#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 -7.92 -4.88 1.61 3.41 -1.26 -5.00 113.62 99.58 1uhw n SER 2 Ca 0.00 0.48 -0.36 0.00 -0.26 0.00 0.00 58.87 58.73 1uhw n SER 2 Cb 0.00 -5.37 -0.06 0.00 -0.26 0.00 0.00 64.21 58.52 1uhw n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1uhw s SER 3 N -2.64 6.46 0.00 4.04 0.01 -1.26 -4.99 113.70 115.32 1uhw s SER 3 Ca 0.22 0.52 0.00 0.00 1.31 0.00 0.00 55.95 58.01 1uhw s SER 3 Cb -0.06 -2.08 0.00 0.00 0.21 0.00 0.00 66.02 64.09 1uhw s SER 3 CO 0.76 0.32 0.00 0.61 0.41 0.00 0.00 173.24 175.34 1uhw n GLY 4 N 1.47 0.71 3.55 3.44 0.00 -1.26 -4.82 105.19 108.27 1uhw n GLY 4 Ca -0.15 -0.71 -0.23 0.00 0.00 0.00 0.00 46.02 44.93 1uhw n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uhw n SER 5 N -4.00 -6.07 -4.52 1.61 2.88 -1.26 -4.76 113.62 97.50 1uhw n SER 5 Ca 0.00 -0.54 -0.35 0.00 -1.33 0.00 0.00 58.87 56.65 1uhw n SER 5 Cb 0.00 -4.96 -0.11 0.00 -0.75 0.00 0.00 64.21 58.39 1uhw n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1uhw n SER 6 N -2.95 0.97 0.00 -3.46 7.64 -1.26 -2.60 113.62 111.96 1uhw n SER 6 Ca -0.01 -0.26 0.00 0.00 1.01 0.00 0.00 58.87 59.61 1uhw n SER 6 Cb 0.57 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 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 6.25 0.95 0.32 0.23 0.00 -1.26 -4.92 105.19 106.76 1uhw n GLY 7 Ca 0.54 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 46.43 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 -0.55 0.00 0.99 4.07 -1.88 -1.93 115.31 116.01 1uhw h LEU 8 Ca 0.00 0.25 0.00 0.00 0.08 0.00 0.00 57.88 58.21 1uhw h LEU 8 Cb 0.00 0.46 0.00 0.00 1.08 0.00 0.00 40.66 42.20 1uhw h LEU 8 CO 0.00 -0.28 0.00 0.61 -1.08 0.00 0.00 178.44 177.69 1uhw n GLY 9 N -1.50 -3.09 0.32 0.83 0.00 -1.19 0.31 105.19 100.87 1uhw n GLY 9 Ca 0.17 0.66 0.16 0.00 0.00 0.00 0.00 46.02 47.01 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 -1.62 1.43 -0.09 4.61 0.00 -1.76 0.74 119.26 122.57 1uhw h ALA 10 Ca 0.00 0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1uhw h ALA 10 Cb 0.00 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1uhw h ALA 10 CO 0.00 -0.52 -0.06 1.25 0.00 0.00 0.00 179.25 179.91 1uhw h LEU 11 N 0.19 -0.21 -0.22 0.00 6.46 0.39 -2.26 115.31 119.67 1uhw h LEU 11 Ca 0.61 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 58.43 1uhw h LEU 11 Cb 1.29 0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 41.31 1uhw h LEU 11 CO -0.68 -0.09 0.09 0.22 -0.62 0.00 0.00 178.44 177.36 1uhw h TYR 12 N -0.07 0.17 -1.08 1.25 3.20 1.09 -1.36 116.97 120.16 1uhw h TYR 12 Ca 0.06 0.01 0.31 0.00 3.14 0.00 0.00 58.73 62.25 1uhw h TYR 12 Cb 0.16 -0.04 -0.12 0.00 1.54 0.00 0.00 36.73 38.27 1uhw h TYR 12 CO -0.18 0.09 0.67 -0.07 -1.64 0.00 0.00 178.16 177.03 1uhw h LEU 13 N 0.20 0.46 0.13 2.82 4.07 -0.13 0.22 115.31 123.08 1uhw h LEU 13 Ca 0.09 0.13 -0.01 0.00 0.08 0.00 0.00 57.88 58.17 1uhw h LEU 13 Cb 0.04 0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.85 1uhw h LEU 13 CO -0.08 -0.02 -0.06 0.28 -1.08 0.00 0.00 178.44 177.48 1uhw h SER 14 N 0.34 -0.15 -0.67 -0.43 0.02 -0.72 -2.95 113.55 109.00 1uhw h SER 14 Ca 0.68 -0.37 0.20 0.00 -0.84 0.00 0.00 61.79 61.46 1uhw h SER 14 Cb 1.72 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 64.27 1uhw h SER 14 CO -0.43 0.33 0.83 0.24 -1.14 0.00 0.00 176.83 176.67 1uhw h MET 15 N -0.67 0.00 -0.41 3.45 2.86 0.21 1.39 114.93 121.76 1uhw h MET 15 Ca -0.02 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.48 