#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 -0.49 0.20 1.61 0.01 -1.26 -5.17 113.70 108.60 2dit s SER 2 Ca 0.00 0.90 0.03 0.00 1.31 0.00 0.00 55.95 58.19 2dit s SER 2 Cb 0.00 0.86 -0.05 0.00 0.21 0.00 0.00 66.02 67.04 2dit s SER 2 CO 0.00 -0.17 -0.00 -0.44 0.41 0.00 0.00 173.24 173.04 2dit s SER 3 N 0.69 1.51 -0.04 2.44 0.01 -1.26 -5.17 113.70 111.88 2dit s SER 3 Ca -0.04 -1.19 -0.29 0.00 1.31 0.00 0.00 55.95 55.75 2dit s SER 3 Cb -0.05 0.07 0.10 0.00 0.21 0.00 0.00 66.02 66.35 2dit s SER 3 CO -0.05 -0.53 0.85 -0.83 0.41 0.00 0.00 173.24 173.09 2dit s GLY 4 N -3.23 -0.44 0.03 3.44 0.00 -1.26 -4.90 107.32 100.96 2dit s GLY 4 Ca 0.26 1.30 0.00 0.00 0.00 0.00 0.00 44.72 46.28 2dit s GLY 4 CO 0.06 0.62 0.00 1.44 0.00 0.00 0.00 173.10 175.22 2dit n SER 5 N 0.21 0.11 -2.08 1.64 7.64 -1.26 -4.81 113.62 115.08 2dit n SER 5 Ca -0.12 0.05 -0.20 0.00 1.01 0.00 0.00 58.87 59.61 2dit n SER 5 Cb 0.60 -0.01 0.01 0.00 -1.01 0.00 0.00 64.21 63.80 2dit n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dit n SER 6 N -2.94 6.49 -2.46 6.43 7.64 -1.26 -4.82 113.62 122.70 2dit n SER 6 Ca 0.00 -3.12 -0.05 0.00 1.01 0.00 0.00 58.87 56.71 2dit n SER 6 Cb 0.26 -1.11 0.01 0.00 -1.01 0.00 0.00 64.21 62.36 2dit n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dit n GLY 7 N 0.50 -1.12 3.86 0.23 0.00 -1.26 -5.01 105.19 102.39 2dit n GLY 7 Ca 0.37 0.81 -0.31 0.00 0.00 0.00 0.00 46.02 46.89 2dit n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dit s GLY 8 N -2.18 1.64 -0.79 -0.02 0.00 -1.26 -4.95 107.32 99.77 2dit s GLY 8 Ca 0.16 -0.18 -0.25 0.00 0.00 0.00 0.00 44.72 44.45 2dit s GLY 8 CO 0.54 0.16 1.91 2.56 0.00 0.00 0.00 173.10 178.27 2dit s PRO 9 N -5.23 2.58 0.08 2.90 0.04 -1.26 -4.94 135.00 129.17 2dit s PRO 9 Ca 0.57 0.06 0.04 0.00 0.04 0.00 0.00 61.00 61.71 2dit s PRO 9 Cb -0.12 -4.80 -0.03 0.00 0.04 0.00 0.00 34.50 29.59 2dit s PRO 9 CO 0.53 -3.13 -0.11 -1.54 0.04 0.00 0.00 177.00 172.80 2dit s SER 10 N 8.07 1.40 0.26 6.66 1.04 -1.26 -5.15 113.70 124.72 2dit s SER 10 Ca 0.69 -0.68 0.03 0.00 0.48 0.00 0.00 55.95 56.47 2dit s SER 10 Cb -0.09 -0.01 -0.06 0.00 0.10 0.00 0.00 66.02 65.97 2dit s SER 10 CO 0.08 -0.18 0.03 0.00 0.98 0.00 0.00 173.24 174.14 2dit s ARG 11 N -2.15 1.45 -0.22 4.02 3.03 -1.26 -5.14 118.95 118.68 2dit s ARG 11 Ca -0.01 -1.76 -0.13 0.00 2.03 0.00 0.00 55.73 55.86 2dit s ARG 11 Cb -0.07 -0.66 -0.05 0.00 -1.03 0.00 0.00 34.95 33.14 2dit s ARG 11 CO 0.01 -0.15 0.25 -1.64 -1.13 0.00 0.00 175.30 172.64 2dit s MET 12 N -3.89 4.12 0.41 3.89 -1.94 -1.26 -4.96 119.30 115.67 2dit s MET 12 Ca 0.32 -0.08 0.26 0.00 -1.71 0.00 0.00 55.69 54.48 2dit s MET 12 Cb 0.07 -3.53 1.36 0.00 2.01 0.00 0.00 34.83 34.74 2dit s MET 12 CO 0.12 0.04 1.62 0.00 -0.01 0.00 0.00 175.02 176.78 2dit h ARG 13 N 7.41 0.10 -6.77 2.03 3.08 -2.06 -3.38 114.38 114.79 2dit h ARG 13 Ca -0.37 -0.01 -0.49 0.00 0.07 0.00 0.00 59.98 59.18 2dit h ARG 13 Cb 1.17 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 2dit h ARG 13 CO 0.68 0.06 0.38 -3.38 -1.07 0.00 0.00 179.97 176.64 2dit s HIS 14 N -5.39 3.88 -0.73 3.04 -3.43 -1.26 -5.01 115.29 106.39 2dit s HIS 14 Ca -0.08 1.86 -0.09 0.00 -0.80 0.00 0.00 55.06 55.95 2dit s HIS 14 Cb 0.31 -3.04 0.19 0.00 -1.43 0.00 0.00 32.58 28.61 2dit s HIS 14 CO 0.81 0.22 0.61 -2.00 -2.00 0.00 0.00 174.74 172.38 2dit s GLU 15 N -1.30 3.10 -0.87 -0.38 2.56 -1.26 -5.00 118.70 115.55 2dit s GLU 15 Ca 0.42 -2.48 -0.09 0.00 0.00 0.00 0.00 54.97 52.82 2dit s GLU 15 Cb -0.27 -4.10 0.22 0.00 2.00 0.00 0.00 34.13 31.99 2dit s GLU 15 CO 0.33 -1.24 0.79 1.03 -0.56 0.00 0.00 175.26 175.62 