#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhw s SER 2 N 0.00 6.85 0.01 1.61 0.15 -1.26 -5.02 113.70 116.03 1uhw s SER 2 Ca 0.00 1.00 -0.04 0.00 0.70 0.00 0.00 55.95 57.61 1uhw s SER 2 Cb 0.00 -2.46 -0.01 0.00 -1.71 0.00 0.00 66.02 61.84 1uhw s SER 2 CO 0.00 -0.62 0.06 -0.44 1.20 0.00 0.00 173.24 173.44 1uhw s SER 3 N 1.44 0.10 0.00 5.45 0.01 -1.26 -5.01 113.70 114.43 1uhw s SER 3 Ca 0.37 -0.29 0.00 0.00 1.31 0.00 0.00 55.95 57.34 1uhw s SER 3 Cb -0.14 0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.24 1uhw s SER 3 CO 0.10 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.05 1uhw n GLY 4 N 1.69 -0.79 3.36 3.44 0.00 -1.26 -5.03 105.19 106.61 1uhw n GLY 4 Ca -0.22 0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1uhw n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uhw s SER 5 N -4.00 4.42 0.85 1.61 0.01 -1.26 -5.05 113.70 110.28 1uhw s SER 5 Ca 0.00 -0.32 -0.17 0.00 1.31 0.00 0.00 55.95 56.77 1uhw s SER 5 Cb 0.00 -1.75 -0.12 0.00 0.21 0.00 0.00 66.02 64.37 1uhw s SER 5 CO 0.00 0.04 -0.38 -1.20 0.41 0.00 0.00 173.24 172.11 1uhw n SER 6 N 4.41 -4.55 0.00 2.44 7.64 -1.26 -2.16 113.62 120.14 1uhw n SER 6 Ca -0.18 0.35 0.00 0.00 1.01 0.00 0.00 58.87 60.05 1uhw n SER 6 Cb 0.51 -0.88 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 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 2.85 1.58 0.46 0.23 0.00 -1.26 -4.53 105.19 104.52 1uhw n GLY 7 Ca 0.03 -0.05 -0.17 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.15 0.00 0.99 3.38 -1.86 -1.49 115.31 115.18 1uhw h LEU 8 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1uhw h LEU 8 Cb 0.00 0.35 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1uhw h LEU 8 CO 0.00 -0.65 0.00 0.61 0.09 0.00 0.00 178.44 178.49 1uhw n GLY 9 N -1.54 -2.15 0.31 0.83 0.00 -1.12 0.25 105.19 101.77 1uhw n GLY 9 Ca -0.12 0.42 0.14 0.00 0.00 0.00 0.00 46.02 46.46 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 -0.82 1.40 0.43 4.61 0.00 -1.88 0.45 119.26 123.43 1uhw h ALA 10 Ca 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1uhw h ALA 10 Cb 0.00 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1uhw h ALA 10 CO 0.00 -0.45 -0.21 1.25 0.00 0.00 0.00 179.25 179.85 1uhw h LEU 11 N 0.27 -0.49 -0.63 0.00 7.12 0.30 -2.48 115.31 119.40 1uhw h LEU 11 Ca 0.58 -0.00 0.11 0.00 0.13 0.00 0.00 57.88 58.69 1uhw h LEU 11 Cb 1.17 0.13 -0.08 0.00 -0.53 0.00 0.00 40.66 41.34 1uhw h LEU 11 CO -0.62 -0.32 0.22 0.22 -0.13 0.00 0.00 178.44 177.81 1uhw h TYR 12 N -0.61 0.37 -0.88 1.25 3.20 0.66 0.45 116.97 121.41 1uhw h TYR 12 Ca -0.06 0.03 0.18 0.00 3.14 0.00 0.00 58.73 62.03 1uhw h TYR 12 Cb 0.46 -0.07 -0.11 0.00 1.54 0.00 0.00 36.73 38.55 1uhw h TYR 12 CO -0.04 0.06 0.43 -0.07 -1.64 0.00 0.00 178.16 176.90 1uhw h LEU 13 N 0.38 0.45 0.66 2.82 3.38 -0.04 -1.21 115.31 121.77 1uhw h LEU 13 Ca 0.33 0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.39 1uhw h LEU 13 Cb 0.44 0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.26 1uhw h LEU 13 CO -0.35 0.12 -0.32 -1.28 0.09 0.00 0.00 178.44 176.71 1uhw h SER 14 N 0.53 -0.76 -0.88 -0.43 0.87 -0.48 -2.78 113.55 109.61 1uhw h SER 14 Ca 0.52 -0.00 0.35 0.00 -1.23 0.00 0.00 61.79 61.42 1uhw h SER 14 Cb 0.86 0.20 -0.16 0.00 -0.44 0.00 0.00 62.40 62.86 1uhw h SER 14 CO -0.44 -0.47 0.41 0.23 -0.53 0.00 0.00 176.83 176.03 1uhw n MET 15 N -5.43 -0.06 -0.10 2.24 2.81 -0.50 0.20 117.12 116.28 1uhw n MET 15 Ca -0.13 1.23 -0.06 0.00 -1.81 0.00 0.00 57.70 56.93 1uhw n MET 15 Cb 0.37 -2.16 0.01 0.00 -0.71 0.00 0.00 33.22 