhw s GLU 28 Ca 0.43 -1.92 -0.11 0.00 0.36 0.00 0.00 54.97 53.73 1uhw s GLU 28 Cb -0.10 -0.80 0.18 0.00 0.26 0.00 0.00 34.13 33.67 1uhw s GLU 28 CO 0.34 -0.21 0.94 0.21 -0.54 0.00 0.00 175.26 175.99 1uhw s LYS 29 N -3.90 0.30 0.00 4.30 2.20 -1.09 -4.97 119.74 116.58 1uhw s LYS 29 Ca 0.36 0.59 0.00 0.00 -0.36 0.00 0.00 55.97 56.56 1uhw s LYS 29 Cb 0.08 0.34 0.00 0.00 -1.51 0.00 0.00 37.83 36.74 1uhw s LYS 29 CO 0.15 -0.26 0.00 -3.47 -0.36 0.00 0.00 175.35 171.41 1uhw n ASP 30 N 5.33 0.00 -2.67 1.43 2.03 -1.26 -2.81 116.55 118.61 1uhw n ASP 30 Ca -0.06 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.21 1uhw n ASP 30 Cb 0.53 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.99 1uhw n ASP 30 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1uhw n LYS 31 N 0.00 0.25 -3.66 -0.67 5.02 -1.26 -5.13 118.16 112.71 1uhw n LYS 31 Ca 0.00 -0.81 -0.06 0.00 -2.02 0.00 0.00 58.31 55.41 1uhw n LYS 31 Cb 0.00 -0.14 -0.08 0.00 -0.02 0.00 0.00 35.03 34.80 1uhw n LYS 31 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1uhw s LYS 32 N 0.05 0.43 0.17 1.97 0.00 -1.12 -5.15 119.74 116.09 1uhw s LYS 32 Ca 0.14 1.15 -0.20 0.00 0.00 0.00 0.00 55.97 57.06 1uhw s LYS 32 Cb 0.21 0.46 -0.08 0.00 0.00 0.00 0.00 37.83 38.42 1uhw s LYS 32 CO -0.12 -0.22 0.68 0.08 0.00 0.00 0.00 175.35 175.77 1uhw s VAL 33 N 2.54 4.60 -0.31 1.79 1.01 -1.26 -2.66 120.40 126.11 1uhw s VAL 33 Ca -0.04 1.29 0.01 0.00 0.00 0.00 0.00 61.98 63.24 1uhw s VAL 33 Cb -0.11 -3.90 0.09 0.00 0.00 0.00 0.00 36.38 32.46 1uhw s VAL 33 CO -0.15 0.34 0.06 -0.36 0.00 0.00 0.00 175.10 174.99 1uhw s PHE 34 N -1.37 2.51 0.42 5.22 0.40 0.81 -5.00 117.98 120.98 1uhw s PHE 34 Ca 0.38 -2.18 -0.08 0.00 -0.60 0.00 0.00 56.93 54.46 1uhw s PHE 34 Cb -0.18 -2.12 -0.05 0.00 0.51 0.00 0.00 43.02 41.18 1uhw s PHE 34 CO 0.21 -0.89 0.75 -0.80 0.70 0.00 0.00 175.22 175.19 1uhw s ASN 35 N 1.34 6.41 -1.31 1.36 0.01 -1.26 -2.41 114.94 119.07 1uhw s ASN 35 Ca 0.08 0.99 -0.07 0.00 -0.71 0.00 0.00 52.86 53.16 1uhw s ASN 35 Cb -0.18 -2.27 -0.00 0.00 0.41 0.00 0.00 41.25 39.21 1uhw s ASN 35 CO -0.16 -0.44 0.57 1.41 -1.51 0.00 0.00 177.10 176.96 1uhw n HIS 36 N -1.64 -1.75 -4.40 2.20 8.25 -1.25 -2.00 115.22 114.63 1uhw n HIS 36 Ca 0.01 0.66 -0.20 0.00 -0.26 0.00 0.00 57.72 57.93 1uhw n HIS 36 Cb 0.54 -3.73 -0.10 0.00 1.12 0.00 0.00 29.99 27.83 1uhw n HIS 36 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1uhw n LEU 38 N -0.53 0.00 -3.70 0.00 4.77 0.50 -3.45 117.00 114.58 1uhw n LEU 38 Ca -0.06 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.80 1uhw n LEU 38 Cb 0.63 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.62 1uhw n LEU 38 CO 0.38 0.00 0.12 0.42 -1.33 0.00 0.00 177.39 176.98 1uhw s THR 39 N 