#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dao n SER 2 N 0.00 -2.75 0.53 1.61 2.88 -1.26 -4.87 113.62 109.77 2dao n SER 2 Ca 0.00 -1.01 -0.21 0.00 -1.33 0.00 0.00 58.87 56.32 2dao n SER 2 Cb 0.00 -2.83 -0.10 0.00 -0.75 0.00 0.00 64.21 60.54 2dao n SER 2 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2dao h SER 3 N -1.59 -1.15 0.00 -3.46 0.02 -2.13 -3.48 113.55 101.77 2dao h SER 3 Ca -0.60 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 2dao h SER 3 Cb 1.38 0.30 0.00 0.00 0.14 0.00 0.00 62.40 64.22 2dao h SER 3 CO 0.75 -0.82 0.00 0.61 -1.14 0.00 0.00 176.83 176.23 2dao n GLY 4 N -1.64 0.75 3.50 -3.77 0.00 -1.26 -5.05 105.19 97.72 2dao n GLY 4 Ca -0.17 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 2dao n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dao s SER 5 N -1.43 6.22 -1.03 1.61 0.15 -1.26 -4.96 113.70 113.00 2dao s SER 5 Ca 0.00 -0.84 -0.18 0.00 0.70 0.00 0.00 55.95 55.63 2dao s SER 5 Cb 0.00 -2.49 0.13 0.00 -1.71 0.00 0.00 66.02 61.95 2dao s SER 5 CO 0.00 -1.61 1.27 -0.55 1.20 0.00 0.00 173.24 173.55 2dao s SER 6 N 3.80 6.74 0.10 5.45 0.15 -1.26 -4.37 113.70 124.32 2dao s SER 6 Ca 0.30 -2.25 0.00 0.00 0.70 0.00 0.00 55.95 54.70 2dao s SER 6 Cb -0.11 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2dao s SER 6 CO 0.10 -1.03 0.00 0.61 1.20 0.00 0.00 173.24 174.12 2dao n GLY 7 N 5.27 -0.83 3.69 9.45 0.00 -1.26 -5.11 105.19 116.40 2dao n GLY 7 Ca 0.29 0.12 -0.45 0.00 0.00 0.00 0.00 46.02 45.99 2dao n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dao n ARG 9 N 3.77 0.74 -1.59 0.00 1.74 -1.26 -5.12 116.66 114.95 2dao n ARG 9 Ca 0.17 -1.85 -0.58 0.00 -0.77 0.00 0.00 57.85 54.82 2dao n ARG 9 Cb 0.31 2.09 -0.07 0.00 -1.02 0.00 0.00 32.46 33.76 2dao n ARG 9 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2dao n LEU 10 N 0.00 1.00 -0.11 0.55 7.99 -1.26 -4.59 117.00 120.58 2dao n LEU 10 Ca -0.04 1.14 -0.05 0.00 -0.01 0.00 0.00 56.01 57.05 2dao n LEU 10 Cb 0.45 -1.03 -0.04 0.00 -0.11 0.00 0.00 43.42 42.68 2dao n LEU 10 CO 0.21 -1.30 0.50 0.25 -1.51 0.00 0.00 177.39 175.54 2dao h LEU 11 N 4.28 -0.80 -0.65 2.23 5.85 -1.91 0.22 115.31 124.52 2dao h LEU 11 Ca -0.48 0.11 0.25 0.00 0.84 0.00 0.00 57.88 58.60 2dao h LEU 11 Cb 1.38 0.34 -0.12 0.00 0.37 0.00 0.00 40.66 42.63 2dao h LEU 11 CO 0.77 -0.13 0.27 -2.67 -0.34 0.00 0.00 178.44 176.34 2dao n TRP 12 N -3.83 0.68 -0.03 1.25 4.27 -1.26 0.22 117.44 118.73 2dao n TRP 12 Ca -0.00 0.77 -0.15 0.00 -3.89 0.00 0.00 57.50 54.23 2dao n TRP 12 Cb 0.12 -1.15 -0.10 0.00 -1.36 0.00 0.00 31.31 28.82 2dao n TRP 12 CO 0.00 0.00 0.00 0.22 -2.29 0.00 0.00 177.69 175.62 2dao h ASP 13 N 0.00 0.29 -1.51 -0.67 3.58 -0.97 -3.20 116.42 113.94 2dao h ASP 13 Ca 0.51 -0.68 0.44 0.00 0.42 0.00 0.00 57.03 57.72 2dao h ASP 13 Cb 1.30 -0.09 -0.06 0.00 1.72 0.00 0.00 39.33 42.21 2dao h ASP 13 CO -0.53 0.92 1.19 0.00 -2.88 0.00 0.00 179.24 177.94 2dao n TYR 14 N -4.51 0.00 0.10 0.28 9.36 0.59 -0.61 117.16 122.38 2dao n TYR 14 Ca -0.09 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 61.07 2dao n TYR 14 Cb 0.47 -0.38 -0.03 0.00 -0.63 0.00 0.00 39.34 38.77 2dao n TYR 14 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2dao h VAL 15 N 0.00 0.00 -0.61 2.97 2.07 -1.52 -3.09 116.25 116.07 2dao h VAL 15 Ca 0.72 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.29 2dao h VAL 15 Cb 3.08 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 32.78 2dao h VAL 15 CO -0.01 0.00 -0.36 0.00 0.02 0.00 0.00 177.57 177.22 2dao n TYR 16 N -3.38 -0.27 -0.26 1.57 9.36 0.22 0.13 117.16 124.54 2dao n TYR 16 Ca -0.04 0.76 0.17 0.00 3.32 0.00 0.00 57.90 62.11 2dao n TYR 16 Cb 0.16 -0.53 0.32 0.00 -0.63 0.00 0.00 39.34 38.66 2dao n TYR 16 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 2dao n GLN 17 N -4.55 -0.06 0.10 2.98 1.13 -1.17 0.77 117.38 116.58 2dao n GLN 17 Ca 0.01 1.13 -0.13 0.00 -1.94 0.00 0.00 57.00 56.08 2dao n GLN 17 Cb 0.16 -1.89 -0.08 0.00 0.11 0.00 