#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 3.41 1.06 1.61 0.15 -1.26 -5.11 113.70 113.56 1uhw s SER 2 Ca 0.00 -0.50 -0.23 0.00 0.70 0.00 0.00 55.95 55.92 1uhw s SER 2 Cb 0.00 -1.49 -0.04 0.00 -1.71 0.00 0.00 66.02 62.78 1uhw s SER 2 CO 0.00 0.13 -0.73 -0.24 1.20 0.00 0.00 173.24 173.60 1uhw n SER 3 N 3.71 -2.67 0.00 5.45 2.88 -1.26 -4.86 113.62 116.87 1uhw n SER 3 Ca -0.19 -0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.27 1uhw n SER 3 Cb 0.52 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 63.25 1uhw n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uhw n GLY 4 N 2.73 -1.05 4.30 0.46 0.00 -1.26 -4.73 105.19 105.65 1uhw n GLY 4 Ca -0.01 0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.30 0.40 -4.54 1.61 7.64 -1.26 -4.62 113.62 112.55 1uhw n SER 5 Ca 0.00 -1.24 -0.27 0.00 1.01 0.00 0.00 58.87 58.38 1uhw n SER 5 Cb 0.00 -1.79 -0.10 0.00 -1.01 0.00 0.00 64.21 61.31 1uhw n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1uhw n SER 6 N -2.85 1.19 0.00 6.43 2.88 -1.26 -2.56 113.62 117.46 1uhw n SER 6 Ca -0.27 -0.75 0.00 0.00 -1.33 0.00 0.00 58.87 56.53 1uhw n SER 6 Cb 0.67 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.79 1uhw n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uhw n GLY 7 N 6.28 1.57 0.19 0.46 0.00 -1.26 -4.92 105.19 107.50 1uhw n GLY 7 Ca 0.50 -0.47 -0.05 0.00 0.00 0.00 0.00 46.02 46.00 1uhw n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uhw n LEU 8 N 0.00 -0.48 0.00 0.99 4.32 -1.16 -0.81 117.00 119.86 1uhw n LEU 8 Ca 0.00 1.33 0.00 0.00 -0.02 0.00 0.00 56.01 57.32 1uhw n LEU 8 Cb 0.00 -0.37 0.00 0.00 -1.62 0.00 0.00 43.42 41.43 1uhw n LEU 8 CO 0.00 -0.92 0.30 0.61 -1.22 0.00 0.00 177.39 176.16 1uhw n GLY 9 N -1.11 -2.19 0.37 -0.72 0.00 -1.06 0.22 105.19 100.70 1uhw n GLY 9 Ca 0.01 0.43 -0.04 0.00 0.00 0.00 0.00 46.02 46.41 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 -0.81 -0.02 0.19 4.61 0.00 -1.57 0.95 119.26 122.60 1uhw h ALA 10 Ca 0.00 0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1uhw h ALA 10 Cb 0.00 0.94 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1uhw h ALA 10 CO 0.00 -0.69 -0.44 1.25 0.00 0.00 0.00 179.25 179.37 1uhw h LEU 11 N -0.10 -1.29 -0.60 0.00 5.85 0.20 -1.69 115.31 117.69 1uhw h LEU 11 Ca 0.27 0.13 0.12 0.00 0.84 0.00 0.00 57.88 59.25 1uhw h LEU 11 Cb 0.57 0.47 -0.10 0.00 0.37 0.00 0.00 40.66 41.97 1uhw h LEU 11 CO -0.83 -0.52 0.04 0.22 -0.34 0.00 0.00 178.44 177.00 1uhw h TYR 12 N -0.72 0.03 -1.01 1.25 3.20 0.53 0.30 116.97 120.54 1uhw h TYR 12 Ca 0.00 0.04 0.24 0.00 3.14 0.00 0.00 58.73 62.15 1uhw h TYR 12 Cb 0.72 0.08 -0.11 0.00 1.54 0.00 0.00 36.73 38.96 1uhw h TYR 12 CO -0.35 -0.13 0.62 -0.07 -1.64 0.00 0.00 178.16 176.59 1uhw h LEU 13 N 0.15 0.64 0.18 2.82 3.38 0.16 0.34 115.31 122.98 1uhw h LEU 13 Ca 0.31 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.38 1uhw h LEU 13 Cb 0.50 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1uhw h LEU 13 CO -0.48 0.15 -0.09 0.28 0.09 0.00 0.00 178.44 178.39 1uhw h SER 14 N 0.57 -0.21 -1.49 -0.43 0.02 0.42 -2.86 113.55 109.57 1uhw h SER 14 Ca 0.61 -0.23 0.45 0.00 -0.84 0.00 0.00 61.79 61.78 1uhw h SER 14 Cb 1.21 0.05 -0.10 0.00 0.14 0.00 0.00 62.40 63.71 1uhw h SER 14 CO -0.40 0.14 1.02 0.24 -1.14 0.00 0.00 176.83 176.69 1uhw h MET 15 N -0.57 0.06 -0.62 3.45 2.86 0.02 1.58 114.93 121.71 1uhw h MET 15 Ca -0.02 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1uhw h MET 15 Cb 0.43 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 