#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dit s SER 2 N 0.00 4.25 -0.14 1.61 0.15 -1.26 -4.99 113.70 113.32 2dit s SER 2 Ca 0.00 2.36 -0.11 0.00 0.70 0.00 0.00 55.95 58.91 2dit s SER 2 Cb 0.00 -2.59 -0.06 0.00 -1.71 0.00 0.00 66.02 61.66 2dit s SER 2 CO 0.00 -2.23 -0.24 -0.24 1.20 0.00 0.00 173.24 171.73 2dit n SER 3 N -2.66 1.49 -0.52 5.45 2.88 -1.26 -5.06 113.62 113.94 2dit n SER 3 Ca 0.13 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.92 2dit n SER 3 Cb 0.50 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 63.38 2dit n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dit n GLY 4 N 1.97 0.78 2.99 0.46 0.00 -1.26 -5.08 105.19 105.06 2dit n GLY 4 Ca -0.24 -0.47 -0.05 0.00 0.00 0.00 0.00 46.02 45.26 2dit n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dit s SER 5 N -2.68 -0.24 -1.17 1.61 1.04 -1.26 -5.08 113.70 105.91 2dit s SER 5 Ca 0.00 0.44 -0.20 0.00 0.48 0.00 0.00 55.95 56.66 2dit s SER 5 Cb 0.00 1.43 0.06 0.00 0.10 0.00 0.00 66.02 67.61 2dit s SER 5 CO 0.00 -0.29 1.61 -0.55 0.98 0.00 0.00 173.24 174.99 2dit s SER 6 N 2.64 6.68 1.40 7.02 0.15 -1.26 -4.90 113.70 125.43 2dit s SER 6 Ca 0.15 -2.00 0.00 0.00 0.70 0.00 0.00 55.95 54.80 2dit s SER 6 Cb -0.15 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 2dit s SER 6 CO -0.17 -1.33 0.00 0.61 1.20 0.00 0.00 173.24 173.55 2dit n GLY 7 N 6.07 3.23 2.43 9.45 0.00 -1.26 -4.22 105.19 120.89 2dit n GLY 7 Ca 0.42 -0.23 -0.16 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 1.82 0.25 -0.02 0.00 -1.26 -4.95 105.19 101.02 2dit n GLY 8 Ca 0.00 -0.86 0.13 0.00 0.00 0.00 0.00 46.02 45.29 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 3.71 0.00 -6.12 1.61 0.13 -2.02 -3.43 132.00 125.89 2dit h PRO 9 Ca -0.01 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.54 2dit h PRO 9 Cb 0.97 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.05 2dit h PRO 9 CO 0.38 0.13 0.87 -1.12 -0.23 0.00 0.00 178.00 178.03 2dit s SER 10 N -6.00 7.00 1.03 1.44 0.01 -1.26 -5.00 113.70 110.92 2dit s SER 10 Ca 0.00 1.58 -0.20 0.00 1.31 0.00 0.00 55.95 58.64 2dit s SER 10 Cb 0.10 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.74 2dit s SER 10 CO 0.59 -0.73 -0.55 0.54 0.41 0.00 0.00 173.24 173.50 2dit n ARG 11 N 6.50 -0.54 -1.50 12.44 1.74 -1.26 -4.53 116.66 129.52 2dit n ARG 11 Ca 0.13 -0.14 -0.12 0.00 -0.77 0.00 0.00 57.85 56.95 2dit n ARG 11 Cb 0.45 -1.37 -0.10 0.00 -1.02 0.00 0.00 32.46 30.42 2dit n ARG 11 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dit n MET 12 N 0.32 0.10 -2.81 5.56 0.00 -1.26 -4.82 117.12 114.22 2dit n MET 12 Ca 0.00 -1.42 -0.43 0.00 0.00 0.00 0.00 57.70 55.86 2dit n MET 12 Cb 0.63 -3.52 -0.03 0.00 0.00 0.00 0.00 33.22 30.31 2dit n MET 12 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 2dit s ARG 13 N 8.09 3.62 -0.19 3.17 0.52 -1.26 -4.91 118.95 127.98 2dit s ARG 13 Ca 0.72 -1.58 -0.34 0.00 -0.52 0.00 0.00 55.73 54.01 2dit s ARG 13 Cb -0.05 -5.07 0.14 0.00 0.52 0.00 0.00 34.95 30.49 2dit s ARG 13 CO 0.16 -1.92 1.20 -3.38 0.02 0.00 0.00 175.30 171.38 2dit s HIS 14 N 3.41 -0.14 0.07 -0.53 -3.43 -1.26 -5.14 115.29 108.26 2dit s HIS 14 Ca 0.37 0.12 -0.30 0.00 -0.80 0.00 0.00 55.06 54.46 2dit s HIS 14 Cb -0.03 0.51 -0.05 0.00 -1.43 0.00 0.00 32.58 31.58 2dit s HIS 14 CO -0.09 -0.21 1.07 -1.21 -2.00 0.00 0.00 174.74 172.30 2dit s GLU 15 N -2.18 4.55 -0.25 -0.38 8.01 -1.26 -4.95 118.70 122.24 2dit s GLU 15 Ca 0.08 1.59 0.18 0.00 0.01 0.00 0.00 54.97 56.83 2dit s GLU 15 Cb -0.01 -3.38 0.49 0.00 -4.31 0.00 0.00 34.13 26.92 2dit s GLU 15 CO -0.05 -0.05 1.14 2.89 0.01 0.00 0.00 175.26 179.20 