0.00 30.24 28.53 2dao n GLN 17 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 2dao h LEU 18 N 0.00 -0.22 -0.51 1.08 3.38 0.11 -3.25 115.31 115.90 2dao h LEU 18 Ca 0.55 -0.26 0.10 0.00 0.09 0.00 0.00 57.88 58.36 2dao h LEU 18 Cb 1.29 0.06 -0.10 0.00 0.09 0.00 0.00 40.66 41.99 2dao h LEU 18 CO -0.68 0.17 -0.20 -0.07 0.09 0.00 0.00 178.44 177.75 2dao h LEU 19 N -0.66 -0.70 -0.28 1.67 -0.00 0.84 -2.63 115.31 113.56 2dao h LEU 19 Ca -0.03 0.18 0.03 0.00 -0.00 0.00 0.00 57.88 58.05 2dao h LEU 19 Cb 0.47 0.40 -0.03 0.00 -0.00 0.00 0.00 40.66 41.49 2dao h LEU 19 CO 0.04 -0.23 -0.17 -1.20 -0.00 0.00 0.00 178.44 176.89 2dao n SER 20 N -5.40 -0.30 -4.74 -0.43 7.64 -0.21 -4.24 113.62 105.93 2dao n SER 20 Ca 0.04 1.04 -0.40 0.00 1.01 0.00 0.00 58.87 60.56 2dao n SER 20 Cb 0.31 -0.34 -0.05 0.00 -1.01 0.00 0.00 64.21 63.12 2dao n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2dao s ASP 21 N -3.82 7.58 -0.14 6.43 1.11 -0.99 -4.93 116.67 121.90 2dao s ASP 21 Ca -0.03 1.87 0.01 0.00 0.18 0.00 0.00 52.55 54.58 2dao s ASP 21 Cb 0.03 -2.60 0.18 0.00 1.07 0.00 0.00 42.92 41.60 2dao s ASP 21 CO 0.17 0.06 1.39 -0.24 1.18 0.00 0.00 175.17 177.73 2dao n SER 22 N 2.08 3.70 -0.07 0.27 2.88 -1.26 -3.85 113.62 117.37 2dao n SER 22 Ca -0.00 -2.52 -0.16 0.00 -1.33 0.00 0.00 58.87 54.87 2dao n SER 22 Cb 0.48 -0.68 -0.14 0.00 -0.75 0.00 0.00 64.21 63.12 2dao n SER 22 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2dao n ARG 23 N 0.17 0.69 -0.95 -1.46 1.74 -1.26 -4.24 116.66 111.34 2dao n ARG 23 Ca 0.17 0.17 -0.06 0.00 -0.77 0.00 0.00 57.85 57.36 2dao n ARG 23 Cb 0.79 -1.62 0.28 0.00 -1.02 0.00 0.00 32.46 30.88 2dao n ARG 23 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2dao n TYR 24 N -3.18 2.29 0.12 -1.55 4.02 -1.25 -4.51 117.16 113.10 2dao n TYR 24 Ca -0.34 -1.13 -0.14 0.00 -0.01 0.00 0.00 57.90 56.28 2dao n TYR 24 Cb 1.05 -0.66 -0.08 0.00 -0.02 0.00 0.00 39.34 39.63 2dao n TYR 24 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 2dao h GLU 25 N 2.39 -0.25 -0.49 -0.72 3.07 -1.74 0.36 114.58 117.21 2dao h GLU 25 Ca 0.26 0.02 0.14 0.00 -0.50 0.00 0.00 59.36 59.28 2dao h GLU 25 Cb 2.23 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 30.18 2dao h GLU 25 CO 0.70 -0.05 0.71 -0.91 -1.40 0.00 0.00 179.01 178.06 2dao h ASN 26 N -0.42 0.00 0.02 1.42 2.35 -1.90 0.85 115.58 117.91 2dao h ASN 26 Ca -0.03 0.00 -0.39 0.00 -0.55 0.00 0.00 56.30 55.34 2dao h ASN 26 Cb 0.32 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.63 2dao h ASN 26 CO 0.04 0.00 -2.40 0.49 -1.65 0.00 0.00 177.43 173.91 2dao n PHE 27 N -3.32 0.21 -3.65 1.19 3.72 -0.90 -4.40 117.46 110.31 2dao n PHE 27 Ca 0.10 0.04 -0.05 0.00 -0.05 0.00 0.00 57.45 57.49 2dao n PHE 27 Cb 0.89 -1.03 -0.07 0.00 -0.94 0.00 0.00 39.48 38.33 2dao n PHE 27 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 2dao s ILE 28 N -2.53 -0.80 0.18 4.37 2.07 0.12 0.17 121.20 124.79 2dao s ILE 28 Ca -0.33 0.10 0.07 0.00 -1.41 0.00 0.00 60.65 59.08 2dao s ILE 28 Cb 0.09 -0.81 -0.04 0.00 0.13 0.00 0.00 42.46 41.83 2dao s ILE 28 CO 0.63 0.04 -0.14 0.00 -1.91 0.00 0.00 174.94 173.56 2dao s ARG 29 N 2.73 1.24 0.15 3.50 1.70 -1.21 -3.76 118.95 123.30 2dao s ARG 29 Ca -0.03 -1.51 -0.31 0.00 -0.47 0.00 0.00 55.73 53.41 2dao s ARG 29 Cb -0.12 -1.03 -0.10 0.00 -0.57 0.00 0.00 34.95 33.13 2dao s ARG 29 CO -0.15 0.17 1.64 -1.58 -1.08 0.00 0.00 175.30 174.30 2dao s TRP 30 N -2.84 2.79 -0.15 5.89 0.52 -1.26 -3.44 118.94 120.44 2dao s TRP 30 Ca 0.19 0.44 -0.12 0.00 0.02 0.00 0.00 56.10 56.63 2dao s TRP 30 Cb -0.01 -4.00 -0.08 0.00 -1.15 0.00 0.00 33.47 28.23 2dao s TRP 30 CO 0.05 -3.83 -0.03 1.49 0.02 0.00 0.00 176.95 174.65 2dao h GLU 31 N 7.35 0.00 -2.54 4.98 4.22 0.64 -3.45 114.58 125.78 2dao h GLU 31 Ca -0.43 0.00 -0.60 0.00 0.08 0.00 0.00 59.36 58.41 2dao h GLU 31 Cb 1.20 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 30.06 2dao h GLU 31 CO 0.93 0.30 -0.88 0.34 -2.18 0.00 0.00 179.01 177.52 