1uhw h MET 15 CO 0.04 0.04 0.36 0.87 1.06 0.00 0.00 176.91 179.28 1uhw h LYS 16 N 0.06 0.85 -6.22 1.72 1.57 -1.18 -2.63 116.57 110.74 1uhw h LYS 16 Ca 0.80 -0.08 -0.62 0.00 -1.87 0.00 0.00 60.65 58.88 1uhw h LYS 16 Cb 2.85 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 35.00 1uhw h LYS 16 CO -0.22 0.62 1.18 -3.47 -0.57 0.00 0.00 179.45 176.99 1uhw n ASP 17 N -4.59 3.34 0.00 0.86 -0.08 0.54 -4.80 116.55 111.82 1uhw n ASP 17 Ca 0.04 0.84 0.12 0.00 -1.51 0.00 0.00 54.79 54.28 1uhw n ASP 17 Cb 0.07 -1.38 0.65 0.00 2.34 0.00 0.00 41.12 42.79 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 7.05 0.55 0.02 -0.67 -0.04 -1.26 0.08 135.00 140.73 1uhw n PRO 18 Ca 0.25 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 1uhw n PRO 18 Cb 0.31 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 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 -1.14 0.00 -0.58 0.54 1.02 -1.26 -4.71 120.64 114.51 1uhw n GLU 19 Ca 0.15 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.34 1uhw n GLU 19 Cb 0.13 -0.46 0.28 0.00 -0.02 0.00 0.00 31.44 31.38 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 -3.10 3.53 0.00 3.49 4.76 -1.25 -4.89 118.16 120.70 1uhw n LYS 20 Ca 0.00 -2.21 0.00 0.00 -2.87 0.00 0.00 58.31 53.23 1uhw n LYS 20 Cb 0.34 -1.94 0.00 0.00 -1.84 0.00 0.00 35.03 31.59 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 0.62 5.41 3.84 0.72 0.00 0.11 -4.69 105.19 111.21 1uhw n GLY 21 Ca 0.20 -1.28 -0.31 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 0.58 4.36 0.51 -0.61 1.01 -0.99 -4.82 121.20 121.24 1uhw s ILE 22 Ca 0.00 0.81 -0.09 0.00 0.00 0.00 0.00 60.65 61.38 1uhw s ILE 22 Cb 0.00 -3.64 0.12 0.00 0.01 0.00 0.00 42.46 38.95 1uhw s ILE 22 CO 0.00 -0.96 0.67 0.29 0.00 0.00 0.00 174.94 174.94 1uhw n LYS 23 N -2.77 -0.77 -3.29 2.79 4.76 -1.26 -4.33 118.16 113.29 1uhw n LYS 23 Ca 0.07 -1.03 -0.07 0.00 -2.87 0.00 0.00 58.31 54.40 1uhw n LYS 23 Cb 0.54 -0.71 -0.05 0.00 -1.84 0.00 0.00 35.03 32.97 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 -4.46 0.43 0.41 1.97 2.02 -1.26 -4.86 118.70 112.95 1uhw s GLU 24 Ca 0.38 0.26 0.07 0.00 0.02 0.00 0.00 54.97 55.70 1uhw s GLU 24 Cb -0.01 -0.24 -0.07 0.00 0.10 0.00 0.00 34.13 33.91 1uhw s GLU 24 CO 0.27 -0.97 0.10 -0.51 0.02 0.00 0.00 175.26 174.16 1uhw s LEU 25 N 2.59 3.00 -0.33 1.80 1.43 -1.22 -4.74 118.68 121.20 1uhw s LEU 25 Ca 0.10 -1.23 -0.07 0.00 -1.03 0.00 0.00 54.13 51.91 1uhw s LEU 25 Cb -0.13 -1.17 0.03 0.00 0.03 0.00 0.00 46.19 44.96 1uhw s LEU 25 CO -0.28 -0.50 0.10 0.54 0.23 0.00 0.00 176.35 176.45 1uhw s ASN 26 N -3.81 5.28 -0.21 2.29 4.22 -1.26 -2.38 114.94 119.07 1uhw s ASN 26 Ca 0.38 -1.02 -0.06 0.00 -2.14 0.00 0.00 52.86 50.02 1uhw s ASN 26 Cb 0.07 -1.88 -0.03 0.00 1.28 0.00 0.00 41.25 40.69 1uhw s ASN 26 CO 0.20 -0.30 0.03 -0.76 -2.04 0.00 0.00 177.10 174.23 1uhw s LEU 27 N 1.43 3.36 -0.14 3.54 1.43 -0.51 -4.89 118.68 122.90 1uhw s LEU 27 Ca -0.00 -0.18 -0.21 0.00 -1.03 0.00 0.00 54.13 52.70 1uhw s LEU 27 Cb -0.19 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 1uhw s LEU 27 CO 0.03 0.04 0.63 -0.70 0.23 0.00 0.00 176.35 176.58 1uhw s GLU 28 N 1.15 4.31 -0.23 1.70 2.12 -1.26 -1.74 118.70 124.74 1uhw s GLU 28 Ca 0.03 0.69 -0.20 0.00 0.36 0.00 0.00 54.97 55.85 1uhw s GLU 28 Cb -0.14 -3.51 0.06 0.00 0.26 0.00 0.00 34.13 30.79 1uhw s GLU 28 CO 0.02 -0.08 0.61 0.21 -0.54 0.00 0.00 175.26 175.48 1uhw s LYS 29 N 1.37 0.70 -1.44 4.30 2.47 -0.39 -4.90 119.74 121.84 1uhw s LYS 29 Ca 0.31 