2dit n ARG 16 N 3.46 2.15 -4.13 1.61 -4.01 -1.26 -4.85 116.66 109.63 2dit n ARG 16 Ca 0.06 -3.59 -0.16 0.00 -1.04 0.00 0.00 57.85 53.12 2dit n ARG 16 Cb 0.48 -1.69 -0.12 0.00 -3.04 0.00 0.00 32.46 28.09 2dit n ARG 16 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 2dit s VAL 17 N -3.76 0.82 0.04 8.89 1.01 -1.26 -0.23 120.40 125.91 2dit s VAL 17 Ca 0.35 -1.16 0.05 0.00 0.00 0.00 0.00 61.98 61.22 2dit s VAL 17 Cb 0.35 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 2dit s VAL 17 CO -0.03 -0.28 -0.15 0.68 0.00 0.00 0.00 175.10 175.33 2dit s VAL 18 N -1.28 1.15 0.03 2.92 -7.23 -0.99 -1.44 120.40 113.56 2dit s VAL 18 Ca -0.06 -1.01 0.05 0.00 -1.81 0.00 0.00 61.98 59.16 2dit s VAL 18 Cb -0.10 -1.04 -0.03 0.00 0.56 0.00 0.00 36.38 35.77 2dit s VAL 18 CO 0.01 0.02 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.08 2dit s ILE 19 N -0.84 3.25 0.10 -0.62 -1.09 0.88 -2.11 121.20 120.77 2dit s ILE 19 Ca 0.02 -0.98 0.08 0.00 -2.23 0.00 0.00 60.65 57.54 2dit s ILE 19 Cb -0.08 -2.40 -0.03 0.00 -1.58 0.00 0.00 42.46 38.37 2dit s ILE 19 CO 0.01 0.36 -0.20 -0.63 -1.23 0.00 0.00 174.94 173.24 2dit s ILE 20 N -0.97 1.65 0.26 2.92 -1.09 -1.17 -2.24 121.20 120.55 2dit s ILE 20 Ca 0.16 -1.52 0.04 0.00 -2.23 0.00 0.00 60.65 57.11 2dit s ILE 20 Cb -0.11 -1.51 -0.05 0.00 -1.58 0.00 0.00 42.46 39.21 2dit s ILE 20 CO 0.07 -0.07 -0.01 -0.54 -1.23 0.00 0.00 174.94 173.16 2dit s LYS 21 N -1.89 1.44 -1.34 2.79 3.01 -1.14 -3.36 119.74 119.25 2dit s LYS 21 Ca 0.06 -1.74 -0.15 0.00 -1.01 0.00 0.00 55.97 53.12 2dit s LYS 21 Cb -0.10 -0.78 0.01 0.00 -1.01 0.00 0.00 37.83 35.95 2dit s LYS 21 CO 0.04 -0.08 0.44 -1.71 0.51 0.00 0.00 175.35 174.55 2dit n ASN 22 N -0.50 -2.00 0.00 2.83 5.15 -0.74 -3.60 115.26 116.40 2dit n ASN 22 Ca -0.05 -1.19 0.00 0.00 -0.60 0.00 0.00 54.58 52.74 2dit n ASN 22 Cb 0.64 -2.19 0.00 0.00 -0.53 0.00 0.00 39.78 37.70 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 -4.65 2.04 -3.83 1.20 0.00 -1.26 -4.27 117.12 106.34 2dit n MET 23 Ca -0.21 0.00 -0.03 0.00 0.00 0.00 0.00 57.70 57.45 2dit n MET 23 Cb 0.63 -0.82 0.02 0.00 0.00 0.00 0.00 33.22 33.05 2dit n MET 23 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 175.97 177.94 2dit n PHE 24 N -1.22 -1.43 -3.79 3.17 1.16 -1.26 -4.28 117.46 109.80 2dit n PHE 24 Ca 0.00 -1.30 -0.13 0.00 -1.87 0.00 0.00 57.45 54.15 2dit n PHE 24 Cb 0.00 0.64 -0.13 0.00 -1.61 0.00 0.00 39.48 38.38 2dit n PHE 24 CO 0.00 0.00 0.00 -1.58 -1.87 0.00 0.00 176.76 173.31 2dit s HIS 25 N -2.17 -0.21 -2.00 2.97 2.46 -1.26 -2.51 115.29 112.57 2dit s HIS 25 Ca 0.22 0.53 0.03 0.00 0.47 0.00 0.00 55.06 56.30 2dit s HIS 25 Cb -0.03 0.05 0.16 0.00 -0.13 0.00 0.00 32.58 32.63 2dit s HIS 25 CO 0.06 -0.12 0.64 -0.35 -2.47 0.00 0.00 174.74 172.49 2dit n PRO 26 N 3.30 0.49 -0.00 2.88 -0.04 -1.26 -1.87 135.00 138.49 2dit n PRO 26 Ca -0.16 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.36 2dit n PRO 26 Cb 0.57 -1.09 -0.09 0.00 -0.04 0.00 0.00 33.50 32.85 2dit n PRO 26 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2dit n MET 27 N -0.59 1.27 0.07 0.54 2.81 -1.26 -4.43 117.12 115.53 2dit n MET 27 Ca 0.02 -0.08 -0.17 0.00 -1.81 0.00 0.00 57.70 55.67 2dit n MET 27 Cb 0.01 -1.24 -0.14 0.00 -0.71 0.00 0.00 33.22 31.14 2dit n MET 27 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2dit h ASP 28 N 0.00 0.40 0.39 7.83 3.32 -1.75 -3.31 116.42 123.30 2dit h ASP 28 Ca 0.00 -0.53 -0.04 0.00 0.02 0.00 0.00 57.03 56.47 2dit h ASP 28 Cb 0.49 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2dit h ASP 28 CO 0.00 1.44 -0.20 -0.26 -1.72 0.00 0.00 179.24 178.50 2dit