2dit s ARG 16 N 0.08 3.52 -0.01 4.30 3.00 -1.26 -4.87 118.95 123.70 2dit s ARG 16 Ca 0.17 -2.77 -0.03 0.00 0.00 0.00 0.00 55.73 53.10 2dit s ARG 16 Cb -0.15 -4.27 0.00 0.00 0.00 0.00 0.00 34.95 30.53 2dit s ARG 16 CO -0.06 -1.25 0.07 0.08 0.00 0.00 0.00 175.30 174.14 2dit s VAL 17 N -0.42 0.04 0.04 3.52 1.01 -1.26 -0.06 120.40 123.27 2dit s VAL 17 Ca 0.22 -0.35 0.09 0.00 0.00 0.00 0.00 61.98 61.94 2dit s VAL 17 Cb -0.12 -0.22 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 2dit s VAL 17 CO -0.08 -0.19 -0.24 0.68 0.00 0.00 0.00 175.10 175.26 2dit s VAL 18 N -0.59 2.29 0.03 2.92 -7.23 -0.71 -0.43 120.40 116.68 2dit s VAL 18 Ca -0.07 -1.32 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 2dit s VAL 18 Cb -0.04 -1.90 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 2dit s VAL 18 CO 0.00 0.38 -0.04 -0.63 -0.31 0.00 0.00 175.10 174.51 2dit s ILE 19 N -0.82 3.86 -0.02 -0.62 -1.09 0.03 -2.04 121.20 120.50 2dit s ILE 19 Ca 0.12 -0.81 0.04 0.00 -2.23 0.00 0.00 60.65 57.77 2dit s ILE 19 Cb -0.10 -2.73 -0.01 0.00 -1.58 0.00 0.00 42.46 38.04 2dit s ILE 19 CO 0.02 0.31 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.28 2dit s ILE 20 N -1.11 1.10 0.24 2.92 -1.09 -1.21 -2.40 121.20 119.65 2dit s ILE 20 Ca 0.20 -0.57 0.11 0.00 -2.23 0.00 0.00 60.65 58.17 2dit s ILE 20 Cb -0.11 -0.93 -0.05 0.00 -1.58 0.00 0.00 42.46 39.79 2dit s ILE 20 CO 0.11 0.32 -0.20 -0.54 -1.23 0.00 0.00 174.94 173.40 2dit s LYS 21 N -0.13 1.66 -1.25 2.79 3.01 -1.16 -2.80 119.74 121.86 2dit s LYS 21 Ca 0.02 -1.62 -0.10 0.00 -1.01 0.00 0.00 55.97 53.25 2dit s LYS 21 Cb -0.07 -1.84 -0.01 0.00 -1.01 0.00 0.00 37.83 34.90 2dit s LYS 21 CO 0.00 0.37 0.67 -1.71 0.51 0.00 0.00 175.35 175.19 2dit n ASN 22 N -0.22 -3.05 0.00 2.83 5.15 -0.55 -3.34 115.26 116.07 2dit n ASN 22 Ca -0.09 -0.97 0.00 0.00 -0.60 0.00 0.00 54.58 52.93 2dit n ASN 22 Cb 0.58 -3.48 0.00 0.00 -0.53 0.00 0.00 39.78 36.35 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 -4.23 1.47 -2.66 1.20 0.00 -1.24 -4.19 117.12 107.46 2dit n MET 23 Ca -0.20 0.00 -0.06 0.00 0.00 0.00 0.00 57.70 57.44 2dit n MET 23 Cb 0.64 -0.88 0.01 0.00 0.00 0.00 0.00 33.22 32.99 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 -1.32 -1.61 -3.74 3.17 1.16 -1.26 -4.37 117.46 109.48 2dit n PHE 24 Ca 0.00 -1.13 -0.13 0.00 -1.87 0.00 0.00 57.45 54.32 2dit n PHE 24 Cb 0.00 0.48 -0.10 0.00 -1.61 0.00 0.00 39.48 38.25 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 -4.83 -0.38 0.07 2.97 2.46 -1.26 -3.44 115.29 110.88 2dit s HIS 25 Ca 0.11 0.91 -0.17 0.00 0.47 0.00 0.00 55.06 56.38 2dit s HIS 25 Cb -0.02 0.14 -0.11 0.00 -0.13 0.00 0.00 32.58 32.45 2dit s HIS 25 CO 0.08 -0.23 1.39 -1.00 -2.47 0.00 0.00 174.74 172.51 2dit h PRO 26 N 5.31 0.55 0.00 2.88 0.13 -1.82 -2.88 132.00 136.16 2dit h PRO 26 Ca -0.27 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 2dit h PRO 26 Cb 1.18 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dit h PRO 26 CO 0.29 0.88 0.00 -0.12 -0.23 0.00 0.00 178.00 178.82 2dit n MET 27 N -4.39 0.11 0.04 0.86 1.56 -1.26 -1.46 117.12 112.58 2dit n MET 27 Ca -0.05 0.50 -0.06 0.00 -0.27 0.00 0.00 57.70 57.82 2dit n MET 27 Cb 0.42 -1.78 -0.11 0.00 2.15 0.00 0.00 33.22 33.90 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 0.00 1.21 6.12 5.19 -1.89 -3.30 116.42 123.75 2dit h ASP 28 Ca 0.00 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.28 2dit h ASP 28 Cb 0.14 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.63 2dit h ASP 28 CO 0.00 0.94 -0.64 -0.26 -3.12 0.00 0.00 179.24 176.16 2dit h PHE 29 N 0.00 0.00 0.00 4.55 0.04 -1.27 -3.08 