#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dit n SER 2 N 0.00 -2.26 -4.11 1.61 2.88 -1.26 -4.85 113.62 105.62 2dit n SER 2 Ca 0.00 -1.09 -0.36 0.00 -1.33 0.00 0.00 58.87 56.09 2dit n SER 2 Cb 0.00 -2.41 0.08 0.00 -0.75 0.00 0.00 64.21 61.13 2dit n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dit n SER 3 N -2.66 -3.02 0.00 -3.46 3.41 -1.26 -5.02 113.62 101.60 2dit n SER 3 Ca 0.01 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2dit n SER 3 Cb 0.52 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 2dit n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dit n GLY 4 N 2.90 0.83 0.06 5.00 0.00 -1.26 -5.08 105.19 107.65 2dit n GLY 4 Ca -0.01 0.56 -0.06 0.00 0.00 0.00 0.00 46.02 46.51 2dit n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2dit h SER 5 N 0.00 0.00 -2.58 1.61 0.87 -2.04 -3.43 113.55 107.97 2dit h SER 5 Ca 0.00 -0.41 -0.57 0.00 -1.23 0.00 0.00 61.79 59.59 2dit h SER 5 Cb 0.00 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 2dit h SER 5 CO 0.00 0.73 1.29 -0.44 -0.53 0.00 0.00 176.83 177.87 2dit s SER 6 N -5.85 5.81 -0.41 6.23 0.01 -1.26 -4.87 113.70 113.36 2dit s SER 6 Ca -0.09 1.18 0.11 0.00 1.31 0.00 0.00 55.95 58.47 2dit s SER 6 Cb -0.01 -2.53 0.37 0.00 0.21 0.00 0.00 66.02 64.07 2dit s SER 6 CO 0.29 -1.80 0.85 0.61 0.41 0.00 0.00 173.24 173.60 2dit n GLY 7 N 5.45 3.82 0.00 3.44 0.00 -1.26 -5.08 105.19 111.56 2dit n GLY 7 Ca 0.23 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.32 2dit n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dit n GLY 8 N 0.05 3.01 0.28 -0.02 0.00 -1.26 -4.88 105.19 102.37 2dit n GLY 8 Ca 0.24 -1.56 0.17 0.00 0.00 0.00 0.00 46.02 44.87 2dit n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dit h PRO 9 N 0.00 0.00 -7.05 1.61 0.13 -2.02 -3.44 132.00 121.22 2dit h PRO 9 Ca 0.00 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.64 2dit h PRO 9 Cb 0.00 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.17 2dit h PRO 9 CO 0.00 0.02 0.18 0.45 -0.23 0.00 0.00 178.00 178.42 2dit s SER 10 N -5.72 6.09 0.61 1.44 0.15 -1.26 -5.04 113.70 109.98 2dit s SER 10 Ca 0.01 0.96 -0.19 0.00 0.70 0.00 0.00 55.95 57.43 2dit s SER 10 Cb 0.09 -2.15 -0.03 0.00 -1.71 0.00 0.00 66.02 62.22 2dit s SER 10 CO 0.55 -0.75 1.26 0.00 1.20 0.00 0.00 173.24 175.50 2dit s ARG 11 N -4.88 2.79 1.08 5.44 1.70 -1.26 -5.01 118.95 118.80 2dit s ARG 11 Ca 0.50 1.98 -0.18 0.00 -0.47 0.00 0.00 55.73 57.56 2dit s ARG 11 Cb -0.10 -1.92 0.26 0.00 -0.57 0.00 0.00 34.95 32.62 2dit s ARG 11 CO 0.46 -1.39 1.21 -1.33 -1.08 0.00 0.00 175.30 173.17 2dit n MET 12 N -1.69 -2.11 -0.53 3.89 2.81 -1.26 -4.93 117.12 113.30 2dit n MET 12 Ca 0.14 -1.89 -0.06 0.00 -1.81 0.00 0.00 57.70 54.08 2dit n MET 12 Cb 0.48 -1.47 0.12 0.00 -0.71 0.00 0.00 33.22 31.65 2dit n MET 12 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 2dit n ARG 13 N -4.24 2.03 -1.93 0.03 1.85 -1.26 -4.91 116.66 108.24 2dit n ARG 13 Ca 0.16 -1.46 -0.21 0.00 -1.00 0.00 0.00 57.85 55.34 2dit n ARG 13 Cb 0.57 -1.67 0.13 0.00 -1.05 0.00 0.00 32.46 30.44 2dit n ARG 13 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2dit n HIS 14 N -0.09 -3.42 -1.86 2.89 8.25 -1.26 -5.03 115.22 114.70 2dit n HIS 14 Ca 0.23 -1.23 -0.08 0.00 -0.26 0.00 0.00 57.72 56.38 2dit n HIS 14 Cb 0.94 -0.69 0.11 0.00 1.12 0.00 0.00 29.99 31.47 2dit n HIS 14 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 2dit n GLU 15 N -2.82 2.47 -1.45 -0.41 0.28 -1.26 -4.92 120.64 112.53 2dit n GLU 15 Ca 0.13 -3.66 -0.40 0.00 -0.16 0.00 0.00 57.16 53.07 2dit n GLU 15 Cb 0.47 -1.87 -0.02 0.00 1.43 0.00 0.00 31.44 31.46 2dit n GLU 15 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2dit