h PHE 29 N 0.07 0.00 -0.17 4.55 0.04 -1.69 -2.31 116.94 117.43 2dit h PHE 29 Ca -0.23 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.46 2dit h PHE 29 Cb 2.01 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 40.15 2dit h PHE 29 CO 0.06 0.20 -0.26 0.93 -0.60 0.00 0.00 178.31 178.65 2dit h GLU 30 N 0.00 0.31 0.10 1.51 4.39 -1.77 -2.94 114.58 116.18 2dit h GLU 30 Ca -0.00 -0.11 -0.27 0.00 0.34 0.00 0.00 59.36 59.32 2dit h GLU 30 Cb 0.45 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.08 2dit h GLU 30 CO 0.03 0.56 -1.26 0.22 -1.16 0.00 0.00 179.01 177.39 2dit h ASP 31 N 0.28 0.34 -3.53 1.42 3.58 -1.56 -3.47 116.42 113.48 2dit h ASP 31 Ca 0.04 -0.38 0.02 0.00 0.42 0.00 0.00 57.03 57.13 2dit h ASP 31 Cb 0.61 -0.11 -0.24 0.00 1.72 0.00 0.00 39.33 41.31 2dit h ASP 31 CO 0.04 1.30 0.31 -1.81 -2.88 0.00 0.00 179.24 176.20 2dit s ASP 32 N -7.02 -0.59 0.17 2.28 1.01 -0.96 -5.05 116.67 106.51 2dit s ASP 32 Ca -0.04 1.13 -0.07 0.00 0.71 0.00 0.00 52.55 54.27 2dit s ASP 32 Cb 0.08 1.15 0.05 0.00 1.01 0.00 0.00 42.92 45.20 2dit s ASP 32 CO 0.87 -0.19 1.51 1.55 0.21 0.00 0.00 175.17 179.12 2dit h PRO 33 N 4.62 0.80 -0.91 8.23 0.13 -1.85 -3.24 132.00 139.78 2dit h PRO 33 Ca -0.29 -0.42 0.26 0.00 -0.87 0.00 0.00 66.00 64.68 2dit h PRO 33 Cb 1.17 0.02 -0.17 0.00 0.13 0.00 0.00 31.00 32.15 2dit h PRO 33 CO 0.08 1.05 0.04 1.28 -0.23 0.00 0.00 178.00 180.23 2dit n LEU 34 N -4.04 -0.09 -0.18 1.56 7.99 -1.26 0.18 117.00 121.16 2dit n LEU 34 Ca -0.02 1.54 -0.07 0.00 -0.01 0.00 0.00 56.01 57.45 2dit n LEU 34 Cb 0.54 -0.57 -0.02 0.00 -0.11 0.00 0.00 43.42 43.27 2dit n LEU 34 CO 0.47 -1.57 0.61 0.58 -1.51 0.00 0.00 177.39 175.97 2dit h VAL 35 N 0.00 0.15 -0.11 4.08 2.07 -1.88 0.30 116.25 120.86 2dit h VAL 35 Ca 0.56 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 68.00 2dit h VAL 35 Cb 1.18 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2dit h VAL 35 CO -0.85 0.00 -0.31 0.25 0.02 0.00 0.00 177.57 176.68 2dit h LEU 36 N -0.22 0.22 0.86 2.57 5.85 -0.47 -2.02 115.31 122.09 2dit h LEU 36 Ca 0.20 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 2dit h LEU 36 Cb 0.56 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.54 2dit h LEU 36 CO -0.64 0.53 -0.41 0.78 -0.34 0.00 0.00 178.44 178.35 2dit h ASN 37 N 0.19 -0.98 -0.69 1.25 2.35 0.53 0.27 115.58 118.50 2dit h ASN 37 Ca 0.03 0.03 0.05 0.00 -0.55 0.00 0.00 56.30 55.86 2dit h ASN 37 Cb 0.65 0.25 -0.05 0.00 0.05 0.00 0.00 38.32 39.22 2dit h ASN 37 CO 0.05 -0.63 0.41 1.05 -1.65 0.00 0.00 177.43 176.66 2dit h GLU 38 N -1.30 0.75 0.42 0.81 4.11 -0.57 -1.03 114.58 117.77 2dit h GLU 38 Ca -0.12 -0.05 -0.02 0.00 0.07 0.00 0.00 59.36 59.25 2dit h GLU 38 Cb 0.89 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.97 2dit h GLU 38 CO 0.19 0.50 -0.20 0.82 0.07 0.00 0.00 179.01 180.39 2dit h ILE 39 N 0.77 0.58 0.25 -1.06 2.04 -1.34 0.45 117.51 119.21 2dit h ILE 39 Ca 0.30 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.95 2dit h ILE 39 Cb 0.12 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 2dit h ILE 39 CO -0.15 0.04 -0.52 -0.09 0.00 0.00 0.00 178.15 177.43 2dit h ARG 40 N -0.68 -0.80 -0.85 2.37 2.43 -0.24 -1.34 114.38 115.27 2dit h ARG 40 Ca -0.06 0.05 0.12 0.00 -0.81 0.00 0.00 59.98 59.28 2dit h ARG 40 Cb 0.50 0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 30.17 2dit h ARG 40 CO 0.09 -0.53 0.55 1.05 -1.51 0.00 0.00 179.97 179.62 2dit h GLU 41 N -0.83 0.71 -0.64 0.20 4.11 -1.23 -1.20 114.58 115.69 2dit h GLU 41 Ca -0.03 -0.04 0.04 0.00 0.07 0.00 0.00 59.36 59.40 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 -0.21 