2dao s ASP 32 N -6.03 2.26 0.46 1.04 -1.08 0.10 -4.94 116.67 108.48 2dao s ASP 32 Ca -0.17 -3.27 0.29 0.00 -0.52 0.00 0.00 52.55 48.88 2dao s ASP 32 Cb 0.03 -0.73 1.37 0.00 -1.46 0.00 0.00 42.92 42.12 2dao s ASP 32 CO 0.31 -0.15 1.71 0.11 0.52 0.00 0.00 175.17 177.67 2dao h LYS 33 N 5.57 0.16 -0.79 4.34 1.79 -1.87 0.91 116.57 126.68 2dao h LYS 33 Ca 0.24 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.72 2dao h LYS 33 Cb 0.87 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.44 2dao h LYS 33 CO 0.46 0.11 0.52 0.93 -1.08 0.00 0.00 179.45 180.38 2dao h GLU 34 N 0.16 1.00 -0.16 3.15 5.08 -1.94 -2.47 114.58 119.40 2dao h GLU 34 Ca 0.70 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 59.00 2dao h GLU 34 Cb 2.25 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 31.27 2dao h GLU 34 CO -0.25 0.66 0.00 0.43 -1.00 0.00 0.00 179.01 178.85 2dao n SER 35 N -4.43 3.30 -4.12 1.42 7.64 0.27 -4.96 113.62 112.74 2dao n SER 35 Ca 0.09 -3.02 -0.34 0.00 1.01 0.00 0.00 58.87 56.61 2dao n SER 35 Cb 0.06 -0.49 -0.01 0.00 -1.01 0.00 0.00 64.21 62.75 2dao n SER 35 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2dao n LYS 36 N -0.84 -3.95 -3.61 1.43 5.02 0.14 -4.32 118.16 112.02 2dao n LYS 36 Ca 0.19 0.45 -0.37 0.00 -2.02 0.00 0.00 58.31 56.55 2dao n LYS 36 Cb 0.79 -5.22 -0.06 0.00 -0.02 0.00 0.00 35.03 30.52 2dao n LYS 36 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2dao s ILE 37 N -3.30 5.23 0.24 -0.18 1.01 -0.55 -2.39 121.20 121.25 2dao s ILE 37 Ca 0.70 0.60 0.01 0.00 0.00 0.00 0.00 60.65 61.97 2dao s ILE 37 Cb -0.37 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 2dao s ILE 37 CO 0.90 0.55 0.15 0.72 0.00 0.00 0.00 174.94 177.25 2dao s PHE 38 N -0.73 1.34 -0.09 3.97 -0.71 -0.35 0.12 117.98 121.54 2dao s PHE 38 Ca 0.20 -1.39 -0.16 0.00 -1.04 0.00 0.00 56.93 54.54 2dao s PHE 38 Cb -0.15 -0.66 0.04 0.00 -1.21 0.00 0.00 43.02 41.04 2dao s PHE 38 CO 0.09 -0.62 0.40 0.50 -1.34 0.00 0.00 175.22 174.25 2dao s ARG 39 N -4.01 0.61 -0.79 1.99 3.00 -1.22 -1.65 118.95 116.88 2dao s ARG 39 Ca 0.39 0.25 -0.24 0.00 -1.00 0.00 0.00 55.73 55.13 2dao s ARG 39 Cb 0.06 0.28 0.06 0.00 0.00 0.00 0.00 34.95 35.36 2dao s ARG 39 CO 0.15 -0.13 1.19 0.42 0.00 0.00 0.00 175.30 176.93 2dao s ILE 40 N -0.51 4.10 0.29 4.11 1.01 -1.18 -3.54 121.20 125.47 2dao s ILE 40 Ca -0.06 -0.34 0.04 0.00 0.00 0.00 0.00 60.65 60.28 2dao s ILE 40 Cb -0.04 -4.85 0.28 0.00 0.01 0.00 0.00 42.46 37.87 2dao s ILE 40 CO 0.03 -1.69 1.72 0.58 0.00 0.00 0.00 174.94 175.57 2dao h VAL 41 N 6.13 0.54 -2.30 2.92 2.07 0.14 -3.37 116.25 122.38 2dao h VAL 41 Ca -0.13 -0.17 -0.32 0.00 0.82 0.00 0.00 66.70 66.91 2dao h VAL 41 Cb 1.05 0.01 -0.34 0.00 -1.52 0.00 0.00 31.29 30.49 2dao h VAL 41 CO 1.25 0.09 -0.62 -0.62 0.02 0.00 0.00 177.57 177.69 2dao s ASP 42 N -5.24 1.51 0.21 0.57 2.15 -0.75 -4.99 116.67 110.13 2dao s ASP 42 Ca -0.12 -0.47 -0.02 0.00 0.43 0.00 0.00 52.55 52.37 2dao s ASP 42 Cb 0.25 0.47 0.18 0.00 -0.30 0.00 0.00 42.92 43.53 2dao s ASP 42 CO 0.78 -0.36 1.57 1.55 -0.17 0.00 0.00 175.17 178.55 2dao h PRO 43 N 8.28 0.58 -0.09 4.34 0.13 -1.87 0.11 132.00 143.49 2dao h PRO 43 Ca -0.16 -0.31 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 2dao h PRO 43 Cb 1.11 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 2dao h PRO 43 CO 0.31 0.90 -0.48 -0.97 -0.23 0.00 0.00 178.00 177.54 2dao h ASN 44 N 0.48 0.24 0.90 1.44 -1.24 -1.96 0.29 115.58 115.73 2dao h ASN 44 Ca 0.04 -0.11 -0.01 0.00 0.71 0.00 0.00 56.30 56.92 2dao h ASN 44 Cb 0.94 -0.07 -0.00 0.00 0.73 0.00 0.00 38.32 39.92 2dao h ASN 44 CO 0.08 0.68 -1.11 0.61 -1.29 0.00 0.00 177.43 176.41 2dao n GLY 45 N -0.04 -1.42 0.11 1.57 0.00 -1.16 -4.18 105.19 100.08 2dao n GLY 45 Ca -0.02 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.60 2dao n GLY 45 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dao n LEU 46 N -2.66 1.85 -0.27 0.99 7.94 0.36 -4.24 117.00 120.98 2dao n LEU 46 Ca -0.01 0.23 0.06 