1.96 -0.01 0.22 -5.08 -4.23 -1.26 -3.86 115.64 103.37 1uhw s THR 39 Ca 0.00 0.04 -0.16 0.00 -1.18 0.00 0.00 61.69 60.39 1uhw s THR 39 Cb 0.00 -0.65 0.24 0.00 1.34 0.00 0.00 72.50 73.42 1uhw s THR 39 CO 0.00 0.02 1.58 1.23 -0.54 0.00 0.00 174.62 176.91 1uhw h GLY 40 N 6.21 0.22 0.65 3.99 0.00 -1.19 1.47 103.07 114.42 1uhw h GLY 40 Ca -0.31 0.38 -0.09 0.00 0.00 0.00 0.00 47.33 47.31 1uhw h GLY 40 CO 0.24 -0.25 -0.31 0.23 0.00 0.00 0.00 176.54 176.46 1uhw h SER 41 N -0.06 0.37 -0.52 0.19 0.87 -1.63 -3.27 113.55 109.50 1uhw h SER 41 Ca 0.32 -0.67 0.10 0.00 -1.23 0.00 0.00 61.79 60.31 1uhw h SER 41 Cb 0.57 -0.11 -0.08 0.00 -0.44 0.00 0.00 62.40 62.35 1uhw h SER 41 CO -0.80 0.97 0.05 1.23 -0.53 0.00 0.00 176.83 177.75 1uhw h GLY 42 N -0.21 0.59 -0.19 5.77 0.00 -1.45 0.28 103.07 107.85 1uhw h GLY 42 Ca -0.02 0.02 0.26 0.00 0.00 0.00 0.00 47.33 47.59 1uhw h GLY 42 CO 0.06 -0.12 0.60 -2.08 0.00 0.00 0.00 176.54 175.01 1uhw h VAL 43 N 0.17 0.51 0.00 4.60 2.07 0.19 1.23 116.25 125.02 1uhw h VAL 43 Ca 0.26 -0.19 -0.18 0.00 0.82 0.00 0.00 66.70 67.42 1uhw h VAL 43 Cb 0.39 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.06 1uhw h VAL 43 CO -0.39 0.10 -0.86 0.40 0.02 0.00 0.00 177.57 176.83 1uhw h ILE 44 N 0.54 1.55 -0.87 4.57 2.04 -0.82 -3.08 117.51 121.43 1uhw h ILE 44 Ca 0.65 -3.03 0.01 0.00 1.00 0.00 0.00 64.86 63.49 1uhw h ILE 44 Cb 1.30 2.67 -0.04 0.00 -0.74 0.00 0.00 36.82 40.00 1uhw h ILE 44 CO -0.47 0.85 0.58 -0.78 0.00 0.00 0.00 178.15 178.32 1uhw h ASP 45 N 0.00 1.00 -0.05 1.72 1.82 0.47 0.30 116.42 121.67 1uhw h ASP 45 Ca -0.01 -0.03 -0.09 0.00 -0.39 0.00 0.00 57.03 56.52 1uhw h ASP 45 Cb 1.60 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 41.35 1uhw h ASP 45 CO 0.11 0.72 -0.23 -0.25 -1.61 0.00 0.00 179.24 177.99 1uhw h TRP 46 N 1.18 0.51 0.42 0.28 7.01 -0.90 1.40 115.95 125.85 1uhw h TRP 46 Ca 0.32 -0.10 -0.02 0.00 2.11 0.00 0.00 58.89 61.20 1uhw h TRP 46 Cb -0.13 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 26.80 1uhw h TRP 46 CO -0.01 0.65 -0.20 -0.07 -2.79 0.00 0.00 178.44 176.02 1uhw h LEU 47 N 0.41 -0.48 -0.50 0.65 3.38 -0.99 -1.52 115.31 116.25 1uhw h LEU 47 Ca 0.06 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1uhw h LEU 47 Cb 0.62 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1uhw h LEU 47 CO 0.04 -0.16 -0.03 0.58 0.09 0.00 0.00 178.44 178.96 1uhw h VAL 48 N -0.82 1.27 -0.57 1.22 2.07 -0.35 1.56 116.25 120.62 1uhw h VAL 48 Ca -0.06 -1.14 0.12 0.00 0.82 0.00 0.00 66.70 66.44 1uhw h VAL 48 Cb 0.55 0.99 -0.11 0.00 -1.52 0.00 0.00 31.29 31.20 1uhw h VAL 48 CO 0.10 0.40 -0.12 0.28 0.02 0.00 0.00 177.57 178.24 1uhw h SER 49 N 0.78 -0.49 1.66 0.57 0.02 0.20 0.41 113.55 116.69 1uhw h SER 49 Ca 0.14 