0.47 0.37 -0.44 0.07 0.00 0.00 179.01 179.27 2dit h ASP 42 N 0.73 0.58 0.49 3.06 3.32 0.07 0.23 116.42 124.89 2dit h ASP 42 Ca 0.41 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.41 2dit h ASP 42 Cb 0.56 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 2dit h ASP 42 CO -0.17 0.39 -0.30 -0.07 -1.72 0.00 0.00 179.24 177.37 2dit h LEU 43 N 0.71 0.00 0.00 1.55 3.38 -0.19 0.32 115.31 121.09 2dit h LEU 43 Ca 0.27 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.09 2dit h LEU 43 Cb 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2dit h LEU 43 CO -0.14 0.30 -0.83 -0.09 0.09 0.00 0.00 178.44 177.78 2dit h ARG 44 N 0.00 0.00 0.00 1.13 2.43 -0.73 -2.82 114.38 114.39 2dit h ARG 44 Ca -0.00 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.02 2dit h ARG 44 Cb 0.63 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 2dit h ARG 44 CO 0.04 0.59 -1.47 1.33 -1.51 0.00 0.00 179.97 178.95 2dit n VAL 45 N -3.19 1.05 0.02 0.20 0.24 0.68 -3.20 118.33 114.12 2dit n VAL 45 Ca -0.01 -0.67 -0.18 0.00 -2.04 0.00 0.00 64.34 61.43 2dit n VAL 45 Cb 0.82 -0.62 -0.13 0.00 -1.47 0.00 0.00 33.84 32.44 2dit n VAL 45 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 2dit h GLU 46 N 0.00 0.31 0.00 7.34 4.11 -0.45 -3.12 114.58 122.76 2dit h GLU 46 Ca -0.16 -0.43 -0.04 0.00 0.07 0.00 0.00 59.36 58.81 2dit h GLU 46 Cb 1.51 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.90 2dit h GLU 46 CO 0.04 1.15 -0.17 0.00 0.07 0.00 0.00 179.01 180.10 2dit h SER 48 N 0.00 0.00 -0.79 0.00 0.87 -1.61 -3.25 113.55 108.78 2dit h SER 48 Ca -0.00 0.00 0.17 0.00 -1.23 0.00 0.00 61.79 60.73 2dit h SER 48 Cb 0.80 0.00 -0.11 0.00 -0.44 0.00 0.00 62.40 62.64 2dit h SER 48 CO 0.02 0.37 0.25 0.11 -0.53 0.00 0.00 176.83 177.05 2dit h LYS 49 N 0.00 0.32 0.01 2.24 1.79 -1.44 0.67 116.57 120.16 2dit h LYS 49 Ca -0.00 -0.02 -0.20 0.00 -2.18 0.00 0.00 60.65 58.25 2dit h LYS 49 Cb 1.06 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.62 2dit h LYS 49 CO 0.05 0.21 -0.90 0.74 -1.08 0.00 0.00 179.45 178.47 2dit h PHE 50 N 0.33 0.29 0.00 -1.35 -1.00 -1.75 -3.48 116.94 109.97 2dit h PHE 50 Ca 0.46 -0.16 0.00 0.00 2.81 0.00 0.00 57.97 61.07 2dit h PHE 50 Cb 0.79 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.32 2dit h PHE 50 CO -0.22 0.99 0.00 0.41 -1.61 0.00 0.00 178.31 177.88 2dit n GLY 51 N 0.92 0.70 3.53 -1.45 0.00 0.23 -5.04 105.19 104.07 2dit n GLY 51 Ca -0.04 0.43 -0.26 0.00 0.00 0.00 0.00 46.02 46.15 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 2.19 1.92 -0.46 1.61 -0.21 -1.26 -4.54 119.66 118.93 2dit s GLN 52 Ca 0.00 -2.17 0.04 0.00 0.02 0.00 0.00 55.36 53.25 2dit s GLN 52 Cb 0.00 -0.71 0.12 0.00 1.00 0.00 0.00 33.01 33.42 2dit s GLN 52 CO 0.00 -0.44 0.19 0.42 -2.12 0.00 0.00 175.29 173.34 2dit s ILE 53 N -3.19 2.45 0.36 1.08 -1.09 -1.26 -4.53 121.20 115.02 2dit s ILE 53 Ca 0.24 -2.96 0.10 0.00 -2.23 0.00 0.00 60.65 55.79 2dit s ILE 53 Cb 0.03 -2.74 0.33 0.00 -1.58 0.00 0.00 42.46 38.50 2dit s ILE 53 CO 0.14 -0.73 1.86 0.03 -1.23 0.00 0.00 174.94 175.01 2dit h ARG 54 N 6.89 0.65 -1.50 2.79 2.47 -1.80 -3.44 114.38 120.43 2dit h ARG 54 Ca -0.07 -0.04 0.09 0.00 -1.26 0.00 0.00 59.98 58.71 2dit h ARG 54 Cb 0.94 -0.15 -0.25 0.00 -1.65 0.00 0.00 29.97 28.86 2dit h ARG 54 CO 0.63 0.43 0.57 0.21 0.56 0.00 0.00 179.97 182.36 2dit s LYS 55 N -5.66 0.49 -0.05 0.04 2.20 -1.19 -4.99 119.74 110.57 2dit s LYS 55 Ca -0.10 0.29 0.00 0.00 -0.36 0.00 0.00 55.97 55.81 2dit s LYS 55 Cb 0.22 0.23 0.02 0.00 -1.51 0.00 0.00 37.83 36.80 2dit s LYS 55 CO 0.79 -0.12 -0.02 -1.17 -0.36 0.00 0.00 175.35 174.47 2dit s LEU 56 N -0.53 1.14 -0.07 5.43 2.96 -1.26 -0.15 118.68 126.20 2dit s LEU 56 Ca 0.01 -0.09 -0.01 0.00 -0.22 0.00 0.00 54.13 53.82 2dit s LEU 56 Cb -0.02 -0.39 0.03 0.00 0.50 0.00 0.00 46.19 46.30 2dit s LEU 56 CO -0.03 -0.09 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.13 2dit s LEU 57 N 1.14 0.78 -0.27 -0.68 1.43 -0.61 -5.03 118.68 115.44 2dit s LEU 57 Ca -0.08 -0.12 -0.12 0.00 -1.03 0.00 0.00 54.13 52.79 2dit s LEU 57 Cb -0.14 -0.49 -0.05 0.00 0.03 0.00 0.00 46.19 45.55 2dit s LEU 57 CO -0.01 -0.16 0.24 -0.22 0.23 0.00 0.00 176.35 176.42 2dit s LEU 58 N 1.76 4.03 -1.04 1.79 0.20 -1.26 -0.76 118.68 123.40 2dit s LEU 58 Ca 0.02 0.08 -0.19 0.00 0.69 0.00 0.00 54.13 54.73 2dit s LEU 58 Cb -0.13 -2.20 0.10 0.00 -0.43 0.00 0.00 46.19 43.53 2dit s LEU 58 CO -0.05 -0.08 1.35 -0.36 -0.29 0.00 0.00 176.35 176.93 2dit s PHE 59 N 1.79 2.93 -0.03 5.38 0.08 -0.44 -4.85 117.98 122.85 2dit s PHE 59 Ca 0.09 -1.34 -0.00 0.00 0.12 0.00 0.00 56.93 55.80 2dit s PHE 59 Cb -0.16 -4.48 0.03 0.00 -0.57 0.00 0.00 43.02 37.83 2dit s PHE 59 CO 0.10 -1.67 1.76 -0.40 -0.10 0.00 0.00 175.22 174.92 2dit n ASP 60 N 7.43 4.85 0.00 1.36 5.68 -1.26 -3.17 116.55 131.44 2dit n ASP 60 Ca 0.32 -2.38 0.00 0.00 -0.50 0.00 0.00 54.79 52.23 2dit n ASP 60 Cb 0.48 -0.97 0.00 0.00 -1.14 0.00 0.00 41.12 39.50 2dit n ASP 60 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2dit n ARG 61 N 1.13 2.10 -2.90 0.11 5.12 -1.26 -4.76 116.66 116.19 2dit n ARG 61 Ca 0.03 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.54 2dit n ARG 61 Cb 0.52 -0.87 -0.04 0.00 -1.16 0.00 0.00 32.46 30.91 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 -1.59 3.37 -2.00 -1.55 2.46 -1.19 -4.91 115.29 109.88 2dit s HIS 62 Ca 0.00 1.18 0.06 0.00 0.47 0.00 0.00 55.06 56.78 2dit s HIS 62 Cb 0.00 -3.02 0.37 0.00 -0.13 0.00 0.00 32.58 29.81 2dit s HIS 62 CO 0.00 -0.31 0.83 -0.35 -2.47 0.00 0.00 174.74 172.45 2dit n PRO 63 N 5.56 0.49 -0.08 2.88 -0.04 -1.26 -1.91 135.00 140.64 2dit n PRO 63 Ca 0.05 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.57 2dit n PRO 63 Cb 0.48 -1.20 0.11 0.00 -0.04 0.00 0.00 33.50 32.85 2dit n PRO 63 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2dit n ASP 64 N -0.70 2.39 -2.72 3.54 8.00 -1.26 -4.82 116.55 120.98 2dit n ASP 64 Ca 0.05 -2.68 -0.03 0.00 0.71 0.00 0.00 54.79 52.83 2dit n ASP 64 Cb 0.02 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 40.80 2dit n ASP 64 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dit n GLY 65 N -0.97 -4.14 3.06 0.44 0.00 -0.80 -1.78 105.19 100.99 2dit n GLY 65 Ca 0.11 1.15 -0.23 0.00 0.00 0.00 0.00 46.02 47.06 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 -0.89 1.04 0.05 1.61 1.01 -1.26 -3.01 120.40 118.95 2dit s VAL 66 Ca -0.16 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 2dit s VAL 66 Cb 0.01 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 2dit s VAL 66 CO 0.66 0.31 -0.02 0.00 0.00 0.00 0.00 175.10 176.05 2dit s ALA 67 N 0.10 0.45 -0.22 5.51 0.00 -1.21 -1.33 121.76 125.07 2dit s ALA 67 Ca -0.03 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.80 2dit s ALA 67 Cb -0.09 0.26 0.06 0.00 0.00 0.00 0.00 23.12 23.34 2dit s ALA 67 CO 0.01 -0.35 -0.05 -1.54 0.00 0.00 0.00 175.76 173.83 2dit s SER 68 N -2.77 3.58 -0.40 0.00 1.04 0.06 -3.05 113.70 112.15 2dit s SER 68 Ca 0.05 -1.04 -0.09 0.00 0.48 0.00 0.00 55.95 55.34 2dit s SER 68 Cb 0.06 -1.10 0.06 0.00 0.10 0.00 0.00 66.02 65.14 2dit s SER 68 CO -0.09 -0.22 0.23 -0.69 0.98 0.00 0.00 173.24 173.45 2dit s VAL 69 N 1.47 4.26 0.24 5.02 1.01 -0.90 -1.57 120.40 129.93 2dit s VAL 69 Ca -0.04 -1.24 -0.29 