0.00 -1.11 0.00 0.00 56.01 55.18 2dao n LEU 46 Cb 0.57 -0.52 0.20 0.00 0.53 0.00 0.00 43.42 44.19 2dao n LEU 46 CO 0.41 0.67 1.04 0.00 -1.11 0.00 0.00 177.39 178.40 2dao h ALA 47 N 0.46 1.14 -0.38 1.96 0.00 -0.59 -1.49 119.26 120.36 2dao h ALA 47 Ca -0.40 0.11 0.08 0.00 0.00 0.00 0.00 54.91 54.69 2dao h ALA 47 Cb 2.03 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 19.80 2dao h ALA 47 CO 0.06 -0.18 -0.12 0.07 0.00 0.00 0.00 179.25 179.08 2dao h ARG 48 N 0.50 -0.04 -0.88 0.00 0.11 -1.74 0.11 114.38 112.44 2dao h ARG 48 Ca 0.43 0.00 0.14 0.00 0.10 0.00 0.00 59.98 60.66 2dao h ARG 48 Cb 0.65 0.01 -0.09 0.00 1.11 0.00 0.00 29.97 31.65 2dao h ARG 48 CO -0.39 -0.03 0.48 -0.07 0.10 0.00 0.00 179.97 180.06 2dao h LEU 49 N -0.04 0.62 -0.24 0.08 3.38 -1.47 1.04 115.31 118.67 2dao h LEU 49 Ca 0.19 0.08 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 2dao h LEU 49 Cb 0.32 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2dao h LEU 49 CO -0.41 0.28 -0.15 -0.25 0.09 0.00 0.00 178.44 178.00 2dao h TRP 50 N 0.70 0.60 0.00 1.13 2.91 -0.96 -3.03 115.95 117.31 2dao h TRP 50 Ca 0.47 -0.16 0.00 0.00 1.13 0.00 0.00 58.89 60.33 2dao h TRP 50 Cb 0.62 -0.14 0.00 0.00 -0.51 0.00 0.00 29.16 29.13 2dao h TRP 50 CO -0.07 0.81 0.00 0.78 -1.03 0.00 0.00 178.44 178.93 2dao h GLY 51 N 0.23 0.00 0.27 2.65 0.00 0.19 -2.92 103.07 103.50 2dao h GLY 51 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2dao h GLY 51 CO 0.04 0.00 -0.13 -0.57 0.00 0.00 0.00 176.54 175.88 2dao h ASN 52 N 0.00 -0.31 -0.30 0.19 -0.73 0.12 -0.72 115.58 113.83 2dao h ASN 52 Ca 0.00 0.01 -0.02 0.00 1.87 0.00 0.00 56.30 58.16 2dao h ASN 52 Cb 0.71 0.08 -0.02 0.00 0.27 0.00 0.00 38.32 39.37 2dao h ASN 52 CO 0.00 -0.21 0.12 1.12 -0.37 0.00 0.00 177.43 178.09 2dao h HIS 53 N -0.39 0.51 0.00 0.67 2.07 -1.67 -0.91 115.15 115.43 2dao h HIS 53 Ca -0.04 -0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.46 2dao h HIS 53 Cb 0.28 -0.16 0.00 0.00 2.57 0.00 0.00 27.41 30.10 2dao h HIS 53 CO 0.15 0.43 0.00 1.17 -3.07 0.00 0.00 177.93 176.61 2dao n LYS 54 N -4.37 0.09 -3.47 5.12 3.00 -1.10 -4.83 118.16 112.59 2dao n LYS 54 Ca 0.02 0.23 -0.18 0.00 -0.00 0.00 0.00 58.31 58.38 2dao n LYS 54 Cb 0.16 -1.50 0.08 0.00 0.00 0.00 0.00 35.03 33.77 2dao n LYS 54 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2dao n ASN 55 N -1.29 -2.48 -4.80 3.14 5.03 -0.35 -5.02 115.26 109.50 2dao n ASN 55 Ca 0.03 -0.63 -0.27 0.00 0.87 0.00 0.00 54.58 54.58 2dao n ASN 55 Cb 0.05 -5.03 -0.05 0.00 -1.02 0.00 0.00 39.78 33.73 2dao n ASN 55 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2dao s ARG 56 N -5.52 2.23 -0.13 3.52 3.00 -0.30 -5.06 118.95 116.67 2dao s ARG 56 Ca 0.07 -2.03 -0.00 0.00 0.00 0.00 0.00 55.73 53.77 2dao s ARG 56 Cb -0.03 -1.92 0.03 0.00 0.00 0.00 0.00 34.95 33.03 2dao s ARG 56 CO 0.74 -0.33 -0.09 0.99 0.00 0.00 0.00 175.30 176.60 2dao s THR 57 N -2.72 1.22 -0.73 0.02 2.01 -1.26 -4.77 115.64 109.40 2dao s THR 57 Ca 0.31 -0.45 -0.03 0.00 0.31 0.00 0.00 61.69 61.83 2dao s THR 57 Cb 0.01 -1.22 0.00 0.00 0.01 0.00 0.00 72.50 71.30 2dao s THR 57 CO 0.18 0.36 0.63 -3.20 -0.69 0.00 0.00 174.62 171.89 2dao n ASN 58 N 4.88 -3.30 -4.61 3.53 2.85 -1.26 -4.92 115.26 112.42 2dao n ASN 58 Ca -0.14 -0.33 -0.43 0.00 -0.11 0.00 0.00 54.58 53.57 2dao n ASN 58 Cb 0.50 -3.12 -0.03 0.00 1.24 0.00 0.00 39.78 38.37 2dao n ASN 58 CO 0.00 0.00 0.00 -0.32 -2.11 0.00 0.00 177.26 174.83 2dao s MET 59 N -5.28 3.47 0.62 1.20 -2.45 -1.26 -4.98 119.30 110.62 2dao s MET 59 Ca 0.17 1.82 0.05 0.00 -1.25 0.00 0.00 55.69 56.49 2dao s MET 59 Cb -0.08 -4.21 0.11 0.00 1.25 0.00 0.00 34.83 31.90 2dao s MET 59 CO 0.42 -1.70 0.85 0.25 1.05 0.00 0.00 175.02 175.89 2dao n THR 60 N 7.07 0.00 0.04 10.11 -2.24 -1.26 -4.25 114.28 123.75 2dao n THR 60 Ca 0.24 -1.68 -0.22 0.00 -2.27 0.00 0.00 64.05 60.12 2dao n THR 60 Cb 0.45 -0.71 -0.14 0.00 -2.10 0.00 0.00 70.33 67.82 2dao n THR 60 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2dao