116.94 117.18 2dit h PHE 29 Ca -0.09 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.65 2dit h PHE 29 Cb 1.79 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.94 2dit h PHE 29 CO 0.00 0.64 -0.16 0.93 -0.60 0.00 0.00 178.31 179.12 2dit h GLU 30 N 0.00 0.00 0.06 1.51 4.39 -1.60 -2.59 114.58 116.35 2dit h GLU 30 Ca -0.01 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.40 2dit h GLU 30 Cb 1.41 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.04 2dit h GLU 30 CO 0.08 0.16 -1.57 0.22 -1.16 0.00 0.00 179.01 176.73 2dit h ASP 31 N 0.00 0.21 -3.30 1.42 3.58 -1.68 -3.48 116.42 113.18 2dit h ASP 31 Ca -0.00 -0.34 0.04 0.00 0.42 0.00 0.00 57.03 57.15 2dit h ASP 31 Cb 0.32 -0.07 -0.25 0.00 1.72 0.00 0.00 39.33 41.05 2dit h ASP 31 CO 0.02 1.29 0.34 -1.81 -2.88 0.00 0.00 179.24 176.20 2dit s ASP 32 N -6.66 -0.57 0.17 2.28 1.01 -0.98 -5.05 116.67 106.88 2dit s ASP 32 Ca -0.08 1.05 -0.08 0.00 0.71 0.00 0.00 52.55 54.16 2dit s ASP 32 Cb 0.08 1.10 0.04 0.00 1.01 0.00 0.00 42.92 45.15 2dit s ASP 32 CO 0.83 -0.18 1.51 1.55 0.21 0.00 0.00 175.17 179.09 2dit h PRO 33 N 4.82 0.82 -0.85 8.23 0.13 -1.86 -3.25 132.00 140.03 2dit h PRO 33 Ca -0.29 -0.43 0.19 0.00 -0.87 0.00 0.00 66.00 64.60 2dit h PRO 33 Cb 1.18 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 32.16 2dit h PRO 33 CO 0.11 1.06 -0.15 1.28 -0.23 0.00 0.00 178.00 180.07 2dit n LEU 34 N -4.05 -0.25 -0.27 1.56 7.99 -1.26 0.04 117.00 120.77 2dit n LEU 34 Ca -0.02 1.47 -0.08 0.00 -0.01 0.00 0.00 56.01 57.36 2dit n LEU 34 Cb 0.54 -0.47 -0.04 0.00 -0.11 0.00 0.00 43.42 43.34 2dit n LEU 34 CO 0.47 -1.43 0.55 0.58 -1.51 0.00 0.00 177.39 176.06 2dit h VAL 35 N 0.00 0.05 -0.36 4.08 2.07 -1.87 0.38 116.25 120.60 2dit h VAL 35 Ca 0.44 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.89 2dit h VAL 35 Cb 0.74 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2dit h VAL 35 CO -0.86 0.00 -0.09 0.25 0.02 0.00 0.00 177.57 176.90 2dit h LEU 36 N -0.16 0.58 0.72 2.57 5.85 -0.60 -1.88 115.31 122.39 2dit h LEU 36 Ca 0.19 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2dit h LEU 36 Cb 0.54 -0.15 0.01 0.00 0.37 0.00 0.00 40.66 41.42 2dit h LEU 36 CO -0.78 0.71 -0.35 0.78 -0.34 0.00 0.00 178.44 178.46 2dit h ASN 37 N 0.56 -0.82 -0.81 1.25 2.35 0.69 0.17 115.58 118.98 2dit h ASN 37 Ca 0.10 0.03 0.10 0.00 -0.55 0.00 0.00 56.30 55.98 2dit h ASN 37 Cb 0.48 0.21 -0.07 0.00 0.05 0.00 0.00 38.32 38.99 2dit h ASN 37 CO 0.03 -0.58 0.45 1.05 -1.65 0.00 0.00 177.43 176.72 2dit h GLU 38 N -0.98 0.72 0.49 0.81 4.11 -0.45 -1.13 114.58 118.15 2dit h GLU 38 Ca -0.10 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.26 2dit h GLU 38 Cb 0.74 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2dit h GLU 38 CO 0.16 0.47 -0.24 0.82 0.07 0.00 0.00 179.01 180.30 2dit h ILE 39 N 0.74 0.52 0.35 -1.06 2.04 -1.25 0.73 117.51 119.58 2dit h ILE 39 Ca 0.40 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 66.23 2dit h ILE 39 Cb 0.40 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 2dit h ILE 39 CO -0.26 0.00 -0.51 -0.09 0.00 0.00 0.00 178.15 177.30 2dit h ARG 40 N -0.67 -0.86 -0.77 2.37 2.43 -0.23 -1.31 114.38 115.34 2dit h ARG 40 Ca -0.07 0.06 0.15 0.00 -0.81 0.00 0.00 59.98 59.31 2dit h ARG 40 Cb 0.51 0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 30.21 2dit h ARG 40 CO 0.11 -0.57 0.51 1.05 -1.51 0.00 0.00 179.97 179.56 2dit h GLU 41 N -0.89 0.43 -0.57 0.20 4.11 -1.23 -0.65 114.58 115.98 2dit h GLU 41 Ca -0.04 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 59.35 2dit h GLU 41 Cb 0.81 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 