n ARG 16 N -0.86 2.79 -3.82 3.44 3.00 -1.26 -4.52 116.66 115.42 2dit n ARG 16 Ca 0.30 -2.28 -0.16 0.00 -0.01 0.00 0.00 57.85 55.70 2dit n ARG 16 Cb 0.84 -3.04 -0.16 0.00 0.00 0.00 0.00 32.46 30.10 2dit n ARG 16 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2dit s VAL 17 N 3.24 0.02 -0.02 1.55 1.01 -1.26 -0.25 120.40 124.68 2dit s VAL 17 Ca 0.54 0.18 -0.01 0.00 0.00 0.00 0.00 61.98 62.68 2dit s VAL 17 Cb 0.15 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.35 2dit s VAL 17 CO -0.04 0.11 0.07 0.68 0.00 0.00 0.00 175.10 175.91 2dit s VAL 18 N 1.06 4.67 0.13 2.92 -7.23 -0.81 0.05 120.40 121.20 2dit s VAL 18 Ca -0.09 -0.36 0.05 0.00 -1.81 0.00 0.00 61.98 59.77 2dit s VAL 18 Cb -0.13 -3.10 -0.04 0.00 0.56 0.00 0.00 36.38 33.67 2dit s VAL 18 CO -0.03 0.41 0.08 -0.63 -0.31 0.00 0.00 175.10 174.62 2dit s ILE 19 N -1.13 4.29 -0.01 -0.62 -1.09 0.36 -1.72 121.20 121.28 2dit s ILE 19 Ca 0.21 -1.05 0.03 0.00 -2.23 0.00 0.00 60.65 57.61 2dit s ILE 19 Cb -0.12 -3.13 -0.01 0.00 -1.58 0.00 0.00 42.46 37.62 2dit s ILE 19 CO 0.11 -0.01 -0.11 -0.63 -1.23 0.00 0.00 174.94 173.07 2dit s ILE 20 N -1.59 0.87 0.17 2.92 -1.09 -1.17 -2.17 121.20 119.15 2dit s ILE 20 Ca 0.29 -0.46 0.10 0.00 -2.23 0.00 0.00 60.65 58.35 2dit s ILE 20 Cb -0.11 -0.73 -0.04 0.00 -1.58 0.00 0.00 42.46 40.00 2dit s ILE 20 CO 0.21 0.25 -0.22 -0.54 -1.23 0.00 0.00 174.94 173.41 2dit s LYS 21 N -0.18 1.40 -1.18 2.79 3.01 -1.06 -3.19 119.74 121.33 2dit s LYS 21 Ca 0.03 -1.44 -0.05 0.00 -1.01 0.00 0.00 55.97 53.50 2dit s LYS 21 Cb -0.05 -1.65 -0.02 0.00 -1.01 0.00 0.00 37.83 35.10 2dit s LYS 21 CO -0.00 0.36 0.85 -1.71 0.51 0.00 0.00 175.35 175.35 2dit n ASN 22 N 0.41 -3.71 0.00 2.83 5.15 -0.85 -2.54 115.26 116.55 2dit n ASN 22 Ca -0.14 -0.78 0.00 0.00 -0.60 0.00 0.00 54.58 53.06 2dit n ASN 22 Cb 0.56 -4.53 0.00 0.00 -0.53 0.00 0.00 39.78 35.28 2dit n ASN 22 CO 0.00 0.00 0.00 1.15 1.40 0.00 0.00 177.26 179.81 2dit n MET 23 N -3.91 2.04 -3.83 1.20 0.00 -1.26 -4.04 117.12 107.32 2dit n MET 23 Ca -0.19 0.00 -0.06 0.00 0.00 0.00 0.00 57.70 57.44 2dit n MET 23 Cb 0.64 -0.84 0.01 0.00 0.00 0.00 0.00 33.22 33.03 2dit n MET 23 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 175.97 175.38 2dit s PHE 24 N -1.40 -0.01 -0.06 3.17 -0.12 -1.26 -4.40 117.98 113.90 2dit s PHE 24 Ca 0.00 -0.51 -0.05 0.00 -0.05 0.00 0.00 56.93 56.31 2dit s PHE 24 Cb 0.00 0.75 0.02 0.00 -0.63 0.00 0.00 43.02 43.16 2dit s PHE 24 CO 0.00 -1.26 0.17 -1.58 -0.05 0.00 0.00 175.22 172.50 2dit s HIS 25 N -2.84 -0.18 -2.00 3.49 2.46 -1.26 -2.22 115.29 112.74 2dit s HIS 25 Ca 0.15 0.45 0.10 0.00 0.47 0.00 0.00 55.06 56.23 2dit s HIS 25 Cb -0.04 0.05 0.59 0.00 -0.13 0.00 0.00 32.58 33.04 2dit s HIS 25 CO 0.08 -0.10 1.03 -0.35 -2.47 0.00 0.00 174.74 172.93 2dit n PRO 26 N 3.12 0.49 0.00 2.88 -0.04 -1.26 -1.99 135.00 138.21 2dit n PRO 26 Ca -0.14 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.43 2dit n PRO 26 Cb 0.58 -1.31 -0.13 0.00 -0.04 0.00 0.00 33.50 32.59 2dit n PRO 26 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 2dit n MET 27 N -0.81 0.55 0.08 0.54 1.56 -1.26 -4.14 117.12 113.63 2dit n MET 27 Ca 0.07 -0.13 -0.17 0.00 -0.27 0.00 0.00 57.70 57.20 2dit n MET 27 Cb 0.03 -1.55 -0.14 0.00 2.15 0.00 0.00 33.22 33.71 2dit n MET 27 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 2dit h ASP 28 N 0.00 0.42 0.59 6.12 5.19 -1.77 -3.30 116.42 123.67 2dit h ASP 28 Ca 0.00 -0.54 -0.05 0.00 -0.62 0.00 0.00 57.03 55.82 2dit h ASP 28 Cb 0.92 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 40.28 2dit h ASP 28 CO 0.00 1.44 -0.23 -0.26 -3.12 0.00 0.00 179.24 177.07 2dit h PHE 29 N 0.07 0.00 0.00 4.55 0.04 -1.69 -2.07 