h TYR 61 N -0.23 0.57 -0.98 4.78 3.20 -1.94 -3.18 116.97 119.20 2dao h TYR 61 Ca -0.28 -0.42 0.21 0.00 3.14 0.00 0.00 58.73 61.38 2dao h TYR 61 Cb 1.17 -0.02 -0.09 0.00 1.54 0.00 0.00 36.73 39.33 2dao h TYR 61 CO 0.00 1.54 0.62 1.05 -1.64 0.00 0.00 178.16 179.73 2dao h GLU 62 N -0.18 0.53 0.00 1.82 4.11 -1.98 0.85 114.58 119.73 2dao h GLU 62 Ca -0.28 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.12 2dao h GLU 62 Cb 1.85 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.98 2dao h GLU 62 CO 0.12 0.35 -0.26 0.36 0.07 0.00 0.00 179.01 179.65 2dao n LYS 63 N -4.63 0.05 -0.02 1.06 2.85 -1.25 -3.82 118.16 112.40 2dao n LYS 63 Ca 0.22 0.03 -0.01 0.00 -1.05 0.00 0.00 58.31 57.50 2dao n LYS 63 Cb 0.69 -1.54 -0.00 0.00 -0.65 0.00 0.00 35.03 33.52 2dao n LYS 63 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 177.40 177.23 2dao n MET 64 N -1.63 0.12 0.02 -1.58 1.56 0.27 -4.22 117.12 111.67 2dao n MET 64 Ca 0.06 0.30 0.18 0.00 -0.27 0.00 0.00 57.70 57.97 2dao n MET 64 Cb 0.36 -0.98 0.38 0.00 2.15 0.00 0.00 33.22 35.12 2dao n MET 64 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 2dao h SER 65 N -0.27 0.00 -0.93 6.12 0.87 -0.97 -1.01 113.55 117.35 2dao h SER 65 Ca 0.00 0.00 0.18 0.00 -1.23 0.00 0.00 61.79 60.74 2dao h SER 65 Cb 0.15 0.00 -0.17 0.00 -0.44 0.00 0.00 62.40 61.93 2dao h SER 65 CO 0.00 0.00 -0.27 0.03 -0.53 0.00 0.00 176.83 176.06 2dao h ARG 66 N 0.00 -0.01 0.41 2.24 2.47 -1.73 -1.52 114.38 116.24 2dao h ARG 66 Ca 0.28 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.98 2dao h ARG 66 Cb 2.27 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 30.59 2dao h ARG 66 CO -0.00 -0.01 -0.25 0.00 0.56 0.00 0.00 179.97 180.27 2dao h ALA 67 N 1.79 -1.09 -0.70 0.04 0.00 -1.45 -2.78 119.26 115.07 2dao h ALA 67 Ca 0.42 -0.13 0.20 0.00 0.00 0.00 0.00 54.91 55.40 2dao h ALA 67 Cb 0.66 0.37 -0.13 0.00 0.00 0.00 0.00 17.79 18.69 2dao h ALA 67 CO -0.96 -1.07 0.04 1.28 0.00 0.00 0.00 179.25 178.54 2dao n LEU 68 N -3.89 -0.06 0.10 0.00 7.99 -0.63 -0.52 117.00 119.98 2dao n LEU 68 Ca -0.08 1.19 -0.04 0.00 -0.01 0.00 0.00 56.01 57.07 2dao n LEU 68 Cb 0.26 -0.44 -0.02 0.00 -0.11 0.00 0.00 43.42 43.11 2dao n LEU 68 CO 0.18 -1.21 0.51 -0.09 -1.51 0.00 0.00 177.39 175.26 2dao h ARG 69 N 0.00 -0.26 -1.34 3.23 2.43 -1.15 -0.58 114.38 116.72 2dao h ARG 69 Ca 0.44 0.02 0.43 0.00 -0.81 0.00 0.00 59.98 60.06 2dao h ARG 69 Cb 0.92 0.06 -0.12 0.00 -0.42 0.00 0.00 29.97 30.40 2dao h ARG 69 CO -0.65 -0.17 0.87 0.45 -1.51 0.00 0.00 179.97 178.96 2dao h HIS 70 N -0.27 0.49 -0.26 2.20 3.86 -0.54 1.30 115.15 121.93 2dao h HIS 70 Ca -0.02 0.02 -0.17 0.00 -1.16 0.00 0.00 60.37 59.04 2dao h HIS 70 Cb 0.21 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 2dao h HIS 70 CO 0.06 -0.18 -0.50 1.88 0.86 0.00 0.00 177.93 180.05 2dao h TYR 71 N 0.09 0.91 -0.91 2.45 0.05 -0.83 -3.18 116.97 115.55 2dao h TYR 71 Ca 0.81 -0.31 0.25 0.00 0.05 0.00 0.00 58.73 59.54 2dao h TYR 71 Cb 2.58 -0.18 -0.15 0.00 1.01 0.00 0.00 36.73 39.99 2dao h TYR 71 CO -0.00 1.09 0.20 1.88 -1.05 0.00 0.00 178.16 180.27 2dao h TYR 72 N 0.58 0.28 -0.05 4.88 0.05 0.33 1.25 116.97 124.29 2dao h TYR 72 Ca 0.02 0.05 -0.05 0.00 0.05 0.00 0.00 58.73 58.81 2dao h TYR 72 Cb 1.07 0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.83 2dao h TYR 72 CO 0.06 -0.28 -0.20 0.87 -1.05 0.00 0.00 178.16 177.56 2dao h LYS 73 N 0.14 0.08 0.00 4.88 1.57 -1.55 -1.13 116.57 120.56 2dao h LYS 73 Ca 0.58 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.34 2dao h LYS 73 Cb 1.21 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2dao h LYS 73 CO -0.72 0.28 0.00 1.28 -0.57 0.00 0.00 179.45 179.71 2dao n LEU 74 N -4.27 0.00 -2.63 2.94 4.77 0.43 -4.86 117.00 113.38 2dao n LEU 74 Ca -0.02 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.79 2dao n LEU 74 Cb 0.28 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2dao n LEU 74 CO 0.37 0.00 0.15 -3.20 -1.33 0.00 