#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 -1.50 -4.76 1.61 2.88 -1.26 -5.14 113.62 105.46 1uhw n SER 2 Ca 0.00 -1.07 -0.30 0.00 -1.33 0.00 0.00 58.87 56.17 1uhw n SER 2 Cb 0.00 0.76 0.11 0.00 -0.75 0.00 0.00 64.21 64.33 1uhw n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1uhw s SER 3 N 0.86 4.04 0.00 -3.46 0.15 -1.26 -4.83 113.70 109.20 1uhw s SER 3 Ca 0.24 1.51 0.00 0.00 0.70 0.00 0.00 55.95 58.40 1uhw s SER 3 Cb 0.13 -2.22 0.00 0.00 -1.71 0.00 0.00 66.02 62.22 1uhw s SER 3 CO -0.10 -2.28 0.00 0.61 1.20 0.00 0.00 173.24 172.66 1uhw n GLY 4 N -1.44 1.13 5.00 9.45 0.00 -1.26 -4.69 105.19 113.38 1uhw n GLY 4 Ca 0.07 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.29 0.00 -3.59 1.61 7.64 -1.26 -4.73 113.62 111.01 1uhw n SER 5 Ca 0.00 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.52 1uhw n SER 5 Cb 0.00 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.23 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 2.95 -5.27 0.00 6.43 7.64 -1.26 -4.18 113.62 119.93 1uhw n SER 6 Ca 0.00 -0.38 0.00 0.00 1.01 0.00 0.00 58.87 59.50 1uhw n SER 6 Cb 0.00 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 61.62 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 -0.55 1.42 0.08 0.23 0.00 -1.26 -4.92 105.19 100.18 1uhw n GLY 7 Ca -0.15 -0.47 -0.02 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.41 -0.02 0.99 4.07 -1.96 0.88 115.31 118.86 1uhw h LEU 8 Ca 0.00 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1uhw h LEU 8 Cb 0.00 0.18 -0.00 0.00 1.08 0.00 0.00 40.66 41.92 1uhw h LEU 8 CO 0.00 -0.04 -0.01 0.61 -1.08 0.00 0.00 178.44 177.91 1uhw n GLY 9 N -1.05 -1.35 0.37 0.83 0.00 -1.26 0.28 105.19 103.01 1uhw n GLY 9 Ca 0.00 0.27 -0.10 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.40 -0.43 -0.09 4.61 0.00 -1.71 0.66 119.26 121.90 1uhw h ALA 10 Ca 0.00 0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1uhw h ALA 10 Cb 0.01 0.76 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 1uhw h ALA 10 CO -0.02 -0.85 -0.38 1.25 0.00 0.00 0.00 179.25 179.25 1uhw h LEU 11 N -0.39 -1.17 -0.33 0.00 7.12 0.33 -1.80 115.31 119.08 1uhw h LEU 11 Ca 0.11 0.16 0.07 0.00 0.13 0.00 0.00 57.88 58.35 1uhw h LEU 11 Cb 0.58 0.48 -0.08 0.00 -0.53 0.00 0.00 40.66 41.11 1uhw h LEU 11 CO -0.46 -0.41 -0.21 0.22 -0.13 0.00 0.00 178.44 177.45 1uhw h TYR 12 N -0.48 -0.54 -0.99 1.25 3.20 0.50 0.11 116.97 120.03 1uhw h TYR 12 Ca 0.08 0.04 0.34 0.00 3.14 0.00 0.00 58.73 62.33 1uhw h TYR 12 Cb 0.60 0.29 -0.16 0.00 1.54 0.00 0.00 36.73 39.00 1uhw h TYR 12 CO -0.43 -0.29 0.50 -0.07 -1.64 0.00 0.00 178.16 176.23 1uhw h LEU 13 N -0.17 0.36 0.00 2.82 3.38 0.11 0.73 115.31 122.55 1uhw h LEU 13 Ca 0.17 0.22 -0.00 0.00 0.09 0.00 0.00 57.88 58.36 1uhw h LEU 13 Cb 0.43 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1uhw h LEU 13 CO -0.43 -0.24 -0.00 -1.28 0.09 0.00 0.00 178.44 176.57 1uhw h SER 14 N 0.20 -0.01 -1.11 -0.43 0.87 -0.23 -2.65 113.55 110.20 1uhw h SER 14 Ca 0.75 -0.28 0.32 0.00 -1.23 0.00 0.00 61.79 61.35 1uhw h SER 14 Cb 1.78 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.70 1uhw h SER 14 CO -0.68 0.28 0.80 0.24 -0.53 0.00 0.00 176.83 176.93 1uhw h MET 15 N -0.29 0.00 -0.84 2.24 2.86 0.12 0.75 114.93 119.77 1uhw h MET 15 Ca -0.00 -0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1uhw h MET 15 Cb 0.28 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.90 1uhw h MET 15 CO 0.00 0.00 0.43 0.87 1.06 0.00 0.00 176.91 179.28 1uhw h LYS 16 N 0.00 1.19 -6.08 1.72 1.57 -0.88 -1.78 116.57 112.31 1uhw h LYS 16 Ca 0.53 -0.16 -0.61 0.00 -1.87 0.00 0.00 60.65 58.54 1uhw h LYS 16 Cb 2.11 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 34.20 1uhw h LYS 16 CO -0.01 0.89 1.37 -3.47 -0.57 0.00 0.00 179.45 177.67 1uhw n ASP 17 N -4.35 3.07 0.00 0.86 -0.08 0.26 -4.79 116.55 111.53 1uhw n ASP 17 Ca 0.08 0.48 0.12 0.00 -1.51 0.00 0.00 54.79 53.96 1uhw n ASP 17 Cb 0.12 -1.44 0.69 0.00 2.34 0.00 0.00 41.12 42.83 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 8.07 0.69 0.01 -0.67 -0.04 -1.25 0.93 135.00 142.74 1uhw n PRO 18 Ca 0.31 0.01 -0.02 0.00 -0.04 0.00 0.00 63.50 63.76 1uhw n PRO 18 Cb 0.35 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.31 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 -1.04 0.06 -0.63 0.54 1.02 -1.26 -4.71 120.64 114.63 1uhw n GLU 19 Ca 0.17 0.02 0.08 0.00 -0.02 0.00 0.00 57.16 57.41 1uhw n GLU 19 Cb 0.09 -0.59 0.34 0.00 -0.02 0.00 0.00 31.44 31.26 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 -3.34 3.74 0.00 3.49 5.02 -1.24 -4.92 118.16 120.90 1uhw n LYS 20 Ca -0.04 -2.66 0.00 0.00 -2.02 0.00 0.00 58.31 53.60 1uhw n LYS 20 Cb 0.31 -1.93 0.00 0.00 -0.02 0.00 0.00 35.03 33.39 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 0.95 5.34 3.77 0.72 0.00 0.26 -4.79 105.19 111.44 1uhw n GLY 21 Ca 0.24 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 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 0.04 3.32 0.06 -0.61 1.01 -0.67 -4.73 121.20 119.62 1uhw s ILE 22 Ca 0.00 0.49 -0.10 0.00 0.00 0.00 0.00 60.65 61.04 1uhw s ILE 22 Cb 0.00 -3.00 -0.06 0.00 0.01 0.00 0.00 42.46 39.42 1uhw s ILE 22 CO 0.00 -0.50 0.39 -0.54 0.00 0.00 0.00 174.94 174.29 1uhw s LYS 23 N -4.62 3.76 -0.33 2.79 1.02 -1.26 -3.93 119.74 117.17 1uhw s LYS 23 Ca 0.63 0.18 -0.02 0.00 0.02 0.00 0.00 55.97 56.78 1uhw s LYS 23 Cb -0.18 -3.04 0.07 0.00 -0.52 0.00 0.00 37.83 34.15 1uhw s LYS 23 CO 0.51 0.59 0.06 -1.21 -0.92 0.00 0.00 175.35 174.38 1uhw s GLU 24 N -1.75 2.30 0.29 1.68 2.02 -1.26 -4.80 118.70 117.18 1uhw s GLU 24 Ca 0.31 -1.42 0.11 0.00 0.02 0.00 0.00 54.97 53.99 1uhw s GLU 24 Cb -0.14 -3.30 -0.05 0.00 0.10 0.00 0.00 34.13 30.73 1uhw s GLU 24 CO 0.17 -0.75 -0.17 -0.51 0.02 0.00 0.00 175.26 174.02 1uhw s LEU 25 N 1.22 2.62 -0.16 1.80 2.01 -1.22 -4.81 118.68 120.15 1uhw s LEU 25 Ca -0.01 -1.07 -0.22 0.00 0.01 0.00 0.00 54.13 52.84 1uhw s LEU 25 Cb -0.20 -1.05 -0.03 0.00 0.01 0.00 0.00 46.19 44.92 1uhw s LEU 25 CO -0.02 -0.03 0.66 0.21 1.01 0.00 0.00 176.35 178.18 1uhw s ASN 26 N -3.52 6.79 0.03 2.29 2.47 -1.26 -2.60 114.94 119.14 1uhw s ASN 26 Ca 0.30 0.96 0.09 0.00 0.42 0.00 0.00 52.86 54.63 1uhw s ASN 26 Cb -0.03 -2.37 -0.03 0.00 -1.45 0.00 0.00 41.25 37.37 1uhw s ASN 26 CO 0.15 -0.24 -0.26 -0.76 -3.72 0.00 0.00 177.10 172.27 1uhw s LEU 27 N 1.61 2.15 0.03 3.21 1.43 -0.78 -4.98 118.68 121.34 1uhw s LEU 27 Ca 0.32 -0.57 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 1uhw s LEU 27 Cb -0.16 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 44.74 1uhw s LEU 27 CO 0.12 0.27 -0.03 -0.70 0.23 0.00 0.00 176.35 176.24 1uhw s GLU 28 N -1.13 0.37 0.06 1.70 2.12 -1.26 -0.02 118.70 120.54 1uhw s GLU 28 Ca 0.11 -0.71 0.00 0.00 0.36 0.00 0.00 54.97 54.73 1uhw s GLU 28 Cb -0.10 0.08 0.00 0.00 0.26 0.00 0.00 34.13 34.38 1uhw s GLU 28 CO 0.01 -0.05 0.00 1.17 -0.54 0.00 0.00 175.26 175.86 1uhw n LYS 29 N 1.38 0.00 -3.33 4.30 4.81 -1.26 -5.02 118.16 119.04 1uhw n LYS 29 Ca -0.22 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.10 1uhw n LYS 