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 1uhw h SER 49 Cb 0.57 0.34 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1uhw h SER 49 CO 0.03 -0.18 -0.22 0.78 -1.14 0.00 0.00 176.83 176.10 1uhw h ASN 50 N 0.02 0.00 -2.19 3.07 2.35 -1.11 -3.48 115.58 114.24 1uhw h ASN 50 Ca 0.28 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1uhw h ASN 50 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1uhw h ASN 50 CO -0.57 0.01 0.00 0.29 -1.65 0.00 0.00 177.43 175.50 1uhw n LYS 51 N -2.83 0.00 0.16 0.81 4.76 0.15 -4.98 118.16 116.23 1uhw n LYS 51 Ca 0.03 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.58 1uhw n LYS 51 Cb 0.51 -1.75 0.08 0.00 -1.84 0.00 0.00 35.03 32.03 1uhw n LYS 51 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1uhw h LEU 52 N 0.00 0.00 0.00 -0.35 3.38 0.17 -3.47 115.31 115.04 1uhw h LEU 52 Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1uhw h LEU 52 Cb 0.87 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.58 1uhw h LEU 52 CO 0.00 0.04 -0.17 1.33 0.09 0.00 0.00 178.44 179.74 1uhw n VAL 53 N -2.90 0.00 -0.04 1.22 0.24 -1.26 -5.03 118.33 110.56 1uhw n VAL 53 Ca 0.02 -0.85 -0.07 0.00 -2.04 0.00 0.00 64.34 61.39 1uhw n VAL 53 Cb 0.56 0.36 -0.14 0.00 -1.47 0.00 0.00 33.84 33.15 1uhw n VAL 53 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1uhw n ARG 54 N -0.28 0.65 -3.97 7.34 5.12 -1.26 -4.91 116.66 119.35 1uhw n ARG 54 Ca -0.00 0.19 -0.10 0.00 -1.93 0.00 0.00 57.85 56.01 1uhw n ARG 54 Cb 0.22 -1.71 -0.03 0.00 -1.16 0.00 0.00 32.46 29.77 1uhw n ARG 54 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 1uhw s ASN 55 N -5.84 0.12 0.24 0.55 0.01 -1.26 -5.04 114.94 103.71 1uhw s ASN 55 Ca -0.06 -1.04 -0.07 0.00 -0.71 0.00 0.00 52.86 50.98 1uhw s ASN 55 Cb 0.08 0.67 0.22 0.00 0.41 0.00 0.00 41.25 42.63 1uhw s ASN 55 CO 0.83 -1.29 1.90 0.03 -1.51 0.00 0.00 177.10 177.06 1uhw h ARG 56 N 2.15 1.23 -0.09 -0.60 2.47 -1.94 -3.05 114.38 114.54 1uhw h ARG 56 Ca -0.27 -0.09 0.02 0.00 -1.26 0.00 0.00 59.98 58.38 1uhw h ARG 56 Cb 1.25 -0.27 -0.03 0.00 -1.65 0.00 0.00 29.97 29.26 1uhw h ARG 56 CO 0.35 0.83 -0.27 0.37 0.56 0.00 0.00 179.97 181.81 1uhw h GLN 57 N 1.26 -0.26 -0.93 0.04 -0.00 -1.99 -0.27 115.11 112.96 1uhw h GLN 57 Ca 0.34 0.02 0.22 0.00 -0.00 0.00 0.00 58.65 59.22 1uhw h GLN 57 Cb -0.11 0.06 -0.18 0.00 0.00 0.00 0.00 27.48 27.25 1uhw h GLN 57 CO -0.07 -0.17 -0.12 0.39 0.00 0.00 0.00 178.83 178.86 1uhw n GLU 58 N -4.00 -0.08 -0.24 1.69 1.02 -1.16 0.19 120.64 118.07 1uhw n GLU 58 Ca -0.03 1.42 -0.03 0.00 -0.02 0.00 0.00 57.16 58.51 1uhw n GLU 58 Cb 0.18 -2.19 0.08 0.00 -0.02 0.00 0.00 31.44 29.50 1uhw n GLU 58 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1uhw h GLY 59 N 0.00 