1uhw h MET 15 Cb 0.51 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 1uhw h MET 15 CO 0.03 0.00 -0.29 0.87 1.06 0.00 0.00 176.91 178.58 1uhw h LYS 16 N 0.00 0.91 -6.08 1.72 1.57 -1.13 -2.95 116.57 110.62 1uhw h LYS 16 Ca 0.32 -0.44 -0.60 0.00 -1.87 0.00 0.00 60.65 58.06 1uhw h LYS 16 Cb 1.98 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.29 1uhw h LYS 16 CO -0.00 1.09 1.40 -3.47 -0.57 0.00 0.00 179.45 177.90 1uhw n ASP 17 N -4.13 3.26 0.00 0.86 -0.08 0.48 -4.79 116.55 112.14 1uhw n ASP 17 Ca -0.02 0.43 0.12 0.00 -1.51 0.00 0.00 54.79 53.81 1uhw n ASP 17 Cb 0.49 -1.49 0.70 0.00 2.34 0.00 0.00 41.12 43.16 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 8.26 0.70 0.01 -0.67 -0.04 -1.26 0.90 135.00 142.89 1uhw n PRO 18 Ca 0.29 0.01 -0.01 0.00 -0.04 0.00 0.00 63.50 63.75 1uhw n PRO 18 Cb 0.39 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.35 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 0.03 -0.72 0.54 1.02 -1.26 -4.71 120.64 114.50 1uhw n GLU 19 Ca 0.17 0.01 0.08 0.00 -0.02 0.00 0.00 57.16 57.40 1uhw n GLU 19 Cb 0.10 -0.55 0.37 0.00 -0.02 0.00 0.00 31.44 31.33 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 -3.19 4.14 0.00 3.49 4.76 -1.24 -4.93 118.16 121.19 1uhw n LYS 20 Ca -0.02 -2.87 0.00 0.00 -2.87 0.00 0.00 58.31 52.55 1uhw n LYS 20 Cb 0.39 -2.04 0.00 0.00 -1.84 0.00 0.00 35.03 31.53 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 0.88 5.40 3.78 0.72 0.00 0.26 -4.81 105.19 111.42 1uhw n GLY 21 Ca 0.26 -1.31 -0.34 0.00 0.00 0.00 0.00 46.02 44.63 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 0.25 3.29 0.42 -0.61 1.01 -1.08 -4.77 121.20 119.71 1uhw s ILE 22 Ca 0.00 0.74 -0.02 0.00 0.00 0.00 0.00 60.65 61.37 1uhw s ILE 22 Cb 0.00 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.18 1uhw s ILE 22 CO 0.00 -0.24 0.66 -0.54 0.00 0.00 0.00 174.94 174.83 1uhw s LYS 23 N -3.53 3.40 -0.28 2.79 -0.14 -1.26 -4.15 119.74 116.56 1uhw s LYS 23 Ca 0.70 -0.18 0.02 0.00 -1.36 0.00 0.00 55.97 55.15 1uhw s LYS 23 Cb -0.22 -2.53 0.08 0.00 -1.68 0.00 0.00 37.83 33.48 1uhw s LYS 23 CO 0.30 -0.08 -0.00 -1.21 -0.76 0.00 0.00 175.35 173.60 1uhw s GLU 24 N -4.53 1.49 0.36 1.68 2.02 -1.26 -4.73 118.70 113.74 1uhw s GLU 24 Ca 0.44 -1.30 0.08 0.00 0.02 0.00 0.00 54.97 54.21 1uhw s GLU 24 Cb -0.10 -2.70 -0.04 0.00 0.10 0.00 0.00 34.13 31.40 1uhw s GLU 24 CO 0.40 -0.76 0.23 -0.51 0.02 0.00 0.00 175.26 174.63 1uhw s LEU 25 N 1.26 3.36 -0.18 1.80 2.01 -1.22 -4.79 118.68 120.92 1uhw s LEU 25 Ca 0.01 -0.73 -0.08 0.00 0.01 0.00 0.00 54.13 53.35 1uhw s LEU 25 Cb -0.19 -1.89 -0.04 0.00 0.01 0.00 0.00 46.19 44.08 1uhw s LEU 25 CO -0.10 -0.41 0.08 0.54 1.01 0.00 0.00 176.35 177.47 1uhw s ASN 26 N -3.95 5.77 -0.00 2.29 2.20 -1.26 -3.85 114.94 116.13 1uhw s ASN 26 Ca 0.41 0.14 0.02 0.00 -0.94 0.00 0.00 52.86 52.48 1uhw s ASN 26 Cb -0.03 -1.97 -0.00 0.00 -2.00 0.00 0.00 41.25 37.25 1uhw s ASN 26 CO 0.25 0.20 -0.05 -0.76 -2.94 0.00 0.00 177.10 173.80 1uhw s LEU 27 N 0.21 1.99 -0.37 3.54 2.01 -0.81 -4.99 118.68 120.26 1uhw s LEU 27 Ca 0.05 -0.09 0.02 0.00 0.01 0.00 0.00 54.13 54.12 1uhw s LEU 27 Cb -0.12 -0.26 0.10 0.00 0.01 0.00 0.00 46.19 45.92 1uhw s LEU 27 CO 0.00 0.06 0.11 -0.70 1.01 0.00 0.00 176.35 176.82 1uhw s GLU 28 N -0.08 1.66 0.08 1.70 2.12 -1.26 0.13 118.70 123.05 1uhw s GLU 28 Ca 0.02 -1.88 -0.32 0.00 0.36 0.00 0.00 54.97 53.15 1uhw s GLU 28 Cb -0.02 -3.33 -0.15 0.00 0.26 0.00 0.00 34.13 30.89 1uhw s