#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dao s SER 2 N 0.00 6.26 0.03 1.61 1.04 -1.26 -5.05 113.70 116.34 2dao s SER 2 Ca 0.00 -0.58 0.01 0.00 0.48 0.00 0.00 55.95 55.85 2dao s SER 2 Cb 0.00 -2.29 -0.04 0.00 0.10 0.00 0.00 66.02 63.79 2dao s SER 2 CO 0.00 -0.76 0.11 -0.94 0.98 0.00 0.00 173.24 172.63 2dao s SER 3 N 2.14 5.79 0.00 7.02 1.04 -1.26 -5.08 113.70 123.35 2dao s SER 3 Ca 0.18 0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.74 2dao s SER 3 Cb -0.16 -1.66 0.00 0.00 0.10 0.00 0.00 66.02 64.30 2dao s SER 3 CO 0.16 0.22 0.00 0.61 0.98 0.00 0.00 173.24 175.21 2dao n GLY 4 N 0.77 3.49 3.00 7.32 0.00 -1.26 -5.18 105.19 113.33 2dao n GLY 4 Ca -0.10 -0.11 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 2dao n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dao s SER 5 N 0.00 0.54 0.24 1.61 0.01 -1.26 -5.05 113.70 109.79 2dao s SER 5 Ca 0.00 -0.39 -0.15 0.00 1.31 0.00 0.00 55.95 56.72 2dao s SER 5 Cb 0.00 0.03 0.29 0.00 0.21 0.00 0.00 66.02 66.55 2dao s SER 5 CO 0.00 -0.16 1.52 -0.24 0.41 0.00 0.00 173.24 174.77 2dao n SER 6 N 1.96 -0.56 0.00 2.44 2.88 -1.26 -4.92 113.62 114.15 2dao n SER 6 Ca -0.20 1.70 0.00 0.00 -1.33 0.00 0.00 58.87 59.04 2dao n SER 6 Cb 0.56 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.60 2dao n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dao n GLY 7 N -1.50 0.17 3.41 0.46 0.00 -1.26 -5.03 105.19 101.44 2dao n GLY 7 Ca 0.11 -1.32 -0.31 0.00 0.00 0.00 0.00 46.02 44.51 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 1.66 2.10 -1.50 0.00 0.00 -1.26 -5.06 116.66 112.60 2dao n ARG 9 Ca -0.16 -3.52 -0.58 0.00 -0.00 0.00 0.00 57.85 53.58 2dao n ARG 9 Cb 0.52 -1.63 -0.08 0.00 -0.00 0.00 0.00 32.46 31.27 2dao n ARG 9 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2dao n LEU 10 N -0.54 0.85 -0.25 2.89 7.99 -1.26 -4.37 117.00 122.31 2dao n LEU 10 Ca 0.19 1.04 -0.06 0.00 -0.01 0.00 0.00 56.01 57.17 2dao n LEU 10 Cb 0.88 -0.78 -0.06 0.00 -0.11 0.00 0.00 43.42 43.35 2dao n LEU 10 CO 0.15 -0.93 0.47 -0.11 -1.51 0.00 0.00 177.39 175.47 2dao n LEU 11 N 3.09 -0.62 -0.31 2.23 7.94 -1.26 0.84 117.00 128.91 2dao n LEU 11 Ca 0.25 1.43 0.30 0.00 -1.11 0.00 0.00 56.01 56.88 2dao n LEU 11 Cb -0.03 -0.32 0.54 0.00 0.53 0.00 0.00 43.42 44.14 2dao n LEU 11 CO 0.74 -1.04 0.97 -2.67 -1.11 0.00 0.00 177.39 174.28 2dao n TRP 12 N -4.33 0.96 0.08 1.96 4.27 -1.26 0.14 117.44 119.25 2dao n TRP 12 Ca 0.01 0.96 -0.22 0.00 -3.89 0.00 0.00 57.50 54.37 2dao n TRP 12 Cb 0.15 -1.38 -0.15 0.00 -1.36 0.00 0.00 31.31 28.58 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 0.63 -0.90 -0.67 1.82 0.14 -3.27 116.42 114.17 2dao h ASP 13 Ca 0.76 -0.92 0.26 0.00 -0.39 0.00 0.00 57.03 56.74 2dao h ASP 13 Cb 2.10 -0.20 -0.04 0.00 0.68 0.00 0.00 39.33 41.87 2dao h ASP 13 CO -0.63 1.51 1.14 0.22 -1.61 0.00 0.00 179.24 179.87 2dao h TYR 14 N -0.14 0.00 0.66 0.28 3.20 0.44 0.38 116.97 121.79 2dao h TYR 14 Ca -0.18 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.66 2dao h TYR 14 Cb 1.82 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.10 2dao h TYR 14 CO 0.17 0.00 -0.34 0.28 -1.64 0.00 0.00 178.16 176.63 2dao h VAL 15 N 0.00 0.00 -0.74 1.81 2.07 -1.56 -3.19 116.25 114.64 2dao h VAL 15 Ca 0.43 0.00 0.09 0.00 0.82 0.00 0.00 66.70 68.04 2dao h VAL 15 Cb 2.70 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 32.35 2dao h VAL 15 CO -0.00 0.00 -0.49 0.22 0.02 0.00 0.00 177.57 177.32 2dao h TYR 16 N -0.91 -1.47 -1.28 1.57 5.03 -1.14 0.50 116.97 119.27 2dao h TYR 16 Ca -0.09 0.10 0.42 0.00 2.58 0.00 0.00 58.73 61.74 2dao h TYR 16 Cb 0.71 0.74 -0.10 0.00 1.55 0.00 0.00 36.73 39.63 2dao h TYR 16 CO 0.04 -0.42 0.86 1.04 -1.32 0.00 0.00 178.16 178.36 2dao n GLN 17 N -5.37 -0.02 -0.07 1.82 6.02 -1.21 0.55 117.38 119.10 2dao n GLN 17 Ca 0.03 0.99 -0.10 0.00 -0.01 0.00 0.00 57.00 57.91 2dao n GLN 17 Cb 0.33 -2.04 -0.08 0.00 1.02 0.00 0.00 30.24 29.47 2dao n GLN 