#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 5.89 -3.43 1.61 7.64 -1.26 -4.84 113.62 119.24 2dit n SER 2 Ca 0.00 -2.85 -0.04 0.00 1.01 0.00 0.00 58.87 56.99 2dit n SER 2 Cb 0.00 -1.30 0.01 0.00 -1.01 0.00 0.00 64.21 61.91 2dit n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dit s SER 3 N 1.12 -0.05 0.00 6.43 0.01 -1.26 -5.17 113.70 114.78 2dit s SER 3 Ca 0.58 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.19 2dit s SER 3 Cb 0.33 0.54 0.00 0.00 0.21 0.00 0.00 66.02 67.10 2dit s SER 3 CO -0.10 -1.06 0.00 0.61 0.41 0.00 0.00 173.24 173.10 2dit n GLY 4 N -0.61 3.57 3.50 3.44 0.00 -1.26 -5.06 105.19 108.77 2dit n GLY 4 Ca -0.05 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 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 0.00 6.24 -0.96 1.61 1.04 -1.26 -4.97 113.70 115.41 2dit s SER 5 Ca 0.00 -0.62 -0.09 0.00 0.48 0.00 0.00 55.95 55.72 2dit s SER 5 Cb 0.00 -2.45 0.24 0.00 0.10 0.00 0.00 66.02 63.91 2dit s SER 5 CO 0.00 -1.42 0.91 -0.55 0.98 0.00 0.00 173.24 173.15 2dit s SER 6 N 3.34 6.80 -0.53 7.02 0.15 -1.26 -4.99 113.70 124.23 2dit s SER 6 Ca 0.28 -3.29 -0.06 0.00 0.70 0.00 0.00 55.95 53.58 2dit s SER 6 Cb -0.13 -2.14 0.14 0.00 -1.71 0.00 0.00 66.02 62.18 2dit s SER 6 CO 0.15 -0.36 0.37 -0.83 1.20 0.00 0.00 173.24 173.76 2dit s GLY 7 N 1.30 2.21 -0.14 9.45 0.00 -1.26 -5.04 107.32 113.84 2dit s GLY 7 Ca 0.25 -2.82 -0.28 0.00 0.00 0.00 0.00 44.72 41.87 2dit s GLY 7 CO -0.09 1.10 0.71 -0.32 0.00 0.00 0.00 173.10 174.50 2dit s GLY 8 N 1.80 -0.55 0.04 0.20 0.00 -1.26 -5.14 107.32 102.41 2dit s GLY 8 Ca 0.11 1.64 -0.31 0.00 0.00 0.00 0.00 44.72 46.16 2dit s GLY 8 CO -0.03 1.29 1.42 2.56 0.00 0.00 0.00 173.10 178.34 2dit s PRO 9 N -0.54 4.29 0.16 2.90 0.04 -1.26 -5.00 135.00 135.59 2dit s PRO 9 Ca -0.06 2.03 -0.22 0.00 0.04 0.00 0.00 61.00 62.78 2dit s PRO 9 Cb -0.02 -3.48 0.06 0.00 0.04 0.00 0.00 34.50 31.10 2dit s PRO 9 CO 0.06 -0.54 0.58 -1.54 0.04 0.00 0.00 177.00 175.60 2dit s SER 10 N 1.70 -0.51 -1.50 6.66 1.04 -1.26 -4.95 113.70 114.88 2dit s SER 10 Ca 0.65 -0.08 -0.10 0.00 0.48 0.00 0.00 55.95 56.89 2dit s SER 10 Cb -0.34 0.59 0.10 0.00 0.10 0.00 0.00 66.02 66.48 2dit s SER 10 CO 0.28 -0.98 0.26 -2.11 0.98 0.00 0.00 173.24 171.67 2dit n ARG 11 N -0.37 -0.85 -0.24 4.02 1.85 -1.26 -4.78 116.66 115.03 2dit n ARG 11 Ca -0.16 0.10 -0.06 0.00 -1.00 0.00 0.00 57.85 56.73 2dit n ARG 11 Cb 0.64 -3.62 -0.06 0.00 -1.05 0.00 0.00 32.46 28.38 2dit n ARG 11 CO 0.00 0.00 0.00 -1.33 -0.01 0.00 0.00 177.63 176.29 2dit n MET 12 N -3.88 -0.25 -3.35 2.89 2.81 -1.26 -4.82 117.12 109.26 2dit n MET 12 Ca -0.09 1.24 -0.21 0.00 -1.81 0.00 0.00 57.70 56.82 2dit n MET 12 Cb 0.50 -1.83 0.06 0.00 -0.71 0.00 0.00 33.22 31.24 2dit n MET 12 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2dit n ARG 13 N -4.31 -6.48 -3.58 0.03 5.12 -1.26 -4.99 116.66 101.18 2dit n ARG 13 Ca 0.01 0.77 -0.11 0.00 -1.93 0.00 0.00 57.85 56.59 2dit n ARG 13 Cb 0.15 -5.54 -0.04 0.00 -1.16 0.00 0.00 32.46 25.87 2dit n ARG 13 CO 0.00 0.00 0.00 -3.38 -1.93 0.00 0.00 177.63 172.32 2dit s HIS 14 N -3.24 -0.30 -0.68 -1.55 -3.43 -1.26 -5.11 115.29 99.71 2dit s HIS 14 Ca 0.46 0.06 -0.27 0.00 -0.80 0.00 0.00 55.06 54.51 2dit s HIS 14 Cb -0.20 0.33 0.03 0.00 -1.43 0.00 0.00 32.58 31.31 2dit s HIS 14 CO 0.57 -0.72 1.23 -1.21 -2.00 0.00 0.00 174.74 172.61 2dit s GLU 15 N -3.59 3.29 -0.32 -0.38 8.01 -1.26 -4.90 118.70 119.55 2dit s GLU 15 Ca 0.01 -0.13 -0.05 0.00 0.01 0.00 0.00 54.97 54.82 2dit s GLU 15 Cb 0.01 -4.13 -0.08 0.00 -4.31 0.00 0.00 34.13 25.62 2dit s GLU 15 CO -0.11 -1.97 3.12 2.89 0.01 