0.88 -0.04 0.00 -1.56 0.00 0.00 55.97 55.57 1uhw s LYS 29 Cb -0.16 0.31 0.00 0.00 -1.46 0.00 0.00 37.83 36.52 1uhw s LYS 29 CO 0.13 -0.09 0.46 -3.47 0.16 0.00 0.00 175.35 172.54 1uhw n ASP 30 N 2.97 -5.67 -3.42 1.43 -0.08 -1.26 -2.27 116.55 108.24 1uhw n ASP 30 Ca -0.15 -0.22 -0.18 0.00 -1.51 0.00 0.00 54.79 52.73 1uhw n ASP 30 Cb 0.56 -4.53 0.07 0.00 2.34 0.00 0.00 41.12 39.56 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 -3.57 -4.70 -3.66 -0.67 5.02 -1.26 -5.01 118.16 104.31 1uhw n LYS 31 Ca -0.12 0.80 -0.08 0.00 -2.02 0.00 0.00 58.31 56.89 1uhw n LYS 31 Cb 0.62 -5.67 -0.08 0.00 -0.02 0.00 0.00 35.03 29.88 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 -5.17 0.54 -1.07 1.97 1.02 -0.96 -5.09 119.74 110.98 1uhw s LYS 32 Ca 0.17 1.09 -0.18 0.00 0.02 0.00 0.00 55.97 57.07 1uhw s LYS 32 Cb -0.03 0.20 0.12 0.00 -0.52 0.00 0.00 37.83 37.60 1uhw s LYS 32 CO 0.75 -0.17 1.34 0.08 -0.92 0.00 0.00 175.35 176.43 1uhw s VAL 33 N 1.83 4.63 -0.58 3.17 1.01 -1.26 -1.26 120.40 127.95 1uhw s VAL 33 Ca -0.08 -1.82 -0.27 0.00 0.00 0.00 0.00 61.98 59.80 1uhw s VAL 33 Cb -0.08 -4.91 -0.01 0.00 0.00 0.00 0.00 36.38 31.38 1uhw s VAL 33 CO -0.17 -1.67 1.74 -0.36 0.00 0.00 0.00 175.10 174.65 1uhw s PHE 34 N 2.85 1.83 0.58 5.22 0.08 -0.71 -4.82 117.98 123.00 1uhw s PHE 34 Ca 0.40 0.65 -0.06 0.00 0.12 0.00 0.00 56.93 58.05 1uhw s PHE 34 Cb -0.02 -4.18 0.01 0.00 -0.57 0.00 0.00 43.02 38.25 1uhw s PHE 34 CO -0.05 -2.32 0.89 -0.80 -0.10 0.00 0.00 175.22 172.84 1uhw s ASN 35 N 6.92 5.63 -1.39 1.36 0.01 -1.26 -1.42 114.94 124.79 1uhw s ASN 35 Ca 0.64 0.70 -0.13 0.00 -0.71 0.00 0.00 52.86 53.37 1uhw s ASN 35 Cb -0.13 -1.72 0.01 0.00 0.41 0.00 0.00 41.25 39.82 1uhw s ASN 35 CO 0.23 -1.03 0.35 1.41 -1.51 0.00 0.00 177.10 176.55 1uhw n HIS 36 N -2.55 -1.42 -4.34 2.20 8.25 -1.20 -2.57 115.22 113.59 1uhw n HIS 36 Ca 0.04 0.45 -0.25 0.00 -0.26 0.00 0.00 57.72 57.70 1uhw n HIS 36 Cb 0.57 -3.02 -0.09 0.00 1.12 0.00 0.00 29.99 28.58 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 -0.99 0.00 -3.64 0.00 4.77 -0.36 -3.40 117.00 113.37 1uhw n LEU 38 Ca -0.04 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.83 1uhw n LEU 38 Cb 0.63 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.65 1uhw n LEU 38 CO 0.44 0.00 0.36 0.42 -1.33 0.00 0.00 177.39 177.28 1uhw s THR 39 N 0.83 -0.00 0.58 -5.08 -4.23 -1.26 -3.67 115.64 102.81 1uhw s THR 39 Ca 0.00 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 60.79 1uhw s THR 39 Cb 0.00 -0.96 0.36 0.00 1.34 0.00 0.00 72.50 73.24 1uhw s THR 39 CO 0.00 0.00 2.09 1.23 -0.54 0.00 0.00 174.62 177.40 1uhw h GLY 40 N 5.85 0.00 0.87 3.99 0.00 -1.09 1.35 103.07 114.04 1uhw h GLY 40 Ca -0.30 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.72 1uhw h GLY 40 CO 0.11 0.00 -1.51 0.23 0.00 0.00 0.00 176.54 175.37 1uhw h SER 41 N 0.00 0.59 -0.13 0.19 0.87 -1.49 -3.21 113.55 110.37 1uhw h SER 41 Ca 0.10 -0.92 -0.13 0.00 -1.23 0.00 0.00 61.79 59.62 1uhw h SER 41 Cb 0.53 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1uhw h SER 41 CO -0.00 1.69 -0.41 1.23 -0.53 0.00 0.00 176.83 178.81 1uhw h GLY 42 N 0.30 0.56 0.13 5.77 0.00 -1.44 -2.71 103.07 105.68 1uhw h GLY 42 Ca -0.30 -0.73 0.05 0.00 0.00 0.00 0.00 47.33 46.35 1uhw h GLY 42 CO 0.17 0.65 -0.34 -0.39 0.00 0.00 0.00 176.54 176.63 1uhw h VAL 43 N 0.13 0.26 -0.90 4.60 -1.51 0.16 0.21 116.25 119.19 1uhw h VAL 43 Ca -0.01 0.00 0.12 0.00 -1.23 0.00 0.00 66.70 65.58 1uhw h VAL 43 Cb 1.03 0.26 -0.07 0.00 -2.13 0.00 0.00 31.29 