0.98 -0.13 0.62 0.00 -1.13 -0.95 103.07 102.47 1uhw h GLY 59 Ca 0.50 -0.30 0.16 0.00 0.00 0.00 0.00 47.33 47.70 1uhw h GLY 59 CO -0.92 0.23 0.16 -2.00 0.00 0.00 0.00 176.54 174.01 1uhw h LEU 60 N 0.77 -0.04 0.31 3.11 7.12 0.37 1.60 115.31 128.56 1uhw h LEU 60 Ca 0.28 0.15 -0.01 0.00 0.13 0.00 0.00 57.88 58.43 1uhw h LEU 60 Cb 0.08 0.22 0.00 0.00 -0.53 0.00 0.00 40.66 40.43 1uhw h LEU 60 CO -0.13 -0.06 -0.15 0.24 -0.13 0.00 0.00 178.44 178.21 1uhw h MET 61 N 0.24 -0.39 -0.14 1.25 0.00 -0.85 -3.01 114.93 112.04 1uhw h MET 61 Ca 0.42 0.03 0.04 0.00 0.00 0.00 0.00 59.70 60.19 1uhw h MET 61 Cb 0.73 0.09 -0.05 0.00 0.00 0.00 0.00 31.60 32.37 1uhw h MET 61 CO -0.54 -0.07 -0.16 0.82 0.00 0.00 0.00 176.91 176.96 1uhw h ILE 62 N -0.78 0.56 -0.99 -1.22 1.08 -0.23 -1.54 117.51 114.38 1uhw h ILE 62 Ca -0.04 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.64 1uhw h ILE 62 Cb 0.51 0.56 -0.19 0.00 -3.07 0.00 0.00 36.82 34.63 1uhw h ILE 62 CO 0.07 0.00 -0.21 -1.20 -0.69 0.00 0.00 178.15 176.11 1uhw n SER 63 N -5.31 -0.33 -0.07 1.72 7.64 0.54 0.12 113.62 117.93 1uhw n SER 63 Ca -0.03 1.70 -0.07 0.00 1.01 0.00 0.00 58.87 61.48 1uhw n SER 63 Cb 0.23 -0.53 -0.01 0.00 -1.01 0.00 0.00 64.21 62.89 1uhw n SER 63 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uhw h ALA 64 N 1.98 -0.01 -0.98 -0.43 0.00 -1.14 0.22 119.26 118.90 1uhw h ALA 64 Ca 0.49 0.10 0.18 0.00 0.00 0.00 0.00 54.91 55.68 1uhw h ALA 64 Cb 0.79 0.45 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 1uhw h ALA 64 CO -1.01 -0.60 0.58 1.03 0.00 0.00 0.00 179.25 179.25 1uhw h SER 65 N -0.17 0.75 0.53 0.00 0.87 0.11 1.17 113.55 116.80 1uhw h SER 65 Ca 0.16 0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 60.78 1uhw h SER 65 Cb 0.41 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1uhw h SER 65 CO -0.40 0.28 -0.25 -0.07 -0.53 0.00 0.00 176.83 175.86 1uhw h LEU 66 N 0.75 -0.60 0.36 2.23 3.38 0.57 -2.36 115.31 119.65 1uhw h LEU 66 Ca 0.56 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.47 1uhw h LEU 66 Cb 0.84 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1uhw h LEU 66 CO -0.38 -0.29 -0.35 0.25 0.09 0.00 0.00 178.44 177.77 1uhw h LEU 67 N -0.91 -0.95 -0.04 1.67 5.85 0.42 -1.54 115.31 119.81 1uhw h LEU 67 Ca -0.07 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1uhw h LEU 67 Cb 0.61 0.32 -0.00 0.00 0.37 0.00 0.00 40.66 41.96 1uhw h LEU 67 CO 0.12 -0.50 -0.02 -0.24 -0.34 0.00 0.00 178.44 177.46 1uhw n SER 68 N -5.46 -0.04 -0.33 1.25 2.88 0.39 0.17 113.62 112.49 1uhw n SER 68 Ca -0.10 0.89 0.32 0.00 -1.33 0.00 0.00 58.87 58.66 1uhw n SER 68 Cb 0.36 -0.42 0.59 0.00 -0.75 0.00 0.00 64.21 63.99 1uhw n SER 68 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1uhw