29 Cb 0.56 -0.45 -0.07 0.00 0.02 0.00 0.00 35.03 35.10 1uhw n LYS 29 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1uhw s ASP 30 N -5.43 0.68 0.00 3.14 2.15 -1.26 -4.95 116.67 111.00 1uhw s ASP 30 Ca 0.00 -0.89 0.00 0.00 0.43 0.00 0.00 52.55 52.09 1uhw s ASP 30 Cb 0.00 0.91 0.00 0.00 -0.30 0.00 0.00 42.92 43.53 1uhw s ASP 30 CO 0.00 -0.31 0.00 0.29 -0.17 0.00 0.00 175.17 174.98 1uhw n LYS 31 N 4.88 0.00 -0.90 4.34 5.02 -1.26 -4.90 118.16 125.35 1uhw n LYS 31 Ca 0.05 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.99 1uhw n LYS 31 Cb 0.48 0.00 0.08 0.00 -0.02 0.00 0.00 35.03 35.57 1uhw n LYS 31 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1uhw n LYS 32 N 0.00 -0.15 -3.34 1.97 5.02 -1.26 -4.99 118.16 115.42 1uhw n LYS 32 Ca 0.00 -0.02 -0.16 0.00 -2.02 0.00 0.00 58.31 56.11 1uhw n LYS 32 Cb 0.00 -1.42 -0.07 0.00 -0.02 0.00 0.00 35.03 33.52 1uhw n LYS 32 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1uhw s VAL 33 N -2.20 -0.37 -0.41 -0.18 1.01 -1.26 -4.12 120.40 112.87 1uhw s VAL 33 Ca 0.48 -0.98 -0.28 0.00 0.00 0.00 0.00 61.98 61.20 1uhw s VAL 33 Cb -0.19 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.56 1uhw s VAL 33 CO 0.75 -0.55 1.66 -0.36 0.00 0.00 0.00 175.10 176.60 1uhw s PHE 34 N 1.38 2.01 0.37 5.22 0.08 0.97 -4.91 117.98 123.10 1uhw s PHE 34 Ca 0.18 0.65 -0.19 0.00 0.12 0.00 0.00 56.93 57.69 1uhw s PHE 34 Cb -0.14 -4.20 -0.10 0.00 -0.57 0.00 0.00 43.02 38.01 1uhw s PHE 34 CO -0.03 -2.49 0.85 -0.80 -0.10 0.00 0.00 175.22 172.65 1uhw s ASN 35 N 5.55 6.88 -1.36 1.36 0.01 -1.26 -1.87 114.94 124.25 1uhw s ASN 35 Ca 0.70 1.51 -0.20 0.00 -0.71 0.00 0.00 52.86 54.16 1uhw s ASN 35 Cb -0.17 -2.47 0.03 0.00 0.41 0.00 0.00 41.25 39.05 1uhw s ASN 35 CO 0.31 -0.27 0.38 1.41 -1.51 0.00 0.00 177.10 177.42 1uhw n HIS 36 N -0.44 -1.31 -3.54 2.20 8.25 -1.25 -3.76 115.22 115.36 1uhw n HIS 36 Ca 0.05 0.29 -0.21 0.00 -0.26 0.00 0.00 57.72 57.59 1uhw n HIS 36 Cb 0.53 -2.76 -0.03 0.00 1.12 0.00 0.00 29.99 28.86 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 -1.58 0.00 -3.64 0.00 4.77 0.35 -3.43 117.00 113.48 1uhw n LEU 38 Ca 0.04 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.96 1uhw n LEU 38 Cb 0.62 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.64 1uhw n LEU 38 CO 0.42 0.00 0.33 0.42 -1.33 0.00 0.00 177.39 177.23 1uhw s THR 39 N 1.53 -0.20 0.28 -5.08 -4.23 -1.26 -3.77 115.64 102.91 1uhw s THR 39 Ca 0.00 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.54 1uhw s THR 39 Cb 0.00 -1.00 0.37 0.00 1.34 0.00 0.00 72.50 73.21 1uhw s THR 39 CO 0.00 0.00 1.40 0.61 -0.54 0.00 0.00 174.62 176.09 1uhw n GLY 40 N 4.55 -1.17 0.29 3.99 0.00 0.26 0.13 105.19 113.23 1uhw n GLY 40 Ca -0.18 0.86 -0.11 0.00 0.00 0.00 0.00 46.02 46.59 1uhw n GLY 40 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1uhw h SER 41 N 0.00 -0.56 -0.58 1.61 0.87 -1.01 -3.12 113.55 110.76 1uhw h SER 41 Ca 0.56 -0.02 0.11 0.00 -1.23 0.00 0.00 61.79 61.21 1uhw h SER 41 Cb 1.20 0.15 -0.11 0.00 -0.44 0.00 0.00 62.40 63.20 1uhw h SER 41 CO -0.83 -0.15 -0.17 1.23 -0.53 0.00 0.00 176.83 176.38 1uhw h GLY 42 N -1.13 0.35 -0.59 5.77 0.00 -0.95 0.45 103.07 106.96 1uhw h GLY 42 Ca -0.07 0.22 0.24 0.00 0.00 0.00 0.00 47.33 47.72 1uhw h GLY 42 CO 0.11 -0.22 0.15 -2.08 0.00 0.00 0.00 176.54 174.49 1uhw h VAL 43 N -0.03 0.23 -0.07 4.60 2.07 0.99 0.48 116.25 124.51 1uhw h VAL 43 Ca 0.27 -0.04 -0.11 0.00 0.82 0.00 0.00 66.70 67.64 1uhw h VAL 43 Cb 0.45 0.09 0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1uhw