30.39 1uhw h VAL 43 CO 0.09 0.00 0.58 0.40 -1.23 0.00 0.00 177.57 177.41 1uhw h ILE 44 N -0.41 0.90 -0.97 7.19 2.04 -1.61 0.24 117.51 124.89 1uhw h ILE 44 Ca 0.09 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.68 1uhw h ILE 44 Cb 0.56 0.03 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 1uhw h ILE 44 CO -0.36 0.15 0.62 -0.78 0.00 0.00 0.00 178.15 177.77 1uhw h ASP 45 N 0.80 1.13 -0.35 1.72 3.58 -0.38 -0.87 116.42 122.05 1uhw h ASP 45 Ca 0.44 -0.04 -0.12 0.00 0.42 0.00 0.00 57.03 57.72 1uhw h ASP 45 Cb 0.57 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.32 1uhw h ASP 45 CO -0.20 0.84 -0.23 -0.25 -2.88 0.00 0.00 179.24 176.52 1uhw h TRP 46 N 1.32 0.97 -0.87 0.28 7.01 0.19 1.00 115.95 125.85 1uhw h TRP 46 Ca 0.35 -0.23 0.10 0.00 2.11 0.00 0.00 58.89 61.22 1uhw h TRP 46 Cb -0.12 -0.23 -0.06 0.00 -2.10 0.00 0.00 29.16 26.65 1uhw h TRP 46 CO 0.00 0.99 0.56 -0.07 -2.79 0.00 0.00 178.44 177.14 1uhw h LEU 47 N 0.74 0.76 0.17 0.65 3.38 0.40 0.55 115.31 121.95 1uhw h LEU 47 Ca 0.10 0.02 -0.34 0.00 0.09 0.00 0.00 57.88 57.75 1uhw h LEU 47 Cb 0.77 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 41.39 1uhw h LEU 47 CO 0.06 0.45 -1.70 0.58 0.09 0.00 0.00 178.44 177.92 1uhw h VAL 48 N 0.84 0.94 -0.68 1.22 2.07 -0.80 1.66 116.25 121.51 1uhw h VAL 48 Ca 0.40 -2.49 0.15 0.00 0.82 0.00 0.00 66.70 65.58 1uhw h VAL 48 Cb 0.43 2.75 -0.11 0.00 -1.52 0.00 0.00 31.29 32.84 1uhw h VAL 48 CO -0.17 0.84 0.04 -1.28 0.02 0.00 0.00 177.57 177.02 1uhw h SER 49 N 0.04 -0.22 1.63 0.57 0.87 0.18 0.47 113.55 117.09 1uhw h SER 49 Ca -0.34 0.16 -0.06 0.00 -1.23 0.00 0.00 61.79 60.32 1uhw h SER 49 Cb 2.04 0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 64.26 1uhw h SER 49 CO 0.16 -0.11 -0.38 0.78 -0.53 0.00 0.00 176.83 176.75 1uhw h ASN 50 N 0.15 0.00 -2.34 6.23 2.35 -1.05 -3.48 115.58 117.44 1uhw h ASN 50 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 1uhw h ASN 50 Cb 0.61 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1uhw h ASN 50 CO -0.56 0.26 0.00 0.29 -1.65 0.00 0.00 177.43 175.77 1uhw n LYS 51 N -3.11 0.00 -0.05 0.81 4.76 0.17 -5.02 118.16 115.72 1uhw n LYS 51 Ca 0.02 0.21 -0.01 0.00 -2.87 0.00 0.00 58.31 55.65 1uhw n LYS 51 Cb 0.64 -1.17 -0.13 0.00 -1.84 0.00 0.00 35.03 32.53 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 -0.96 0.00 -4.59 -0.35 4.77 0.56 -4.98 117.00 111.45 1uhw n LEU 52 Ca 0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.70 1uhw n LEU 52 Cb 0.39 0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.65 1uhw n LEU 52 CO 0.00 0.24 -0.19 0.68 -1.33 0.00 0.00 177.39 176.79 1uhw s VAL 53 N -2.74 0.61 0.04 4.08 -7.23 -1.22 -5.04 120.40 108.90 1uhw s VAL 53 Ca -0.08 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.19 1uhw s VAL 53 Cb 0.08 -2.21 -0.22 0.00 0.56 0.00 0.00 36.38 34.58 1uhw s VAL 53 CO 0.70 0.00 0.97 0.03 -0.31 0.00 0.00 175.10 176.49 1uhw h ARG 54 N 1.61 0.01 -2.91 4.82 2.47 -1.95 -3.46 114.38 114.98 1uhw h ARG 54 Ca -0.36 -0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.34 1uhw h ARG 54 Cb 1.29 0.01 -0.11 0.00 -1.65 0.00 0.00 29.97 29.50 1uhw h ARG 54 CO 0.58 0.77 0.25 0.54 0.56 0.00 0.00 179.97 182.67 1uhw s ASN 55 N -6.44 -0.50 0.28 7.04 2.20 -1.26 -5.04 114.94 111.22 1uhw s ASN 55 Ca -0.02 -0.08 -0.04 0.00 -0.94 0.00 0.00 52.86 51.78 1uhw s ASN 55 Cb 0.09 0.59 0.57 0.00 -2.00 0.00 0.00 41.25 40.50 1uhw s ASN 55 CO 0.82 -0.97 1.60 0.03 -2.94 0.00 0.00 177.10 175.63 1uhw h ARG 56 N 2.00 0.04 -0.46 3.55 2.47 -1.93 -0.17 114.38 119.89 1uhw h ARG 56 Ca -0.31 -0.00 0.05 0.00 -1.26 0.00 0.00 59.98 58.46 1uhw h ARG 56 Cb 1.29 -0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 29.54 1uhw h ARG 56 CO 0.35 0.03 -0.37 0.37 0.56 0.00 0.00 179.97 180.91 1uhw h GLN 57 N 0.04 -0.12 -0.77 0.04 -0.00 -1.96 0.21 115.11 112.56 1uhw h GLN 57 Ca 0.50 0.01 0.17 0.00 -0.00 0.00 0.00 58.65 59.33 1uhw h GLN 57 Cb 0.94 0.03 -0.14 0.00 0.00 0.00 0.00 27.48 28.30 1uhw h GLN 57 CO -0.84 -0.08 -0.08 0.93 0.00 0.00 0.00 178.83 178.77 1uhw h GLU 58 N -0.12 0.05 -0.93 1.69 3.07 -1.44 0.55 114.58 117.45 1uhw h GLU 58 Ca 0.08 -0.00 0.16 0.00 -0.50 0.00 0.00 59.36 59.09 1uhw h GLU 58 Cb 0.32 -0.01 -0.10 0.00 -0.84 0.00 0.00 28.75 28.12 1uhw h GLU 58 CO -0.50 0.03 0.53 0.78 -1.40 0.00 0.00 179.01 178.46 1uhw h GLY 59 N 0.05 1.57 0.51 -3.84 0.00 -0.32 0.61 103.07 101.65 1uhw h GLY 59 Ca 0.40 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1uhw h GLY 59 CO -0.73 -0.01 -0.38 -2.00 0.00 0.00 0.00 176.54 173.42 1uhw h LEU 60 N 0.74 -1.07 -0.30 3.11 7.12 0.19 1.56 115.31 126.66 1uhw h LEU 60 Ca 0.51 0.10 0.05 0.00 0.13 0.00 0.00 57.88 58.67 1uhw h LEU 60 Cb 0.70 0.37 -0.04 0.00 -0.53 0.00 0.00 40.66 41.17 1uhw h LEU 60 CO -0.35 -0.51 0.04 0.24 -0.13 0.00 0.00 178.44 177.73 1uhw h MET 61 N -0.73 0.13 0.10 1.25 0.00 -0.91 -2.33 114.93 112.45 1uhw h MET 61 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 59.70 59.68 1uhw h MET 61 Cb 0.68 -0.03 0.00 0.00 0.00 0.00 0.00 31.60 32.25 1uhw h MET 61 CO -0.12 0.09 -0.05 0.82 0.00 0.00 0.00 176.91 177.65 1uhw h ILE 62 N 0.14 0.91 -1.00 -1.22 1.08 -0.52 -2.72 117.51 114.18 1uhw h ILE 62 Ca 0.14 -0.04 0.18 0.00 -0.39 0.00 0.00 64.86 64.75 1uhw h ILE 62 Cb 0.17 0.94 -0.17 0.00 -3.07 0.00 0.00 36.82 34.68 1uhw h ILE 62 CO -0.21 0.01 -0.33 0.28 -0.69 0.00 0.00 178.15 177.22 1uhw h SER 63 N -0.15 -1.21 -0.77 1.72 0.02 0.27 1.09 113.55 114.53 1uhw h SER 63 Ca -0.01 0.31 0.17 0.00 -0.84 0.00 0.00 61.79 61.41 1uhw h SER 63 Cb 0.12 0.70 -0.14 0.00 0.14 0.00 0.00 62.40 63.21 1uhw h SER 63 CO 0.02 -0.31 -0.10 0.00 -1.14 0.00 0.00 176.83 175.31 1uhw h ALA 64 N 1.66 0.66 -0.92 3.77 0.00 -1.10 0.96 119.26 124.28 1uhw h ALA 64 Ca 0.41 0.28 0.16 0.00 0.00 0.00 0.00 54.91 55.75 1uhw h ALA 64 Cb 0.66 0.51 -0.10 0.00 0.00 0.00 0.00 17.79 18.86 1uhw h ALA 64 CO -1.01 -0.43 0.52 1.03 0.00 0.00 0.00 179.25 179.37 1uhw h SER 65 N 0.04 0.66 0.56 0.00 0.87 0.12 1.17 113.55 116.98 1uhw h SER 65 Ca 0.40 0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 61.02 1uhw h SER 65 Cb 0.66 -0.03 0.01 0.00 -0.44 0.00 0.00 62.40 62.60 1uhw h SER 65 CO -0.74 0.27 -0.27 -0.07 -0.53 0.00 0.00 176.83 175.49 1uhw h LEU 66 N 0.71 -0.64 0.50 2.23 -0.00 0.13 -1.71 115.31 116.54 1uhw h LEU 66 Ca 0.51 -0.04 -0.02 0.00 -0.00 0.00 0.00 57.88 58.33 1uhw h LEU 66 Cb 0.72 0.16 -0.02 0.00 -0.00 0.00 0.00 40.66 41.53 1uhw h LEU 66 CO -0.36 -0.31 -0.46 0.25 -0.00 0.00 0.00 178.44 177.56 1uhw h LEU 67 N -0.98 -1.24 -0.64 1.67 7.12 -0.05 -0.63 115.31 120.56 1uhw h LEU 67 Ca -0.08 0.10 0.06 0.00 0.13 0.00 0.00 57.88 58.09 1uhw h LEU 67 Cb 0.64 0.40 -0.08 0.00 -0.53 0.00 0.00 40.66 41.10 1uhw h LEU 67 CO 0.13 -0.62 -0.38 -0.24 -0.13 0.00 0.00 178.44 177.20 1uhw n SER 68 N -5.22 -0.68 -0.33 1.25 2.88 0.40 0.19 113.62 112.11 1uhw n SER 68 Ca -0.11 1.40 0.24 0.00 -1.33 0.00 0.00 58.87 59.07 1uhw n SER 68 Cb 0.42 -0.28 0.48 0.00 -0.75 0.00 0.00 64.21 64.09 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 0.26 0.00 -1.46 4.39 -1.12 -3.44 114.58 113.21 1uhw h GLU 69 Ca 0.10 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1uhw h GLU 69 Cb 0.26 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1uhw h GLU 69 CO -0.60 0.17 0.00 0.41 -1.16 0.00 0.00 179.01 177.83 1uhw n GLY 70 N -1.29 1.83 0.08 -3.84 0.00 0.52 -5.02 105.19 97.47 1uhw n GLY 70 Ca 0.32 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.46 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 -0.22 0.72 -4.37 1.61 4.01 -0.30 -4.71 117.16 113.90 1uhw n TYR 71 Ca 0.00 0.21 -0.28 0.00 -0.16 0.00 0.00 57.90 57.67 1uhw n TYR 71 Cb 0.00 -0.78 -0.17 0.00 -0.31 0.00 0.00 39.34 38.09 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 -4.76 1.64 -0.19 7.72 2.01 -1.26 -4.13 118.68 119.71 1uhw s LEU 72 Ca 0.02 -0.40 -0.16 0.00 0.01 0.00 0.00 54.13 53.60 1uhw s LEU 72 Cb 0.12 -1.03 -0.04 0.00 0.01 0.00 0.00 46.19 45.25 1uhw s LEU 72 CO 0.77 -0.01 0.41 -1.10 1.01 0.00 0.00 176.35 177.43 1uhw s GLN 73 N 1.08 4.20 -0.16 1.70 -1.52 0.28 -4.79 119.66 120.45 1uhw s GLN 73 Ca -0.05 0.24 -0.29 0.00 -1.95 0.00 0.00 55.36 53.30 1uhw s GLN 73 Cb -0.15 -3.52 -0.02 0.00 -0.22 0.00 0.00 33.01 29.11 1uhw s GLN 73 CO -0.02 -0.00 1.27 -1.25 -0.25 0.00 0.00 175.29 175.03 1uhw s PRO 74 N 1.20 4.24 -0.00 2.91 0.04 -1.26 -1.33 135.00 140.79 1uhw s PRO 74 Ca 0.20 1.68 0.04 0.00 0.04 0.00 0.00 61.00 62.95 1uhw s PRO 74 Cb -0.15 -3.76 -0.03 0.00 0.04 0.00 0.00 34.50 30.61 1uhw s PRO 74 CO 0.08 -0.69 -0.10 0.00 0.04 0.00 0.00 177.00 176.32 1uhw s ALA 75 N 3.42 2.87 0.00 8.56 0.00 -1.14 -4.72 121.76 130.75 1uhw s ALA 75 Ca 0.55 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1uhw s ALA 75 Cb -0.22 -1.03 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1uhw s ALA 75 CO 0.15 0.59 0.00 0.41 0.00 0.00 0.00 175.76 176.92 1uhw n GLY 76 N 1.71 0.97 1.60 0.00 0.00 -1.26 -4.46 105.19 103.75 1uhw n GLY 76 Ca -0.16 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.64 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 0.47 0.02 0.00 1.61 2.03 -1.26 -4.77 116.55 114.66 1uhw n ASP 77 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1uhw n ASP 77 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1uhw n ASP 77 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1uhw n LEU 78 N -2.33 0.00 -0.34 -2.67 7.94 -1.26 0.62 117.00 118.95 1uhw n LEU 78 Ca 0.00 0.71 0.30 0.00 -1.11 0.00 0.00 56.01 55.91 1uhw n LEU 78 Cb 0.02 -0.21 0.56 0.00 0.53 0.00 0.00 43.42 44.31 1uhw n LEU 78 CO 0.00 -0.21 1.10 0.28 -1.11 0.00 0.00 177.39 177.45 1uhw h SER 79 N 0.00 0.38 -0.27 1.96 0.02 -1.90 1.46 113.55 115.20 1uhw h SER 79 Ca 0.00 0.22 0.01 0.00 -0.84 0.00 0.00 61.79 61.18 1uhw h SER 79 Cb 0.00 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 1uhw h SER 79 CO 0.00 -0.30 0.15 0.11 -1.14 0.00 0.00 176.83 175.65 1uhw h LYS 80 N 0.12 0.31 -0.62 3.45 1.57 -1.46 -1.30 116.57 118.64 1uhw h LYS 80 Ca 0.81 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.57 1uhw h LYS 80 Cb 2.10 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 34.31 1uhw h LYS 80 CO -0.67 0.20 0.38 -0.91 -0.57 0.00 0.00 179.45 177.89 1uhw h ASN 81 N 0.31 0.72 0.33 0.86 2.35 0.76 -2.58 115.58 118.34 1uhw h ASN 81 Ca 0.10 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1uhw h ASN 81 Cb 0.00 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.16 1uhw h ASN 81 CO -0.05 0.55 -0.49 0.00 -1.65 0.00 0.00 177.43 175.79 1uhw h ALA 82 N 1.58 -1.01 -0.41 -0.83 0.00 0.09 -1.31 119.26 117.37 1uhw h ALA 82 Ca 0.22 -0.15 -0.34 