GLU 28 CO -0.00 -0.99 1.50 -0.22 -0.54 0.00 0.00 175.26 175.01 1uhw h LYS 29 N 7.72 -0.79 0.00 4.30 3.64 -1.95 -3.45 116.57 126.04 1uhw h LYS 29 Ca -0.07 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1uhw h LYS 29 Cb 1.03 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1uhw h LYS 29 CO 0.58 -0.53 0.00 -0.25 -2.27 0.00 0.00 179.45 176.99 1uhw n ASP 30 N -5.18 0.00 0.00 4.20 9.92 -1.26 -4.95 116.55 119.27 1uhw n ASP 30 Ca -0.10 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.16 1uhw n ASP 30 Cb 0.40 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.88 1uhw n ASP 30 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1uhw n LYS 31 N -2.08 1.09 -3.75 -1.24 5.02 -1.26 -5.00 118.16 110.95 1uhw n LYS 31 Ca 0.00 -0.85 -0.37 0.00 -2.02 0.00 0.00 58.31 55.06 1uhw n LYS 31 Cb 0.00 -0.77 -0.12 0.00 -0.02 0.00 0.00 35.03 34.11 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 -0.41 3.11 -0.82 1.97 1.02 -1.26 -5.04 119.74 118.31 1uhw s LYS 32 Ca 0.00 -0.85 -0.22 0.00 0.02 0.00 0.00 55.97 54.92 1uhw s LYS 32 Cb 0.00 -3.40 0.07 0.00 -0.52 0.00 0.00 37.83 33.99 1uhw s LYS 32 CO 0.00 -0.44 1.16 0.08 -0.92 0.00 0.00 175.35 175.23 1uhw s VAL 33 N 1.51 4.24 -0.66 3.17 1.01 -1.26 -3.14 120.40 125.27 1uhw s VAL 33 Ca 0.03 -0.62 -0.27 0.00 0.00 0.00 0.00 61.98 61.11 1uhw s VAL 33 Cb -0.17 -4.83 0.02 0.00 0.00 0.00 0.00 36.38 31.40 1uhw s VAL 33 CO 0.03 -1.64 1.42 -0.36 0.00 0.00 0.00 175.10 174.55 1uhw s PHE 34 N 4.19 2.18 0.19 5.22 0.08 0.12 -4.84 117.98 125.12 1uhw s PHE 34 Ca 0.32 0.26 0.04 0.00 0.12 0.00 0.00 56.93 57.68 1uhw s PHE 34 Cb -0.09 -4.46 -0.03 0.00 -0.57 0.00 0.00 43.02 37.87 1uhw s PHE 34 CO 0.02 -2.07 0.26 -0.80 -0.10 0.00 0.00 175.22 172.53 1uhw s ASN 35 N 4.70 6.04 -1.50 1.36 0.01 -1.26 -1.92 114.94 122.37 1uhw s ASN 35 Ca 0.46 0.01 -0.11 0.00 -0.71 0.00 0.00 52.86 52.51 1uhw s ASN 35 Cb -0.09 -1.72 0.07 0.00 0.41 0.00 0.00 41.25 39.92 1uhw s ASN 35 CO 0.19 0.01 0.90 1.41 -1.51 0.00 0.00 177.10 178.09 1uhw n HIS 36 N -0.86 -2.17 -4.51 2.20 8.25 -1.26 -2.11 115.22 114.76 1uhw n HIS 36 Ca -0.08 0.88 -0.22 0.00 -0.26 0.00 0.00 57.72 58.04 1uhw n HIS 36 Cb 0.56 -3.96 -0.05 0.00 1.12 0.00 0.00 29.99 27.66 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 0.00 0.00 -3.64 0.00 4.77 0.50 -3.43 117.00 115.19 1uhw n LEU 38 Ca -0.14 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.78 1uhw n LEU 38 Cb 0.45 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.47 1uhw n LEU 38 CO 0.24 0.00 0.34 0.42 -1.33 0.00 0.00 177.39 177.06 1uhw s THR 39 N 1.82 -0.08 0.18 -5.08 -4.23 -1.26 -4.04 115.64 102.94 1uhw s THR 39 Ca 0.00 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.33 1uhw s THR 39 Cb 0.00 -1.00 0.14 0.00 1.34 0.00 0.00 72.50 72.98 1uhw s THR 39 CO 0.00 0.00 1.34 0.61 -0.54 0.00 0.00 174.62 176.03 1uhw n GLY 40 N 4.41 -1.91 0.06 3.99 0.00 -1.18 0.19 105.19 110.75 1uhw n GLY 40 Ca -0.19 0.98 -0.12 0.00 0.00 0.00 0.00 46.02 46.69 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 0.03 -0.26 1.61 0.87 -1.68 -2.93 113.55 111.18 1uhw h SER 41 Ca 0.26 -0.25 0.06 0.00 -1.23 0.00 0.00 61.79 60.63 1uhw h SER 41 Cb 0.47 -0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.36 1uhw h SER 41 CO -0.85 0.27 -0.18 1.23 -0.53 0.00 0.00 176.83 176.77 1uhw h GLY 42 N -0.21 -0.01 -0.46 5.77 0.00 -0.55 0.49 103.07 108.10 1uhw h GLY 42 Ca 0.01 0.23 0.14 0.00 0.00 0.00 0.00 47.33 47.71 1uhw h GLY 42 CO 0.00 -0.18 -0.19 -2.08 0.00 0.00 0.00 176.54 174.09 1uhw h VAL 43 N -0.17 0.26 0.00 4.60 2.07 0.21 1.45 116.25 124.68 1uhw h VAL 43 Ca 0.14 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.58 1uhw h VAL 43 Cb 0.39 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1uhw h VAL 43 CO -0.36 0.00 -0.41 0.40 0.02 0.00 0.00 177.57 177.22 1uhw h ILE 44 N -0.01 1.16 -0.63 4.57 2.04 -1.06 -2.68 117.51 120.90 1uhw h ILE 44 Ca 0.34 -1.46 -0.02 0.00 1.00 0.00 0.00 64.86 64.72 1uhw h ILE 44 Cb 0.53 1.