n GLU 69 N -2.97 -0.06 0.00 -1.46 -0.58 -0.89 -4.72 120.64 109.97 1uhw n GLU 69 Ca 0.00 1.35 0.00 0.00 -0.42 0.00 0.00 57.16 58.09 1uhw n GLU 69 Cb 0.01 -2.44 0.00 0.00 -0.57 0.00 0.00 31.44 28.44 1uhw n GLU 69 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1uhw n GLY 70 N -1.28 1.60 0.16 0.62 0.00 0.46 -4.99 105.19 101.76 1uhw n GLY 70 Ca 0.38 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.53 1uhw n GLY 70 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1uhw h TYR 71 N 0.00 0.00 -3.30 1.61 0.05 -1.35 -3.42 116.97 110.55 1uhw h TYR 71 Ca 0.00 0.00 -0.43 0.00 0.05 0.00 0.00 58.73 58.35 1uhw h TYR 71 Cb 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 36.73 37.37 1uhw h TYR 71 CO 0.00 0.00 -0.77 -0.51 -1.05 0.00 0.00 178.16 175.83 1uhw s LEU 72 N -4.95 0.78 -0.11 3.88 1.43 -1.25 -4.42 118.68 114.04 1uhw s LEU 72 Ca 0.05 -0.10 -0.10 0.00 -1.03 0.00 0.00 54.13 52.95 1uhw s LEU 72 Cb 0.09 -0.44 -0.05 0.00 0.03 0.00 0.00 46.19 45.82 1uhw s LEU 72 CO 0.48 -0.16 0.22 -1.10 0.23 0.00 0.00 176.35 176.01 1uhw s GLN 73 N 1.71 3.75 0.39 1.70 -1.52 0.37 -4.68 119.66 121.38 1uhw s GLN 73 Ca 0.01 0.00 -0.25 0.00 -1.95 0.00 0.00 55.36 53.18 1uhw s GLN 73 Cb -0.13 -3.26 -0.09 0.00 -0.22 0.00 0.00 33.01 29.31 1uhw s GLN 73 CO -0.04 0.62 1.06 -1.25 -0.25 0.00 0.00 175.29 175.43 1uhw s PRO 74 N -0.65 4.21 -0.20 2.91 0.04 -1.26 -0.29 135.00 139.76 1uhw s PRO 74 Ca 0.16 1.55 -0.04 0.00 0.04 0.00 0.00 61.00 62.71 1uhw s PRO 74 Cb -0.13 -2.62 0.10 0.00 0.04 0.00 0.00 34.50 31.90 1uhw s PRO 74 CO 0.05 -0.11 0.34 0.00 0.04 0.00 0.00 177.00 177.32 1uhw s ALA 75 N -1.60 -0.86 0.00 8.56 0.00 -1.11 -4.90 121.76 121.85 1uhw s ALA 75 Ca 0.56 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.48 1uhw s ALA 75 Cb -0.23 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.49 1uhw s ALA 75 CO 0.29 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.46 1uhw n GLY 76 N 5.36 1.92 1.00 0.00 0.00 -1.26 -4.27 105.19 107.94 1uhw n GLY 76 Ca -0.06 -0.79 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 1uhw n GLY 76 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1uhw n ASP 77 N 0.00 -0.51 0.00 1.61 8.00 -1.26 -4.95 116.55 119.44 1uhw n ASP 77 Ca 0.00 -1.31 0.00 0.00 0.71 0.00 0.00 54.79 54.19 1uhw n ASP 77 Cb 0.00 0.84 0.00 0.00 -0.02 0.00 0.00 41.12 41.94 1uhw n ASP 77 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1uhw n LEU 78 N 0.00 0.00 -0.27 0.64 4.32 -1.26 -3.81 117.00 116.62 1uhw n LEU 78 Ca -0.01 0.00 0.05 0.00 -0.02 0.00 0.00 56.01 56.03 1uhw n LEU 78 Cb 0.15 0.00 0.16 0.00 -1.62 0.00 0.00 43.42 42.11 1uhw n LEU 78 CO 0.06 0.00 0.79 0.77 -1.22 0.00 0.00 177.39 177.80 1uhw h SER 79 N 0.00 -0.45 0.77 -1.43 4.64 -1.90 