17 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2dao h LEU 18 N 0.00 0.00 -0.94 1.08 3.38 -0.04 -3.35 115.31 115.43 2dao h LEU 18 Ca 0.74 -0.59 0.16 0.00 0.09 0.00 0.00 57.88 58.28 2dao h LEU 18 Cb 2.56 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 43.15 2dao h LEU 18 CO -0.28 0.88 -0.34 0.18 0.09 0.00 0.00 178.44 178.97 2dao n LEU 19 N -4.65 -0.55 -0.23 1.67 7.99 0.19 0.26 117.00 121.69 2dao n LEU 19 Ca -0.09 1.64 -0.02 0.00 -0.01 0.00 0.00 56.01 57.54 2dao n LEU 19 Cb 0.34 -0.40 0.05 0.00 -0.11 0.00 0.00 43.42 43.29 2dao n LEU 19 CO 0.21 -1.50 0.69 -1.28 -1.51 0.00 0.00 177.39 173.99 2dao h SER 20 N 0.00 -0.85 -1.83 -1.43 0.87 -1.55 -3.31 113.55 105.45 2dao h SER 20 Ca 0.36 0.22 -0.50 0.00 -1.23 0.00 0.00 61.79 60.63 2dao h SER 20 Cb 0.59 0.49 -0.06 0.00 -0.44 0.00 0.00 62.40 62.98 2dao h SER 20 CO -0.95 -0.26 1.18 -1.81 -0.53 0.00 0.00 176.83 174.47 2dao s ASP 21 N -5.21 5.75 0.58 6.23 1.01 0.14 -4.83 116.67 120.34 2dao s ASP 21 Ca -0.14 -0.33 0.30 0.00 0.71 0.00 0.00 52.55 53.08 2dao s ASP 21 Cb 0.19 -2.55 1.41 0.00 1.01 0.00 0.00 42.92 42.98 2dao s ASP 21 CO 0.72 -2.11 1.79 0.28 0.21 0.00 0.00 175.17 176.06 2dao h SER 22 N 11.95 0.00 -0.32 0.27 0.02 -1.77 0.20 113.55 123.90 2dao h SER 22 Ca -0.16 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 60.89 2dao h SER 22 Cb 1.08 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.61 2dao h SER 22 CO 1.27 0.00 0.48 0.03 -1.14 0.00 0.00 176.83 177.47 2dao h ARG 23 N 0.00 0.00 -0.97 3.45 3.08 -1.88 0.47 114.38 118.53 2dao h ARG 23 Ca 0.34 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.85 2dao h ARG 23 Cb 1.68 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 31.43 2dao h ARG 23 CO -0.00 0.00 0.66 0.66 -1.07 0.00 0.00 179.97 180.22 2dao n TYR 24 N -3.40 3.02 0.06 3.04 4.02 0.71 -4.48 117.16 120.14 2dao n TYR 24 Ca 0.05 -2.05 -0.07 0.00 -0.01 0.00 0.00 57.90 55.82 2dao n TYR 24 Cb 0.62 -1.02 0.08 0.00 -0.02 0.00 0.00 39.34 39.01 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 1.18 0.35 0.00 -0.72 4.39 -0.16 0.33 114.58 119.94 2dao h GLU 25 Ca 0.62 -0.25 -0.09 0.00 0.34 0.00 0.00 59.36 59.98 2dao h GLU 25 Cb 2.46 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 31.14 2dao h GLU 25 CO 1.16 0.86 -0.43 -0.91 -1.16 0.00 0.00 179.01 178.53 2dao h ASN 26 N 0.25 0.00 0.06 1.42 2.35 -1.81 -3.27 115.58 114.59 2dao h ASN 26 Ca -0.01 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.41 2dao h ASN 26 Cb 1.16 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.49 2dao h ASN 26 CO 0.10 0.43 -1.85 0.49 -1.65 0.00 0.00 177.43 174.96 2dao n PHE 27 N -3.80 0.97 -3.65 1.19 3.72 -1.14 -3.86 117.46 110.88 2dao n PHE 27 Ca -0.01 0.28 -0.03 0.00 -0.05 0.00 0.00 57.45 57.64 2dao n PHE 27 Cb 0.49 -1.12 -0.05 0.00 -0.94 0.00 0.00 39.48 37.87 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 -2.49 -0.72 0.23 4.37 2.07 0.11 0.18 121.20 124.96 2dao s ILE 28 Ca -0.27 0.00 0.04 0.00 -1.41 0.00 0.00 60.65 59.01 2dao s ILE 28 Cb 0.07 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.61 2dao s ILE 28 CO 0.67 0.00 -0.03 0.00 -1.91 0.00 0.00 174.94 173.67 2dao s ARG 29 N 2.54 1.35 -0.03 3.50 1.70 -1.22 -3.92 118.95 122.87 2dao s ARG 29 Ca -0.07 -1.67 -0.30 0.00 -0.47 0.00 0.00 55.73 53.22 2dao s ARG 29 Cb -0.10 -0.75 -0.05 0.00 -0.57 0.00 0.00 34.95 33.49 2dao s ARG 29 CO -0.19 -0.04 1.37 -1.58 -1.08 0.00 0.00 175.30 173.77 2dao s TRP 30 N -3.31 2.85 -0.18 5.89 0.52 -1.26 -3.09 118.94 120.36 2dao s TRP 30 Ca 0.27 0.87 -0.21 0.00 0.02 0.00 0.00 56.10 57.05 2dao s TRP 30 Cb 0.05 -3.62 -0.18 0.00 -1.15 0.00 0.00 33.47 28.56 2dao s TRP 30 CO 0.08 -2.25 0.30 0.93 0.02 0.00 0.00 176.95 176.03 2dao h GLU 31 N 7.94 0.00 -2.71 4.98 4.39 -0.35 -3.44 114.58 125.38 2dao h GLU 31 Ca -0.36 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 58.74 2dao h GLU 31 Cb 1.17 0.00 -0.39 0.00 -0.10 0.00 0.00 28.75 29.42 2dao h GLU 31 CO 0.91 