0.00 0.00 175.26 179.20 2dit n ARG 16 N 8.95 2.33 -4.01 1.61 1.85 -1.26 -4.57 116.66 121.55 2dit n ARG 16 Ca 0.04 -1.83 -0.13 0.00 -1.00 0.00 0.00 57.85 54.94 2dit n ARG 16 Cb 0.49 -2.11 -0.13 0.00 -1.05 0.00 0.00 32.46 29.65 2dit n ARG 16 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2dit s VAL 17 N -0.80 0.24 0.04 8.89 1.01 -1.26 -0.25 120.40 128.26 2dit s VAL 17 Ca 0.62 -0.42 0.09 0.00 0.00 0.00 0.00 61.98 62.27 2dit s VAL 17 Cb 0.35 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 36.44 2dit s VAL 17 CO -0.13 -0.12 -0.26 0.68 0.00 0.00 0.00 175.10 175.27 2dit s VAL 18 N -0.54 2.14 0.06 2.92 -7.23 -1.01 -0.36 120.40 116.39 2dit s VAL 18 Ca -0.04 -1.35 0.02 0.00 -1.81 0.00 0.00 61.98 58.80 2dit s VAL 18 Cb -0.04 -1.82 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 2dit s VAL 18 CO -0.00 0.40 0.09 -0.63 -0.31 0.00 0.00 175.10 174.64 2dit s ILE 19 N -0.78 4.63 -0.05 -0.62 -1.09 0.07 -2.09 121.20 121.27 2dit s ILE 19 Ca 0.12 -0.68 0.02 0.00 -2.23 0.00 0.00 60.65 57.88 2dit s ILE 19 Cb -0.10 -3.21 0.01 0.00 -1.58 0.00 0.00 42.46 37.58 2dit s ILE 19 CO 0.02 0.16 -0.10 -0.63 -1.23 0.00 0.00 174.94 173.16 2dit s ILE 20 N -1.36 0.93 0.28 2.92 -1.09 -1.16 -2.51 121.20 119.21 2dit s ILE 20 Ca 0.29 -0.37 0.09 0.00 -2.23 0.00 0.00 60.65 58.43 2dit s ILE 20 Cb -0.12 -0.87 -0.04 0.00 -1.58 0.00 0.00 42.46 39.85 2dit s ILE 20 CO 0.21 0.31 0.04 -0.54 -1.23 0.00 0.00 174.94 173.73 2dit s LYS 21 N 0.66 2.35 -1.31 2.79 -0.14 -1.18 -3.13 119.74 119.78 2dit s LYS 21 Ca -0.12 -1.43 -0.13 0.00 -1.36 0.00 0.00 55.97 52.92 2dit s LYS 21 Cb -0.15 -2.18 0.01 0.00 -1.68 0.00 0.00 37.83 33.83 2dit s LYS 21 CO 0.02 0.31 0.53 -1.71 -0.76 0.00 0.00 175.35 173.74 2dit n ASN 22 N -0.97 -2.41 0.00 2.83 5.15 -0.63 -3.16 115.26 116.08 2dit n ASN 22 Ca -0.06 -1.11 0.00 0.00 -0.60 0.00 0.00 54.58 52.82 2dit n ASN 22 Cb 0.59 -2.68 0.00 0.00 -0.53 0.00 0.00 39.78 37.16 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 -4.50 3.89 -4.05 1.20 0.00 -1.25 -4.06 117.12 108.36 2dit n MET 23 Ca -0.21 0.00 -0.13 0.00 0.00 0.00 0.00 57.70 57.37 2dit n MET 23 Cb 0.63 -0.99 -0.04 0.00 0.00 0.00 0.00 33.22 32.82 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 -1.99 0.80 -0.07 3.17 -0.12 -1.26 -4.23 117.98 114.28 2dit s PHE 24 Ca 0.00 -1.11 -0.07 0.00 -0.05 0.00 0.00 56.93 55.70 2dit s PHE 24 Cb 0.00 0.05 0.02 0.00 -0.63 0.00 0.00 43.02 42.46 2dit s PHE 24 CO 0.00 -1.12 0.20 -1.58 -0.05 0.00 0.00 175.22 172.67 2dit s HIS 25 N -3.28 -0.19 0.03 3.49 2.46 -1.26 -2.57 115.29 113.97 2dit s HIS 25 Ca 0.27 0.47 -0.21 0.00 0.47 0.00 0.00 55.06 56.06 2dit s HIS 25 Cb -0.01 0.06 -0.15 0.00 -0.13 0.00 0.00 32.58 32.36 2dit s HIS 25 CO 0.16 -0.13 1.34 -1.00 -2.47 0.00 0.00 174.74 172.64 2dit h PRO 26 N 5.63 0.32 0.00 2.88 0.13 -1.80 -2.89 132.00 136.27 2dit h PRO 26 Ca -0.26 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2dit h PRO 26 Cb 1.20 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dit h PRO 26 CO 0.38 0.71 0.03 -1.33 -0.23 0.00 0.00 178.00 177.56 2dit n MET 27 N -4.59 0.03 0.03 0.86 2.81 -1.26 -1.06 117.12 113.94 2dit n MET 27 Ca -0.06 0.51 -0.19 0.00 -1.81 0.00 0.00 57.70 56.14 2dit n MET 27 Cb 0.35 -1.62 -0.14 0.00 -0.71 0.00 0.00 33.22 31.10 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 0.41 0.42 7.83 5.19 -1.90 -3.34 116.42 125.03 2dit h ASP 28 Ca 0.00 -0.75 -0.05 0.00 -0.62 0.00 0.00 57.03 55.62 2dit h ASP 28 Cb 0.05 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.42 2dit h ASP 28 CO 0.00 1.65 -0.22 -0.26 -3.12 0.00 0.00 179.24 177.29 2dit h PHE 29 N 0.07 0.00 0.00 4.55 