30.73 1uhw n MET 15 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1uhw h LYS 16 N 0.00 -0.01 -6.17 0.03 1.57 -1.15 0.14 116.57 110.99 1uhw h LYS 16 Ca 0.72 0.00 -0.70 0.00 -1.87 0.00 0.00 60.65 58.79 1uhw h LYS 16 Cb 1.85 0.00 0.01 0.00 0.08 0.00 0.00 32.23 34.18 1uhw h LYS 16 CO -0.70 -0.01 0.99 -3.47 -0.57 0.00 0.00 179.45 175.70 1uhw n ASP 17 N -5.29 2.64 0.00 0.86 -0.08 0.54 -4.71 116.55 110.51 1uhw n ASP 17 Ca 0.01 1.00 0.11 0.00 -1.51 0.00 0.00 54.79 54.41 1uhw n ASP 17 Cb 0.20 -1.20 0.57 0.00 2.34 0.00 0.00 41.12 43.03 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 5.94 0.32 -0.01 -0.67 -0.04 -1.25 0.68 135.00 139.96 1uhw n PRO 18 Ca 0.27 0.07 -0.04 0.00 -0.04 0.00 0.00 63.50 63.75 1uhw n PRO 18 Cb 0.18 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.12 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 -1.29 0.12 -0.34 0.54 1.02 -1.26 -4.62 120.64 114.80 1uhw n GLU 19 Ca 0.11 0.05 0.07 0.00 -0.02 0.00 0.00 57.16 57.36 1uhw n GLU 19 Cb 0.18 -0.70 0.23 0.00 -0.02 0.00 0.00 31.44 31.14 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 -3.42 2.53 0.00 3.49 5.02 -1.25 -4.90 118.16 119.63 1uhw n LYS 20 Ca -0.08 -1.85 0.00 0.00 -2.02 0.00 0.00 58.31 54.36 1uhw n LYS 20 Cb 0.40 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1uhw n LYS 20 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1uhw n GLY 21 N 1.04 5.27 3.79 0.72 0.00 0.21 -4.65 105.19 111.58 1uhw n GLY 21 Ca 0.17 -1.27 -0.31 0.00 0.00 0.00 0.00 46.02 44.60 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 -0.06 3.66 0.54 -0.61 1.01 0.48 -4.71 121.20 121.51 1uhw s ILE 22 Ca 0.00 0.57 -0.06 0.00 0.00 0.00 0.00 60.65 61.16 1uhw s ILE 22 Cb 0.00 -3.17 0.12 0.00 0.01 0.00 0.00 42.46 39.42 1uhw s ILE 22 CO 0.00 -0.67 0.74 0.29 0.00 0.00 0.00 174.94 175.30 1uhw n LYS 23 N -3.16 -0.44 -3.37 2.79 4.76 -1.26 -3.89 118.16 113.59 1uhw n LYS 23 Ca 0.08 -1.41 -0.13 0.00 -2.87 0.00 0.00 58.31 53.98 1uhw n LYS 23 Cb 0.53 -0.68 -0.08 0.00 -1.84 0.00 0.00 35.03 32.96 1uhw n LYS 23 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1uhw s GLU 24 N -4.52 0.34 0.35 1.97 2.02 -1.26 -4.88 118.70 112.72 1uhw s GLU 24 Ca 0.44 0.17 0.08 0.00 0.02 0.00 0.00 54.97 55.68 1uhw s GLU 24 Cb -0.02 -0.57 -0.05 0.00 0.10 0.00 0.00 34.13 33.60 1uhw s GLU 24 CO 0.30 -0.88 0.10 -0.51 0.02 0.00 0.00 175.26 174.30 1uhw s LEU 25 N 2.46 3.15 -0.82 1.80 2.01 -1.25 -4.78 118.68 121.24 1uhw s LEU 25 Ca 0.10 -0.89 -0.16 0.00 0.01 0.00 0.00 54.13 53.19 1uhw s LEU 25 Cb -0.14 -1.57 0.18 0.00 0.01 0.00 0.00 46.19 44.67 1uhw s LEU 25 CO -0.25 -0.31 0.86 0.54 1.01 0.00 0.00 176.35 178.21 1uhw s ASN 26 N -3.81 6.64 -0.56 2.29 2.20 -1.26 -3.49 114.94 116.95 1uhw s ASN 26 Ca 0.37 -2.33 -0.28 0.00 -0.94 0.00 0.00 52.86 49.68 1uhw s ASN 26 Cb -0.01 -2.28 0.03 0.00 -2.00 0.00 0.00 41.25 36.99 1uhw s ASN 26 CO 0.21 -0.79 1.21 -0.76 -2.94 0.00 0.00 177.10 174.03 1uhw s LEU 27 N 1.25 3.47 -0.32 3.54 1.43 -1.20 -4.85 118.68 122.00 1uhw s LEU 27 Ca 0.21 0.18 -0.01 0.00 -1.03 0.00 0.00 54.13 53.48 1uhw s LEU 27 Cb -0.11 -3.21 0.07 0.00 0.03 0.00 0.00 46.19 42.97 1uhw s LEU 27 CO -0.07 -1.47 0.03 -0.70 0.23 0.00 0.00 176.35 174.36 1uhw s GLU 28 N 4.95 2.20 -0.23 1.70 2.12 -1.26 -0.62 118.70 127.56 1uhw s GLU 28 Ca 0.45 -1.46 -0.15 0.00 0.36 0.00 0.00 54.97 54.16 1uhw s GLU 28 Cb -0.08 -3.22 0.07 0.00 0.26 0.00 0.00 34.13 31.16 1uhw s GLU 28 CO 0.26 -0.74 0.58 0.21 -0.54 0.00 0.00 175.26 175.04 1uhw s LYS 29 N 1.16 0.61 0.00 4.30 2.20 -0.67 -4.90 119.74 122.44 1uhw s LYS 29 Ca -0.01 1.01 0.00 0.00 -0.36 0.00 0.00 55.97 56.61 1uhw s LYS 29 Cb -0.20 0.13 0.00 0.00 -1.51 0.00 0.00 37.83 36.25 1uhw s LYS 29 CO -0.03 -0.14 0.00 -3.47 -0.36 0.00 0.00 175.35 171.35 1uhw n ASP 30 N 3.96 -0.98 -2.98 1.43 -0.08 -1.26 -4.00 116.55 112.64 1uhw n ASP 30 Ca -0.20 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 52.95 1uhw n ASP 30 Cb 0.57 -0.43 0.06 0.00 2.34 0.00 0.00 41.12 43.67 1uhw n ASP 30 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1uhw n LYS 31 N -1.13 -2.30 -3.32 -0.67 5.02 -1.26 -5.03 118.16 109.47 1uhw n LYS 31 Ca 0.00 0.73 0.03 0.00 -2.02 0.00 0.00 58.31 57.05 1uhw n LYS 31 Cb 0.40 -5.18 -0.04 0.00 -0.02 0.00 0.00 35.03 30.18 1uhw n LYS 31 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1uhw s LYS 32 N -4.28 0.10 -0.30 1.97 1.02 -1.26 -5.14 119.74 111.86 1uhw s LYS 32 Ca 0.35 0.24 -0.05 0.00 0.02 0.00 0.00 55.97 56.53 1uhw s LYS 32 Cb -0.05 0.12 0.03 0.00 -0.52 0.00 0.00 37.83 37.42 1uhw s LYS 32 CO 0.62 -0.03 0.05 0.54 -0.92 0.00 0.00 175.35 175.61 1uhw s VAL 33 N 1.93 3.55 -0.58 3.17 0.11 -1.26 -1.68 120.40 125.65 1uhw s VAL 33 Ca -0.02 -1.00 -0.21 0.00 -2.93 0.00 0.00 61.98 57.83 1uhw s VAL 33 Cb -0.02 -2.91 0.07 0.00 -1.53 0.00 0.00 36.38 31.99 1uhw s VAL 33 CO -0.15 -0.01 0.78 -0.36 -3.33 0.00 0.00 175.10 172.03 1uhw s PHE 34 N 1.40 2.90 -0.01 1.54 0.08 0.21 -4.82 117.98 119.28 1uhw s PHE 34 Ca -0.00 -0.62 -0.30 0.00 0.12 0.00 0.00 56.93 56.12 1uhw s PHE 34 Cb -0.18 -3.97 -0.04 0.00 -0.57 0.00 0.00 43.02 38.26 1uhw s PHE 34 CO 0.01 -1.33 1.20 -0.80 -0.10 0.00 0.00 175.22 174.20 1uhw s ASN 35 N 3.30 7.07 -0.26 1.36 -0.87 -1.26 -2.92 114.94 121.36 1uhw s ASN 35 Ca 0.18 1.89 -0.01 0.00 -1.57 0.00 0.00 52.86 53.34 1uhw s ASN 35 Cb -0.19 -2.57 0.00 0.00 -0.02 0.00 0.00 41.25 38.47 1uhw s ASN 35 CO 0.10 -0.54 0.16 1.41 -2.57 0.00 0.00 177.10 175.67 1uhw n HIS 36 N 4.73 -0.43 -3.22 2.20 8.25 -1.23 -2.54 115.22 122.98 1uhw n HIS 36 Ca 0.10 0.14 -0.19 0.00 -0.26 0.00 0.00 57.72 57.51 1uhw n HIS 36 Cb 0.46 -1.67 0.01 0.00 1.12 0.00 0.00 29.99 29.91 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 -1.84 0.00 -3.65 0.00 4.77 0.53 -3.91 117.00 112.89 1uhw n LEU 38 Ca 0.08 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.92 1uhw n LEU 38 Cb 0.61 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.62 1uhw n LEU 38 CO 0.40 0.00 0.35 0.42 -1.33 0.00 0.00 177.39 177.23 1uhw s THR 39 N 0.21 -0.00 0.55 -5.08 -4.23 -1.26 -3.04 115.64 102.79 1uhw s THR 39 Ca 0.00 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 60.80 1uhw s THR 39 Cb 0.00 -0.91 0.43 0.00 1.34 0.00 0.00 72.50 73.35 1uhw s THR 39 CO 0.00 0.00 1.93 1.23 -0.54 0.00 0.00 174.62 177.25 1uhw h GLY 40 N 5.22 0.00 0.76 3.99 0.00 -1.34 1.66 103.07 113.34 1uhw h GLY 40 Ca -0.29 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 46.83 1uhw h GLY 40 CO 0.10 0.00 -0.97 0.23 0.00 0.00 0.00 176.54 175.89 1uhw h SER 41 N 0.00 0.52 0.03 0.19 0.87 -1.65 -3.22 113.55 110.29 1uhw h SER 41 Ca 0.31 -0.94 -0.00 0.00 -1.23 0.00 0.00 61.79 59.93 1uhw h SER 41 Cb 1.31 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1uhw h SER 41 CO -0.00 1.46 -0.01 1.23 -0.53 0.00 0.00 176.83 178.98 1uhw h GLY 42 N -0.25 -0.04 -0.67 5.77 0.00 -1.22 -2.43 103.07 104.22 1uhw h GLY 42 Ca -0.18 0.01 0.12 0.00 0.00 0.00 0.00 47.33 47.28 1uhw h GLY 42 CO 0.16 -0.01 -0.40 -0.39 0.00 0.00 0.00 176.54 175.90 1uhw h VAL 43 N -0.61 0.08 -0.55 4.60 -1.51 0.22 0.62 116.25 119.10 1uhw h VAL 43 Ca -0.00 0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.51 