2dit h GLU 41 CO -0.15 0.28 0.31 -0.44 0.07 0.00 0.00 179.01 179.09 2dit h ASP 42 N 0.44 0.70 0.41 3.06 3.32 0.13 0.99 116.42 125.48 2dit h ASP 42 Ca 0.38 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 57.29 2dit h ASP 42 Cb 0.85 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 2dit h ASP 42 CO -0.13 0.59 -0.25 -0.07 -1.72 0.00 0.00 179.24 177.66 2dit h LEU 43 N 0.76 0.00 0.08 1.55 3.38 -0.06 0.27 115.31 121.29 2dit h LEU 43 Ca 0.20 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.91 2dit h LEU 43 Cb 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2dit h LEU 43 CO -0.03 0.25 -1.24 -0.09 0.09 0.00 0.00 178.44 177.42 2dit h ARG 44 N 0.00 0.18 0.00 1.13 2.43 -0.88 -2.79 114.38 114.44 2dit h ARG 44 Ca -0.00 -0.31 -0.15 0.00 -0.81 0.00 0.00 59.98 58.71 2dit h ARG 44 Cb 0.53 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 2dit h ARG 44 CO 0.03 1.11 -0.92 -0.39 -1.51 0.00 0.00 179.97 178.29 2dit h VAL 45 N 0.05 0.86 0.01 0.20 -1.51 -0.49 -2.98 116.25 112.38 2dit h VAL 45 Ca -0.12 -2.33 -0.10 0.00 -1.23 0.00 0.00 66.70 62.92 2dit h VAL 45 Cb 1.92 2.35 0.01 0.00 -2.13 0.00 0.00 31.29 33.45 2dit h VAL 45 CO 0.17 0.49 -0.39 1.05 -1.23 0.00 0.00 177.57 177.66 2dit h GLU 46 N 0.00 0.26 0.00 5.19 4.11 -0.56 -2.96 114.58 120.61 2dit h GLU 46 Ca -0.07 -0.28 0.00 0.00 0.07 0.00 0.00 59.36 59.08 2dit h GLU 46 Cb 1.53 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.86 2dit h GLU 46 CO 0.07 1.00 0.00 0.00 0.07 0.00 0.00 179.01 180.15 2dit h SER 48 N 0.00 0.16 -1.00 0.00 0.87 -1.53 -3.30 113.55 108.74 2dit h SER 48 Ca 0.00 -0.16 0.38 0.00 -1.23 0.00 0.00 61.79 60.78 2dit h SER 48 Cb 0.54 -0.05 -0.17 0.00 -0.44 0.00 0.00 62.40 62.27 2dit h SER 48 CO 0.00 1.12 0.48 0.11 -0.53 0.00 0.00 176.83 178.01 2dit h LYS 49 N 0.03 0.07 0.07 2.24 1.79 -1.34 1.07 116.57 120.51 2dit h LYS 49 Ca -0.05 -0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 58.16 2dit h LYS 49 Cb 1.82 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 32.44 2dit h LYS 49 CO 0.15 0.05 -1.25 0.74 -1.08 0.00 0.00 179.45 178.07 2dit h PHE 50 N 0.07 0.25 0.00 -1.35 -1.00 -1.76 -3.49 116.94 109.67 2dit h PHE 50 Ca 0.79 -0.19 0.00 0.00 2.81 0.00 0.00 57.97 61.39 2dit h PHE 50 Cb 1.99 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 41.54 2dit h PHE 50 CO -0.07 1.17 0.00 0.41 -1.61 0.00 0.00 178.31 178.21 2dit n GLY 51 N 1.49 -0.53 3.41 -1.45 0.00 0.37 -5.04 105.19 103.44 2dit n GLY 51 Ca -0.07 0.56 -0.17 0.00 0.00 0.00 0.00 46.02 46.33 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 1.08 1.86 -0.32 1.61 -0.21 -1.25 -4.62 119.66 117.80 2dit s GLN 52 Ca 0.00 -1.87 0.04 0.00 0.02 0.00 0.00 55.36 53.54 2dit s GLN 52 Cb 0.00 0.40 0.09 0.00 1.00 0.00 0.00 33.01 34.50 2dit s GLN 52 CO 0.00 -0.74 0.03 0.42 -2.12 0.00 0.00 175.29 172.88 2dit s ILE 53 N -3.18 2.17 0.40 1.08 -1.09 -1.26 -4.52 121.20 114.80 2dit s ILE 53 Ca 0.35 -2.17 0.07 0.00 -2.23 0.00 0.00 60.65 56.67 2dit s ILE 53 Cb 0.01 -2.55 0.27 0.00 -1.58 0.00 0.00 42.46 38.61 2dit s ILE 53 CO 0.23 -0.51 2.04 0.03 -1.23 0.00 0.00 174.94 175.51 2dit h ARG 54 N 7.67 0.58 -1.68 2.79 2.47 -1.85 -3.44 114.38 120.92 2dit h ARG 54 Ca -0.07 -0.04 0.04 0.00 -1.26 0.00 0.00 59.98 58.65 2dit h ARG 54 Cb 1.02 -0.13 -0.25 0.00 -1.65 0.00 0.00 29.97 28.97 2dit h ARG 54 CO 0.51 0.39 0.40 0.21 0.56 0.00 0.00 179.97 182.03 2dit s LYS 55 N -5.53 0.59 -0.04 0.04 2.47 -1.24 -4.99 119.74 111.04 2dit s LYS 55 Ca -0.09 0.60 0.02 0.00 -1.56 0.00 0.00 55.97 54.94 2dit s LYS 55 Cb 0.18 0.29 0.02 0.00 -1.46 0.00 0.00 37.83 36.85 2dit s LYS 55 CO 0.74 -0.09 -0.07 -1.17 