0.00 0.00 0.00 0.00 54.91 54.65 1uhw h ALA 82 Cb -0.06 0.75 -0.13 0.00 0.00 0.00 0.00 17.79 18.36 1uhw h ALA 82 CO -0.04 -1.12 0.30 0.00 0.00 0.00 0.00 179.25 178.39 1uhw n ALA 83 N -2.84 5.55 -0.01 0.00 0.00 -0.87 -3.50 120.51 118.85 1uhw n ALA 83 Ca -0.10 -1.96 -0.02 0.00 0.00 0.00 0.00 53.44 51.36 1uhw n ALA 83 Cb 0.43 -1.66 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 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 0.79 0.72 -0.79 0.00 -0.08 -0.49 -4.97 116.55 111.73 1uhw n ASP 84 Ca 0.34 0.11 -0.03 0.00 -1.51 0.00 0.00 54.79 53.70 1uhw n ASP 84 Cb 0.59 -0.36 -0.04 0.00 2.34 0.00 0.00 41.12 43.66 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 2.62 0.73 0.14 0.27 0.00 -1.23 -4.99 105.19 102.73 1uhw n GLY 85 Ca -0.03 -0.03 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 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 5.11 0.00 0.00 -0.61 1.08 -1.72 -3.50 117.51 117.87 1uhw h ILE 86 Ca -0.30 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 64.12 1uhw h ILE 86 Cb 1.25 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 1uhw h ILE 86 CO -0.15 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.31 1uhw n ALA 87 N -2.22 0.00 0.00 1.87 0.00 -1.26 -4.87 120.51 114.02 1uhw n ALA 87 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1uhw n ALA 87 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.59 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 -1.26 0.00 0.00 0.00 2.13 -1.26 -4.67 120.64 115.59 1uhw n GLU 88 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1uhw n GLU 88 Cb 0.00 -2.18 0.00 0.00 0.27 0.00 0.00 31.44 29.53 1uhw n GLU 88 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1uhw n ASN 89 N 0.00 0.00 0.11 4.31 4.13 -1.26 -5.04 115.26 117.52 1uhw n ASN 89 Ca 0.00 0.00 -0.03 0.00 1.68 0.00 0.00 54.58 56.23 1uhw n ASN 89 Cb 0.00 0.00 0.08 0.00 -1.54 0.00 0.00 39.78 38.32 1uhw n ASN 89 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1uhw h PRO 90 N 0.00 0.00 -7.05 3.52 0.13 -1.83 -3.45 132.00 123.32 1uhw h PRO 90 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 1uhw h PRO 90 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 1uhw h PRO 90 CO 0.00 0.73 0.37 0.12 -0.23 0.00 0.00 178.00 178.99 1uhw s PHE 91 N -3.30 3.14 -0.26 1.56 5.36 -1.26 -3.77 117.98 119.45 1uhw s PHE 91 Ca -0.00 1.60 0.01 0.00 -0.96 0.00 0.00 56.93 57.57 1uhw s PHE 91 Cb 0.12 -3.00 0.07 0.00 -0.34 0.00 0.00 43.02 39.86 1uhw s PHE 91 CO 0.78 -0.57 -0.01 -0.51 -1.46 0.00 0.00 175.22 173.45 1uhw s LEU 92 N -3.26 2.71 -0.59 6.12 1.43 -1.26 -4.97 118.68 118.85 1uhw s LEU 92 Ca 0.64 -1.35 -0.23 0.00 -1.03 0.00 0.00 54.13 52.17 1uhw s LEU 92 Cb -0.15 -1.15 -0.20 0.00 0.03 0.00 0.00 46.19 44.73 1uhw s LEU 92 CO 0.19 -0.29 1.84 -0.67 0.23 0.00 0.00 176.35 177.65 1uhw n ASP 93 N 4.67 2.27 -3.97 2.29 2.03 -1.26 -4.33 116.55 118.25 1uhw n ASP 93 Ca -0.08 -2.60 -0.10 0.00 0.52 0.00 0.00 54.79 52.52 1uhw n ASP 93 Cb 0.44 -0.96 -0.12 0.00 -0.72 0.00 0.00 41.12 39.76 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 5.34 0.26 0.00 1.67 0.15 -1.26 -4.63 113.70 115.23 1uhw s SER 94 Ca 0.58 -0.40 0.23 0.00 0.70 0.00 0.00 55.95 57.05 1uhw s SER 94 Cb 0.14 0.07 1.17 0.00 -1.71 0.00 0.00 66.02 65.69 1uhw s SER 94 CO 0.16 -0.23 1.74 -0.81 1.20 0.00 0.00 173.24 175.31 1uhw n PRO 95 N 1.90 0.36 -0.08 5.44 -0.04 -1.26 -1.57 135.00 139.74 1uhw n PRO 95 Ca -0.21 0.07 -0.17 0.00 -0.04 0.00 0.00 63.50 63.15 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 