1uhw h VAL 43 Cb 0.56 0.08 -0.05 0.00 -2.13 0.00 0.00 31.29 29.75 1uhw h VAL 43 CO 0.01 0.00 0.29 0.40 -1.23 0.00 0.00 177.57 177.04 1uhw h ILE 44 N -0.12 0.97 -0.97 7.19 2.04 -1.61 -0.47 117.51 124.55 1uhw h ILE 44 Ca 0.25 -0.19 0.26 0.00 1.00 0.00 0.00 64.86 66.18 1uhw h ILE 44 Cb 0.56 0.37 -0.13 0.00 -0.74 0.00 0.00 36.82 36.87 1uhw h ILE 44 CO -0.80 0.10 0.52 -0.78 0.00 0.00 0.00 178.15 177.18 1uhw h ASP 45 N 0.56 0.51 0.01 1.72 3.58 0.67 1.72 116.42 125.18 1uhw h ASP 45 Ca 0.24 0.16 -0.15 0.00 0.42 0.00 0.00 57.03 57.70 1uhw h ASP 45 Cb 0.13 0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 1uhw h ASP 45 CO -0.15 -0.00 -0.48 -0.25 -2.88 0.00 0.00 179.24 175.47 1uhw h TRP 46 N 0.44 0.66 -0.01 0.28 7.01 0.52 0.88 115.95 125.74 1uhw h TRP 46 Ca 0.64 -0.21 -0.00 0.00 2.11 0.00 0.00 58.89 61.43 1uhw h TRP 46 Cb 1.30 -0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 28.23 1uhw h TRP 46 CO -0.05 0.92 0.01 -0.07 -2.79 0.00 0.00 178.44 176.45 1uhw h LEU 47 N 0.43 0.02 -0.11 0.65 3.38 0.33 -1.52 115.31 118.48 1uhw h LEU 47 Ca 0.02 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 1uhw h LEU 47 Cb 1.00 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1uhw h LEU 47 CO 0.09 0.10 -0.20 0.58 0.09 0.00 0.00 178.44 179.10 1uhw h VAL 48 N -0.07 1.38 -0.85 1.22 2.07 0.17 1.18 116.25 121.35 1uhw h VAL 48 Ca 0.00 -1.46 0.17 0.00 0.82 0.00 0.00 66.70 66.24 1uhw h VAL 48 Cb 0.09 2.06 -0.16 0.00 -1.52 0.00 0.00 31.29 31.76 1uhw h VAL 48 CO -0.00 0.42 -0.18 0.28 0.02 0.00 0.00 177.57 178.11 1uhw h SER 49 N -0.08 -0.74 1.45 0.57 0.02 0.91 1.43 113.55 117.11 1uhw h SER 49 Ca 0.01 0.25 -0.08 0.00 -0.84 0.00 0.00 61.79 61.13 1uhw h SER 49 Cb 0.78 0.51 -0.01 0.00 0.14 0.00 0.00 62.40 63.82 1uhw h SER 49 CO 0.05 -0.28 -0.39 0.78 -1.14 0.00 0.00 176.83 175.85 1uhw h ASN 50 N 0.01 0.00 -0.96 3.07 2.35 -1.26 -3.48 115.58 115.31 1uhw h ASN 50 Ca 0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.17 1uhw h ASN 50 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.03 1uhw h ASN 50 CO -0.86 0.39 0.00 0.29 -1.65 0.00 0.00 177.43 175.61 1uhw n LYS 51 N -3.24 0.00 0.07 0.81 4.76 0.49 -4.98 118.16 116.07 1uhw n LYS 51 Ca 0.02 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.38 1uhw n LYS 51 Cb 0.66 -1.72 0.06 0.00 -1.84 0.00 0.00 35.03 32.19 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 0.34 0.00 -0.35 3.38 0.11 -3.46 115.31 115.33 1uhw h LEU 52 Ca 0.00 -0.22 -0.17 0.00 0.09 0.00 0.00 57.88 57.58 1uhw h LEU 52 Cb 0.69 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1uhw h LEU 52 CO 0.00 0.94 -0.12 1.33 0.09 0.00 0.00 178.44 180.68 1uhw n VAL 53 N -3.81 0.00 -0.07 1.22 0.24 -1.25 -5.05 118.33 109.61 1uhw n VAL 53 Ca -0.03 -0.62 -0.03 0.00 -2.04 0.00 0.00 64.34 61.61 1uhw n VAL 53 Cb 0.69 0.02 -0.16 0.00 -1.47 0.00 0.00 33.84 32.93 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 -0.44 0.77 -4.07 7.34 5.12 -1.26 -4.92 116.66 119.20 1uhw n ARG 54 Ca -0.05 -0.07 -0.12 0.00 -1.93 0.00 0.00 57.85 55.69 1uhw n ARG 54 Cb 0.17 -1.50 -0.06 0.00 -1.16 0.00 0.00 32.46 29.91 1uhw n ARG 54 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1uhw s ASN 55 N -5.05 0.30 0.16 0.55 2.20 -1.26 -5.05 114.94 106.78 1uhw s ASN 55 Ca -0.09 -1.22 -0.13 0.00 -0.94 0.00 0.00 52.86 50.49 1uhw s ASN 55 Cb 0.08 0.57 0.05 0.00 -2.00 0.00 0.00 41.25 39.94 1uhw s ASN 55 CO 0.82 -1.13 1.68 -0.09 -2.94 0.00 0.00 177.10 175.44 1uhw h ARG 56 N 2.29 0.84 0.07 3.55 9.65 -1.97 -3.05 114.38 125.75 1uhw h ARG 56 Ca -0.29 -0.19 0.01 0.00 -1.10 0.00 0.00 59.98 58.41 1uhw h ARG 56 Cb 1.25 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 29.68 1uhw h ARG 56 CO 0.40 0.78 -0.28 0.37 2.80 0.00 0.00 179.97 184.04 1uhw h GLN 57 N 0.74 -0.38 -0.93 0.20 4.15 -2.00 -1.33 115.11 115.56 1uhw h GLN 57 Ca 0.17 0.03 0.19 0.00 0.77 0.00 0.00 58.65 59.80 1uhw h GLN 57 Cb 0.29 0.09 -0.18 0.00 0.21 0.00 0.00 27.48 27.89 1uhw h GLN 57 CO -0.00 -0.25 -0.24 -1.91 -1.93 0.00 0.00 178.83 174.49 1uhw n GLU 58 N -4.02 -0.09 -0.27 1.69 2.13 -1.21 0.19 120.64 119.06 1uhw n GLU 58 Ca -0.04 1.46 0.03 0.00 0.66 0.00 0.00 57.16 59.26 1uhw n GLU 58 Cb 0.22 -2.18 0.17 0.00 0.27 0.00 0.00 31.44 29.92 1uhw n GLU 58 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1uhw h GLY 59 N 0.00 1.21 0.34 8.31 0.00 -1.24 0.40 103.07 112.10 1uhw h GLY 59 Ca 0.44 -0.26 0.06 0.00 0.00 0.00 0.00 47.33 47.57 1uhw h GLY 59 CO -0.96 0.06 -0.13 -2.00 0.00 0.00 0.00 176.54 173.52 1uhw h LEU 60 N 0.68 -0.43 0.72 3.11 7.12 0.32 0.41 115.31 127.24 1uhw h LEU 60 Ca 0.39 0.10 -0.04 0.00 0.13 0.00 0.00 57.88 58.47 1uhw h LEU 60 Cb 0.43 0.24 0.01 0.00 -0.53 0.00 0.00 40.66 40.80 1uhw h LEU 60 CO -0.28 -0.16 -0.35 0.24 -0.13 0.00 0.00 178.44 177.76 1uhw h MET 61 N -0.09 -0.93 -0.63 1.25 0.00 -0.64 -2.79 114.93 111.09 1uhw h MET 61 Ca 0.14 0.06 0.13 0.00 0.00 0.00 0.00 59.70 60.03 1uhw h MET 61 Cb 0.30 0.21 -0.12 0.00 0.00 0.00 0.00 31.60 32.00 1uhw h MET 61 CO -0.32 -0.61 -0.14 0.82 0.00 0.00 0.00 176.91 176.66 1uhw h ILE 62 N -1.01 0.38 -0.75 -1.22 1.08 -0.65 0.41 117.51 115.75 1uhw h ILE 62 Ca -0.10 -0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.49 1uhw h ILE 62 Cb 0.75 0.37 -0.13 0.00 -3.07 0.00 0.00 36.82 34.74 1uhw h ILE 62 CO 0.16 0.00 -0.36 0.28 -0.69 0.00 0.00 178.15 177.54 1uhw h SER 63 N 0.01 -1.30 -0.85 1.72 0.02 -0.00 0.76 113.55 113.91 1uhw h SER 63 Ca 0.31 0.26 0.22 0.00 -0.84 0.00 0.00 61.79 61.74 1uhw h SER 63 Cb 0.47 0.66 -0.14 0.00 0.14 0.00 0.00 62.40 63.53 1uhw h SER 63 CO -0.64 -0.30 0.20 0.00 -1.14 0.00 0.00 176.83 174.95 1uhw h ALA 64 N 1.11 1.18 -0.64 3.77 0.00 -0.65 1.46 119.26 125.47 1uhw h ALA 64 Ca 0.27 0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.44 1uhw h ALA 64 Cb 0.57 0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 1uhw h ALA 64 CO -0.80 -0.45 0.43 1.03 0.00 0.00 0.00 179.25 179.46 1uhw h SER 65 N 0.20 0.66 0.40 0.00 0.87 0.72 0.59 113.55 116.99 1uhw h SER 65 Ca 0.52 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 61.05 1uhw h SER 65 Cb 1.02 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1uhw h SER 65 CO -0.65 0.46 -0.19 -0.07 -0.53 0.00 0.00 176.83 175.85 1uhw h LEU 66 N 0.77 -0.46 0.21 2.23 3.38 0.28 -2.38 115.31 119.34 1uhw h LEU 66 Ca 0.26 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.15 1uhw h LEU 66 Cb 0.07 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1uhw h LEU 66 CO -0.07 -0.02 -0.46 0.25 0.09 0.00 0.00 178.44 178.23 1uhw h LEU 67 N -1.05 -1.33 -0.46 1.67 5.85 -0.31 -1.15 115.31 118.54 1uhw h LEU 67 Ca -0.06 0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.84 1uhw h LEU 67 Cb 0.51 0.48 -0.06 0.00 0.37 0.00 0.00 40.66 41.97 1uhw h LEU 67 CO 0.09 -0.54 -0.30 -1.28 -0.34 0.00 0.00 178.44 176.07 1uhw h SER 68 N -0.75 -1.08 -1.24 1.25 0.87 0.07 1.00 113.55 113.67 1uhw h SER 68 Ca -0.00 0.16 0.45 0.00 -1.23 0.00 0.00 61.79 61.16 1uhw h SER 68 Cb 0.74 0.47 -0.15 0.00 -0.44 0.00 0.00 62.40 63.02 1uhw h SER 68 CO -0.21 -0.13 0.76 -0.33 -0.53 0.00 0.00 176.83 176.39 1uhw h GLU 69 N -0.04 0.03 0.00 2.24 4.39 -1.15 -3.43 114.58 116.62 1uhw h GLU 69 Ca 0.07 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1uhw h GLU 69 Cb 0.23 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1uhw h GLU 69 CO -0.45 0.02 0.00 0.41 -1.16 0.00 0.00 179.01 177.83 1uhw n GLY 70 N -1.43 1.87 0.07 -3.84 0.00 0.34 -5.01 105.19 97.19 1uhw n GLY 70 Ca 0.39 0.00 0.12 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 -3.27 1.61 0.05 -1.26 -3.43 116.97 110.67 1uhw h TYR 71 Ca 0.00 0.00 -0.40 0.00 0.05 0.00 0.00 58.73 58.38 1uhw h TYR 71 Cb 0.00 0.00 -0.39 0.00 1.01 0.00 0.00 36.73 37.35 1uhw h TYR 71 CO 0.00 0.00 -0.75 -0.51 -1.05 0.00 0.00 178.16 175.85 1uhw s LEU 72 N -4.28 0.29 0.06 3.88 1.43 -1.26 -4.43 118.68 114.38 1uhw s LEU 72 Ca 0.06 -0.05 -0.15 0.00 -1.03 0.00 0.00 54.13 52.97 1uhw s LEU 72 Cb 0.13 -0.23 -0.06 0.00 0.03 0.00 0.00 46.19 46.06 1uhw s LEU 72 CO 0.71 -0.25 0.47 -1.10 0.23 0.00 0.00 176.35 176.42 1uhw s GLN 73 N 2.11 3.96 0.41 1.70 -1.52 0.62 -4.64 119.66 122.30 1uhw s GLN 73 Ca 0.05 0.45 -0.24 0.00 -1.95 0.00 0.00 55.36 53.67 1uhw s GLN 73 Cb -0.13 -3.13 -0.09 0.00 -0.22 0.00 0.00 33.01 29.45 1uhw s GLN 73 CO -0.04 0.62 1.05 -1.25 -0.25 0.00 0.00 175.29 175.42 1uhw s PRO 74 N -1.41 4.12 -0.31 2.91 0.04 -1.26 -1.18 135.00 137.91 1uhw s PRO 74 Ca 0.29 1.51 -0.00 0.00 0.04 0.00 0.00 61.00 62.84 1uhw s PRO 74 Cb -0.16 -2.50 0.10 0.00 0.04 0.00 0.00 34.50 31.97 1uhw s PRO 74 CO 0.16 -0.18 0.09 0.00 0.04 0.00 0.00 177.00 177.12 1uhw s ALA 75 N -1.68 1.72 0.00 8.56 0.00 -0.84 -4.89 121.76 124.64 1uhw s ALA 75 Ca 0.59 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.76 1uhw s ALA 75 Cb -0.22 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.23 1uhw s ALA 75 CO 0.27 -1.67 0.00 0.41 0.00 0.00 0.00 175.76 174.78 1uhw n GLY 76 N 4.77 0.59 0.11 0.00 0.00 -1.26 -4.37 105.19 105.03 1uhw n GLY 76 Ca -0.01 -2.18 -0.14 0.00 0.00 0.00 0.00 46.02 43.69 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 0.27 1.04 0.40 1.61 9.92 -1.26 -3.85 116.55 124.69 1uhw n ASP 77 Ca 0.00 0.04 -0.16 0.00 -0.53 0.00 0.00 54.79 54.14 1uhw n ASP 77 Cb 0.00 0.16 -0.08 0.00 -0.64 0.00 0.00 41.12 40.56 1uhw n ASP 77 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1uhw h LEU 78 N 0.01 -0.87 -2.20 0.64 5.85 -2.00 0.45 115.31 117.19 1uhw h LEU 78 Ca -0.51 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1uhw h LEU 78 Cb 2.07 0.23 0.00 0.00 0.37 0.00 0.00 40.66 43.33 1uhw h LEU 78 CO 0.00 -0.60 0.22 0.77 -0.34 0.00 0.00 178.44 178.50 1uhw h SER 79 N -1.09 0.00 0.00 1.25 4.64 -1.83 -1.64 113.55 114.88 1uhw h SER 79 Ca -0.11 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1uhw h SER 79 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1uhw h SER 79 CO 0.17 0.00 -0.00 0.11 -0.87 0.00 0.00 176.83 176.24 1uhw h LYS 80 N 0.00 -0.00 -0.94 4.77 1.57 -1.46 -2.98 116.57 117.53 1uhw h LYS 80 Ca 0.00 0.00 0.20 0.00 -1.87 0.00 0.00 60.65 58.98 1uhw h LYS 80 Cb 0.44 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.57 1uhw h LYS 80 CO 0.00 -0.00 -0.19 -0.91 -0.57 0.00 0.00 179.45 177.78 1uhw h ASN 81 N -0.62 -0.80 -0.02 0.86 2.35 0.53 0.60 115.58 118.47 1uhw h ASN 81 Ca -0.00 0.28 0.04 0.00 -0.55 0.00 0.00 56.30 56.06 1uhw h ASN 81 Cb 0.00 0.56 -0.05 0.00 0.05 0.00 0.00 38.32 38.88 1uhw h ASN 81 CO 0.00 -0.31 -0.32 0.00 -1.65 0.00 0.00 177.43 175.14 1uhw h ALA 82 N 1.94 -0.46 -0.35 -0.83 0.00 -1.46 -0.99 119.26 117.11 1uhw h ALA 82 Ca 0.47 -0.01 -0.38 0.00 0.00 0.00 0.00 54.91 54.99 1uhw h ALA 82 Cb 0.76 0.58 -0.14 0.00 0.00 0.00 0.00 17.79 19.00 