0.16 0.00 0.00 175.35 174.92 2dit s LEU 56 N 0.04 1.52 -0.06 5.43 2.96 -1.26 -0.11 118.68 127.19 2dit s LEU 56 Ca 0.01 -0.17 -0.03 0.00 -0.22 0.00 0.00 54.13 53.72 2dit s LEU 56 Cb -0.04 -0.54 0.04 0.00 0.50 0.00 0.00 46.19 46.14 2dit s LEU 56 CO -0.03 -0.01 0.11 -0.76 -1.32 0.00 0.00 176.35 174.34 2dit s LEU 57 N 0.67 0.08 -0.26 -0.68 1.43 -0.09 -5.02 118.68 114.81 2dit s LEU 57 Ca -0.10 0.21 -0.11 0.00 -1.03 0.00 0.00 54.13 53.10 2dit s LEU 57 Cb -0.13 0.08 -0.05 0.00 0.03 0.00 0.00 46.19 46.12 2dit s LEU 57 CO 0.01 -0.24 0.19 -0.22 0.23 0.00 0.00 176.35 176.32 2dit s LEU 58 N 2.17 4.06 -1.25 1.79 0.20 -1.26 0.15 118.68 124.54 2dit s LEU 58 Ca 0.03 0.06 -0.06 0.00 0.69 0.00 0.00 54.13 54.85 2dit s LEU 58 Cb -0.12 -2.14 0.18 0.00 -0.43 0.00 0.00 46.19 43.68 2dit s LEU 58 CO -0.04 -0.02 2.01 0.49 -0.29 0.00 0.00 176.35 178.50 2dit n PHE 59 N 4.79 2.68 0.24 5.38 3.72 -0.34 -4.76 117.46 129.17 2dit n PHE 59 Ca -0.14 -2.75 0.09 0.00 -0.05 0.00 0.00 57.45 54.60 2dit n PHE 59 Cb 0.52 -1.74 0.48 0.00 -0.94 0.00 0.00 39.48 37.81 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 5.12 0.00 0.57 4.37 2.03 -1.95 -1.34 116.42 125.22 2dit h ASP 60 Ca 0.50 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.77 2dit h ASP 60 Cb 0.47 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.98 2dit h ASP 60 CO 1.49 0.00 -0.27 0.03 -1.03 0.00 0.00 179.24 179.46 2dit h ARG 61 N 0.00 -0.74 -6.31 4.15 -0.00 -1.92 -3.35 114.38 106.21 2dit h ARG 61 Ca 0.00 0.05 -0.57 0.00 -0.50 0.00 0.00 59.98 58.96 2dit h ARG 61 Cb 0.78 0.17 0.02 0.00 0.00 0.00 0.00 29.97 30.93 2dit h ARG 61 CO 0.00 -0.44 1.20 1.58 0.00 0.00 0.00 179.97 182.32 2dit n HIS 62 N -5.35 2.41 0.98 3.04 -0.00 -0.50 -4.82 115.22 110.97 2dit n HIS 62 Ca -0.12 -0.23 0.06 0.00 0.46 0.00 0.00 57.72 57.89 2dit n HIS 62 Cb 0.34 -2.75 0.33 0.00 -0.12 0.00 0.00 29.99 27.79 2dit n HIS 62 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2dit n PRO 63 N 7.28 0.49 -0.80 1.57 -0.04 -1.26 -2.44 135.00 139.80 2dit n PRO 63 Ca 0.22 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.66 2dit n PRO 63 Cb 0.36 -1.35 0.26 0.00 -0.04 0.00 0.00 33.50 32.73 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 -0.85 3.85 -3.43 3.54 9.92 -1.26 -4.81 116.55 123.51 2dit n ASP 64 Ca 0.08 -3.33 -0.21 0.00 -0.53 0.00 0.00 54.79 50.80 2dit n ASP 64 Cb 0.04 -0.66 0.01 0.00 -0.64 0.00 0.00 41.12 39.87 2dit n ASP 64 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dit n GLY 65 N -0.59 -0.89 3.49 0.44 0.00 -1.02 -1.48 105.19 105.14 2dit n GLY 65 Ca 0.34 0.83 -0.34 0.00 0.00 0.00 0.00 46.02 46.86 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 -2.52 3.78 0.18 1.61 1.01 -1.25 -2.64 120.40 120.57 2dit s VAL 66 Ca 0.14 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 61.75 2dit s VAL 66 Cb -0.02 -2.64 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 2dit s VAL 66 CO 0.84 0.51 -0.03 0.00 0.00 0.00 0.00 175.10 176.42 2dit s ALA 67 N 0.27 1.50 -0.23 5.51 0.00 -1.12 -1.20 121.76 126.49 2dit s ALA 67 Ca -0.04 -1.60 -0.01 0.00 0.00 0.00 0.00 51.96 50.31 2dit s ALA 67 Cb -0.14 0.37 0.07 0.00 0.00 0.00 0.00 23.12 23.41 2dit s ALA 67 CO 0.03 -0.23 0.00 0.45 0.00 0.00 0.00 175.76 176.02 2dit s SER 68 N -3.21 3.53 -0.40 0.00 0.15 0.12 -3.32 113.70 110.57 2dit s SER 68 Ca 0.23 -1.12 -0.05 0.00 0.70 0.00 0.00 55.95 55.71 2dit s SER 68 Cb 0.05 -0.92 0.10 0.00 -1.71 0.00 0.00 66.02 63.53 2dit s SER 68 CO 0.04 -0.29 0.20 -0.69 1.20 0.00 0.00 173.24 173.70 2dit s VAL 69 N 1.59 3.56 0.50 4.45 1.01 -0.87 -0.91 120.40 129.73 2dit s VAL 69 Ca -0.02 -1.79 -0.19 0.00 0.00 0.00 