h VAL 43 CO -0.61 0.02 -0.38 0.40 0.02 0.00 0.00 177.57 177.03 1uhw h ILE 44 N 0.13 1.41 -0.86 4.57 2.04 -0.55 -2.98 117.51 121.27 1uhw h ILE 44 Ca 0.55 -1.77 0.22 0.00 1.00 0.00 0.00 64.86 64.86 1uhw h ILE 44 Cb 1.12 2.31 -0.15 0.00 -0.74 0.00 0.00 36.82 39.36 1uhw h ILE 44 CO -0.74 0.51 0.13 -0.78 0.00 0.00 0.00 178.15 177.27 1uhw h ASP 45 N -0.09 -0.20 -0.21 1.72 1.82 0.40 0.95 116.42 120.83 1uhw h ASP 45 Ca -0.03 0.21 -0.00 0.00 -0.39 0.00 0.00 57.03 56.83 1uhw h ASP 45 Cb 1.03 0.33 -0.01 0.00 0.68 0.00 0.00 39.33 41.36 1uhw h ASP 45 CO 0.08 -0.20 0.13 -0.25 -1.61 0.00 0.00 179.24 177.39 1uhw h TRP 46 N 0.14 0.27 0.02 0.28 7.01 -0.61 1.56 115.95 124.61 1uhw h TRP 46 Ca 0.52 0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.55 1uhw h TRP 46 Cb 1.01 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.93 1uhw h TRP 46 CO -0.36 0.20 -0.40 -0.07 -2.79 0.00 0.00 178.44 175.03 1uhw h LEU 47 N 0.26 -1.20 -0.23 0.65 3.38 0.88 0.29 115.31 119.36 1uhw h LEU 47 Ca 0.08 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1uhw h LEU 47 Cb 0.00 0.47 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1uhw h LEU 47 CO -0.01 -0.45 0.12 0.58 0.09 0.00 0.00 178.44 178.76 1uhw h VAL 48 N -0.57 1.13 -0.65 1.22 2.07 -0.17 1.69 116.25 120.99 1uhw h VAL 48 Ca 0.05 -0.38 0.12 0.00 0.82 0.00 0.00 66.70 67.31 1uhw h VAL 48 Cb 0.64 0.96 -0.12 0.00 -1.52 0.00 0.00 31.29 31.24 1uhw h VAL 48 CO -0.29 0.13 -0.26 0.28 0.02 0.00 0.00 177.57 177.45 1uhw h SER 49 N 0.25 -0.91 1.87 0.57 0.02 0.30 0.64 113.55 116.29 1uhw h SER 49 Ca 0.08 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 1uhw h SER 49 Cb 0.10 0.51 0.00 0.00 0.14 0.00 0.00 62.40 63.15 1uhw h SER 49 CO -0.01 -0.27 -0.12 0.78 -1.14 0.00 0.00 176.83 176.07 1uhw h ASN 50 N -0.08 0.00 -2.75 3.07 2.35 -0.17 -3.48 115.58 114.51 1uhw h ASN 50 Ca 0.28 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1uhw h ASN 50 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1uhw h ASN 50 CO -0.70 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 175.37 1uhw n LYS 51 N -3.03 0.00 0.02 0.81 4.76 0.47 -4.99 118.16 116.21 1uhw n LYS 51 Ca 0.04 0.14 0.11 0.00 -2.87 0.00 0.00 58.31 55.72 1uhw n LYS 51 Cb 0.53 -1.37 -0.02 0.00 -1.84 0.00 0.00 35.03 32.32 1uhw n LYS 51 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1uhw n LEU 52 N -1.24 0.58 0.00 -0.35 4.77 0.44 -4.95 117.00 116.25 1uhw n LEU 52 Ca 0.00 -0.06 -0.11 0.00 -0.03 0.00 0.00 56.01 55.82 1uhw n LEU 52 Cb 0.46 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.44 1uhw n LEU 52 CO 0.00 0.05 -0.06 1.33 -1.33 0.00 0.00 177.39 177.39 1uhw n VAL 53 N -1.98 0.00 0.05 4.08 0.24 -1.26 -5.01 118.33 114.45 1uhw n VAL 53 Ca 0.01 -1.25 -0.06 0.00 -2.04 0.00 0.00 64.34 61.00 1uhw n VAL 53 Cb 0.45 0.60 -0.10 0.00 -1.47 0.00 0.00 33.84 33.31 1uhw n VAL 53 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1uhw h ARG 54 N 0.00 0.00 0.00 7.34 2.47 -1.95 -3.47 114.38 118.77 1uhw h ARG 54 Ca -0.13 0.00 0.14 0.00 -1.26 0.00 0.00 59.98 58.73 1uhw h ARG 54 Cb 0.62 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.92 1uhw h ARG 54 CO 0.19 0.81 0.50 0.27 0.56 0.00 0.00 179.97 182.30 1uhw n ASN 55 N -3.26 -1.38 -0.30 7.04 6.94 -1.26 -5.02 115.26 118.03 1uhw n ASN 55 Ca -0.03 -1.70 0.07 0.00 -0.02 0.00 0.00 54.58 52.90 1uhw n ASN 55 Cb 0.93 2.24 0.29 0.00 -2.36 0.00 0.00 39.78 40.88 1uhw n ASN 55 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 1uhw h ARG 56 N 0.00 0.87 0.00 -3.83 2.47 -1.94 -2.71 114.38 