0.04 -1.08 -2.34 116.94 118.19 2dit h PHE 29 Ca -0.35 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.37 2dit h PHE 29 Cb 2.05 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 40.19 2dit h PHE 29 CO 0.07 0.22 -0.23 0.93 -0.60 0.00 0.00 178.31 178.70 2dit h GLU 30 N 0.00 0.00 0.10 1.51 4.39 -1.65 -2.65 114.58 116.28 2dit h GLU 30 Ca -0.00 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.42 2dit h GLU 30 Cb 0.49 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2dit h GLU 30 CO 0.03 0.23 -1.32 0.22 -1.16 0.00 0.00 179.01 177.00 2dit h ASP 31 N 0.00 0.32 -3.28 1.42 3.58 -1.58 -3.47 116.42 113.40 2dit h ASP 31 Ca -0.00 -0.38 0.05 0.00 0.42 0.00 0.00 57.03 57.11 2dit h ASP 31 Cb 0.41 -0.10 -0.25 0.00 1.72 0.00 0.00 39.33 41.10 2dit h ASP 31 CO 0.03 1.31 0.38 -1.81 -2.88 0.00 0.00 179.24 176.27 2dit s ASP 32 N -6.96 -0.52 0.21 2.28 1.01 -1.00 -5.05 116.67 106.65 2dit s ASP 32 Ca -0.05 0.98 -0.03 0.00 0.71 0.00 0.00 52.55 54.17 2dit s ASP 32 Cb 0.08 1.02 0.17 0.00 1.01 0.00 0.00 42.92 45.20 2dit s ASP 32 CO 0.86 -0.17 1.57 1.55 0.21 0.00 0.00 175.17 179.19 2dit h PRO 33 N 4.55 0.60 -1.00 8.23 0.13 -1.87 -3.23 132.00 139.41 2dit h PRO 33 Ca -0.28 -0.32 0.27 0.00 -0.87 0.00 0.00 66.00 64.80 2dit h PRO 33 Cb 1.18 0.01 -0.19 0.00 0.13 0.00 0.00 31.00 32.13 2dit h PRO 33 CO 0.10 0.91 0.01 1.28 -0.23 0.00 0.00 178.00 180.07 2dit n LEU 34 N -4.02 -0.13 -0.24 1.56 7.99 -1.26 -0.36 117.00 120.54 2dit n LEU 34 Ca -0.02 1.70 -0.09 0.00 -0.01 0.00 0.00 56.01 57.59 2dit n LEU 34 Cb 0.53 -0.61 -0.05 0.00 -0.11 0.00 0.00 43.42 43.18 2dit n LEU 34 CO 0.46 -1.71 0.55 0.58 -1.51 0.00 0.00 177.39 175.75 2dit h VAL 35 N 0.00 0.06 -0.27 4.08 2.07 -1.90 0.39 116.25 120.68 2dit h VAL 35 Ca 0.60 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 68.05 2dit h VAL 35 Cb 1.22 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2dit h VAL 35 CO -0.94 0.00 -0.13 0.25 0.02 0.00 0.00 177.57 176.76 2dit h LEU 36 N -0.21 0.43 0.68 2.57 5.85 -0.91 -1.88 115.31 121.85 2dit h LEU 36 Ca 0.17 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 2dit h LEU 36 Cb 0.55 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.47 2dit h LEU 36 CO -0.73 0.60 -0.33 0.78 -0.34 0.00 0.00 178.44 178.42 2dit h ASN 37 N 0.42 -0.78 -0.71 1.25 2.35 0.55 0.26 115.58 118.92 2dit h ASN 37 Ca 0.08 0.03 0.09 0.00 -0.55 0.00 0.00 56.30 55.94 2dit h ASN 37 Cb 0.48 0.20 -0.07 0.00 0.05 0.00 0.00 38.32 38.99 2dit h ASN 37 CO 0.03 -0.53 0.36 1.05 -1.65 0.00 0.00 177.43 176.69 2dit h GLU 38 N -0.98 0.60 0.51 0.81 4.11 -0.43 -0.86 114.58 118.34 2dit h GLU 38 Ca -0.09 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.28 2dit h GLU 38 Cb 0.70 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2dit h GLU 38 CO 0.15 0.40 -0.24 0.82 0.07 0.00 0.00 179.01 180.21 2dit h ILE 39 N 0.62 0.49 0.23 -1.06 2.04 -1.30 0.83 117.51 119.37 2dit h ILE 39 Ca 0.34 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 66.12 2dit h ILE 39 Cb 0.34 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 2dit h ILE 39 CO -0.26 0.02 -0.49 -0.09 0.00 0.00 0.00 178.15 177.33 2dit h ARG 40 N -0.74 -0.76 -0.86 2.37 2.43 -0.13 -1.39 114.38 115.30 2dit h ARG 40 Ca -0.07 0.05 0.13 0.00 -0.81 0.00 0.00 59.98 59.29 2dit h ARG 40 Cb 0.55 0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 30.21 2dit h ARG 40 CO 0.11 -0.51 0.56 1.05 -1.51 0.00 0.00 179.97 179.67 2dit h GLU 41 N -0.79 0.65 -0.68 0.20 4.11 -1.19 -0.89 114.58 115.99 2dit h GLU 41 Ca -0.02 -0.04 0.04 0.00 0.07 0.00 0.00 59.36 59.41 2dit h GLU 41 Cb 0.75 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.80 