116.94 117.84 2dit h PHE 29 Ca -0.21 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.56 2dit h PHE 29 Cb 2.01 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.16 2dit h PHE 29 CO 0.07 0.23 0.00 0.93 -0.60 0.00 0.00 178.31 178.94 2dit h GLU 30 N 0.00 0.00 0.00 1.51 5.08 -1.72 -3.02 114.58 116.43 2dit h GLU 30 Ca -0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.99 2dit h GLU 30 Cb 0.58 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.77 2dit h GLU 30 CO 0.03 0.00 -2.39 -3.47 -1.00 0.00 0.00 179.01 172.18 2dit n ASP 31 N -2.64 0.71 -3.64 1.42 -0.08 -0.83 -5.02 116.55 106.48 2dit n ASP 31 Ca 0.01 -0.04 -0.11 0.00 -1.51 0.00 0.00 54.79 53.14 2dit n ASP 31 Cb 0.26 0.55 -0.07 0.00 2.34 0.00 0.00 41.12 44.20 2dit n ASP 31 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 2dit s ASP 32 N -5.77 -0.57 0.15 1.67 1.01 -0.89 -5.06 116.67 107.21 2dit s ASP 32 Ca -0.18 1.10 -0.11 0.00 0.71 0.00 0.00 52.55 54.08 2dit s ASP 32 Cb 0.07 1.12 -0.03 0.00 1.01 0.00 0.00 42.92 45.09 2dit s ASP 32 CO 0.74 -0.19 1.48 1.55 0.21 0.00 0.00 175.17 178.97 2dit h PRO 33 N 4.61 0.94 -0.81 8.23 0.13 -1.85 -3.25 132.00 140.00 2dit h PRO 33 Ca -0.29 -0.49 0.22 0.00 -0.87 0.00 0.00 66.00 64.57 2dit h PRO 33 Cb 1.17 0.02 -0.15 0.00 0.13 0.00 0.00 31.00 32.16 2dit h PRO 33 CO 0.09 1.15 -0.01 1.28 -0.23 0.00 0.00 178.00 180.28 2dit n LEU 34 N -4.06 -0.12 -0.15 1.56 7.99 -1.26 0.28 117.00 121.23 2dit n LEU 34 Ca -0.02 1.39 -0.10 0.00 -0.01 0.00 0.00 56.01 57.27 2dit n LEU 34 Cb 0.54 -0.49 -0.05 0.00 -0.11 0.00 0.00 43.42 43.31 2dit n LEU 34 CO 0.49 -1.40 0.56 0.58 -1.51 0.00 0.00 177.39 176.11 2dit h VAL 35 N 0.00 0.09 -0.16 4.08 2.07 -1.89 0.31 116.25 120.75 2dit h VAL 35 Ca 0.48 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.94 2dit h VAL 35 Cb 0.97 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2dit h VAL 35 CO -0.78 0.00 -0.17 0.25 0.02 0.00 0.00 177.57 176.90 2dit h LEU 36 N -0.30 0.25 0.75 2.57 5.85 -0.39 -1.74 115.31 122.29 2dit h LEU 36 Ca 0.14 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 2dit h LEU 36 Cb 0.58 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.55 2dit h LEU 36 CO -0.62 0.44 -0.36 0.78 -0.34 0.00 0.00 178.44 178.34 2dit h ASN 37 N 0.24 -0.85 -0.75 1.25 2.35 0.50 0.21 115.58 118.53 2dit h ASN 37 Ca 0.05 0.03 0.07 0.00 -0.55 0.00 0.00 56.30 55.89 2dit h ASN 37 Cb 0.45 0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.98 2dit h ASN 37 CO 0.03 -0.54 0.43 1.05 -1.65 0.00 0.00 177.43 176.75 2dit h GLU 38 N -1.13 0.76 0.45 0.81 4.11 -0.53 -0.91 114.58 118.14 2dit h GLU 38 Ca -0.10 -0.05 -0.02 0.00 0.07 0.00 0.00 59.36 59.26 2dit h GLU 38 Cb 0.77 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2dit h GLU 38 CO 0.17 0.50 -0.22 0.82 0.07 0.00 0.00 179.01 180.36 2dit h ILE 39 N 0.78 0.55 0.32 -1.06 2.04 -1.29 0.41 117.51 119.27 2dit h ILE 39 Ca 0.34 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 66.04 2dit h ILE 39 Cb 0.21 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 2dit h ILE 39 CO -0.19 0.03 -0.50 -0.09 0.00 0.00 0.00 178.15 177.40 2dit h ARG 40 N -0.70 -0.83 -0.91 2.37 2.43 -0.31 -1.27 114.38 115.16 2dit h ARG 40 Ca -0.06 0.06 0.15 0.00 -0.81 0.00 0.00 59.98 59.31 2dit h ARG 40 Cb 0.51 0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 30.17 2dit h ARG 40 CO 0.10 -0.55 0.59 1.05 -1.51 0.00 0.00 179.97 179.65 2dit h GLU 41 N -0.86 0.69 -0.89 0.20 4.11 -1.21 -0.31 114.58 116.31 2dit h GLU 41 Ca -0.04 -0.04 0.02 0.00 0.07 0.00 0.00 59.36 59.37 2dit h GLU 41 Cb 0.79 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.83 2dit h GLU 41 CO -0.16 0.46 0.59 -0.44 0.07 0.00 0.00 179.01 179.53 2dit h