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 1uhw h ILE 44 CO -0.75 0.40 0.32 -0.78 0.00 0.00 0.00 178.15 177.34 1uhw h ASP 45 N 0.00 0.81 -0.20 1.72 1.82 0.67 0.18 116.42 121.41 1uhw h ASP 45 Ca -0.00 -0.12 -0.05 0.00 -0.39 0.00 0.00 57.03 56.47 1uhw h ASP 45 Cb 0.78 -0.21 -0.02 0.00 0.68 0.00 0.00 39.33 40.57 1uhw h ASP 45 CO 0.05 0.70 -0.02 -0.25 -1.61 0.00 0.00 179.24 178.11 1uhw h TRP 46 N 0.86 0.52 0.28 0.28 7.01 -0.13 1.49 115.95 126.26 1uhw h TRP 46 Ca 0.22 -0.05 -0.01 0.00 2.11 0.00 0.00 58.89 61.15 1uhw h TRP 46 Cb 0.09 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 27.00 1uhw h TRP 46 CO -0.00 0.53 -0.13 -0.07 -2.79 0.00 0.00 178.44 175.97 1uhw h LEU 47 N 0.48 -0.32 -0.73 0.65 3.38 -0.96 -1.23 115.31 116.58 1uhw h LEU 47 Ca 0.10 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 1uhw h LEU 47 Cb 0.34 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1uhw h LEU 47 CO 0.01 0.00 -0.12 0.58 0.09 0.00 0.00 178.44 179.01 1uhw h VAL 48 N -0.66 1.26 -0.46 1.22 2.07 -0.40 1.61 116.25 120.90 1uhw h VAL 48 Ca -0.04 -1.21 0.08 0.00 0.82 0.00 0.00 66.70 66.35 1uhw h VAL 48 Cb 0.46 1.03 -0.07 0.00 -1.52 0.00 0.00 31.29 31.20 1uhw h VAL 48 CO 0.06 0.42 0.06 0.28 0.02 0.00 0.00 177.57 178.41 1uhw h SER 49 N 0.76 -0.05 1.68 0.57 0.02 0.22 0.54 113.55 117.29 1uhw h SER 49 Ca 0.12 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1uhw h SER 49 Cb 0.63 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.30 1uhw h SER 49 CO 0.04 0.01 -0.20 0.78 -1.14 0.00 0.00 176.83 176.32 1uhw h ASN 50 N 0.19 0.00 -0.99 3.07 2.35 -1.00 -3.48 115.58 115.73 1uhw h ASN 50 Ca 0.23 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1uhw h ASN 50 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1uhw h ASN 50 CO -0.32 0.01 0.00 0.29 -1.65 0.00 0.00 177.43 175.76 1uhw n LYS 51 N -2.83 0.00 0.20 0.81 4.76 0.15 -4.96 118.16 116.29 1uhw n LYS 51 Ca 0.04 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.55 1uhw n LYS 51 Cb 0.51 -2.06 0.39 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 0.18 -3.46 115.31 115.07 1uhw h LEU 52 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1uhw h LEU 52 Cb 0.82 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1uhw h LEU 52 CO 0.00 0.32 -0.12 1.33 0.09 0.00 0.00 178.44 180.06 1uhw n VAL 53 N -3.51 0.00 -0.05 1.22 0.24 -1.26 -5.03 118.33 109.94 1uhw n VAL 53 Ca -0.00 -0.62 -0.04 0.00 -2.04 0.00 0.00 64.34 61.64 1uhw n VAL 53 Cb 0.47 0.22 -0.15 0.00 -1.47 0.00 0.00 33.84 32.91 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 -0.24 0.67 -3.99 7.34 1.74 -1.26 -4.90 116.66 116.03 1uhw n ARG 54 Ca -0.01 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.97 1uhw n ARG 54 Cb 0.16 -1.58 -0.04 0.00 -1.02 0.00 0.00 32.46 29.98 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 -5.35 0.06 0.21 0.55 2.20 -1.26 -5.05 114.94 106.31 1uhw s ASN 55 Ca -0.08 -1.01 -0.10 0.00 -0.94 0.00 0.00 52.86 50.73 1uhw s ASN 55 Cb 0.08 0.63 0.17 0.00 -2.00 0.00 0.00 