#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 -0.15 0.01 1.61 0.15 -1.26 -5.11 113.70 108.96 1uhw s SER 2 Ca 0.00 0.24 0.01 0.00 0.70 0.00 0.00 55.95 56.90 1uhw s SER 2 Cb 0.00 0.88 -0.01 0.00 -1.71 0.00 0.00 66.02 65.18 1uhw s SER 2 CO 0.00 -0.04 -0.03 -0.55 1.20 0.00 0.00 173.24 173.82 1uhw s SER 3 N 0.87 0.30 0.00 5.45 0.15 -1.26 -5.09 113.70 114.12 1uhw s SER 3 Ca -0.05 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.39 1uhw s SER 3 Cb -0.03 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.29 1uhw s SER 3 CO -0.12 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1uhw n GLY 4 N 2.48 0.40 3.61 9.45 0.00 -1.26 -5.05 105.19 114.82 1uhw n GLY 4 Ca -0.17 -1.93 -0.65 0.00 0.00 0.00 0.00 46.02 43.28 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 0.00 1.00 0.11 1.61 7.64 -1.26 -4.83 113.62 117.89 1uhw n SER 5 Ca 0.00 1.15 -0.05 0.00 1.01 0.00 0.00 58.87 60.98 1uhw n SER 5 Cb 0.00 -0.86 -0.02 0.00 -1.01 0.00 0.00 64.21 62.31 1uhw n SER 5 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1uhw h SER 6 N 4.58 -0.28 -0.44 6.43 0.02 -1.96 0.37 113.55 122.27 1uhw h SER 6 Ca -0.44 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 60.57 1uhw h SER 6 Cb 1.34 0.07 -0.07 0.00 0.14 0.00 0.00 62.40 63.89 1uhw h SER 6 CO 0.91 -0.01 -0.40 1.23 -1.14 0.00 0.00 176.83 177.41 1uhw h GLY 7 N -0.69 -1.34 0.91 -3.77 0.00 -2.00 0.20 103.07 96.39 1uhw h GLY 7 Ca -0.03 0.81 -0.03 0.00 0.00 0.00 0.00 47.33 48.08 1uhw h GLY 7 CO 0.05 -0.30 -0.26 1.41 0.00 0.00 0.00 176.54 177.44 1uhw h LEU 8 N -0.18 -0.62 0.00 3.11 3.38 -1.96 -2.51 115.31 116.53 1uhw h LEU 8 Ca 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1uhw h LEU 8 Cb 0.37 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1uhw h LEU 8 CO -0.50 -0.38 0.00 0.61 0.09 0.00 0.00 178.44 178.26 1uhw n GLY 9 N -1.14 -2.75 0.32 0.83 0.00 0.13 0.20 105.19 102.79 1uhw n GLY 9 Ca -0.12 0.54 0.13 0.00 0.00 0.00 0.00 46.02 46.57 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 -1.09 1.17 0.57 4.61 0.00 -0.68 0.51 119.26 124.35 1uhw h ALA 10 Ca 0.00 0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1uhw h ALA 10 Cb 0.00 0.48 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1uhw h ALA 10 CO 0.00 -0.53 -0.32 1.25 0.00 0.00 0.00 179.25 179.64 1uhw h LEU 11 N 0.08 -0.80 -0.65 0.00 5.85 0.74 -2.33 115.31 118.20 1uhw h LEU 11 Ca 0.56 0.04 0.13 0.00 0.84 0.00 0.00 57.88 59.45 1uhw h LEU 11 Cb 1.15 0.23 -0.09 0.00 0.37 0.00 0.00 40.66 42.32 1uhw h LEU 11 CO -0.80 -0.52 0.15 0.22 -0.34 0.00 0.00 178.44 177.15 1uhw h TYR 12 N -0.83 0.23 -1.00 1.25 3.20 0.65 0.28 116.97 120.75 1uhw h TYR 12 Ca -0.07 0.04 0.21 0.00 3.14 0.00 0.00 58.73 62.04 1uhw h TYR 12 Cb 0.67 -0.00 -0.10 0.00 1.54 0.00 0.00 36.73 38.83 1uhw h TYR 12 CO -0.08 -0.05 0.61 -0.07 -1.64 0.00 0.00 178.16 176.94 1uhw h LEU 13 N 0.27 0.70 -0.08 2.82 3.38 0.10 0.46 115.31 122.96 1uhw h LEU 13 Ca 0.35 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.39 1uhw h LEU 13 Cb 0.55 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1uhw h LEU 13 CO -0.44 0.23 -0.05 0.28 0.09 0.00 0.00 178.44 178.55 1uhw h SER 14 N 0.67 0.18 -1.17 -0.43 0.02 0.03 -2.88 113.55 109.97 1uhw h SER 14 Ca 0.58 -0.44 0.34 0.00 -0.84 0.00 0.00 61.79 61.43 1uhw h SER 14 Cb 1.03 -0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.47 1uhw h SER 14 CO -0.37 0.58 0.96 0.24 -1.14 0.00 0.00 176.83 177.11 1uhw h MET 15 N -0.22 0.00 -0.32 3.45 2.86 0.44 0.89 114.93 122.03 1uhw h MET 15 Ca 0.02 