ASP 42 N 0.71 0.99 -0.18 3.06 3.32 -0.07 -0.18 116.42 124.09 2dit h ASP 42 Ca 0.47 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.43 2dit h ASP 42 Cb 0.74 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.04 2dit h ASP 42 CO -0.22 0.70 -0.10 -0.07 -1.72 0.00 0.00 179.24 177.83 2dit h LEU 43 N 1.17 0.51 -0.35 1.55 3.38 0.05 0.19 115.31 121.81 2dit h LEU 43 Ca 0.34 -0.13 -0.19 0.00 0.09 0.00 0.00 57.88 57.99 2dit h LEU 43 Cb -0.06 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2dit h LEU 43 CO -0.10 0.65 -0.75 0.03 0.09 0.00 0.00 178.44 178.37 2dit h ARG 44 N 0.49 0.47 0.00 1.13 3.08 -0.96 -0.95 114.38 117.65 2dit h ARG 44 Ca 0.09 -0.39 -0.08 0.00 0.07 0.00 0.00 59.98 59.67 2dit h ARG 44 Cb 0.47 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 2dit h ARG 44 CO 0.03 1.03 -0.42 -0.39 -1.07 0.00 0.00 179.97 179.14 2dit h VAL 45 N 0.32 0.67 0.11 2.04 -1.51 -0.77 -2.33 116.25 114.78 2dit h VAL 45 Ca -0.04 -1.95 -0.19 0.00 -1.23 0.00 0.00 66.70 63.29 2dit h VAL 45 Cb 1.33 2.32 0.01 0.00 -2.13 0.00 0.00 31.29 32.82 2dit h VAL 45 CO 0.13 0.38 -0.93 1.05 -1.23 0.00 0.00 177.57 176.98 2dit h GLU 46 N 0.00 0.22 0.00 5.19 4.11 -0.57 -3.15 114.58 120.39 2dit h GLU 46 Ca -0.01 -0.38 0.00 0.00 0.07 0.00 0.00 59.36 59.04 2dit h GLU 46 Cb 1.31 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.70 2dit h GLU 46 CO 0.05 1.18 0.00 0.00 0.07 0.00 0.00 179.01 180.31 2dit h SER 48 N 0.00 0.22 -0.91 0.00 0.87 -1.51 -3.32 113.55 108.90 2dit h SER 48 Ca 0.00 -0.22 0.30 0.00 -1.23 0.00 0.00 61.79 60.64 2dit h SER 48 Cb 0.69 -0.07 -0.17 0.00 -0.44 0.00 0.00 62.40 62.41 2dit h SER 48 CO 0.00 1.15 0.20 0.29 -0.53 0.00 0.00 176.83 177.94 2dit n LYS 49 N -3.47 -0.07 0.08 2.24 4.76 -1.16 0.21 118.16 120.75 2dit n LYS 49 Ca -0.04 1.32 -0.11 0.00 -2.87 0.00 0.00 58.31 56.61 2dit n LYS 49 Cb 0.96 -2.20 -0.11 0.00 -1.84 0.00 0.00 35.03 31.84 2dit n LYS 49 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 2dit h PHE 50 N 0.00 0.24 0.00 2.13 -1.00 -1.78 -3.48 116.94 113.05 2dit h PHE 50 Ca 0.64 -0.17 0.00 0.00 2.81 0.00 0.00 57.97 61.25 2dit h PHE 50 Cb 1.48 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 41.03 2dit h PHE 50 CO -0.29 1.11 0.00 0.41 -1.61 0.00 0.00 178.31 177.93 2dit n GLY 51 N 1.37 -0.05 3.46 -1.45 0.00 0.56 -4.97 105.19 104.11 2dit n GLY 51 Ca -0.04 0.48 -0.16 0.00 0.00 0.00 0.00 46.02 46.31 2dit n GLY 51 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dit s GLN 52 N 1.26 1.91 -0.47 1.61 -0.21 -1.25 -4.62 119.66 117.90 2dit s GLN 52 Ca 0.00 -1.82 0.03 0.00 0.02 0.00 0.00 55.36 53.59 2dit s GLN 52 Cb 0.00 0.43 0.12 0.00 1.00 0.00 0.00 33.01 34.56 2dit s GLN 52 CO 0.00 -0.78 0.21 0.42 -2.12 0.00 0.00 175.29 173.02 2dit s ILE 53 N -3.07 2.61 0.40 1.08 -1.09 -1.26 -4.51 121.20 115.36 2dit s ILE 53 Ca 0.32 -2.95 0.08 0.00 -2.23 0.00 0.00 60.65 55.88 2dit s ILE 53 Cb -0.00 -2.84 0.29 0.00 -1.58 0.00 0.00 42.46 38.34 2dit s ILE 53 CO 0.22 -0.74 2.00 0.03 -1.23 0.00 0.00 174.94 175.22 2dit h ARG 54 N 6.94 0.58 -1.72 2.79 -0.00 -1.85 -3.44 114.38 117.68 2dit h ARG 54 Ca -0.06 -0.03 0.04 0.00 -0.50 0.00 0.00 59.98 59.42 2dit h ARG 54 Cb 0.94 -0.13 -0.25 0.00 0.00 0.00 0.00 29.97 30.53 2dit h ARG 54 CO 0.64 0.38 0.35 0.21 0.00 0.00 0.00 179.97 181.55 2dit s LYS 55 N -5.54 0.59 -0.08 0.04 2.47 -1.24 -5.01 119.74 110.98 2dit s LYS 55 Ca -0.09 0.74 0.00 0.00 -1.56 0.00 0.00 55.97 55.06 2dit s LYS 55 Cb 0.19 0.27 0.02 0.00 -1.46 0.00 0.00 37.83 36.85 2dit s LYS 55 CO 0.75 -0.08 -0.07 -1.17 0.16 0.00 0.00 175.35 174.95 2dit s LEU 56 N 0.40 1.23 -0.25 5.43 2.96 -1.26 0.35 118.68 127.54 2dit s LEU 56 Ca 0.01 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 