1.26 113.55 116.44 1uhw h SER 79 Ca 0.00 0.21 -0.04 0.00 -0.47 0.00 0.00 61.79 61.49 1uhw h SER 79 Cb 0.00 0.39 0.01 0.00 -0.31 0.00 0.00 62.40 62.49 1uhw h SER 79 CO 0.00 -0.21 -0.37 0.50 -0.87 0.00 0.00 176.83 175.88 1uhw h LYS 80 N 0.07 -1.00 -1.07 4.77 3.64 -1.91 0.22 116.57 121.29 1uhw h LYS 80 Ca 0.42 0.07 0.29 0.00 -1.27 0.00 0.00 60.65 60.16 1uhw h LYS 80 Cb 0.74 0.23 -0.08 0.00 -0.41 0.00 0.00 32.23 32.71 1uhw h LYS 80 CO -0.72 -0.65 0.72 -0.91 -2.27 0.00 0.00 179.45 175.62 1uhw h ASN 81 N -1.22 0.28 0.47 4.20 2.35 -1.47 0.18 115.58 120.37 1uhw h ASN 81 Ca -0.11 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1uhw h ASN 81 Cb 0.81 0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.19 1uhw h ASN 81 CO 0.17 0.05 -0.23 0.00 -1.65 0.00 0.00 177.43 175.78 1uhw h ALA 82 N 1.55 -0.63 -0.56 -0.83 0.00 0.19 -2.92 119.26 116.07 1uhw h ALA 82 Ca 0.58 -0.16 0.16 0.00 0.00 0.00 0.00 54.91 55.48 1uhw h ALA 82 Cb 1.75 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 19.77 1uhw h ALA 82 CO -0.19 -0.61 0.64 0.00 0.00 0.00 0.00 179.25 179.09 1uhw h ALA 83 N -1.01 2.31 0.40 0.00 0.00 0.13 -0.36 119.26 120.73 1uhw h ALA 83 Ca -0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1uhw h ALA 83 Cb 0.53 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1uhw h ALA 83 CO 0.11 -0.93 -0.35 0.22 0.00 0.00 0.00 179.25 178.30 1uhw h ASP 84 N 0.00 -0.94 0.00 0.00 3.58 -0.53 -3.45 116.42 115.07 1uhw h ASP 84 Ca 0.27 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.79 1uhw h ASP 84 Cb 1.55 0.30 0.00 0.00 1.72 0.00 0.00 39.33 42.90 1uhw h ASP 84 CO -0.00 -0.48 0.00 0.61 -2.88 0.00 0.00 179.24 176.49 1uhw n GLY 85 N -1.40 -0.03 0.00 -0.78 0.00 -0.19 -5.09 105.19 97.70 1uhw n GLY 85 Ca -0.09 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1uhw n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1uhw n ILE 86 N 0.00 0.00 -1.07 -0.61 2.08 -0.91 -5.03 119.36 113.82 1uhw n ILE 86 Ca 0.00 0.84 0.00 0.00 0.56 0.00 0.00 62.75 64.15 1uhw n ILE 86 Cb 0.00 -1.63 0.00 0.00 -0.75 0.00 0.00 39.64 37.26 1uhw n ILE 86 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1uhw n ALA 87 N -1.15 0.00 0.68 -1.39 0.00 -1.26 -5.01 120.51 112.38 1uhw n ALA 87 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 1uhw n ALA 87 Cb 0.00 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.68 1uhw n ALA 87 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1uhw n GLU 88 N 0.00 2.00 -3.74 0.00 2.13 -1.26 -4.68 120.64 115.09 1uhw n GLU 88 Ca 0.00 -1.55 -0.29 0.00 0.66 0.00 0.00 57.16 55.98 1uhw n GLU 88 Cb 0.00 -1.36 -0.16 0.00 0.27 0.00 0.00 31.44 30.19 1uhw n GLU 88 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 1uhw s ASN 89 N -1.12 3.34 0.19 