0.00 177.39 173.38 2dao n ASN 75 N -0.94 -5.09 -0.13 -1.43 2.85 -0.43 -4.94 115.26 105.16 2dao n ASN 75 Ca 0.17 -0.35 -0.24 0.00 -0.11 0.00 0.00 54.58 54.05 2dao n ASN 75 Cb 0.08 -3.73 -0.11 0.00 1.24 0.00 0.00 39.78 37.26 2dao n ASN 75 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 2dao n ILE 76 N -4.27 1.46 -4.18 -1.44 5.41 -1.19 -3.97 119.36 111.18 2dao n ILE 76 Ca -0.01 -0.45 -0.16 0.00 1.00 0.00 0.00 62.75 63.13 2dao n ILE 76 Cb 0.55 -1.65 -0.11 0.00 -0.71 0.00 0.00 39.64 37.72 2dao n ILE 76 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2dao s ILE 77 N -2.50 1.02 -0.09 1.39 1.01 -1.26 -2.47 121.20 118.30 2dao s ILE 77 Ca -0.36 -1.52 0.01 0.00 0.00 0.00 0.00 60.65 58.78 2dao s ILE 77 Cb 0.12 -1.25 0.02 0.00 0.01 0.00 0.00 42.46 41.36 2dao s ILE 77 CO 0.52 -0.43 -0.11 -0.60 0.00 0.00 0.00 174.94 174.32 2dao s ARG 78 N -2.40 1.76 -0.53 2.79 3.52 -0.63 -4.30 118.95 119.16 2dao s ARG 78 Ca 0.03 -0.39 -0.24 0.00 -0.13 0.00 0.00 55.73 55.00 2dao s ARG 78 Cb -0.06 -1.59 0.04 0.00 -1.56 0.00 0.00 34.95 31.78 2dao s ARG 78 CO 0.01 -0.11 0.93 0.21 -0.81 0.00 0.00 175.30 175.54 2dao s LYS 79 N 1.14 3.37 0.28 5.12 2.20 -1.26 -1.57 119.74 129.03 2dao s LYS 79 Ca -0.05 -0.17 -0.28 0.00 -0.36 0.00 0.00 55.97 55.11 2dao s LYS 79 Cb -0.14 -4.02 -0.14 0.00 -1.51 0.00 0.00 37.83 32.01 2dao s LYS 79 CO -0.02 -1.42 0.96 0.39 -0.36 0.00 0.00 175.35 174.90 2dao n GLU 80 N 7.38 1.22 -0.12 4.03 -0.58 -1.21 -4.90 120.64 126.46 2dao n GLU 80 Ca 0.03 0.43 -0.13 0.00 -0.42 0.00 0.00 57.16 57.06 2dao n GLU 80 Cb 0.48 -1.76 -0.02 0.00 -0.57 0.00 0.00 31.44 29.56 2dao n GLU 80 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2dao h PRO 81 N 1.88 0.91 0.00 3.49 0.13 -1.95 -3.39 132.00 133.07 2dao h PRO 81 Ca -0.38 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 2dao h PRO 81 Cb 1.35 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2dao h PRO 81 CO 0.60 1.13 0.00 0.41 -0.23 0.00 0.00 178.00 179.91 2dao n GLY 82 N 0.14 -1.78 3.20 1.56 0.00 -1.26 -4.85 105.19 102.20 2dao n GLY 82 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 2dao n GLY 82 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dao n GLN 83 N -0.23 -2.25 0.00 1.61 1.13 -1.26 -5.02 117.38 111.36 2dao n GLN 83 Ca 0.00 -0.65 0.00 0.00 -1.94 0.00 0.00 57.00 54.41 2dao n GLN 83 Cb 0.00 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 28.67 2dao n GLN 83 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 2dao n ARG 84 N -2.55 0.00 -1.29 -1.09 0.63 -1.26 -4.67 116.66 106.42 2dao n ARG 84 Ca 0.04 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.69 2dao n ARG 84 Cb 0.53 -0.26 -0.08 0.00 0.45 0.00 0.00 32.46 33.10 2dao n ARG 84 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2dao n LEU 85 N -2.03 7.05 -4.46 6.15 4.32 -1.26 -4.86 117.00 121.91 2dao n LEU 85 Ca 0.00 -3.93 -0.33 0.00 -0.02 0.00 0.00 56.01 51.72 2dao n LEU 85 Cb 0.00 -1.44 -0.13 0.00 -1.62 0.00 0.00 43.42 40.23 2dao n LEU 85 CO 0.00 1.89 -0.41 -0.22 -1.22 0.00 0.00 177.39 177.43 2dao s LEU 86 N -0.45 2.93 -0.02 2.23 1.98 -1.26 -3.13 118.68 120.96 2dao s LEU 86 Ca 0.66 -0.20 0.03 0.00 -2.89 0.00 0.00 54.13 51.73 2dao s LEU 86 Cb 0.26 -1.66 -0.00 0.00 0.66 0.00 0.00 46.19 45.45 2dao s LEU 86 CO -0.06 0.23 -0.11 -0.36 -1.89 0.00 0.00 176.35 174.16 2dao s PHE 87 N -0.03 1.07 -0.16 5.38 0.08 -0.66 -3.35 117.98 120.30 2dao s PHE 87 Ca -0.02 -0.23 0.01 0.00 0.12 0.00 0.00 56.93 56.81 2dao s PHE 87 Cb -0.14 -0.72 0.03 0.00 -0.57 0.00 0.00 43.02 41.62 2dao s PHE 87 CO 0.03 -0.06 -0.15 0.50 -0.10 0.00 0.00 175.22 175.45 2dao s ARG 88 N -0.10 2.40 -1.04 0.44 3.00 -0.61 -1.21 118.95 121.84 2dao s ARG 88 Ca 0.01 -0.67 -0.23 0.00 -1.00 0.00 0.00 55.73 53.84 2dao s ARG 88 Cb -0.06 -2.26 -0.03 0.00 0.00 0.00 0.00 34.95 32.59 2dao s ARG 88 CO 0.00 -0.27 1.84 -0.06 0.00 0.00 0.00 175.30 176.81 2dao s PHE 89 N 1.43 2.07 0.01 5.12 0.08 -1.01 -1.60 117.98 124.08 2dao s PHE 89 Ca 0.04 0.11 -0.06 0.00 