109.24 1uhw h ARG 56 Ca -0.22 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 1uhw h ARG 56 Cb 0.97 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 29.10 1uhw h ARG 56 CO 0.29 0.57 0.00 0.94 0.56 0.00 0.00 179.97 182.34 1uhw n GLN 57 N -4.54 0.00 -0.34 0.04 0.00 -1.26 -0.88 117.38 110.41 1uhw n GLN 57 Ca 0.16 0.60 0.03 0.00 -0.00 0.00 0.00 57.00 57.78 1uhw n GLN 57 Cb 0.32 -1.40 0.09 0.00 0.00 0.00 0.00 30.24 29.25 1uhw n GLN 57 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1uhw n GLU 58 N -2.06 -0.13 -0.14 3.69 4.71 -1.13 0.11 120.64 125.69 1uhw n GLU 58 Ca 0.00 1.42 -0.04 0.00 -0.01 0.00 0.00 57.16 58.53 1uhw n GLU 58 Cb 0.00 -2.11 0.03 0.00 -1.01 0.00 0.00 31.44 28.34 1uhw n GLU 58 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 1uhw h GLY 59 N 0.00 0.32 -0.25 0.62 0.00 -1.15 0.14 103.07 102.75 1uhw h GLY 59 Ca 0.39 0.16 0.09 0.00 0.00 0.00 0.00 47.33 47.97 1uhw h GLY 59 CO -0.93 -0.18 -0.32 -2.00 0.00 0.00 0.00 176.54 173.12 1uhw h LEU 60 N -0.01 -1.07 0.21 3.11 7.12 0.27 1.67 115.31 126.62 1uhw h LEU 60 Ca 0.22 0.20 -0.00 0.00 0.13 0.00 0.00 57.88 58.43 1uhw h LEU 60 Cb 0.34 0.52 -0.01 0.00 -0.53 0.00 0.00 40.66 40.98 1uhw h LEU 60 CO -0.47 -0.31 -0.16 0.24 -0.13 0.00 0.00 178.44 177.61 1uhw h MET 61 N -0.21 -0.36 -0.25 1.25 2.86 -0.71 -2.55 114.93 114.97 1uhw h MET 61 Ca 0.20 0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.91 1uhw h MET 61 Cb 0.53 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.23 1uhw h MET 61 CO -0.59 -0.24 -0.03 0.82 1.06 0.00 0.00 176.91 177.93 1uhw h ILE 62 N -0.37 0.78 -0.90 -1.22 1.08 0.39 -2.29 117.51 114.97 1uhw h ILE 62 Ca -0.01 -0.01 0.12 0.00 -0.39 0.00 0.00 64.86 64.57 1uhw h ILE 62 Cb 0.33 0.75 -0.14 0.00 -3.07 0.00 0.00 36.82 34.69 1uhw h ILE 62 CO -0.00 0.01 -0.44 0.28 -0.69 0.00 0.00 178.15 177.30 1uhw h SER 63 N 0.03 -1.62 -0.87 1.72 0.02 0.27 0.94 113.55 114.06 1uhw h SER 63 Ca 0.12 0.30 0.22 0.00 -0.84 0.00 0.00 61.79 61.59 1uhw h SER 63 Cb 0.17 0.78 -0.15 0.00 0.14 0.00 0.00 62.40 63.34 1uhw h SER 63 CO -0.23 -0.28 0.07 0.00 -1.14 0.00 0.00 176.83 175.24 1uhw h ALA 64 N 1.00 1.04 -0.99 3.77 0.00 -1.01 1.42 119.26 124.49 1uhw h ALA 64 Ca 0.26 0.27 0.16 0.00 0.00 0.00 0.00 54.91 55.60 1uhw h ALA 64 Cb 0.54 0.45 -0.09 0.00 0.00 0.00 0.00 17.79 18.70 1uhw h ALA 64 CO -0.91 -0.48 0.62 1.03 0.00 0.00 0.00 179.25 179.51 1uhw h SER 65 N 0.10 0.82 0.40 0.00 0.87 0.10 0.74 113.55 116.58 1uhw h SER 65 Ca 0.51 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 61.12 1uhw h SER 65 Cb 0.99 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1uhw h SER 65 CO -0.75 0.37 -0.19 -0.07 -0.53 0.00 0.00 176.83 175.66 1uhw h LEU 66 N 0.84 -0.46 0.01 2.23 3.38 0.24 -2.72 115.31 118.83 1uhw h LEU 66 Ca 0.53 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.41 1uhw h LEU 66 Cb 0.72 0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.53 1uhw h LEU 66 CO -0.30 -0.07 -0.39 0.25 0.09 0.00 0.00 178.44 178.02 1uhw h LEU 67 N -0.92 -1.17 -0.24 1.67 5.85 -0.22 -1.37 115.31 118.90 1uhw h LEU 67 Ca -0.06 0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.83 1uhw h LEU 67 Cb 0.55 0.46 -0.03 0.00 0.37 0.00 0.00 40.66 42.01 1uhw h LEU 67 CO 0.09 -0.44 -0.14 -0.24 -0.34 0.00 0.00 178.44 177.37 1uhw n SER 68 N -5.44 -0.25 -0.43 1.25 2.88 0.25 0.19 113.62 112.06 1uhw n SER 68 Ca -0.06 1.12 0.36 0.00 -1.33 0.00 0.00 58.87 58.96 1uhw n SER 68 Cb 0.36 -0.40 0.64 0.00 -0.75 0.00 0.00 64.21 64.05 1uhw n SER 68 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1uhw