2dit s LEU 56 Cb -0.05 -0.66 0.07 0.00 0.50 0.00 0.00 46.19 46.05 2dit s LEU 56 CO -0.05 -0.08 -0.03 -0.76 -1.32 0.00 0.00 176.35 174.11 2dit s LEU 57 N 1.29 2.66 -0.34 -0.68 1.43 -0.05 -5.00 118.68 117.99 2dit s LEU 57 Ca -0.04 -1.28 -0.18 0.00 -1.03 0.00 0.00 54.13 51.60 2dit s LEU 57 Cb -0.14 -1.16 -0.00 0.00 0.03 0.00 0.00 46.19 44.91 2dit s LEU 57 CO -0.03 -0.27 0.53 -0.22 0.23 0.00 0.00 176.35 176.60 2dit s LEU 58 N 1.39 4.30 -0.87 1.79 0.20 -1.26 -0.18 118.68 124.06 2dit s LEU 58 Ca -0.03 0.05 -0.23 0.00 0.69 0.00 0.00 54.13 54.61 2dit s LEU 58 Cb -0.19 -2.62 0.07 0.00 -0.43 0.00 0.00 46.19 43.02 2dit s LEU 58 CO -0.08 -0.48 1.25 -0.36 -0.29 0.00 0.00 176.35 176.39 2dit s PHE 59 N 2.43 2.62 -0.24 5.38 0.08 -0.53 -4.85 117.98 122.88 2dit s PHE 59 Ca 0.20 -0.72 0.01 0.00 0.12 0.00 0.00 56.93 56.54 2dit s PHE 59 Cb -0.15 -4.52 0.09 0.00 -0.57 0.00 0.00 43.02 37.87 2dit s PHE 59 CO 0.13 -1.82 1.03 -0.40 -0.10 0.00 0.00 175.22 174.05 2dit n ASP 60 N 8.28 2.79 -0.04 1.36 5.75 -1.26 -3.56 116.55 129.86 2dit n ASP 60 Ca 0.17 -2.20 -0.07 0.00 -0.01 0.00 0.00 54.79 52.68 2dit n ASP 60 Cb 0.49 -0.54 -0.04 0.00 -1.03 0.00 0.00 41.12 40.00 2dit n ASP 60 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2dit n ARG 61 N 0.24 0.21 -1.93 0.11 5.12 -1.26 -4.52 116.66 114.63 2dit n ARG 61 Ca 0.07 0.06 -0.42 0.00 -1.93 0.00 0.00 57.85 55.63 2dit n ARG 61 Cb 0.60 -1.08 -0.03 0.00 -1.16 0.00 0.00 32.46 30.79 2dit n ARG 61 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2dit s HIS 62 N -2.17 1.87 -2.00 -1.55 2.46 -1.23 -4.80 115.29 107.86 2dit s HIS 62 Ca -0.12 0.07 0.09 0.00 0.47 0.00 0.00 55.06 55.56 2dit s HIS 62 Cb 0.04 -3.99 0.51 0.00 -0.13 0.00 0.00 32.58 29.01 2dit s HIS 62 CO 0.19 -4.22 0.96 -0.35 -2.47 0.00 0.00 174.74 168.85 2dit n PRO 63 N 7.07 0.49 -0.18 2.88 -0.04 -1.26 -1.98 135.00 141.98 2dit n PRO 63 Ca 0.18 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.71 2dit n PRO 63 Cb 0.42 -1.28 0.16 0.00 -0.04 0.00 0.00 33.50 32.76 2dit n PRO 63 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2dit n ASP 64 N -0.78 2.82 -2.73 3.54 -0.08 -1.26 -4.82 116.55 113.24 2dit n ASP 64 Ca 0.06 -2.82 -0.04 0.00 -1.51 0.00 0.00 54.79 50.48 2dit n ASP 64 Cb 0.03 -0.39 -0.03 0.00 2.34 0.00 0.00 41.12 43.07 2dit n ASP 64 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dit n GLY 65 N -0.86 -3.91 2.84 0.27 0.00 -0.84 -2.01 105.19 100.69 2dit n GLY 65 Ca 0.15 1.32 -0.23 0.00 0.00 0.00 0.00 46.02 47.26 2dit n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dit s VAL 66 N -0.56 0.58 0.19 1.61 1.01 -1.25 -3.04 120.40 118.93 2dit s VAL 66 Ca -0.21 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 61.80 2dit s VAL 66 Cb 0.01 -0.66 -0.05 0.00 0.00 0.00 0.00 36.38 35.69 2dit s VAL 66 CO 0.60 0.27 -0.15 0.00 0.00 0.00 0.00 175.10 175.82 2dit s ALA 67 N 1.54 1.95 -0.27 5.51 0.00 -1.19 -1.46 121.76 127.84 2dit s ALA 67 Ca -0.01 -1.60 0.01 0.00 0.00 0.00 0.00 51.96 50.37 2dit s ALA 67 Cb -0.13 -0.09 0.08 0.00 0.00 0.00 0.00 23.12 22.97 2dit s ALA 67 CO -0.04 0.08 -0.01 0.45 0.00 0.00 0.00 175.76 176.24 2dit s SER 68 N -3.16 4.14 -0.48 0.00 0.15 0.74 -3.03 113.70 112.06 2dit s SER 68 Ca 0.20 -1.49 -0.14 0.00 0.70 0.00 0.00 55.95 55.22 2dit s SER 68 Cb -0.02 -1.27 0.09 0.00 -1.71 0.00 0.00 66.02 63.12 2dit s SER 68 CO 0.06 -0.29 0.40 -0.69 1.20 0.00 0.00 173.24 173.92 2dit s VAL 69 N 1.29 4.99 0.34 4.45 1.01 -0.70 -0.87 120.40 130.91 2dit s VAL 69 Ca 0.00 -1.30 -0.26 0.00 0.00 0.00 0.00 61.98 60.43 2dit s VAL 69 Cb -0.19 -4.07 -0.10 0.00 0.00 0.00 0.00 36.38 32.02 2dit s VAL 69 CO -0.09 -0.66 1.00 -0.44 0.00 0.00 0.00 175.10 174.90 2dit s SER 