41.25 40.14 1uhw s ASN 55 CO 0.85 -1.23 1.88 0.03 -2.94 0.00 0.00 177.10 175.69 1uhw h ARG 56 N 2.19 1.00 -0.09 3.55 2.47 -1.95 -3.06 114.38 118.49 1uhw h ARG 56 Ca -0.26 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.41 1uhw h ARG 56 Cb 1.25 -0.23 -0.03 0.00 -1.65 0.00 0.00 29.97 29.32 1uhw h ARG 56 CO 0.35 0.66 -0.20 0.37 0.56 0.00 0.00 179.97 181.72 1uhw h GLN 57 N 1.03 -0.17 -0.91 0.04 -0.00 -1.99 0.56 115.11 113.66 1uhw h GLN 57 Ca 0.29 0.01 0.20 0.00 -0.00 0.00 0.00 58.65 59.15 1uhw h GLN 57 Cb -0.10 0.04 -0.17 0.00 0.00 0.00 0.00 27.48 27.24 1uhw h GLN 57 CO -0.07 -0.12 -0.17 0.39 0.00 0.00 0.00 178.83 178.87 1uhw n GLU 58 N -3.63 -0.08 -0.11 1.69 1.02 -1.17 0.15 120.64 118.52 1uhw n GLU 58 Ca -0.02 1.41 -0.06 0.00 -0.02 0.00 0.00 57.16 58.47 1uhw n GLU 58 Cb 0.13 -2.14 0.02 0.00 -0.02 0.00 0.00 31.44 29.43 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 0.49 -0.54 0.62 0.00 -1.09 -1.03 103.07 101.52 1uhw h GLY 59 Ca 0.47 -0.11 0.15 0.00 0.00 0.00 0.00 47.33 47.84 1uhw h GLY 59 CO -0.92 0.06 -0.22 -2.00 0.00 0.00 0.00 176.54 173.47 1uhw h LEU 60 N 0.34 -0.79 0.58 3.11 7.12 0.35 1.64 115.31 127.65 1uhw h LEU 60 Ca 0.16 0.23 -0.03 0.00 0.13 0.00 0.00 57.88 58.38 1uhw h LEU 60 Cb 0.10 0.50 0.01 0.00 -0.53 0.00 0.00 40.66 40.74 1uhw h LEU 60 CO -0.14 -0.26 -0.28 0.24 -0.13 0.00 0.00 178.44 177.87 1uhw h MET 61 N -0.02 -0.75 -0.19 1.25 0.00 -0.93 -2.95 114.93 111.34 1uhw h MET 61 Ca 0.35 0.05 0.05 0.00 0.00 0.00 0.00 59.70 60.16 1uhw h MET 61 Cb 0.56 0.17 -0.07 0.00 0.00 0.00 0.00 31.60 32.27 1uhw h MET 61 CO -0.79 -0.44 -0.32 0.82 0.00 0.00 0.00 176.91 176.18 1uhw h ILE 62 N -0.98 0.28 -0.87 -1.22 1.08 0.06 -0.80 117.51 115.06 1uhw h ILE 62 Ca -0.08 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.56 1uhw h ILE 62 Cb 0.66 0.28 -0.16 0.00 -3.07 0.00 0.00 36.82 34.52 1uhw h ILE 62 CO 0.13 0.00 -0.23 -1.20 -0.69 0.00 0.00 178.15 176.16 1uhw n SER 63 N -5.41 -0.34 -0.14 1.72 7.64 0.55 0.13 113.62 117.76 1uhw n SER 63 Ca -0.02 1.50 -0.07 0.00 1.01 0.00 0.00 58.87 61.29 1uhw n SER 63 Cb 0.33 -0.44 -0.02 0.00 -1.01 0.00 0.00 64.21 63.07 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 1.68 -0.20 -0.86 -0.43 0.00 -0.96 0.36 119.26 118.85 1uhw h ALA 64 Ca 0.41 0.11 0.22 0.00 0.00 0.00 0.00 54.91 55.65 1uhw h ALA 64 Cb 0.62 0.77 -0.14 0.00 0.00 0.00 0.00 17.79 19.04 1uhw h ALA 64 CO -0.90 -0.74 0.20 1.03 0.00 0.00 0.00 179.25 178.85 1uhw h SER 65 N -0.24 -0.04 0.49 0.00 0.87 0.12 1.44 113.55 116.19 1uhw h SER 65 Ca 0.18 0.20 -0.02 0.00 -1.23 0.00 0.00 61.79 60.91 1uhw h SER 65 Cb 0.55 0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 1uhw h SER 65 CO -0.59 -0.15 -0.24 -0.07 -0.53 0.00 0.00 176.83 175.25 1uhw h LEU 66 N 0.20 -0.56 0.42 2.23 -0.00 0.03 -1.70 115.31 115.93 1uhw h LEU 66 Ca 0.53 -0.05 -0.01 0.00 -0.00 0.00 0.00 57.88 58.35 1uhw h LEU 66 Cb 1.05 0.14 -0.02 0.00 -0.00 0.00 0.00 40.66 41.83 1uhw h LEU 66 CO -0.65 -0.28 -0.42 0.25 -0.00 0.00 0.00 178.44 177.33 1uhw h LEU 67 N -0.83 -1.16 -0.34 1.67 7.12 0.16 -2.03 115.31 119.90 1uhw h LEU 67 Ca -0.07 0.09 0.03 0.00 0.13 0.00 0.00 57.88 58.07 1uhw h LEU 67 Cb 0.58 0.38 -0.04 0.00 -0.53 0.00 0.00 40.66 41.05 1uhw h LEU 67 CO 0.11 -0.56 -0.20 -0.24 -0.13 0.00 0.00 178.44 177.42 1uhw n SER 68 N -4.98 -0.36 -0.34 1.25 2.88 0.47 0.19 113.62 112.73 1uhw n SER 68 Ca -0.10 1.16 0.32 0.00 -1.33 0.00 0.00 58.87 58.92 1uhw n SER 68 Cb 0.39 -0.36 0.58 0.00 -0.75 0.00 0.00 64.21 64.07 