h GLU 69 N 0.00 0.09 0.00 -1.46 4.39 -1.18 -3.44 114.58 112.99 1uhw h GLU 69 Ca 0.04 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1uhw h GLU 69 Cb 0.10 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1uhw h GLU 69 CO -0.23 0.06 0.00 0.41 -1.16 0.00 0.00 179.01 178.10 1uhw n GLY 70 N -1.50 1.95 0.17 -3.84 0.00 0.50 -5.01 105.19 97.46 1uhw n GLY 70 Ca 0.37 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.48 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 -3.13 1.61 0.05 -1.29 -3.43 116.97 110.77 1uhw h TYR 71 Ca 0.00 0.00 -0.64 0.00 0.05 0.00 0.00 58.73 58.14 1uhw h TYR 71 Cb 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 36.73 37.39 1uhw h TYR 71 CO 0.00 0.11 -0.85 -0.51 -1.05 0.00 0.00 178.16 175.86 1uhw s LEU 72 N -5.95 1.95 -0.14 3.88 2.01 -1.26 -4.19 118.68 114.98 1uhw s LEU 72 Ca 0.04 -0.57 -0.13 0.00 0.01 0.00 0.00 54.13 53.48 1uhw s LEU 72 Cb 0.07 -1.34 -0.05 0.00 0.01 0.00 0.00 46.19 44.89 1uhw s LEU 72 CO 0.73 0.00 0.27 -1.10 1.01 0.00 0.00 176.35 177.26 1uhw s GLN 73 N 1.20 4.10 0.15 1.70 -1.52 0.13 -4.79 119.66 120.64 1uhw s GLN 73 Ca 0.01 0.08 -0.30 0.00 -1.95 0.00 0.00 55.36 53.20 1uhw s GLN 73 Cb -0.14 -3.37 -0.07 0.00 -0.22 0.00 0.00 33.01 29.21 1uhw s GLN 73 CO -0.08 0.37 1.13 -1.25 -0.25 0.00 0.00 175.29 175.21 1uhw s PRO 74 N 0.07 4.54 -0.38 2.91 0.04 -1.26 -1.33 135.00 139.59 1uhw s PRO 74 Ca 0.16 1.74 0.01 0.00 0.04 0.00 0.00 61.00 62.96 1uhw s PRO 74 Cb -0.13 -3.29 0.15 0.00 0.04 0.00 0.00 34.50 31.26 1uhw s PRO 74 CO 0.05 -0.02 0.24 0.00 0.04 0.00 0.00 177.00 177.30 1uhw s ALA 75 N 0.10 1.20 0.00 8.56 0.00 -1.21 -4.84 121.76 125.58 1uhw s ALA 75 Ca 0.52 -2.09 0.00 0.00 0.00 0.00 0.00 51.96 50.39 1uhw s ALA 75 Cb -0.30 -1.64 0.00 0.00 0.00 0.00 0.00 23.12 21.18 1uhw s ALA 75 CO 0.34 -2.08 0.00 0.41 0.00 0.00 0.00 175.76 174.43 1uhw n GLY 76 N 3.73 1.24 2.01 0.00 0.00 -1.26 -4.63 105.19 106.29 1uhw n GLY 76 Ca 0.15 -2.23 -0.16 0.00 0.00 0.00 0.00 46.02 43.78 1uhw n GLY 76 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1uhw n ASP 77 N 0.00 -3.02 0.00 1.61 -0.08 -1.26 -2.15 116.55 111.65 1uhw n ASP 77 Ca 0.00 -0.46 0.00 0.00 -1.51 0.00 0.00 54.79 52.82 1uhw n ASP 77 Cb 0.00 -0.59 0.00 0.00 2.34 0.00 0.00 41.12 42.87 1uhw n ASP 77 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1uhw n LEU 78 N 0.00 0.00 -0.02 -2.67 4.32 -1.26 -3.79 117.00 113.58 1uhw n LEU 78 Ca 0.07 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 55.98 1uhw n LEU 78 Cb 0.32 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.06 1uhw n LEU 78 CO 0.21 0.00 0.50 0.28 -1.22 0.00 0.00 177.39 177.16 1uhw h SER 79 N 0.00 -0.97 -0.56 -1.43 0.02 -1.87 1.43 113.55 110.17 1uhw h SER 79 Ca 0.00 0.12 0.05 0.00 -0.84 0.00 0.00 61.79 61.12 1uhw h SER 79 Cb 0.00 0.38 -0.07 0.00 0.14 0.00 0.00 62.40 62.85 1uhw h SER 79 CO 0.00 -0.26 -0.35 0.50 -1.14 0.00 0.00 176.83 175.58 1uhw h LYS 80 N -0.30 -0.02 -0.73 3.45 3.64 -1.53 0.68 116.57 121.77 1uhw h LYS 80 Ca 0.02 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.54 1uhw h LYS 80 Cb 0.37 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.10 1uhw h LYS 80 CO -0.26 -0.02 0.27 -0.97 -2.27 0.00 0.00 179.45 176.21 1uhw h ASN 81 N -0.02 0.24 -0.78 4.20 -0.73 -1.70 -0.78 115.58 116.00 1uhw h ASN 81 Ca 0.09 0.11 0.12 0.00 1.87 0.00 0.00 56.30 58.49 1uhw h ASN 81 Cb 0.26 0.09 -0.13 0.00 0.27 0.00 0.00 38.32 38.80 1uhw h ASN 81 CO -0.54 0.10 -0.38 0.00 -0.37 0.00 0.00 177.43 176.24 1uhw h ALA 82 N 1.53 -0.01 -0.50 1.57 0.00 0.80 0.72 119.26 123.36 1uhw h ALA 82 Ca 0.39 0.21 -0.45 0.00 0.00 0.00 0.00 54.91 55.06 1uhw h ALA 82 Cb 0.59 0.93 -0.17 0.00 0.00 0.00 0.00 17.79 19.14 1uhw h ALA 82 CO -0.40 -0.68 0.36 0.00 0.00 0.00 0.00 179.25 178.53 1uhw n ALA 83 N -3.29 6.20 0.01 0.00 0.00 -0.28 -4.20 120.51 118.95 1uhw n ALA 83 Ca 0.06 -2.73 -0.01 0.00 0.00 0.00 0.00 53.44 50.77 1uhw n ALA 83 Cb 0.37 -2.01 -0.00 0.00 0.00 0.00 0.00 19.45 17.81 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 0.84 0.62 0.00 0.00 -0.08 0.25 -4.99 116.55 113.19 1uhw n ASP 84 Ca 0.45 0.09 0.00 0.00 -1.51 0.00 0.00 54.79 53.82 1uhw n ASP 84 Cb 0.58 -0.25 0.00 0.00 2.34 0.00 0.00 41.12 43.79 1uhw n ASP 84 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1uhw n GLY 85 N 3.14 0.00 0.00 0.27 0.00 -1.23 -5.08 105.19 102.28 1uhw n GLY 85 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.06 -0.61 5.41 -1.26 -5.02 119.36 117.82 1uhw n ILE 86 Ca 0.00 0.82 0.00 0.00 1.00 0.00 0.00 62.75 64.57 1uhw n ILE 86 Cb 0.00 -1.60 0.00 0.00 -0.71 0.00 0.00 39.64 37.33 1uhw n ILE 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1uhw n ALA 87 N -0.79 0.00 0.35 -1.39 0.00 -1.26 -5.03 120.51 112.39 1uhw n ALA 87 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 1uhw n ALA 87 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 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 0.43 -3.62 0.00 0.00 -1.26 -4.71 120.64 111.48 1uhw n GLU 88 Ca 0.00 0.03 -0.40 0.00 0.00 0.00 0.00 57.16 56.80 1uhw n GLU 88 Cb 0.00 -1.68 -0.10 0.00 0.00 0.00 0.00 31.44 29.66 1uhw n GLU 88 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 1uhw s ASN 89 N -4.52 5.58 0.28 -1.84 -0.87 -1.26 -4.92 114.94 107.39 1uhw s ASN 89 Ca 0.01 -1.67 0.13 0.00 -1.57 0.00 0.00 52.86 49.77 1uhw s ASN 89 Cb 0.13 -1.96 0.30 0.00 -0.02 0.00 0.00 41.25 39.69 1uhw s ASN 89 CO 0.80 -0.57 1.56 1.55 -2.57 0.00 0.00 177.10 177.86 1uhw h PRO 90 N 8.36 0.00 -6.76 -0.60 0.13 -1.84 -3.45 132.00 127.84 1uhw h PRO 90 Ca -0.21 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.43 1uhw h PRO 90 Cb 1.08 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 1uhw h PRO 90 CO 0.77 0.60 0.37 0.12 -0.23 0.00 0.00 178.00 179.62 1uhw s PHE 91 N -3.32 3.92 -0.30 1.56 5.36 -1.26 -4.03 117.98 119.91 1uhw s PHE 91 Ca 0.00 1.88 -0.01 0.00 -0.96 0.00 0.00 56.93 57.85 1uhw s PHE 91 Cb 0.11 -3.02 0.06 0.00 -0.34 0.00 0.00 43.02 39.83 1uhw s PHE 91 CO 0.75 0.32 -0.00 -0.51 -1.46 0.00 0.00 175.22 174.31 1uhw s LEU 92 N -1.26 3.92 -0.60 6.12 1.43 -1.26 -4.94 118.68 122.08 1uhw s LEU 92 Ca 0.42 -1.35 -0.22 0.00 -1.03 0.00 0.00 54.13 51.95 1uhw s LEU 92 Cb -0.26 -1.69 -0.19 0.00 0.03 0.00 0.00 46.19 44.07 1uhw s LEU 92 CO 0.33 -0.27 1.85 -0.67 0.23 0.00 0.00 176.35 177.82 1uhw n ASP 93 N 4.59 2.29 -3.98 2.29 2.03 -1.26 -4.31 116.55 118.20 1uhw n ASP 93 Ca -0.12 -2.60 -0.09 0.00 0.52 0.00 0.00 54.79 52.49 1uhw n ASP 93 Cb 0.43 -0.97 -0.11 0.00 -0.72 0.00 0.00 41.12 39.75 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 5.31 0.23 0.00 1.67 0.15 -1.26 -4.72 113.70 115.09 1uhw s SER 94 Ca 0.57 -0.49 0.22 0.00 0.70 0.00 0.00 55.95 56.95 1uhw s SER 94 Cb 0.14 0.10 0.95 0.00 -1.71 0.00 0.00 66.02 65.50 1uhw s SER 94 CO 0.15 -0.30 1.70 -0.81 1.20 0.00 0.00 173.24 175.19 1uhw n PRO 95 N 1.62 0.03 -0.01 5.44 -0.04 -1.26 -0.55 135.00 140.23 1uhw n PRO 95 Ca -0.24 0.12 -0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1uhw n PRO 95 Cb 0.55 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.51 