70 N 2.81 7.13 0.46 3.32 0.01 0.16 -1.92 113.70 125.67 2dit s SER 70 Ca 0.04 1.95 0.03 0.00 1.31 0.00 0.00 55.95 59.27 2dit s SER 70 Cb -0.26 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.37 2dit s SER 70 CO 0.04 -0.22 0.07 -0.36 0.41 0.00 0.00 173.24 173.18 2dit s PHE 71 N -1.58 1.82 -0.04 2.43 0.40 0.65 -3.01 117.98 118.66 2dit s PHE 71 Ca 0.52 -1.13 0.02 0.00 -0.60 0.00 0.00 56.93 55.74 2dit s PHE 71 Cb -0.21 -1.38 -0.04 0.00 0.51 0.00 0.00 43.02 41.90 2dit s PHE 71 CO 0.27 -0.05 -0.00 -2.13 0.70 0.00 0.00 175.22 174.01 2dit n ARG 72 N -1.09 2.46 -4.26 0.44 3.00 -1.26 -4.81 116.66 111.14 2dit n ARG 72 Ca -0.13 0.01 -0.35 0.00 -0.00 0.00 0.00 57.85 57.38 2dit n ARG 72 Cb 0.66 -1.09 -0.09 0.00 0.00 0.00 0.00 32.46 31.94 2dit n ARG 72 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2dit s ASP 73 N -3.72 5.45 0.54 6.15 1.11 -1.26 -5.00 116.67 119.94 2dit s ASP 73 Ca -0.03 0.18 0.33 0.00 0.18 0.00 0.00 52.55 53.22 2dit s ASP 73 Cb 0.01 -1.63 1.38 0.00 1.07 0.00 0.00 42.92 43.75 2dit s ASP 73 CO 0.13 0.36 1.98 1.55 1.18 0.00 0.00 175.17 180.37 2dit h PRO 74 N 5.32 0.00 0.00 8.23 0.13 -1.99 -3.07 132.00 140.62 2dit h PRO 74 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 2dit h PRO 74 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dit h PRO 74 CO 0.57 0.00 -0.11 0.93 -0.23 0.00 0.00 178.00 179.16 2dit h GLU 75 N 0.00 0.00 -0.59 0.86 5.08 -1.98 -3.01 114.58 114.94 2dit h GLU 75 Ca 0.00 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.48 2dit h GLU 75 Cb 0.48 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.62 2dit h GLU 75 CO 0.00 0.40 -0.13 0.93 -1.00 0.00 0.00 179.01 179.21 2dit h GLU 76 N -1.00 0.01 0.08 2.33 3.07 -1.93 -0.84 114.58 116.30 2dit h GLU 76 Ca -0.02 -0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2dit h GLU 76 Cb 0.45 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.36 2dit h GLU 76 CO -0.01 0.01 -0.04 0.00 -1.40 0.00 0.00 179.01 177.57 2dit h ALA 77 N 1.58 -1.02 -1.69 3.43 0.00 -1.69 0.73 119.26 120.59 2dit h ALA 77 Ca 0.28 -0.02 0.49 0.00 0.00 0.00 0.00 54.91 55.66 2dit h ALA 77 Cb 0.44 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 2dit h ALA 77 CO -0.59 -1.02 1.36 0.22 0.00 0.00 0.00 179.25 179.22 2dit h ASP 78 N -0.11 0.00 0.37 0.00 3.58 -1.37 1.94 116.42 120.83 2dit h ASP 78 Ca -0.01 0.00 -0.32 0.00 0.42 0.00 0.00 57.03 57.12 2dit h ASP 78 Cb 0.08 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 2dit h ASP 78 CO 0.02 0.00 -1.78 0.22 -2.88 0.00 0.00 179.24 174.82 2dit h TYR 79 N 0.00 0.21 0.00 0.28 3.20 -0.75 -3.33 116.97 116.57 2dit h TYR 79 Ca 0.80 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 62.52 2dit h TYR 79 Cb 3.52 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 41.78 2dit h TYR 79 CO 0.00 1.31 0.00 0.00 -1.64 0.00 0.00 178.16 177.83 2dit h ILE 81 N 0.00 1.26 0.00 0.00 -0.00 -1.24 -1.66 117.51 115.87 2dit h ILE 81 Ca 0.00 -2.89 -0.11 0.00 -0.00 0.00 0.00 64.86 61.87 2dit h ILE 81 Cb 0.36 2.60 -0.02 0.00 -0.00 0.00 0.00 36.82 39.76 2dit h ILE 81 CO 0.00 0.72 -1.38 0.00 -0.00 0.00 0.00 178.15 177.49 2dit n GLN 82 N -3.23 0.62 0.02 0.16 10.64 -0.91 -2.95 117.38 121.74 2dit n GLN 82 Ca -0.03 0.15 -0.00 0.00 -1.83 0.00 0.00 57.00 55.29 2dit n GLN 82 Cb 0.90 -1.78 -0.09 0.00 -0.86 0.00 0.00 30.24 28.41 2dit n GLN 82 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 2dit n THR 83 N -2.76 1.14 1.08 -0.39 -1.04 -0.47 -3.97 114.28 107.87 2dit n THR 83 Ca -0.07 -0.69 0.12 0.00 -2.04 0.00 0.00 64.05 61.36 2dit n THR 83 Cb 0.74 -0.68 0.15 0.00 -1.82 0.00 0.00 70.33 68.72 2dit n THR 83 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2dit n LEU 84 N -2.85 