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1uhw h MET 15 Cb 0.52 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 1uhw h MET 15 CO 0.01 0.00 0.12 0.87 1.06 0.00 0.00 176.91 178.97 1uhw h LYS 16 N 0.00 0.49 -6.08 1.72 1.57 -1.19 -2.62 116.57 110.45 1uhw h LYS 16 Ca 0.56 -0.10 -0.64 0.00 -1.87 0.00 0.00 60.65 58.60 1uhw h LYS 16 Cb 2.47 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 34.71 1uhw h LYS 16 CO -0.01 0.51 1.31 -3.47 -0.57 0.00 0.00 179.45 177.22 1uhw n ASP 17 N -4.70 2.76 0.00 0.86 -0.08 0.31 -4.78 116.55 110.92 1uhw n ASP 17 Ca -0.02 0.58 0.12 0.00 -1.51 0.00 0.00 54.79 53.96 1uhw n ASP 17 Cb 0.15 -1.34 0.67 0.00 2.34 0.00 0.00 41.12 42.94 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 7.68 0.64 0.01 -0.67 -0.04 -1.26 0.84 135.00 142.20 1uhw n PRO 18 Ca 0.33 0.02 -0.02 0.00 -0.04 0.00 0.00 63.50 63.79 1uhw n PRO 18 Cb 0.28 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.24 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 -1.07 0.05 -0.41 0.54 1.02 -1.26 -4.66 120.64 114.85 1uhw n GLU 19 Ca 0.16 0.02 0.08 0.00 -0.02 0.00 0.00 57.16 57.40 1uhw n GLU 19 Cb 0.11 -0.58 0.27 0.00 -0.02 0.00 0.00 31.44 31.21 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 -3.31 2.82 0.00 3.49 4.76 -1.25 -4.91 118.16 119.77 1uhw n LYS 20 Ca -0.03 -2.14 0.00 0.00 -2.87 0.00 0.00 58.31 53.26 1uhw n LYS 20 Cb 0.33 -1.64 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 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 1.11 5.47 3.81 0.72 0.00 0.25 -4.81 105.19 111.73 1uhw n GLY 21 Ca 0.20 -1.36 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 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 0.29 3.97 0.27 -0.61 1.01 -0.99 -4.74 121.20 120.40 1uhw s ILE 22 Ca 0.00 1.10 0.07 0.00 0.00 0.00 0.00 60.65 61.82 1uhw s ILE 22 Cb 0.00 -3.49 -0.03 0.00 0.01 0.00 0.00 42.46 38.95 1uhw s ILE 22 CO 0.00 -0.38 0.24 -0.54 0.00 0.00 0.00 174.94 174.26 1uhw s LYS 23 N -3.57 2.95 -0.09 2.79 -0.14 -1.26 -4.07 119.74 116.35 1uhw s LYS 23 Ca 0.64 -1.06 -0.01 0.00 -1.36 0.00 0.00 55.97 54.19 1uhw s LYS 23 Cb -0.14 -2.59 0.03 0.00 -1.68 0.00 0.00 37.83 33.44 1uhw s LYS 23 CO 0.25 0.34 -0.04 -1.83 -0.76 0.00 0.00 175.35 173.31 1uhw s GLU 24 N -3.90 1.10 0.42 1.68 -1.05 -1.26 -4.73 118.70 110.97 1uhw s GLU 24 Ca 0.35 -0.10 0.07 0.00 -0.15 0.00 0.00 54.97 55.14 1uhw s GLU 24 Cb -0.08 -1.26 -0.03 0.00 -0.44 0.00 0.00 34.13 32.32 1uhw s GLU 24 CO 0.26 -0.25 0.29 -0.51 0.95 0.00 0.00 175.26 176.00 1uhw s LEU 25 N 1.68 3.21 -1.01 1.83 1.43 -1.14 -4.68 118.68 120.00 1uhw s LEU 25 Ca 0.02 -0.94 -0.13 0.00 -1.03 0.00 0.00 54.13 52.05 1uhw s LEU 25 Cb -0.13 -1.71 0.21 0.00 0.03 0.00 0.00 46.19 44.60 1uhw s LEU 25 CO -0.06 -0.64 1.07 0.54 0.23 0.00 0.00 176.35 177.50 1uhw s ASN 26 N -4.04 6.98 0.18 2.29 2.20 -1.26 -3.74 114.94 117.54 1uhw s ASN 26 Ca 0.44 -2.92 -0.27 0.00 -0.94 0.00 0.00 52.86 49.16 1uhw s ASN 26 Cb 0.00 -2.28 -0.08 0.00 -2.00 0.00 0.00 41.25 36.89 1uhw s ASN 26 CO 0.25 -0.60 0.85 -0.76 -2.94 0.00 0.00 177.10 173.89 1uhw s LEU 27 N 0.44 4.59 0.09 3.54 1.43 -1.05 -4.85 118.68 122.87 1uhw s LEU 27 Ca 0.30 1.74 0.06 0.00 -1.03 0.00 0.00 54.13 55.20 1uhw s LEU 27 Cb -0.08 -3.42 -0.03 0.00 0.03 0.00 0.00 46.19 42.69 1uhw s LEU 27 CO -0.07 0.15 -0.17 -0.70 0.23 0.00 0.00 176.35 175.79 1uhw s GLU 28 N -0.97 0.95 0.06 1.70 2.12 -1.26 -0.93 118.70 120.37 1uhw s GLU 28 Ca 0.39 -1.05 0.00 0.00 0.36 0.00 0.00 54.97 54.67 1uhw s GLU 28 Cb -0.24 -1.06 0.00 0.00 0.26 0.00 0.00 