0.87 -0.82 -0.51 -1.16 0.00 0.00 179.01 178.30 2dao s ASP 32 N -6.56 2.97 0.62 1.42 1.01 -0.37 -4.96 116.67 110.81 2dao s ASP 32 Ca -0.24 -2.73 0.30 0.00 0.71 0.00 0.00 52.55 50.59 2dao s ASP 32 Cb 0.03 -0.74 1.66 0.00 1.01 0.00 0.00 42.92 44.88 2dao s ASP 32 CO 0.56 -0.24 2.00 0.11 0.21 0.00 0.00 175.17 177.81 2dao h LYS 33 N 6.39 0.00 -0.35 8.23 1.79 -1.86 0.25 116.57 131.02 2dao h LYS 33 Ca 0.10 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.43 2dao h LYS 33 Cb 0.92 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.56 2dao h LYS 33 CO 0.41 0.00 -0.33 1.05 -1.08 0.00 0.00 179.45 179.50 2dao h GLU 34 N 0.00 0.78 -0.17 3.15 9.09 -1.95 -3.17 114.58 122.31 2dao h GLU 34 Ca 0.09 -0.37 -0.05 0.00 0.05 0.00 0.00 59.36 59.08 2dao h GLU 34 Cb 0.71 -0.01 -0.03 0.00 -1.65 0.00 0.00 28.75 27.77 2dao h GLU 34 CO -0.00 0.99 -0.10 0.43 0.05 0.00 0.00 179.01 180.38 2dao n SER 35 N -4.07 2.73 -4.18 3.06 7.64 0.30 -4.97 113.62 114.13 2dao n SER 35 Ca -0.01 -3.37 -0.30 0.00 1.01 0.00 0.00 58.87 56.20 2dao n SER 35 Cb 0.49 -0.53 -0.06 0.00 -1.01 0.00 0.00 64.21 63.10 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 -1.04 -1.99 -3.74 1.43 5.02 0.62 -4.50 118.16 113.96 2dao n LYS 36 Ca 0.22 0.23 -0.36 0.00 -2.02 0.00 0.00 58.31 56.39 2dao n LYS 36 Cb 0.82 -4.10 -0.09 0.00 -0.02 0.00 0.00 35.03 31.65 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 -4.10 5.27 0.25 -0.18 1.01 -0.44 -2.79 121.20 120.22 2dao s ILE 37 Ca 0.08 0.14 0.11 0.00 0.00 0.00 0.00 60.65 60.98 2dao s ILE 37 Cb -0.05 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 38.95 2dao s ILE 37 CO 0.95 0.40 -0.19 0.72 0.00 0.00 0.00 174.94 176.82 2dao s PHE 38 N 0.69 2.15 -0.07 3.97 -0.71 -0.27 0.43 117.98 124.17 2dao s PHE 38 Ca 0.07 -0.39 -0.03 0.00 -1.04 0.00 0.00 56.93 55.54 2dao s PHE 38 Cb -0.12 -0.97 0.04 0.00 -1.21 0.00 0.00 43.02 40.76 2dao s PHE 38 CO 0.01 0.59 0.14 0.50 -1.34 0.00 0.00 175.22 175.13 2dao s ARG 39 N -3.36 0.06 -0.91 1.99 3.52 -1.18 -0.33 118.95 118.74 2dao s ARG 39 Ca 0.26 0.44 -0.24 0.00 -0.13 0.00 0.00 55.73 56.06 2dao s ARG 39 Cb -0.05 -0.23 -0.01 0.00 -1.56 0.00 0.00 34.95 33.11 2dao s ARG 39 CO 0.12 -0.23 1.72 0.42 -0.81 0.00 0.00 175.30 176.53 2dao s ILE 40 N 1.63 3.62 0.20 4.11 1.01 -0.44 -3.43 121.20 127.91 2dao s ILE 40 Ca -0.04 -0.41 -0.17 0.00 0.00 0.00 0.00 60.65 60.03 2dao s ILE 40 Cb -0.12 -4.43 0.19 0.00 0.01 0.00 0.00 42.46 38.11 2dao s ILE 40 CO -0.06 -1.35 1.61 0.58 0.00 0.00 0.00 174.94 175.72 2dao h VAL 41 N 6.99 0.27 -3.20 2.92 2.07 -0.51 -3.35 116.25 121.44 2dao h VAL 41 Ca 0.08 0.00 -0.58 0.00 0.82 0.00 0.00 66.70 67.02 2dao h VAL 41 Cb 1.02 0.27 -0.40 0.00 -1.52 0.00 0.00 31.29 30.67 2dao h VAL 41 CO 1.29 0.00 -0.76 -0.62 0.02 0.00 0.00 177.57 177.50 2dao s ASP 42 N -5.19 3.88 0.33 0.57 -1.08 -0.60 -4.99 116.67 109.59 2dao s ASP 42 Ca -0.14 -1.51 0.12 0.00 -0.52 0.00 0.00 52.55 50.50 2dao s ASP 42 Cb 0.18 -0.85 0.56 0.00 -1.46 0.00 0.00 42.92 41.35 2dao s ASP 42 CO 0.72 -0.39 1.73 1.55 0.52 0.00 0.00 175.17 179.30 2dao h PRO 43 N 8.10 0.00 -0.59 4.34 0.13 -1.83 -2.20 132.00 139.94 2dao h PRO 43 Ca -0.14 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.95 2dao h PRO 43 Cb 1.03 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.13 2dao h PRO 43 CO 0.45 0.48 0.20 -0.97 -0.23 0.00 0.00 178.00 177.93 2dao h ASN 44 N 0.00 0.82 0.29 1.44 -1.24 -1.95 0.11 115.58 115.04 2dao h ASN 44 Ca -0.00 -0.13 0.00 0.00 0.71 0.00 0.00 56.30 56.88 2dao h ASN 44 Cb 0.86 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 39.69 2dao h ASN 44 CO 0.06 0.76 -0.51 0.61 -1.29 0.00 0.00 177.43 177.06 2dao n GLY 45 N -0.94 -0.89 0.12 1.57 0.00 -1.15 -4.02 105.19 99.89 2dao n GLY 45 Ca 0.05 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.10 2.23 -0.04 0.99 -0.00 -0.84 -4.19 117.00 114.05 2dao n LEU 46 Ca 0.08 0.28 -0.08 0.00 -0.00 0.00 0.00 56.01 56.28 2dao n LEU 46 Cb 0.35 -0.97 -0.02 