1uhw h ALA 82 CO -0.95 -0.83 0.14 0.00 0.00 0.00 0.00 179.25 177.61 1uhw n ALA 83 N -2.78 6.29 0.12 0.00 0.00 0.20 -3.62 120.51 120.71 1uhw n ALA 83 Ca -0.05 -2.51 0.00 0.00 0.00 0.00 0.00 53.44 50.88 1uhw n ALA 83 Cb 0.33 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1uhw n ALA 83 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1uhw n ASP 84 N 1.35 0.16 -1.07 0.00 2.03 -0.40 -4.90 116.55 113.71 1uhw n ASP 84 Ca 0.45 0.41 -0.01 0.00 0.52 0.00 0.00 54.79 56.16 1uhw n ASP 84 Cb 0.66 0.22 0.00 0.00 -0.72 0.00 0.00 41.12 41.29 1uhw n ASP 84 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1uhw n GLY 85 N 2.03 -0.48 0.19 0.27 0.00 -1.09 -5.04 105.19 101.07 1uhw n GLY 85 Ca 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 1uhw n GLY 85 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1uhw h ILE 86 N 0.59 0.00 0.00 -0.61 1.08 -1.62 -3.50 117.51 113.46 1uhw h ILE 86 Ca -0.07 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.15 1uhw h ILE 86 Cb 0.81 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.56 1uhw h ILE 86 CO -0.03 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.43 1uhw n ALA 87 N -2.42 0.00 0.63 1.87 0.00 -1.26 -5.02 120.51 114.30 1uhw n ALA 87 Ca -0.06 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.50 1uhw n ALA 87 Cb 0.18 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.66 1uhw n ALA 87 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1uhw n GLU 88 N 0.00 0.25 -3.63 0.00 -0.00 -1.26 -4.71 120.64 111.29 1uhw n GLU 88 Ca 0.00 -0.00 -0.39 0.00 -0.00 0.00 0.00 57.16 56.76 1uhw n GLU 88 Cb 0.00 -1.58 -0.10 0.00 -0.00 0.00 0.00 31.44 29.76 1uhw n GLU 88 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1uhw s ASN 89 N -3.80 5.56 0.48 -1.84 3.84 -1.26 -4.91 114.94 113.01 1uhw s ASN 89 Ca 0.04 -1.84 0.27 0.00 0.21 0.00 0.00 52.86 51.54 1uhw s ASN 89 Cb 0.15 -1.96 0.82 0.00 -0.55 0.00 0.00 41.25 39.71 1uhw s ASN 89 CO 0.80 -0.62 1.78 1.55 -2.79 0.00 0.00 177.10 177.82 1uhw h PRO 90 N 8.33 0.00 -6.32 0.43 0.13 -1.84 -3.44 132.00 129.29 1uhw h PRO 90 Ca -0.19 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.38 1uhw h PRO 90 Cb 1.07 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.16 1uhw h PRO 90 CO 0.79 0.05 -0.02 0.12 -0.23 0.00 0.00 178.00 178.71 1uhw s PHE 91 N -3.43 3.73 -0.27 1.56 5.36 -1.26 -3.92 117.98 119.75 1uhw s PHE 91 Ca 0.04 1.24 0.03 0.00 -0.96 0.00 0.00 56.93 57.28 1uhw s PHE 91 Cb 0.07 -2.49 0.06 0.00 -0.34 0.00 0.00 43.02 40.33 1uhw s PHE 91 CO 0.62 0.51 -0.09 -0.51 -1.46 0.00 0.00 175.22 174.28 1uhw s LEU 92 N -1.47 3.55 -0.65 6.12 1.43 -1.26 -4.98 118.68 121.43 1uhw s LEU 92 Ca 0.34 -1.47 -0.19 0.00 -1.03 0.00 0.00 54.13 51.78 1uhw s LEU 92 Cb -0.18 -1.55 -0.16 0.00 0.03 0.00 0.00 46.19 44.33 1uhw s LEU 92 CO 0.20 -0.21 1.87 -0.67 0.23 0.00 0.00 176.35 177.76 1uhw n ASP 93 N 4.42 2.60 -3.95 2.29 2.03 -1.26 -4.20 116.55 118.49 1uhw n ASP 93 Ca -0.12 -2.56 -0.10 0.00 0.52 0.00 0.00 54.79 52.53 1uhw n ASP 93 Cb 0.42 -0.99 -0.11 0.00 -0.72 0.00 0.00 41.12 39.72 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 4.99 0.17 0.00 1.67 0.15 -1.26 -4.65 113.70 114.77 1uhw s SER 94 Ca 0.53 -0.38 0.22 0.00 0.70 0.00 0.00 55.95 57.01 1uhw s SER 94 Cb 0.13 0.12 0.93 0.00 -1.71 0.00 0.00 66.02 65.49 1uhw s SER 94 CO 0.12 -0.29 1.70 -0.81 1.20 0.00 0.00 173.24 175.15 1uhw n PRO 95 N 1.70 0.00 -0.04 5.44 -0.04 -1.26 -2.18 135.00 138.63 1uhw n PRO 95 Ca -0.23 0.13 -0.15 0.00 -0.04 0.00 0.00 63.50 63.21 1uhw n PRO 95 Cb 0.56 