34.13 33.09 1uhw s GLU 28 CO 0.28 0.24 0.00 1.17 -0.54 0.00 0.00 175.26 176.41 1uhw n LYS 29 N 1.17 0.00 -3.35 4.30 4.81 -1.15 -5.01 118.16 118.93 1uhw n LYS 29 Ca -0.20 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.00 1uhw n LYS 29 Cb 0.54 -0.16 -0.09 0.00 0.02 0.00 0.00 35.03 35.33 1uhw n LYS 29 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 1uhw s ASP 30 N -5.20 1.55 0.00 3.14 -4.77 -1.26 -4.93 116.67 105.19 1uhw s ASP 30 Ca 0.00 -2.48 0.00 0.00 -3.30 0.00 0.00 52.55 46.77 1uhw s ASP 30 Cb 0.00 -0.06 0.00 0.00 -1.09 0.00 0.00 42.92 41.77 1uhw s ASP 30 CO 0.00 -0.21 0.00 0.29 0.70 0.00 0.00 175.17 175.95 1uhw n LYS 31 N 3.40 0.00 -1.69 2.11 4.76 -1.26 -4.92 118.16 120.56 1uhw n LYS 31 Ca 0.21 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.22 1uhw n LYS 31 Cb 0.45 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.61 1uhw n LYS 31 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1uhw n LYS 32 N 0.00 2.69 -3.94 1.97 5.02 -1.26 -4.94 118.16 117.69 1uhw n LYS 32 Ca 0.00 0.98 -0.32 0.00 -2.02 0.00 0.00 58.31 56.95 1uhw n LYS 32 Cb 0.00 -2.85 -0.14 0.00 -0.02 0.00 0.00 35.03 32.02 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 2.53 2.63 -0.59 -0.18 1.01 -1.26 -2.94 120.40 121.60 1uhw s VAL 33 Ca 0.82 -2.76 -0.27 0.00 0.00 0.00 0.00 61.98 59.77 1uhw s VAL 33 Cb -0.52 -2.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 1uhw s VAL 33 CO 0.38 -0.71 1.79 -0.36 0.00 0.00 0.00 175.10 176.20 1uhw s PHE 34 N 0.37 1.76 0.20 5.22 0.08 -0.10 -4.91 117.98 120.60 1uhw s PHE 34 Ca 0.14 0.70 -0.06 0.00 0.12 0.00 0.00 56.93 57.83 1uhw s PHE 34 Cb -0.22 -4.14 -0.06 0.00 -0.57 0.00 0.00 43.02 38.02 1uhw s PHE 34 CO -0.04 -2.33 0.47 -0.80 -0.10 0.00 0.00 175.22 172.41 1uhw s ASN 35 N 7.39 6.52 -1.53 1.36 -0.87 -1.26 -2.53 114.94 124.02 1uhw s ASN 35 Ca 0.66 0.70 -0.14 0.00 -1.57 0.00 0.00 52.86 52.51 1uhw s ASN 35 Cb -0.13 -2.14 0.08 0.00 -0.02 0.00 0.00 41.25 39.04 1uhw s ASN 35 CO 0.22 -0.04 0.99 1.41 -2.57 0.00 0.00 177.10 177.11 1uhw n HIS 36 N -0.25 -2.33 -4.35 2.20 8.25 -1.26 -1.10 115.22 116.38 1uhw n HIS 36 Ca -0.01 0.91 -0.28 0.00 -0.26 0.00 0.00 57.72 58.07 1uhw n HIS 36 Cb 0.52 -4.02 -0.06 0.00 1.12 0.00 0.00 29.99 27.55 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 -1.33 0.00 0.00 0.00 4.77 0.35 -2.87 117.00 117.91 1uhw n LEU 38 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1uhw n LEU 38 Cb 0.66 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1uhw n LEU 38 CO 0.42 0.00 0.00 0.35 -1.33 0.00 0.00 177.39 176.83 1uhw n THR 39 N 0.00 0.00 -0.11 -5.08 -2.24 -1.26 -3.61 114.28 101.99 1uhw n THR 39 Ca 0.00 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.59 1uhw n THR 39 Cb 0.00 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.14 1uhw n THR 39 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uhw n GLY 40 N 0.00 -0.32 0.09 3.38 0.00 0.23 -4.10 105.19 104.47 1uhw n GLY 40 Ca 0.00 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.35 -0.07 -0.71 1.61 0.87 -1.43 -3.31 113.55 110.17 1uhw h SER 41 Ca -0.51 -0.57 0.16 0.00 -1.23 0.00 0.00 61.79 59.64 1uhw h SER 41 Cb 1.62 0.02 -0.12 0.00 -0.44 0.00 0.00 62.40 63.48 1uhw h SER 41 CO -0.19 0.63 0.07 1.23 -0.53 0.00 0.00 176.83 178.04 1uhw h GLY 42 N -0.87 0.87 -0.41 5.77 0.00 -1.85 0.44 103.07 107.01 1uhw h GLY 42 Ca -0.01 0.05 0.27 0.00 0.00 0.00 0.00 47.33 47.64 1uhw h GLY 42 CO 0.01 -0.23 0.46 -2.08 0.00 0.00 0.00 176.54 174.70 1uhw h VAL 43 N 0.17 0.36 0.07 4.60 2.07 -1.73 0.58 116.25 