0.00 -0.00 0.00 0.00 43.42 42.79 2dao n LEU 46 CO 0.33 0.58 0.77 0.00 -0.00 0.00 0.00 177.39 179.07 2dao h ALA 47 N -0.40 0.04 -0.74 1.96 0.00 -0.97 -2.06 119.26 117.09 2dao h ALA 47 Ca -0.48 0.08 0.17 0.00 0.00 0.00 0.00 54.91 54.68 2dao h ALA 47 Cb 1.64 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 19.59 2dao h ALA 47 CO -0.17 -0.55 0.01 0.07 0.00 0.00 0.00 179.25 178.61 2dao h ARG 48 N -0.11 0.10 -0.52 0.00 0.11 -1.72 0.14 114.38 112.39 2dao h ARG 48 Ca 0.12 -0.01 0.06 0.00 0.10 0.00 0.00 59.98 60.26 2dao h ARG 48 Cb 0.29 -0.02 -0.05 0.00 1.11 0.00 0.00 29.97 31.30 2dao h ARG 48 CO -0.29 0.07 0.22 -0.07 0.10 0.00 0.00 179.97 180.01 2dao h LEU 49 N 0.11 0.28 -0.17 0.08 3.38 -1.55 -1.74 115.31 115.70 2dao h LEU 49 Ca 0.40 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.41 2dao h LEU 49 Cb 0.70 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2dao h LEU 49 CO -0.65 0.19 0.08 -0.25 0.09 0.00 0.00 178.44 177.90 2dao h TRP 50 N 0.43 0.24 -0.04 1.13 2.91 -0.51 -2.25 115.95 117.86 2dao h TRP 50 Ca 0.24 -0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.29 2dao h TRP 50 Cb 0.22 -0.07 -0.05 0.00 -0.51 0.00 0.00 29.16 28.74 2dao h TRP 50 CO -0.13 0.27 -0.30 0.78 -1.03 0.00 0.00 178.44 178.03 2dao h GLY 51 N 0.14 -0.45 0.75 2.65 0.00 -0.54 -1.62 103.07 104.00 2dao h GLY 51 Ca 0.06 0.36 0.09 0.00 0.00 0.00 0.00 47.33 47.84 2dao h GLY 51 CO -0.01 -0.22 0.58 -0.57 0.00 0.00 0.00 176.54 176.32 2dao h ASN 52 N -0.42 0.82 -0.38 0.19 -1.24 -1.29 0.39 115.58 113.64 2dao h ASN 52 Ca 0.07 0.02 0.07 0.00 0.71 0.00 0.00 56.30 57.18 2dao h ASN 52 Cb 0.53 -0.15 -0.07 0.00 0.73 0.00 0.00 38.32 39.36 2dao h ASN 52 CO -0.28 0.49 -0.05 -0.74 -1.29 0.00 0.00 177.43 175.56 2dao h HIS 53 N 0.91 -0.12 -0.31 0.67 2.76 -0.68 0.84 115.15 119.23 2dao h HIS 53 Ca 0.41 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.55 2dao h HIS 53 Cb 0.37 0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.40 2dao h HIS 53 CO -0.00 -0.12 0.07 1.63 -1.30 0.00 0.00 177.93 178.21 2dao n LYS 54 N -5.25 2.52 -3.77 5.26 4.76 -0.80 -4.88 118.16 116.01 2dao n LYS 54 Ca 0.02 -1.45 -0.23 0.00 -2.87 0.00 0.00 58.31 53.79 2dao n LYS 54 Cb 0.20 -1.78 0.02 0.00 -1.84 0.00 0.00 35.03 31.63 2dao n LYS 54 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2dao n ASN 55 N 0.16 -1.16 -4.94 4.39 3.02 0.29 -4.99 115.26 112.03 2dao n ASN 55 Ca 0.16 -0.86 -0.22 0.00 -0.03 0.00 0.00 54.58 53.63 2dao n ASN 55 Cb 0.78 -3.81 0.01 0.00 -0.61 0.00 0.00 39.78 36.14 2dao n ASN 55 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2dao s ARG 56 N -6.15 2.36 -0.00 3.52 1.81 0.13 -4.98 118.95 115.65 2dao s ARG 56 Ca 0.04 -1.75 0.01 0.00 -1.72 0.00 0.00 55.73 52.31 2dao s ARG 56 Cb -0.02 -2.37 0.00 0.00 -0.45 0.00 0.00 34.95 32.11 2dao s ARG 56 CO 0.83 -0.58 -0.01 0.99 -0.68 0.00 0.00 175.30 175.84 2dao s THR 57 N -2.65 0.13 -1.37 0.02 2.01 -1.26 -4.33 115.64 108.19 2dao s THR 57 Ca 0.47 -0.05 -0.07 0.00 0.31 0.00 0.00 61.69 62.35 2dao s THR 57 Cb -0.04 -0.13 0.03 0.00 0.01 0.00 0.00 72.50 72.37 2dao s THR 57 CO 0.29 0.05 1.01 -3.20 -0.69 0.00 0.00 174.62 172.08 2dao n ASN 58 N 3.17 -4.18 -4.66 3.53 2.85 -1.26 -4.92 115.26 109.79 2dao n ASN 58 Ca -0.14 -0.67 -0.43 0.00 -0.11 0.00 0.00 54.58 53.23 2dao n ASN 58 Cb 0.58 -4.57 -0.02 0.00 1.24 0.00 0.00 39.78 37.02 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 -6.15 4.25 0.16 1.20 -2.45 -1.26 -5.03 119.30 110.02 2dao s MET 59 Ca 0.39 1.54 0.09 0.00 -1.25 0.00 0.00 55.69 56.46 2dao s MET 59 Cb -0.18 -3.70 -0.04 0.00 1.25 0.00 0.00 34.83 32.15 2dao s MET 59 CO 0.77 -0.65 -0.12 -0.08 1.05 0.00 0.00 175.02 175.98 2dao s THR 60 N 3.28 3.09 0.59 10.11 -1.32 -1.26 -4.12 115.64 126.02 2dao s THR 60 Ca 0.50 -1.59 0.30 0.00 -1.21 0.00 0.00 61.69 59.69 2dao s THR 60 Cb -0.19 -2.49 0.36 0.00 -1.51 0.00 0.00 72.50 68.67 2dao s THR 60 CO 0.12 -0.03 2.18 0.22 -2.21 0.00 0.00 174.62 174.89 2dao