0.00 0.00 0.00 0.00 61.98 60.41 2dit s VAL 69 Cb -0.18 -3.53 -0.09 0.00 0.00 0.00 0.00 36.38 32.58 2dit s VAL 69 CO -0.07 -0.41 0.91 -0.44 0.00 0.00 0.00 175.10 175.10 2dit s SER 70 N 1.90 7.56 0.29 3.32 0.01 0.79 -2.34 113.70 125.23 2dit s SER 70 Ca 0.02 1.88 0.11 0.00 1.31 0.00 0.00 55.95 59.27 2dit s SER 70 Cb -0.22 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.37 2dit s SER 70 CO 0.03 0.14 -0.17 -0.36 0.41 0.00 0.00 173.24 173.29 2dit s PHE 71 N -1.24 2.27 -0.15 2.43 0.40 0.68 -2.52 117.98 119.85 2dit s PHE 71 Ca 0.41 -0.40 -0.10 0.00 -0.60 0.00 0.00 56.93 56.25 2dit s PHE 71 Cb -0.24 -1.08 -0.24 0.00 0.51 0.00 0.00 43.02 41.97 2dit s PHE 71 CO 0.30 0.65 0.27 -2.13 0.70 0.00 0.00 175.22 175.01 2dit n ARG 72 N -0.65 0.70 -4.25 0.44 3.00 -1.26 -4.80 116.66 109.85 2dit n ARG 72 Ca -0.05 0.33 -0.35 0.00 -0.00 0.00 0.00 57.85 57.78 2dit n ARG 72 Cb 0.61 -1.70 -0.09 0.00 0.00 0.00 0.00 32.46 31.28 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 -6.98 5.44 0.41 6.15 1.11 -1.26 -5.00 116.67 116.53 2dit s ASP 73 Ca -0.25 0.16 0.20 0.00 0.18 0.00 0.00 52.55 52.84 2dit s ASP 73 Cb 0.07 -1.66 0.88 0.00 1.07 0.00 0.00 42.92 43.28 2dit s ASP 73 CO 0.71 0.34 1.83 1.55 1.18 0.00 0.00 175.17 180.78 2dit h PRO 74 N 5.48 0.00 -0.41 8.23 0.13 -1.90 -3.04 132.00 140.49 2dit h PRO 74 Ca -0.48 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.50 2dit h PRO 74 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2dit h PRO 74 CO 0.58 0.30 -0.35 0.93 -0.23 0.00 0.00 178.00 179.23 2dit h GLU 75 N 0.00 0.96 0.39 0.86 5.08 -1.96 -2.67 114.58 117.24 2dit h GLU 75 Ca -0.00 -0.48 -0.02 0.00 -1.00 0.00 0.00 59.36 57.85 2dit h GLU 75 Cb 0.72 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2dit h GLU 75 CO 0.04 1.15 -0.19 1.49 -1.00 0.00 0.00 179.01 180.50 2dit h GLU 76 N 0.79 -0.50 -0.56 2.33 4.57 -1.94 -2.69 114.58 116.57 2dit h GLU 76 Ca 0.07 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.35 2dit h GLU 76 Cb 0.94 0.11 -0.09 0.00 -0.16 0.00 0.00 28.75 29.56 2dit h GLU 76 CO 0.09 -0.34 -0.55 0.00 -1.18 0.00 0.00 179.01 177.03 2dit h ALA 77 N -1.65 -0.67 -1.21 2.92 0.00 -1.65 1.03 119.26 118.03 2dit h ALA 77 Ca -0.05 0.04 0.35 0.00 0.00 0.00 0.00 54.91 55.25 2dit h ALA 77 Cb 0.40 1.16 -0.09 0.00 0.00 0.00 0.00 17.79 19.26 2dit h ALA 77 CO 0.09 -1.01 0.80 0.22 0.00 0.00 0.00 179.25 179.36 2dit h ASP 78 N -0.29 0.27 0.96 0.00 3.58 -1.56 1.06 116.42 120.43 2dit h ASP 78 Ca 0.11 0.08 -0.11 0.00 0.42 0.00 0.00 57.03 57.52 2dit h ASP 78 Cb 0.55 0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.63 2dit h ASP 78 CO -0.69 -0.02 -1.10 0.22 -2.88 0.00 0.00 179.24 174.77 2dit h TYR 79 N 0.19 0.00 0.00 0.28 3.20 0.25 -3.31 116.97 117.58 2dit h TYR 79 Ca 0.68 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.55 2dit h TYR 79 Cb 2.12 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.39 2dit h TYR 79 CO -0.00 0.40 -0.05 0.00 -1.64 0.00 0.00 178.16 176.87 2dit h ILE 81 N 0.00 0.71 0.00 0.00 -0.00 -0.52 -0.84 117.51 116.86 2dit h ILE 81 Ca 0.00 -2.00 -0.18 0.00 -0.00 0.00 0.00 64.86 62.68 2dit h ILE 81 Cb 0.91 2.35 -0.03 0.00 -0.00 0.00 0.00 36.82 40.04 2dit h ILE 81 CO 0.00 0.40 -1.50 0.00 -0.00 0.00 0.00 178.15 177.05 2dit n GLN 82 N -3.20 0.63 0.03 0.16 10.64 -1.21 -3.03 117.38 121.40 2dit n GLN 82 Ca 0.02 0.20 0.02 0.00 -1.83 0.00 0.00 57.00 55.41 2dit n GLN 82 Cb 0.70 -1.78 -0.09 0.00 -0.86 0.00 0.00 30.24 28.21 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 -2.86 1.03 1.11 -0.39 -1.04 -1.11 -3.96 114.28 107.05 2dit n THR 83 Ca -0.11 -0.67 0.12 0.00 -2.04 0.00 0.00 64.05 61.35 