122.37 1uhw h VAL 43 Ca 0.39 -0.12 -0.23 0.00 0.82 0.00 0.00 66.70 67.56 1uhw h VAL 43 Cb 0.67 -0.01 0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1uhw h VAL 43 CO -0.57 0.06 -0.95 0.40 0.02 0.00 0.00 177.57 176.54 1uhw h ILE 44 N 0.34 1.37 -1.00 4.57 2.04 -0.38 -3.01 117.51 121.44 1uhw h ILE 44 Ca 0.65 -2.33 0.18 0.00 1.00 0.00 0.00 64.86 64.37 1uhw h ILE 44 Cb 1.38 2.71 -0.10 0.00 -0.74 0.00 0.00 36.82 40.07 1uhw h ILE 44 CO -0.59 0.69 0.61 -0.78 0.00 0.00 0.00 178.15 178.08 1uhw h ASP 45 N 0.06 0.79 -0.66 1.72 3.58 0.28 0.64 116.42 122.83 1uhw h ASP 45 Ca -0.14 0.09 -0.08 0.00 0.42 0.00 0.00 57.03 57.32 1uhw h ASP 45 Cb 1.66 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 42.63 1uhw h ASP 45 CO 0.18 0.29 0.09 -0.25 -2.88 0.00 0.00 179.24 176.67 1uhw h TRP 46 N 0.78 1.18 -0.32 0.28 7.01 -0.15 1.49 115.95 126.22 1uhw h TRP 46 Ca 0.57 -0.17 0.01 0.00 2.11 0.00 0.00 58.89 61.40 1uhw h TRP 46 Cb 0.86 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 27.58 1uhw h TRP 46 CO -0.01 0.99 0.21 -0.07 -2.79 0.00 0.00 178.44 176.77 1uhw h LEU 47 N 1.02 0.35 -0.14 0.65 3.38 0.24 0.11 115.31 120.92 1uhw h LEU 47 Ca 0.20 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.05 1uhw h LEU 47 Cb 0.47 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1uhw h LEU 47 CO 0.02 0.25 -0.35 0.58 0.09 0.00 0.00 178.44 179.03 1uhw h VAL 48 N 0.42 1.36 -0.63 1.22 2.07 -0.26 1.48 116.25 121.91 1uhw h VAL 48 Ca 0.12 -1.63 0.13 0.00 0.82 0.00 0.00 66.70 66.14 1uhw h VAL 48 Cb -0.04 2.03 -0.11 0.00 -1.52 0.00 0.00 31.29 31.65 1uhw h VAL 48 CO -0.03 0.49 -0.05 0.28 0.02 0.00 0.00 177.57 178.27 1uhw h SER 49 N 0.11 -0.39 1.89 0.57 0.02 0.24 0.55 113.55 116.54 1uhw h SER 49 Ca -0.00 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1uhw h SER 49 Cb 0.96 0.32 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1uhw h SER 49 CO 0.08 -0.15 -0.10 0.78 -1.14 0.00 0.00 176.83 176.29 1uhw h ASN 50 N 0.07 0.00 -2.84 3.07 2.35 -0.97 -3.48 115.58 113.78 1uhw h ASN 50 Ca 0.32 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.07 1uhw h ASN 50 Cb 0.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1uhw h ASN 50 CO -0.58 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 175.49 1uhw n LYS 51 N -3.04 0.00 -0.02 0.81 4.76 0.19 -5.01 118.16 115.86 1uhw n LYS 51 Ca 0.04 0.39 0.07 0.00 -2.87 0.00 0.00 58.31 55.93 1uhw n LYS 51 Cb 0.53 -1.42 -0.15 0.00 -1.84 0.00 0.00 35.03 32.15 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 -1.03 0.00 0.00 -0.35 4.77 0.47 -4.97 117.00 115.89 1uhw n LEU 52 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.93 1uhw n LEU 52 Cb 0.47 0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.61 1uhw n LEU 52 CO 0.00 0.06 -0.03 1.33 -1.33 0.00 0.00 177.39 177.42 1uhw n VAL 53 N -2.23 0.00 -0.02 4.08 0.24 -1.26 -5.04 118.33 114.10 1uhw n VAL 53 Ca -0.07 -0.45 0.04 0.00 -2.04 0.00 0.00 64.34 61.82 1uhw n VAL 53 Cb 0.58 0.17 -0.14 0.00 -1.47 0.00 0.00 33.84 32.98 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 -0.17 0.66 -3.84 7.34 1.74 -1.26 -4.93 116.66 116.20 1uhw n ARG 54 Ca -0.01 -0.07 -0.08 0.00 -0.77 0.00 0.00 57.85 56.92 1uhw n ARG 54 Cb 0.11 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 1uhw n ARG 54 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1uhw s ASN 55 N -5.01 -0.09 0.20 0.55 6.03 -1.26 -5.04 114.94 110.33 1uhw s ASN 55 Ca -0.07 -0.93 -0.10 0.00 -1.03 0.00 0.00 52.86 50.73 1uhw s ASN 55 Cb 0.11 0.79 0.15 0.00 -3.03 0.00 0.00 41.25 39.26 