h TYR 61 N 3.21 0.00 -0.76 9.09 3.20 -1.94 -1.46 116.97 128.31 2dao h TYR 61 Ca -0.48 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.41 2dao h TYR 61 Cb 1.19 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.42 2dao h TYR 61 CO 0.63 0.00 0.49 0.93 -1.64 0.00 0.00 178.16 178.58 2dao h GLU 62 N 0.00 0.95 0.00 1.82 4.39 -1.98 -1.35 114.58 118.41 2dao h GLU 62 Ca 0.04 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2dao h GLU 62 Cb 0.25 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2dao h GLU 62 CO -0.00 0.63 -0.63 1.57 -1.16 0.00 0.00 179.01 179.42 2dao h LYS 63 N 0.98 0.00 0.26 2.33 2.10 -1.72 -3.37 116.57 117.15 2dao h LYS 63 Ca 0.29 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.93 2dao h LYS 63 Cb -0.05 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.28 2dao h LYS 63 CO -0.09 0.00 -0.12 1.98 -2.00 0.00 0.00 179.45 179.22 2dao h MET 64 N 0.00 -0.34 -1.66 0.07 4.05 -0.64 -3.20 114.93 113.21 2dao h MET 64 Ca 0.00 0.02 0.49 0.00 -0.28 0.00 0.00 59.70 59.93 2dao h MET 64 Cb 0.79 0.08 -0.07 0.00 -0.80 0.00 0.00 31.60 31.59 2dao h MET 64 CO 0.00 -0.02 1.19 -1.13 0.23 0.00 0.00 176.91 177.17 2dao n SER 65 N -5.01 0.02 -0.19 1.39 3.41 -0.58 -1.54 113.62 111.12 2dao n SER 65 Ca -0.07 0.88 -0.05 0.00 -0.26 0.00 0.00 58.87 59.37 2dao n SER 65 Cb 0.24 -0.44 -0.05 0.00 -0.26 0.00 0.00 64.21 63.70 2dao n SER 65 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2dao n ARG 66 N -3.72 -0.20 0.00 4.33 5.12 -1.21 -0.56 116.66 120.43 2dao n ARG 66 Ca 0.38 0.95 -0.01 0.00 -1.93 0.00 0.00 57.85 57.25 2dao n ARG 66 Cb 1.71 -1.40 -0.00 0.00 -1.16 0.00 0.00 32.46 31.60 2dao n ARG 66 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dao h ALA 67 N -0.05 -0.50 -0.83 7.54 0.00 -1.53 -1.30 119.26 122.59 2dao h ALA 67 Ca 0.07 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.10 2dao h ALA 67 Cb 0.18 0.53 -0.13 0.00 0.00 0.00 0.00 17.79 18.37 2dao h ALA 67 CO -0.42 -0.51 -0.34 1.28 0.00 0.00 0.00 179.25 179.26 2dao n LEU 68 N -2.61 -0.57 0.03 0.00 7.99 -0.60 -1.07 117.00 120.17 2dao n LEU 68 Ca -0.00 1.45 -0.05 0.00 -0.01 0.00 0.00 56.01 57.40 2dao n LEU 68 Cb 0.01 -0.32 -0.03 0.00 -0.11 0.00 0.00 43.42 42.97 2dao n LEU 68 CO 0.00 -1.29 0.50 -0.09 -1.51 0.00 0.00 177.39 175.00 2dao h ARG 69 N 0.00 -0.22 -1.48 3.23 2.43 -0.42 0.47 114.38 118.38 2dao h ARG 69 Ca 0.28 0.01 0.44 0.00 -0.81 0.00 0.00 59.98 59.90 2dao h ARG 69 Cb 0.48 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 30.00 2dao h ARG 69 CO -0.82 -0.15 1.03 1.25 -1.51 0.00 0.00 179.97 179.78 2dao h HIS 70 N -0.23 0.20 0.13 2.20 2.76 0.07 1.07 115.15 121.36 2dao h HIS 70 Ca -0.00 0.01 -0.28 0.00 -2.20 0.00 0.00 60.37 57.89 2dao h HIS 70 Cb 0.23 -0.05 0.02 0.00 1.55 0.00 0.00 27.41 29.15 2dao h HIS 70 CO -0.35 -0.05 -1.25 1.88 -1.30 0.00 0.00 177.93 176.87 2dao h TYR 71 N 0.06 0.69 -0.82 5.26 0.05 0.45 -3.32 116.97 119.34 2dao h TYR 71 Ca 0.77 -0.47 0.16 0.00 0.05 0.00 0.00 58.73 59.23 2dao h TYR 71 Cb 2.81 -0.04 -0.15 0.00 1.01 0.00 0.00 36.73 40.35 2dao h TYR 71 CO -0.00 1.35 -0.24 1.88 -1.05 0.00 0.00 178.16 180.10 2dao h TYR 72 N 0.14 -0.54 -0.12 4.88 0.05 0.59 0.95 116.97 122.92 2dao h TYR 72 Ca -0.16 0.08 -0.04 0.00 0.05 0.00 0.00 58.73 58.66 2dao h TYR 72 Cb 1.94 0.37 -0.01 0.00 1.01 0.00 0.00 36.73 40.04 2dao h TYR 72 CO 0.08 -0.36 -0.11 0.87 -1.05 0.00 0.00 178.16 177.59 2dao h LYS 73 N -0.02 0.19 0.00 4.88 6.56 -1.65 -1.00 116.57 125.52 2dao h LYS 73 Ca 0.38 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.93 2dao h LYS 73 Cb 0.60 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.23 2dao h LYS 73 CO -0.85 0.31 0.00 1.28 -2.06 0.00 0.00 179.45 178.13 2dao n LEU 74 N -4.31 0.00 -2.22 2.94 4.77 0.32 -4.86 117.00 113.65 2dao n LEU 74 Ca -0.01 0.14 -0.12 0.00 -0.03 0.00 0.00 56.01 55.99 2dao n LEU 74 Cb 0.24 -0.14 0.04 0.00 -2.33 0.00 0.00 43.42 41.24 2dao n LEU 74 CO 0.37 -0.06 0.11 -3.20 -1.33 