4.31 -0.87 -1.26 -4.99 114.94 114.54 1uhw s ASN 89 Ca 0.31 -1.11 0.05 0.00 -1.57 0.00 0.00 52.86 50.54 1uhw s ASN 89 Cb 0.16 -0.70 0.09 0.00 -0.02 0.00 0.00 41.25 40.78 1uhw s ASN 89 CO 0.22 -0.34 1.45 1.55 -2.57 0.00 0.00 177.10 177.41 1uhw h PRO 90 N 8.19 0.14 -7.18 -0.60 0.13 -1.86 -3.45 132.00 127.38 1uhw h PRO 90 Ca -0.16 -0.14 -0.47 0.00 -0.87 0.00 0.00 66.00 64.36 1uhw h PRO 90 Cb 1.08 0.04 0.03 0.00 0.13 0.00 0.00 31.00 32.27 1uhw h PRO 90 CO 0.39 0.86 0.37 0.12 -0.23 0.00 0.00 178.00 179.51 1uhw s PHE 91 N -3.34 3.27 -0.16 1.56 5.36 -1.26 -4.10 117.98 119.32 1uhw s PHE 91 Ca -0.02 1.50 -0.02 0.00 -0.96 0.00 0.00 56.93 57.42 1uhw s PHE 91 Cb 0.11 -2.88 0.05 0.00 -0.34 0.00 0.00 43.02 39.96 1uhw s PHE 91 CO 0.81 -0.60 0.02 -0.51 -1.46 0.00 0.00 175.22 173.48 1uhw s LEU 92 N -4.08 1.04 -1.00 6.12 1.43 -1.26 -4.99 118.68 115.93 1uhw s LEU 92 Ca 0.61 -0.60 -0.17 0.00 -1.03 0.00 0.00 54.13 52.95 1uhw s LEU 92 Cb -0.12 -0.57 -0.09 0.00 0.03 0.00 0.00 46.19 45.43 1uhw s LEU 92 CO 0.31 -0.26 2.09 -0.67 0.23 0.00 0.00 176.35 178.04 1uhw n ASP 93 N 5.07 3.60 -4.07 2.29 2.03 -1.26 -4.32 116.55 119.88 1uhw n ASP 93 Ca -0.09 -2.65 -0.16 0.00 0.52 0.00 0.00 54.79 52.42 1uhw n ASP 93 Cb 0.48 -1.26 -0.12 0.00 -0.72 0.00 0.00 41.12 39.50 1uhw n ASP 93 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1uhw s SER 94 N 4.15 1.07 0.07 1.67 0.15 -1.26 -4.71 113.70 114.84 1uhw s SER 94 Ca 0.53 -0.45 0.23 0.00 0.70 0.00 0.00 55.95 56.95 1uhw s SER 94 Cb 0.14 -0.02 0.92 0.00 -1.71 0.00 0.00 66.02 65.34 1uhw s SER 94 CO 0.03 -0.09 1.71 -0.81 1.20 0.00 0.00 173.24 175.29 1uhw n PRO 95 N 1.82 0.06 0.00 5.44 -0.04 -1.26 -2.19 135.00 138.84 1uhw n PRO 95 Ca -0.20 0.18 -0.18 0.00 -0.04 0.00 0.00 63.50 63.27 1uhw n PRO 95 Cb 0.55 -1.60 -0.14 0.00 -0.04 0.00 0.00 33.50 32.28 1uhw n PRO 95 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1uhw h ASP 96 N 0.00 0.30 -3.99 3.54 3.32 -1.95 -3.45 116.42 114.18 1uhw h ASP 96 Ca 0.00 -0.96 -0.54 0.00 0.02 0.00 0.00 57.03 55.55 1uhw h ASP 96 Cb 0.42 -0.10 0.11 0.00 0.22 0.00 0.00 39.33 39.99 1uhw h ASP 96 CO 0.00 1.24 0.66 0.00 -1.72 0.00 0.00 179.24 179.42 1uhw s ALA 97 N -2.40 3.15 0.05 3.45 0.00 -1.17 -4.93 121.76 119.91 1uhw s ALA 97 Ca -0.15 1.38 0.04 0.00 0.00 0.00 0.00 51.96 53.22 1uhw s ALA 97 Cb -0.00 -3.56 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 1uhw s ALA 97 CO 0.78 -1.14 -0.11 -0.06 0.00 0.00 0.00 175.76 175.24 1uhw s PHE 98 N -1.25 0.93 0.11 0.00 0.08 -1.26 -1.37 117.98 115.22 1uhw s PHE 98 Ca 0.62 -0.46 -0.02 0.00 0.12 0.00 0.00 56.93 57.20 1uhw s PHE 98 Cb -0.41 -0.54 -0.04 0.00 -0.57 0.00 0.00 43.02 41.46 1uhw s PHE 98 CO 0.52 -0.01 0.05 0.71 -0.10 0.00 0.00 175.22 176.39 1uhw s