2dit h GLU 41 CO -0.20 0.43 0.41 -0.44 0.07 0.00 0.00 179.01 179.28 2dit h ASP 42 N 0.67 0.66 0.38 3.06 3.32 0.15 0.22 116.42 124.88 2dit h ASP 42 Ca 0.42 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.42 2dit h ASP 42 Cb 0.68 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 2dit h ASP 42 CO -0.18 0.45 -0.30 -0.07 -1.72 0.00 0.00 179.24 177.41 2dit h LEU 43 N 0.79 0.00 0.00 1.55 3.38 -0.16 0.43 115.31 121.31 2dit h LEU 43 Ca 0.28 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.12 2dit h LEU 43 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2dit h LEU 43 CO -0.13 0.30 -0.79 -0.09 0.09 0.00 0.00 178.44 177.82 2dit h ARG 44 N 0.00 0.00 0.00 1.13 2.43 -0.84 -2.77 114.38 114.34 2dit h ARG 44 Ca -0.00 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.04 2dit h ARG 44 Cb 0.57 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 2dit h ARG 44 CO 0.04 0.54 -1.44 1.33 -1.51 0.00 0.00 179.97 178.92 2dit n VAL 45 N -3.17 0.97 -0.01 0.20 0.24 0.64 -3.32 118.33 113.89 2dit n VAL 45 Ca -0.01 -0.65 -0.17 0.00 -2.04 0.00 0.00 64.34 61.46 2dit n VAL 45 Cb 0.80 -0.57 -0.14 0.00 -1.47 0.00 0.00 33.84 32.46 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 0.16 0.00 7.34 4.11 -0.24 -3.20 114.58 122.76 2dit h GLU 46 Ca -0.14 -0.26 -0.01 0.00 0.07 0.00 0.00 59.36 59.02 2dit h GLU 46 Cb 1.45 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.79 2dit h GLU 46 CO 0.03 1.12 -0.05 0.00 0.07 0.00 0.00 179.01 180.18 2dit h SER 48 N 0.00 0.00 -0.93 0.00 0.87 -1.63 -3.25 113.55 108.62 2dit h SER 48 Ca -0.00 0.00 0.27 0.00 -1.23 0.00 0.00 61.79 60.83 2dit h SER 48 Cb 0.57 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 62.39 2dit h SER 48 CO 0.01 0.63 0.37 0.11 -0.53 0.00 0.00 176.83 177.41 2dit h LYS 49 N 0.00 0.26 0.01 2.24 1.79 -1.47 0.60 116.57 120.00 2dit h LYS 49 Ca -0.01 -0.02 -0.19 0.00 -2.18 0.00 0.00 60.65 58.26 2dit h LYS 49 Cb 1.23 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.80 2dit h LYS 49 CO 0.08 0.17 -0.90 0.74 -1.08 0.00 0.00 179.45 178.46 2dit h PHE 50 N 0.27 0.06 0.00 -1.35 0.04 -1.75 -3.48 116.94 110.73 2dit h PHE 50 Ca 0.62 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 61.35 2dit h PHE 50 Cb 1.32 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.46 2dit h PHE 50 CO -0.16 0.92 0.00 0.41 -0.60 0.00 0.00 178.31 178.87 2dit n GLY 51 N 1.02 -0.71 2.02 -1.45 0.00 0.21 -5.02 105.19 101.25 2dit n GLY 51 Ca -0.01 0.60 -0.13 0.00 0.00 0.00 0.00 46.02 46.48 2dit n GLY 51 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dit n GLN 52 N 0.00 0.32 -3.92 1.61 6.02 -1.25 -4.63 117.38 115.52 2dit n GLN 52 Ca 0.00 -2.09 -0.30 0.00 -0.01 0.00 0.00 57.00 54.60 2dit n GLN 52 Cb 0.00 1.63 -0.14 0.00 1.02 0.00 0.00 30.24 32.75 2dit n GLN 52 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2dit s ILE 53 N -2.80 2.24 0.35 5.09 -1.09 -1.26 -4.39 121.20 119.35 2dit s ILE 53 Ca 0.23 -2.84 0.06 0.00 -2.23 0.00 0.00 60.65 55.87 2dit s ILE 53 Cb 0.01 -2.59 0.30 0.00 -1.58 0.00 0.00 42.46 38.60 2dit s ILE 53 CO 0.16 -0.75 1.92 0.03 -1.23 0.00 0.00 174.94 175.08 2dit h ARG 54 N 6.93 0.75 -1.49 2.79 2.47 -1.85 -3.44 114.38 120.54 2dit h ARG 54 Ca -0.06 -0.05 0.09 0.00 -1.26 0.00 0.00 59.98 58.70 2dit h ARG 54 Cb 0.94 -0.17 -0.27 0.00 -1.65 0.00 0.00 29.97 28.82 2dit h ARG 54 CO 0.60 0.50 0.55 0.21 0.56 0.00 0.00 179.97 182.39 2dit s LYS 55 N -5.71 0.44 -0.01 0.04 2.20 -1.19 -4.99 119.74 110.52 2dit s LYS 55 Ca -0.10 0.42 0.01 0.00 -0.36 0.00 0.00 55.97 55.94 2dit s LYS 55 Cb 0.20 0.21 0.00 0.00 -1.51 0.00 0.00 37.83 36.74 2dit s