0.00 0.00 177.39 173.29 2dao n ASN 75 N -1.14 -3.63 -0.07 -1.43 5.15 -0.38 -4.96 115.26 108.80 2dao n ASN 75 Ca 0.12 -0.31 -0.12 0.00 -0.60 0.00 0.00 54.58 53.67 2dao n ASN 75 Cb 0.10 -2.97 -0.07 0.00 -0.53 0.00 0.00 39.78 36.32 2dao n ASN 75 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2dao n ILE 76 N -3.49 0.85 -3.80 -1.44 5.41 -1.15 -3.85 119.36 111.89 2dao n ILE 76 Ca -0.05 -0.30 -0.13 0.00 1.00 0.00 0.00 62.75 63.27 2dao n ILE 76 Cb 0.55 -1.19 -0.14 0.00 -0.71 0.00 0.00 39.64 38.15 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 -2.29 -0.03 -0.15 1.39 1.01 -1.26 -2.00 121.20 117.87 2dao s ILE 77 Ca -0.20 0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.56 2dao s ILE 77 Cb 0.06 -0.14 -0.00 0.00 0.01 0.00 0.00 42.46 42.38 2dao s ILE 77 CO 0.32 0.04 -0.17 -0.13 0.00 0.00 0.00 174.94 175.00 2dao s ARG 78 N 0.61 3.17 -0.71 2.79 0.52 -1.07 -3.96 118.95 120.30 2dao s ARG 78 Ca -0.05 -0.78 -0.27 0.00 -0.52 0.00 0.00 55.73 54.11 2dao s ARG 78 Cb -0.07 -2.56 0.03 0.00 0.52 0.00 0.00 34.95 32.87 2dao s ARG 78 CO -0.02 0.04 1.32 0.21 0.02 0.00 0.00 175.30 176.87 2dao s LYS 79 N 0.74 3.17 0.24 3.54 2.20 -1.26 -2.78 119.74 125.59 2dao s LYS 79 Ca -0.07 -0.12 -0.31 0.00 -0.36 0.00 0.00 55.97 55.10 2dao s LYS 79 Cb -0.16 -4.18 -0.13 0.00 -1.51 0.00 0.00 37.83 31.85 2dao s LYS 79 CO 0.01 -2.16 1.45 0.39 -0.36 0.00 0.00 175.35 174.68 2dao n GLU 80 N 9.29 2.14 -1.15 4.03 -0.58 -1.18 -4.97 120.64 128.21 2dao n GLU 80 Ca 0.05 0.76 -0.29 0.00 -0.42 0.00 0.00 57.16 57.27 2dao n GLU 80 Cb 0.49 -2.45 0.19 0.00 -0.57 0.00 0.00 31.44 29.10 2dao n GLU 80 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2dao s PRO 81 N -0.27 0.16 0.00 3.49 0.04 -1.26 -3.92 135.00 133.24 2dao s PRO 81 Ca 0.69 0.43 0.00 0.00 0.04 0.00 0.00 61.00 62.16 2dao s PRO 81 Cb -0.63 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.20 2dao s PRO 81 CO 0.48 -2.90 0.00 0.41 0.04 0.00 0.00 177.00 175.03 2dao n GLY 82 N -1.05 1.15 3.73 0.56 0.00 -1.26 -4.89 105.19 103.42 2dao n GLY 82 Ca 0.06 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2dao n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dao s GLN 83 N 0.00 -0.15 -0.03 1.61 -1.52 -1.25 -5.05 119.66 113.26 2dao s GLN 83 Ca 0.00 -0.04 -0.04 0.00 -1.95 0.00 0.00 55.36 53.33 2dao s GLN 83 Cb 0.00 -1.72 -0.01 0.00 -0.22 0.00 0.00 33.01 31.06 2dao s GLN 83 CO 0.00 -3.01 -0.07 0.54 -0.25 0.00 0.00 175.29 172.50 2dao n ARG 84 N -4.26 0.11 -2.22 2.91 5.12 -1.26 -4.77 116.66 112.29 2dao n ARG 84 Ca 0.12 0.04 -0.37 0.00 -1.93 0.00 0.00 57.85 55.71 2dao n ARG 84 Cb 0.59 -0.60 0.02 0.00 -1.16 0.00 0.00 32.46 31.31 2dao n ARG 84 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2dao n LEU 85 N -2.98 6.76 -4.63 0.55 7.99 -1.26 -4.98 117.00 118.44 2dao n LEU 85 Ca -0.03 -5.06 -0.36 0.00 -0.01 0.00 0.00 56.01 50.54 2dao n LEU 85 Cb 0.11 -0.93 -0.10 0.00 -0.11 0.00 0.00 43.42 42.38 2dao n LEU 85 CO 0.04 1.94 -0.20 -0.22 -1.51 0.00 0.00 177.39 177.45 2dao s LEU 86 N -3.98 3.98 0.03 2.23 1.98 -1.26 -1.33 118.68 120.33 2dao s LEU 86 Ca 0.49 0.06 0.05 0.00 -2.89 0.00 0.00 54.13 51.84 2dao s LEU 86 Cb 0.38 -2.06 -0.02 0.00 0.66 0.00 0.00 46.19 45.15 2dao s LEU 86 CO -0.31 0.07 -0.15 -0.36 -1.89 0.00 0.00 176.35 173.71 2dao s PHE 87 N 1.02 1.34 -0.14 5.38 0.08 0.55 -3.13 117.98 123.09 2dao s PHE 87 Ca 0.06 -0.34 -0.00 0.00 0.12 0.00 0.00 56.93 56.77 2dao s PHE 87 Cb -0.14 -0.80 0.03 0.00 -0.57 0.00 0.00 43.02 41.54 2dao s PHE 87 CO 0.04 0.04 -0.07 0.50 -0.10 0.00 0.00 175.22 175.63 2dao s ARG 88 N -1.05 1.49 -0.94 0.44 3.52 -1.12 -1.11 118.95 120.18 2dao s ARG 88 Ca 0.03 -0.37 -0.24 0.00 -0.13 0.00 0.00 55.73 55.03 2dao s ARG 88 Cb -0.08 -1.77 0.04 0.00 -1.56 0.00 0.00 34.95 31.58 2dao s ARG 88 CO 0.01 -0.34 1.46 -0.06 -0.81 0.00 0.00 175.30 175.57 2dao s PHE 89 N 1.68 2.40 0.00 5.12 0.08 -1.12 -2.58 117.98 123.56 2dao s PHE 89 Ca 0.03 -0.52 0.00 0.00 0.12 0.00 0.00 