2dit n THR 83 Cb 0.86 -0.60 0.21 0.00 -1.82 0.00 0.00 70.33 68.97 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 -2.80 1.08 0.00 -4.42 4.77 -0.32 -3.96 117.00 111.35 2dit n LEU 84 Ca -0.10 -0.32 0.06 0.00 -0.03 0.00 0.00 56.01 55.62 2dit n LEU 84 Cb 0.81 -0.12 0.27 0.00 -2.33 0.00 0.00 43.42 42.05 2dit n LEU 84 CO 0.43 0.22 0.69 -0.90 -1.33 0.00 0.00 177.39 176.49 2dit n ASP 85 N -0.85 0.00 0.00 -1.43 5.75 -1.17 -2.23 116.55 116.62 2dit n ASP 85 Ca 0.09 0.43 0.00 0.00 -0.01 0.00 0.00 54.79 55.30 2dit n ASP 85 Cb 0.37 -0.46 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 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 -0.25 -0.66 3.27 6.12 0.00 -1.13 -3.88 105.19 108.66 2dit n GLY 86 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 2dit n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dit n ARG 87 N -0.30 -0.56 -4.09 1.61 5.12 -0.95 -4.40 116.66 113.09 2dit n ARG 87 Ca 0.00 -0.14 -0.27 0.00 -1.93 0.00 0.00 57.85 55.51 2dit n ARG 87 Cb 0.01 -1.59 -0.17 0.00 -1.16 0.00 0.00 32.46 29.55 2dit n ARG 87 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2dit s TRP 88 N -2.25 1.63 -0.01 -1.55 0.52 -1.26 0.80 118.94 116.81 2dit s TRP 88 Ca 0.52 -0.80 0.06 0.00 0.02 0.00 0.00 56.10 55.90 2dit s TRP 88 Cb -0.15 -1.28 -0.02 0.00 -1.15 0.00 0.00 33.47 30.87 2dit s TRP 88 CO 0.70 -0.50 -0.20 -0.06 0.02 0.00 0.00 176.95 176.92 2dit s PHE 89 N 1.43 1.76 0.00 -1.98 0.40 0.27 -4.67 117.98 115.19 2dit s PHE 89 Ca 0.01 -0.33 0.00 0.00 -0.60 0.00 0.00 56.93 56.00 2dit s PHE 89 Cb -0.13 -1.13 0.00 0.00 0.51 0.00 0.00 43.02 42.26 2dit s PHE 89 CO -0.06 -0.03 0.00 0.41 0.70 0.00 0.00 175.22 176.24 2dit n GLY 90 N 2.59 0.14 0.00 4.36 0.00 -1.26 -1.21 105.19 109.81 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 -1.02 1.58 3.66 -0.02 0.00 -1.26 -5.09 105.19 103.03 2dit n GLY 91 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.47 2.35 0.73 1.61 1.70 -0.35 -5.07 118.95 119.45 2dit s ARG 92 Ca 0.00 -1.31 -0.11 0.00 -0.47 0.00 0.00 55.73 53.84 2dit s ARG 92 Cb 0.00 -2.23 0.03 0.00 -0.57 0.00 0.00 34.95 32.17 2dit s ARG 92 CO 0.00 0.39 1.07 -1.14 -1.08 0.00 0.00 175.30 174.54 2dit s GLN 93 N -3.47 2.67 0.05 3.89 0.74 -1.26 0.94 119.66 123.22 2dit s GLN 93 Ca 0.30 0.94 -0.00 0.00 0.05 0.00 0.00 55.36 56.65 2dit s GLN 93 Cb -0.07 -1.96 -0.04 0.00 1.10 0.00 0.00 33.01 32.04 2dit s GLN 93 CO 0.20 -1.29 -0.04 0.96 -0.55 0.00 0.00 175.29 174.57 2dit s ILE 94 N -3.04 0.31 0.21 -2.34 -4.36 0.24 -4.72 121.20 107.51 2dit s ILE 94 Ca 0.59 -1.67 0.08 0.00 -0.26 0.00 0.00 60.65 59.40 2dit s ILE 94 Cb -0.15 -1.32 -0.04 0.00 1.25 0.00 0.00 42.46 42.20 2dit s ILE 94 CO 0.55 -0.87 0.00 0.28 0.24 0.00 0.00 174.94 175.14 2dit s THR 95 N -3.37 3.63 0.09 8.37 -1.32 -1.24 -2.85 115.64 118.96 2dit s THR 95 Ca 0.04 -1.59 0.04 0.00 -1.21 0.00 0.00 61.69 58.97 2dit s THR 95 Cb 0.04 -2.87 -0.03 0.00 -1.51 0.00 0.00 72.50 68.13 2dit s THR 95 CO -0.07 -0.20 -0.12 0.00 -2.21 0.00 0.00 174.62 172.02 2dit s ALA 96 N -1.92 1.16 0.02 11.08 0.00 -1.26 -2.86 121.76 127.97 2dit s ALA 96 Ca 0.29 -1.10 -0.28 0.00 0.00 0.00 0.00 51.96 50.86 2dit s ALA 96 Cb -0.08 -0.04 0.10 0.00 0.00 0.00 0.00 23.12 23.10 2dit s ALA 96 CO 0.19 0.07 0.89 1.14 0.00 0.00 0.00 175.76 178.05 2dit s GLN 97 N -2.27 0.87 0.08 0.00 0.00 -0.95 -4.73 119.66 112.66 2dit s GLN 97 Ca 0.02 -0.35 -0.24 0.00 -0.00 0.00 0.00 55.36 54.79 2dit s GLN 97 Cb -0.07 0.38 -0.06 0.00 0.00 0.00 0.00 33.01 33.27 2dit s GLN 97 CO 0.01 -0.38 0.74 0.00 0.00 0.00 0.00 175.29 175.66 2dit s ALA 98 N -3.15 3.42 0.49 2.60 0.00 -1.26 -0.08 121.76 123.78 2dit s ALA 98 