0.12 0.00 0.00 56.93 57.14 2dao s PHE 89 Cb -0.13 -4.22 -0.04 0.00 -0.57 0.00 0.00 43.02 38.06 2dao s PHE 89 CO -0.11 -1.64 1.01 0.52 -0.10 0.00 0.00 175.22 174.90 2dao h MET 90 N 10.26 -0.22 -7.41 0.44 2.86 -1.80 -3.45 114.93 115.60 2dao h MET 90 Ca 0.18 0.02 -0.50 0.00 -2.06 0.00 0.00 59.70 57.34 2dao h MET 90 Cb 0.98 0.05 0.07 0.00 0.06 0.00 0.00 31.60 32.76 2dao h MET 90 CO 1.28 -0.15 0.39 0.21 1.06 0.00 0.00 176.91 179.70 2dao s LYS 91 N -3.34 3.07 0.21 1.72 2.20 -1.20 -5.03 119.74 117.37 2dao s LYS 91 Ca -0.03 0.50 -0.30 0.00 -0.36 0.00 0.00 55.97 55.78 2dao s LYS 91 Cb 0.00 -2.06 -0.08 0.00 -1.51 0.00 0.00 37.83 34.18 2dao s LYS 91 CO 0.10 -0.88 1.07 0.99 -0.36 0.00 0.00 175.35 176.27 2dao s THR 92 N -3.28 3.80 0.06 3.43 2.01 -1.26 -4.97 115.64 115.43 2dao s THR 92 Ca 0.57 1.66 -0.19 0.00 0.31 0.00 0.00 61.69 64.05 2dao s THR 92 Cb -0.11 -4.06 -0.13 0.00 0.01 0.00 0.00 72.50 68.21 2dao s THR 92 CO 0.52 0.34 1.37 1.55 -0.69 0.00 0.00 174.62 177.70 2dao h PRO 93 N 4.60 0.46 -0.86 4.92 0.13 -1.95 -3.09 132.00 136.20 2dao h PRO 93 Ca -0.45 -0.24 0.23 0.00 -0.87 0.00 0.00 66.00 64.67 2dao h PRO 93 Cb 1.21 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 2dao h PRO 93 CO 0.70 0.81 0.60 -0.44 -0.23 0.00 0.00 178.00 179.43 2dao h ASP 94 N 0.12 0.15 0.30 1.44 3.32 -2.00 -0.96 116.42 118.80 2dao h ASP 94 Ca 0.03 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 2dao h ASP 94 Cb 0.72 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.26 2dao h ASP 94 CO 0.05 0.06 -0.14 -0.33 -1.72 0.00 0.00 179.24 177.15 2dao h GLU 95 N 0.15 -0.39 -0.38 3.56 5.08 -1.89 -3.14 114.58 117.57 2dao h GLU 95 Ca 0.42 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.79 2dao h GLU 95 Cb 1.43 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.75 2dao h GLU 95 CO -0.07 -0.19 0.14 0.82 -1.00 0.00 0.00 179.01 178.71 2dao h ILE 96 N -0.50 1.20 -0.73 3.13 5.03 -1.31 -2.97 117.51 121.36 2dao h ILE 96 Ca -0.04 -0.61 0.26 0.00 -0.12 0.00 0.00 64.86 64.34 2dao h ILE 96 Cb 0.38 0.89 -0.13 0.00 -3.03 0.00 0.00 36.82 34.92 2dao h ILE 96 CO 0.07 0.22 0.22 0.23 -0.68 0.00 0.00 178.15 178.20 2dao n MET 97 N -4.66 -0.05 -3.93 2.37 2.81 -0.51 -2.76 117.12 110.39 2dao n MET 97 Ca -0.01 1.06 -0.32 0.00 -1.81 0.00 0.00 57.70 56.62 2dao n MET 97 Cb 0.15 -1.79 -0.14 0.00 -0.71 0.00 0.00 33.22 30.74 2dao n MET 97 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2dao s SER 98 N -4.82 4.77 -0.16 7.83 0.15 -1.12 -5.05 113.70 115.30 2dao s SER 98 Ca -0.08 -2.45 -0.21 0.00 0.70 0.00 0.00 55.95 53.91 2dao s SER 98 Cb 0.23 -1.69 -0.03 0.00 -1.71 0.00 0.00 66.02 62.82 2dao s SER 98 CO 0.57 -0.36 0.61 -0.83 1.20 0.00 0.00 173.24 174.43 2dao s GLY 99 N 0.70 2.23 -0.20 9.45 0.00 -1.11 -4.92 107.32 113.46 2dao s GLY 99 Ca 0.13 -0.18 -0.21 0.00 0.00 0.00 0.00 44.72 44.46 2dao s GLY 99 CO -0.05 1.18 0.22 3.21 0.00 0.00 0.00 173.10 177.66 2dao h ARG 100 N 7.19 0.00 0.00 2.90 3.08 -1.93 -3.44 114.38 122.19 2dao h ARG 100 Ca -0.35 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.60 2dao h ARG 100 Cb 1.16 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 2dao h ARG 100 CO 0.77 0.91 -1.03 2.41 -1.07 0.00 0.00 179.97 181.96 2dao n THR 101 N -4.46 0.90 -3.10 2.04 -1.04 -1.26 -4.86 114.28 102.50 2dao n THR 101 Ca -0.28 0.06 -0.45 0.00 -2.04 0.00 0.00 64.05 61.34 2dao n THR 101 Cb 0.63 -1.74 -0.01 0.00 -1.82 0.00 0.00 70.33 67.39 2dao n THR 101 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2dao s ASP 102 N -5.93 7.06 0.54 8.00 1.11 -1.26 -5.02 116.67 121.16 2dao s ASP 102 Ca -0.12 -3.02 -0.19 0.00 0.18 0.00 0.00 52.55 49.40 2dao s ASP 102 Cb 0.04 -2.33 -0.06 0.00 1.07 0.00 0.00 42.92 41.64 2dao s ASP 102 CO 0.17 -0.64 1.11 -0.13 1.18 0.00 0.00 175.17 176.86 2dao s ARG 103 N 0.76 3.38 -0.43 8.23 0.52 -1.26 -4.80 118.95 125.35 2dao s ARG 103 Ca 0.35 1.55 0.05 0.00 -0.52 0.00 0.00 55.73 57.17 2dao s ARG 103 Cb -0.06 -2.01 0.43 0.00 0.52 0.00 0.00 34.95 33.83 