56.93 56.56 2dao s PHE 89 Cb -0.14 -4.62 0.00 0.00 -0.57 0.00 0.00 43.02 37.69 2dao s PHE 89 CO -0.08 -1.96 0.45 -1.33 -0.10 0.00 0.00 175.22 172.20 2dao n MET 90 N 9.00 0.00 -2.39 0.44 2.81 -0.85 -4.80 117.12 121.33 2dao n MET 90 Ca 0.27 0.35 -0.39 0.00 -1.81 0.00 0.00 57.70 56.13 2dao n MET 90 Cb 0.50 -1.12 -0.03 0.00 -0.71 0.00 0.00 33.22 31.86 2dao n MET 90 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2dao s LYS 91 N -1.61 4.29 0.34 0.03 2.47 -1.23 -4.98 119.74 119.05 2dao s LYS 91 Ca 0.00 1.79 -0.29 0.00 -1.56 0.00 0.00 55.97 55.91 2dao s LYS 91 Cb 0.00 -2.84 -0.11 0.00 -1.46 0.00 0.00 37.83 33.42 2dao s LYS 91 CO 0.00 -0.10 1.46 0.99 0.16 0.00 0.00 175.35 177.85 2dao s THR 92 N -1.36 2.27 -0.02 3.43 2.01 -1.26 -4.95 115.64 115.76 2dao s THR 92 Ca 0.53 0.26 -0.25 0.00 0.31 0.00 0.00 61.69 62.53 2dao s THR 92 Cb -0.30 -3.16 -0.20 0.00 0.01 0.00 0.00 72.50 68.85 2dao s THR 92 CO 0.38 0.06 1.27 1.55 -0.69 0.00 0.00 174.62 177.19 2dao h PRO 93 N 3.58 0.04 -0.14 4.92 0.13 -1.95 -2.92 132.00 135.65 2dao h PRO 93 Ca -0.49 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 64.66 2dao h PRO 93 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 2dao h PRO 93 CO 0.68 0.52 0.20 -0.44 -0.23 0.00 0.00 178.00 178.73 2dao h ASP 94 N -0.44 0.00 0.00 1.44 3.32 -2.01 -1.48 116.42 117.25 2dao h ASP 94 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.98 2dao h ASP 94 Cb 0.51 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.07 2dao h ASP 94 CO 0.00 0.00 -0.30 -0.08 -1.72 0.00 0.00 179.24 177.14 2dao h GLU 95 N 0.00 0.20 -0.26 3.56 4.57 -1.93 -3.27 114.58 117.45 2dao h GLU 95 Ca 0.07 -0.22 -0.02 0.00 -1.18 0.00 0.00 59.36 58.01 2dao h GLU 95 Cb 0.46 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 2dao h GLU 95 CO -0.00 0.95 0.06 0.82 -1.18 0.00 0.00 179.01 179.66 2dao h ILE 96 N -0.45 1.13 0.00 2.32 2.04 -1.11 -3.26 117.51 118.17 2dao h ILE 96 Ca -0.04 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2dao h ILE 96 Cb 1.06 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2dao h ILE 96 CO 0.06 0.16 0.00 0.23 0.00 0.00 0.00 178.15 178.60 2dao n MET 97 N -4.39 0.00 -2.21 2.37 2.81 -0.77 -4.14 117.12 110.79 2dao n MET 97 Ca 0.01 0.65 -0.42 0.00 -1.81 0.00 0.00 57.70 56.12 2dao n MET 97 Cb 0.16 -1.01 -0.03 0.00 -0.71 0.00 0.00 33.22 31.63 2dao n MET 97 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2dao s SER 98 N -2.81 6.85 -0.23 7.83 0.01 -1.23 -4.83 113.70 119.29 2dao s SER 98 Ca 0.00 2.19 -0.29 0.00 1.31 0.00 0.00 55.95 59.16 2dao s SER 98 Cb 0.00 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.65 2dao s SER 98 CO 0.00 -0.68 1.36 -0.83 0.41 0.00 0.00 173.24 173.50 2dao s GLY 99 N 1.55 1.45 -0.16 3.44 0.00 -1.26 -4.90 107.32 107.43 2dao s GLY 99 Ca 0.64 0.31 -0.13 0.00 0.00 0.00 0.00 44.72 45.54 2dao s GLY 99 CO 0.28 2.65 -0.19 0.54 0.00 0.00 0.00 173.10 176.38 2dao n ARG 100 N 7.13 0.49 -0.07 2.90 5.12 -1.26 -4.83 116.66 126.15 2dao n ARG 100 Ca 0.15 0.44 -0.15 0.00 -1.93 0.00 0.00 57.85 56.37 2dao n ARG 100 Cb 0.46 -1.62 -0.05 0.00 -1.16 0.00 0.00 32.46 30.08 2dao n ARG 100 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 2dao n THR 101 N -4.54 1.02 -3.83 0.55 -1.04 -1.26 -4.95 114.28 100.23 2dao n THR 101 Ca -0.14 -0.11 -0.30 0.00 -2.04 0.00 0.00 64.05 61.46 2dao n THR 101 Cb 0.40 -1.80 -0.15 0.00 -1.82 0.00 0.00 70.33 66.97 2dao n THR 101 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2dao s ASP 102 N -6.35 4.18 -0.40 8.00 2.15 -1.26 -5.08 116.67 117.91 2dao s ASP 102 Ca -0.21 -1.72 -0.40 0.00 0.43 0.00 0.00 52.55 50.65 2dao s ASP 102 Cb 0.07 -1.10 -0.16 0.00 -0.30 0.00 0.00 42.92 41.44 2dao s ASP 102 CO 0.28 -0.39 2.05 0.54 -0.17 0.00 0.00 175.17 177.48 2dao n ARG 103 N 4.67 0.62 -0.55 4.34 5.12 -1.26 -4.77 116.66 124.83 2dao n ARG 103 Ca -0.01 0.19 -0.06 0.00 -1.93 0.00 0.00 57.85 56.04 2dao n ARG 103 Cb 0.42 -1.98 0.02 0.00 -1.16 0.00 0.00 