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 -3.74 -0.05 0.00 -1.46 -0.58 -0.64 -4.71 120.64 109.46 1uhw n GLU 69 Ca 0.01 1.26 0.00 0.00 -0.42 0.00 0.00 57.16 58.00 1uhw n GLU 69 Cb 0.09 -2.32 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 0.87 0.20 0.62 0.00 0.50 -4.97 105.19 101.10 1uhw n GLY 70 Ca 0.36 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.50 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 -3.36 1.61 0.05 -1.47 -3.38 116.97 110.42 1uhw h TYR 71 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.32 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 0.00 -0.79 -0.51 -1.05 0.00 0.00 178.16 175.81 1uhw s LEU 72 N -4.71 1.25 -0.14 3.88 1.43 -1.25 -4.28 118.68 114.86 1uhw s LEU 72 Ca -0.03 -0.20 -0.15 0.00 -1.03 0.00 0.00 54.13 52.73 1uhw s LEU 72 Cb 0.07 -0.62 -0.05 0.00 0.03 0.00 0.00 46.19 45.63 1uhw s LEU 72 CO 0.21 -0.07 0.35 -1.10 0.23 0.00 0.00 176.35 175.97 1uhw s GLN 73 N 1.20 4.25 0.24 1.70 -1.52 0.51 -4.77 119.66 121.27 1uhw s GLN 73 Ca -0.06 0.21 -0.30 0.00 -1.95 0.00 0.00 55.36 53.26 1uhw s GLN 73 Cb -0.14 -3.41 -0.09 0.00 -0.22 0.00 0.00 33.01 29.15 1uhw s GLN 73 CO -0.02 0.25 1.09 -1.25 -0.25 0.00 0.00 175.29 175.11 1uhw s PRO 74 N 0.41 4.64 -0.21 2.91 0.04 -1.26 0.40 135.00 141.93 1uhw s PRO 74 Ca 0.19 1.76 -0.04 0.00 0.04 0.00 0.00 61.00 62.95 1uhw s PRO 74 Cb -0.14 -3.22 0.07 0.00 0.04 0.00 0.00 34.50 31.25 1uhw s PRO 74 CO 0.06 0.19 0.08 0.00 0.04 0.00 0.00 177.00 177.37 1uhw s ALA 75 N -0.86 0.71 0.00 8.56 0.00 -0.76 -4.91 121.76 124.50 1uhw s ALA 75 Ca 0.46 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.77 1uhw s ALA 75 Cb -0.31 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 21.63 1uhw s ALA 75 CO 0.38 -1.29 0.00 0.41 0.00 0.00 0.00 175.76 175.27 1uhw n GLY 76 N 5.18 0.54 2.05 0.00 0.00 -1.26 -4.23 105.19 107.47 1uhw n GLY 76 Ca -0.07 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.98 0.00 1.61 2.03 -1.26 -4.90 116.55 113.06 1uhw n ASP 77 Ca 0.00 0.21 0.00 0.00 0.52 0.00 0.00 54.79 55.52 1uhw n ASP 77 Cb 0.00 1.28 0.00 0.00 -0.72 0.00 0.00 41.12 41.68 1uhw n ASP 77 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1uhw n LEU 78 N -2.73 0.00 -0.29 -2.67 4.77 -1.26 0.18 117.00 115.01 1uhw n LEU 78 Ca 0.00 0.53 -0.04 0.00 -0.03 0.00 0.00 56.01 56.48 1uhw n LEU 78 Cb 0.00 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.07 1uhw n LEU 78 CO 0.00 -0.03 0.60 0.77 -1.33 0.00 0.00 177.39 177.39 1uhw h SER 79 N 0.00 -1.35 -0.06 -1.43 4.64 -1.92 0.72 113.55 114.16 1uhw h SER 79 Ca 0.00 0.27 0.01 0.00 -0.47 0.00 0.00 61.79 61.60 1uhw h SER 79 Cb 0.00 0.68 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1uhw h SER 79 CO 0.00 -0.30 -0.07 0.11 -0.87 0.00 0.00 176.83 175.71 1uhw h LYS 80 N -0.09 -0.04 -1.36 4.77 1.57 -1.63 1.24 116.57 121.02 1uhw h LYS 80 Ca 0.27 0.00 0.42 0.00 -1.87 0.00 0.00 60.65 59.48 1uhw h LYS 80 Cb 0.57 0.01 -0.11 0.00 0.08 0.00 0.00 32.23 32.78 1uhw h LYS 80 CO -0.82 -0.03 0.91 -0.91 -0.57 0.00 0.00 179.45 178.03 1uhw h ASN 81 N -0.04 0.21 0.39 0.86 4.21 0.31 0.55 115.58 122.07 1uhw h ASN 81 Ca 0.01 0.10 -0.02 0.00 1.21 0.00 0.00 56.30 57.60 1uhw h ASN 81 Cb 0.07 0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.35 1uhw h ASN 81 CO -0.07 -0.11 -0.19 0.00 -1.29 0.00 0.00 177.43 175.77 1uhw h ALA 82 N 1.50 -0.52 -0.53 -0.83 0.00 0.25 -2.88 119.26 116.25 1uhw h ALA 82 Ca 0.78 -0.18 0.15 0.00 0.00 0.00 0.00 54.91 55.67 1uhw h ALA 82 Cb 2.58 