0.00 -2.28 3.54 3.32 -1.95 -3.45 116.42 115.60 1uhw h ASP 96 Ca 0.00 -0.74 -0.55 0.00 0.02 0.00 0.00 57.03 55.77 1uhw h ASP 96 Cb 0.20 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.76 1uhw h ASP 96 CO 0.00 1.18 1.30 0.00 -1.72 0.00 0.00 179.24 180.00 1uhw s ALA 97 N -2.30 3.35 -0.18 3.45 0.00 -1.18 -4.95 121.76 119.94 1uhw s ALA 97 Ca -0.22 1.17 -0.06 0.00 0.00 0.00 0.00 51.96 52.85 1uhw s ALA 97 Cb 0.01 -3.91 -0.04 0.00 0.00 0.00 0.00 23.12 19.19 1uhw s ALA 97 CO 0.61 -1.90 0.03 -0.06 0.00 0.00 0.00 175.76 174.45 1uhw s PHE 98 N 5.48 3.17 -0.05 0.00 0.08 -1.26 -1.64 117.98 123.76 1uhw s PHE 98 Ca 0.91 -0.08 0.04 0.00 0.12 0.00 0.00 56.93 57.92 1uhw s PHE 98 Cb -0.40 -2.06 -0.00 0.00 -0.57 0.00 0.00 43.02 39.99 1uhw s PHE 98 CO 0.40 0.05 -0.16 0.71 -0.10 0.00 0.00 175.22 176.12 1uhw s TYR 99 N 0.48 1.62 -0.00 0.36 2.02 -1.24 -2.88 117.35 117.72 1uhw s TYR 99 Ca 0.01 -0.48 0.05 0.00 -0.37 0.00 0.00 57.07 56.28 1uhw s TYR 99 Cb -0.13 -1.11 -0.01 0.00 -0.40 0.00 0.00 41.96 40.31 1uhw s TYR 99 CO 0.01 -0.18 -0.17 1.52 -1.57 0.00 0.00 175.55 175.17 1uhw s TYR 100 N 0.14 1.49 0.54 2.71 1.13 -0.44 -1.23 117.35 121.68 1uhw s TYR 100 Ca -0.05 -0.30 -0.22 0.00 -1.41 0.00 0.00 57.07 55.09 1uhw s TYR 100 Cb -0.12 -0.94 -0.06 0.00 -1.10 0.00 0.00 41.96 39.74 1uhw s TYR 100 CO 0.02 -0.01 1.28 1.19 -2.51 0.00 0.00 175.55 175.52 1uhw n PHE 101 N 2.51 2.02 -1.09 -3.49 3.72 -1.26 0.99 117.46 120.86 1uhw n PHE 101 Ca -0.15 0.45 -0.33 0.00 -0.05 0.00 0.00 57.45 57.37 1uhw n PHE 101 Cb 0.54 -2.33 -0.02 0.00 -0.94 0.00 0.00 39.48 36.73 1uhw n PHE 101 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1uhw n PRO 102 N -0.86 2.63 0.00 -1.08 -0.04 -1.26 -2.49 135.00 131.91 1uhw n PRO 102 Ca 0.10 -1.88 0.00 0.00 -0.04 0.00 0.00 63.50 61.68 1uhw n PRO 102 Cb 0.44 -2.72 0.00 0.00 -0.04 0.00 0.00 33.50 31.18 1uhw n PRO 102 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1uhw n ASP 103 N 4.63 0.00 -2.52 3.54 8.00 -1.26 -5.12 116.55 123.82 1uhw n ASP 103 Ca 0.57 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 56.04 1uhw n ASP 103 Cb 0.23 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.34 1uhw n ASP 103 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1uhw n SER 104 N -0.62 0.53 0.00 -2.24 2.88 -1.04 -4.71 113.62 108.43 1uhw n SER 104 Ca 0.00 -1.28 0.00 0.00 -1.33 0.00 0.00 58.87 56.26 1uhw n SER 104 Cb 0.00 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 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 3.76 0.29 0.15 0.46 0.00 -1.23 -4.62 105.19 103.99 1uhw n GLY 105 Ca 0.02 -1.94 -0.17 0.00 0.00 0.00 0.00 46.02 43.94 1uhw n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uhw h PRO 106 N 0.00 0.45 -6.04 1.61 0.13 -1.79 -3.35 132.00 123.00 1uhw h PRO 106 Ca 0.00 -0.44 -0.58 0.00 -0.87 0.00 0.00 66.00 64.11 1uhw h PRO 106 Cb 0.00 0.11 -0.11 0.00 0.13 0.00 0.00 31.00 31.14 1uhw h PRO 106 CO 0.00 1.09 0.78 0.45 -0.23 0.00 0.00 178.00 180.09 1uhw s SER 107 N -6.73 6.27 0.64 1.44 0.15 -1.26 -4.91 113.70 109.29 1uhw s SER 107 Ca -0.13 -0.45 -0.10 0.00 0.70 0.00 0.00 55.95 55.98 1uhw s SER 107 Cb 0.04 -2.49 -0.00 0.00 -1.71 0.00 0.00 66.02 61.86 1uhw s SER 107 CO 0.82 -1.51 1.01 -0.44 1.20 0.00 0.00 173.24 174.33 1uhw s SER 108 N 3.33 5.74 0.00 5.45 0.01 -1.26 -4.81 113.70 122.17 1uhw s SER 108 Ca 0.32 1.10 0.25 0.00 1.31 0.00 0.00 55.95 58.93 1uhw s SER 108 Cb -0.11 -2.04 0.44 0.00 0.21 0.00 0.00 66.02 64.52 1uhw s SER 108 CO 0.17 -1.10 1.40 0.61 0.41 0.00 0.00 173.24 174.73