32.46 29.76 2dao n ARG 103 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 2dao n LEU 104 N 7.76 5.27 -0.12 0.55 0.00 -1.26 -3.87 117.00 125.34 2dao n LEU 104 Ca 0.43 -2.54 -0.18 0.00 0.00 0.00 0.00 56.01 53.72 2dao n LEU 104 Cb 0.09 -0.98 -0.12 0.00 0.00 0.00 0.00 43.42 42.41 2dao n LEU 104 CO 0.82 0.98 -1.32 -0.62 0.00 0.00 0.00 177.39 177.25 2dao n GLU 105 N 0.87 0.66 -0.37 1.96 4.71 -1.26 -4.56 120.64 122.65 2dao n GLU 105 Ca 0.11 0.15 -0.08 0.00 -0.01 0.00 0.00 57.16 57.33 2dao n GLU 105 Cb 0.57 -1.53 -0.06 0.00 -1.01 0.00 0.00 31.44 29.41 2dao n GLU 105 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 2dao n HIS 106 N -3.26 -0.29 -0.22 -0.32 8.25 -1.25 0.80 115.22 118.92 2dao n HIS 106 Ca -0.45 1.12 0.20 0.00 -0.26 0.00 0.00 57.72 58.33 2dao n HIS 106 Cb 1.00 -0.63 0.38 0.00 1.12 0.00 0.00 29.99 31.85 2dao n HIS 106 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2dao n LEU 107 N -5.17 0.20 -0.25 2.41 7.99 -1.26 0.17 117.00 121.09 2dao n LEU 107 Ca 0.04 1.14 0.08 0.00 -0.01 0.00 0.00 56.01 57.25 2dao n LEU 107 Cb 0.26 -0.54 0.16 0.00 -0.11 0.00 0.00 43.42 43.20 2dao n LEU 107 CO -0.14 -1.26 0.52 -0.62 -1.51 0.00 0.00 177.39 174.38 2dao n GLU 108 N -4.59 -0.06 -2.41 3.23 1.02 0.24 -0.23 120.64 117.84 2dao n GLU 108 Ca 0.25 1.07 -0.16 0.00 -0.02 0.00 0.00 57.16 58.30 2dao n GLU 108 Cb 0.84 -1.66 0.03 0.00 -0.02 0.00 0.00 31.44 30.62 2dao n GLU 108 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2dao n SER 109 N -5.04 3.52 0.00 1.62 2.88 0.13 -4.76 113.62 111.96 2dao n SER 109 Ca 0.14 -3.13 -0.01 0.00 -1.33 0.00 0.00 58.87 54.55 2dao n SER 109 Cb 0.46 -0.42 -0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2dao n SER 109 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2dao n GLN 110 N -0.56 0.03 -0.22 -1.46 7.27 0.68 -4.79 117.38 118.33 2dao n GLN 110 Ca 0.28 0.01 -0.05 0.00 0.07 0.00 0.00 57.00 57.32 2dao n GLN 110 Cb 0.85 -0.28 0.05 0.00 2.41 0.00 0.00 30.24 33.28 2dao n GLN 110 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 2dao h GLU 111 N -0.06 0.78 -7.00 3.69 4.39 -1.88 -3.43 114.58 111.07 2dao h GLU 111 Ca 0.00 -0.05 -0.55 0.00 0.34 0.00 0.00 59.36 59.10 2dao h GLU 111 Cb 0.06 -0.18 0.14 0.00 -0.10 0.00 0.00 28.75 28.67 2dao h GLU 111 CO 0.00 0.52 0.57 1.28 -1.16 0.00 0.00 179.01 180.22 2dao n LEU 112 N -4.69 5.23 -4.92 1.33 4.77 -1.26 -5.00 117.00 112.46 2dao n LEU 112 Ca 0.06 0.99 -0.30 0.00 -0.03 0.00 0.00 56.01 56.73 2dao n LEU 112 Cb 0.05 -1.56 -0.04 0.00 -2.33 0.00 0.00 43.42 39.55 2dao n LEU 112 CO 0.34 -0.63 -0.04 -0.94 -1.33 0.00 0.00 177.39 174.79 2dao s SER 113 N -0.85 6.40 -0.01 -1.43 1.04 -1.26 -4.98 113.70 112.61 2dao s SER 113 Ca 0.70 0.38 0.03 0.00 0.48 0.00 0.00 55.95 57.55 2dao s SER 113 Cb -0.43 -2.00 -0.01 0.00 0.10 0.00 0.00 66.02 63.68 2dao s SER 113 CO 0.51 0.06 -0.11 -0.83 0.98 0.00 0.00 173.24 173.85 2dao s GLY 114 N -2.75 0.53 0.00 7.32 0.00 -1.26 -5.01 107.32 106.14 2dao s GLY 114 Ca 0.38 -0.47 0.14 0.00 0.00 0.00 0.00 44.72 44.77 2dao s GLY 114 CO 0.27 -0.39 1.44 -1.55 0.00 0.00 0.00 173.10 172.87 2dao n PRO 115 N 2.79 0.06 0.01 2.90 -0.04 -1.26 -3.33 135.00 136.13 2dao n PRO 115 Ca -0.14 0.22 -0.06 0.00 -0.04 0.00 0.00 63.50 63.49 2dao n PRO 115 Cb 0.56 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.48 2dao n PRO 115 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dao h SER 116 N 0.00 -0.12 -3.63 3.54 0.87 -2.05 -3.44 113.55 108.73 2dao h SER 116 Ca 0.00 -0.22 -0.63 0.00 -1.23 0.00 0.00 61.79 59.71 2dao h SER 116 Cb 0.21 0.03 -0.16 0.00 -0.44 0.00 0.00 62.40 62.04 2dao h SER 116 CO 0.00 0.46 -0.53 -0.94 -0.53 0.00 0.00 176.83 175.28 2dao s SER 117 N -5.53 5.89 0.00 6.23 1.04 -1.21 -5.32 113.70 114.80 2dao s SER 117 Ca -0.07 0.03 0.30 0.00 0.48 0.00 0.00 55.95 56.70 2dao s SER 117 Cb -0.00 -2.06 1.48 0.00 0.10 0.00 0.00 66.02 65.53 2dao s SER 117 CO 0.24 0.04 1.99 0.61 0.98 0.00 0.00 173.24 177.09