LYS 55 CO 0.78 -0.07 -0.04 -1.17 -0.36 0.00 0.00 175.35 174.49 2dit s LEU 56 N -0.07 1.86 -0.09 5.43 2.96 -1.26 0.49 118.68 127.99 2dit s LEU 56 Ca 0.03 -0.08 -0.04 0.00 -0.22 0.00 0.00 54.13 53.83 2dit s LEU 56 Cb -0.04 -0.25 0.05 0.00 0.50 0.00 0.00 46.19 46.44 2dit s LEU 56 CO -0.06 0.03 0.17 -0.76 -1.32 0.00 0.00 176.35 174.41 2dit s LEU 57 N 0.10 -0.10 -0.37 -0.68 1.43 -0.65 -5.02 118.68 113.40 2dit s LEU 57 Ca -0.01 0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 53.28 2dit s LEU 57 Cb -0.04 0.31 0.00 0.00 0.03 0.00 0.00 46.19 46.49 2dit s LEU 57 CO -0.00 -0.25 0.37 -0.22 0.23 0.00 0.00 176.35 176.48 2dit s LEU 58 N 2.30 4.63 -1.47 1.79 0.20 -1.26 -0.95 118.68 123.93 2dit s LEU 58 Ca 0.03 -0.44 -0.11 0.00 0.69 0.00 0.00 54.13 54.30 2dit s LEU 58 Cb -0.12 -2.32 0.03 0.00 -0.43 0.00 0.00 46.19 43.35 2dit s LEU 58 CO -0.06 -0.41 2.45 0.49 -0.29 0.00 0.00 176.35 178.53 2dit n PHE 59 N 5.40 2.93 0.05 5.38 3.72 -0.39 -4.72 117.46 129.83 2dit n PHE 59 Ca -0.09 -2.97 0.20 0.00 -0.05 0.00 0.00 57.45 54.54 2dit n PHE 59 Cb 0.49 -2.35 0.58 0.00 -0.94 0.00 0.00 39.48 37.26 2dit n PHE 59 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 2dit h ASP 60 N 5.43 0.00 0.70 4.37 2.03 -1.94 -0.61 116.42 126.39 2dit h ASP 60 Ca 0.67 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.94 2dit h ASP 60 Cb 0.47 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.97 2dit h ASP 60 CO 1.76 0.00 -0.39 0.03 -1.03 0.00 0.00 179.24 179.61 2dit h ARG 61 N 0.00 -0.97 -6.26 4.15 -0.00 -1.92 -3.35 114.38 106.02 2dit h ARG 61 Ca 0.24 0.07 -0.65 0.00 -0.50 0.00 0.00 59.98 59.14 2dit h ARG 61 Cb 1.73 0.22 0.02 0.00 0.00 0.00 0.00 29.97 31.95 2dit h ARG 61 CO -0.00 -0.65 1.00 1.58 0.00 0.00 0.00 179.97 181.90 2dit n HIS 62 N -5.54 2.22 0.31 3.04 -0.00 -0.24 -4.81 115.22 110.20 2dit n HIS 62 Ca -0.14 0.18 0.16 0.00 0.46 0.00 0.00 57.72 58.39 2dit n HIS 62 Cb 0.42 -2.59 0.67 0.00 -0.12 0.00 0.00 29.99 28.37 2dit n HIS 62 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2dit h PRO 63 N 8.23 0.00 -0.89 1.57 0.13 -1.86 -2.78 132.00 136.40 2dit h PRO 63 Ca -0.48 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.48 2dit h PRO 63 Cb 1.28 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.31 2dit h PRO 63 CO 0.94 0.00 0.22 -3.47 -0.23 0.00 0.00 178.00 175.46 2dit n ASP 64 N -2.90 3.63 -3.02 1.44 -0.08 -1.26 -4.66 116.55 109.70 2dit n ASP 64 Ca 0.01 -2.78 -0.00 0.00 -1.51 0.00 0.00 54.79 50.51 2dit n ASP 64 Cb 0.28 -0.66 -0.00 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 -0.10 -1.52 3.15 0.27 0.00 -1.05 -1.60 105.19 104.34 2dit n GLY 65 Ca 0.27 0.17 -0.28 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.21 1.57 0.05 1.61 1.01 -1.25 -2.81 120.40 119.37 2dit s VAL 66 Ca -0.00 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 2dit s VAL 66 Cb 0.00 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 2dit s VAL 66 CO 0.27 0.45 -0.02 0.00 0.00 0.00 0.00 175.10 175.80 2dit s ALA 67 N 0.18 0.45 -0.21 5.51 0.00 -1.18 -1.26 121.76 125.25 2dit s ALA 67 Ca -0.09 -1.13 0.01 0.00 0.00 0.00 0.00 51.96 50.75 2dit s ALA 67 Cb -0.14 0.26 0.05 0.00 0.00 0.00 0.00 23.12 23.29 2dit s ALA 67 CO 0.04 -0.35 -0.09 -1.54 0.00 0.00 0.00 175.76 173.82 2dit s SER 68 N -2.77 3.58 -0.44 0.00 1.04 -0.12 -2.99 113.70 112.00 2dit s SER 68 Ca 0.05 -0.99 -0.09 0.00 0.48 0.00 0.00 55.95 55.39 2dit s SER 68 Cb 0.06 -1.24 0.09 0.00 0.10 0.00 0.00 66.02 65.03 2dit s SER 68 CO -0.09 -0.17 0.29 -0.69 0.98 0.00 0.00 173.24 173.56 2dit s VAL 69 N 1.37 4.23 0.30 5.02 1.01 -0.89 -1.64 120.40 129.82 2dit s VAL 69 Ca -0.03 -1.55 -0.28 0.00 0.00 0.00 0.00 61.98 60.13 2dit s VAL 69 Cb -0.17 -3.67 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 2dit s VAL 69 CO -0.07 -0.61 1.00 -0.55 0.00 0.00 0.00 175.10 174.87 2dit s SER 70 N 2.33 7.30 0.31 3.32 0.15 0.18 -2.40 113.70 124.89 2dit s SER 70 Ca 0.04 2.02 0.06 0.00 0.70 0.00 0.00 55.95 58.77 2dit s SER 70 Cb -0.24 -2.60 -0.06 0.00 -1.71 0.00 0.00 66.02 61.40 2dit s SER 70 CO 0.01 -0.11 -0.03 -0.36 1.20 0.00 0.00 173.24 173.96 2dit s PHE 71 N -1.39 2.06 -0.22 3.44 0.40 0.65 -2.82 117.98 120.10 2dit s PHE 71 Ca 0.48 -0.74 0.08 0.00 -0.60 0.00 0.00 56.93 56.15 2dit s PHE 71 Cb -0.25 -1.25 -0.21 0.00 0.51 0.00 0.00 43.02 41.82 2dit s PHE 71 CO 0.31 0.26 -0.03 -2.13 0.70 0.00 0.00 175.22 174.33 2dit n ARG 72 N -0.67 0.67 -4.27 0.44 3.00 -1.26 -4.83 116.66 109.74 2dit n ARG 72 Ca -0.05 0.10 -0.34 0.00 -0.00 0.00 0.00 57.85 57.57 2dit n ARG 72 Cb 0.65 -1.55 -0.09 0.00 0.00 0.00 0.00 32.46 31.47 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 -6.12 5.33 0.34 6.15 1.01 -1.26 -5.01 116.67 117.10 2dit s ASP 73 Ca -0.23 0.11 0.13 0.00 0.71 0.00 0.00 52.55 53.27 2dit s ASP 73 Cb 0.08 -1.48 0.59 0.00 1.01 0.00 0.00 42.92 43.12 2dit s ASP 73 CO 0.71 0.33 1.74 1.55 0.21 0.00 0.00 175.17 179.71 2dit h PRO 74 N 4.67 0.00 0.39 8.23 0.13 -1.98 -3.12 132.00 140.32 2dit h PRO 74 Ca -0.50 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 2dit h PRO 74 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dit h PRO 74 CO 0.57 0.46 -0.19 0.93 -0.23 0.00 0.00 178.00 179.54 2dit h GLU 75 N 0.00 -0.51 -0.67 0.86 4.39 -1.97 -1.99 114.58 114.69 2dit h GLU 75 Ca -0.00 0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.83 2dit h GLU 75 Cb 0.85 0.12 -0.12 0.00 -0.10 0.00 0.00 28.75 29.50 2dit h GLU 75 CO 0.06 -0.28 -0.43 0.93 -1.16 0.00 0.00 179.01 178.13 2dit h GLU 76 N -1.10 -0.16 0.64 2.33 3.07 -1.96 0.30 114.58 117.70 2dit h GLU 76 Ca -0.05 0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.79 2dit h GLU 76 Cb 0.46 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 2dit h GLU 76 CO 0.09 -0.11 -0.42 0.00 -1.40 0.00 0.00 179.01 177.17 2dit h ALA 77 N 0.77 -1.04 -0.44 3.43 0.00 -1.65 0.38 119.26 120.70 2dit h ALA 77 Ca 0.21 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 55.04 2dit h ALA 77 Cb 0.56 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 2dit h ALA 77 CO -0.75 -1.11 0.53 0.22 0.00 0.00 0.00 179.25 178.15 2dit h ASP 78 N -1.01 0.00 0.32 0.00 3.58 -0.55 0.22 116.42 118.98 2dit h ASP 78 Ca -0.08 0.00 -0.33 0.00 0.42 0.00 0.00 57.03 57.04 2dit h ASP 78 Cb 0.82 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.86 2dit h ASP 78 CO 0.06 0.00 -1.76 0.22 -2.88 0.00 0.00 179.24 174.89 2dit h TYR 79 N 0.00 0.39 0.00 0.28 3.20 0.54 -3.34 116.97 118.04 2dit h TYR 79 Ca 0.21 -0.29 -0.05 0.00 3.14 0.00 0.00 58.73 61.74 2dit h TYR 79 Cb 1.27 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.52 2dit h TYR 79 CO 0.00 1.47 -0.23 0.00 -1.64 0.00 0.00 178.16 177.77 2dit h ILE 81 N 0.00 1.28 0.00 0.00 -0.00 -1.34 0.75 117.51 118.20 2dit h ILE 81 Ca -0.00 -1.32 -0.25 0.00 -0.00 0.00 0.00 64.86 63.29 2dit h ILE 81 Cb 0.48 1.71 -0.04 0.00 -0.00 0.00 0.00 36.82 38.96 2dit h ILE 81 CO 0.03 0.38 -1.71 0.00 -0.00 0.00 0.00 178.15 176.84 2dit n GLN 82 N -4.08 0.64 0.05 0.16 10.64 -0.88 -2.92 117.38 120.98 2dit n GLN 82 Ca -0.02 0.21 -0.02 0.00 -1.83 0.00 0.00 57.00 55.34 2dit n GLN 82 Cb 0.42 -1.75 -0.07 0.00 -0.86 0.00 0.00 30.24 27.97 2dit n GLN 82 CO 0.00 0.00 0.00 1.15 -1.83 0.00 0.00 177.06 176.38 2dit h THR 83 N 0.00 0.75 -0.01 -0.39 2.02 -1.02 -3.31 112.91 110.95 2dit h THR 83 Ca -0.27 -2.30 0.00 0.00 0.77 0.00 0.00 66.41 64.61 2dit h THR 83 Cb 1.86 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 70.53 2dit h THR 83 CO 0.06 0.43 -0.48 0.18 0.37 0.00 0.00 175.52 176.07 2dit n LEU 84 N -3.03 1.22 0.00 2.58 4.77 0.26 -4.06 117.00 118.74 2dit n LEU 84 Ca -0.07 -0.40 0.03 0.00 -0.03 0.00 0.00 56.01 55.54 2dit n LEU 84 Cb 0.86 -0.09 0.13 0.00 -2.33 0.00 0.00 43.42 41.99 2dit n LEU 84 CO 0.43 0.24 0.60 -0.90 -1.33 0.00 0.00 177.39 176.43 2dit n ASP 85 N -0.76 0.00 -0.08 -1.43 5.75 -1.15 -1.73 116.55 117.15 2dit n ASP 85 Ca 0.09 0.50 0.02 0.00 -0.01 0.00 0.00 54.79 55.39 2dit n ASP 85 Cb 0.38 -0.50 0.03 0.00 -1.03 0.00 0.00 41.12 40.00 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 -0.87 1.64 3.62 6.12 0.00 -1.22 -4.22 105.19 110.27 2dit n GLY 86 Ca 0.01 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.04 0.37 -0.10 1.61 1.81 -0.71 -4.67 118.95 116.23 2dit s ARG 87 Ca 0.07 1.00 0.01 0.00 -1.72 0.00 0.00 55.73 55.08 2dit s ARG 87 Cb 0.06 -1.69 0.02 0.00 -0.45 0.00 0.00 34.95 32.89 2dit s ARG 87 CO 0.01 -2.90 -0.10 -1.58 -0.68 0.00 0.00 175.30 170.05 2dit s TRP 88 N -2.69 1.52 -0.02 -0.53 0.52 -1.26 0.69 118.94 117.17 2dit s TRP 88 Ca 0.66 -0.69 0.05 0.00 0.02 0.00 0.00 56.10 56.14 2dit s TRP 88 Cb -0.22 -1.19 -0.01 0.00 -1.15 0.00 0.00 33.47 30.90 2dit s TRP 88 CO 0.60 -0.42 -0.17 -0.06 0.02 0.00 0.00 176.95 176.92 2dit s PHE 89 N 1.25 1.52 0.00 -1.98 0.40 0.34 -4.70 117.98 114.81 2dit s PHE 89 Ca -0.03 -0.31 0.00 0.00 -0.60 0.00 0.00 56.93 55.99 2dit s PHE 89 Cb -0.14 -0.98 0.00 0.00 0.51 0.00 0.00 43.02 42.41 2dit s PHE 89 CO -0.03 -0.04 0.00 0.41 0.70 0.00 0.00 175.22 176.25 2dit n GLY 90 N 2.74 0.08 0.00 4.36 0.00 -1.26 -1.12 105.19 109.99 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 -0.23 2.22 3.85 -0.02 0.00 -1.26 -5.08 105.19 104.67 2dit n GLY 91 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.51 2.60 0.52 1.61 1.70 -0.27 -5.06 118.95 119.53 2dit s ARG 92 Ca 0.00 -1.44 -0.08 0.00 -0.47 0.00 0.00 55.73 53.74 2dit s ARG 92 Cb 0.00 -2.40 -0.04 0.00 -0.57 0.00 0.00 34.95 31.94 2dit s ARG 92 CO 0.00 -0.05 0.87 -1.14 -1.08 0.00 0.00 175.30 173.90 2dit s GLN 93 N -4.05 3.59 0.23 3.89 0.74 -1.26 0.13 119.66 122.92 2dit s GLN 93 Ca 0.44 0.42 0.00 0.00 0.05 0.00 0.00 55.36 56.28 2dit s GLN 93 Cb -0.04 -2.27 -0.05 0.00 1.10 0.00 0.00 33.01 31.75 2dit s GLN 93 CO 0.27 -0.31 0.11 0.96 -0.55 0.00 0.00 175.29 175.76 2dit s ILE 94 N -2.86 0.33 0.22 -2.34 -4.36 0.22 -4.65 121.20 107.76 2dit s ILE 94 Ca 0.50 -2.00 0.10 0.00 -0.26 0.00 0.00 60.65 59.00 2dit s ILE 94 Cb -0.11 -2.55 -0.05 0.00 1.25 0.00 0.00 42.46 41.01 2dit s ILE 94 CO 0.47 -0.03 -0.19 0.28 0.24 0.00 0.00 174.94 175.71 2dit s THR 95 N -3.92 2.15 0.04 8.37 -1.32 -1.19 -3.40 115.64 116.37 2dit s THR 95 Ca 0.37 -2.20 0.03 0.00 -1.21 0.00 0.00 61.69 58.68 2dit s THR 95 Cb 0.07 -2.12 -0.02 0.00 -1.51 0.00 0.00 72.50 68.92 2dit s THR 95 CO 0.12 -0.39 -0.09 0.00 -2.21 0.00 0.00 174.62 172.05 2dit s ALA 96 N -2.39 0.74 0.11 11.08 0.00 -1.25 -3.12 121.76 126.93 2dit s ALA 96 Ca 0.24 -0.74 -0.25 0.00 0.00 0.00 0.00 51.96 51.20 2dit s ALA 96 Cb -0.05 -0.03 0.07 0.00 0.00 0.00 0.00 23.12 23.11 2dit s ALA 96 CO 0.11 0.06 0.82 1.14 0.00 0.00 0.00 175.76 177.89 2dit s GLN 97 N -1.34 1.14 0.11 0.00 0.00 -1.04 -4.68 119.66 113.85 2dit s GLN 97 Ca -0.05 -0.52 -0.26 0.00 -0.00 0.00 0.00 55.36 54.53 2dit s GLN 97 Cb -0.09 0.46 -0.07 0.00 0.00 0.00 0.00 33.01 33.32 2dit s GLN 97 CO 0.01 -0.51 0.80 0.00 0.00 0.00 0.00 175.29 175.59 2dit s ALA 98 N -3.40 