TYR 99 N -1.26 0.72 -0.04 0.36 2.02 -1.25 -2.74 117.35 115.16 1uhw s TYR 99 Ca -0.06 -1.14 -0.25 0.00 -0.37 0.00 0.00 57.07 55.25 1uhw s TYR 99 Cb -0.10 -0.42 0.05 0.00 -0.40 0.00 0.00 41.96 41.10 1uhw s TYR 99 CO 0.01 -0.50 0.55 1.52 -1.57 0.00 0.00 175.55 175.57 1uhw s TYR 100 N -4.00 -0.50 0.36 2.71 1.13 0.60 0.19 117.35 117.84 1uhw s TYR 100 Ca 0.19 0.83 -0.27 0.00 -1.41 0.00 0.00 57.07 56.41 1uhw s TYR 100 Cb 0.07 0.30 -0.09 0.00 -1.10 0.00 0.00 41.96 41.15 1uhw s TYR 100 CO -0.02 -0.54 1.17 -0.06 -2.51 0.00 0.00 175.55 173.60 1uhw s PHE 101 N -1.25 3.18 -1.13 -3.49 0.08 -1.26 0.14 117.98 114.25 1uhw s PHE 101 Ca -0.12 1.57 -0.19 0.00 0.12 0.00 0.00 56.93 58.31 1uhw s PHE 101 Cb -0.02 -3.40 -0.05 0.00 -0.57 0.00 0.00 43.02 38.98 1uhw s PHE 101 CO 0.08 -1.21 2.02 -0.35 -0.10 0.00 0.00 175.22 175.66 1uhw n PRO 102 N 0.41 2.20 0.00 0.24 -0.04 -1.26 -2.67 135.00 133.88 1uhw n PRO 102 Ca 0.03 -2.35 0.00 0.00 -0.04 0.00 0.00 63.50 61.14 1uhw n PRO 102 Cb 0.46 -3.21 0.00 0.00 -0.04 0.00 0.00 33.50 30.71 1uhw n PRO 102 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1uhw n ASP 103 N 7.80 0.00 0.00 3.54 -0.08 -1.26 -5.04 116.55 121.51 1uhw n ASP 103 Ca 0.50 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.78 1uhw n ASP 103 Cb 0.41 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.87 1uhw n ASP 103 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1uhw n SER 104 N -0.72 0.00 -0.47 1.67 7.64 -1.09 -5.08 113.62 115.57 1uhw n SER 104 Ca 0.00 0.01 0.01 0.00 1.01 0.00 0.00 58.87 59.90 1uhw n SER 104 Cb 0.00 -0.12 -0.00 0.00 -1.01 0.00 0.00 64.21 63.08 1uhw n SER 104 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uhw n GLY 105 N 2.27 -0.46 3.55 0.23 0.00 -1.20 -4.13 105.19 105.45 1uhw n GLY 105 Ca 0.00 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 1uhw n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uhw s PRO 106 N -0.20 2.94 0.07 1.61 0.04 -0.85 -4.29 135.00 134.31 1uhw s PRO 106 Ca 0.00 0.05 -0.31 0.00 0.04 0.00 0.00 61.00 60.78 1uhw s PRO 106 Cb 0.00 -4.41 -0.08 0.00 0.04 0.00 0.00 34.50 30.05 1uhw s PRO 106 CO 0.00 -2.48 1.57 0.45 0.04 0.00 0.00 177.00 176.58 1uhw s SER 107 N 5.94 6.67 0.21 6.66 0.15 -1.26 -4.90 113.70 127.17 1uhw s SER 107 Ca 0.52 2.41 -0.31 0.00 0.70 0.00 0.00 55.95 59.26 1uhw s SER 107 Cb -0.09 -2.57 -0.11 0.00 -1.71 0.00 0.00 66.02 61.54 1uhw s SER 107 CO 0.15 -0.83 1.61 -0.94 1.20 0.00 0.00 173.24 174.42 1uhw s SER 108 N 2.10 6.49 0.00 5.45 1.04 -1.26 -4.98 113.70 122.54 1uhw s SER 108 Ca 0.71 2.76 0.00 0.00 0.48 0.00 0.00 55.95 59.90 1uhw s SER 108 Cb -0.38 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.13 1uhw s SER 108 CO 0.31 -0.87 0.00 0.61 0.98 0.00 0.00 173.24 174.26