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 20.55 1uhw h ALA 82 CO -0.31 -0.56 0.57 0.00 0.00 0.00 0.00 179.25 178.96 1uhw h ALA 83 N -0.72 2.28 0.40 0.00 0.00 0.61 -0.83 119.26 120.99 1uhw h ALA 83 Ca -0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 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 0.09 -0.84 -0.36 0.22 0.00 0.00 0.00 179.25 178.35 1uhw h ASP 84 N 0.00 -0.97 0.00 0.00 3.58 -0.40 -3.45 116.42 115.17 1uhw h ASP 84 Ca 0.25 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.78 1uhw h ASP 84 Cb 1.39 0.31 0.00 0.00 1.72 0.00 0.00 39.33 42.75 1uhw h ASP 84 CO -0.00 -0.49 0.00 0.61 -2.88 0.00 0.00 179.24 176.48 1uhw n GLY 85 N -1.41 -1.74 0.06 -0.78 0.00 -0.35 -5.08 105.19 95.89 1uhw n GLY 85 Ca -0.09 0.65 -0.01 0.00 0.00 0.00 0.00 46.02 46.56 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 0.00 0.00 0.00 -0.61 1.08 -1.64 -3.50 117.51 112.84 1uhw h ILE 86 Ca 0.00 -0.52 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 1uhw h ILE 86 Cb 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.75 1uhw h ILE 86 CO 0.00 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.46 1uhw n ALA 87 N -2.45 0.00 -0.51 1.87 0.00 -1.26 -5.01 120.51 113.15 1uhw n ALA 87 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.53 1uhw n ALA 87 Cb 0.04 0.00 0.35 0.00 0.00 0.00 0.00 19.45 19.83 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 3.28 -3.62 0.00 0.00 -1.26 -4.69 120.64 114.34 1uhw n GLU 88 Ca 0.00 -2.80 -0.29 0.00 0.00 0.00 0.00 57.16 54.07 1uhw n GLU 88 Cb 0.00 -1.75 -0.13 0.00 0.00 0.00 0.00 31.44 29.56 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 -0.95 3.46 0.33 4.31 -0.87 -1.26 -4.96 114.94 115.00 1uhw s ASN 89 Ca 0.51 -2.26 0.17 0.00 -1.57 0.00 0.00 52.86 49.71 1uhw s ASN 89 Cb 0.30 -0.75 0.45 0.00 -0.02 0.00 0.00 41.25 41.23 1uhw s ASN 89 CO 0.29 -0.31 1.62 1.55 -2.57 0.00 0.00 177.10 177.68 1uhw h PRO 90 N 7.12 0.00 -6.03 -0.60 0.13 -1.87 -3.43 132.00 127.32 1uhw h PRO 90 Ca -0.01 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.55 1uhw h PRO 90 Cb 0.96 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.03 1uhw h PRO 90 CO 0.40 0.45 0.20 0.12 -0.23 0.00 0.00 178.00 178.94 1uhw s PHE 91 N -3.36 3.53 -0.39 1.56 2.19 -1.26 -4.43 117.98 115.83 1uhw s PHE 91 Ca 0.01 1.28 -0.12 0.00 0.33 0.00 0.00 56.93 58.43 1uhw s PHE 91 Cb 0.10 -2.89 0.03 0.00 -1.31 0.00 0.00 43.02 38.94 1uhw s PHE 91 CO 0.71 -0.02 0.24 -0.51 1.83 0.00 0.00 175.22 177.46 1uhw s LEU 92 N 1.24 4.85 -0.78 6.12 1.02 -1.26 -4.95 118.68 124.92 1uhw s LEU 92 Ca 0.39 -0.98 -0.15 0.00 0.02 0.00 0.00 54.13 53.42 1uhw s LEU 92 Cb -0.18 -2.06 -0.11 0.00 0.02 0.00 0.00 46.19 43.86 1uhw s LEU 92 CO 0.17 -0.41 1.96 -0.67 0.02 0.00 0.00 176.35 177.42 1uhw n ASP 93 N 5.05 3.38 -4.03 2.29 2.03 -1.26 -4.42 116.55 119.59 1uhw n ASP 93 Ca -0.11 -2.50 -0.12 0.00 0.52 0.00 0.00 54.79 52.58 1uhw n ASP 93 Cb 0.46 -1.07 -0.11 0.00 -0.72 0.00 0.00 41.12 39.68 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 4.38 0.62 0.10 1.67 0.15 -1.26 -4.70 113.70 114.65 1uhw s SER 94 Ca 0.48 -0.51 0.23 0.00 0.70 0.00 0.00 55.95 56.85 1uhw s SER 94 Cb 0.12 0.05 0.92 0.00 -1.71 0.00 0.00 66.02 65.40 1uhw s SER 94 CO 0.05 -0.22 1.72 -0.81 1.20 0.00 0.00 173.24 175.18 1uhw n PRO 95 N 1.59 0.09 0.10 5.44 -0.04 -1.26 -2.40 135.00 138.53 1uhw n PRO 95 Ca -0.23 0.20 -0.08 0.00 -0.04 0.00 0.00 63.50 63.36 1uhw n PRO 95 Cb 0.55 -1.64 -0.04 0.00 -0.04 0.00 0.00 33.50 