3.38 0.41 2.60 0.00 -1.26 -0.75 121.76 122.74 2dit s ALA 98 Ca 0.07 0.36 -0.23 0.00 0.00 0.00 0.00 51.96 52.17 2dit s ALA 98 Cb -0.02 -3.03 -0.10 0.00 0.00 0.00 0.00 23.12 19.98 2dit s ALA 98 CO -0.05 0.15 1.00 -0.46 0.00 0.00 0.00 175.76 176.40 2dit s TRP 99 N -0.52 3.32 -0.24 0.00 -0.00 0.52 -4.84 118.94 117.18 2dit s TRP 99 Ca 0.39 1.65 0.10 0.00 -0.00 0.00 0.00 56.10 58.24 2dit s TRP 99 Cb -0.22 -2.99 0.45 0.00 -0.00 0.00 0.00 33.47 30.71 2dit s TRP 99 CO 0.25 -0.34 1.32 -3.47 -0.00 0.00 0.00 176.95 174.72 2dit n ASP 100 N -0.28 2.06 -4.11 5.86 2.03 -1.26 -4.62 116.55 116.23 2dit n ASP 100 Ca 0.06 -3.83 -0.38 0.00 0.52 0.00 0.00 54.79 51.16 2dit n ASP 100 Cb 0.52 -0.57 -0.02 0.00 -0.72 0.00 0.00 41.12 40.32 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 -1.12 -0.54 0.61 0.27 0.00 -1.26 -4.82 105.19 98.33 2dit n GLY 101 Ca 0.25 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 -4.76 0.00 -1.56 2.61 5.66 -1.26 -5.09 114.28 109.88 2dit n THR 102 Ca -0.20 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.42 2dit n THR 102 Cb 0.62 -0.45 0.06 0.00 -1.55 0.00 0.00 70.33 69.02 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 -2.18 3.63 -2.11 1.09 5.66 -1.26 -4.93 114.28 114.18 2dit n THR 103 Ca 0.00 -0.47 -0.30 0.00 -3.05 0.00 0.00 64.05 60.23 2dit n THR 103 Cb 0.19 -1.14 0.02 0.00 -1.55 0.00 0.00 70.33 67.85 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 -1.07 5.75 0.00 1.09 5.75 -1.26 -4.74 116.55 122.08 2dit n ASP 104 Ca 0.14 -3.76 0.00 0.00 -0.01 0.00 0.00 54.79 51.16 2dit n ASP 104 Cb 0.48 -0.63 0.00 0.00 -1.03 0.00 0.00 41.12 39.94 2dit n ASP 104 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2dit n TYR 105 N -0.60 0.00 0.12 2.11 4.01 -1.26 -4.56 117.16 116.98 2dit n TYR 105 Ca 0.46 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 58.23 2dit n TYR 105 Cb 0.64 -0.38 -0.04 0.00 -0.31 0.00 0.00 39.34 39.25 2dit n TYR 105 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dit n GLN 106 N -1.65 2.54 -2.43 -0.72 -0.00 -1.26 -4.95 117.38 108.91 2dit n GLN 106 Ca 0.00 -0.03 -0.42 0.00 -0.00 0.00 0.00 57.00 56.55 2dit n GLN 106 Cb 0.00 -0.96 -0.02 0.00 -0.00 0.00 0.00 30.24 29.26 2dit n GLN 106 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2dit s SER 107 N -2.12 6.32 0.00 2.61 0.15 -1.26 -4.82 113.70 114.59 2dit s SER 107 Ca -0.00 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.17 2dit s SER 107 Cb 0.04 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 2dit s SER 107 CO 0.23 -1.50 0.00 0.61 1.20 0.00 0.00 173.24 173.78 2dit n GLY 108 N 5.10 0.88 3.77 9.45 0.00 -1.26 -4.73 105.19 118.40 2dit n GLY 108 Ca 0.14 -2.28 -0.33 0.00 0.00 0.00 0.00 46.02 43.54 2dit n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dit s PRO 109 N -1.05 2.90 0.32 1.61 0.04 -1.26 -5.07 135.00 132.49 2dit s PRO 109 Ca 0.00 1.43 0.07 0.00 0.04 0.00 0.00 61.00 62.53 2dit s PRO 109 Cb 0.00 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 2dit s PRO 109 CO 0.00 -1.18 -0.03 -1.12 0.04 0.00 0.00 177.00 174.71 2dit s SER 110 N -2.45 3.03 0.15 6.66 0.01 -1.26 -5.09 113.70 114.75 2dit s SER 110 Ca 0.68 -1.26 0.05 0.00 1.31 0.00 0.00 55.95 56.73 2dit s SER 110 Cb -0.21 -0.22 -0.04 0.00 0.21 0.00 0.00 66.02 65.76 2dit s SER 110 CO 0.39 -0.39 0.13 -0.44 0.41 0.00 0.00 173.24 173.33 2dit s SER 111 N -3.52 5.51 0.00 2.44 0.01 -1.26 -5.30 113.70 111.57 2dit s SER 111 Ca 0.32 -0.12 0.00 0.00 1.31 0.00 0.00 55.95 57.47 2dit s SER 111 Cb 0.06 -1.44 0.00 0.00 0.21 0.00 0.00 66.02 64.85 2dit s SER 111 CO 0.14 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.49