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.40 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 0.11 -3.03 3.54 5.19 -1.95 -3.45 116.42 116.83 1uhw h ASP 96 Ca 0.00 -0.83 -0.53 0.00 -0.62 0.00 0.00 57.03 55.06 1uhw h ASP 96 Cb 0.37 -0.03 0.07 0.00 0.18 0.00 0.00 39.33 39.92 1uhw h ASP 96 CO 0.00 0.92 0.92 0.00 -3.12 0.00 0.00 179.24 177.96 1uhw s ALA 97 N -2.91 3.81 0.03 3.45 0.00 -1.18 -5.00 121.76 119.96 1uhw s ALA 97 Ca -0.17 1.52 0.08 0.00 0.00 0.00 0.00 51.96 53.39 1uhw s ALA 97 Cb -0.01 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.43 1uhw s ALA 97 CO 0.71 -0.91 -0.23 -0.06 0.00 0.00 0.00 175.76 175.28 1uhw s PHE 98 N 0.58 2.42 0.01 0.00 0.08 -1.26 -2.84 117.98 116.98 1uhw s PHE 98 Ca 0.68 -0.35 -0.01 0.00 0.12 0.00 0.00 56.93 57.37 1uhw s PHE 98 Cb -0.47 -1.44 -0.01 0.00 -0.57 0.00 0.00 43.02 40.52 1uhw s PHE 98 CO 0.39 0.15 0.00 0.71 -0.10 0.00 0.00 175.22 176.37 1uhw s TYR 99 N -0.81 0.19 -0.00 0.36 2.02 -1.17 -1.98 117.35 115.96 1uhw s TYR 99 Ca 0.12 -0.39 -0.03 0.00 -0.37 0.00 0.00 57.07 56.41 1uhw s TYR 99 Cb -0.10 -0.14 -0.00 0.00 -0.40 0.00 0.00 41.96 41.31 1uhw s TYR 99 CO 0.03 -0.18 0.05 1.52 -1.57 0.00 0.00 175.55 175.39 1uhw s TYR 100 N -1.24 0.06 0.42 2.71 1.13 -0.32 0.20 117.35 120.30 1uhw s TYR 100 Ca -0.14 -0.12 -0.26 0.00 -1.41 0.00 0.00 57.07 55.15 1uhw s TYR 100 Cb -0.08 -0.06 -0.08 0.00 -1.10 0.00 0.00 41.96 40.63 1uhw s TYR 100 CO -0.00 -0.14 1.31 -0.06 -2.51 0.00 0.00 175.55 174.15 1uhw s PHE 101 N -0.74 2.76 -1.20 -3.49 0.08 -1.26 -0.27 117.98 113.86 1uhw s PHE 101 Ca -0.08 1.40 -0.20 0.00 0.12 0.00 0.00 56.93 58.17 1uhw s PHE 101 Cb -0.05 -3.68 -0.03 0.00 -0.57 0.00 0.00 43.02 38.69 1uhw s PHE 101 CO 0.00 -2.17 1.91 -0.35 -0.10 0.00 0.00 175.22 174.51 1uhw n PRO 102 N 0.01 2.34 0.00 0.24 -0.04 -1.26 -2.64 135.00 133.65 1uhw n PRO 102 Ca 0.04 -2.67 0.00 0.00 -0.04 0.00 0.00 63.50 60.83 1uhw n PRO 102 Cb 0.44 -3.45 0.00 0.00 -0.04 0.00 0.00 33.50 30.45 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 9.90 0.00 0.00 3.54 2.03 -1.26 -5.05 116.55 125.71 1uhw n ASP 103 Ca 0.48 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.79 1uhw n ASP 103 Cb 0.44 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.84 1uhw n ASP 103 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1uhw n SER 104 N 0.00 0.00 -0.03 1.67 7.64 -1.08 -5.06 113.62 116.76 1uhw n SER 104 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1uhw n SER 104 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 2.64 0.56 3.81 0.23 0.00 -1.22 -4.69 105.19 106.54 1uhw n GLY 105 Ca 0.00 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 44.89 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 0.00 2.58 0.00 1.61 0.04 -1.05 -4.28 135.00 133.89 1uhw s PRO 106 Ca 0.00 0.82 0.00 0.00 0.04 0.00 0.00 61.00 61.86 1uhw s PRO 106 Cb 0.00 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1uhw s PRO 106 CO 0.00 -1.31 0.00 0.45 0.04 0.00 0.00 177.00 176.18 1uhw n SER 107 N -3.25 -0.57 0.01 6.66 2.88 -1.26 -4.91 113.62 113.18 1uhw n SER 107 Ca 0.07 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.59 1uhw n SER 107 Cb 0.55 0.89 -0.01 0.00 -0.75 0.00 0.00 64.21 64.89 1uhw n SER 107 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1uhw n SER 108 N -1.05 1.31 0.00 -3.46 3.41 -1.26 -5.03 113.62 107.53 1uhw n SER 108 Ca 0.00 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 1uhw n SER 108 Cb 0.00 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 1uhw n SER 108 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49