Ca 0.06 0.27 -0.00 0.00 0.00 0.00 0.00 51.96 52.28 2dit s ALA 98 Cb -0.01 -2.94 0.01 0.00 0.00 0.00 0.00 23.12 20.18 2dit s ALA 98 CO -0.08 0.17 0.72 -0.46 0.00 0.00 0.00 175.76 176.11 2dit s TRP 99 N -0.47 3.15 0.00 0.00 -0.00 -0.52 -4.86 118.94 116.23 2dit s TRP 99 Ca 0.36 0.23 0.00 0.00 -0.00 0.00 0.00 56.10 56.70 2dit s TRP 99 Cb -0.21 -2.46 0.00 0.00 -0.00 0.00 0.00 33.47 30.80 2dit s TRP 99 CO 0.23 -0.53 0.00 -3.47 -0.00 0.00 0.00 176.95 173.18 2dit n ASP 100 N -2.20 0.00 0.00 5.86 2.03 -1.26 -4.74 116.55 116.24 2dit n ASP 100 Ca 0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.34 2dit n ASP 100 Cb 0.58 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 2dit n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dit n GLY 101 N 3.07 -1.12 0.00 0.27 0.00 -1.26 -5.03 105.19 101.12 2dit n GLY 101 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.37 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 -1.68 2.61 5.66 -1.26 -5.09 114.28 114.52 2dit n THR 102 Ca 0.00 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.61 2dit n THR 102 Cb 0.00 -0.16 0.04 0.00 -1.55 0.00 0.00 70.33 68.66 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 -1.61 3.43 -1.53 1.09 5.66 -1.26 -4.92 114.28 115.13 2dit n THR 103 Ca 0.00 -0.50 -0.17 0.00 -3.05 0.00 0.00 64.05 60.33 2dit n THR 103 Cb 0.13 -1.42 0.14 0.00 -1.55 0.00 0.00 70.33 67.63 2dit n THR 103 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2dit n ASP 104 N -0.55 4.15 0.51 1.09 9.92 -1.26 -4.62 116.55 125.79 2dit n ASP 104 Ca 0.11 -3.77 -0.20 0.00 -0.53 0.00 0.00 54.79 50.40 2dit n ASP 104 Cb 0.44 -0.67 -0.09 0.00 -0.64 0.00 0.00 41.12 40.16 2dit n ASP 104 CO 0.00 0.00 0.00 1.88 0.13 0.00 0.00 177.20 179.21 2dit h TYR 105 N 1.44 -1.20 0.00 1.24 0.05 -2.03 -3.36 116.97 113.11 2dit h TYR 105 Ca 0.38 -0.03 -0.25 0.00 0.05 0.00 0.00 58.73 58.88 2dit h TYR 105 Cb 1.62 0.40 -0.05 0.00 1.01 0.00 0.00 36.73 39.71 2dit h TYR 105 CO 1.15 -0.75 -2.12 0.00 -1.05 0.00 0.00 178.16 175.39 2dit n GLN 106 N -5.51 1.04 -1.54 4.88 -0.00 -1.26 -5.00 117.38 109.99 2dit n GLN 106 Ca -0.16 -0.04 -0.45 0.00 -0.00 0.00 0.00 57.00 56.34 2dit n GLN 106 Cb 0.51 -1.45 -0.02 0.00 -0.00 0.00 0.00 30.24 29.29 2dit n GLN 106 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2dit n SER 107 N -2.54 0.56 -4.90 2.61 3.41 -1.26 -4.99 113.62 106.51 2dit n SER 107 Ca -0.23 1.16 -0.27 0.00 -0.26 0.00 0.00 58.87 59.27 2dit n SER 107 Cb 0.95 -1.20 -0.01 0.00 -0.26 0.00 0.00 64.21 63.70 2dit n SER 107 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dit s GLY 108 N -0.69 2.41 -0.83 5.00 0.00 -1.26 -4.92 107.32 107.03 2dit s GLY 108 Ca 0.60 -1.16 -0.25 0.00 0.00 0.00 0.00 44.72 43.91 2dit s GLY 108 CO 0.59 -1.96 1.93 2.56 0.00 0.00 0.00 173.10 176.21 2dit s PRO 109 N -4.28 2.57 -0.13 2.90 0.04 -1.26 -4.90 135.00 129.94 2dit s PRO 109 Ca 0.32 -0.08 -0.05 0.00 0.04 0.00 0.00 61.00 61.24 2dit s PRO 109 Cb -0.02 -4.90 0.06 0.00 0.04 0.00 0.00 34.50 29.68 2dit s PRO 109 CO 0.20 -3.22 0.26 0.45 0.04 0.00 0.00 177.00 174.72 2dit s SER 110 N 8.05 0.34 -0.21 6.66 0.15 -1.26 -5.05 113.70 122.38 2dit s SER 110 Ca 0.69 0.58 -0.16 0.00 0.70 0.00 0.00 55.95 57.76 2dit s SER 110 Cb -0.08 0.66 -0.09 0.00 -1.71 0.00 0.00 66.02 64.80 2dit s SER 110 CO 0.04 -0.24 -0.26 -0.24 1.20 0.00 0.00 173.24 173.75 2dit n SER 111 N 5.28 1.92 0.00 5.45 2.88 -1.26 -5.25 113.62 122.64 2dit n SER 111 Ca -0.07 0.39 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 2dit n SER 111 Cb 0.50 -0.81 0.00 0.00 -0.75 0.00 0.00 64.21 63.14 2dit n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42