32.33 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 -0.29 -2.69 3.54 3.32 -1.95 -3.45 116.42 114.89 1uhw h ASP 96 Ca 0.00 -0.11 -0.55 0.00 0.02 0.00 0.00 57.03 56.39 1uhw h ASP 96 Cb 0.45 0.08 0.22 0.00 0.22 0.00 0.00 39.33 40.29 1uhw h ASP 96 CO 0.00 0.20 -1.13 0.00 -1.72 0.00 0.00 179.24 176.58 1uhw n ALA 97 N -2.70 -3.71 -3.42 3.45 0.00 -1.22 -4.94 120.51 107.98 1uhw n ALA 97 Ca -0.06 -0.55 -0.12 0.00 0.00 0.00 0.00 53.44 52.71 1uhw n ALA 97 Cb 0.20 -1.50 -0.12 0.00 0.00 0.00 0.00 19.45 18.02 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 -2.13 -0.30 0.08 0.00 0.08 -1.26 -3.67 117.98 110.77 1uhw s PHE 98 Ca 0.51 0.73 0.03 0.00 0.12 0.00 0.00 56.93 58.32 1uhw s PHE 98 Cb -0.24 0.07 -0.03 0.00 -0.57 0.00 0.00 43.02 42.25 1uhw s PHE 98 CO 0.73 -0.18 -0.10 0.71 -0.10 0.00 0.00 175.22 176.27 1uhw s TYR 99 N 0.68 0.99 -0.04 0.36 2.02 -1.26 -1.83 117.35 118.26 1uhw s TYR 99 Ca -0.05 -0.61 -0.06 0.00 -0.37 0.00 0.00 57.07 55.98 1uhw s TYR 99 Cb -0.06 -0.55 0.01 0.00 -0.40 0.00 0.00 41.96 40.96 1uhw s TYR 99 CO -0.04 -0.02 0.15 1.52 -1.57 0.00 0.00 175.55 175.59 1uhw s TYR 100 N -2.13 -0.12 0.61 2.71 1.13 0.16 0.19 117.35 119.91 1uhw s TYR 100 Ca 0.01 0.29 -0.19 0.00 -1.41 0.00 0.00 57.07 55.78 1uhw s TYR 100 Cb -0.05 0.03 -0.03 0.00 -1.10 0.00 0.00 41.96 40.82 1uhw s TYR 100 CO 0.00 -0.14 1.25 -0.06 -2.51 0.00 0.00 175.55 174.09 1uhw s PHE 101 N -0.29 2.27 -1.14 -3.49 0.08 -1.26 0.19 117.98 114.35 1uhw s PHE 101 Ca -0.04 1.50 -0.19 0.00 0.12 0.00 0.00 56.93 58.32 1uhw s PHE 101 Cb -0.03 -3.57 -0.05 0.00 -0.57 0.00 0.00 43.02 38.80 1uhw s PHE 101 CO 0.01 -2.51 2.00 -0.35 -0.10 0.00 0.00 175.22 174.27 1uhw n PRO 102 N -1.68 2.22 0.00 0.24 -0.04 -1.26 -2.54 135.00 131.94 1uhw n PRO 102 Ca 0.14 -2.39 0.00 0.00 -0.04 0.00 0.00 63.50 61.21 1uhw n PRO 102 Cb 0.49 -3.24 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 8.10 0.00 -4.53 3.54 -0.08 -1.26 -5.13 116.55 117.18 1uhw n ASP 103 Ca 0.50 0.00 -0.25 0.00 -1.51 0.00 0.00 54.79 53.52 1uhw n ASP 103 Cb 0.42 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.78 1uhw n ASP 103 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1uhw s SER 104 N 0.00 4.00 0.00 1.67 0.01 -1.05 -5.09 113.70 113.23 1uhw s SER 104 Ca 0.00 -0.76 0.00 0.00 1.31 0.00 0.00 55.95 56.50 1uhw s SER 104 Cb 0.00 -0.56 0.00 0.00 0.21 0.00 0.00 66.02 65.67 1uhw s SER 104 CO 0.00 0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.33 1uhw n GLY 105 N -0.28 -0.11 3.57 3.44 0.00 -1.24 -4.08 105.19 106.49 1uhw n GLY 105 Ca -0.09 -1.39 -0.35 0.00 0.00 0.00 0.00 46.02 44.20 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 -2.00 3.14 0.01 1.61 0.04 -0.89 -4.58 135.00 132.33 1uhw s PRO 106 Ca 0.00 -1.03 -0.30 0.00 0.04 0.00 0.00 61.00 59.71 1uhw s PRO 106 Cb 0.00 -5.28 -0.08 0.00 0.04 0.00 0.00 34.50 29.18 1uhw s PRO 106 CO 0.00 -2.90 1.90 -1.12 0.04 0.00 0.00 177.00 174.92 1uhw s SER 107 N 6.07 6.48 -0.11 6.66 0.01 -1.26 -4.84 113.70 126.71 1uhw s SER 107 Ca 0.59 2.56 -0.08 0.00 1.31 0.00 0.00 55.95 60.34 1uhw s SER 107 Cb -0.01 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.63 1uhw s SER 107 CO 0.00 -1.04 -0.18 -0.24 0.41 0.00 0.00 173.24 172.19 1uhw n SER 108 N 7.51 1.13 -0.37 2.44 2.88 -1.26 -5.17 113.62 120.78 1uhw n SER 108 Ca 0.19 0.19 0.14 0.00 -1.33 0.00 0.00 58.87 58.07 1uhw n SER 108 Cb 0.42 -0.45 0.62 0.00 -0.75 0.00 0.00 64.21 64.05 1uhw n SER 108 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42