1uhw s ASN 55 CO 0.87 -1.53 1.83 0.03 -2.03 0.00 0.00 177.10 176.27 1uhw h ARG 56 N 2.01 1.03 -0.05 3.55 2.47 -1.95 -3.08 114.38 118.36 1uhw h ARG 56 Ca -0.26 -0.11 0.01 0.00 -1.26 0.00 0.00 59.98 58.35 1uhw h ARG 56 Cb 1.25 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 29.35 1uhw h ARG 56 CO 0.33 0.76 -0.15 0.37 0.56 0.00 0.00 179.97 181.84 1uhw h GLN 57 N 1.03 -0.14 -0.91 0.04 -0.00 -2.00 -0.30 115.11 112.83 1uhw h GLN 57 Ca 0.26 0.01 0.18 0.00 -0.00 0.00 0.00 58.65 59.10 1uhw h GLN 57 Cb 0.02 0.03 -0.17 0.00 0.00 0.00 0.00 27.48 27.36 1uhw h GLN 57 CO -0.04 -0.09 -0.23 -1.91 0.00 0.00 0.00 178.83 176.55 1uhw n GLU 58 N -3.35 -0.08 -0.23 1.69 2.13 -1.19 0.19 120.64 119.79 1uhw n GLU 58 Ca -0.01 1.41 0.00 0.00 0.66 0.00 0.00 57.16 59.22 1uhw n GLU 58 Cb 0.10 -2.11 0.12 0.00 0.27 0.00 0.00 31.44 29.82 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 0.98 -0.10 8.31 0.00 -1.17 -1.12 103.07 109.97 1uhw h GLY 59 Ca 0.43 -0.19 0.07 0.00 0.00 0.00 0.00 47.33 47.63 1uhw h GLY 59 CO -0.93 0.05 -0.36 -2.00 0.00 0.00 0.00 176.54 173.30 1uhw h LEU 60 N 0.55 -1.16 0.12 3.11 7.12 0.37 1.56 115.31 126.97 1uhw h LEU 60 Ca 0.33 0.18 0.01 0.00 0.13 0.00 0.00 57.88 58.54 1uhw h LEU 60 Cb 0.34 0.52 -0.03 0.00 -0.53 0.00 0.00 40.66 40.96 1uhw h LEU 60 CO -0.26 -0.35 -0.21 0.24 -0.13 0.00 0.00 178.44 177.72 1uhw h MET 61 N -0.33 -0.39 -0.06 1.25 0.00 -0.93 -2.37 114.93 112.11 1uhw h MET 61 Ca 0.14 0.03 0.03 0.00 0.00 0.00 0.00 59.70 59.89 1uhw h MET 61 Cb 0.56 0.09 -0.04 0.00 0.00 0.00 0.00 31.60 32.21 1uhw h MET 61 CO -0.49 -0.26 -0.15 0.82 0.00 0.00 0.00 176.91 176.84 1uhw h ILE 62 N -0.40 0.62 -0.96 -1.22 1.08 -0.36 -2.38 117.51 113.89 1uhw h ILE 62 Ca 0.03 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.62 1uhw h ILE 62 Cb 0.42 0.62 -0.14 0.00 -3.07 0.00 0.00 36.82 34.65 1uhw h ILE 62 CO -0.11 0.00 -0.45 -1.20 -0.69 0.00 0.00 178.15 175.70 1uhw n SER 63 N -5.29 -0.77 -0.23 1.72 7.64 0.52 0.14 113.62 117.35 1uhw n SER 63 Ca -0.04 1.69 0.02 0.00 1.01 0.00 0.00 58.87 61.55 1uhw n SER 63 Cb 0.20 -0.32 0.10 0.00 -1.01 0.00 0.00 64.21 63.18 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 1.01 0.58 -0.92 -0.43 0.00 -0.92 0.86 119.26 119.44 1uhw h ALA 64 Ca 0.27 0.23 0.15 0.00 0.00 0.00 0.00 54.91 55.56 1uhw h ALA 64 Cb 0.51 0.43 -0.08 0.00 0.00 0.00 0.00 17.79 18.65 1uhw h ALA 64 CO -0.94 -0.42 0.59 1.03 0.00 0.00 0.00 179.25 179.52 1uhw h SER 65 N 0.06 0.69 0.24 0.00 0.87 0.14 1.11 113.55 116.66 1uhw h SER 65 Ca 0.34 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.94 1uhw h SER 65 Cb 0.56 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1uhw h SER 65 CO -0.63 0.33 -0.12 -0.07 -0.53 0.00 0.00 176.83 175.81 1uhw h LEU 66 N 0.72 -0.28 0.42 2.23 3.38 0.20 -2.21 115.31 119.77 1uhw h LEU 66 Ca 0.47 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1uhw h LEU 66 Cb 0.75 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1uhw h LEU 66 CO -0.23 0.17 -0.39 0.25 0.09 0.00 0.00 178.44 178.32 1uhw h LEU 67 N -0.80 -1.05 -0.36 1.67 5.85 0.31 -1.02 115.31 119.92 1uhw h LEU 67 Ca -0.03 0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1uhw h LEU 67 Cb 0.51 0.35 -0.05 0.00 0.37 0.00 0.00 40.66 41.84 1uhw h LEU 67 CO 0.06 -0.55 -0.26 0.28 -0.34 0.00 0.00 178.44 177.62 1uhw h SER 68 N -0.82 -0.94 -1.06 1.25 0.02 0.12 0.72 113.55 112.84 1uhw h SER 68 Ca -0.04 0.14 0.42 0.00 -0.84 0.00 0.00 61.79 61.46 1uhw h SER 68 Cb 0.72 0.41 -0.16 0.00 0.14 0.00 0.00 62.40 63.51 1uhw h SER 68 CO -0.04 -0.13 0.61 -0.62 -1.14 0.00 0.00 176.83 175.50 1uhw n GLU 69 N -3.99 -0.05 0.00 3.45 -0.58 -0.83 -4.71 120.64 113.93 1uhw n GLU 69 Ca 0.00 1.28 0.00 0.00 -0.42 0.00 0.00 57.16 58.02 1uhw n GLU 69 Cb 0.13 -2.36 0.00 0.00 -0.57 0.00 0.00 31.44 28.64 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 -1.32 1.77 0.09 0.62 0.00 0.25 -5.00 105.19 101.60 1uhw n GLY 70 Ca 0.37 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.52 1uhw n GLY 70 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1uhw n TYR 71 N -0.54 0.81 -3.72 1.61 4.01 -0.42 -4.65 117.16 114.27 1uhw n TYR 71 Ca 0.00 0.24 -0.23 0.00 -0.16 0.00 0.00 57.90 57.75 1uhw n TYR 71 Cb 0.00 -0.86 -0.18 0.00 -0.31 0.00 0.00 39.34 38.00 1uhw n TYR 71 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1uhw s LEU 72 N -4.41 0.47 0.06 7.72 1.43 -1.25 -4.34 118.68 118.35 1uhw s LEU 72 Ca 0.10 -0.17 -0.20 0.00 -1.03 0.00 0.00 54.13 52.83 1uhw s LEU 72 Cb 0.13 -0.33 -0.06 0.00 0.03 0.00 0.00 46.19 45.95 1uhw s LEU 72 CO 0.63 -0.24 0.60 -1.10 0.23 0.00 0.00 176.35 176.46 1uhw s GLN 73 N 2.05 4.27 0.33 1.70 -1.52 0.49 -4.70 119.66 122.27 1uhw s GLN 73 Ca 0.04 0.77 -0.27 0.00 -1.95 0.00 0.00 55.36 53.95 1uhw s GLN 73 Cb -0.13 -3.27 -0.09 0.00 -0.22 0.00 0.00 33.01 29.29 1uhw s GLN 73 CO -0.05 0.54 1.07 -1.25 -0.25 0.00 0.00 175.29 175.35 1uhw s PRO 74 N -0.81 4.44 -0.14 2.91 0.04 -1.26 -1.03 135.00 139.14 1uhw s PRO 74 Ca 0.30 1.66 -0.03 0.00 0.04 0.00 0.00 61.00 62.97 1uhw s PRO 74 Cb -0.19 -2.90 0.05 0.00 0.04 0.00 0.00 34.50 31.49 1uhw s PRO 74 CO 0.19 0.07 0.05 0.00 0.04 0.00 0.00 177.00 177.34 1uhw s ALA 75 N -1.39 0.70 0.00 8.56 0.00 -1.07 -4.93 121.76 123.63 1uhw s ALA 75 Ca 0.50 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.10 1uhw s ALA 75 Cb -0.27 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1uhw s ALA 75 CO 0.34 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.58 1uhw n GLY 76 N 5.16 0.39 1.80 0.00 0.00 -1.26 -4.37 105.19 106.91 1uhw n GLY 76 Ca -0.07 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 0.00 0.00 1.61 9.92 -1.26 -4.81 116.55 122.01 1uhw n ASP 77 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1uhw n ASP 77 Cb 0.00 0.20 0.00 0.00 -0.64 0.00 0.00 41.12 40.68 1uhw n ASP 77 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1uhw n LEU 78 N -2.40 0.00 -0.35 0.64 7.94 -1.26 0.11 117.00 121.68 1uhw n LEU 78 Ca 0.00 0.75 0.26 0.00 -1.11 0.00 0.00 56.01 55.91 1uhw n LEU 78 Cb 0.00 -0.25 0.54 0.00 0.53 0.00 0.00 43.42 44.25 1uhw n LEU 78 CO 0.00 -0.25 1.22 0.28 -1.11 0.00 0.00 177.39 177.54 1uhw h SER 79 N 0.00 0.39 -0.31 1.96 0.02 -1.91 0.59 113.55 114.29 1uhw h SER 79 Ca 0.00 0.09 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1uhw h SER 79 Cb 0.00 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 1uhw h SER 79 CO 0.00 0.03 0.17 0.11 -1.14 0.00 0.00 176.83 176.00 1uhw h LYS 80 N 0.32 0.35 0.00 3.45 1.57 -1.37 0.15 116.57 121.03 1uhw h LYS 80 Ca 0.64 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.40 1uhw h LYS 80 Cb 1.74 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.97 1uhw h LYS 80 CO -0.32 0.23 0.10 -0.91 -0.57 0.00 0.00 179.45 177.99 1uhw h ASN 81 N 0.36 0.00 0.26 0.86 2.35 0.64 -1.23 115.58 118.82 1uhw h ASN 81 Ca 0.12 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1uhw h ASN 81 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 1uhw h ASN 81 CO -0.06 0.00 -0.13 0.00 -1.65 0.00 0.00 177.43 175.59 1uhw h ALA 82 N 1.77 -0.35 0.00 -0.83 0.00 -0.35 -3.01 119.26 116.48 1uhw h ALA 82 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1uhw h ALA 82 Cb 0.21 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1uhw h ALA 82 CO 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 179.25 178.86 1uhw n ALA 83 N -2.64 1.17 0.12 0.00 0.00 -0.55 -2.72 120.51 115.88 1uhw n ALA 83 Ca -0.07 0.15 -0.09 0.00 0.00 0.00 0.00 53.44 53.42 1uhw n ALA 83 Cb 0.24 -1.29 -0.05 0.00 0.00 0.00 0.00 19.45 18.35 1uhw n ALA 83 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1uhw h ASP 84 N 0.00 -0.76 0.00 0.00 3.58 -1.18 -3.46 116.42 114.60 1uhw h ASP 84 Ca 0.00 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.52 1uhw h ASP 84 Cb 0.07 0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.39 1uhw h ASP 84 CO 0.00 -0.33 0.00 0.61 -2.88 0.00 0.00 179.24 176.64 1uhw n GLY 85 N -1.28 0.00 0.00 -0.78 0.00 -1.10 -5.09 105.19 96.94 1uhw n GLY 85 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 -0.61 5.41 -1.23 -5.02 119.36 117.91 1uhw n ILE 86 Ca 0.00 1.11 0.00 0.00 1.00 0.00 0.00 62.75 64.86 1uhw n ILE 86 Cb 0.00 -2.04 0.00 0.00 -0.71 0.00 0.00 39.64 36.89 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 -1.57 0.00 -0.40 -1.39 0.00 -1.26 -5.02 120.51 110.87 1uhw n ALA 87 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1uhw n ALA 87 Cb 0.00 0.00 0.29 0.00 0.00 0.00 0.00 19.45 19.74 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 2.98 -3.69 0.00 2.13 -1.26 -4.68 120.64 116.11 1uhw n GLU 88 Ca 0.00 -2.59 -0.29 0.00 0.66 0.00 0.00 57.16 54.94 1uhw n GLU 88 Cb 0.00 -1.58 -0.12 0.00 0.27 0.00 0.00 31.44 30.01 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 -1.01 3.47 0.47 4.31 -0.87 -1.26 -4.92 114.94 115.12 1uhw s ASN 89 Ca 0.44 -3.04 0.27 0.00 -1.57 0.00 0.00 52.86 48.96 1uhw s ASN 89 Cb 0.24 -1.06 0.80 0.00 -0.02 0.00 0.00 41.25 41.21 1uhw s ASN 89 CO 0.27 -0.20 1.77 1.55 -2.57 0.00 0.00 177.10 177.92 1uhw h PRO 90 N 6.15 0.00 -6.22 -0.60 0.13 -1.83 -3.44 132.00 126.20 1uhw h PRO 90 Ca 0.09 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.67 1uhw h PRO 90 Cb 0.88 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.97 1uhw h PRO 90 CO 0.52 0.08 0.19 0.12 -0.23 0.00 0.00 178.00 178.68 1uhw s PHE 91 N -3.43 3.65 -0.38 1.56 5.36 -1.26 -4.50 117.98 118.98 1uhw s PHE 91 Ca 0.04 1.44 -0.10 0.00 -0.96 0.00 0.00 56.93 57.35 1uhw s PHE 91 Cb 0.08 -2.90 0.04 0.00 -0.34 0.00 0.00 43.02 39.90 1uhw s PHE 91 CO 0.62 0.11 0.20 -0.51 -1.46 0.00 0.00 175.22 174.18 1uhw s LEU 92 N 0.62 4.75 -0.71 6.12 1.02 -1.26 -4.93 118.68 124.30 1uhw s LEU 92 Ca 0.42 -1.15 -0.18 0.00 0.02 0.00 0.00 54.13 53.23 1uhw s LEU 92 Cb -0.19 -1.98 -0.15 0.00 0.02 0.00 0.00 46.19 43.89 1uhw s LEU 92 CO 0.22 -0.41 1.90 -0.67 0.02 0.00 0.00 176.35 177.41 1uhw n ASP 93 N 4.94 2.81 -3.88 2.29 2.03 -1.26 -4.31 116.55 119.16 1uhw n ASP 93 Ca -0.12 -2.56 -0.11 0.00 0.52 0.00 0.00 54.79 52.53 1uhw n ASP 93 Cb 0.45 -1.03 -0.09 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 4.82 0.06 0.00 1.67 0.15 -1.26 -4.72 113.70 114.42 1uhw s SER 94 Ca 0.52 -0.33 0.22 0.00 0.70 0.00 0.00 55.95 57.06 1uhw s SER 94 Cb 0.13 0.23 1.02 0.00 -1.71 0.00 0.00 66.02 65.69 1uhw s SER 94 CO 0.10 -0.45 1.72 -0.81 1.20 0.00 0.00 173.24 174.99 1uhw n PRO 95 N 1.08 0.12 0.00 5.44 -0.04 -1.26 -1.41 135.00 138.93 1uhw n PRO 95 Ca -0.21 0.10 -0.08 0.00 -0.04 0.00 0.00 63.50 63.28 1uhw n PRO 95 Cb 0.57 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.47 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 -0.10 -2.23 3.54 3.32 -1.95 -3.43 116.42 115.56 1uhw h ASP 96 Ca 0.00 -0.35 -0.59 0.00 0.02 0.00 0.00 57.03 56.11 1uhw h ASP 96 Cb 0.31 0.03 0.05 0.00 0.22 0.00 0.00 39.33 39.94 1uhw h ASP 96 CO 0.00 0.53 0.81 0.00 -1.72 0.00 0.00 179.24 178.86 1uhw n ALA 97 N -2.67 1.24 -2.60 3.45 0.00 -1.21 -4.88 120.51 113.84 1uhw n ALA 97 Ca -0.06 0.44 -0.32 0.00 0.00 0.00 0.00 53.44 53.50 1uhw n ALA 97 Cb 0.22 -2.35 -0.14 0.00 0.00 0.00 0.00 19.45 17.17 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 1.15 2.63 0.09 0.00 0.08 -1.26 -0.60 117.98 120.06 1uhw s PHE 98 Ca 0.80 -0.37 0.02 0.00 0.12 0.00 0.00 56.93 57.50 1uhw s PHE 98 Cb -0.69 -1.64 -0.04 0.00 -0.57 0.00 0.00 43.02 40.08 1uhw s PHE 98 CO 0.39 0.02 -0.07 0.71 -0.10 0.00 0.00 175.22 176.18 1uhw s TYR 99 N -0.44 0.84 -0.05 0.36 2.02 -1.24 -2.61 117.35 116.23 1uhw s TYR 99 Ca 0.05 -0.84 -0.18 0.00 -0.37 0.00 0.00 57.07 55.73 1uhw s TYR 99 Cb -0.12 -0.49 0.04 0.00 -0.40 0.00 0.00 41.96 40.99 1uhw s TYR 99 CO 0.02 -0.14 0.41 1.52 -1.57 0.00 0.00 175.55 175.78 1uhw s TYR 100 N -3.21 -0.34 0.58 2.71 1.13 -0.20 0.13 117.35 118.16 1uhw s TYR 100 Ca 0.08 0.63 -0.19 0.00 -1.41 0.00 0.00 57.07 56.17 1uhw s TYR 100 Cb 0.02 0.17 -0.04 0.00 -1.10 0.00 0.00 41.96 41.02 1uhw s TYR 100 CO -0.04 -0.40 1.18 -0.06 -2.51 0.00 0.00 175.55 173.72 1uhw s PHE 101 N -0.98 2.49 -1.15 -3.49 0.08 -1.26 0.18 117.98 113.85 1uhw s PHE 101 Ca -0.10 1.53 -0.19 0.00 0.12 0.00 0.00 56.93 58.29 1uhw s PHE 101 Cb -0.04 -3.40 -0.04 0.00 -0.57 0.00 0.00 43.02 38.97 1uhw s PHE 101 CO 0.05 -1.98 1.98 -0.35 -0.10 0.00 0.00 175.22 174.82 1uhw n PRO 102 N -1.53 2.24 0.00 0.24 -0.04 -1.26 -2.65 135.00 132.00 1uhw n PRO 102 Ca 0.13 -2.46 0.00 0.00 -0.04 0.00 0.00 63.50 61.13 1uhw n PRO 102 Cb 0.50 -3.29 0.00 0.00 -0.04 0.00 0.00 33.50 30.67 1uhw n PRO 102 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1uhw n ASP 103 N 8.51 0.00 -4.90 3.54 5.68 -1.26 -5.13 116.55 122.99 1uhw n ASP 103 Ca 0.49 0.00 -0.21 0.00 -0.50 0.00 0.00 54.79 54.58 1uhw n ASP 103 Cb 0.42 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.38 1uhw n ASP 103 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1uhw s SER 104 N 0.00 5.09 0.00 -1.12 0.01 -1.08 -5.06 113.70 111.53 1uhw s SER 104 Ca 0.00 -0.74 0.00 0.00 1.31 0.00 0.00 55.95 56.52 1uhw s SER 104 Cb 0.00 -0.51 0.00 0.00 0.21 0.00 0.00 66.02 65.72 1uhw s SER 104 CO 0.00 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.56 1uhw n GLY 105 N -1.61 0.77 3.78 3.44 0.00 -1.09 -4.46 105.19 106.03 1uhw n GLY 105 Ca 0.04 -1.72 -0.29 0.00 0.00 0.00 0.00 46.02 44.05 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 -1.84 0.79 -0.09 1.61 0.04 -0.26 -4.21 135.00 131.04 1uhw s PRO 106 Ca 0.00 0.16 -0.00 0.00 0.04 0.00 0.00 61.00 61.20 1uhw s PRO 106 Cb 0.00 -1.81 0.02 0.00 0.04 0.00 0.00 34.50 32.75 1uhw s PRO 106 CO 0.00 -2.41 -0.07 -1.12 0.04 0.00 0.00 177.00 173.44 1uhw s SER 107 N -4.12 1.93 0.06 6.66 0.01 -1.26 -5.00 113.70 111.98 1uhw s SER 107 Ca 0.66 -0.26 -0.26 0.00 1.31 0.00 0.00 55.95 57.40 1uhw s SER 107 Cb -0.13 -0.75 0.08 0.00 0.21 0.00 0.00 66.02 65.43 1uhw s SER 107 CO 0.54 -0.10 0.69 -0.94 0.41 0.00 0.00 173.24 173.84 1uhw s SER 108 N 1.51 -0.54 0.00 2.44 1.04 -1.26 -5.15 113.70 111.74 1uhw s SER 108 Ca 0.01 0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1uhw s SER 108 Cb -0.13 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1uhw s SER 108 CO -0.05 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 173.99