1.19 0.00 -4.42 4.77 -0.62 -4.04 117.00 111.03 2dit n LEU 84 Ca -0.11 -0.39 0.05 0.00 -0.03 0.00 0.00 56.01 55.53 2dit n LEU 84 Cb 0.84 -0.09 0.24 0.00 -2.33 0.00 0.00 43.42 42.08 2dit n LEU 84 CO 0.43 0.24 0.62 -0.90 -1.33 0.00 0.00 177.39 176.45 2dit n ASP 85 N -0.81 0.00 -0.05 -1.43 5.75 -1.15 -1.99 116.55 116.87 2dit n ASP 85 Ca 0.08 0.28 0.01 0.00 -0.01 0.00 0.00 54.79 55.16 2dit n ASP 85 Cb 0.38 -0.37 0.01 0.00 -1.03 0.00 0.00 41.12 40.11 2dit n ASP 85 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dit n GLY 86 N -0.46 0.86 3.63 6.12 0.00 -1.20 -4.19 105.19 109.96 2dit n GLY 86 Ca 0.04 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 2dit n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dit s ARG 87 N -0.76 0.47 -0.10 1.61 1.81 -0.84 -4.65 118.95 116.49 2dit s ARG 87 Ca 0.03 1.10 0.01 0.00 -1.72 0.00 0.00 55.73 55.15 2dit s ARG 87 Cb 0.03 -1.70 0.02 0.00 -0.45 0.00 0.00 34.95 32.85 2dit s ARG 87 CO 0.00 -2.86 -0.11 -1.58 -0.68 0.00 0.00 175.30 170.07 2dit s TRP 88 N -2.67 1.67 -0.01 -0.53 0.52 -1.26 0.76 118.94 117.42 2dit s TRP 88 Ca 0.66 -0.79 0.05 0.00 0.02 0.00 0.00 56.10 56.04 2dit s TRP 88 Cb -0.22 -1.28 -0.01 0.00 -1.15 0.00 0.00 33.47 30.81 2dit s TRP 88 CO 0.60 -0.46 -0.16 -0.06 0.02 0.00 0.00 176.95 176.89 2dit s PHE 89 N 1.23 1.42 0.00 -1.98 0.40 0.32 -4.71 117.98 114.66 2dit s PHE 89 Ca -0.03 -0.27 0.00 0.00 -0.60 0.00 0.00 56.93 56.03 2dit s PHE 89 Cb -0.14 -0.91 0.00 0.00 0.51 0.00 0.00 43.02 42.48 2dit s PHE 89 CO -0.04 -0.02 0.00 0.41 0.70 0.00 0.00 175.22 176.27 2dit n GLY 90 N 2.65 0.13 0.00 4.36 0.00 -1.26 -1.17 105.19 109.90 2dit n GLY 90 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2dit n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dit n GLY 91 N -0.91 1.85 3.80 -0.02 0.00 -1.26 -5.09 105.19 103.55 2dit n GLY 91 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2dit n GLY 91 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2dit s ARG 92 N -0.43 2.46 0.55 1.61 1.70 -0.32 -5.07 118.95 119.45 2dit s ARG 92 Ca 0.00 -1.55 -0.08 0.00 -0.47 0.00 0.00 55.73 53.63 2dit s ARG 92 Cb 0.00 -2.25 -0.04 0.00 -0.57 0.00 0.00 34.95 32.09 2dit s ARG 92 CO 0.00 -0.02 0.91 -1.14 -1.08 0.00 0.00 175.30 173.97 2dit s GLN 93 N -3.96 3.55 0.16 3.89 0.74 -1.26 0.12 119.66 122.89 2dit s GLN 93 Ca 0.42 0.46 0.00 0.00 0.05 0.00 0.00 55.36 56.29 2dit s GLN 93 Cb -0.02 -2.23 -0.04 0.00 1.10 0.00 0.00 33.01 31.82 2dit s GLN 93 CO 0.25 -0.40 0.05 0.96 -0.55 0.00 0.00 175.29 175.59 2dit s ILE 94 N -2.96 0.35 0.26 -2.34 -4.36 0.23 -4.69 121.20 107.68 2dit s ILE 94 Ca 0.51 -1.95 0.11 0.00 -0.26 0.00 0.00 60.65 59.06 2dit s ILE 94 Cb -0.11 -2.17 -0.05 0.00 1.25 0.00 0.00 42.46 41.39 2dit s ILE 94 CO 0.49 -0.39 -0.14 0.28 0.24 0.00 0.00 174.94 175.42 2dit s THR 95 N -3.88 2.79 0.07 8.37 -1.32 -1.05 -3.23 115.64 117.39 2dit s THR 95 Ca 0.26 -2.16 0.03 0.00 -1.21 0.00 0.00 61.69 58.62 2dit s THR 95 Cb 0.07 -2.45 -0.03 0.00 -1.51 0.00 0.00 72.50 68.58 2dit s THR 95 CO 0.05 -0.33 -0.10 0.00 -2.21 0.00 0.00 174.62 172.03 2dit s ALA 96 N -2.28 0.88 0.10 11.08 0.00 -1.25 -2.57 121.76 127.72 2dit s ALA 96 Ca 0.29 -0.96 -0.26 0.00 0.00 0.00 0.00 51.96 51.03 2dit s ALA 96 Cb -0.06 0.01 0.08 0.00 0.00 0.00 0.00 23.12 23.15 2dit s ALA 96 CO 0.16 0.01 0.82 1.14 0.00 0.00 0.00 175.76 177.89 2dit s GLN 97 N -2.05 1.12 -0.03 0.00 0.00 -0.92 -4.70 119.66 113.07 2dit s GLN 97 Ca -0.03 -0.50 -0.20 0.00 -0.00 0.00 0.00 55.36 54.64 2dit s GLN 97 Cb -0.07 0.46 -0.05 0.00 0.00 0.00 0.00 33.01 33.35 2dit s GLN 97 CO 0.00 -0.50 0.56 0.00 0.00 0.00 0.00 175.29 175.35 2dit s ALA 98 N -3.40 3.50 0.66 2.60 0.00 -1.26 -0.49 121.76 123.37 2dit s ALA 98 