0.00 61.98 59.99 2dit s VAL 69 Cb -0.18 -3.32 -0.08 0.00 0.00 0.00 0.00 36.38 32.80 2dit s VAL 69 CO -0.09 -0.58 1.00 -0.44 0.00 0.00 0.00 175.10 174.99 2dit s SER 70 N 1.91 6.51 0.17 3.32 0.01 0.84 -1.73 113.70 124.73 2dit s SER 70 Ca 0.05 1.73 0.05 0.00 1.31 0.00 0.00 55.95 59.09 2dit s SER 70 Cb -0.23 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.42 2dit s SER 70 CO -0.02 -0.67 -0.10 -0.36 0.41 0.00 0.00 173.24 172.51 2dit s PHE 71 N -2.32 1.41 -0.18 2.43 0.40 0.92 -2.95 117.98 117.70 2dit s PHE 71 Ca 0.63 -0.74 -0.15 0.00 -0.60 0.00 0.00 56.93 56.07 2dit s PHE 71 Cb -0.12 -0.72 -0.21 0.00 0.51 0.00 0.00 43.02 42.48 2dit s PHE 71 CO 0.24 0.13 0.22 -2.13 0.70 0.00 0.00 175.22 174.38 2dit n ARG 72 N -0.27 0.64 -4.40 0.44 3.00 -1.26 -4.64 116.66 110.17 2dit n ARG 72 Ca -0.09 0.42 -0.34 0.00 -0.00 0.00 0.00 57.85 57.85 2dit n ARG 72 Cb 0.61 -1.71 -0.10 0.00 0.00 0.00 0.00 32.46 31.26 2dit n ARG 72 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 2dit s ASP 73 N -6.96 5.03 0.50 6.15 -4.77 -1.26 -5.01 116.67 110.35 2dit s ASP 73 Ca -0.27 0.04 0.29 0.00 -3.30 0.00 0.00 52.55 49.30 2dit s ASP 73 Cb 0.07 -1.33 1.20 0.00 -1.09 0.00 0.00 42.92 41.76 2dit s ASP 73 CO 0.65 0.33 1.93 1.55 0.70 0.00 0.00 175.17 180.34 2dit h PRO 74 N 4.85 0.00 -0.26 2.11 0.13 -1.98 -3.07 132.00 133.78 2dit h PRO 74 Ca -0.50 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.55 2dit h PRO 74 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2dit h PRO 74 CO 0.55 0.12 -0.16 0.93 -0.23 0.00 0.00 178.00 179.21 2dit h GLU 75 N 0.00 0.57 0.70 0.86 5.08 -1.97 -1.14 114.58 118.67 2dit h GLU 75 Ca -0.00 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.06 2dit h GLU 75 Cb 0.58 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.83 2dit h GLU 75 CO 0.02 0.84 -0.33 1.49 -1.00 0.00 0.00 179.01 180.02 2dit h GLU 76 N 0.29 -0.90 0.11 2.33 4.81 -1.94 -2.33 114.58 116.94 2dit h GLU 76 Ca 0.05 0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 2dit h GLU 76 Cb 0.69 0.20 -0.05 0.00 0.63 0.00 0.00 28.75 30.23 2dit h GLU 76 CO 0.05 -0.60 -0.40 0.00 -0.73 0.00 0.00 179.01 177.33 2dit h ALA 77 N -1.33 -0.69 -0.15 2.92 0.00 -1.64 1.14 119.26 119.51 2dit h ALA 77 Ca -0.10 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.79 2dit h ALA 77 Cb 0.72 0.67 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2dit h ALA 77 CO 0.16 -0.96 0.42 0.22 0.00 0.00 0.00 179.25 179.09 2dit h ASP 78 N -0.62 0.00 0.00 0.00 3.58 -1.29 0.55 116.42 118.63 2dit h ASP 78 Ca 0.03 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.43 2dit h ASP 78 Cb 0.66 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.70 2dit h ASP 78 CO -0.24 0.00 -2.05 0.00 -2.88 0.00 0.00 179.24 174.07 2dit n TYR 79 N -3.13 0.00 0.06 0.28 9.36 0.24 -4.25 117.16 119.72 2dit n TYR 79 Ca 0.02 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.13 2dit n TYR 79 Cb 0.51 -0.56 -0.13 0.00 -0.63 0.00 0.00 39.34 38.53 2dit n TYR 79 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2dit h ILE 81 N 0.03 0.35 0.00 0.00 -0.00 -0.91 0.82 117.51 117.79 2dit h ILE 81 Ca -0.11 -0.79 -0.12 0.00 -0.00 0.00 0.00 64.86 63.84 2dit h ILE 81 Cb 1.88 1.59 -0.02 0.00 -0.00 0.00 0.00 36.82 40.27 2dit h ILE 81 CO 0.14 0.12 -1.40 0.00 -0.00 0.00 0.00 178.15 177.02 2dit n GLN 82 N -3.32 0.62 -0.01 0.16 10.64 -1.23 -3.11 117.38 121.14 2dit n GLN 82 Ca -0.00 0.16 0.09 0.00 -1.83 0.00 0.00 57.00 55.42 2dit n GLN 82 Cb 0.35 -1.78 -0.15 0.00 -0.86 0.00 0.00 30.24 27.80 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 -2.79 0.20 1.03 -0.39 -1.04 -1.04 -4.19 114.28 106.06 