2dao s ARG 103 CO -0.05 -0.81 1.26 -0.11 0.02 0.00 0.00 175.30 175.61 2dao n LEU 104 N -1.34 5.16 -0.13 2.53 7.94 -1.26 -4.69 117.00 125.21 2dao n LEU 104 Ca 0.11 -4.97 -0.20 0.00 -1.11 0.00 0.00 56.01 49.84 2dao n LEU 104 Cb 0.51 -0.49 -0.12 0.00 0.53 0.00 0.00 43.42 43.86 2dao n LEU 104 CO 0.42 2.12 -1.35 -0.62 -1.11 0.00 0.00 177.39 176.85 2dao n GLU 105 N -0.59 0.64 -0.31 1.96 -0.58 -1.26 -4.41 120.64 116.09 2dao n GLU 105 Ca 0.43 0.17 0.15 0.00 -0.42 0.00 0.00 57.16 57.49 2dao n GLU 105 Cb 0.74 -1.52 0.39 0.00 -0.57 0.00 0.00 31.44 30.48 2dao n GLU 105 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2dao h HIS 106 N -0.13 0.86 -0.34 -0.32 2.76 -2.03 0.27 115.15 116.22 2dao h HIS 106 Ca -0.59 0.03 -0.18 0.00 -2.20 0.00 0.00 60.37 57.43 2dao h HIS 106 Cb 1.86 -0.26 -0.10 0.00 1.55 0.00 0.00 27.41 30.46 2dao h HIS 106 CO 0.02 0.22 0.23 1.28 -1.30 0.00 0.00 177.93 178.37 2dao n LEU 107 N -4.64 4.38 -0.11 0.26 4.77 -1.26 -3.38 117.00 117.01 2dao n LEU 107 Ca 0.21 -2.26 -0.19 0.00 -0.03 0.00 0.00 56.01 53.74 2dao n LEU 107 Cb 0.61 -0.64 -0.12 0.00 -2.33 0.00 0.00 43.42 40.93 2dao n LEU 107 CO 0.26 0.72 -1.27 1.21 -1.33 0.00 0.00 177.39 176.97 2dao n GLU 108 N -0.01 0.66 -0.02 3.23 2.13 0.94 -4.60 120.64 122.98 2dao n GLU 108 Ca 0.20 0.17 -0.04 0.00 0.66 0.00 0.00 57.16 58.15 2dao n GLU 108 Cb 0.87 -1.55 -0.02 0.00 0.27 0.00 0.00 31.44 31.02 2dao n GLU 108 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2dao n SER 109 N -3.32 1.29 -0.33 4.31 3.41 -1.25 -4.60 113.62 113.13 2dao n SER 109 Ca -0.44 0.03 0.26 0.00 -0.26 0.00 0.00 58.87 58.46 2dao n SER 109 Cb 1.00 -0.11 0.51 0.00 -0.26 0.00 0.00 64.21 65.34 2dao n SER 109 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2dao h GLN 110 N -0.11 0.20 -0.41 4.33 4.15 -1.87 0.59 115.11 121.99 2dao h GLN 110 Ca -0.11 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.28 2dao h GLN 110 Cb 1.11 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.74 2dao h GLN 110 CO -0.05 0.13 0.19 1.49 -1.93 0.00 0.00 178.83 178.66 2dao h GLU 111 N 0.21 0.60 -7.24 1.69 4.57 -1.81 -3.44 114.58 109.16 2dao h GLU 111 Ca 0.77 -0.10 -0.50 0.00 -1.18 0.00 0.00 59.36 58.36 2dao h GLU 111 Cb 1.86 -0.10 0.20 0.00 -0.16 0.00 0.00 28.75 30.54 2dao h GLU 111 CO -0.67 0.54 0.17 -0.51 -1.18 0.00 0.00 179.01 177.36 2dao s LEU 112 N -9.85 2.26 0.39 1.64 1.43 0.21 -4.96 118.68 109.79 2dao s LEU 112 Ca -0.13 1.97 0.08 0.00 -1.03 0.00 0.00 54.13 55.01 2dao s LEU 112 Cb 0.10 -4.22 -0.04 0.00 0.03 0.00 0.00 46.19 42.06 2dao s LEU 112 CO 0.75 -3.37 0.25 -0.44 0.23 0.00 0.00 176.35 173.77 2dao s SER 113 N -2.68 4.80 0.00 2.29 0.01 -1.26 -5.00 113.70 111.86 2dao s SER 113 Ca 0.67 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 57.10 2dao s SER 113 Cb -0.23 -0.62 0.00 0.00 0.21 0.00 0.00 66.02 65.38 2dao s SER 113 CO 0.60 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 174.35 2dao n GLY 114 N -1.34 0.98 0.05 3.44 0.00 -1.26 -5.01 105.19 102.04 2dao n GLY 114 Ca 0.00 0.43 0.09 0.00 0.00 0.00 0.00 46.02 46.54 2dao n GLY 114 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dao n PRO 115 N 0.00 0.07 -4.21 1.61 -0.04 -1.26 -4.68 135.00 126.48 2dao n PRO 115 Ca 0.00 0.32 -0.35 0.00 -0.04 0.00 0.00 63.50 63.42 2dao n PRO 115 Cb 0.00 -1.63 -0.09 0.00 -0.04 0.00 0.00 33.50 31.74 2dao n PRO 115 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2dao s SER 116 N -3.44 5.57 0.00 3.54 0.01 -1.26 -4.99 113.70 113.13 2dao s SER 116 Ca 0.06 0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.54 2dao s SER 116 Cb 0.09 -1.68 0.00 0.00 0.21 0.00 0.00 66.02 64.64 2dao s SER 116 CO 0.31 0.37 0.00 -0.24 0.41 0.00 0.00 173.24 174.08 2dao n SER 117 N 2.24 0.25 0.00 2.44 2.88 -1.26 -5.19 113.62 114.98 2dao n SER 117 Ca -0.19 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.40 2dao n SER 117 Cb 0.54 0.00 0.29 0.00 -0.75 0.00 0.00 64.21 64.28 2dao n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42