Ca 0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 51.96 51.95 2dit s ALA 98 Cb -0.02 -2.70 0.06 0.00 0.00 0.00 0.00 23.12 20.46 2dit s ALA 98 CO -0.06 0.15 0.94 -0.46 0.00 0.00 0.00 175.76 176.33 2dit s TRP 99 N -0.05 2.83 0.13 0.00 -0.00 0.11 -4.88 118.94 117.07 2dit s TRP 99 Ca 0.30 0.26 0.00 0.00 -0.00 0.00 0.00 56.10 56.65 2dit s TRP 99 Cb -0.17 -3.05 0.00 0.00 -0.00 0.00 0.00 33.47 30.24 2dit s TRP 99 CO 0.15 -1.26 0.00 -0.25 -0.00 0.00 0.00 176.95 175.60 2dit n ASP 100 N -2.73 0.14 0.00 5.86 9.92 -1.26 -4.73 116.55 123.75 2dit n ASP 100 Ca 0.08 0.22 0.00 0.00 -0.53 0.00 0.00 54.79 54.56 2dit n ASP 100 Cb 0.60 0.10 0.00 0.00 -0.64 0.00 0.00 41.12 41.18 2dit n ASP 100 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dit n GLY 101 N 2.18 -0.85 0.84 0.44 0.00 -1.26 -4.80 105.19 101.74 2dit n GLY 101 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2dit n GLY 101 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2dit n THR 102 N 0.00 0.00 -1.11 2.61 5.66 -1.26 -5.09 114.28 115.08 2dit n THR 102 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 2dit n THR 102 Cb 0.00 -0.57 0.11 0.00 -1.55 0.00 0.00 70.33 68.32 2dit n THR 102 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 2dit n THR 103 N -2.32 1.64 -1.31 1.09 5.66 -1.26 -4.93 114.28 112.85 2dit n THR 103 Ca 0.00 -0.27 -0.05 0.00 -3.05 0.00 0.00 64.05 60.68 2dit n THR 103 Cb 0.20 -0.94 0.21 0.00 -1.55 0.00 0.00 70.33 68.25 2dit n THR 103 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 2dit n ASP 104 N -1.87 3.06 -0.06 1.09 5.68 -1.26 -4.64 116.55 118.54 2dit n ASP 104 Ca 0.11 -3.58 -0.13 0.00 -0.50 0.00 0.00 54.79 50.69 2dit n ASP 104 Cb 0.51 -0.66 -0.09 0.00 -1.14 0.00 0.00 41.12 39.74 2dit n ASP 104 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 2dit h TYR 105 N 1.25 -1.50 0.00 2.11 0.05 -2.03 -3.21 116.97 113.63 2dit h TYR 105 Ca 0.25 0.06 0.00 0.00 0.05 0.00 0.00 58.73 59.09 2dit h TYR 105 Cb 1.84 0.69 0.00 0.00 1.01 0.00 0.00 36.73 40.27 2dit h TYR 105 CO 1.04 -0.47 -1.50 0.00 -1.05 0.00 0.00 178.16 176.17 2dit n GLN 106 N -5.13 0.78 -2.03 4.88 0.00 -1.26 -5.00 117.38 109.62 2dit n GLN 106 Ca -0.04 -0.11 -0.31 0.00 0.00 0.00 0.00 57.00 56.53 2dit n GLN 106 Cb 0.33 -1.33 -0.00 0.00 0.00 0.00 0.00 30.24 29.23 2dit n GLN 106 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2dit s SER 107 N -3.50 6.33 -0.06 2.61 0.01 -1.21 -5.09 113.70 112.79 2dit s SER 107 Ca -0.03 1.44 -0.14 0.00 1.31 0.00 0.00 55.95 58.53 2dit s SER 107 Cb 0.10 -2.47 0.03 0.00 0.21 0.00 0.00 66.02 63.89 2dit s SER 107 CO 0.63 -0.79 0.34 -0.83 0.41 0.00 0.00 173.24 173.01 2dit s GLY 108 N -3.89 -0.21 0.07 3.44 0.00 -1.26 -4.72 107.32 100.74 2dit s GLY 108 Ca 0.56 0.64 0.17 0.00 0.00 0.00 0.00 44.72 46.08 2dit s GLY 108 CO 0.48 0.45 1.52 -1.55 0.00 0.00 0.00 173.10 174.00 2dit n PRO 109 N 1.93 0.05 -4.22 2.90 -0.04 -1.26 -4.66 135.00 129.69 2dit n PRO 109 Ca -0.18 0.30 -0.35 0.00 -0.04 0.00 0.00 63.50 63.23 2dit n PRO 109 Cb 0.57 -1.60 -0.10 0.00 -0.04 0.00 0.00 33.50 32.33 2dit n PRO 109 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dit s SER 110 N -3.32 5.37 1.00 3.54 0.15 -1.26 -5.09 113.70 114.09 2dit s SER 110 Ca 0.06 0.09 -0.18 0.00 0.70 0.00 0.00 55.95 56.63 2dit s SER 110 Cb 0.09 -1.74 -0.06 0.00 -1.71 0.00 0.00 66.02 62.60 2dit s SER 110 CO 0.29 0.27 -0.41 -1.20 1.20 0.00 0.00 173.24 173.39 2dit n SER 111 N 2.87 -3.69 0.00 5.45 7.64 -1.26 -5.18 113.62 119.44 2dit n SER 111 Ca -0.18 0.15 0.00 0.00 1.01 0.00 0.00 58.87 59.85 2dit n SER 111 Cb 0.53 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 2dit n SER 111 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64