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 -0.02 -1.15 3.54 5.19 -1.95 -3.45 116.42 118.58 1uhw h ASP 96 Ca 0.00 0.00 -0.84 0.00 -0.62 0.00 0.00 57.03 55.57 1uhw h ASP 96 Cb 0.36 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.88 1uhw h ASP 96 CO 0.00 0.17 0.76 0.00 -3.12 0.00 0.00 179.24 177.05 1uhw n ALA 97 N -2.29 -1.01 -2.69 3.45 0.00 -1.24 -4.83 120.51 111.91 1uhw n ALA 97 Ca -0.00 0.46 -0.33 0.00 0.00 0.00 0.00 53.44 53.58 1uhw n ALA 97 Cb 0.01 -2.01 -0.09 0.00 0.00 0.00 0.00 19.45 17.36 1uhw n ALA 97 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1uhw s PHE 98 N 3.19 3.09 0.00 0.00 0.08 -1.26 -0.58 117.98 122.51 1uhw s PHE 98 Ca 1.03 0.09 -0.04 0.00 0.12 0.00 0.00 56.93 58.13 1uhw s PHE 98 Cb -1.37 -1.67 -0.00 0.00 -0.57 0.00 0.00 43.02 39.40 1uhw s PHE 98 CO 0.77 0.47 0.08 0.71 -0.10 0.00 0.00 175.22 177.15 1uhw s TYR 99 N -1.10 0.10 0.01 0.36 2.02 -1.25 -3.29 117.35 114.20 1uhw s TYR 99 Ca 0.20 -0.22 0.01 0.00 -0.37 0.00 0.00 57.07 56.69 1uhw s TYR 99 Cb -0.12 -0.08 -0.01 0.00 -0.40 0.00 0.00 41.96 41.35 1uhw s TYR 99 CO 0.11 -0.22 -0.04 1.52 -1.57 0.00 0.00 175.55 175.35 1uhw s TYR 100 N -1.22 0.33 0.22 2.71 -0.85 -0.44 0.13 117.35 118.23 1uhw s TYR 100 Ca -0.13 -0.25 -0.30 0.00 -0.52 0.00 0.00 57.07 55.87 1uhw s TYR 100 Cb -0.08 -0.21 -0.09 0.00 0.38 0.00 0.00 41.96 41.96 1uhw s TYR 100 CO 0.01 -0.06 1.31 -0.06 -1.52 0.00 0.00 175.55 175.23 1uhw s PHE 101 N -0.65 3.23 -1.14 -3.49 0.08 -1.26 0.21 117.98 114.96 1uhw s PHE 101 Ca -0.05 1.24 -0.14 0.00 0.12 0.00 0.00 56.93 58.10 1uhw s PHE 101 Cb -0.05 -3.62 -0.07 0.00 -0.57 0.00 0.00 43.02 38.72 1uhw s PHE 101 CO -0.00 -1.89 2.22 -0.35 -0.10 0.00 0.00 175.22 175.10 1uhw n PRO 102 N 2.40 2.38 0.00 0.24 -0.04 -1.26 -0.73 135.00 137.98 1uhw n PRO 102 Ca 0.05 -2.04 0.00 0.00 -0.04 0.00 0.00 63.50 61.48 1uhw n PRO 102 Cb 0.43 -2.90 0.00 0.00 -0.04 0.00 0.00 33.50 30.98 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 5.73 0.00 -0.11 3.54 2.03 -1.26 -4.96 116.55 121.51 1uhw n ASP 103 Ca 0.54 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.71 1uhw n ASP 103 Cb 0.31 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.60 1uhw n ASP 103 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1uhw n SER 104 N -0.49 1.97 -3.41 1.67 2.88 -1.04 -4.90 113.62 110.30 1uhw n SER 104 Ca 0.00 -0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1uhw n SER 104 Cb 0.00 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 1uhw n SER 104 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uhw n GLY 105 N 2.34 -3.62 3.57 0.46 0.00 0.09 -4.71 105.19 103.31 1uhw n GLY 105 Ca -0.38 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.77 3.18 0.06 1.61 0.04 -1.25 -4.94 135.00 131.93 1uhw s PRO 106 Ca 0.00 -1.22 -0.24 0.00 0.04 0.00 0.00 61.00 59.58 1uhw s PRO 106 Cb 0.00 -5.32 -0.06 0.00 0.04 0.00 0.00 34.50 29.16 1uhw s PRO 106 CO 0.00 -2.97 0.74 -1.54 0.04 0.00 0.00 177.00 173.27 1uhw s SER 107 N 5.82 7.20 0.03 6.66 1.04 -1.26 -4.98 113.70 128.20 1uhw s SER 107 Ca 0.60 1.43 -0.34 0.00 0.48 0.00 0.00 55.95 58.12 1uhw s SER 107 Cb -0.00 -2.45 -0.13 0.00 0.10 0.00 0.00 66.02 63.53 1uhw s SER 107 CO 0.04 0.07 1.74 -1.54 0.98 0.00 0.00 173.24 174.52 1uhw n SER 108 N 2.56 3.28 0.00 7.02 3.41 -1.26 -5.14 113.62 123.49 1uhw n SER 108 Ca -0.04 1.02 0.00 0.00 -0.26 0.00 0.00 58.87 59.59 1uhw n SER 108 Cb 0.50 -1.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 1uhw n SER 108 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49