2dit n THR 83 Ca -0.08 -0.54 0.11 0.00 -2.04 0.00 0.00 64.05 61.51 2dit n THR 83 Cb 0.76 -0.08 0.12 0.00 -1.82 0.00 0.00 70.33 69.31 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 -2.35 0.89 0.00 -4.42 4.77 0.28 -4.01 117.00 112.17 2dit n LEU 84 Ca -0.06 -0.28 0.06 0.00 -0.03 0.00 0.00 56.01 55.70 2dit n LEU 84 Cb 0.62 -0.12 0.27 0.00 -2.33 0.00 0.00 43.42 41.86 2dit n LEU 84 CO 0.45 0.20 0.65 -0.90 -1.33 0.00 0.00 177.39 176.46 2dit n ASP 85 N -1.23 0.00 0.00 -1.43 5.75 -1.18 -1.91 116.55 116.55 2dit n ASP 85 Ca 0.06 0.25 0.00 0.00 -0.01 0.00 0.00 54.79 55.10 2dit n ASP 85 Cb 0.35 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 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 -0.32 2.04 3.65 6.12 0.00 -1.19 -4.00 105.19 111.49 2dit n GLY 86 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.82 0.69 -0.10 1.61 1.81 -0.80 -4.67 118.95 116.67 2dit s ARG 87 Ca 0.00 1.12 0.01 0.00 -1.72 0.00 0.00 55.73 55.14 2dit s ARG 87 Cb 0.00 -1.72 0.02 0.00 -0.45 0.00 0.00 34.95 32.80 2dit s ARG 87 CO 0.00 -2.72 -0.13 -1.58 -0.68 0.00 0.00 175.30 170.19 2dit s TRP 88 N -2.71 1.75 -0.02 -0.53 0.52 -1.26 0.63 118.94 117.33 2dit s TRP 88 Ca 0.66 -0.79 0.06 0.00 0.02 0.00 0.00 56.10 56.04 2dit s TRP 88 Cb -0.21 -1.30 -0.01 0.00 -1.15 0.00 0.00 33.47 30.80 2dit s TRP 88 CO 0.59 -0.43 -0.19 -0.06 0.02 0.00 0.00 176.95 176.88 2dit s PHE 89 N 1.02 1.70 0.00 -1.98 0.40 0.34 -4.69 117.98 114.78 2dit s PHE 89 Ca -0.07 -0.34 0.00 0.00 -0.60 0.00 0.00 56.93 55.92 2dit s PHE 89 Cb -0.15 -1.10 0.00 0.00 0.51 0.00 0.00 43.02 42.28 2dit s PHE 89 CO -0.01 -0.04 0.00 0.41 0.70 0.00 0.00 175.22 176.27 2dit n GLY 90 N 2.67 0.02 0.00 4.36 0.00 -1.26 -0.98 105.19 110.00 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 -0.02 2.51 3.98 -0.02 0.00 -1.26 -5.09 105.19 105.29 2dit n GLY 91 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2dit n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dit s ARG 92 N -0.33 2.78 0.49 1.61 1.81 -0.15 -5.04 118.95 120.12 2dit s ARG 92 Ca 0.00 -1.29 -0.06 0.00 -1.72 0.00 0.00 55.73 52.67 2dit s ARG 92 Cb 0.00 -2.68 -0.04 0.00 -0.45 0.00 0.00 34.95 31.79 2dit s ARG 92 CO 0.00 -0.22 0.80 -1.14 -0.68 0.00 0.00 175.30 174.06 2dit s GLN 93 N -4.28 3.53 0.04 3.54 0.74 -1.26 0.13 119.66 122.09 2dit s GLN 93 Ca 0.53 0.23 0.01 0.00 0.05 0.00 0.00 55.36 56.17 2dit s GLN 93 Cb -0.08 -2.36 -0.02 0.00 1.10 0.00 0.00 33.01 31.65 2dit s GLN 93 CO 0.32 -0.24 -0.05 0.96 -0.55 0.00 0.00 175.29 175.73 2dit s ILE 94 N -2.77 0.33 0.17 -2.34 -4.36 0.21 -4.68 121.20 107.75 2dit s ILE 94 Ca 0.48 -1.11 0.06 0.00 -0.26 0.00 0.00 60.65 59.82 2dit s ILE 94 Cb -0.10 -0.58 -0.04 0.00 1.25 0.00 0.00 42.46 42.99 2dit s ILE 94 CO 0.45 -0.51 0.09 0.28 0.24 0.00 0.00 174.94 175.50 2dit s THR 95 N -1.74 4.26 0.10 8.37 -1.32 -1.21 -3.16 115.64 120.93 2dit s THR 95 Ca -0.10 -1.18 0.06 0.00 -1.21 0.00 0.00 61.69 59.25 2dit s THR 95 Cb -0.08 -3.16 -0.03 0.00 -1.51 0.00 0.00 72.50 67.72 2dit s THR 95 CO -0.01 -0.11 -0.15 0.00 -2.21 0.00 0.00 174.62 172.14 2dit s ALA 96 N -1.74 1.38 0.08 11.08 0.00 -1.26 -2.98 121.76 128.32 2dit s ALA 96 Ca 0.30 -1.17 -0.26 0.00 0.00 0.00 0.00 51.96 50.83 2dit s ALA 96 Cb -0.10 -0.10 0.08 0.00 0.00 0.00 0.00 23.12 23.01 2dit s ALA 96 CO 0.22 0.15 0.80 1.14 0.00 0.00 0.00 175.76 178.06 2dit s GLN 97 N -2.24 1.06 -0.13 0.00 0.00 -1.01 -4.72 119.66 112.62 2dit s GLN 97 Ca 0.04 -0.43 -0.23 0.00 -0.00 0.00 0.00 55.36 54.74 2dit s GLN 97 Cb -0.07 0.46 -0.03 0.00 0.00 0.00 0.00 33.01 33.37 2dit s GLN 97 CO 0.03 -0.47 0.69 0.00 0.00 0.00 0.00 175.29 175.54 2dit s ALA 98 N -3.38 3.45 0.38 2.60 0.00 -1.26 -0.79 121.76 122.76 2dit s ALA 98 Ca 0.05 -0.04 -0.21 0.00 0.00 0.00 0.00 51.96 51.76 2dit s ALA 98 Cb -0.01 -2.99 -0.10 0.00 0.00 0.00 0.00 23.12 20.01 2dit s ALA 98 CO -0.08 -0.35 0.89 -0.46 0.00 0.00 0.00 175.76 175.76 2dit s TRP 99 N 1.41 3.41 -0.04 0.00 -0.00 0.43 -4.91 118.94 119.25 2dit s TRP 99 Ca 0.34 1.55 -0.05 0.00 -0.00 0.00 0.00 56.10 57.95 2dit s TRP 99 Cb -0.17 -2.79 -0.02 0.00 -0.00 0.00 0.00 33.47 30.50 2dit s TRP 99 CO 0.14 0.02 -0.09 -0.25 -0.00 0.00 0.00 176.95 176.76 2dit n ASP 100 N -0.28 0.58 0.00 5.86 8.00 -1.26 -4.65 116.55 124.80 2dit n ASP 100 Ca 0.05 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.64 2dit n ASP 100 Cb 0.53 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 2dit n ASP 100 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dit n GLY 101 N 1.88 -0.84 0.00 0.44 0.00 -1.26 -4.96 105.19 100.45 2dit n GLY 101 Ca -0.04 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.32 2.61 5.66 -1.26 -5.09 114.28 114.88 2dit n THR 102 Ca 0.00 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.65 2dit n THR 102 Cb 0.00 -0.22 0.10 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 -1.44 2.88 -1.23 1.09 5.66 -1.26 -4.94 114.28 115.03 2dit n THR 103 Ca 0.00 -0.33 0.05 0.00 -3.05 0.00 0.00 64.05 60.72 2dit n THR 103 Cb 0.15 -1.21 0.21 0.00 -1.55 0.00 0.00 70.33 67.93 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 -2.35 2.80 0.02 1.09 8.00 -1.26 -4.67 116.55 120.19 2dit n ASP 104 Ca 0.14 -3.39 -0.04 0.00 0.71 0.00 0.00 54.79 52.20 2dit n ASP 104 Cb 0.50 -0.54 -0.03 0.00 -0.02 0.00 0.00 41.12 41.02 2dit n ASP 104 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2dit h TYR 105 N 1.02 -0.43 0.01 1.24 0.05 -2.00 -3.35 116.97 113.51 2dit h TYR 105 Ca 0.07 0.01 -0.37 0.00 0.05 0.00 0.00 58.73 58.49 2dit h TYR 105 Cb 1.35 0.19 -0.06 0.00 1.01 0.00 0.00 36.73 39.22 2dit h TYR 105 CO 0.58 -0.16 -2.35 0.00 -1.05 0.00 0.00 178.16 175.18 2dit n GLN 106 N -3.30 0.67 -1.44 4.88 -0.00 -1.26 -4.99 117.38 111.95 2dit n GLN 106 Ca -0.02 0.12 -0.39 0.00 -0.00 0.00 0.00 57.00 56.71 2dit n GLN 106 Cb 0.11 -1.56 0.03 0.00 -0.00 0.00 0.00 30.24 28.82 2dit n GLN 106 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2dit n SER 107 N -3.11 -1.31 -4.67 2.61 2.88 -1.26 -4.98 113.62 103.78 2dit n SER 107 Ca -0.38 0.77 -0.23 0.00 -1.33 0.00 0.00 58.87 57.69 2dit n SER 107 Cb 1.05 -1.12 0.12 0.00 -0.75 0.00 0.00 64.21 63.51 2dit n SER 107 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dit s GLY 108 N -1.09 1.74 -0.06 0.46 0.00 -1.26 -4.87 107.32 102.24 2dit s GLY 108 Ca 0.66 -1.90 -0.30 0.00 0.00 0.00 0.00 44.72 43.19 2dit s GLY 108 CO 0.57 -1.28 1.50 2.56 0.00 0.00 0.00 173.10 176.44 2dit s PRO 109 N -5.14 4.22 0.04 2.90 0.04 -1.26 -5.02 135.00 130.78 2dit s PRO 109 Ca 0.67 2.01 0.05 0.00 0.04 0.00 0.00 61.00 63.77 2dit s PRO 109 Cb -0.04 -3.82 -0.04 0.00 0.04 0.00 0.00 34.50 30.64 2dit s PRO 109 CO 0.45 -0.74 -0.08 -1.54 0.04 0.00 0.00 177.00 175.12 2dit s SER 110 N 2.63 4.55 -0.09 6.66 1.04 -1.26 -5.12 113.70 122.10 2dit s SER 110 Ca 0.67 -0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.90 2dit s SER 110 Cb -0.30 -1.00 0.01 0.00 0.10 0.00 0.00 66.02 64.83 2dit s SER 110 CO 0.25 0.24 -0.18 -0.55 0.98 0.00 0.00 173.24 173.99 2dit s SER 111 N -1.70 2.50 0.00 7.02 0.15 -1.26 -5.32 113.70 115.10 2dit s SER 111 Ca 0.19 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.39 2dit s SER 111 Cb -0.11 -1.14 0.00 0.00 -1.71 0.00 0.00 66.02 63.06 2dit s SER 111 CO 0.10 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.22